A0A087X4L4_POEFO Loading...

Very low density lipoprotein receptor

AlphaFold DB , UniProt , Accession A0A087X4L4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 696 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	G	40.8	Very low	66.3	Low	122 Å²	122	100.5 Å²	100.5	100%	1.258	62%	0.619	S	S	*	*				0	125.1	0	0	0	0	0	0	106.8	V3	G1-V3 PolarHBondContact O-N 3.27Å; G1-V3 VanDerWaalsContact O-N 3.08Å
2	N	51.6	Low	67.4	Low	164 Å²	164	92.6 Å²	92.6	88%	0.877	57%	0.571	S	S	*	*			trans	-64.1	109.2	-179.6	-89.2	1.1	0	0	0	109.4	T4	N2-T4 PolarHBondContact O-N 3.46Å
3	V	56.6	Low	68.1	Low	93 Å²	93	92.3 Å²	92.3	56%	0.564	58%	0.584	S	S	*	*			trans	-67.5	115.6	168.8	179.9	0	0	0	0	106.3	G1	G1-V3 PolarHBondContact O-N 3.27Å; G1-V3 VanDerWaalsContact O-N 3.08Å
4	T	61.5	Low	68.5	Low	130 Å²	130	91.1 Å²	91.1	80%	0.798	58%	0.579	S	S	*	*			trans	-99.2	104.3	174.8	28.7	0	0	0	0	106.9	N2	N2-T4 PolarHBondContact O-N 3.46Å
5	C	74.4	Confident	68.9	Low	27 Å²	27	87.7 Å²	87.7	18%	0.182	57%	0.568	C	S	.	*			trans	-69.1	162.3	176.5	-56.8	0	0	0	0	111.2	E9 T11 C17	C5-E9 HydrophobicContact CB-CB 3.85Å; C5-T11 HydrophobicContact CB-CG2 3.74Å; C5-T11 WeakPolarHBondContact SG-CG2 3.25Å; C5-C17 HydrophobicContact CB-CB 3.73Å; C5-C17 WeakPolarHBondContact CB-SG 3.2Å; C5-C17 VanDerWaalsContact SG-CA 3.54Å; C5-C17 WeakPolarHBondContact SG-CB 3.36Å; C5-C17 CovalentContact SG-SG 2.01Å; C5-C17 PolarHBondContact SG-SG 3.37Å
6	A	73.7	Confident	69.2	Low	57 Å²	57	91.7 Å²	91.7	47%	0.471	57%	0.569	S	S	.	*			trans	-65.5	160.4	-179.5	0	0	0	0	0	112	N8 E9	A6-N8 PolarHBondContact O-N 3.22Å; A6-E9 HydrophobicContact CB-CG 4.28Å; A6-E9 PolarHBondContact N-OE2 3.22Å; A6-E9 VanDerWaalsContact N-OE2 3.1Å; A6-E9 PolarHBondContact O-N 2.96Å
7	L	66.9	Low	70	Confident	160 Å²	160	89 Å²	89	84%	0.838	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-21.4	-176.7	-98.7	144	0	0	0	115.3	K20	L7-K20 WeakPolarHBondContact O-CE 2.98Å; L7-K20 PolarHBondContact O-NZ 2.93Å
8	N	70.3	Confident	70.4	Confident	128 Å²	128	85 Å²	85	68%	0.684	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	8.3	-178.8	-62.2	-6.2	0	0	0	113.3	A6 K20	A6-N8 PolarHBondContact O-N 3.22Å; N8-K20 PolarHBondContact O-N 3.1Å; N8-K20 VanDerWaalsContact O-N 3.17Å
9	E	76.2	Confident	70.9	Confident	83 Å²	83	82.8 Å²	82.8	39%	0.388	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	146	-177.8	-66.1	172.7	167.5	0	0	110.3	C5 A6 C17 I18	C5-E9 HydrophobicContact CB-CB 3.85Å; A6-E9 HydrophobicContact CB-CG 4.28Å; A6-E9 PolarHBondContact N-OE2 3.22Å; A6-E9 VanDerWaalsContact N-OE2 3.1Å; A6-E9 PolarHBondContact O-N 2.96Å; E9-C17 HydrophobicContact CB-CB 4.27Å; E9-I18 CarbonylContact C-O 3.59Å; E9-I18 WeakPolarHBondContact CA-O 3.27Å; E9-I18 WeakPolarHBondContact CB-O 3.48Å
10	F	77.4	Confident	70.8	Confident	65 Å²	65	84.7 Å²	84.7	29%	0.285	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.8	173.2	177.8	-100.4	0	0	0	109.6	C17 I18 K20 V23	F10-C17 WeakPolarHBondContact O-CA 3.43Å; F10-I18 HydrophobicContact CB-CG1 4.03Å; F10-I18 HydrophobicContact CD1-CD1 4.07Å; F10-I18 HydrophobicContact CD1-CG1 4.04Å; F10-I18 PolarHBondContact N-O 2.79Å; F10-I18 PolarHBondContact O-N 2.84Å; F10-K20 HydrophobicContact CB-CG 4.47Å; F10-V23 HydrophobicContact CB-CG2 3.51Å; F10-V23 HydrophobicContact CD1-CG2 3.95Å; F10-V23 HydrophobicContact CD2-CG2 4.06Å; F10-V23 HydrophobicContact CG-CG2 3.58Å
11	T	80.2	Confident	70.8	Confident	76 Å²	76	87.2 Å²	87.2	47%	0.466	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	107.7	177.3	48.5	0	0	0	0	109.8	C5	C5-T11 HydrophobicContact CB-CG2 3.74Å; C5-T11 WeakPolarHBondContact SG-CG2 3.25Å
12	C	79.6	Confident	72.2	Confident	6 Å²	6	86.1 Å²	86.1	4%	0.041	49%	0.487	C	S	.	.			trans	-58.7	153.2	169	-74.9	0	0	0	0	112.4	S14 G15 R16 C30	C12-S14 PolarHBondContact O-N 3.2Å; C12-G15 WeakPolarHBondContact O-CA 3.2Å; C12-G15 PolarHBondContact O-N 2.8Å; C12-R16 HydrophobicContact CB-CB 4Å; C12-R16 WeakPolarHBondContact CB-O 3.39Å; C12-R16 PolarHBondContact N-O 3.19Å; C12-C30 WeakPolarHBondContact CA-SG 3.43Å; C12-C30 HydrophobicContact CB-CB 4.34Å; C12-C30 WeakPolarHBondContact CB-SG 3.49Å; C12-C30 VanDerWaalsContact SG-CA 3.52Å; C12-C30 WeakPolarHBondContact SG-CB 3.31Å; C12-C30 CovalentContact SG-SG 2Å; C12-C30 PolarHBondContact SG-SG 3.34Å
13	A	76.3	Confident	73.3	Confident	89 Å²	89	80.3 Å²	80.3	74%	0.736	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.8	175	0	0	0	0	0	112.2	G15 S34	A13-G15 PolarHBondContact O-N 3.06Å; A13-S34 WeakPolarHBondContact CB-OG 3.43Å; A13-S34 PolarHBondContact N-OG 2.83Å
14	S	73.3	Confident	73.9	Confident	75 Å²	75	78.7 Å²	78.7	52%	0.524	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.2	169	53.5	0	0	0	0	115.1	C12 D32	C12-S14 PolarHBondContact O-N 3.2Å; S14-D32 WeakPolarHBondContact CA-OD2 3.43Å; S14-D32 WeakPolarHBondContact CB-OD2 3.45Å; S14-D32 PolarHBondContact N-OD2 3.07Å; S14-D32 PolarHBondContact OG-OD2 3.29Å
15	G	74.1	Confident	74.4	Confident	40 Å²	40	75.6 Å²	75.6	41%	0.412	43%	0.429	S	S	.	.	S	Bend	trans	85.7	10.4	180	0	0	0	0	0	114.9	C12 A13	C12-G15 WeakPolarHBondContact O-CA 3.2Å; C12-G15 PolarHBondContact O-N 2.8Å; A13-G15 PolarHBondContact O-N 3.06Å
16	R	75.1	Confident	74.1	Confident	152 Å²	152	77.3 Å²	77.3	57%	0.574	45%	0.451	S	S	*	.			trans	-82.3	146.3	172.9	-163.9	174.9	-176.6	-163.5	-3.4	111	C12	C12-R16 HydrophobicContact CB-CB 4Å; C12-R16 WeakPolarHBondContact CB-O 3.39Å; C12-R16 PolarHBondContact N-O 3.19Å
17	C	82.6	Confident	73.9	Confident	46 Å²	46	81 Å²	81	31%	0.311	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.2	175.4	-53.8	0	0	0	0	109.3	C5 E9 F10	C5-C17 HydrophobicContact CB-CB 3.73Å; C5-C17 WeakPolarHBondContact CB-SG 3.2Å; C5-C17 VanDerWaalsContact SG-CA 3.54Å; C5-C17 WeakPolarHBondContact SG-CB 3.36Å; C5-C17 CovalentContact SG-SG 2.01Å; C5-C17 PolarHBondContact SG-SG 3.37Å; E9-C17 HydrophobicContact CB-CB 4.27Å; F10-C17 WeakPolarHBondContact O-CA 3.43Å
18	I	77.4	Confident	74.4	Confident	17 Å²	17	77.8 Å²	77.8	9%	0.087	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	162.1	173.5	63.5	172	0	0	0	109.8	E9 F10 F22 V23 D29 C30 D35	E9-I18 CarbonylContact C-O 3.59Å; E9-I18 WeakPolarHBondContact CA-O 3.27Å; E9-I18 WeakPolarHBondContact CB-O 3.48Å; F10-I18 HydrophobicContact CB-CG1 4.03Å; F10-I18 HydrophobicContact CD1-CD1 4.07Å; F10-I18 HydrophobicContact CD1-CG1 4.04Å; F10-I18 PolarHBondContact N-O 2.79Å; F10-I18 PolarHBondContact O-N 2.84Å; I18-F22 HydrophobicContact CD1-CB 4.48Å; I18-F22 WeakPolarHBondContact CD1-O 2.95Å; I18-V23 HydrophobicContact CD1-CG2 4.42Å; I18-D29 HydrophobicContact CD1-CB 4.43Å; I18-C30 HydrophobicContact CD1-CB 4.35Å; I18-D35 HydrophobicContact CD1-CB 3.48Å; I18-D35 VanDerWaalsContact CD1-CB 3.48Å
19	S	78.3	Confident	74.8	Confident	44 Å²	44	74 Å²	74	31%	0.308	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	144.7	176.5	-169.9	0	0	0	0	110.5	N21 F22	S19-N21 PolarHBondContact O-N 3.07Å; S19-F22 VanDerWaalsContact CB-CD2 3.47Å; S19-F22 PolarHBondContact O-N 3.45Å
20	K	70.5	Confident	74.7	Confident	119 Å²	119	70.3 Å²	70.3	52%	0.517	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-58.9	-15.9	171.8	-76.5	179.2	175.7	171.9	0	114.3	L7 N8 F10 F22	L7-K20 WeakPolarHBondContact O-CE 2.98Å; L7-K20 PolarHBondContact O-NZ 2.93Å; N8-K20 PolarHBondContact O-N 3.1Å; N8-K20 VanDerWaalsContact O-N 3.17Å; F10-K20 HydrophobicContact CB-CG 4.47Å; K20-F22 VanDerWaalsContact C-N 3.29Å
21	N	70	Confident	74.4	Confident	138 Å²	138	70 Å²	70	74%	0.738	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-78.4	-13.6	174.3	-64.6	-10.5	0	0	0	113.3	S19	S19-N21 PolarHBondContact O-N 3.07Å
22	F	70.3	Confident	74.2	Confident	99 Å²	99	69.5 Å²	69.5	43%	0.434	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-105.6	29.6	176.8	-59.8	-56.7	0	0	0	110.6	I18 S19 K20 N25 D29	I18-F22 HydrophobicContact CD1-CB 4.48Å; I18-F22 WeakPolarHBondContact CD1-O 2.95Å; S19-F22 VanDerWaalsContact CB-CD2 3.47Å; S19-F22 PolarHBondContact O-N 3.45Å; K20-F22 VanDerWaalsContact C-N 3.29Å; F22-N25 PolarHBondContact O-OD1 2.9Å; F22-D29 HydrophobicContact CB-CB 4.18Å
23	V	73.9	Confident	73.9	Confident	42 Å²	42	70.2 Å²	70.2	26%	0.255	42%	0.422	S	S	.	.	S	Bend	trans	-111	123.9	172.8	178.7	0	0	0	0	105.1	F10 I18	F10-V23 HydrophobicContact CB-CG2 3.51Å; F10-V23 HydrophobicContact CD1-CG2 3.95Å; F10-V23 HydrophobicContact CD2-CG2 4.06Å; F10-V23 HydrophobicContact CG-CG2 3.58Å; I18-V23 HydrophobicContact CD1-CG2 4.42Å
24	C	70.2	Confident	74.1	Confident	59 Å²	59	67.2 Å²	67.2	40%	0.399	40%	0.396	S	S	.	.	S	Bend	trans	63.5	38	-177.9	-52.1	0	0	0	0	114.5	D35 E36 C39	C24-D35 PolarHBondContact N-O 3.31Å; C24-E36 VanDerWaalsContact CA-OE1 3.25Å; C24-E36 WeakPolarHBondContact CA-OE1 3.34Å; C24-E36 PolarHBondContact N-OE1 2.78Å; C24-C39 VanDerWaalsContact CA-SG 3.52Å; C24-C39 HydrophobicContact CB-CB 3.7Å; C24-C39 WeakPolarHBondContact CB-SG 3.26Å; C24-C39 WeakPolarHBondContact SG-CA 3.37Å; C24-C39 WeakPolarHBondContact SG-CB 3.01Å; C24-C39 CovalentContact SG-SG 2.01Å; C24-C39 PolarHBondContact SG-SG 2.87Å
25	N	71.1	Confident	74.2	Confident	66 Å²	66	63.7 Å²	63.7	35%	0.353	37%	0.371	S	S	.	.	S	Bend	trans	-99.5	1.5	175.3	63.1	-37.5	0	0	0	113.1	F22 D29 E36	F22-N25 PolarHBondContact O-OD1 2.9Å; N25-D29 PolarHBondContact ND2-OD2 3.27Å; N25-D29 PolarHBondContact OD1-OD2 3.2Å; N25-E36 PolarHBondContact N-OE1 2.92Å; N25-E36 PolarHBondContact OD1-OE1 3.43Å
26	G	68.1	Low	74.4	Confident	63 Å²	63	64.9 Å²	64.9	65%	0.649	37%	0.366	S	S	*	.	S	Bend	trans	82.8	9.2	175.8	0	0	0	0	0	114.5	E36	G26-E36 VanDerWaalsContact N-CD 3.34Å; G26-E36 PolarHBondContact N-OE1 2.99Å; G26-E36 PolarHBondContact N-OE2 3.42Å
27	E	71.1	Confident	74.1	Confident	135 Å²	135	63 Å²	63	63%	0.631	37%	0.371	S	S	*	.	S	Bend	trans	-122.7	141	174.4	-64.2	-164.1	161.8	0	0	109.8	D29	E27-D29 VanDerWaalsContact C-N 3.33Å; E27-D29 PolarHBondContact O-N 2.99Å
28	D	76.1	Confident	73.2	Confident	91 Å²	91	68.6 Å²	68.6	49%	0.487	40%	0.398	S	S	.	.			trans	-79.1	80.3	176.5	178.5	15.9	0	0	0	110.2	C30 G31 D32 G33	D28-C30 VanDerWaalsContact C-N 3.3Å; D28-G31 VanDerWaalsContact OD1-CA 3.24Å; D28-G31 WeakPolarHBondContact OD1-CA 3.37Å; D28-G31 PolarHBondContact OD1-N 3.44Å; D28-D32 PolarHBondContact OD1-N 3.02Å; D28-G33 VanDerWaalsContact OD1-CA 3.27Å; D28-G33 WeakPolarHBondContact OD1-CA 3.02Å; D28-G33 PolarHBondContact OD1-N 3.4Å
29	D	78.4	Confident	72.7	Confident	50 Å²	50	70.2 Å²	70.2	27%	0.267	41%	0.41	S	S	.	.	S	Bend	trans	-76.8	-22.9	177.9	-76.8	-62.3	0	0	0	111.8	I18 F22 N25 E27 D35	I18-D29 HydrophobicContact CD1-CB 4.43Å; F22-D29 HydrophobicContact CB-CB 4.18Å; N25-D29 PolarHBondContact ND2-OD2 3.27Å; N25-D29 PolarHBondContact OD1-OD2 3.2Å; E27-D29 VanDerWaalsContact C-N 3.33Å; E27-D29 PolarHBondContact O-N 2.99Å; D29-D35 WeakPolarHBondContact CA-OD2 3.41Å; D29-D35 VanDerWaalsContact CB-OD2 3.29Å; D29-D35 WeakPolarHBondContact CB-OD2 3.31Å; D29-D35 PolarHBondContact N-OD2 3Å
30	C	74.8	Confident	71.7	Confident	4 Å²	4	72.2 Å²	72.2	3%	0.027	43%	0.43	C	S	.	.	S	Bend	trans	-80.1	-23.6	-179.9	-158.7	0	0	0	0	112.7	C12 I18 D28 D32 D35	C12-C30 WeakPolarHBondContact CA-SG 3.43Å; C12-C30 HydrophobicContact CB-CB 4.34Å; C12-C30 WeakPolarHBondContact CB-SG 3.49Å; C12-C30 VanDerWaalsContact SG-CA 3.52Å; C12-C30 WeakPolarHBondContact SG-CB 3.31Å; C12-C30 CovalentContact SG-SG 2Å; C12-C30 PolarHBondContact SG-SG 3.34Å; I18-C30 HydrophobicContact CD1-CB 4.35Å; D28-C30 VanDerWaalsContact C-N 3.3Å; C30-D32 PolarHBondContact O-N 2.03Å; C30-D32 PolarHBondContact SG-OD1 3.37Å; C30-D35 HydrophobicContact CB-CB 3.87Å; C30-D35 WeakPolarHBondContact CB-OD1 3.33Å; C30-D35 WeakPolarHBondContact CB-OD2 3.19Å; C30-D35 PolarHBondContact N-OD2 3.22Å
31	G	72	Confident	70.8	Confident	58 Å²	58	72.6 Å²	72.6	60%	0.598	44%	0.444	S	S	*	.	S	Bend	trans	76.7	-4.8	-178.7	0	0	0	0	0	114.4	D28	D28-G31 VanDerWaalsContact OD1-CA 3.24Å; D28-G31 WeakPolarHBondContact OD1-CA 3.37Å; D28-G31 PolarHBondContact OD1-N 3.44Å
32	D	75.2	Confident	69.8	Low	67 Å²	67	70.7 Å²	70.7	36%	0.358	44%	0.442	S	S	.	.	S	Bend	trans	-123.4	4.1	174.5	65	14.4	0	0	0	112.1	S14 D28 C30 S34	S14-D32 WeakPolarHBondContact CA-OD2 3.43Å; S14-D32 WeakPolarHBondContact CB-OD2 3.45Å; S14-D32 PolarHBondContact N-OD2 3.07Å; S14-D32 PolarHBondContact OG-OD2 3.29Å; D28-D32 PolarHBondContact OD1-N 3.02Å; C30-D32 PolarHBondContact O-N 2.03Å; C30-D32 PolarHBondContact SG-OD1 3.37Å; D32-S34 VanDerWaalsContact C-N 3.27Å; D32-S34 PolarHBondContact O-N 2.02Å; D32-S34 WeakPolarHBondContact OD1-CB 3.47Å; D32-S34 PolarHBondContact OD1-N 3.09Å; D32-S34 PolarHBondContact OD1-OG 3.33Å; D32-S34 PolarHBondContact OD2-OG 3.46Å
33	G	72.8	Confident	69.2	Low	20 Å²	20	70.8 Å²	70.8	21%	0.206	46%	0.455	C	S	.	.	S	Bend	trans	71.9	5.7	-179.4	0	0	0	0	0	115.7	D28 D35 E36 V37	D28-G33 VanDerWaalsContact OD1-CA 3.27Å; D28-G33 WeakPolarHBondContact OD1-CA 3.02Å; D28-G33 PolarHBondContact OD1-N 3.4Å; G33-D35 VanDerWaalsContact C-OD1 3.27Å; G33-D35 PolarHBondContact O-N 3.22Å; G33-E36 PolarHBondContact O-N 3.17Å; G33-E36 VanDerWaalsContact O-N 3.14Å; G33-V37 WeakPolarHBondContact O-CG2 3.4Å
34	S	80.4	Confident	68.8	Low	26 Å²	26	70 Å²	70	18%	0.182	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.2	-173.2	-51.8	0	0	0	0	114.4	A13 D32 E36	A13-S34 WeakPolarHBondContact CB-OG 3.43Å; A13-S34 PolarHBondContact N-OG 2.83Å; D32-S34 VanDerWaalsContact C-N 3.27Å; D32-S34 PolarHBondContact O-N 2.02Å; D32-S34 WeakPolarHBondContact OD1-CB 3.47Å; D32-S34 PolarHBondContact OD1-N 3.09Å; D32-S34 PolarHBondContact OD1-OG 3.33Å; D32-S34 PolarHBondContact OD2-OG 3.46Å; S34-E36 VanDerWaalsContact C-N 3.29Å
35	D	75.5	Confident	68.8	Low	1 Å²	1	69.4 Å²	69.4	1%	0.005	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-13.1	175.8	52.8	-25.4	0	0	0	114.1	I18 C24 D29 C30 G33	I18-D35 HydrophobicContact CD1-CB 3.48Å; I18-D35 VanDerWaalsContact CD1-CB 3.48Å; C24-D35 PolarHBondContact N-O 3.31Å; D29-D35 WeakPolarHBondContact CA-OD2 3.41Å; D29-D35 VanDerWaalsContact CB-OD2 3.29Å; D29-D35 WeakPolarHBondContact CB-OD2 3.31Å; D29-D35 PolarHBondContact N-OD2 3Å; C30-D35 HydrophobicContact CB-CB 3.87Å; C30-D35 WeakPolarHBondContact CB-OD1 3.33Å; C30-D35 WeakPolarHBondContact CB-OD2 3.19Å; C30-D35 PolarHBondContact N-OD2 3.22Å; G33-D35 VanDerWaalsContact C-OD1 3.27Å; G33-D35 PolarHBondContact O-N 3.22Å
36	E	79.3	Confident	68.6	Low	66 Å²	66	72.8 Å²	72.8	31%	0.308	48%	0.476	S	S	.	.	S	Bend	trans	-113.6	6.5	-179.7	-65.5	-63	145.8	0	0	112.8	C24 N25 G26 G33 S34	C24-E36 VanDerWaalsContact CA-OE1 3.25Å; C24-E36 WeakPolarHBondContact CA-OE1 3.34Å; C24-E36 PolarHBondContact N-OE1 2.78Å; N25-E36 PolarHBondContact N-OE1 2.92Å; N25-E36 PolarHBondContact OD1-OE1 3.43Å; G26-E36 VanDerWaalsContact N-CD 3.34Å; G26-E36 PolarHBondContact N-OE1 2.99Å; G26-E36 PolarHBondContact N-OE2 3.42Å; G33-E36 PolarHBondContact O-N 3.17Å; G33-E36 VanDerWaalsContact O-N 3.14Å; S34-E36 VanDerWaalsContact C-N 3.29Å
37	V	69.1	Low	68.6	Low	111 Å²	111	76.2 Å²	76.2	67%	0.673	48%	0.479	S	S	*	.	S	Bend	trans	-103.9	117.7	178.4	-154.6	0	0	0	0	109.2	G33	G33-V37 WeakPolarHBondContact O-CG2 3.4Å
38	D	63.8	Low	68.7	Low	165 Å²	165	74.1 Å²	74.1	88%	0.882	47%	0.47	S	S	*	.	S	Bend	trans	88.2	38.9	180	-152.4	30.4	0	0	0	116.5
39	C	65.6	Low	68.8	Low	50 Å²	50	71.2 Å²	71.2	34%	0.338	45%	0.452	S	S	.	.			trans	-77.4	121.3	169.5	-54.4	0	0	0	0	111	C24	C24-C39 VanDerWaalsContact CA-SG 3.52Å; C24-C39 HydrophobicContact CB-CB 3.7Å; C24-C39 WeakPolarHBondContact CB-SG 3.26Å; C24-C39 WeakPolarHBondContact SG-CA 3.37Å; C24-C39 WeakPolarHBondContact SG-CB 3.01Å; C24-C39 CovalentContact SG-SG 2.01Å; C24-C39 PolarHBondContact SG-SG 2.87Å
40	A	58.2	Low	68.8	Low	87 Å²	87	72.7 Å²	72.7	72%	0.719	46%	0.458	S	S	*	.			trans	-61.4	136.5	171.8	0	0	0	0	0	109.8	S42	A40-S42 PolarHBondContact O-N 3.39Å
41	P	50.1	Low	69	Low	126 Å²	126	72.7 Å²	72.7	82%	0.818	46%	0.458	S	S	*	.			trans	-63.8	108.6	-175.3	24.6	-32.3	0	0	0	109.7	S43	P41-S43 PolarHBondContact O-N 3.44Å
42	S	49.8	Very low	69	Low	98 Å²	98	72.9 Å²	72.9	69%	0.685	46%	0.46	S	S	*	.			trans	-65.7	98.6	171.4	37.8	0	0	0	0	108.9	A40	A40-S42 PolarHBondContact O-N 3.39Å
43	S	58.1	Low	68.7	Low	101 Å²	101	72.8 Å²	72.8	71%	0.706	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-66	128.6	161.5	56.3	0	0	0	0	108.6	P41	P41-S43 PolarHBondContact O-N 3.44Å
44	C	66.1	Low	68.5	Low	26 Å²	26	74.8 Å²	74.8	18%	0.176	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-53.6	161.3	179.7	-56.2	0	0	0	0	113.2	E48 Q50 C56	C44-E48 HydrophobicContact CB-CB 3.85Å; C44-Q50 WeakPolarHBondContact SG-CB 3.02Å; C44-C56 HydrophobicContact CB-CB 3.78Å; C44-C56 WeakPolarHBondContact CB-SG 3.42Å; C44-C56 VanDerWaalsContact SG-CA 3.59Å; C44-C56 WeakPolarHBondContact SG-CB 3.31Å; C44-C56 CovalentContact SG-SG 2.03Å; C44-C56 PolarHBondContact SG-SG 2.96Å
45	A	69.8	Low	68.2	Low	47 Å²	47	76.2 Å²	76.2	39%	0.388	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-60.2	158	179.6	0	0	0	0	0	111.6	N47 E48	A45-N47 PolarHBondContact O-N 3Å; A45-E48 HydrophobicContact CB-CG 4.29Å; A45-E48 WeakPolarHBondContact CB-OE2 3.16Å; A45-E48 PolarHBondContact N-OE2 2.94Å; A45-E48 PolarHBondContact O-N 2.74Å
46	P	67.3	Low	68.4	Low	137 Å²	137	79.1 Å²	79.1	89%	0.89	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14	-173.6	-10.7	11.3	0	0	0	116.4
47	N	66.3	Low	68.4	Low	134 Å²	134	76.7 Å²	76.7	72%	0.717	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	14.9	179	-68.5	-7.3	0	0	0	112.9	A45 A59	A45-N47 PolarHBondContact O-N 3Å; N47-A59 WeakPolarHBondContact O-CB 3.31Å; N47-A59 PolarHBondContact O-N 3.01Å
48	E	74.6	Confident	68.9	Low	92 Å²	92	73.8 Å²	73.8	43%	0.43	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.3	-177.8	-68.7	171.6	174.5	0	0	110.4	C44 A45 C56 I57	C44-E48 HydrophobicContact CB-CB 3.85Å; A45-E48 HydrophobicContact CB-CG 4.29Å; A45-E48 WeakPolarHBondContact CB-OE2 3.16Å; A45-E48 PolarHBondContact N-OE2 2.94Å; A45-E48 PolarHBondContact O-N 2.74Å; E48-C56 HydrophobicContact CB-CB 4.28Å; E48-I57 CarbonylContact C-O 3.57Å; E48-I57 WeakPolarHBondContact CA-O 3.46Å; E48-I57 WeakPolarHBondContact CB-O 3.33Å
49	F	76.9	Confident	69.4	Low	29 Å²	29	68.7 Å²	68.7	13%	0.127	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.7	173.3	175.3	-102.8	0	0	0	110.2	C56 I57 V62 D74	F49-C56 CarbonylContact O-C 2.76Å; F49-C56 WeakPolarHBondContact O-CA 3.46Å; F49-I57 HydrophobicContact CB-CG1 4.02Å; F49-I57 HydrophobicContact CD1-CD1 3.95Å; F49-I57 HydrophobicContact CD1-CG1 3.88Å; F49-I57 HydrophobicContact CG-CG1 4.46Å; F49-I57 PolarHBondContact N-O 3.47Å; F49-I57 PolarHBondContact O-N 3.01Å; F49-V62 HydrophobicContact CB-CG2 3.56Å; F49-V62 HydrophobicContact CD1-CG2 3.85Å; F49-V62 HydrophobicContact CD2-CG2 4.14Å; F49-V62 HydrophobicContact CG-CG2 3.58Å; F49-D74 HydrophobicContact CE1-CB 4.36Å
50	Q	78.8	Confident	69.8	Low	81 Å²	81	71.9 Å²	71.9	38%	0.379	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	114.2	175.7	-166	167.3	16.6	0	0	110.2	C44 S55	C44-Q50 WeakPolarHBondContact SG-CB 3.02Å; Q50-S55 CarbonylContact C-O 3.54Å; Q50-S55 WeakPolarHBondContact CA-O 3.32Å
51	C	78.6	Confident	70.6	Confident	4 Å²	4	72.8 Å²	72.8	3%	0.027	46%	0.456	C	S	.	.			trans	-59.5	157.4	168.6	-54.4	0	0	0	0	110.5	N53 A54 S55 C69	C51-N53 WeakPolarHBondContact CB-OD1 3.27Å; C51-N53 PolarHBondContact O-N 3.32Å; C51-N53 VanDerWaalsContact O-N 3.15Å; C51-A54 WeakPolarHBondContact O-CA 3.05Å; C51-A54 PolarHBondContact O-N 3.09Å; C51-S55 WeakPolarHBondContact CB-O 3.39Å; C51-S55 PolarHBondContact N-O 3.33Å; C51-C69 HydrophobicContact CB-CB 3.72Å; C51-C69 WeakPolarHBondContact CB-SG 3.33Å; C51-C69 VanDerWaalsContact SG-CA 3.56Å; C51-C69 WeakPolarHBondContact SG-CB 3.36Å; C51-C69 CovalentContact SG-SG 2.03Å; C51-C69 PolarHBondContact SG-SG 2.84Å
52	G	72.3	Confident	72.1	Confident	63 Å²	63	68.7 Å²	68.7	65%	0.649	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.9	179	0	0	0	0	0	113.9	A54 D71 S73	G52-A54 VanDerWaalsContact C-N 3.29Å; G52-D71 VanDerWaalsContact C-OD2 3.23Å; G52-D71 WeakPolarHBondContact CA-OD2 3.46Å; G52-D71 PolarHBondContact N-OD2 3.39Å; G52-S73 PolarHBondContact N-OG 3.36Å; G52-S73 VanDerWaalsContact N-OG 3.09Å
53	N	70.3	Confident	73.3	Confident	65 Å²	65	66.2 Å²	66.2	35%	0.348	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	8.8	170.3	81.5	-8.7	0	0	0	114.6	C51 S55 D71	C51-N53 WeakPolarHBondContact CB-OD1 3.27Å; C51-N53 PolarHBondContact O-N 3.32Å; C51-N53 VanDerWaalsContact O-N 3.15Å; N53-S55 VanDerWaalsContact C-N 3.33Å; N53-S55 PolarHBondContact ND2-OG 2.97Å; N53-S55 PolarHBondContact O-N 2.98Å; N53-S55 WeakPolarHBondContact OD1-CB 3.34Å; N53-S55 PolarHBondContact OD1-N 3.38Å; N53-S55 PolarHBondContact OD1-OG 3.45Å; N53-D71 PolarHBondContact N-OD2 3.43Å
54	A	68.5	Low	74	Confident	62 Å²	62	64.3 Å²	64.3	51%	0.512	39%	0.392	S	S	.	.	S	Bend	trans	71	9.2	-176.3	0	0	0	0	0	117.1	C51 G52	C51-A54 WeakPolarHBondContact O-CA 3.05Å; C51-A54 PolarHBondContact O-N 3.09Å; G52-A54 VanDerWaalsContact C-N 3.29Å
55	S	72.6	Confident	74.1	Confident	56 Å²	56	68 Å²	68	39%	0.392	41%	0.41	S	S	.	.			trans	-74.5	146.6	169.9	-55.1	0	0	0	0	111.4	Q50 C51 N53	Q50-S55 CarbonylContact C-O 3.54Å; Q50-S55 WeakPolarHBondContact CA-O 3.32Å; C51-S55 WeakPolarHBondContact CB-O 3.39Å; C51-S55 PolarHBondContact N-O 3.33Å; N53-S55 VanDerWaalsContact C-N 3.33Å; N53-S55 PolarHBondContact ND2-OG 2.97Å; N53-S55 PolarHBondContact O-N 2.98Å; N53-S55 WeakPolarHBondContact OD1-CB 3.34Å; N53-S55 PolarHBondContact OD1-N 3.38Å; N53-S55 PolarHBondContact OD1-OG 3.45Å
56	C	81.2	Confident	74.1	Confident	61 Å²	61	70.9 Å²	70.9	41%	0.412	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.9	179.4	-55	0	0	0	0	110.4	C44 E48 F49	C44-C56 HydrophobicContact CB-CB 3.78Å; C44-C56 WeakPolarHBondContact CB-SG 3.42Å; C44-C56 VanDerWaalsContact SG-CA 3.59Å; C44-C56 WeakPolarHBondContact SG-CB 3.31Å; C44-C56 CovalentContact SG-SG 2.03Å; C44-C56 PolarHBondContact SG-SG 2.96Å; E48-C56 HydrophobicContact CB-CB 4.28Å; F49-C56 CarbonylContact O-C 2.76Å; F49-C56 WeakPolarHBondContact O-CA 3.46Å
57	I	78.6	Confident	74.5	Confident	16 Å²	16	68.3 Å²	68.3	8%	0.082	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	157.6	171.9	62.4	167.8	0	0	0	110.1	E48 F49 W61 V62 D68 C69 D74	E48-I57 CarbonylContact C-O 3.57Å; E48-I57 WeakPolarHBondContact CA-O 3.46Å; E48-I57 WeakPolarHBondContact CB-O 3.33Å; F49-I57 HydrophobicContact CB-CG1 4.02Å; F49-I57 HydrophobicContact CD1-CD1 3.95Å; F49-I57 HydrophobicContact CD1-CG1 3.88Å; F49-I57 HydrophobicContact CG-CG1 4.46Å; F49-I57 PolarHBondContact N-O 3.47Å; F49-I57 PolarHBondContact O-N 3.01Å; I57-W61 HydrophobicContact CD1-CB 4.25Å; I57-W61 VanDerWaalsContact CD1-O 3.23Å; I57-W61 WeakPolarHBondContact CD1-O 3.47Å; I57-V62 HydrophobicContact CD1-CG2 4.39Å; I57-D68 HydrophobicContact CD1-CB 4.17Å; I57-C69 VanDerWaalsContact CD1-SG 3.58Å; I57-D74 HydrophobicContact CD1-CB 3.8Å
58	P	80.3	Confident	75.2	Confident	49 Å²	49	64.9 Å²	64.9	32%	0.318	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	138.2	173.6	-25.2	36.7	0	0	0	112.2	N60 W61	P58-N60 WeakPolarHBondContact CB-OD1 3.4Å; P58-N60 PolarHBondContact O-N 2.85Å; P58-W61 HydrophobicContact CB-CD2 4.45Å; P58-W61 HydrophobicContact CB-CG 4.32Å; P58-W61 HydrophobicContact CG-CD2 4.18Å; P58-W61 HydrophobicContact CG-CE3 4.43Å; P58-W61 WeakPolarHBondContact O-CB 3.37Å; P58-W61 PolarHBondContact O-N 3.04Å
59	A	73	Confident	75.3	Confident	58 Å²	58	60.5 Å²	60.5	48%	0.479	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-11.9	-176.7	0	0	0	0	0	114.8	N47 W61	N47-A59 WeakPolarHBondContact O-CB 3.31Å; N47-A59 PolarHBondContact O-N 3.01Å; A59-W61 VanDerWaalsContact C-N 3.32Å
60	N	74.4	Confident	75.2	Confident	117 Å²	117	67.7 Å²	67.7	63%	0.626	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.2	173.8	60.9	-63.5	0	0	0	113.8	P58	P58-N60 WeakPolarHBondContact CB-OD1 3.4Å; P58-N60 PolarHBondContact O-N 2.85Å
61	W	75.7	Confident	75	Confident	107 Å²	107	66.8 Å²	66.8	41%	0.405	39%	0.394	S	S	.	.	S	Bend	trans	-106.2	38.4	177.1	-62.8	-1.8	0	0	0	110.7	I57 P58 A59 D64 D68	I57-W61 HydrophobicContact CD1-CB 4.25Å; I57-W61 VanDerWaalsContact CD1-O 3.23Å; I57-W61 WeakPolarHBondContact CD1-O 3.47Å; P58-W61 HydrophobicContact CB-CD2 4.45Å; P58-W61 HydrophobicContact CB-CG 4.32Å; P58-W61 HydrophobicContact CG-CD2 4.18Å; P58-W61 HydrophobicContact CG-CE3 4.43Å; P58-W61 WeakPolarHBondContact O-CB 3.37Å; P58-W61 PolarHBondContact O-N 3.04Å; A59-W61 VanDerWaalsContact C-N 3.32Å; W61-D64 VanDerWaalsContact C-OD1 3.27Å; W61-D64 WeakPolarHBondContact CA-OD2 3.46Å; W61-D68 HydrophobicContact CB-CB 4.48Å; W61-D68 HydrophobicContact CE3-CB 3.97Å
62	V	80.1	Confident	74.7	Confident	39 Å²	39	72.6 Å²	72.6	24%	0.236	42%	0.42	C	S	.	.	S	Bend	trans	-123.5	118	-179.4	-176.7	0	0	0	0	106.6	F49 I57	F49-V62 HydrophobicContact CB-CG2 3.56Å; F49-V62 HydrophobicContact CD1-CG2 3.85Å; F49-V62 HydrophobicContact CD2-CG2 4.14Å; F49-V62 HydrophobicContact CG-CG2 3.58Å; I57-V62 HydrophobicContact CD1-CG2 4.39Å
63	C	76.3	Confident	75.1	Confident	47 Å²	47	70.8 Å²	70.8	32%	0.318	40%	0.398	S	S	.	.	S	Bend	trans	66.2	37.1	-176.5	-47.9	0	0	0	0	114.1	D74 E75 C80	C63-D74 PolarHBondContact N-O 2.87Å; C63-E75 WeakPolarHBondContact CA-OE1 3.3Å; C63-E75 PolarHBondContact N-OE1 3.19Å; C63-C80 HydrophobicContact CB-CB 3.83Å; C63-C80 WeakPolarHBondContact CB-SG 3.47Å; C63-C80 WeakPolarHBondContact SG-CA 3.41Å; C63-C80 WeakPolarHBondContact SG-CB 3.25Å; C63-C80 CovalentContact SG-SG 2.03Å; C63-C80 PolarHBondContact SG-SG 2.85Å
64	D	72.3	Confident	75.4	Confident	60 Å²	60	67.7 Å²	67.7	32%	0.321	38%	0.381	S	S	.	.	S	Bend	trans	-102.1	13.8	176	60.6	-29.7	0	0	0	114.7	W61 D66 E75	W61-D64 VanDerWaalsContact C-OD1 3.27Å; W61-D64 WeakPolarHBondContact CA-OD2 3.46Å; D64-D66 PolarHBondContact O-N 2.84Å; D64-E75 PolarHBondContact N-OE1 2.88Å
65	D	67.9	Low	75.9	Confident	103 Å²	103	66.5 Å²	66.5	55%	0.551	37%	0.365	S	S	*	.	S	Bend	trans	71.2	6.5	177	-69.3	-55.2	0	0	0	114.8	E75 R82	D65-E75 PolarHBondContact N-OE1 2.03Å; D65-R82 VanDerWaalsContact CG-NH2 3.27Å; D65-R82 IonicContact OD1-CZ 2.84Å; D65-R82 IonicContact OD1-NH1 2.76Å; D65-R82 PolarHBondContact OD1-NH1 2.92Å; D65-R82 IonicContact OD1-NH2 3.95Å; D65-R82 PolarHBondContact OD1-NH2 3.36Å; D65-R82 IonicContact OD2-CZ 3.97Å; D65-R82 IonicContact OD2-NH1 3.09Å; D65-R82 IonicContact OD2-NH2 2.72Å; D65-R82 PolarHBondContact OD2-NH2 3.03Å
66	D	69.6	Low	76.1	Confident	108 Å²	108	65.2 Å²	65.2	58%	0.578	36%	0.358	S	S	*	.	S	Bend	trans	-111.9	142.4	172.5	-78.7	-40.6	0	0	0	110.4	D64 D68 E75	D64-D66 PolarHBondContact O-N 2.84Å; D66-D68 PolarHBondContact O-N 3.48Å; D66-E75 VanDerWaalsContact O-CG 3.27Å; D66-E75 WeakPolarHBondContact O-CG 3.18Å
67	V	76.5	Confident	75.5	Confident	83 Å²	83	67.1 Å²	67.1	50%	0.503	37%	0.37	S	S	.	.			trans	-91.5	94	179.6	176.6	0	0	0	0	109	C69 Q72	V67-C69 WeakPolarHBondContact CG1-O 3.44Å; V67-Q72 HydrophobicContact CB-CG 4.39Å; V67-Q72 HydrophobicContact CG1-CB 4.39Å; V67-Q72 HydrophobicContact CG1-CG 3.45Å; V67-Q72 VanDerWaalsContact CG1-CG 3.45Å; V67-Q72 HydrophobicContact CG2-CG 3.97Å
68	D	79.8	Confident	74.9	Confident	62 Å²	62	71.5 Å²	71.5	33%	0.332	41%	0.408	S	S	.	.			trans	-94.8	-29.5	177.9	-70.3	-57.7	0	0	0	112.2	I57 W61 D66 D74	I57-D68 HydrophobicContact CD1-CB 4.17Å; W61-D68 HydrophobicContact CB-CB 4.48Å; W61-D68 HydrophobicContact CE3-CB 3.97Å; D66-D68 PolarHBondContact O-N 3.48Å; D68-D74 WeakPolarHBondContact CA-OD2 3.3Å; D68-D74 WeakPolarHBondContact CB-OD2 3.43Å; D68-D74 PolarHBondContact N-OD2 2.97Å
69	C	77.6	Confident	74.3	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.007	42%	0.421	C	S	.	.	S	Bend	trans	-80.4	127.7	166.7	-71.5	0	0	0	0	110.6	C51 I57 V67 D71 Q72 D74	C51-C69 HydrophobicContact CB-CB 3.72Å; C51-C69 WeakPolarHBondContact CB-SG 3.33Å; C51-C69 VanDerWaalsContact SG-CA 3.56Å; C51-C69 WeakPolarHBondContact SG-CB 3.36Å; C51-C69 CovalentContact SG-SG 2.03Å; C51-C69 PolarHBondContact SG-SG 2.84Å; I57-C69 VanDerWaalsContact CD1-SG 3.58Å; V67-C69 WeakPolarHBondContact CG1-O 3.44Å; C69-D71 WeakPolarHBondContact CB-OD1 3.33Å; C69-D71 PolarHBondContact O-N 3.37Å; C69-Q72 PolarHBondContact O-N 3Å; C69-D74 HydrophobicContact CB-CB 4.12Å; C69-D74 WeakPolarHBondContact CB-OD1 3.3Å; C69-D74 PolarHBondContact N-OD2 3.04Å
70	Q	74	Confident	74.2	Confident	179 Å²	179	75.4 Å²	75.4	84%	0.836	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.2	178.1	-150.9	178.7	14	0	0	113.9
71	D	75	Confident	73.5	Confident	63 Å²	63	72.8 Å²	72.8	34%	0.337	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	8.4	177.5	72.6	-15.9	0	0	0	114.1	G52 N53 C69 S73	G52-D71 VanDerWaalsContact C-OD2 3.23Å; G52-D71 WeakPolarHBondContact CA-OD2 3.46Å; G52-D71 PolarHBondContact N-OD2 3.39Å; N53-D71 PolarHBondContact N-OD2 3.43Å; C69-D71 WeakPolarHBondContact CB-OD1 3.33Å; C69-D71 PolarHBondContact O-N 3.37Å; D71-S73 PolarHBondContact O-N 2.97Å; D71-S73 WeakPolarHBondContact OD1-CB 3.48Å; D71-S73 PolarHBondContact OD1-N 3.37Å; D71-S73 VanDerWaalsContact OD1-N 3.07Å; D71-S73 PolarHBondContact OD1-OG 2.99Å; D71-S73 PolarHBondContact OD2-OG 3.35Å
72	Q	72.8	Confident	72.3	Confident	125 Å²	125	74.5 Å²	74.5	58%	0.584	42%	0.415	S	S	*	.	S	Bend	trans	59.3	23	-178.1	-61.7	170.1	1.6	0	0	113.9	V67 C69 D74 E75 A76	V67-Q72 HydrophobicContact CB-CG 4.39Å; V67-Q72 HydrophobicContact CG1-CB 4.39Å; V67-Q72 HydrophobicContact CG1-CG 3.45Å; V67-Q72 VanDerWaalsContact CG1-CG 3.45Å; V67-Q72 HydrophobicContact CG2-CG 3.97Å; C69-Q72 PolarHBondContact O-N 3Å; Q72-D74 VanDerWaalsContact C-N 3.26Å; Q72-D74 VanDerWaalsContact C-OD1 3.23Å; Q72-D74 WeakPolarHBondContact CA-OD1 3.48Å; Q72-D74 PolarHBondContact O-N 3.33Å; Q72-E75 PolarHBondContact O-N 3.43Å; Q72-A76 PolarHBondContact O-N 3.45Å
73	S	79.8	Confident	70.5	Confident	25 Å²	25	80.9 Å²	80.9	18%	0.175	44%	0.442	C	S	.	.			trans	-68.7	-25.1	-179.8	-80.3	0	0	0	0	114.1	G52 D71	G52-S73 PolarHBondContact N-OG 3.36Å; G52-S73 VanDerWaalsContact N-OG 3.09Å; D71-S73 PolarHBondContact O-N 2.97Å; D71-S73 WeakPolarHBondContact OD1-CB 3.48Å; D71-S73 PolarHBondContact OD1-N 3.37Å; D71-S73 VanDerWaalsContact OD1-N 3.07Å; D71-S73 PolarHBondContact OD1-OG 2.99Å; D71-S73 PolarHBondContact OD2-OG 3.35Å
74	D	77.4	Confident	68.7	Low	0 Å²	0	84.3 Å²	84.3	0%	0	46%	0.464	C	S	.	.	S	Bend	trans	-67.5	-39.7	172.3	53.2	-18.5	0	0	0	112.5	F49 I57 C63 D68 C69 Q72 C80	F49-D74 HydrophobicContact CE1-CB 4.36Å; I57-D74 HydrophobicContact CD1-CB 3.8Å; C63-D74 PolarHBondContact N-O 2.87Å; D68-D74 WeakPolarHBondContact CA-OD2 3.3Å; D68-D74 WeakPolarHBondContact CB-OD2 3.43Å; D68-D74 PolarHBondContact N-OD2 2.97Å; C69-D74 HydrophobicContact CB-CB 4.12Å; C69-D74 WeakPolarHBondContact CB-OD1 3.3Å; C69-D74 PolarHBondContact N-OD2 3.04Å; Q72-D74 VanDerWaalsContact C-N 3.26Å; Q72-D74 VanDerWaalsContact C-OD1 3.23Å; Q72-D74 WeakPolarHBondContact CA-OD1 3.48Å; Q72-D74 PolarHBondContact O-N 3.33Å; D74-C80 PolarHBondContact O-SG 2.89Å; D74-C80 VanDerWaalsContact O-SG 3.41Å
75	E	79.6	Confident	67.2	Low	37 Å²	37	87.4 Å²	87.4	17%	0.173	49%	0.485	C	S	.	.	S	Bend	trans	-99.6	13.3	-178.9	-71	-60.2	146.4	0	0	113.7	C63 D64 D65 D66 Q72 P77	C63-E75 WeakPolarHBondContact CA-OE1 3.3Å; C63-E75 PolarHBondContact N-OE1 3.19Å; D64-E75 PolarHBondContact N-OE1 2.88Å; D65-E75 PolarHBondContact N-OE1 2.03Å; D66-E75 VanDerWaalsContact O-CG 3.27Å; D66-E75 WeakPolarHBondContact O-CG 3.18Å; Q72-E75 PolarHBondContact O-N 3.43Å; E75-P77 WeakPolarHBondContact O-CD 3.48Å
76	A	77.3	Confident	66.2	Low	29 Å²	29	87.6 Å²	87.6	24%	0.24	49%	0.492	C	S	.	.			trans	-61.5	125.4	-174.9	0	0	0	0	0	111.9	Q72 A78 R79 C80	Q72-A76 PolarHBondContact O-N 3.45Å; A76-A78 PolarHBondContact O-N 2.99Å; A76-R79 PolarHBondContact O-N 2.83Å; A76-C80 PolarHBondContact O-N 2.86Å; A76-C80 VanDerWaalsContact O-N 3.16Å
77	P	67.1	Low	65.1	Low	102 Å²	102	88.6 Å²	88.6	66%	0.662	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.8	-176	-26.3	32.6	0	0	0	114.4	E75 R79	E75-P77 WeakPolarHBondContact O-CD 3.48Å; P77-R79 PolarHBondContact O-N 3.06Å
78	A	66.2	Low	63.6	Low	107 Å²	107	88.3 Å²	88.3	88%	0.884	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-21.2	177.7	0	0	0	0	0	113.4	A76	A76-A78 PolarHBondContact O-N 2.99Å
79	R	68.7	Low	62.6	Low	160 Å²	160	94.6 Å²	94.6	60%	0.604	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-40.6	-175.2	-162.1	-172	-69.5	-105.1	9.2	112.1	A76 P77 G81	A76-R79 PolarHBondContact O-N 2.83Å; P77-R79 PolarHBondContact O-N 3.06Å; R79-G81 PolarHBondContact O-N 3.49Å
80	C	69.5	Low	61.7	Low	30 Å²	30	95.9 Å²	95.9	20%	0.203	54%	0.544	C	S	.	.	S	Bend	trans	-78.2	1	-180	-58.8	0	0	0	0	114.4	C63 D74 A76 R82	C63-C80 HydrophobicContact CB-CB 3.83Å; C63-C80 WeakPolarHBondContact CB-SG 3.47Å; C63-C80 WeakPolarHBondContact SG-CA 3.41Å; C63-C80 WeakPolarHBondContact SG-CB 3.25Å; C63-C80 CovalentContact SG-SG 2.03Å; C63-C80 PolarHBondContact SG-SG 2.85Å; D74-C80 PolarHBondContact O-SG 2.89Å; D74-C80 VanDerWaalsContact O-SG 3.41Å; A76-C80 PolarHBondContact O-N 2.86Å; A76-C80 VanDerWaalsContact O-N 3.16Å; C80-R82 PolarHBondContact O-N 3.49Å
81	G	61.4	Low	61.3	Low	62 Å²	62	92.3 Å²	92.3	64%	0.639	53%	0.53	S	S	*	.			trans	60.8	16.1	172.7	0	0	0	0	0	114.9	R79 H83	R79-G81 PolarHBondContact O-N 3.49Å; G81-H83 PolarHBondContact O-N 3.07Å; G81-H83 VanDerWaalsContact O-N 3.14Å
82	R	50.6	Low	60.5	Low	142 Å²	142	94.7 Å²	94.7	54%	0.536	55%	0.551	S	S	.	*			trans	-76.9	102.8	175	-71.6	-170.1	-177.4	-175.2	5.2	108.5	D65 C80	D65-R82 VanDerWaalsContact CG-NH2 3.27Å; D65-R82 IonicContact OD1-CZ 2.84Å; D65-R82 IonicContact OD1-NH1 2.76Å; D65-R82 PolarHBondContact OD1-NH1 2.92Å; D65-R82 IonicContact OD1-NH2 3.95Å; D65-R82 PolarHBondContact OD1-NH2 3.36Å; D65-R82 IonicContact OD2-CZ 3.97Å; D65-R82 IonicContact OD2-NH1 3.09Å; D65-R82 IonicContact OD2-NH2 2.72Å; D65-R82 PolarHBondContact OD2-NH2 3.03Å; C80-R82 PolarHBondContact O-N 3.49Å
83	H	40.4	Very low	60.1	Low	173 Å²	173	90.9 Å²	90.9	80%	0.801	54%	0.539	S	S	*	.			trans	-52.1	128.2	164	-96.3	-79.4	0	0	0	109.2	G81 T85	G81-H83 PolarHBondContact O-N 3.07Å; G81-H83 VanDerWaalsContact O-N 3.14Å; H83-T85 PolarHBondContact O-N 3.15Å
84	P	40	Very low	59.7	Low	120 Å²	120	92.7 Å²	92.7	78%	0.779	54%	0.544	S	S	*	.			trans	-69.6	104.7	171.5	26.5	-28.8	0	0	0	107.6
85	T	40	Very low	59.5	Low	125 Å²	125	94.4 Å²	94.4	77%	0.767	55%	0.553	S	S	*	*			trans	-62.3	138.9	161.5	39.9	0	0	0	0	108.5	H83	H83-T85 PolarHBondContact O-N 3.15Å
86	P	46.1	Very low	59.4	Low	107 Å²	107	98.8 Å²	98.8	70%	0.695	57%	0.573	S	S	*	*			trans	-59.2	163.7	-177.8	-13.6	26.8	0	0	0	111.3	A88	P86-A88 PolarHBondContact O-N 3.45Å
87	P	46.9	Very low	59.4	Low	128 Å²	128	97.7 Å²	97.7	83%	0.831	56%	0.564	S	S	*	*			trans	-59.6	108.9	-176.4	26.4	-32.3	0	0	0	108.6	K89	P87-K89 PolarHBondContact O-N 3.24Å
88	A	45.9	Very low	59.8	Low	78 Å²	78	98 Å²	98	65%	0.645	57%	0.569	S	S	*	*			trans	-64.4	108.4	174	0	0	0	0	0	106.2	P86 C90	P86-A88 PolarHBondContact O-N 3.45Å; A88-C90 PolarHBondContact O-N 2.81Å
89	K	57.4	Low	59.9	Low	194 Å²	194	95.7 Å²	95.7	84%	0.843	55%	0.546	S	S	*	.			trans	-48.4	124.9	150.8	-68.9	179	176	-179.4	0	105.6	P87 L91	P87-K89 PolarHBondContact O-N 3.24Å; K89-L91 PolarHBondContact O-N 3.07Å
90	C	60.2	Low	60	Low	27 Å²	27	90 Å²	90	18%	0.182	54%	0.537	C	S	.	.			trans	-45	142.3	-178.3	-53.3	0	0	0	0	110	A88 E94 Q96 C102	A88-C90 PolarHBondContact O-N 2.81Å; C90-E94 HydrophobicContact CB-CB 3.95Å; C90-Q96 VanDerWaalsContact SG-CB 3.53Å; C90-C102 HydrophobicContact CB-CB 3.84Å; C90-C102 WeakPolarHBondContact CB-SG 3.11Å; C90-C102 WeakPolarHBondContact SG-CB 3.48Å; C90-C102 CovalentContact SG-SG 2.04Å; C90-C102 PolarHBondContact SG-SG 3.34Å
91	L	65.6	Low	60.2	Low	105 Å²	105	92.7 Å²	92.7	55%	0.55	55%	0.546	S	S	.	.			trans	-55.6	157.7	-178.9	-87.6	78.6	0	0	0	110.3	K89 S93 E94	K89-L91 PolarHBondContact O-N 3.07Å; L91-S93 PolarHBondContact O-N 2.83Å; L91-E94 HydrophobicContact CB-CG 4.4Å; L91-E94 PolarHBondContact N-OE2 3.34Å; L91-E94 PolarHBondContact O-N 3.45Å
92	S	58.4	Low	61.1	Low	112 Å²	112	92.3 Å²	92.3	78%	0.783	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.2	-178.8	54.6	0	0	0	0	114.6	K105	S92-K105 WeakPolarHBondContact O-CE 3.32Å; S92-K105 PolarHBondContact O-NZ 3.03Å
93	S	63	Low	62.1	Low	46 Å²	46	86.4 Å²	86.4	32%	0.322	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-4.8	175	43.2	0	0	0	0	114.5	L91 K105	L91-S93 PolarHBondContact O-N 2.83Å; S93-K105 WeakPolarHBondContact O-CB 3.44Å; S93-K105 WeakPolarHBondContact O-CG 3.42Å; S93-K105 PolarHBondContact O-N 3.1Å
94	E	71.3	Confident	63.7	Low	62 Å²	62	81.6 Å²	81.6	29%	0.29	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	156.3	-175.5	-67.8	163.5	-175	0	0	110.5	C90 L91 C102 I103 K105	C90-E94 HydrophobicContact CB-CB 3.95Å; L91-E94 HydrophobicContact CB-CG 4.4Å; L91-E94 PolarHBondContact N-OE2 3.34Å; L91-E94 PolarHBondContact O-N 3.45Å; E94-C102 HydrophobicContact CB-CB 4.45Å; E94-I103 CarbonylContact C-O 3.53Å; E94-I103 VanDerWaalsContact CA-O 3.25Å; E94-I103 WeakPolarHBondContact CA-O 3.4Å; E94-K105 WeakPolarHBondContact O-CE 3.39Å
95	M	73.6	Confident	65.1	Low	37 Å²	37	81.6 Å²	81.6	18%	0.182	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.8	176.4	63.2	169.9	-84.1	0	0	110.1	C102 I103 K105 R108	M95-C102 CarbonylContact O-C 3.43Å; M95-C102 WeakPolarHBondContact O-CA 3.36Å; M95-I103 HydrophobicContact CE-CD1 4.43Å; M95-I103 HydrophobicContact CG-CD1 4.23Å; M95-I103 HydrophobicContact CG-CG1 3.58Å; M95-I103 PolarHBondContact N-O 2.88Å; M95-I103 PolarHBondContact O-N 3.1Å; M95-I103 HydrophobicContact SD-CD1 4.29Å; M95-I103 HydrophobicContact SD-CG1 4.28Å; M95-K105 HydrophobicContact CB-CG 4.18Å; M95-R108 HydrophobicContact CE-CB 4.44Å; M95-R108 HydrophobicContact CE-CG 3.87Å; M95-R108 HydrophobicContact SD-CB 3.45Å; M95-R108 WeakPolarHBondContact SD-CB 3.47Å; M95-R108 WeakPolarHBondContact SD-CD 3.25Å; M95-R108 HydrophobicContact SD-CG 3.47Å; M95-R108 WeakPolarHBondContact SD-CG 3.42Å
96	Q	77.8	Confident	66.6	Low	128 Å²	128	83.5 Å²	83.5	60%	0.598	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.9	179.8	-157.5	166.3	14.9	0	0	110.4	C90 G100 E101	C90-Q96 VanDerWaalsContact SG-CB 3.53Å; Q96-G100 PolarHBondContact NE2-O 3.43Å; Q96-E101 CarbonylContact C-O 3.56Å; Q96-E101 WeakPolarHBondContact CA-O 3.23Å
97	C	77.8	Confident	67.5	Low	7 Å²	7	84.3 Å²	84.3	5%	0.047	47%	0.465	C	S	.	.			trans	-61.9	155.9	166.9	-63.9	0	0	0	0	110.1	S99 G100 E101 C115	C97-S99 WeakPolarHBondContact CB-OG 3.49Å; C97-S99 PolarHBondContact O-N 2.84Å; C97-G100 PolarHBondContact O-N 3.12Å; C97-E101 HydrophobicContact CB-CB 4.34Å; C97-E101 WeakPolarHBondContact CB-O 3.46Å; C97-E101 PolarHBondContact N-O 3.44Å; C97-C115 HydrophobicContact CB-CB 3.97Å; C97-C115 WeakPolarHBondContact CB-SG 3.34Å; C97-C115 WeakPolarHBondContact SG-CB 3.43Å; C97-C115 CovalentContact SG-SG 2.04Å; C97-C115 PolarHBondContact SG-SG 3.31Å
98	S	74.6	Confident	68.6	Low	109 Å²	109	84.1 Å²	84.1	76%	0.762	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.8	174.8	-59.6	0	0	0	0	113.2	G100	S98-G100 VanDerWaalsContact C-N 3.29Å
99	S	68.4	Low	69.7	Low	57 Å²	57	81.3 Å²	81.3	40%	0.399	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.5	172.2	56.5	0	0	0	0	114.3	C97	C97-S99 WeakPolarHBondContact CB-OG 3.49Å; C97-S99 PolarHBondContact O-N 2.84Å
100	G	70.4	Confident	70.1	Confident	40 Å²	40	74.3 Å²	74.3	41%	0.412	40%	0.395	S	S	.	.	S	Bend	trans	102.5	-11.6	174.7	0	0	0	0	0	115.9	Q96 C97 S98	Q96-G100 PolarHBondContact NE2-O 3.43Å; C97-G100 PolarHBondContact O-N 3.12Å; S98-G100 VanDerWaalsContact C-N 3.29Å
101	E	75.5	Confident	70.3	Confident	87 Å²	87	75.5 Å²	75.5	41%	0.407	41%	0.411	S	S	.	.			trans	-73.6	149.4	178.2	-55.4	-70.2	-176.8	0	0	111.9	Q96 C97 K116	Q96-E101 CarbonylContact C-O 3.56Å; Q96-E101 WeakPolarHBondContact CA-O 3.23Å; C97-E101 HydrophobicContact CB-CB 4.34Å; C97-E101 WeakPolarHBondContact CB-O 3.46Å; C97-E101 PolarHBondContact N-O 3.44Å; E101-K116 IonicContact OE1-NZ 2.68Å; E101-K116 PolarHBondContact OE1-NZ 2.99Å
102	C	78.7	Confident	70.2	Confident	55 Å²	55	75.4 Å²	75.4	37%	0.372	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.8	173.8	-62.8	0	0	0	0	109.8	C90 E94 M95	C90-C102 HydrophobicContact CB-CB 3.84Å; C90-C102 WeakPolarHBondContact CB-SG 3.11Å; C90-C102 WeakPolarHBondContact SG-CB 3.48Å; C90-C102 CovalentContact SG-SG 2.04Å; C90-C102 PolarHBondContact SG-SG 3.34Å; E94-C102 HydrophobicContact CB-CB 4.45Å; M95-C102 CarbonylContact O-C 3.43Å; M95-C102 WeakPolarHBondContact O-CA 3.36Å
103	I	73	Confident	71	Confident	18 Å²	18	74.6 Å²	74.6	9%	0.092	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	157.7	174.5	61.8	169.5	0	0	0	110.4	E94 M95 W107 D120	E94-I103 CarbonylContact C-O 3.53Å; E94-I103 VanDerWaalsContact CA-O 3.25Å; E94-I103 WeakPolarHBondContact CA-O 3.4Å; M95-I103 HydrophobicContact CE-CD1 4.43Å; M95-I103 HydrophobicContact CG-CD1 4.23Å; M95-I103 HydrophobicContact CG-CG1 3.58Å; M95-I103 PolarHBondContact N-O 2.88Å; M95-I103 PolarHBondContact O-N 3.1Å; M95-I103 HydrophobicContact SD-CD1 4.29Å; M95-I103 HydrophobicContact SD-CG1 4.28Å; I103-W107 HydrophobicContact CD1-CB 4.39Å; I103-W107 VanDerWaalsContact CD1-O 3.28Å; I103-W107 WeakPolarHBondContact CD1-O 3.3Å; I103-D120 HydrophobicContact CD1-CB 3.6Å
104	H	73.9	Confident	71.7	Confident	71 Å²	71	75.4 Å²	75.4	33%	0.329	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	141.8	179.2	-165.9	-89.4	0	0	0	110.4	K106 W107	H104-K106 PolarHBondContact ND1-N 3.16Å; H104-K106 PolarHBondContact O-N 2.86Å; H104-W107 HydrophobicContact CB-CD2 4.47Å; H104-W107 HydrophobicContact CB-CG 4.18Å; H104-W107 WeakPolarHBondContact O-CB 3.28Å; H104-W107 PolarHBondContact O-N 3.43Å
105	K	68.8	Low	72	Confident	121 Å²	121	72.6 Å²	72.6	53%	0.526	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-13.8	-178.7	-77.8	177.4	178.3	176.5	0	115.4	S92 S93 E94 M95	S92-K105 WeakPolarHBondContact O-CE 3.32Å; S92-K105 PolarHBondContact O-NZ 3.03Å; S93-K105 WeakPolarHBondContact O-CB 3.44Å; S93-K105 WeakPolarHBondContact O-CG 3.42Å; S93-K105 PolarHBondContact O-N 3.1Å; E94-K105 WeakPolarHBondContact O-CE 3.39Å; M95-K105 HydrophobicContact CB-CG 4.18Å
106	K	70.5	Confident	71.9	Confident	164 Å²	164	79.1 Å²	79.1	71%	0.713	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-22.2	175.7	-73.5	-177.1	178.2	-178.2	0	112.4	H104 R108	H104-K106 PolarHBondContact ND1-N 3.16Å; H104-K106 PolarHBondContact O-N 2.86Å; K106-R108 PolarHBondContact O-N 3.46Å
107	W	65.5	Low	71.7	Confident	125 Å²	125	78.9 Å²	78.9	47%	0.473	42%	0.421	S	S	.	.	S	Bend	trans	-93	31.9	-174.5	-57.2	10.7	0	0	0	110.2	I103 H104 D110 D114	I103-W107 HydrophobicContact CD1-CB 4.39Å; I103-W107 VanDerWaalsContact CD1-O 3.28Å; I103-W107 WeakPolarHBondContact CD1-O 3.3Å; H104-W107 HydrophobicContact CB-CD2 4.47Å; H104-W107 HydrophobicContact CB-CG 4.18Å; H104-W107 WeakPolarHBondContact O-CB 3.28Å; H104-W107 PolarHBondContact O-N 3.43Å; W107-D110 WeakPolarHBondContact CA-OD2 3.29Å; W107-D114 HydrophobicContact CE3-CB 4.02Å
108	R	71.5	Confident	71.3	Confident	124 Å²	124	79.8 Å²	79.8	47%	0.468	43%	0.432	S	S	.	.	S	Bend	trans	-119.9	121.5	-179.9	-167.5	-164.7	-178.6	-130.3	-9	106.1	M95 K106 D110	M95-R108 HydrophobicContact CE-CB 4.44Å; M95-R108 HydrophobicContact CE-CG 3.87Å; M95-R108 HydrophobicContact SD-CB 3.45Å; M95-R108 WeakPolarHBondContact SD-CB 3.47Å; M95-R108 WeakPolarHBondContact SD-CD 3.25Å; M95-R108 HydrophobicContact SD-CG 3.47Å; M95-R108 WeakPolarHBondContact SD-CG 3.42Å; K106-R108 PolarHBondContact O-N 3.46Å; R108-D110 PolarHBondContact O-N 3.36Å
109	C	68.7	Low	71.5	Confident	18 Å²	18	75.9 Å²	75.9	12%	0.122	41%	0.405	C	S	.	.	S	Bend	trans	58.9	35.8	-174.4	-50.4	0	0	0	0	111.1	D120 E121 C124 R127	C109-D120 PolarHBondContact N-O 2.86Å; C109-E121 VanDerWaalsContact C-OE1 3.24Å; C109-E121 WeakPolarHBondContact CA-OE1 3.44Å; C109-E121 WeakPolarHBondContact CA-OE2 3.38Å; C109-E121 PolarHBondContact N-OE1 3.17Å; C109-C124 WeakPolarHBondContact CA-SG 3.49Å; C109-C124 HydrophobicContact CB-CB 3.55Å; C109-C124 WeakPolarHBondContact CB-SG 3.39Å; C109-C124 VanDerWaalsContact SG-CA 3.6Å; C109-C124 WeakPolarHBondContact SG-CB 3.46Å; C109-C124 CovalentContact SG-SG 2.01Å; C109-C124 PolarHBondContact SG-SG 2.87Å; C109-R127 PolarHBondContact O-NE 3.04Å; C109-R127 PolarHBondContact O-NH2 2.85Å
110	D	65.4	Low	71.8	Confident	48 Å²	48	73.2 Å²	73.2	26%	0.257	39%	0.386	S	S	.	.	S	Bend	trans	-90.1	-18.4	178	73.6	-9.6	0	0	0	113.6	W107 R108 D112 E121 R127	W107-D110 WeakPolarHBondContact CA-OD2 3.29Å; R108-D110 PolarHBondContact O-N 3.36Å; D110-D112 PolarHBondContact OD1-N 2.92Å; D110-E121 PolarHBondContact N-OE1 3.46Å; D110-R127 PolarHBondContact O-NH1 2.9Å; D110-R127 VanDerWaalsContact O-NH1 3.11Å
111	G	63.2	Low	72.2	Confident	51 Å²	51	73.9 Å²	73.9	53%	0.526	38%	0.378	S	S	.	.	S	Bend	trans	115.2	-10.5	174.5	0	0	0	0	0	112.9	E121	G111-E121 WeakPolarHBondContact CA-OE2 3.34Å; G111-E121 PolarHBondContact N-OE1 2.93Å; G111-E121 PolarHBondContact N-OE2 3.39Å
112	D	65.4	Low	71.9	Confident	104 Å²	104	72.5 Å²	72.5	56%	0.556	38%	0.381	S	S	*	.	S	Bend	trans	-110.9	134.6	179.6	-70.5	-45.8	0	0	0	110.1	D110 D114 E121	D110-D112 PolarHBondContact OD1-N 2.92Å; D112-D114 PolarHBondContact O-N 2.92Å; D112-E121 WeakPolarHBondContact O-CG 3.35Å
113	P	73.4	Confident	71.3	Confident	95 Å²	95	77.6 Å²	77.6	62%	0.617	41%	0.405	S	S	*	.			trans	-77.7	86.8	175.6	29.5	-31.4	0	0	0	110.3
114	D	77.8	Confident	70.9	Confident	62 Å²	62	78.9 Å²	78.9	33%	0.332	42%	0.415	S	S	.	.			trans	-82	-28.9	177	-72.1	-54.6	0	0	0	112.3	W107 D112 D120	W107-D114 HydrophobicContact CE3-CB 4.02Å; D112-D114 PolarHBondContact O-N 2.92Å; D114-D120 WeakPolarHBondContact CA-OD2 3.19Å; D114-D120 WeakPolarHBondContact CB-OD2 3.33Å; D114-D120 PolarHBondContact N-OD2 2.83Å
115	C	77.4	Confident	70.2	Confident	3 Å²	3	80.5 Å²	80.5	2%	0.02	43%	0.432	C	S	.	.	S	Bend	trans	-71.6	133.1	165.3	-66	0	0	0	0	109	C97 D117 G118 D120	C97-C115 HydrophobicContact CB-CB 3.97Å; C97-C115 WeakPolarHBondContact CB-SG 3.34Å; C97-C115 WeakPolarHBondContact SG-CB 3.43Å; C97-C115 CovalentContact SG-SG 2.04Å; C97-C115 PolarHBondContact SG-SG 3.31Å; C115-D117 PolarHBondContact O-N 3.29Å; C115-G118 PolarHBondContact O-N 2.8Å; C115-D120 HydrophobicContact CB-CB 4.3Å; C115-D120 WeakPolarHBondContact CB-OD1 3.41Å; C115-D120 PolarHBondContact N-OD1 3.32Å; C115-D120 PolarHBondContact N-OD2 2.97Å; C115-D120 VanDerWaalsContact SG-CB 3.55Å
116	K	72	Confident	69.4	Low	175 Å²	175	79.4 Å²	79.4	76%	0.761	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-23.1	173.8	-71.6	175.8	-178.1	154.7	0	114.8	E101	E101-K116 IonicContact OE1-NZ 2.68Å; E101-K116 PolarHBondContact OE1-NZ 2.99Å
117	D	73.5	Confident	68.5	Low	122 Å²	122	78.3 Å²	78.3	65%	0.652	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	10.4	-180	-160.3	28.7	0	0	0	112.5	C115 S119	C115-D117 PolarHBondContact O-N 3.29Å; D117-S119 PolarHBondContact O-N 3.08Å; D117-S119 VanDerWaalsContact O-N 3.11Å
118	G	69.7	Low	67.8	Low	26 Å²	26	77.8 Å²	77.8	27%	0.268	45%	0.452	S	S	.	.	S	Bend	trans	59.4	21.4	-179.7	0	0	0	0	0	115.2	C115 D120 E121 A122	C115-G118 PolarHBondContact O-N 2.8Å; G118-D120 VanDerWaalsContact C-N 3.27Å; G118-D120 WeakPolarHBondContact CA-OD1 3.34Å; G118-D120 PolarHBondContact O-N 2.73Å; G118-E121 PolarHBondContact O-N 3.17Å; G118-A122 PolarHBondContact O-N 2.75Å
119	S	78.3	Confident	67.2	Low	28 Å²	28	73.4 Å²	73.4	20%	0.196	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.9	-172.6	-0.8	0	0	0	0	113.6	D117	D117-S119 PolarHBondContact O-N 3.08Å; D117-S119 VanDerWaalsContact O-N 3.11Å
120	D	75	Confident	66.8	Low	0 Å²	0	78.4 Å²	78.4	0%	0	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.7	172.6	48	-20.7	0	0	0	113.8	I103 C109 D114 C115 G118	I103-D120 HydrophobicContact CD1-CB 3.6Å; C109-D120 PolarHBondContact N-O 2.86Å; D114-D120 WeakPolarHBondContact CA-OD2 3.19Å; D114-D120 WeakPolarHBondContact CB-OD2 3.33Å; D114-D120 PolarHBondContact N-OD2 2.83Å; C115-D120 HydrophobicContact CB-CB 4.3Å; C115-D120 WeakPolarHBondContact CB-OD1 3.41Å; C115-D120 PolarHBondContact N-OD1 3.32Å; C115-D120 PolarHBondContact N-OD2 2.97Å; C115-D120 VanDerWaalsContact SG-CB 3.55Å; G118-D120 VanDerWaalsContact C-N 3.27Å; G118-D120 WeakPolarHBondContact CA-OD1 3.34Å; G118-D120 PolarHBondContact O-N 2.73Å
121	E	78.7	Confident	66.4	Low	55 Å²	55	82.6 Å²	82.6	26%	0.257	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-6	179.6	-65.3	-56.2	120.3	0	0	113.3	C109 D110 G111 D112 G118 N123	C109-E121 VanDerWaalsContact C-OE1 3.24Å; C109-E121 WeakPolarHBondContact CA-OE1 3.44Å; C109-E121 WeakPolarHBondContact CA-OE2 3.38Å; C109-E121 PolarHBondContact N-OE1 3.17Å; D110-E121 PolarHBondContact N-OE1 3.46Å; G111-E121 WeakPolarHBondContact CA-OE2 3.34Å; G111-E121 PolarHBondContact N-OE1 2.93Å; G111-E121 PolarHBondContact N-OE2 3.39Å; D112-E121 WeakPolarHBondContact O-CG 3.35Å; G118-E121 PolarHBondContact O-N 3.17Å; E121-N123 PolarHBondContact O-N 2.97Å
122	A	69.6	Low	66.3	Low	57 Å²	57	87 Å²	87	47%	0.471	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	123.6	178.1	0	0	0	0	0	111.8	G118	G118-A122 PolarHBondContact O-N 2.75Å
123	N	65.4	Low	66.6	Low	163 Å²	163	85.7 Å²	85.7	87%	0.872	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	46.1	170.7	-141.1	8.9	0	0	0	115	E121	E121-N123 PolarHBondContact O-N 2.97Å
124	C	65.3	Low	66.5	Low	45 Å²	45	83.8 Å²	83.8	30%	0.304	47%	0.474	S	S	.	.			trans	-83.3	139.8	177	-64.2	0	0	0	0	112.9	C109	C109-C124 WeakPolarHBondContact CA-SG 3.49Å; C109-C124 HydrophobicContact CB-CB 3.55Å; C109-C124 WeakPolarHBondContact CB-SG 3.39Å; C109-C124 VanDerWaalsContact SG-CA 3.6Å; C109-C124 WeakPolarHBondContact SG-CB 3.46Å; C109-C124 CovalentContact SG-SG 2.01Å; C109-C124 PolarHBondContact SG-SG 2.87Å
125	P	59	Low	66.4	Low	104 Å²	104	86.3 Å²	86.3	68%	0.675	48%	0.482	S	S	*	.			trans	-65.2	141.3	174.4	25.7	-30.6	0	0	0	110.5	R127	P125-R127 PolarHBondContact O-N 2.87Å
126	A	52.4	Low	66.4	Low	98 Å²	98	86.2 Å²	86.2	81%	0.81	48%	0.482	S	S	*	.			trans	-54.6	114.5	179.8	0	0	0	0	0	110.8	S128	A126-S128 PolarHBondContact O-N 3.02Å
127	R	51	Low	66.4	Low	142 Å²	142	84.9 Å²	84.9	54%	0.536	48%	0.483	S	S	.	.			trans	-61.3	108.5	178	-79.6	178	161.1	-177.9	-12.6	109.2	C109 D110 P125	C109-R127 PolarHBondContact O-NE 3.04Å; C109-R127 PolarHBondContact O-NH2 2.85Å; D110-R127 PolarHBondContact O-NH1 2.9Å; D110-R127 VanDerWaalsContact O-NH1 3.11Å; P125-R127 PolarHBondContact O-N 2.87Å
128	S	51.6	Low	66.1	Low	113 Å²	113	84.7 Å²	84.7	79%	0.79	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-93	119	159.4	46.6	0	0	0	0	106.7	A126	A126-S128 PolarHBondContact O-N 3.02Å
129	C	58.6	Low	65.9	Low	32 Å²	32	84.7 Å²	84.7	22%	0.216	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-62.6	145	177.6	-55.6	0	0	0	0	109.4	K133 K135 C141	C129-K133 HydrophobicContact CB-CB 4.28Å; C129-K135 VanDerWaalsContact SG-CB 3.59Å; C129-C141 HydrophobicContact CB-CB 3.98Å; C129-C141 WeakPolarHBondContact CB-SG 3.31Å; C129-C141 WeakPolarHBondContact SG-CB 3.18Å; C129-C141 CovalentContact SG-SG 2.05Å; C129-C141 PolarHBondContact SG-SG 3.24Å
130	E	59.5	Low	65.5	Low	124 Å²	124	85 Å²	85	58%	0.579	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-55	148.4	169.4	-74.1	169.8	146.7	0	0	110.1	D132 K133	E130-D132 PolarHBondContact O-N 3.22Å; E130-K133 PolarHBondContact O-N 3.28Å; E130-K133 VanDerWaalsContact OE2-CE 3.26Å; E130-K133 WeakPolarHBondContact OE2-CE 3.3Å; E130-K133 IonicContact OE2-NZ 2.89Å; E130-K133 PolarHBondContact OE2-NZ 2.85Å
131	P	58.5	Low	65.5	Low	135 Å²	135	87.6 Å²	87.6	88%	0.877	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.5	-171.2	-6.7	2.8	0	0	0	115.9
132	D	60.8	Low	65.3	Low	143 Å²	143	85.9 Å²	85.9	77%	0.765	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	9.1	-178.5	-66.3	-32	0	0	0	114.2	E130 G144	E130-D132 PolarHBondContact O-N 3.22Å; D132-G144 PolarHBondContact O-N 2.85Å
133	K	70.1	Confident	65.2	Low	77 Å²	77	87.9 Å²	87.9	34%	0.335	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.8	179.5	-64.7	-172.5	-172.8	175.8	0	111.5	C129 E130 C141 I142	C129-K133 HydrophobicContact CB-CB 4.28Å; E130-K133 PolarHBondContact O-N 3.28Å; E130-K133 VanDerWaalsContact OE2-CE 3.26Å; E130-K133 WeakPolarHBondContact OE2-CE 3.3Å; E130-K133 IonicContact OE2-NZ 2.89Å; E130-K133 PolarHBondContact OE2-NZ 2.85Å; K133-C141 HydrophobicContact CB-CB 4.35Å; K133-C141 HydrophobicContact CD-CB 4.49Å; K133-I142 CarbonylContact C-O 3.58Å; K133-I142 VanDerWaalsContact CA-O 3.26Å; K133-I142 WeakPolarHBondContact CA-O 3.39Å; K133-I142 VanDerWaalsContact CB-O 3.29Å; K133-I142 WeakPolarHBondContact CB-O 3.49Å
134	F	73.1	Confident	65.2	Low	55 Å²	55	81.8 Å²	81.8	24%	0.241	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	137.8	174.5	177.3	-102.4	0	0	0	109.9	C141 I142 Q147	F134-C141 CarbonylContact O-C 3.53Å; F134-C141 WeakPolarHBondContact O-CA 3.25Å; F134-I142 HydrophobicContact CB-CG1 4.03Å; F134-I142 HydrophobicContact CD1-CD1 3.94Å; F134-I142 HydrophobicContact CD1-CG1 3.89Å; F134-I142 HydrophobicContact CG-CG1 4.47Å; F134-I142 PolarHBondContact N-O 3.33Å; F134-I142 PolarHBondContact O-N 2.98Å; F134-Q147 HydrophobicContact CB-CB 4.48Å; F134-Q147 HydrophobicContact CD1-CG 4.27Å; F134-Q147 VanDerWaalsContact CD2-CD 3.45Å; F134-Q147 HydrophobicContact CD2-CG 4.34Å; F134-Q147 VanDerWaalsContact CD2-NE2 3.34Å; F134-Q147 HydrophobicContact CE1-CG 4.43Å; F134-Q147 HydrophobicContact CG-CB 4.37Å; F134-Q147 HydrophobicContact CG-CG 4.21Å
135	K	75.6	Confident	65.2	Low	115 Å²	115	84.2 Å²	84.2	50%	0.5	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.9	179.5	-172.6	-180	174.5	-177.1	0	109	C129	C129-K135 VanDerWaalsContact SG-CB 3.59Å
136	C	75.9	Confident	65.6	Low	1 Å²	1	85.2 Å²	85.2	1%	0.007	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-65.1	157.4	170.2	-47.4	0	0	0	0	110	D138 G139 S140 C154	C136-D138 VanDerWaalsContact C-N 3.25Å; C136-D138 PolarHBondContact O-N 3.06Å; C136-G139 PolarHBondContact O-N 3.08Å; C136-S140 WeakPolarHBondContact CB-O 3.22Å; C136-S140 WeakPolarHBondContact CB-OG 3.23Å; C136-S140 PolarHBondContact N-O 2.83Å; C136-S140 PolarHBondContact SG-O 2.73Å; C136-S140 PolarHBondContact SG-OG 2.96Å; C136-C154 HydrophobicContact CB-CB 3.79Å; C136-C154 WeakPolarHBondContact CB-SG 3.41Å; C136-C154 WeakPolarHBondContact SG-CB 3.44Å; C136-C154 CovalentContact SG-SG 2.03Å; C136-C154 PolarHBondContact SG-SG 3.27Å
137	D	72.9	Confident	66.4	Low	148 Å²	148	84.6 Å²	84.6	79%	0.791	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-27	-179.5	-78.9	-15.2	0	0	0	112.1	G139 D156	D137-G139 PolarHBondContact O-N 3.35Å; D137-D156 PolarHBondContact N-OD2 3.07Å
138	D	66.7	Low	67.2	Low	118 Å²	118	80.6 Å²	80.6	63%	0.631	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-3.5	169.5	-162.9	35.9	0	0	0	114.1	C136 D156	C136-D138 VanDerWaalsContact C-N 3.25Å; C136-D138 PolarHBondContact O-N 3.06Å; D138-D156 HydrophobicContact CB-CB 4.24Å; D138-D156 PolarHBondContact N-OD2 3.4Å
139	G	67	Low	68.1	Low	26 Å²	26	78.3 Å²	78.3	27%	0.268	43%	0.43	S	S	.	.	S	Bend	trans	90.5	-0.1	174	0	0	0	0	0	115.8	C136 D137	C136-G139 PolarHBondContact O-N 3.08Å; D137-G139 PolarHBondContact O-N 3.35Å
140	S	68.9	Low	68.5	Low	35 Å²	35	79.7 Å²	79.7	25%	0.245	45%	0.449	C	S	.	.			trans	-70.7	147.6	168.4	36.3	0	0	0	0	111.7	C136	C136-S140 WeakPolarHBondContact CB-O 3.22Å; C136-S140 WeakPolarHBondContact CB-OG 3.23Å; C136-S140 PolarHBondContact N-O 2.83Å; C136-S140 PolarHBondContact SG-O 2.73Å; C136-S140 PolarHBondContact SG-OG 2.96Å
141	C	74.4	Confident	69	Low	53 Å²	53	82 Å²	82	36%	0.358	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.8	-179	-53.3	0	0	0	0	110.5	C129 K133 F134	C129-C141 HydrophobicContact CB-CB 3.98Å; C129-C141 WeakPolarHBondContact CB-SG 3.31Å; C129-C141 WeakPolarHBondContact SG-CB 3.18Å; C129-C141 CovalentContact SG-SG 2.05Å; C129-C141 PolarHBondContact SG-SG 3.24Å; K133-C141 HydrophobicContact CB-CB 4.35Å; K133-C141 HydrophobicContact CD-CB 4.49Å; F134-C141 CarbonylContact O-C 3.53Å; F134-C141 WeakPolarHBondContact O-CA 3.25Å
142	I	74	Confident	69.8	Low	19 Å²	19	84.7 Å²	84.7	10%	0.097	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	160	173	61.5	167.1	0	0	0	111	K133 F134 R146 D153 D159	K133-I142 CarbonylContact C-O 3.58Å; K133-I142 VanDerWaalsContact CA-O 3.26Å; K133-I142 WeakPolarHBondContact CA-O 3.39Å; K133-I142 VanDerWaalsContact CB-O 3.29Å; K133-I142 WeakPolarHBondContact CB-O 3.49Å; F134-I142 HydrophobicContact CB-CG1 4.03Å; F134-I142 HydrophobicContact CD1-CD1 3.94Å; F134-I142 HydrophobicContact CD1-CG1 3.89Å; F134-I142 HydrophobicContact CG-CG1 4.47Å; F134-I142 PolarHBondContact N-O 3.33Å; F134-I142 PolarHBondContact O-N 2.98Å; I142-R146 HydrophobicContact CB-CB 4.45Å; I142-R146 HydrophobicContact CD1-CB 4.06Å; I142-D153 HydrophobicContact CD1-CB 4.49Å; I142-D159 HydrophobicContact CD1-CB 3.48Å; I142-D159 VanDerWaalsContact CD1-CB 3.48Å
143	Q	69.4	Low	70.5	Confident	99 Å²	99	80.4 Å²	80.4	46%	0.463	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	138.6	171.6	-74.5	-84.9	-29.1	0	0	109.4	S145 R146	Q143-S145 PolarHBondContact O-N 3.39Å; Q143-R146 HydrophobicContact CB-CG 4.38Å; Q143-R146 WeakPolarHBondContact O-CB 3.48Å; Q143-R146 PolarHBondContact O-N 2.9Å
144	G	64.3	Low	70.8	Confident	36 Å²	36	76.8 Å²	76.8	37%	0.371	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-57.2	-21.2	-178.7	0	0	0	0	0	114.6	D132 R146	D132-G144 PolarHBondContact O-N 2.85Å; G144-R146 VanDerWaalsContact C-N 3.31Å
145	S	64.6	Low	70.7	Confident	96 Å²	96	81 Å²	81	67%	0.671	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-75.4	-13.3	174.1	54.8	0	0	0	0	115.1	Q143	Q143-S145 PolarHBondContact O-N 3.39Å
146	R	67.9	Low	70.5	Confident	125 Å²	125	78 Å²	78	47%	0.472	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-94.9	-4.6	177.7	-68.1	-171.1	-175.3	-168.4	-1.6	113.2	I142 Q143 G144 D153	I142-R146 HydrophobicContact CB-CB 4.45Å; I142-R146 HydrophobicContact CD1-CB 4.06Å; Q143-R146 HydrophobicContact CB-CG 4.38Å; Q143-R146 WeakPolarHBondContact O-CB 3.48Å; Q143-R146 PolarHBondContact O-N 2.9Å; G144-R146 VanDerWaalsContact C-N 3.31Å; R146-D153 HydrophobicContact CB-CB 4.22Å; R146-D153 WeakPolarHBondContact CB-OD2 3.31Å; R146-D153 IonicContact NH1-OD1 3.19Å
147	Q	70.4	Confident	70.2	Confident	84 Å²	84	78.2 Å²	78.2	39%	0.393	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	127.6	169	-170.4	-178.7	15.3	0	0	108.9	F134	F134-Q147 HydrophobicContact CB-CB 4.48Å; F134-Q147 HydrophobicContact CD1-CG 4.27Å; F134-Q147 VanDerWaalsContact CD2-CD 3.45Å; F134-Q147 HydrophobicContact CD2-CG 4.34Å; F134-Q147 VanDerWaalsContact CD2-NE2 3.34Å; F134-Q147 HydrophobicContact CE1-CG 4.43Å; F134-Q147 HydrophobicContact CG-CB 4.37Å; F134-Q147 HydrophobicContact CG-CG 4.21Å
148	C	67.6	Low	70.4	Confident	59 Å²	59	72 Å²	72	40%	0.399	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	39.7	175.3	-55.8	0	0	0	0	115.4	D159 E160 C163	C148-D159 PolarHBondContact N-O 2.75Å; C148-E160 VanDerWaalsContact C-OE1 3.3Å; C148-E160 VanDerWaalsContact CA-OE1 3.23Å; C148-E160 WeakPolarHBondContact CA-OE1 3.35Å; C148-E160 PolarHBondContact N-OE1 2.75Å; C148-C163 WeakPolarHBondContact CA-SG 3.44Å; C148-C163 HydrophobicContact CB-CB 3.55Å; C148-C163 WeakPolarHBondContact CB-SG 3.29Å; C148-C163 WeakPolarHBondContact SG-CA 3.44Å; C148-C163 WeakPolarHBondContact SG-CB 3.43Å; C148-C163 CovalentContact SG-SG 2.01Å; C148-C163 PolarHBondContact SG-SG 3.3Å
149	N	70.6	Confident	70.7	Confident	65 Å²	65	66.4 Å²	66.4	35%	0.348	36%	0.363	S	S	.	.	S	Bend	trans	-97.1	1.7	178.2	73.2	13.7	0	0	0	113	Y151 D153 E160	N149-Y151 VanDerWaalsContact C-N 3.34Å; N149-Y151 WeakPolarHBondContact OD1-CA 3.47Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.37Å; N149-Y151 PolarHBondContact OD1-N 2.65Å; N149-Y151 PolarHBondContact OD1-O 2.71Å; N149-D153 PolarHBondContact ND2-OD2 3.34Å; N149-D153 PolarHBondContact OD1-OD2 3.27Å; N149-E160 PolarHBondContact N-OE1 3.12Å; N149-E160 PolarHBondContact OD1-OE1 2.9Å
150	G	67.1	Low	71.2	Confident	60 Å²	60	67.9 Å²	67.9	62%	0.619	36%	0.363	S	S	*	.	S	Bend	trans	85	4.2	-180	0	0	0	0	0	114.2	E160	G150-E160 VanDerWaalsContact CA-OE2 3.3Å; G150-E160 WeakPolarHBondContact CA-OE2 3.4Å; G150-E160 VanDerWaalsContact N-CD 3.3Å; G150-E160 PolarHBondContact N-OE1 3.36Å; G150-E160 PolarHBondContact N-OE2 2.8Å; G150-E160 VanDerWaalsContact N-OE2 3.17Å
151	Y	68.9	Low	71.2	Confident	173 Å²	173	71.9 Å²	71.9	68%	0.678	38%	0.38	S	S	*	.	S	Bend	trans	-118.7	140.4	175.2	-64.6	-88.4	0	0	0	109	N149 D153 D159 E160	N149-Y151 VanDerWaalsContact C-N 3.34Å; N149-Y151 WeakPolarHBondContact OD1-CA 3.47Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.37Å; N149-Y151 PolarHBondContact OD1-N 2.65Å; N149-Y151 PolarHBondContact OD1-O 2.71Å; Y151-D153 PolarHBondContact O-N 3.49Å; Y151-D159 VanDerWaalsContact O-OD2 3.11Å; Y151-E160 VanDerWaalsContact O-CG 3.28Å; Y151-E160 WeakPolarHBondContact O-CG 3.25Å
152	R	74.8	Confident	70.5	Confident	191 Å²	191	76.7 Å²	76.7	72%	0.721	40%	0.402	S	S	*	.			trans	-73.2	92.9	172.9	-178.9	-180	-67.2	-177.8	-2.3	108.9	C154	R152-C154 WeakPolarHBondContact CG-O 3.36Å
153	D	77.3	Confident	70.1	Confident	53 Å²	53	77.3 Å²	77.3	28%	0.283	41%	0.408	S	S	.	.			trans	-92.9	-23.6	174.8	-75.4	-65.6	0	0	0	112.8	I142 R146 N149 Y151 D159	I142-D153 HydrophobicContact CD1-CB 4.49Å; R146-D153 HydrophobicContact CB-CB 4.22Å; R146-D153 WeakPolarHBondContact CB-OD2 3.31Å; R146-D153 IonicContact NH1-OD1 3.19Å; N149-D153 PolarHBondContact ND2-OD2 3.34Å; N149-D153 PolarHBondContact OD1-OD2 3.27Å; Y151-D153 PolarHBondContact O-N 3.49Å; D153-D159 VanDerWaalsContact CA-OD2 3.31Å; D153-D159 WeakPolarHBondContact CA-OD2 3.13Å; D153-D159 VanDerWaalsContact CB-OD2 3.26Å; D153-D159 WeakPolarHBondContact CB-OD2 3.44Å; D153-D159 PolarHBondContact N-OD2 3.19Å
154	C	75.7	Confident	69.6	Low	2 Å²	2	81.1 Å²	81.1	1%	0.014	42%	0.423	C	S	.	.	S	Bend	trans	-88.8	138.5	163.8	-62.1	0	0	0	0	109.7	C136 R152 D156 G157 D159	C136-C154 HydrophobicContact CB-CB 3.79Å; C136-C154 WeakPolarHBondContact CB-SG 3.41Å; C136-C154 WeakPolarHBondContact SG-CB 3.44Å; C136-C154 CovalentContact SG-SG 2.03Å; C136-C154 PolarHBondContact SG-SG 3.27Å; R152-C154 WeakPolarHBondContact CG-O 3.36Å; C154-D156 WeakPolarHBondContact CB-OD1 3.48Å; C154-D156 PolarHBondContact O-N 3.14Å; C154-G157 WeakPolarHBondContact O-CA 3.43Å; C154-G157 PolarHBondContact O-N 2.96Å; C154-D159 HydrophobicContact CB-CB 4.21Å; C154-D159 VanDerWaalsContact CB-OD1 3.27Å; C154-D159 WeakPolarHBondContact CB-OD1 3.33Å; C154-D159 PolarHBondContact N-OD1 3.49Å; C154-D159 PolarHBondContact N-OD2 2.8Å; C154-D159 VanDerWaalsContact SG-CB 3.51Å
155	D	70.8	Confident	68.9	Low	142 Å²	142	84.8 Å²	84.8	76%	0.759	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.5	179.8	-64.9	-50	0	0	0	112.8
156	D	72.1	Confident	68.2	Low	54 Å²	54	87.2 Å²	87.2	29%	0.289	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.4	174.3	66.8	2	0	0	0	113.9	D137 D138 C154 S158	D137-D156 PolarHBondContact N-OD2 3.07Å; D138-D156 HydrophobicContact CB-CB 4.24Å; D138-D156 PolarHBondContact N-OD2 3.4Å; C154-D156 WeakPolarHBondContact CB-OD1 3.48Å; C154-D156 PolarHBondContact O-N 3.14Å; D156-S158 VanDerWaalsContact C-N 3.32Å; D156-S158 WeakPolarHBondContact OD1-CB 3.25Å; D156-S158 PolarHBondContact OD1-N 3.13Å; D156-S158 PolarHBondContact OD1-OG 3.46Å; D156-S158 WeakPolarHBondContact OD2-CB 3.44Å; D156-S158 PolarHBondContact OD2-OG 2.94Å
157	G	68.9	Low	67.3	Low	5 Å²	5	87.5 Å²	87.5	5%	0.052	45%	0.454	C	S	.	.			trans	72.6	13.7	-174.3	0	0	0	0	0	115.9	C154 D159 E160 I161	C154-G157 WeakPolarHBondContact O-CA 3.43Å; C154-G157 PolarHBondContact O-N 2.96Å; G157-D159 VanDerWaalsContact C-OD1 3.27Å; G157-D159 WeakPolarHBondContact CA-OD1 3.06Å; G157-D159 PolarHBondContact O-N 3.32Å; G157-E160 PolarHBondContact O-N 2.74Å; G157-E160 VanDerWaalsContact O-N 3.13Å; G157-I161 WeakPolarHBondContact O-CD1 3.22Å; G157-I161 VanDerWaalsContact O-CG1 3.23Å; G157-I161 WeakPolarHBondContact O-CG1 3.3Å; G157-I161 PolarHBondContact O-N 3.25Å
158	S	76.7	Confident	66.4	Low	16 Å²	16	88.6 Å²	88.6	11%	0.112	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.4	-179.2	-62.4	0	0	0	0	114	D156 E160	D156-S158 VanDerWaalsContact C-N 3.32Å; D156-S158 WeakPolarHBondContact OD1-CB 3.25Å; D156-S158 PolarHBondContact OD1-N 3.13Å; D156-S158 PolarHBondContact OD1-OG 3.46Å; D156-S158 WeakPolarHBondContact OD2-CB 3.44Å; D156-S158 PolarHBondContact OD2-OG 2.94Å; S158-E160 PolarHBondContact O-N 2.96Å
159	D	74.3	Confident	65.9	Low	1 Å²	1	87.1 Å²	87.1	1%	0.005	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.8	173.3	57.4	-43.4	0	0	0	114.4	I142 C148 Y151 D153 C154 G157 C163	I142-D159 HydrophobicContact CD1-CB 3.48Å; I142-D159 VanDerWaalsContact CD1-CB 3.48Å; C148-D159 PolarHBondContact N-O 2.75Å; Y151-D159 VanDerWaalsContact O-OD2 3.11Å; D153-D159 VanDerWaalsContact CA-OD2 3.31Å; D153-D159 WeakPolarHBondContact CA-OD2 3.13Å; D153-D159 VanDerWaalsContact CB-OD2 3.26Å; D153-D159 WeakPolarHBondContact CB-OD2 3.44Å; D153-D159 PolarHBondContact N-OD2 3.19Å; C154-D159 HydrophobicContact CB-CB 4.21Å; C154-D159 VanDerWaalsContact CB-OD1 3.27Å; C154-D159 WeakPolarHBondContact CB-OD1 3.33Å; C154-D159 PolarHBondContact N-OD1 3.49Å; C154-D159 PolarHBondContact N-OD2 2.8Å; C154-D159 VanDerWaalsContact SG-CB 3.51Å; G157-D159 VanDerWaalsContact C-OD1 3.27Å; G157-D159 WeakPolarHBondContact CA-OD1 3.06Å; G157-D159 PolarHBondContact O-N 3.32Å; D159-C163 PolarHBondContact O-SG 2.86Å
160	E	76.8	Confident	65.3	Low	58 Å²	58	90 Å²	90	27%	0.271	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-4.2	-179.8	-67.9	-62.5	139.4	0	0	112.8	C148 N149 G150 Y151 G157 S158	C148-E160 VanDerWaalsContact C-OE1 3.3Å; C148-E160 VanDerWaalsContact CA-OE1 3.23Å; C148-E160 WeakPolarHBondContact CA-OE1 3.35Å; C148-E160 PolarHBondContact N-OE1 2.75Å; N149-E160 PolarHBondContact N-OE1 3.12Å; N149-E160 PolarHBondContact OD1-OE1 2.9Å; G150-E160 VanDerWaalsContact CA-OE2 3.3Å; G150-E160 WeakPolarHBondContact CA-OE2 3.4Å; G150-E160 VanDerWaalsContact N-CD 3.3Å; G150-E160 PolarHBondContact N-OE1 3.36Å; G150-E160 PolarHBondContact N-OE2 2.8Å; G150-E160 VanDerWaalsContact N-OE2 3.17Å; Y151-E160 VanDerWaalsContact O-CG 3.28Å; Y151-E160 WeakPolarHBondContact O-CG 3.25Å; G157-E160 PolarHBondContact O-N 2.74Å; G157-E160 VanDerWaalsContact O-N 3.13Å; S158-E160 PolarHBondContact O-N 2.96Å
161	I	68.1	Low	65	Low	119 Å²	119	88.6 Å²	88.6	61%	0.61	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	126.4	179.5	-60.2	163	0	0	0	108.3	G157	G157-I161 WeakPolarHBondContact O-CD1 3.22Å; G157-I161 VanDerWaalsContact O-CG1 3.23Å; G157-I161 WeakPolarHBondContact O-CG1 3.3Å; G157-I161 PolarHBondContact O-N 3.25Å
162	N	60.5	Low	64.5	Low	154 Å²	154	86.5 Å²	86.5	82%	0.824	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	25.7	-177.3	-148.3	13.3	0	0	0	115.7	K164	N162-K164 PolarHBondContact O-N 2.93Å
163	C	64.9	Low	64.2	Low	32 Å²	32	84.7 Å²	84.7	22%	0.216	46%	0.458	C	S	.	.			trans	-68.6	108.4	166.7	-63.9	0	0	0	0	110.5	C148 D159 N165	C148-C163 WeakPolarHBondContact CA-SG 3.44Å; C148-C163 HydrophobicContact CB-CB 3.55Å; C148-C163 WeakPolarHBondContact CB-SG 3.29Å; C148-C163 WeakPolarHBondContact SG-CA 3.44Å; C148-C163 WeakPolarHBondContact SG-CB 3.43Å; C148-C163 CovalentContact SG-SG 2.01Å; C148-C163 PolarHBondContact SG-SG 3.3Å; D159-C163 PolarHBondContact O-SG 2.86Å; C163-N165 PolarHBondContact O-N 2.8Å
164	K	60.2	Low	64.1	Low	179 Å²	179	87.6 Å²	87.6	78%	0.778	47%	0.468	S	S	*	.			trans	-66.3	88.6	166.5	-75.8	-177.6	179.8	176.5	0	108.2	N162 L166	N162-K164 PolarHBondContact O-N 2.93Å; K164-L166 VanDerWaalsContact C-N 3.29Å; K164-L166 HydrophobicContact CB-CD1 4.5Å; K164-L166 PolarHBondContact O-N 3.24Å
165	N	49.8	Very low	64.2	Low	112 Å²	112	89.5 Å²	89.5	60%	0.599	48%	0.476	S	S	*	.			trans	-61.3	89.4	172.9	-131.4	-26.7	0	0	0	108.5	C163 T167	C163-N165 PolarHBondContact O-N 2.8Å; N165-T167 VanDerWaalsContact C-N 3.29Å; N165-T167 PolarHBondContact O-N 2.83Å
166	L	49.6	Very low	64.7	Low	147 Å²	147	89.3 Å²	89.3	77%	0.77	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	6.5	-175.4	-98.6	155.9	0	0	0	113.5	K164	K164-L166 VanDerWaalsContact C-N 3.29Å; K164-L166 HydrophobicContact CB-CD1 4.5Å; K164-L166 PolarHBondContact O-N 3.24Å
167	T	49.2	Very low	65	Low	131 Å²	131	86.9 Å²	86.9	80%	0.804	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.4	39.9	179.4	39.4	0	0	0	0	113.4	N165	N165-T167 VanDerWaalsContact C-N 3.29Å; N165-T167 PolarHBondContact O-N 2.83Å
168	Q	50.5	Low	65.5	Low	108 Å²	108	97 Å²	97	51%	0.505	49%	0.492	S	S	.	.			trans	-125.8	118.3	152.2	-94.5	178.4	-0.4	0	0	107	N170	Q168-N170 HydrophobicContact CB-CB 4.12Å; Q168-N170 PolarHBondContact O-N 2.87Å; Q168-N170 PolarHBondContact OE1-ND2 3.29Å
169	C	58	Low	65.5	Low	27 Å²	27	98.4 Å²	98.4	18%	0.182	50%	0.502	C	S	.	.			trans	-69.9	46.8	168.8	-43.9	0	0	0	0	110.1	G171 K176 C182	C169-G171 PolarHBondContact O-N 2.87Å; C169-K176 HydrophobicContact CB-CB 4.25Å; C169-C182 HydrophobicContact CB-CB 4Å; C169-C182 WeakPolarHBondContact CB-SG 3.29Å; C169-C182 WeakPolarHBondContact SG-CB 3.42Å; C169-C182 CovalentContact SG-SG 2.03Å; C169-C182 PolarHBondContact SG-SG 2.72Å
170	N	58.1	Low	65.4	Low	126 Å²	126	100.5 Å²	100.5	67%	0.674	52%	0.524	S	S	*	.			trans	-97.6	86.9	-175.9	-71.2	-6.6	0	0	0	108.1	Q168	Q168-N170 HydrophobicContact CB-CB 4.12Å; Q168-N170 PolarHBondContact O-N 2.87Å; Q168-N170 PolarHBondContact OE1-ND2 3.29Å
171	G	58.9	Low	65.5	Low	31 Å²	31	103.4 Å²	103.4	32%	0.32	54%	0.538	S	S	.	.	S	Bend	trans	-165.6	146	170.3	0	0	0	0	0	110.1	C169 E173 K174	C169-G171 PolarHBondContact O-N 2.87Å; G171-E173 PolarHBondContact O-N 3.43Å; G171-K174 PolarHBondContact O-N 2.86Å; G171-K174 VanDerWaalsContact O-N 3.13Å
172	P	59.4	Low	66	Low	129 Å²	129	100.4 Å²	100.4	84%	0.838	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.6	-179.8	25.2	-33.7	0	0	0	113.5
173	E	68.4	Low	66.9	Low	153 Å²	153	94.1 Å²	94.1	72%	0.715	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	8	-178.4	-59.6	-174.5	160.6	0	0	113.7	G171 E184 M185	G171-E173 PolarHBondContact O-N 3.43Å; E173-E184 CarbonylContact O-C 3.57Å; E173-E184 WeakPolarHBondContact O-CA 3.28Å; E173-M185 PolarHBondContact O-N 2.83Å
174	K	76.3	Confident	67.6	Low	113 Å²	113	98 Å²	98	49%	0.491	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.6	-179.8	-65	-172.6	179.9	-178.1	0	111.3	G171 I183	G171-K174 PolarHBondContact O-N 2.86Å; G171-K174 VanDerWaalsContact O-N 3.13Å; K174-I183 CarbonylContact C-O 3.5Å; K174-I183 WeakPolarHBondContact CA-O 3.36Å
175	F	76.9	Confident	68.2	Low	43 Å²	43	92.8 Å²	92.8	19%	0.189	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.5	176.2	177.2	-96.6	0	0	0	110.2	C182 I183 M185 V188 I227	F175-C182 CarbonylContact O-C 3.52Å; F175-C182 WeakPolarHBondContact O-CA 3.19Å; F175-I183 HydrophobicContact CB-CG1 4.09Å; F175-I183 HydrophobicContact CD1-CD1 3.98Å; F175-I183 HydrophobicContact CD1-CG1 3.85Å; F175-I183 HydrophobicContact CG-CG1 4.46Å; F175-I183 PolarHBondContact N-O 2.82Å; F175-I183 PolarHBondContact O-N 3.11Å; F175-M185 HydrophobicContact CB-CE 4.3Å; F175-M185 HydrophobicContact CB-SD 4.26Å; F175-V188 HydrophobicContact CB-CG2 3.4Å; F175-V188 VanDerWaalsContact CB-CG2 3.4Å; F175-V188 HydrophobicContact CD1-CG2 3.77Å; F175-V188 HydrophobicContact CD2-CG1 4.43Å; F175-V188 HydrophobicContact CD2-CG2 3.95Å; F175-V188 HydrophobicContact CE1-CG2 4.5Å; F175-V188 HydrophobicContact CE2-CG1 4.46Å; F175-V188 HydrophobicContact CG-CG2 3.44Å; F175-V188 VanDerWaalsContact CG-CG2 3.44Å; F175-I227 HydrophobicContact CE2-CD1 4.05Å; F175-I227 HydrophobicContact CZ-CD1 3.82Å
176	K	80.3	Confident	69.6	Low	138 Å²	138	91.6 Å²	91.6	60%	0.6	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	113	178.9	-173.1	178.4	-179.7	-178.4	0	109.9	C169	C169-K176 HydrophobicContact CB-CB 4.25Å
177	C	79.7	Confident	71.1	Confident	2 Å²	2	88.7 Å²	88.7	1%	0.014	47%	0.468	C	S	.	.			trans	-58.8	148.1	169.9	-59	0	0	0	0	110.4	S179 G180 E181 C195	C177-S179 VanDerWaalsContact CB-OG 3.31Å; C177-S179 WeakPolarHBondContact CB-OG 3.38Å; C177-S179 PolarHBondContact O-N 3.34Å; C177-G180 PolarHBondContact O-N 3.43Å; C177-E181 HydrophobicContact CB-CB 4.19Å; C177-E181 VanDerWaalsContact CB-O 3.29Å; C177-E181 WeakPolarHBondContact CB-O 3.23Å; C177-E181 PolarHBondContact N-O 3.32Å; C177-E181 PolarHBondContact SG-O 2.72Å; C177-C195 HydrophobicContact CB-CB 3.78Å; C177-C195 WeakPolarHBondContact CB-SG 3.49Å; C177-C195 WeakPolarHBondContact SG-CB 3.32Å; C177-C195 CovalentContact SG-SG 2.02Å; C177-C195 PolarHBondContact SG-SG 3.01Å
178	R	80	Confident	72.7	Confident	219 Å²	219	82.9 Å²	82.9	83%	0.826	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.6	172.2	-167	-179.5	-68.5	-179.3	-0.8	112.4	G180 S199	R178-G180 PolarHBondContact O-N 2.85Å; R178-S199 WeakPolarHBondContact CB-OG 3.37Å
179	S	75.6	Confident	74	Confident	45 Å²	45	78.3 Å²	78.3	32%	0.315	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.5	174	61.6	0	0	0	0	114.3	C177 D197	C177-S179 VanDerWaalsContact CB-OG 3.31Å; C177-S179 WeakPolarHBondContact CB-OG 3.38Å; C177-S179 PolarHBondContact O-N 3.34Å; S179-D197 VanDerWaalsContact CA-OD2 3.28Å; S179-D197 WeakPolarHBondContact CA-OD2 3.47Å; S179-D197 WeakPolarHBondContact CB-OD2 3.41Å; S179-D197 PolarHBondContact N-OD2 2.96Å
180	G	72.8	Confident	75.1	Confident	45 Å²	45	79.7 Å²	79.7	46%	0.464	42%	0.418	S	S	.	.	S	Bend	trans	102.5	-9.9	179.2	0	0	0	0	0	115.9	C177 R178	C177-G180 PolarHBondContact O-N 3.43Å; R178-G180 PolarHBondContact O-N 2.85Å
181	E	78.1	Confident	76.1	Confident	119 Å²	119	83 Å²	83	56%	0.556	43%	0.426	S	S	*	.			trans	-75.8	148.1	177.3	-66.5	-63.2	152.8	0	0	112.2	C177 P196	C177-E181 HydrophobicContact CB-CB 4.19Å; C177-E181 VanDerWaalsContact CB-O 3.29Å; C177-E181 WeakPolarHBondContact CB-O 3.23Å; C177-E181 PolarHBondContact N-O 3.32Å; C177-E181 PolarHBondContact SG-O 2.72Å; E181-P196 HydrophobicContact CG-CG 4.42Å
182	C	79.1	Confident	77.2	Confident	55 Å²	55	86.2 Å²	86.2	37%	0.372	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123	172.1	-46	0	0	0	0	110.2	C169 F175	C169-C182 HydrophobicContact CB-CB 4Å; C169-C182 WeakPolarHBondContact CB-SG 3.29Å; C169-C182 WeakPolarHBondContact SG-CB 3.42Å; C169-C182 CovalentContact SG-SG 2.03Å; C169-C182 PolarHBondContact SG-SG 2.72Å; F175-C182 CarbonylContact O-C 3.52Å; F175-C182 WeakPolarHBondContact O-CA 3.19Å
183	I	80.3	Confident	78.2	Confident	23 Å²	23	87.3 Å²	87.3	12%	0.118	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	166	171.7	61.7	168.3	0	0	0	110.6	K174 F175 K187 V188 D194 D200	K174-I183 CarbonylContact C-O 3.5Å; K174-I183 WeakPolarHBondContact CA-O 3.36Å; F175-I183 HydrophobicContact CB-CG1 4.09Å; F175-I183 HydrophobicContact CD1-CD1 3.98Å; F175-I183 HydrophobicContact CD1-CG1 3.85Å; F175-I183 HydrophobicContact CG-CG1 4.46Å; F175-I183 PolarHBondContact N-O 2.82Å; F175-I183 PolarHBondContact O-N 3.11Å; I183-K187 HydrophobicContact CD1-CB 4.49Å; I183-V188 HydrophobicContact CD1-CG2 4.11Å; I183-V188 HydrophobicContact CG1-CG2 4.48Å; I183-D194 HydrophobicContact CD1-CB 4.07Å; I183-D194 HydrophobicContact CG2-CB 4.41Å; I183-D200 HydrophobicContact CD1-CB 3.74Å
184	E	78.1	Confident	78.9	Confident	112 Å²	112	82.7 Å²	82.7	52%	0.523	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.3	173.5	-71.9	-177.1	172.3	0	0	110.9	E173 S186 K187	E173-E184 CarbonylContact O-C 3.57Å; E173-E184 WeakPolarHBondContact O-CA 3.28Å; E184-S186 WeakPolarHBondContact CB-OG 3.35Å; E184-S186 PolarHBondContact O-N 2.85Å; E184-S186 PolarHBondContact OE2-OG 2.86Å; E184-K187 HydrophobicContact CB-CD 4.5Å; E184-K187 HydrophobicContact CB-CG 4.36Å; E184-K187 WeakPolarHBondContact O-CB 3.38Å; E184-K187 PolarHBondContact O-N 3.05Å
185	M	74.4	Confident	79.1	Confident	70 Å²	70	77.4 Å²	77.4	35%	0.345	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-59.4	-28.8	178.6	-166.6	65.2	73.2	0	0	112.4	E173 F175 K187 V188	E173-M185 PolarHBondContact O-N 2.83Å; F175-M185 HydrophobicContact CB-CE 4.3Å; F175-M185 HydrophobicContact CB-SD 4.26Å; M185-K187 PolarHBondContact O-N 2.94Å; M185-V188 WeakPolarHBondContact O-CB 3.47Å; M185-V188 PolarHBondContact O-N 2.66Å; M185-V188 HydrophobicContact SD-CB 4.47Å; M185-V188 HydrophobicContact SD-CG2 4.01Å
186	S	78.9	Confident	79.3	Confident	88 Å²	88	79.1 Å²	79.1	62%	0.615	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-63.7	-19.2	174.1	59.5	0	0	0	0	114	E184	E184-S186 WeakPolarHBondContact CB-OG 3.35Å; E184-S186 PolarHBondContact O-N 2.85Å; E184-S186 PolarHBondContact OE2-OG 2.86Å
187	K	80.6	Confident	79.2	Confident	86 Å²	86	77 Å²	77	37%	0.374	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-99	-3.4	179.9	-61.4	-176.3	-176.6	-179.1	0	113	I183 E184 M185 N190 D194	I183-K187 HydrophobicContact CD1-CB 4.49Å; E184-K187 HydrophobicContact CB-CD 4.5Å; E184-K187 HydrophobicContact CB-CG 4.36Å; E184-K187 WeakPolarHBondContact O-CB 3.38Å; E184-K187 PolarHBondContact O-N 3.05Å; M185-K187 PolarHBondContact O-N 2.94Å; K187-N190 WeakPolarHBondContact CA-ND2 3.47Å; K187-N190 VanDerWaalsContact O-CG 3.26Å; K187-N190 PolarHBondContact O-ND2 2.69Å; K187-N190 PolarHBondContact O-OD1 3.04Å; K187-D194 HydrophobicContact CB-CB 4.34Å
188	V	82	Confident	79	Confident	8 Å²	8	83.6 Å²	83.6	5%	0.048	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	131.7	174.4	-174.7	0	0	0	0	108.2	F175 I183 M185 N190 V226 I227	F175-V188 HydrophobicContact CB-CG2 3.4Å; F175-V188 VanDerWaalsContact CB-CG2 3.4Å; F175-V188 HydrophobicContact CD1-CG2 3.77Å; F175-V188 HydrophobicContact CD2-CG1 4.43Å; F175-V188 HydrophobicContact CD2-CG2 3.95Å; F175-V188 HydrophobicContact CE1-CG2 4.5Å; F175-V188 HydrophobicContact CE2-CG1 4.46Å; F175-V188 HydrophobicContact CG-CG2 3.44Å; F175-V188 VanDerWaalsContact CG-CG2 3.44Å; I183-V188 HydrophobicContact CD1-CG2 4.11Å; I183-V188 HydrophobicContact CG1-CG2 4.48Å; M185-V188 WeakPolarHBondContact O-CB 3.47Å; M185-V188 PolarHBondContact O-N 2.66Å; M185-V188 HydrophobicContact SD-CB 4.47Å; M185-V188 HydrophobicContact SD-CG2 4.01Å; V188-N190 PolarHBondContact O-N 2.99Å; V188-V226 HydrophobicContact CB-CG1 4.07Å; V188-V226 HydrophobicContact CG1-CB 4.39Å; V188-V226 HydrophobicContact CG1-CG1 3.82Å; V188-I227 HydrophobicContact CG1-CD1 3.32Å; V188-I227 HydrophobicContact CG1-CG1 3.71Å
189	C	78.1	Confident	79	Confident	13 Å²	13	74.2 Å²	74.2	9%	0.088	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	37.4	177.9	-158.3	0	0	0	0	115.6	D200 C206 N207 V226	C189-D200 PolarHBondContact N-O 3.42Å; C189-C206 WeakPolarHBondContact CA-SG 3.4Å; C189-C206 HydrophobicContact CB-CB 4.22Å; C189-C206 WeakPolarHBondContact CB-SG 3.13Å; C189-C206 WeakPolarHBondContact SG-CA 3.48Å; C189-C206 WeakPolarHBondContact SG-CB 3.31Å; C189-C206 CovalentContact SG-SG 1.99Å; C189-C206 PolarHBondContact SG-SG 3.1Å; C189-N207 PolarHBondContact O-ND2 2.8Å; C189-N207 PolarHBondContact SG-N 2.98Å; C189-N207 PolarHBondContact SG-ND2 3Å; C189-V226 HydrophobicContact CB-CG1 3.67Å
190	N	82.3	Confident	79.2	Confident	55 Å²	55	72 Å²	72	29%	0.294	37%	0.368	S	S	.	.	S	Bend	trans	-97.6	7.6	-177.7	67.5	-2.1	0	0	0	114.2	K187 V188 I192 D194 E201	K187-N190 WeakPolarHBondContact CA-ND2 3.47Å; K187-N190 VanDerWaalsContact O-CG 3.26Å; K187-N190 PolarHBondContact O-ND2 2.69Å; K187-N190 PolarHBondContact O-OD1 3.04Å; V188-N190 PolarHBondContact O-N 2.99Å; N190-I192 VanDerWaalsContact C-N 3.28Å; N190-I192 WeakPolarHBondContact OD1-CA 3.24Å; N190-I192 VanDerWaalsContact OD1-CB 3.29Å; N190-I192 WeakPolarHBondContact OD1-CB 3.38Å; N190-I192 PolarHBondContact OD1-N 2.87Å; N190-I192 PolarHBondContact OD1-O 3.15Å; N190-I192 VanDerWaalsContact OD1-O 3.05Å; N190-D194 PolarHBondContact ND2-OD2 2.99Å; N190-E201 PolarHBondContact N-OE1 3.37Å; N190-E201 PolarHBondContact OD1-OE1 3.39Å
191	K	77.6	Confident	79.7	Confident	195 Å²	195	71 Å²	71	85%	0.848	35%	0.351	S	S	*	.	S	Bend	trans	66.7	20.8	-171.3	-53	177.1	-178	176.2	0	114.4	E201	K191-E201 WeakPolarHBondContact CA-OE1 3.32Å; K191-E201 WeakPolarHBondContact CA-OE2 3.34Å; K191-E201 PolarHBondContact N-OE1 3.36Å
192	I	81.6	Confident	79.8	Confident	100 Å²	100	67 Å²	67	51%	0.513	34%	0.336	S	S	.	.	S	Bend	trans	-126.9	134.1	178.8	-52.7	175.7	0	0	0	108.5	N190 D194 E201	N190-I192 VanDerWaalsContact C-N 3.28Å; N190-I192 WeakPolarHBondContact OD1-CA 3.24Å; N190-I192 VanDerWaalsContact OD1-CB 3.29Å; N190-I192 WeakPolarHBondContact OD1-CB 3.38Å; N190-I192 PolarHBondContact OD1-N 2.87Å; N190-I192 PolarHBondContact OD1-O 3.15Å; N190-I192 VanDerWaalsContact OD1-O 3.05Å; I192-D194 PolarHBondContact O-N 3.02Å; I192-E201 VanDerWaalsContact C-CD 3.43Å; I192-E201 PolarHBondContact N-OE1 3.25Å; I192-E201 PolarHBondContact N-OE2 2.79Å; I192-E201 VanDerWaalsContact N-OE2 3.1Å
193	R	81.2	Confident	79.4	Confident	152 Å²	152	72.1 Å²	72.1	57%	0.574	36%	0.358	S	S	*	.			trans	-75.4	95.3	173.5	-174.3	-169.5	70.1	178.5	-2.6	110.6	C195 W198	R193-C195 WeakPolarHBondContact CG-O 3.38Å; R193-W198 HydrophobicContact CB-CZ2 4.44Å; R193-W198 VanDerWaalsContact CD-NE1 3.27Å; R193-W198 HydrophobicContact CG-CD2 4.24Å; R193-W198 HydrophobicContact CG-CG 4.28Å
194	D	82.6	Confident	79	Confident	56 Å²	56	77.3 Å²	77.3	30%	0.299	39%	0.386	S	S	.	.			trans	-93.9	-28.5	172.3	-74.5	-68.7	0	0	0	111.8	I183 K187 N190 I192 D200	I183-D194 HydrophobicContact CD1-CB 4.07Å; I183-D194 HydrophobicContact CG2-CB 4.41Å; K187-D194 HydrophobicContact CB-CB 4.34Å; N190-D194 PolarHBondContact ND2-OD2 2.99Å; I192-D194 PolarHBondContact O-N 3.02Å; D194-D200 VanDerWaalsContact CA-OD2 3.31Å; D194-D200 WeakPolarHBondContact CA-OD2 3.49Å; D194-D200 WeakPolarHBondContact CB-OD2 3.12Å; D194-D200 PolarHBondContact N-OD2 3.44Å
195	C	81.1	Confident	78.7	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.014	39%	0.385	C	S	.	.	S	Bend	trans	-91.7	138.5	169	-67.4	0	0	0	0	112.5	C177 R193 D197 W198 D200	C177-C195 HydrophobicContact CB-CB 3.78Å; C177-C195 WeakPolarHBondContact CB-SG 3.49Å; C177-C195 WeakPolarHBondContact SG-CB 3.32Å; C177-C195 CovalentContact SG-SG 2.02Å; C177-C195 PolarHBondContact SG-SG 3.01Å; R193-C195 WeakPolarHBondContact CG-O 3.38Å; C195-D197 PolarHBondContact O-N 2.79Å; C195-W198 PolarHBondContact O-N 2.9Å; C195-D200 HydrophobicContact CB-CB 4.1Å; C195-D200 VanDerWaalsContact CB-OD1 3.32Å; C195-D200 WeakPolarHBondContact CB-OD1 3.43Å; C195-D200 VanDerWaalsContact N-CG 3.32Å; C195-D200 PolarHBondContact N-OD1 3.11Å; C195-D200 PolarHBondContact N-OD2 3.08Å
196	P	81.1	Confident	79	Confident	78 Å²	78	75.2 Å²	75.2	51%	0.506	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.6	175.7	-23.7	31	0	0	0	114.1	E181	E181-P196 HydrophobicContact CG-CG 4.42Å
197	D	78.8	Confident	79	Confident	95 Å²	95	76.4 Å²	76.4	51%	0.508	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	14.4	-175.7	-76.8	-16.8	0	0	0	114	S179 C195 S199	S179-D197 VanDerWaalsContact CA-OD2 3.28Å; S179-D197 WeakPolarHBondContact CA-OD2 3.47Å; S179-D197 WeakPolarHBondContact CB-OD2 3.41Å; S179-D197 PolarHBondContact N-OD2 2.96Å; C195-D197 PolarHBondContact O-N 2.79Å; D197-S199 PolarHBondContact O-N 2.96Å; D197-S199 PolarHBondContact O-OG 3.13Å
198	W	76.1	Confident	79.1	Confident	140 Å²	140	75.3 Å²	75.3	53%	0.53	38%	0.378	S	S	.	.	S	Bend	trans	56.2	17.7	-176	-76	80.6	0	0	0	114.6	R193 C195 D200 E201	R193-W198 HydrophobicContact CB-CZ2 4.44Å; R193-W198 VanDerWaalsContact CD-NE1 3.27Å; R193-W198 HydrophobicContact CG-CD2 4.24Å; R193-W198 HydrophobicContact CG-CG 4.28Å; C195-W198 PolarHBondContact O-N 2.9Å; W198-D200 WeakPolarHBondContact CA-OD1 3.49Å; W198-D200 PolarHBondContact O-N 2.97Å; W198-E201 HydrophobicContact CE3-CB 4.18Å; W198-E201 PolarHBondContact O-N 2.99Å; W198-E201 VanDerWaalsContact O-N 3.13Å
199	S	79.9	Confident	79.1	Confident	21 Å²	21	77.9 Å²	77.9	15%	0.147	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-12.4	-174.7	-58.7	0	0	0	0	113.5	R178 D197	R178-S199 WeakPolarHBondContact CB-OG 3.37Å; D197-S199 PolarHBondContact O-N 2.96Å; D197-S199 PolarHBondContact O-OG 3.13Å
200	D	79.7	Confident	79.4	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.7	170.9	53.3	-30.3	0	0	0	113.8	I183 C189 D194 C195 W198	I183-D200 HydrophobicContact CD1-CB 3.74Å; C189-D200 PolarHBondContact N-O 3.42Å; D194-D200 VanDerWaalsContact CA-OD2 3.31Å; D194-D200 WeakPolarHBondContact CA-OD2 3.49Å; D194-D200 WeakPolarHBondContact CB-OD2 3.12Å; D194-D200 PolarHBondContact N-OD2 3.44Å; C195-D200 HydrophobicContact CB-CB 4.1Å; C195-D200 VanDerWaalsContact CB-OD1 3.32Å; C195-D200 WeakPolarHBondContact CB-OD1 3.43Å; C195-D200 VanDerWaalsContact N-CG 3.32Å; C195-D200 PolarHBondContact N-OD1 3.11Å; C195-D200 PolarHBondContact N-OD2 3.08Å; W198-D200 WeakPolarHBondContact CA-OD1 3.49Å; W198-D200 PolarHBondContact O-N 2.97Å
201	E	83.2	Confident	79.6	Confident	22 Å²	22	77.3 Å²	77.3	10%	0.103	39%	0.388	C	S	.	.			trans	-135.4	58.4	-172.1	-47.8	-141.2	113.4	0	0	114	N190 K191 I192 W198 I203	N190-E201 PolarHBondContact N-OE1 3.37Å; N190-E201 PolarHBondContact OD1-OE1 3.39Å; K191-E201 WeakPolarHBondContact CA-OE1 3.32Å; K191-E201 WeakPolarHBondContact CA-OE2 3.34Å; K191-E201 PolarHBondContact N-OE1 3.36Å; I192-E201 VanDerWaalsContact C-CD 3.43Å; I192-E201 PolarHBondContact N-OE1 3.25Å; I192-E201 PolarHBondContact N-OE2 2.79Å; I192-E201 VanDerWaalsContact N-OE2 3.1Å; W198-E201 HydrophobicContact CE3-CB 4.18Å; W198-E201 PolarHBondContact O-N 2.99Å; W198-E201 VanDerWaalsContact O-N 3.13Å; E201-I203 PolarHBondContact O-N 2.77Å
202	P	78.7	Confident	80	Confident	35 Å²	35	74.8 Å²	74.8	23%	0.227	38%	0.383	C	S	.	.			trans	-67	124.8	177.4	26.2	-31.2	0	0	0	111.4	N204 E205 C206 I227	P202-N204 PolarHBondContact O-N 2.72Å; P202-E205 HydrophobicContact CB-CB 4.38Å; P202-E205 HydrophobicContact CG-CB 4.21Å; P202-E205 PolarHBondContact O-N 2.81Å; P202-C206 HydrophobicContact CG-CB 4.16Å; P202-C206 WeakPolarHBondContact O-CB 3.25Å; P202-C206 PolarHBondContact O-N 2.86Å; P202-I227 HydrophobicContact CG-CD1 4.07Å; P202-I227 HydrophobicContact CG-CG1 4.12Å; P202-I227 HydrophobicContact CG-CG2 3.71Å
203	I	71.8	Confident	80.1	Confident	164 Å²	164	76.8 Å²	76.8	84%	0.841	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30	-170.7	-65	165.5	0	0	0	114.3	E201	E201-I203 PolarHBondContact O-N 2.77Å
204	N	70.9	Confident	80.2	Confident	132 Å²	132	76.6 Å²	76.6	71%	0.706	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-6.6	-171.9	-71.3	-13.8	0	0	0	115.3	P202	P202-N204 PolarHBondContact O-N 2.72Å
205	E	72.8	Confident	80.3	Confident	109 Å²	109	76.6 Å²	76.6	51%	0.509	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	7.2	-169.6	-63.5	-179.6	-174.5	0	0	112.6	P202 I227 G228	P202-E205 HydrophobicContact CB-CB 4.38Å; P202-E205 HydrophobicContact CG-CB 4.21Å; P202-E205 PolarHBondContact O-N 2.81Å; E205-I227 HydrophobicContact CB-CG2 4.48Å; E205-I227 WeakPolarHBondContact O-CA 3.2Å; E205-G228 PolarHBondContact O-N 2.81Å; E205-G228 VanDerWaalsContact O-N 3.11Å
206	C	81.1	Confident	80.3	Confident	28 Å²	28	77 Å²	77	19%	0.189	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-102.6	118.4	-169.3	-175.5	0	0	0	0	109.2	C189 P202 V208	C189-C206 WeakPolarHBondContact CA-SG 3.4Å; C189-C206 HydrophobicContact CB-CB 4.22Å; C189-C206 WeakPolarHBondContact CB-SG 3.13Å; C189-C206 WeakPolarHBondContact SG-CA 3.48Å; C189-C206 WeakPolarHBondContact SG-CB 3.31Å; C189-C206 CovalentContact SG-SG 1.99Å; C189-C206 PolarHBondContact SG-SG 3.1Å; P202-C206 HydrophobicContact CG-CB 4.16Å; P202-C206 WeakPolarHBondContact O-CB 3.25Å; P202-C206 PolarHBondContact O-N 2.86Å; C206-V208 PolarHBondContact O-N 2.95Å
207	N	78.8	Confident	80.5	Confident	113 Å²	113	74.9 Å²	74.9	60%	0.604	40%	0.401	S	S	*	.	S	Bend	trans	53.3	29.5	-172.9	-70.4	-38.1	0	0	0	113.6	C189 V226	C189-N207 PolarHBondContact O-ND2 2.8Å; C189-N207 PolarHBondContact SG-N 2.98Å; C189-N207 PolarHBondContact SG-ND2 3Å; N207-V226 PolarHBondContact N-O 2.83Å
208	V	82.3	Confident	80.9	Confident	64 Å²	64	70.8 Å²	70.8	39%	0.388	38%	0.38	S	S	.	.			trans	-99.3	128	174.1	175.2	0	0	0	0	107.1	C206 E210	C206-V208 PolarHBondContact O-N 2.95Å; V208-E210 HydrophobicContact CG1-CG 4.37Å; V208-E210 VanDerWaalsContact O-CD 3.25Å; V208-E210 PolarHBondContact O-N 2.92Å
209	N	81.3	Confident	81.3	Confident	61 Å²	61	66.8 Å²	66.8	33%	0.326	37%	0.373	S	S	.	.			trans	-88.6	94.3	175.7	-170.1	-52.8	0	0	0	110.4	C211 L212 D224	N209-C211 PolarHBondContact O-N 2.91Å; N209-C211 WeakPolarHBondContact OD1-CA 3.02Å; N209-C211 VanDerWaalsContact OD1-CB 3.28Å; N209-C211 WeakPolarHBondContact OD1-CB 3.05Å; N209-C211 PolarHBondContact OD1-N 2.86Å; N209-C211 VanDerWaalsContact OD1-N 3.09Å; N209-L212 HydrophobicContact CB-CD1 4.05Å; N209-L212 HydrophobicContact CB-CG 4.15Å; N209-L212 PolarHBondContact O-N 3.17Å; N209-L212 WeakPolarHBondContact OD1-CG 3.32Å; N209-L212 PolarHBondContact OD1-N 3.06Å; N209-L212 VanDerWaalsContact OD1-N 3.14Å; N209-D224 WeakPolarHBondContact CA-OD1 3.32Å; N209-D224 WeakPolarHBondContact CB-OD2 3.03Å; N209-D224 VanDerWaalsContact CG-OD2 3.28Å; N209-D224 VanDerWaalsContact ND2-CG 3.31Å; N209-D224 PolarHBondContact ND2-OD2 2.85Å
210	E	85.7	Confident	81.5	Confident	35 Å²	35	69.5 Å²	69.5	16%	0.164	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-71.1	-19.9	178.4	-61.7	84	-174.4	0	0	112.7	V208 L212 L213 G216 G228 F229	V208-E210 HydrophobicContact CG1-CG 4.37Å; V208-E210 VanDerWaalsContact O-CD 3.25Å; V208-E210 PolarHBondContact O-N 2.92Å; E210-L212 PolarHBondContact O-N 2.82Å; E210-L213 PolarHBondContact O-N 3Å; E210-G216 PolarHBondContact O-N 3.43Å; E210-G228 VanDerWaalsContact OE2-C 3.31Å; E210-F229 HydrophobicContact CB-CB 4.31Å; E210-F229 HydrophobicContact CB-CD1 3.44Å; E210-F229 VanDerWaalsContact CB-CD1 3.44Å; E210-F229 HydrophobicContact CB-CE1 4Å; E210-F229 HydrophobicContact CB-CG 4.02Å; E210-F229 HydrophobicContact CG-CD1 3.81Å; E210-F229 HydrophobicContact CG-CE1 4.31Å
211	C	86.8	Confident	81.9	Confident	21 Å²	21	72.6 Å²	72.6	14%	0.142	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-66.3	-22.2	178.1	-57.6	0	0	0	0	113.4	N209 L213 N215 C222	N209-C211 PolarHBondContact O-N 2.91Å; N209-C211 WeakPolarHBondContact OD1-CA 3.02Å; N209-C211 VanDerWaalsContact OD1-CB 3.28Å; N209-C211 WeakPolarHBondContact OD1-CB 3.05Å; N209-C211 PolarHBondContact OD1-N 2.86Å; N209-C211 VanDerWaalsContact OD1-N 3.09Å; C211-L213 VanDerWaalsContact C-N 3.25Å; C211-L213 PolarHBondContact O-N 3.1Å; C211-N215 VanDerWaalsContact O-CA 3.28Å; C211-N215 WeakPolarHBondContact O-CA 3.41Å; C211-N215 PolarHBondContact O-N 3.03Å; C211-C222 WeakPolarHBondContact CA-SG 3.25Å; C211-C222 HydrophobicContact CB-CB 3.65Å; C211-C222 WeakPolarHBondContact CB-SG 3.33Å; C211-C222 WeakPolarHBondContact SG-CB 3.41Å; C211-C222 CovalentContact SG-SG 2.03Å; C211-C222 PolarHBondContact SG-SG 3.27Å
212	L	85.8	Confident	82.2	Confident	142 Å²	142	72.6 Å²	72.6	74%	0.743	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-68.2	-24	176.3	-66.8	176.6	0	0	0	113.2	N209 E210	N209-L212 HydrophobicContact CB-CD1 4.05Å; N209-L212 HydrophobicContact CB-CG 4.15Å; N209-L212 PolarHBondContact O-N 3.17Å; N209-L212 WeakPolarHBondContact OD1-CG 3.32Å; N209-L212 PolarHBondContact OD1-N 3.06Å; N209-L212 VanDerWaalsContact OD1-N 3.14Å; E210-L212 PolarHBondContact O-N 2.82Å
213	L	83.2	Confident	82.6	Confident	142 Å²	142	75.3 Å²	75.3	74%	0.743	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	107.2	-179.3	-73.2	169.6	0	0	0	110.1	E210 C211 N215 G216	E210-L213 PolarHBondContact O-N 3Å; C211-L213 VanDerWaalsContact C-N 3.25Å; C211-L213 PolarHBondContact O-N 3.1Å; L213-N215 PolarHBondContact O-N 2.92Å; L213-N215 VanDerWaalsContact O-N 3.1Å; L213-G216 PolarHBondContact O-N 2.59Å
214	N	84	Confident	83.2	Confident	148 Å²	148	71 Å²	71	79%	0.791	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	50.4	35.3	179.2	-165.8	40.1	0	0	0	113.5	G216 G217	N214-G216 PolarHBondContact O-N 3.38Å; N214-G217 WeakPolarHBondContact O-CA 3.36Å; N214-G217 PolarHBondContact O-N 3.37Å
215	N	83.4	Confident	83.7	Confident	57 Å²	57	68.7 Å²	68.7	31%	0.305	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	56.5	32.3	-177.8	-160.2	39.2	0	0	0	113.7	C211 L213 G217 C218 H220 C222	C211-N215 VanDerWaalsContact O-CA 3.28Å; C211-N215 WeakPolarHBondContact O-CA 3.41Å; C211-N215 PolarHBondContact O-N 3.03Å; L213-N215 PolarHBondContact O-N 2.92Å; L213-N215 VanDerWaalsContact O-N 3.1Å; N215-G217 PolarHBondContact O-N 3.15Å; N215-G217 VanDerWaalsContact O-N 3.07Å; N215-C218 PolarHBondContact ND2-O 3.28Å; N215-C218 WeakPolarHBondContact O-CB 3.4Å; N215-C218 PolarHBondContact O-N 2.94Å; N215-C218 PolarHBondContact O-SG 3.15Å; N215-H220 PolarHBondContact ND2-O 2.01Å; N215-C222 WeakPolarHBondContact O-CB 3.34Å; N215-C222 WeakPolarHBondContact OD1-CB 3.36Å
216	G	81.6	Confident	84.1	Confident	11 Å²	11	66 Å²	66	11%	0.113	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	65.8	7.3	-172.4	0	0	0	0	0	114.1	E210 L213 N214 C218 F229	E210-G216 PolarHBondContact O-N 3.43Å; L213-G216 PolarHBondContact O-N 2.59Å; N214-G216 PolarHBondContact O-N 3.38Å; G216-C218 VanDerWaalsContact C-N 3.28Å; G216-F229 WeakPolarHBondContact O-CE2 3.48Å; G216-F229 WeakPolarHBondContact O-CZ 3.48Å
217	G	84.6	Confident	84	Confident	33 Å²	33	66.5 Å²	66.5	34%	0.34	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	77.2	9.9	-166.1	0	0	0	0	0	114	N214 N215	N214-G217 WeakPolarHBondContact O-CA 3.36Å; N214-G217 PolarHBondContact O-N 3.37Å; N215-G217 PolarHBondContact O-N 3.15Å; N215-G217 VanDerWaalsContact O-N 3.07Å
218	C	87.4	Confident	84.2	Confident	9 Å²	9	61.7 Å²	61.7	6%	0.061	34%	0.342	C	S	.	.			trans	-75.6	140.8	174.5	-52.5	0	0	0	0	111.4	N215 G216 C222 C231 K243	N215-C218 PolarHBondContact ND2-O 3.28Å; N215-C218 WeakPolarHBondContact O-CB 3.4Å; N215-C218 PolarHBondContact O-N 2.94Å; N215-C218 PolarHBondContact O-SG 3.15Å; G216-C218 VanDerWaalsContact C-N 3.28Å; C218-C222 HydrophobicContact CB-CB 4.14Å; C218-C231 WeakPolarHBondContact CA-SG 3.38Å; C218-C231 HydrophobicContact CB-CB 3.61Å; C218-C231 WeakPolarHBondContact CB-SG 3.32Å; C218-C231 WeakPolarHBondContact SG-CA 3.41Å; C218-C231 WeakPolarHBondContact SG-CB 3.26Å; C218-C231 CovalentContact SG-SG 2.01Å; C218-C231 PolarHBondContact SG-SG 3.01Å; C218-K243 WeakPolarHBondContact CA-O 3.38Å
219	S	85.3	Confident	84.4	Confident	56 Å²	56	61.9 Å²	61.9	39%	0.392	34%	0.338	S	S	.	.	S	Bend	trans	-75.1	-30.8	-179.8	61.4	0	0	0	0	114.4	K243 C245	S219-K243 PolarHBondContact N-O 3.1Å; S219-K243 PolarHBondContact OG-O 3.47Å; S219-C245 WeakPolarHBondContact OG-CB 3.23Å; S219-C245 PolarHBondContact OG-N 3.15Å; S219-C245 PolarHBondContact OG-SG 3.13Å; S219-C245 VanDerWaalsContact OG-SG 3.35Å
220	H	84.3	Confident	84.7	Confident	78 Å²	78	63.7 Å²	63.7	36%	0.361	34%	0.344	S	S	.	.	S	Bend	trans	-126.2	-82.9	-179.1	-66	119.8	0	0	0	112	N215 C245	N215-H220 PolarHBondContact ND2-O 2.01Å; H220-C245 WeakPolarHBondContact ND1-CB 3.33Å; H220-C245 PolarHBondContact ND1-SG 3.42Å
221	I	87	Confident	84.9	Confident	64 Å²	64	62.3 Å²	62.3	33%	0.328	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.5	-173.3	-54.7	172.2	0	0	0	108.4	K223 C231 D232 T234	I221-K223 HydrophobicContact CG2-CG 4.3Å; I221-C231 CarbonylContact O-C 3.57Å; I221-C231 WeakPolarHBondContact O-CA 3.42Å; I221-D232 HydrophobicContact CB-CB 4.08Å; I221-D232 WeakPolarHBondContact CB-O 3.44Å; I221-D232 HydrophobicContact CG2-CB 4.26Å; I221-D232 PolarHBondContact N-O 2.82Å; I221-D232 PolarHBondContact O-N 3.08Å; I221-T234 HydrophobicContact CD1-CG2 4.19Å; I221-T234 HydrophobicContact CG1-CG2 4.48Å
222	C	89.3	Confident	84.9	Confident	22 Å²	22	64 Å²	64	15%	0.149	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.3	169.1	-176.6	0	0	0	0	108.2	C211 N215 C218	C211-C222 WeakPolarHBondContact CA-SG 3.25Å; C211-C222 HydrophobicContact CB-CB 3.65Å; C211-C222 WeakPolarHBondContact CB-SG 3.33Å; C211-C222 WeakPolarHBondContact SG-CB 3.41Å; C211-C222 CovalentContact SG-SG 2.03Å; C211-C222 PolarHBondContact SG-SG 3.27Å; N215-C222 WeakPolarHBondContact O-CB 3.34Å; N215-C222 WeakPolarHBondContact OD1-CB 3.36Å; C218-C222 HydrophobicContact CB-CB 4.14Å
223	K	87.6	Confident	85	Confident	92 Å²	92	57.7 Å²	57.7	40%	0.4	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	113	174.3	-66.7	-178.1	-173.6	165.8	0	108.1	I221 F229 E230 D232	I221-K223 HydrophobicContact CG2-CG 4.3Å; K223-F229 WeakPolarHBondContact O-CA 3.24Å; K223-E230 PolarHBondContact N-O 3.12Å; K223-E230 PolarHBondContact O-N 3.37Å; K223-D232 HydrophobicContact CD-CB 4.36Å; K223-D232 WeakPolarHBondContact CE-OD2 3.32Å; K223-D232 IonicContact NZ-OD2 3.16Å; K223-D232 PolarHBondContact NZ-OD2 3.04Å
224	D	84.2	Confident	85.1	Confident	74 Å²	74	53.5 Å²	53.5	40%	0.396	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.4	173.3	-169.1	35.1	0	0	0	109.5	N209	N209-D224 WeakPolarHBondContact CA-OD1 3.32Å; N209-D224 WeakPolarHBondContact CB-OD2 3.03Å; N209-D224 VanDerWaalsContact CG-OD2 3.28Å; N209-D224 VanDerWaalsContact ND2-CG 3.31Å; N209-D224 PolarHBondContact ND2-OD2 2.85Å
225	M	81.9	Confident	85.2	Confident	84 Å²	84	52.5 Å²	52.5	41%	0.414	30%	0.296	S	S	.	.			trans	-107.6	165.5	175.2	-64.1	-173.4	171.7	0	0	109.7	I227 G228 E230	M225-I227 PolarHBondContact O-N 3.5Å; M225-G228 CarbonylContact C-O 3.51Å; M225-G228 WeakPolarHBondContact CA-O 3.36Å; M225-G228 VanDerWaalsContact CB-O 3.32Å; M225-G228 WeakPolarHBondContact CB-O 3.48Å; M225-G228 PolarHBondContact N-O 2.88Å; M225-E230 HydrophobicContact CE-CB 3.35Å; M225-E230 HydrophobicContact CE-CG 4.12Å; M225-E230 WeakPolarHBondContact CE-OE2 3.26Å; M225-E230 HydrophobicContact SD-CB 4.28Å
226	V	81.1	Confident	85	Confident	51 Å²	51	50.6 Å²	50.6	31%	0.309	29%	0.29	S	S	.	.	S	Bend	trans	-61.3	-30.5	176.5	-176.7	0	0	0	0	111.2	V188 C189 N207	V188-V226 HydrophobicContact CB-CG1 4.07Å; V188-V226 HydrophobicContact CG1-CB 4.39Å; V188-V226 HydrophobicContact CG1-CG1 3.82Å; C189-V226 HydrophobicContact CB-CG1 3.67Å; N207-V226 PolarHBondContact N-O 2.83Å
227	I	79.4	Confident	85.3	Confident	40 Å²	40	51 Å²	51	21%	0.205	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-127.7	114.4	169.4	-62.8	173.9	0	0	0	108.2	F175 V188 P202 E205 M225	F175-I227 HydrophobicContact CE2-CD1 4.05Å; F175-I227 HydrophobicContact CZ-CD1 3.82Å; V188-I227 HydrophobicContact CG1-CD1 3.32Å; V188-I227 HydrophobicContact CG1-CG1 3.71Å; P202-I227 HydrophobicContact CG-CD1 4.07Å; P202-I227 HydrophobicContact CG-CG1 4.12Å; P202-I227 HydrophobicContact CG-CG2 3.71Å; E205-I227 HydrophobicContact CB-CG2 4.48Å; E205-I227 WeakPolarHBondContact O-CA 3.2Å; M225-I227 PolarHBondContact O-N 3.5Å
228	G	83.1	Confident	85.4	Confident	11 Å²	11	55.6 Å²	55.6	11%	0.113	30%	0.302	C	S	.	.	S	Bend	trans	68.7	-158.4	-179.9	0	0	0	0	0	114.3	E205 E210 M225	E205-G228 PolarHBondContact O-N 2.81Å; E205-G228 VanDerWaalsContact O-N 3.11Å; E210-G228 VanDerWaalsContact OE2-C 3.31Å; M225-G228 CarbonylContact C-O 3.51Å; M225-G228 WeakPolarHBondContact CA-O 3.36Å; M225-G228 VanDerWaalsContact CB-O 3.32Å; M225-G228 WeakPolarHBondContact CB-O 3.48Å; M225-G228 PolarHBondContact N-O 2.88Å
229	F	86.1	Confident	85.4	Confident	68 Å²	68	57.6 Å²	57.6	30%	0.298	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.5	-176.9	69.8	-79.2	0	0	0	111.5	E210 G216 K223	E210-F229 HydrophobicContact CB-CB 4.31Å; E210-F229 HydrophobicContact CB-CD1 3.44Å; E210-F229 VanDerWaalsContact CB-CD1 3.44Å; E210-F229 HydrophobicContact CB-CE1 4Å; E210-F229 HydrophobicContact CB-CG 4.02Å; E210-F229 HydrophobicContact CG-CD1 3.81Å; E210-F229 HydrophobicContact CG-CE1 4.31Å; G216-F229 WeakPolarHBondContact O-CE2 3.48Å; G216-F229 WeakPolarHBondContact O-CZ 3.48Å; K223-F229 WeakPolarHBondContact O-CA 3.24Å
230	E	87.4	Confident	85.4	Confident	99 Å²	99	60.5 Å²	60.5	46%	0.463	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.8	172.8	-179.4	179.2	-151.8	0	0	110.1	K223 M225	K223-E230 PolarHBondContact N-O 3.12Å; K223-E230 PolarHBondContact O-N 3.37Å; M225-E230 HydrophobicContact CE-CB 3.35Å; M225-E230 HydrophobicContact CE-CG 4.12Å; M225-E230 WeakPolarHBondContact CE-OE2 3.26Å; M225-E230 HydrophobicContact SD-CB 4.28Å
231	C	88.4	Confident	85.3	Confident	7 Å²	7	62.3 Å²	62.3	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.9	171.2	-57.6	0	0	0	0	109.9	C218 I221 L239 H242	C218-C231 WeakPolarHBondContact CA-SG 3.38Å; C218-C231 HydrophobicContact CB-CB 3.61Å; C218-C231 WeakPolarHBondContact CB-SG 3.32Å; C218-C231 WeakPolarHBondContact SG-CA 3.41Å; C218-C231 WeakPolarHBondContact SG-CB 3.26Å; C218-C231 CovalentContact SG-SG 2.01Å; C218-C231 PolarHBondContact SG-SG 3.01Å; I221-C231 CarbonylContact O-C 3.57Å; I221-C231 WeakPolarHBondContact O-CA 3.42Å; C231-L239 HydrophobicContact CB-CD2 3.73Å; C231-L239 WeakPolarHBondContact O-CD1 3.01Å; C231-L239 WeakPolarHBondContact O-CD2 3.17Å; C231-H242 VanDerWaalsContact CB-O 3.31Å; C231-H242 WeakPolarHBondContact CB-O 3.46Å; C231-H242 PolarHBondContact SG-O 2.82Å; C231-H242 VanDerWaalsContact SG-O 3.36Å
232	D	87.8	Confident	84.8	Confident	55 Å²	55	67.1 Å²	67.1	29%	0.294	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	158.9	173.5	-161.3	7.6	0	0	0	110.6	I221 K223	I221-D232 HydrophobicContact CB-CB 4.08Å; I221-D232 WeakPolarHBondContact CB-O 3.44Å; I221-D232 HydrophobicContact CG2-CB 4.26Å; I221-D232 PolarHBondContact N-O 2.82Å; I221-D232 PolarHBondContact O-N 3.08Å; K223-D232 HydrophobicContact CD-CB 4.36Å; K223-D232 WeakPolarHBondContact CE-OD2 3.32Å; K223-D232 IonicContact NZ-OD2 3.16Å; K223-D232 PolarHBondContact NZ-OD2 3.04Å
233	C	87.4	Confident	84.4	Confident	11 Å²	11	70.8 Å²	70.8	7%	0.074	37%	0.368	C	S	.	.			trans	-108	151.7	178.9	-61.9	0	0	0	0	111	L237 Q238 L239 C245	C233-L237 HydrophobicContact CB-CB 3.93Å; C233-L237 VanDerWaalsContact CB-O 3.24Å; C233-L237 WeakPolarHBondContact CB-O 3.36Å; C233-Q238 VanDerWaalsContact SG-C 3.59Å; C233-L239 HydrophobicContact CB-CD1 4.47Å; C233-L239 WeakPolarHBondContact SG-CD1 3.06Å; C233-L239 WeakPolarHBondContact SG-CG 3.42Å; C233-C245 WeakPolarHBondContact CA-SG 3.33Å; C233-C245 HydrophobicContact CB-CB 3.92Å; C233-C245 WeakPolarHBondContact CB-SG 3.21Å; C233-C245 VanDerWaalsContact SG-CA 3.57Å; C233-C245 WeakPolarHBondContact SG-CB 3.03Å; C233-C245 CovalentContact SG-SG 2.03Å; C233-C245 PolarHBondContact SG-SG 2.79Å
234	T	86.4	Confident	84.3	Confident	54 Å²	54	69.3 Å²	69.3	33%	0.331	37%	0.367	S	S	.	.			trans	-64.5	153.8	167.5	49.9	0	0	0	0	110	I221 G236 L237	I221-T234 HydrophobicContact CD1-CG2 4.19Å; I221-T234 HydrophobicContact CG1-CG2 4.48Å; T234-G236 PolarHBondContact O-N 3.47Å; T234-L237 PolarHBondContact O-N 3.35Å; T234-L237 VanDerWaalsContact O-N 3.14Å; T234-L237 WeakPolarHBondContact OG1-CD1 3.3Å
235	P	84.4	Confident	84.5	Confident	126 Å²	126	66.8 Å²	66.8	82%	0.818	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	138.3	177.6	-26.6	34.5	0	0	0	112.2
236	G	80.3	Confident	84.7	Confident	17 Å²	17	63.5 Å²	63.5	18%	0.175	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-0.2	-175.4	0	0	0	0	0	115	T234 I248	T234-G236 PolarHBondContact O-N 3.47Å; G236-I248 PolarHBondContact O-N 3.45Å; G236-I248 VanDerWaalsContact O-N 3.15Å
237	L	87.1	Confident	85	Confident	19 Å²	19	63.8 Å²	63.8	10%	0.099	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.1	176.2	-67.4	143.2	0	0	0	110.1	C233 T234 C245 G246 D247	C233-L237 HydrophobicContact CB-CB 3.93Å; C233-L237 VanDerWaalsContact CB-O 3.24Å; C233-L237 WeakPolarHBondContact CB-O 3.36Å; T234-L237 PolarHBondContact O-N 3.35Å; T234-L237 VanDerWaalsContact O-N 3.14Å; T234-L237 WeakPolarHBondContact OG1-CD1 3.3Å; L237-C245 HydrophobicContact CB-CB 4.16Å; L237-G246 CarbonylContact C-O 3.55Å; L237-G246 WeakPolarHBondContact CA-O 3.46Å; L237-G246 WeakPolarHBondContact CB-O 3.27Å; L237-G246 WeakPolarHBondContact CD2-O 3.47Å; L237-D247 HydrophobicContact CD2-CB 4.36Å
238	Q	87.1	Confident	85.4	Confident	131 Å²	131	64.8 Å²	64.8	61%	0.612	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.6	179.4	-179	175.2	21.7	0	0	110.9	C233 I240 C245 G246 I248	C233-Q238 VanDerWaalsContact SG-C 3.59Å; Q238-I240 PolarHBondContact O-N 2.89Å; Q238-C245 CarbonylContact O-C 3.59Å; Q238-C245 WeakPolarHBondContact O-CA 3.34Å; Q238-G246 PolarHBondContact N-O 3.25Å; Q238-G246 PolarHBondContact O-N 2.98Å; Q238-I248 HydrophobicContact CB-CD1 3.94Å; Q238-I248 HydrophobicContact CB-CG1 3.63Å
239	L	87.5	Confident	85.7	Confident	51 Å²	51	67.6 Å²	67.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	128.1	174.4	-82.5	109.8	0	0	0	112.1	C231 C233 H242 T244	C231-L239 HydrophobicContact CB-CD2 3.73Å; C231-L239 WeakPolarHBondContact O-CD1 3.01Å; C231-L239 WeakPolarHBondContact O-CD2 3.17Å; C233-L239 HydrophobicContact CB-CD1 4.47Å; C233-L239 WeakPolarHBondContact SG-CD1 3.06Å; C233-L239 WeakPolarHBondContact SG-CG 3.42Å; L239-H242 WeakPolarHBondContact CD2-O 3.32Å; L239-T244 WeakPolarHBondContact CA-O 3.27Å
240	I	85.4	Confident	85.8	Confident	116 Å²	116	65.3 Å²	65.3	60%	0.595	35%	0.35	S	S	*	.	S	Bend	trans	-92.2	-56	174.9	-59.5	172.2	0	0	0	110	Q238 T244 G246	Q238-I240 PolarHBondContact O-N 2.89Å; I240-T244 PolarHBondContact N-O 2.99Å; I240-G246 VanDerWaalsContact CD1-CA 3.49Å
241	D	82	Confident	85.8	Confident	116 Å²	116	62.6 Å²	62.6	62%	0.62	34%	0.341	S	S	*	.	S	Bend	trans	-118.5	38.9	-173.1	-61.5	-42.8	0	0	0	113	K243	D241-K243 PolarHBondContact O-N 2.9Å
242	H	77	Confident	85.7	Confident	165 Å²	165	68.2 Å²	68.2	76%	0.764	37%	0.368	S	S	*	.	S	Bend	trans	56.5	2.3	-173.6	-61.2	-72.6	0	0	0	116	C231 L239	C231-H242 VanDerWaalsContact CB-O 3.31Å; C231-H242 WeakPolarHBondContact CB-O 3.46Å; C231-H242 PolarHBondContact SG-O 2.82Å; C231-H242 VanDerWaalsContact SG-O 3.36Å; L239-H242 WeakPolarHBondContact CD2-O 3.32Å
243	K	81.3	Confident	85.4	Confident	99 Å²	99	70.3 Å²	70.3	43%	0.43	38%	0.38	S	S	.	.	S	Bend	trans	-137.4	-35.8	180	-66.2	-171.6	179.7	-170.1	0	113.6	C218 S219 D241	C218-K243 WeakPolarHBondContact CA-O 3.38Å; S219-K243 PolarHBondContact N-O 3.1Å; S219-K243 PolarHBondContact OG-O 3.47Å; D241-K243 PolarHBondContact O-N 2.9Å
244	T	85.7	Confident	84.8	Confident	62 Å²	62	73 Å²	73	38%	0.38	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-99.9	133.4	-177.7	44.6	0	0	0	0	111.2	L239 I240	L239-T244 WeakPolarHBondContact CA-O 3.27Å; I240-T244 PolarHBondContact N-O 2.99Å
245	C	86.8	Confident	84.6	Confident	21 Å²	21	71.9 Å²	71.9	14%	0.142	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.7	176.4	-64.8	0	0	0	0	111	S219 H220 C233 L237 Q238	S219-C245 WeakPolarHBondContact OG-CB 3.23Å; S219-C245 PolarHBondContact OG-N 3.15Å; S219-C245 PolarHBondContact OG-SG 3.13Å; S219-C245 VanDerWaalsContact OG-SG 3.35Å; H220-C245 WeakPolarHBondContact ND1-CB 3.33Å; H220-C245 PolarHBondContact ND1-SG 3.42Å; C233-C245 WeakPolarHBondContact CA-SG 3.33Å; C233-C245 HydrophobicContact CB-CB 3.92Å; C233-C245 WeakPolarHBondContact CB-SG 3.21Å; C233-C245 VanDerWaalsContact SG-CA 3.57Å; C233-C245 WeakPolarHBondContact SG-CB 3.03Å; C233-C245 CovalentContact SG-SG 2.03Å; C233-C245 PolarHBondContact SG-SG 2.79Å; L237-C245 HydrophobicContact CB-CB 4.16Å; Q238-C245 CarbonylContact O-C 3.59Å; Q238-C245 WeakPolarHBondContact O-CA 3.34Å
246	G	86.1	Confident	84.7	Confident	14 Å²	14	68.5 Å²	68.5	14%	0.144	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	158.4	168.3	0	0	0	0	0	112.2	L237 Q238 I240	L237-G246 CarbonylContact C-O 3.55Å; L237-G246 WeakPolarHBondContact CA-O 3.46Å; L237-G246 WeakPolarHBondContact CB-O 3.27Å; L237-G246 WeakPolarHBondContact CD2-O 3.47Å; Q238-G246 PolarHBondContact N-O 3.25Å; Q238-G246 PolarHBondContact O-N 2.98Å; I240-G246 VanDerWaalsContact CD1-CA 3.49Å
247	D	89.3	Confident	85.1	Confident	58 Å²	58	67.9 Å²	67.9	31%	0.31	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	134.8	175.4	-168.9	55.2	0	0	0	111.1	L237 N263 K265 G266	L237-D247 HydrophobicContact CD2-CB 4.36Å; D247-N263 PolarHBondContact OD2-ND2 3.04Å; D247-K265 WeakPolarHBondContact OD1-CA 3.22Å; D247-G266 PolarHBondContact OD1-N 3.29Å
248	I	87.9	Confident	85.1	Confident	60 Å²	60	67.3 Å²	67.3	31%	0.308	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-83.3	119.5	172.4	-61.4	173.7	0	0	0	106.6	G236 Q238 E250 N263	G236-I248 PolarHBondContact O-N 3.45Å; G236-I248 VanDerWaalsContact O-N 3.15Å; Q238-I248 HydrophobicContact CB-CD1 3.94Å; Q238-I248 HydrophobicContact CB-CG1 3.63Å; I248-E250 HydrophobicContact CG2-CG 4.23Å; I248-E250 PolarHBondContact O-N 3.17Å; I248-E250 VanDerWaalsContact O-OE2 3.04Å; I248-N263 PolarHBondContact O-OD1 2.93Å
249	N	87.4	Confident	85.3	Confident	71 Å²	71	61.7 Å²	61.7	38%	0.38	34%	0.335	S	S	.	.			trans	-79.6	88.9	173.7	-172.5	-6.4	0	0	0	110.2	C251 M252 N263	N249-C251 PolarHBondContact O-N 3.44Å; N249-C251 WeakPolarHBondContact OD1-CB 3.41Å; N249-C251 PolarHBondContact OD1-N 3.43Å; N249-M252 HydrophobicContact CB-CG 4.04Å; N249-M252 PolarHBondContact O-N 3.16Å; N249-N263 WeakPolarHBondContact CA-OD1 3.32Å
250	E	89.1	Confident	85.4	Confident	20 Å²	20	62.2 Å²	62.2	9%	0.093	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-64.4	-25.6	-178.6	-62.8	98.1	169.4	0	0	112.3	I248 M252 N253 I256 N263 Y268	I248-E250 HydrophobicContact CG2-CG 4.23Å; I248-E250 PolarHBondContact O-N 3.17Å; I248-E250 VanDerWaalsContact O-OE2 3.04Å; E250-M252 PolarHBondContact O-N 3.04Å; E250-M252 VanDerWaalsContact O-N 3.08Å; E250-N253 PolarHBondContact O-N 3.48Å; E250-I256 HydrophobicContact CB-CD1 3.71Å; E250-I256 HydrophobicContact CB-CG2 4.38Å; E250-I256 HydrophobicContact CG-CD1 4.36Å; E250-I256 WeakPolarHBondContact O-CD1 3.07Å; E250-N263 PolarHBondContact N-OD1 2.74Å; E250-N263 PolarHBondContact OE2-OD1 3.18Å; E250-Y268 HydrophobicContact CB-CD1 3.67Å; E250-Y268 HydrophobicContact CB-CE1 4.31Å; E250-Y268 HydrophobicContact CB-CG 4.09Å; E250-Y268 HydrophobicContact CG-CD1 3.67Å; E250-Y268 HydrophobicContact CG-CE1 4.21Å
251	C	88.1	Confident	85.7	Confident	41 Å²	41	58.4 Å²	58.4	28%	0.277	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-67.1	-10.1	179.8	-60.6	0	0	0	0	114.3	N249 N253 C261 N263	N249-C251 PolarHBondContact O-N 3.44Å; N249-C251 WeakPolarHBondContact OD1-CB 3.41Å; N249-C251 PolarHBondContact OD1-N 3.43Å; C251-N253 VanDerWaalsContact C-N 3.31Å; C251-C261 WeakPolarHBondContact CA-SG 3.47Å; C251-C261 HydrophobicContact CB-CB 3.71Å; C251-C261 WeakPolarHBondContact CB-SG 3.49Å; C251-C261 WeakPolarHBondContact SG-CB 3.44Å; C251-C261 CovalentContact SG-SG 2.04Å; C251-C261 PolarHBondContact SG-SG 2.84Å; C251-N263 PolarHBondContact SG-N 3.47Å; C251-N263 VanDerWaalsContact SG-N 3.36Å
252	M	85.1	Confident	86.1	Confident	125 Å²	125	55.9 Å²	55.9	62%	0.616	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-75.6	-20.2	172	-61	-62.5	-78.7	0	0	112.6	N249 E250 P254	N249-M252 HydrophobicContact CB-CG 4.04Å; N249-M252 PolarHBondContact O-N 3.16Å; E250-M252 PolarHBondContact O-N 3.04Å; E250-M252 VanDerWaalsContact O-N 3.08Å; M252-P254 WeakPolarHBondContact O-CD 3.4Å
253	N	82.5	Confident	86.8	Confident	100 Å²	100	50.5 Å²	50.5	54%	0.535	28%	0.284	S	S	.	.	S	Bend	trans	-86.9	117.7	179.7	-73.8	-22.5	0	0	0	110.9	E250 C251 G255 I256	E250-N253 PolarHBondContact O-N 3.48Å; C251-N253 VanDerWaalsContact C-N 3.31Å; N253-G255 PolarHBondContact O-N 2.95Å; N253-I256 HydrophobicContact CB-CD1 3.81Å; N253-I256 HydrophobicContact CB-CG1 3.93Å; N253-I256 PolarHBondContact O-N 3.27Å
254	P	75.1	Confident	87.2	Confident	66 Å²	66	50 Å²	50	43%	0.429	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	125.3	177.4	-17.4	30.3	0	0	0	110.5	M252 F526	M252-P254 WeakPolarHBondContact O-CD 3.4Å; P254-F526 HydrophobicContact CB-CD1 4.45Å
255	G	80.6	Confident	87.2	Confident	32 Å²	32	55.8 Å²	55.8	33%	0.33	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	103	-3.2	176.1	0	0	0	0	0	116.2	N253 F526	N253-G255 PolarHBondContact O-N 2.95Å; G255-F526 VanDerWaalsContact CA-CD1 3.48Å
256	I	87.3	Confident	87	Confident	54 Å²	54	56.2 Å²	56.2	28%	0.277	31%	0.313	S	S	.	.	S	Bend	trans	-65.2	-42.6	172.5	-73.6	-160.5	0	0	0	112	E250 N253 Y268	E250-I256 HydrophobicContact CB-CD1 3.71Å; E250-I256 HydrophobicContact CB-CG2 4.38Å; E250-I256 HydrophobicContact CG-CD1 4.36Å; E250-I256 WeakPolarHBondContact O-CD1 3.07Å; N253-I256 HydrophobicContact CB-CD1 3.81Å; N253-I256 HydrophobicContact CB-CG1 3.93Å; N253-I256 PolarHBondContact O-N 3.27Å; I256-Y268 HydrophobicContact CG2-CD1 4.24Å; I256-Y268 HydrophobicContact CG2-CD2 3.61Å; I256-Y268 HydrophobicContact CG2-CE1 3.93Å; I256-Y268 HydrophobicContact CG2-CE2 3.23Å; I256-Y268 HydrophobicContact CG2-CG 4.1Å; I256-Y268 VanDerWaalsContact CG2-CZ 3.41Å
257	C	88.8	Confident	87.1	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.027	32%	0.315	C	S	.	.	S	Bend	trans	-120.4	135.6	170.1	-61.2	0	0	0	0	110	Q259 C261 C270 K464	C257-Q259 VanDerWaalsContact C-N 3.29Å; C257-Q259 PolarHBondContact O-N 3Å; C257-C261 HydrophobicContact CB-CB 3.89Å; C257-C270 VanDerWaalsContact CA-SG 3.52Å; C257-C270 HydrophobicContact CB-CB 3.72Å; C257-C270 WeakPolarHBondContact CB-SG 3.41Å; C257-C270 WeakPolarHBondContact SG-CA 3.48Å; C257-C270 WeakPolarHBondContact SG-CB 3.33Å; C257-C270 CovalentContact SG-SG 2.03Å; C257-C270 PolarHBondContact SG-SG 3.43Å; C257-K464 PolarHBondContact O-NZ 3.06Å
258	S	87.9	Confident	87.2	Confident	7 Å²	7	59 Å²	59	5%	0.049	32%	0.321	C	S	.	.	S	Bend	trans	-51.4	-45.6	174.5	172.4	0	0	0	0	112.3	K464 D508	S258-K464 WeakPolarHBondContact O-CE 3.36Å; S258-D508 WeakPolarHBondContact CA-OD1 3.4Å; S258-D508 WeakPolarHBondContact CB-OD1 3.35Å; S258-D508 WeakPolarHBondContact CB-OD2 3.35Å; S258-D508 VanDerWaalsContact OG-CG 3.28Å; S258-D508 PolarHBondContact OG-OD1 2.03Å; S258-D508 PolarHBondContact OG-OD2 2.92Å
259	Q	89.6	Confident	87.4	Confident	13 Å²	13	61.1 Å²	61.1	6%	0.061	33%	0.328	C	S	.	.	S	Bend	trans	-128.9	-86.3	-175.2	-65.2	-179	-2.2	0	0	113.4	C257 Y276 C285 K464	C257-Q259 VanDerWaalsContact C-N 3.29Å; C257-Q259 PolarHBondContact O-N 3Å; Q259-Y276 VanDerWaalsContact NE2-CE1 3.33Å; Q259-C285 HydrophobicContact CG-CB 3.92Å; Q259-K464 WeakPolarHBondContact O-CD 3.23Å; Q259-K464 WeakPolarHBondContact O-CE 3.22Å; Q259-K464 PolarHBondContact O-NZ 2.95Å
260	I	90.9	Very high	87.6	Confident	63 Å²	63	59.3 Å²	59.3	32%	0.323	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.1	-175.5	-57.7	168.3	0	0	0	108.7	I262 C270 E271 H273	I260-I262 HydrophobicContact CG2-CG1 4.3Å; I260-C270 WeakPolarHBondContact O-CA 3.34Å; I260-E271 HydrophobicContact CB-CB 4.14Å; I260-E271 WeakPolarHBondContact CB-O 3.17Å; I260-E271 HydrophobicContact CG2-CB 4.38Å; I260-E271 PolarHBondContact N-O 2.88Å; I260-E271 PolarHBondContact O-N 3.02Å; I260-H273 HydrophobicContact CD1-CB 4.45Å
261	C	91.3	Very high	87.7	Confident	35 Å²	35	61.8 Å²	61.8	24%	0.236	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127	174.7	-173	0	0	0	0	109.6	C251 C257	C251-C261 WeakPolarHBondContact CA-SG 3.47Å; C251-C261 HydrophobicContact CB-CB 3.71Å; C251-C261 WeakPolarHBondContact CB-SG 3.49Å; C251-C261 WeakPolarHBondContact SG-CB 3.44Å; C251-C261 CovalentContact SG-SG 2.04Å; C251-C261 PolarHBondContact SG-SG 2.84Å; C257-C261 HydrophobicContact CB-CB 3.89Å
262	I	91.4	Very high	88	Confident	63 Å²	63	61.3 Å²	61.3	32%	0.323	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.2	175.9	-55.8	173.5	0	0	0	107.3	I260 L264 Y268 K269 E271	I260-I262 HydrophobicContact CG2-CG1 4.3Å; I262-L264 HydrophobicContact CG2-CD2 4.12Å; I262-Y268 WeakPolarHBondContact O-CA 3.27Å; I262-K269 HydrophobicContact CB-CB 4.44Å; I262-K269 PolarHBondContact N-O 3.15Å; I262-K269 PolarHBondContact O-N 3.49Å; I262-E271 HydrophobicContact CD1-CG 4.2Å
263	N	90.3	Very high	88.3	Confident	53 Å²	53	58.5 Å²	58.5	28%	0.283	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	126.7	175.9	-169	61.6	0	0	0	109.8	D247 I248 N249 E250 C251	D247-N263 PolarHBondContact OD2-ND2 3.04Å; I248-N263 PolarHBondContact O-OD1 2.93Å; N249-N263 WeakPolarHBondContact CA-OD1 3.32Å; E250-N263 PolarHBondContact N-OD1 2.74Å; E250-N263 PolarHBondContact OE2-OD1 3.18Å; C251-N263 PolarHBondContact SG-N 3.47Å; C251-N263 VanDerWaalsContact SG-N 3.36Å
264	L	89.5	Confident	88.7	Confident	88 Å²	88	60.6 Å²	60.6	46%	0.461	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	161.5	176.2	-58.3	174.9	0	0	0	108.6	I262 G266 G267 K269	I262-L264 HydrophobicContact CG2-CD2 4.12Å; L264-G266 PolarHBondContact O-N 3.01Å; L264-G266 VanDerWaalsContact O-N 3.14Å; L264-G267 CarbonylContact C-O 3.6Å; L264-G267 VanDerWaalsContact CA-O 3.22Å; L264-G267 WeakPolarHBondContact CA-O 3.47Å; L264-G267 VanDerWaalsContact CB-O 3.28Å; L264-G267 WeakPolarHBondContact CB-O 2.96Å; L264-G267 PolarHBondContact N-O 3.39Å; L264-G267 PolarHBondContact O-N 2.67Å; L264-K269 HydrophobicContact CD1-CB 4.04Å
265	K	86.3	Confident	89.4	Confident	183 Å²	183	58.6 Å²	58.6	80%	0.796	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	115.9	176.5	-171.6	176	178.5	178.8	0	110.2	D247	D247-K265 WeakPolarHBondContact OD1-CA 3.22Å
266	G	83	Confident	89.9	Confident	31 Å²	31	58 Å²	58	32%	0.32	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	16.1	-178.6	0	0	0	0	0	114.5	D247 L264	D247-G266 PolarHBondContact OD1-N 3.29Å; L264-G266 PolarHBondContact O-N 3.01Å; L264-G266 VanDerWaalsContact O-N 3.14Å
267	G	88.2	Confident	90.2	Very high	18 Å²	18	61.7 Å²	61.7	19%	0.186	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.7	-166.9	173.2	0	0	0	0	0	113.2	L264	L264-G267 CarbonylContact C-O 3.6Å; L264-G267 VanDerWaalsContact CA-O 3.22Å; L264-G267 WeakPolarHBondContact CA-O 3.47Å; L264-G267 VanDerWaalsContact CB-O 3.28Å; L264-G267 WeakPolarHBondContact CB-O 2.96Å; L264-G267 PolarHBondContact N-O 3.39Å; L264-G267 PolarHBondContact O-N 2.67Å
268	Y	91.6	Very high	90.3	Very high	112 Å²	112	65.5 Å²	65.5	44%	0.439	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	162.9	-174.2	63.4	-82	0	0	0	112.4	E250 I256 I262	E250-Y268 HydrophobicContact CB-CD1 3.67Å; E250-Y268 HydrophobicContact CB-CE1 4.31Å; E250-Y268 HydrophobicContact CB-CG 4.09Å; E250-Y268 HydrophobicContact CG-CD1 3.67Å; E250-Y268 HydrophobicContact CG-CE1 4.21Å; I256-Y268 HydrophobicContact CG2-CD1 4.24Å; I256-Y268 HydrophobicContact CG2-CD2 3.61Å; I256-Y268 HydrophobicContact CG2-CE1 3.93Å; I256-Y268 HydrophobicContact CG2-CE2 3.23Å; I256-Y268 HydrophobicContact CG2-CG 4.1Å; I256-Y268 VanDerWaalsContact CG2-CZ 3.41Å; I262-Y268 WeakPolarHBondContact O-CA 3.27Å
269	K	90.9	Very high	90.4	Very high	105 Å²	105	66.8 Å²	66.8	46%	0.457	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.8	172.6	-172.9	-172.5	-179.2	-159	0	109.9	I262 L264 E271	I262-K269 HydrophobicContact CB-CB 4.44Å; I262-K269 PolarHBondContact N-O 3.15Å; I262-K269 PolarHBondContact O-N 3.49Å; L264-K269 HydrophobicContact CD1-CB 4.04Å; K269-E271 HydrophobicContact CD-CG 4.48Å; K269-E271 WeakPolarHBondContact CE-OE1 3.48Å; K269-E271 IonicContact NZ-OE1 2.75Å; K269-E271 PolarHBondContact NZ-OE1 3.04Å
270	C	92	Very high	90.3	Very high	32 Å²	32	72.2 Å²	72.2	22%	0.216	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.8	171.8	-56.9	0	0	0	0	111.1	C257 I260 M278	C257-C270 VanDerWaalsContact CA-SG 3.52Å; C257-C270 HydrophobicContact CB-CB 3.72Å; C257-C270 WeakPolarHBondContact CB-SG 3.41Å; C257-C270 WeakPolarHBondContact SG-CA 3.48Å; C257-C270 WeakPolarHBondContact SG-CB 3.33Å; C257-C270 CovalentContact SG-SG 2.03Å; C257-C270 PolarHBondContact SG-SG 3.43Å; I260-C270 WeakPolarHBondContact O-CA 3.34Å; C270-M278 HydrophobicContact CB-CE 4.17Å; C270-M278 VanDerWaalsContact O-CE 3.29Å; C270-M278 WeakPolarHBondContact O-CE 3.44Å
271	E	92.3	Very high	90.1	Very high	72 Å²	72	73.4 Å²	73.4	34%	0.336	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	157.6	172.4	-64.2	-171.7	169.2	0	0	110.4	I260 I262 K269	I260-E271 HydrophobicContact CB-CB 4.14Å; I260-E271 WeakPolarHBondContact CB-O 3.17Å; I260-E271 HydrophobicContact CG2-CB 4.38Å; I260-E271 PolarHBondContact N-O 2.88Å; I260-E271 PolarHBondContact O-N 3.02Å; I262-E271 HydrophobicContact CD1-CG 4.2Å; K269-E271 HydrophobicContact CD-CG 4.48Å; K269-E271 WeakPolarHBondContact CE-OE1 3.48Å; K269-E271 IonicContact NZ-OE1 2.75Å; K269-E271 PolarHBondContact NZ-OE1 3.04Å
272	C	93.6	Very high	89.7	Confident	32 Å²	32	75.4 Å²	75.4	22%	0.216	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-103.7	145.4	177.8	-57.3	0	0	0	0	110.5	C285	C272-C285 WeakPolarHBondContact CA-SG 3.37Å; C272-C285 HydrophobicContact CB-CB 3.8Å; C272-C285 WeakPolarHBondContact CB-SG 3.5Å; C272-C285 VanDerWaalsContact SG-CA 3.56Å; C272-C285 WeakPolarHBondContact SG-CB 3.29Å; C272-C285 CovalentContact SG-SG 2.04Å; C272-C285 PolarHBondContact SG-SG 3.46Å
273	H	91.6	Very high	89.4	Confident	66 Å²	66	76.3 Å²	76.3	31%	0.306	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-70.1	163.9	173.4	-161.3	16.1	0	0	0	110.9	I260 G275 Y276 I463	I260-H273 HydrophobicContact CD1-CB 4.45Å; H273-G275 PolarHBondContact O-N 2.85Å; H273-Y276 HydrophobicContact CB-CD2 4.29Å; H273-Y276 WeakPolarHBondContact O-CB 3.42Å; H273-Y276 PolarHBondContact O-N 3.09Å; H273-I463 HydrophobicContact CB-CG2 4.07Å
274	N	90.7	Very high	89.4	Confident	143 Å²	143	75.4 Å²	75.4	77%	0.765	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	136.4	-176.8	-169.1	16.7	0	0	0	110.4	Y276	N274-Y276 VanDerWaalsContact C-N 3.32Å
275	G	88.8	Confident	89.5	Confident	24 Å²	24	71.3 Å²	71.3	25%	0.247	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-7.4	-171.8	0	0	0	0	0	114.7	H273 V288 L550	H273-G275 PolarHBondContact O-N 2.85Å; G275-V288 PolarHBondContact O-N 2.79Å; G275-L550 WeakPolarHBondContact O-CD1 3.47Å
276	Y	92.8	Very high	89.8	Confident	21 Å²	21	67 Å²	67	8%	0.082	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	145.6	172.3	-63.2	-95.4	0	0	0	111.1	Q259 H273 N274 K286 A287 I463 E507 L550	Q259-Y276 VanDerWaalsContact NE2-CE1 3.33Å; H273-Y276 HydrophobicContact CB-CD2 4.29Å; H273-Y276 WeakPolarHBondContact O-CB 3.42Å; H273-Y276 PolarHBondContact O-N 3.09Å; N274-Y276 VanDerWaalsContact C-N 3.32Å; Y276-K286 CarbonylContact C-O 3.56Å; Y276-K286 VanDerWaalsContact CA-O 3.27Å; Y276-K286 WeakPolarHBondContact CA-O 3.37Å; Y276-A287 HydrophobicContact CD1-CB 4.13Å; Y276-A287 HydrophobicContact CE1-CB 3.93Å; Y276-I463 HydrophobicContact CE2-CD1 3.62Å; Y276-E507 HydrophobicContact CE1-CG 4.11Å; Y276-L550 HydrophobicContact CD1-CD1 4.27Å; Y276-L550 HydrophobicContact CD2-CD1 3.93Å; Y276-L550 HydrophobicContact CE1-CD1 3.93Å; Y276-L550 HydrophobicContact CE2-CB 3.84Å; Y276-L550 HydrophobicContact CE2-CD1 3.56Å; Y276-L550 HydrophobicContact CE2-CD2 4.47Å; Y276-L550 HydrophobicContact CE2-CG 4.15Å; Y276-L550 HydrophobicContact CG-CD1 4.26Å; Y276-L550 WeakPolarHBondContact OH-CB 3.06Å
277	Q	92.4	Very high	90.2	Very high	130 Å²	130	66.7 Å²	66.7	61%	0.607	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	142	172.4	-78.8	177.9	19.1	0	0	110.3	D279 K286 V288	Q277-D279 PolarHBondContact O-N 2.9Å; Q277-K286 PolarHBondContact N-O 2.79Å; Q277-K286 PolarHBondContact O-N 2.85Å; Q277-V288 HydrophobicContact CB-CG2 3.74Å; Q277-V288 VanDerWaalsContact CD-CG2 3.48Å; Q277-V288 HydrophobicContact CG-CG2 3.48Å; Q277-V288 VanDerWaalsContact CG-CG2 3.48Å
278	M	92	Very high	90.3	Very high	84 Å²	84	68.9 Å²	68.9	41%	0.414	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123.5	176.6	-167.8	174.9	-73.4	0	0	109.4	C270 P280	C270-M278 HydrophobicContact CB-CE 4.17Å; C270-M278 VanDerWaalsContact O-CE 3.29Å; C270-M278 WeakPolarHBondContact O-CE 3.44Å; M278-P280 WeakPolarHBondContact O-CD 3.44Å
279	D	88.5	Confident	89.9	Confident	35 Å²	35	66.6 Å²	66.6	19%	0.187	40%	0.396	C	S	.	.			trans	-71.9	117.3	172.8	-177.5	-17.4	0	0	0	109	Q277 A281 T282 S283 V284 K286	Q277-D279 PolarHBondContact O-N 2.9Å; D279-A281 PolarHBondContact O-N 2.86Å; D279-A281 VanDerWaalsContact O-N 3.15Å; D279-A281 PolarHBondContact OD1-N 3.18Å; D279-T282 WeakPolarHBondContact CB-OG1 3.41Å; D279-T282 VanDerWaalsContact CG-OG1 3.26Å; D279-T282 PolarHBondContact O-N 2.88Å; D279-T282 PolarHBondContact OD2-OG1 2.81Å; D279-T282 VanDerWaalsContact OD2-OG1 3.13Å; D279-S283 WeakPolarHBondContact O-CA 3.42Å; D279-S283 PolarHBondContact O-N 2.83Å; D279-V284 WeakPolarHBondContact CB-O 3.39Å; D279-V284 PolarHBondContact N-O 3.26Å; D279-K286 HydrophobicContact CB-CD 4.31Å; D279-K286 WeakPolarHBondContact OD2-CE 3.35Å; D279-K286 IonicContact OD2-NZ 3.63Å; D279-K286 PolarHBondContact OD2-NZ 2.83Å
280	P	87.4	Confident	89.6	Confident	127 Å²	127	67.3 Å²	67.3	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.3	-175.8	26.2	-34.3	0	0	0	113.7	M278	M278-P280 WeakPolarHBondContact O-CD 3.44Å
281	A	87.1	Confident	89.3	Confident	88 Å²	88	68.6 Å²	68.6	73%	0.727	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-35.6	178.7	0	0	0	0	0	112.8	D279	D279-A281 PolarHBondContact O-N 2.86Å; D279-A281 VanDerWaalsContact O-N 3.15Å; D279-A281 PolarHBondContact OD1-N 3.18Å
282	T	84.1	Confident	89.4	Confident	76 Å²	76	65.4 Å²	65.4	47%	0.466	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-10.6	-171.4	58.2	0	0	0	0	113.7	D279 V284	D279-T282 WeakPolarHBondContact CB-OG1 3.41Å; D279-T282 VanDerWaalsContact CG-OG1 3.26Å; D279-T282 PolarHBondContact O-N 2.88Å; D279-T282 PolarHBondContact OD2-OG1 2.81Å; D279-T282 VanDerWaalsContact OD2-OG1 3.13Å; T282-V284 PolarHBondContact O-N 2.76Å; T282-V284 VanDerWaalsContact O-N 3.16Å
283	S	84.8	Confident	89.4	Confident	82 Å²	82	64 Å²	64	57%	0.573	38%	0.378	S	S	*	.			trans	56.8	19.2	-171.8	-54.9	0	0	0	0	114.1	D279	D279-S283 WeakPolarHBondContact O-CA 3.42Å; D279-S283 PolarHBondContact O-N 2.83Å
284	V	90.1	Very high	89.6	Confident	35 Å²	35	60.9 Å²	60.9	21%	0.212	36%	0.363	C	S	.	.			trans	-93.8	143.2	177.5	174.8	0	0	0	0	109.8	D279 T282 K286 D508	D279-V284 WeakPolarHBondContact CB-O 3.39Å; D279-V284 PolarHBondContact N-O 3.26Å; T282-V284 PolarHBondContact O-N 2.76Å; T282-V284 VanDerWaalsContact O-N 3.16Å; V284-K286 PolarHBondContact O-N 3.36Å; V284-D508 HydrophobicContact CG1-CB 4.36Å; V284-D508 WeakPolarHBondContact CG1-OD2 3.12Å
285	C	92.3	Very high	89.9	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.014	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.5	175.4	-65.1	0	0	0	0	110.2	Q259 C272	Q259-C285 HydrophobicContact CG-CB 3.92Å; C272-C285 WeakPolarHBondContact CA-SG 3.37Å; C272-C285 HydrophobicContact CB-CB 3.8Å; C272-C285 WeakPolarHBondContact CB-SG 3.5Å; C272-C285 VanDerWaalsContact SG-CA 3.56Å; C272-C285 WeakPolarHBondContact SG-CB 3.29Å; C272-C285 CovalentContact SG-SG 2.04Å; C272-C285 PolarHBondContact SG-SG 3.46Å
286	K	91.8	Very high	90.3	Very high	92 Å²	92	53 Å²	53	40%	0.4	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144.2	177.3	-72.5	-176.2	176.4	163	0	111.8	Y276 Q277 D279 V284 E507	Y276-K286 CarbonylContact C-O 3.56Å; Y276-K286 VanDerWaalsContact CA-O 3.27Å; Y276-K286 WeakPolarHBondContact CA-O 3.37Å; Q277-K286 PolarHBondContact N-O 2.79Å; Q277-K286 PolarHBondContact O-N 2.85Å; D279-K286 HydrophobicContact CB-CD 4.31Å; D279-K286 WeakPolarHBondContact OD2-CE 3.35Å; D279-K286 IonicContact OD2-NZ 3.63Å; D279-K286 PolarHBondContact OD2-NZ 2.83Å; V284-K286 PolarHBondContact O-N 3.36Å; K286-E507 WeakPolarHBondContact CA-OE1 3.16Å
287	A	92.1	Very high	90.4	Very high	24 Å²	24	52 Å²	52	20%	0.198	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	141.9	178.6	0	0	0	0	0	111.2	Y276 F506 E507 L550	Y276-A287 HydrophobicContact CD1-CB 4.13Å; Y276-A287 HydrophobicContact CE1-CB 3.93Å; A287-F506 HydrophobicContact CB-CE1 4.18Å; A287-F506 HydrophobicContact CB-CZ 3.72Å; A287-E507 PolarHBondContact N-OE1 2.88Å; A287-L550 HydrophobicContact CB-CD1 3.63Å
288	V	88.6	Confident	90.5	Very high	64 Å²	64	45.9 Å²	45.9	39%	0.388	28%	0.283	S	S	.	.			trans	-104.7	130.1	172.2	-176.9	0	0	0	0	108.5	G275 Q277	G275-V288 PolarHBondContact O-N 2.79Å; Q277-V288 HydrophobicContact CB-CG2 3.74Å; Q277-V288 VanDerWaalsContact CD-CG2 3.48Å; Q277-V288 HydrophobicContact CG-CG2 3.48Å; Q277-V288 VanDerWaalsContact CG-CG2 3.48Å
289	G	84.1	Confident	90.5	Very high	65 Å²	65	47.9 Å²	47.9	67%	0.67	29%	0.286	S	S	*	.	S	Bend	trans	131.3	-125.9	172.9	0	0	0	0	0	112.9
290	K	83.9	Confident	90.6	Very high	119 Å²	119	54.6 Å²	54.6	52%	0.517	31%	0.308	S	S	.	.	S	Bend	trans	-77.7	148	-178.5	-66.9	-179.6	-173.3	165.3	0	110.6	F329 H548	K290-F329 HydrophobicContact CD-CZ 4.31Å; K290-H548 PolarHBondContact O-CD2 3.2Å; K290-H548 VanDerWaalsContact O-CD2 3.28Å; K290-H548 PolarHBondContact O-NE2 3.17Å
291	E	86.8	Confident	90.8	Very high	59 Å²	59	49 Å²	49	28%	0.276	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-67.4	132.3	178.4	-64.1	179.5	-163.9	0	0	111.4	R309	E291-R309 VanDerWaalsContact CD-NE 3.33Å; E291-R309 IonicContact OE1-CZ 3.54Å; E291-R309 IonicContact OE1-NE 3.03Å; E291-R309 PolarHBondContact OE1-NE 2.87Å; E291-R309 IonicContact OE1-NH2 2.65Å; E291-R309 PolarHBondContact OE1-NH2 2.85Å; E291-R309 WeakPolarHBondContact OE2-CD 3.34Å; E291-R309 WeakPolarHBondContact OE2-CG 3.09Å; E291-R309 IonicContact OE2-NE 2.79Å; E291-R309 PolarHBondContact OE2-NE 2.95Å
292	P	93.3	Very high	91.1	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.039	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-70.1	144	177	31.2	-36.4	0	0	0	110.7	L307 F506 V546 H548	P292-L307 HydrophobicContact CB-CD1 4.09Å; P292-L307 HydrophobicContact CG-CB 4.29Å; P292-L307 HydrophobicContact CG-CD1 4.07Å; P292-L307 PolarHBondContact O-N 2.7Å; P292-F506 HydrophobicContact CB-CD1 3.94Å; P292-F506 HydrophobicContact CB-CE1 3.54Å; P292-F506 HydrophobicContact CB-CZ 3.95Å; P292-F506 HydrophobicContact CG-CD1 4.13Å; P292-F506 HydrophobicContact CG-CE1 3.62Å; P292-F506 HydrophobicContact CG-CZ 4.36Å; P292-V546 HydrophobicContact CB-CG1 4.42Å; P292-H548 HydrophobicContact CB-CB 4.35Å
293	C	94	Very high	91.6	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.1	179.4	-59.9	0	0	0	0	110.3	R304 L305 V546 Y547	C293-R304 HydrophobicContact CB-CG 4.04Å; C293-R304 PolarHBondContact SG-NE 3Å; C293-R304 PolarHBondContact SG-NH2 2.91Å; C293-L305 CarbonylContact C-O 3.5Å; C293-L305 VanDerWaalsContact CA-O 3.29Å; C293-L305 WeakPolarHBondContact CA-O 2.74Å; C293-V546 WeakPolarHBondContact O-CA 2.91Å; C293-Y547 PolarHBondContact O-N 3Å
294	L	96.6	Very high	91.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	135.7	165.5	-60.9	178	0	0	0	109.3	R304 L305 L307 T504 F511 I520 L534 V544 I545 V546	L294-R304 CarbonylContact O-C 3.55Å; L294-R304 VanDerWaalsContact O-CA 3.26Å; L294-R304 WeakPolarHBondContact O-CA 3.42Å; L294-L305 HydrophobicContact CB-CB 4.48Å; L294-L305 PolarHBondContact N-O 2.76Å; L294-L305 PolarHBondContact O-N 2.97Å; L294-L307 HydrophobicContact CD1-CD2 3.8Å; L294-L307 HydrophobicContact CD2-CD2 4.46Å; L294-L307 HydrophobicContact CG-CD2 3.77Å; L294-L307 HydrophobicContact CG-CG 4.3Å; L294-T504 HydrophobicContact CD2-CG2 4.13Å; L294-F511 HydrophobicContact CD1-CD1 4.43Å; L294-F511 HydrophobicContact CD1-CG 4.4Å; L294-F511 HydrophobicContact CD2-CB 4.45Å; L294-F511 HydrophobicContact CD2-CD2 4.14Å; L294-F511 HydrophobicContact CD2-CG 4.26Å; L294-I520 HydrophobicContact CD1-CG2 4.17Å; L294-L534 HydrophobicContact CD1-CD1 3.76Å; L294-V544 HydrophobicContact CB-CG2 4.25Å; L294-V544 HydrophobicContact CD2-CG2 4.19Å; L294-I545 WeakPolarHBondContact CA-O 3.48Å; L294-V546 HydrophobicContact CD2-CB 4.39Å; L294-V546 HydrophobicContact CD2-CG2 3.48Å; L294-V546 VanDerWaalsContact CD2-CG2 3.48Å
295	I	96.3	Very high	92.1	Very high	2 Å²	2	43 Å²	43	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128	167.3	-60.7	178.9	0	0	0	106.9	I302 R303 R304 I315 L325 I334 L349 V544 I545 Y547	I295-I302 HydrophobicContact CG2-CG2 3.64Å; I295-R303 VanDerWaalsContact CA-O 3.31Å; I295-R303 WeakPolarHBondContact CA-O 3.15Å; I295-R304 HydrophobicContact CG1-CB 4.45Å; I295-R304 HydrophobicContact CG1-CG 4.38Å; I295-I315 HydrophobicContact CD1-CD1 4.35Å; I295-I315 HydrophobicContact CG2-CD1 3.73Å; I295-L325 HydrophobicContact CB-CD1 4.46Å; I295-L325 HydrophobicContact CG2-CD1 4.06Å; I295-L325 HydrophobicContact CG2-CD2 4.3Å; I295-I334 HydrophobicContact CD1-CG2 4.48Å; I295-L349 HydrophobicContact CD1-CD1 4.36Å; I295-V544 WeakPolarHBondContact O-CA 3.28Å; I295-I545 HydrophobicContact CB-CG1 4.16Å; I295-I545 PolarHBondContact N-O 3.35Å; I295-I545 PolarHBondContact O-N 3.02Å; I295-Y547 HydrophobicContact CD1-CD1 4.45Å; I295-Y547 HydrophobicContact CD1-CD2 3.93Å; I295-Y547 HydrophobicContact CD1-CG 3.77Å
296	F	96.9	Very high	92.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.4	-173.9	62.1	-87.5	0	0	0	112.3	N298 I302 R303 L305 Y312 I520 L538 D543 V544	F296-N298 HydrophobicContact CE2-CB 4.4Å; F296-I302 WeakPolarHBondContact O-CA 3.19Å; F296-I302 WeakPolarHBondContact O-CG2 3.47Å; F296-R303 HydrophobicContact CD1-CB 4.47Å; F296-R303 HydrophobicContact CD2-CB 4.42Å; F296-R303 HydrophobicContact CE1-CB 3.89Å; F296-R303 HydrophobicContact CE2-CB 3.85Å; F296-R303 HydrophobicContact CE2-CG 4.38Å; F296-R303 HydrophobicContact CZ-CB 3.55Å; F296-R303 HydrophobicContact CZ-CG 4.38Å; F296-R303 PolarHBondContact N-O 3.28Å; F296-R303 PolarHBondContact O-N 2.9Å; F296-L305 HydrophobicContact CE1-CB 4.12Å; F296-Y312 HydrophobicContact CE1-CE2 4.33Å; F296-Y312 AromaticContact CZ-CE2 3.8Å; F296-Y312 HydrophobicContact CZ-CE2 3.8Å; F296-I520 HydrophobicContact CB-CD1 4.13Å; F296-I520 HydrophobicContact CD1-CD1 3.59Å; F296-I520 HydrophobicContact CD2-CD1 3.75Å; F296-I520 HydrophobicContact CE1-CD1 3.82Å; F296-I520 HydrophobicContact CE2-CD1 3.97Å; F296-I520 HydrophobicContact CG-CD1 3.55Å; F296-I520 HydrophobicContact CZ-CD1 4Å; F296-L538 HydrophobicContact CE2-CD1 4.14Å; F296-L538 HydrophobicContact CE2-CD2 3.92Å; F296-L538 HydrophobicContact CZ-CD2 4.37Å; F296-D543 CarbonylContact C-O 3.59Å; F296-D543 WeakPolarHBondContact CA-O 3.23Å; F296-D543 VanDerWaalsContact CB-O 3.26Å; F296-D543 WeakPolarHBondContact CB-O 3.46Å; F296-V544 HydrophobicContact CB-CB 4Å; F296-V544 HydrophobicContact CB-CG2 4Å
297	T	96.3	Very high	92	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	148.4	173.6	55.2	0	0	0	0	110.5	I302 A322 A323 L325 P541 Q542 D543	T297-I302 HydrophobicContact CG2-CG1 4.48Å; T297-A322 WeakPolarHBondContact CB-O 3.33Å; T297-A322 HydrophobicContact CG2-CB 3.93Å; T297-A323 PolarHBondContact OG1-O 3.39Å; T297-L325 HydrophobicContact CG2-CB 4.29Å; T297-L325 HydrophobicContact CG2-CD2 3.48Å; T297-L325 VanDerWaalsContact CG2-CD2 3.48Å; T297-L325 HydrophobicContact CG2-CG 4.31Å; T297-P541 WeakPolarHBondContact O-CA 3.48Å; T297-Q542 PolarHBondContact OG1-N 3.13Å; T297-D543 PolarHBondContact N-O 2.93Å; T297-D543 PolarHBondContact OG1-N 3.46Å
298	N	94.8	Very high	91.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.216	C	C	.	.			trans	-142.6	50.7	176	178.5	59.1	0	0	0	110.7	F296 R300 D301 R303 N539	F296-N298 HydrophobicContact CE2-CB 4.4Å; N298-R300 VanDerWaalsContact C-N 3.25Å; N298-R300 PolarHBondContact O-N 2.86Å; N298-D301 VanDerWaalsContact CB-OD1 3.27Å; N298-D301 WeakPolarHBondContact CB-OD1 3.41Å; N298-D301 PolarHBondContact N-O 2.89Å; N298-D301 PolarHBondContact ND2-OD1 2.84Å; N298-D301 VanDerWaalsContact O-OD1 3.12Å; N298-R303 PolarHBondContact ND2-NH1 3.32Å; N298-R303 PolarHBondContact ND2-NH2 2.83Å; N298-N539 PolarHBondContact OD1-N 3.34Å
299	R	91	Very high	91.3	Very high	126 Å²	126	50 Å²	50	48%	0.475	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	63.6	-64.8	-176.6	-153.6	173.5	173.7	-178.4	1.1	115.7	N321 A322 D540	R299-N321 CarbonylContact O-C 3.51Å; R299-N321 VanDerWaalsContact O-CA 3.27Å; R299-N321 WeakPolarHBondContact O-CA 3.05Å; R299-A322 PolarHBondContact O-N 3.29Å; R299-D540 HydrophobicContact CB-CB 4.01Å; R299-D540 HydrophobicContact CG-CB 4.32Å; R299-D540 PolarHBondContact N-O 3.31Å
300	R	90.4	Very high	91.3	Very high	175 Å²	175	54.5 Å²	54.5	66%	0.66	23%	0.228	S	C	*	.	S	Bend	trans	-103.5	-9.2	-173.2	-67.8	-169.8	176.3	-179.6	0.8	113.7	N298 Q318 Q319	N298-R300 VanDerWaalsContact C-N 3.25Å; N298-R300 PolarHBondContact O-N 2.86Å; R300-Q318 PolarHBondContact O-N 3.41Å; R300-Q319 WeakPolarHBondContact CA-O 3.44Å; R300-Q319 WeakPolarHBondContact O-CB 3.39Å; R300-Q319 PolarHBondContact O-N 3.19Å
301	D	91.7	Very high	91.4	Very high	11 Å²	11	53.6 Å²	53.6	6%	0.059	23%	0.226	C	C	.	.			trans	-145.8	164.4	-179.3	58.2	-13.8	0	0	0	111.1	N298 R303 Q314 V316	N298-D301 VanDerWaalsContact CB-OD1 3.27Å; N298-D301 WeakPolarHBondContact CB-OD1 3.41Å; N298-D301 PolarHBondContact N-O 2.89Å; N298-D301 PolarHBondContact ND2-OD1 2.84Å; N298-D301 VanDerWaalsContact O-OD1 3.12Å; D301-R303 IonicContact OD1-NE 2.63Å; D301-R303 IonicContact OD1-NH2 2.78Å; D301-R303 IonicContact OD2-CZ 3.36Å; D301-R303 VanDerWaalsContact OD2-CZ 3.24Å; D301-R303 IonicContact OD2-NE 3.18Å; D301-R303 PolarHBondContact OD2-NE 3.24Å; D301-R303 IonicContact OD2-NH2 2.68Å; D301-R303 PolarHBondContact OD2-NH2 3.36Å; D301-Q314 HydrophobicContact CB-CG 4.04Å; D301-Q314 PolarHBondContact OD2-OE1 2.92Å; D301-V316 VanDerWaalsContact CA-O 3.28Å; D301-V316 WeakPolarHBondContact CA-O 3.39Å; D301-V316 WeakPolarHBondContact CB-O 3.34Å
302	I	93.8	Very high	91.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.9	168.8	-54.7	177.6	0	0	0	107	I295 F296 T297 I315 V316 A322 L325 W336	I295-I302 HydrophobicContact CG2-CG2 3.64Å; F296-I302 WeakPolarHBondContact O-CA 3.19Å; F296-I302 WeakPolarHBondContact O-CG2 3.47Å; T297-I302 HydrophobicContact CG2-CG1 4.48Å; I302-I315 HydrophobicContact CB-CD1 4.47Å; I302-I315 HydrophobicContact CB-CG1 4.09Å; I302-I315 HydrophobicContact CG2-CD1 3.81Å; I302-I315 HydrophobicContact CG2-CG1 3.92Å; I302-I315 WeakPolarHBondContact O-CG1 3.34Å; I302-I315 PolarHBondContact O-N 3.18Å; I302-V316 HydrophobicContact CB-CB 4Å; I302-V316 HydrophobicContact CB-CG2 4.36Å; I302-V316 HydrophobicContact CD1-CB 4.17Å; I302-V316 HydrophobicContact CD1-CG2 4.25Å; I302-V316 HydrophobicContact CG1-CB 4.16Å; I302-V316 PolarHBondContact N-O 2.77Å; I302-V316 PolarHBondContact O-N 3.13Å; I302-A322 HydrophobicContact CG1-CB 4.33Å; I302-L325 HydrophobicContact CG2-CD2 4.17Å; I302-W336 HydrophobicContact CD1-CB 3.72Å; I302-W336 HydrophobicContact CD1-CD2 3.92Å; I302-W336 HydrophobicContact CD1-CE3 4.46Å; I302-W336 HydrophobicContact CD1-CG 3.58Å
303	R	93.4	Very high	91.3	Very high	48 Å²	48	58.4 Å²	58.4	18%	0.181	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.8	-173.2	-61.5	-173.8	178.4	175	-7.2	111.3	I295 F296 N298 D301 Y312 T313	I295-R303 VanDerWaalsContact CA-O 3.31Å; I295-R303 WeakPolarHBondContact CA-O 3.15Å; F296-R303 HydrophobicContact CD1-CB 4.47Å; F296-R303 HydrophobicContact CD2-CB 4.42Å; F296-R303 HydrophobicContact CE1-CB 3.89Å; F296-R303 HydrophobicContact CE2-CB 3.85Å; F296-R303 HydrophobicContact CE2-CG 4.38Å; F296-R303 HydrophobicContact CZ-CB 3.55Å; F296-R303 HydrophobicContact CZ-CG 4.38Å; F296-R303 PolarHBondContact N-O 3.28Å; F296-R303 PolarHBondContact O-N 2.9Å; N298-R303 PolarHBondContact ND2-NH1 3.32Å; N298-R303 PolarHBondContact ND2-NH2 2.83Å; D301-R303 IonicContact OD1-NE 2.63Å; D301-R303 IonicContact OD1-NH2 2.78Å; D301-R303 IonicContact OD2-CZ 3.36Å; D301-R303 VanDerWaalsContact OD2-CZ 3.24Å; D301-R303 IonicContact OD2-NE 3.18Å; D301-R303 PolarHBondContact OD2-NE 3.24Å; D301-R303 IonicContact OD2-NH2 2.68Å; D301-R303 PolarHBondContact OD2-NH2 3.36Å; R303-Y312 WeakPolarHBondContact CD-OH 3.01Å; R303-Y312 PolarHBondContact NH1-OH 2.68Å; R303-T313 CarbonylContact C-O 3.4Å; R303-T313 WeakPolarHBondContact CA-O 3.48Å
304	R	92.9	Very high	91	Very high	94 Å²	94	62.3 Å²	62.3	36%	0.355	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.7	176	178.2	-177.1	173	-158.2	-5.5	109.4	C293 L294 I295 Y312 T313 I315	C293-R304 HydrophobicContact CB-CG 4.04Å; C293-R304 PolarHBondContact SG-NE 3Å; C293-R304 PolarHBondContact SG-NH2 2.91Å; L294-R304 CarbonylContact O-C 3.55Å; L294-R304 VanDerWaalsContact O-CA 3.26Å; L294-R304 WeakPolarHBondContact O-CA 3.42Å; I295-R304 HydrophobicContact CG1-CB 4.45Å; I295-R304 HydrophobicContact CG1-CG 4.38Å; R304-Y312 WeakPolarHBondContact O-CA 3.25Å; R304-T313 PolarHBondContact N-O 3.14Å; R304-T313 PolarHBondContact O-N 3.02Å; R304-I315 HydrophobicContact CB-CG2 3.94Å
305	L	94.1	Very high	90.6	Very high	11 Å²	11	64 Å²	64	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	117.7	175	172	64.5	0	0	0	109.8	C293 L294 F296 E311 Y312 L534 A535	C293-L305 CarbonylContact C-O 3.5Å; C293-L305 VanDerWaalsContact CA-O 3.29Å; C293-L305 WeakPolarHBondContact CA-O 2.74Å; L294-L305 HydrophobicContact CB-CB 4.48Å; L294-L305 PolarHBondContact N-O 2.76Å; L294-L305 PolarHBondContact O-N 2.97Å; F296-L305 HydrophobicContact CE1-CB 4.12Å; L305-E311 CarbonylContact C-O 3.55Å; L305-E311 VanDerWaalsContact CA-O 3.31Å; L305-E311 WeakPolarHBondContact CA-O 3.18Å; L305-Y312 HydrophobicContact CB-CD2 4.27Å; L305-Y312 HydrophobicContact CD1-CD2 4.01Å; L305-L534 HydrophobicContact CD2-CB 4.03Å; L305-A535 HydrophobicContact CD2-CB 4.48Å
306	G	92.4	Very high	90.1	Very high	4 Å²	4	64 Å²	64	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.3	171.8	0	0	0	0	0	111.7	K310 E311	G306-K310 WeakPolarHBondContact O-CA 3.31Å; G306-K310 PolarHBondContact O-N 3.28Å; G306-E311 PolarHBondContact N-O 2.73Å
307	L	89.7	Confident	89.4	Confident	40 Å²	40	68.5 Å²	68.5	21%	0.209	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-28.5	-176.6	-70	178.1	0	0	0	113.4	P292 L294 F511 L534	P292-L307 HydrophobicContact CB-CD1 4.09Å; P292-L307 HydrophobicContact CG-CB 4.29Å; P292-L307 HydrophobicContact CG-CD1 4.07Å; P292-L307 PolarHBondContact O-N 2.7Å; L294-L307 HydrophobicContact CD1-CD2 3.8Å; L294-L307 HydrophobicContact CD2-CD2 4.46Å; L294-L307 HydrophobicContact CG-CD2 3.77Å; L294-L307 HydrophobicContact CG-CG 4.3Å; L307-F511 HydrophobicContact CD1-CE2 4.11Å; L307-F511 HydrophobicContact CD1-CZ 3.9Å; L307-F511 HydrophobicContact CD2-CE1 4.15Å; L307-F511 HydrophobicContact CD2-CZ 4.15Å; L307-L534 HydrophobicContact CD2-CD1 4.24Å
308	E	84.1	Confident	88.7	Confident	123 Å²	123	76.8 Å²	76.8	58%	0.575	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-61.1	-179.6	-64.4	-178.5	-163.7	0	0	111.7	K310	E308-K310 VanDerWaalsContact C-N 3.26Å; E308-K310 PolarHBondContact O-N 3.18Å
309	R	80.4	Confident	88.3	Confident	163 Å²	163	77.2 Å²	77.2	62%	0.615	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.3	-178.5	-68.6	177	-170	-139.2	-1.9	114.8	E291 E311	E291-R309 VanDerWaalsContact CD-NE 3.33Å; E291-R309 IonicContact OE1-CZ 3.54Å; E291-R309 IonicContact OE1-NE 3.03Å; E291-R309 PolarHBondContact OE1-NE 2.87Å; E291-R309 IonicContact OE1-NH2 2.65Å; E291-R309 PolarHBondContact OE1-NH2 2.85Å; E291-R309 WeakPolarHBondContact OE2-CD 3.34Å; E291-R309 WeakPolarHBondContact OE2-CG 3.09Å; E291-R309 IonicContact OE2-NE 2.79Å; E291-R309 PolarHBondContact OE2-NE 2.95Å; R309-E311 HydrophobicContact CB-CG 3.86Å; R309-E311 VanDerWaalsContact CD-OE1 3.32Å; R309-E311 WeakPolarHBondContact CD-OE1 3.3Å; R309-E311 PolarHBondContact O-N 2.76Å; R309-E311 VanDerWaalsContact O-N 3.15Å
310	K	84.9	Confident	88.1	Confident	159 Å²	159	79.8 Å²	79.8	69%	0.691	35%	0.346	S	S	*	.			trans	53	31.8	-173.9	-57.4	-173.6	177.6	-173.4	0	112.9	G306 E308 Y312	G306-K310 WeakPolarHBondContact O-CA 3.31Å; G306-K310 PolarHBondContact O-N 3.28Å; E308-K310 VanDerWaalsContact C-N 3.26Å; E308-K310 PolarHBondContact O-N 3.18Å; K310-Y312 PolarHBondContact O-N 2.01Å
311	E	85.3	Confident	88.1	Confident	100 Å²	100	73.5 Å²	73.5	47%	0.467	33%	0.326	S	S	.	.			trans	-67.4	121.1	173.9	-74.1	179	-170.8	0	0	109.2	L305 G306 R309	L305-E311 CarbonylContact C-O 3.55Å; L305-E311 VanDerWaalsContact CA-O 3.31Å; L305-E311 WeakPolarHBondContact CA-O 3.18Å; G306-E311 PolarHBondContact N-O 2.73Å; R309-E311 HydrophobicContact CB-CG 3.86Å; R309-E311 VanDerWaalsContact CD-OE1 3.32Å; R309-E311 WeakPolarHBondContact CD-OE1 3.3Å; R309-E311 PolarHBondContact O-N 2.76Å; R309-E311 VanDerWaalsContact O-N 3.15Å
312	Y	89.3	Confident	88.2	Confident	103 Å²	103	73 Å²	73	40%	0.404	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115.2	-176.5	-169.4	-91.9	0	0	0	110.1	F296 R303 R304 L305 K310	F296-Y312 HydrophobicContact CE1-CE2 4.33Å; F296-Y312 AromaticContact CZ-CE2 3.8Å; F296-Y312 HydrophobicContact CZ-CE2 3.8Å; R303-Y312 WeakPolarHBondContact CD-OH 3.01Å; R303-Y312 PolarHBondContact NH1-OH 2.68Å; R304-Y312 WeakPolarHBondContact O-CA 3.25Å; L305-Y312 HydrophobicContact CB-CD2 4.27Å; L305-Y312 HydrophobicContact CD1-CD2 4.01Å; K310-Y312 PolarHBondContact O-N 2.01Å
313	T	88.4	Confident	88.2	Confident	62 Å²	62	73.1 Å²	73.1	38%	0.38	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.2	-176	63.1	0	0	0	0	112.4	R303 R304	R303-T313 CarbonylContact C-O 3.4Å; R303-T313 WeakPolarHBondContact CA-O 3.48Å; R304-T313 PolarHBondContact N-O 3.14Å; R304-T313 PolarHBondContact O-N 3.02Å
314	Q	87.8	Confident	88.4	Confident	86 Å²	86	70.8 Å²	70.8	40%	0.402	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.3	171.2	-170.6	171.8	-63.1	0	0	108.5	D301 E317	D301-Q314 HydrophobicContact CB-CG 4.04Å; D301-Q314 PolarHBondContact OD2-OE1 2.92Å; Q314-E317 HydrophobicContact CG-CG 4.33Å; Q314-E317 PolarHBondContact NE2-OE1 2.78Å
315	I	88.1	Confident	88.5	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.179	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	-30.5	-174	58.4	167	0	0	0	113.5	I295 I302 R304 I334 L349	I295-I315 HydrophobicContact CD1-CD1 4.35Å; I295-I315 HydrophobicContact CG2-CD1 3.73Å; I302-I315 HydrophobicContact CB-CD1 4.47Å; I302-I315 HydrophobicContact CB-CG1 4.09Å; I302-I315 HydrophobicContact CG2-CD1 3.81Å; I302-I315 HydrophobicContact CG2-CG1 3.92Å; I302-I315 WeakPolarHBondContact O-CG1 3.34Å; I302-I315 PolarHBondContact O-N 3.18Å; R304-I315 HydrophobicContact CB-CG2 3.94Å; I315-I334 HydrophobicContact CD1-CD1 3.98Å; I315-L349 HydrophobicContact CD1-CD2 4.18Å
316	V	85.9	Confident	88.7	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.1	175.8	-178.7	0	0	0	0	108.1	D301 I302 Q319 I334 W336 T347	D301-V316 VanDerWaalsContact CA-O 3.28Å; D301-V316 WeakPolarHBondContact CA-O 3.39Å; D301-V316 WeakPolarHBondContact CB-O 3.34Å; I302-V316 HydrophobicContact CB-CB 4Å; I302-V316 HydrophobicContact CB-CG2 4.36Å; I302-V316 HydrophobicContact CD1-CB 4.17Å; I302-V316 HydrophobicContact CD1-CG2 4.25Å; I302-V316 HydrophobicContact CG1-CB 4.16Å; I302-V316 PolarHBondContact N-O 2.77Å; I302-V316 PolarHBondContact O-N 3.13Å; V316-Q319 HydrophobicContact CG1-CG 4.05Å; V316-Q319 VanDerWaalsContact CG1-NE2 3.3Å; V316-I334 HydrophobicContact CG2-CD1 3.72Å; V316-W336 HydrophobicContact CG1-CH2 4.33Å; V316-W336 HydrophobicContact CG1-CZ2 3.93Å; V316-T347 HydrophobicContact CG2-CG2 4.33Å
317	E	83.8	Confident	88.8	Confident	95 Å²	95	67.3 Å²	67.3	44%	0.444	30%	0.303	S	S	.	.			trans	-111.2	167.4	-176	-40.3	-158.8	141.4	0	0	112	Q314 Q319	Q314-E317 HydrophobicContact CG-CG 4.33Å; Q314-E317 PolarHBondContact NE2-OE1 2.78Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.48Å; E317-Q319 PolarHBondContact O-NE2 2.83Å
318	Q	81	Confident	89.1	Confident	175 Å²	175	65.4 Å²	65.4	82%	0.818	29%	0.293	S	S	*	.			trans	57.6	35.9	167.3	-54.6	-178.1	5.2	0	0	114.9	R300	R300-Q318 PolarHBondContact O-N 3.41Å
319	Q	85.8	Confident	89.5	Confident	9 Å²	9	61 Å²	61	4%	0.042	27%	0.272	C	S	.	.			trans	-76.4	151.4	171.6	-55.8	-53.1	-63	0	0	110.6	R300 V316 E317 A322 D338	R300-Q319 WeakPolarHBondContact CA-O 3.44Å; R300-Q319 WeakPolarHBondContact O-CB 3.39Å; R300-Q319 PolarHBondContact O-N 3.19Å; V316-Q319 HydrophobicContact CG1-CG 4.05Å; V316-Q319 VanDerWaalsContact CG1-NE2 3.3Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.48Å; E317-Q319 PolarHBondContact O-NE2 2.83Å; Q319-A322 HydrophobicContact CB-CB 4.16Å; Q319-A322 HydrophobicContact CG-CB 4.3Å; Q319-D338 PolarHBondContact OE1-OD2 2.85Å
320	R	86.7	Confident	89.9	Confident	181 Å²	181	59.6 Å²	59.6	68%	0.683	28%	0.277	S	S	*	.	S	Bend	trans	-80.1	-52.1	174.8	-68.6	-168.3	174.7	-133.4	-3.4	110.3	D338 Q341	R320-D338 PolarHBondContact N-OD2 3.29Å; R320-Q341 HydrophobicContact CB-CG 4.33Å; R320-Q341 HydrophobicContact CG-CG 3.97Å
321	N	91.8	Very high	90.1	Very high	42 Å²	42	56.2 Å²	56.2	23%	0.225	26%	0.264	C	S	.	.			trans	-157.9	87.6	174.1	-168.2	12.6	0	0	0	111.2	R299 A323 D338 L339	R299-N321 CarbonylContact O-C 3.51Å; R299-N321 VanDerWaalsContact O-CA 3.27Å; R299-N321 WeakPolarHBondContact O-CA 3.05Å; N321-A323 PolarHBondContact O-N 2.98Å; N321-D338 PolarHBondContact N-OD1 3.37Å; N321-D338 VanDerWaalsContact N-OD1 3.15Å; N321-D338 CarbonylContact O-C 3.59Å; N321-D338 WeakPolarHBondContact O-CA 3.06Å; N321-L339 HydrophobicContact CB-CB 4.2Å; N321-L339 PolarHBondContact O-N 2.84Å
322	A	93.7	Very high	90.4	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.6	176.3	0	0	0	0	0	110.3	T297 R299 I302 Q319 A337	T297-A322 WeakPolarHBondContact CB-O 3.33Å; T297-A322 HydrophobicContact CG2-CB 3.93Å; R299-A322 PolarHBondContact O-N 3.29Å; I302-A322 HydrophobicContact CG1-CB 4.33Å; Q319-A322 HydrophobicContact CB-CB 4.16Å; Q319-A322 HydrophobicContact CG-CB 4.3Å; A322-A337 WeakPolarHBondContact CA-O 3.28Å
323	A	93.4	Very high	90.5	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-64.4	-175.5	0	0	0	0	0	112.4	T297 N321 A337 L339 Q542 D543	T297-A323 PolarHBondContact OG1-O 3.39Å; N321-A323 PolarHBondContact O-N 2.98Å; A323-A337 PolarHBondContact N-O 2.93Å; A323-L339 HydrophobicContact CB-CD1 3.6Å; A323-L339 HydrophobicContact CB-CD2 4Å; A323-L339 HydrophobicContact CB-CG 3.58Å; A323-Q542 VanDerWaalsContact O-CB 3.3Å; A323-Q542 WeakPolarHBondContact O-CB 3.35Å; A323-D543 WeakPolarHBondContact O-CB 3.3Å
324	A	96.1	Very high	90.7	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	150.8	-177.1	0	0	0	0	0	112.1	W336 A337 L369 I371 D543	A324-W336 CarbonylContact O-C 3.5Å; A324-W336 VanDerWaalsContact O-CA 3.23Å; A324-W336 WeakPolarHBondContact O-CA 3.36Å; A324-A337 HydrophobicContact CB-CB 4.3Å; A324-A337 PolarHBondContact O-N 3.17Å; A324-L369 WeakPolarHBondContact CB-O 3.43Å; A324-I371 HydrophobicContact CB-CB 4.37Å; A324-I371 HydrophobicContact CB-CD1 4.25Å; A324-I371 HydrophobicContact CB-CG1 4.02Å; A324-D543 WeakPolarHBondContact CA-OD2 3.31Å
325	L	96.4	Very high	91.1	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	149	178.2	75.4	90.3	0	0	0	112.4	I295 T297 I302 F335 W336 D543 I545	I295-L325 HydrophobicContact CB-CD1 4.46Å; I295-L325 HydrophobicContact CG2-CD1 4.06Å; I295-L325 HydrophobicContact CG2-CD2 4.3Å; T297-L325 HydrophobicContact CG2-CB 4.29Å; T297-L325 HydrophobicContact CG2-CD2 3.48Å; T297-L325 VanDerWaalsContact CG2-CD2 3.48Å; T297-L325 HydrophobicContact CG2-CG 4.31Å; I302-L325 HydrophobicContact CG2-CD2 4.17Å; L325-F335 VanDerWaalsContact CA-O 3.26Å; L325-F335 WeakPolarHBondContact CA-O 3.44Å; L325-W336 HydrophobicContact CB-CB 4.17Å; L325-D543 HydrophobicContact CG-CB 4.47Å; L325-D543 PolarHBondContact N-OD2 3.21Å; L325-I545 HydrophobicContact CD1-CB 4.12Å; L325-I545 HydrophobicContact CD1-CD1 3.57Å; L325-I545 HydrophobicContact CD1-CG1 3.55Å; L325-I545 HydrophobicContact CD1-CG2 3.65Å; L325-I545 HydrophobicContact CG-CG2 4.46Å; L325-I545 WeakPolarHBondContact O-CG2 3.28Å
326	D	97.6	Very high	91.5	Very high	28 Å²	28	42.5 Å²	42.5	15%	0.15	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	169.4	167.9	-166.5	9.5	0	0	0	109.6	F335 I371 A372 V373	D326-F335 PolarHBondContact N-O 2.82Å; D326-F335 PolarHBondContact O-N 2.7Å; D326-F335 VanDerWaalsContact O-O 3.1Å; D326-I371 HydrophobicContact CB-CG2 4.23Å; D326-A372 WeakPolarHBondContact OD2-CA 3.34Å; D326-V373 HydrophobicContact CB-CB 4.41Å; D326-V373 HydrophobicContact CB-CG2 3.8Å; D326-V373 WeakPolarHBondContact OD2-CB 3.19Å; D326-V373 PolarHBondContact OD2-N 2.72Å
327	A	95.8	Very high	92	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.017	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.8	-171.6	0	0	0	0	0	113.5	T333 I334 I545 Y547 Q552	A327-T333 CarbonylContact C-O 3.39Å; A327-T333 WeakPolarHBondContact CA-O 3.13Å; A327-I334 HydrophobicContact CB-CG2 3.98Å; A327-I545 HydrophobicContact CB-CD1 3.69Å; A327-Y547 HydrophobicContact CB-CD2 3.89Å; A327-Y547 HydrophobicContact CB-CE2 3.96Å; A327-Q552 PolarHBondContact O-NE2 3.13Å
328	D	95.4	Very high	92.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	109	161.1	178.9	-12.3	0	0	0	108	N330 Q331 Q332 T333 V373 K378 F395	D328-N330 PolarHBondContact OD1-N 3.09Å; D328-Q331 HydrophobicContact CB-CB 4.33Å; D328-Q331 PolarHBondContact OD1-N 3.01Å; D328-Q331 VanDerWaalsContact OD1-N 3.15Å; D328-Q331 VanDerWaalsContact OD2-CG 3.31Å; D328-Q331 WeakPolarHBondContact OD2-CG 3.26Å; D328-Q331 PolarHBondContact OD2-OE1 2.84Å; D328-Q332 CarbonylContact O-C 3.52Å; D328-Q332 WeakPolarHBondContact O-CA 3.43Å; D328-Q332 PolarHBondContact O-N 3.14Å; D328-T333 PolarHBondContact N-O 3.34Å; D328-T333 PolarHBondContact O-N 3.5Å; D328-V373 HydrophobicContact CB-CG1 4.19Å; D328-K378 IonicContact OD1-NZ 3.59Å; D328-K378 IonicContact OD2-NZ 2.65Å; D328-K378 PolarHBondContact OD2-NZ 2.96Å; D328-F395 HydrophobicContact CB-CE2 4.28Å; D328-F395 HydrophobicContact CB-CZ 4.44Å; D328-F395 WeakPolarHBondContact OD2-CE2 3.42Å
329	F	92.2	Very high	93.1	Very high	30 Å²	30	31.4 Å²	31.4	13%	0.132	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-40.2	-177.3	-176.9	-87.1	0	0	0	111.9	K290 Q331 Q332 Y547 E549	K290-F329 HydrophobicContact CD-CZ 4.31Å; F329-Q331 VanDerWaalsContact C-N 3.32Å; F329-Q331 PolarHBondContact O-N 2Å; F329-Q332 PolarHBondContact O-N 2.97Å; F329-Q332 VanDerWaalsContact O-N 3.08Å; F329-Y547 HydrophobicContact CB-CE2 4.48Å; F329-Y547 HydrophobicContact CD2-CD1 4.13Å; F329-Y547 HydrophobicContact CD2-CD2 4.35Å; F329-Y547 AromaticContact CD2-CE1 3.68Å; F329-Y547 HydrophobicContact CD2-CE1 3.68Å; F329-Y547 AromaticContact CD2-CE2 3.93Å; F329-Y547 HydrophobicContact CD2-CE2 3.93Å; F329-Y547 HydrophobicContact CD2-CG 4.45Å; F329-Y547 AromaticContact CD2-CZ 3.57Å; F329-Y547 HydrophobicContact CE2-CD1 4.19Å; F329-Y547 AromaticContact CE2-CE1 3.72Å; F329-Y547 HydrophobicContact CE2-CE1 3.72Å; F329-E549 HydrophobicContact CD1-CB 3.7Å; F329-E549 HydrophobicContact CE1-CB 3.29Å; F329-E549 HydrophobicContact CE2-CB 4.29Å; F329-E549 HydrophobicContact CG-CB 4.37Å; F329-E549 HydrophobicContact CZ-CB 3.61Å
330	N	89.6	Confident	93.2	Very high	134 Å²	134	33 Å²	33	72%	0.717	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-33.7	-176.2	-174.7	61.1	0	0	0	111.8	D328	D328-N330 PolarHBondContact OD1-N 3.09Å
331	Q	89.1	Confident	93.4	Very high	88 Å²	88	27.5 Å²	27.5	41%	0.411	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	0.2	172.4	-65.5	-171.1	-12.6	0	0	113.4	D328 F329 T333	D328-Q331 HydrophobicContact CB-CB 4.33Å; D328-Q331 PolarHBondContact OD1-N 3.01Å; D328-Q331 VanDerWaalsContact OD1-N 3.15Å; D328-Q331 VanDerWaalsContact OD2-CG 3.31Å; D328-Q331 WeakPolarHBondContact OD2-CG 3.26Å; D328-Q331 PolarHBondContact OD2-OE1 2.84Å; F329-Q331 VanDerWaalsContact C-N 3.32Å; F329-Q331 PolarHBondContact O-N 2Å; Q331-T333 PolarHBondContact O-N 2.91Å; Q331-T333 VanDerWaalsContact O-N 3.13Å; Q331-T333 PolarHBondContact O-OG1 3.17Å
332	Q	90	Very high	93.5	Very high	74 Å²	74	31.2 Å²	31.2	35%	0.346	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	36.5	-173.9	-50.6	-171.1	-93.4	0	0	112.7	D328 F329 L349	D328-Q332 CarbonylContact O-C 3.52Å; D328-Q332 WeakPolarHBondContact O-CA 3.43Å; D328-Q332 PolarHBondContact O-N 3.14Å; F329-Q332 PolarHBondContact O-N 2.97Å; F329-Q332 VanDerWaalsContact O-N 3.08Å; Q332-L349 WeakPolarHBondContact O-CB 3.17Å; Q332-L349 PolarHBondContact O-N 3Å
333	T	91.7	Very high	93.5	Very high	15 Å²	15	31.2 Å²	31.2	9%	0.092	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.8	-173.6	-60.3	0	0	0	0	109.3	A327 D328 Q331 F335 T347	A327-T333 CarbonylContact C-O 3.39Å; A327-T333 WeakPolarHBondContact CA-O 3.13Å; D328-T333 PolarHBondContact N-O 3.34Å; D328-T333 PolarHBondContact O-N 3.5Å; Q331-T333 PolarHBondContact O-N 2.91Å; Q331-T333 VanDerWaalsContact O-N 3.13Å; Q331-T333 PolarHBondContact O-OG1 3.17Å; T333-F335 HydrophobicContact CG2-CD2 4.34Å; T333-F335 HydrophobicContact CG2-CE1 4.46Å; T333-F335 HydrophobicContact CG2-CE2 3.7Å; T333-F335 HydrophobicContact CG2-CZ 3.77Å; T333-T347 CarbonylContact C-O 3.53Å; T333-T347 WeakPolarHBondContact CA-O 3.19Å; T333-T347 WeakPolarHBondContact CG2-O 3.21Å
334	I	93.7	Very high	93.7	Very high	5 Å²	5	31 Å²	31	3%	0.026	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.2	172	59.8	166.5	0	0	0	109.9	I295 I315 V316 A327 W336 S346 T347 L349	I295-I334 HydrophobicContact CD1-CG2 4.48Å; I315-I334 HydrophobicContact CD1-CD1 3.98Å; V316-I334 HydrophobicContact CG2-CD1 3.72Å; A327-I334 HydrophobicContact CB-CG2 3.98Å; I334-W336 HydrophobicContact CD1-CE3 4.33Å; I334-W336 HydrophobicContact CD1-CZ3 4.38Å; I334-W336 HydrophobicContact CG1-CE3 4.31Å; I334-W336 HydrophobicContact CG1-CZ3 4.27Å; I334-S346 CarbonylContact O-C 3.59Å; I334-S346 WeakPolarHBondContact O-CA 3.19Å; I334-T347 HydrophobicContact CD1-CG2 3.78Å; I334-T347 HydrophobicContact CG1-CG2 3.56Å; I334-T347 PolarHBondContact N-O 3.08Å; I334-T347 PolarHBondContact O-N 2.93Å; I334-L349 HydrophobicContact CD1-CD2 4.07Å; I334-L349 HydrophobicContact CG1-CD2 4.3Å; I334-L349 HydrophobicContact CG1-CG 4.43Å; I334-L349 HydrophobicContact CG2-CD1 3.52Å; I334-L349 HydrophobicContact CG2-CD2 4.23Å; I334-L349 HydrophobicContact CG2-CG 3.86Å
335	F	95.8	Very high	93.6	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.9	174.8	-63.6	-92	0	0	0	108.7	L325 D326 T333 Y345 S346 V361 V373 L380 F395	L325-F335 VanDerWaalsContact CA-O 3.26Å; L325-F335 WeakPolarHBondContact CA-O 3.44Å; D326-F335 PolarHBondContact N-O 2.82Å; D326-F335 PolarHBondContact O-N 2.7Å; D326-F335 VanDerWaalsContact O-O 3.1Å; T333-F335 HydrophobicContact CG2-CD2 4.34Å; T333-F335 HydrophobicContact CG2-CE1 4.46Å; T333-F335 HydrophobicContact CG2-CE2 3.7Å; T333-F335 HydrophobicContact CG2-CZ 3.77Å; F335-Y345 VanDerWaalsContact CA-O 3.29Å; F335-Y345 WeakPolarHBondContact CA-O 3.05Å; F335-S346 VanDerWaalsContact CE1-CB 3.49Å; F335-V361 HydrophobicContact CD1-CG2 4.47Å; F335-V361 HydrophobicContact CE1-CG2 4.27Å; F335-V373 HydrophobicContact CB-CG2 4.44Å; F335-V373 HydrophobicContact CD2-CG2 3.7Å; F335-V373 HydrophobicContact CE2-CG2 4.31Å; F335-V373 HydrophobicContact CG-CG2 4.29Å; F335-L380 HydrophobicContact CB-CD1 4.28Å; F335-L380 HydrophobicContact CD1-CD1 4.35Å; F335-L380 HydrophobicContact CG-CD1 4.19Å; F335-F395 HydrophobicContact CE2-CD2 4.47Å; F335-F395 HydrophobicContact CE2-CE2 4.24Å; F335-F395 HydrophobicContact CE2-CZ 4.31Å; F335-F395 HydrophobicContact CZ-CB 4.47Å; F335-F395 HydrophobicContact CZ-CD1 4.23Å; F335-F395 AromaticContact CZ-CD2 3.92Å; F335-F395 HydrophobicContact CZ-CD2 3.92Å; F335-F395 HydrophobicContact CZ-CE1 4.45Å; F335-F395 HydrophobicContact CZ-CE2 4.15Å; F335-F395 AromaticContact CZ-CG 3.97Å; F335-F395 HydrophobicContact CZ-CG 3.97Å; F335-F395 HydrophobicContact CZ-CZ 4.43Å
336	W	96.2	Very high	93.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	149.9	176.1	72.9	98.8	0	0	0	112.2	I302 V316 A324 L325 I334 I344 Y345 T347 H358	I302-W336 HydrophobicContact CD1-CB 3.72Å; I302-W336 HydrophobicContact CD1-CD2 3.92Å; I302-W336 HydrophobicContact CD1-CE3 4.46Å; I302-W336 HydrophobicContact CD1-CG 3.58Å; V316-W336 HydrophobicContact CG1-CH2 4.33Å; V316-W336 HydrophobicContact CG1-CZ2 3.93Å; A324-W336 CarbonylContact O-C 3.5Å; A324-W336 VanDerWaalsContact O-CA 3.23Å; A324-W336 WeakPolarHBondContact O-CA 3.36Å; L325-W336 HydrophobicContact CB-CB 4.17Å; I334-W336 HydrophobicContact CD1-CE3 4.33Å; I334-W336 HydrophobicContact CD1-CZ3 4.38Å; I334-W336 HydrophobicContact CG1-CE3 4.31Å; I334-W336 HydrophobicContact CG1-CZ3 4.27Å; W336-I344 CarbonylContact O-C 3.44Å; W336-I344 WeakPolarHBondContact O-CA 3.01Å; W336-I344 WeakPolarHBondContact O-CG2 3.4Å; W336-Y345 VanDerWaalsContact CE2-CB 3.41Å; W336-Y345 HydrophobicContact CZ2-CG 4.04Å; W336-Y345 PolarHBondContact N-O 3.25Å; W336-Y345 PolarHBondContact O-N 3.26Å; W336-T347 HydrophobicContact CH2-CG2 4.11Å; W336-T347 HydrophobicContact CZ3-CG2 3.75Å; W336-H358 HydrophobicContact CH2-CB 4.44Å; W336-H358 AromaticContact CH2-CD2 3.96Å
337	A	96.1	Very high	93.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	128	172.8	0	0	0	0	0	110.2	A322 A323 A324 P368 I371	A322-A337 WeakPolarHBondContact CA-O 3.28Å; A323-A337 PolarHBondContact N-O 2.93Å; A324-A337 HydrophobicContact CB-CB 4.3Å; A324-A337 PolarHBondContact O-N 3.17Å; A337-P368 HydrophobicContact CB-CB 3.96Å; A337-P368 HydrophobicContact CB-CG 3.55Å; A337-I371 HydrophobicContact CB-CD1 3.55Å; A337-I371 HydrophobicContact CB-CG1 4.39Å
338	D	94.7	Very high	92.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	111.8	167.7	-173.5	-38.3	0	0	0	109.6	Q319 R320 N321 G340 Q341 R342 A343 Y345	Q319-D338 PolarHBondContact OE1-OD2 2.85Å; R320-D338 PolarHBondContact N-OD2 3.29Å; N321-D338 PolarHBondContact N-OD1 3.37Å; N321-D338 VanDerWaalsContact N-OD1 3.15Å; N321-D338 CarbonylContact O-C 3.59Å; N321-D338 WeakPolarHBondContact O-CA 3.06Å; D338-G340 VanDerWaalsContact C-N 3.33Å; D338-G340 PolarHBondContact O-N 2.85Å; D338-G340 WeakPolarHBondContact OD1-CA 3.07Å; D338-G340 PolarHBondContact OD1-N 3.15Å; D338-Q341 HydrophobicContact CB-CB 4.15Å; D338-Q341 HydrophobicContact CB-CG 4.45Å; D338-Q341 PolarHBondContact O-N 3.13Å; D338-Q341 PolarHBondContact OD1-N 2.73Å; D338-Q341 PolarHBondContact OD2-NE2 3.21Å; D338-R342 PolarHBondContact O-N 2.79Å; D338-A343 PolarHBondContact N-O 3.01Å; D338-A343 PolarHBondContact O-N 3.49Å; D338-Y345 HydrophobicContact CB-CD2 4.31Å; D338-Y345 HydrophobicContact CB-CE2 4.25Å
339	L	92.6	Very high	92.1	Very high	39 Å²	39	36.7 Å²	36.7	20%	0.204	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-32.4	-179.2	-57.8	-176.7	0	0	0	112.3	N321 A323 Q341 R342 T367 P368 L369	N321-L339 HydrophobicContact CB-CB 4.2Å; N321-L339 PolarHBondContact O-N 2.84Å; A323-L339 HydrophobicContact CB-CD1 3.6Å; A323-L339 HydrophobicContact CB-CD2 4Å; A323-L339 HydrophobicContact CB-CG 3.58Å; L339-Q341 VanDerWaalsContact C-N 3.32Å; L339-R342 WeakPolarHBondContact O-CG 3.43Å; L339-T367 HydrophobicContact CD1-CG2 4.42Å; L339-T367 HydrophobicContact CD2-CG2 4.04Å; L339-P368 HydrophobicContact CD2-CG 4.06Å; L339-L369 HydrophobicContact CD1-CD2 4.37Å
340	G	89.6	Confident	90.8	Very high	41 Å²	41	40.4 Å²	40.4	42%	0.423	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-25.7	178.9	0	0	0	0	0	112.8	D338	D338-G340 VanDerWaalsContact C-N 3.33Å; D338-G340 PolarHBondContact O-N 2.85Å; D338-G340 WeakPolarHBondContact OD1-CA 3.07Å; D338-G340 PolarHBondContact OD1-N 3.15Å
341	Q	89.9	Confident	89.2	Confident	67 Å²	67	44.6 Å²	44.6	31%	0.313	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-8.8	176.8	-62.4	-174.2	67.1	0	0	113.8	R320 D338 L339 A343 Y345	R320-Q341 HydrophobicContact CB-CG 4.33Å; R320-Q341 HydrophobicContact CG-CG 3.97Å; D338-Q341 HydrophobicContact CB-CB 4.15Å; D338-Q341 HydrophobicContact CB-CG 4.45Å; D338-Q341 PolarHBondContact O-N 3.13Å; D338-Q341 PolarHBondContact OD1-N 2.73Å; D338-Q341 PolarHBondContact OD2-NE2 3.21Å; L339-Q341 VanDerWaalsContact C-N 3.32Å; Q341-A343 VanDerWaalsContact C-N 3.26Å; Q341-A343 PolarHBondContact O-N 3.33Å; Q341-Y345 HydrophobicContact CB-CE2 4.06Å; Q341-Y345 PolarHBondContact OE1-OH 3.01Å
342	R	93.9	Very high	87.4	Confident	119 Å²	119	51.3 Å²	51.3	45%	0.449	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	44.2	177.3	-66.9	178.2	64.4	168.1	-1.1	112.2	D338 L339 N364 V365	D338-R342 PolarHBondContact O-N 2.79Å; L339-R342 WeakPolarHBondContact O-CG 3.43Å; R342-N364 PolarHBondContact O-N 2.04Å; R342-V365 VanDerWaalsContact CB-O 3.25Å; R342-V365 WeakPolarHBondContact CB-O 3.05Å; R342-V365 PolarHBondContact NE-O 2.86Å; R342-V365 WeakPolarHBondContact O-CG2 3.04Å; R342-V365 PolarHBondContact O-N 2.03Å
343	A	94.8	Very high	85.5	Confident	1 Å²	1	51 Å²	51	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	154.7	-177	0	0	0	0	0	111.7	D338 Q341 Y345 K360 I362	D338-A343 PolarHBondContact N-O 3.01Å; D338-A343 PolarHBondContact O-N 3.49Å; Q341-A343 VanDerWaalsContact C-N 3.26Å; Q341-A343 PolarHBondContact O-N 3.33Å; A343-Y345 HydrophobicContact CB-CD2 4.39Å; A343-Y345 HydrophobicContact CB-CE2 3.78Å; A343-K360 HydrophobicContact CB-CD 4.04Å; A343-K360 HydrophobicContact CB-CG 4.02Å; A343-I362 VanDerWaalsContact CA-O 3.28Å; A343-I362 WeakPolarHBondContact CA-O 3.28Å; A343-I362 WeakPolarHBondContact CB-O 3.29Å
344	I	96.2	Very high	83.5	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.5	169	-54.8	175.4	0	0	0	108.2	W336 V361 I362 V365 I371 L380 W382	W336-I344 CarbonylContact O-C 3.44Å; W336-I344 WeakPolarHBondContact O-CA 3.01Å; W336-I344 WeakPolarHBondContact O-CG2 3.4Å; I344-V361 PolarHBondContact O-N 3.25Å; I344-I362 HydrophobicContact CB-CB 4.07Å; I344-I362 HydrophobicContact CB-CG1 4.35Å; I344-I362 HydrophobicContact CD1-CB 4.26Å; I344-I362 HydrophobicContact CD1-CG1 4.29Å; I344-I362 HydrophobicContact CG1-CB 4.29Å; I344-I362 PolarHBondContact N-O 3.27Å; I344-I362 PolarHBondContact O-N 2.79Å; I344-V365 HydrophobicContact CD1-CG1 4.38Å; I344-V365 HydrophobicContact CG1-CG1 4.42Å; I344-V365 HydrophobicContact CG1-CG2 4.46Å; I344-I371 HydrophobicContact CD1-CD1 4.24Å; I344-I371 HydrophobicContact CG1-CD1 4.29Å; I344-I371 HydrophobicContact CG2-CD1 3.9Å; I344-L380 HydrophobicContact CD1-CD2 4.23Å; I344-L380 HydrophobicContact CG2-CD2 3.99Å; I344-W382 HydrophobicContact CD1-CB 4.26Å; I344-W382 HydrophobicContact CD1-CD2 4.08Å; I344-W382 HydrophobicContact CD1-CE3 4.43Å; I344-W382 HydrophobicContact CD1-CG 4.01Å
345	Y	94.4	Very high	81.5	Confident	18 Å²	18	59.6 Å²	59.6	7%	0.071	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	160	-178.7	-70.4	-82.3	0	0	0	111.2	F335 W336 D338 Q341 A343 H358 K359 K360	F335-Y345 VanDerWaalsContact CA-O 3.29Å; F335-Y345 WeakPolarHBondContact CA-O 3.05Å; W336-Y345 VanDerWaalsContact CE2-CB 3.41Å; W336-Y345 HydrophobicContact CZ2-CG 4.04Å; W336-Y345 PolarHBondContact N-O 3.25Å; W336-Y345 PolarHBondContact O-N 3.26Å; D338-Y345 HydrophobicContact CB-CD2 4.31Å; D338-Y345 HydrophobicContact CB-CE2 4.25Å; Q341-Y345 HydrophobicContact CB-CE2 4.06Å; Q341-Y345 PolarHBondContact OE1-OH 3.01Å; A343-Y345 HydrophobicContact CB-CD2 4.39Å; A343-Y345 HydrophobicContact CB-CE2 3.78Å; Y345-H358 HydrophobicContact CD1-CB 4.26Å; Y345-K359 CarbonylContact C-O 3.49Å; Y345-K359 WeakPolarHBondContact CA-O 3.48Å; Y345-K360 HydrophobicContact CD1-CB 4.08Å; Y345-K360 HydrophobicContact CE1-CB 3.76Å; Y345-K360 HydrophobicContact CE1-CG 4.09Å; Y345-K360 VanDerWaalsContact OH-CE 3.23Å; Y345-K360 WeakPolarHBondContact OH-CE 3.27Å
346	S	93.4	Very high	79.7	Confident	10 Å²	10	60.8 Å²	60.8	7%	0.07	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	148.9	171.7	67.6	0	0	0	0	111.1	I334 F335 K359 V361	I334-S346 CarbonylContact O-C 3.59Å; I334-S346 WeakPolarHBondContact O-CA 3.19Å; F335-S346 VanDerWaalsContact CE1-CB 3.49Å; S346-K359 PolarHBondContact N-O 3.44Å; S346-K359 PolarHBondContact O-N 3.19Å; S346-V361 VanDerWaalsContact OG-CG2 3.23Å; S346-V361 WeakPolarHBondContact OG-CG2 3.38Å
347	T	90	Very high	78.3	Confident	11 Å²	11	67.3 Å²	67.3	7%	0.067	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.9	169.7	-163	0	0	0	0	110.9	V316 T333 I334 W336 G356	V316-T347 HydrophobicContact CG2-CG2 4.33Å; T333-T347 CarbonylContact C-O 3.53Å; T333-T347 WeakPolarHBondContact CA-O 3.19Å; T333-T347 WeakPolarHBondContact CG2-O 3.21Å; I334-T347 HydrophobicContact CD1-CG2 3.78Å; I334-T347 HydrophobicContact CG1-CG2 3.56Å; I334-T347 PolarHBondContact N-O 3.08Å; I334-T347 PolarHBondContact O-N 2.93Å; W336-T347 HydrophobicContact CH2-CG2 4.11Å; W336-T347 HydrophobicContact CZ3-CG2 3.75Å; T347-G356 PolarHBondContact OG1-O 3.27Å
348	V	88.6	Confident	77.6	Confident	78 Å²	78	70.3 Å²	70.3	47%	0.473	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.8	174.8	-177.5	0	0	0	0	108.2	D350	V348-D350 PolarHBondContact O-N 3.47Å; V348-D350 VanDerWaalsContact O-N 3.17Å
349	L	80.9	Confident	77.2	Confident	36 Å²	36	74.8 Å²	74.8	19%	0.188	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-77.5	95.7	175.4	-66.7	175.2	0	0	0	109.6	I295 I315 Q332 I334 Y547	I295-L349 HydrophobicContact CD1-CD1 4.36Å; I315-L349 HydrophobicContact CD1-CD2 4.18Å; Q332-L349 WeakPolarHBondContact O-CB 3.17Å; Q332-L349 PolarHBondContact O-N 3Å; I334-L349 HydrophobicContact CD1-CD2 4.07Å; I334-L349 HydrophobicContact CG1-CD2 4.3Å; I334-L349 HydrophobicContact CG1-CG 4.43Å; I334-L349 HydrophobicContact CG2-CD1 3.52Å; I334-L349 HydrophobicContact CG2-CD2 4.23Å; I334-L349 HydrophobicContact CG2-CG 3.86Å; L349-Y547 HydrophobicContact CD1-CE2 4.16Å
350	D	65.4	Low	77.2	Confident	109 Å²	109	78.5 Å²	78.5	58%	0.583	41%	0.405	S	S	*	.			trans	-75.2	148.3	172.4	-115	-25.6	0	0	0	111.7	V348 R352 G353	V348-D350 PolarHBondContact O-N 3.47Å; V348-D350 VanDerWaalsContact O-N 3.17Å; D350-R352 PolarHBondContact O-N 2.81Å; D350-G353 PolarHBondContact O-N 2.81Å
351	R	56	Low	77.3	Confident	222 Å²	222	77.2 Å²	77.2	84%	0.838	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-9.9	-177.1	-71.2	-172.3	-173.5	-176.9	2.5	114.7
352	R	50.8	Low	77.5	Confident	228 Å²	228	74.3 Å²	74.3	86%	0.86	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-3.5	-175.3	-69	-173.6	-176.4	-138.9	0.6	114.5	D350 D354	D350-R352 PolarHBondContact O-N 2.81Å; R352-D354 PolarHBondContact O-N 2.98Å
353	G	51.1	Low	77.4	Confident	67 Å²	67	72.5 Å²	72.5	69%	0.691	37%	0.374	S	S	*	.			trans	70.8	16.5	-173.8	0	0	0	0	0	114	D350 V355	D350-G353 PolarHBondContact O-N 2.81Å; G353-V355 PolarHBondContact O-N 3Å
354	D	48.9	Very low	77.1	Confident	120 Å²	120	77.8 Å²	77.8	64%	0.642	40%	0.403	S	S	*	.			trans	-73.1	124.7	168	-101.1	-31.9	0	0	0	108.7	R352 G356	R352-D354 PolarHBondContact O-N 2.98Å; D354-G356 PolarHBondContact O-N 2.95Å
355	V	51.8	Low	77	Confident	82 Å²	82	78 Å²	78	50%	0.497	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-68.9	103.1	179.2	-179.2	0	0	0	0	107.9	G353 H358	G353-V355 PolarHBondContact O-N 3Å; V355-H358 VanDerWaalsContact CG1-NE2 3.32Å; V355-H358 WeakPolarHBondContact CG1-NE2 3.38Å
356	G	58.1	Low	76.9	Confident	28 Å²	28	80.7 Å²	80.7	29%	0.289	42%	0.417	S	S	.	.			trans	-54.9	154.1	163.2	0	0	0	0	0	110.5	T347 D354 H358	T347-G356 PolarHBondContact OG1-O 3.27Å; D354-G356 PolarHBondContact O-N 2.95Å; G356-H358 PolarHBondContact O-N 2.91Å; G356-H358 VanDerWaalsContact O-N 3.11Å
357	V	67.8	Low	76.9	Confident	137 Å²	137	82.3 Å²	82.3	83%	0.83	43%	0.427	S	S	*	.			trans	-57	121.3	178.3	178.3	0	0	0	0	109.6	K359	V357-K359 PolarHBondContact O-N 3.37Å
358	H	81.3	Confident	77.2	Confident	64 Å²	64	81.8 Å²	81.8	30%	0.296	42%	0.424	S	S	.	.			trans	-58.2	109.8	174.3	-64.1	176.5	0	0	0	109	W336 Y345 V355 G356	W336-H358 HydrophobicContact CH2-CB 4.44Å; W336-H358 AromaticContact CH2-CD2 3.96Å; Y345-H358 HydrophobicContact CD1-CB 4.26Å; V355-H358 VanDerWaalsContact CG1-NE2 3.32Å; V355-H358 WeakPolarHBondContact CG1-NE2 3.38Å; G356-H358 PolarHBondContact O-N 2.91Å; G356-H358 VanDerWaalsContact O-N 3.11Å
359	K	86	Confident	77.4	Confident	94 Å²	94	80.6 Å²	80.6	41%	0.409	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.2	177.1	-178.2	-175.8	175.9	-168.9	0	108.1	Y345 S346 V357 V361 N396	Y345-K359 CarbonylContact C-O 3.49Å; Y345-K359 WeakPolarHBondContact CA-O 3.48Å; S346-K359 PolarHBondContact N-O 3.44Å; S346-K359 PolarHBondContact O-N 3.19Å; V357-K359 PolarHBondContact O-N 3.37Å; K359-V361 PolarHBondContact O-N 2.79Å; K359-N396 PolarHBondContact NZ-OD1 2.94Å
360	K	91.3	Very high	78.1	Confident	117 Å²	117	78.9 Å²	78.9	51%	0.509	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	116.8	167.9	-170.8	177.7	-62.4	-173.4	0	108.5	A343 Y345 D363	A343-K360 HydrophobicContact CB-CD 4.04Å; A343-K360 HydrophobicContact CB-CG 4.02Å; Y345-K360 HydrophobicContact CD1-CB 4.08Å; Y345-K360 HydrophobicContact CE1-CB 3.76Å; Y345-K360 HydrophobicContact CE1-CG 4.09Å; Y345-K360 VanDerWaalsContact OH-CE 3.23Å; Y345-K360 WeakPolarHBondContact OH-CE 3.27Å; K360-D363 HydrophobicContact CD-CB 4.29Å
361	V	93.3	Very high	79.6	Confident	13 Å²	13	74.1 Å²	74.1	8%	0.079	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-50.4	-177.7	-176.9	0	0	0	0	110.4	F335 I344 S346 K359 F395	F335-V361 HydrophobicContact CD1-CG2 4.47Å; F335-V361 HydrophobicContact CE1-CG2 4.27Å; I344-V361 PolarHBondContact O-N 3.25Å; S346-V361 VanDerWaalsContact OG-CG2 3.23Å; S346-V361 WeakPolarHBondContact OG-CG2 3.38Å; K359-V361 PolarHBondContact O-N 2.79Å; V361-F395 WeakPolarHBondContact CG1-O 3.44Å
362	I	94.3	Very high	81.6	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136	-179.9	-50.9	-63.9	0	0	0	108.7	A343 I344 V365 L380 W382 A393	A343-I362 VanDerWaalsContact CA-O 3.28Å; A343-I362 WeakPolarHBondContact CA-O 3.28Å; A343-I362 WeakPolarHBondContact CB-O 3.29Å; I344-I362 HydrophobicContact CB-CB 4.07Å; I344-I362 HydrophobicContact CB-CG1 4.35Å; I344-I362 HydrophobicContact CD1-CB 4.26Å; I344-I362 HydrophobicContact CD1-CG1 4.29Å; I344-I362 HydrophobicContact CG1-CB 4.29Å; I344-I362 PolarHBondContact N-O 3.27Å; I344-I362 PolarHBondContact O-N 2.79Å; I362-V365 HydrophobicContact CG2-CG1 3.78Å; I362-L380 HydrophobicContact CG1-CD2 4.39Å; I362-W382 HydrophobicContact CG2-CH2 4.36Å; I362-W382 HydrophobicContact CG2-CZ2 4.27Å; I362-A393 HydrophobicContact CD1-CB 3.59Å
363	D	91.3	Very high	83.8	Confident	81 Å²	81	52.8 Å²	52.8	43%	0.433	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	167.7	173.9	69.7	-1.9	0	0	0	111.8	K360 V365 R400	K360-D363 HydrophobicContact CD-CB 4.29Å; D363-V365 PolarHBondContact O-N 3.14Å; D363-R400 IonicContact OD1-NH1 3.91Å
364	N	88.8	Confident	86	Confident	112 Å²	112	49.6 Å²	49.6	60%	0.599	27%	0.267	S	S	*	.			trans	60	28.3	174.5	-55.3	-61.1	0	0	0	114.9	R342	R342-N364 PolarHBondContact O-N 2.04Å
365	V	92.9	Very high	88.3	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.036	24%	0.242	C	C	.	.			trans	-74.9	147.5	166.9	-65.7	0	0	0	0	109.2	R342 I344 I362 D363 P368	R342-V365 VanDerWaalsContact CB-O 3.25Å; R342-V365 WeakPolarHBondContact CB-O 3.05Å; R342-V365 PolarHBondContact NE-O 2.86Å; R342-V365 WeakPolarHBondContact O-CG2 3.04Å; R342-V365 PolarHBondContact O-N 2.03Å; I344-V365 HydrophobicContact CD1-CG1 4.38Å; I344-V365 HydrophobicContact CG1-CG1 4.42Å; I344-V365 HydrophobicContact CG1-CG2 4.46Å; I362-V365 HydrophobicContact CG2-CG1 3.78Å; D363-V365 PolarHBondContact O-N 3.14Å; V365-P368 HydrophobicContact CB-CG 4.07Å; V365-P368 HydrophobicContact CG2-CG 3.77Å
366	Q	93.3	Very high	90.3	Very high	73 Å²	73	42.1 Å²	42.1	34%	0.341	22%	0.222	S	C	.	.	S	Bend	trans	-89.8	-70.8	179.7	-54.6	-66.3	-51.6	0	0	109.2	D384 T387	Q366-D384 WeakPolarHBondContact CB-OD1 2.9Å; Q366-D384 PolarHBondContact N-OD2 2.9Å; Q366-T387 HydrophobicContact CB-CG2 4.28Å; Q366-T387 HydrophobicContact CG-CG2 3.37Å
367	T	94	Very high	92.1	Very high	45 Å²	45	41.8 Å²	41.8	28%	0.276	21%	0.212	S	C	.	.			trans	-140.6	71.8	-174.8	-37.2	0	0	0	0	109.8	L339 L369 D384 L385	L339-T367 HydrophobicContact CD1-CG2 4.42Å; L339-T367 HydrophobicContact CD2-CG2 4.04Å; T367-L369 HydrophobicContact CG2-CD2 4.14Å; T367-L369 HydrophobicContact CG2-CG 4.39Å; T367-L369 PolarHBondContact O-N 3.3Å; T367-L369 VanDerWaalsContact O-N 3.15Å; T367-D384 PolarHBondContact N-OD1 2.79Å; T367-L385 HydrophobicContact CG2-CB 4.39Å; T367-L385 PolarHBondContact O-N 2.92Å
368	P	94.7	Very high	93.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	103.5	178.4	29.5	-36.8	0	0	0	111.2	A337 L339 V365 S383	A337-P368 HydrophobicContact CB-CB 3.96Å; A337-P368 HydrophobicContact CB-CG 3.55Å; L339-P368 HydrophobicContact CD2-CG 4.06Å; V365-P368 HydrophobicContact CB-CG 4.07Å; V365-P368 HydrophobicContact CG2-CG 3.77Å; P368-S383 VanDerWaalsContact CA-O 3.25Å; P368-S383 WeakPolarHBondContact CA-O 3.17Å
369	L	93.5	Very high	94	Very high	52 Å²	52	35.2 Å²	35.2	27%	0.272	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-15.4	-178.6	-67.9	-172	0	0	0	113.9	A324 L339 T367 S383 L385	A324-L369 WeakPolarHBondContact CB-O 3.43Å; L339-L369 HydrophobicContact CD1-CD2 4.37Å; T367-L369 HydrophobicContact CG2-CD2 4.14Å; T367-L369 HydrophobicContact CG2-CG 4.39Å; T367-L369 PolarHBondContact O-N 3.3Å; T367-L369 VanDerWaalsContact O-N 3.15Å; L369-S383 PolarHBondContact N-O 3.36Å; L369-L385 HydrophobicContact CD1-CB 4.02Å; L369-L385 HydrophobicContact CD1-CD1 4.33Å; L369-L385 HydrophobicContact CD1-CD2 3.75Å; L369-L385 HydrophobicContact CD1-CG 4.25Å; L369-L385 HydrophobicContact CG-CB 4.23Å
370	G	95.4	Very high	94.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	139.5	176.1	0	0	0	0	0	111.1	W382 S383 A412 I414	G370-W382 WeakPolarHBondContact O-CA 3.4Å; G370-W382 VanDerWaalsContact O-CB 3.3Å; G370-W382 WeakPolarHBondContact O-CB 3.45Å; G370-S383 VanDerWaalsContact CA-OG 3.31Å; G370-S383 WeakPolarHBondContact CA-OG 3.04Å; G370-S383 PolarHBondContact N-OG 2.77Å; G370-S383 VanDerWaalsContact N-OG 3.15Å; G370-S383 PolarHBondContact O-N 2.04Å; G370-S383 VanDerWaalsContact O-N 3.11Å; G370-S383 PolarHBondContact O-OG 2.83Å; G370-A412 PolarHBondContact N-O 2.72Å; G370-I414 VanDerWaalsContact C-CG2 3.45Å
371	I	97.5	Very high	94.9	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.041	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.2	173.3	-67.2	175.3	0	0	0	108.1	A324 D326 A337 I344 L380 Y381 W382	A324-I371 HydrophobicContact CB-CB 4.37Å; A324-I371 HydrophobicContact CB-CD1 4.25Å; A324-I371 HydrophobicContact CB-CG1 4.02Å; D326-I371 HydrophobicContact CB-CG2 4.23Å; A337-I371 HydrophobicContact CB-CD1 3.55Å; A337-I371 HydrophobicContact CB-CG1 4.39Å; I344-I371 HydrophobicContact CD1-CD1 4.24Å; I344-I371 HydrophobicContact CG1-CD1 4.29Å; I344-I371 HydrophobicContact CG2-CD1 3.9Å; I371-L380 HydrophobicContact CG2-CD1 3.51Å; I371-L380 HydrophobicContact CG2-CG 4.34Å; I371-Y381 WeakPolarHBondContact CA-O 3.2Å; I371-W382 HydrophobicContact CG1-CB 4.25Å
372	A	97.9	Very high	95.1	Very high	2 Å²	2	25 Å²	25	2%	0.017	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.3	171.9	0	0	0	0	0	111	D326 Y381 I414 V416	D326-A372 WeakPolarHBondContact OD2-CA 3.34Å; A372-Y381 PolarHBondContact N-O 2.86Å; A372-Y381 PolarHBondContact O-N 3Å; A372-I414 HydrophobicContact CB-CG2 3.93Å; A372-V416 HydrophobicContact CB-CB 4.46Å; A372-V416 HydrophobicContact CB-CG1 3.77Å; A372-V416 HydrophobicContact CB-CG2 4.16Å
373	V	97.7	Very high	95.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.8	-175.8	173.5	0	0	0	0	109.6	D326 D328 F335 W375 L380 F395 V416	D326-V373 HydrophobicContact CB-CB 4.41Å; D326-V373 HydrophobicContact CB-CG2 3.8Å; D326-V373 WeakPolarHBondContact OD2-CB 3.19Å; D326-V373 PolarHBondContact OD2-N 2.72Å; D328-V373 HydrophobicContact CB-CG1 4.19Å; F335-V373 HydrophobicContact CB-CG2 4.44Å; F335-V373 HydrophobicContact CD2-CG2 3.7Å; F335-V373 HydrophobicContact CE2-CG2 4.31Å; F335-V373 HydrophobicContact CG-CG2 4.29Å; V373-W375 VanDerWaalsContact O-CE3 3.22Å; V373-W375 PolarHBondContact O-N 3.02Å; V373-L380 HydrophobicContact CG2-CD1 3.71Å; V373-F395 HydrophobicContact CG1-CE1 3.88Å; V373-F395 HydrophobicContact CG1-CZ 3.54Å; V373-V416 WeakPolarHBondContact O-CG2 3.37Å
374	D	96.9	Very high	95.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	96.6	166.3	178.6	-11.5	0	0	0	109.3	I376 Y377 K378 N379 Y381 P418 M439	D374-I376 PolarHBondContact O-N 3.01Å; D374-I376 PolarHBondContact OD1-N 3Å; D374-Y377 PolarHBondContact OD1-N 2.57Å; D374-Y377 WeakPolarHBondContact OD2-CB 3.29Å; D374-Y377 WeakPolarHBondContact OD2-CD2 3.31Å; D374-K378 VanDerWaalsContact O-CA 3.25Å; D374-K378 WeakPolarHBondContact O-CA 3.26Å; D374-K378 PolarHBondContact O-N 2.91Å; D374-N379 HydrophobicContact CB-CB 4.28Å; D374-N379 WeakPolarHBondContact CB-O 3.48Å; D374-N379 PolarHBondContact N-O 2.73Å; D374-N379 PolarHBondContact O-N 2.89Å; D374-Y381 HydrophobicContact CB-CD2 4.42Å; D374-Y381 HydrophobicContact CB-CE2 3.84Å; D374-P418 WeakPolarHBondContact OD1-CB 3.48Å; D374-M439 HydrophobicContact CB-CE 3.79Å; D374-M439 WeakPolarHBondContact OD2-CE 3.45Å
375	W	95.8	Very high	95.7	Very high	30 Å²	30	17.5 Å²	17.5	11%	0.114	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.9	-179.5	61.7	91.2	0	0	0	113.5	V373 K378 V416 P418 L462 Q552 L553	V373-W375 VanDerWaalsContact O-CE3 3.22Å; V373-W375 PolarHBondContact O-N 3.02Å; W375-K378 WeakPolarHBondContact O-CE 3.41Å; W375-K378 PolarHBondContact O-NZ 2.98Å; W375-V416 HydrophobicContact CZ3-CG2 4.3Å; W375-P418 HydrophobicContact CD2-CG 4.13Å; W375-P418 HydrophobicContact CE3-CG 4.31Å; W375-P418 HydrophobicContact CH2-CG 3.75Å; W375-P418 HydrophobicContact CZ2-CG 3.54Å; W375-P418 HydrophobicContact CZ3-CG 4.13Å; W375-L462 HydrophobicContact CH2-CD1 3.75Å; W375-L462 HydrophobicContact CZ2-CD1 3.94Å; W375-Q552 HydrophobicContact CD2-CB 3.82Å; W375-Q552 HydrophobicContact CD2-CG 3.68Å; W375-Q552 HydrophobicContact CE3-CB 4.42Å; W375-Q552 HydrophobicContact CE3-CG 3.78Å; W375-Q552 HydrophobicContact CG-CB 3.94Å; W375-Q552 HydrophobicContact CG-CG 4.07Å; W375-Q552 HydrophobicContact CH2-CG 4.46Å; W375-Q552 HydrophobicContact CZ2-CB 4.28Å; W375-Q552 HydrophobicContact CZ2-CG 4.37Å; W375-Q552 HydrophobicContact CZ3-CG 4.19Å; W375-L553 PolarHBondContact NE1-O 3.33Å
376	I	95.4	Very high	95.7	Very high	16 Å²	16	19.4 Å²	19.4	8%	0.082	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-52.1	-179.6	-62	179.2	0	0	0	110	D374 P418 L419 N557	D374-I376 PolarHBondContact O-N 3.01Å; D374-I376 PolarHBondContact OD1-N 3Å; I376-P418 HydrophobicContact CB-CB 4.24Å; I376-P418 HydrophobicContact CD1-CB 3.93Å; I376-P418 HydrophobicContact CD1-CG 3.87Å; I376-P418 HydrophobicContact CG1-CB 4.2Å; I376-P418 HydrophobicContact CG1-CG 4.15Å; I376-L419 HydrophobicContact CD1-CD2 3.66Å; I376-L419 HydrophobicContact CD1-CG 4.32Å; I376-N557 HydrophobicContact CG2-CB 3.81Å; I376-N557 PolarHBondContact O-ND2 3.43Å
377	Y	94.3	Very high	95.7	Very high	20 Å²	20	19.1 Å²	19.1	8%	0.078	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.9	-176.8	-60	-99.9	0	0	0	114.2	D374 N379 N557 W558 C559 P572	D374-Y377 PolarHBondContact OD1-N 2.57Å; D374-Y377 WeakPolarHBondContact OD2-CB 3.29Å; D374-Y377 WeakPolarHBondContact OD2-CD2 3.31Å; Y377-N379 WeakPolarHBondContact CB-ND2 3.21Å; Y377-N557 VanDerWaalsContact CD1-OD1 3.25Å; Y377-N557 WeakPolarHBondContact CD1-OD1 3.32Å; Y377-W558 VanDerWaalsContact OH-CD1 3.31Å; Y377-C559 HydrophobicContact CD1-CB 3.97Å; Y377-C559 VanDerWaalsContact CD1-SG 3.58Å; Y377-C559 HydrophobicContact CE1-CB 4.28Å; Y377-P572 HydrophobicContact CD2-CB 4.16Å; Y377-P572 HydrophobicContact CD2-CG 3.74Å; Y377-P572 HydrophobicContact CE1-CB 4.37Å; Y377-P572 HydrophobicContact CE2-CB 3.6Å; Y377-P572 HydrophobicContact CE2-CG 3.71Å; Y377-P572 HydrophobicContact CG-CG 4.25Å
378	K	94.3	Very high	95.8	Very high	55 Å²	55	20.7 Å²	20.7	24%	0.239	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	45.9	178	-50.2	-56.7	-176.5	-171	0	112.5	D328 D374 W375 F395	D328-K378 IonicContact OD1-NZ 3.59Å; D328-K378 IonicContact OD2-NZ 2.65Å; D328-K378 PolarHBondContact OD2-NZ 2.96Å; D374-K378 VanDerWaalsContact O-CA 3.25Å; D374-K378 WeakPolarHBondContact O-CA 3.26Å; D374-K378 PolarHBondContact O-N 2.91Å; W375-K378 WeakPolarHBondContact O-CE 3.41Å; W375-K378 PolarHBondContact O-NZ 2.98Å; K378-F395 HydrophobicContact CB-CD1 4.31Å; K378-F395 HydrophobicContact CB-CD2 3.99Å; K378-F395 HydrophobicContact CB-CE1 4.35Å; K378-F395 HydrophobicContact CB-CE2 4.05Å; K378-F395 HydrophobicContact CB-CG 4.11Å; K378-F395 HydrophobicContact CB-CZ 4.21Å; K378-F395 HydrophobicContact CD-CD2 4.16Å; K378-F395 HydrophobicContact CD-CE2 3.56Å; K378-F395 HydrophobicContact CD-CZ 3.92Å; K378-F395 HydrophobicContact CG-CE2 4.38Å; K378-F395 WeakPolarHBondContact O-CD1 3.44Å; K378-F395 WeakPolarHBondContact O-CG 3.38Å; K378-F395 PolarHBondContact O-N 3.02Å
379	N	95.8	Very high	95.8	Very high	8 Å²	8	21.5 Å²	21.5	4%	0.043	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	147.7	175.6	-63.2	-51.9	0	0	0	110.7	D374 Y377 Y381 V392 A393 F395 L571	D374-N379 HydrophobicContact CB-CB 4.28Å; D374-N379 WeakPolarHBondContact CB-O 3.48Å; D374-N379 PolarHBondContact N-O 2.73Å; D374-N379 PolarHBondContact O-N 2.89Å; Y377-N379 WeakPolarHBondContact CB-ND2 3.21Å; N379-Y381 HydrophobicContact CB-CE2 3.87Å; N379-V392 HydrophobicContact CB-CG2 4.12Å; N379-A393 CarbonylContact C-O 3.53Å; N379-A393 VanDerWaalsContact CA-O 3.3Å; N379-A393 WeakPolarHBondContact CA-O 3.06Å; N379-F395 WeakPolarHBondContact O-CE1 3.42Å; N379-L571 WeakPolarHBondContact ND2-CD2 3.27Å
380	L	97.4	Very high	96	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.6	178.7	-173	73	0	0	0	108.8	F335 I344 I362 I371 V373 V392 A393	F335-L380 HydrophobicContact CB-CD1 4.28Å; F335-L380 HydrophobicContact CD1-CD1 4.35Å; F335-L380 HydrophobicContact CG-CD1 4.19Å; I344-L380 HydrophobicContact CD1-CD2 4.23Å; I344-L380 HydrophobicContact CG2-CD2 3.99Å; I362-L380 HydrophobicContact CG1-CD2 4.39Å; I371-L380 HydrophobicContact CG2-CD1 3.51Å; I371-L380 HydrophobicContact CG2-CG 4.34Å; V373-L380 HydrophobicContact CG2-CD1 3.71Å; L380-V392 CarbonylContact O-C 3.52Å; L380-V392 VanDerWaalsContact O-CA 3.29Å; L380-V392 WeakPolarHBondContact O-CA 3.24Å; L380-A393 PolarHBondContact N-O 3.01Å; L380-A393 PolarHBondContact O-N 2.92Å
381	Y	98.1	Very high	96.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.4	176	-62	-99.9	0	0	0	109.1	I371 A372 D374 N379 S391 V392 L403 V416 L423 M439	I371-Y381 WeakPolarHBondContact CA-O 3.2Å; A372-Y381 PolarHBondContact N-O 2.86Å; A372-Y381 PolarHBondContact O-N 3Å; D374-Y381 HydrophobicContact CB-CD2 4.42Å; D374-Y381 HydrophobicContact CB-CE2 3.84Å; N379-Y381 HydrophobicContact CB-CE2 3.87Å; Y381-S391 WeakPolarHBondContact CA-O 3.43Å; Y381-V392 HydrophobicContact CD1-CB 3.76Å; Y381-V392 HydrophobicContact CD1-CG2 3.75Å; Y381-V392 HydrophobicContact CD2-CG2 4.33Å; Y381-V392 HydrophobicContact CE1-CB 3.67Å; Y381-V392 HydrophobicContact CE1-CG2 3.37Å; Y381-V392 HydrophobicContact CE2-CG2 3.99Å; Y381-V392 HydrophobicContact CG-CB 4.47Å; Y381-V392 HydrophobicContact CG-CG2 4.21Å; Y381-V392 VanDerWaalsContact CZ-CG2 3.49Å; Y381-L403 HydrophobicContact CD1-CD1 4.04Å; Y381-L403 HydrophobicContact CE1-CD1 3.88Å; Y381-V416 HydrophobicContact CD2-CG1 3.82Å; Y381-V416 HydrophobicContact CE2-CG1 4.3Å; Y381-V416 HydrophobicContact CG-CG1 4.16Å; Y381-L423 HydrophobicContact CD1-CD1 4.09Å; Y381-L423 HydrophobicContact CD1-CD2 4.25Å; Y381-L423 HydrophobicContact CG-CD1 4.18Å; Y381-M439 HydrophobicContact CD2-CE 4.34Å; Y381-M439 HydrophobicContact CE1-CB 4.4Å; Y381-M439 WeakPolarHBondContact CE1-O 3.31Å; Y381-M439 HydrophobicContact CE2-CE 3.48Å; Y381-M439 VanDerWaalsContact CE2-CE 3.48Å
382	W	97.8	Very high	96.1	Very high	11 Å²	11	18.9 Å²	18.9	4%	0.042	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	148.8	173.8	71.9	97.7	0	0	0	111.8	I344 I362 G370 I371 I390 S391 A393	I344-W382 HydrophobicContact CD1-CB 4.26Å; I344-W382 HydrophobicContact CD1-CD2 4.08Å; I344-W382 HydrophobicContact CD1-CE3 4.43Å; I344-W382 HydrophobicContact CD1-CG 4.01Å; I362-W382 HydrophobicContact CG2-CH2 4.36Å; I362-W382 HydrophobicContact CG2-CZ2 4.27Å; G370-W382 WeakPolarHBondContact O-CA 3.4Å; G370-W382 VanDerWaalsContact O-CB 3.3Å; G370-W382 WeakPolarHBondContact O-CB 3.45Å; I371-W382 HydrophobicContact CG1-CB 4.25Å; W382-I390 WeakPolarHBondContact O-CA 3.35Å; W382-S391 VanDerWaalsContact CE2-CB 3.45Å; W382-S391 PolarHBondContact N-O 3.18Å; W382-S391 PolarHBondContact O-N 2.68Å; W382-A393 HydrophobicContact CH2-CB 4.06Å; W382-A393 HydrophobicContact CZ3-CB 3.7Å
383	S	97.1	Very high	96	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.9	167.3	44.3	0	0	0	0	108.8	P368 L369 G370 A412	P368-S383 VanDerWaalsContact CA-O 3.25Å; P368-S383 WeakPolarHBondContact CA-O 3.17Å; L369-S383 PolarHBondContact N-O 3.36Å; G370-S383 VanDerWaalsContact CA-OG 3.31Å; G370-S383 WeakPolarHBondContact CA-OG 3.04Å; G370-S383 PolarHBondContact N-OG 2.77Å; G370-S383 VanDerWaalsContact N-OG 3.15Å; G370-S383 PolarHBondContact O-N 2.04Å; G370-S383 VanDerWaalsContact O-N 3.11Å; G370-S383 PolarHBondContact O-OG 2.83Å; S383-A412 WeakPolarHBondContact CB-O 3.43Å; S383-A412 PolarHBondContact OG-O 3.28Å
384	D	96.1	Very high	95.8	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	112.4	177.8	-172.7	-47.8	0	0	0	109.4	Q366 T367 G386 T387 K388 T389	Q366-D384 WeakPolarHBondContact CB-OD1 2.9Å; Q366-D384 PolarHBondContact N-OD2 2.9Å; T367-D384 PolarHBondContact N-OD1 2.79Å; D384-G386 PolarHBondContact OD1-N 2.78Å; D384-T387 WeakPolarHBondContact CB-OG1 3.25Å; D384-T387 VanDerWaalsContact CG-OG1 3.26Å; D384-T387 PolarHBondContact OD1-N 3.43Å; D384-T387 PolarHBondContact OD1-OG1 2.86Å; D384-K388 VanDerWaalsContact O-CA 3.25Å; D384-K388 WeakPolarHBondContact O-CA 3.13Å; D384-K388 PolarHBondContact O-N 3.4Å; D384-T389 PolarHBondContact N-O 3.23Å; D384-T389 PolarHBondContact O-N 3.05Å; D384-T389 VanDerWaalsContact O-N 3.12Å
385	L	94	Very high	95.6	Very high	37 Å²	37	21.1 Å²	21.1	19%	0.194	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-40.4	-178.7	-170.8	75.2	0	0	0	111.6	T367 L369 K388 E410	T367-L385 HydrophobicContact CG2-CB 4.39Å; T367-L385 PolarHBondContact O-N 2.92Å; L369-L385 HydrophobicContact CD1-CB 4.02Å; L369-L385 HydrophobicContact CD1-CD1 4.33Å; L369-L385 HydrophobicContact CD1-CD2 3.75Å; L369-L385 HydrophobicContact CD1-CG 4.25Å; L369-L385 HydrophobicContact CG-CB 4.23Å; L385-K388 WeakPolarHBondContact O-CG 2.9Å; L385-K388 PolarHBondContact O-N 2.83Å; L385-E410 HydrophobicContact CD1-CB 3.87Å; L385-E410 WeakPolarHBondContact CD1-OE2 3.13Å
386	G	92.3	Very high	95.3	Very high	46 Å²	46	24.3 Å²	24.3	47%	0.474	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-38.1	-175.1	0	0	0	0	0	112.8	D384	D384-G386 PolarHBondContact OD1-N 2.78Å
387	T	93.8	Very high	95	Very high	66 Å²	66	24.4 Å²	24.4	41%	0.405	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.7	174.2	60.4	0	0	0	0	114	Q366 D384 T389	Q366-T387 HydrophobicContact CB-CG2 4.28Å; Q366-T387 HydrophobicContact CG-CG2 3.37Å; D384-T387 WeakPolarHBondContact CB-OG1 3.25Å; D384-T387 VanDerWaalsContact CG-OG1 3.26Å; D384-T387 PolarHBondContact OD1-N 3.43Å; D384-T387 PolarHBondContact OD1-OG1 2.86Å; T387-T389 VanDerWaalsContact C-N 3.34Å; T387-T389 WeakPolarHBondContact O-CG2 3.3Å; T387-T389 PolarHBondContact OG1-OG1 2.86Å
388	K	95.3	Very high	94.9	Very high	78 Å²	78	28.7 Å²	28.7	34%	0.339	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	48.3	-171.7	-54.6	-177.3	-179.5	-123.6	0	111.6	D384 L385 L408 R409 E410	D384-K388 VanDerWaalsContact O-CA 3.25Å; D384-K388 WeakPolarHBondContact O-CA 3.13Å; D384-K388 PolarHBondContact O-N 3.4Å; L385-K388 WeakPolarHBondContact O-CG 2.9Å; L385-K388 PolarHBondContact O-N 2.83Å; K388-L408 WeakPolarHBondContact O-CD1 3.41Å; K388-R409 VanDerWaalsContact CD-O 3.32Å; K388-R409 WeakPolarHBondContact CD-O 3.38Å; K388-R409 WeakPolarHBondContact CE-O 3.21Å; K388-R409 PolarHBondContact NZ-O 3Å; K388-E410 IonicContact NZ-OE1 3.63Å; K388-E410 PolarHBondContact NZ-OE1 3.34Å
389	T	96.1	Very high	94.8	Very high	17 Å²	17	29 Å²	29	10%	0.104	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.4	-178.8	67.7	0	0	0	0	113	D384 T387 V402 F404 N405	D384-T389 PolarHBondContact N-O 3.23Å; D384-T389 PolarHBondContact O-N 3.05Å; D384-T389 VanDerWaalsContact O-N 3.12Å; T387-T389 VanDerWaalsContact C-N 3.34Å; T387-T389 WeakPolarHBondContact O-CG2 3.3Å; T387-T389 PolarHBondContact OG1-OG1 2.86Å; T389-V402 HydrophobicContact CG2-CG1 3.89Å; T389-F404 VanDerWaalsContact CA-O 3.25Å; T389-F404 WeakPolarHBondContact CA-O 3.4Å; T389-F404 WeakPolarHBondContact CB-O 3.18Å; T389-N405 HydrophobicContact CG2-CB 4.1Å
390	I	97.4	Very high	94.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.6	163.4	-65.7	168.8	0	0	0	107.3	W382 L403 F404 L408 I414 L423 W425	W382-I390 WeakPolarHBondContact O-CA 3.35Å; I390-L403 PolarHBondContact O-N 3.5Å; I390-F404 HydrophobicContact CB-CB 4.35Å; I390-F404 HydrophobicContact CB-CD2 4.12Å; I390-F404 HydrophobicContact CD1-CD2 4.28Å; I390-F404 HydrophobicContact CG2-CD2 4.32Å; I390-F404 PolarHBondContact N-O 3.35Å; I390-F404 PolarHBondContact O-N 2.83Å; I390-F404 VanDerWaalsContact O-N 3.17Å; I390-L408 HydrophobicContact CB-CD1 4.4Å; I390-L408 HydrophobicContact CD1-CD1 4.08Å; I390-L408 HydrophobicContact CD1-CD2 3.88Å; I390-L408 HydrophobicContact CG1-CD1 3.84Å; I390-L408 HydrophobicContact CG1-CD2 4.46Å; I390-I414 HydrophobicContact CG2-CD1 3.77Å; I390-L423 HydrophobicContact CG2-CD2 3.94Å; I390-W425 HydrophobicContact CD1-CB 4.25Å; I390-W425 HydrophobicContact CD1-CD2 3.34Å; I390-W425 VanDerWaalsContact CD1-CE2 3.43Å; I390-W425 HydrophobicContact CD1-CE3 3.91Å; I390-W425 HydrophobicContact CD1-CG 3.51Å; I390-W425 HydrophobicContact CD1-CZ2 4.04Å; I390-W425 HydrophobicContact CD1-CZ3 4.47Å
391	S	96.8	Very high	94.5	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	157.3	-171.9	-66.8	0	0	0	0	111.5	Y381 W382 K401	Y381-S391 WeakPolarHBondContact CA-O 3.43Å; W382-S391 VanDerWaalsContact CE2-CB 3.45Å; W382-S391 PolarHBondContact N-O 3.18Å; W382-S391 PolarHBondContact O-N 2.68Å; S391-K401 CarbonylContact C-O 3.53Å; S391-K401 WeakPolarHBondContact CA-O 3.39Å
392	V	97.2	Very high	94.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.1	177.2	63.9	0	0	0	0	110.3	N379 L380 Y381 R400 K401 L403 L569 L571	N379-V392 HydrophobicContact CB-CG2 4.12Å; L380-V392 CarbonylContact O-C 3.52Å; L380-V392 VanDerWaalsContact O-CA 3.29Å; L380-V392 WeakPolarHBondContact O-CA 3.24Å; Y381-V392 HydrophobicContact CD1-CB 3.76Å; Y381-V392 HydrophobicContact CD1-CG2 3.75Å; Y381-V392 HydrophobicContact CD2-CG2 4.33Å; Y381-V392 HydrophobicContact CE1-CB 3.67Å; Y381-V392 HydrophobicContact CE1-CG2 3.37Å; Y381-V392 HydrophobicContact CE2-CG2 3.99Å; Y381-V392 HydrophobicContact CG-CB 4.47Å; Y381-V392 HydrophobicContact CG-CG2 4.21Å; Y381-V392 VanDerWaalsContact CZ-CG2 3.49Å; V392-R400 CarbonylContact O-C 3.55Å; V392-R400 VanDerWaalsContact O-CA 3.3Å; V392-R400 WeakPolarHBondContact O-CA 3.27Å; V392-K401 HydrophobicContact CG1-CB 4.15Å; V392-K401 PolarHBondContact N-O 3.48Å; V392-K401 PolarHBondContact O-N 2.82Å; V392-L403 HydrophobicContact CB-CD1 4.07Å; V392-L403 HydrophobicContact CB-CG 4.31Å; V392-L403 HydrophobicContact CG1-CD1 4.02Å; V392-L403 HydrophobicContact CG1-CD2 3.85Å; V392-L403 HydrophobicContact CG1-CG 3.82Å; V392-L569 HydrophobicContact CG1-CD1 4.34Å; V392-L571 HydrophobicContact CG1-CD1 3.96Å; V392-L571 HydrophobicContact CG2-CD2 4.1Å
393	A	96.3	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	162.4	171.5	0	0	0	0	0	111.2	I362 N379 L380 W382 K399 R400	I362-A393 HydrophobicContact CD1-CB 3.59Å; N379-A393 CarbonylContact C-O 3.53Å; N379-A393 VanDerWaalsContact CA-O 3.3Å; N379-A393 WeakPolarHBondContact CA-O 3.06Å; L380-A393 PolarHBondContact N-O 3.01Å; L380-A393 PolarHBondContact O-N 2.92Å; W382-A393 HydrophobicContact CH2-CB 4.06Å; W382-A393 HydrophobicContact CZ3-CB 3.7Å; A393-K399 WeakPolarHBondContact CA-O 3.22Å; A393-K399 WeakPolarHBondContact CB-O 3.46Å; A393-R400 HydrophobicContact CB-CB 4.03Å
394	N	94.3	Very high	94.2	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.15	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	162.7	166.1	64.7	-16.7	0	0	0	110.9	N396 G397 T398 K399	N394-N396 PolarHBondContact O-N 3.27Å; N394-G397 PolarHBondContact O-N 2.98Å; N394-G397 VanDerWaalsContact OD1-C 3.32Å; N394-G397 WeakPolarHBondContact OD1-CA 3.5Å; N394-G397 PolarHBondContact OD1-N 2.93Å; N394-T398 PolarHBondContact ND2-OG1 3.38Å; N394-T398 PolarHBondContact OD1-N 3.48Å; N394-K399 PolarHBondContact N-O 2.87Å; N394-K399 VanDerWaalsContact N-O 3.12Å; N394-K399 PolarHBondContact OD1-N 2.84Å; N394-K399 VanDerWaalsContact OD1-N 3.1Å; N394-K399 PolarHBondContact OD1-O 3.14Å
395	F	92.5	Very high	94	Very high	21 Å²	21	47.5 Å²	47.5	9%	0.092	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.9	178.2	-79.3	13.2	0	0	0	115.3	D328 F335 V361 V373 K378 N379	D328-F395 HydrophobicContact CB-CE2 4.28Å; D328-F395 HydrophobicContact CB-CZ 4.44Å; D328-F395 WeakPolarHBondContact OD2-CE2 3.42Å; F335-F395 HydrophobicContact CE2-CD2 4.47Å; F335-F395 HydrophobicContact CE2-CE2 4.24Å; F335-F395 HydrophobicContact CE2-CZ 4.31Å; F335-F395 HydrophobicContact CZ-CB 4.47Å; F335-F395 HydrophobicContact CZ-CD1 4.23Å; F335-F395 AromaticContact CZ-CD2 3.92Å; F335-F395 HydrophobicContact CZ-CD2 3.92Å; F335-F395 HydrophobicContact CZ-CE1 4.45Å; F335-F395 HydrophobicContact CZ-CE2 4.15Å; F335-F395 AromaticContact CZ-CG 3.97Å; F335-F395 HydrophobicContact CZ-CG 3.97Å; F335-F395 HydrophobicContact CZ-CZ 4.43Å; V361-F395 WeakPolarHBondContact CG1-O 3.44Å; V373-F395 HydrophobicContact CG1-CE1 3.88Å; V373-F395 HydrophobicContact CG1-CZ 3.54Å; K378-F395 HydrophobicContact CB-CD1 4.31Å; K378-F395 HydrophobicContact CB-CD2 3.99Å; K378-F395 HydrophobicContact CB-CE1 4.35Å; K378-F395 HydrophobicContact CB-CE2 4.05Å; K378-F395 HydrophobicContact CB-CG 4.11Å; K378-F395 HydrophobicContact CB-CZ 4.21Å; K378-F395 HydrophobicContact CD-CD2 4.16Å; K378-F395 HydrophobicContact CD-CE2 3.56Å; K378-F395 HydrophobicContact CD-CZ 3.92Å; K378-F395 HydrophobicContact CG-CE2 4.38Å; K378-F395 WeakPolarHBondContact O-CD1 3.44Å; K378-F395 WeakPolarHBondContact O-CG 3.38Å; K378-F395 PolarHBondContact O-N 3.02Å; N379-F395 WeakPolarHBondContact O-CE1 3.42Å
396	N	88.5	Confident	93.9	Very high	97 Å²	97	50.3 Å²	50.3	52%	0.519	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-5.4	176	-73.4	-38	0	0	0	113.7	K359 N394 T398	K359-N396 PolarHBondContact NZ-OD1 2.94Å; N394-N396 PolarHBondContact O-N 3.27Å; N396-T398 HydrophobicContact CB-CG2 4.13Å; N396-T398 PolarHBondContact O-N 3.46Å; N396-T398 VanDerWaalsContact O-N 3.16Å
397	G	90.7	Very high	93.6	Very high	19 Å²	19	50.4 Å²	50.4	20%	0.196	28%	0.277	C	S	.	.	S	Bend	trans	69.2	0.9	-177.2	0	0	0	0	0	115.9	N394 K399	N394-G397 PolarHBondContact O-N 2.98Å; N394-G397 VanDerWaalsContact OD1-C 3.32Å; N394-G397 WeakPolarHBondContact OD1-CA 3.5Å; N394-G397 PolarHBondContact OD1-N 2.93Å; G397-K399 VanDerWaalsContact C-N 3.35Å; G397-K399 PolarHBondContact O-N 2.84Å
398	T	91.3	Very high	93.5	Very high	109 Å²	109	47.7 Å²	47.7	67%	0.669	26%	0.261	S	S	*	.	S	Bend	trans	-70.5	-29.3	-175.1	61.2	0	0	0	0	113.6	N394 N396	N394-T398 PolarHBondContact ND2-OG1 3.38Å; N394-T398 PolarHBondContact OD1-N 3.48Å; N396-T398 HydrophobicContact CB-CG2 4.13Å; N396-T398 PolarHBondContact O-N 3.46Å; N396-T398 VanDerWaalsContact O-N 3.16Å
399	K	92.6	Very high	93.4	Very high	63 Å²	63	51.2 Å²	51.2	27%	0.274	27%	0.272	S	S	.	.	S	Bend	trans	-121.9	118.9	177.3	-66.4	-177.6	176.8	176.3	0	107.8	A393 N394 G397 F568 L569	A393-K399 WeakPolarHBondContact CA-O 3.22Å; A393-K399 WeakPolarHBondContact CB-O 3.46Å; N394-K399 PolarHBondContact N-O 2.87Å; N394-K399 VanDerWaalsContact N-O 3.12Å; N394-K399 PolarHBondContact OD1-N 2.84Å; N394-K399 VanDerWaalsContact OD1-N 3.1Å; N394-K399 PolarHBondContact OD1-O 3.14Å; G397-K399 VanDerWaalsContact C-N 3.35Å; G397-K399 PolarHBondContact O-N 2.84Å; K399-F568 HydrophobicContact CB-CD2 4.32Å; K399-F568 HydrophobicContact CB-CE1 4.44Å; K399-F568 HydrophobicContact CB-CE2 3.66Å; K399-F568 HydrophobicContact CB-CZ 3.74Å; K399-F568 HydrophobicContact CD-CD2 3.91Å; K399-F568 HydrophobicContact CD-CE2 4.06Å; K399-F568 HydrophobicContact CD-CG 4.5Å; K399-F568 VanDerWaalsContact CD-O 3.27Å; K399-F568 WeakPolarHBondContact CD-O 3.29Å; K399-F568 WeakPolarHBondContact CE-O 3.41Å; K399-F568 HydrophobicContact CG-CD2 3.97Å; K399-F568 HydrophobicContact CG-CE2 3.6Å; K399-F568 HydrophobicContact CG-CZ 4.22Å; K399-F568 PolarHBondContact NZ-O 3.23Å; K399-L569 HydrophobicContact CB-CD1 4.47Å; K399-L569 HydrophobicContact CB-CD2 3.7Å; K399-L569 HydrophobicContact CB-CG 4.03Å; K399-L569 HydrophobicContact CD-CD2 4.14Å; K399-L569 HydrophobicContact CD-CG 4.49Å
400	R	93.5	Very high	93.4	Very high	138 Å²	138	52.5 Å²	52.5	52%	0.521	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	148.8	177.4	73.9	179.2	-173.4	-171.2	0.6	112	D363 V392 A393 F568	D363-R400 IonicContact OD1-NH1 3.91Å; V392-R400 CarbonylContact O-C 3.55Å; V392-R400 VanDerWaalsContact O-CA 3.3Å; V392-R400 WeakPolarHBondContact O-CA 3.27Å; A393-R400 HydrophobicContact CB-CB 4.03Å; R400-F568 WeakPolarHBondContact O-CZ 3.49Å
401	K	93.8	Very high	93.3	Very high	51 Å²	51	52.5 Å²	52.5	22%	0.222	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	140.8	173.7	177.3	174.2	-174.6	150.6	0	110.8	S391 V392 L403 F568 L569 V586 C587	S391-K401 CarbonylContact C-O 3.53Å; S391-K401 WeakPolarHBondContact CA-O 3.39Å; V392-K401 HydrophobicContact CG1-CB 4.15Å; V392-K401 PolarHBondContact N-O 3.48Å; V392-K401 PolarHBondContact O-N 2.82Å; K401-L403 HydrophobicContact CD-CD2 4.41Å; K401-F568 HydrophobicContact CB-CE1 4.45Å; K401-L569 HydrophobicContact CB-CD1 4.29Å; K401-V586 HydrophobicContact CD-CB 4.48Å; K401-V586 HydrophobicContact CD-CG1 3.18Å; K401-C587 VanDerWaalsContact CD-O 3.26Å; K401-C587 WeakPolarHBondContact CD-O 3.29Å; K401-C587 WeakPolarHBondContact CE-O 3.26Å; K401-C587 PolarHBondContact NZ-O 2.85Å
402	V	95.2	Very high	93.2	Very high	68 Å²	68	52.6 Å²	52.6	41%	0.412	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	118.5	165.1	-177.6	0	0	0	0	108.4	T389 N405	T389-V402 HydrophobicContact CG2-CG1 3.89Å; V402-N405 HydrophobicContact CG1-CB 4.02Å
403	L	94.9	Very high	93.2	Very high	24 Å²	24	53.5 Å²	53.5	13%	0.126	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-46.5	178.4	-66.4	178.3	0	0	0	110.9	Y381 I390 V392 K401 L423 L571	Y381-L403 HydrophobicContact CD1-CD1 4.04Å; Y381-L403 HydrophobicContact CE1-CD1 3.88Å; I390-L403 PolarHBondContact O-N 3.5Å; V392-L403 HydrophobicContact CB-CD1 4.07Å; V392-L403 HydrophobicContact CB-CG 4.31Å; V392-L403 HydrophobicContact CG1-CD1 4.02Å; V392-L403 HydrophobicContact CG1-CD2 3.85Å; V392-L403 HydrophobicContact CG1-CG 3.82Å; K401-L403 HydrophobicContact CD-CD2 4.41Å; L403-L423 HydrophobicContact CD1-CD2 4.44Å; L403-L571 HydrophobicContact CD2-CD1 4.31Å
404	F	95.6	Very high	93.3	Very high	16 Å²	16	53.8 Å²	53.8	7%	0.07	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.9	-178.7	-56.7	-66.5	0	0	0	110.4	T389 I390 L408 W425 S437 G441 R444	T389-F404 VanDerWaalsContact CA-O 3.25Å; T389-F404 WeakPolarHBondContact CA-O 3.4Å; T389-F404 WeakPolarHBondContact CB-O 3.18Å; I390-F404 HydrophobicContact CB-CB 4.35Å; I390-F404 HydrophobicContact CB-CD2 4.12Å; I390-F404 HydrophobicContact CD1-CD2 4.28Å; I390-F404 HydrophobicContact CG2-CD2 4.32Å; I390-F404 PolarHBondContact N-O 3.35Å; I390-F404 PolarHBondContact O-N 2.83Å; I390-F404 VanDerWaalsContact O-N 3.17Å; F404-L408 HydrophobicContact CB-CD1 3.88Å; F404-W425 HydrophobicContact CD2-CH2 4.19Å; F404-W425 AromaticContact CE2-CH2 3.91Å; F404-W425 HydrophobicContact CE2-CH2 3.91Å; F404-W425 HydrophobicContact CE2-CZ3 4.2Å; F404-W425 HydrophobicContact CZ-CH2 4.39Å; F404-S437 VanDerWaalsContact CE2-OG 3.28Å; F404-S437 WeakPolarHBondContact CE2-OG 3.31Å; F404-S437 WeakPolarHBondContact CZ-OG 3.35Å; F404-G441 WeakPolarHBondContact CE1-O 3.03Å; F404-R444 HydrophobicContact CE1-CB 4.11Å; F404-R444 HydrophobicContact CE1-CG 4.5Å; F404-R444 HydrophobicContact CZ-CB 4.29Å
405	N	92.8	Very high	93.4	Very high	114 Å²	114	53 Å²	53	61%	0.61	28%	0.283	S	S	*	.			trans	-135.8	6.4	176.2	64.2	-7.7	0	0	0	112.5	T389 V402	T389-N405 HydrophobicContact CG2-CB 4.1Å; V402-N405 HydrophobicContact CG1-CB 4.02Å
406	T	90.4	Very high	93.7	Very high	95 Å²	95	52.5 Å²	52.5	58%	0.583	28%	0.282	S	S	*	.	S	Bend	trans	-126.8	147.1	180	51.2	0	0	0	0	109.5	L408 R444	T406-L408 PolarHBondContact O-N 3.11Å; T406-L408 VanDerWaalsContact O-N 3.13Å; T406-R444 PolarHBondContact O-NH1 2.83Å
407	G	87.1	Confident	94.1	Very high	48 Å²	48	48.2 Å²	48.2	50%	0.495	26%	0.259	S	S	.	.	S	Bend	trans	69	7.6	176.2	0	0	0	0	0	115.9	K433 R444	G407-K433 PolarHBondContact O-NZ 2.89Å; G407-R444 PolarHBondContact O-NH2 3.29Å
408	L	92.3	Very high	94.4	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.052	25%	0.25	C	S	.	.			trans	-95.7	126.4	170.7	-63.8	171.4	0	0	0	108.7	K388 I390 F404 T406 P411 W425 D427	K388-L408 WeakPolarHBondContact O-CD1 3.41Å; I390-L408 HydrophobicContact CB-CD1 4.4Å; I390-L408 HydrophobicContact CD1-CD1 4.08Å; I390-L408 HydrophobicContact CD1-CD2 3.88Å; I390-L408 HydrophobicContact CG1-CD1 3.84Å; I390-L408 HydrophobicContact CG1-CD2 4.46Å; F404-L408 HydrophobicContact CB-CD1 3.88Å; T406-L408 PolarHBondContact O-N 3.11Å; T406-L408 VanDerWaalsContact O-N 3.13Å; L408-P411 HydrophobicContact CB-CG 4.49Å; L408-P411 HydrophobicContact CD2-CB 4.47Å; L408-W425 HydrophobicContact CD2-CZ2 4.37Å; L408-D427 WeakPolarHBondContact CA-OD2 3.37Å
409	R	92.6	Very high	94.5	Very high	151 Å²	151	45.7 Å²	45.7	57%	0.57	24%	0.236	S	C	*	.	S	Bend	trans	-104.5	-65.1	179.3	-67.6	-66.2	-172	163.4	1.3	110	K388 D427	K388-R409 VanDerWaalsContact CD-O 3.32Å; K388-R409 WeakPolarHBondContact CD-O 3.38Å; K388-R409 WeakPolarHBondContact CE-O 3.21Å; K388-R409 PolarHBondContact NZ-O 3Å; R409-D427 PolarHBondContact N-OD2 2.84Å
410	E	94.9	Very high	94.6	Very high	45 Å²	45	44.8 Å²	44.8	21%	0.21	24%	0.238	C	C	.	.	S	Bend	trans	-135.3	73.4	179.4	-56	-60.5	147.4	0	0	109.8	L385 K388 A412 D427 W428	L385-E410 HydrophobicContact CD1-CB 3.87Å; L385-E410 WeakPolarHBondContact CD1-OE2 3.13Å; K388-E410 IonicContact NZ-OE1 3.63Å; K388-E410 PolarHBondContact NZ-OE1 3.34Å; E410-A412 PolarHBondContact O-N 2.82Å; E410-D427 PolarHBondContact N-OD1 3.4Å; E410-D427 WeakPolarHBondContact O-CA 3.34Å; E410-W428 HydrophobicContact CB-CD2 3.59Å; E410-W428 HydrophobicContact CB-CE3 4.08Å; E410-W428 HydrophobicContact CB-CG 4.04Å; E410-W428 HydrophobicContact CB-CH2 4.07Å; E410-W428 HydrophobicContact CB-CZ2 3.6Å; E410-W428 HydrophobicContact CB-CZ3 4.29Å; E410-W428 HydrophobicContact CG-CD2 4.15Å; E410-W428 HydrophobicContact CG-CE3 4.13Å; E410-W428 HydrophobicContact CG-CH2 3.73Å; E410-W428 HydrophobicContact CG-CZ2 3.76Å; E410-W428 HydrophobicContact CG-CZ3 3.92Å; E410-W428 VanDerWaalsContact O-CD1 3.25Å; E410-W428 PolarHBondContact O-N 2.9Å; E410-W428 VanDerWaalsContact O-N 3.15Å; E410-W428 PolarHBondContact O-NE1 3.18Å
411	P	96.1	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.2	-179.1	29.4	-35.1	0	0	0	111.2	L408 S426	L408-P411 HydrophobicContact CB-CG 4.49Å; L408-P411 HydrophobicContact CD2-CB 4.47Å; P411-S426 WeakPolarHBondContact CA-O 3.1Å
412	A	94.3	Very high	94.9	Very high	7 Å²	7	36.7 Å²	36.7	6%	0.058	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-101.2	-177.8	0	0	0	0	0	111.8	G370 S383 E410 S426	G370-A412 PolarHBondContact N-O 2.72Å; S383-A412 WeakPolarHBondContact CB-O 3.43Å; S383-A412 PolarHBondContact OG-O 3.28Å; E410-A412 PolarHBondContact O-N 2.82Å; A412-S426 PolarHBondContact N-O 2.79Å
413	S	96.8	Very high	95	Very high	19 Å²	19	33.5 Å²	33.5	13%	0.133	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	154.1	-175.7	-173.8	0	0	0	0	112	W425 S426 N456 I458	S413-W425 WeakPolarHBondContact O-CA 3.31Å; S413-W425 WeakPolarHBondContact O-CB 3.02Å; S413-S426 PolarHBondContact N-OG 2.76Å; S413-S426 PolarHBondContact O-N 3.24Å; S413-S426 PolarHBondContact O-OG 2.8Å; S413-N456 WeakPolarHBondContact CB-O 3.43Å; S413-I458 PolarHBondContact OG-N 2.03Å
414	I	98.1	Very high	95.2	Very high	7 Å²	7	32.4 Å²	32.4	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.7	-176.2	-168	170.4	0	0	0	109.7	G370 A372 I390 L423 Y424 W425	G370-I414 VanDerWaalsContact C-CG2 3.45Å; A372-I414 HydrophobicContact CB-CG2 3.93Å; I390-I414 HydrophobicContact CG2-CD1 3.77Å; I414-L423 HydrophobicContact CD1-CD1 3.81Å; I414-L423 HydrophobicContact CD1-CD2 4.27Å; I414-L423 HydrophobicContact CD1-CG 4.3Å; I414-L423 HydrophobicContact CG1-CD1 3.73Å; I414-L423 HydrophobicContact CG1-CG 4.31Å; I414-Y424 CarbonylContact C-O 3.48Å; I414-Y424 WeakPolarHBondContact CA-O 3.35Å; I414-Y424 WeakPolarHBondContact CG1-O 3.27Å; I414-W425 HydrophobicContact CB-CB 4.36Å; I414-W425 HydrophobicContact CG1-CB 4.23Å
415	A	98.1	Very high	95.3	Very high	12 Å²	12	31.6 Å²	31.6	10%	0.099	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	149	179.6	0	0	0	0	0	111.3	Y424 I458 L460	A415-Y424 PolarHBondContact N-O 2.93Å; A415-Y424 PolarHBondContact O-N 2.03Å; A415-I458 HydrophobicContact CB-CD1 3.97Å; A415-I458 HydrophobicContact CB-CG1 4.2Å; A415-L460 HydrophobicContact CB-CD1 3.79Å; A415-L460 HydrophobicContact CB-CG 3.8Å
416	V	97.8	Very high	95.5	Very high	10 Å²	10	26.2 Å²	26.2	6%	0.061	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	141.7	-176.4	-68.2	0	0	0	0	112.2	A372 V373 W375 Y381 L423 M439	A372-V416 HydrophobicContact CB-CB 4.46Å; A372-V416 HydrophobicContact CB-CG1 3.77Å; A372-V416 HydrophobicContact CB-CG2 4.16Å; V373-V416 WeakPolarHBondContact O-CG2 3.37Å; W375-V416 HydrophobicContact CZ3-CG2 4.3Å; Y381-V416 HydrophobicContact CD2-CG1 3.82Å; Y381-V416 HydrophobicContact CE2-CG1 4.3Å; Y381-V416 HydrophobicContact CG-CG1 4.16Å; V416-L423 HydrophobicContact CG1-CD1 3.45Å; V416-L423 VanDerWaalsContact CG1-CD1 3.45Å; V416-M439 HydrophobicContact CB-CE 3.92Å; V416-M439 HydrophobicContact CB-SD 4.42Å; V416-M439 HydrophobicContact CG1-CE 3.86Å
417	D	97.3	Very high	95.8	Very high	7 Å²	7	21.7 Å²	21.7	4%	0.037	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	90.9	163.7	175.4	1.2	0	0	0	108.5	L419 S420 G421 F422 Y424 L460 L462	D417-L419 PolarHBondContact O-N 2.62Å; D417-L419 WeakPolarHBondContact OD1-CB 3.39Å; D417-L419 PolarHBondContact OD1-N 3.28Å; D417-L419 VanDerWaalsContact OD1-N 3.08Å; D417-S420 PolarHBondContact OD1-N 2.97Å; D417-S420 WeakPolarHBondContact OD2-CB 3.24Å; D417-S420 PolarHBondContact OD2-OG 3.37Å; D417-G421 WeakPolarHBondContact O-CA 3.25Å; D417-G421 PolarHBondContact O-N 2.84Å; D417-F422 PolarHBondContact N-O 3.22Å; D417-F422 PolarHBondContact O-N 3.35Å; D417-Y424 HydrophobicContact CB-CE2 4.13Å; D417-L460 HydrophobicContact CB-CD1 4.41Å; D417-L462 HydrophobicContact CB-CD2 3.86Å
418	P	95.9	Very high	96.2	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.019	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-12.6	-177.7	31	-35.5	0	0	0	113.6	D374 W375 I376 M439	D374-P418 WeakPolarHBondContact OD1-CB 3.48Å; W375-P418 HydrophobicContact CD2-CG 4.13Å; W375-P418 HydrophobicContact CE3-CG 4.31Å; W375-P418 HydrophobicContact CH2-CG 3.75Å; W375-P418 HydrophobicContact CZ2-CG 3.54Å; W375-P418 HydrophobicContact CZ3-CG 4.13Å; I376-P418 HydrophobicContact CB-CB 4.24Å; I376-P418 HydrophobicContact CD1-CB 3.93Å; I376-P418 HydrophobicContact CD1-CG 3.87Å; I376-P418 HydrophobicContact CG1-CB 4.2Å; I376-P418 HydrophobicContact CG1-CG 4.15Å; P418-M439 HydrophobicContact CB-CE 4.35Å; P418-M439 HydrophobicContact CB-SD 4.37Å
419	L	94.1	Very high	96.2	Very high	72 Å²	72	23.1 Å²	23.1	38%	0.377	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-44.3	176.2	-61.4	171.4	0	0	0	110.7	I376 D417 L553	I376-L419 HydrophobicContact CD1-CD2 3.66Å; I376-L419 HydrophobicContact CD1-CG 4.32Å; D417-L419 PolarHBondContact O-N 2.62Å; D417-L419 WeakPolarHBondContact OD1-CB 3.39Å; D417-L419 PolarHBondContact OD1-N 3.28Å; D417-L419 VanDerWaalsContact OD1-N 3.08Å; L419-L553 HydrophobicContact CD1-CB 3.96Å; L419-L553 HydrophobicContact CD1-CD1 3.84Å
420	S	94.5	Very high	96	Very high	44 Å²	44	24.4 Å²	24.4	31%	0.308	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-11	178.7	-46.6	0	0	0	0	113.1	D417 Q575	D417-S420 PolarHBondContact OD1-N 2.97Å; D417-S420 WeakPolarHBondContact OD2-CB 3.24Å; D417-S420 PolarHBondContact OD2-OG 3.37Å; S420-Q575 WeakPolarHBondContact O-CG 3.16Å; S420-Q575 PolarHBondContact O-N 3.24Å
421	G	96	Very high	95.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.01	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	32.3	179.4	0	0	0	0	0	113.8	D417 G438 M439	D417-G421 WeakPolarHBondContact O-CA 3.25Å; D417-G421 PolarHBondContact O-N 2.84Å; G421-G438 CarbonylContact O-C 3.53Å; G421-G438 WeakPolarHBondContact O-CA 3.48Å; G421-M439 PolarHBondContact O-N 2.93Å
422	F	97.5	Very high	95.9	Very high	18 Å²	18	28 Å²	28	8%	0.079	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	149.7	179.9	-72.3	-73.9	0	0	0	112.8	D417 Y424 K436 S437 M439 P574 I576	D417-F422 PolarHBondContact N-O 3.22Å; D417-F422 PolarHBondContact O-N 3.35Å; F422-Y424 HydrophobicContact CB-CE2 3.64Å; F422-K436 HydrophobicContact CB-CG 4.5Å; F422-K436 HydrophobicContact CD1-CD 4.11Å; F422-K436 HydrophobicContact CD1-CG 3.93Å; F422-K436 HydrophobicContact CE1-CD 4.43Å; F422-K436 VanDerWaalsContact CE1-CE 3.49Å; F422-K436 HydrophobicContact CG-CG 4.45Å; F422-S437 CarbonylContact C-O 3.6Å; F422-S437 VanDerWaalsContact CA-O 3.3Å; F422-S437 WeakPolarHBondContact CA-O 3.06Å; F422-S437 WeakPolarHBondContact CD1-O 3.39Å; F422-M439 VanDerWaalsContact C-CG 3.47Å; F422-M439 WeakPolarHBondContact O-CG 3.5Å; F422-P574 HydrophobicContact CD1-CB 3.93Å; F422-P574 HydrophobicContact CE1-CB 3.42Å; F422-P574 VanDerWaalsContact CE1-CB 3.42Å; F422-P574 HydrophobicContact CE2-CB 4.3Å; F422-P574 HydrophobicContact CZ-CB 3.63Å; F422-I576 HydrophobicContact CZ-CG1 4.2Å
423	L	97.6	Very high	96	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.4	178.2	-177.9	71.5	0	0	0	108.1	Y381 I390 L403 I414 V416 W425 K436 S437 M439	Y381-L423 HydrophobicContact CD1-CD1 4.09Å; Y381-L423 HydrophobicContact CD1-CD2 4.25Å; Y381-L423 HydrophobicContact CG-CD1 4.18Å; I390-L423 HydrophobicContact CG2-CD2 3.94Å; L403-L423 HydrophobicContact CD1-CD2 4.44Å; I414-L423 HydrophobicContact CD1-CD1 3.81Å; I414-L423 HydrophobicContact CD1-CD2 4.27Å; I414-L423 HydrophobicContact CD1-CG 4.3Å; I414-L423 HydrophobicContact CG1-CD1 3.73Å; I414-L423 HydrophobicContact CG1-CG 4.31Å; V416-L423 HydrophobicContact CG1-CD1 3.45Å; V416-L423 VanDerWaalsContact CG1-CD1 3.45Å; L423-W425 HydrophobicContact CD2-CE3 4.44Å; L423-W425 HydrophobicContact CD2-CZ3 4.46Å; L423-W425 HydrophobicContact CG-CE3 4.31Å; L423-K436 CarbonylContact O-C 3.57Å; L423-K436 VanDerWaalsContact O-CA 3.31Å; L423-K436 WeakPolarHBondContact O-CA 3.14Å; L423-S437 PolarHBondContact N-O 2.99Å; L423-S437 PolarHBondContact O-N 2.91Å; L423-M439 HydrophobicContact CB-CG 4.12Å
424	Y	98.4	Very high	96.1	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.4	-178.8	-56.3	-99.3	0	0	0	109.3	I414 A415 D417 F422 E435 K436 L447 I458 L460 L467 L482	I414-Y424 CarbonylContact C-O 3.48Å; I414-Y424 WeakPolarHBondContact CA-O 3.35Å; I414-Y424 WeakPolarHBondContact CG1-O 3.27Å; A415-Y424 PolarHBondContact N-O 2.93Å; A415-Y424 PolarHBondContact O-N 2.03Å; D417-Y424 HydrophobicContact CB-CE2 4.13Å; F422-Y424 HydrophobicContact CB-CE2 3.64Å; Y424-E435 WeakPolarHBondContact CA-O 3.46Å; Y424-K436 HydrophobicContact CD1-CB 3.9Å; Y424-K436 HydrophobicContact CD1-CD 4.28Å; Y424-K436 HydrophobicContact CD1-CG 3.87Å; Y424-K436 HydrophobicContact CE1-CB 3.95Å; Y424-K436 HydrophobicContact CE1-CD 3.46Å; Y424-K436 VanDerWaalsContact CE1-CD 3.46Å; Y424-K436 HydrophobicContact CE1-CG 3.49Å; Y424-K436 VanDerWaalsContact CE1-CG 3.49Å; Y424-K436 WeakPolarHBondContact OH-CE 3Å; Y424-K436 PolarHBondContact OH-NZ 3.49Å; Y424-L447 HydrophobicContact CD1-CD2 4.2Å; Y424-L447 HydrophobicContact CE1-CD2 4.35Å; Y424-I458 WeakPolarHBondContact O-CD1 3.35Å; Y424-L460 HydrophobicContact CD2-CD1 3.72Å; Y424-L460 HydrophobicContact CD2-CD2 4.03Å; Y424-L460 HydrophobicContact CE2-CD1 4.02Å; Y424-L460 HydrophobicContact CE2-CD2 4.37Å; Y424-L460 HydrophobicContact CG-CD2 4.19Å; Y424-L467 HydrophobicContact CD1-CD1 3.88Å; Y424-L467 HydrophobicContact CG-CD1 4.15Å; Y424-L482 HydrophobicContact CE1-CD2 3.82Å; Y424-L482 HydrophobicContact CE2-CD2 4.36Å
425	W	98.2	Very high	96	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	155.8	174.1	66.8	93.7	0	0	0	111.9	I390 F404 L408 S413 I414 L423 I434 E435 S437 R444	I390-W425 HydrophobicContact CD1-CB 4.25Å; I390-W425 HydrophobicContact CD1-CD2 3.34Å; I390-W425 VanDerWaalsContact CD1-CE2 3.43Å; I390-W425 HydrophobicContact CD1-CE3 3.91Å; I390-W425 HydrophobicContact CD1-CG 3.51Å; I390-W425 HydrophobicContact CD1-CZ2 4.04Å; I390-W425 HydrophobicContact CD1-CZ3 4.47Å; F404-W425 HydrophobicContact CD2-CH2 4.19Å; F404-W425 AromaticContact CE2-CH2 3.91Å; F404-W425 HydrophobicContact CE2-CH2 3.91Å; F404-W425 HydrophobicContact CE2-CZ3 4.2Å; F404-W425 HydrophobicContact CZ-CH2 4.39Å; L408-W425 HydrophobicContact CD2-CZ2 4.37Å; S413-W425 WeakPolarHBondContact O-CA 3.31Å; S413-W425 WeakPolarHBondContact O-CB 3.02Å; I414-W425 HydrophobicContact CB-CB 4.36Å; I414-W425 HydrophobicContact CG1-CB 4.23Å; L423-W425 HydrophobicContact CD2-CE3 4.44Å; L423-W425 HydrophobicContact CD2-CZ3 4.46Å; L423-W425 HydrophobicContact CG-CE3 4.31Å; W425-I434 WeakPolarHBondContact O-CA 3.41Å; W425-E435 HydrophobicContact CD2-CB 3.96Å; W425-E435 HydrophobicContact CE3-CB 4.34Å; W425-E435 HydrophobicContact CH2-CB 3.78Å; W425-E435 HydrophobicContact CZ2-CB 3.32Å; W425-E435 HydrophobicContact CZ2-CG 4.04Å; W425-E435 WeakPolarHBondContact CZ2-OE2 3.36Å; W425-E435 HydrophobicContact CZ3-CB 4.24Å; W425-E435 PolarHBondContact N-O 3.24Å; W425-E435 VanDerWaalsContact N-O 3.1Å; W425-E435 PolarHBondContact NE1-OE2 3.27Å; W425-E435 PolarHBondContact O-N 3.43Å; W425-S437 VanDerWaalsContact CZ3-OG 3.32Å; W425-S437 WeakPolarHBondContact CZ3-OG 3.5Å; W425-R444 HydrophobicContact CH2-CG 4.01Å; W425-R444 HydrophobicContact CZ2-CG 4.36Å
426	S	97.6	Very high	95.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	142.5	169.6	49.7	0	0	0	0	111.3	P411 A412 S413 P455 N456	P411-S426 WeakPolarHBondContact CA-O 3.1Å; A412-S426 PolarHBondContact N-O 2.79Å; S413-S426 PolarHBondContact N-OG 2.76Å; S413-S426 PolarHBondContact O-N 3.24Å; S413-S426 PolarHBondContact O-OG 2.8Å; S426-P455 VanDerWaalsContact CB-O 3.3Å; S426-P455 WeakPolarHBondContact CB-O 3.33Å; S426-P455 PolarHBondContact OG-O 3.32Å; S426-N456 PolarHBondContact OG-O 2.97Å
427	D	97.1	Very high	95.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	114.8	171.8	-173.8	-19.2	0	0	0	108	L408 R409 E410 G429 A432 K433	L408-D427 WeakPolarHBondContact CA-OD2 3.37Å; R409-D427 PolarHBondContact N-OD2 2.84Å; E410-D427 PolarHBondContact N-OD1 3.4Å; E410-D427 WeakPolarHBondContact O-CA 3.34Å; D427-G429 PolarHBondContact OD1-N 2.92Å; D427-A432 CarbonylContact O-C 3.59Å; D427-A432 WeakPolarHBondContact O-CA 3.18Å; D427-K433 HydrophobicContact CB-CG 4.11Å; D427-K433 PolarHBondContact N-O 3.03Å; D427-K433 PolarHBondContact O-N 3.07Å; D427-K433 VanDerWaalsContact O-O 3.1Å
428	W	94.9	Very high	95.9	Very high	83 Å²	83	28.3 Å²	28.3	31%	0.314	15%	0.148	S	C	.	.			trans	-95.1	0.9	-178	61	-95.2	0	0	0	113.6	E410 P455	E410-W428 HydrophobicContact CB-CD2 3.59Å; E410-W428 HydrophobicContact CB-CE3 4.08Å; E410-W428 HydrophobicContact CB-CG 4.04Å; E410-W428 HydrophobicContact CB-CH2 4.07Å; E410-W428 HydrophobicContact CB-CZ2 3.6Å; E410-W428 HydrophobicContact CB-CZ3 4.29Å; E410-W428 HydrophobicContact CG-CD2 4.15Å; E410-W428 HydrophobicContact CG-CE3 4.13Å; E410-W428 HydrophobicContact CG-CH2 3.73Å; E410-W428 HydrophobicContact CG-CZ2 3.76Å; E410-W428 HydrophobicContact CG-CZ3 3.92Å; E410-W428 VanDerWaalsContact O-CD1 3.25Å; E410-W428 PolarHBondContact O-N 2.9Å; E410-W428 VanDerWaalsContact O-N 3.15Å; E410-W428 PolarHBondContact O-NE1 3.18Å; W428-P455 HydrophobicContact CB-CG 4.17Å
429	G	91.7	Very high	95.9	Very high	6 Å²	6	28.1 Å²	28.1	6%	0.062	15%	0.147	C	C	.	.	S	Bend	trans	-70.6	162.7	175.5	0	0	0	0	0	111.4	D427 P431 A432	D427-G429 PolarHBondContact OD1-N 2.92Å; G429-P431 CarbonylContact O-C 3.54Å; G429-P431 WeakPolarHBondContact O-CA 3.49Å; G429-A432 VanDerWaalsContact O-CA 3.26Å; G429-A432 WeakPolarHBondContact O-CA 3.32Å; G429-A432 PolarHBondContact O-N 3.23Å
430	E	89.6	Confident	95.9	Very high	178 Å²	178	26 Å²	26	83%	0.832	14%	0.136	S	C	*	.	S	Bend	trans	-78.9	122	-174.3	-63.1	-178.9	174	0	0	112.6
431	P	92.6	Very high	95.9	Very high	103 Å²	103	25.1 Å²	25.1	67%	0.669	13%	0.134	S	C	*	.	S	Bend	cis	-82.1	139.5	-4.9	33.8	-34.2	0	0	0	113.4	G429	G429-P431 CarbonylContact O-C 3.54Å; G429-P431 WeakPolarHBondContact O-CA 3.49Å
432	A	95.7	Very high	95.7	Very high	16 Å²	16	27 Å²	27	13%	0.132	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-69.3	142.6	-178	0	0	0	0	0	111.4	D427 G429 I452 Q453	D427-A432 CarbonylContact O-C 3.59Å; D427-A432 WeakPolarHBondContact O-CA 3.18Å; G429-A432 VanDerWaalsContact O-CA 3.26Å; G429-A432 WeakPolarHBondContact O-CA 3.32Å; G429-A432 PolarHBondContact O-N 3.23Å; A432-I452 HydrophobicContact CB-CG2 4.33Å; A432-I452 WeakPolarHBondContact O-CG2 3.48Å; A432-Q453 WeakPolarHBondContact CB-O 3Å
433	K	96.6	Very high	95.5	Very high	31 Å²	31	29 Å²	29	14%	0.135	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	157	-171.4	59.9	-165.4	179.5	-157	0	112.7	G407 D427 E435 V446 V448	G407-K433 PolarHBondContact O-NZ 2.89Å; D427-K433 HydrophobicContact CB-CG 4.11Å; D427-K433 PolarHBondContact N-O 3.03Å; D427-K433 PolarHBondContact O-N 3.07Å; D427-K433 VanDerWaalsContact O-O 3.1Å; K433-E435 HydrophobicContact CD-CG 4.01Å; K433-E435 VanDerWaalsContact CE-OE2 3.24Å; K433-E435 WeakPolarHBondContact CE-OE2 3.46Å; K433-E435 HydrophobicContact CG-CG 4.02Å; K433-V446 HydrophobicContact CB-CG1 4.09Å; K433-V448 CarbonylContact C-O 3.58Å; K433-V448 VanDerWaalsContact CA-O 3.24Å; K433-V448 WeakPolarHBondContact CA-O 3.48Å; K433-V448 WeakPolarHBondContact CB-O 3.38Å
434	I	98.1	Very high	95.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.4	161.5	-64.2	166.9	0	0	0	106.9	W425 L447 V448 I452 P455 I458 L467 W469	W425-I434 WeakPolarHBondContact O-CA 3.41Å; I434-L447 HydrophobicContact CG2-CB 4.44Å; I434-L447 HydrophobicContact CG2-CD2 4.25Å; I434-L447 WeakPolarHBondContact O-CA 3.34Å; I434-L447 WeakPolarHBondContact O-CB 3.06Å; I434-L447 PolarHBondContact O-N 2.78Å; I434-V448 HydrophobicContact CB-CB 4.12Å; I434-V448 HydrophobicContact CB-CG2 4.38Å; I434-V448 HydrophobicContact CD1-CB 4.42Å; I434-V448 HydrophobicContact CD1-CG2 4.41Å; I434-V448 PolarHBondContact N-O 3.21Å; I434-V448 PolarHBondContact O-N 3.14Å; I434-V448 VanDerWaalsContact O-N 3.1Å; I434-I452 HydrophobicContact CD1-CD1 3.91Å; I434-I452 HydrophobicContact CG1-CD1 3.73Å; I434-P455 HydrophobicContact CG1-CB 4.4Å; I434-I458 HydrophobicContact CD1-CG2 4.5Å; I434-L467 HydrophobicContact CD1-CD2 4.15Å; I434-L467 HydrophobicContact CG2-CD1 4.05Å; I434-W469 HydrophobicContact CD1-CB 3.99Å; I434-W469 HydrophobicContact CD1-CD2 3.71Å; I434-W469 HydrophobicContact CD1-CE3 4.2Å; I434-W469 HydrophobicContact CD1-CG 3.62Å
435	E	97.1	Very high	95.3	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	157.4	-177.5	-66.9	-174.9	96.1	0	0	111.3	Y424 W425 K433 R444 Q445 V446	Y424-E435 WeakPolarHBondContact CA-O 3.46Å; W425-E435 HydrophobicContact CD2-CB 3.96Å; W425-E435 HydrophobicContact CE3-CB 4.34Å; W425-E435 HydrophobicContact CH2-CB 3.78Å; W425-E435 HydrophobicContact CZ2-CB 3.32Å; W425-E435 HydrophobicContact CZ2-CG 4.04Å; W425-E435 WeakPolarHBondContact CZ2-OE2 3.36Å; W425-E435 HydrophobicContact CZ3-CB 4.24Å; W425-E435 PolarHBondContact N-O 3.24Å; W425-E435 VanDerWaalsContact N-O 3.1Å; W425-E435 PolarHBondContact NE1-OE2 3.27Å; W425-E435 PolarHBondContact O-N 3.43Å; K433-E435 HydrophobicContact CD-CG 4.01Å; K433-E435 VanDerWaalsContact CE-OE2 3.24Å; K433-E435 WeakPolarHBondContact CE-OE2 3.46Å; K433-E435 HydrophobicContact CG-CG 4.02Å; E435-R444 VanDerWaalsContact CD-NH2 3.26Å; E435-R444 IonicContact OE1-CZ 3.24Å; E435-R444 VanDerWaalsContact OE1-CZ 3.24Å; E435-R444 IonicContact OE1-NE 2.74Å; E435-R444 PolarHBondContact OE1-NE 2.75Å; E435-R444 IonicContact OE1-NH2 2.73Å; E435-R444 PolarHBondContact OE1-NH2 2.86Å; E435-R444 IonicContact OE2-CZ 3.24Å; E435-R444 IonicContact OE2-NE 3.72Å; E435-R444 IonicContact OE2-NH2 2.96Å; E435-R444 PolarHBondContact OE2-NH2 3.16Å; E435-Q445 WeakPolarHBondContact CA-O 3.22Å; E435-V446 HydrophobicContact CG-CG2 4.32Å
436	K	96.8	Very high	95.2	Very high	30 Å²	30	41 Å²	41	13%	0.13	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143	176.9	178.6	-176.1	-175.6	168.8	0	108.8	F422 L423 Y424 R444 Q445 L482	F422-K436 HydrophobicContact CB-CG 4.5Å; F422-K436 HydrophobicContact CD1-CD 4.11Å; F422-K436 HydrophobicContact CD1-CG 3.93Å; F422-K436 HydrophobicContact CE1-CD 4.43Å; F422-K436 VanDerWaalsContact CE1-CE 3.49Å; F422-K436 HydrophobicContact CG-CG 4.45Å; L423-K436 CarbonylContact O-C 3.57Å; L423-K436 VanDerWaalsContact O-CA 3.31Å; L423-K436 WeakPolarHBondContact O-CA 3.14Å; Y424-K436 HydrophobicContact CD1-CB 3.9Å; Y424-K436 HydrophobicContact CD1-CD 4.28Å; Y424-K436 HydrophobicContact CD1-CG 3.87Å; Y424-K436 HydrophobicContact CE1-CB 3.95Å; Y424-K436 HydrophobicContact CE1-CD 3.46Å; Y424-K436 VanDerWaalsContact CE1-CD 3.46Å; Y424-K436 HydrophobicContact CE1-CG 3.49Å; Y424-K436 VanDerWaalsContact CE1-CG 3.49Å; Y424-K436 WeakPolarHBondContact OH-CE 3Å; Y424-K436 PolarHBondContact OH-NZ 3.49Å; K436-R444 CarbonylContact O-C 3.56Å; K436-R444 WeakPolarHBondContact O-CA 3.47Å; K436-Q445 PolarHBondContact N-O 3.31Å; K436-Q445 PolarHBondContact O-N 2.82Å; K436-Q445 VanDerWaalsContact O-O 3.07Å; K436-L482 PolarHBondContact NZ-O 2.87Å
437	S	97.2	Very high	95.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	167.5	170.4	70.3	0	0	0	0	111.4	F404 F422 L423 W425 D443	F404-S437 VanDerWaalsContact CE2-OG 3.28Å; F404-S437 WeakPolarHBondContact CE2-OG 3.31Å; F404-S437 WeakPolarHBondContact CZ-OG 3.35Å; F422-S437 CarbonylContact C-O 3.6Å; F422-S437 VanDerWaalsContact CA-O 3.3Å; F422-S437 WeakPolarHBondContact CA-O 3.06Å; F422-S437 WeakPolarHBondContact CD1-O 3.39Å; L423-S437 PolarHBondContact N-O 2.99Å; L423-S437 PolarHBondContact O-N 2.91Å; W425-S437 VanDerWaalsContact CZ3-OG 3.32Å; W425-S437 WeakPolarHBondContact CZ3-OG 3.5Å; S437-D443 WeakPolarHBondContact CA-O 3.49Å
438	G	97.1	Very high	95.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	141.6	163.3	0	0	0	0	0	111.5	G421 N440 G441 A442	G421-G438 CarbonylContact O-C 3.53Å; G421-G438 WeakPolarHBondContact O-CA 3.48Å; G438-N440 PolarHBondContact O-N 3.09Å; G438-N440 VanDerWaalsContact O-N 3.08Å; G438-G441 WeakPolarHBondContact O-CA 3.46Å; G438-G441 PolarHBondContact O-N 2.8Å; G438-A442 WeakPolarHBondContact CA-O 3.16Å; G438-A442 PolarHBondContact N-O 3.33Å
439	M	96.6	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.1	177.6	-71.7	176.1	75.7	0	0	113.2	D374 Y381 V416 P418 G421 F422 L423 G441 P572	D374-M439 HydrophobicContact CB-CE 3.79Å; D374-M439 WeakPolarHBondContact OD2-CE 3.45Å; Y381-M439 HydrophobicContact CD2-CE 4.34Å; Y381-M439 HydrophobicContact CE1-CB 4.4Å; Y381-M439 WeakPolarHBondContact CE1-O 3.31Å; Y381-M439 HydrophobicContact CE2-CE 3.48Å; Y381-M439 VanDerWaalsContact CE2-CE 3.48Å; V416-M439 HydrophobicContact CB-CE 3.92Å; V416-M439 HydrophobicContact CB-SD 4.42Å; V416-M439 HydrophobicContact CG1-CE 3.86Å; P418-M439 HydrophobicContact CB-CE 4.35Å; P418-M439 HydrophobicContact CB-SD 4.37Å; G421-M439 PolarHBondContact O-N 2.93Å; F422-M439 VanDerWaalsContact C-CG 3.47Å; F422-M439 WeakPolarHBondContact O-CG 3.5Å; L423-M439 HydrophobicContact CB-CG 4.12Å; M439-G441 VanDerWaalsContact C-N 3.26Å; M439-G441 PolarHBondContact O-N 2.92Å; M439-P572 HydrophobicContact CB-CG 3.86Å; M439-P572 HydrophobicContact CE-CG 3.94Å; M439-P572 HydrophobicContact CG-CG 4.39Å; M439-P572 HydrophobicContact SD-CG 3.69Å
440	N	93.9	Very high	95.3	Very high	27 Å²	27	46.2 Å²	46.2	14%	0.144	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.4	170.9	66.7	-13.9	0	0	0	114.6	G438 A442 L571 P572 P574 S584 V586	G438-N440 PolarHBondContact O-N 3.09Å; G438-N440 VanDerWaalsContact O-N 3.08Å; N440-A442 VanDerWaalsContact OD1-CB 3.3Å; N440-A442 WeakPolarHBondContact OD1-CB 3.41Å; N440-A442 PolarHBondContact OD1-N 2.91Å; N440-L571 HydrophobicContact CB-CB 4.01Å; N440-P572 PolarHBondContact N-O 2.76Å; N440-P574 WeakPolarHBondContact OD1-CD 3.01Å; N440-S584 WeakPolarHBondContact CB-OG 3.48Å; N440-S584 PolarHBondContact ND2-OG 2.94Å; N440-V586 HydrophobicContact CB-CG2 4.31Å
441	G	93.4	Very high	95.4	Very high	26 Å²	26	43.4 Å²	43.4	27%	0.268	26%	0.256	S	S	.	.	S	Bend	trans	87.2	9.2	-175.8	0	0	0	0	0	114.9	F404 G438 M439	F404-G441 WeakPolarHBondContact CE1-O 3.03Å; G438-G441 WeakPolarHBondContact O-CA 3.46Å; G438-G441 PolarHBondContact O-N 2.8Å; M439-G441 VanDerWaalsContact C-N 3.26Å; M439-G441 PolarHBondContact O-N 2.92Å
442	A	92.8	Very high	95.5	Very high	41 Å²	41	38.9 Å²	38.9	34%	0.339	23%	0.226	S	C	.	.			trans	-93.3	169.3	176	0	0	0	0	0	112.1	G438 N440 R444	G438-A442 WeakPolarHBondContact CA-O 3.16Å; G438-A442 PolarHBondContact N-O 3.33Å; N440-A442 VanDerWaalsContact OD1-CB 3.3Å; N440-A442 WeakPolarHBondContact OD1-CB 3.41Å; N440-A442 PolarHBondContact OD1-N 2.91Å; A442-R444 PolarHBondContact O-N 3.48Å
443	D	93.6	Very high	95.5	Very high	58 Å²	58	42.8 Å²	42.8	31%	0.31	24%	0.241	S	C	.	.	S	Bend	trans	51.9	48.7	170	-164.9	41.3	0	0	0	114.9	S437 Q445 P574 I576	S437-D443 WeakPolarHBondContact CA-O 3.49Å; D443-Q445 VanDerWaalsContact CG-NE2 3.33Å; D443-Q445 PolarHBondContact OD1-NE2 3.15Å; D443-Q445 PolarHBondContact OD2-NE2 3.13Å; D443-P574 HydrophobicContact CB-CG 4.3Å; D443-I576 HydrophobicContact CB-CD1 4.28Å; D443-I576 VanDerWaalsContact OD2-CD1 3.23Å; D443-I576 WeakPolarHBondContact OD2-CD1 3.37Å
444	R	95.9	Very high	95.4	Very high	68 Å²	68	46.4 Å²	46.4	26%	0.257	25%	0.254	S	S	.	.			trans	-73.9	127.2	176.8	177.9	174.4	176.5	-179.5	7	111	F404 T406 G407 W425 E435 K436 A442	F404-R444 HydrophobicContact CE1-CB 4.11Å; F404-R444 HydrophobicContact CE1-CG 4.5Å; F404-R444 HydrophobicContact CZ-CB 4.29Å; T406-R444 PolarHBondContact O-NH1 2.83Å; G407-R444 PolarHBondContact O-NH2 3.29Å; W425-R444 HydrophobicContact CH2-CG 4.01Å; W425-R444 HydrophobicContact CZ2-CG 4.36Å; E435-R444 VanDerWaalsContact CD-NH2 3.26Å; E435-R444 IonicContact OE1-CZ 3.24Å; E435-R444 VanDerWaalsContact OE1-CZ 3.24Å; E435-R444 IonicContact OE1-NE 2.74Å; E435-R444 PolarHBondContact OE1-NE 2.75Å; E435-R444 IonicContact OE1-NH2 2.73Å; E435-R444 PolarHBondContact OE1-NH2 2.86Å; E435-R444 IonicContact OE2-CZ 3.24Å; E435-R444 IonicContact OE2-NE 3.72Å; E435-R444 IonicContact OE2-NH2 2.96Å; E435-R444 PolarHBondContact OE2-NH2 3.16Å; K436-R444 CarbonylContact O-C 3.56Å; K436-R444 WeakPolarHBondContact O-CA 3.47Å; A442-R444 PolarHBondContact O-N 3.48Å
445	Q	94.9	Very high	95.3	Very high	106 Å²	106	46.4 Å²	46.4	50%	0.495	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.3	-177.1	-57.7	-179.9	10.3	0	0	110.3	E435 K436 D443	E435-Q445 WeakPolarHBondContact CA-O 3.22Å; K436-Q445 PolarHBondContact N-O 3.31Å; K436-Q445 PolarHBondContact O-N 2.82Å; K436-Q445 VanDerWaalsContact O-O 3.07Å; D443-Q445 VanDerWaalsContact CG-NE2 3.33Å; D443-Q445 PolarHBondContact OD1-NE2 3.15Å; D443-Q445 PolarHBondContact OD2-NE2 3.13Å
446	V	95.8	Very high	95.1	Very high	80 Å²	80	47.1 Å²	47.1	49%	0.485	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.2	172.6	-177.7	0	0	0	0	108.4	K433 E435 A449	K433-V446 HydrophobicContact CB-CG1 4.09Å; E435-V446 HydrophobicContact CG-CG2 4.32Å; V446-A449 HydrophobicContact CG1-CB 3.93Å
447	L	96.9	Very high	95.1	Very high	28 Å²	28	45.7 Å²	45.7	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-44.8	179.6	-173.6	71.4	0	0	0	111.4	Y424 I434 L467 V480	Y424-L447 HydrophobicContact CD1-CD2 4.2Å; Y424-L447 HydrophobicContact CE1-CD2 4.35Å; I434-L447 HydrophobicContact CG2-CB 4.44Å; I434-L447 HydrophobicContact CG2-CD2 4.25Å; I434-L447 WeakPolarHBondContact O-CA 3.34Å; I434-L447 WeakPolarHBondContact O-CB 3.06Å; I434-L447 PolarHBondContact O-N 2.78Å; L447-L467 HydrophobicContact CD2-CD1 4.02Å; L447-V480 HydrophobicContact CD2-CG1 4.23Å
448	V	97.1	Very high	95.1	Very high	9 Å²	9	46.1 Å²	46.1	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.4	179.5	-175.3	0	0	0	0	109.1	K433 I434 I452 W469 V480	K433-V448 CarbonylContact C-O 3.58Å; K433-V448 VanDerWaalsContact CA-O 3.24Å; K433-V448 WeakPolarHBondContact CA-O 3.48Å; K433-V448 WeakPolarHBondContact CB-O 3.38Å; I434-V448 HydrophobicContact CB-CB 4.12Å; I434-V448 HydrophobicContact CB-CG2 4.38Å; I434-V448 HydrophobicContact CD1-CB 4.42Å; I434-V448 HydrophobicContact CD1-CG2 4.41Å; I434-V448 PolarHBondContact N-O 3.21Å; I434-V448 PolarHBondContact O-N 3.14Å; I434-V448 VanDerWaalsContact O-N 3.1Å; V448-I452 HydrophobicContact CG1-CD1 4.18Å; V448-W469 HydrophobicContact CG1-CZ2 4.4Å; V448-V480 HydrophobicContact CG2-CG1 4.03Å
449	A	94.9	Very high	95.1	Very high	67 Å²	67	47.1 Å²	47.1	55%	0.554	26%	0.261	S	S	*	.			trans	-133.4	-7.5	-178.6	0	0	0	0	0	114.2	V446	V446-A449 HydrophobicContact CG1-CB 3.93Å
450	T	93.8	Very high	95.2	Very high	94 Å²	94	48.1 Å²	48.1	58%	0.577	27%	0.266	S	S	*	.	S	Bend	trans	-118	157.3	-176.4	58.3	0	0	0	0	110.7	I452 R487	T450-I452 PolarHBondContact O-N 3.36Å; T450-I452 VanDerWaalsContact O-N 3.14Å; T450-R487 PolarHBondContact O-NH1 3.23Å
451	D	92.8	Very high	95.3	Very high	120 Å²	120	47.6 Å²	47.6	64%	0.642	26%	0.263	S	S	*	.	S	Bend	trans	43.9	47.4	-178.3	-56.3	-29.2	0	0	0	112.6	L474 R487	D451-L474 WeakPolarHBondContact O-CD1 3.48Å; D451-R487 PolarHBondContact O-NH2 3.33Å
452	I	95.3	Very high	95.3	Very high	7 Å²	7	48 Å²	48	4%	0.036	26%	0.259	C	S	.	.			trans	-142.2	134.2	-176.5	-170	164.6	0	0	0	107.9	A432 I434 V448 T450 P455	A432-I452 HydrophobicContact CB-CG2 4.33Å; A432-I452 WeakPolarHBondContact O-CG2 3.48Å; I434-I452 HydrophobicContact CD1-CD1 3.91Å; I434-I452 HydrophobicContact CG1-CD1 3.73Å; V448-I452 HydrophobicContact CG1-CD1 4.18Å; T450-I452 PolarHBondContact O-N 3.36Å; T450-I452 VanDerWaalsContact O-N 3.14Å; I452-P455 HydrophobicContact CD1-CB 3.75Å; I452-P455 HydrophobicContact CD1-CG 3.72Å; I452-P455 HydrophobicContact CG1-CB 3.95Å; I452-P455 HydrophobicContact CG1-CG 3.76Å
453	Q	94.2	Very high	95.1	Very high	98 Å²	98	48.2 Å²	48.2	46%	0.458	25%	0.254	S	S	.	.	S	Bend	trans	-131.9	-70.2	-176.9	-67.3	-62.7	-43.5	0	0	109.7	A432 P455 D471 K473 L474	A432-Q453 WeakPolarHBondContact CB-O 3Å; Q453-P455 WeakPolarHBondContact O-CD 3.35Å; Q453-D471 PolarHBondContact N-OD2 3.07Å; Q453-K473 HydrophobicContact CB-CB 3.74Å; Q453-K473 HydrophobicContact CB-CG 3.91Å; Q453-K473 HydrophobicContact CG-CG 4.37Å; Q453-L474 HydrophobicContact CB-CD1 4.43Å; Q453-L474 HydrophobicContact CB-CG 4.1Å; Q453-L474 HydrophobicContact CG-CD1 4.04Å; Q453-L474 HydrophobicContact CG-CD2 3.82Å; Q453-L474 HydrophobicContact CG-CG 3.83Å
454	W	95.3	Very high	94.9	Very high	108 Å²	108	48.8 Å²	48.8	41%	0.409	25%	0.254	S	S	.	.			trans	-118.2	70.9	179.6	-66.6	-8.5	0	0	0	111.6	N456 D471 S472 K473	W454-N456 PolarHBondContact O-N 3.03Å; W454-N456 VanDerWaalsContact O-N 3.14Å; W454-D471 PolarHBondContact N-OD1 2.85Å; W454-D471 VanDerWaalsContact N-OD1 3.13Å; W454-D471 PolarHBondContact N-OD2 3.25Å; W454-D471 WeakPolarHBondContact O-CA 2.98Å; W454-S472 PolarHBondContact O-N 3.15Å; W454-S472 VanDerWaalsContact O-N 3.09Å; W454-K473 HydrophobicContact CB-CB 3.93Å; W454-K473 HydrophobicContact CD2-CB 3.72Å; W454-K473 HydrophobicContact CD2-CG 4.43Å; W454-K473 HydrophobicContact CE3-CB 3.97Å; W454-K473 HydrophobicContact CG-CB 3.71Å
455	P	96.4	Very high	94.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	108.9	174.9	30.6	-36.9	0	0	0	110.2	S426 W428 I434 I452 Q453	S426-P455 VanDerWaalsContact CB-O 3.3Å; S426-P455 WeakPolarHBondContact CB-O 3.33Å; S426-P455 PolarHBondContact OG-O 3.32Å; W428-P455 HydrophobicContact CB-CG 4.17Å; I434-P455 HydrophobicContact CG1-CB 4.4Å; I452-P455 HydrophobicContact CD1-CB 3.75Å; I452-P455 HydrophobicContact CD1-CG 3.72Å; I452-P455 HydrophobicContact CG1-CB 3.95Å; I452-P455 HydrophobicContact CG1-CG 3.76Å; Q453-P455 WeakPolarHBondContact O-CD 3.35Å
456	N	93.1	Very high	94.8	Very high	22 Å²	22	42.3 Å²	42.3	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-93.7	177.8	-76.4	-25.9	0	0	0	109.7	S413 S426 W454 V470 S472 P500 F501	S413-N456 WeakPolarHBondContact CB-O 3.43Å; S426-N456 PolarHBondContact OG-O 2.97Å; W454-N456 PolarHBondContact O-N 3.03Å; W454-N456 VanDerWaalsContact O-N 3.14Å; N456-V470 PolarHBondContact N-O 2.88Å; N456-V470 VanDerWaalsContact N-O 3.13Å; N456-S472 PolarHBondContact ND2-OG 3.01Å; N456-P500 PolarHBondContact ND2-O 2.71Å; N456-F501 WeakPolarHBondContact CB-O 3.37Å
457	G	95.5	Very high	94.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	138.6	-177.2	0	0	0	0	0	113.5	W469 V470 F501 V503	G457-W469 VanDerWaalsContact O-CA 3.25Å; G457-W469 WeakPolarHBondContact O-CA 3.35Å; G457-W469 WeakPolarHBondContact O-CB 3.47Å; G457-V470 PolarHBondContact O-N 3.45Å; G457-V470 VanDerWaalsContact O-N 3.17Å; G457-F501 WeakPolarHBondContact CA-O 3.28Å; G457-F501 PolarHBondContact N-O 2.87Å; G457-V503 WeakPolarHBondContact O-CG1 3.38Å
458	I	98.1	Very high	95	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.046	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.5	168.6	65.6	164.2	0	0	0	111	S413 A415 Y424 I434 Y468 W469	S413-I458 PolarHBondContact OG-N 2.03Å; A415-I458 HydrophobicContact CB-CD1 3.97Å; A415-I458 HydrophobicContact CB-CG1 4.2Å; Y424-I458 WeakPolarHBondContact O-CD1 3.35Å; I434-I458 HydrophobicContact CD1-CG2 4.5Å; I458-Y468 CarbonylContact C-O 3.59Å; I458-Y468 VanDerWaalsContact CA-O 3.32Å; I458-Y468 WeakPolarHBondContact CA-O 3.36Å; I458-W469 HydrophobicContact CG2-CB 3.85Å
459	T	97.9	Very high	95	Very high	21 Å²	21	36.8 Å²	36.8	13%	0.129	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	158.7	173.3	-166.3	0	0	0	0	111.2	L467 Y468 V503 V505	T459-L467 WeakPolarHBondContact O-CA 3.33Å; T459-Y468 PolarHBondContact N-O 3.41Å; T459-Y468 PolarHBondContact O-N 2.82Å; T459-V503 VanDerWaalsContact CB-O 3.27Å; T459-V503 WeakPolarHBondContact CB-O 3.24Å; T459-V503 HydrophobicContact CG2-CG1 4.01Å; T459-V503 HydrophobicContact CG2-CG2 4.31Å; T459-V505 HydrophobicContact CG2-CB 4.44Å; T459-V505 HydrophobicContact CG2-CG1 3.87Å; T459-V505 HydrophobicContact CG2-CG2 4.04Å
460	L	97.5	Very high	95.2	Very high	21 Å²	21	33.6 Å²	33.6	11%	0.11	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.4	-174.9	-55.5	175	0	0	0	110.4	A415 D417 Y424 L462 L467 L482	A415-L460 HydrophobicContact CB-CD1 3.79Å; A415-L460 HydrophobicContact CB-CG 3.8Å; D417-L460 HydrophobicContact CB-CD1 4.41Å; Y424-L460 HydrophobicContact CD2-CD1 3.72Å; Y424-L460 HydrophobicContact CD2-CD2 4.03Å; Y424-L460 HydrophobicContact CE2-CD1 4.02Å; Y424-L460 HydrophobicContact CE2-CD2 4.37Å; Y424-L460 HydrophobicContact CG-CD2 4.19Å; L460-L462 HydrophobicContact CB-CD2 4.08Å; L460-L462 HydrophobicContact CD1-CD2 4.31Å; L460-L467 HydrophobicContact CD2-CB 3.95Å; L460-L467 HydrophobicContact CD2-CD1 3.85Å; L460-L467 HydrophobicContact CD2-CG 3.93Å; L460-L482 HydrophobicContact CD2-CD2 3.72Å
461	D	95.6	Very high	95.3	Very high	16 Å²	16	29.1 Å²	29.1	9%	0.086	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	94.8	160.9	-172.6	-26.7	0	0	0	107.8	I463 K464 G465 R466 Y468 V505 K525	D461-I463 PolarHBondContact O-N 2.91Å; D461-I463 PolarHBondContact OD1-N 3.43Å; D461-I463 VanDerWaalsContact OD1-N 3.13Å; D461-K464 HydrophobicContact CB-CB 4.3Å; D461-K464 PolarHBondContact O-N 3.45Å; D461-K464 PolarHBondContact OD1-N 3.36Å; D461-G465 WeakPolarHBondContact O-CA 3.43Å; D461-G465 PolarHBondContact O-N 3.4Å; D461-R466 PolarHBondContact N-O 3.01Å; D461-R466 PolarHBondContact O-N 3.21Å; D461-Y468 HydrophobicContact CB-CE2 4.11Å; D461-V505 HydrophobicContact CB-CG2 4.19Å; D461-K525 IonicContact OD2-NZ 3.23Å; D461-K525 PolarHBondContact OD2-NZ 3.33Å
462	L	93.1	Very high	95.4	Very high	35 Å²	35	23.5 Å²	23.5	18%	0.183	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-21	-178.3	-63.4	-178	0	0	0	113.2	W375 D417 L460 L553	W375-L462 HydrophobicContact CH2-CD1 3.75Å; W375-L462 HydrophobicContact CZ2-CD1 3.94Å; D417-L462 HydrophobicContact CB-CD2 3.86Å; L460-L462 HydrophobicContact CB-CD2 4.08Å; L460-L462 HydrophobicContact CD1-CD2 4.31Å; L462-L553 HydrophobicContact CB-CD1 4.15Å
463	I	90.3	Very high	95.3	Very high	45 Å²	45	28.8 Å²	28.8	23%	0.231	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-44.8	179.2	-56.1	-179.7	0	0	0	109.6	H273 Y276 D461	H273-I463 HydrophobicContact CB-CG2 4.07Å; Y276-I463 HydrophobicContact CE2-CD1 3.62Å; D461-I463 PolarHBondContact O-N 2.91Å; D461-I463 PolarHBondContact OD1-N 3.43Å; D461-I463 VanDerWaalsContact OD1-N 3.13Å
464	K	89.6	Confident	95.3	Very high	70 Å²	70	26.5 Å²	26.5	30%	0.304	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-15.4	176.4	-74.1	-72.8	-162.2	175.9	0	113.5	C257 S258 Q259 D461 R466	C257-K464 PolarHBondContact O-NZ 3.06Å; S258-K464 WeakPolarHBondContact O-CE 3.36Å; Q259-K464 WeakPolarHBondContact O-CD 3.23Å; Q259-K464 WeakPolarHBondContact O-CE 3.22Å; Q259-K464 PolarHBondContact O-NZ 2.95Å; D461-K464 HydrophobicContact CB-CB 4.3Å; D461-K464 PolarHBondContact O-N 3.45Å; D461-K464 PolarHBondContact OD1-N 3.36Å; K464-R466 HydrophobicContact CB-CB 4.36Å
465	G	92.6	Very high	95.4	Very high	24 Å²	24	24.4 Å²	24.4	25%	0.247	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	50.6	-173.2	0	0	0	0	0	111.6	D461 L482	D461-G465 WeakPolarHBondContact O-CA 3.43Å; D461-G465 PolarHBondContact O-N 3.4Å; G465-L482 VanDerWaalsContact C-CG 3.44Å; G465-L482 VanDerWaalsContact O-CG 3.32Å; G465-L482 WeakPolarHBondContact O-CG 3.3Å; G465-L482 PolarHBondContact O-N 2.78Å; G465-L482 VanDerWaalsContact O-N 3.12Å
466	R	95.1	Very high	95.3	Very high	13 Å²	13	24.7 Å²	24.7	5%	0.049	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.5	-175.1	-151.6	170.4	-156.5	-157.2	-1.4	112.9	D461 K464 Y468 S479 V480 D481 N486	D461-R466 PolarHBondContact N-O 3.01Å; D461-R466 PolarHBondContact O-N 3.21Å; K464-R466 HydrophobicContact CB-CB 4.36Å; R466-Y468 HydrophobicContact CB-CE2 4.2Å; R466-Y468 HydrophobicContact CG-CE2 4.37Å; R466-S479 VanDerWaalsContact CZ-OG 3.27Å; R466-S479 PolarHBondContact NH1-OG 3.33Å; R466-S479 VanDerWaalsContact NH1-OG 3.17Å; R466-V480 WeakPolarHBondContact CG-O 3.04Å; R466-D481 IonicContact CZ-OD1 3.95Å; R466-D481 IonicContact NE-OD1 3.7Å; R466-D481 PolarHBondContact NE-OD1 2.99Å; R466-D481 VanDerWaalsContact NE-OD1 3.09Å; R466-N486 PolarHBondContact NH2-O 3.28Å
467	L	97.8	Very high	95.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.3	174.4	-175.1	152.1	0	0	0	109.8	Y424 I434 L447 T459 L460 W469 S479 V480 L482	Y424-L467 HydrophobicContact CD1-CD1 3.88Å; Y424-L467 HydrophobicContact CG-CD1 4.15Å; I434-L467 HydrophobicContact CD1-CD2 4.15Å; I434-L467 HydrophobicContact CG2-CD1 4.05Å; L447-L467 HydrophobicContact CD2-CD1 4.02Å; T459-L467 WeakPolarHBondContact O-CA 3.33Å; L460-L467 HydrophobicContact CD2-CB 3.95Å; L460-L467 HydrophobicContact CD2-CD1 3.85Å; L460-L467 HydrophobicContact CD2-CG 3.93Å; L467-W469 HydrophobicContact CD2-CB 4.2Å; L467-W469 HydrophobicContact CD2-CD2 4.49Å; L467-W469 HydrophobicContact CD2-CE3 3.81Å; L467-S479 CarbonylContact O-C 3.5Å; L467-S479 WeakPolarHBondContact O-CA 3.23Å; L467-V480 HydrophobicContact CB-CG1 4.12Å; L467-V480 HydrophobicContact CD2-CG1 4.3Å; L467-V480 PolarHBondContact N-O 3.03Å; L467-V480 PolarHBondContact O-N 3.42Å; L467-L482 HydrophobicContact CB-CD2 4.01Å
468	Y	98.2	Very high	95.7	Very high	1 Å²	1	23.7 Å²	23.7	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141.2	172.7	-70.6	-100.6	0	0	0	109.5	I458 T459 D461 R466 L477 S478 V490 V505 K525	I458-Y468 CarbonylContact C-O 3.59Å; I458-Y468 VanDerWaalsContact CA-O 3.32Å; I458-Y468 WeakPolarHBondContact CA-O 3.36Å; T459-Y468 PolarHBondContact N-O 3.41Å; T459-Y468 PolarHBondContact O-N 2.82Å; D461-Y468 HydrophobicContact CB-CE2 4.11Å; R466-Y468 HydrophobicContact CB-CE2 4.2Å; R466-Y468 HydrophobicContact CG-CE2 4.37Å; Y468-L477 HydrophobicContact CD1-CD2 4.21Å; Y468-S478 WeakPolarHBondContact CA-O 3.45Å; Y468-V490 HydrophobicContact CE1-CG2 4.27Å; Y468-V505 HydrophobicContact CD1-CG1 4.34Å; Y468-V505 HydrophobicContact CD2-CG1 3.89Å; Y468-V505 HydrophobicContact CE2-CG1 4.27Å; Y468-V505 HydrophobicContact CG-CG1 3.94Å; Y468-K525 HydrophobicContact CE1-CB 4.13Å; Y468-K525 WeakPolarHBondContact CE1-O 3.23Å
469	W	98.2	Very high	95.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161	175.7	79.1	100.8	0	0	0	112.1	I434 V448 G457 I458 L467 L477 S478 V480 R487	I434-W469 HydrophobicContact CD1-CB 3.99Å; I434-W469 HydrophobicContact CD1-CD2 3.71Å; I434-W469 HydrophobicContact CD1-CE3 4.2Å; I434-W469 HydrophobicContact CD1-CG 3.62Å; V448-W469 HydrophobicContact CG1-CZ2 4.4Å; G457-W469 VanDerWaalsContact O-CA 3.25Å; G457-W469 WeakPolarHBondContact O-CA 3.35Å; G457-W469 WeakPolarHBondContact O-CB 3.47Å; I458-W469 HydrophobicContact CG2-CB 3.85Å; L467-W469 HydrophobicContact CD2-CB 4.2Å; L467-W469 HydrophobicContact CD2-CD2 4.49Å; L467-W469 HydrophobicContact CD2-CE3 3.81Å; W469-L477 WeakPolarHBondContact O-CA 3.49Å; W469-S478 VanDerWaalsContact CE3-O 3.29Å; W469-S478 PolarHBondContact N-O 3.04Å; W469-S478 PolarHBondContact O-N 3Å; W469-V480 HydrophobicContact CE3-CG1 4.43Å; W469-V480 HydrophobicContact CH2-CB 4.36Å; W469-V480 HydrophobicContact CH2-CG1 4.47Å; W469-V480 HydrophobicContact CZ3-CB 3.87Å; W469-V480 HydrophobicContact CZ3-CG1 3.73Å; W469-R487 HydrophobicContact CH2-CG 4.16Å
470	V	98.1	Very high	95.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.6	173.7	-70.2	0	0	0	0	110	N456 G457 L477 L497 P500 V503 W512	N456-V470 PolarHBondContact N-O 2.88Å; N456-V470 VanDerWaalsContact N-O 3.13Å; G457-V470 PolarHBondContact O-N 3.45Å; G457-V470 VanDerWaalsContact O-N 3.17Å; V470-L477 HydrophobicContact CG1-CB 4.34Å; V470-L477 HydrophobicContact CG1-CD1 4.02Å; V470-L477 HydrophobicContact CG1-CG 4.01Å; V470-L497 HydrophobicContact CG1-CD2 4.37Å; V470-P500 HydrophobicContact CB-CB 3.78Å; V470-P500 HydrophobicContact CB-CG 3.85Å; V470-P500 HydrophobicContact CG1-CB 4.15Å; V470-P500 HydrophobicContact CG2-CB 3.9Å; V470-P500 HydrophobicContact CG2-CG 4.27Å; V470-V503 HydrophobicContact CG1-CB 3.9Å; V470-V503 HydrophobicContact CG1-CG1 4.34Å; V470-V503 HydrophobicContact CG1-CG2 4.21Å; V470-V503 HydrophobicContact CG2-CB 4.39Å; V470-V503 HydrophobicContact CG2-CG1 4.38Å; V470-W512 HydrophobicContact CG1-CB 4.43Å
471	D	97.4	Very high	95.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.9	175.7	-168.7	-51.8	0	0	0	109.9	Q453 W454 K473 L474 H475 M476	Q453-D471 PolarHBondContact N-OD2 3.07Å; W454-D471 PolarHBondContact N-OD1 2.85Å; W454-D471 VanDerWaalsContact N-OD1 3.13Å; W454-D471 PolarHBondContact N-OD2 3.25Å; W454-D471 WeakPolarHBondContact O-CA 2.98Å; D471-K473 VanDerWaalsContact C-N 3.34Å; D471-K473 PolarHBondContact OD1-N 3.1Å; D471-L474 HydrophobicContact CB-CB 4.21Å; D471-L474 PolarHBondContact OD1-N 2.01Å; D471-H475 PolarHBondContact O-N 2.86Å; D471-H475 VanDerWaalsContact O-N 3.11Å; D471-M476 HydrophobicContact CB-CG 3.87Å; D471-M476 PolarHBondContact N-O 2.97Å; D471-M476 PolarHBondContact O-N 3.48Å
472	S	94.9	Very high	95.4	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.021	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-26	-176.6	-70.6	0	0	0	0	114	W454 N456 H475 P500	W454-S472 PolarHBondContact O-N 3.15Å; W454-S472 VanDerWaalsContact O-N 3.09Å; N456-S472 PolarHBondContact ND2-OG 3.01Å; S472-H475 PolarHBondContact O-CE1 3.32Å; S472-H475 PolarHBondContact O-ND1 3.03Å; S472-P500 WeakPolarHBondContact OG-CD 3.05Å; S472-P500 PolarHBondContact OG-O 3.49Å
473	K	93.3	Very high	95.3	Very high	117 Å²	117	26.6 Å²	26.6	51%	0.509	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-32.1	-178.1	-178.2	57.6	179	175.1	0	111.9	Q453 W454 D471	Q453-K473 HydrophobicContact CB-CB 3.74Å; Q453-K473 HydrophobicContact CB-CG 3.91Å; Q453-K473 HydrophobicContact CG-CG 4.37Å; W454-K473 HydrophobicContact CB-CB 3.93Å; W454-K473 HydrophobicContact CD2-CB 3.72Å; W454-K473 HydrophobicContact CD2-CG 4.43Å; W454-K473 HydrophobicContact CE3-CB 3.97Å; W454-K473 HydrophobicContact CG-CB 3.71Å; D471-K473 VanDerWaalsContact C-N 3.34Å; D471-K473 PolarHBondContact OD1-N 3.1Å
474	L	94.2	Very high	95.4	Very high	50 Å²	50	25.7 Å²	25.7	26%	0.262	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.7	179.2	-62.5	179.2	0	0	0	113.5	D451 Q453 D471 M476 Q492	D451-L474 WeakPolarHBondContact O-CD1 3.48Å; Q453-L474 HydrophobicContact CB-CD1 4.43Å; Q453-L474 HydrophobicContact CB-CG 4.1Å; Q453-L474 HydrophobicContact CG-CD1 4.04Å; Q453-L474 HydrophobicContact CG-CD2 3.82Å; Q453-L474 HydrophobicContact CG-CG 3.83Å; D471-L474 HydrophobicContact CB-CB 4.21Å; D471-L474 PolarHBondContact OD1-N 2.01Å; L474-M476 VanDerWaalsContact C-N 3.27Å; L474-M476 HydrophobicContact CB-CG 3.66Å; L474-M476 HydrophobicContact CB-SD 3.51Å; L474-M476 VanDerWaalsContact CB-SD 3.51Å; L474-M476 HydrophobicContact CD1-SD 3.6Å; L474-M476 HydrophobicContact CG-SD 4.21Å; L474-M476 PolarHBondContact O-N 3.25Å; L474-Q492 PolarHBondContact O-NE2 2.93Å
475	H	95.8	Very high	95.5	Very high	65 Å²	65	26.8 Å²	26.8	30%	0.301	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	44.2	-178	-53.4	-62.1	0	0	0	112.7	D471 S472 Q492 S493 L497 A498	D471-H475 PolarHBondContact O-N 2.86Å; D471-H475 VanDerWaalsContact O-N 3.11Å; S472-H475 PolarHBondContact O-CE1 3.32Å; S472-H475 PolarHBondContact O-ND1 3.03Å; H475-Q492 WeakPolarHBondContact O-CA 3.39Å; H475-S493 PolarHBondContact O-N 2.89Å; H475-L497 WeakPolarHBondContact CA-O 3.13Å; H475-L497 HydrophobicContact CB-CB 4.45Å; H475-L497 WeakPolarHBondContact CB-O 3.35Å; H475-L497 PolarHBondContact ND1-O 3.05Å; H475-A498 PolarHBondContact CE1-O 2.81Å; H475-A498 PolarHBondContact ND1-O 2.87Å
476	M	96.1	Very high	95.4	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.03	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.2	-171	66.2	-173.2	-80.1	0	0	113.4	D471 L474 S478 K489 L491 Q492	D471-M476 HydrophobicContact CB-CG 3.87Å; D471-M476 PolarHBondContact N-O 2.97Å; D471-M476 PolarHBondContact O-N 3.48Å; L474-M476 VanDerWaalsContact C-N 3.27Å; L474-M476 HydrophobicContact CB-CG 3.66Å; L474-M476 HydrophobicContact CB-SD 3.51Å; L474-M476 VanDerWaalsContact CB-SD 3.51Å; L474-M476 HydrophobicContact CD1-SD 3.6Å; L474-M476 HydrophobicContact CG-SD 4.21Å; L474-M476 PolarHBondContact O-N 3.25Å; M476-S478 WeakPolarHBondContact CE-OG 2.98Å; M476-K489 HydrophobicContact CE-CG 4.23Å; M476-L491 CarbonylContact C-O 3.55Å; M476-L491 VanDerWaalsContact CA-O 3.3Å; M476-L491 WeakPolarHBondContact CA-O 3.23Å; M476-Q492 HydrophobicContact CB-CB 4.36Å; M476-Q492 HydrophobicContact CB-CG 4.34Å
477	L	97.8	Very high	95.3	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.7	167.7	-168	155	0	0	0	107.8	Y468 W469 V470 V490 L491 L497 V503 V510 W512	Y468-L477 HydrophobicContact CD1-CD2 4.21Å; W469-L477 WeakPolarHBondContact O-CA 3.49Å; V470-L477 HydrophobicContact CG1-CB 4.34Å; V470-L477 HydrophobicContact CG1-CD1 4.02Å; V470-L477 HydrophobicContact CG1-CG 4.01Å; L477-V490 HydrophobicContact CD2-CB 3.62Å; L477-V490 HydrophobicContact CD2-CG1 3.93Å; L477-V490 HydrophobicContact CD2-CG2 3.97Å; L477-V490 PolarHBondContact O-N 2.03Å; L477-L491 HydrophobicContact CB-CB 4.19Å; L477-L491 PolarHBondContact N-O 2.84Å; L477-L491 PolarHBondContact O-N 2.8Å; L477-L497 HydrophobicContact CB-CD1 4.15Å; L477-V503 HydrophobicContact CD1-CG2 4.22Å; L477-V510 HydrophobicContact CD1-CG1 4Å; L477-V510 HydrophobicContact CD1-CG2 3.77Å; L477-V510 HydrophobicContact CD2-CG1 4.43Å; L477-V510 HydrophobicContact CD2-CG2 4.33Å; L477-W512 HydrophobicContact CD1-CD2 4.43Å; L477-W512 HydrophobicContact CD1-CE3 4.03Å; L477-W512 HydrophobicContact CD1-CZ3 4.47Å
478	S	97.3	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.9	-176.9	-72.7	0	0	0	0	112.5	Y468 W469 M476 N488	Y468-S478 WeakPolarHBondContact CA-O 3.45Å; W469-S478 VanDerWaalsContact CE3-O 3.29Å; W469-S478 PolarHBondContact N-O 3.04Å; W469-S478 PolarHBondContact O-N 3Å; M476-S478 WeakPolarHBondContact CE-OG 2.98Å; S478-N488 WeakPolarHBondContact CA-O 3.05Å
479	S	96.8	Very high	94.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.3	178.1	60.8	0	0	0	0	111.2	R466 L467 R487 N488	R466-S479 VanDerWaalsContact CZ-OG 3.27Å; R466-S479 PolarHBondContact NH1-OG 3.33Å; R466-S479 VanDerWaalsContact NH1-OG 3.17Å; L467-S479 CarbonylContact O-C 3.5Å; L467-S479 WeakPolarHBondContact O-CA 3.23Å; S479-R487 CarbonylContact O-C 3.53Å; S479-R487 WeakPolarHBondContact O-CA 3.03Å; S479-N488 PolarHBondContact N-O 2.81Å; S479-N488 PolarHBondContact O-N 2.8Å; S479-N488 PolarHBondContact OG-O 2.86Å
480	V	96.4	Very high	94.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	146.6	-179.5	67.3	0	0	0	0	109.2	L447 V448 R466 L467 W469 G484 D485 R487	L447-V480 HydrophobicContact CD2-CG1 4.23Å; V448-V480 HydrophobicContact CG2-CG1 4.03Å; R466-V480 WeakPolarHBondContact CG-O 3.04Å; L467-V480 HydrophobicContact CB-CG1 4.12Å; L467-V480 HydrophobicContact CD2-CG1 4.3Å; L467-V480 PolarHBondContact N-O 3.03Å; L467-V480 PolarHBondContact O-N 3.42Å; W469-V480 HydrophobicContact CE3-CG1 4.43Å; W469-V480 HydrophobicContact CH2-CB 4.36Å; W469-V480 HydrophobicContact CH2-CG1 4.47Å; W469-V480 HydrophobicContact CZ3-CB 3.87Å; W469-V480 HydrophobicContact CZ3-CG1 3.73Å; V480-G484 VanDerWaalsContact CG2-C 3.48Å; V480-G484 WeakPolarHBondContact CG2-O 3.43Å; V480-D485 WeakPolarHBondContact CG2-O 3.39Å; V480-R487 HydrophobicContact CG2-CB 4.33Å
481	D	95.1	Very high	94.7	Very high	38 Å²	38	42.6 Å²	42.6	20%	0.203	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	155.1	176.3	-65.2	-5.2	0	0	0	110.3	R466 N483 G484 D485 N486	R466-D481 IonicContact CZ-OD1 3.95Å; R466-D481 IonicContact NE-OD1 3.7Å; R466-D481 PolarHBondContact NE-OD1 2.99Å; R466-D481 VanDerWaalsContact NE-OD1 3.09Å; D481-N483 WeakPolarHBondContact CB-OD1 3.35Å; D481-N483 PolarHBondContact O-N 3.38Å; D481-G484 PolarHBondContact O-N 3.23Å; D481-D485 WeakPolarHBondContact CB-O 3.45Å; D481-D485 PolarHBondContact N-O 2.9Å; D481-N486 WeakPolarHBondContact OD2-CB 3.41Å; D481-N486 PolarHBondContact OD2-ND2 2.94Å
482	L	94.6	Very high	94.7	Very high	23 Å²	23	47.8 Å²	47.8	12%	0.12	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-5.7	-175.8	-64.8	174.6	0	0	0	114.5	Y424 K436 L460 G465 L467	Y424-L482 HydrophobicContact CE1-CD2 3.82Å; Y424-L482 HydrophobicContact CE2-CD2 4.36Å; K436-L482 PolarHBondContact NZ-O 2.87Å; L460-L482 HydrophobicContact CD2-CD2 3.72Å; G465-L482 VanDerWaalsContact C-CG 3.44Å; G465-L482 VanDerWaalsContact O-CG 3.32Å; G465-L482 WeakPolarHBondContact O-CG 3.3Å; G465-L482 PolarHBondContact O-N 2.78Å; G465-L482 VanDerWaalsContact O-N 3.12Å; L467-L482 HydrophobicContact CB-CD2 4.01Å
483	N	91.8	Very high	94.6	Very high	102 Å²	102	48.8 Å²	48.8	55%	0.545	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-9.8	170.2	65.6	-12.7	0	0	0	113.3	D481 D485	D481-N483 WeakPolarHBondContact CB-OD1 3.35Å; D481-N483 PolarHBondContact O-N 3.38Å; N483-D485 PolarHBondContact ND2-OD2 2.9Å; N483-D485 PolarHBondContact OD1-N 3.28Å
484	G	92.5	Very high	94.7	Very high	25 Å²	25	46 Å²	46	26%	0.258	24%	0.244	S	C	.	.	S	Bend	trans	99.7	-4	-178.7	0	0	0	0	0	114.5	V480 D481	V480-G484 VanDerWaalsContact CG2-C 3.48Å; V480-G484 WeakPolarHBondContact CG2-O 3.43Å; D481-G484 PolarHBondContact O-N 3.23Å
485	D	91.2	Very high	94.6	Very high	93 Å²	93	49.4 Å²	49.4	50%	0.497	26%	0.263	S	S	.	.			trans	-88.9	175.7	-177.6	-64.2	-37.7	0	0	0	112.8	V480 D481 N483 R487	V480-D485 WeakPolarHBondContact CG2-O 3.39Å; D481-D485 WeakPolarHBondContact CB-O 3.45Å; D481-D485 PolarHBondContact N-O 2.9Å; N483-D485 PolarHBondContact ND2-OD2 2.9Å; N483-D485 PolarHBondContact OD1-N 3.28Å; D485-R487 VanDerWaalsContact C-N 3.3Å; D485-R487 PolarHBondContact O-N 3.41Å
486	N	90.9	Very high	94.6	Very high	99 Å²	99	50.8 Å²	50.8	53%	0.529	27%	0.266	S	S	.	.	S	Bend	trans	47.5	48.1	173.5	-56	-47.9	0	0	0	113.6	R466 D481 N488	R466-N486 PolarHBondContact NH2-O 3.28Å; D481-N486 WeakPolarHBondContact OD2-CB 3.41Å; D481-N486 PolarHBondContact OD2-ND2 2.94Å; N486-N488 PolarHBondContact O-N 3.15Å
487	R	93.4	Very high	94.5	Very high	80 Å²	80	50.5 Å²	50.5	30%	0.302	27%	0.265	S	S	.	.			trans	-61.6	131.5	176.1	-177.3	176.9	176.3	172.9	0.5	110.8	T450 D451 W469 S479 V480 D485	T450-R487 PolarHBondContact O-NH1 3.23Å; D451-R487 PolarHBondContact O-NH2 3.33Å; W469-R487 HydrophobicContact CH2-CG 4.16Å; S479-R487 CarbonylContact O-C 3.53Å; S479-R487 WeakPolarHBondContact O-CA 3.03Å; V480-R487 HydrophobicContact CG2-CB 4.33Å; D485-R487 VanDerWaalsContact C-N 3.3Å; D485-R487 PolarHBondContact O-N 3.41Å
488	N	92.9	Very high	94.4	Very high	47 Å²	47	51.7 Å²	51.7	25%	0.251	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.9	175.6	-178.9	39.2	0	0	0	111.2	S478 S479 N486 V490 F526	S478-N488 WeakPolarHBondContact CA-O 3.05Å; S479-N488 PolarHBondContact N-O 2.81Å; S479-N488 PolarHBondContact O-N 2.8Å; S479-N488 PolarHBondContact OG-O 2.86Å; N486-N488 PolarHBondContact O-N 3.15Å; N488-V490 PolarHBondContact O-N 3.41Å; N488-F526 PolarHBondContact ND2-O 3.42Å
489	K	94.9	Very high	94.3	Very high	109 Å²	109	54.3 Å²	54.3	47%	0.474	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	107.1	170.7	-178.8	-174.6	-72.4	-175.1	0	107.8	M476 Q492	M476-K489 HydrophobicContact CE-CG 4.23Å; K489-Q492 HydrophobicContact CD-CB 4.12Å
490	V	95.7	Very high	94.3	Very high	8 Å²	8	54.3 Å²	54.3	5%	0.048	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-45.4	-172.3	178.4	0	0	0	0	111	Y468 L477 N488 K525 S527 G528	Y468-V490 HydrophobicContact CE1-CG2 4.27Å; L477-V490 HydrophobicContact CD2-CB 3.62Å; L477-V490 HydrophobicContact CD2-CG1 3.93Å; L477-V490 HydrophobicContact CD2-CG2 3.97Å; L477-V490 PolarHBondContact O-N 2.03Å; N488-V490 PolarHBondContact O-N 3.41Å; V490-K525 WeakPolarHBondContact CG1-O 3.2Å; V490-S527 CarbonylContact O-C 3.6Å; V490-G528 WeakPolarHBondContact O-CA 3.05Å; V490-G528 PolarHBondContact O-N 3.09Å
491	L	96.3	Very high	94.2	Very high	27 Å²	27	56.4 Å²	56.4	14%	0.141	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.7	-179.7	-179.8	63.6	0	0	0	109.6	M476 L477 L497 W512 V531	M476-L491 CarbonylContact C-O 3.55Å; M476-L491 VanDerWaalsContact CA-O 3.3Å; M476-L491 WeakPolarHBondContact CA-O 3.23Å; L477-L491 HydrophobicContact CB-CB 4.19Å; L477-L491 PolarHBondContact N-O 2.84Å; L477-L491 PolarHBondContact O-N 2.8Å; L491-L497 HydrophobicContact CB-CD1 4.32Å; L491-L497 HydrophobicContact CD2-CD1 3.97Å; L491-L497 HydrophobicContact CG-CD1 3.96Å; L491-W512 HydrophobicContact CD2-CH2 3.81Å; L491-W512 HydrophobicContact CD2-CZ2 4.01Å; L491-V531 HydrophobicContact CD2-CG2 4.31Å
492	Q	96.1	Very high	94.3	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	114.1	168.1	-176.3	167.3	24.7	0	0	108.9	L474 H475 M476 K489	L474-Q492 PolarHBondContact O-NE2 2.93Å; H475-Q492 WeakPolarHBondContact O-CA 3.39Å; M476-Q492 HydrophobicContact CB-CB 4.36Å; M476-Q492 HydrophobicContact CB-CG 4.34Å; K489-Q492 HydrophobicContact CD-CB 4.12Å
493	S	94.4	Very high	94.5	Very high	23 Å²	23	53.8 Å²	53.8	16%	0.161	28%	0.282	C	S	.	.			trans	-162.4	120.6	-176.3	171.4	0	0	0	0	109.6	H475 D495 Y496 L497	H475-S493 PolarHBondContact O-N 2.89Å; S493-D495 PolarHBondContact O-N 3.15Å; S493-D495 PolarHBondContact OG-N 3.3Å; S493-Y496 WeakPolarHBondContact OG-CD2 3.28Å; S493-Y496 PolarHBondContact OG-N 2.79Å; S493-L497 VanDerWaalsContact O-CB 3.31Å; S493-L497 WeakPolarHBondContact O-CB 3.49Å; S493-L497 PolarHBondContact O-N 2.78Å
494	A	94.1	Very high	94.8	Very high	58 Å²	58	49.5 Å²	49.5	48%	0.479	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.5	175.5	0	0	0	0	0	112.3	A498	A494-A498 WeakPolarHBondContact O-CA 3.05Å; A494-A498 PolarHBondContact O-N 3.39Å
495	D	93.1	Very high	95	Very high	122 Å²	122	48.8 Å²	48.8	65%	0.652	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-38.8	-178.1	-56.1	-37	0	0	0	112.3	S493 N517	S493-D495 PolarHBondContact O-N 3.15Å; S493-D495 PolarHBondContact OG-N 3.3Å; D495-N517 PolarHBondContact O-ND2 3.34Å
496	Y	94.7	Very high	95.2	Very high	95 Å²	95	44.8 Å²	44.8	37%	0.373	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-15.8	-175.9	-59.2	-67.4	0	0	0	114.3	S493 W512 Y521 V531	S493-Y496 WeakPolarHBondContact OG-CD2 3.28Å; S493-Y496 PolarHBondContact OG-N 2.79Å; Y496-W512 PolarHBondContact O-NE1 2.88Å; Y496-Y521 HydrophobicContact CD1-CD1 4.14Å; Y496-Y521 AromaticContact CD1-CE1 3.78Å; Y496-Y521 HydrophobicContact CD1-CE1 3.78Å; Y496-Y521 HydrophobicContact CE1-CE1 4.33Å; Y496-V531 HydrophobicContact CD1-CG1 3.88Å; Y496-V531 HydrophobicContact CD2-CG1 4.32Å; Y496-V531 HydrophobicContact CE1-CG1 4.06Å; Y496-V531 HydrophobicContact CE2-CG1 4.48Å; Y496-V531 HydrophobicContact CG-CG1 4.02Å
497	L	95.3	Very high	95.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.			trans	-126.2	48.7	179.9	-63.6	161.1	0	0	0	110	V470 H475 L477 L491 S493 P500 W512	V470-L497 HydrophobicContact CG1-CD2 4.37Å; H475-L497 WeakPolarHBondContact CA-O 3.13Å; H475-L497 HydrophobicContact CB-CB 4.45Å; H475-L497 WeakPolarHBondContact CB-O 3.35Å; H475-L497 PolarHBondContact ND1-O 3.05Å; L477-L497 HydrophobicContact CB-CD1 4.15Å; L491-L497 HydrophobicContact CB-CD1 4.32Å; L491-L497 HydrophobicContact CD2-CD1 3.97Å; L491-L497 HydrophobicContact CG-CD1 3.96Å; S493-L497 VanDerWaalsContact O-CB 3.31Å; S493-L497 WeakPolarHBondContact O-CB 3.49Å; S493-L497 PolarHBondContact O-N 2.78Å; L497-P500 HydrophobicContact CB-CG 4.32Å; L497-P500 HydrophobicContact CD2-CB 3.96Å; L497-P500 HydrophobicContact CD2-CG 4.01Å; L497-W512 HydrophobicContact CD2-CD2 4.26Å; L497-W512 HydrophobicContact CD2-CG 4.19Å; L497-W512 HydrophobicContact CD2-CZ2 4.36Å
498	A	94.4	Very high	95.3	Very high	25 Å²	25	39.3 Å²	39.3	21%	0.207	20%	0.204	C	C	.	.	S	Bend	trans	-65.6	-49.7	179.4	0	0	0	0	0	111.1	H475 A494 D514 E516	H475-A498 PolarHBondContact CE1-O 2.81Å; H475-A498 PolarHBondContact ND1-O 2.87Å; A494-A498 WeakPolarHBondContact O-CA 3.05Å; A494-A498 PolarHBondContact O-N 3.39Å; A498-D514 PolarHBondContact N-OD2 3.38Å; A498-E516 HydrophobicContact CB-CB 3.91Å; A498-E516 HydrophobicContact CB-CG 4.16Å
499	H	94.9	Very high	95.4	Very high	56 Å²	56	41.3 Å²	41.3	26%	0.259	21%	0.208	S	C	.	.	S	Bend	trans	-148.4	73.2	173.4	-156.1	105.3	0	0	0	111.5	F501 D514 G515 E516	H499-F501 AromaticContact CD2-CD1 3.98Å; H499-F501 AromaticContact CD2-CE1 3.39Å; H499-F501 WeakPolarHBondContact CD2-CE1 3.06Å; H499-F501 AromaticContact CD2-CZ 3.43Å; H499-F501 VanDerWaalsContact CD2-CZ 3.43Å; H499-F501 WeakPolarHBondContact CD2-CZ 3.47Å; H499-F501 AromaticContact NE2-CE1 3.42Å; H499-F501 WeakPolarHBondContact NE2-CE1 3.27Å; H499-F501 AromaticContact NE2-CZ 3.76Å; H499-D514 PolarHBondContact N-OD2 3.23Å; H499-G515 PolarHBondContact O-N 3.37Å; H499-E516 HydrophobicContact CB-CB 4Å
500	P	96.9	Very high	95.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.2	179.4	29.4	-38.5	0	0	0	112.9	N456 V470 S472 L497 T513	N456-P500 PolarHBondContact ND2-O 2.71Å; V470-P500 HydrophobicContact CB-CB 3.78Å; V470-P500 HydrophobicContact CB-CG 3.85Å; V470-P500 HydrophobicContact CG1-CB 4.15Å; V470-P500 HydrophobicContact CG2-CB 3.9Å; V470-P500 HydrophobicContact CG2-CG 4.27Å; S472-P500 WeakPolarHBondContact OG-CD 3.05Å; S472-P500 PolarHBondContact OG-O 3.49Å; L497-P500 HydrophobicContact CB-CG 4.32Å; L497-P500 HydrophobicContact CD2-CB 3.96Å; L497-P500 HydrophobicContact CD2-CG 4.01Å; P500-T513 CarbonylContact C-O 3.52Å; P500-T513 WeakPolarHBondContact CA-O 3.38Å
501	F	95.3	Very high	95.6	Very high	44 Å²	44	36.1 Å²	36.1	19%	0.193	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-50.5	179.6	-73.9	-60	0	0	0	113.1	N456 G457 H499 T513 G515 Q542	N456-F501 WeakPolarHBondContact CB-O 3.37Å; G457-F501 WeakPolarHBondContact CA-O 3.28Å; G457-F501 PolarHBondContact N-O 2.87Å; H499-F501 AromaticContact CD2-CD1 3.98Å; H499-F501 AromaticContact CD2-CE1 3.39Å; H499-F501 WeakPolarHBondContact CD2-CE1 3.06Å; H499-F501 AromaticContact CD2-CZ 3.43Å; H499-F501 VanDerWaalsContact CD2-CZ 3.43Å; H499-F501 WeakPolarHBondContact CD2-CZ 3.47Å; H499-F501 AromaticContact NE2-CE1 3.42Å; H499-F501 WeakPolarHBondContact NE2-CE1 3.27Å; H499-F501 AromaticContact NE2-CZ 3.76Å; F501-T513 PolarHBondContact N-O 2.8Å; F501-G515 VanDerWaalsContact CE2-CA 3.47Å; F501-Q542 VanDerWaalsContact CB-O 3.31Å; F501-Q542 WeakPolarHBondContact CB-O 3.16Å
502	A	97.2	Very high	95.7	Very high	2 Å²	2	34.9 Å²	34.9	2%	0.017	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.6	-177.9	0	0	0	0	0	112.1	W512 T513 D543 V544	A502-W512 CarbonylContact O-C 3.55Å; A502-W512 WeakPolarHBondContact O-CA 3.45Å; A502-W512 WeakPolarHBondContact O-CB 3.36Å; A502-T513 PolarHBondContact N-OG1 3.4Å; A502-T513 VanDerWaalsContact N-OG1 3.13Å; A502-T513 PolarHBondContact O-N 3.09Å; A502-D543 HydrophobicContact CB-CB 4.41Å; A502-D543 WeakPolarHBondContact CB-OD1 3.35Å; A502-V544 HydrophobicContact CB-CG1 3.99Å
503	V	98.1	Very high	95.8	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.03	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.8	178.9	62.5	0	0	0	0	109.3	G457 T459 V470 L477 V510 F511 W512	G457-V503 WeakPolarHBondContact O-CG1 3.38Å; T459-V503 VanDerWaalsContact CB-O 3.27Å; T459-V503 WeakPolarHBondContact CB-O 3.24Å; T459-V503 HydrophobicContact CG2-CG1 4.01Å; T459-V503 HydrophobicContact CG2-CG2 4.31Å; V470-V503 HydrophobicContact CG1-CB 3.9Å; V470-V503 HydrophobicContact CG1-CG1 4.34Å; V470-V503 HydrophobicContact CG1-CG2 4.21Å; V470-V503 HydrophobicContact CG2-CB 4.39Å; V470-V503 HydrophobicContact CG2-CG1 4.38Å; L477-V503 HydrophobicContact CD1-CG2 4.22Å; V503-V510 HydrophobicContact CG2-CG2 3.42Å; V503-V510 VanDerWaalsContact CG2-CG2 3.42Å; V503-F511 CarbonylContact C-O 3.6Å; V503-F511 VanDerWaalsContact CA-O 3.28Å; V503-F511 WeakPolarHBondContact CA-O 3.37Å; V503-W512 HydrophobicContact CB-CB 4.36Å; V503-W512 HydrophobicContact CG2-CB 4.43Å
504	T	97.9	Very high	95.9	Very high	11 Å²	11	28.5 Å²	28.5	7%	0.067	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	153.5	176.6	-170.5	0	0	0	0	109.7	L294 F511 V544 V546	L294-T504 HydrophobicContact CD2-CG2 4.13Å; T504-F511 HydrophobicContact CG2-CB 3.88Å; T504-F511 HydrophobicContact CG2-CD2 4.29Å; T504-F511 PolarHBondContact N-O 2.63Å; T504-F511 PolarHBondContact O-N 3.28Å; T504-V544 HydrophobicContact CG2-CG1 4.03Å; T504-V544 HydrophobicContact CG2-CG2 4.14Å; T504-V546 HydrophobicContact CG2-CG2 3.66Å; T504-V546 PolarHBondContact OG1-N 3.25Å
505	V	96.9	Very high	95.9	Very high	11 Å²	11	26.4 Å²	26.4	7%	0.067	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.2	-176	-68.3	0	0	0	0	110.9	T459 D461 Y468 V510	T459-V505 HydrophobicContact CG2-CB 4.44Å; T459-V505 HydrophobicContact CG2-CG1 3.87Å; T459-V505 HydrophobicContact CG2-CG2 4.04Å; D461-V505 HydrophobicContact CB-CG2 4.19Å; Y468-V505 HydrophobicContact CD1-CG1 4.34Å; Y468-V505 HydrophobicContact CD2-CG1 3.89Å; Y468-V505 HydrophobicContact CE2-CG1 4.27Å; Y468-V505 HydrophobicContact CG-CG1 3.94Å; V505-V510 HydrophobicContact CG1-CB 4.1Å; V505-V510 HydrophobicContact CG1-CG2 3.84Å
506	F	95.5	Very high	95.9	Very high	9 Å²	9	27.2 Å²	27.2	4%	0.039	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	136.2	170.2	-170.7	-106.2	0	0	0	110.1	A287 P292 D508 R509 F511 V546 H548 I551	A287-F506 HydrophobicContact CB-CE1 4.18Å; A287-F506 HydrophobicContact CB-CZ 3.72Å; P292-F506 HydrophobicContact CB-CD1 3.94Å; P292-F506 HydrophobicContact CB-CE1 3.54Å; P292-F506 HydrophobicContact CB-CZ 3.95Å; P292-F506 HydrophobicContact CG-CD1 4.13Å; P292-F506 HydrophobicContact CG-CE1 3.62Å; P292-F506 HydrophobicContact CG-CZ 4.36Å; F506-D508 PolarHBondContact O-N 2.76Å; F506-R509 PolarHBondContact N-O 3.5Å; F506-R509 PolarHBondContact O-N 3.31Å; F506-R509 VanDerWaalsContact O-O 3.08Å; F506-F511 HydrophobicContact CB-CE2 4.23Å; F506-V546 HydrophobicContact CB-CB 4.34Å; F506-V546 HydrophobicContact CB-CG1 3.95Å; F506-V546 HydrophobicContact CB-CG2 3.9Å; F506-V546 HydrophobicContact CD2-CG1 3.93Å; F506-V546 HydrophobicContact CG-CG1 3.91Å; F506-H548 HydrophobicContact CD2-CB 4.48Å; F506-H548 HydrophobicContact CE2-CB 3.76Å; F506-H548 AromaticContact CE2-CG 3.67Å; F506-H548 AromaticContact CE2-ND1 3.55Å; F506-H548 HydrophobicContact CZ-CB 4.1Å; F506-H548 AromaticContact CZ-CE1 3.96Å; F506-H548 AromaticContact CZ-CG 3.62Å; F506-H548 AromaticContact CZ-ND1 3.56Å; F506-I551 HydrophobicContact CD2-CD1 3.82Å; F506-I551 HydrophobicContact CD2-CG1 3.83Å; F506-I551 HydrophobicContact CE2-CD1 4.31Å; F506-I551 HydrophobicContact CE2-CG1 4.11Å
507	E	93.3	Very high	95.9	Very high	42 Å²	42	25.7 Å²	25.7	20%	0.196	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-128.4	-172.8	-63.5	174.7	165.8	0	0	110.7	Y276 K286 A287 R509 K525	Y276-E507 HydrophobicContact CE1-CG 4.11Å; K286-E507 WeakPolarHBondContact CA-OE1 3.16Å; A287-E507 PolarHBondContact N-OE1 2.88Å; E507-R509 VanDerWaalsContact C-N 3.35Å; E507-K525 WeakPolarHBondContact O-CD 3.38Å; E507-K525 WeakPolarHBondContact O-CE 3.31Å; E507-K525 PolarHBondContact O-NZ 3.38Å
508	D	93.3	Very high	95.9	Very high	21 Å²	21	30.7 Å²	30.7	11%	0.112	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	11.5	179	-73.4	0.9	0	0	0	112.9	S258 V284 F506 N524 K525 F526	S258-D508 WeakPolarHBondContact CA-OD1 3.4Å; S258-D508 WeakPolarHBondContact CB-OD1 3.35Å; S258-D508 WeakPolarHBondContact CB-OD2 3.35Å; S258-D508 VanDerWaalsContact OG-CG 3.28Å; S258-D508 PolarHBondContact OG-OD1 2.03Å; S258-D508 PolarHBondContact OG-OD2 2.92Å; V284-D508 HydrophobicContact CG1-CB 4.36Å; V284-D508 WeakPolarHBondContact CG1-OD2 3.12Å; F506-D508 PolarHBondContact O-N 2.76Å; D508-N524 WeakPolarHBondContact O-CA 3.31Å; D508-K525 PolarHBondContact O-N 2.97Å; D508-F526 HydrophobicContact CB-CE2 4.15Å
509	R	95.1	Very high	96	Very high	90 Å²	90	29.7 Å²	29.7	34%	0.34	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.1	-177.9	-57.3	-163	79.9	142.6	9	112.4	F506 E507 F511 A523 D530 V532	F506-R509 PolarHBondContact N-O 3.5Å; F506-R509 PolarHBondContact O-N 3.31Å; F506-R509 VanDerWaalsContact O-O 3.08Å; E507-R509 VanDerWaalsContact C-N 3.35Å; R509-F511 HydrophobicContact CB-CE1 4.11Å; R509-F511 HydrophobicContact CB-CE2 3.95Å; R509-F511 HydrophobicContact CB-CZ 3.58Å; R509-F511 HydrophobicContact CG-CZ 4.45Å; R509-A523 CarbonylContact C-O 3.56Å; R509-A523 VanDerWaalsContact CA-O 3.24Å; R509-A523 WeakPolarHBondContact CA-O 3.41Å; R509-D530 PolarHBondContact NH2-O 2.65Å; R509-D530 VanDerWaalsContact NH2-O 3.15Å; R509-V532 VanDerWaalsContact NH2-CG2 3.28Å
510	V	97.4	Very high	96.1	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.5	168.2	63.5	0	0	0	0	108.4	L477 V503 V505 W512 G522 A523 K525	L477-V510 HydrophobicContact CD1-CG1 4Å; L477-V510 HydrophobicContact CD1-CG2 3.77Å; L477-V510 HydrophobicContact CD2-CG1 4.43Å; L477-V510 HydrophobicContact CD2-CG2 4.33Å; V503-V510 HydrophobicContact CG2-CG2 3.42Å; V503-V510 VanDerWaalsContact CG2-CG2 3.42Å; V505-V510 HydrophobicContact CG1-CB 4.1Å; V505-V510 HydrophobicContact CG1-CG2 3.84Å; V510-W512 HydrophobicContact CG1-CZ3 4.31Å; V510-G522 CarbonylContact O-C 3.54Å; V510-G522 WeakPolarHBondContact O-CA 3.21Å; V510-A523 HydrophobicContact CG1-CB 4.31Å; V510-A523 PolarHBondContact N-O 3.22Å; V510-A523 PolarHBondContact O-N 3.14Å; V510-K525 HydrophobicContact CB-CB 4.01Å; V510-K525 HydrophobicContact CG1-CB 4.34Å
511	F	98.1	Very high	96.2	Very high	7 Å²	7	28 Å²	28	3%	0.031	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.9	179.8	-51.5	-77.1	0	0	0	109.2	L294 L307 V503 T504 F506 R509 Y521 L534 V546	L294-F511 HydrophobicContact CD1-CD1 4.43Å; L294-F511 HydrophobicContact CD1-CG 4.4Å; L294-F511 HydrophobicContact CD2-CB 4.45Å; L294-F511 HydrophobicContact CD2-CD2 4.14Å; L294-F511 HydrophobicContact CD2-CG 4.26Å; L307-F511 HydrophobicContact CD1-CE2 4.11Å; L307-F511 HydrophobicContact CD1-CZ 3.9Å; L307-F511 HydrophobicContact CD2-CE1 4.15Å; L307-F511 HydrophobicContact CD2-CZ 4.15Å; V503-F511 CarbonylContact C-O 3.6Å; V503-F511 VanDerWaalsContact CA-O 3.28Å; V503-F511 WeakPolarHBondContact CA-O 3.37Å; T504-F511 HydrophobicContact CG2-CB 3.88Å; T504-F511 HydrophobicContact CG2-CD2 4.29Å; T504-F511 PolarHBondContact N-O 2.63Å; T504-F511 PolarHBondContact O-N 3.28Å; F506-F511 HydrophobicContact CB-CE2 4.23Å; R509-F511 HydrophobicContact CB-CE1 4.11Å; R509-F511 HydrophobicContact CB-CE2 3.95Å; R509-F511 HydrophobicContact CB-CZ 3.58Å; R509-F511 HydrophobicContact CG-CZ 4.45Å; F511-Y521 VanDerWaalsContact CA-O 3.25Å; F511-Y521 WeakPolarHBondContact CA-O 2.98Å; F511-L534 HydrophobicContact CD1-CD1 3.38Å; F511-L534 HydrophobicContact CE1-CD1 3.66Å; F511-L534 HydrophobicContact CG-CD1 4.44Å; F511-V546 HydrophobicContact CD2-CG2 4.12Å; F511-V546 HydrophobicContact CE2-CG2 4.4Å
512	W	98.3	Very high	96.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.3	177.8	67.4	98.4	0	0	0	111.6	V470 L477 L491 Y496 L497 A502 V503 V510 I520 Y521 A523 V531	V470-W512 HydrophobicContact CG1-CB 4.43Å; L477-W512 HydrophobicContact CD1-CD2 4.43Å; L477-W512 HydrophobicContact CD1-CE3 4.03Å; L477-W512 HydrophobicContact CD1-CZ3 4.47Å; L491-W512 HydrophobicContact CD2-CH2 3.81Å; L491-W512 HydrophobicContact CD2-CZ2 4.01Å; Y496-W512 PolarHBondContact O-NE1 2.88Å; L497-W512 HydrophobicContact CD2-CD2 4.26Å; L497-W512 HydrophobicContact CD2-CG 4.19Å; L497-W512 HydrophobicContact CD2-CZ2 4.36Å; A502-W512 CarbonylContact O-C 3.55Å; A502-W512 WeakPolarHBondContact O-CA 3.45Å; A502-W512 WeakPolarHBondContact O-CB 3.36Å; V503-W512 HydrophobicContact CB-CB 4.36Å; V503-W512 HydrophobicContact CG2-CB 4.43Å; V510-W512 HydrophobicContact CG1-CZ3 4.31Å; W512-I520 WeakPolarHBondContact O-CA 3.32Å; W512-Y521 VanDerWaalsContact CE2-CB 3.41Å; W512-Y521 AromaticContact CE2-CD2 3.96Å; W512-Y521 HydrophobicContact CZ2-CD2 4.21Å; W512-Y521 AromaticContact CZ2-CG 3.92Å; W512-Y521 HydrophobicContact CZ2-CG 3.92Å; W512-Y521 PolarHBondContact N-O 3.16Å; W512-Y521 VanDerWaalsContact N-O 3.09Å; W512-Y521 AromaticContact NE1-CD2 3.54Å; W512-Y521 PolarHBondContact O-N 3.28Å; W512-A523 HydrophobicContact CH2-CB 3.88Å; W512-A523 HydrophobicContact CZ3-CB 3.73Å; W512-V531 HydrophobicContact CH2-CG1 4.09Å; W512-V531 HydrophobicContact CZ2-CG1 4.4Å
513	T	97.8	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.2	169.7	65.5	0	0	0	0	109.8	P500 F501 A502 I520 P541 V544	P500-T513 CarbonylContact C-O 3.52Å; P500-T513 WeakPolarHBondContact CA-O 3.38Å; F501-T513 PolarHBondContact N-O 2.8Å; A502-T513 PolarHBondContact N-OG1 3.4Å; A502-T513 VanDerWaalsContact N-OG1 3.13Å; A502-T513 PolarHBondContact O-N 3.09Å; T513-I520 HydrophobicContact CG2-CG1 4.11Å; T513-P541 WeakPolarHBondContact CB-O 3.16Å; T513-P541 HydrophobicContact CG2-CB 4.1Å; T513-P541 PolarHBondContact OG1-O 3.24Å; T513-V544 HydrophobicContact CG2-CB 3.62Å; T513-V544 HydrophobicContact CG2-CG1 3.54Å
514	D	97.1	Very high	96.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.3	171.9	-169.2	-75.6	0	0	0	110	A498 H499 E516 N517 K518 A519 Y521	A498-D514 PolarHBondContact N-OD2 3.38Å; H499-D514 PolarHBondContact N-OD2 3.23Å; D514-E516 PolarHBondContact OD1-N 2.03Å; D514-N517 HydrophobicContact CB-CB 4.16Å; D514-N517 WeakPolarHBondContact OD1-CB 3.36Å; D514-N517 PolarHBondContact OD1-N 3.18Å; D514-K518 WeakPolarHBondContact O-CA 2.97Å; D514-K518 PolarHBondContact O-N 3.41Å; D514-A519 PolarHBondContact N-O 2.71Å; D514-A519 PolarHBondContact O-N 3.41Å; D514-Y521 HydrophobicContact CB-CD2 4.31Å; D514-Y521 HydrophobicContact CB-CE2 3.98Å
515	G	93.7	Very high	96	Very high	14 Å²	14	27.2 Å²	27.2	14%	0.144	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-36	-176.4	0	0	0	0	0	114.4	H499 F501 K518	H499-G515 PolarHBondContact O-N 3.37Å; F501-G515 VanDerWaalsContact CE2-CA 3.47Å; G515-K518 WeakPolarHBondContact O-CG 3.48Å
516	E	93.5	Very high	95.8	Very high	139 Å²	139	27.7 Å²	27.7	65%	0.65	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-49.5	-176.9	-171.3	63.1	-150.5	0	0	109.9	A498 H499 D514 K518	A498-E516 HydrophobicContact CB-CB 3.91Å; A498-E516 HydrophobicContact CB-CG 4.16Å; H499-E516 HydrophobicContact CB-CB 4Å; D514-E516 PolarHBondContact OD1-N 2.03Å; E516-K518 PolarHBondContact O-N 3.38Å
517	N	94.4	Very high	95.6	Very high	63 Å²	63	30.6 Å²	30.6	34%	0.337	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-11.8	176.2	-71.8	-40.6	0	0	0	113.4	D495 D514 A519 Y521	D495-N517 PolarHBondContact O-ND2 3.34Å; D514-N517 HydrophobicContact CB-CB 4.16Å; D514-N517 WeakPolarHBondContact OD1-CB 3.36Å; D514-N517 PolarHBondContact OD1-N 3.18Å; N517-A519 VanDerWaalsContact C-N 3.27Å; N517-A519 HydrophobicContact CB-CB 4.43Å; N517-A519 PolarHBondContact O-N 3.43Å; N517-Y521 HydrophobicContact CB-CE2 4.11Å; N517-Y521 WeakPolarHBondContact CB-OH 3.45Å
518	K	95.8	Very high	95.6	Very high	105 Å²	105	28.9 Å²	28.9	46%	0.457	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	44.5	178.4	-70.7	175.9	-179.9	177.5	0	112.5	D514 G515 E516 N537 L538	D514-K518 WeakPolarHBondContact O-CA 2.97Å; D514-K518 PolarHBondContact O-N 3.41Å; G515-K518 WeakPolarHBondContact O-CG 3.48Å; E516-K518 PolarHBondContact O-N 3.38Å; K518-N537 PolarHBondContact O-N 2.82Å; K518-L538 VanDerWaalsContact CB-O 3.23Å; K518-L538 WeakPolarHBondContact CB-O 3.14Å; K518-L538 WeakPolarHBondContact CD-O 3.29Å; K518-L538 WeakPolarHBondContact CG-O 3.28Å; K518-L538 WeakPolarHBondContact O-CB 3.08Å; K518-L538 PolarHBondContact O-N 2.73Å
519	A	96.2	Very high	95.6	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.025	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.6	-170.1	0	0	0	0	0	112.5	D514 N517 Y521 T533 A535	D514-A519 PolarHBondContact N-O 2.71Å; D514-A519 PolarHBondContact O-N 3.41Å; N517-A519 VanDerWaalsContact C-N 3.27Å; N517-A519 HydrophobicContact CB-CB 4.43Å; N517-A519 PolarHBondContact O-N 3.43Å; A519-Y521 HydrophobicContact CB-CD2 4.47Å; A519-Y521 HydrophobicContact CB-CE1 4.45Å; A519-Y521 HydrophobicContact CB-CE2 3.81Å; A519-T533 HydrophobicContact CB-CG2 4.37Å; A519-A535 CarbonylContact C-O 3.46Å; A519-A535 VanDerWaalsContact CA-O 3.23Å; A519-A535 WeakPolarHBondContact CA-O 3.11Å; A519-A535 WeakPolarHBondContact CB-O 2.9Å
520	I	97.5	Very high	95.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.8	168.4	-60.8	173.2	0	0	0	107.5	L294 F296 W512 T513 L534 A535 L538	L294-I520 HydrophobicContact CD1-CG2 4.17Å; F296-I520 HydrophobicContact CB-CD1 4.13Å; F296-I520 HydrophobicContact CD1-CD1 3.59Å; F296-I520 HydrophobicContact CD2-CD1 3.75Å; F296-I520 HydrophobicContact CE1-CD1 3.82Å; F296-I520 HydrophobicContact CE2-CD1 3.97Å; F296-I520 HydrophobicContact CG-CD1 3.55Å; F296-I520 HydrophobicContact CZ-CD1 4Å; W512-I520 WeakPolarHBondContact O-CA 3.32Å; T513-I520 HydrophobicContact CG2-CG1 4.11Å; I520-L534 HydrophobicContact CG2-CB 4.32Å; I520-L534 HydrophobicContact CG2-CD1 4.27Å; I520-L534 PolarHBondContact O-N 3.41Å; I520-A535 HydrophobicContact CB-CB 4.3Å; I520-A535 HydrophobicContact CD1-CB 4.32Å; I520-A535 HydrophobicContact CG1-CB 4.45Å; I520-A535 PolarHBondContact N-O 3.02Å; I520-A535 PolarHBondContact O-N 3.07Å; I520-L538 HydrophobicContact CD1-CD1 3.91Å; I520-L538 HydrophobicContact CG1-CD1 3.66Å
521	Y	97.6	Very high	95.5	Very high	20 Å²	20	33.2 Å²	33.2	8%	0.078	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	162.2	178.8	-62.2	-78.1	0	0	0	111	Y496 F511 W512 D514 N517 A519 V531 V532 T533	Y496-Y521 HydrophobicContact CD1-CD1 4.14Å; Y496-Y521 AromaticContact CD1-CE1 3.78Å; Y496-Y521 HydrophobicContact CD1-CE1 3.78Å; Y496-Y521 HydrophobicContact CE1-CE1 4.33Å; F511-Y521 VanDerWaalsContact CA-O 3.25Å; F511-Y521 WeakPolarHBondContact CA-O 2.98Å; W512-Y521 VanDerWaalsContact CE2-CB 3.41Å; W512-Y521 AromaticContact CE2-CD2 3.96Å; W512-Y521 HydrophobicContact CZ2-CD2 4.21Å; W512-Y521 AromaticContact CZ2-CG 3.92Å; W512-Y521 HydrophobicContact CZ2-CG 3.92Å; W512-Y521 PolarHBondContact N-O 3.16Å; W512-Y521 VanDerWaalsContact N-O 3.09Å; W512-Y521 AromaticContact NE1-CD2 3.54Å; W512-Y521 PolarHBondContact O-N 3.28Å; D514-Y521 HydrophobicContact CB-CD2 4.31Å; D514-Y521 HydrophobicContact CB-CE2 3.98Å; N517-Y521 HydrophobicContact CB-CE2 4.11Å; N517-Y521 WeakPolarHBondContact CB-OH 3.45Å; A519-Y521 HydrophobicContact CB-CD2 4.47Å; A519-Y521 HydrophobicContact CB-CE1 4.45Å; A519-Y521 HydrophobicContact CB-CE2 3.81Å; Y521-V531 HydrophobicContact CD1-CG1 4.32Å; Y521-V532 CarbonylContact C-O 3.54Å; Y521-V532 VanDerWaalsContact CA-O 3.3Å; Y521-V532 WeakPolarHBondContact CA-O 3.33Å; Y521-T533 HydrophobicContact CD1-CG2 4.46Å; Y521-T533 HydrophobicContact CE1-CG2 4.23Å; Y521-T533 WeakPolarHBondContact CE1-OG1 3.06Å
522	G	97.1	Very high	95.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.7	168.4	0	0	0	0	0	112.3	V510 V531 V532	V510-G522 CarbonylContact O-C 3.54Å; V510-G522 WeakPolarHBondContact O-CA 3.21Å; G522-V531 CarbonylContact O-C 3.5Å; G522-V531 WeakPolarHBondContact O-CA 3.04Å; G522-V532 PolarHBondContact N-O 2.99Å; G522-V532 WeakPolarHBondContact O-CG2 3.14Å; G522-V532 PolarHBondContact O-N 3.04Å
523	A	97.1	Very high	95.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	172.5	-179.5	0	0	0	0	0	110.7	R509 V510 W512 K525 V531	R509-A523 CarbonylContact C-O 3.56Å; R509-A523 VanDerWaalsContact CA-O 3.24Å; R509-A523 WeakPolarHBondContact CA-O 3.41Å; V510-A523 HydrophobicContact CG1-CB 4.31Å; V510-A523 PolarHBondContact N-O 3.22Å; V510-A523 PolarHBondContact O-N 3.14Å; W512-A523 HydrophobicContact CH2-CB 3.88Å; W512-A523 HydrophobicContact CZ3-CB 3.73Å; A523-K525 PolarHBondContact O-N 3.01Å; A523-V531 HydrophobicContact CB-CG2 4.09Å
524	N	95.4	Very high	95.1	Very high	41 Å²	41	41.7 Å²	41.7	22%	0.219	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.8	168.9	-174.5	-64.6	0	0	0	110	D508 F526 S527 G528 S529	D508-N524 WeakPolarHBondContact O-CA 3.31Å; N524-F526 PolarHBondContact O-N 3.11Å; N524-F526 WeakPolarHBondContact OD1-CB 3.4Å; N524-F526 PolarHBondContact OD1-N 2.91Å; N524-S527 WeakPolarHBondContact CB-OG 3.32Å; N524-S527 PolarHBondContact OD1-N 2.8Å; N524-S527 PolarHBondContact OD1-OG 2.97Å; N524-G528 VanDerWaalsContact O-CA 3.27Å; N524-G528 WeakPolarHBondContact O-CA 3.46Å; N524-G528 PolarHBondContact O-N 2.88Å; N524-S529 PolarHBondContact N-O 2.89Å
525	K	94.7	Very high	94.9	Very high	5 Å²	5	42.2 Å²	42.2	2%	0.022	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.8	-174.4	77.6	-179.7	-177	-173.9	0	114.4	D461 Y468 V490 E507 D508 V510 A523	D461-K525 IonicContact OD2-NZ 3.23Å; D461-K525 PolarHBondContact OD2-NZ 3.33Å; Y468-K525 HydrophobicContact CE1-CB 4.13Å; Y468-K525 WeakPolarHBondContact CE1-O 3.23Å; V490-K525 WeakPolarHBondContact CG1-O 3.2Å; E507-K525 WeakPolarHBondContact O-CD 3.38Å; E507-K525 WeakPolarHBondContact O-CE 3.31Å; E507-K525 PolarHBondContact O-NZ 3.38Å; D508-K525 PolarHBondContact O-N 2.97Å; V510-K525 HydrophobicContact CB-CB 4.01Å; V510-K525 HydrophobicContact CG1-CB 4.34Å; A523-K525 PolarHBondContact O-N 3.01Å
526	F	92.8	Very high	94.9	Very high	21 Å²	21	45 Å²	45	9%	0.092	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-49.6	-178.4	-53.8	-71	0	0	0	111.6	P254 G255 N488 D508 N524	P254-F526 HydrophobicContact CB-CD1 4.45Å; G255-F526 VanDerWaalsContact CA-CD1 3.48Å; N488-F526 PolarHBondContact ND2-O 3.42Å; D508-F526 HydrophobicContact CB-CE2 4.15Å; N524-F526 PolarHBondContact O-N 3.11Å; N524-F526 WeakPolarHBondContact OD1-CB 3.4Å; N524-F526 PolarHBondContact OD1-N 2.91Å
527	S	91.4	Very high	94.9	Very high	70 Å²	70	45.3 Å²	45.3	49%	0.49	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-18.1	-175.2	57.1	0	0	0	0	114.6	V490 N524 S529	V490-S527 CarbonylContact O-C 3.6Å; N524-S527 WeakPolarHBondContact CB-OG 3.32Å; N524-S527 PolarHBondContact OD1-N 2.8Å; N524-S527 PolarHBondContact OD1-OG 2.97Å; S527-S529 PolarHBondContact O-N 3.14Å; S527-S529 PolarHBondContact OG-N 3.38Å; S527-S529 PolarHBondContact OG-OG 3.03Å
528	G	93.1	Very high	94.9	Very high	6 Å²	6	42.4 Å²	42.4	6%	0.062	24%	0.244	C	C	.	.			trans	68.7	6.8	-169.3	0	0	0	0	0	114.4	V490 N524	V490-G528 WeakPolarHBondContact O-CA 3.05Å; V490-G528 PolarHBondContact O-N 3.09Å; N524-G528 VanDerWaalsContact O-CA 3.27Å; N524-G528 WeakPolarHBondContact O-CA 3.46Å; N524-G528 PolarHBondContact O-N 2.88Å
529	S	93	Very high	94.6	Very high	48 Å²	48	42.4 Å²	42.4	34%	0.336	25%	0.248	S	C	.	.			trans	-75.6	172.3	177.8	66.6	0	0	0	0	112.3	N524 S527 V531	N524-S529 PolarHBondContact N-O 2.89Å; S527-S529 PolarHBondContact O-N 3.14Å; S527-S529 PolarHBondContact OG-N 3.38Å; S527-S529 PolarHBondContact OG-OG 3.03Å; S529-V531 PolarHBondContact O-N 2.79Å
530	D	93.9	Very high	94.4	Very high	115 Å²	115	43.9 Å²	43.9	62%	0.615	26%	0.256	S	S	*	.	S	Bend	trans	58.7	45.6	171.9	-48.9	-58.3	0	0	0	113.2	R509 V532	R509-D530 PolarHBondContact NH2-O 2.65Å; R509-D530 VanDerWaalsContact NH2-O 3.15Å; D530-V532 PolarHBondContact O-N 3.37Å
531	V	96.4	Very high	94.3	Very high	40 Å²	40	43.9 Å²	43.9	24%	0.242	26%	0.256	C	S	.	.			trans	-62.7	123.7	176	-174.8	0	0	0	0	109.4	L491 Y496 W512 Y521 G522 A523 S529	L491-V531 HydrophobicContact CD2-CG2 4.31Å; Y496-V531 HydrophobicContact CD1-CG1 3.88Å; Y496-V531 HydrophobicContact CD2-CG1 4.32Å; Y496-V531 HydrophobicContact CE1-CG1 4.06Å; Y496-V531 HydrophobicContact CE2-CG1 4.48Å; Y496-V531 HydrophobicContact CG-CG1 4.02Å; W512-V531 HydrophobicContact CH2-CG1 4.09Å; W512-V531 HydrophobicContact CZ2-CG1 4.4Å; Y521-V531 HydrophobicContact CD1-CG1 4.32Å; G522-V531 CarbonylContact O-C 3.5Å; G522-V531 WeakPolarHBondContact O-CA 3.04Å; A523-V531 HydrophobicContact CB-CG2 4.09Å; S529-V531 PolarHBondContact O-N 2.79Å
532	V	95.7	Very high	94.2	Very high	54 Å²	54	45.2 Å²	45.2	33%	0.327	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141	177.2	-60	0	0	0	0	110.6	R509 Y521 G522 D530 L534	R509-V532 VanDerWaalsContact NH2-CG2 3.28Å; Y521-V532 CarbonylContact C-O 3.54Å; Y521-V532 VanDerWaalsContact CA-O 3.3Å; Y521-V532 WeakPolarHBondContact CA-O 3.33Å; G522-V532 PolarHBondContact N-O 2.99Å; G522-V532 WeakPolarHBondContact O-CG2 3.14Å; G522-V532 PolarHBondContact O-N 3.04Å; D530-V532 PolarHBondContact O-N 3.37Å; V532-L534 HydrophobicContact CG2-CD2 4.18Å; V532-L534 HydrophobicContact CG2-CG 4.41Å
533	T	95.6	Very high	94.2	Very high	81 Å²	81	46.2 Å²	46.2	50%	0.497	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.9	170.5	-48.8	0	0	0	0	109.4	A519 Y521	A519-T533 HydrophobicContact CB-CG2 4.37Å; Y521-T533 HydrophobicContact CD1-CG2 4.46Å; Y521-T533 HydrophobicContact CE1-CG2 4.23Å; Y521-T533 WeakPolarHBondContact CE1-OG1 3.06Å
534	L	94.8	Very high	94.2	Very high	50 Å²	50	46.4 Å²	46.4	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-38.6	-179.3	-67.9	174.6	0	0	0	112.5	L294 L305 L307 F511 I520 V532	L294-L534 HydrophobicContact CD1-CD1 3.76Å; L305-L534 HydrophobicContact CD2-CB 4.03Å; L307-L534 HydrophobicContact CD2-CD1 4.24Å; F511-L534 HydrophobicContact CD1-CD1 3.38Å; F511-L534 HydrophobicContact CE1-CD1 3.66Å; F511-L534 HydrophobicContact CG-CD1 4.44Å; I520-L534 HydrophobicContact CG2-CB 4.32Å; I520-L534 HydrophobicContact CG2-CD1 4.27Å; I520-L534 PolarHBondContact O-N 3.41Å; V532-L534 HydrophobicContact CG2-CD2 4.18Å; V532-L534 HydrophobicContact CG2-CG 4.41Å
535	A	94.1	Very high	94.3	Very high	12 Å²	12	45.4 Å²	45.4	10%	0.099	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	146.9	175.4	0	0	0	0	0	109.5	L305 A519 I520 L538	L305-A535 HydrophobicContact CD2-CB 4.48Å; A519-A535 CarbonylContact C-O 3.46Å; A519-A535 VanDerWaalsContact CA-O 3.23Å; A519-A535 WeakPolarHBondContact CA-O 3.11Å; A519-A535 WeakPolarHBondContact CB-O 2.9Å; I520-A535 HydrophobicContact CB-CB 4.3Å; I520-A535 HydrophobicContact CD1-CB 4.32Å; I520-A535 HydrophobicContact CG1-CB 4.45Å; I520-A535 PolarHBondContact N-O 3.02Å; I520-A535 PolarHBondContact O-N 3.07Å; A535-L538 HydrophobicContact CB-CD1 4.26Å; A535-L538 HydrophobicContact CB-CD2 4.46Å
536	S	94.1	Very high	94.4	Very high	72 Å²	72	45.6 Å²	45.6	50%	0.503	27%	0.265	S	S	.	.			trans	-138.4	170.8	179	64.9	0	0	0	0	110.3	L538	S536-L538 VanDerWaalsContact C-N 3.28Å; S536-L538 PolarHBondContact O-N 3.19Å
537	N	92.9	Very high	94.5	Very high	146 Å²	146	46 Å²	46	78%	0.781	27%	0.267	S	S	*	.	S	Bend	trans	58.1	39.7	-177.8	-55.6	-43.1	0	0	0	112.8	K518	K518-N537 PolarHBondContact O-N 2.82Å
538	L	94.3	Very high	94.6	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	24%	0.244	C	C	.	.			trans	-80	157.3	172.8	-56.7	178.6	0	0	0	109.7	F296 K518 I520 A535 S536 P541	F296-L538 HydrophobicContact CE2-CD1 4.14Å; F296-L538 HydrophobicContact CE2-CD2 3.92Å; F296-L538 HydrophobicContact CZ-CD2 4.37Å; K518-L538 VanDerWaalsContact CB-O 3.23Å; K518-L538 WeakPolarHBondContact CB-O 3.14Å; K518-L538 WeakPolarHBondContact CD-O 3.29Å; K518-L538 WeakPolarHBondContact CG-O 3.28Å; K518-L538 WeakPolarHBondContact O-CB 3.08Å; K518-L538 PolarHBondContact O-N 2.73Å; I520-L538 HydrophobicContact CD1-CD1 3.91Å; I520-L538 HydrophobicContact CG1-CD1 3.66Å; A535-L538 HydrophobicContact CB-CD1 4.26Å; A535-L538 HydrophobicContact CB-CD2 4.46Å; S536-L538 VanDerWaalsContact C-N 3.28Å; S536-L538 PolarHBondContact O-N 3.19Å; L538-P541 HydrophobicContact CB-CB 4.33Å; L538-P541 HydrophobicContact CB-CG 4.06Å; L538-P541 HydrophobicContact CD1-CB 3.85Å; L538-P541 HydrophobicContact CD1-CG 4.02Å
539	N	90.1	Very high	94.6	Very high	104 Å²	104	46.3 Å²	46.3	56%	0.556	26%	0.259	S	S	*	.	S	Bend	trans	-85.3	-46.4	-178.5	-74.8	-33.2	0	0	0	111.8	N298	N298-N539 PolarHBondContact OD1-N 3.34Å
540	D	92	Very high	94.6	Very high	34 Å²	34	45.2 Å²	45.2	18%	0.182	25%	0.249	C	C	.	.			trans	-168.2	82.3	-178.2	-171.6	15.4	0	0	0	109.2	R299 Q542	R299-D540 HydrophobicContact CB-CB 4.01Å; R299-D540 HydrophobicContact CG-CB 4.32Å; R299-D540 PolarHBondContact N-O 3.31Å; D540-Q542 PolarHBondContact O-N 3.28Å; D540-Q542 PolarHBondContact OD1-NE2 1.99Å
541	P	94.6	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.			trans	-82.9	90.2	-176.8	33.9	-34.4	0	0	0	111.6	T297 T513 L538	T297-P541 WeakPolarHBondContact O-CA 3.48Å; T513-P541 WeakPolarHBondContact CB-O 3.16Å; T513-P541 HydrophobicContact CG2-CB 4.1Å; T513-P541 PolarHBondContact OG1-O 3.24Å; L538-P541 HydrophobicContact CB-CB 4.33Å; L538-P541 HydrophobicContact CB-CG 4.06Å; L538-P541 HydrophobicContact CD1-CB 3.85Å; L538-P541 HydrophobicContact CD1-CG 4.02Å
542	Q	95	Very high	94.4	Very high	48 Å²	48	41.6 Å²	41.6	22%	0.224	23%	0.227	C	C	.	.			trans	-80.6	-35.4	-173.9	-71.1	-71.9	-32.4	0	0	113.4	T297 A323 F501 D540	T297-Q542 PolarHBondContact OG1-N 3.13Å; A323-Q542 VanDerWaalsContact O-CB 3.3Å; A323-Q542 WeakPolarHBondContact O-CB 3.35Å; F501-Q542 VanDerWaalsContact CB-O 3.31Å; F501-Q542 WeakPolarHBondContact CB-O 3.16Å; D540-Q542 PolarHBondContact O-N 3.28Å; D540-Q542 PolarHBondContact OD1-NE2 1.99Å
543	D	97.4	Very high	94.2	Very high	22 Å²	22	40.6 Å²	40.6	12%	0.118	22%	0.219	C	C	.	.			trans	-143.4	150.3	-176.2	-158.5	6.5	0	0	0	113.1	F296 T297 A323 A324 L325 A502	F296-D543 CarbonylContact C-O 3.59Å; F296-D543 WeakPolarHBondContact CA-O 3.23Å; F296-D543 VanDerWaalsContact CB-O 3.26Å; F296-D543 WeakPolarHBondContact CB-O 3.46Å; T297-D543 PolarHBondContact N-O 2.93Å; T297-D543 PolarHBondContact OG1-N 3.46Å; A323-D543 WeakPolarHBondContact O-CB 3.3Å; A324-D543 WeakPolarHBondContact CA-OD2 3.31Å; L325-D543 HydrophobicContact CG-CB 4.47Å; L325-D543 PolarHBondContact N-OD2 3.21Å; A502-D543 HydrophobicContact CB-CB 4.41Å; A502-D543 WeakPolarHBondContact CB-OD1 3.35Å
544	V	97.6	Very high	93.9	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	133.3	179.5	63.8	0	0	0	0	111.4	L294 I295 F296 A502 T504 T513	L294-V544 HydrophobicContact CB-CG2 4.25Å; L294-V544 HydrophobicContact CD2-CG2 4.19Å; I295-V544 WeakPolarHBondContact O-CA 3.28Å; F296-V544 HydrophobicContact CB-CB 4Å; F296-V544 HydrophobicContact CB-CG2 4Å; A502-V544 HydrophobicContact CB-CG1 3.99Å; T504-V544 HydrophobicContact CG2-CG1 4.03Å; T504-V544 HydrophobicContact CG2-CG2 4.14Å; T513-V544 HydrophobicContact CG2-CB 3.62Å; T513-V544 HydrophobicContact CG2-CG1 3.54Å
545	I	97.6	Very high	93.7	Very high	20 Å²	20	41 Å²	41	10%	0.103	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152.2	170.9	77.7	176.1	0	0	0	110.5	L294 I295 L325 A327	L294-I545 WeakPolarHBondContact CA-O 3.48Å; I295-I545 HydrophobicContact CB-CG1 4.16Å; I295-I545 PolarHBondContact N-O 3.35Å; I295-I545 PolarHBondContact O-N 3.02Å; L325-I545 HydrophobicContact CD1-CB 4.12Å; L325-I545 HydrophobicContact CD1-CD1 3.57Å; L325-I545 HydrophobicContact CD1-CG1 3.55Å; L325-I545 HydrophobicContact CD1-CG2 3.65Å; L325-I545 HydrophobicContact CG-CG2 4.46Å; L325-I545 WeakPolarHBondContact O-CG2 3.28Å; A327-I545 HydrophobicContact CB-CD1 3.69Å
546	V	96.8	Very high	93.6	Very high	9 Å²	9	44.9 Å²	44.9	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.1	162.1	179.6	0	0	0	0	108.8	P292 C293 L294 T504 F506 F511 H548 I551	P292-V546 HydrophobicContact CB-CG1 4.42Å; C293-V546 WeakPolarHBondContact O-CA 2.91Å; L294-V546 HydrophobicContact CD2-CB 4.39Å; L294-V546 HydrophobicContact CD2-CG2 3.48Å; L294-V546 VanDerWaalsContact CD2-CG2 3.48Å; T504-V546 HydrophobicContact CG2-CG2 3.66Å; T504-V546 PolarHBondContact OG1-N 3.25Å; F506-V546 HydrophobicContact CB-CB 4.34Å; F506-V546 HydrophobicContact CB-CG1 3.95Å; F506-V546 HydrophobicContact CB-CG2 3.9Å; F506-V546 HydrophobicContact CD2-CG1 3.93Å; F506-V546 HydrophobicContact CG-CG1 3.91Å; F511-V546 HydrophobicContact CD2-CG2 4.12Å; F511-V546 HydrophobicContact CE2-CG2 4.4Å; V546-H548 HydrophobicContact CG1-CB 4.3Å; V546-I551 HydrophobicContact CB-CD1 3.38Å; V546-I551 HydrophobicContact CG1-CD1 3.35Å; V546-I551 VanDerWaalsContact O-CD1 3.23Å; V546-I551 WeakPolarHBondContact O-CD1 3.44Å
547	Y	94.5	Very high	93.5	Very high	30 Å²	30	43.1 Å²	43.1	12%	0.118	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	98.9	176.3	-172.6	-99.7	0	0	0	110.1	C293 I295 A327 F329 L349	C293-Y547 PolarHBondContact O-N 3Å; I295-Y547 HydrophobicContact CD1-CD1 4.45Å; I295-Y547 HydrophobicContact CD1-CD2 3.93Å; I295-Y547 HydrophobicContact CD1-CG 3.77Å; A327-Y547 HydrophobicContact CB-CD2 3.89Å; A327-Y547 HydrophobicContact CB-CE2 3.96Å; F329-Y547 HydrophobicContact CB-CE2 4.48Å; F329-Y547 HydrophobicContact CD2-CD1 4.13Å; F329-Y547 HydrophobicContact CD2-CD2 4.35Å; F329-Y547 AromaticContact CD2-CE1 3.68Å; F329-Y547 HydrophobicContact CD2-CE1 3.68Å; F329-Y547 AromaticContact CD2-CE2 3.93Å; F329-Y547 HydrophobicContact CD2-CE2 3.93Å; F329-Y547 HydrophobicContact CD2-CG 4.45Å; F329-Y547 AromaticContact CD2-CZ 3.57Å; F329-Y547 HydrophobicContact CE2-CD1 4.19Å; F329-Y547 AromaticContact CE2-CE1 3.72Å; F329-Y547 HydrophobicContact CE2-CE1 3.72Å; L349-Y547 HydrophobicContact CD1-CE2 4.16Å
548	H	94.3	Very high	93.4	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.023	24%	0.236	C	C	.	.			trans	-155.6	152.4	179.1	-167.9	-94.2	0	0	0	111.5	K290 P292 F506 V546 L550 I551	K290-H548 PolarHBondContact O-CD2 3.2Å; K290-H548 VanDerWaalsContact O-CD2 3.28Å; K290-H548 PolarHBondContact O-NE2 3.17Å; P292-H548 HydrophobicContact CB-CB 4.35Å; F506-H548 HydrophobicContact CD2-CB 4.48Å; F506-H548 HydrophobicContact CE2-CB 3.76Å; F506-H548 AromaticContact CE2-CG 3.67Å; F506-H548 AromaticContact CE2-ND1 3.55Å; F506-H548 HydrophobicContact CZ-CB 4.1Å; F506-H548 AromaticContact CZ-CE1 3.96Å; F506-H548 AromaticContact CZ-CG 3.62Å; F506-H548 AromaticContact CZ-ND1 3.56Å; V546-H548 HydrophobicContact CG1-CB 4.3Å; H548-L550 PolarHBondContact ND1-N 2.62Å; H548-L550 VanDerWaalsContact ND1-N 3.16Å; H548-L550 PolarHBondContact O-N 2.93Å; H548-I551 HydrophobicContact CB-CD1 4.13Å; H548-I551 HydrophobicContact CB-CG1 4.44Å; H548-I551 PolarHBondContact O-N 3.42Å
549	E	92.4	Very high	93.2	Very high	77 Å²	77	42.9 Å²	42.9	36%	0.36	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-67.1	-35	-175.6	72.8	-169.2	166.7	0	0	113.6	F329 I551 Q552	F329-E549 HydrophobicContact CD1-CB 3.7Å; F329-E549 HydrophobicContact CE1-CB 3.29Å; F329-E549 HydrophobicContact CE2-CB 4.29Å; F329-E549 HydrophobicContact CG-CB 4.37Å; F329-E549 HydrophobicContact CZ-CB 3.61Å; E549-I551 PolarHBondContact O-N 2.84Å; E549-Q552 PolarHBondContact O-N 2.69Å
550	L	93.1	Very high	93.1	Very high	25 Å²	25	42.9 Å²	42.9	13%	0.131	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-74.2	-10.4	-176.4	-59.8	174	0	0	0	114.3	G275 Y276 A287 H548	G275-L550 WeakPolarHBondContact O-CD1 3.47Å; Y276-L550 HydrophobicContact CD1-CD1 4.27Å; Y276-L550 HydrophobicContact CD2-CD1 3.93Å; Y276-L550 HydrophobicContact CE1-CD1 3.93Å; Y276-L550 HydrophobicContact CE2-CB 3.84Å; Y276-L550 HydrophobicContact CE2-CD1 3.56Å; Y276-L550 HydrophobicContact CE2-CD2 4.47Å; Y276-L550 HydrophobicContact CE2-CG 4.15Å; Y276-L550 HydrophobicContact CG-CD1 4.26Å; Y276-L550 WeakPolarHBondContact OH-CB 3.06Å; A287-L550 HydrophobicContact CB-CD1 3.63Å; H548-L550 PolarHBondContact ND1-N 2.62Å; H548-L550 VanDerWaalsContact ND1-N 3.16Å; H548-L550 PolarHBondContact O-N 2.93Å
551	I	92.4	Very high	92.7	Very high	51 Å²	51	49.1 Å²	49.1	26%	0.262	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-75.7	-34.7	173.1	-66.3	170	0	0	0	110.2	F506 V546 H548 E549 L553	F506-I551 HydrophobicContact CD2-CD1 3.82Å; F506-I551 HydrophobicContact CD2-CG1 3.83Å; F506-I551 HydrophobicContact CE2-CD1 4.31Å; F506-I551 HydrophobicContact CE2-CG1 4.11Å; V546-I551 HydrophobicContact CB-CD1 3.38Å; V546-I551 HydrophobicContact CG1-CD1 3.35Å; V546-I551 VanDerWaalsContact O-CD1 3.23Å; V546-I551 WeakPolarHBondContact O-CD1 3.44Å; H548-I551 HydrophobicContact CB-CD1 4.13Å; H548-I551 HydrophobicContact CB-CG1 4.44Å; H548-I551 PolarHBondContact O-N 3.42Å; E549-I551 PolarHBondContact O-N 2.84Å; I551-L553 PolarHBondContact O-N 2.9Å
552	Q	93.5	Very high	92.2	Very high	29 Å²	29	58.4 Å²	58.4	14%	0.136	31%	0.311	C	S	.	.	S	Bend	trans	-101.5	77.3	-177.6	-66.4	-171	-14.4	0	0	110.2	A327 W375 E549	A327-Q552 PolarHBondContact O-NE2 3.13Å; W375-Q552 HydrophobicContact CD2-CB 3.82Å; W375-Q552 HydrophobicContact CD2-CG 3.68Å; W375-Q552 HydrophobicContact CE3-CB 4.42Å; W375-Q552 HydrophobicContact CE3-CG 3.78Å; W375-Q552 HydrophobicContact CG-CB 3.94Å; W375-Q552 HydrophobicContact CG-CG 4.07Å; W375-Q552 HydrophobicContact CH2-CG 4.46Å; W375-Q552 HydrophobicContact CZ2-CB 4.28Å; W375-Q552 HydrophobicContact CZ2-CG 4.37Å; W375-Q552 HydrophobicContact CZ3-CG 4.19Å; E549-Q552 PolarHBondContact O-N 2.69Å
553	L	91.1	Very high	91.8	Very high	33 Å²	33	58.7 Å²	58.7	17%	0.173	32%	0.315	C	S	.	.			trans	-54.6	140.1	179.2	-63.9	175.2	0	0	0	111.4	W375 L419 L462 I551	W375-L553 PolarHBondContact NE1-O 3.33Å; L419-L553 HydrophobicContact CD1-CB 3.96Å; L419-L553 HydrophobicContact CD1-CD1 3.84Å; L462-L553 HydrophobicContact CB-CD1 4.15Å; I551-L553 PolarHBondContact O-N 2.9Å
554	A	89.9	Confident	91.2	Very high	102 Å²	102	58 Å²	58	84%	0.843	31%	0.313	S	S	*	.			trans	-68.3	135.5	177.3	0	0	0	0	0	110.6
555	G	89.9	Confident	90.7	Very high	38 Å²	38	59.5 Å²	59.5	39%	0.392	33%	0.329	S	S	.	.			trans	-147.4	166.7	176.5	0	0	0	0	0	112.7
556	T	91.6	Very high	90.5	Very high	92 Å²	92	59 Å²	59	56%	0.564	33%	0.327	S	S	*	.			trans	-86.9	122.7	-178.4	-51.4	0	0	0	0	110.4	W558	T556-W558 HydrophobicContact CG2-CD2 4.33Å; T556-W558 HydrophobicContact CG2-CZ2 4.25Å; T556-W558 PolarHBondContact O-N 3.46Å; T556-W558 PolarHBondContact O-NE1 2.77Å
557	N	92.3	Very high	90.1	Very high	35 Å²	35	61.7 Å²	61.7	19%	0.187	35%	0.346	C	S	.	.			trans	-85	107.1	171.4	179.9	-15.7	0	0	0	110.2	I376 Y377 C559 T560	I376-N557 HydrophobicContact CG2-CB 3.81Å; I376-N557 PolarHBondContact O-ND2 3.43Å; Y377-N557 VanDerWaalsContact CD1-OD1 3.25Å; Y377-N557 WeakPolarHBondContact CD1-OD1 3.32Å; N557-C559 PolarHBondContact O-N 2.03Å; N557-C559 WeakPolarHBondContact OD1-CA 3.34Å; N557-C559 WeakPolarHBondContact OD1-CB 2.94Å; N557-C559 PolarHBondContact OD1-N 3.17Å; N557-T560 HydrophobicContact CB-CG2 3.74Å; N557-T560 WeakPolarHBondContact O-CG2 3.44Å; N557-T560 PolarHBondContact O-OG1 2.02Å; N557-T560 PolarHBondContact OD1-N 2.87Å
558	W	90.7	Very high	90	Very high	131 Å²	131	61.8 Å²	61.8	50%	0.496	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-5.3	-179.7	-57.1	96.2	0	0	0	114.2	Y377 T556 K582 Y583	Y377-W558 VanDerWaalsContact OH-CD1 3.31Å; T556-W558 HydrophobicContact CG2-CD2 4.33Å; T556-W558 HydrophobicContact CG2-CZ2 4.25Å; T556-W558 PolarHBondContact O-N 3.46Å; T556-W558 PolarHBondContact O-NE1 2.77Å; W558-K582 HydrophobicContact CB-CB 4.28Å; W558-K582 HydrophobicContact CD2-CB 4.1Å; W558-K582 HydrophobicContact CD2-CG 4.17Å; W558-K582 HydrophobicContact CG-CB 3.8Å; W558-K582 HydrophobicContact CG-CG 4.4Å; W558-Y583 HydrophobicContact CB-CD1 3.68Å; W558-Y583 HydrophobicContact CB-CE1 4.28Å
559	C	91.1	Very high	90	Very high	12 Å²	12	61.8 Å²	61.8	8%	0.081	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	4.9	178.5	-62.1	0	0	0	0	113.4	Y377 N557 N563 G564 C570	Y377-C559 HydrophobicContact CD1-CB 3.97Å; Y377-C559 VanDerWaalsContact CD1-SG 3.58Å; Y377-C559 HydrophobicContact CE1-CB 4.28Å; N557-C559 PolarHBondContact O-N 2.03Å; N557-C559 WeakPolarHBondContact OD1-CA 3.34Å; N557-C559 WeakPolarHBondContact OD1-CB 2.94Å; N557-C559 PolarHBondContact OD1-N 3.17Å; C559-N563 CarbonylContact O-C 3.21Å; C559-N563 WeakPolarHBondContact O-CA 2.9Å; C559-N563 PolarHBondContact O-N 3.37Å; C559-G564 PolarHBondContact O-N 3.23Å; C559-C570 HydrophobicContact CB-CB 3.63Å; C559-C570 WeakPolarHBondContact CB-SG 3.4Å; C559-C570 WeakPolarHBondContact SG-CB 3.36Å; C559-C570 CovalentContact SG-SG 2.03Å; C559-C570 PolarHBondContact SG-SG 2.79Å
560	T	86.8	Confident	90.1	Very high	104 Å²	104	58.3 Å²	58.3	64%	0.638	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-43.9	-174.5	42.2	0	0	0	0	113.4	N557 K562	N557-T560 HydrophobicContact CB-CG2 3.74Å; N557-T560 WeakPolarHBondContact O-CG2 3.44Å; N557-T560 PolarHBondContact O-OG1 2.02Å; N557-T560 PolarHBondContact OD1-N 2.87Å; T560-K562 PolarHBondContact O-N 2.78Å
561	E	84.6	Confident	90.2	Very high	165 Å²	165	57.1 Å²	57.1	77%	0.771	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-79.9	113.6	179	-64.6	-164.1	168	0	0	111.2	N563 G564	E561-N563 PolarHBondContact O-N 3.4Å; E561-N563 VanDerWaalsContact O-N 3.09Å; E561-G564 PolarHBondContact O-N 3Å
562	K	84.3	Confident	90.3	Very high	195 Å²	195	54.8 Å²	54.8	85%	0.848	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	47.9	39.5	177.4	-63.3	-177.5	178.2	175.8	0	113.8	T560 G564 G565	T560-K562 PolarHBondContact O-N 2.78Å; K562-G564 VanDerWaalsContact C-N 3.25Å; K562-G564 PolarHBondContact O-N 2.7Å; K562-G565 PolarHBondContact O-N 2.82Å
563	N	86.7	Confident	90.4	Very high	55 Å²	55	53.5 Å²	53.5	29%	0.294	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	57.6	35.5	-178.6	-169.3	49.2	0	0	0	112.9	C559 E561 G565 C566 F568 C570	C559-N563 CarbonylContact O-C 3.21Å; C559-N563 WeakPolarHBondContact O-CA 2.9Å; C559-N563 PolarHBondContact O-N 3.37Å; E561-N563 PolarHBondContact O-N 3.4Å; E561-N563 VanDerWaalsContact O-N 3.09Å; N563-G565 PolarHBondContact O-N 2.59Å; N563-C566 PolarHBondContact ND2-O 3.28Å; N563-C566 VanDerWaalsContact O-CB 3.31Å; N563-C566 WeakPolarHBondContact O-CB 3.26Å; N563-C566 PolarHBondContact O-N 3.28Å; N563-C566 PolarHBondContact O-SG 2.95Å; N563-F568 PolarHBondContact ND2-O 2.85Å; N563-C570 WeakPolarHBondContact O-CB 3.27Å
564	G	83.4	Confident	90.6	Very high	7 Å²	7	52.5 Å²	52.5	7%	0.072	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	63.5	18.6	-175.2	0	0	0	0	0	114	C559 E561 K562 C566 Y583	C559-G564 PolarHBondContact O-N 3.23Å; E561-G564 PolarHBondContact O-N 3Å; K562-G564 VanDerWaalsContact C-N 3.25Å; K562-G564 PolarHBondContact O-N 2.7Å; G564-C566 PolarHBondContact O-N 3.1Å; G564-Y583 VanDerWaalsContact O-CE2 3.31Å; G564-Y583 WeakPolarHBondContact O-CE2 3.46Å; G564-Y583 PolarHBondContact O-OH 2.9Å
565	G	88.7	Confident	90.8	Very high	35 Å²	35	50 Å²	50	36%	0.361	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	77.6	0.9	-172.1	0	0	0	0	0	114.6	K562 N563	K562-G565 PolarHBondContact O-N 2.82Å; N563-G565 PolarHBondContact O-N 2.59Å
566	C	91.7	Very high	90.9	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.061	28%	0.281	C	S	.	.			trans	-77.4	134.7	-177.1	-53.8	0	0	0	0	112.4	N563 G564 F568 C570 C585	N563-C566 PolarHBondContact ND2-O 3.28Å; N563-C566 VanDerWaalsContact O-CB 3.31Å; N563-C566 WeakPolarHBondContact O-CB 3.26Å; N563-C566 PolarHBondContact O-N 3.28Å; N563-C566 PolarHBondContact O-SG 2.95Å; G564-C566 PolarHBondContact O-N 3.1Å; C566-F568 VanDerWaalsContact C-N 3.35Å; C566-F568 PolarHBondContact O-N 2.86Å; C566-C570 HydrophobicContact CB-CB 4.15Å; C566-C585 WeakPolarHBondContact CA-SG 3.33Å; C566-C585 HydrophobicContact CB-CB 3.58Å; C566-C585 WeakPolarHBondContact CB-SG 3.4Å; C566-C585 WeakPolarHBondContact SG-CA 3.14Å; C566-C585 WeakPolarHBondContact SG-CB 3.4Å; C566-C585 CovalentContact SG-SG 2.02Å; C566-C585 PolarHBondContact SG-SG 2.03Å
567	S	90.1	Very high	90.8	Very high	66 Å²	66	53 Å²	53	46%	0.462	28%	0.277	S	S	.	.	S	Bend	trans	-69.1	-31	177.3	59.1	0	0	0	0	113.5	Q598 C600	S567-Q598 PolarHBondContact N-O 3.43Å; S567-Q598 VanDerWaalsContact N-O 3.09Å; S567-Q598 PolarHBondContact OG-O 3.13Å; S567-C600 PolarHBondContact OG-N 2.84Å; S567-C600 PolarHBondContact OG-SG 2.88Å; S567-C600 VanDerWaalsContact OG-SG 3.34Å
568	F	91.9	Very high	90.7	Very high	32 Å²	32	60.7 Å²	60.7	14%	0.14	31%	0.309	C	S	.	.	S	Bend	trans	-116.5	-96.9	-178.4	-172.8	-114	0	0	0	112.4	K399 R400 K401 N563 C566 V586 P588	K399-F568 HydrophobicContact CB-CD2 4.32Å; K399-F568 HydrophobicContact CB-CE1 4.44Å; K399-F568 HydrophobicContact CB-CE2 3.66Å; K399-F568 HydrophobicContact CB-CZ 3.74Å; K399-F568 HydrophobicContact CD-CD2 3.91Å; K399-F568 HydrophobicContact CD-CE2 4.06Å; K399-F568 HydrophobicContact CD-CG 4.5Å; K399-F568 VanDerWaalsContact CD-O 3.27Å; K399-F568 WeakPolarHBondContact CD-O 3.29Å; K399-F568 WeakPolarHBondContact CE-O 3.41Å; K399-F568 HydrophobicContact CG-CD2 3.97Å; K399-F568 HydrophobicContact CG-CE2 3.6Å; K399-F568 HydrophobicContact CG-CZ 4.22Å; K399-F568 PolarHBondContact NZ-O 3.23Å; R400-F568 WeakPolarHBondContact O-CZ 3.49Å; K401-F568 HydrophobicContact CB-CE1 4.45Å; N563-F568 PolarHBondContact ND2-O 2.85Å; C566-F568 VanDerWaalsContact C-N 3.35Å; C566-F568 PolarHBondContact O-N 2.86Å; F568-V586 WeakPolarHBondContact CB-O 3.09Å; F568-V586 VanDerWaalsContact CD1-O 3.31Å; F568-V586 WeakPolarHBondContact CD1-O 3.46Å; F568-P588 HydrophobicContact CB-CG 4.33Å; F568-P588 HydrophobicContact CD1-CG 3.94Å; F568-P588 HydrophobicContact CD2-CG 3.77Å; F568-P588 HydrophobicContact CE1-CB 4.45Å; F568-P588 HydrophobicContact CE1-CG 4.12Å; F568-P588 HydrophobicContact CE2-CG 3.96Å; F568-P588 HydrophobicContact CG-CG 3.76Å; F568-P588 HydrophobicContact CZ-CB 4.44Å; F568-P588 HydrophobicContact CZ-CG 4.13Å
569	L	93.4	Very high	90.8	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.6	179.2	-74.5	171.3	0	0	0	110.7	V392 K399 K401 L571 C585 V586	V392-L569 HydrophobicContact CG1-CD1 4.34Å; K399-L569 HydrophobicContact CB-CD1 4.47Å; K399-L569 HydrophobicContact CB-CD2 3.7Å; K399-L569 HydrophobicContact CB-CG 4.03Å; K399-L569 HydrophobicContact CD-CD2 4.14Å; K399-L569 HydrophobicContact CD-CG 4.49Å; K401-L569 HydrophobicContact CB-CD1 4.29Å; L569-L571 HydrophobicContact CB-CD2 4.45Å; L569-L571 HydrophobicContact CB-CG 4.38Å; L569-C585 WeakPolarHBondContact O-CA 3.12Å; L569-V586 PolarHBondContact N-O 2.8Å; L569-V586 PolarHBondContact O-N 3.07Å
570	C	94.6	Very high	90.8	Very high	3 Å²	3	63 Å²	63	2%	0.02	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.5	170.3	-174.8	0	0	0	0	107.3	C559 N563 C566 Y583	C559-C570 HydrophobicContact CB-CB 3.63Å; C559-C570 WeakPolarHBondContact CB-SG 3.4Å; C559-C570 WeakPolarHBondContact SG-CB 3.36Å; C559-C570 CovalentContact SG-SG 2.03Å; C559-C570 PolarHBondContact SG-SG 2.79Å; N563-C570 WeakPolarHBondContact O-CB 3.27Å; C566-C570 HydrophobicContact CB-CB 4.15Å; C570-Y583 WeakPolarHBondContact SG-CD2 3.25Å
571	L	95.6	Very high	91.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.7	-175.9	-59.4	-177.3	0	0	0	110.1	N379 V392 L403 N440 L569 A573 Y583 S584 V586	N379-L571 WeakPolarHBondContact ND2-CD2 3.27Å; V392-L571 HydrophobicContact CG1-CD1 3.96Å; V392-L571 HydrophobicContact CG2-CD2 4.1Å; L403-L571 HydrophobicContact CD2-CD1 4.31Å; N440-L571 HydrophobicContact CB-CB 4.01Å; L569-L571 HydrophobicContact CB-CD2 4.45Å; L569-L571 HydrophobicContact CB-CG 4.38Å; L571-A573 PolarHBondContact O-N 3.37Å; L571-Y583 CarbonylContact O-C 3.49Å; L571-Y583 VanDerWaalsContact O-CA 3.3Å; L571-Y583 WeakPolarHBondContact O-CA 3.42Å; L571-Y583 WeakPolarHBondContact O-CB 3.43Å; L571-S584 PolarHBondContact N-O 3.23Å; L571-S584 PolarHBondContact O-N 3.31Å; L571-V586 HydrophobicContact CB-CG2 4.29Å; L571-V586 HydrophobicContact CD1-CB 4.26Å; L571-V586 HydrophobicContact CD1-CG2 3.86Å; L571-V586 HydrophobicContact CG-CG2 4.11Å
572	P	95.6	Very high	91.5	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.013	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	136.9	173.4	19	-26.2	0	0	0	110.5	Y377 M439 N440	Y377-P572 HydrophobicContact CD2-CB 4.16Å; Y377-P572 HydrophobicContact CD2-CG 3.74Å; Y377-P572 HydrophobicContact CE1-CB 4.37Å; Y377-P572 HydrophobicContact CE2-CB 3.6Å; Y377-P572 HydrophobicContact CE2-CG 3.71Å; Y377-P572 HydrophobicContact CG-CG 4.25Å; M439-P572 HydrophobicContact CB-CG 3.86Å; M439-P572 HydrophobicContact CE-CG 3.94Å; M439-P572 HydrophobicContact CG-CG 4.39Å; M439-P572 HydrophobicContact SD-CG 3.69Å; N440-P572 PolarHBondContact N-O 2.76Å
573	A	94.8	Very high	91.9	Very high	3 Å²	3	52.8 Å²	52.8	3%	0.025	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-96.5	147.7	176.5	0	0	0	0	0	110	L571 Q575 P581 K582	L571-A573 PolarHBondContact O-N 3.37Å; A573-Q575 PolarHBondContact O-N 3.19Å; A573-Q575 PolarHBondContact O-NE2 3.4Å; A573-P581 HydrophobicContact CB-CG 4.15Å; A573-P581 WeakPolarHBondContact CB-O 3.48Å; A573-K582 PolarHBondContact N-O 3.08Å; A573-K582 VanDerWaalsContact N-O 3.1Å
574	P	95.8	Very high	92.3	Very high	11 Å²	11	51.6 Å²	51.6	7%	0.071	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-64.3	126.8	-176.9	24.7	-33.1	0	0	0	111.5	F422 N440 D443 I576 S580	F422-P574 HydrophobicContact CD1-CB 3.93Å; F422-P574 HydrophobicContact CE1-CB 3.42Å; F422-P574 VanDerWaalsContact CE1-CB 3.42Å; F422-P574 HydrophobicContact CE2-CB 4.3Å; F422-P574 HydrophobicContact CZ-CB 3.63Å; N440-P574 WeakPolarHBondContact OD1-CD 3.01Å; D443-P574 HydrophobicContact CB-CG 4.3Å; P574-I576 VanDerWaalsContact C-N 3.33Å; P574-I576 HydrophobicContact CB-CG1 4.21Å; P574-I576 HydrophobicContact CG-CD1 4.45Å; P574-I576 PolarHBondContact O-N 3.2Å; P574-I576 VanDerWaalsContact O-N 3.07Å; P574-S580 WeakPolarHBondContact O-CB 3.2Å; P574-S580 PolarHBondContact O-OG 3.49Å
575	Q	94.2	Very high	92.8	Very high	49 Å²	49	51.8 Å²	51.8	23%	0.229	27%	0.272	C	S	.	.			trans	-84.4	74	179.6	-60	-53.4	-69.9	0	0	110.8	S420 A573 P581 K582	S420-Q575 WeakPolarHBondContact O-CG 3.16Å; S420-Q575 PolarHBondContact O-N 3.24Å; A573-Q575 PolarHBondContact O-N 3.19Å; A573-Q575 PolarHBondContact O-NE2 3.4Å; Q575-P581 PolarHBondContact NE2-O 2.01Å; Q575-K582 VanDerWaalsContact OE1-CD 3.3Å
576	I	91	Very high	93	Very high	104 Å²	104	50.7 Å²	50.7	53%	0.533	26%	0.258	S	S	.	.			trans	-77.6	-42.1	-179.3	-53.9	168	0	0	0	111	F422 D443 P574 S580	F422-I576 HydrophobicContact CZ-CG1 4.2Å; D443-I576 HydrophobicContact CB-CD1 4.28Å; D443-I576 VanDerWaalsContact OD2-CD1 3.23Å; D443-I576 WeakPolarHBondContact OD2-CD1 3.37Å; P574-I576 VanDerWaalsContact C-N 3.33Å; P574-I576 HydrophobicContact CB-CG1 4.21Å; P574-I576 HydrophobicContact CG-CD1 4.45Å; P574-I576 PolarHBondContact O-N 3.2Å; P574-I576 VanDerWaalsContact O-N 3.07Å; I576-S580 PolarHBondContact N-OG 2.82Å
577	N	90.5	Very high	93	Very high	90 Å²	90	50.4 Å²	50.4	48%	0.481	26%	0.256	S	S	.	.	S	Bend	trans	-139.6	171.2	178.5	66	46.9	0	0	0	110.9	H579 S580	N577-H579 PolarHBondContact O-N 3.43Å; N577-H579 VanDerWaalsContact OD1-C 3.3Å; N577-H579 VanDerWaalsContact OD1-CA 3.31Å; N577-H579 WeakPolarHBondContact OD1-CA 3.47Å; N577-H579 WeakPolarHBondContact OD1-CB 3.05Å; N577-H579 PolarHBondContact OD1-N 3.04Å; N577-S580 PolarHBondContact N-OG 2.83Å; N577-S580 VanDerWaalsContact N-OG 3.15Å; N577-S580 WeakPolarHBondContact O-CB 3.23Å; N577-S580 PolarHBondContact O-N 3.13Å; N577-S580 PolarHBondContact O-OG 3.01Å; N577-S580 PolarHBondContact OD1-N 2.86Å; N577-S580 PolarHBondContact OD1-OG 2.9Å
578	K	89.8	Confident	93	Very high	197 Å²	197	48.9 Å²	48.9	86%	0.857	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.2	-178.9	-169.1	175.3	178.7	-179.6	0	113.8
579	H	91.7	Very high	92.8	Very high	174 Å²	174	51.9 Å²	51.9	81%	0.806	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-2.4	-179.8	-56.1	97.8	0	0	0	113.2	N577	N577-H579 PolarHBondContact O-N 3.43Å; N577-H579 VanDerWaalsContact OD1-C 3.3Å; N577-H579 VanDerWaalsContact OD1-CA 3.31Å; N577-H579 WeakPolarHBondContact OD1-CA 3.47Å; N577-H579 WeakPolarHBondContact OD1-CB 3.05Å; N577-H579 PolarHBondContact OD1-N 3.04Å
580	S	92.5	Very high	92.3	Very high	17 Å²	17	53.9 Å²	53.9	12%	0.119	30%	0.298	C	S	.	.	S	Bend	trans	-59.2	136.5	176.5	-71.9	0	0	0	0	110.1	P574 I576 N577	P574-S580 WeakPolarHBondContact O-CB 3.2Å; P574-S580 PolarHBondContact O-OG 3.49Å; I576-S580 PolarHBondContact N-OG 2.82Å; N577-S580 PolarHBondContact N-OG 2.83Å; N577-S580 VanDerWaalsContact N-OG 3.15Å; N577-S580 WeakPolarHBondContact O-CB 3.23Å; N577-S580 PolarHBondContact O-N 3.13Å; N577-S580 PolarHBondContact O-OG 3.01Å; N577-S580 PolarHBondContact OD1-N 2.86Å; N577-S580 PolarHBondContact OD1-OG 2.9Å
581	P	92.6	Very high	92.1	Very high	83 Å²	83	57.4 Å²	57.4	54%	0.539	31%	0.314	S	S	.	.			trans	-60.5	147.8	173.8	27.3	-33.8	0	0	0	109.5	A573 Q575	A573-P581 HydrophobicContact CB-CG 4.15Å; A573-P581 WeakPolarHBondContact CB-O 3.48Å; Q575-P581 PolarHBondContact NE2-O 2.01Å
582	K	92.3	Very high	91.8	Very high	89 Å²	89	61.5 Å²	61.5	39%	0.387	33%	0.333	S	S	.	.	S	Bend	trans	-76.1	-33.6	-179.8	-61.2	-55.7	179.7	-172.7	0	112.9	W558 A573 Q575	W558-K582 HydrophobicContact CB-CB 4.28Å; W558-K582 HydrophobicContact CD2-CB 4.1Å; W558-K582 HydrophobicContact CD2-CG 4.17Å; W558-K582 HydrophobicContact CG-CB 3.8Å; W558-K582 HydrophobicContact CG-CG 4.4Å; A573-K582 PolarHBondContact N-O 3.08Å; A573-K582 VanDerWaalsContact N-O 3.1Å; Q575-K582 VanDerWaalsContact OE1-CD 3.3Å
583	Y	94.1	Very high	91.5	Very high	78 Å²	78	64.6 Å²	64.6	31%	0.306	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	166.9	178.1	66.7	-89.3	0	0	0	109.7	W558 G564 C570 L571	W558-Y583 HydrophobicContact CB-CD1 3.68Å; W558-Y583 HydrophobicContact CB-CE1 4.28Å; G564-Y583 VanDerWaalsContact O-CE2 3.31Å; G564-Y583 WeakPolarHBondContact O-CE2 3.46Å; G564-Y583 PolarHBondContact O-OH 2.9Å; C570-Y583 WeakPolarHBondContact SG-CD2 3.25Å; L571-Y583 CarbonylContact O-C 3.49Å; L571-Y583 VanDerWaalsContact O-CA 3.3Å; L571-Y583 WeakPolarHBondContact O-CA 3.42Å; L571-Y583 WeakPolarHBondContact O-CB 3.43Å
584	S	93.8	Very high	91.2	Very high	29 Å²	29	65.5 Å²	65.5	20%	0.203	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	148.2	173.1	59.7	0	0	0	0	110.8	N440 L571	N440-S584 WeakPolarHBondContact CB-OG 3.48Å; N440-S584 PolarHBondContact ND2-OG 2.94Å; L571-S584 PolarHBondContact N-O 3.23Å; L571-S584 PolarHBondContact O-N 3.31Å
585	C	93.6	Very high	90.6	Very high	11 Å²	11	70.2 Å²	70.2	7%	0.074	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	136.7	176	-59	0	0	0	0	110.5	C566 L569 L593 G597	C566-C585 WeakPolarHBondContact CA-SG 3.33Å; C566-C585 HydrophobicContact CB-CB 3.58Å; C566-C585 WeakPolarHBondContact CB-SG 3.4Å; C566-C585 WeakPolarHBondContact SG-CA 3.14Å; C566-C585 WeakPolarHBondContact SG-CB 3.4Å; C566-C585 CovalentContact SG-SG 2.02Å; C566-C585 PolarHBondContact SG-SG 2.03Å; L569-C585 WeakPolarHBondContact O-CA 3.12Å; C585-L593 HydrophobicContact CB-CD1 3.83Å; C585-G597 WeakPolarHBondContact CB-O 3.28Å; C585-G597 PolarHBondContact SG-O 2.79Å; C585-G597 VanDerWaalsContact SG-O 3.37Å
586	V	92.9	Very high	90.2	Very high	12 Å²	12	71.5 Å²	71.5	7%	0.073	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.2	-175.2	-171.5	0	0	0	0	109.6	K401 N440 F568 L569 L571	K401-V586 HydrophobicContact CD-CB 4.48Å; K401-V586 HydrophobicContact CD-CG1 3.18Å; N440-V586 HydrophobicContact CB-CG2 4.31Å; F568-V586 WeakPolarHBondContact CB-O 3.09Å; F568-V586 VanDerWaalsContact CD1-O 3.31Å; F568-V586 WeakPolarHBondContact CD1-O 3.46Å; L569-V586 PolarHBondContact N-O 2.8Å; L569-V586 PolarHBondContact O-N 3.07Å; L571-V586 HydrophobicContact CB-CG2 4.29Å; L571-V586 HydrophobicContact CD1-CB 4.26Å; L571-V586 HydrophobicContact CD1-CG2 3.86Å; L571-V586 HydrophobicContact CG-CG2 4.11Å
587	C	92.4	Very high	89.9	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.02	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-100.4	156.5	-173.5	-68.1	0	0	0	0	114.2	K401 Q591 C600	K401-C587 VanDerWaalsContact CD-O 3.26Å; K401-C587 WeakPolarHBondContact CD-O 3.29Å; K401-C587 WeakPolarHBondContact CE-O 3.26Å; K401-C587 PolarHBondContact NZ-O 2.85Å; C587-Q591 HydrophobicContact CB-CB 4.18Å; C587-C600 WeakPolarHBondContact CA-SG 3.1Å; C587-C600 HydrophobicContact CB-CB 3.69Å; C587-C600 WeakPolarHBondContact CB-SG 3.5Å; C587-C600 WeakPolarHBondContact SG-CA 3.4Å; C587-C600 WeakPolarHBondContact SG-CB 3.16Å; C587-C600 CovalentContact SG-SG 2.03Å; C587-C600 PolarHBondContact SG-SG 2.89Å
588	P	91	Very high	89.7	Confident	34 Å²	34	67.9 Å²	67.9	22%	0.221	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-58.1	166.3	174.9	-19.8	31.3	0	0	0	113.1	F568 G590 Q591	F568-P588 HydrophobicContact CB-CG 4.33Å; F568-P588 HydrophobicContact CD1-CG 3.94Å; F568-P588 HydrophobicContact CD2-CG 3.77Å; F568-P588 HydrophobicContact CE1-CB 4.45Å; F568-P588 HydrophobicContact CE1-CG 4.12Å; F568-P588 HydrophobicContact CE2-CG 3.96Å; F568-P588 HydrophobicContact CG-CG 3.76Å; F568-P588 HydrophobicContact CZ-CB 4.44Å; F568-P588 HydrophobicContact CZ-CG 4.13Å; P588-G590 PolarHBondContact O-N 3.01Å; P588-Q591 PolarHBondContact O-N 3.05Å
589	A	85.9	Confident	89.7	Confident	95 Å²	95	66.7 Å²	66.7	79%	0.785	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	135.3	174.4	0	0	0	0	0	111.6	Q591	A589-Q591 VanDerWaalsContact C-N 3.31Å
590	G	84.1	Confident	89.7	Confident	48 Å²	48	59.8 Å²	59.8	50%	0.495	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	11.8	-177.3	0	0	0	0	0	115	P588 E603	P588-G590 PolarHBondContact O-N 3.01Å; G590-E603 PolarHBondContact O-N 3.38Å
591	Q	90.4	Very high	89.5	Confident	76 Å²	76	65 Å²	65	36%	0.355	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.5	173.1	-63.4	-171.8	6	0	0	110.9	C587 P588 A589 C600 R601	C587-Q591 HydrophobicContact CB-CB 4.18Å; P588-Q591 PolarHBondContact O-N 3.05Å; A589-Q591 VanDerWaalsContact C-N 3.31Å; Q591-C600 HydrophobicContact CB-CB 4.27Å; Q591-R601 CarbonylContact C-O 3.5Å; Q591-R601 VanDerWaalsContact CA-O 3.25Å; Q591-R601 WeakPolarHBondContact CA-O 3.43Å; Q591-R601 WeakPolarHBondContact CB-O 3.41Å
592	E	88.5	Confident	89.1	Confident	87 Å²	87	65.9 Å²	65.9	41%	0.407	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	155.5	174.3	-72.6	-179.9	178	0	0	111.4	C600 R601 E603	E592-C600 WeakPolarHBondContact O-CA 3.47Å; E592-R601 HydrophobicContact CB-CG 4.31Å; E592-R601 PolarHBondContact N-O 3.18Å; E592-R601 PolarHBondContact O-N 2.99Å; E592-R601 IonicContact OE2-CZ 3.84Å; E592-R601 IonicContact OE2-NE 3.73Å; E592-R601 IonicContact OE2-NH2 3.06Å; E592-R601 PolarHBondContact OE2-NH2 2.93Å; E592-E603 HydrophobicContact CG-CG 3.78Å
593	L	89.6	Confident	88.2	Confident	67 Å²	67	66.6 Å²	66.6	35%	0.351	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.8	169.6	-165.7	67.6	0	0	0	109.5	C585	C585-L593 HydrophobicContact CB-CD1 3.83Å
594	A	88.1	Confident	86.7	Confident	22 Å²	22	67.1 Å²	67.1	18%	0.182	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70.4	165.8	176	0	0	0	0	0	111.2	D596 G597 R599	A594-D596 WeakPolarHBondContact CB-OD1 3.34Å; A594-D596 PolarHBondContact O-N 2.9Å; A594-D596 VanDerWaalsContact O-N 3.07Å; A594-G597 PolarHBondContact O-N 2.84Å; A594-R599 HydrophobicContact CB-CB 4.26Å; A594-R599 VanDerWaalsContact CB-O 3.27Å; A594-R599 WeakPolarHBondContact CB-O 3.46Å; A594-R599 PolarHBondContact N-O 3.26Å
595	A	84.8	Confident	84.4	Confident	110 Å²	110	72.9 Å²	72.9	91%	0.909	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.6	-179.3	0	0	0	0	0	114	G597	A595-G597 PolarHBondContact O-N 3.33Å
596	D	85.1	Confident	82.2	Confident	76 Å²	76	78.3 Å²	78.3	41%	0.406	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-8.4	172.8	64.7	8.6	0	0	0	113.4	A594 Q598 R599	A594-D596 WeakPolarHBondContact CB-OD1 3.34Å; A594-D596 PolarHBondContact O-N 2.9Å; A594-D596 VanDerWaalsContact O-N 3.07Å; D596-Q598 PolarHBondContact O-N 3.19Å; D596-Q598 PolarHBondContact OD1-N 3.44Å; D596-R599 PolarHBondContact OD1-N 3.34Å; D596-R599 WeakPolarHBondContact OD2-CB 3.08Å; D596-R599 WeakPolarHBondContact OD2-CD 3.34Å; D596-R599 WeakPolarHBondContact OD2-CG 3.18Å; D596-R599 IonicContact OD2-NE 3.74Å
597	G	83.8	Confident	79.6	Confident	33 Å²	33	82.3 Å²	82.3	34%	0.34	49%	0.49	S	S	.	.	S	Bend	trans	69.8	10.3	-179	0	0	0	0	0	114.3	C585 A594 A595	C585-G597 WeakPolarHBondContact CB-O 3.28Å; C585-G597 PolarHBondContact SG-O 2.79Å; C585-G597 VanDerWaalsContact SG-O 3.37Å; A594-G597 PolarHBondContact O-N 2.84Å; A595-G597 PolarHBondContact O-N 3.33Å
598	Q	86.9	Confident	77.1	Confident	85 Å²	85	87.8 Å²	87.8	40%	0.397	52%	0.524	S	S	.	.	S	Bend	trans	-131.5	-38.6	-171.6	-71.9	-176	1.4	0	0	114.1	S567 D596	S567-Q598 PolarHBondContact N-O 3.43Å; S567-Q598 VanDerWaalsContact N-O 3.09Å; S567-Q598 PolarHBondContact OG-O 3.13Å; D596-Q598 PolarHBondContact O-N 3.19Å; D596-Q598 PolarHBondContact OD1-N 3.44Å
599	R	90.3	Very high	74.4	Confident	171 Å²	171	90.8 Å²	90.8	65%	0.645	55%	0.545	S	S	*	.			trans	-97	152.3	-175.9	-65.3	179.3	-174.8	169.4	1.9	111.5	A594 D596	A594-R599 HydrophobicContact CB-CB 4.26Å; A594-R599 VanDerWaalsContact CB-O 3.27Å; A594-R599 WeakPolarHBondContact CB-O 3.46Å; A594-R599 PolarHBondContact N-O 3.26Å; D596-R599 PolarHBondContact OD1-N 3.34Å; D596-R599 WeakPolarHBondContact OD2-CB 3.08Å; D596-R599 WeakPolarHBondContact OD2-CD 3.34Å; D596-R599 WeakPolarHBondContact OD2-CG 3.18Å; D596-R599 IonicContact OD2-NE 3.74Å
600	C	90.6	Very high	72.2	Confident	29 Å²	29	92.9 Å²	92.9	20%	0.196	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.7	175.5	-56.7	0	0	0	0	111	S567 C587 Q591 E592	S567-C600 PolarHBondContact OG-N 2.84Å; S567-C600 PolarHBondContact OG-SG 2.88Å; S567-C600 VanDerWaalsContact OG-SG 3.34Å; C587-C600 WeakPolarHBondContact CA-SG 3.1Å; C587-C600 HydrophobicContact CB-CB 3.69Å; C587-C600 WeakPolarHBondContact CB-SG 3.5Å; C587-C600 WeakPolarHBondContact SG-CA 3.4Å; C587-C600 WeakPolarHBondContact SG-CB 3.16Å; C587-C600 CovalentContact SG-SG 2.03Å; C587-C600 PolarHBondContact SG-SG 2.89Å; Q591-C600 HydrophobicContact CB-CB 4.27Å; E592-C600 WeakPolarHBondContact O-CA 3.47Å
601	R	88.9	Confident	69.7	Low	127 Å²	127	99.1 Å²	99.1	48%	0.479	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	144.9	175.2	64	179.5	-173.1	-179	4.5	109.7	Q591 E592	Q591-R601 CarbonylContact C-O 3.5Å; Q591-R601 VanDerWaalsContact CA-O 3.25Å; Q591-R601 WeakPolarHBondContact CA-O 3.43Å; Q591-R601 WeakPolarHBondContact CB-O 3.41Å; E592-R601 HydrophobicContact CB-CG 4.31Å; E592-R601 PolarHBondContact N-O 3.18Å; E592-R601 PolarHBondContact O-N 2.99Å; E592-R601 IonicContact OE2-CZ 3.84Å; E592-R601 IonicContact OE2-NE 3.73Å; E592-R601 IonicContact OE2-NH2 3.06Å; E592-R601 PolarHBondContact OE2-NH2 2.93Å
602	P	84.9	Confident	67.1	Low	101 Å²	101	101.3 Å²	101.3	66%	0.656	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-60.3	143.3	170.8	25.2	-31.5	0	0	0	110.2	A604	P602-A604 PolarHBondContact O-N 3.18Å
603	E	73.6	Confident	64.3	Low	105 Å²	105	104.3 Å²	104.3	49%	0.491	60%	0.595	S	S	.	*			trans	-55.6	127	172.2	-79.7	172.5	-166.5	0	0	109.4	G590 E592 N605	G590-E603 PolarHBondContact O-N 3.38Å; E592-E603 HydrophobicContact CG-CG 3.78Å; E603-N605 PolarHBondContact O-N 3.47Å; E603-N605 VanDerWaalsContact O-N 3.07Å
604	A	62.5	Low	61.8	Low	88 Å²	88	105.9 Å²	105.9	73%	0.727	61%	0.612	S	S	*	*			trans	-70.4	107.3	175.1	0	0	0	0	0	107.8	P602 V606	P602-A604 PolarHBondContact O-N 3.18Å; A604-V606 PolarHBondContact O-N 2.99Å
605	N	45.5	Very low	59.3	Low	150 Å²	150	110.3 Å²	110.3	80%	0.802	64%	0.637	S	S	*	*			trans	-55.4	101.4	169.8	-83.3	-18.2	0	0	0	108.9	E603 S607	E603-N605 PolarHBondContact O-N 3.47Å; E603-N605 VanDerWaalsContact O-N 3.07Å; N605-S607 PolarHBondContact O-N 2.85Å
606	V	45.8	Very low	56.8	Low	126 Å²	126	111.9 Å²	111.9	76%	0.764	64%	0.635	S	S	*	*			trans	-71.1	79.7	165	-175.4	0	0	0	0	106.6	A604 T608	A604-V606 PolarHBondContact O-N 2.99Å; V606-T608 HydrophobicContact CG1-CG2 4.17Å; V606-T608 PolarHBondContact O-N 3.34Å
607	S	38.8	Very low	54.5	Low	95 Å²	95	120.8 Å²	120.8	66%	0.664	66%	0.663	S	S	*	*			trans	-72.3	100.6	159.1	46.3	0	0	0	0	106.3	N605 S609	N605-S607 PolarHBondContact O-N 2.85Å; S607-S609 PolarHBondContact O-N 2.83Å
608	T	41.1	Very low	52.2	Low	118 Å²	118	122.5 Å²	122.5	72%	0.724	68%	0.681	S	S	*	*			trans	-64.5	79.6	168	37.6	0	0	0	0	109.3	V606 I610	V606-T608 HydrophobicContact CG1-CG2 4.17Å; V606-T608 PolarHBondContact O-N 3.34Å; T608-I610 VanDerWaalsContact C-N 3.31Å; T608-I610 PolarHBondContact O-N 2.93Å
609	S	34	Very low	50.4	Low	97 Å²	97	124.5 Å²	124.5	68%	0.678	71%	0.705	S	S	*	*			trans	-81.1	86.7	157.4	52.5	0	0	0	0	107.6	S607 Q611	S607-S609 PolarHBondContact O-N 2.83Å; S609-Q611 VanDerWaalsContact C-N 3.29Å; S609-Q611 PolarHBondContact O-N 3.27Å
610	I	38.5	Very low	48.3	Very low	140 Å²	140	121.1 Å²	121.1	72%	0.718	71%	0.714	S	S	*	*			trans	-66.8	97.2	163.7	-61.1	174.7	0	0	0	105.9	T608 V612	T608-I610 VanDerWaalsContact C-N 3.31Å; T608-I610 PolarHBondContact O-N 2.93Å; I610-V612 HydrophobicContact CG2-CG2 4.05Å; I610-V612 PolarHBondContact O-N 2.04Å; I610-V612 VanDerWaalsContact O-N 3.1Å
611	Q	32.6	Very low	46.3	Very low	179 Å²	179	124.1 Å²	124.1	84%	0.836	74%	0.74	S	S	*	*			trans	-67.2	102	162.5	-75.9	-102.6	-50.3	0	0	107	S609 D613	S609-Q611 VanDerWaalsContact C-N 3.29Å; S609-Q611 PolarHBondContact O-N 3.27Å; Q611-D613 PolarHBondContact O-N 3.19Å
612	V	36.3	Very low	44.2	Very low	122 Å²	122	121.7 Å²	121.7	74%	0.739	75%	0.747	S	S	*	*			trans	-74.5	101.1	169.1	178.3	0	0	0	0	107	I610 S614	I610-V612 HydrophobicContact CG2-CG2 4.05Å; I610-V612 PolarHBondContact O-N 2.04Å; I610-V612 VanDerWaalsContact O-N 3.1Å; V612-S614 PolarHBondContact O-N 3.19Å
613	D	29.3	Very low	42.4	Very low	149 Å²	149	128 Å²	128	80%	0.797	76%	0.758	S	S	*	*			trans	-84	105.3	172.4	-140.9	-8.6	0	0	0	109	Q611 T615	Q611-D613 PolarHBondContact O-N 3.19Å; D613-T615 PolarHBondContact O-N 3.27Å
614	S	36.1	Very low	41.5	Very low	101 Å²	101	126.4 Å²	126.4	71%	0.706	76%	0.763	S	S	*	*			trans	-89.8	93.9	-178.7	62.5	0	0	0	0	110.5	V612	V612-S614 PolarHBondContact O-N 3.19Å
615	T	35.8	Very low	41.2	Very low	115 Å²	115	126.4 Å²	126.4	71%	0.706	75%	0.754	S	S	*	*			trans	-158.1	104.1	159.8	31.2	0	0	0	0	111.7	D613	D613-T615 PolarHBondContact O-N 3.27Å
616	T	32.5	Very low	41.7	Very low	142 Å²	142	124.9 Å²	124.9	87%	0.871	75%	0.745	S	S	*	*				163.7	115.4	119.6	38.4	0	0	0	0	110.6
617	R	37.7	Very low	42.4	Very low	263 Å²	263	122.2 Å²	122.2	99%	0.992	73%	0.73	S	S	*	*			trans	-66.7	126	160.7	-95.9	173.6	166.2	171.4	-5.1	108.2
618	G	34.2	Very low	43.9	Very low	70 Å²	70	122.3 Å²	122.3	72%	0.722	73%	0.727	S	S	*	*			trans	-173.8	89.5	172.6	0	0	0	0	0	111.4	A620	G618-A620 PolarHBondContact O-N 2.86Å
619	S	49.4	Very low	45.2	Very low	126 Å²	126	121.7 Å²	121.7	88%	0.881	72%	0.718	S	S	*	*			trans	-37.2	110.5	171.9	39.7	0	0	0	0	115.7
620	A	46.3	Very low	46.9	Very low	101 Å²	101	122.3 Å²	122.3	84%	0.835	71%	0.713	S	S	*	*			trans	-179.6	57.1	149.8	0	0	0	0	0	112.4	G618	G618-A620 PolarHBondContact O-N 2.86Å
621	A	47.5	Very low	48.7	Very low	91 Å²	91	121.8 Å²	121.8	75%	0.752	71%	0.711	S	S	*	*			trans	-119	38.3	-178.9	0	0	0	0	0	113.8
622	A	46.8	Very low	50.9	Low	76 Å²	76	116 Å²	116	63%	0.628	69%	0.694	S	S	*	*	S	Bend	trans	-106.7	-4.8	177.2	0	0	0	0	0	114.5
623	W	46.7	Very low	53	Low	233 Å²	233	116.2 Å²	116.2	88%	0.883	69%	0.689	S	S	*	*	S	Bend	trans	-115	-0.6	-175.1	-69.7	86.8	0	0	0	115.1
624	A	54.4	Low	55.6	Low	72 Å²	72	112 Å²	112	60%	0.595	68%	0.675	S	S	*	*	S	Bend	trans	-103.7	-7.6	-178	0	0	0	0	0	115
625	V	56.4	Low	57.9	Low	88 Å²	88	110.2 Å²	110.2	53%	0.533	67%	0.666	S	S	.	*	H	α-helix	trans	-89.1	-27.6	-174.8	-172.6	0	0	0	0	112.3	L629	V625-L629 HydrophobicContact CG1-CD1 4.04Å; V625-L629 PolarHBondContact O-N 2.87Å
626	L	54.9	Low	60.2	Low	118 Å²	118	107.2 Å²	107.2	62%	0.618	65%	0.653	S	S	*	*	H	α-helix	trans	-65	-42.6	179.6	-94.8	148.6	0	0	0	114.6	L630	L626-L630 PolarHBondContact O-N 2.75Å
627	P	60.4	Low	62.7	Low	70 Å²	70	102 Å²	102	46%	0.455	63%	0.627	S	S	.	*	H	α-helix	trans	-68.9	-34.5	178.5	-17.9	30.8	0	0	0	113	L630 L631	P627-L630 PolarHBondContact O-N 3.35Å; P627-L631 PolarHBondContact O-N 2.99Å
628	V	70.5	Confident	64.9	Low	98 Å²	98	92.4 Å²	92.4	59%	0.594	61%	0.605	S	S	*	*	H	α-helix	trans	-72.1	-38.9	-178.6	-179.4	0	0	0	0	111.1	L631 A632	V628-L631 PolarHBondContact O-N 3.32Å; V628-A632 WeakPolarHBondContact O-CB 3.37Å; V628-A632 PolarHBondContact O-N 2.83Å
629	L	68.2	Low	67.3	Low	104 Å²	104	95.7 Å²	95.7	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-65.1	-38.8	172.8	-94.9	160	0	0	0	112.5	V625 A632 M633	V625-L629 HydrophobicContact CG1-CD1 4.04Å; V625-L629 PolarHBondContact O-N 2.87Å; L629-A632 PolarHBondContact O-N 2.74Å; L629-M633 WeakPolarHBondContact O-CG 3.45Å; L629-M633 PolarHBondContact O-N 2.87Å
630	L	70.5	Confident	68.8	Low	110 Å²	110	94.8 Å²	94.8	58%	0.576	58%	0.581	S	S	*	*	H	α-helix	trans	-67	-39.6	176.1	-80.9	164.8	0	0	0	112.3	L626 P627 M633 A634	L626-L630 PolarHBondContact O-N 2.75Å; P627-L630 PolarHBondContact O-N 3.35Å; L630-M633 PolarHBondContact O-N 2.66Å; L630-A634 WeakPolarHBondContact O-CB 3.26Å; L630-A634 PolarHBondContact O-N 3.42Å
631	L	76.3	Confident	70.5	Confident	129 Å²	129	97.2 Å²	97.2	68%	0.675	58%	0.577	S	S	*	*	H	α-helix	trans	-65	-40.9	173.9	-90.4	158.8	0	0	0	112.3	P627 V628 A634 A635	P627-L631 PolarHBondContact O-N 2.99Å; V628-L631 PolarHBondContact O-N 3.32Å; L631-A634 PolarHBondContact O-N 2.81Å; L631-A635 WeakPolarHBondContact O-CB 3.43Å; L631-A635 PolarHBondContact O-N 2.78Å
632	A	78.3	Confident	72.1	Confident	58 Å²	58	99.8 Å²	99.8	48%	0.479	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-40.6	176.3	0	0	0	0	0	112.2	V628 L629 A635 A636	V628-A632 WeakPolarHBondContact O-CB 3.37Å; V628-A632 PolarHBondContact O-N 2.83Å; L629-A632 PolarHBondContact O-N 2.74Å; A632-A635 PolarHBondContact O-N 2.04Å; A632-A636 WeakPolarHBondContact O-CB 3.33Å; A632-A636 PolarHBondContact O-N 2.87Å
633	M	80.9	Confident	73.7	Confident	126 Å²	126	102.8 Å²	102.8	62%	0.621	56%	0.562	S	S	*	*	H	α-helix	trans	-68.4	-36.6	175.7	-72.5	-151.5	-70.5	0	0	112.6	L629 L630 A636 G637	L629-M633 WeakPolarHBondContact O-CG 3.45Å; L629-M633 PolarHBondContact O-N 2.87Å; L630-M633 PolarHBondContact O-N 2.66Å; M633-A636 PolarHBondContact O-N 3.02Å; M633-G637 PolarHBondContact O-N 3.42Å
634	A	83.3	Confident	75	Confident	62 Å²	62	97 Å²	97	51%	0.512	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-41.6	174.2	0	0	0	0	0	112	L630 L631 G637 A638	L630-A634 WeakPolarHBondContact O-CB 3.26Å; L630-A634 PolarHBondContact O-N 3.42Å; L631-A634 PolarHBondContact O-N 2.81Å; A634-G637 PolarHBondContact O-N 3.29Å; A634-A638 PolarHBondContact O-N 3.22Å
635	A	84.1	Confident	76	Confident	63 Å²	63	100.8 Å²	100.8	52%	0.521	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-41.1	176.3	0	0	0	0	0	112.3	L631 A632 A638 Y639	L631-A635 WeakPolarHBondContact O-CB 3.43Å; L631-A635 PolarHBondContact O-N 2.78Å; A632-A635 PolarHBondContact O-N 2.04Å; A635-A638 PolarHBondContact O-N 3.35Å; A635-Y639 PolarHBondContact O-N 3.42Å
636	A	84.5	Confident	76.6	Confident	52 Å²	52	101.3 Å²	101.3	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-64	-39.9	174.6	0	0	0	0	0	112.1	A632 M633 Y639 L640	A632-A636 WeakPolarHBondContact O-CB 3.33Å; A632-A636 PolarHBondContact O-N 2.87Å; M633-A636 PolarHBondContact O-N 3.02Å; A636-Y639 PolarHBondContact O-N 3.26Å; A636-L640 WeakPolarHBondContact O-CG 3.44Å; A636-L640 PolarHBondContact O-N 3.45Å
637	G	85.9	Confident	77.2	Confident	32 Å²	32	100.9 Å²	100.9	33%	0.33	54%	0.542	S	S	.	.	H	α-helix	trans	-62.4	-44.3	174.1	0	0	0	0	0	112.9	M633 A634 L640 M641	M633-G637 PolarHBondContact O-N 3.42Å; A634-G637 PolarHBondContact O-N 3.29Å; G637-L640 PolarHBondContact O-N 2.82Å; G637-M641 PolarHBondContact O-N 3.11Å
638	A	82.9	Confident	77.3	Confident	62 Å²	62	106.2 Å²	106.2	51%	0.512	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-41.2	176.8	0	0	0	0	0	112.2	A634 A635 M641 W642	A634-A638 PolarHBondContact O-N 3.22Å; A635-A638 PolarHBondContact O-N 3.35Å; A638-M641 PolarHBondContact O-N 3.49Å; A638-W642 WeakPolarHBondContact O-CB 3.15Å; A638-W642 PolarHBondContact O-N 2.99Å
639	Y	85.8	Confident	76.3	Confident	138 Å²	138	106.7 Å²	106.7	54%	0.541	56%	0.557	S	S	.	*	H	α-helix	trans	-63.4	-42.2	175.9	-179.1	-103.7	0	0	0	112.4	A635 A636 W642 R643	A635-Y639 PolarHBondContact O-N 3.42Å; A636-Y639 PolarHBondContact O-N 3.26Å; Y639-W642 HydrophobicContact CD2-CE3 4.36Å; Y639-W642 HydrophobicContact CE2-CE3 4.24Å; Y639-W642 HydrophobicContact CE2-CZ3 4.23Å; Y639-W642 PolarHBondContact O-N 3.28Å; Y639-R643 WeakPolarHBondContact O-CB 3.47Å; Y639-R643 PolarHBondContact O-N 2.95Å
640	L	80.9	Confident	75.3	Confident	108 Å²	108	108.9 Å²	108.9	57%	0.565	57%	0.565	S	S	*	*	H	α-helix	trans	-66	-39.7	176.4	-73.7	171	0	0	0	112	A636 G637 R643 N644	A636-L640 WeakPolarHBondContact O-CG 3.44Å; A636-L640 PolarHBondContact O-N 3.45Å; G637-L640 PolarHBondContact O-N 2.82Å; L640-R643 PolarHBondContact O-N 3.37Å; L640-N644 WeakPolarHBondContact O-CB 3.41Å; L640-N644 PolarHBondContact O-N 3.11Å
641	M	81	Confident	73.8	Confident	151 Å²	151	113 Å²	113	74%	0.744	58%	0.578	S	S	*	*	H	α-helix	trans	-64.4	-42.6	174.2	-75.8	-171.2	179.2	0	0	112.2	G637 A638 N644 W645	G637-M641 PolarHBondContact O-N 3.11Å; A638-M641 PolarHBondContact O-N 3.49Å; M641-N644 PolarHBondContact O-N 3.39Å; M641-W645 WeakPolarHBondContact O-CB 3.45Å; M641-W645 PolarHBondContact O-N 2.65Å
642	W	80.9	Confident	71.9	Confident	145 Å²	145	112.4 Å²	112.4	55%	0.549	58%	0.584	S	S	.	*	H	α-helix	trans	-62.5	-43.6	175.9	178.2	79.8	0	0	0	112.2	A638 Y639 N644 W645 Q646	A638-W642 WeakPolarHBondContact O-CB 3.15Å; A638-W642 PolarHBondContact O-N 2.99Å; Y639-W642 HydrophobicContact CD2-CE3 4.36Å; Y639-W642 HydrophobicContact CE2-CE3 4.24Å; Y639-W642 HydrophobicContact CE2-CZ3 4.23Å; Y639-W642 PolarHBondContact O-N 3.28Å; W642-N644 VanDerWaalsContact C-N 3.35Å; W642-N644 PolarHBondContact O-N 2.91Å; W642-W645 WeakPolarHBondContact O-CB 3.41Å; W642-W645 PolarHBondContact O-N 2.05Å; W642-Q646 HydrophobicContact CZ2-CG 4.31Å; W642-Q646 PolarHBondContact O-N 3.3Å
643	R	80	Confident	69.6	Low	139 Å²	139	118.8 Å²	118.8	53%	0.525	61%	0.606	S	S	.	*	H	α-helix	trans	-62.9	-40	175.5	-172.5	180	175.7	-171.4	-0.5	112.1	Y639 L640 W645 Q646 L647	Y639-R643 WeakPolarHBondContact O-CB 3.47Å; Y639-R643 PolarHBondContact O-N 2.95Å; L640-R643 PolarHBondContact O-N 3.37Å; R643-W645 VanDerWaalsContact C-N 3.34Å; R643-Q646 WeakPolarHBondContact O-CB 2.96Å; R643-Q646 PolarHBondContact O-N 2.91Å; R643-L647 WeakPolarHBondContact O-CG 2.88Å; R643-L647 PolarHBondContact O-N 2.73Å
644	N	75.8	Confident	67.4	Low	113 Å²	113	119.5 Å²	119.5	60%	0.604	61%	0.613	S	S	*	*	H	α-helix	trans	-71.3	-31.3	178.4	-136	10.9	0	0	0	112.1	L640 M641 W642 K648	L640-N644 WeakPolarHBondContact O-CB 3.41Å; L640-N644 PolarHBondContact O-N 3.11Å; M641-N644 PolarHBondContact O-N 3.39Å; W642-N644 VanDerWaalsContact C-N 3.35Å; W642-N644 PolarHBondContact O-N 2.91Å; N644-K648 PolarHBondContact O-N 2.99Å; N644-K648 VanDerWaalsContact O-N 3.14Å
645	W	74.3	Confident	64.9	Low	151 Å²	151	126.3 Å²	126.3	57%	0.572	63%	0.631	S	S	*	*	H	α-helix	trans	-67.2	-42.5	171.6	-179	83.8	0	0	0	112.1	M641 W642 R643 L647 K648 N649	M641-W645 WeakPolarHBondContact O-CB 3.45Å; M641-W645 PolarHBondContact O-N 2.65Å; W642-W645 WeakPolarHBondContact O-CB 3.41Å; W642-W645 PolarHBondContact O-N 2.05Å; R643-W645 VanDerWaalsContact C-N 3.34Å; W645-L647 PolarHBondContact O-N 3.24Å; W645-K648 PolarHBondContact O-N 2.01Å; W645-N649 VanDerWaalsContact CZ2-ND2 3.29Å; W645-N649 WeakPolarHBondContact CZ2-ND2 3Å; W645-N649 PolarHBondContact O-N 3.19Å
646	Q	68.5	Low	62.4	Low	99 Å²	99	130.6 Å²	130.6	46%	0.463	65%	0.645	S	S	.	*	H	α-helix	trans	-57.5	-46.6	171.8	-98.6	-91.2	-41.3	0	0	112.2	W642 R643 K648 N649 Q650	W642-Q646 HydrophobicContact CZ2-CG 4.31Å; W642-Q646 PolarHBondContact O-N 3.3Å; R643-Q646 WeakPolarHBondContact O-CB 2.96Å; R643-Q646 PolarHBondContact O-N 2.91Å; Q646-K648 VanDerWaalsContact C-N 3.31Å; Q646-K648 PolarHBondContact O-N 2.85Å; Q646-N649 PolarHBondContact O-N 3.48Å; Q646-Q650 PolarHBondContact O-N 3.03Å
647	L	67.6	Low	59.9	Low	108 Å²	108	134.8 Å²	134.8	57%	0.565	66%	0.661	S	S	*	*	H	α-helix	trans	-65.6	-30.2	178.7	-72.7	167.6	0	0	0	113.4	R643 W645	R643-L647 WeakPolarHBondContact O-CG 2.88Å; R643-L647 PolarHBondContact O-N 2.73Å; W645-L647 PolarHBondContact O-N 3.24Å
648	K	63.8	Low	57.6	Low	182 Å²	182	138.7 Å²	138.7	79%	0.791	68%	0.68	S	S	*	*	H	α-helix	trans	-76.6	-25.7	176.4	-109.7	-178.2	177.7	-178.1	0	113.7	N644 W645 Q646	N644-K648 PolarHBondContact O-N 2.99Å; N644-K648 VanDerWaalsContact O-N 3.14Å; W645-K648 PolarHBondContact O-N 2.01Å; Q646-K648 VanDerWaalsContact C-N 3.31Å; Q646-K648 PolarHBondContact O-N 2.85Å
649	N	49.1	Very low	55.1	Low	108 Å²	108	140.9 Å²	140.9	58%	0.578	69%	0.687	S	S	*	*	S	Bend	trans	-93.6	2.5	-179.3	-82	-3.4	0	0	0	113.9	W645 Q646 K651	W645-N649 VanDerWaalsContact CZ2-ND2 3.29Å; W645-N649 WeakPolarHBondContact CZ2-ND2 3Å; W645-N649 PolarHBondContact O-N 3.19Å; Q646-N649 PolarHBondContact O-N 3.48Å; N649-K651 PolarHBondContact O-N 3.04Å
650	Q	47.5	Very low	52.4	Low	150 Å²	150	144.3 Å²	144.3	70%	0.701	70%	0.7	S	S	*	*			trans	-96.9	66.7	175.5	-140	178.1	3.2	0	0	111	Q646	Q646-Q650 PolarHBondContact O-N 3.03Å
651	K	38.3	Very low	50.1	Low	198 Å²	198	148 Å²	148	86%	0.861	72%	0.719	S	S	*	*			trans	-139.4	96.8	160.3	-85.1	-165.3	177.4	-172.4	0	109.8	N649	N649-K651 PolarHBondContact O-N 3.04Å
652	S	35.4	Very low	47.7	Very low	115 Å²	115	149.6 Å²	149.6	80%	0.804	72%	0.722	S	S	*	*			trans	173.7	85.3	143	170.1	0	0	0	0	109.5
653	M	32	Very low	45.2	Very low	192 Å²	192	148.5 Å²	148.5	95%	0.946	73%	0.732	S	S	*	*			trans	-150.4	92.2	136.2	-84.9	-162.3	162.9	0	0	105.9
654	N	32.8	Very low	42.8	Very low	141 Å²	141	148.7 Å²	148.7	75%	0.754	75%	0.749	S	S	*	*			trans	-67.8	127	167.6	-89.2	-7.6	0	0	0	108.6
655	F	30.9	Very low	40.8	Very low	205 Å²	205	152.2 Å²	152.2	90%	0.899	76%	0.761	S	S	*	*			trans	-136.8	87.2	145.3	-97.2	-82.4	0	0	0	106.7
656	D	32.6	Very low	38.9	Very low	153 Å²	153	153.9 Å²	153.9	82%	0.818	78%	0.776	S	S	*	*			trans	-80.6	110.6	157.5	-81.1	-37.7	0	0	0	106.9
657	N	31	Very low	37.1	Very low	141 Å²	141	156.3 Å²	156.3	75%	0.754	79%	0.792	S	S	*	*			trans	-114.5	113.9	162.5	-169.6	14.9	0	0	0	106.7
658	P	38.6	Very low	35.3	Very low	114 Å²	114	159 Å²	159	74%	0.74	81%	0.806	S	S	*	*			trans	-103.4	113.7	178.8	33.8	-23.1	0	0	0	110.1
659	V	30.6	Very low	33.5	Very low	107 Å²	107	157.6 Å²	157.6	65%	0.648	81%	0.807	S	S	*	*			trans	-142.5	125.3	155.8	-158.9	0	0	0	0	110.6
660	Y	29.2	Very low	32.6	Very low	211 Å²	211	160.4 Å²	160.4	83%	0.827	82%	0.82	S	S	*	*			trans	84.5	94.3	171.4	-63.1	-69.7	0	0	0	118.5
661	L	32	Very low	31.6	Very low	184 Å²	184	159.5 Å²	159.5	96%	0.963	82%	0.82	S	S	*	*				-148	134.5	124	-98.7	163.6	0	0	0	109.6
662	K	30.5	Very low	31.2	Very low	185 Å²	185	156.1 Å²	156.1	80%	0.804	81%	0.81	S	S	*	*			trans	-78.8	153.6	-173.8	-105.9	174.5	173.7	173.9	0	112.1
663	T	28.1	Very low	30.8	Very low	122 Å²	122	156.1 Å²	156.1	75%	0.748	81%	0.805	S	S	*	*			trans	68	113.8	147.2	53.1	0	0	0	0	119.8
664	T	30.5	Very low	30.7	Very low	143 Å²	143	157.9 Å²	157.9	88%	0.877	80%	0.802	S	S	*	*				-173.9	140.6	99.3	24.8	0	0	0	0	110.6
665	E	34.1	Very low	30.5	Very low	187 Å²	187	160.6 Å²	160.6	87%	0.874	81%	0.809	S	S	*	*			trans	-64.3	143.2	171.7	-70	165.6	133.2	0	0	111.2
666	E	33.5	Very low	30.4	Very low	187 Å²	187	154.5 Å²	154.5	87%	0.874	80%	0.804	S	S	*	*				173.9	127	119	-95.3	-179.6	174.8	0	0	111
667	D	30.4	Very low	30.2	Very low	149 Å²	149	152.1 Å²	152.1	80%	0.797	81%	0.806	S	S	*	*			trans	-1.8	131.9	159.5	-63	-42.3	0	0	0	120.5
668	L	30.5	Very low	30.1	Very low	165 Å²	165	153 Å²	153	86%	0.864	81%	0.81	S	S	*	*				-171.8	108.3	117.2	-99.6	150.7	0	0	0	112.1
669	N	25.6	Very low	29.8	Very low	152 Å²	152	154.7 Å²	154.7	81%	0.813	82%	0.818	S	S	*	*			trans	-48.7	143.7	152.4	-93.2	-26.2	0	0	0	111.1
670	I	30.2	Very low	29.6	Very low	168 Å²	168	152.5 Å²	152.5	86%	0.862	82%	0.818	S	S	*	*				-164.6	139	124.1	-90.7	147.5	0	0	0	110.5
671	D	27.5	Very low	29.7	Very low	130 Å²	130	151 Å²	151	70%	0.695	82%	0.818	S	S	*	*			trans	-91.4	153.1	-167.4	-118.2	-14.7	0	0	0	114.1
672	I	29.8	Very low	29.5	Very low	128 Å²	128	147.1 Å²	147.1	66%	0.656	80%	0.802	S	S	*	*			trans	62.7	118.5	135.9	-49.4	162.4	0	0	0	119.4
673	T	27.2	Very low	29.6	Very low	114 Å²	114	148.8 Å²	148.8	70%	0.699	81%	0.805	S	S	*	*				172.1	128.6	103.5	32.8	0	0	0	0	116.8
674	R	28.3	Very low	30.1	Very low	230 Å²	230	148 Å²	148	87%	0.868	80%	0.801	S	S	*	*			trans	72.5	109.1	133.1	-73.9	-179.7	175.2	177.3	-0.3	122.5
675	H	30.1	Very low	30.1	Very low	198 Å²	198	146.1 Å²	146.1	92%	0.917	80%	0.801	S	S	*	*				12.3	133.9	121.3	-74.9	-12	0	0	0	120.4
676	G	28.1	Very low	29.9	Very low	77 Å²	77	144.2 Å²	144.2	79%	0.794	80%	0.795	S	S	*	*				158.1	113	128.9	0	0	0	0	0	117.5
677	A	29.5	Very low	29.7	Very low	102 Å²	102	140.6 Å²	140.6	84%	0.843	79%	0.791	S	S	*	*			trans	101.1	103	139.4	0	0	0	0	0	121.4
678	N	28.8	Very low	29.8	Very low	159 Å²	159	141 Å²	141	85%	0.85	79%	0.791	S	S	*	*			trans	17.5	141.1	130.6	-76.5	-15.7	0	0	0	122.9
679	V	31.1	Very low	29.7	Very low	150 Å²	150	139 Å²	139	91%	0.909	79%	0.785	S	S	*	*				151.3	136.6	126.3	176.8	0	0	0	0	106.5
680	G	27.3	Very low	30	Very low	62 Å²	62	137.4 Å²	137.4	64%	0.639	79%	0.786	S	S	*	*			cis	176.4	144.7	3.4	0	0	0	0	0	109.3
681	H	30.6	Very low	30.2	Very low	178 Å²	178	135.1 Å²	135.1	82%	0.824	78%	0.78	S	S	*	*			trans	32.1	127.5	151.7	-73.5	-61	0	0	0	126.2
682	T	28.9	Very low	30.8	Very low	103 Å²	103	136 Å²	136	63%	0.632	79%	0.785	S	S	*	*				76.9	130.7	125.7	57	0	0	0	0	122.4
683	Y	31.2	Very low	31.2	Very low	220 Å²	220	137.7 Å²	137.7	86%	0.863	80%	0.795	S	S	*	*				-175.8	168.7	117.6	-96.5	-57.5	0	0	0	111.4
684	P	38.6	Very low	32.1	Very low	105 Å²	105	139.3 Å²	139.3	68%	0.682	80%	0.8	S	S	*	*				-111.9	168.8	-129.9	40.9	-28.3	0	0	0	115.6
685	A	30.2	Very low	32.7	Very low	104 Å²	104	136.3 Å²	136.3	86%	0.86	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-89.7	129.6	168.6	0	0	0	0	0	111.2
686	I	31.2	Very low	33.2	Very low	147 Å²	147	135.6 Å²	135.6	75%	0.754	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-97.9	131.9	174.5	-72	170.1	0	0	0	108.8	I688	I686-I688 HydrophobicContact CG2-CG1 4.23Å
687	S	28.9	Very low	33.5	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.5	138.7	168.8	31.3	0	0	0	0	111.3
688	I	31.3	Very low	33.7	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	82%	0.817	S	S	*	*			trans	-136.5	126.2	162.6	-58.8	-180	0	0	0	109.7	I686	I686-I688 HydrophobicContact CG2-CG1 4.23Å
689	V	30.1	Very low	34	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	82%	0.815	S	S	*	*			trans	-71.5	146.6	173.3	172	0	0	0	0	110.4	T691	V689-T691 HydrophobicContact CG1-CG2 4.22Å
690	S	32	Very low	34.1	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	81%	0.809	S	S	*	*			trans	-125.9	120.4	162.7	172.5	0	0	0	0	108.3
691	T	32.8	Very low	34.6	Very low	120 Å²	120	143.6 Å²	143.6	74%	0.736	82%	0.82	S	S	*	*			trans	-89.7	153	178.4	41.3	0	0	0	0	111.2	V689	V689-T691 HydrophobicContact CG1-CG2 4.22Å
692	D	39.9	Very low	34.8	Very low	147 Å²	147	141.3 Å²	141.3	79%	0.786	82%	0.82	S	S	*	*			trans	-46.4	152.3	165.3	-61.4	-54.8	0	0	0	113.7
693	D	40	Very low	35.2	Very low	164 Å²	164	144 Å²	144	88%	0.877	83%	0.833	S	S	*	*				-165.2	140	119.8	-103.8	-26.2	0	0	0	113.2
694	D	45.6	Very low	35.6	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	83%	0.831	S	S	*	*			trans	-65	178.4	176.3	-88.3	-47.6	0	0	0	115.5
695	L	41.2	Very low	35.3	Very low	168 Å²	168	140.9 Å²	140.9	88%	0.88	84%	0.843	S	S	*	*			trans	111	128.3	155.4	-64.9	151	0	0	0	112.8
696	S	40.5	Very low	35.8	Very low	182 Å²	182	144.3 Å²	144.3	100%	1.273	84%	0.842	S	S	*	*			cis	-167.9	0	15.7	51.6	0	0	0	0	109.5

Retrieved 696 of 696 residues in 185.6 ms (Link to these results)

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