A0A087XNF7_POEFO Loading...

EMAP like 1

AlphaFold DB , UniProt , Accession A0A087XNF7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 816 aa.

						>A0A087XNF7_POEFO|A0A087XNF7
SDDSASAASSMEVTDRIASLEQRVQMQEDEIQLLKSALADVVRRLNHSEEQQAMGSRRGPTKARPMIATLPLRPTVNNGTVLPKKGSSTLPSPSGPGTRKDAGPAANKRIFCSDSLLENCQISKSSKTFTVRRANSNEHVGTLTRKDSGDSKGNRTRAGSTGSNSSGKRSDSSKQRDPVFNAEEGYVKMFLKGRPVTMFMPKHQVDSYSLEARGELPSNKLKLDWWNCYGYRGRDCRSNLYLLPTGETVYFIASVVVLFNVDEQLQRHYTGHTDDIKCLAVHPDKITIATGQVAGTSSDGKQLAPHVRVWDSVSLNTLHVLGTGFFDRALVCLAFSKSNGGNTLCVVDDSNDHVLSVWDWQREERLAEAKCSNESVFAADFHPTDSNIVVTCGKSHLYFWTLEKGMLVKKQGLFEKQEKPKFVLCVTFAENGDAITGDSSGNILVWGKGTNRISRVIQGAHEGSIFAVCMLRNGALVSGGKDRRLISWDSSYQQIQTVEVLEFFGPIRTIAEGRGETVLIGTTKNFVLQGTLDGEFIPITQGHTDELWGLAVHPWKPQFLTCGYDRQVCLWDSSTHQLIWTKTLEDTAQSAGFNPSGAVVAVGTQTGRWLVLDTDSKDLVTVHTDGNEQLSVMRYGPDSNFLAIGSHDNYIYIYAVAENGRKYSRVGKCSGHSSFITHLDWSVDSQYLVSNSGDYEILYWIPSVCKQVVSVETTRDIQWFTHTCTLGFQVFGLWPDGSDGTDINAACASNDKSLLVTGDDFGKVHLFSYPCSQFRAPSHVYRGHSSHVTNVSFLHDDSYLVSTGGKDMSVLQWRIV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	S	37.3	Very low	43.5	Very low	165 Å²	165	123.1 Å²	123.1	100%	1.154	83%	0.83	S	S	*	*				0	122.6	0	32.9	0	0	0	0	107.4
2	D	33.8	Very low	45.6	Very low	155 Å²	155	124.6 Å²	124.6	83%	0.829	82%	0.816	S	S	*	*			trans	74.9	80.8	166	-58.1	-11	0	0	0	119.3
3	D	39.4	Very low	47.4	Very low	159 Å²	159	123.3 Å²	123.3	85%	0.85	80%	0.804	S	S	*	*			trans	-50.3	118.2	140.4	-81.2	-44.1	0	0	0	111.3
4	S	39.8	Very low	48.9	Very low	119 Å²	119	120.9 Å²	120.9	83%	0.832	79%	0.786	S	S	*	*			trans	-156.4	49.5	162.3	-73.6	0	0	0	0	111
5	A	41	Very low	50.6	Low	100 Å²	100	118.9 Å²	118.9	83%	0.826	77%	0.765	S	S	*	*	S	Bend	trans	-143.2	54.4	175.7	0	0	0	0	0	111.9
6	S	42.9	Very low	52.1	Low	114 Å²	114	120.8 Å²	120.8	80%	0.797	75%	0.753	S	S	*	*			trans	-162.7	50	173	64.5	0	0	0	0	114.5
7	A	39.1	Very low	53.5	Low	107 Å²	107	118.6 Å²	118.6	88%	0.884	73%	0.734	S	S	*	*			trans	-133	32.4	177.6	0	0	0	0	0	114.4
8	A	44.4	Very low	55.1	Low	103 Å²	103	114.8 Å²	114.8	85%	0.851	72%	0.716	S	S	*	*	S	Bend	trans	-121.9	30.9	175	0	0	0	0	0	112.9
9	S	51.1	Low	56.5	Low	115 Å²	115	110.8 Å²	110.8	80%	0.804	69%	0.693	S	S	*	*	S	Bend	trans	-144	61.9	-178.6	-179.5	0	0	0	0	112.9
10	S	52.8	Low	57.6	Low	115 Å²	115	110.5 Å²	110.5	80%	0.804	69%	0.685	S	S	*	*			trans	179.9	73.9	137.3	69.3	0	0	0	0	110.3
11	M	56.8	Low	59	Low	102 Å²	102	111.2 Å²	111.2	50%	0.502	68%	0.681	S	S	.	*			trans	-82.3	119	155.8	-101.6	170.9	76.2	0	0	106.5	D15 R16	M11-D15 HydrophobicContact CE-CB 3.91Å; M11-D15 HydrophobicContact CG-CB 4.4Å; M11-R16 HydrophobicContact CB-CG 4.24Å; M11-R16 HydrophobicContact CE-CG 3.83Å
12	E	69.1	Low	61.3	Low	141 Å²	141	109.4 Å²	109.4	66%	0.659	65%	0.654	S	S	*	*			trans	-58.1	146.1	171.9	-69.8	-173.6	159.9	0	0	109.2	T14 D15 R16	E12-T14 PolarHBondContact O-N 3.33Å; E12-D15 PolarHBondContact O-N 2.82Å; E12-R16 PolarHBondContact O-N 3.21Å
13	V	68.7	Low	63.6	Low	108 Å²	108	109 Å²	109	66%	0.655	64%	0.641	S	S	*	*	H	α-helix	trans	-54.9	-31.7	-172.9	172.7	0	0	0	0	111.9	R16 I17	V13-R16 PolarHBondContact O-N 2.71Å; V13-I17 HydrophobicContact CG1-CD1 3.91Å; V13-I17 WeakPolarHBondContact O-CG1 3.25Å; V13-I17 PolarHBondContact O-N 3.21Å; V13-I17 VanDerWaalsContact O-N 3.07Å
14	T	67.8	Low	65.8	Low	90 Å²	90	105.1 Å²	105.1	55%	0.552	62%	0.623	S	S	*	*	H	α-helix	trans	-59.5	-42.5	174.1	32.1	0	0	0	0	113.5	E12 R16 I17 A18	E12-T14 PolarHBondContact O-N 3.33Å; T14-R16 VanDerWaalsContact C-N 3.34Å; T14-R16 PolarHBondContact O-N 3.13Å; T14-I17 PolarHBondContact O-N 3.26Å; T14-A18 PolarHBondContact O-N 2.76Å
15	D	75	Confident	67.9	Low	90 Å²	90	104.1 Å²	104.1	48%	0.481	61%	0.605	S	S	.	*	H	α-helix	trans	-72.4	-30	179.8	-68.7	-21	0	0	0	112.1	M11 E12 S19	M11-D15 HydrophobicContact CE-CB 3.91Å; M11-D15 HydrophobicContact CG-CB 4.4Å; E12-D15 PolarHBondContact O-N 2.82Å; D15-S19 WeakPolarHBondContact O-CB 3.28Å; D15-S19 PolarHBondContact O-N 3.48Å
16	R	74.3	Confident	69.9	Low	150 Å²	150	104.2 Å²	104.2	57%	0.566	59%	0.59	S	S	*	*	H	α-helix	trans	-69.8	-39	172.6	-74.9	-179.6	176.8	179.5	0.3	111.8	M11 E12 V13 T14 S19 L20	M11-R16 HydrophobicContact CB-CG 4.24Å; M11-R16 HydrophobicContact CE-CG 3.83Å; E12-R16 PolarHBondContact O-N 3.21Å; V13-R16 PolarHBondContact O-N 2.71Å; T14-R16 VanDerWaalsContact C-N 3.34Å; T14-R16 PolarHBondContact O-N 3.13Å; R16-S19 PolarHBondContact O-N 2.9Å; R16-L20 WeakPolarHBondContact O-CG 3.25Å; R16-L20 PolarHBondContact O-N 3.06Å; R16-L20 VanDerWaalsContact O-N 3.1Å
17	I	76.2	Confident	71.8	Confident	83 Å²	83	104.4 Å²	104.4	43%	0.426	58%	0.578	S	S	.	*	H	α-helix	trans	-65	-47.8	175.8	-68.9	167.3	0	0	0	109.9	V13 T14 S19 L20 E21	V13-I17 HydrophobicContact CG1-CD1 3.91Å; V13-I17 WeakPolarHBondContact O-CG1 3.25Å; V13-I17 PolarHBondContact O-N 3.21Å; V13-I17 VanDerWaalsContact O-N 3.07Å; T14-I17 PolarHBondContact O-N 3.26Å; I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3.34Å; I17-L20 PolarHBondContact O-N 2.79Å; I17-E21 HydrophobicContact CG2-CG 4.29Å; I17-E21 WeakPolarHBondContact O-CG 3.25Å; I17-E21 PolarHBondContact O-N 3.01Å
18	A	83.1	Confident	73.9	Confident	50 Å²	50	104.2 Å²	104.2	41%	0.413	56%	0.559	S	S	.	*	H	α-helix	trans	-59.4	-39.2	177.2	0	0	0	0	0	112.7	T14 L20 Q22	T14-A18 PolarHBondContact O-N 2.76Å; A18-L20 PolarHBondContact O-N 3.01Å; A18-Q22 WeakPolarHBondContact O-CB 3.29Å; A18-Q22 PolarHBondContact O-N 3.09Å
19	S	81.6	Confident	75.8	Confident	39 Å²	39	103.8 Å²	103.8	27%	0.273	54%	0.542	S	S	.	.	H	α-helix	trans	-66.2	-34.8	175.2	-175.3	0	0	0	0	113.1	D15 R16 I17 R23	D15-S19 WeakPolarHBondContact O-CB 3.28Å; D15-S19 PolarHBondContact O-N 3.48Å; R16-S19 PolarHBondContact O-N 2.9Å; I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3.34Å; S19-R23 WeakPolarHBondContact O-CG 3.43Å; S19-R23 PolarHBondContact O-N 2.91Å
20	L	77.9	Confident	77.5	Confident	105 Å²	105	104.4 Å²	104.4	55%	0.55	53%	0.532	S	S	.	.	H	α-helix	trans	-74.1	-42.2	176.6	-73.6	170.1	0	0	0	111.6	R16 I17 A18 Q22 R23 V24	R16-L20 WeakPolarHBondContact O-CG 3.25Å; R16-L20 PolarHBondContact O-N 3.06Å; R16-L20 VanDerWaalsContact O-N 3.1Å; I17-L20 PolarHBondContact O-N 2.79Å; A18-L20 PolarHBondContact O-N 3.01Å; L20-Q22 VanDerWaalsContact C-N 3.3Å; L20-Q22 PolarHBondContact O-N 3.17Å; L20-R23 PolarHBondContact O-N 3.47Å; L20-R23 VanDerWaalsContact O-N 3.11Å; L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 3.28Å
21	E	86.5	Confident	79.2	Confident	126 Å²	126	103 Å²	103	59%	0.589	52%	0.515	S	S	*	.	H	α-helix	trans	-59.3	-42.1	174.2	-72.2	175.1	167	0	0	111.2	I17 R23 V24 Q25	I17-E21 HydrophobicContact CG2-CG 4.29Å; I17-E21 WeakPolarHBondContact O-CG 3.25Å; I17-E21 PolarHBondContact O-N 3.01Å; E21-R23 VanDerWaalsContact C-N 3.33Å; E21-R23 PolarHBondContact O-N 3.45Å; E21-V24 PolarHBondContact O-N 2.89Å; E21-Q25 PolarHBondContact O-N 3.04Å
22	Q	86.7	Confident	80.6	Confident	127 Å²	127	104.7 Å²	104.7	59%	0.593	52%	0.522	S	S	*	.	H	α-helix	trans	-63.4	-36.6	175.2	-168	-179.6	9.1	0	0	112.6	A18 L20 M26	A18-Q22 WeakPolarHBondContact O-CB 3.29Å; A18-Q22 PolarHBondContact O-N 3.09Å; L20-Q22 VanDerWaalsContact C-N 3.3Å; L20-Q22 PolarHBondContact O-N 3.17Å; Q22-M26 HydrophobicContact CG-CE 4.49Å; Q22-M26 WeakPolarHBondContact O-CG 3.25Å; Q22-M26 PolarHBondContact O-N 3.49Å; Q22-M26 VanDerWaalsContact O-N 3.08Å
23	R	82.3	Confident	81.4	Confident	145 Å²	145	103.8 Å²	103.8	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-69.9	-38.8	175.1	-73.5	-178.7	-147.7	-171.9	4.2	112.5	S19 L20 E21 Q25 M26 Q27	S19-R23 WeakPolarHBondContact O-CG 3.43Å; S19-R23 PolarHBondContact O-N 2.91Å; L20-R23 PolarHBondContact O-N 3.47Å; L20-R23 VanDerWaalsContact O-N 3.11Å; E21-R23 VanDerWaalsContact C-N 3.33Å; E21-R23 PolarHBondContact O-N 3.45Å; R23-Q25 VanDerWaalsContact C-N 3.32Å; R23-M26 HydrophobicContact CG-CE 4.08Å; R23-M26 PolarHBondContact O-N 2.88Å; R23-Q27 WeakPolarHBondContact O-CG 3.22Å; R23-Q27 PolarHBondContact O-N 2.89Å
24	V	85.6	Confident	81.9	Confident	78 Å²	78	104.3 Å²	104.3	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-43.5	175	171.8	0	0	0	0	109.9	L20 E21 M26 Q27 E28	L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 3.28Å; E21-V24 PolarHBondContact O-N 2.89Å; V24-M26 PolarHBondContact O-N 3.33Å; V24-Q27 PolarHBondContact O-N 3.35Å; V24-Q27 VanDerWaalsContact O-N 3.16Å; V24-E28 PolarHBondContact O-N 2.88Å
25	Q	84	Confident	82.7	Confident	98 Å²	98	106.6 Å²	106.6	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.9	-165	63.2	58.9	0	0	112.5	E21 R23 Q27 E28 D29	E21-Q25 PolarHBondContact O-N 3.04Å; R23-Q25 VanDerWaalsContact C-N 3.32Å; Q25-Q27 VanDerWaalsContact C-N 3.3Å; Q25-Q27 PolarHBondContact O-N 2.82Å; Q25-E28 PolarHBondContact NE2-OE2 2.87Å; Q25-E28 VanDerWaalsContact NE2-OE2 3.15Å; Q25-E28 PolarHBondContact O-N 3.41Å; Q25-D29 PolarHBondContact O-N 2.83Å
26	M	83.1	Confident	83.2	Confident	103 Å²	103	105.6 Å²	105.6	51%	0.507	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-36.5	175.2	-73.9	-173.9	-66.2	0	0	112.3	Q22 R23 V24 D29 E30	Q22-M26 HydrophobicContact CG-CE 4.49Å; Q22-M26 WeakPolarHBondContact O-CG 3.25Å; Q22-M26 PolarHBondContact O-N 3.49Å; Q22-M26 VanDerWaalsContact O-N 3.08Å; R23-M26 HydrophobicContact CG-CE 4.08Å; R23-M26 PolarHBondContact O-N 2.88Å; V24-M26 PolarHBondContact O-N 3.33Å; M26-D29 PolarHBondContact O-N 3.37Å; M26-E30 PolarHBondContact O-N 3.19Å
27	Q	81.6	Confident	83.9	Confident	118 Å²	118	100.9 Å²	100.9	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-69.5	-36.3	175	-74.2	-176.2	-28.6	0	0	112.4	R23 V24 Q25 D29 E30 I31	R23-Q27 WeakPolarHBondContact O-CG 3.22Å; R23-Q27 PolarHBondContact O-N 2.89Å; V24-Q27 PolarHBondContact O-N 3.35Å; V24-Q27 VanDerWaalsContact O-N 3.16Å; Q25-Q27 VanDerWaalsContact C-N 3.3Å; Q25-Q27 PolarHBondContact O-N 2.82Å; Q27-D29 VanDerWaalsContact C-N 3.33Å; Q27-E30 PolarHBondContact O-N 2.79Å; Q27-I31 WeakPolarHBondContact O-CB 3.44Å; Q27-I31 WeakPolarHBondContact O-CD1 3.43Å; Q27-I31 WeakPolarHBondContact O-CG1 3.34Å; Q27-I31 PolarHBondContact O-N 3.31Å
28	E	84.5	Confident	84.1	Confident	103 Å²	103	102.4 Å²	102.4	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-41.7	172.6	-74.3	-174	162.5	0	0	111.7	V24 Q25 I31 Q32	V24-E28 PolarHBondContact O-N 2.88Å; Q25-E28 PolarHBondContact NE2-OE2 2.87Å; Q25-E28 VanDerWaalsContact NE2-OE2 3.15Å; Q25-E28 PolarHBondContact O-N 3.41Å; E28-I31 PolarHBondContact O-N 2.8Å; E28-Q32 WeakPolarHBondContact O-CB 3.5Å; E28-Q32 PolarHBondContact O-N 3.19Å
29	D	84.2	Confident	84.3	Confident	93 Å²	93	102.1 Å²	102.1	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-41	176.7	-71.6	-19.1	0	0	0	112	Q25 M26 Q27 Q32 L33	Q25-D29 PolarHBondContact O-N 2.83Å; M26-D29 PolarHBondContact O-N 3.37Å; Q27-D29 VanDerWaalsContact C-N 3.33Å; D29-Q32 WeakPolarHBondContact O-CB 3.26Å; D29-Q32 PolarHBondContact O-N 2.72Å; D29-L33 PolarHBondContact O-N 3.33Å
30	E	86.7	Confident	84.7	Confident	128 Å²	128	103.4 Å²	103.4	60%	0.598	52%	0.524	S	S	*	.	H	α-helix	trans	-63.3	-41.5	173.1	-77.7	-172.4	163.7	0	0	112.2	M26 Q27 Q32 L33 L34	M26-E30 PolarHBondContact O-N 3.19Å; Q27-E30 PolarHBondContact O-N 2.79Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.48Å; E30-L33 WeakPolarHBondContact O-CB 3.48Å; E30-L33 PolarHBondContact O-N 2.61Å; E30-L34 WeakPolarHBondContact O-CB 3.47Å; E30-L34 WeakPolarHBondContact O-CG 3.39Å; E30-L34 PolarHBondContact O-N 2.83Å
31	I	87.6	Confident	85.1	Confident	87 Å²	87	101.8 Å²	101.8	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-64.7	-38.7	176.1	-71.6	166.4	0	0	0	110.7	Q27 E28 L33 L34 K35	Q27-I31 WeakPolarHBondContact O-CB 3.44Å; Q27-I31 WeakPolarHBondContact O-CD1 3.43Å; Q27-I31 WeakPolarHBondContact O-CG1 3.34Å; Q27-I31 PolarHBondContact O-N 3.31Å; E28-I31 PolarHBondContact O-N 2.8Å; I31-L33 VanDerWaalsContact C-N 3.35Å; I31-L34 PolarHBondContact O-N 3.21Å; I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 WeakPolarHBondContact O-CB 3.19Å; I31-K35 VanDerWaalsContact O-CG 3.31Å; I31-K35 WeakPolarHBondContact O-CG 3.42Å; I31-K35 PolarHBondContact O-N 3.25Å
32	Q	86	Confident	85	Confident	136 Å²	136	99.4 Å²	99.4	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-62.9	-43.2	175.2	-167.5	108.8	-24.3	0	0	110.9	E28 D29 E30 K35 S36	E28-Q32 WeakPolarHBondContact O-CB 3.5Å; E28-Q32 PolarHBondContact O-N 3.19Å; D29-Q32 WeakPolarHBondContact O-CB 3.26Å; D29-Q32 PolarHBondContact O-N 2.72Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.48Å; Q32-K35 PolarHBondContact O-N 3.49Å; Q32-S36 PolarHBondContact O-N 3.41Å
33	L	85.9	Confident	85.1	Confident	123 Å²	123	101.8 Å²	101.8	64%	0.644	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-45.1	176.2	-120.7	139	0	0	0	111.3	D29 E30 I31 K35 S36 A37	D29-L33 PolarHBondContact O-N 3.33Å; E30-L33 WeakPolarHBondContact O-CB 3.48Å; E30-L33 PolarHBondContact O-N 2.61Å; I31-L33 VanDerWaalsContact C-N 3.35Å; L33-K35 PolarHBondContact O-N 2.78Å; L33-S36 PolarHBondContact O-N 3.1Å; L33-S36 PolarHBondContact O-OG 3.35Å; L33-A37 PolarHBondContact O-N 3.13Å
34	L	79.8	Confident	85.3	Confident	119 Å²	119	102.2 Å²	102.2	62%	0.623	52%	0.518	S	S	*	.	H	α-helix	trans	-61.3	-43	175.1	-79.9	162.1	0	0	0	112.5	E30 I31 S36 A37 L38	E30-L34 WeakPolarHBondContact O-CB 3.47Å; E30-L34 WeakPolarHBondContact O-CG 3.39Å; E30-L34 PolarHBondContact O-N 2.83Å; I31-L34 PolarHBondContact O-N 3.21Å; L34-S36 VanDerWaalsContact C-N 3.31Å; L34-S36 PolarHBondContact O-N 2.95Å; L34-A37 PolarHBondContact O-N 3.26Å; L34-L38 WeakPolarHBondContact O-CB 3.41Å; L34-L38 PolarHBondContact O-N 3.05Å
35	K	84.1	Confident	84.8	Confident	138 Å²	138	103 Å²	103	60%	0.6	52%	0.519	S	S	*	.	H	α-helix	trans	-60.7	-40.7	174.5	-76	172.8	-179.5	173.9	0	111.6	I31 Q32 L33 A39	I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 WeakPolarHBondContact O-CB 3.19Å; I31-K35 VanDerWaalsContact O-CG 3.31Å; I31-K35 WeakPolarHBondContact O-CG 3.42Å; I31-K35 PolarHBondContact O-N 3.25Å; Q32-K35 PolarHBondContact O-N 3.49Å; L33-K35 PolarHBondContact O-N 2.78Å; K35-A39 WeakPolarHBondContact O-CB 3.03Å; K35-A39 PolarHBondContact O-N 3.26Å
36	S	86.4	Confident	84.5	Confident	69 Å²	69	102.2 Å²	102.2	48%	0.483	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-40.8	177.3	78.2	0	0	0	0	112.6	Q32 L33 L34 A39 D40	Q32-S36 PolarHBondContact O-N 3.41Å; L33-S36 PolarHBondContact O-N 3.1Å; L33-S36 PolarHBondContact O-OG 3.35Å; L34-S36 VanDerWaalsContact C-N 3.31Å; L34-S36 PolarHBondContact O-N 2.95Å; S36-A39 PolarHBondContact O-N 2.92Å; S36-D40 PolarHBondContact O-N 2.72Å
37	A	88.1	Confident	84.4	Confident	50 Å²	50	102.2 Å²	102.2	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-41.4	176.6	0	0	0	0	0	111.3	L33 L34 D40 V41	L33-A37 PolarHBondContact O-N 3.13Å; L34-A37 PolarHBondContact O-N 3.26Å; A37-D40 PolarHBondContact O-N 3.33Å; A37-V41 WeakPolarHBondContact O-CG2 3.46Å; A37-V41 PolarHBondContact O-N 3.45Å
38	L	81.4	Confident	84	Confident	115 Å²	115	99.7 Å²	99.7	60%	0.602	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-42.5	175.1	-174.4	65.5	0	0	0	111.6	L34 D40 V41 V42	L34-L38 WeakPolarHBondContact O-CB 3.41Å; L34-L38 PolarHBondContact O-N 3.05Å; L38-D40 VanDerWaalsContact C-N 3.28Å; L38-D40 PolarHBondContact O-N 3.29Å; L38-V41 PolarHBondContact O-N 3.16Å; L38-V42 WeakPolarHBondContact O-CG2 3.23Å; L38-V42 PolarHBondContact O-N 3.39Å
39	A	87.3	Confident	83.6	Confident	44 Å²	44	99.9 Å²	99.9	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-61.7	-36.7	175.4	0	0	0	0	0	112.3	K35 S36 R43	K35-A39 WeakPolarHBondContact O-CB 3.03Å; K35-A39 PolarHBondContact O-N 3.26Å; S36-A39 PolarHBondContact O-N 2.92Å; A39-R43 WeakPolarHBondContact O-CG 3.49Å; A39-R43 PolarHBondContact O-N 2.9Å
40	D	89.6	Confident	83.1	Confident	67 Å²	67	101 Å²	101	36%	0.358	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-39.9	175.1	-173.7	63.1	0	0	0	112.5	S36 A37 L38 R43 R44	S36-D40 PolarHBondContact O-N 2.72Å; A37-D40 PolarHBondContact O-N 3.33Å; L38-D40 VanDerWaalsContact C-N 3.28Å; L38-D40 PolarHBondContact O-N 3.29Å; D40-R43 PolarHBondContact O-N 2.82Å; D40-R44 PolarHBondContact O-N 2.87Å; D40-R44 IonicContact OD2-CZ 3.29Å; D40-R44 VanDerWaalsContact OD2-CZ 3.29Å; D40-R44 IonicContact OD2-NE 2.98Å; D40-R44 PolarHBondContact OD2-NE 2.79Å; D40-R44 IonicContact OD2-NH2 2.83Å; D40-R44 PolarHBondContact OD2-NH2 2.92Å
41	V	85.8	Confident	82.5	Confident	70 Å²	70	100.3 Å²	100.3	42%	0.424	51%	0.512	S	S	.	.	H	α-helix	trans	-62	-44.4	173.1	171.5	0	0	0	0	110.9	A37 L38 R43 R44 L45	A37-V41 WeakPolarHBondContact O-CG2 3.46Å; A37-V41 PolarHBondContact O-N 3.45Å; L38-V41 PolarHBondContact O-N 3.16Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 3.31Å; V41-R44 PolarHBondContact O-N 2.93Å; V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 PolarHBondContact O-N 2.99Å
42	V	85.3	Confident	81.3	Confident	76 Å²	76	103 Å²	103	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-40.2	176.6	171.8	0	0	0	0	111.4	L38 L45 N46	L38-V42 WeakPolarHBondContact O-CG2 3.23Å; L38-V42 PolarHBondContact O-N 3.39Å; V42-L45 PolarHBondContact O-N 2.77Å; V42-N46 PolarHBondContact O-N 3.38Å
43	R	88	Confident	80.2	Confident	177 Å²	177	99.5 Å²	99.5	67%	0.668	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-43.2	173.6	-76.8	-179.8	-162.5	157.4	4.6	112.3	A39 D40 V41 L45 N46 H47	A39-R43 WeakPolarHBondContact O-CG 3.49Å; A39-R43 PolarHBondContact O-N 2.9Å; D40-R43 PolarHBondContact O-N 2.82Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 3.31Å; R43-L45 VanDerWaalsContact C-N 3.33Å; R43-N46 PolarHBondContact O-N 3.17Å; R43-H47 WeakPolarHBondContact O-CB 3.09Å; R43-H47 PolarHBondContact O-N 2.94Å
44	R	85.4	Confident	78.9	Confident	154 Å²	154	100.5 Å²	100.5	58%	0.581	52%	0.519	S	S	*	.	H	α-helix	trans	-66	-36.6	177.3	-76.9	-173.1	-85.1	157.7	-6.3	112.1	D40 V41 H47 S48	D40-R44 PolarHBondContact O-N 2.87Å; D40-R44 IonicContact OD2-CZ 3.29Å; D40-R44 VanDerWaalsContact OD2-CZ 3.29Å; D40-R44 IonicContact OD2-NE 2.98Å; D40-R44 PolarHBondContact OD2-NE 2.79Å; D40-R44 IonicContact OD2-NH2 2.83Å; D40-R44 PolarHBondContact OD2-NH2 2.92Å; V41-R44 PolarHBondContact O-N 2.93Å; R44-H47 PolarHBondContact O-N 3.32Å; R44-S48 WeakPolarHBondContact O-CB 3.48Å; R44-S48 PolarHBondContact O-N 2.86Å
45	L	76.4	Confident	77.7	Confident	95 Å²	95	97.8 Å²	97.8	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-49.8	175.1	-152	104.8	0	0	0	110.7	V41 V42 R43 H47 S48 E49	V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 PolarHBondContact O-N 2.99Å; V42-L45 PolarHBondContact O-N 2.77Å; R43-L45 VanDerWaalsContact C-N 3.33Å; L45-H47 VanDerWaalsContact C-N 3.27Å; L45-H47 PolarHBondContact O-N 2.9Å; L45-S48 WeakPolarHBondContact O-CB 3.34Å; L45-S48 PolarHBondContact O-N 2.86Å; L45-S48 VanDerWaalsContact O-N 3.08Å; L45-E49 WeakPolarHBondContact O-CG 3.42Å; L45-E49 PolarHBondContact O-N 3.23Å
46	N	78.3	Confident	76.1	Confident	82 Å²	82	96.1 Å²	96.1	44%	0.439	53%	0.526	S	S	.	.	H	α-helix	trans	-59.5	-38.5	176.1	-71.1	-8.6	0	0	0	111.9	V42 R43 E49 E50	V42-N46 PolarHBondContact O-N 3.38Å; R43-N46 PolarHBondContact O-N 3.17Å; N46-E49 PolarHBondContact O-N 2.78Å; N46-E50 WeakPolarHBondContact O-CB 3.33Å; N46-E50 WeakPolarHBondContact O-CG 3.28Å; N46-E50 PolarHBondContact O-N 3.23Å
47	H	80.3	Confident	74.3	Confident	102 Å²	102	103.3 Å²	103.3	47%	0.472	54%	0.543	S	S	.	.	H	α-helix	trans	-68.8	-35.8	176.8	-155.4	62.1	0	0	0	112.4	R43 R44 L45 E50 Q51	R43-H47 WeakPolarHBondContact O-CB 3.09Å; R43-H47 PolarHBondContact O-N 2.94Å; R44-H47 PolarHBondContact O-N 3.32Å; L45-H47 VanDerWaalsContact C-N 3.27Å; L45-H47 PolarHBondContact O-N 2.9Å; H47-E50 IonicContact ND1-OE2 3.83Å; H47-Q51 PolarHBondContact CD2-NE2 2.91Å; H47-Q51 VanDerWaalsContact CD2-NE2 3.26Å; H47-Q51 PolarHBondContact NE2-NE2 3.25Å; H47-Q51 WeakPolarHBondContact O-CB 3.38Å; H47-Q51 VanDerWaalsContact O-CG 3.26Å; H47-Q51 WeakPolarHBondContact O-CG 3.5Å; H47-Q51 PolarHBondContact O-N 2.91Å
48	S	73.9	Confident	72.1	Confident	65 Å²	65	113.1 Å²	113.1	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-67	-41.2	173.2	-177.4	0	0	0	0	111.8	R44 L45 Q51 Q52	R44-S48 WeakPolarHBondContact O-CB 3.48Å; R44-S48 PolarHBondContact O-N 2.86Å; L45-S48 WeakPolarHBondContact O-CB 3.34Å; L45-S48 PolarHBondContact O-N 2.86Å; L45-S48 VanDerWaalsContact O-N 3.08Å; S48-Q51 PolarHBondContact O-N 2.67Å; S48-Q52 PolarHBondContact O-N 2.85Å
49	E	75.7	Confident	70	Confident	108 Å²	108	110.7 Å²	110.7	51%	0.505	57%	0.572	S	S	.	*	H	α-helix	trans	-65.9	-40.1	175.4	-72.4	-178.3	170.3	0	0	111.7	L45 N46 Q52 A53	L45-E49 WeakPolarHBondContact O-CG 3.42Å; L45-E49 PolarHBondContact O-N 3.23Å; N46-E49 PolarHBondContact O-N 2.78Å; E49-Q52 PolarHBondContact O-N 3.34Å; E49-A53 WeakPolarHBondContact O-CB 3.32Å; E49-A53 PolarHBondContact O-N 2.71Å
50	E	74.1	Confident	67.7	Low	117 Å²	117	114.6 Å²	114.6	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-63.4	-39.1	172.1	-79.4	-179.1	167.2	0	0	112.4	N46 H47 A53 M54	N46-E50 WeakPolarHBondContact O-CB 3.33Å; N46-E50 WeakPolarHBondContact O-CG 3.28Å; N46-E50 PolarHBondContact O-N 3.23Å; H47-E50 IonicContact ND1-OE2 3.83Å; E50-A53 PolarHBondContact O-N 3.07Å; E50-M54 PolarHBondContact O-N 3.04Å
51	Q	72.3	Confident	65.2	Low	113 Å²	113	117.6 Å²	117.6	53%	0.528	61%	0.614	S	S	.	*	H	α-helix	trans	-69.3	-37.2	175.7	-74.6	-178.4	12.7	0	0	112.3	H47 S48 M54 G55	H47-Q51 PolarHBondContact CD2-NE2 2.91Å; H47-Q51 VanDerWaalsContact CD2-NE2 3.26Å; H47-Q51 PolarHBondContact NE2-NE2 3.25Å; H47-Q51 WeakPolarHBondContact O-CB 3.38Å; H47-Q51 VanDerWaalsContact O-CG 3.26Å; H47-Q51 WeakPolarHBondContact O-CG 3.5Å; H47-Q51 PolarHBondContact O-N 2.91Å; S48-Q51 PolarHBondContact O-N 2.67Å; Q51-M54 PolarHBondContact O-N 2.93Å; Q51-G55 PolarHBondContact O-N 2.87Å
52	Q	63.8	Low	62.6	Low	144 Å²	144	124.2 Å²	124.2	67%	0.673	64%	0.637	S	S	*	*	H	α-helix	trans	-65	-40.2	170.8	-91.7	-177.1	-15.8	0	0	112.1	S48 E49 M54 G55 S56	S48-Q52 PolarHBondContact O-N 2.85Å; E49-Q52 PolarHBondContact O-N 3.34Å; Q52-M54 VanDerWaalsContact C-N 3.3Å; Q52-M54 PolarHBondContact O-N 3.39Å; Q52-G55 PolarHBondContact O-N 2.74Å; Q52-S56 PolarHBondContact O-N 2.78Å
53	A	61.7	Low	60.1	Low	61 Å²	61	125.5 Å²	125.5	50%	0.504	66%	0.656	S	S	.	*	H	α-helix	trans	-65.2	-31.9	175	0	0	0	0	0	112.6	E49 E50	E49-A53 WeakPolarHBondContact O-CB 3.32Å; E49-A53 PolarHBondContact O-N 2.71Å; E50-A53 PolarHBondContact O-N 3.07Å
54	M	59.6	Low	57.6	Low	144 Å²	144	127.8 Å²	127.8	71%	0.709	67%	0.665	S	S	*	*	H	α-helix	trans	-77.2	-29.3	172.9	-77.1	-154.8	-88.6	0	0	113.6	E50 Q51 Q52 S56	E50-M54 PolarHBondContact O-N 3.04Å; Q51-M54 PolarHBondContact O-N 2.93Å; Q52-M54 VanDerWaalsContact C-N 3.3Å; Q52-M54 PolarHBondContact O-N 3.39Å; M54-S56 VanDerWaalsContact C-N 3.34Å
55	G	53.7	Low	55.7	Low	62 Å²	62	124.8 Å²	124.8	64%	0.639	67%	0.665	S	S	*	*	H	α-helix	trans	-69.4	-28.6	173.7	0	0	0	0	0	113.9	Q51 Q52 R57	Q51-G55 PolarHBondContact O-N 2.87Å; Q52-G55 PolarHBondContact O-N 2.74Å; G55-R57 VanDerWaalsContact C-N 3.26Å; G55-R57 PolarHBondContact O-N 3.34Å
56	S	51.6	Low	53.5	Low	104 Å²	104	127.1 Å²	127.1	73%	0.727	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	2.6	179.2	-172.8	0	0	0	0	114.5	Q52 M54	Q52-S56 PolarHBondContact O-N 2.78Å; M54-S56 VanDerWaalsContact C-N 3.34Å
57	R	49.1	Very low	51.2	Low	219 Å²	219	129.6 Å²	129.6	83%	0.826	69%	0.687	S	S	*	*			trans	-115.2	68.9	179.1	-74.2	-173.9	174.8	175.1	1.6	112.5	G55	G55-R57 VanDerWaalsContact C-N 3.26Å; G55-R57 PolarHBondContact O-N 3.34Å
58	R	40.1	Very low	48.8	Very low	256 Å²	256	128.4 Å²	128.4	97%	0.966	70%	0.695	S	S	*	*			trans	-126.9	88.3	153.6	-80.2	-169.4	176.5	-174.3	0.6	110.2
59	G	37.3	Very low	46.7	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	71%	0.712	S	S	*	*	S	Bend	trans	-168.5	138.2	167.2	0	0	0	0	0	108.3	T61	G59-T61 PolarHBondContact O-N 3.44Å
60	P	40	Very low	44.9	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	73%	0.73	S	S	*	*			trans	-78.5	123.4	-156.8	30.3	-33	0	0	0	113.7
61	T	36.9	Very low	43	Very low	129 Å²	129	134.8 Å²	134.8	79%	0.791	74%	0.742	S	S	*	*			trans	22.6	126.1	138.7	48.3	0	0	0	0	120.4	G59	G59-T61 PolarHBondContact O-N 3.44Å
62	K	32.3	Very low	41	Very low	209 Å²	209	137.4 Å²	137.4	91%	0.909	76%	0.759	S	S	*	*				-161.1	135.4	105.3	-102.3	174.7	-172.7	-178.2	0	113
63	A	32.3	Very low	39.6	Very low	104 Å²	104	142 Å²	142	86%	0.86	77%	0.77	S	S	*	*			trans	76.6	92.3	158.5	0	0	0	0	0	120.8
64	R	35.3	Very low	38.2	Very low	225 Å²	225	144.9 Å²	144.9	85%	0.849	78%	0.783	S	S	*	*			trans	-55.6	179.4	143.9	-107.8	-166.1	165.6	175.7	-2.5	112.3
65	P	45.3	Very low	36.6	Very low	90 Å²	90	143.9 Å²	143.9	58%	0.584	79%	0.786	S	S	*	*			cis	-149.4	-178.7	-22.3	35.6	-14.1	0	0	0	117.5
66	M	29.5	Very low	35.3	Very low	144 Å²	144	146.7 Å²	146.7	71%	0.709	79%	0.79	S	S	*	*			trans	95	107.6	143.5	-63.6	-144.2	179.7	0	0	118.2
67	I	30.9	Very low	34	Very low	135 Å²	135	147.8 Å²	147.8	69%	0.692	79%	0.788	S	S	*	*				113.1	109.7	75.2	-89.2	175.8	0	0	0	105.2
68	A	30.1	Very low	32.8	Very low	77 Å²	77	144.6 Å²	144.6	64%	0.636	79%	0.787	S	S	*	*				55.4	134.6	87.1	0	0	0	0	0	111.2
69	T	28.9	Very low	32.2	Very low	132 Å²	132	136 Å²	136	81%	0.81	78%	0.778	S	S	*	*			cis	-174.2	158.5	17.2	5.2	0	0	0	0	105
70	L	38.2	Very low	31.8	Very low	167 Å²	167	139.4 Å²	139.4	87%	0.874	79%	0.786	S	S	*	*			trans	-46.6	157.7	162.9	-74.9	147	0	0	0	113.2
71	P	35.3	Very low	31.2	Very low	124 Å²	124	139.9 Å²	139.9	81%	0.805	79%	0.786	S	S	*	*			trans	-132.2	155.8	134.2	28.6	-12.1	0	0	0	114.8
72	L	30.1	Very low	30.8	Very low	169 Å²	169	141.2 Å²	141.2	89%	0.885	79%	0.788	S	S	*	*			trans	-61.1	161.3	171.5	-79	132.6	0	0	0	113.9
73	R	33.3	Very low	31.3	Very low	241 Å²	241	136.3 Å²	136.3	91%	0.909	78%	0.777	S	S	*	*			trans	-40.2	155.9	174.7	-68.6	178.4	170.8	177.4	-2.5	115.3
74	P	33.3	Very low	31.1	Very low	120 Å²	120	140.6 Å²	140.6	78%	0.779	78%	0.777	S	S	*	*				-139.6	159.1	100.9	27	-7.1	0	0	0	116.6
75	T	25.7	Very low	30.7	Very low	124 Å²	124	140 Å²	140	76%	0.761	78%	0.781	S	S	*	*			trans	-20.2	142.4	160.4	41.1	0	0	0	0	122.4
76	V	25.8	Very low	29.8	Very low	120 Å²	120	139.3 Å²	139.3	73%	0.727	79%	0.79	S	S	*	*				92.1	122.2	129.5	175	0	0	0	0	120.2
77	N	24.8	Very low	29.6	Very low	128 Å²	128	138.1 Å²	138.1	68%	0.684	80%	0.795	S	S	*	*			trans	99.7	117.2	145.7	-85.8	-2.6	0	0	0	122.2
78	N	24.4	Very low	29.5	Very low	151 Å²	151	136.6 Å²	136.6	81%	0.807	80%	0.797	S	S	*	*			trans	67.6	115.6	130.6	-66.9	-7.4	0	0	0	119.2
79	G	27.4	Very low	29.4	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	81%	0.806	S	S	*	*			trans	166	81.9	161.3	0	0	0	0	0	113.2
80	T	27.4	Very low	29.5	Very low	136 Å²	136	140.7 Å²	140.7	83%	0.834	81%	0.807	S	S	*	*			trans	-44.3	153.8	163	42	0	0	0	0	114.5
81	V	28.4	Very low	29.5	Very low	136 Å²	136	138.5 Å²	138.5	82%	0.824	80%	0.803	S	S	*	*			trans	129.2	101.4	141.9	-178.7	0	0	0	0	114.3
82	L	27.5	Very low	29.2	Very low	157 Å²	157	137.6 Å²	137.6	82%	0.822	80%	0.8	S	S	*	*			trans	-75.8	-179.9	147.8	-80.1	168.5	0	0	0	109.7
83	P	43.5	Very low	29.8	Very low	106 Å²	106	135.9 Å²	135.9	69%	0.688	80%	0.798	S	S	*	*			cis	-137.7	-178.3	-32.8	33.1	-13.6	0	0	0	112.5
84	K	27.4	Very low	29.6	Very low	195 Å²	195	129.9 Å²	129.9	85%	0.848	79%	0.793	S	S	*	*			trans	164.3	117.1	139.6	-93.6	169.1	-177.9	-179.8	0	109.9
85	K	27.3	Very low	29.4	Very low	213 Å²	213	127.8 Å²	127.8	93%	0.926	79%	0.794	S	S	*	*				90.3	130.2	77.7	-97.4	-163.1	179.4	-173.4	0	114.6
86	G	26.3	Very low	30.3	Very low	75 Å²	75	128.4 Å²	128.4	77%	0.773	80%	0.8	S	S	*	*			trans	134.7	94.7	159.4	0	0	0	0	0	112.4
87	S	25.9	Very low	30.4	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	80%	0.798	S	S	*	*				77.2	114.1	73.5	-175.5	0	0	0	0	115.2
88	S	28.1	Very low	30.6	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	81%	0.809	S	S	*	*			trans	157.1	106.2	141	45.8	0	0	0	0	109.6
89	T	28.7	Very low	30.8	Very low	135 Å²	135	130.9 Å²	130.9	83%	0.828	81%	0.813	S	S	*	*				60.8	110.1	88.2	58.3	0	0	0	0	116.3
90	L	29.7	Very low	30.9	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	81%	0.811	S	S	*	*			trans	-12.4	161.9	145.6	-71	164.2	0	0	0	117.2
91	P	38.2	Very low	30.9	Very low	121 Å²	121	136.1 Å²	136.1	79%	0.786	81%	0.809	S	S	*	*			cis	-151.9	-179.6	39.9	38.2	-14.3	0	0	0	118.4
92	S	30.4	Very low	30.9	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	81%	0.811	S	S	*	*			trans	-68.2	163.2	166.6	-30.7	0	0	0	0	113.1
93	P	42.5	Very low	30.9	Very low	132 Å²	132	130.5 Å²	130.5	86%	0.857	81%	0.807	S	S	*	*				-149.6	-175.3	112.5	35.2	-14.8	0	0	0	115.9
94	S	29.8	Very low	30.3	Very low	115 Å²	115	132 Å²	132	80%	0.804	82%	0.816	S	S	*	*			trans	-102.9	149.3	-151.1	48.1	0	0	0	0	119.1
95	G	29.2	Very low	30.3	Very low	77 Å²	77	127.2 Å²	127.2	79%	0.794	81%	0.814	S	S	*	*			trans	65	170.8	143.1	0	0	0	0	0	121
96	P	44.3	Very low	30.4	Very low	137 Å²	137	121.1 Å²	121.1	89%	0.89	80%	0.803	S	S	*	*			cis	-141.3	171.4	-1	40.8	-21.3	0	0	0	118.3
97	G	26.6	Very low	30.3	Very low	66 Å²	66	124.5 Å²	124.5	68%	0.68	80%	0.803	S	S	*	*			trans	83.3	121.5	147.1	0	0	0	0	0	120.3
98	T	29.4	Very low	30.3	Very low	149 Å²	149	127.4 Å²	127.4	91%	0.914	80%	0.801	S	S	*	*				-179.3	158	84.8	31.5	0	0	0	0	113.1
99	R	28.7	Very low	30	Very low	235 Å²	235	134 Å²	134	89%	0.887	81%	0.81	S	S	*	*			trans	-60.3	164.3	179.7	-60.7	166.5	173.7	174.8	-4.5	113
100	K	29	Very low	29.8	Very low	175 Å²	175	134.9 Å²	134.9	76%	0.761	81%	0.808	S	S	*	*			cis	179.9	146	41.5	-131.3	172.4	-173.8	-169.8	0	105.2
101	D	27.3	Very low	29.5	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	81%	0.81	S	S	*	*				177.1	159	90.3	-96.1	-27.8	0	0	0	113.1
102	A	28.7	Very low	28.8	Very low	104 Å²	104	136.6 Å²	136.6	86%	0.86	81%	0.81	S	S	*	*			trans	-23.5	155.1	173.6	0	0	0	0	0	119.7
103	G	27	Very low	28.5	Very low	72 Å²	72	137 Å²	137	74%	0.742	81%	0.813	S	S	*	*			cis	148.2	137.2	13.7	0	0	0	0	0	108.2
104	P	32.1	Very low	27.6	Very low	136 Å²	136	138.1 Å²	138.1	88%	0.883	81%	0.812	S	S	*	*			trans	-108.2	157	-178.7	37.7	-29.1	0	0	0	113.8
105	A	26.3	Very low	27.3	Very low	96 Å²	96	137.7 Å²	137.7	79%	0.793	81%	0.808	S	S	*	*			trans	-143	113.6	166.7	0	0	0	0	0	108.9
106	A	29.2	Very low	27.1	Very low	84 Å²	84	141.3 Å²	141.3	69%	0.694	81%	0.809	S	S	*	*				69.8	117.1	87.6	0	0	0	0	0	112.3
107	N	25.9	Very low	26.2	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	81%	0.811	S	S	*	*				170.6	155.9	74.3	-101.6	-28.4	0	0	0	106.6
108	K	24.9	Very low	26.1	Very low	178 Å²	178	147.2 Å²	147.2	77%	0.774	81%	0.812	S	S	*	*			cis	-170.4	128.4	43.1	-127.2	161	-171.9	-176.7	0	108.7
109	R	22.4	Very low	25.8	Very low	243 Å²	243	146.3 Å²	146.3	92%	0.917	80%	0.801	S	S	*	*			trans	-96.1	143.5	154.9	-79.2	-179.6	177.3	172.2	-1.7	107.4
110	I	23.5	Very low	25.6	Very low	154 Å²	154	141.5 Å²	141.5	79%	0.79	80%	0.802	S	S	*	*			trans	-114	125.6	170.8	-65.9	174.8	0	0	0	107.5
111	F	23.9	Very low	25.2	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.873	80%	0.804	S	S	*	*			trans	-122.2	137.5	161.9	-107.4	-79.7	0	0	0	106.9
112	C	22.9	Very low	25	Very low	118 Å²	118	141.7 Å²	141.7	80%	0.797	80%	0.804	S	S	*	*			trans	-173.7	142.1	153.2	-91	0	0	0	0	104.8
113	S	24.6	Very low	24.7	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	80%	0.797	S	S	*	*			cis	-177.8	147.4	0.5	40.9	0	0	0	0	106.7
114	D	23.3	Very low	24.6	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	80%	0.804	S	S	*	*			trans	-59.3	145.6	166.8	-79.4	-46.9	0	0	0	112.8
115	S	24.5	Very low	24.3	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	80%	0.795	S	S	*	*				167.1	131.6	117.4	47.5	0	0	0	0	114.3
116	L	24.7	Very low	24.2	Very low	153 Å²	153	147 Å²	147	80%	0.801	80%	0.795	S	S	*	*			trans	63	112.1	140.2	-61.3	166.6	0	0	0	119.9
117	L	26.4	Very low	23.9	Very low	179 Å²	179	151.7 Å²	151.7	94%	0.937	80%	0.8	S	S	*	*				-164	138	105.4	-99	161.7	0	0	0	112.4
118	E	23.3	Very low	23.8	Very low	149 Å²	149	150.6 Å²	150.6	70%	0.696	80%	0.799	S	S	*	*			trans	-81.4	161.1	-173.7	-103	177.9	133.9	0	0	114.7
119	N	23.8	Very low	23.7	Very low	130 Å²	130	151.2 Å²	151.2	70%	0.695	80%	0.802	S	S	*	*			trans	70.3	114	144.3	-64.5	-25.2	0	0	0	120.5
120	C	23.3	Very low	23.7	Very low	133 Å²	133	145.6 Å²	145.6	90%	0.899	80%	0.795	S	S	*	*				-169.3	147.4	98.3	-115.9	0	0	0	0	114.2
121	Q	21.5	Very low	23.7	Very low	170 Å²	170	144.8 Å²	144.8	79%	0.794	80%	0.797	S	S	*	*			trans	-80.3	-179.6	-174.7	-64.9	171.2	-27.8	0	0	114
122	I	22.5	Very low	23.7	Very low	156 Å²	156	146.5 Å²	146.5	80%	0.8	80%	0.797	S	S	*	*			trans	89.6	128.6	156.7	-50.7	170.5	0	0	0	113
123	S	23.7	Very low	23.7	Very low	100 Å²	100	153 Å²	153	70%	0.699	81%	0.805	S	S	*	*			cis	-159	148.7	24.2	32.7	0	0	0	0	111.1
124	K	25.1	Very low	23.7	Very low	206 Å²	206	152.1 Å²	152.1	90%	0.896	81%	0.805	S	S	*	*			trans	-64.1	129.1	153.6	-69.4	174.2	175.9	177	0	108.6
125	S	23.9	Very low	23.8	Very low	100 Å²	100	152.7 Å²	152.7	70%	0.699	81%	0.808	S	S	*	*			trans	-139.5	103.2	155.7	105.2	0	0	0	0	109.6
126	S	24.3	Very low	23.9	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	81%	0.812	S	S	*	*			trans	-67.1	124.9	165	-51.7	0	0	0	0	109
127	K	24.1	Very low	24	Very low	182 Å²	182	153.7 Å²	153.7	79%	0.791	82%	0.815	S	S	*	*			trans	-131	93.3	157.2	-79.9	-172	179.6	175.5	0	109.1
128	T	22.5	Very low	24	Very low	125 Å²	125	153.8 Å²	153.8	77%	0.767	81%	0.811	S	S	*	*			trans	-61.6	118.9	160.7	24.5	0	0	0	0	109.6
129	F	23.9	Very low	24.2	Very low	191 Å²	191	154.9 Å²	154.9	84%	0.838	82%	0.816	S	S	*	*			trans	-108.7	95.5	157.1	-91.3	-80.7	0	0	0	108.4
130	T	22.3	Very low	24.3	Very low	125 Å²	125	155 Å²	155	77%	0.767	82%	0.82	S	S	*	*			trans	-76.1	118.5	163.4	30.2	0	0	0	0	109.4
131	V	24.4	Very low	24.4	Very low	136 Å²	136	151.8 Å²	151.8	82%	0.824	81%	0.81	S	S	*	*			trans	-124	117.1	155.8	178.9	0	0	0	0	109
132	R	22.4	Very low	24.6	Very low	236 Å²	236	150.8 Å²	150.8	89%	0.891	82%	0.816	S	S	*	*			trans	-61.4	134.7	177	-65.7	168.4	168.9	172.1	-5.2	110.5
133	R	23.9	Very low	24.8	Very low	253 Å²	253	151 Å²	151	96%	0.955	82%	0.818	S	S	*	*			trans	-105.5	117.3	153.1	-95.8	-177.3	174	169.6	-1.2	108.3
134	A	24.9	Very low	25	Very low	95 Å²	95	152.6 Å²	152.6	79%	0.785	82%	0.823	S	S	*	*			trans	-81.3	143.3	178.9	0	0	0	0	0	110.7
135	N	24.1	Very low	25.1	Very low	169 Å²	169	153.8 Å²	153.8	90%	0.904	82%	0.822	S	S	*	*			trans	-70.4	140.3	158.8	-85.7	-13.3	0	0	0	109.9
136	S	28	Very low	25.2	Very low	118 Å²	118	157.7 Å²	157.7	83%	0.825	83%	0.826	S	S	*	*			trans	-151.9	116.9	147.5	54.9	0	0	0	0	109.5
137	N	26.6	Very low	25.3	Very low	161 Å²	161	159.4 Å²	159.4	86%	0.861	83%	0.827	S	S	*	*			trans	-82.1	171.8	160.9	-118.8	-2.7	0	0	0	109.2
138	E	26.5	Very low	25.4	Very low	180 Å²	180	155.8 Å²	155.8	84%	0.841	83%	0.825	S	S	*	*			trans	90.8	138.8	165.4	-60.1	-166.4	178	0	0	116.9
139	H	26.9	Very low	25.6	Very low	173 Å²	173	153.4 Å²	153.4	80%	0.801	82%	0.824	S	S	*	*			cis	-168.1	-177.3	-18.2	-145.2	64.5	0	0	0	106.1
140	V	26.3	Very low	25.8	Very low	131 Å²	131	151.8 Å²	151.8	79%	0.794	83%	0.825	S	S	*	*			trans	110	108.8	154.6	-170.5	0	0	0	0	115.8
141	G	25.6	Very low	26.1	Very low	66 Å²	66	149.9 Å²	149.9	68%	0.68	82%	0.817	S	S	*	*			trans	-87.5	175.3	168.2	0	0	0	0	0	113.5
142	T	25.7	Very low	26.4	Very low	150 Å²	150	153.3 Å²	153.3	92%	0.92	82%	0.82	S	S	*	*			trans	-143.8	137.8	158.1	-19.8	0	0	0	0	110.2
143	L	26.5	Very low	26.6	Very low	161 Å²	161	145.5 Å²	145.5	84%	0.843	81%	0.813	S	S	*	*			trans	-88	174.8	-178.3	-89.2	149.7	0	0	0	112.7
144	T	27.2	Very low	26.7	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	81%	0.807	S	S	*	*			trans	99.1	137.4	162.2	74.5	0	0	0	0	115
145	R	26.2	Very low	26.9	Very low	232 Å²	232	148.3 Å²	148.3	88%	0.875	82%	0.815	S	S	*	*			cis	-165.2	150.8	7.3	-139.7	176.3	175.6	177.4	-3.8	110.3
146	K	27.6	Very low	27	Very low	181 Å²	181	146 Å²	146	79%	0.787	81%	0.807	S	S	*	*			trans	-18.4	145.5	159.9	-71.9	173.8	167.1	-175.2	0	120.8
147	D	24.8	Very low	27	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	81%	0.813	S	S	*	*				-168.3	131.5	108.6	-98.7	-26.1	0	0	0	110
148	S	27.6	Very low	27.1	Very low	107 Å²	107	149.6 Å²	149.6	75%	0.748	81%	0.813	S	S	*	*				90.6	119	54.2	-53.7	0	0	0	0	113.9
149	G	26.1	Very low	26.9	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	81%	0.807	S	S	*	*			trans	148.7	83.6	165.8	0	0	0	0	0	113.5
150	D	27.9	Very low	27.1	Very low	158 Å²	158	141.5 Å²	141.5	85%	0.845	81%	0.807	S	S	*	*				51.6	137.2	87.3	-93.5	-25.1	0	0	0	115
151	S	29.7	Very low	27.1	Very low	85 Å²	85	142.4 Å²	142.4	59%	0.594	81%	0.813	S	S	*	*			cis	178.4	156.5	4.3	-123.8	0	0	0	0	109.9
152	K	30.2	Very low	27.1	Very low	207 Å²	207	142.6 Å²	142.6	90%	0.9	82%	0.815	S	S	*	*			trans	71.5	144.8	151.8	-62.7	168	-178.1	175.6	0	120.1
153	G	26.3	Very low	27.3	Very low	72 Å²	72	141.4 Å²	141.4	74%	0.742	81%	0.813	S	S	*	*			cis	169.2	146.4	-0.7	0	0	0	0	0	113.4
154	N	25.5	Very low	27.2	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	82%	0.817	S	S	*	*			trans	44.1	129.8	150.1	-84.1	-5	0	0	0	123.7
155	R	29.1	Very low	27.4	Very low	251 Å²	251	141.4 Å²	141.4	95%	0.947	82%	0.818	S	S	*	*				-166.4	143.1	109.9	-104.8	170.2	169.8	-178.3	-2.6	114.6
156	T	26.1	Very low	27.6	Very low	120 Å²	120	136 Å²	136	74%	0.736	82%	0.816	S	S	*	*			trans	-92.5	153	-171.6	46.6	0	0	0	0	114.5
157	R	29	Very low	27.5	Very low	252 Å²	252	130.9 Å²	130.9	95%	0.951	81%	0.814	S	S	*	*				-169.7	139.2	128.1	-114.5	176.4	175.4	174.7	-2.2	114
158	A	27.2	Very low	27.7	Very low	103 Å²	103	133.4 Å²	133.4	85%	0.851	82%	0.818	S	S	*	*			trans	-61.3	166.6	175.2	0	0	0	0	0	113.7
159	G	24.2	Very low	27.7	Very low	71 Å²	71	140 Å²	140	73%	0.732	83%	0.826	S	S	*	*			cis	157.8	145.1	1.9	0	0	0	0	0	108.8
160	S	29.3	Very low	27.8	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	83%	0.829	S	S	*	*			trans	-174.2	112.2	151.4	46.5	0	0	0	0	112.6
161	T	26.3	Very low	27.9	Very low	149 Å²	149	140.5 Å²	140.5	91%	0.914	82%	0.821	S	S	*	*			trans	30.2	120.2	140.5	52.8	0	0	0	0	121.7
162	G	26.8	Very low	28	Very low	70 Å²	70	141 Å²	141	72%	0.722	82%	0.824	S	S	*	*			trans	175.1	86.4	156.4	0	0	0	0	0	115.5
163	S	29.7	Very low	28.5	Very low	126 Å²	126	136.7 Å²	136.7	88%	0.881	82%	0.821	S	S	*	*			trans	54.6	112.7	156.4	54.5	0	0	0	0	121.8
164	N	25.2	Very low	29.3	Very low	175 Å²	175	141.5 Å²	141.5	94%	0.936	82%	0.821	S	S	*	*			trans	-58.1	128.5	159.2	-96	-12	0	0	0	112.8
165	S	30.4	Very low	30.8	Very low	117 Å²	117	140.6 Å²	140.6	82%	0.818	81%	0.812	S	S	*	*			trans	-138.1	130.6	134.1	66.8	0	0	0	0	108.5	G167	S165-G167 PolarHBondContact O-N 2.88Å; S165-G167 VanDerWaalsContact O-N 3.08Å
166	S	29.5	Very low	32.9	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	80%	0.8	S	S	*	*			trans	-67.1	100.7	-166.5	51	0	0	0	0	112.6	K168	S166-K168 PolarHBondContact O-N 2.96Å
167	G	26	Very low	35.6	Very low	73 Å²	73	136.6 Å²	136.6	75%	0.753	79%	0.791	S	S	*	*			trans	-71.8	104.1	165	0	0	0	0	0	110.8	S165 R169	S165-G167 PolarHBondContact O-N 2.88Å; S165-G167 VanDerWaalsContact O-N 3.08Å; G167-R169 PolarHBondContact O-N 2.88Å
168	K	30.3	Very low	38.3	Very low	204 Å²	204	125.1 Å²	125.1	89%	0.887	75%	0.749	S	S	*	*			trans	-67.1	111.1	155.3	-86	-177.7	176.8	177.3	0	106.9	S166 S170	S166-K168 PolarHBondContact O-N 2.96Å; K168-S170 PolarHBondContact O-N 2.7Å; K168-S170 VanDerWaalsContact O-N 3.17Å
169	R	27.4	Very low	41.3	Very low	244 Å²	244	123.9 Å²	123.9	92%	0.921	73%	0.731	S	S	*	*			trans	-52.6	117.7	165.7	-71.2	177.3	174	-179.4	-3.2	107.9	G167 D171	G167-R169 PolarHBondContact O-N 2.88Å; R169-D171 PolarHBondContact O-N 3.01Å; R169-D171 VanDerWaalsContact O-N 3.15Å
170	S	27.6	Very low	44.5	Very low	119 Å²	119	123.2 Å²	123.2	83%	0.832	71%	0.707	S	S	*	*			trans	-66.8	108.6	172.7	56	0	0	0	0	108.5	K168	K168-S170 PolarHBondContact O-N 2.7Å; K168-S170 VanDerWaalsContact O-N 3.17Å
171	D	29.5	Very low	47.4	Very low	124 Å²	124	119.5 Å²	119.5	66%	0.663	68%	0.679	S	S	*	*			trans	-55.8	139.4	166.9	-156.4	9.4	0	0	0	109.1	R169	R169-D171 PolarHBondContact O-N 3.01Å; R169-D171 VanDerWaalsContact O-N 3.15Å
172	S	33.1	Very low	50.3	Low	95 Å²	95	115.3 Å²	115.3	66%	0.664	66%	0.659	S	S	*	*	S	Bend	trans	-49.4	139.2	177	44.7	0	0	0	0	111.9	K174	S172-K174 PolarHBondContact O-N 2.92Å
173	S	40.2	Very low	53.2	Low	118 Å²	118	120.8 Å²	120.8	83%	0.825	67%	0.666	S	S	*	*			trans	-33.4	93.2	-179.2	55.4	0	0	0	0	115.7
174	K	43.8	Very low	55.9	Low	172 Å²	172	119.9 Å²	119.9	75%	0.748	65%	0.648	S	S	*	*			trans	-82.6	109.7	155.8	-74.2	179.4	179.6	169.8	0	107.6	S172	S172-K174 PolarHBondContact O-N 2.92Å
175	Q	57.3	Low	59	Low	137 Å²	137	111.6 Å²	111.6	64%	0.64	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-56.5	138.6	169.6	-71.6	176.4	-11.1	0	0	109
176	R	71.9	Confident	62	Low	186 Å²	186	107.1 Å²	107.1	70%	0.702	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-98.1	126.3	-179.3	-68.7	-171.8	-172.1	-169.8	4.1	108.9	F190	R176-F190 HydrophobicContact CB-CD1 4.39Å; R176-F190 HydrophobicContact CB-CD2 3.63Å; R176-F190 HydrophobicContact CB-CE1 4.49Å; R176-F190 HydrophobicContact CB-CE2 3.77Å; R176-F190 HydrophobicContact CB-CG 3.96Å; R176-F190 HydrophobicContact CB-CZ 4.21Å; R176-F190 WeakPolarHBondContact O-CD2 3.18Å
177	D	82.5	Confident	65	Low	102 Å²	102	101.4 Å²	101.4	55%	0.545	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-60.1	153.8	169.8	-67.9	-25.2	0	0	0	110.4	F190	D177-F190 WeakPolarHBondContact O-CE2 3.39Å
178	P	85.3	Confident	68.2	Low	11 Å²	11	100.4 Å²	100.4	7%	0.071	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-58.6	153.5	175.6	23.7	-32.6	0	0	0	111.5	V187 K188 L210 F774	P178-V187 HydrophobicContact CB-CG1 4.12Å; P178-K188 CarbonylContact C-O 3.56Å; P178-K188 WeakPolarHBondContact CA-O 3.27Å; P178-K188 WeakPolarHBondContact CB-O 3.27Å; P178-L210 HydrophobicContact CB-CD1 4.39Å; P178-L210 HydrophobicContact CG-CD1 4.19Å; P178-L210 WeakPolarHBondContact O-CD2 3.13Å; P178-F774 HydrophobicContact CG-CB 3.84Å; P178-F774 HydrophobicContact CG-CD1 3.86Å; P178-F774 HydrophobicContact CG-CD2 3.58Å; P178-F774 HydrophobicContact CG-CE1 4.27Å; P178-F774 HydrophobicContact CG-CE2 4.04Å; P178-F774 HydrophobicContact CG-CG 3.48Å; P178-F774 VanDerWaalsContact CG-CG 3.48Å; P178-F774 HydrophobicContact CG-CZ 4.35Å
179	V	90.8	Very high	71.1	Confident	77 Å²	77	91.3 Å²	91.3	47%	0.467	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.4	-178.9	-179.2	0	0	0	0	109.6	V187 K188 F190	V179-V187 CarbonylContact O-C 3.56Å; V179-V187 WeakPolarHBondContact O-CA 3.45Å; V179-K188 PolarHBondContact N-O 3.24Å; V179-K188 PolarHBondContact O-N 2.9Å; V179-F190 HydrophobicContact CG2-CE2 4.2Å
180	F	91.7	Very high	74	Confident	56 Å²	56	81.6 Å²	81.6	25%	0.246	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.9	172.6	171.3	-129.4	0	0	0	110.5	A182 Y186 V187 M200 Y208 L210	F180-A182 HydrophobicContact CE1-CB 3.95Å; F180-A182 HydrophobicContact CZ-CB 3.85Å; F180-Y186 WeakPolarHBondContact CD2-O 3.32Å; F180-V187 HydrophobicContact CB-CG2 4.48Å; F180-V187 HydrophobicContact CD2-CG2 4.19Å; F180-M200 HydrophobicContact CD2-CE 3.6Å; F180-M200 HydrophobicContact CE2-CE 3.35Å; F180-M200 HydrophobicContact CE2-SD 3.96Å; F180-M200 HydrophobicContact CZ-CE 4.47Å; F180-Y208 HydrophobicContact CB-CE1 4.41Å; F180-Y208 HydrophobicContact CD1-CD1 4.15Å; F180-Y208 AromaticContact CD2-CD1 3.7Å; F180-Y208 HydrophobicContact CD2-CD1 3.7Å; F180-Y208 HydrophobicContact CD2-CE1 4.08Å; F180-Y208 HydrophobicContact CE1-CD1 4.2Å; F180-Y208 AromaticContact CE2-CD1 3.8Å; F180-Y208 HydrophobicContact CE2-CD1 3.8Å; F180-Y208 AromaticContact CG-CD1 3.9Å; F180-Y208 HydrophobicContact CG-CD1 3.9Å; F180-Y208 HydrophobicContact CG-CE1 4.16Å; F180-Y208 HydrophobicContact CZ-CD1 4.04Å; F180-L210 HydrophobicContact CB-CB 4.21Å; F180-L210 HydrophobicContact CB-CD2 4.34Å
181	N	90.8	Very high	76.8	Confident	35 Å²	35	76.1 Å²	76.1	19%	0.187	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	109.1	171.9	-176.4	-23.3	0	0	0	109.4	E183 E184 G185 Y186	N181-E183 WeakPolarHBondContact OD1-CB 3.34Å; N181-E183 PolarHBondContact OD1-N 3.18Å; N181-E184 PolarHBondContact OD1-N 3.09Å; N181-G185 WeakPolarHBondContact O-CA 3.07Å; N181-G185 PolarHBondContact O-N 3.07Å; N181-Y186 HydrophobicContact CB-CD1 4.11Å; N181-Y186 HydrophobicContact CB-CD2 4.11Å; N181-Y186 HydrophobicContact CB-CE1 3.73Å; N181-Y186 HydrophobicContact CB-CE2 3.73Å; N181-Y186 HydrophobicContact CB-CG 4.29Å; N181-Y186 PolarHBondContact N-O 2.82Å; N181-Y186 PolarHBondContact ND2-OH 2.89Å; N181-Y186 PolarHBondContact O-N 3.15Å; N181-Y186 VanDerWaalsContact O-N 3.15Å
182	A	87	Confident	79.3	Confident	61 Å²	61	77.3 Å²	77.3	50%	0.504	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-29.3	179.7	0	0	0	0	0	113.4	F180 V205	F180-A182 HydrophobicContact CE1-CB 3.95Å; F180-A182 HydrophobicContact CZ-CB 3.85Å; A182-V205 WeakPolarHBondContact O-CG1 3.41Å
183	E	86.9	Confident	81.6	Confident	186 Å²	186	75.7 Å²	75.7	87%	0.869	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-43.4	-178.3	-62.8	-177	171.1	0	0	111.7	N181	N181-E183 WeakPolarHBondContact OD1-CB 3.34Å; N181-E183 PolarHBondContact OD1-N 3.18Å
184	E	86.4	Confident	83.8	Confident	106 Å²	106	76.3 Å²	76.3	50%	0.495	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-16.1	-179.9	-69.1	-173.3	-156.5	0	0	113.1	N181 Y186 R715	N181-E184 PolarHBondContact OD1-N 3.09Å; E184-Y186 HydrophobicContact CB-CD1 3.53Å; E184-Y186 HydrophobicContact CB-CE1 3.56Å; E184-Y186 HydrophobicContact CG-CE1 4.22Å; E184-Y186 WeakPolarHBondContact OE2-CE1 3.14Å; E184-R715 PolarHBondContact O-NH1 3.4Å; E184-R715 PolarHBondContact O-NH2 3.16Å
185	G	91	Very high	86	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.01	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	52.9	178.2	0	0	0	0	0	113.3	N181 M200	N181-G185 WeakPolarHBondContact O-CA 3.07Å; N181-G185 PolarHBondContact O-N 3.07Å; G185-M200 WeakPolarHBondContact O-CG 3.49Å; G185-M200 PolarHBondContact O-N 3.29Å
186	Y	92.4	Very high	87.7	Confident	23 Å²	23	65.6 Å²	65.6	9%	0.09	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.4	177.2	68.9	-105.3	0	0	0	113.6	F180 N181 E184 K188 T197 M198 F199	F180-Y186 WeakPolarHBondContact CD2-O 3.32Å; N181-Y186 HydrophobicContact CB-CD1 4.11Å; N181-Y186 HydrophobicContact CB-CD2 4.11Å; N181-Y186 HydrophobicContact CB-CE1 3.73Å; N181-Y186 HydrophobicContact CB-CE2 3.73Å; N181-Y186 HydrophobicContact CB-CG 4.29Å; N181-Y186 PolarHBondContact N-O 2.82Å; N181-Y186 PolarHBondContact ND2-OH 2.89Å; N181-Y186 PolarHBondContact O-N 3.15Å; N181-Y186 VanDerWaalsContact O-N 3.15Å; E184-Y186 HydrophobicContact CB-CD1 3.53Å; E184-Y186 HydrophobicContact CB-CE1 3.56Å; E184-Y186 HydrophobicContact CG-CE1 4.22Å; E184-Y186 WeakPolarHBondContact OE2-CE1 3.14Å; Y186-K188 HydrophobicContact CD2-CB 4.16Å; Y186-K188 HydrophobicContact CE2-CB 3.94Å; Y186-K188 PolarHBondContact OH-NZ 2.84Å; Y186-K188 VanDerWaalsContact OH-NZ 3.16Å; Y186-T197 HydrophobicContact CD1-CG2 4.05Å; Y186-T197 HydrophobicContact CD2-CG2 3.64Å; Y186-T197 HydrophobicContact CE1-CG2 4.45Å; Y186-T197 HydrophobicContact CE2-CG2 4.11Å; Y186-T197 HydrophobicContact CG-CG2 3.61Å; Y186-M198 CarbonylContact C-O 3.56Å; Y186-M198 VanDerWaalsContact CA-O 3.27Å; Y186-M198 WeakPolarHBondContact CA-O 3.34Å; Y186-M198 VanDerWaalsContact CB-O 3.3Å; Y186-M198 WeakPolarHBondContact CB-O 3.5Å; Y186-F199 HydrophobicContact CD1-CD1 4.37Å; Y186-F199 AromaticContact CD1-CE1 3.87Å; Y186-F199 HydrophobicContact CD1-CE1 3.87Å; Y186-F199 HydrophobicContact CG-CE1 4.34Å
187	V	92.9	Very high	88.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.5	163.4	176.3	0	0	0	0	109.1	P178 V179 F180 M198 M200 Y208 L210 F728 F731	P178-V187 HydrophobicContact CB-CG1 4.12Å; V179-V187 CarbonylContact O-C 3.56Å; V179-V187 WeakPolarHBondContact O-CA 3.45Å; F180-V187 HydrophobicContact CB-CG2 4.48Å; F180-V187 HydrophobicContact CD2-CG2 4.19Å; V187-M198 HydrophobicContact CG1-CE 4.38Å; V187-M198 PolarHBondContact N-O 2.92Å; V187-M198 PolarHBondContact O-N 3.22Å; V187-M200 HydrophobicContact CG2-CE 3.75Å; V187-Y208 HydrophobicContact CG2-CD1 4.4Å; V187-Y208 HydrophobicContact CG2-CE1 3.54Å; V187-L210 HydrophobicContact CG1-CD1 4.37Å; V187-F728 HydrophobicContact CB-CD2 4.33Å; V187-F728 HydrophobicContact CB-CE2 4.44Å; V187-F728 HydrophobicContact CG2-CD2 4.13Å; V187-F728 HydrophobicContact CG2-CE2 3.76Å; V187-F731 HydrophobicContact CG1-CE1 4.34Å; V187-F731 HydrophobicContact CG1-CE2 4.08Å; V187-F731 HydrophobicContact CG1-CZ 3.91Å
188	K	92.7	Very high	89.3	Confident	52 Å²	52	54.4 Å²	54.4	23%	0.226	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	112.3	178.2	-175.8	173.1	-74	161	0	109.4	P178 V179 Y186 F190 P195 V196 T197	P178-K188 CarbonylContact C-O 3.56Å; P178-K188 WeakPolarHBondContact CA-O 3.27Å; P178-K188 WeakPolarHBondContact CB-O 3.27Å; V179-K188 PolarHBondContact N-O 3.24Å; V179-K188 PolarHBondContact O-N 2.9Å; Y186-K188 HydrophobicContact CD2-CB 4.16Å; Y186-K188 HydrophobicContact CE2-CB 3.94Å; Y186-K188 PolarHBondContact OH-NZ 2.84Å; Y186-K188 VanDerWaalsContact OH-NZ 3.16Å; K188-F190 HydrophobicContact CD-CZ 4.38Å; K188-F190 HydrophobicContact CG-CZ 4.37Å; K188-P195 HydrophobicContact CD-CB 3.75Å; K188-P195 HydrophobicContact CG-CB 3.79Å; K188-V196 CarbonylContact C-O 3.55Å; K188-V196 WeakPolarHBondContact CA-O 3.36Å; K188-T197 VanDerWaalsContact CE-OG1 3.23Å; K188-T197 WeakPolarHBondContact CE-OG1 3.38Å
189	M	91.6	Very high	89.7	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.059	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	156	175.6	175.8	172.2	67.5	0	0	109.9	L191 P195 V196 M198 L726 F731 W734	M189-L191 HydrophobicContact CE-CD1 4.04Å; M189-L191 HydrophobicContact CE-CD2 4.28Å; M189-L191 HydrophobicContact CE-CG 4.1Å; M189-L191 HydrophobicContact SD-CD2 4.45Å; M189-P195 CarbonylContact O-C 3.52Å; M189-P195 WeakPolarHBondContact O-CA 3.44Å; M189-V196 PolarHBondContact N-O 2.8Å; M189-V196 PolarHBondContact O-N 2.87Å; M189-M198 HydrophobicContact CB-CE 3.56Å; M189-M198 HydrophobicContact CE-CE 4.25Å; M189-M198 HydrophobicContact CE-SD 4.35Å; M189-L726 HydrophobicContact CE-CD2 4.13Å; M189-F731 HydrophobicContact CE-CB 4.34Å; M189-F731 HydrophobicContact SD-CB 4.28Å; M189-F731 HydrophobicContact SD-CD2 4.29Å; M189-W734 VanDerWaalsContact CE-CD1 3.48Å; M189-W734 HydrophobicContact CE-CG 4.02Å; M189-W734 HydrophobicContact SD-CB 3.9Å; M189-W734 HydrophobicContact SD-CG 3.93Å
190	F	89.3	Confident	89.8	Confident	41 Å²	41	52.5 Å²	52.5	18%	0.18	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	115.6	177.6	-62.1	-90.3	0	0	0	110.5	R176 D177 V179 K188 R194 P195	R176-F190 HydrophobicContact CB-CD1 4.39Å; R176-F190 HydrophobicContact CB-CD2 3.63Å; R176-F190 HydrophobicContact CB-CE1 4.49Å; R176-F190 HydrophobicContact CB-CE2 3.77Å; R176-F190 HydrophobicContact CB-CG 3.96Å; R176-F190 HydrophobicContact CB-CZ 4.21Å; R176-F190 WeakPolarHBondContact O-CD2 3.18Å; D177-F190 WeakPolarHBondContact O-CE2 3.39Å; V179-F190 HydrophobicContact CG2-CE2 4.2Å; K188-F190 HydrophobicContact CD-CZ 4.38Å; K188-F190 HydrophobicContact CG-CZ 4.37Å; F190-R194 WeakPolarHBondContact CA-O 3.14Å; F190-P195 HydrophobicContact CD1-CB 4.05Å; F190-P195 HydrophobicContact CE1-CB 3.82Å
191	L	86.8	Confident	89.8	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.7	172.2	-65.4	176.5	0	0	0	108.4	M189 G193 R194 V196 Y695 L726 W734	M189-L191 HydrophobicContact CE-CD1 4.04Å; M189-L191 HydrophobicContact CE-CD2 4.28Å; M189-L191 HydrophobicContact CE-CG 4.1Å; M189-L191 HydrophobicContact SD-CD2 4.45Å; L191-G193 PolarHBondContact O-N 3.48Å; L191-R194 PolarHBondContact N-O 2.86Å; L191-R194 WeakPolarHBondContact O-CB 3.38Å; L191-R194 PolarHBondContact O-N 3.21Å; L191-V196 HydrophobicContact CD1-CG2 4.27Å; L191-Y695 HydrophobicContact CB-CD2 4.13Å; L191-Y695 HydrophobicContact CB-CE2 4.21Å; L191-Y695 HydrophobicContact CD1-CG 4.32Å; L191-L726 HydrophobicContact CD1-CD2 3.68Å; L191-W734 HydrophobicContact CD1-CZ2 4.49Å; L191-W734 HydrophobicContact CD2-CD2 4.11Å; L191-W734 HydrophobicContact CD2-CE3 4.08Å; L191-W734 HydrophobicContact CD2-CG 4.4Å
192	K	81.4	Confident	89.8	Confident	149 Å²	149	53.7 Å²	53.7	65%	0.648	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	33.1	-171.1	-78.4	-173.6	166.2	152.3	0	114.5	R194 D739	K192-R194 VanDerWaalsContact C-N 3.25Å; K192-R194 PolarHBondContact O-N 2.96Å; K192-D739 WeakPolarHBondContact CD-OD1 3.25Å; K192-D739 WeakPolarHBondContact CE-OD1 3.38Å; K192-D739 WeakPolarHBondContact CE-OD2 3.16Å; K192-D739 IonicContact NZ-OD1 3.17Å; K192-D739 PolarHBondContact NZ-OD1 3.24Å; K192-D739 IonicContact NZ-OD2 2.67Å; K192-D739 PolarHBondContact NZ-OD2 3.1Å
193	G	80.9	Confident	89.8	Confident	61 Å²	61	57.3 Å²	57.3	63%	0.629	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-4.2	-177.7	0	0	0	0	0	115.4	L191	L191-G193 PolarHBondContact O-N 3.48Å
194	R	86.1	Confident	89.9	Confident	132 Å²	132	50.9 Å²	50.9	50%	0.498	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	128	168.5	-69.9	-172.4	176.6	-175.6	1.2	109.8	F190 L191 K192 D694	F190-R194 WeakPolarHBondContact CA-O 3.14Å; L191-R194 PolarHBondContact N-O 2.86Å; L191-R194 WeakPolarHBondContact O-CB 3.38Å; L191-R194 PolarHBondContact O-N 3.21Å; K192-R194 VanDerWaalsContact C-N 3.25Å; K192-R194 PolarHBondContact O-N 2.96Å; R194-D694 IonicContact CZ-OD1 3.77Å; R194-D694 IonicContact NH1-OD1 2.99Å; R194-D694 PolarHBondContact NH1-OD1 2.97Å
195	P	90.3	Very high	90	Very high	77 Å²	77	46.7 Å²	46.7	50%	0.5	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.8	177.4	29.5	-31.5	0	0	0	111.6	K188 M189 F190	K188-P195 HydrophobicContact CD-CB 3.75Å; K188-P195 HydrophobicContact CG-CB 3.79Å; M189-P195 CarbonylContact O-C 3.52Å; M189-P195 WeakPolarHBondContact O-CA 3.44Å; F190-P195 HydrophobicContact CD1-CB 4.05Å; F190-P195 HydrophobicContact CE1-CB 3.82Å
196	V	92.7	Very high	89.9	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.2	171.1	-175.5	0	0	0	0	108.2	K188 M189 L191 M198 I697	K188-V196 CarbonylContact C-O 3.55Å; K188-V196 WeakPolarHBondContact CA-O 3.36Å; M189-V196 PolarHBondContact N-O 2.8Å; M189-V196 PolarHBondContact O-N 2.87Å; L191-V196 HydrophobicContact CD1-CG2 4.27Å; V196-M198 HydrophobicContact CG1-CG 4.3Å; V196-I697 HydrophobicContact CG1-CD1 4.05Å; V196-I697 HydrophobicContact CG1-CG1 4.41Å
197	T	93.9	Very high	89.6	Confident	51 Å²	51	57.9 Å²	57.9	31%	0.313	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.3	-177	-55.9	0	0	0	0	110	Y186 K188 F199	Y186-T197 HydrophobicContact CD1-CG2 4.05Å; Y186-T197 HydrophobicContact CD2-CG2 3.64Å; Y186-T197 HydrophobicContact CE1-CG2 4.45Å; Y186-T197 HydrophobicContact CE2-CG2 4.11Å; Y186-T197 HydrophobicContact CG-CG2 3.61Å; K188-T197 VanDerWaalsContact CE-OG1 3.23Å; K188-T197 WeakPolarHBondContact CE-OG1 3.38Å; T197-F199 HydrophobicContact CG2-CE1 4.44Å; T197-F199 HydrophobicContact CG2-CE2 4.14Å; T197-F199 HydrophobicContact CG2-CZ 4Å
198	M	94.1	Very high	89.5	Confident	2 Å²	2	59 Å²	59	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	112.3	-174.9	-61.6	170.7	-67.9	0	0	109.6	Y186 V187 M189 V196 I697 F728 F731	Y186-M198 CarbonylContact C-O 3.56Å; Y186-M198 VanDerWaalsContact CA-O 3.27Å; Y186-M198 WeakPolarHBondContact CA-O 3.34Å; Y186-M198 VanDerWaalsContact CB-O 3.3Å; Y186-M198 WeakPolarHBondContact CB-O 3.5Å; V187-M198 HydrophobicContact CG1-CE 4.38Å; V187-M198 PolarHBondContact N-O 2.92Å; V187-M198 PolarHBondContact O-N 3.22Å; M189-M198 HydrophobicContact CB-CE 3.56Å; M189-M198 HydrophobicContact CE-CE 4.25Å; M189-M198 HydrophobicContact CE-SD 4.35Å; V196-M198 HydrophobicContact CG1-CG 4.3Å; M198-I697 HydrophobicContact CG-CD1 3.73Å; M198-F728 HydrophobicContact CB-CB 4.1Å; M198-F731 HydrophobicContact CE-CB 3.53Å; M198-F731 HydrophobicContact CE-CD1 4.15Å; M198-F731 HydrophobicContact CE-CD2 4.03Å; M198-F731 HydrophobicContact CE-CG 3.64Å; M198-F731 HydrophobicContact SD-CB 3.47Å; M198-F731 WeakPolarHBondContact SD-CB 3.38Å; M198-F731 HydrophobicContact SD-CG 4.15Å
199	F	93.3	Very high	89.2	Confident	48 Å²	48	59.3 Å²	59.3	21%	0.211	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.8	-179.7	-64.3	-80.2	0	0	0	110.9	Y186 T197 V711 R715 F728	Y186-F199 HydrophobicContact CD1-CD1 4.37Å; Y186-F199 AromaticContact CD1-CE1 3.87Å; Y186-F199 HydrophobicContact CD1-CE1 3.87Å; Y186-F199 HydrophobicContact CG-CE1 4.34Å; T197-F199 HydrophobicContact CG2-CE1 4.44Å; T197-F199 HydrophobicContact CG2-CE2 4.14Å; T197-F199 HydrophobicContact CG2-CZ 4Å; F199-V711 HydrophobicContact CB-CG1 3.98Å; F199-V711 HydrophobicContact CD1-CG1 3.32Å; F199-V711 HydrophobicContact CD2-CG1 3.61Å; F199-V711 HydrophobicContact CD2-CG2 4.3Å; F199-V711 HydrophobicContact CE1-CG1 3.58Å; F199-V711 HydrophobicContact CE1-CG2 4.34Å; F199-V711 HydrophobicContact CE2-CG1 3.84Å; F199-V711 HydrophobicContact CE2-CG2 3.81Å; F199-V711 HydrophobicContact CG-CG1 3.33Å; F199-V711 HydrophobicContact CZ-CG1 3.83Å; F199-V711 HydrophobicContact CZ-CG2 3.83Å; F199-R715 HydrophobicContact CB-CB 4.03Å; F199-F728 WeakPolarHBondContact O-CB 3.36Å
200	M	92.8	Very high	88.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-100.6	158.4	176.2	72	-171.3	69.7	0	0	111.5	F180 G185 V187 V205 Y208 F728	F180-M200 HydrophobicContact CD2-CE 3.6Å; F180-M200 HydrophobicContact CE2-CE 3.35Å; F180-M200 HydrophobicContact CE2-SD 3.96Å; F180-M200 HydrophobicContact CZ-CE 4.47Å; G185-M200 WeakPolarHBondContact O-CG 3.49Å; G185-M200 PolarHBondContact O-N 3.29Å; V187-M200 HydrophobicContact CG2-CE 3.75Å; M200-V205 HydrophobicContact CG-CG2 3.57Å; M200-V205 HydrophobicContact SD-CB 4.33Å; M200-V205 HydrophobicContact SD-CG2 3.95Å; M200-Y208 HydrophobicContact CE-CD1 3.89Å; M200-Y208 HydrophobicContact CE-CE1 4.26Å; M200-Y208 HydrophobicContact CE-CG 4.14Å; M200-Y208 HydrophobicContact SD-CD1 4.36Å; M200-Y208 HydrophobicContact SD-CG 4.05Å; M200-F728 HydrophobicContact CB-CD1 3.53Å; M200-F728 HydrophobicContact CB-CD2 3.76Å; M200-F728 HydrophobicContact CB-CE1 3.47Å; M200-F728 VanDerWaalsContact CB-CE1 3.47Å; M200-F728 HydrophobicContact CB-CE2 3.7Å; M200-F728 HydrophobicContact CB-CG 3.67Å; M200-F728 HydrophobicContact CB-CZ 3.54Å; M200-F728 HydrophobicContact CE-CD2 4.23Å; M200-F728 HydrophobicContact CE-CE2 3.56Å; M200-F728 HydrophobicContact CE-CZ 4Å; M200-F728 HydrophobicContact CG-CZ 4.41Å; M200-F728 HydrophobicContact SD-CE2 4.23Å; M200-F728 HydrophobicContact SD-CZ 4.08Å
201	P	92.8	Very high	88.5	Confident	14 Å²	14	67.5 Å²	67.5	9%	0.091	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-59.6	144.5	174.1	-24.5	35.2	0	0	0	112.1	H203 Q204 D716	P201-H203 WeakPolarHBondContact CB-CE1 3.32Å; P201-H203 WeakPolarHBondContact CB-ND1 3.17Å; P201-H203 PolarHBondContact O-N 3.26Å; P201-H203 VanDerWaalsContact O-N 3.17Å; P201-Q204 HydrophobicContact CB-CG 4.43Å; P201-Q204 PolarHBondContact O-N 3.04Å; P201-D716 WeakPolarHBondContact CA-OD1 3.32Å; P201-D716 WeakPolarHBondContact CB-OD1 3.3Å
202	K	90.2	Very high	88.4	Confident	102 Å²	102	69.2 Å²	69.2	44%	0.443	37%	0.372	S	S	.	.	H	α-helix	trans	-56.5	-39.1	-174.6	-68.1	-176.3	-180	178.4	0	112.8	Q204 V205 D716	K202-Q204 PolarHBondContact O-N 2.78Å; K202-V205 PolarHBondContact O-N 3.11Å; K202-D716 PolarHBondContact N-OD1 3.36Å
203	H	88.4	Confident	88.3	Confident	137 Å²	137	73.4 Å²	73.4	63%	0.634	38%	0.384	S	S	*	.	H	α-helix	trans	-66.8	-15.8	-178.7	69.7	-85.8	0	0	0	114.1	P201	P201-H203 WeakPolarHBondContact CB-CE1 3.32Å; P201-H203 WeakPolarHBondContact CB-ND1 3.17Å; P201-H203 PolarHBondContact O-N 3.26Å; P201-H203 VanDerWaalsContact O-N 3.17Å
204	Q	87.9	Confident	88.2	Confident	50 Å²	50	71.4 Å²	71.4	23%	0.234	36%	0.363	C	S	.	.	H	α-helix	trans	-96.7	-22.5	-179.5	-61	-171.2	-10.1	0	0	112.9	P201 K202 D206 S207 Y208	P201-Q204 HydrophobicContact CB-CG 4.43Å; P201-Q204 PolarHBondContact O-N 3.04Å; K202-Q204 PolarHBondContact O-N 2.78Å; Q204-D206 VanDerWaalsContact C-N 3.35Å; Q204-D206 PolarHBondContact O-N 2.71Å; Q204-S207 PolarHBondContact O-N 3.38Å; Q204-S207 VanDerWaalsContact O-N 3.12Å; Q204-S207 PolarHBondContact O-OG 3.06Å; Q204-Y208 WeakPolarHBondContact O-CB 3.44Å; Q204-Y208 PolarHBondContact O-N 3.31Å
205	V	89.3	Confident	88.3	Confident	18 Å²	18	72.7 Å²	72.7	11%	0.109	38%	0.375	C	S	.	.	H	α-helix	trans	-54.7	-47.6	-172.8	-179.4	0	0	0	0	112.1	A182 M200 K202 S207 Y208	A182-V205 WeakPolarHBondContact O-CG1 3.41Å; M200-V205 HydrophobicContact CG-CG2 3.57Å; M200-V205 HydrophobicContact SD-CB 4.33Å; M200-V205 HydrophobicContact SD-CG2 3.95Å; K202-V205 PolarHBondContact O-N 3.11Å; V205-S207 VanDerWaalsContact C-N 3.26Å; V205-S207 PolarHBondContact O-N 2.95Å; V205-Y208 PolarHBondContact O-N 2.85Å
206	D	87.3	Confident	88.3	Confident	161 Å²	161	73.5 Å²	73.5	86%	0.861	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.9	-175	-61.3	-28.4	0	0	0	113.1	Q204	Q204-D206 VanDerWaalsContact C-N 3.35Å; Q204-D206 PolarHBondContact O-N 2.71Å
207	S	87.9	Confident	88.2	Confident	98 Å²	98	73.6 Å²	73.6	69%	0.685	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-9.3	-176.2	63.7	0	0	0	0	113.9	Q204 V205	Q204-S207 PolarHBondContact O-N 3.38Å; Q204-S207 VanDerWaalsContact O-N 3.12Å; Q204-S207 PolarHBondContact O-OG 3.06Å; V205-S207 VanDerWaalsContact C-N 3.26Å; V205-S207 PolarHBondContact O-N 2.95Å
208	Y	89.8	Confident	87.9	Confident	24 Å²	24	76.4 Å²	76.4	9%	0.094	40%	0.397	C	S	.	.			trans	-77.1	131.8	-172	-175	-99.4	0	0	0	111.4	F180 V187 M200 Q204 V205 L210 F728 F731 S772	F180-Y208 HydrophobicContact CB-CE1 4.41Å; F180-Y208 HydrophobicContact CD1-CD1 4.15Å; F180-Y208 AromaticContact CD2-CD1 3.7Å; F180-Y208 HydrophobicContact CD2-CD1 3.7Å; F180-Y208 HydrophobicContact CD2-CE1 4.08Å; F180-Y208 HydrophobicContact CE1-CD1 4.2Å; F180-Y208 AromaticContact CE2-CD1 3.8Å; F180-Y208 HydrophobicContact CE2-CD1 3.8Å; F180-Y208 AromaticContact CG-CD1 3.9Å; F180-Y208 HydrophobicContact CG-CD1 3.9Å; F180-Y208 HydrophobicContact CG-CE1 4.16Å; F180-Y208 HydrophobicContact CZ-CD1 4.04Å; V187-Y208 HydrophobicContact CG2-CD1 4.4Å; V187-Y208 HydrophobicContact CG2-CE1 3.54Å; M200-Y208 HydrophobicContact CE-CD1 3.89Å; M200-Y208 HydrophobicContact CE-CE1 4.26Å; M200-Y208 HydrophobicContact CE-CG 4.14Å; M200-Y208 HydrophobicContact SD-CD1 4.36Å; M200-Y208 HydrophobicContact SD-CG 4.05Å; Q204-Y208 WeakPolarHBondContact O-CB 3.44Å; Q204-Y208 PolarHBondContact O-N 3.31Å; V205-Y208 PolarHBondContact O-N 2.85Å; Y208-L210 HydrophobicContact CE1-CB 4.33Å; Y208-L210 HydrophobicContact CE1-CD1 4.34Å; Y208-F728 HydrophobicContact CD2-CE2 4.34Å; Y208-F728 AromaticContact CD2-CZ 3.81Å; Y208-F728 HydrophobicContact CD2-CZ 3.81Å; Y208-F728 AromaticContact CE2-CE2 3.89Å; Y208-F728 HydrophobicContact CE2-CE2 3.89Å; Y208-F728 AromaticContact CE2-CZ 3.63Å; Y208-F728 HydrophobicContact CE2-CZ 3.63Å; Y208-F728 AromaticContact CZ-CE2 3.99Å; Y208-F731 WeakPolarHBondContact OH-CZ 3.28Å; Y208-S772 WeakPolarHBondContact CE2-O 3.42Å; Y208-S772 PolarHBondContact OH-O 3.24Å
209	S	86.7	Confident	87.8	Confident	59 Å²	59	78.7 Å²	78.7	41%	0.413	41%	0.409	S	S	.	.			trans	-126.5	128.1	171	177.8	0	0	0	0	109.1	E211 A212 Q773	S209-E211 VanDerWaalsContact C-N 3.28Å; S209-E211 PolarHBondContact O-N 3.23Å; S209-E211 PolarHBondContact OG-N 2.86Å; S209-A212 WeakPolarHBondContact O-CB 3.37Å; S209-A212 PolarHBondContact O-N 2.85Å; S209-Q773 PolarHBondContact O-OE1 2.98Å
210	L	83.9	Confident	87.8	Confident	43 Å²	43	81.8 Å²	81.8	23%	0.225	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.8	179	-173.4	67	0	0	0	112.7	P178 F180 V187 Y208 A212	P178-L210 HydrophobicContact CB-CD1 4.39Å; P178-L210 HydrophobicContact CG-CD1 4.19Å; P178-L210 WeakPolarHBondContact O-CD2 3.13Å; F180-L210 HydrophobicContact CB-CB 4.21Å; F180-L210 HydrophobicContact CB-CD2 4.34Å; V187-L210 HydrophobicContact CG1-CD1 4.37Å; Y208-L210 HydrophobicContact CE1-CB 4.33Å; Y208-L210 HydrophobicContact CE1-CD1 4.34Å; L210-A212 VanDerWaalsContact C-N 3.28Å
211	E	82.1	Confident	87.6	Confident	182 Å²	182	82.2 Å²	82.2	85%	0.85	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-7.1	178.4	-63.3	-173.9	172.9	0	0	112.8	S209	S209-E211 VanDerWaalsContact C-N 3.28Å; S209-E211 PolarHBondContact O-N 3.23Å; S209-E211 PolarHBondContact OG-N 2.86Å
212	A	84.8	Confident	87.3	Confident	39 Å²	39	86.1 Å²	86.1	32%	0.322	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-63.4	141.9	176.3	0	0	0	0	0	110.2	S209 L210 Q773	S209-A212 WeakPolarHBondContact O-CB 3.37Å; S209-A212 PolarHBondContact O-N 2.85Å; L210-A212 VanDerWaalsContact C-N 3.28Å; A212-Q773 PolarHBondContact O-OE1 3.12Å
213	R	79.6	Confident	86.7	Confident	236 Å²	236	82.5 Å²	82.5	89%	0.891	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-96.1	133.3	177.7	-66.5	-174.4	178.2	-171.3	-1.3	109.5
214	G	78	Confident	85.5	Confident	20 Å²	20	77 Å²	77	21%	0.206	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-64.2	153.2	167.5	0	0	0	0	0	111.2	P777	G214-P777 WeakPolarHBondContact O-CD 3.28Å; G214-P777 WeakPolarHBondContact O-CG 3.32Å
215	E	87.6	Confident	83.8	Confident	158 Å²	158	81 Å²	81	74%	0.738	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-90.3	155.5	174.3	-63.9	-171.7	168.6	0	0	110.7	S768	E215-S768 PolarHBondContact O-OG 3.42Å
216	L	90.7	Very high	82.1	Confident	94 Å²	94	81.2 Å²	81.2	49%	0.492	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-75.2	141.6	170.1	-84.4	165.5	0	0	0	109.3	S218 P777	L216-S218 PolarHBondContact O-N 2.85Å; L216-P777 HydrophobicContact CD2-CB 3.68Å; L216-P777 HydrophobicContact CD2-CG 4.18Å; L216-P777 HydrophobicContact CG-CB 3.79Å; L216-P777 HydrophobicContact CG-CG 3.95Å
217	P	91.4	Very high	80.9	Confident	9 Å²	9	73.6 Å²	73.6	6%	0.058	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-62.3	139.9	173.4	26	-32.1	0	0	0	110.4	N219 L754 L766 H779	P217-N219 VanDerWaalsContact C-N 3.27Å; P217-N219 PolarHBondContact O-N 2.82Å; P217-L754 HydrophobicContact CB-CD2 3.61Å; P217-L766 HydrophobicContact CB-CD2 4.47Å; P217-L766 HydrophobicContact CG-CD2 4.19Å; P217-L766 HydrophobicContact CG-CG 4.06Å; P217-H779 PolarHBondContact O-NE2 2.75Å; P217-H779 VanDerWaalsContact O-NE2 3.14Å
218	S	88.5	Confident	79.9	Confident	110 Å²	110	69 Å²	69	77%	0.769	34%	0.34	S	S	*	.	S	Bend	trans	-63.6	-37	175.7	44.9	0	0	0	0	111.9	L216	L216-S218 PolarHBondContact O-N 2.85Å
219	N	91.1	Very high	79.4	Confident	50 Å²	50	68.4 Å²	68.4	27%	0.267	34%	0.338	S	S	.	.			trans	-80.5	153.7	-179.5	-62.6	80.3	0	0	0	111.4	P217 L754 L766 I815 V816	P217-N219 VanDerWaalsContact C-N 3.27Å; P217-N219 PolarHBondContact O-N 2.82Å; N219-L754 HydrophobicContact CB-CD1 4.04Å; N219-L754 HydrophobicContact CB-CD2 4.3Å; N219-L766 WeakPolarHBondContact O-CD2 3.45Å; N219-I815 HydrophobicContact CB-CG2 3.7Å; N219-V816 CarbonylContact C-O 3.59Å; N219-V816 VanDerWaalsContact CA-O 3.31Å; N219-V816 WeakPolarHBondContact CA-O 3.39Å
220	K	92.4	Very high	79.3	Confident	114 Å²	114	65.6 Å²	65.6	50%	0.496	32%	0.318	S	S	.	.			trans	-124.5	161.5	173.7	-64.2	179.9	-178.4	179	0	110.3	Y781 I815 V816	K220-Y781 WeakPolarHBondContact CA-OH 3.43Å; K220-I815 WeakPolarHBondContact O-CA 3.48Å; K220-V816 HydrophobicContact CB-CG2 3.93Å; K220-V816 PolarHBondContact N-O 3.42Å; K220-V816 WeakPolarHBondContact O-CG2 3.44Å; K220-V816 PolarHBondContact O-N 2.97Å
221	L	89.4	Confident	79.7	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.047	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	140.1	168.7	-56.2	-178.9	0	0	0	108.6	V764 L766 Y781 L800 W813 R814 I815	L221-V764 HydrophobicContact CD1-CG1 4.05Å; L221-L766 HydrophobicContact CD1-CB 4.32Å; L221-L766 HydrophobicContact CD2-CD1 4.39Å; L221-L766 HydrophobicContact CD2-CD2 4.21Å; L221-L766 HydrophobicContact CG-CB 4.36Å; L221-L766 HydrophobicContact CG-CD2 4.04Å; L221-Y781 HydrophobicContact CB-CD1 4.01Å; L221-Y781 HydrophobicContact CB-CD2 3.92Å; L221-Y781 HydrophobicContact CB-CE1 3.71Å; L221-Y781 HydrophobicContact CB-CE2 3.6Å; L221-Y781 HydrophobicContact CB-CG 4.11Å; L221-Y781 VanDerWaalsContact CB-CZ 3.49Å; L221-Y781 HydrophobicContact CD1-CD2 3.64Å; L221-Y781 HydrophobicContact CD1-CE2 3.65Å; L221-Y781 HydrophobicContact CD1-CG 4.38Å; L221-Y781 HydrophobicContact CG-CD2 4.06Å; L221-Y781 HydrophobicContact CG-CE2 3.61Å; L221-Y781 VanDerWaalsContact N-CZ 3.29Å; L221-Y781 PolarHBondContact N-OH 2.91Å; L221-Y781 WeakPolarHBondContact O-CE1 3.43Å; L221-L800 HydrophobicContact CD1-CD2 3.5Å; L221-L800 HydrophobicContact CD2-CD2 4.33Å; L221-W813 HydrophobicContact CB-CB 4.14Å; L221-W813 HydrophobicContact CD1-CB 4.31Å; L221-W813 HydrophobicContact CD1-CG 4.48Å; L221-W813 HydrophobicContact CD2-CB 4.3Å; L221-W813 HydrophobicContact CG-CB 4.48Å; L221-R814 CarbonylContact C-O 3.23Å; L221-R814 WeakPolarHBondContact CA-O 3.26Å; L221-I815 HydrophobicContact CD2-CG1 4.05Å
222	K	86.9	Confident	80.2	Confident	96 Å²	96	55.7 Å²	55.7	42%	0.417	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.7	168.7	-171.8	-175.9	174.1	-158.3	0	107.6	D224 R814 V816	K222-D224 VanDerWaalsContact C-N 3.29Å; K222-D224 IonicContact NZ-OD1 2.7Å; K222-D224 PolarHBondContact O-N 3.45Å; K222-R814 PolarHBondContact N-O 3.32Å; K222-R814 PolarHBondContact O-N 2.96Å; K222-V816 HydrophobicContact CB-CG1 4.24Å; K222-V816 HydrophobicContact CB-CG2 4.27Å
223	L	77.8	Confident	80.4	Confident	26 Å²	26	53.9 Å²	53.9	14%	0.136	26%	0.255	C	S	.	.			trans	-65.6	99.3	162.6	-158.7	81	0	0	0	105.8	N227 H268 T270 L811 Q812 W813	L223-N227 HydrophobicContact CD1-CB 4.29Å; L223-N227 HydrophobicContact CG-CB 4.36Å; L223-H268 HydrophobicContact CD2-CB 3.78Å; L223-H268 VanDerWaalsContact CD2-CG 3.47Å; L223-T270 HydrophobicContact CD2-CG2 4.42Å; L223-L811 HydrophobicContact CD1-CB 4.22Å; L223-L811 HydrophobicContact CD1-CD2 4.4Å; L223-Q812 WeakPolarHBondContact CD1-O 3.44Å; L223-W813 HydrophobicContact CB-CE3 4.29Å; L223-W813 HydrophobicContact CB-CZ3 4.29Å; L223-W813 HydrophobicContact CD1-CD2 4.15Å; L223-W813 HydrophobicContact CD1-CE3 3.85Å; L223-W813 HydrophobicContact CD1-CH2 4.13Å; L223-W813 HydrophobicContact CD1-CZ2 4.41Å; L223-W813 HydrophobicContact CD1-CZ3 3.84Å
224	D	61.5	Low	80.9	Confident	20 Å²	20	48.1 Å²	48.1	11%	0.107	23%	0.233	C	C	.	.			trans	-81.4	168.1	-175.7	-152.4	12.3	0	0	0	109.9	K222 W226 N227 H268 R814	K222-D224 VanDerWaalsContact C-N 3.29Å; K222-D224 IonicContact NZ-OD1 2.7Å; K222-D224 PolarHBondContact O-N 3.45Å; D224-W226 PolarHBondContact O-N 3.18Å; D224-N227 WeakPolarHBondContact CB-ND2 3.41Å; D224-N227 PolarHBondContact N-ND2 2.84Å; D224-N227 WeakPolarHBondContact O-CB 3.4Å; D224-N227 PolarHBondContact O-N 3.42Å; D224-H268 PolarHBondContact O-CE1 2.78Å; D224-H268 VanDerWaalsContact O-CE1 3.29Å; D224-R814 HydrophobicContact CB-CB 3.79Å; D224-R814 WeakPolarHBondContact OD2-CD 3.43Å; D224-R814 IonicContact OD2-CZ 2.8Å; D224-R814 IonicContact OD2-NE 3.24Å; D224-R814 IonicContact OD2-NH1 2.95Å; D224-R814 PolarHBondContact OD2-NH1 3.02Å
225	W	53.9	Low	81.4	Confident	134 Å²	134	50.1 Å²	50.1	51%	0.508	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	26.4	-166.2	-65.8	-7.3	0	0	0	116.1	L265 Q266	W225-L265 HydrophobicContact CB-CD2 4.01Å; W225-L265 HydrophobicContact CE3-CD1 3.98Å; W225-L265 HydrophobicContact CE3-CD2 3.91Å; W225-L265 HydrophobicContact CE3-CG 4.47Å; W225-L265 HydrophobicContact CZ3-CD1 4.21Å; W225-L265 CarbonylContact O-C 3.58Å; W225-Q266 CarbonylContact C-O 3.55Å; W225-Q266 WeakPolarHBondContact CA-O 3.46Å; W225-Q266 WeakPolarHBondContact CB-O 3.47Å; W225-Q266 WeakPolarHBondContact O-CA 3.4Å; W225-Q266 WeakPolarHBondContact O-CB 3.37Å; W225-Q266 PolarHBondContact O-N 3.17Å
226	W	52.4	Low	81.5	Confident	24 Å²	24	42.8 Å²	42.8	9%	0.091	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-153.7	12.4	179.6	-153.5	-77.7	0	0	0	113.5	D224 F259 Q264 L265 Q266 T575 H576	D224-W226 PolarHBondContact O-N 3.18Å; W226-F259 HydrophobicContact CE3-CE2 4.01Å; W226-F259 HydrophobicContact CH2-CD2 4.15Å; W226-F259 AromaticContact CH2-CE2 3.1Å; W226-F259 HydrophobicContact CH2-CE2 3.1Å; W226-F259 AromaticContact CH2-CZ 3.52Å; W226-F259 HydrophobicContact CH2-CZ 3.52Å; W226-F259 HydrophobicContact CZ2-CE2 4.04Å; W226-F259 HydrophobicContact CZ2-CZ 4.33Å; W226-F259 AromaticContact CZ3-CD2 3.67Å; W226-F259 HydrophobicContact CZ3-CD2 3.67Å; W226-F259 AromaticContact CZ3-CE2 3.03Å; W226-F259 HydrophobicContact CZ3-CE2 3.03Å; W226-F259 AromaticContact CZ3-CZ 3.93Å; W226-F259 HydrophobicContact CZ3-CZ 3.93Å; W226-Q264 HydrophobicContact CE3-CB 4.25Å; W226-Q264 HydrophobicContact CH2-CB 3.14Å; W226-Q264 HydrophobicContact CH2-CG 3.67Å; W226-Q264 VanDerWaalsContact CH2-OE1 3.23Å; W226-Q264 HydrophobicContact CZ2-CB 3.51Å; W226-Q264 HydrophobicContact CZ2-CG 3.94Å; W226-Q264 HydrophobicContact CZ3-CB 3.61Å; W226-Q264 WeakPolarHBondContact CZ3-O 3.3Å; W226-L265 VanDerWaalsContact CE3-CA 3.41Å; W226-L265 VanDerWaalsContact CE3-N 3.32Å; W226-Q266 HydrophobicContact CE3-CG 4.2Å; W226-Q266 HydrophobicContact CZ3-CG 4.48Å; W226-T575 PolarHBondContact NE1-O 3.33Å; W226-H576 AromaticContact CD1-CD2 2.76Å; W226-H576 AromaticContact CD1-CE1 3.52Å; W226-H576 AromaticContact CD1-CG 2.85Å; W226-H576 AromaticContact CD1-ND1 3.36Å; W226-H576 AromaticContact CD1-NE2 3.2Å; W226-H576 HydrophobicContact CG-CB 4.35Å; W226-H576 AromaticContact CG-CD2 3.45Å; W226-H576 VanDerWaalsContact CG-CD2 3.45Å; W226-H576 AromaticContact CG-CE1 3.92Å; W226-H576 AromaticContact CG-CG 3.88Å; W226-H576 AromaticContact CG-NE2 3.47Å; W226-H576 AromaticContact NE1-CD2 2.98Å; W226-H576 PolarHBondContact NE1-CD2 2.84Å; W226-H576 AromaticContact NE1-CG 3.2Å; W226-H576 AromaticContact NE1-NE2 3.84Å; W226-H576 PolarHBondContact O-ND1 2.78Å
227	N	62.6	Low	81.4	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	19%	0.193	C	C	.	.			trans	-102.4	3.7	-150.9	-75.3	2.9	0	0	0	117	L223 D224 H576 L811 Q812	L223-N227 HydrophobicContact CD1-CB 4.29Å; L223-N227 HydrophobicContact CG-CB 4.36Å; D224-N227 WeakPolarHBondContact CB-ND2 3.41Å; D224-N227 PolarHBondContact N-ND2 2.84Å; D224-N227 WeakPolarHBondContact O-CB 3.4Å; D224-N227 PolarHBondContact O-N 3.42Å; N227-H576 PolarHBondContact OD1-CE1 2.8Å; N227-L811 CarbonylContact O-C 3.54Å; N227-L811 WeakPolarHBondContact O-CA 3.47Å; N227-Q812 HydrophobicContact CB-CB 3.77Å; N227-Q812 WeakPolarHBondContact CB-O 3.47Å; N227-Q812 PolarHBondContact ND2-O 2.69Å; N227-Q812 PolarHBondContact O-N 3.45Å
228	C	66.2	Low	81.1	Confident	2 Å²	2	44 Å²	44	1%	0.014	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.4	175.6	-69.3	0	0	0	0	110.4	V257 Q266 H268 L811	C228-V257 HydrophobicContact CB-CG2 3.76Å; C228-Q266 PolarHBondContact O-NE2 3.38Å; C228-Q266 VanDerWaalsContact O-NE2 3.14Å; C228-H268 PolarHBondContact SG-CD2 2.84Å; C228-H268 PolarHBondContact SG-NE2 3.03Å; C228-H268 VanDerWaalsContact SG-NE2 3.45Å; C228-L811 HydrophobicContact CB-CD2 4.15Å; C228-L811 WeakPolarHBondContact SG-CD2 3.44Å
229	Y	80.9	Confident	81.3	Confident	10 Å²	10	38.8 Å²	38.8	4%	0.039	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.8	170.7	-55.7	-97.2	0	0	0	110.1	F559 W571 H576 V810 Q812	Y229-F559 HydrophobicContact CD2-CZ 4.39Å; Y229-F559 HydrophobicContact CE1-CZ 4.28Å; Y229-F559 HydrophobicContact CE2-CE1 4.35Å; Y229-F559 AromaticContact CE2-CZ 3.69Å; Y229-F559 HydrophobicContact CE2-CZ 3.69Å; Y229-F559 AromaticContact CZ-CZ 3.61Å; Y229-W571 HydrophobicContact CD1-CD2 4.31Å; Y229-W571 AromaticContact CD1-CE3 3.73Å; Y229-W571 HydrophobicContact CD1-CE3 3.73Å; Y229-W571 HydrophobicContact CD1-CH2 4.39Å; Y229-W571 AromaticContact CD1-CZ3 3.77Å; Y229-W571 HydrophobicContact CD1-CZ3 3.77Å; Y229-W571 HydrophobicContact CE1-CD2 4.37Å; Y229-W571 AromaticContact CE1-CE3 3.84Å; Y229-W571 HydrophobicContact CE1-CE3 3.84Å; Y229-W571 HydrophobicContact CE1-CZ3 4.32Å; Y229-H576 HydrophobicContact CE1-CB 3.63Å; Y229-H576 AromaticContact CZ-ND1 3.72Å; Y229-H576 VanDerWaalsContact OH-CB 3.24Å; Y229-H576 WeakPolarHBondContact OH-CB 3.43Å; Y229-H576 PolarHBondContact OH-ND1 3.31Å; Y229-V810 HydrophobicContact CD2-CB 3.98Å; Y229-V810 HydrophobicContact CD2-CG1 4.11Å; Y229-V810 WeakPolarHBondContact CD2-O 3.31Å; Y229-V810 HydrophobicContact CG-CB 4.34Å; Y229-V810 PolarHBondContact N-O 3.32Å; Y229-V810 PolarHBondContact O-N 2.88Å; Y229-Q812 HydrophobicContact CE2-CB 4.27Å; Y229-Q812 PolarHBondContact OH-OE1 2.87Å; Y229-Q812 VanDerWaalsContact OH-OE1 3.05Å
230	G	83.9	Confident	81.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.164	C	C	.	.			trans	112.5	159.4	173.8	0	0	0	0	0	114.5	Y250 I252 Q541	G230-Y250 WeakPolarHBondContact O-CE2 3.32Å; G230-I252 VanDerWaalsContact C-CD1 3.44Å; G230-Q541 WeakPolarHBondContact CA-O 3.35Å; G230-Q541 PolarHBondContact N-O 3.4Å; G230-Q541 VanDerWaalsContact N-O 3.15Å
231	Y	92.6	Very high	81.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	15%	0.154	C	C	.	.			trans	-134.8	134.7	177.2	157.4	-111.4	0	0	0	108.7	G233 N239 Y250 T509 N525 V527	Y231-G233 PolarHBondContact O-N 2.68Å; Y231-N239 PolarHBondContact OH-OD1 2.97Å; Y231-Y250 HydrophobicContact CD2-CD2 4.04Å; Y231-Y250 HydrophobicContact CD2-CG 4.04Å; Y231-T509 PolarHBondContact OH-OG1 3.01Å; Y231-N525 VanDerWaalsContact O-CA 3.29Å; Y231-N525 WeakPolarHBondContact O-CA 3.38Å; Y231-N525 WeakPolarHBondContact O-CB 3.13Å; Y231-N525 PolarHBondContact O-ND2 3.34Å; Y231-N525 PolarHBondContact O-OD1 2.92Å; Y231-V527 HydrophobicContact CD1-CG2 3.77Å; Y231-V527 HydrophobicContact CD2-CG2 3.88Å; Y231-V527 HydrophobicContact CE1-CG2 4.42Å; Y231-V527 HydrophobicContact CG-CG2 3.45Å; Y231-V527 VanDerWaalsContact CG-CG2 3.45Å
232	R	91.8	Very high	81.9	Confident	18 Å²	18	36.3 Å²	36.3	7%	0.068	16%	0.163	C	C	.	.			trans	-84.2	78.6	-179.4	-166.1	172	-175.3	159.6	7.8	112.3	D235 C236 N239 F251 D275 K277	R232-D235 WeakPolarHBondContact CG-OD1 3.49Å; R232-D235 IonicContact CZ-OD1 4Å; R232-D235 IonicContact CZ-OD2 3.06Å; R232-D235 IonicContact NE-OD1 2.62Å; R232-D235 PolarHBondContact NE-OD1 3.08Å; R232-D235 IonicContact NE-OD2 3.85Å; R232-D235 PolarHBondContact NE-OD2 3.3Å; R232-D235 VanDerWaalsContact NE-OD2 3.15Å; R232-D235 IonicContact NH2-OD2 3.89Å; R232-D235 PolarHBondContact NH2-OD2 2.67Å; R232-C236 VanDerWaalsContact CD-SG 3.5Å; R232-C236 HydrophobicContact CG-CB 4.25Å; R232-C236 PolarHBondContact NE-SG 2.95Å; R232-C236 VanDerWaalsContact NE-SG 3.44Å; R232-C236 WeakPolarHBondContact O-CB 2.85Å; R232-N239 PolarHBondContact O-ND2 3.48Å; R232-F251 HydrophobicContact CB-CD2 4.41Å; R232-F251 HydrophobicContact CB-CE2 4.37Å; R232-F251 PolarHBondContact N-O 2.87Å; R232-D275 IonicContact CZ-OD1 3.17Å; R232-D275 IonicContact CZ-OD2 2.78Å; R232-D275 IonicContact NH1-OD1 3.3Å; R232-D275 PolarHBondContact NH1-OD1 2.88Å; R232-D275 IonicContact NH1-OD2 2.67Å; R232-D275 PolarHBondContact NH1-OD2 3.22Å; R232-D275 IonicContact NH2-OD2 2.8Å; R232-D275 PolarHBondContact NH2-OD2 2.94Å; R232-K277 VanDerWaalsContact NH2-NZ 3.11Å
233	G	89.1	Confident	82.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.144	C	C	.	.			trans	-99.4	-20.6	178.9	0	0	0	0	0	115.1	Y231 R508 T522 N525	Y231-G233 PolarHBondContact O-N 2.68Å; G233-R508 WeakPolarHBondContact O-CG 3.27Å; G233-T522 WeakPolarHBondContact CA-O 3.12Å; G233-N525 PolarHBondContact N-OD1 2.83Å
234	R	90.1	Very high	82.8	Confident	115 Å²	115	35.6 Å²	35.6	43%	0.434	17%	0.169	S	C	.	.	S	Bend	trans	-62.2	-53.2	-176.2	-177.2	-180	175	120.8	-2.5	113.1	R508 T523 N525 T544	R234-R508 PolarHBondContact O-NH1 2.71Å; R234-R508 PolarHBondContact O-NH2 3.25Å; R234-T523 WeakPolarHBondContact CA-O 3.44Å; R234-N525 PolarHBondContact N-OD1 3.22Å; R234-T544 WeakPolarHBondContact CD-O 3.27Å; R234-T544 PolarHBondContact NH1-O 2.87Å
235	D	89.4	Confident	84.1	Confident	62 Å²	62	38.5 Å²	38.5	33%	0.332	19%	0.188	S	C	.	.	S	Bend	trans	-110.1	-19.3	-171.7	69.4	-25.7	0	0	0	113.8	R232 K277 R508	R232-D235 WeakPolarHBondContact CG-OD1 3.49Å; R232-D235 IonicContact CZ-OD1 4Å; R232-D235 IonicContact CZ-OD2 3.06Å; R232-D235 IonicContact NE-OD1 2.62Å; R232-D235 PolarHBondContact NE-OD1 3.08Å; R232-D235 IonicContact NE-OD2 3.85Å; R232-D235 PolarHBondContact NE-OD2 3.3Å; R232-D235 VanDerWaalsContact NE-OD2 3.15Å; R232-D235 IonicContact NH2-OD2 3.89Å; R232-D235 PolarHBondContact NH2-OD2 2.67Å; D235-K277 IonicContact OD2-NZ 3.02Å; D235-K277 PolarHBondContact OD2-NZ 3.45Å; D235-R508 PolarHBondContact O-NH2 3.48Å
236	C	89.3	Confident	85.8	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.027	17%	0.171	C	C	.	.			trans	-97.7	168.4	-179.6	-63.3	0	0	0	0	113.5	R232 F251 R508	R232-C236 VanDerWaalsContact CD-SG 3.5Å; R232-C236 HydrophobicContact CG-CB 4.25Å; R232-C236 PolarHBondContact NE-SG 2.95Å; R232-C236 VanDerWaalsContact NE-SG 3.44Å; R232-C236 WeakPolarHBondContact O-CB 2.85Å; C236-F251 HydrophobicContact CB-CE2 4.12Å; C236-F251 HydrophobicContact CB-CZ 4.11Å; C236-R508 PolarHBondContact O-NE 3.49Å; C236-R508 PolarHBondContact O-NH2 2.96Å
237	R	88.8	Confident	87.8	Confident	62 Å²	62	32.5 Å²	32.5	23%	0.234	17%	0.171	C	C	.	.			trans	-141.7	160.2	-178.8	-72	-178.9	172.8	85.7	4.4	109.5	N239	R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.12Å
238	S	83.9	Confident	89.3	Confident	67 Å²	67	32.5 Å²	32.5	47%	0.469	17%	0.171	S	C	.	.	S	Bend	trans	47	50.1	174	-56.9	0	0	0	0	113.1	Y241	S238-Y241 PolarHBondContact O-OH 3.02Å
239	N	93.5	Very high	90.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.			trans	-131.9	27.4	-170.7	61.2	-37	0	0	0	113.2	Y231 R232 R237 Y250 F251 T509	Y231-N239 PolarHBondContact OH-OD1 2.97Å; R232-N239 PolarHBondContact O-ND2 3.48Å; R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.12Å; N239-Y250 WeakPolarHBondContact O-CA 3.5Å; N239-Y250 WeakPolarHBondContact O-CB 3.35Å; N239-F251 HydrophobicContact CB-CD1 3.91Å; N239-F251 HydrophobicContact CB-CE1 3.16Å; N239-F251 HydrophobicContact CB-CE2 4.34Å; N239-F251 HydrophobicContact CB-CZ 3.41Å; N239-F251 VanDerWaalsContact CB-CZ 3.41Å; N239-T509 WeakPolarHBondContact OD1-CG2 3.39Å
240	L	95.5	Very high	91.4	Very high	5 Å²	5	32 Å²	32	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.4	177.4	-177.6	65.6	0	0	0	108.6	T248 V249 Y250 A511 L519 V527	L240-T248 HydrophobicContact CD1-CG2 3.62Å; L240-V249 WeakPolarHBondContact CA-O 3.39Å; L240-Y250 HydrophobicContact CD1-CD1 4.27Å; L240-A511 HydrophobicContact CD2-CB 4.48Å; L240-A511 HydrophobicContact CG-CB 4.17Å; L240-A511 WeakPolarHBondContact O-CB 3.25Å; L240-L519 HydrophobicContact CD2-CB 3.96Å; L240-V527 HydrophobicContact CD1-CG1 3.9Å; L240-V527 HydrophobicContact CD1-CG2 4.39Å; L240-V527 HydrophobicContact CD2-CG1 4.02Å
241	Y	95.1	Very high	91.9	Very high	73 Å²	73	32 Å²	32	29%	0.286	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.1	-180	-62.9	-91.5	0	0	0	110	S238 T248 V249 L279 V281	S238-Y241 PolarHBondContact O-OH 3.02Å; Y241-T248 CarbonylContact O-C 3.09Å; Y241-T248 WeakPolarHBondContact O-CA 3.41Å; Y241-V249 PolarHBondContact N-O 3.42Å; Y241-V249 PolarHBondContact O-N 3.02Å; Y241-L279 HydrophobicContact CD2-CD2 3.25Å; Y241-L279 HydrophobicContact CE2-CD2 3.4Å; Y241-L279 VanDerWaalsContact CE2-CD2 3.4Å; Y241-L279 HydrophobicContact CG-CD2 4.31Å; Y241-L279 PolarHBondContact OH-O 2.59Å; Y241-V281 HydrophobicContact CD1-CG2 3.97Å; Y241-V281 HydrophobicContact CD2-CG2 4.05Å; Y241-V281 HydrophobicContact CG-CG2 3.68Å
242	L	94.8	Very high	92	Very high	43 Å²	43	32 Å²	32	23%	0.225	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.9	168.2	-175.8	69.1	0	0	0	109.4	G246 E512 G513 R514 L519	L242-G246 WeakPolarHBondContact CD1-O 3.47Å; L242-E512 WeakPolarHBondContact CB-O 3.47Å; L242-G513 VanDerWaalsContact CD2-CA 3.45Å; L242-R514 HydrophobicContact CD2-CB 4.18Å; L242-R514 VanDerWaalsContact CD2-N 3.26Å; L242-L519 HydrophobicContact CB-CD1 4.04Å; L242-L519 HydrophobicContact CD1-CD1 4.36Å
243	L	93.9	Very high	92	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	17%	0.166	C	C	.	.			trans	-81.1	154.9	172.8	-62.1	-177.5	0	0	0	110.9	T245 G246 E247 V249 L258 V281 I288	L243-T245 WeakPolarHBondContact CB-OG1 3.38Å; L243-T245 PolarHBondContact O-N 3.29Å; L243-T245 VanDerWaalsContact O-N 3.08Å; L243-G246 PolarHBondContact O-N 3.36Å; L243-E247 HydrophobicContact CB-CB 4.49Å; L243-E247 HydrophobicContact CD1-CB 4.42Å; L243-E247 PolarHBondContact N-O 2.77Å; L243-V249 HydrophobicContact CD1-CG2 3.6Å; L243-V249 HydrophobicContact CD2-CG2 4.22Å; L243-V249 HydrophobicContact CG-CG2 3.56Å; L243-L258 HydrophobicContact CD1-CD2 3.97Å; L243-V281 HydrophobicContact CD2-CG1 3.99Å; L243-I288 HydrophobicContact CD1-CD1 4.39Å; L243-I288 HydrophobicContact CD2-CD1 4.45Å
244	P	89.6	Confident	92.1	Very high	104 Å²	104	31.3 Å²	31.3	68%	0.675	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-20.4	174.5	-24.2	34.1	0	0	0	114	G246 K285	P244-G246 PolarHBondContact O-N 2.89Å; P244-K285 HydrophobicContact CG-CB 3.46Å; P244-K285 VanDerWaalsContact CG-CB 3.46Å; P244-K285 HydrophobicContact CG-CG 3.88Å
245	T	89.4	Confident	92.3	Very high	81 Å²	81	25.9 Å²	25.9	50%	0.497	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-16.8	172.9	53.8	0	0	0	0	113	L243 E247	L243-T245 WeakPolarHBondContact CB-OG1 3.38Å; L243-T245 PolarHBondContact O-N 3.29Å; L243-T245 VanDerWaalsContact O-N 3.08Å; T245-E247 WeakPolarHBondContact CB-OE2 3.46Å; T245-E247 WeakPolarHBondContact OG1-CG 3.42Å; T245-E247 PolarHBondContact OG1-N 2.87Å; T245-E247 PolarHBondContact OG1-OE2 3.43Å
246	G	89.7	Confident	92.5	Very high	15 Å²	15	22.9 Å²	22.9	16%	0.155	13%	0.13	C	C	.	.	S	Bend	trans	93.4	-1.1	-170.3	0	0	0	0	0	113.3	L242 L243 P244	L242-G246 WeakPolarHBondContact CD1-O 3.47Å; L243-G246 PolarHBondContact O-N 3.36Å; P244-G246 PolarHBondContact O-N 2.89Å
247	E	93.2	Very high	92.8	Very high	18 Å²	18	22.7 Å²	22.7	8%	0.084	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.3	178.8	-65.2	164.8	127.6	0	0	111.1	L243 T245 L258 F259 N260 R267	L243-E247 HydrophobicContact CB-CB 4.49Å; L243-E247 HydrophobicContact CD1-CB 4.42Å; L243-E247 PolarHBondContact N-O 2.77Å; T245-E247 WeakPolarHBondContact CB-OE2 3.46Å; T245-E247 WeakPolarHBondContact OG1-CG 3.42Å; T245-E247 PolarHBondContact OG1-N 2.87Å; T245-E247 PolarHBondContact OG1-OE2 3.43Å; E247-L258 HydrophobicContact CB-CB 4.3Å; E247-F259 CarbonylContact C-O 3.55Å; E247-F259 WeakPolarHBondContact CA-O 3.48Å; E247-N260 HydrophobicContact CG-CB 4.19Å; E247-R267 WeakPolarHBondContact OE1-CD 3.41Å; E247-R267 IonicContact OE1-CZ 2.83Å; E247-R267 IonicContact OE1-NH1 3.93Å; E247-R267 PolarHBondContact OE1-NH1 3.32Å; E247-R267 IonicContact OE2-NH1 2.83Å
248	T	94.7	Very high	93	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.3	171.2	-61.8	0	0	0	0	109.3	L240 Y241 Y250 F259 L519 I539	L240-T248 HydrophobicContact CD1-CG2 3.62Å; Y241-T248 CarbonylContact O-C 3.09Å; Y241-T248 WeakPolarHBondContact O-CA 3.41Å; T248-Y250 HydrophobicContact CG2-CD1 4.08Å; T248-Y250 HydrophobicContact CG2-CE1 4.37Å; T248-F259 PolarHBondContact N-O 2.96Å; T248-F259 PolarHBondContact O-N 3.13Å; T248-L519 HydrophobicContact CG2-CD1 3.82Å; T248-I539 HydrophobicContact CG2-CD1 4.35Å
249	V	96.1	Very high	93.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.7	-175.3	-176.9	0	0	0	0	110.6	L240 Y241 L243 V256 V257 L258 L279 I288	L240-V249 WeakPolarHBondContact CA-O 3.39Å; Y241-V249 PolarHBondContact N-O 3.42Å; Y241-V249 PolarHBondContact O-N 3.02Å; L243-V249 HydrophobicContact CD1-CG2 3.6Å; L243-V249 HydrophobicContact CD2-CG2 4.22Å; L243-V249 HydrophobicContact CG-CG2 3.56Å; V249-V256 HydrophobicContact CG1-CG1 3.72Å; V249-V257 WeakPolarHBondContact CA-O 3.44Å; V249-L258 HydrophobicContact CG2-CB 4.4Å; V249-L258 HydrophobicContact CG2-CD2 4.22Å; V249-L258 HydrophobicContact CG2-CG 4.01Å; V249-L279 HydrophobicContact CG1-CD1 3.84Å; V249-L279 HydrophobicContact CG1-CD2 4.39Å; V249-I288 HydrophobicContact CG1-CD1 4.33Å
250	Y	95.7	Very high	93.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	179.2	172.5	56.5	-90.1	0	0	0	109.9	G230 Y231 N239 L240 T248 V256 V257 F259 T540	G230-Y250 WeakPolarHBondContact O-CE2 3.32Å; Y231-Y250 HydrophobicContact CD2-CD2 4.04Å; Y231-Y250 HydrophobicContact CD2-CG 4.04Å; N239-Y250 WeakPolarHBondContact O-CA 3.5Å; N239-Y250 WeakPolarHBondContact O-CB 3.35Å; L240-Y250 HydrophobicContact CD1-CD1 4.27Å; T248-Y250 HydrophobicContact CG2-CD1 4.08Å; T248-Y250 HydrophobicContact CG2-CE1 4.37Å; Y250-V256 CarbonylContact O-C 3.47Å; Y250-V256 VanDerWaalsContact O-CG1 3.29Å; Y250-V256 WeakPolarHBondContact O-CG1 3.49Å; Y250-V257 HydrophobicContact CD2-CB 4.1Å; Y250-V257 HydrophobicContact CD2-CG2 4.35Å; Y250-V257 HydrophobicContact CE1-CB 4.41Å; Y250-V257 HydrophobicContact CE1-CG1 4.33Å; Y250-V257 HydrophobicContact CE2-CB 3.68Å; Y250-V257 HydrophobicContact CE2-CG1 4.05Å; Y250-V257 HydrophobicContact CE2-CG2 3.86Å; Y250-V257 PolarHBondContact N-O 3.2Å; Y250-V257 PolarHBondContact O-N 3.14Å; Y250-F259 HydrophobicContact CE1-CB 4.01Å; Y250-T540 HydrophobicContact CE2-CG2 4.34Å; Y250-T540 WeakPolarHBondContact OH-CG2 3.39Å; Y250-T540 PolarHBondContact OH-OG1 2.96Å
251	F	94.9	Very high	92.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	156.4	174.9	59.7	-104.2	0	0	0	112	R232 C236 N239 V255 V256 I276 K277 L279	R232-F251 HydrophobicContact CB-CD2 4.41Å; R232-F251 HydrophobicContact CB-CE2 4.37Å; R232-F251 PolarHBondContact N-O 2.87Å; C236-F251 HydrophobicContact CB-CE2 4.12Å; C236-F251 HydrophobicContact CB-CZ 4.11Å; N239-F251 HydrophobicContact CB-CD1 3.91Å; N239-F251 HydrophobicContact CB-CE1 3.16Å; N239-F251 HydrophobicContact CB-CE2 4.34Å; N239-F251 HydrophobicContact CB-CZ 3.41Å; N239-F251 VanDerWaalsContact CB-CZ 3.41Å; F251-V255 VanDerWaalsContact CA-O 3.29Å; F251-V255 WeakPolarHBondContact CA-O 3.38Å; F251-V255 WeakPolarHBondContact CB-O 3.5Å; F251-V256 HydrophobicContact CB-CG2 4.46Å; F251-I276 HydrophobicContact CB-CB 4.19Å; F251-I276 HydrophobicContact CB-CD1 4.12Å; F251-I276 HydrophobicContact CB-CG2 4.14Å; F251-I276 HydrophobicContact CD1-CB 4.42Å; F251-I276 HydrophobicContact CD1-CG2 3.63Å; F251-I276 HydrophobicContact CD2-CB 3.84Å; F251-I276 HydrophobicContact CD2-CG2 3.92Å; F251-I276 WeakPolarHBondContact CD2-O 3.38Å; F251-I276 HydrophobicContact CE1-CG2 3.9Å; F251-I276 HydrophobicContact CE2-CB 4.34Å; F251-I276 HydrophobicContact CE2-CG2 4.22Å; F251-I276 WeakPolarHBondContact CE2-O 3.15Å; F251-I276 HydrophobicContact CG-CB 3.91Å; F251-I276 HydrophobicContact CG-CG2 3.63Å; F251-I276 HydrophobicContact CZ-CG2 4.21Å; F251-K277 WeakPolarHBondContact CZ-O 3.3Å; F251-L279 HydrophobicContact CD1-CB 3.81Å; F251-L279 HydrophobicContact CD1-CD1 4.1Å; F251-L279 HydrophobicContact CE1-CB 3.74Å
252	I	92.9	Very high	92.5	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	143.2	169.3	-171.7	169.1	0	0	0	108.2	G230 S254 V255 V257	G230-I252 VanDerWaalsContact C-CD1 3.44Å; I252-S254 PolarHBondContact O-N 2.79Å; I252-V255 PolarHBondContact N-O 2.77Å; I252-V255 PolarHBondContact O-N 3.02Å; I252-V257 HydrophobicContact CG2-CG2 4.39Å
253	A	91.6	Very high	92.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	-127.9	-172.7	0	0	0	0	0	111.7	I276 G783 S785 D807	A253-I276 PolarHBondContact O-N 2.79Å; A253-G783 WeakPolarHBondContact CB-O 3.14Å; A253-S785 WeakPolarHBondContact CA-OG 3.48Å; A253-D807 HydrophobicContact CB-CB 3.72Å
254	S	92.3	Very high	91.6	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.014	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	10.8	176	71	0	0	0	0	114	I252 D274 G783	I252-S254 PolarHBondContact O-N 2.79Å; S254-D274 WeakPolarHBondContact CA-O 3.29Å; S254-D274 VanDerWaalsContact CB-O 3.26Å; S254-D274 WeakPolarHBondContact CB-O 3.39Å; S254-G783 PolarHBondContact N-O 2.88Å; S254-G783 VanDerWaalsContact OG-C 3.25Å; S254-G783 PolarHBondContact OG-O 3.31Å
255	V	93.3	Very high	91.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.6	-172.5	-174.4	0	0	0	0	111.3	F251 I252 V257 H268 T270	F251-V255 VanDerWaalsContact CA-O 3.29Å; F251-V255 WeakPolarHBondContact CA-O 3.38Å; F251-V255 WeakPolarHBondContact CB-O 3.5Å; I252-V255 PolarHBondContact N-O 2.77Å; I252-V255 PolarHBondContact O-N 3.02Å; V255-V257 HydrophobicContact CG1-CG2 4.47Å; V255-H268 HydrophobicContact CG1-CB 3.85Å; V255-T270 HydrophobicContact CG1-CG2 4.2Å; V255-T270 HydrophobicContact CG2-CG2 4.18Å
256	V	95.2	Very high	91.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.2	163.5	-169	0	0	0	0	108.6	V249 Y250 F251 H268 Y269 I276 L279 T290 W310	V249-V256 HydrophobicContact CG1-CG1 3.72Å; Y250-V256 CarbonylContact O-C 3.47Å; Y250-V256 VanDerWaalsContact O-CG1 3.29Å; Y250-V256 WeakPolarHBondContact O-CG1 3.49Å; F251-V256 HydrophobicContact CB-CG2 4.46Å; V256-H268 WeakPolarHBondContact O-CA 3.26Å; V256-Y269 HydrophobicContact CG2-CD1 4.06Å; V256-Y269 PolarHBondContact N-O 2.8Å; V256-Y269 VanDerWaalsContact N-O 3.08Å; V256-Y269 PolarHBondContact O-N 2.77Å; V256-I276 HydrophobicContact CG2-CD1 3.47Å; V256-I276 VanDerWaalsContact CG2-CD1 3.47Å; V256-L279 HydrophobicContact CG1-CD1 3.7Å; V256-L279 HydrophobicContact CG2-CD1 4.46Å; V256-T290 HydrophobicContact CG2-CG2 3.86Å; V256-W310 HydrophobicContact CB-CH2 4.26Å; V256-W310 HydrophobicContact CB-CZ2 3.99Å; V256-W310 HydrophobicContact CG1-CH2 3.93Å; V256-W310 HydrophobicContact CG1-CZ2 3.79Å; V256-W310 HydrophobicContact CG2-CZ2 3.9Å
257	V	94.1	Very high	91.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.9	178.5	-172.9	0	0	0	0	108.7	C228 V249 Y250 I252 V255 F259 Q266	C228-V257 HydrophobicContact CB-CG2 3.76Å; V249-V257 WeakPolarHBondContact CA-O 3.44Å; Y250-V257 HydrophobicContact CD2-CB 4.1Å; Y250-V257 HydrophobicContact CD2-CG2 4.35Å; Y250-V257 HydrophobicContact CE1-CB 4.41Å; Y250-V257 HydrophobicContact CE1-CG1 4.33Å; Y250-V257 HydrophobicContact CE2-CB 3.68Å; Y250-V257 HydrophobicContact CE2-CG1 4.05Å; Y250-V257 HydrophobicContact CE2-CG2 3.86Å; Y250-V257 PolarHBondContact N-O 3.2Å; Y250-V257 PolarHBondContact O-N 3.14Å; I252-V257 HydrophobicContact CG2-CG2 4.39Å; V255-V257 HydrophobicContact CG1-CG2 4.47Å; V257-F259 HydrophobicContact CG1-CB 4.34Å; V257-Q266 HydrophobicContact CG1-CB 4.32Å; V257-Q266 HydrophobicContact CG1-CG 3.96Å
258	L	94.3	Very high	91.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	105.3	168.6	-58	88.8	0	0	0	107.4	L243 E247 V249 Q266 R267 W310 L315	L243-L258 HydrophobicContact CD1-CD2 3.97Å; E247-L258 HydrophobicContact CB-CB 4.3Å; V249-L258 HydrophobicContact CG2-CB 4.4Å; V249-L258 HydrophobicContact CG2-CD2 4.22Å; V249-L258 HydrophobicContact CG2-CG 4.01Å; L258-Q266 CarbonylContact O-C 3.53Å; L258-Q266 VanDerWaalsContact O-CA 3.26Å; L258-Q266 WeakPolarHBondContact O-CA 3.42Å; L258-R267 HydrophobicContact CB-CB 4.27Å; L258-R267 HydrophobicContact CD1-CB 4.44Å; L258-R267 WeakPolarHBondContact CD1-O 3.26Å; L258-R267 PolarHBondContact N-O 2.78Å; L258-R267 PolarHBondContact O-N 3.43Å; L258-W310 HydrophobicContact CD1-CH2 4Å; L258-W310 HydrophobicContact CD1-CZ3 4.18Å; L258-W310 HydrophobicContact CD2-CH2 4.49Å; L258-W310 HydrophobicContact CD2-CZ3 4.43Å; L258-L315 HydrophobicContact CD1-CD2 4.01Å
259	F	92.6	Very high	91.4	Very high	6 Å²	6	24.8 Å²	24.8	3%	0.026	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	108.6	-169.9	-179.3	-128.8	0	0	0	112	W226 E247 T248 Y250 V257 V261 L265 Q266 I539	W226-F259 HydrophobicContact CE3-CE2 4.01Å; W226-F259 HydrophobicContact CH2-CD2 4.15Å; W226-F259 AromaticContact CH2-CE2 3.1Å; W226-F259 HydrophobicContact CH2-CE2 3.1Å; W226-F259 AromaticContact CH2-CZ 3.52Å; W226-F259 HydrophobicContact CH2-CZ 3.52Å; W226-F259 HydrophobicContact CZ2-CE2 4.04Å; W226-F259 HydrophobicContact CZ2-CZ 4.33Å; W226-F259 AromaticContact CZ3-CD2 3.67Å; W226-F259 HydrophobicContact CZ3-CD2 3.67Å; W226-F259 AromaticContact CZ3-CE2 3.03Å; W226-F259 HydrophobicContact CZ3-CE2 3.03Å; W226-F259 AromaticContact CZ3-CZ 3.93Å; W226-F259 HydrophobicContact CZ3-CZ 3.93Å; E247-F259 CarbonylContact C-O 3.55Å; E247-F259 WeakPolarHBondContact CA-O 3.48Å; T248-F259 PolarHBondContact N-O 2.96Å; T248-F259 PolarHBondContact O-N 3.13Å; Y250-F259 HydrophobicContact CE1-CB 4.01Å; V257-F259 HydrophobicContact CG1-CB 4.34Å; F259-V261 HydrophobicContact CD1-CG2 3.72Å; F259-V261 HydrophobicContact CE1-CB 4.46Å; F259-V261 HydrophobicContact CE1-CG2 3.72Å; F259-V261 PolarHBondContact O-N 3.16Å; F259-L265 CarbonylContact C-O 3.55Å; F259-Q266 HydrophobicContact CB-CG 4.41Å; F259-Q266 HydrophobicContact CD2-CG 3.44Å; F259-Q266 VanDerWaalsContact CD2-CG 3.44Å; F259-Q266 HydrophobicContact CE2-CG 4.03Å; F259-Q266 HydrophobicContact CG-CG 4.36Å; F259-I539 HydrophobicContact CD1-CD1 4.27Å; F259-I539 HydrophobicContact CE1-CB 4.1Å; F259-I539 HydrophobicContact CE1-CD1 4.31Å; F259-I539 HydrophobicContact CE1-CG1 4.42Å; F259-I539 WeakPolarHBondContact CE1-O 3.48Å
260	N	91.1	Very high	91.2	Very high	16 Å²	16	28.1 Å²	28.1	9%	0.086	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	106.7	168.4	-169.2	-24.1	0	0	0	109.6	E247 D262 E263 Q264 L265	E247-N260 HydrophobicContact CG-CB 4.19Å; N260-D262 VanDerWaalsContact C-N 3.33Å; N260-D262 PolarHBondContact OD1-N 2.91Å; N260-E263 HydrophobicContact CB-CB 4.26Å; N260-E263 WeakPolarHBondContact ND2-CG 3.41Å; N260-E263 PolarHBondContact ND2-OE2 2.95Å; N260-E263 PolarHBondContact OD1-N 2.97Å; N260-Q264 WeakPolarHBondContact O-CA 3.24Å; N260-Q264 PolarHBondContact O-N 2.99Å; N260-Q264 VanDerWaalsContact O-N 3.13Å; N260-L265 PolarHBondContact N-O 3.48Å; N260-L265 PolarHBondContact O-N 3.47Å; N260-L265 VanDerWaalsContact O-N 3.15Å
261	V	86.5	Confident	90.9	Very high	27 Å²	27	29.1 Å²	29.1	16%	0.164	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-35.6	-179.6	-174.8	0	0	0	0	111.2	F259 Q264 I539	F259-V261 HydrophobicContact CD1-CG2 3.72Å; F259-V261 HydrophobicContact CE1-CB 4.46Å; F259-V261 HydrophobicContact CE1-CG2 3.72Å; F259-V261 PolarHBondContact O-N 3.16Å; V261-Q264 PolarHBondContact O-NE2 3.42Å; V261-I539 HydrophobicContact CG1-CG2 4.16Å; V261-I539 HydrophobicContact CG2-CD1 3.78Å
262	D	86.2	Confident	90.8	Very high	116 Å²	116	29.1 Å²	29.1	62%	0.62	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-44.4	-175.3	-67.2	-30.1	0	0	0	111.4	N260 Q264 R514	N260-D262 VanDerWaalsContact C-N 3.33Å; N260-D262 PolarHBondContact OD1-N 2.91Å; D262-Q264 PolarHBondContact O-N 3.37Å; D262-R514 IonicContact OD2-NH1 2.67Å
263	E	85.9	Confident	90.6	Very high	129 Å²	129	31.1 Å²	31.1	60%	0.603	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.5	-179.5	-68.5	179.9	168.9	0	0	112.9	N260 L265	N260-E263 HydrophobicContact CB-CB 4.26Å; N260-E263 WeakPolarHBondContact ND2-CG 3.41Å; N260-E263 PolarHBondContact ND2-OE2 2.95Å; N260-E263 PolarHBondContact OD1-N 2.97Å; E263-L265 VanDerWaalsContact C-N 3.31Å; E263-L265 HydrophobicContact CB-CB 4.33Å; E263-L265 HydrophobicContact CB-CD1 4.11Å; E263-L265 HydrophobicContact CB-CG 4.09Å
264	Q	85	Confident	90.6	Very high	72 Å²	72	32.3 Å²	32.3	34%	0.336	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	60.4	-164.1	-62.6	-74.3	-83.6	0	0	109.5	W226 N260 V261 D262	W226-Q264 HydrophobicContact CE3-CB 4.25Å; W226-Q264 HydrophobicContact CH2-CB 3.14Å; W226-Q264 HydrophobicContact CH2-CG 3.67Å; W226-Q264 VanDerWaalsContact CH2-OE1 3.23Å; W226-Q264 HydrophobicContact CZ2-CB 3.51Å; W226-Q264 HydrophobicContact CZ2-CG 3.94Å; W226-Q264 HydrophobicContact CZ3-CB 3.61Å; W226-Q264 WeakPolarHBondContact CZ3-O 3.3Å; N260-Q264 WeakPolarHBondContact O-CA 3.24Å; N260-Q264 PolarHBondContact O-N 2.99Å; N260-Q264 VanDerWaalsContact O-N 3.13Å; V261-Q264 PolarHBondContact O-NE2 3.42Å; D262-Q264 PolarHBondContact O-N 3.37Å
265	L	86.4	Confident	90.6	Very high	57 Å²	57	33.5 Å²	33.5	30%	0.298	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.9	169.4	-65.8	175.8	0	0	0	113.5	W225 W226 F259 N260 E263	W225-L265 HydrophobicContact CB-CD2 4.01Å; W225-L265 HydrophobicContact CE3-CD1 3.98Å; W225-L265 HydrophobicContact CE3-CD2 3.91Å; W225-L265 HydrophobicContact CE3-CG 4.47Å; W225-L265 HydrophobicContact CZ3-CD1 4.21Å; W225-L265 CarbonylContact O-C 3.58Å; W226-L265 VanDerWaalsContact CE3-CA 3.41Å; W226-L265 VanDerWaalsContact CE3-N 3.32Å; F259-L265 CarbonylContact C-O 3.55Å; N260-L265 PolarHBondContact N-O 3.48Å; N260-L265 PolarHBondContact O-N 3.47Å; N260-L265 VanDerWaalsContact O-N 3.15Å; E263-L265 VanDerWaalsContact C-N 3.31Å; E263-L265 HydrophobicContact CB-CB 4.33Å; E263-L265 HydrophobicContact CB-CD1 4.11Å; E263-L265 HydrophobicContact CB-CG 4.09Å
266	Q	88.1	Confident	90.7	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.037	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.2	173.7	-69.5	-176.8	6.7	0	0	109.8	W225 W226 C228 V257 L258 F259 H268	W225-Q266 CarbonylContact C-O 3.55Å; W225-Q266 WeakPolarHBondContact CA-O 3.46Å; W225-Q266 WeakPolarHBondContact CB-O 3.47Å; W225-Q266 WeakPolarHBondContact O-CA 3.4Å; W225-Q266 WeakPolarHBondContact O-CB 3.37Å; W225-Q266 PolarHBondContact O-N 3.17Å; W226-Q266 HydrophobicContact CE3-CG 4.2Å; W226-Q266 HydrophobicContact CZ3-CG 4.48Å; C228-Q266 PolarHBondContact O-NE2 3.38Å; C228-Q266 VanDerWaalsContact O-NE2 3.14Å; V257-Q266 HydrophobicContact CG1-CB 4.32Å; V257-Q266 HydrophobicContact CG1-CG 3.96Å; L258-Q266 CarbonylContact O-C 3.53Å; L258-Q266 VanDerWaalsContact O-CA 3.26Å; L258-Q266 WeakPolarHBondContact O-CA 3.42Å; F259-Q266 HydrophobicContact CB-CG 4.41Å; F259-Q266 HydrophobicContact CD2-CG 3.44Å; F259-Q266 VanDerWaalsContact CD2-CG 3.44Å; F259-Q266 HydrophobicContact CE2-CG 4.03Å; F259-Q266 HydrophobicContact CG-CG 4.36Å; Q266-H268 PolarHBondContact OE1-NE2 2.81Å
267	R	91.3	Very high	90.6	Very high	57 Å²	57	36 Å²	36	22%	0.215	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.6	165.9	-67.9	165.4	58.5	-138.3	-4.3	108.6	E247 L258 S312 V313 L315	E247-R267 WeakPolarHBondContact OE1-CD 3.41Å; E247-R267 IonicContact OE1-CZ 2.83Å; E247-R267 IonicContact OE1-NH1 3.93Å; E247-R267 PolarHBondContact OE1-NH1 3.32Å; E247-R267 IonicContact OE2-NH1 2.83Å; L258-R267 HydrophobicContact CB-CB 4.27Å; L258-R267 HydrophobicContact CD1-CB 4.44Å; L258-R267 WeakPolarHBondContact CD1-O 3.26Å; L258-R267 PolarHBondContact N-O 2.78Å; L258-R267 PolarHBondContact O-N 3.43Å; R267-S312 PolarHBondContact NH1-O 2.95Å; R267-S312 PolarHBondContact NH2-O 3.06Å; R267-V313 PolarHBondContact NH2-O 3.15Å; R267-L315 HydrophobicContact CB-CD1 4.26Å
268	H	91.9	Very high	90.6	Very high	23 Å²	23	36.2 Å²	36.2	11%	0.106	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.8	-169.8	-50.1	93.6	0	0	0	111.3	L223 D224 C228 V255 V256 Q266 T270	L223-H268 HydrophobicContact CD2-CB 3.78Å; L223-H268 VanDerWaalsContact CD2-CG 3.47Å; D224-H268 PolarHBondContact O-CE1 2.78Å; D224-H268 VanDerWaalsContact O-CE1 3.29Å; C228-H268 PolarHBondContact SG-CD2 2.84Å; C228-H268 PolarHBondContact SG-NE2 3.03Å; C228-H268 VanDerWaalsContact SG-NE2 3.45Å; V255-H268 HydrophobicContact CG1-CB 3.85Å; V256-H268 WeakPolarHBondContact O-CA 3.26Å; Q266-H268 PolarHBondContact OE1-NE2 2.81Å; H268-T270 HydrophobicContact CB-CG2 4.26Å
269	Y	94	Very high	90.7	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	111.9	166.8	175.9	-98.9	0	0	0	109.2	V256 H272 R308 W310 L315 T317	V256-Y269 HydrophobicContact CG2-CD1 4.06Å; V256-Y269 PolarHBondContact N-O 2.8Å; V256-Y269 VanDerWaalsContact N-O 3.08Å; V256-Y269 PolarHBondContact O-N 2.77Å; Y269-H272 AromaticContact CE1-CD2 3.9Å; Y269-R308 WeakPolarHBondContact OH-CD 3.15Å; Y269-W310 AromaticContact CD1-CD2 3.99Å; Y269-W310 HydrophobicContact CD1-CD2 3.99Å; Y269-W310 AromaticContact CD1-CE2 3.77Å; Y269-W310 HydrophobicContact CD1-CG 4.18Å; Y269-W310 HydrophobicContact CD1-CZ2 4.23Å; Y269-W310 AromaticContact CD1-NE1 3.79Å; Y269-W310 HydrophobicContact CD2-CB 4.26Å; Y269-W310 AromaticContact CD2-CD2 3.86Å; Y269-W310 HydrophobicContact CD2-CD2 3.86Å; Y269-W310 AromaticContact CD2-CE3 3.94Å; Y269-W310 HydrophobicContact CD2-CE3 3.94Å; Y269-W310 HydrophobicContact CD2-CG 4.01Å; Y269-W310 AromaticContact CE1-CD1 3.55Å; Y269-W310 HydrophobicContact CE1-CD2 4.16Å; Y269-W310 AromaticContact CE1-CG 3.85Å; Y269-W310 HydrophobicContact CE1-CG 3.85Å; Y269-W310 AromaticContact CE1-NE1 3.67Å; Y269-W310 HydrophobicContact CE2-CB 3.63Å; Y269-W310 HydrophobicContact CE2-CD2 4.06Å; Y269-W310 HydrophobicContact CE2-CE3 4.47Å; Y269-W310 AromaticContact CE2-CG 3.69Å; Y269-W310 HydrophobicContact CE2-CG 3.69Å; Y269-W310 AromaticContact CG-CD2 3.8Å; Y269-W310 HydrophobicContact CG-CD2 3.8Å; Y269-W310 AromaticContact CG-CE2 3.95Å; Y269-W310 AromaticContact CG-CE3 3.99Å; Y269-W310 HydrophobicContact CG-CE3 3.99Å; Y269-W310 HydrophobicContact CG-CG 4.23Å; Y269-W310 HydrophobicContact CG-CH2 4.46Å; Y269-W310 HydrophobicContact CG-CZ2 4.3Å; Y269-W310 HydrophobicContact CG-CZ3 4.3Å; Y269-W310 AromaticContact CZ-CD1 3.6Å; Y269-W310 AromaticContact CZ-CG 3.56Å; Y269-L315 WeakPolarHBondContact CD2-O 3.37Å; Y269-T317 PolarHBondContact OH-OG1 3.27Å
270	T	91.6	Very high	90.9	Very high	69 Å²	69	36.2 Å²	36.2	42%	0.423	19%	0.19	S	C	.	.			trans	-111.5	30.4	-174.1	64.4	0	0	0	0	112.1	L223 V255 H268 H272	L223-T270 HydrophobicContact CD2-CG2 4.42Å; V255-T270 HydrophobicContact CG1-CG2 4.2Å; V255-T270 HydrophobicContact CG2-CG2 4.18Å; H268-T270 HydrophobicContact CB-CG2 4.26Å; T270-H272 VanDerWaalsContact C-N 3.32Å
271	G	89.8	Confident	91.1	Very high	21 Å²	21	36.5 Å²	36.5	22%	0.216	19%	0.192	C	C	.	.			trans	-73	-23.1	-177.1	0	0	0	0	0	113.9	R308	G271-R308 PolarHBondContact O-NE 2.79Å; G271-R308 VanDerWaalsContact O-NE 3.16Å; G271-R308 PolarHBondContact O-NH1 2.86Å; G271-R308 PolarHBondContact O-NH2 3.02Å; G271-R308 VanDerWaalsContact O-NH2 3.07Å
272	H	91.9	Very high	91.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.187	C	C	.	.			trans	-76.8	157.1	-178.3	-70.3	-74.1	0	0	0	112.3	Y269 T270 I276 T290 Q292 H306	Y269-H272 AromaticContact CE1-CD2 3.9Å; T270-H272 VanDerWaalsContact C-N 3.32Å; H272-I276 HydrophobicContact CB-CD1 4.45Å; H272-I276 HydrophobicContact CB-CG1 4.15Å; H272-I276 VanDerWaalsContact CD2-CD1 3.49Å; H272-I276 WeakPolarHBondContact CD2-CD1 3.46Å; H272-T290 PolarHBondContact CE1-O 2.7Å; H272-T290 VanDerWaalsContact NE2-CB 3.32Å; H272-T290 WeakPolarHBondContact NE2-CB 3.48Å; H272-T290 PolarHBondContact NE2-OG1 3.33Å; H272-Q292 PolarHBondContact ND1-OE1 3.35Å; H272-H306 AromaticContact ND1-NE2 3.64Å
273	T	89.6	Confident	91.9	Very high	43 Å²	43	32.5 Å²	32.5	26%	0.264	17%	0.172	S	C	.	.	S	Bend	trans	-104.1	-14.5	-178.9	58.9	0	0	0	0	113	Q292	T273-Q292 PolarHBondContact OG1-NE2 2.9Å; T273-Q292 VanDerWaalsContact OG1-NE2 3.13Å; T273-Q292 PolarHBondContact OG1-OE1 3.49Å
274	D	91.5	Very high	92.3	Very high	26 Å²	26	29.6 Å²	29.6	14%	0.139	16%	0.161	C	C	.	.	S	Bend	trans	-151.7	-175.4	-176.6	-146.8	-52.4	0	0	0	109.5	S254 I276 V293 G295	S254-D274 WeakPolarHBondContact CA-O 3.29Å; S254-D274 VanDerWaalsContact CB-O 3.26Å; S254-D274 WeakPolarHBondContact CB-O 3.39Å; D274-I276 PolarHBondContact O-N 3Å; D274-V293 HydrophobicContact CB-CG2 3.75Å; D274-V293 VanDerWaalsContact OD1-CG2 3.29Å; D274-V293 WeakPolarHBondContact OD1-CG2 3.14Å; D274-G295 WeakPolarHBondContact OD2-CA 3.5Å
275	D	91.9	Very high	92.6	Very high	27 Å²	27	31.3 Å²	31.3	14%	0.144	17%	0.167	C	C	.	.			trans	-45.6	123.9	-179.4	-91	-19.6	0	0	0	113.2	R232 Q292 V293 S785	R232-D275 IonicContact CZ-OD1 3.17Å; R232-D275 IonicContact CZ-OD2 2.78Å; R232-D275 IonicContact NH1-OD1 3.3Å; R232-D275 PolarHBondContact NH1-OD1 2.88Å; R232-D275 IonicContact NH1-OD2 2.67Å; R232-D275 PolarHBondContact NH1-OD2 3.22Å; R232-D275 IonicContact NH2-OD2 2.8Å; R232-D275 PolarHBondContact NH2-OD2 2.94Å; D275-Q292 CarbonylContact O-C 3.47Å; D275-Q292 VanDerWaalsContact O-CA 3.24Å; D275-Q292 WeakPolarHBondContact O-CA 3.48Å; D275-V293 HydrophobicContact CB-CB 4.44Å; D275-V293 HydrophobicContact CB-CG1 3.91Å; D275-V293 HydrophobicContact CB-CG2 3.65Å; D275-V293 PolarHBondContact O-N 2.84Å; D275-S785 WeakPolarHBondContact OD1-CB 3.49Å; D275-S785 PolarHBondContact OD1-OG 2.6Å
276	I	94.9	Very high	92.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	133.4	166.9	-55.5	175	0	0	0	108.2	F251 A253 V256 H272 D274	F251-I276 HydrophobicContact CB-CB 4.19Å; F251-I276 HydrophobicContact CB-CD1 4.12Å; F251-I276 HydrophobicContact CB-CG2 4.14Å; F251-I276 HydrophobicContact CD1-CB 4.42Å; F251-I276 HydrophobicContact CD1-CG2 3.63Å; F251-I276 HydrophobicContact CD2-CB 3.84Å; F251-I276 HydrophobicContact CD2-CG2 3.92Å; F251-I276 WeakPolarHBondContact CD2-O 3.38Å; F251-I276 HydrophobicContact CE1-CG2 3.9Å; F251-I276 HydrophobicContact CE2-CB 4.34Å; F251-I276 HydrophobicContact CE2-CG2 4.22Å; F251-I276 WeakPolarHBondContact CE2-O 3.15Å; F251-I276 HydrophobicContact CG-CB 3.91Å; F251-I276 HydrophobicContact CG-CG2 3.63Å; F251-I276 HydrophobicContact CZ-CG2 4.21Å; A253-I276 PolarHBondContact O-N 2.79Å; V256-I276 HydrophobicContact CG2-CD1 3.47Å; V256-I276 VanDerWaalsContact CG2-CD1 3.47Å; H272-I276 HydrophobicContact CB-CD1 4.45Å; H272-I276 HydrophobicContact CB-CG1 4.15Å; H272-I276 VanDerWaalsContact CD2-CD1 3.49Å; H272-I276 WeakPolarHBondContact CD2-CD1 3.46Å; D274-I276 PolarHBondContact O-N 3Å
277	K	93.5	Very high	93.4	Very high	53 Å²	53	32.3 Å²	32.3	23%	0.23	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-24.3	-178.9	-77.3	-67	-176.3	176.4	0	114.4	R232 D235 F251 G291 V293 L330	R232-K277 VanDerWaalsContact NH2-NZ 3.11Å; D235-K277 IonicContact OD2-NZ 3.02Å; D235-K277 PolarHBondContact OD2-NZ 3.45Å; F251-K277 WeakPolarHBondContact CZ-O 3.3Å; K277-G291 PolarHBondContact N-O 3.48Å; K277-V293 HydrophobicContact CD-CG1 4.29Å; K277-V293 HydrophobicContact CG-CG1 3.41Å; K277-V293 VanDerWaalsContact CG-CG1 3.41Å; K277-L330 WeakPolarHBondContact CB-O 3.46Å
278	C	94.4	Very high	93.6	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.034	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.9	-178.7	48.7	0	0	0	0	111.3	T290 G291 L330 V331 L333	C278-T290 WeakPolarHBondContact O-CA 3.26Å; C278-G291 PolarHBondContact O-N 2.87Å; C278-L330 PolarHBondContact SG-O 2.62Å; C278-V331 WeakPolarHBondContact CB-O 3.19Å; C278-L333 HydrophobicContact CB-CB 4.44Å; C278-L333 HydrophobicContact CB-CD1 4.09Å; C278-L333 HydrophobicContact CB-CG 4.12Å; C278-L333 WeakPolarHBondContact SG-CD1 3.29Å; C278-L333 WeakPolarHBondContact SG-CG 3.49Å
279	L	96.4	Very high	93.9	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139.4	-179.6	-178.7	147.2	0	0	0	109.2	Y241 V249 F251 V256 V281 I288 A289 T290	Y241-L279 HydrophobicContact CD2-CD2 3.25Å; Y241-L279 HydrophobicContact CE2-CD2 3.4Å; Y241-L279 VanDerWaalsContact CE2-CD2 3.4Å; Y241-L279 HydrophobicContact CG-CD2 4.31Å; Y241-L279 PolarHBondContact OH-O 2.59Å; V249-L279 HydrophobicContact CG1-CD1 3.84Å; V249-L279 HydrophobicContact CG1-CD2 4.39Å; F251-L279 HydrophobicContact CD1-CB 3.81Å; F251-L279 HydrophobicContact CD1-CD1 4.1Å; F251-L279 HydrophobicContact CE1-CB 3.74Å; V256-L279 HydrophobicContact CG1-CD1 3.7Å; V256-L279 HydrophobicContact CG2-CD1 4.46Å; L279-V281 HydrophobicContact CD2-CG2 4.13Å; L279-I288 HydrophobicContact CD1-CG2 4.19Å; L279-I288 HydrophobicContact CD2-CG2 4.4Å; L279-I288 HydrophobicContact CG-CG2 4.03Å; L279-A289 CarbonylContact C-O 3.53Å; L279-A289 WeakPolarHBondContact CA-O 3.4Å; L279-T290 HydrophobicContact CB-CG2 4.06Å; L279-T290 HydrophobicContact CD1-CG2 3.66Å; L279-T290 HydrophobicContact CG-CG2 3.8Å
280	A	96.1	Very high	94.1	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.033	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.9	176.3	0	0	0	0	0	110.5	A289 L333 F335	A280-A289 PolarHBondContact N-O 3.03Å; A280-A289 PolarHBondContact O-N 2.75Å; A280-L333 HydrophobicContact CB-CB 3.89Å; A280-L333 WeakPolarHBondContact CB-O 3.1Å; A280-F335 HydrophobicContact CB-CD2 4.06Å; A280-F335 HydrophobicContact CB-CE2 4.35Å
281	V	95.9	Very high	94.3	Very high	22 Å²	22	25 Å²	25	13%	0.133	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.7	-179.2	-177.9	0	0	0	0	110.9	Y241 L243 L279 K285	Y241-V281 HydrophobicContact CD1-CG2 3.97Å; Y241-V281 HydrophobicContact CD2-CG2 4.05Å; Y241-V281 HydrophobicContact CG-CG2 3.68Å; L243-V281 HydrophobicContact CD2-CG1 3.99Å; L279-V281 HydrophobicContact CD2-CG2 4.13Å; V281-K285 HydrophobicContact CG1-CD 4.27Å
282	H	96.4	Very high	94.5	Very high	12 Å²	12	24 Å²	24	6%	0.056	13%	0.126	C	C	.	.			trans	-39.8	138.2	168.5	166.1	-13.3	0	0	0	113.3	D284 K285 T287 F335 G340 G341 W360	H282-D284 WeakPolarHBondContact CA-OD1 3.22Å; H282-D284 IonicContact CE1-OD1 3.94Å; H282-D284 IonicContact CE1-OD2 3.82Å; H282-D284 IonicContact CG-OD1 3.16Å; H282-D284 PolarHBondContact ND1-N 3.04Å; H282-D284 IonicContact ND1-OD1 2.91Å; H282-D284 PolarHBondContact ND1-OD1 3Å; H282-D284 IonicContact ND1-OD2 2.62Å; H282-D284 PolarHBondContact ND1-OD2 2.92Å; H282-D284 PolarHBondContact O-N 3.13Å; H282-K285 WeakPolarHBondContact O-CA 3.47Å; H282-K285 PolarHBondContact O-N 3.41Å; H282-T287 VanDerWaalsContact CA-O 3.25Å; H282-T287 WeakPolarHBondContact CA-O 3.31Å; H282-T287 PolarHBondContact N-O 3.33Å; H282-F335 HydrophobicContact CB-CB 4.14Å; H282-F335 HydrophobicContact CB-CD1 3.88Å; H282-F335 HydrophobicContact CB-CD2 3.35Å; H282-F335 HydrophobicContact CB-CE1 3.98Å; H282-F335 HydrophobicContact CB-CE2 3.46Å; H282-F335 VanDerWaalsContact CB-CE2 3.46Å; H282-F335 HydrophobicContact CB-CG 3.54Å; H282-F335 HydrophobicContact CB-CZ 3.76Å; H282-F335 AromaticContact CD2-CD1 3.58Å; H282-F335 AromaticContact CD2-CE1 3.74Å; H282-G340 PolarHBondContact CE1-O 2.82Å; H282-G340 PolarHBondContact NE2-O 3.13Å; H282-G341 PolarHBondContact CD2-O 3.2Å; H282-G341 WeakPolarHBondContact NE2-CA 3.14Å; H282-G341 PolarHBondContact NE2-O 3.44Å; H282-W360 AromaticContact CD2-CZ2 3.89Å; H282-W360 AromaticContact NE2-CZ2 3.73Å
283	P	93.4	Very high	94.5	Very high	47 Å²	47	24.8 Å²	24.8	31%	0.305	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.7	160	-29.7	37.6	0	0	0	113.8	K285 S336	P283-K285 PolarHBondContact O-N 2.76Å; P283-S336 VanDerWaalsContact CG-O 3.23Å; P283-S336 WeakPolarHBondContact CG-O 3.4Å
284	D	93.3	Very high	94.6	Very high	68 Å²	68	23.9 Å²	23.9	36%	0.364	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.4	170.4	72.3	-8.2	0	0	0	114.2	H282 I286 T287	H282-D284 WeakPolarHBondContact CA-OD1 3.22Å; H282-D284 IonicContact CE1-OD1 3.94Å; H282-D284 IonicContact CE1-OD2 3.82Å; H282-D284 IonicContact CG-OD1 3.16Å; H282-D284 PolarHBondContact ND1-N 3.04Å; H282-D284 IonicContact ND1-OD1 2.91Å; H282-D284 PolarHBondContact ND1-OD1 3Å; H282-D284 IonicContact ND1-OD2 2.62Å; H282-D284 PolarHBondContact ND1-OD2 2.92Å; H282-D284 PolarHBondContact O-N 3.13Å; D284-I286 PolarHBondContact O-N 3.35Å; D284-I286 PolarHBondContact OD1-N 3.01Å; D284-T287 PolarHBondContact OD1-N 3.1Å; D284-T287 WeakPolarHBondContact OD2-CB 3.44Å; D284-T287 PolarHBondContact OD2-N 3.37Å; D284-T287 PolarHBondContact OD2-OG1 3.05Å
285	K	91.7	Very high	94.3	Very high	107 Å²	107	22.7 Å²	22.7	47%	0.465	12%	0.121	S	C	.	.	S	Bend	trans	59.1	19.1	-176.9	-52.5	-61.3	-179.8	-178	0	115.3	P244 V281 H282 P283	P244-K285 HydrophobicContact CG-CB 3.46Å; P244-K285 VanDerWaalsContact CG-CB 3.46Å; P244-K285 HydrophobicContact CG-CG 3.88Å; V281-K285 HydrophobicContact CG1-CD 4.27Å; H282-K285 WeakPolarHBondContact O-CA 3.47Å; H282-K285 PolarHBondContact O-N 3.41Å; P283-K285 PolarHBondContact O-N 2.76Å
286	I	94.1	Very high	93.9	Very high	76 Å²	76	26 Å²	26	39%	0.39	14%	0.143	S	C	.	.	S	Bend	trans	-123	-47.5	-179.5	-65.8	170.3	0	0	0	109.7	D284 D311 S312 V313	D284-I286 PolarHBondContact O-N 3.35Å; D284-I286 PolarHBondContact OD1-N 3.01Å; I286-D311 WeakPolarHBondContact CG2-OD1 3.33Å; I286-S312 WeakPolarHBondContact O-CB 3.29Å; I286-S312 PolarHBondContact O-N 2.85Å; I286-S312 PolarHBondContact O-OG 3.34Å; I286-V313 HydrophobicContact CG2-CG2 4.06Å
287	T	96.6	Very high	93.1	Very high	10 Å²	10	27.7 Å²	27.7	6%	0.061	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.6	179.2	-57.3	0	0	0	0	110.2	H282 D284 V309 L318 F335 W360	H282-T287 VanDerWaalsContact CA-O 3.25Å; H282-T287 WeakPolarHBondContact CA-O 3.31Å; H282-T287 PolarHBondContact N-O 3.33Å; D284-T287 PolarHBondContact OD1-N 3.1Å; D284-T287 WeakPolarHBondContact OD2-CB 3.44Å; D284-T287 PolarHBondContact OD2-N 3.37Å; D284-T287 PolarHBondContact OD2-OG1 3.05Å; T287-V309 HydrophobicContact CG2-CG1 3.44Å; T287-V309 VanDerWaalsContact CG2-CG1 3.44Å; T287-L318 HydrophobicContact CG2-CD1 4.41Å; T287-F335 HydrophobicContact CG2-CZ 4.44Å; T287-W360 HydrophobicContact CG2-CH2 4.15Å; T287-W360 HydrophobicContact CG2-CZ3 4.49Å
288	I	97.4	Very high	92	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.4	179.5	-59.3	174.8	0	0	0	109.4	L243 V249 L279 T290 V309 W310	L243-I288 HydrophobicContact CD1-CD1 4.39Å; L243-I288 HydrophobicContact CD2-CD1 4.45Å; V249-I288 HydrophobicContact CG1-CD1 4.33Å; L279-I288 HydrophobicContact CD1-CG2 4.19Å; L279-I288 HydrophobicContact CD2-CG2 4.4Å; L279-I288 HydrophobicContact CG-CG2 4.03Å; I288-T290 HydrophobicContact CG2-CG2 4.16Å; I288-V309 CarbonylContact O-C 3.56Å; I288-V309 WeakPolarHBondContact O-CA 3.35Å; I288-W310 HydrophobicContact CB-CD2 4.12Å; I288-W310 HydrophobicContact CB-CE3 4.48Å; I288-W310 HydrophobicContact CB-CH2 4.08Å; I288-W310 HydrophobicContact CB-CZ2 3.65Å; I288-W310 HydrophobicContact CB-CZ3 4.47Å; I288-W310 HydrophobicContact CD1-CH2 3.47Å; I288-W310 VanDerWaalsContact CD1-CH2 3.47Å; I288-W310 HydrophobicContact CD1-CZ2 3.88Å; I288-W310 HydrophobicContact CD1-CZ3 3.92Å; I288-W310 HydrophobicContact CG1-CH2 4.31Å; I288-W310 HydrophobicContact CG1-CZ2 4.35Å; I288-W310 HydrophobicContact CG2-CH2 4.15Å; I288-W310 HydrophobicContact CG2-CZ2 3.4Å; I288-W310 PolarHBondContact N-O 3.08Å; I288-W310 VanDerWaalsContact O-CD1 3.31Å; I288-W310 PolarHBondContact O-N 2.85Å
289	A	97.4	Very high	91.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.3	170.4	0	0	0	0	0	110.4	L279 A280 V307 R308 V309 F335 L344	L279-A289 CarbonylContact C-O 3.53Å; L279-A289 WeakPolarHBondContact CA-O 3.4Å; A280-A289 PolarHBondContact N-O 3.03Å; A280-A289 PolarHBondContact O-N 2.75Å; A289-V307 HydrophobicContact CB-CG1 4.35Å; A289-R308 CarbonylContact C-O 3.53Å; A289-R308 WeakPolarHBondContact CA-O 3.35Å; A289-V309 HydrophobicContact CB-CG2 4.26Å; A289-F335 HydrophobicContact CB-CE2 3.44Å; A289-F335 VanDerWaalsContact CB-CE2 3.44Å; A289-F335 HydrophobicContact CB-CZ 3.49Å; A289-F335 VanDerWaalsContact CB-CZ 3.49Å; A289-L344 HydrophobicContact CB-CD1 4.08Å; A289-L344 HydrophobicContact CB-CD2 4.25Å
290	T	97.4	Very high	90	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140	-178.6	42.4	0	0	0	0	110.6	V256 H272 C278 L279 I288 V307 R308 W310	V256-T290 HydrophobicContact CG2-CG2 3.86Å; H272-T290 PolarHBondContact CE1-O 2.7Å; H272-T290 VanDerWaalsContact NE2-CB 3.32Å; H272-T290 WeakPolarHBondContact NE2-CB 3.48Å; H272-T290 PolarHBondContact NE2-OG1 3.33Å; C278-T290 WeakPolarHBondContact O-CA 3.26Å; L279-T290 HydrophobicContact CB-CG2 4.06Å; L279-T290 HydrophobicContact CD1-CG2 3.66Å; L279-T290 HydrophobicContact CG-CG2 3.8Å; I288-T290 HydrophobicContact CG2-CG2 4.16Å; T290-V307 CarbonylContact O-C 3.6Å; T290-V307 WeakPolarHBondContact O-CA 2.99Å; T290-R308 PolarHBondContact N-O 3.16Å; T290-R308 PolarHBondContact O-N 2.91Å; T290-R308 PolarHBondContact OG1-O 3.4Å; T290-W310 HydrophobicContact CG2-CZ2 4.32Å; T290-W310 PolarHBondContact OG1-NE1 2.99Å
291	G	95.5	Very high	89.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.5	-177.3	0	0	0	0	0	111.5	K277 C278 L333	K277-G291 PolarHBondContact N-O 3.48Å; C278-G291 PolarHBondContact O-N 2.87Å; G291-L333 VanDerWaalsContact N-CD1 3.3Å
292	Q	94.1	Very high	88.9	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	163.8	178.4	67.5	168.3	41.2	0	0	113.1	H272 T273 D275 P305 H306	H272-Q292 PolarHBondContact ND1-OE1 3.35Å; T273-Q292 PolarHBondContact OG1-NE2 2.9Å; T273-Q292 VanDerWaalsContact OG1-NE2 3.13Å; T273-Q292 PolarHBondContact OG1-OE1 3.49Å; D275-Q292 CarbonylContact O-C 3.47Å; D275-Q292 VanDerWaalsContact O-CA 3.24Å; D275-Q292 WeakPolarHBondContact O-CA 3.48Å; Q292-P305 WeakPolarHBondContact O-CB 3.41Å; Q292-H306 PolarHBondContact N-O 2.79Å; Q292-H306 PolarHBondContact NE2-CE1 2.75Å; Q292-H306 PolarHBondContact NE2-ND1 2.98Å; Q292-H306 PolarHBondContact OE1-CE1 3.05Å; Q292-H306 PolarHBondContact OE1-NE2 2.9Å; Q292-H306 VanDerWaalsContact OE1-NE2 3.15Å
293	V	93.3	Very high	88.5	Confident	18 Å²	18	50.8 Å²	50.8	11%	0.109	29%	0.285	C	S	.	.			trans	-75.1	164.4	166.9	-54.2	0	0	0	0	112	D274 D275 K277 G295 A329	D274-V293 HydrophobicContact CB-CG2 3.75Å; D274-V293 VanDerWaalsContact OD1-CG2 3.29Å; D274-V293 WeakPolarHBondContact OD1-CG2 3.14Å; D275-V293 HydrophobicContact CB-CB 4.44Å; D275-V293 HydrophobicContact CB-CG1 3.91Å; D275-V293 HydrophobicContact CB-CG2 3.65Å; D275-V293 PolarHBondContact O-N 2.84Å; K277-V293 HydrophobicContact CD-CG1 4.29Å; K277-V293 HydrophobicContact CG-CG1 3.41Å; K277-V293 VanDerWaalsContact CG-CG1 3.41Å; V293-G295 PolarHBondContact O-N 2.83Å; V293-A329 HydrophobicContact CB-CB 4.13Å; V293-A329 HydrophobicContact CG1-CB 3.81Å
294	A	91.3	Very high	88.4	Confident	24 Å²	24	50.2 Å²	50.2	20%	0.198	28%	0.284	C	S	.	.			trans	-66.4	127.8	164.3	0	0	0	0	0	108.7	L303 P305 R328	A294-L303 CarbonylContact C-O 3.59Å; A294-L303 VanDerWaalsContact CA-O 3.26Å; A294-L303 WeakPolarHBondContact CA-O 3.41Å; A294-P305 HydrophobicContact CB-CG 4.2Å; A294-R328 WeakPolarHBondContact CB-O 3.23Å; A294-R328 PolarHBondContact N-O 2.83Å
295	G	85.6	Confident	88.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-178.2	-177.5	0	0	0	0	0	113.7	D274 V293 Q302 L303	D274-G295 WeakPolarHBondContact OD2-CA 3.5Å; V293-G295 PolarHBondContact O-N 2.83Å; G295-Q302 CarbonylContact O-C 3.55Å; G295-Q302 WeakPolarHBondContact O-CA 3.22Å; G295-L303 PolarHBondContact N-O 3.05Å; G295-L303 PolarHBondContact O-N 2.84Å
296	T	82.8	Confident	88.6	Confident	96 Å²	96	42.9 Å²	42.9	59%	0.589	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.1	174.1	-52	0	0	0	0	109.4
297	S	77.7	Confident	88.7	Confident	36 Å²	36	39.3 Å²	39.3	25%	0.252	23%	0.231	S	C	.	.			trans	-70.9	163.4	173.3	-171.2	0	0	0	0	110.9	D299 G300 K301	S297-D299 PolarHBondContact O-N 2.75Å; S297-D299 VanDerWaalsContact O-N 3.09Å; S297-G300 PolarHBondContact O-N 2.99Å; S297-K301 PolarHBondContact N-O 3.14Å
298	S	71.9	Confident	88.8	Confident	52 Å²	52	41 Å²	41	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.7	172	48.3	0	0	0	0	113.1	G300	S298-G300 PolarHBondContact O-N 2.78Å
299	D	73.9	Confident	88.8	Confident	120 Å²	120	41 Å²	41	64%	0.642	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	9.1	177.7	-52.6	-16.5	0	0	0	112.9	S297 K301	S297-D299 PolarHBondContact O-N 2.75Å; S297-D299 VanDerWaalsContact O-N 3.09Å; D299-K301 PolarHBondContact O-N 2.84Å
300	G	74.9	Confident	88.8	Confident	57 Å²	57	41 Å²	41	59%	0.588	24%	0.237	S	C	*	.	S	Bend	trans	72.2	6.9	-176.3	0	0	0	0	0	114.8	S297 S298	S297-G300 PolarHBondContact O-N 2.99Å; S298-G300 PolarHBondContact O-N 2.78Å
301	K	84	Confident	88.7	Confident	140 Å²	140	42.5 Å²	42.5	61%	0.609	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-79.1	133.5	177.5	-68.8	178.9	-176	166.1	0	110.8	S297 D299 L303	S297-K301 PolarHBondContact N-O 3.14Å; D299-K301 PolarHBondContact O-N 2.84Å; K301-L303 PolarHBondContact O-N 3.36Å
302	Q	84.3	Confident	88.7	Confident	150 Å²	150	42.6 Å²	42.6	70%	0.701	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	128.4	174.5	-166.2	175.1	9.6	0	0	110.6	G295	G295-Q302 CarbonylContact O-C 3.55Å; G295-Q302 WeakPolarHBondContact O-CA 3.22Å
303	L	87.8	Confident	88.7	Confident	63 Å²	63	47 Å²	47	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.4	172	-62.7	174.2	0	0	0	108.3	A294 G295 K301	A294-L303 CarbonylContact C-O 3.59Å; A294-L303 VanDerWaalsContact CA-O 3.26Å; A294-L303 WeakPolarHBondContact CA-O 3.41Å; G295-L303 PolarHBondContact N-O 3.05Å; G295-L303 PolarHBondContact O-N 2.84Å; K301-L303 PolarHBondContact O-N 3.36Å
304	A	90.8	Very high	88.6	Confident	36 Å²	36	48.7 Å²	48.7	30%	0.298	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-67.3	145.9	179.3	0	0	0	0	0	111.1
305	P	94.6	Very high	88.8	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.032	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-67.6	145.6	169	23.2	-21	0	0	0	109.8	Q292 A294 F326 L330	Q292-P305 WeakPolarHBondContact O-CB 3.41Å; A294-P305 HydrophobicContact CB-CG 4.2Å; P305-F326 HydrophobicContact CB-CB 4.32Å; P305-F326 WeakPolarHBondContact CD-O 3.34Å; P305-F326 HydrophobicContact CG-CB 3.85Å; P305-F326 WeakPolarHBondContact CG-O 3.49Å; P305-L330 HydrophobicContact CB-CG 4.46Å
306	H	95.1	Very high	89.2	Confident	16 Å²	16	54.4 Å²	54.4	7%	0.074	31%	0.312	C	S	.	.			trans	-147.1	161.8	178.7	62.7	-112.6	0	0	0	111	H272 Q292 R308 V320 L330	H272-H306 AromaticContact ND1-NE2 3.64Å; Q292-H306 PolarHBondContact N-O 2.79Å; Q292-H306 PolarHBondContact NE2-CE1 2.75Å; Q292-H306 PolarHBondContact NE2-ND1 2.98Å; Q292-H306 PolarHBondContact OE1-CE1 3.05Å; Q292-H306 PolarHBondContact OE1-NE2 2.9Å; Q292-H306 VanDerWaalsContact OE1-NE2 3.15Å; H306-R308 PolarHBondContact NE2-NE 2.77Å; H306-V320 HydrophobicContact CB-CG1 4.08Å; H306-L330 VanDerWaalsContact C-CD1 3.5Å; H306-L330 VanDerWaalsContact O-CD1 3.28Å; H306-L330 WeakPolarHBondContact O-CD1 3.12Å
307	V	97.1	Very high	89.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.5	168.1	179.5	0	0	0	0	109.1	A289 T290 V309 V320 L321 F326 L330 L333 L344 V346	A289-V307 HydrophobicContact CB-CG1 4.35Å; T290-V307 CarbonylContact O-C 3.6Å; T290-V307 WeakPolarHBondContact O-CA 2.99Å; V307-V309 HydrophobicContact CG1-CG2 4.48Å; V307-V320 CarbonylContact O-C 3.41Å; V307-V320 WeakPolarHBondContact O-CA 3.21Å; V307-L321 HydrophobicContact CB-CB 4.18Å; V307-L321 HydrophobicContact CG1-CD1 4.43Å; V307-L321 PolarHBondContact N-O 3.33Å; V307-L321 VanDerWaalsContact N-O 3.11Å; V307-L321 PolarHBondContact O-N 2.83Å; V307-F326 HydrophobicContact CG2-CE2 4Å; V307-F326 HydrophobicContact CG2-CZ 4.24Å; V307-L330 HydrophobicContact CB-CD1 4.42Å; V307-L330 HydrophobicContact CG2-CD1 3.4Å; V307-L330 VanDerWaalsContact CG2-CD1 3.4Å; V307-L333 HydrophobicContact CG1-CD1 4.49Å; V307-L333 HydrophobicContact CG1-CD2 4.28Å; V307-L333 HydrophobicContact CG2-CD2 3.84Å; V307-L344 HydrophobicContact CG1-CD2 3.99Å; V307-V346 HydrophobicContact CG2-CG1 4.01Å; V307-V346 HydrophobicContact CG2-CG2 4.08Å
308	R	97.3	Very high	90.8	Very high	47 Å²	47	54.5 Å²	54.5	18%	0.177	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.2	167.4	-69.8	179.7	172.9	-117	5.3	109.9	Y269 G271 A289 T290 H306 T317 H319 V320	Y269-R308 WeakPolarHBondContact OH-CD 3.15Å; G271-R308 PolarHBondContact O-NE 2.79Å; G271-R308 VanDerWaalsContact O-NE 3.16Å; G271-R308 PolarHBondContact O-NH1 2.86Å; G271-R308 PolarHBondContact O-NH2 3.02Å; G271-R308 VanDerWaalsContact O-NH2 3.07Å; A289-R308 CarbonylContact C-O 3.53Å; A289-R308 WeakPolarHBondContact CA-O 3.35Å; T290-R308 PolarHBondContact N-O 3.16Å; T290-R308 PolarHBondContact O-N 2.91Å; T290-R308 PolarHBondContact OG1-O 3.4Å; H306-R308 PolarHBondContact NE2-NE 2.77Å; R308-T317 HydrophobicContact CB-CG2 4.47Å; R308-T317 HydrophobicContact CG-CG2 4.45Å; R308-T317 PolarHBondContact NH1-OG1 3.18Å; R308-H319 WeakPolarHBondContact CA-O 3.32Å; R308-V320 HydrophobicContact CG-CG2 4.37Å
309	V	97.6	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129	167.7	-173	0	0	0	0	107.6	T287 I288 A289 V307 L318 H319 L321 F335 W360	T287-V309 HydrophobicContact CG2-CG1 3.44Å; T287-V309 VanDerWaalsContact CG2-CG1 3.44Å; I288-V309 CarbonylContact O-C 3.56Å; I288-V309 WeakPolarHBondContact O-CA 3.35Å; A289-V309 HydrophobicContact CB-CG2 4.26Å; V307-V309 HydrophobicContact CG1-CG2 4.48Å; V309-L318 WeakPolarHBondContact O-CA 3.17Å; V309-L318 WeakPolarHBondContact O-CB 3.4Å; V309-L318 PolarHBondContact O-N 2.95Å; V309-H319 HydrophobicContact CB-CB 4.28Å; V309-H319 PolarHBondContact N-O 2.92Å; V309-H319 PolarHBondContact O-N 2.69Å; V309-H319 VanDerWaalsContact O-N 3.1Å; V309-L321 HydrophobicContact CG2-CD1 4.14Å; V309-F335 HydrophobicContact CG1-CZ 4.46Å; V309-W360 HydrophobicContact CB-CE3 4.45Å; V309-W360 HydrophobicContact CG1-CD2 4.47Å; V309-W360 HydrophobicContact CG1-CE3 3.85Å; V309-W360 HydrophobicContact CG1-CZ3 3.98Å; V309-W360 HydrophobicContact CG2-CB 4.38Å; V309-W360 HydrophobicContact CG2-CE3 4.5Å
310	W	97.5	Very high	93	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	159.6	-172.6	54.2	-82.7	0	0	0	111.3	V256 L258 Y269 I288 T290 L315 N316	V256-W310 HydrophobicContact CB-CH2 4.26Å; V256-W310 HydrophobicContact CB-CZ2 3.99Å; V256-W310 HydrophobicContact CG1-CH2 3.93Å; V256-W310 HydrophobicContact CG1-CZ2 3.79Å; V256-W310 HydrophobicContact CG2-CZ2 3.9Å; L258-W310 HydrophobicContact CD1-CH2 4Å; L258-W310 HydrophobicContact CD1-CZ3 4.18Å; L258-W310 HydrophobicContact CD2-CH2 4.49Å; L258-W310 HydrophobicContact CD2-CZ3 4.43Å; Y269-W310 AromaticContact CD1-CD2 3.99Å; Y269-W310 HydrophobicContact CD1-CD2 3.99Å; Y269-W310 AromaticContact CD1-CE2 3.77Å; Y269-W310 HydrophobicContact CD1-CG 4.18Å; Y269-W310 HydrophobicContact CD1-CZ2 4.23Å; Y269-W310 AromaticContact CD1-NE1 3.79Å; Y269-W310 HydrophobicContact CD2-CB 4.26Å; Y269-W310 AromaticContact CD2-CD2 3.86Å; Y269-W310 HydrophobicContact CD2-CD2 3.86Å; Y269-W310 AromaticContact CD2-CE3 3.94Å; Y269-W310 HydrophobicContact CD2-CE3 3.94Å; Y269-W310 HydrophobicContact CD2-CG 4.01Å; Y269-W310 AromaticContact CE1-CD1 3.55Å; Y269-W310 HydrophobicContact CE1-CD2 4.16Å; Y269-W310 AromaticContact CE1-CG 3.85Å; Y269-W310 HydrophobicContact CE1-CG 3.85Å; Y269-W310 AromaticContact CE1-NE1 3.67Å; Y269-W310 HydrophobicContact CE2-CB 3.63Å; Y269-W310 HydrophobicContact CE2-CD2 4.06Å; Y269-W310 HydrophobicContact CE2-CE3 4.47Å; Y269-W310 AromaticContact CE2-CG 3.69Å; Y269-W310 HydrophobicContact CE2-CG 3.69Å; Y269-W310 AromaticContact CG-CD2 3.8Å; Y269-W310 HydrophobicContact CG-CD2 3.8Å; Y269-W310 AromaticContact CG-CE2 3.95Å; Y269-W310 AromaticContact CG-CE3 3.99Å; Y269-W310 HydrophobicContact CG-CE3 3.99Å; Y269-W310 HydrophobicContact CG-CG 4.23Å; Y269-W310 HydrophobicContact CG-CH2 4.46Å; Y269-W310 HydrophobicContact CG-CZ2 4.3Å; Y269-W310 HydrophobicContact CG-CZ3 4.3Å; Y269-W310 AromaticContact CZ-CD1 3.6Å; Y269-W310 AromaticContact CZ-CG 3.56Å; I288-W310 HydrophobicContact CB-CD2 4.12Å; I288-W310 HydrophobicContact CB-CE3 4.48Å; I288-W310 HydrophobicContact CB-CH2 4.08Å; I288-W310 HydrophobicContact CB-CZ2 3.65Å; I288-W310 HydrophobicContact CB-CZ3 4.47Å; I288-W310 HydrophobicContact CD1-CH2 3.47Å; I288-W310 VanDerWaalsContact CD1-CH2 3.47Å; I288-W310 HydrophobicContact CD1-CZ2 3.88Å; I288-W310 HydrophobicContact CD1-CZ3 3.92Å; I288-W310 HydrophobicContact CG1-CH2 4.31Å; I288-W310 HydrophobicContact CG1-CZ2 4.35Å; I288-W310 HydrophobicContact CG2-CH2 4.15Å; I288-W310 HydrophobicContact CG2-CZ2 3.4Å; I288-W310 PolarHBondContact N-O 3.08Å; I288-W310 VanDerWaalsContact O-CD1 3.31Å; I288-W310 PolarHBondContact O-N 2.85Å; T290-W310 HydrophobicContact CG2-CZ2 4.32Å; T290-W310 PolarHBondContact OG1-NE1 2.99Å; W310-L315 HydrophobicContact CE3-CD2 4.43Å; W310-L315 HydrophobicContact CZ3-CD2 3.95Å; W310-N316 VanDerWaalsContact CA-O 3.27Å; W310-N316 WeakPolarHBondContact CA-O 3.43Å; W310-N316 VanDerWaalsContact CB-O 3.27Å; W310-N316 WeakPolarHBondContact CB-O 3.43Å
311	D	96.3	Very high	93.9	Very high	30 Å²	30	48 Å²	48	16%	0.16	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.2	-179.9	169.5	38.4	0	0	0	110.8	I286 V313 S314 L315 N316 L318	I286-D311 WeakPolarHBondContact CG2-OD1 3.33Å; D311-V313 PolarHBondContact O-N 3.01Å; D311-V313 PolarHBondContact OD1-N 3.04Å; D311-S314 WeakPolarHBondContact OD2-CB 3.34Å; D311-S314 PolarHBondContact OD2-N 3.23Å; D311-S314 PolarHBondContact OD2-OG 2.86Å; D311-L315 WeakPolarHBondContact O-CA 3.43Å; D311-L315 PolarHBondContact O-N 3.45Å; D311-N316 PolarHBondContact N-O 3.02Å; D311-L318 HydrophobicContact CB-CD1 4.31Å; D311-L318 HydrophobicContact CB-CD2 4.4Å; D311-L318 HydrophobicContact CB-CG 4.43Å
312	S	95.1	Very high	93.9	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.014	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.1	-179.5	71.1	0	0	0	0	113.8	R267 I286	R267-S312 PolarHBondContact NH1-O 2.95Å; R267-S312 PolarHBondContact NH2-O 3.06Å; I286-S312 WeakPolarHBondContact O-CB 3.29Å; I286-S312 PolarHBondContact O-N 2.85Å; I286-S312 PolarHBondContact O-OG 3.34Å
313	V	93.2	Very high	93.9	Very high	93 Å²	93	39.4 Å²	39.4	56%	0.564	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-52	-179.6	179.9	0	0	0	0	111.1	R267 I286 D311	R267-V313 PolarHBondContact NH2-O 3.15Å; I286-V313 HydrophobicContact CG2-CG2 4.06Å; D311-V313 PolarHBondContact O-N 3.01Å; D311-V313 PolarHBondContact OD1-N 3.04Å
314	S	92.8	Very high	93.8	Very high	54 Å²	54	39.4 Å²	39.4	38%	0.378	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-15.1	-179.8	67.4	0	0	0	0	114.2	D311 N316	D311-S314 WeakPolarHBondContact OD2-CB 3.34Å; D311-S314 PolarHBondContact OD2-N 3.23Å; D311-S314 PolarHBondContact OD2-OG 2.86Å; S314-N316 WeakPolarHBondContact CB-ND2 3.3Å; S314-N316 PolarHBondContact O-N 2.93Å; S314-N316 PolarHBondContact OG-N 2.89Å; S314-N316 PolarHBondContact OG-ND2 2.92Å
315	L	94.1	Very high	93.8	Very high	46 Å²	46	40.4 Å²	40.4	24%	0.241	24%	0.24	C	C	.	.			trans	60.2	18.4	-173.2	-52.1	175	0	0	0	113.8	L258 R267 Y269 W310 D311	L258-L315 HydrophobicContact CD1-CD2 4.01Å; R267-L315 HydrophobicContact CB-CD1 4.26Å; Y269-L315 WeakPolarHBondContact CD2-O 3.37Å; W310-L315 HydrophobicContact CE3-CD2 4.43Å; W310-L315 HydrophobicContact CZ3-CD2 3.95Å; D311-L315 WeakPolarHBondContact O-CA 3.43Å; D311-L315 PolarHBondContact O-N 3.45Å
316	N	95.7	Very high	93.8	Very high	100 Å²	100	40.6 Å²	40.6	54%	0.535	24%	0.24	S	C	.	.			trans	-83.8	138.8	177.1	-69.3	-41.7	0	0	0	111	W310 D311 S314 L318	W310-N316 VanDerWaalsContact CA-O 3.27Å; W310-N316 WeakPolarHBondContact CA-O 3.43Å; W310-N316 VanDerWaalsContact CB-O 3.27Å; W310-N316 WeakPolarHBondContact CB-O 3.43Å; D311-N316 PolarHBondContact N-O 3.02Å; S314-N316 WeakPolarHBondContact CB-ND2 3.3Å; S314-N316 PolarHBondContact O-N 2.93Å; S314-N316 PolarHBondContact OG-N 2.89Å; S314-N316 PolarHBondContact OG-ND2 2.92Å; N316-L318 PolarHBondContact O-N 2.72Å
317	T	96.5	Very high	93.6	Very high	54 Å²	54	43.4 Å²	43.4	33%	0.331	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.5	167	-51	0	0	0	0	109.4	Y269 R308 V320	Y269-T317 PolarHBondContact OH-OG1 3.27Å; R308-T317 HydrophobicContact CB-CG2 4.47Å; R308-T317 HydrophobicContact CG-CG2 4.45Å; R308-T317 PolarHBondContact NH1-OG1 3.18Å; T317-V320 HydrophobicContact CG2-CG2 3.89Å
318	L	95.9	Very high	93.3	Very high	79 Å²	79	49.2 Å²	49.2	41%	0.414	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-49.1	175.9	-58.4	176.2	0	0	0	110.6	T287 V309 D311 N316	T287-L318 HydrophobicContact CG2-CD1 4.41Å; V309-L318 WeakPolarHBondContact O-CA 3.17Å; V309-L318 WeakPolarHBondContact O-CB 3.4Å; V309-L318 PolarHBondContact O-N 2.95Å; D311-L318 HydrophobicContact CB-CD1 4.31Å; D311-L318 HydrophobicContact CB-CD2 4.4Å; D311-L318 HydrophobicContact CB-CG 4.43Å; N316-L318 PolarHBondContact O-N 2.72Å
319	H	96.3	Very high	93	Very high	42 Å²	42	47.5 Å²	47.5	19%	0.194	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.6	-175.6	-63.6	-77.9	0	0	0	112.2	R308 V309 L321 W360 Q361 E363	R308-H319 WeakPolarHBondContact CA-O 3.32Å; V309-H319 HydrophobicContact CB-CB 4.28Å; V309-H319 PolarHBondContact N-O 2.92Å; V309-H319 PolarHBondContact O-N 2.69Å; V309-H319 VanDerWaalsContact O-N 3.1Å; H319-L321 HydrophobicContact CB-CD2 4.25Å; H319-W360 AromaticContact CD2-CE3 3.78Å; H319-W360 AromaticContact CD2-CZ3 3.9Å; H319-Q361 PolarHBondContact CE1-O 3.09Å; H319-Q361 VanDerWaalsContact CE1-O 3.26Å; H319-E363 HydrophobicContact CB-CG 4.4Å; H319-E363 IonicContact CE1-OE1 3.88Å; H319-E363 IonicContact CG-OE1 3.59Å; H319-E363 IonicContact ND1-OE1 3.87Å; H319-E363 PolarHBondContact ND1-OE1 2.95Å
320	V	95.7	Very high	92.8	Very high	49 Å²	49	47.5 Å²	47.5	30%	0.297	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	110.3	172.6	-174.2	0	0	0	0	108.8	H306 V307 R308 T317	H306-V320 HydrophobicContact CB-CG1 4.08Å; V307-V320 CarbonylContact O-C 3.41Å; V307-V320 WeakPolarHBondContact O-CA 3.21Å; R308-V320 HydrophobicContact CG-CG2 4.37Å; T317-V320 HydrophobicContact CG2-CG2 3.89Å
321	L	94	Very high	92.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.5	-171.4	-48.1	173.5	0	0	0	112.1	V307 V309 H319 T323 L344 W360 E363	V307-L321 HydrophobicContact CB-CB 4.18Å; V307-L321 HydrophobicContact CG1-CD1 4.43Å; V307-L321 PolarHBondContact N-O 3.33Å; V307-L321 VanDerWaalsContact N-O 3.11Å; V307-L321 PolarHBondContact O-N 2.83Å; V309-L321 HydrophobicContact CG2-CD1 4.14Å; H319-L321 HydrophobicContact CB-CD2 4.25Å; L321-T323 VanDerWaalsContact C-N 3.35Å; L321-T323 PolarHBondContact O-N 2.89Å; L321-L344 HydrophobicContact CD1-CD2 3.88Å; L321-W360 HydrophobicContact CD1-CB 3.74Å; L321-E363 HydrophobicContact CD2-CB 4Å; L321-E363 HydrophobicContact CD2-CG 3.84Å
322	G	84.3	Confident	92.4	Very high	11 Å²	11	48.4 Å²	48.4	11%	0.113	28%	0.281	C	S	.	.			trans	67.6	27.5	165.9	0	0	0	0	0	115.5	G324 F325 F326	G322-G324 PolarHBondContact O-N 2.76Å; G322-F325 PolarHBondContact O-N 2.9Å; G322-F326 WeakPolarHBondContact O-CD2 3.29Å
323	T	84.5	Confident	92.4	Very high	100 Å²	100	49 Å²	49	61%	0.613	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	113.8	174	-52.3	0	0	0	0	110.1	L321 F325	L321-T323 VanDerWaalsContact C-N 3.35Å; L321-T323 PolarHBondContact O-N 2.89Å; T323-F325 VanDerWaalsContact C-N 3.33Å
324	G	85.3	Confident	92.5	Very high	63 Å²	63	45 Å²	45	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	3.1	-178.2	0	0	0	0	0	115.5	G322	G322-G324 PolarHBondContact O-N 2.76Å
325	F	91.7	Very high	92.7	Very high	57 Å²	57	42.8 Å²	42.8	25%	0.25	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-47.3	173	169.6	-106.7	0	0	0	112.1	G322 T323 V354 W358 R365 E368	G322-F325 PolarHBondContact O-N 2.9Å; T323-F325 VanDerWaalsContact C-N 3.33Å; F325-V354 HydrophobicContact CZ-CG1 4.25Å; F325-W358 HydrophobicContact CD1-CH2 4.28Å; F325-W358 AromaticContact CD1-CZ2 3.58Å; F325-W358 HydrophobicContact CD1-CZ2 3.58Å; F325-W358 AromaticContact CE1-CZ2 3.94Å; F325-W358 HydrophobicContact CE1-CZ2 3.94Å; F325-W358 HydrophobicContact CG-CZ2 4.22Å; F325-R365 VanDerWaalsContact CD2-NH1 3.27Å; F325-E368 WeakPolarHBondContact CE2-OE2 3.36Å; F325-E368 WeakPolarHBondContact CZ-OE2 3.4Å
326	F	93.3	Very high	92.8	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.035	23%	0.232	C	C	.	.	S	Bend	trans	-74.5	150.6	-177.8	-58.1	-65.4	0	0	0	111.4	P305 V307 G322 L330 V346 D348 W358	P305-F326 HydrophobicContact CB-CB 4.32Å; P305-F326 WeakPolarHBondContact CD-O 3.34Å; P305-F326 HydrophobicContact CG-CB 3.85Å; P305-F326 WeakPolarHBondContact CG-O 3.49Å; V307-F326 HydrophobicContact CG2-CE2 4Å; V307-F326 HydrophobicContact CG2-CZ 4.24Å; G322-F326 WeakPolarHBondContact O-CD2 3.29Å; F326-L330 HydrophobicContact CB-CD2 3.83Å; F326-L330 HydrophobicContact CD1-CD2 3.6Å; F326-L330 HydrophobicContact CD2-CD1 4.38Å; F326-L330 HydrophobicContact CD2-CD2 3.96Å; F326-L330 HydrophobicContact CE1-CD2 4.06Å; F326-L330 HydrophobicContact CE2-CD2 4.38Å; F326-L330 HydrophobicContact CG-CD2 3.54Å; F326-L330 HydrophobicContact CZ-CD2 4.44Å; F326-V346 HydrophobicContact CD1-CG1 4.35Å; F326-V346 HydrophobicContact CE1-CB 3.93Å; F326-V346 HydrophobicContact CE1-CG1 3.55Å; F326-V346 HydrophobicContact CZ-CB 4Å; F326-V346 HydrophobicContact CZ-CG1 3.68Å; F326-V346 HydrophobicContact CZ-CG2 4.16Å; F326-D348 HydrophobicContact CB-CB 4.46Å; F326-D348 HydrophobicContact CD1-CB 4.14Å; F326-W358 HydrophobicContact CE1-CZ2 4.46Å; F326-W358 AromaticContact CZ-CZ2 3.96Å; F326-W358 HydrophobicContact CZ-CZ2 3.96Å; F326-W358 AromaticContact CZ-NE1 3.77Å
327	D	91	Very high	92.6	Very high	75 Å²	75	39.9 Å²	39.9	40%	0.401	22%	0.224	S	C	.	.			trans	-117.5	145.6	176.8	-171.3	24.2	0	0	0	111.5	A329	D327-A329 VanDerWaalsContact C-N 3.29Å; D327-A329 PolarHBondContact O-N 3.29Å
328	R	91.2	Very high	92.3	Very high	122 Å²	122	39.8 Å²	39.8	46%	0.46	23%	0.226	S	C	.	.	S	Bend	trans	56.3	-65.3	-179.7	-64.4	177.5	174	169.3	2.9	117.4	A294 D349 N351	A294-R328 WeakPolarHBondContact CB-O 3.23Å; A294-R328 PolarHBondContact N-O 2.83Å; R328-D349 HydrophobicContact CB-CB 4.43Å; R328-D349 VanDerWaalsContact CD-O 3.31Å; R328-D349 WeakPolarHBondContact CD-O 3.26Å; R328-N351 VanDerWaalsContact CZ-OD1 3.3Å; R328-N351 PolarHBondContact NH1-OD1 2.87Å; R328-N351 PolarHBondContact NH2-OD1 2.79Å; R328-N351 VanDerWaalsContact NH2-OD1 3.14Å
329	A	91.9	Very high	91.9	Very high	11 Å²	11	38.2 Å²	38.2	9%	0.091	22%	0.218	C	C	.	.			trans	-161.7	169.2	-176	0	0	0	0	0	111.7	V293 D327 D348 D349	V293-A329 HydrophobicContact CB-CB 4.13Å; V293-A329 HydrophobicContact CG1-CB 3.81Å; D327-A329 VanDerWaalsContact C-N 3.29Å; D327-A329 PolarHBondContact O-N 3.29Å; A329-D348 CarbonylContact O-C 3.53Å; A329-D348 VanDerWaalsContact O-CA 3.29Å; A329-D348 WeakPolarHBondContact O-CA 3.36Å; A329-D349 HydrophobicContact CB-CB 3.9Å; A329-D349 PolarHBondContact O-N 2.92Å
330	L	93.1	Very high	91.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.2	175.5	-62.5	-179.9	0	0	0	110.1	K277 C278 P305 H306 V307 F326 V346 D348	K277-L330 WeakPolarHBondContact CB-O 3.46Å; C278-L330 PolarHBondContact SG-O 2.62Å; P305-L330 HydrophobicContact CB-CG 4.46Å; H306-L330 VanDerWaalsContact C-CD1 3.5Å; H306-L330 VanDerWaalsContact O-CD1 3.28Å; H306-L330 WeakPolarHBondContact O-CD1 3.12Å; V307-L330 HydrophobicContact CB-CD1 4.42Å; V307-L330 HydrophobicContact CG2-CD1 3.4Å; V307-L330 VanDerWaalsContact CG2-CD1 3.4Å; F326-L330 HydrophobicContact CB-CD2 3.83Å; F326-L330 HydrophobicContact CD1-CD2 3.6Å; F326-L330 HydrophobicContact CD2-CD1 4.38Å; F326-L330 HydrophobicContact CD2-CD2 3.96Å; F326-L330 HydrophobicContact CE1-CD2 4.06Å; F326-L330 HydrophobicContact CE2-CD2 4.38Å; F326-L330 HydrophobicContact CG-CD2 3.54Å; F326-L330 HydrophobicContact CZ-CD2 4.44Å; L330-V346 HydrophobicContact CD1-CG1 4.45Å; L330-V346 HydrophobicContact CD2-CG1 3.69Å; L330-D348 HydrophobicContact CD2-CB 4.13Å
331	V	91.9	Very high	91.4	Very high	43 Å²	43	36 Å²	36	26%	0.261	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-39.5	-171.4	-169.5	0	0	0	0	111.9	C278 V347 D349 V376	C278-V331 WeakPolarHBondContact CB-O 3.19Å; V331-V347 PolarHBondContact N-O 2.87Å; V331-D349 HydrophobicContact CG2-CB 3.56Å; V331-V376 WeakPolarHBondContact CG1-O 3.45Å
332	C	92.9	Very high	91.3	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.4	-175.8	-53.6	0	0	0	0	111.6	V346 V347 F377 A378 A379	C332-V346 WeakPolarHBondContact O-CA 3.49Å; C332-V347 HydrophobicContact CB-CB 4.04Å; C332-V347 HydrophobicContact CB-CG2 4.17Å; C332-V347 PolarHBondContact N-O 2.96Å; C332-V347 PolarHBondContact O-N 2.81Å; C332-F377 VanDerWaalsContact SG-C 3.55Å; C332-A378 VanDerWaalsContact SG-CA 3.6Å; C332-A379 HydrophobicContact CB-CB 3.79Å
333	L	95.1	Very high	91.8	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	136.9	173.2	-70.6	171.5	0	0	0	109	C278 A280 G291 V307 L344 C345 V346	C278-L333 HydrophobicContact CB-CB 4.44Å; C278-L333 HydrophobicContact CB-CD1 4.09Å; C278-L333 HydrophobicContact CB-CG 4.12Å; C278-L333 WeakPolarHBondContact SG-CD1 3.29Å; C278-L333 WeakPolarHBondContact SG-CG 3.49Å; A280-L333 HydrophobicContact CB-CB 3.89Å; A280-L333 WeakPolarHBondContact CB-O 3.1Å; G291-L333 VanDerWaalsContact N-CD1 3.3Å; V307-L333 HydrophobicContact CG1-CD1 4.49Å; V307-L333 HydrophobicContact CG1-CD2 4.28Å; V307-L333 HydrophobicContact CG2-CD2 3.84Å; L333-L344 HydrophobicContact CD2-CD2 4.39Å; L333-C345 WeakPolarHBondContact CA-O 3.04Å; L333-V346 HydrophobicContact CD2-CB 4.01Å; L333-V346 HydrophobicContact CD2-CG1 3.71Å; L333-V346 HydrophobicContact CD2-CG2 3.6Å
334	A	96.3	Very high	92.4	Very high	9 Å²	9	35 Å²	35	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	142.4	167.1	0	0	0	0	0	111.4	L344 C345 A379 F381	A334-L344 WeakPolarHBondContact O-CD1 3.4Å; A334-C345 PolarHBondContact N-O 3.22Å; A334-C345 PolarHBondContact O-N 2.87Å; A334-C345 PolarHBondContact O-SG 3.34Å; A334-A379 VanDerWaalsContact CB-O 3.28Å; A334-A379 WeakPolarHBondContact CB-O 3.43Å; A334-F381 HydrophobicContact CB-CD2 4.38Å; A334-F381 WeakPolarHBondContact O-CE2 3.44Å
335	F	96.6	Very high	92.9	Very high	8 Å²	8	32 Å²	32	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	147	170	-73.1	-81.4	0	0	0	110.7	A280 H282 T287 A289 V309 L344 W360 F381	A280-F335 HydrophobicContact CB-CD2 4.06Å; A280-F335 HydrophobicContact CB-CE2 4.35Å; H282-F335 HydrophobicContact CB-CB 4.14Å; H282-F335 HydrophobicContact CB-CD1 3.88Å; H282-F335 HydrophobicContact CB-CD2 3.35Å; H282-F335 HydrophobicContact CB-CE1 3.98Å; H282-F335 HydrophobicContact CB-CE2 3.46Å; H282-F335 VanDerWaalsContact CB-CE2 3.46Å; H282-F335 HydrophobicContact CB-CG 3.54Å; H282-F335 HydrophobicContact CB-CZ 3.76Å; H282-F335 AromaticContact CD2-CD1 3.58Å; H282-F335 AromaticContact CD2-CE1 3.74Å; T287-F335 HydrophobicContact CG2-CZ 4.44Å; A289-F335 HydrophobicContact CB-CE2 3.44Å; A289-F335 VanDerWaalsContact CB-CE2 3.44Å; A289-F335 HydrophobicContact CB-CZ 3.49Å; A289-F335 VanDerWaalsContact CB-CZ 3.49Å; V309-F335 HydrophobicContact CG1-CZ 4.46Å; F335-L344 HydrophobicContact CD1-CB 4.26Å; F335-L344 HydrophobicContact CD1-CD1 3.67Å; F335-L344 HydrophobicContact CD2-CD1 3.98Å; F335-L344 HydrophobicContact CE1-CB 4.31Å; F335-L344 HydrophobicContact CE1-CD1 3.73Å; F335-L344 HydrophobicContact CE1-CG 4.48Å; F335-L344 HydrophobicContact CE2-CD1 4.04Å; F335-L344 HydrophobicContact CG-CD1 3.83Å; F335-L344 HydrophobicContact CZ-CD1 3.94Å; F335-W360 AromaticContact CD1-NE1 3.98Å; F335-W360 AromaticContact CE1-CD1 3.77Å; F335-W360 HydrophobicContact CE1-CD2 4.34Å; F335-W360 HydrophobicContact CE1-CG 4.18Å; F335-W360 AromaticContact CE1-NE1 3.65Å; F335-F381 VanDerWaalsContact C-CD2 3.43Å; F335-F381 WeakPolarHBondContact O-CD2 3.31Å
336	S	95.5	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.			trans	-60.7	143	166	44.9	0	0	0	0	110.7	P283 N339 G341 T343 F381	P283-S336 VanDerWaalsContact CG-O 3.23Å; P283-S336 WeakPolarHBondContact CG-O 3.4Å; S336-N339 VanDerWaalsContact CB-OD1 3.25Å; S336-N339 WeakPolarHBondContact CB-OD1 2.89Å; S336-N339 PolarHBondContact OG-ND2 2.97Å; S336-N339 PolarHBondContact OG-OD1 2.84Å; S336-G341 WeakPolarHBondContact O-CA 3.09Å; S336-G341 PolarHBondContact O-N 3.47Å; S336-T343 VanDerWaalsContact CB-OG1 3.22Å; S336-T343 WeakPolarHBondContact CB-OG1 3.33Å; S336-T343 PolarHBondContact N-O 2.74Å; S336-T343 PolarHBondContact OG-N 3.15Å; S336-T343 PolarHBondContact OG-O 3.4Å; S336-T343 PolarHBondContact OG-OG1 3.5Å; S336-F381 VanDerWaalsContact N-CD2 3.35Å
337	K	91.8	Very high	93.3	Very high	85 Å²	85	28.9 Å²	28.9	37%	0.37	16%	0.16	S	C	.	.	S	Bend	trans	-104.4	-31.6	-175.4	-61.8	171.6	-170.2	161.4	0	112.3	D380	K337-D380 WeakPolarHBondContact CE-OD1 3.42Å; K337-D380 IonicContact NZ-OD1 3.37Å; K337-D380 PolarHBondContact NZ-OD1 2.9Å; K337-D380 IonicContact NZ-OD2 2.83Å; K337-D380 PolarHBondContact NZ-OD2 2.95Å
338	S	89.3	Confident	93.4	Very high	52 Å²	52	25.5 Å²	25.5	36%	0.364	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-31.3	-171.3	53.9	0	0	0	0	115.1	P383 T384 S386	S338-P383 WeakPolarHBondContact CB-O 3.26Å; S338-T384 VanDerWaalsContact CB-C 3.47Å; S338-S386 VanDerWaalsContact OG-CA 3.28Å; S338-S386 WeakPolarHBondContact OG-CA 3.38Å; S338-S386 VanDerWaalsContact OG-CB 3.29Å; S338-S386 WeakPolarHBondContact OG-CB 2.95Å; S338-S386 PolarHBondContact OG-N 3.24Å
339	N	89.4	Confident	93.5	Very high	47 Å²	47	22.7 Å²	22.7	25%	0.251	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	18	-178.4	64.8	3.2	0	0	0	112.5	S336 G341 N342 T343 S386	S336-N339 VanDerWaalsContact CB-OD1 3.25Å; S336-N339 WeakPolarHBondContact CB-OD1 2.89Å; S336-N339 PolarHBondContact OG-ND2 2.97Å; S336-N339 PolarHBondContact OG-OD1 2.84Å; N339-G341 VanDerWaalsContact C-N 3.3Å; N339-G341 PolarHBondContact O-N 3.48Å; N339-G341 PolarHBondContact OD1-N 3.14Å; N339-N342 PolarHBondContact OD1-N 2.61Å; N339-T343 PolarHBondContact ND2-OG1 2.85Å; N339-S386 WeakPolarHBondContact ND2-CB 3.29Å
340	G	88.9	Confident	93.5	Very high	43 Å²	43	22.8 Å²	22.8	44%	0.443	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	9.2	-175.8	0	0	0	0	0	115	H282	H282-G340 PolarHBondContact CE1-O 2.82Å; H282-G340 PolarHBondContact NE2-O 3.13Å
341	G	90.9	Very high	93.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	13.4	176.4	0	0	0	0	0	115.7	H282 S336 N339 T343 W360	H282-G341 PolarHBondContact CD2-O 3.2Å; H282-G341 WeakPolarHBondContact NE2-CA 3.14Å; H282-G341 PolarHBondContact NE2-O 3.44Å; S336-G341 WeakPolarHBondContact O-CA 3.09Å; S336-G341 PolarHBondContact O-N 3.47Å; N339-G341 VanDerWaalsContact C-N 3.3Å; N339-G341 PolarHBondContact O-N 3.48Å; N339-G341 PolarHBondContact OD1-N 3.14Å; G341-T343 PolarHBondContact O-N 2.86Å; G341-T343 VanDerWaalsContact O-N 3.13Å; G341-W360 PolarHBondContact O-NE1 2.9Å
342	N	92.8	Very high	93.4	Very high	76 Å²	76	28 Å²	28	41%	0.406	16%	0.163	S	C	.	.			trans	-60.2	-25.3	-177.9	-71.9	-2.3	0	0	0	114.2	N339 W360	N339-N342 PolarHBondContact OD1-N 2.61Å; N342-W360 VanDerWaalsContact O-CD1 3.26Å
343	T	94.8	Very high	93.5	Very high	15 Å²	15	28.4 Å²	28.4	9%	0.092	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.1	178.4	59.1	0	0	0	0	112.3	S336 N339 G341 W358 L366	S336-T343 VanDerWaalsContact CB-OG1 3.22Å; S336-T343 WeakPolarHBondContact CB-OG1 3.33Å; S336-T343 PolarHBondContact N-O 2.74Å; S336-T343 PolarHBondContact OG-N 3.15Å; S336-T343 PolarHBondContact OG-O 3.4Å; S336-T343 PolarHBondContact OG-OG1 3.5Å; N339-T343 PolarHBondContact ND2-OG1 2.85Å; G341-T343 PolarHBondContact O-N 2.86Å; G341-T343 VanDerWaalsContact O-N 3.13Å; T343-W358 CarbonylContact C-O 3.56Å; T343-W358 VanDerWaalsContact CA-O 3.25Å; T343-W358 WeakPolarHBondContact CA-O 2.92Å; T343-L366 HydrophobicContact CG2-CD1 3.66Å
344	L	96.4	Very high	93.5	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132	177.4	-178.2	74.3	0	0	0	109.3	A289 V307 L321 L333 A334 F335 V346 V357 W358 W360	A289-L344 HydrophobicContact CB-CD1 4.08Å; A289-L344 HydrophobicContact CB-CD2 4.25Å; V307-L344 HydrophobicContact CG1-CD2 3.99Å; L321-L344 HydrophobicContact CD1-CD2 3.88Å; L333-L344 HydrophobicContact CD2-CD2 4.39Å; A334-L344 WeakPolarHBondContact O-CD1 3.4Å; F335-L344 HydrophobicContact CD1-CB 4.26Å; F335-L344 HydrophobicContact CD1-CD1 3.67Å; F335-L344 HydrophobicContact CD2-CD1 3.98Å; F335-L344 HydrophobicContact CE1-CB 4.31Å; F335-L344 HydrophobicContact CE1-CD1 3.73Å; F335-L344 HydrophobicContact CE1-CG 4.48Å; F335-L344 HydrophobicContact CE2-CD1 4.04Å; F335-L344 HydrophobicContact CG-CD1 3.83Å; F335-L344 HydrophobicContact CZ-CD1 3.94Å; L344-V346 HydrophobicContact CD2-CG2 4.12Å; L344-V346 HydrophobicContact CG-CG2 4.22Å; L344-V357 CarbonylContact O-C 3.55Å; L344-V357 WeakPolarHBondContact O-CA 3.27Å; L344-W358 PolarHBondContact N-O 3.37Å; L344-W358 PolarHBondContact O-N 3.34Å; L344-W360 HydrophobicContact CB-CB 4.3Å
345	C	96.1	Very high	93.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143	170.5	73	0	0	0	0	110.3	L333 A334 L355 S356 V357 F381 V389	L333-C345 WeakPolarHBondContact CA-O 3.04Å; A334-C345 PolarHBondContact N-O 3.22Å; A334-C345 PolarHBondContact O-N 2.87Å; A334-C345 PolarHBondContact O-SG 3.34Å; C345-L355 HydrophobicContact CB-CD1 4.22Å; C345-S356 CarbonylContact C-O 3.56Å; C345-S356 WeakPolarHBondContact CA-O 3.44Å; C345-V357 HydrophobicContact CB-CG2 4.34Å; C345-F381 HydrophobicContact CB-CD2 4.37Å; C345-F381 HydrophobicContact CB-CE2 3.45Å; C345-F381 VanDerWaalsContact CB-CE2 3.45Å; C345-F381 HydrophobicContact CB-CZ 3.74Å; C345-F381 WeakPolarHBondContact SG-CE2 3.47Å; C345-V389 HydrophobicContact CB-CG2 4.48Å
346	V	96.4	Very high	93.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.4	-176.7	-169.8	0	0	0	0	108.7	V307 F326 L330 C332 L333 L344 S356	V307-V346 HydrophobicContact CG2-CG1 4.01Å; V307-V346 HydrophobicContact CG2-CG2 4.08Å; F326-V346 HydrophobicContact CD1-CG1 4.35Å; F326-V346 HydrophobicContact CE1-CB 3.93Å; F326-V346 HydrophobicContact CE1-CG1 3.55Å; F326-V346 HydrophobicContact CZ-CB 4Å; F326-V346 HydrophobicContact CZ-CG1 3.68Å; F326-V346 HydrophobicContact CZ-CG2 4.16Å; L330-V346 HydrophobicContact CD1-CG1 4.45Å; L330-V346 HydrophobicContact CD2-CG1 3.69Å; C332-V346 WeakPolarHBondContact O-CA 3.49Å; L333-V346 HydrophobicContact CD2-CB 4.01Å; L333-V346 HydrophobicContact CD2-CG1 3.71Å; L333-V346 HydrophobicContact CD2-CG2 3.6Å; L344-V346 HydrophobicContact CD2-CG2 4.12Å; L344-V346 HydrophobicContact CG-CG2 4.22Å; V346-S356 PolarHBondContact N-O 2.93Å; V346-S356 PolarHBondContact O-N 2.77Å; V346-S356 PolarHBondContact O-OG 3.49Å
347	V	96.3	Very high	93.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.9	170.9	-175.2	0	0	0	0	109	V331 C332 H353 V354 L355 V376 A379	V331-V347 PolarHBondContact N-O 2.87Å; C332-V347 HydrophobicContact CB-CB 4.04Å; C332-V347 HydrophobicContact CB-CG2 4.17Å; C332-V347 PolarHBondContact N-O 2.96Å; C332-V347 PolarHBondContact O-N 2.81Å; V347-H353 HydrophobicContact CG1-CB 4.13Å; V347-V354 WeakPolarHBondContact CA-O 3.31Å; V347-L355 HydrophobicContact CG2-CB 4.38Å; V347-L355 HydrophobicContact CG2-CD1 3.68Å; V347-V376 HydrophobicContact CG1-CB 4.2Å; V347-V376 HydrophobicContact CG1-CG1 4.3Å; V347-V376 HydrophobicContact CG1-CG2 4.42Å; V347-A379 HydrophobicContact CG2-CB 3.9Å
348	D	94.7	Very high	93.7	Very high	4 Å²	4	25 Å²	25	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	168	173.9	69.6	30.3	0	0	0	112.9	F326 A329 L330 S350 H353 V354	F326-D348 HydrophobicContact CB-CB 4.46Å; F326-D348 HydrophobicContact CD1-CB 4.14Å; A329-D348 CarbonylContact O-C 3.53Å; A329-D348 VanDerWaalsContact O-CA 3.29Å; A329-D348 WeakPolarHBondContact O-CA 3.36Å; L330-D348 HydrophobicContact CD2-CB 4.13Å; D348-S350 VanDerWaalsContact C-N 3.32Å; D348-S350 WeakPolarHBondContact OD1-CB 3.26Å; D348-S350 PolarHBondContact OD1-N 3.01Å; D348-S350 VanDerWaalsContact OD1-N 3.1Å; D348-S350 PolarHBondContact OD1-OG 2.72Å; D348-H353 WeakPolarHBondContact O-CA 3.48Å; D348-V354 PolarHBondContact N-O 3.45Å; D348-V354 PolarHBondContact OD1-N 3.19Å
349	D	92.6	Very high	94	Very high	64 Å²	64	24 Å²	24	34%	0.342	14%	0.139	S	C	.	.			trans	-98.4	28.2	177.1	-156.3	38.3	0	0	0	111.7	R328 A329 V331 H353	R328-D349 HydrophobicContact CB-CB 4.43Å; R328-D349 VanDerWaalsContact CD-O 3.31Å; R328-D349 WeakPolarHBondContact CD-O 3.26Å; A329-D349 HydrophobicContact CB-CB 3.9Å; A329-D349 PolarHBondContact O-N 2.92Å; V331-D349 HydrophobicContact CG2-CB 3.56Å; D349-H353 IonicContact OD1-CD2 3.38Å; D349-H353 IonicContact OD1-NE2 3.87Å
350	S	92	Very high	94.3	Very high	12 Å²	12	22.3 Å²	22.3	8%	0.084	13%	0.129	C	C	.	.	S	Bend	trans	-65.9	166.2	171.5	71.1	0	0	0	0	110.3	D348 D352 H353	D348-S350 VanDerWaalsContact C-N 3.32Å; D348-S350 WeakPolarHBondContact OD1-CB 3.26Å; D348-S350 PolarHBondContact OD1-N 3.01Å; D348-S350 VanDerWaalsContact OD1-N 3.1Å; D348-S350 PolarHBondContact OD1-OG 2.72Å; S350-D352 PolarHBondContact O-N 2.75Å; S350-D352 PolarHBondContact OG-N 2.95Å; S350-H353 PolarHBondContact O-N 3.29Å; S350-H353 PolarHBondContact O-ND1 3.33Å; S350-H353 PolarHBondContact OG-N 3.14Å; S350-H353 VanDerWaalsContact OG-N 3.13Å
351	N	90.4	Very high	94.5	Very high	104 Å²	104	24.9 Å²	24.9	56%	0.556	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.4	176.3	-66.6	-30.7	0	0	0	113.1	R328	R328-N351 VanDerWaalsContact CZ-OD1 3.3Å; R328-N351 PolarHBondContact NH1-OD1 2.87Å; R328-N351 PolarHBondContact NH2-OD1 2.79Å; R328-N351 VanDerWaalsContact NH2-OD1 3.14Å
352	D	92.3	Very high	94.7	Very high	49 Å²	49	32.1 Å²	32.1	26%	0.262	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	2.2	179.5	-70	-28.6	0	0	0	113.1	S350 V354 K370 C371 S372	S350-D352 PolarHBondContact O-N 2.75Å; S350-D352 PolarHBondContact OG-N 2.95Å; D352-V354 HydrophobicContact CB-CG2 4.43Å; D352-V354 PolarHBondContact O-N 2.93Å; D352-K370 HydrophobicContact CB-CB 4.39Å; D352-K370 HydrophobicContact CB-CD 4.11Å; D352-K370 HydrophobicContact CB-CG 4.16Å; D352-K370 IonicContact OD1-NZ 3.67Å; D352-K370 VanDerWaalsContact OD2-CE 3.25Å; D352-K370 WeakPolarHBondContact OD2-CE 3.27Å; D352-K370 IonicContact OD2-NZ 3.56Å; D352-K370 PolarHBondContact OD2-NZ 3.41Å; D352-C371 PolarHBondContact O-N 3.43Å; D352-S372 CarbonylContact C-O 3.59Å; D352-S372 PolarHBondContact O-N 3.12Å
353	H	94.3	Very high	94.7	Very high	16 Å²	16	33.2 Å²	33.2	7%	0.074	16%	0.16	C	C	.	.			trans	35.2	71.5	-174.3	-56.1	77.1	0	0	0	111.8	V347 D348 D349 S350 L355 C371 S372 E374 V376	V347-H353 HydrophobicContact CG1-CB 4.13Å; D348-H353 WeakPolarHBondContact O-CA 3.48Å; D349-H353 IonicContact OD1-CD2 3.38Å; D349-H353 IonicContact OD1-NE2 3.87Å; S350-H353 PolarHBondContact O-N 3.29Å; S350-H353 PolarHBondContact O-ND1 3.33Å; S350-H353 PolarHBondContact OG-N 3.14Å; S350-H353 VanDerWaalsContact OG-N 3.13Å; H353-L355 PolarHBondContact O-N 2.89Å; H353-C371 WeakPolarHBondContact O-CB 3.35Å; H353-C371 PolarHBondContact O-N 3.11Å; H353-S372 WeakPolarHBondContact CB-O 3.4Å; H353-S372 PolarHBondContact N-O 2.5Å; H353-S372 PolarHBondContact ND1-O 2.92Å; H353-E374 PolarHBondContact CE1-O 2.8Å; H353-V376 HydrophobicContact CB-CG2 3.98Å
354	V	96.1	Very high	94.6	Very high	25 Å²	25	36.5 Å²	36.5	15%	0.152	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	123.7	-170.4	-179	0	0	0	0	109.7	F325 V347 D348 D352 E368	F325-V354 HydrophobicContact CZ-CG1 4.25Å; V347-V354 WeakPolarHBondContact CA-O 3.31Å; D348-V354 PolarHBondContact N-O 3.45Å; D348-V354 PolarHBondContact OD1-N 3.19Å; D352-V354 HydrophobicContact CB-CG2 4.43Å; D352-V354 PolarHBondContact O-N 2.93Å; V354-E368 HydrophobicContact CG1-CB 4.27Å
355	L	96.9	Very high	94.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.8	167.9	172.4	64.6	0	0	0	108.2	C345 V347 H353 E368 A369 C371 V389 T391 W400 L407	C345-L355 HydrophobicContact CB-CD1 4.22Å; V347-L355 HydrophobicContact CG2-CB 4.38Å; V347-L355 HydrophobicContact CG2-CD1 3.68Å; H353-L355 PolarHBondContact O-N 2.89Å; L355-E368 CarbonylContact O-C 3.59Å; L355-E368 WeakPolarHBondContact O-CA 3.31Å; L355-A369 PolarHBondContact N-O 2.88Å; L355-A369 PolarHBondContact O-N 3.33Å; L355-C371 HydrophobicContact CB-CB 3.95Å; L355-V389 HydrophobicContact CD1-CG1 4.46Å; L355-V389 HydrophobicContact CD2-CG1 4.46Å; L355-T391 HydrophobicContact CD2-CG2 4.15Å; L355-W400 HydrophobicContact CD2-CB 4.29Å; L355-W400 HydrophobicContact CD2-CD2 3.71Å; L355-W400 HydrophobicContact CD2-CE3 4.3Å; L355-W400 HydrophobicContact CD2-CG 3.66Å; L355-L407 HydrophobicContact CD2-CD1 4.02Å; L355-L407 HydrophobicContact CG-CD1 3.97Å
356	S	96	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.6	176.7	59.8	0	0	0	0	111	C345 V346 W358 A367	C345-S356 CarbonylContact C-O 3.56Å; C345-S356 WeakPolarHBondContact CA-O 3.44Å; V346-S356 PolarHBondContact N-O 2.93Å; V346-S356 PolarHBondContact O-N 2.77Å; V346-S356 PolarHBondContact O-OG 3.49Å; S356-W358 PolarHBondContact OG-NE1 2.77Å; S356-A367 WeakPolarHBondContact CA-O 3.4Å
357	V	96.1	Very high	94.3	Very high	1 Å²	1	45 Å²	45	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.4	176.7	-177.9	0	0	0	0	108.7	L344 C345 L366 A367 F381 L402 L407	L344-V357 CarbonylContact O-C 3.55Å; L344-V357 WeakPolarHBondContact O-CA 3.27Å; C345-V357 HydrophobicContact CB-CG2 4.34Å; V357-L366 HydrophobicContact CG1-CD1 4.35Å; V357-L366 WeakPolarHBondContact O-CB 3.04Å; V357-L366 PolarHBondContact O-N 2.79Å; V357-A367 PolarHBondContact N-O 3.49Å; V357-A367 PolarHBondContact O-N 2.81Å; V357-F381 HydrophobicContact CG1-CZ 4.38Å; V357-L402 HydrophobicContact CG1-CD2 4.28Å; V357-L407 HydrophobicContact CG2-CD1 4.29Å; V357-L407 HydrophobicContact CG2-CD2 4.13Å
358	W	95.9	Very high	94.2	Very high	17 Å²	17	49.1 Å²	49.1	6%	0.064	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.7	-171.9	-62.8	78.9	0	0	0	110.8	F325 F326 T343 L344 S356 E364 R365	F325-W358 HydrophobicContact CD1-CH2 4.28Å; F325-W358 AromaticContact CD1-CZ2 3.58Å; F325-W358 HydrophobicContact CD1-CZ2 3.58Å; F325-W358 AromaticContact CE1-CZ2 3.94Å; F325-W358 HydrophobicContact CE1-CZ2 3.94Å; F325-W358 HydrophobicContact CG-CZ2 4.22Å; F326-W358 HydrophobicContact CE1-CZ2 4.46Å; F326-W358 AromaticContact CZ-CZ2 3.96Å; F326-W358 HydrophobicContact CZ-CZ2 3.96Å; F326-W358 AromaticContact CZ-NE1 3.77Å; T343-W358 CarbonylContact C-O 3.56Å; T343-W358 VanDerWaalsContact CA-O 3.25Å; T343-W358 WeakPolarHBondContact CA-O 2.92Å; L344-W358 PolarHBondContact N-O 3.37Å; L344-W358 PolarHBondContact O-N 3.34Å; S356-W358 PolarHBondContact OG-NE1 2.77Å; W358-E364 WeakPolarHBondContact CA-O 3.37Å; W358-R365 HydrophobicContact CD2-CB 4.09Å; W358-R365 HydrophobicContact CD2-CG 4.23Å; W358-R365 HydrophobicContact CE3-CB 3.8Å; W358-R365 HydrophobicContact CE3-CG 4.43Å; W358-R365 HydrophobicContact CH2-CB 3.85Å; W358-R365 HydrophobicContact CH2-CG 4.2Å; W358-R365 HydrophobicContact CZ2-CB 4.12Å; W358-R365 HydrophobicContact CZ2-CG 3.97Å; W358-R365 HydrophobicContact CZ3-CB 3.69Å; W358-R365 HydrophobicContact CZ3-CG 4.43Å
359	D	95.3	Very high	94.2	Very high	30 Å²	30	50 Å²	50	16%	0.16	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	100.7	154	-176.8	-28.4	0	0	0	106.5	Q361 R362 E363 E364 L366	D359-Q361 VanDerWaalsContact C-N 3.31Å; D359-Q361 PolarHBondContact O-N 3.06Å; D359-Q361 PolarHBondContact OD1-N 3.22Å; D359-R362 HydrophobicContact CB-CB 4.41Å; D359-R362 PolarHBondContact O-N 2.68Å; D359-R362 PolarHBondContact OD1-N 3.31Å; D359-R362 VanDerWaalsContact OD1-N 3.17Å; D359-R362 VanDerWaalsContact OD2-CD 3.25Å; D359-R362 WeakPolarHBondContact OD2-CD 3.4Å; D359-E363 PolarHBondContact O-N 3.02Å; D359-E364 PolarHBondContact N-O 2.73Å; D359-E364 PolarHBondContact O-N 2.97Å; D359-E364 VanDerWaalsContact O-N 3.09Å; D359-L366 HydrophobicContact CB-CD1 4.26Å; D359-L366 HydrophobicContact CB-CD2 4.16Å; D359-L366 HydrophobicContact CB-CG 4.23Å
360	W	94.7	Very high	94.3	Very high	13 Å²	13	53.3 Å²	53.3	5%	0.049	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-23.2	-170	63.5	-94	0	0	0	112.9	H282 T287 V309 H319 L321 F335 G341 N342 L344	H282-W360 AromaticContact CD2-CZ2 3.89Å; H282-W360 AromaticContact NE2-CZ2 3.73Å; T287-W360 HydrophobicContact CG2-CH2 4.15Å; T287-W360 HydrophobicContact CG2-CZ3 4.49Å; V309-W360 HydrophobicContact CB-CE3 4.45Å; V309-W360 HydrophobicContact CG1-CD2 4.47Å; V309-W360 HydrophobicContact CG1-CE3 3.85Å; V309-W360 HydrophobicContact CG1-CZ3 3.98Å; V309-W360 HydrophobicContact CG2-CB 4.38Å; V309-W360 HydrophobicContact CG2-CE3 4.5Å; H319-W360 AromaticContact CD2-CE3 3.78Å; H319-W360 AromaticContact CD2-CZ3 3.9Å; L321-W360 HydrophobicContact CD1-CB 3.74Å; F335-W360 AromaticContact CD1-NE1 3.98Å; F335-W360 AromaticContact CE1-CD1 3.77Å; F335-W360 HydrophobicContact CE1-CD2 4.34Å; F335-W360 HydrophobicContact CE1-CG 4.18Å; F335-W360 AromaticContact CE1-NE1 3.65Å; G341-W360 PolarHBondContact O-NE1 2.9Å; N342-W360 VanDerWaalsContact O-CD1 3.26Å; L344-W360 HydrophobicContact CB-CB 4.3Å
361	Q	94.5	Very high	94.3	Very high	97 Å²	97	53 Å²	53	45%	0.453	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-34.2	177.9	-67.7	178.2	13.6	0	0	111.3	H319 D359	H319-Q361 PolarHBondContact CE1-O 3.09Å; H319-Q361 VanDerWaalsContact CE1-O 3.26Å; D359-Q361 VanDerWaalsContact C-N 3.31Å; D359-Q361 PolarHBondContact O-N 3.06Å; D359-Q361 PolarHBondContact OD1-N 3.22Å
362	R	93.4	Very high	94.4	Very high	151 Å²	151	48.7 Å²	48.7	57%	0.57	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-5.2	178.3	-58.6	-177.6	71.7	-124.5	-15.5	112.9	D359 E364	D359-R362 HydrophobicContact CB-CB 4.41Å; D359-R362 PolarHBondContact O-N 2.68Å; D359-R362 PolarHBondContact OD1-N 3.31Å; D359-R362 VanDerWaalsContact OD1-N 3.17Å; D359-R362 VanDerWaalsContact OD2-CD 3.25Å; D359-R362 WeakPolarHBondContact OD2-CD 3.4Å; R362-E364 HydrophobicContact CB-CB 4.33Å; R362-E364 HydrophobicContact CB-CG 4.19Å; R362-E364 IonicContact CZ-OE1 3.43Å; R362-E364 IonicContact CZ-OE2 3.23Å; R362-E364 VanDerWaalsContact CZ-OE2 3.23Å; R362-E364 IonicContact NH1-OE1 3.71Å; R362-E364 IonicContact NH1-OE2 2.71Å; R362-E364 PolarHBondContact NH1-OE2 2.81Å; R362-E364 IonicContact NH2-OE1 2.82Å; R362-E364 PolarHBondContact NH2-OE1 2.91Å; R362-E364 IonicContact NH2-OE2 3.33Å; R362-E364 PolarHBondContact NH2-OE2 2.99Å; R362-E364 PolarHBondContact O-N 3.32Å
363	E	93.6	Very high	94.3	Very high	100 Å²	100	52.1 Å²	52.1	47%	0.467	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	27.8	-173.8	-52.2	-175.3	172.6	0	0	112.8	H319 L321 D359	H319-E363 HydrophobicContact CB-CG 4.4Å; H319-E363 IonicContact CE1-OE1 3.88Å; H319-E363 IonicContact CG-OE1 3.59Å; H319-E363 IonicContact ND1-OE1 3.87Å; H319-E363 PolarHBondContact ND1-OE1 2.95Å; L321-E363 HydrophobicContact CD2-CB 4Å; L321-E363 HydrophobicContact CD2-CG 3.84Å; D359-E363 PolarHBondContact O-N 3.02Å
364	E	93.1	Very high	94.3	Very high	83 Å²	83	55.4 Å²	55.4	39%	0.388	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132	-175.3	-77.5	-179.7	-173.7	0	0	110.8	W358 D359 R362	W358-E364 WeakPolarHBondContact CA-O 3.37Å; D359-E364 PolarHBondContact N-O 2.73Å; D359-E364 PolarHBondContact O-N 2.97Å; D359-E364 VanDerWaalsContact O-N 3.09Å; R362-E364 HydrophobicContact CB-CB 4.33Å; R362-E364 HydrophobicContact CB-CG 4.19Å; R362-E364 IonicContact CZ-OE1 3.43Å; R362-E364 IonicContact CZ-OE2 3.23Å; R362-E364 VanDerWaalsContact CZ-OE2 3.23Å; R362-E364 IonicContact NH1-OE1 3.71Å; R362-E364 IonicContact NH1-OE2 2.71Å; R362-E364 PolarHBondContact NH1-OE2 2.81Å; R362-E364 IonicContact NH2-OE1 2.82Å; R362-E364 PolarHBondContact NH2-OE1 2.91Å; R362-E364 IonicContact NH2-OE2 3.33Å; R362-E364 PolarHBondContact NH2-OE2 2.99Å; R362-E364 PolarHBondContact O-N 3.32Å
365	R	94.4	Very high	94.1	Very high	108 Å²	108	56 Å²	56	41%	0.408	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	121.4	172.8	-170.6	-179.2	66	171.5	17.4	109.9	F325 W358 E368	F325-R365 VanDerWaalsContact CD2-NH1 3.27Å; W358-R365 HydrophobicContact CD2-CB 4.09Å; W358-R365 HydrophobicContact CD2-CG 4.23Å; W358-R365 HydrophobicContact CE3-CB 3.8Å; W358-R365 HydrophobicContact CE3-CG 4.43Å; W358-R365 HydrophobicContact CH2-CB 3.85Å; W358-R365 HydrophobicContact CH2-CG 4.2Å; W358-R365 HydrophobicContact CZ2-CB 4.12Å; W358-R365 HydrophobicContact CZ2-CG 3.97Å; W358-R365 HydrophobicContact CZ3-CB 3.69Å; W358-R365 HydrophobicContact CZ3-CG 4.43Å; R365-E368 IonicContact CZ-OE1 3.32Å; R365-E368 IonicContact CZ-OE2 3.95Å; R365-E368 IonicContact NE-OE2 2.79Å; R365-E368 VanDerWaalsContact NH1-CD 3.27Å; R365-E368 IonicContact NH1-OE1 2.87Å; R365-E368 PolarHBondContact NH1-OE1 3.19Å; R365-E368 IonicContact NH1-OE2 3.46Å; R365-E368 PolarHBondContact NH1-OE2 3.37Å; R365-E368 IonicContact NH2-OE1 2.53Å; R365-E368 PolarHBondContact NH2-OE1 3.14Å; R365-E368 IonicContact NH2-OE2 3.33Å
366	L	93.8	Very high	94	Very high	66 Å²	66	56.1 Å²	56.1	35%	0.346	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-40.9	-178	-60	179.2	0	0	0	112.7	T343 V357 D359	T343-L366 HydrophobicContact CG2-CD1 3.66Å; V357-L366 HydrophobicContact CG1-CD1 4.35Å; V357-L366 WeakPolarHBondContact O-CB 3.04Å; V357-L366 PolarHBondContact O-N 2.79Å; D359-L366 HydrophobicContact CB-CD1 4.26Å; D359-L366 HydrophobicContact CB-CD2 4.16Å; D359-L366 HydrophobicContact CB-CG 4.23Å
367	A	94.5	Very high	93.9	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.041	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	157.4	-179.2	0	0	0	0	0	111.5	S356 V357 L402 G405 L407	S356-A367 WeakPolarHBondContact CA-O 3.4Å; V357-A367 PolarHBondContact N-O 3.49Å; V357-A367 PolarHBondContact O-N 2.81Å; A367-L402 HydrophobicContact CB-CD1 3.44Å; A367-L402 VanDerWaalsContact CB-CD1 3.44Å; A367-G405 VanDerWaalsContact CB-O 3.26Å; A367-G405 WeakPolarHBondContact CB-O 3.05Å; A367-L407 HydrophobicContact CB-CD1 4.26Å; A367-L407 HydrophobicContact CB-CG 3.93Å
368	E	94.3	Very high	93.8	Very high	87 Å²	87	58.3 Å²	58.3	41%	0.407	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.2	170.7	71.8	-171.8	157.5	0	0	110.7	F325 V354 L355 R365	F325-E368 WeakPolarHBondContact CE2-OE2 3.36Å; F325-E368 WeakPolarHBondContact CZ-OE2 3.4Å; V354-E368 HydrophobicContact CG1-CB 4.27Å; L355-E368 CarbonylContact O-C 3.59Å; L355-E368 WeakPolarHBondContact O-CA 3.31Å; R365-E368 IonicContact CZ-OE1 3.32Å; R365-E368 IonicContact CZ-OE2 3.95Å; R365-E368 IonicContact NE-OE2 2.79Å; R365-E368 VanDerWaalsContact NH1-CD 3.27Å; R365-E368 IonicContact NH1-OE1 2.87Å; R365-E368 PolarHBondContact NH1-OE1 3.19Å; R365-E368 IonicContact NH1-OE2 3.46Å; R365-E368 PolarHBondContact NH1-OE2 3.37Å; R365-E368 IonicContact NH2-OE1 2.53Å; R365-E368 PolarHBondContact NH2-OE1 3.14Å; R365-E368 IonicContact NH2-OE2 3.33Å
369	A	95.1	Very high	93.8	Very high	22 Å²	22	57.9 Å²	57.9	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	148.5	171	0	0	0	0	0	110.7	L355 C371 W400 L407	L355-A369 PolarHBondContact N-O 2.88Å; L355-A369 PolarHBondContact O-N 3.33Å; A369-C371 PolarHBondContact O-N 3.49Å; A369-W400 HydrophobicContact CB-CZ3 3.86Å; A369-L407 HydrophobicContact CB-CB 3.8Å; A369-L407 HydrophobicContact CB-CD1 4.02Å
370	K	94.5	Very high	93.8	Very high	133 Å²	133	57.7 Å²	57.7	58%	0.578	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	114.9	170	-59.2	-170.5	178.3	-152.1	0	109.2	D352 W400	D352-K370 HydrophobicContact CB-CB 4.39Å; D352-K370 HydrophobicContact CB-CD 4.11Å; D352-K370 HydrophobicContact CB-CG 4.16Å; D352-K370 IonicContact OD1-NZ 3.67Å; D352-K370 VanDerWaalsContact OD2-CE 3.25Å; D352-K370 WeakPolarHBondContact OD2-CE 3.27Å; D352-K370 IonicContact OD2-NZ 3.56Å; D352-K370 PolarHBondContact OD2-NZ 3.41Å; K370-W400 WeakPolarHBondContact O-CH2 3.37Å
371	C	91.9	Very high	93.9	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.034	27%	0.274	C	S	.	.			trans	-79.1	-54.5	-175.4	-166.3	0	0	0	0	110.7	D352 H353 L355 A369 T391 H396 W400	D352-C371 PolarHBondContact O-N 3.43Å; H353-C371 WeakPolarHBondContact O-CB 3.35Å; H353-C371 PolarHBondContact O-N 3.11Å; L355-C371 HydrophobicContact CB-CB 3.95Å; A369-C371 PolarHBondContact O-N 3.49Å; C371-T391 PolarHBondContact SG-OG1 3.13Å; C371-H396 PolarHBondContact O-CE1 2.77Å; C371-H396 PolarHBondContact SG-NE2 2.79Å; C371-H396 VanDerWaalsContact SG-NE2 3.35Å; C371-W400 HydrophobicContact CB-CZ2 4.14Å; C371-W400 VanDerWaalsContact SG-CZ2 3.59Å
372	S	92	Very high	93.9	Very high	14 Å²	14	53 Å²	53	10%	0.098	26%	0.255	C	S	.	.			trans	-162.5	148.7	-169.1	-178.6	0	0	0	0	111.3	D352 H353 E374	D352-S372 CarbonylContact C-O 3.59Å; D352-S372 PolarHBondContact O-N 3.12Å; H353-S372 WeakPolarHBondContact CB-O 3.4Å; H353-S372 PolarHBondContact N-O 2.5Å; H353-S372 PolarHBondContact ND1-O 2.92Å; S372-E374 VanDerWaalsContact C-N 3.26Å; S372-E374 VanDerWaalsContact CB-O 3.3Å; S372-E374 WeakPolarHBondContact CB-O 3.44Å; S372-E374 PolarHBondContact OG-N 2.77Å; S372-E374 PolarHBondContact OG-O 2.87Å
373	N	90.9	Very high	93.8	Very high	122 Å²	122	47.7 Å²	47.7	65%	0.652	24%	0.24	S	C	*	.	S	Bend	trans	-89.8	1.5	170.5	-59.8	5.6	0	0	0	112
374	E	92.9	Very high	93.6	Very high	84 Å²	84	46.5 Å²	46.5	39%	0.393	24%	0.24	S	C	.	.	S	Bend	trans	-125.9	158.7	-177.9	-69.3	-78.4	-159.9	0	0	109.1	H353 S372 V376 K394	H353-E374 PolarHBondContact CE1-O 2.8Å; S372-E374 VanDerWaalsContact C-N 3.26Å; S372-E374 VanDerWaalsContact CB-O 3.3Å; S372-E374 WeakPolarHBondContact CB-O 3.44Å; S372-E374 PolarHBondContact OG-N 2.77Å; S372-E374 PolarHBondContact OG-O 2.87Å; E374-V376 PolarHBondContact O-N 3.15Å; E374-K394 HydrophobicContact CB-CB 4.31Å; E374-K394 IonicContact OE1-NZ 3.86Å; E374-K394 PolarHBondContact OE1-NZ 2.83Å; E374-K394 VanDerWaalsContact OE2-CD 3.3Å; E374-K394 WeakPolarHBondContact OE2-CD 3.49Å; E374-K394 WeakPolarHBondContact OE2-CE 3.24Å; E374-K394 IonicContact OE2-NZ 2.72Å; E374-K394 PolarHBondContact OE2-NZ 2.8Å
375	S	91.9	Very high	93.5	Very high	39 Å²	39	45.2 Å²	45.2	27%	0.273	24%	0.236	S	C	.	.			trans	-56.7	125.9	-172.4	53.2	0	0	0	0	113.8	F377 G393 K394	S375-F377 WeakPolarHBondContact OG-CE1 3.38Å; S375-F377 WeakPolarHBondContact OG-CZ 3Å; S375-G393 CarbonylContact O-C 3.53Å; S375-G393 VanDerWaalsContact O-CA 3.26Å; S375-G393 WeakPolarHBondContact O-CA 3.3Å; S375-K394 PolarHBondContact O-N 2.89Å
376	V	94.6	Very high	93.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	135.3	171.7	-175.3	0	0	0	0	108.3	V331 V347 H353 E374 C392	V331-V376 WeakPolarHBondContact CG1-O 3.45Å; V347-V376 HydrophobicContact CG1-CB 4.2Å; V347-V376 HydrophobicContact CG1-CG1 4.3Å; V347-V376 HydrophobicContact CG1-CG2 4.42Å; H353-V376 HydrophobicContact CB-CG2 3.98Å; E374-V376 PolarHBondContact O-N 3.15Å; V376-C392 WeakPolarHBondContact CG1-O 3.42Å
377	F	94.3	Very high	93.2	Very high	34 Å²	34	41.5 Å²	41.5	15%	0.149	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-28.3	-175.2	-61	-36.9	0	0	0	114.2	C332 S375 C392 F422 L424	C332-F377 VanDerWaalsContact SG-C 3.55Å; S375-F377 WeakPolarHBondContact OG-CE1 3.38Å; S375-F377 WeakPolarHBondContact OG-CZ 3Å; F377-C392 PolarHBondContact N-O 2.92Å; F377-F422 HydrophobicContact CE2-CB 4.18Å; F377-F422 AromaticContact CE2-CD1 3.71Å; F377-F422 HydrophobicContact CE2-CD1 3.71Å; F377-F422 HydrophobicContact CE2-CG 4.32Å; F377-F422 HydrophobicContact CZ-CD1 4.02Å; F377-F422 HydrophobicContact CZ-CE1 4.41Å; F377-L424 HydrophobicContact CD2-CD2 3.86Å; F377-L424 HydrophobicContact CE2-CD2 3.81Å
378	A	94.5	Very high	93.2	Very high	12 Å²	12	42.8 Å²	42.8	10%	0.099	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	149.3	175.4	0	0	0	0	0	111.2	C332 T391 C392 V426	C332-A378 VanDerWaalsContact SG-CA 3.6Å; A378-T391 CarbonylContact O-C 3.58Å; A378-T391 VanDerWaalsContact O-CA 3.26Å; A378-T391 WeakPolarHBondContact O-CA 3.5Å; A378-C392 PolarHBondContact N-O 3.44Å; A378-C392 PolarHBondContact O-N 2.79Å; A378-V426 HydrophobicContact CB-CG1 4.05Å
379	A	95.6	Very high	93.2	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.4	168.9	0	0	0	0	0	107.4	C332 A334 V347 V390 T391	C332-A379 HydrophobicContact CB-CB 3.79Å; A334-A379 VanDerWaalsContact CB-O 3.28Å; A334-A379 WeakPolarHBondContact CB-O 3.43Å; V347-A379 HydrophobicContact CG2-CB 3.9Å; A379-V390 CarbonylContact C-O 3.46Å; A379-V390 VanDerWaalsContact CA-O 3.3Å; A379-V390 WeakPolarHBondContact CA-O 3.32Å; A379-T391 HydrophobicContact CB-CG2 3.91Å
380	D	95.8	Very high	93.3	Very high	27 Å²	27	37.8 Å²	37.8	14%	0.144	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	148.9	178.3	-165.8	12.5	0	0	0	111.1	K337 V390 V426 F428	K337-D380 WeakPolarHBondContact CE-OD1 3.42Å; K337-D380 IonicContact NZ-OD1 3.37Å; K337-D380 PolarHBondContact NZ-OD1 2.9Å; K337-D380 IonicContact NZ-OD2 2.83Å; K337-D380 PolarHBondContact NZ-OD2 2.95Å; D380-V390 PolarHBondContact N-O 2.9Å; D380-V390 PolarHBondContact O-N 3.01Å; D380-V426 HydrophobicContact CB-CG1 4.37Å; D380-F428 HydrophobicContact CB-CE2 3.98Å
381	F	95.6	Very high	93.4	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	145.1	176.6	-81.9	-88.4	0	0	0	111.2	A334 F335 S336 C345 V357 S386 V389 F428	A334-F381 HydrophobicContact CB-CD2 4.38Å; A334-F381 WeakPolarHBondContact O-CE2 3.44Å; F335-F381 VanDerWaalsContact C-CD2 3.43Å; F335-F381 WeakPolarHBondContact O-CD2 3.31Å; S336-F381 VanDerWaalsContact N-CD2 3.35Å; C345-F381 HydrophobicContact CB-CD2 4.37Å; C345-F381 HydrophobicContact CB-CE2 3.45Å; C345-F381 VanDerWaalsContact CB-CE2 3.45Å; C345-F381 HydrophobicContact CB-CZ 3.74Å; C345-F381 WeakPolarHBondContact SG-CE2 3.47Å; V357-F381 HydrophobicContact CG1-CZ 4.38Å; F381-S386 WeakPolarHBondContact CD1-O 3.43Å; F381-S386 VanDerWaalsContact CE1-O 3.25Å; F381-S386 WeakPolarHBondContact CE1-O 3.39Å; F381-V389 HydrophobicContact CD1-CG2 3.58Å; F381-V389 HydrophobicContact CD2-CG2 4.5Å; F381-V389 HydrophobicContact CE1-CG2 3.33Å; F381-V389 HydrophobicContact CE2-CG2 4.31Å; F381-V389 HydrophobicContact CG-CG2 4.18Å; F381-V389 HydrophobicContact CZ-CG2 3.74Å; F381-F428 WeakPolarHBondContact O-CE2 3.46Å
382	H	94.5	Very high	93.6	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.046	18%	0.176	C	C	.	.			trans	-62.3	135.3	170.9	-172.7	-83	0	0	0	110.6	T384 D385 I388 F428 G432	H382-T384 VanDerWaalsContact C-N 3.3Å; H382-T384 PolarHBondContact CE1-OG1 3.28Å; H382-T384 PolarHBondContact ND1-N 3.26Å; H382-T384 VanDerWaalsContact ND1-N 3.16Å; H382-T384 PolarHBondContact ND1-OG1 2.87Å; H382-T384 PolarHBondContact O-N 3.02Å; H382-D385 HydrophobicContact CB-CB 4.46Å; H382-D385 PolarHBondContact ND1-N 3.48Å; H382-D385 PolarHBondContact O-N 2.75Å; H382-I388 HydrophobicContact CB-CB 3.79Å; H382-I388 HydrophobicContact CB-CG2 4.06Å; H382-I388 PolarHBondContact N-O 3.13Å; H382-F428 HydrophobicContact CB-CE1 4.23Å; H382-F428 HydrophobicContact CB-CZ 4.4Å; H382-F428 AromaticContact CD2-CD1 3.91Å; H382-F428 AromaticContact CD2-CE1 3.76Å; H382-G432 PolarHBondContact NE2-O 2.92Å
383	P	91.9	Very high	93.7	Very high	39 Å²	39	30.5 Å²	30.5	25%	0.253	17%	0.171	S	C	.	.	S	Bend	trans	-64.4	-31.4	-172.3	23.2	-34.5	0	0	0	113.6	S338 F428	S338-P383 WeakPolarHBondContact CB-O 3.26Å; P383-F428 HydrophobicContact CG-CB 3.71Å; P383-F428 HydrophobicContact CG-CG 4.13Å
384	T	90.3	Very high	93.9	Very high	76 Å²	76	27.9 Å²	27.9	47%	0.466	15%	0.154	S	C	.	.	S	Bend	trans	-104	-9.9	-178.1	78.9	0	0	0	0	114.7	S338 H382	S338-T384 VanDerWaalsContact CB-C 3.47Å; H382-T384 VanDerWaalsContact C-N 3.3Å; H382-T384 PolarHBondContact CE1-OG1 3.28Å; H382-T384 PolarHBondContact ND1-N 3.26Å; H382-T384 VanDerWaalsContact ND1-N 3.16Å; H382-T384 PolarHBondContact ND1-OG1 2.87Å; H382-T384 PolarHBondContact O-N 3.02Å
385	D	89.9	Confident	93.7	Very high	55 Å²	55	26.7 Å²	26.7	29%	0.294	16%	0.155	S	C	.	.			trans	-135.6	116.5	-174.1	-171.8	-15.1	0	0	0	109.5	H382 N387 I388	H382-D385 HydrophobicContact CB-CB 4.46Å; H382-D385 PolarHBondContact ND1-N 3.48Å; H382-D385 PolarHBondContact O-N 2.75Å; D385-N387 PolarHBondContact O-N 2.86Å; D385-N387 WeakPolarHBondContact OD1-CB 3.38Å; D385-N387 PolarHBondContact OD1-N 2.92Å; D385-I388 HydrophobicContact CB-CD1 4.06Å; D385-I388 HydrophobicContact CB-CG1 4.24Å; D385-I388 WeakPolarHBondContact OD2-CD1 3.42Å
386	S	89.6	Confident	93.8	Very high	28 Å²	28	25.1 Å²	25.1	20%	0.196	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.4	-176.5	54.4	0	0	0	0	112.8	S338 N339 F381	S338-S386 VanDerWaalsContact OG-CA 3.28Å; S338-S386 WeakPolarHBondContact OG-CA 3.38Å; S338-S386 VanDerWaalsContact OG-CB 3.29Å; S338-S386 WeakPolarHBondContact OG-CB 2.95Å; S338-S386 PolarHBondContact OG-N 3.24Å; N339-S386 WeakPolarHBondContact ND2-CB 3.29Å; F381-S386 WeakPolarHBondContact CD1-O 3.43Å; F381-S386 VanDerWaalsContact CE1-O 3.25Å; F381-S386 WeakPolarHBondContact CE1-O 3.39Å
387	N	92.6	Very high	93.8	Very high	68 Å²	68	25.2 Å²	25.2	36%	0.364	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-7.6	-177.8	-61.5	-32.7	0	0	0	112.2	D385 T401 L402	D385-N387 PolarHBondContact O-N 2.86Å; D385-N387 WeakPolarHBondContact OD1-CB 3.38Å; D385-N387 PolarHBondContact OD1-N 2.92Å; N387-T401 CarbonylContact O-C 3.6Å; N387-T401 WeakPolarHBondContact O-CA 3.41Å; N387-L402 HydrophobicContact CB-CB 4.16Å; N387-L402 PolarHBondContact O-N 2.83Å
388	I	94.1	Very high	93.9	Very high	33 Å²	33	25.8 Å²	25.8	17%	0.169	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.4	-177.9	-58.1	174.8	0	0	0	110.1	H382 D385 W400	H382-I388 HydrophobicContact CB-CB 3.79Å; H382-I388 HydrophobicContact CB-CG2 4.06Å; H382-I388 PolarHBondContact N-O 3.13Å; D385-I388 HydrophobicContact CB-CD1 4.06Å; D385-I388 HydrophobicContact CB-CG1 4.24Å; D385-I388 WeakPolarHBondContact OD2-CD1 3.42Å; I388-W400 VanDerWaalsContact CA-O 3.28Å; I388-W400 WeakPolarHBondContact CA-O 3.43Å
389	V	95.7	Very high	94	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.3	172.4	-179.2	0	0	0	0	108.5	C345 L355 F381 T391 W400	C345-V389 HydrophobicContact CB-CG2 4.48Å; L355-V389 HydrophobicContact CD1-CG1 4.46Å; L355-V389 HydrophobicContact CD2-CG1 4.46Å; F381-V389 HydrophobicContact CD1-CG2 3.58Å; F381-V389 HydrophobicContact CD2-CG2 4.5Å; F381-V389 HydrophobicContact CE1-CG2 3.33Å; F381-V389 HydrophobicContact CE2-CG2 4.31Å; F381-V389 HydrophobicContact CG-CG2 4.18Å; F381-V389 HydrophobicContact CZ-CG2 3.74Å; V389-T391 HydrophobicContact CG1-CG2 4.26Å; V389-W400 HydrophobicContact CB-CB 4.25Å; V389-W400 PolarHBondContact N-O 3.48Å; V389-W400 WeakPolarHBondContact O-CB 3.46Å; V389-W400 PolarHBondContact O-N 3Å
390	V	96.6	Very high	94	Very high	1 Å²	1	26 Å²	26	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129	174.6	-176.4	0	0	0	0	108.7	A379 D380 L397 Y398 F399 V426 F428	A379-V390 CarbonylContact C-O 3.46Å; A379-V390 VanDerWaalsContact CA-O 3.3Å; A379-V390 WeakPolarHBondContact CA-O 3.32Å; D380-V390 PolarHBondContact N-O 2.9Å; D380-V390 PolarHBondContact O-N 3.01Å; V390-L397 HydrophobicContact CG1-CD1 3.99Å; V390-Y398 WeakPolarHBondContact CA-O 3.32Å; V390-F399 HydrophobicContact CG1-CD1 4.41Å; V390-F399 HydrophobicContact CG1-CE1 4.24Å; V390-F399 HydrophobicContact CG2-CD1 3.54Å; V390-F399 HydrophobicContact CG2-CE1 3.77Å; V390-F399 HydrophobicContact CG2-CG 4.44Å; V390-V426 HydrophobicContact CG1-CG2 4.02Å; V390-F428 HydrophobicContact CB-CZ 4.07Å; V390-F428 HydrophobicContact CG2-CE1 3.94Å; V390-F428 HydrophobicContact CG2-CZ 3.68Å
391	T	96.8	Very high	94	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.8	176.7	62.5	0	0	0	0	110.4	L355 C371 A378 A379 V389 H396 L397 Y398 W400	L355-T391 HydrophobicContact CD2-CG2 4.15Å; C371-T391 PolarHBondContact SG-OG1 3.13Å; A378-T391 CarbonylContact O-C 3.58Å; A378-T391 VanDerWaalsContact O-CA 3.26Å; A378-T391 WeakPolarHBondContact O-CA 3.5Å; A379-T391 HydrophobicContact CB-CG2 3.91Å; V389-T391 HydrophobicContact CG1-CG2 4.26Å; T391-H396 PolarHBondContact OG1-NE2 2.65Å; T391-L397 WeakPolarHBondContact O-CA 3.4Å; T391-Y398 PolarHBondContact N-O 3.37Å; T391-Y398 PolarHBondContact O-N 3.5Å; T391-W400 PolarHBondContact OG1-NE1 2.93Å
392	C	95.6	Very high	93.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	154.5	179	74.8	0	0	0	0	112.7	V376 F377 A378 H396 L397 V423	V376-C392 WeakPolarHBondContact CG1-O 3.42Å; F377-C392 PolarHBondContact N-O 2.92Å; A378-C392 PolarHBondContact N-O 3.44Å; A378-C392 PolarHBondContact O-N 2.79Å; C392-H396 CarbonylContact C-O 3.6Å; C392-H396 VanDerWaalsContact CA-O 3.31Å; C392-H396 WeakPolarHBondContact CA-O 3.21Å; C392-L397 HydrophobicContact CB-CD1 3.75Å; C392-V423 HydrophobicContact CB-CB 3.92Å; C392-V423 HydrophobicContact CB-CG1 3.61Å
393	G	94.9	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	-154.5	-175.7	0	0	0	0	0	114.4	S375 S395 H396 V423	S375-G393 CarbonylContact O-C 3.53Å; S375-G393 VanDerWaalsContact O-CA 3.26Å; S375-G393 WeakPolarHBondContact O-CA 3.3Å; G393-S395 PolarHBondContact O-N 3.16Å; G393-H396 PolarHBondContact N-O 3.19Å; G393-H396 PolarHBondContact O-N 2.86Å; G393-V423 WeakPolarHBondContact CA-O 3.47Å; G393-V423 PolarHBondContact N-O 3.33Å; G393-V423 PolarHBondContact O-N 2.93Å
394	K	94.3	Very high	93.4	Very high	67 Å²	67	40 Å²	40	29%	0.291	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-66.5	114.1	176.6	-179.9	179.5	167.2	-153	0	110.7	E374 S375 H396 F422	E374-K394 HydrophobicContact CB-CB 4.31Å; E374-K394 IonicContact OE1-NZ 3.86Å; E374-K394 PolarHBondContact OE1-NZ 2.83Å; E374-K394 VanDerWaalsContact OE2-CD 3.3Å; E374-K394 WeakPolarHBondContact OE2-CD 3.49Å; E374-K394 WeakPolarHBondContact OE2-CE 3.24Å; E374-K394 IonicContact OE2-NZ 2.72Å; E374-K394 PolarHBondContact OE2-NZ 2.8Å; S375-K394 PolarHBondContact O-N 2.89Å; K394-H396 WeakPolarHBondContact O-CB 3.21Å; K394-H396 PolarHBondContact O-N 3.31Å; K394-F422 HydrophobicContact CB-CD1 3.62Å; K394-F422 HydrophobicContact CB-CE1 3.73Å; K394-F422 HydrophobicContact CD-CE1 3.8Å; K394-F422 HydrophobicContact CG-CD1 3.79Å; K394-F422 HydrophobicContact CG-CE1 3.52Å; K394-F422 HydrophobicContact CG-CZ 4.47Å
395	S	89.8	Confident	93.1	Very high	59 Å²	59	38.3 Å²	38.3	41%	0.413	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	23.3	-174.1	-69.3	0	0	0	0	114.2	G393 K419 K421	G393-S395 PolarHBondContact O-N 3.16Å; S395-K419 VanDerWaalsContact O-CE 3.27Å; S395-K419 WeakPolarHBondContact O-CE 3.43Å; S395-K419 PolarHBondContact O-NZ 3.26Å; S395-K421 PolarHBondContact N-O 2.98Å
396	H	93.3	Very high	93.2	Very high	5 Å²	5	42.1 Å²	42.1	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.5	-166.7	-179	76.6	0	0	0	110.3	C371 T391 C392 G393 K394 Y398	C371-H396 PolarHBondContact O-CE1 2.77Å; C371-H396 PolarHBondContact SG-NE2 2.79Å; C371-H396 VanDerWaalsContact SG-NE2 3.35Å; T391-H396 PolarHBondContact OG1-NE2 2.65Å; C392-H396 CarbonylContact C-O 3.6Å; C392-H396 VanDerWaalsContact CA-O 3.31Å; C392-H396 WeakPolarHBondContact CA-O 3.21Å; G393-H396 PolarHBondContact N-O 3.19Å; G393-H396 PolarHBondContact O-N 2.86Å; K394-H396 WeakPolarHBondContact O-CB 3.21Å; K394-H396 PolarHBondContact O-N 3.31Å; H396-Y398 AromaticContact CE1-CD2 3.1Å; H396-Y398 WeakPolarHBondContact CE1-CD2 3.39Å; H396-Y398 AromaticContact CE1-CE2 3.55Å; H396-Y398 AromaticContact CG-CD2 3.99Å; H396-Y398 AromaticContact ND1-CD2 3.14Å; H396-Y398 WeakPolarHBondContact ND1-CD2 3.4Å; H396-Y398 AromaticContact ND1-CE2 3.19Å; H396-Y398 WeakPolarHBondContact ND1-CE2 3.26Å; H396-Y398 AromaticContact NE2-CD2 3.87Å
397	L	95.1	Very high	93.4	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	113.6	167	-178.6	68	0	0	0	108.5	V390 T391 C392 F399 G412 F414 V423 T436 W446	V390-L397 HydrophobicContact CG1-CD1 3.99Å; T391-L397 WeakPolarHBondContact O-CA 3.4Å; C392-L397 HydrophobicContact CB-CD1 3.75Å; L397-F399 HydrophobicContact CD2-CE2 4.46Å; L397-F399 HydrophobicContact CG-CE2 4.39Å; L397-G412 PolarHBondContact O-N 3.24Å; L397-F414 HydrophobicContact CD2-CZ 4.2Å; L397-V423 HydrophobicContact CB-CG2 4.47Å; L397-V423 HydrophobicContact CD1-CG1 4.45Å; L397-T436 HydrophobicContact CD1-CG2 4.06Å; L397-T436 HydrophobicContact CD2-CG2 4.41Å; L397-W446 HydrophobicContact CD2-CD2 4.01Å; L397-W446 HydrophobicContact CD2-CE3 4.32Å; L397-W446 HydrophobicContact CD2-CH2 3.47Å; L397-W446 VanDerWaalsContact CD2-CH2 3.47Å; L397-W446 HydrophobicContact CD2-CZ2 3.05Å; L397-W446 HydrophobicContact CD2-CZ3 4.08Å
398	Y	95.7	Very high	93.5	Very high	45 Å²	45	41.5 Å²	41.5	18%	0.176	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.1	-177.9	-73.3	-96.8	0	0	0	111.4	V390 T391 H396 W400 K409 K410 Q411	V390-Y398 WeakPolarHBondContact CA-O 3.32Å; T391-Y398 PolarHBondContact N-O 3.37Å; T391-Y398 PolarHBondContact O-N 3.5Å; H396-Y398 AromaticContact CE1-CD2 3.1Å; H396-Y398 WeakPolarHBondContact CE1-CD2 3.39Å; H396-Y398 AromaticContact CE1-CE2 3.55Å; H396-Y398 AromaticContact CG-CD2 3.99Å; H396-Y398 AromaticContact ND1-CD2 3.14Å; H396-Y398 WeakPolarHBondContact ND1-CD2 3.4Å; H396-Y398 AromaticContact ND1-CE2 3.19Å; H396-Y398 WeakPolarHBondContact ND1-CE2 3.26Å; H396-Y398 AromaticContact NE2-CD2 3.87Å; Y398-W400 HydrophobicContact CG-CZ2 4.45Å; Y398-K409 HydrophobicContact CD1-CB 4.03Å; Y398-K409 HydrophobicContact CD1-CD 4.3Å; Y398-K409 HydrophobicContact CD1-CG 4.36Å; Y398-K409 HydrophobicContact CE1-CD 4.13Å; Y398-K409 HydrophobicContact CE1-CG 4.46Å; Y398-K410 WeakPolarHBondContact CA-O 3.35Å; Y398-Q411 HydrophobicContact CD1-CB 4Å; Y398-Q411 HydrophobicContact CD1-CG 4.44Å; Y398-Q411 HydrophobicContact CE1-CB 3.62Å; Y398-Q411 HydrophobicContact CE1-CG 3.93Å
399	F	95.9	Very high	93.5	Very high	22 Å²	22	45.6 Å²	45.6	10%	0.096	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.9	170.6	-60.9	-96.5	0	0	0	107	V390 L397 K410 A434 W446 N451	V390-F399 HydrophobicContact CG1-CD1 4.41Å; V390-F399 HydrophobicContact CG1-CE1 4.24Å; V390-F399 HydrophobicContact CG2-CD1 3.54Å; V390-F399 HydrophobicContact CG2-CE1 3.77Å; V390-F399 HydrophobicContact CG2-CG 4.44Å; L397-F399 HydrophobicContact CD2-CE2 4.46Å; L397-F399 HydrophobicContact CG-CE2 4.39Å; F399-K410 HydrophobicContact CB-CB 4.41Å; F399-K410 PolarHBondContact N-O 3.22Å; F399-K410 PolarHBondContact O-N 3.19Å; F399-A434 HydrophobicContact CE1-CB 4.09Å; F399-W446 HydrophobicContact CE2-CD2 4.42Å; F399-W446 HydrophobicContact CE2-CE3 4.11Å; F399-W446 HydrophobicContact CZ-CB 3.91Å; F399-W446 HydrophobicContact CZ-CD2 4.08Å; F399-W446 HydrophobicContact CZ-CE3 4.15Å; F399-W446 AromaticContact CZ-CG 3.97Å; F399-W446 HydrophobicContact CZ-CG 3.97Å; F399-N451 HydrophobicContact CD2-CB 4.1Å; F399-N451 HydrophobicContact CE2-CB 4.41Å
400	W	96.1	Very high	93.4	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	135.5	-179.9	-57	87.7	0	0	0	109.2	L355 A369 K370 C371 I388 V389 T391 Y398 L407 V408 K409	L355-W400 HydrophobicContact CD2-CB 4.29Å; L355-W400 HydrophobicContact CD2-CD2 3.71Å; L355-W400 HydrophobicContact CD2-CE3 4.3Å; L355-W400 HydrophobicContact CD2-CG 3.66Å; A369-W400 HydrophobicContact CB-CZ3 3.86Å; K370-W400 WeakPolarHBondContact O-CH2 3.37Å; C371-W400 HydrophobicContact CB-CZ2 4.14Å; C371-W400 VanDerWaalsContact SG-CZ2 3.59Å; I388-W400 VanDerWaalsContact CA-O 3.28Å; I388-W400 WeakPolarHBondContact CA-O 3.43Å; V389-W400 HydrophobicContact CB-CB 4.25Å; V389-W400 PolarHBondContact N-O 3.48Å; V389-W400 WeakPolarHBondContact O-CB 3.46Å; V389-W400 PolarHBondContact O-N 3Å; T391-W400 PolarHBondContact OG1-NE1 2.93Å; Y398-W400 HydrophobicContact CG-CZ2 4.45Å; W400-L407 HydrophobicContact CB-CD2 4.42Å; W400-L407 HydrophobicContact CE3-CB 3.96Å; W400-L407 HydrophobicContact CZ3-CB 4.49Å; W400-V408 CarbonylContact C-O 3.5Å; W400-V408 WeakPolarHBondContact CA-O 3.44Å; W400-K409 HydrophobicContact CD2-CB 4.16Å; W400-K409 HydrophobicContact CE3-CB 3.63Å; W400-K409 HydrophobicContact CH2-CB 3.79Å; W400-K409 HydrophobicContact CH2-CD 3.91Å; W400-K409 HydrophobicContact CH2-CG 4.49Å; W400-K409 HydrophobicContact CZ2-CB 4.27Å; W400-K409 HydrophobicContact CZ3-CB 3.48Å; W400-K409 VanDerWaalsContact CZ3-CB 3.48Å; W400-K409 HydrophobicContact CZ3-CD 4.14Å; W400-K409 HydrophobicContact CZ3-CG 4.33Å
401	T	95.1	Very high	93.2	Very high	26 Å²	26	54.9 Å²	54.9	16%	0.16	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.8	173.5	-49	0	0	0	0	109	N387 E403 V408	N387-T401 CarbonylContact O-C 3.6Å; N387-T401 WeakPolarHBondContact O-CA 3.41Å; T401-E403 HydrophobicContact CG2-CG 3.87Å; T401-E403 PolarHBondContact O-N 2.95Å; T401-V408 PolarHBondContact N-O 3.17Å; T401-V408 PolarHBondContact O-N 3.45Å
402	L	93.3	Very high	93	Very high	25 Å²	25	55 Å²	55	13%	0.131	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	105.2	176.6	-177	66.2	0	0	0	109.2	V357 A367 N387 M406 L407	V357-L402 HydrophobicContact CG1-CD2 4.28Å; A367-L402 HydrophobicContact CB-CD1 3.44Å; A367-L402 VanDerWaalsContact CB-CD1 3.44Å; N387-L402 HydrophobicContact CB-CB 4.16Å; N387-L402 PolarHBondContact O-N 2.83Å; L402-M406 WeakPolarHBondContact CA-O 3.43Å; L402-L407 HydrophobicContact CB-CD2 4.18Å; L402-L407 HydrophobicContact CD1-CD2 3.89Å; L402-L407 HydrophobicContact CD1-CG 4.32Å
403	E	91.4	Very high	92.8	Very high	106 Å²	106	58 Å²	58	50%	0.495	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.8	179.8	-64.4	-175.8	-174.8	0	0	109.7	T401 G405 M406	T401-E403 HydrophobicContact CG2-CG 3.87Å; T401-E403 PolarHBondContact O-N 2.95Å; E403-G405 PolarHBondContact O-N 3.05Å; E403-G405 VanDerWaalsContact O-N 3.13Å; E403-M406 PolarHBondContact N-O 3.15Å; E403-M406 PolarHBondContact O-N 2.71Å
404	K	84.9	Confident	92.4	Very high	213 Å²	213	59 Å²	59	93%	0.926	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	38.7	174.9	-57.9	179.2	-179.7	176.5	0	114.3	M406	K404-M406 VanDerWaalsContact C-N 3.34Å
405	G	85.2	Confident	91.9	Very high	41 Å²	41	61.2 Å²	61.2	42%	0.423	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	11	-179	0	0	0	0	0	114.7	A367 E403	A367-G405 VanDerWaalsContact CB-O 3.26Å; A367-G405 WeakPolarHBondContact CB-O 3.05Å; E403-G405 PolarHBondContact O-N 3.05Å; E403-G405 VanDerWaalsContact O-N 3.13Å
406	M	91.7	Very high	91.3	Very high	135 Å²	135	67.9 Å²	67.9	67%	0.665	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.1	173.9	-58.6	-174.5	-156	0	0	110.8	L402 E403 K404	L402-M406 WeakPolarHBondContact CA-O 3.43Å; E403-M406 PolarHBondContact N-O 3.15Å; E403-M406 PolarHBondContact O-N 2.71Å; K404-M406 VanDerWaalsContact C-N 3.34Å
407	L	94.4	Very high	90.7	Very high	20 Å²	20	70.4 Å²	70.4	11%	0.105	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.5	175.5	-70.5	167.3	0	0	0	109.9	L355 V357 A367 A369 W400 L402	L355-L407 HydrophobicContact CD2-CD1 4.02Å; L355-L407 HydrophobicContact CG-CD1 3.97Å; V357-L407 HydrophobicContact CG2-CD1 4.29Å; V357-L407 HydrophobicContact CG2-CD2 4.13Å; A367-L407 HydrophobicContact CB-CD1 4.26Å; A367-L407 HydrophobicContact CB-CG 3.93Å; A369-L407 HydrophobicContact CB-CB 3.8Å; A369-L407 HydrophobicContact CB-CD1 4.02Å; W400-L407 HydrophobicContact CB-CD2 4.42Å; W400-L407 HydrophobicContact CE3-CB 3.96Å; W400-L407 HydrophobicContact CZ3-CB 4.49Å; L402-L407 HydrophobicContact CB-CD2 4.18Å; L402-L407 HydrophobicContact CD1-CD2 3.89Å; L402-L407 HydrophobicContact CD1-CG 4.32Å
408	V	94.3	Very high	90.1	Very high	62 Å²	62	78.7 Å²	78.7	38%	0.376	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.9	177.3	-177.4	0	0	0	0	109.2	W400 T401	W400-V408 CarbonylContact C-O 3.5Å; W400-V408 WeakPolarHBondContact CA-O 3.44Å; T401-V408 PolarHBondContact N-O 3.17Å; T401-V408 PolarHBondContact O-N 3.45Å
409	K	93.6	Very high	89.6	Confident	119 Å²	119	81 Å²	81	52%	0.517	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.6	-178	70.8	-175.6	178.8	-179.7	0	113.2	Y398 W400	Y398-K409 HydrophobicContact CD1-CB 4.03Å; Y398-K409 HydrophobicContact CD1-CD 4.3Å; Y398-K409 HydrophobicContact CD1-CG 4.36Å; Y398-K409 HydrophobicContact CE1-CD 4.13Å; Y398-K409 HydrophobicContact CE1-CG 4.46Å; W400-K409 HydrophobicContact CD2-CB 4.16Å; W400-K409 HydrophobicContact CE3-CB 3.63Å; W400-K409 HydrophobicContact CH2-CB 3.79Å; W400-K409 HydrophobicContact CH2-CD 3.91Å; W400-K409 HydrophobicContact CH2-CG 4.49Å; W400-K409 HydrophobicContact CZ2-CB 4.27Å; W400-K409 HydrophobicContact CZ3-CB 3.48Å; W400-K409 VanDerWaalsContact CZ3-CB 3.48Å; W400-K409 HydrophobicContact CZ3-CD 4.14Å; W400-K409 HydrophobicContact CZ3-CG 4.33Å
410	K	94.1	Very high	89.3	Confident	109 Å²	109	80.1 Å²	80.1	47%	0.474	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.2	168	-67.7	176.6	-178.3	167.8	0	109.2	Y398 F399	Y398-K410 WeakPolarHBondContact CA-O 3.35Å; F399-K410 HydrophobicContact CB-CB 4.41Å; F399-K410 PolarHBondContact N-O 3.22Å; F399-K410 PolarHBondContact O-N 3.19Å
411	Q	93.1	Very high	89	Confident	90 Å²	90	86.6 Å²	86.6	42%	0.421	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	140.5	-180	-170.3	-178.2	-23	0	0	111	Y398 L413 N451	Y398-Q411 HydrophobicContact CD1-CB 4Å; Y398-Q411 HydrophobicContact CD1-CG 4.44Å; Y398-Q411 HydrophobicContact CE1-CB 3.62Å; Y398-Q411 HydrophobicContact CE1-CG 3.93Å; Q411-L413 PolarHBondContact O-N 3.01Å; Q411-N451 PolarHBondContact O-ND2 3.15Å
412	G	91.7	Very high	89	Confident	1 Å²	1	87.9 Å²	87.9	1%	0.01	42%	0.417	C	S	.	.			trans	-64.5	125.5	169.2	0	0	0	0	0	111.8	L397	L397-G412 PolarHBondContact O-N 3.24Å
413	L	91.6	Very high	89.1	Confident	65 Å²	65	86.8 Å²	86.8	34%	0.34	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-96.7	110.4	179	-60.1	176.4	0	0	0	109.7	Q411 E415 N451 R452	Q411-L413 PolarHBondContact O-N 3.01Å; L413-E415 VanDerWaalsContact C-N 3.29Å; L413-E415 HydrophobicContact CB-CG 4.34Å; L413-N451 PolarHBondContact N-O 2.93Å; L413-R452 HydrophobicContact CB-CG 4.18Å; L413-R452 HydrophobicContact CD1-CG 4.11Å
414	F	85.9	Confident	89.3	Confident	20 Å²	20	82.2 Å²	82.2	9%	0.088	39%	0.39	C	S	.	.			trans	-78.6	-14.3	179.4	-68.4	-97.2	0	0	0	113.2	L397 K416 Q417 K419 P420 V423 L444 W446 I453	L397-F414 HydrophobicContact CD2-CZ 4.2Å; F414-K416 PolarHBondContact O-N 3.12Å; F414-Q417 PolarHBondContact O-N 3.06Å; F414-K419 HydrophobicContact CD2-CG 4.19Å; F414-K419 HydrophobicContact CE2-CG 4.25Å; F414-P420 HydrophobicContact CE1-CG 3.76Å; F414-P420 HydrophobicContact CZ-CG 4.21Å; F414-V423 HydrophobicContact CZ-CG2 4.22Å; F414-L444 HydrophobicContact CD1-CD1 4.02Å; F414-L444 HydrophobicContact CE1-CD1 3.57Å; F414-W446 HydrophobicContact CD1-CH2 4.04Å; F414-W446 HydrophobicContact CD1-CZ2 4.29Å; F414-W446 HydrophobicContact CD2-CH2 4.13Å; F414-W446 AromaticContact CE1-CH2 3.84Å; F414-W446 HydrophobicContact CE1-CH2 3.84Å; F414-W446 AromaticContact CE1-CZ2 3.76Å; F414-W446 HydrophobicContact CE1-CZ2 3.76Å; F414-W446 AromaticContact CE2-CH2 3.93Å; F414-W446 HydrophobicContact CE2-CH2 3.93Å; F414-W446 HydrophobicContact CE2-CZ2 4.47Å; F414-W446 HydrophobicContact CG-CH2 4.17Å; F414-W446 AromaticContact CZ-CH2 3.78Å; F414-W446 HydrophobicContact CZ-CH2 3.78Å; F414-W446 AromaticContact CZ-CZ2 3.87Å; F414-W446 HydrophobicContact CZ-CZ2 3.87Å; F414-I453 HydrophobicContact CB-CD1 4.27Å; F414-I453 HydrophobicContact CD1-CD1 3.89Å; F414-I453 HydrophobicContact CG-CD1 4.35Å
415	E	83.4	Confident	89.8	Confident	113 Å²	113	72.6 Å²	72.6	53%	0.528	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	-101.7	178	-61.5	-172.1	172	0	0	114	L413 Q417 R452	L413-E415 VanDerWaalsContact C-N 3.29Å; L413-E415 HydrophobicContact CB-CG 4.34Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; E415-R452 WeakPolarHBondContact OE1-CD 3.37Å; E415-R452 WeakPolarHBondContact OE1-CG 3.43Å; E415-R452 IonicContact OE1-CZ 2.78Å; E415-R452 VanDerWaalsContact OE1-CZ 3.3Å; E415-R452 IonicContact OE1-NE 3.21Å; E415-R452 PolarHBondContact OE1-NE 2.88Å; E415-R452 IonicContact OE1-NH1 3.65Å; E415-R452 PolarHBondContact OE1-NH1 3.13Å
416	K	77.4	Confident	90.3	Very high	200 Å²	200	71.4 Å²	71.4	87%	0.87	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.6	-176.1	-61.8	-178.9	-178	177.2	0	113.2	F414	F414-K416 PolarHBondContact O-N 3.12Å
417	Q	82	Confident	90.4	Very high	57 Å²	57	65.8 Å²	65.8	27%	0.266	31%	0.307	S	S	.	.	S	Bend	trans	-93.3	142.9	-179.7	-62.6	-60.4	-18.4	0	0	110.9	F414 E415 K419 I453 V456	F414-Q417 PolarHBondContact O-N 3.06Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; Q417-K419 PolarHBondContact O-N 3.3Å; Q417-I453 HydrophobicContact CB-CD1 4.32Å; Q417-I453 HydrophobicContact CG-CD1 4.22Å; Q417-V456 HydrophobicContact CG-CG1 4.49Å; Q417-V456 HydrophobicContact CG-CG2 3.8Å
418	E	82.5	Confident	90.4	Very high	179 Å²	179	65.5 Å²	65.5	84%	0.836	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-64	133.8	171.4	-169.3	176.1	178.9	0	0	109.5	P420	E418-P420 WeakPolarHBondContact O-CD 3.08Å
419	K	84.7	Confident	90.4	Very high	93 Å²	93	63 Å²	63	40%	0.404	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-67.5	119.5	-179.3	-175.6	179.4	177	-178.6	0	108.9	S395 F414 Q417	S395-K419 VanDerWaalsContact O-CE 3.27Å; S395-K419 WeakPolarHBondContact O-CE 3.43Å; S395-K419 PolarHBondContact O-NZ 3.26Å; F414-K419 HydrophobicContact CD2-CG 4.19Å; F414-K419 HydrophobicContact CE2-CG 4.25Å; Q417-K419 PolarHBondContact O-N 3.3Å
420	P	88.6	Confident	90.1	Very high	4 Å²	4	64.3 Å²	64.3	3%	0.026	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-68.4	151.9	178.9	29.2	-34.5	0	0	0	110.6	F414 E418 F422 V423 D438	F414-P420 HydrophobicContact CE1-CG 3.76Å; F414-P420 HydrophobicContact CZ-CG 4.21Å; E418-P420 WeakPolarHBondContact O-CD 3.08Å; P420-F422 VanDerWaalsContact C-N 3.33Å; P420-F422 PolarHBondContact O-N 3.35Å; P420-V423 HydrophobicContact CG-CG2 3.99Å; P420-D438 HydrophobicContact CB-CB 3.67Å; P420-D438 HydrophobicContact CG-CB 3.81Å
421	K	91.3	Very high	89.8	Confident	140 Å²	140	63.4 Å²	63.4	61%	0.609	30%	0.299	S	S	*	.	S	Bend	trans	-64.5	-39.3	178.2	-171.3	177.1	177	177.6	0	111.8	S395 S439	S395-K421 PolarHBondContact N-O 2.98Å; K421-S439 PolarHBondContact N-OG 3.44Å
422	F	94.4	Very high	89.7	Confident	54 Å²	54	59.1 Å²	59.1	24%	0.237	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-134.6	137.7	176.1	-51.9	-86	0	0	0	110.7	F377 K394 P420 L424 D438 S439	F377-F422 HydrophobicContact CE2-CB 4.18Å; F377-F422 AromaticContact CE2-CD1 3.71Å; F377-F422 HydrophobicContact CE2-CD1 3.71Å; F377-F422 HydrophobicContact CE2-CG 4.32Å; F377-F422 HydrophobicContact CZ-CD1 4.02Å; F377-F422 HydrophobicContact CZ-CE1 4.41Å; K394-F422 HydrophobicContact CB-CD1 3.62Å; K394-F422 HydrophobicContact CB-CE1 3.73Å; K394-F422 HydrophobicContact CD-CE1 3.8Å; K394-F422 HydrophobicContact CG-CD1 3.79Å; K394-F422 HydrophobicContact CG-CE1 3.52Å; K394-F422 HydrophobicContact CG-CZ 4.47Å; P420-F422 VanDerWaalsContact C-N 3.33Å; P420-F422 PolarHBondContact O-N 3.35Å; F422-L424 HydrophobicContact CB-CD2 3.94Å; F422-L424 HydrophobicContact CB-CG 4.13Å; F422-D438 CarbonylContact O-C 3.58Å; F422-D438 WeakPolarHBondContact O-CA 3.27Å; F422-S439 PolarHBondContact N-OG 3.02Å; F422-S439 PolarHBondContact O-N 3.34Å; F422-S439 PolarHBondContact O-OG 3.06Å
423	V	95.8	Very high	89.8	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.9	162.2	-173.6	0	0	0	0	106.6	C392 G393 L397 F414 P420 T436	C392-V423 HydrophobicContact CB-CB 3.92Å; C392-V423 HydrophobicContact CB-CG1 3.61Å; G393-V423 WeakPolarHBondContact CA-O 3.47Å; G393-V423 PolarHBondContact N-O 3.33Å; G393-V423 PolarHBondContact O-N 2.93Å; L397-V423 HydrophobicContact CB-CG2 4.47Å; L397-V423 HydrophobicContact CD1-CG1 4.45Å; F414-V423 HydrophobicContact CZ-CG2 4.22Å; P420-V423 HydrophobicContact CG-CG2 3.99Å; V423-T436 HydrophobicContact CG1-CG2 4.05Å
424	L	94.8	Very high	90	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-30.2	-160.8	-71.4	170	0	0	0	113.6	F377 F422 G437 I465 F466	F377-L424 HydrophobicContact CD2-CD2 3.86Å; F377-L424 HydrophobicContact CE2-CD2 3.81Å; F422-L424 HydrophobicContact CB-CD2 3.94Å; F422-L424 HydrophobicContact CB-CG 4.13Å; L424-G437 PolarHBondContact N-O 3.38Å; L424-I465 WeakPolarHBondContact CB-O 3.39Å; L424-I465 VanDerWaalsContact CD1-O 3.27Å; L424-I465 WeakPolarHBondContact CD1-O 3.34Å; L424-F466 HydrophobicContact CD1-CD1 3.77Å; L424-F466 HydrophobicContact CD1-CE1 3.83Å; L424-F466 HydrophobicContact CD2-CD1 4.31Å; L424-F466 HydrophobicContact CD2-CE1 4.26Å; L424-F466 HydrophobicContact CG-CD1 4.47Å
425	C	94.9	Very high	90.4	Very high	11 Å²	11	56.4 Å²	56.4	7%	0.074	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.6	-177.9	52.4	0	0	0	0	110.7	T436 G437 F466 V468	C425-T436 VanDerWaalsContact O-CA 3.31Å; C425-T436 WeakPolarHBondContact O-CA 3.47Å; C425-G437 PolarHBondContact O-N 2.89Å; C425-G437 VanDerWaalsContact O-N 3.15Å; C425-F466 WeakPolarHBondContact CB-O 3.49Å; C425-V468 HydrophobicContact CB-CG2 4.06Å
426	V	95.6	Very high	91.1	Very high	16 Å²	16	51 Å²	51	10%	0.097	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.2	175.2	63.1	0	0	0	0	109.3	A378 D380 V390 I435 T436	A378-V426 HydrophobicContact CB-CG1 4.05Å; D380-V426 HydrophobicContact CB-CG1 4.37Å; V390-V426 HydrophobicContact CG1-CG2 4.02Å; V426-I435 CarbonylContact C-O 3.6Å; V426-I435 VanDerWaalsContact CA-O 3.29Å; V426-I435 WeakPolarHBondContact CA-O 3.31Å; V426-T436 HydrophobicContact CB-CG2 4.18Å; V426-T436 HydrophobicContact CG2-CG2 3.94Å
427	T	95.2	Very high	91.9	Very high	18 Å²	18	41.5 Å²	41.5	11%	0.11	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	177.9	168.2	-167.9	0	0	0	0	109	I435 V468 L476	T427-I435 HydrophobicContact CG2-CB 3.97Å; T427-I435 HydrophobicContact CG2-CD1 4.44Å; T427-I435 HydrophobicContact CG2-CG2 4.43Å; T427-I435 PolarHBondContact N-O 2.73Å; T427-I435 PolarHBondContact O-N 3.05Å; T427-V468 HydrophobicContact CG2-CB 4.02Å; T427-V468 HydrophobicContact CG2-CG2 3.58Å; T427-L476 HydrophobicContact CG2-CD1 3.98Å
428	F	94.4	Very high	92.5	Very high	13 Å²	13	38.9 Å²	38.9	6%	0.057	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.2	178.9	-61.7	-91.2	0	0	0	110.9	D380 F381 H382 P383 V390 D433 A434	D380-F428 HydrophobicContact CB-CE2 3.98Å; F381-F428 WeakPolarHBondContact O-CE2 3.46Å; H382-F428 HydrophobicContact CB-CE1 4.23Å; H382-F428 HydrophobicContact CB-CZ 4.4Å; H382-F428 AromaticContact CD2-CD1 3.91Å; H382-F428 AromaticContact CD2-CE1 3.76Å; P383-F428 HydrophobicContact CG-CB 3.71Å; P383-F428 HydrophobicContact CG-CG 4.13Å; V390-F428 HydrophobicContact CB-CZ 4.07Å; V390-F428 HydrophobicContact CG2-CE1 3.94Å; V390-F428 HydrophobicContact CG2-CZ 3.68Å; F428-D433 WeakPolarHBondContact CA-O 3.31Å; F428-A434 HydrophobicContact CD1-CB 3.96Å; F428-A434 HydrophobicContact CE1-CB 3.81Å
429	A	92.5	Very high	93.1	Very high	10 Å²	10	31.5 Å²	31.5	8%	0.083	16%	0.156	C	C	.	.			trans	-79.7	163.5	167.4	0	0	0	0	0	111.8	N431 G432 D433 I435 M470	A429-N431 WeakPolarHBondContact CB-OD1 3.13Å; A429-N431 PolarHBondContact O-N 2.85Å; A429-G432 WeakPolarHBondContact O-CA 3.49Å; A429-G432 PolarHBondContact O-N 2.74Å; A429-D433 HydrophobicContact CB-CB 4.47Å; A429-D433 PolarHBondContact N-O 3.28Å; A429-I435 HydrophobicContact CB-CD1 3.88Å; A429-M470 HydrophobicContact CB-CE 4.06Å
430	E	87.6	Confident	93.6	Very high	147 Å²	147	30.4 Å²	30.4	69%	0.687	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.9	178.4	-62	-175.5	172.2	0	0	112.7	G432	E430-G432 PolarHBondContact O-N 3.42Å
431	N	89.1	Confident	93.8	Very high	89 Å²	89	30.2 Å²	30.2	48%	0.476	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.4	175.2	69	-5.3	0	0	0	113.4	A429 D433 K448	A429-N431 WeakPolarHBondContact CB-OD1 3.13Å; A429-N431 PolarHBondContact O-N 2.85Å; N431-D433 PolarHBondContact ND2-OD2 2.92Å; N431-D433 WeakPolarHBondContact OD1-CB 2.94Å; N431-D433 PolarHBondContact OD1-N 3.16Å; N431-K448 WeakPolarHBondContact O-CD 3.21Å
432	G	89.7	Confident	94	Very high	1 Å²	1	25 Å²	25	1%	0.01	14%	0.137	C	C	.	.	S	Bend	trans	89.2	8.3	-176.4	0	0	0	0	0	114.9	H382 A429 E430	H382-G432 PolarHBondContact NE2-O 2.92Å; A429-G432 WeakPolarHBondContact O-CA 3.49Å; A429-G432 PolarHBondContact O-N 2.74Å; E430-G432 PolarHBondContact O-N 3.42Å
433	D	93.8	Very high	94.1	Very high	25 Å²	25	22.4 Å²	22.4	13%	0.134	13%	0.126	C	C	.	.			trans	-71	137	171.5	-68.3	-17.7	0	0	0	110	F428 A429 N431 V445 W446 G447 K448	F428-D433 WeakPolarHBondContact CA-O 3.31Å; A429-D433 HydrophobicContact CB-CB 4.47Å; A429-D433 PolarHBondContact N-O 3.28Å; N431-D433 PolarHBondContact ND2-OD2 2.92Å; N431-D433 WeakPolarHBondContact OD1-CB 2.94Å; N431-D433 PolarHBondContact OD1-N 3.16Å; D433-V445 HydrophobicContact CB-CG1 3.79Å; D433-W446 WeakPolarHBondContact CA-O 3.39Å; D433-W446 WeakPolarHBondContact CB-O 3.29Å; D433-G447 WeakPolarHBondContact OD1-CA 3.34Å; D433-K448 PolarHBondContact OD1-N 2.81Å
434	A	95.4	Very high	94.1	Very high	4 Å²	4	22.5 Å²	22.5	3%	0.033	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	136	172.1	0	0	0	0	0	109.1	F399 F428 V445 W446	F399-A434 HydrophobicContact CE1-CB 4.09Å; F428-A434 HydrophobicContact CD1-CB 3.96Å; F428-A434 HydrophobicContact CE1-CB 3.81Å; A434-V445 CarbonylContact O-C 3.55Å; A434-V445 WeakPolarHBondContact O-CA 3.15Å; A434-W446 HydrophobicContact CB-CB 4.16Å; A434-W446 PolarHBondContact N-O 2.78Å; A434-W446 VanDerWaalsContact O-CD1 3.3Å; A434-W446 PolarHBondContact O-N 2.94Å
435	I	96.3	Very high	94.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.6	179.8	-60	165	0	0	0	107.6	V426 T427 A429 I443 L444 V445 M470 L476 Y492	V426-I435 CarbonylContact C-O 3.6Å; V426-I435 VanDerWaalsContact CA-O 3.29Å; V426-I435 WeakPolarHBondContact CA-O 3.31Å; T427-I435 HydrophobicContact CG2-CB 3.97Å; T427-I435 HydrophobicContact CG2-CD1 4.44Å; T427-I435 HydrophobicContact CG2-CG2 4.43Å; T427-I435 PolarHBondContact N-O 2.73Å; T427-I435 PolarHBondContact O-N 3.05Å; A429-I435 HydrophobicContact CB-CD1 3.88Å; I435-I443 HydrophobicContact CG2-CG2 3.59Å; I435-L444 CarbonylContact C-O 3.56Å; I435-L444 WeakPolarHBondContact CA-O 3.09Å; I435-V445 HydrophobicContact CG1-CG1 4.46Å; I435-V445 HydrophobicContact CG1-CG2 4.47Å; I435-M470 HydrophobicContact CD1-CE 3.5Å; I435-L476 HydrophobicContact CD1-CD1 4.21Å; I435-L476 HydrophobicContact CD1-CD2 4.38Å; I435-L476 HydrophobicContact CG2-CD1 4.46Å; I435-L476 HydrophobicContact CG2-CD2 4.07Å; I435-Y492 HydrophobicContact CD1-CE1 3.82Å; I435-Y492 HydrophobicContact CG1-CE1 4.34Å
436	T	96.1	Very high	94.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.8	-178.8	61	0	0	0	0	111.7	L397 V423 C425 V426 L444 W446	L397-T436 HydrophobicContact CD1-CG2 4.06Å; L397-T436 HydrophobicContact CD2-CG2 4.41Å; V423-T436 HydrophobicContact CG1-CG2 4.05Å; C425-T436 VanDerWaalsContact O-CA 3.31Å; C425-T436 WeakPolarHBondContact O-CA 3.47Å; V426-T436 HydrophobicContact CB-CG2 4.18Å; V426-T436 HydrophobicContact CG2-CG2 3.94Å; T436-L444 PolarHBondContact N-O 3.31Å; T436-L444 PolarHBondContact O-N 3.07Å; T436-L444 WeakPolarHBondContact OG1-CB 3.16Å; T436-L444 PolarHBondContact OG1-O 2.89Å; T436-W446 PolarHBondContact OG1-NE1 2.96Å
437	G	95.9	Very high	93.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.8	168.4	0	0	0	0	0	111.3	L424 C425	L424-G437 PolarHBondContact N-O 3.38Å; C425-G437 PolarHBondContact O-N 2.89Å; C425-G437 VanDerWaalsContact O-N 3.15Å
438	D	94.7	Very high	93.7	Very high	2 Å²	2	26 Å²	26	1%	0.011	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	174.4	-176	79.4	14.3	0	0	0	114.4	P420 F422 S440 G441 N442 I465	P420-D438 HydrophobicContact CB-CB 3.67Å; P420-D438 HydrophobicContact CG-CB 3.81Å; F422-D438 CarbonylContact O-C 3.58Å; F422-D438 WeakPolarHBondContact O-CA 3.27Å; D438-S440 PolarHBondContact O-N 2.86Å; D438-S440 VanDerWaalsContact OD1-C 3.32Å; D438-S440 WeakPolarHBondContact OD1-CA 3.17Å; D438-S440 WeakPolarHBondContact OD1-CB 3.38Å; D438-S440 PolarHBondContact OD1-N 3.47Å; D438-G441 PolarHBondContact OD1-N 3.47Å; D438-N442 PolarHBondContact N-O 2.86Å; D438-N442 VanDerWaalsContact N-O 3.16Å; D438-N442 PolarHBondContact OD1-N 2.92Å; D438-N442 WeakPolarHBondContact OD2-CB 3.2Å; D438-N442 PolarHBondContact OD2-ND2 3.22Å; D438-I465 PolarHBondContact O-N 2.85Å
439	S	95.1	Very high	93.3	Very high	23 Å²	23	29 Å²	29	16%	0.161	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.3	176.9	55	0	0	0	0	114.6	K421 F422 G441 S464	K421-S439 PolarHBondContact N-OG 3.44Å; F422-S439 PolarHBondContact N-OG 3.02Å; F422-S439 PolarHBondContact O-N 3.34Å; F422-S439 PolarHBondContact O-OG 3.06Å; S439-G441 VanDerWaalsContact C-N 3.35Å; S439-S464 WeakPolarHBondContact O-CA 3.3Å; S439-S464 PolarHBondContact O-OG 3.48Å
440	S	93.4	Very high	93.2	Very high	71 Å²	71	31.6 Å²	31.6	50%	0.497	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.7	-175	-57.7	0	0	0	0	112.5	D438 N442	D438-S440 PolarHBondContact O-N 2.86Å; D438-S440 VanDerWaalsContact OD1-C 3.32Å; D438-S440 WeakPolarHBondContact OD1-CA 3.17Å; D438-S440 WeakPolarHBondContact OD1-CB 3.38Å; D438-S440 PolarHBondContact OD1-N 3.47Å; S440-N442 WeakPolarHBondContact CB-ND2 3.5Å
441	G	94.2	Very high	93.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	86.2	18.4	-179.8	0	0	0	0	0	113.9	D438 S439 A460 H461 G463	D438-G441 PolarHBondContact OD1-N 3.47Å; S439-G441 VanDerWaalsContact C-N 3.35Å; G441-A460 WeakPolarHBondContact O-CA 3.21Å; G441-A460 WeakPolarHBondContact O-CB 3.44Å; G441-A460 PolarHBondContact O-N 2.9Å; G441-H461 PolarHBondContact O-N 2.88Å; G441-G463 WeakPolarHBondContact CA-O 3.38Å
442	N	95.2	Very high	93.4	Very high	30 Å²	30	28.5 Å²	28.5	16%	0.16	17%	0.169	C	C	.	.			trans	-101.1	145.8	178.2	-44.6	-58.8	0	0	0	111.7	D438 S440 L444 I457 Q458 G459	D438-N442 PolarHBondContact N-O 2.86Å; D438-N442 VanDerWaalsContact N-O 3.16Å; D438-N442 PolarHBondContact OD1-N 2.92Å; D438-N442 WeakPolarHBondContact OD2-CB 3.2Å; D438-N442 PolarHBondContact OD2-ND2 3.22Å; S440-N442 WeakPolarHBondContact CB-ND2 3.5Å; N442-L444 HydrophobicContact CB-CD2 4.27Å; N442-I457 WeakPolarHBondContact CA-O 3.41Å; N442-Q458 WeakPolarHBondContact OD1-CA 3.34Å; N442-G459 PolarHBondContact OD1-N 2.77Å
443	I	96.1	Very high	93.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.7	166.7	-60.5	172.1	0	0	0	107.6	I435 I457 A460 I465 L476 W488	I435-I443 HydrophobicContact CG2-CG2 3.59Å; I443-I457 HydrophobicContact CB-CB 4.23Å; I443-I457 HydrophobicContact CB-CD1 3.75Å; I443-I457 HydrophobicContact CG2-CD1 3.72Å; I443-I457 PolarHBondContact N-O 2.97Å; I443-I457 VanDerWaalsContact N-O 3.13Å; I443-I457 PolarHBondContact O-N 2.86Å; I443-A460 HydrophobicContact CD1-CB 3.94Å; I443-A460 HydrophobicContact CG1-CB 3.94Å; I443-I465 HydrophobicContact CD1-CD1 4.44Å; I443-I465 HydrophobicContact CG1-CD1 3.6Å; I443-L476 HydrophobicContact CD1-CD2 4.41Å; I443-L476 HydrophobicContact CG2-CD2 4.36Å; I443-W488 HydrophobicContact CD1-CD2 4.3Å; I443-W488 HydrophobicContact CD1-CH2 4.47Å; I443-W488 HydrophobicContact CD1-CZ2 3.7Å
444	L	95.3	Very high	93.5	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.1	179	-48.7	173.6	0	0	0	109.4	F414 I435 T436 N442 W446 I453 V456	F414-L444 HydrophobicContact CD1-CD1 4.02Å; F414-L444 HydrophobicContact CE1-CD1 3.57Å; I435-L444 CarbonylContact C-O 3.56Å; I435-L444 WeakPolarHBondContact CA-O 3.09Å; T436-L444 PolarHBondContact N-O 3.31Å; T436-L444 PolarHBondContact O-N 3.07Å; T436-L444 WeakPolarHBondContact OG1-CB 3.16Å; T436-L444 PolarHBondContact OG1-O 2.89Å; N442-L444 HydrophobicContact CB-CD2 4.27Å; L444-W446 HydrophobicContact CB-CZ2 4.41Å; L444-W446 HydrophobicContact CD1-CZ2 4.08Å; L444-I453 HydrophobicContact CD1-CD1 4.25Å; L444-I453 HydrophobicContact CD2-CD1 4.38Å; L444-V456 HydrophobicContact CD2-CB 4.34Å; L444-V456 HydrophobicContact CD2-CG1 3.78Å; L444-V456 HydrophobicContact CD2-CG2 3.96Å
445	V	95.3	Very high	93.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.9	177.1	-171.6	0	0	0	0	108.5	D433 A434 I435 I453 S454 R455 Y492	D433-V445 HydrophobicContact CB-CG1 3.79Å; A434-V445 CarbonylContact O-C 3.55Å; A434-V445 WeakPolarHBondContact O-CA 3.15Å; I435-V445 HydrophobicContact CG1-CG1 4.46Å; I435-V445 HydrophobicContact CG1-CG2 4.47Å; V445-I453 CarbonylContact O-C 3.59Å; V445-I453 WeakPolarHBondContact O-CA 3.5Å; V445-S454 PolarHBondContact O-N 2.97Å; V445-S454 PolarHBondContact O-OG 3.29Å; V445-R455 HydrophobicContact CB-CB 4.05Å; V445-R455 HydrophobicContact CG2-CB 4.19Å; V445-R455 PolarHBondContact N-O 3.38Å; V445-R455 PolarHBondContact O-N 2.9Å; V445-Y492 HydrophobicContact CG1-CE2 4.41Å; V445-Y492 HydrophobicContact CG2-CD1 4.4Å; V445-Y492 HydrophobicContact CG2-CD2 4.38Å; V445-Y492 HydrophobicContact CG2-CE1 3.96Å; V445-Y492 HydrophobicContact CG2-CE2 3.93Å
446	W	94.7	Very high	93.1	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.9	-176.2	-53.9	80	0	0	0	108.4	L397 F399 F414 D433 A434 T436 L444 I453	L397-W446 HydrophobicContact CD2-CD2 4.01Å; L397-W446 HydrophobicContact CD2-CE3 4.32Å; L397-W446 HydrophobicContact CD2-CH2 3.47Å; L397-W446 VanDerWaalsContact CD2-CH2 3.47Å; L397-W446 HydrophobicContact CD2-CZ2 3.05Å; L397-W446 HydrophobicContact CD2-CZ3 4.08Å; F399-W446 HydrophobicContact CE2-CD2 4.42Å; F399-W446 HydrophobicContact CE2-CE3 4.11Å; F399-W446 HydrophobicContact CZ-CB 3.91Å; F399-W446 HydrophobicContact CZ-CD2 4.08Å; F399-W446 HydrophobicContact CZ-CE3 4.15Å; F399-W446 AromaticContact CZ-CG 3.97Å; F399-W446 HydrophobicContact CZ-CG 3.97Å; F414-W446 HydrophobicContact CD1-CH2 4.04Å; F414-W446 HydrophobicContact CD1-CZ2 4.29Å; F414-W446 HydrophobicContact CD2-CH2 4.13Å; F414-W446 AromaticContact CE1-CH2 3.84Å; F414-W446 HydrophobicContact CE1-CH2 3.84Å; F414-W446 AromaticContact CE1-CZ2 3.76Å; F414-W446 HydrophobicContact CE1-CZ2 3.76Å; F414-W446 AromaticContact CE2-CH2 3.93Å; F414-W446 HydrophobicContact CE2-CH2 3.93Å; F414-W446 HydrophobicContact CE2-CZ2 4.47Å; F414-W446 HydrophobicContact CG-CH2 4.17Å; F414-W446 AromaticContact CZ-CH2 3.78Å; F414-W446 HydrophobicContact CZ-CH2 3.78Å; F414-W446 AromaticContact CZ-CZ2 3.87Å; F414-W446 HydrophobicContact CZ-CZ2 3.87Å; D433-W446 WeakPolarHBondContact CA-O 3.39Å; D433-W446 WeakPolarHBondContact CB-O 3.29Å; A434-W446 HydrophobicContact CB-CB 4.16Å; A434-W446 PolarHBondContact N-O 2.78Å; A434-W446 VanDerWaalsContact O-CD1 3.3Å; A434-W446 PolarHBondContact O-N 2.94Å; T436-W446 PolarHBondContact OG1-NE1 2.96Å; L444-W446 HydrophobicContact CB-CZ2 4.41Å; L444-W446 HydrophobicContact CD1-CZ2 4.08Å; W446-I453 HydrophobicContact CD2-CG1 4.16Å; W446-I453 HydrophobicContact CE3-CG1 3.91Å; W446-I453 HydrophobicContact CH2-CD1 3.92Å; W446-I453 HydrophobicContact CH2-CG1 3.55Å; W446-I453 HydrophobicContact CZ2-CD1 4.12Å; W446-I453 HydrophobicContact CZ2-CG1 3.81Å; W446-I453 HydrophobicContact CZ3-CD1 4.42Å; W446-I453 HydrophobicContact CZ3-CG1 3.6Å
447	G	92.3	Very high	93.1	Very high	13 Å²	13	40.5 Å²	40.5	13%	0.134	23%	0.231	C	C	.	.			trans	-63.7	136.9	-174.1	0	0	0	0	0	112.1	D433 G449 T450 R452	D433-G447 WeakPolarHBondContact OD1-CA 3.34Å; G447-G449 PolarHBondContact O-N 2.7Å; G447-T450 WeakPolarHBondContact O-CA 3.46Å; G447-T450 WeakPolarHBondContact O-CB 3.32Å; G447-T450 PolarHBondContact O-N 2.85Å; G447-T450 PolarHBondContact O-OG1 2.81Å; G447-R452 PolarHBondContact N-O 2.9Å
448	K	90.2	Very high	92.9	Very high	111 Å²	111	46.9 Å²	46.9	48%	0.483	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	131.7	177.7	-178.4	179.2	-179.3	172.8	0	112.4	N431 D433 T450	N431-K448 WeakPolarHBondContact O-CD 3.21Å; D433-K448 PolarHBondContact OD1-N 2.81Å; K448-T450 PolarHBondContact O-N 3.45Å
449	G	86.6	Confident	92.6	Very high	78 Å²	78	49.4 Å²	49.4	80%	0.804	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	-1.3	179.6	0	0	0	0	0	114.6	G447	G447-G449 PolarHBondContact O-N 2.7Å
450	T	89.4	Confident	92.5	Very high	63 Å²	63	48.8 Å²	48.8	39%	0.387	28%	0.284	S	S	.	.			trans	-107.8	163.2	174.3	82.6	0	0	0	0	110.3	G447 K448 R452	G447-T450 WeakPolarHBondContact O-CA 3.46Å; G447-T450 WeakPolarHBondContact O-CB 3.32Å; G447-T450 PolarHBondContact O-N 2.85Å; G447-T450 PolarHBondContact O-OG1 2.81Å; K448-T450 PolarHBondContact O-N 3.45Å; T450-R452 PolarHBondContact OG1-N 3.47Å; T450-R452 PolarHBondContact OG1-O 2.92Å
451	N	90.7	Very high	92.6	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	26%	0.262	C	S	.	.	S	Bend	trans	-111	25.9	168.6	64.8	-31.1	0	0	0	111	F399 Q411 L413	F399-N451 HydrophobicContact CD2-CB 4.1Å; F399-N451 HydrophobicContact CE2-CB 4.41Å; Q411-N451 PolarHBondContact O-ND2 3.15Å; L413-N451 PolarHBondContact N-O 2.93Å
452	R	91.6	Very high	92.6	Very high	130 Å²	130	53 Å²	53	49%	0.491	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-121.2	151.2	-174.4	-67.3	174.7	-177.1	-128.7	5.4	110.2	L413 E415 G447 T450 S454	L413-R452 HydrophobicContact CB-CG 4.18Å; L413-R452 HydrophobicContact CD1-CG 4.11Å; E415-R452 WeakPolarHBondContact OE1-CD 3.37Å; E415-R452 WeakPolarHBondContact OE1-CG 3.43Å; E415-R452 IonicContact OE1-CZ 2.78Å; E415-R452 VanDerWaalsContact OE1-CZ 3.3Å; E415-R452 IonicContact OE1-NE 3.21Å; E415-R452 PolarHBondContact OE1-NE 2.88Å; E415-R452 IonicContact OE1-NH1 3.65Å; E415-R452 PolarHBondContact OE1-NH1 3.13Å; G447-R452 PolarHBondContact N-O 2.9Å; T450-R452 PolarHBondContact OG1-N 3.47Å; T450-R452 PolarHBondContact OG1-O 2.92Å; R452-S454 PolarHBondContact O-N 2.79Å
453	I	93.4	Very high	92.4	Very high	30 Å²	30	52.3 Å²	52.3	15%	0.154	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.8	178.3	-58.9	176.1	0	0	0	109.2	F414 Q417 L444 V445 W446 R455 V456	F414-I453 HydrophobicContact CB-CD1 4.27Å; F414-I453 HydrophobicContact CD1-CD1 3.89Å; F414-I453 HydrophobicContact CG-CD1 4.35Å; Q417-I453 HydrophobicContact CB-CD1 4.32Å; Q417-I453 HydrophobicContact CG-CD1 4.22Å; L444-I453 HydrophobicContact CD1-CD1 4.25Å; L444-I453 HydrophobicContact CD2-CD1 4.38Å; V445-I453 CarbonylContact O-C 3.59Å; V445-I453 WeakPolarHBondContact O-CA 3.5Å; W446-I453 HydrophobicContact CD2-CG1 4.16Å; W446-I453 HydrophobicContact CE3-CG1 3.91Å; W446-I453 HydrophobicContact CH2-CD1 3.92Å; W446-I453 HydrophobicContact CH2-CG1 3.55Å; W446-I453 HydrophobicContact CZ2-CD1 4.12Å; W446-I453 HydrophobicContact CZ2-CG1 3.81Å; W446-I453 HydrophobicContact CZ3-CD1 4.42Å; W446-I453 HydrophobicContact CZ3-CG1 3.6Å; I453-R455 WeakPolarHBondContact CG2-O 3.16Å; I453-V456 HydrophobicContact CG2-CG2 3.42Å; I453-V456 VanDerWaalsContact CG2-CG2 3.42Å
454	S	91.9	Very high	92.4	Very high	75 Å²	75	53.5 Å²	53.5	52%	0.524	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-38.3	174	59.9	0	0	0	0	111.8	V445 R452	V445-S454 PolarHBondContact O-N 2.97Å; V445-S454 PolarHBondContact O-OG 3.29Å; R452-S454 PolarHBondContact O-N 2.79Å
455	R	91.4	Very high	92.4	Very high	110 Å²	110	53.3 Å²	53.3	42%	0.415	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.2	-178.5	-178.1	174.4	-115.3	173.4	-11.7	111.4	V445 I453 S491	V445-R455 HydrophobicContact CB-CB 4.05Å; V445-R455 HydrophobicContact CG2-CB 4.19Å; V445-R455 PolarHBondContact N-O 3.38Å; V445-R455 PolarHBondContact O-N 2.9Å; I453-R455 WeakPolarHBondContact CG2-O 3.16Å; R455-S491 PolarHBondContact NH1-O 3.42Å
456	V	92.7	Very high	92.4	Very high	41 Å²	41	54.9 Å²	54.9	25%	0.248	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.4	179.3	-178.7	0	0	0	0	108.8	Q417 L444 I453 Q458	Q417-V456 HydrophobicContact CG-CG1 4.49Å; Q417-V456 HydrophobicContact CG-CG2 3.8Å; L444-V456 HydrophobicContact CD2-CB 4.34Å; L444-V456 HydrophobicContact CD2-CG1 3.78Å; L444-V456 HydrophobicContact CD2-CG2 3.96Å; I453-V456 HydrophobicContact CG2-CG2 3.42Å; I453-V456 VanDerWaalsContact CG2-CG2 3.42Å; V456-Q458 HydrophobicContact CG1-CG 3.55Å
457	I	94.1	Very high	92.5	Very high	26 Å²	26	55.2 Å²	55.2	13%	0.133	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	99.4	169.5	-54.5	129.8	0	0	0	106	N442 I443 A460 W488 Y492	N442-I457 WeakPolarHBondContact CA-O 3.41Å; I443-I457 HydrophobicContact CB-CB 4.23Å; I443-I457 HydrophobicContact CB-CD1 3.75Å; I443-I457 HydrophobicContact CG2-CD1 3.72Å; I443-I457 PolarHBondContact N-O 2.97Å; I443-I457 VanDerWaalsContact N-O 3.13Å; I443-I457 PolarHBondContact O-N 2.86Å; I457-A460 HydrophobicContact CG2-CB 3.97Å; I457-W488 HydrophobicContact CG2-CH2 3.96Å; I457-W488 HydrophobicContact CG2-CZ3 3.73Å; I457-Y492 VanDerWaalsContact CD1-CB 3.47Å; I457-Y492 HydrophobicContact CD1-CD1 4.08Å; I457-Y492 HydrophobicContact CD1-CG 3.89Å
458	Q	92.3	Very high	92.6	Very high	134 Å²	134	55.3 Å²	55.3	63%	0.626	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	136.6	-177.6	-66.6	-172.3	-23.5	0	0	110.5	N442 V456 A460	N442-Q458 WeakPolarHBondContact OD1-CA 3.34Å; V456-Q458 HydrophobicContact CG1-CG 3.55Å; Q458-A460 VanDerWaalsContact C-N 3.27Å; Q458-A460 PolarHBondContact O-N 2.89Å
459	G	89.5	Confident	92.8	Very high	55 Å²	55	51 Å²	51	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	35.7	178	0	0	0	0	0	113.3	N442 H461	N442-G459 PolarHBondContact OD1-N 2.77Å; G459-H461 PolarHBondContact O-N 3.12Å
460	A	93.2	Very high	93.1	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	27%	0.265	C	S	.	.	S	Bend	trans	-58.6	-36.6	173.6	0	0	0	0	0	111.2	G441 I443 I457 Q458 I465 I486 W488	G441-A460 WeakPolarHBondContact O-CA 3.21Å; G441-A460 WeakPolarHBondContact O-CB 3.44Å; G441-A460 PolarHBondContact O-N 2.9Å; I443-A460 HydrophobicContact CD1-CB 3.94Å; I443-A460 HydrophobicContact CG1-CB 3.94Å; I457-A460 HydrophobicContact CG2-CB 3.97Å; Q458-A460 VanDerWaalsContact C-N 3.27Å; Q458-A460 PolarHBondContact O-N 2.89Å; A460-I465 HydrophobicContact CB-CD1 4.37Å; A460-I486 WeakPolarHBondContact O-CD1 3.41Å; A460-W488 HydrophobicContact CB-CH2 3.57Å; A460-W488 HydrophobicContact CB-CZ2 3.68Å
461	H	95.4	Very high	93.2	Very high	7 Å²	7	46.8 Å²	46.8	3%	0.032	25%	0.25	C	S	.	.	S	Bend	trans	-128.8	152.4	174.6	-74.7	-97.8	0	0	0	110.3	G441 G459 G463 I465 S478 D482 R484	G441-H461 PolarHBondContact O-N 2.88Å; G459-H461 PolarHBondContact O-N 3.12Å; H461-G463 WeakPolarHBondContact CB-O 3.37Å; H461-G463 PolarHBondContact O-N 3.43Å; H461-I465 HydrophobicContact CB-CD1 4.42Å; H461-I465 HydrophobicContact CB-CG1 3.93Å; H461-S478 WeakPolarHBondContact NE2-CB 3.26Å; H461-S478 PolarHBondContact NE2-OG 3.02Å; H461-D482 WeakPolarHBondContact CA-OD2 3.46Å; H461-D482 VanDerWaalsContact CB-OD2 3.27Å; H461-D482 WeakPolarHBondContact CB-OD2 3.33Å; H461-D482 IonicContact CE1-OD1 3.9Å; H461-D482 IonicContact CG-OD1 3.99Å; H461-D482 IonicContact CG-OD2 3.43Å; H461-D482 VanDerWaalsContact ND1-CG 3.32Å; H461-D482 IonicContact ND1-OD1 2.86Å; H461-D482 PolarHBondContact ND1-OD1 3.32Å; H461-D482 IonicContact ND1-OD2 3.72Å; H461-D482 PolarHBondContact ND1-OD2 3.01Å; H461-R484 PolarHBondContact CE1-O 3.44Å; H461-R484 VanDerWaalsContact CE1-O 3.3Å
462	E	92.8	Very high	92.9	Very high	153 Å²	153	53.3 Å²	53.3	72%	0.715	27%	0.272	S	S	*	.	S	Bend	trans	-73.7	-15.2	174.6	-70.6	176.1	-155.1	0	0	112.1	D482 R484	E462-D482 HydrophobicContact CB-CB 4.36Å; E462-D482 PolarHBondContact N-OD2 3.3Å; E462-R484 IonicContact OE1-CZ 3.42Å; E462-R484 IonicContact OE1-NH1 2.83Å; E462-R484 PolarHBondContact OE1-NH1 2.96Å; E462-R484 IonicContact OE1-NH2 2.92Å; E462-R484 PolarHBondContact OE1-NH2 3.09Å
463	G	92.3	Very high	92.5	Very high	15 Å²	15	52.9 Å²	52.9	16%	0.155	28%	0.279	C	S	.	.	S	Bend	trans	-137.1	-174.5	178.8	0	0	0	0	0	112.8	G441 H461	G441-G463 WeakPolarHBondContact CA-O 3.38Å; H461-G463 WeakPolarHBondContact CB-O 3.37Å; H461-G463 PolarHBondContact O-N 3.43Å
464	S	94.8	Very high	92.1	Very high	26 Å²	26	52.4 Å²	52.4	18%	0.182	28%	0.281	C	S	.	.			trans	-61.8	135.7	-177.2	-50.4	0	0	0	0	112.8	S439 G480 K481	S439-S464 WeakPolarHBondContact O-CA 3.3Å; S439-S464 PolarHBondContact O-OG 3.48Å; S464-G480 CarbonylContact O-C 3.59Å; S464-G480 WeakPolarHBondContact O-CA 2.89Å; S464-K481 PolarHBondContact O-N 2.79Å
465	I	96.8	Very high	92	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	113.5	179.3	-59.7	172.9	0	0	0	108.6	L424 D438 I443 A460 H461 V468	L424-I465 WeakPolarHBondContact CB-O 3.39Å; L424-I465 VanDerWaalsContact CD1-O 3.27Å; L424-I465 WeakPolarHBondContact CD1-O 3.34Å; D438-I465 PolarHBondContact O-N 2.85Å; I443-I465 HydrophobicContact CD1-CD1 4.44Å; I443-I465 HydrophobicContact CG1-CD1 3.6Å; A460-I465 HydrophobicContact CB-CD1 4.37Å; H461-I465 HydrophobicContact CB-CD1 4.42Å; H461-I465 HydrophobicContact CB-CG1 3.93Å; I465-V468 HydrophobicContact CG2-CG1 3.86Å
466	F	95.3	Very high	92.2	Very high	33 Å²	33	44.1 Å²	44.1	15%	0.145	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-28.3	-177.6	-70.1	-58.8	0	0	0	113.3	L424 C425 G479 K481 I507	L424-F466 HydrophobicContact CD1-CD1 3.77Å; L424-F466 HydrophobicContact CD1-CE1 3.83Å; L424-F466 HydrophobicContact CD2-CD1 4.31Å; L424-F466 HydrophobicContact CD2-CE1 4.26Å; L424-F466 HydrophobicContact CG-CD1 4.47Å; C425-F466 WeakPolarHBondContact CB-O 3.49Å; F466-G479 PolarHBondContact N-O 3.28Å; F466-K481 HydrophobicContact CE2-CB 3.85Å; F466-K481 HydrophobicContact CE2-CG 4.44Å; F466-I507 WeakPolarHBondContact CD2-O 3.38Å
467	A	95.2	Very high	92.3	Very high	8 Å²	8	42.1 Å²	42.1	7%	0.066	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.1	-176.8	0	0	0	0	0	111.2	S478 G479 I510	A467-S478 WeakPolarHBondContact O-CA 3.39Å; A467-G479 PolarHBondContact N-O 2.86Å; A467-G479 PolarHBondContact O-N 2.95Å; A467-I510 HydrophobicContact CB-CB 4.17Å; A467-I510 HydrophobicContact CB-CD1 3.72Å; A467-I510 HydrophobicContact CB-CG1 3.74Å
468	V	95.3	Very high	92.4	Very high	16 Å²	16	40.9 Å²	40.9	10%	0.097	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132	167.6	-69.3	0	0	0	0	107.7	C425 T427 I465 L476 V477	C425-V468 HydrophobicContact CB-CG2 4.06Å; T427-V468 HydrophobicContact CG2-CB 4.02Å; T427-V468 HydrophobicContact CG2-CG2 3.58Å; I465-V468 HydrophobicContact CG2-CG1 3.86Å; V468-L476 HydrophobicContact CB-CD1 4.35Å; V468-V477 CarbonylContact C-O 3.49Å; V468-V477 WeakPolarHBondContact CA-O 3.46Å
469	C	94.4	Very high	92.5	Very high	21 Å²	21	34.5 Å²	34.5	14%	0.142	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.5	-178.5	-174	0	0	0	0	109.1	V477 I510	C469-V477 PolarHBondContact N-O 2.76Å; C469-V477 PolarHBondContact O-N 3.28Å; C469-I510 HydrophobicContact CB-CB 4.04Å; C469-I510 HydrophobicContact CB-CG2 3.7Å
470	M	92.7	Very high	92.6	Very high	37 Å²	37	31.9 Å²	31.9	18%	0.182	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.7	171	-168	59.5	70.4	0	0	108	A429 I435 L476	A429-M470 HydrophobicContact CB-CE 4.06Å; I435-M470 HydrophobicContact CD1-CE 3.5Å; M470-L476 HydrophobicContact CE-CB 3.97Å; M470-L476 HydrophobicContact CE-CD1 3.85Å; M470-L476 HydrophobicContact CE-CG 4.48Å; M470-L476 HydrophobicContact SD-CB 4.21Å
471	L	90.8	Very high	92.7	Very high	15 Å²	15	37.8 Å²	37.8	8%	0.079	19%	0.189	C	C	.	.			trans	-82.7	157.2	177.4	-60.8	-179.8	0	0	0	110.6	N473 G474 A475 V477 E512	L471-N473 WeakPolarHBondContact CB-OD1 3.14Å; L471-N473 PolarHBondContact O-N 3.37Å; L471-N473 VanDerWaalsContact O-N 3.12Å; L471-G474 PolarHBondContact O-N 2.61Å; L471-A475 WeakPolarHBondContact CB-O 3.37Å; L471-A475 HydrophobicContact CD1-CB 4.41Å; L471-A475 PolarHBondContact N-O 3.14Å; L471-V477 HydrophobicContact CD1-CG2 3.57Å; L471-V477 HydrophobicContact CD2-CG2 4.39Å; L471-V477 HydrophobicContact CG-CG2 3.87Å; L471-E512 HydrophobicContact CD2-CB 3.96Å; L471-E512 HydrophobicContact CD2-CG 3.89Å
472	R	84.2	Confident	92.6	Very high	178 Å²	178	38.6 Å²	38.6	67%	0.672	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.2	176.1	-79.4	179.4	-67.4	-158.7	-11	115.2	G474 E512 G513	R472-G474 PolarHBondContact O-N 3Å; R472-E512 WeakPolarHBondContact CB-OE1 3.04Å; R472-E512 WeakPolarHBondContact CG-OE1 3.43Å; R472-E512 WeakPolarHBondContact CG-OE2 3.39Å; R472-E512 IonicContact CZ-OE1 3.83Å; R472-E512 VanDerWaalsContact CZ-OE1 3.24Å; R472-E512 PolarHBondContact N-OE2 2.8Å; R472-E512 IonicContact NE-OE1 3.69Å; R472-E512 PolarHBondContact NE-OE1 3.17Å; R472-E512 IonicContact NE-OE2 3.62Å; R472-E512 IonicContact NH2-OE1 3.33Å; R472-E512 PolarHBondContact NH2-OE1 2.85Å; R472-G513 PolarHBondContact NH2-O 3Å
473	N	83.6	Confident	92.7	Very high	121 Å²	121	33.9 Å²	33.9	65%	0.647	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	3.2	175	66.8	-0	0	0	0	112.9	L471 A475	L471-N473 WeakPolarHBondContact CB-OD1 3.14Å; L471-N473 PolarHBondContact O-N 3.37Å; L471-N473 VanDerWaalsContact O-N 3.12Å; N473-A475 VanDerWaalsContact C-N 3.29Å; N473-A475 PolarHBondContact O-N 3.39Å; N473-A475 VanDerWaalsContact OD1-CB 3.23Å; N473-A475 WeakPolarHBondContact OD1-CB 3.34Å; N473-A475 PolarHBondContact OD1-N 2.84Å
474	G	84.8	Confident	92.8	Very high	19 Å²	19	37 Å²	37	20%	0.196	18%	0.176	C	C	.	.	S	Bend	trans	82.1	-0.1	-178.5	0	0	0	0	0	114.5	L471 R472	L471-G474 PolarHBondContact O-N 2.61Å; R472-G474 PolarHBondContact O-N 3Å
475	A	90.9	Very high	92.8	Very high	9 Å²	9	35.7 Å²	35.7	7%	0.074	17%	0.168	C	C	.	.			trans	-79.2	136.5	174.7	0	0	0	0	0	110.8	L471 N473 W488	L471-A475 WeakPolarHBondContact CB-O 3.37Å; L471-A475 HydrophobicContact CD1-CB 4.41Å; L471-A475 PolarHBondContact N-O 3.14Å; N473-A475 VanDerWaalsContact C-N 3.29Å; N473-A475 PolarHBondContact O-N 3.39Å; N473-A475 VanDerWaalsContact OD1-CB 3.23Å; N473-A475 WeakPolarHBondContact OD1-CB 3.34Å; N473-A475 PolarHBondContact OD1-N 2.84Å; A475-W488 WeakPolarHBondContact CA-O 3.24Å
476	L	94.4	Very high	92.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138	172.1	177	73.4	0	0	0	108.5	T427 I435 I443 V468 M470 S487 W488 Y492	T427-L476 HydrophobicContact CG2-CD1 3.98Å; I435-L476 HydrophobicContact CD1-CD1 4.21Å; I435-L476 HydrophobicContact CD1-CD2 4.38Å; I435-L476 HydrophobicContact CG2-CD1 4.46Å; I435-L476 HydrophobicContact CG2-CD2 4.07Å; I443-L476 HydrophobicContact CD1-CD2 4.41Å; I443-L476 HydrophobicContact CG2-CD2 4.36Å; V468-L476 HydrophobicContact CB-CD1 4.35Å; M470-L476 HydrophobicContact CE-CB 3.97Å; M470-L476 HydrophobicContact CE-CD1 3.85Å; M470-L476 HydrophobicContact CE-CG 4.48Å; M470-L476 HydrophobicContact SD-CB 4.21Å; L476-S487 CarbonylContact O-C 3.56Å; L476-S487 WeakPolarHBondContact O-CA 3.33Å; L476-W488 HydrophobicContact CB-CB 4.16Å; L476-W488 HydrophobicContact CD2-CG 4.38Å; L476-W488 PolarHBondContact N-O 3.01Å; L476-W488 VanDerWaalsContact O-CD1 3.29Å; L476-W488 PolarHBondContact O-N 3.5Å; L476-Y492 HydrophobicContact CD2-CD1 4.11Å; L476-Y492 HydrophobicContact CD2-CE1 4.25Å
477	V	95.1	Very high	92.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.9	170.8	-175.5	0	0	0	0	109.2	V468 C469 L471 L485 I486 I510 L532	V468-V477 CarbonylContact C-O 3.49Å; V468-V477 WeakPolarHBondContact CA-O 3.46Å; C469-V477 PolarHBondContact N-O 2.76Å; C469-V477 PolarHBondContact O-N 3.28Å; L471-V477 HydrophobicContact CD1-CG2 3.57Å; L471-V477 HydrophobicContact CD2-CG2 4.39Å; L471-V477 HydrophobicContact CG-CG2 3.87Å; V477-L485 HydrophobicContact CG1-CD1 3.41Å; V477-L485 VanDerWaalsContact CG1-CD1 3.41Å; V477-L485 HydrophobicContact CG1-CD2 4.05Å; V477-L485 HydrophobicContact CG1-CG 3.56Å; V477-I486 CarbonylContact C-O 3.6Å; V477-I486 WeakPolarHBondContact CA-O 3.44Å; V477-I510 HydrophobicContact CG1-CD1 4.28Å; V477-I510 HydrophobicContact CG1-CG2 4.39Å; V477-L532 HydrophobicContact CG1-CD2 4.49Å; V477-L532 HydrophobicContact CG2-CD1 4.45Å
478	S	96.1	Very high	92.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148.6	176.9	63.1	0	0	0	0	111.8	H461 A467 L485 I486 W488	H461-S478 WeakPolarHBondContact NE2-CB 3.26Å; H461-S478 PolarHBondContact NE2-OG 3.02Å; A467-S478 WeakPolarHBondContact O-CA 3.39Å; S478-L485 WeakPolarHBondContact O-CA 3.3Å; S478-I486 PolarHBondContact N-O 2.98Å; S478-I486 PolarHBondContact O-N 3.04Å; S478-W488 PolarHBondContact OG-NE1 3.28Å
479	G	95.1	Very high	92.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	150.7	176.9	0	0	0	0	0	112.6	F466 A467 R484	F466-G479 PolarHBondContact N-O 3.28Å; A467-G479 PolarHBondContact N-O 2.86Å; A467-G479 PolarHBondContact O-N 2.95Å; G479-R484 WeakPolarHBondContact CA-O 3.33Å
480	G	92.5	Very high	92.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	-152.7	-170.8	0	0	0	0	0	115.7	S464 D482 R483 I507	S464-G480 CarbonylContact O-C 3.59Å; S464-G480 WeakPolarHBondContact O-CA 2.89Å; G480-D482 PolarHBondContact O-N 2.79Å; G480-R483 PolarHBondContact O-N 2.88Å; G480-I507 PolarHBondContact O-N 2.83Å
481	K	94.3	Very high	91.8	Very high	133 Å²	133	41.2 Å²	41.2	58%	0.578	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.4	-174.6	-169	177.2	177.4	-174.2	0	113.5	S464 F466 R483	S464-K481 PolarHBondContact O-N 2.79Å; F466-K481 HydrophobicContact CE2-CB 3.85Å; F466-K481 HydrophobicContact CE2-CG 4.44Å; K481-R483 PolarHBondContact O-N 3.02Å
482	D	93.9	Very high	91.8	Very high	24 Å²	24	41.4 Å²	41.4	13%	0.128	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	0.2	180	61.5	-6.6	0	0	0	113.9	H461 E462 G480 R484	H461-D482 WeakPolarHBondContact CA-OD2 3.46Å; H461-D482 VanDerWaalsContact CB-OD2 3.27Å; H461-D482 WeakPolarHBondContact CB-OD2 3.33Å; H461-D482 IonicContact CE1-OD1 3.9Å; H461-D482 IonicContact CG-OD1 3.99Å; H461-D482 IonicContact CG-OD2 3.43Å; H461-D482 VanDerWaalsContact ND1-CG 3.32Å; H461-D482 IonicContact ND1-OD1 2.86Å; H461-D482 PolarHBondContact ND1-OD1 3.32Å; H461-D482 IonicContact ND1-OD2 3.72Å; H461-D482 PolarHBondContact ND1-OD2 3.01Å; E462-D482 HydrophobicContact CB-CB 4.36Å; E462-D482 PolarHBondContact N-OD2 3.3Å; G480-D482 PolarHBondContact O-N 2.79Å; D482-R484 PolarHBondContact O-N 2.75Å; D482-R484 VanDerWaalsContact O-N 3.11Å; D482-R484 PolarHBondContact OD1-N 2.89Å
483	R	94.3	Very high	92.1	Very high	54 Å²	54	38.5 Å²	38.5	20%	0.204	20%	0.202	C	C	.	.			trans	63.1	9.3	-178.9	-44.5	175	-60.8	-151.1	10.5	114	G480 K481 E499 V500 E502	G480-R483 PolarHBondContact O-N 2.88Å; K481-R483 PolarHBondContact O-N 3.02Å; R483-E499 IonicContact CZ-OE1 3.93Å; R483-E499 IonicContact NE-OE1 2.66Å; R483-E499 IonicContact NH2-OE1 2.95Å; R483-E499 PolarHBondContact NH2-OE1 2.99Å; R483-V500 HydrophobicContact CB-CB 4.4Å; R483-V500 PolarHBondContact O-N 2.88Å; R483-E502 IonicContact CZ-OE2 2.86Å; R483-E502 IonicContact NH1-OE1 3.34Å; R483-E502 IonicContact NH1-OE2 3.8Å; R483-E502 PolarHBondContact NH1-OE2 3.47Å; R483-E502 IonicContact NH2-OE2 3.89Å
484	R	93.9	Very high	92.6	Very high	80 Å²	80	38 Å²	38	30%	0.302	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	134.3	176.9	-67.8	-178.3	-179.7	155	9.5	109.5	H461 E462 G479 D482 I486 T497 V498	H461-R484 PolarHBondContact CE1-O 3.44Å; H461-R484 VanDerWaalsContact CE1-O 3.3Å; E462-R484 IonicContact OE1-CZ 3.42Å; E462-R484 IonicContact OE1-NH1 2.83Å; E462-R484 PolarHBondContact OE1-NH1 2.96Å; E462-R484 IonicContact OE1-NH2 2.92Å; E462-R484 PolarHBondContact OE1-NH2 3.09Å; G479-R484 WeakPolarHBondContact CA-O 3.33Å; D482-R484 PolarHBondContact O-N 2.75Å; D482-R484 VanDerWaalsContact O-N 3.11Å; D482-R484 PolarHBondContact OD1-N 2.89Å; R484-I486 HydrophobicContact CB-CG1 4.28Å; R484-T497 HydrophobicContact CB-CG2 4.1Å; R484-T497 HydrophobicContact CG-CG2 4.21Å; R484-V498 CarbonylContact C-O 3.6Å; R484-V498 WeakPolarHBondContact CA-O 3.35Å
485	L	94.7	Very high	92.9	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117	167.3	-169.4	77.6	0	0	0	107.4	V477 S478 T497 V498 I507 I510 V518 I520 L532 F536	V477-L485 HydrophobicContact CG1-CD1 3.41Å; V477-L485 VanDerWaalsContact CG1-CD1 3.41Å; V477-L485 HydrophobicContact CG1-CD2 4.05Å; V477-L485 HydrophobicContact CG1-CG 3.56Å; S478-L485 WeakPolarHBondContact O-CA 3.3Å; L485-T497 CarbonylContact O-C 3.56Å; L485-T497 WeakPolarHBondContact O-CA 3.41Å; L485-V498 PolarHBondContact N-O 2.92Å; L485-V498 PolarHBondContact O-N 2.93Å; L485-I507 HydrophobicContact CB-CD1 4Å; L485-I507 HydrophobicContact CD1-CD1 4.1Å; L485-I510 HydrophobicContact CD1-CD1 3.5Å; L485-I510 HydrophobicContact CD1-CG1 3.91Å; L485-V518 HydrophobicContact CD2-CG1 4.37Å; L485-I520 HydrophobicContact CD1-CD1 4.34Å; L485-I520 HydrophobicContact CD2-CD1 4.11Å; L485-L532 HydrophobicContact CD2-CD2 3.54Å; L485-L532 HydrophobicContact CG-CD2 4.27Å; L485-F536 HydrophobicContact CD2-CE2 4.1Å; L485-F536 HydrophobicContact CD2-CZ 3.63Å
486	I	95.1	Very high	92.8	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.7	-175.4	-52.8	179.7	0	0	0	109.2	A460 V477 S478 R484 W488 Q494 Q496 T497	A460-I486 WeakPolarHBondContact O-CD1 3.41Å; V477-I486 CarbonylContact C-O 3.6Å; V477-I486 WeakPolarHBondContact CA-O 3.44Å; S478-I486 PolarHBondContact N-O 2.98Å; S478-I486 PolarHBondContact O-N 3.04Å; R484-I486 HydrophobicContact CB-CG1 4.28Å; I486-W488 HydrophobicContact CB-CZ2 3.95Å; I486-W488 HydrophobicContact CD1-CZ2 4.21Å; I486-W488 HydrophobicContact CG2-CD2 4.19Å; I486-W488 HydrophobicContact CG2-CH2 4.08Å; I486-W488 HydrophobicContact CG2-CZ2 3.47Å; I486-W488 VanDerWaalsContact CG2-CZ2 3.47Å; I486-W488 PolarHBondContact O-NE1 3.23Å; I486-Q494 HydrophobicContact CG2-CB 4.49Å; I486-Q494 HydrophobicContact CG2-CG 3.7Å; I486-Q496 WeakPolarHBondContact CA-O 3.36Å; I486-T497 HydrophobicContact CG1-CG2 4.01Å
487	S	94.6	Very high	92.7	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.2	174.2	-176.7	0	0	0	0	110.3	L476 I495 Q496	L476-S487 CarbonylContact O-C 3.56Å; L476-S487 WeakPolarHBondContact O-CA 3.33Å; S487-I495 PolarHBondContact O-N 2.9Å; S487-Q496 PolarHBondContact N-O 3.14Å; S487-Q496 PolarHBondContact O-N 3.49Å
488	W	94.5	Very high	92.6	Very high	9 Å²	9	47.9 Å²	47.9	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.9	-176.8	-44.4	80.3	0	0	0	110.7	I443 I457 A460 A475 L476 S478 I486 Q493 Q494	I443-W488 HydrophobicContact CD1-CD2 4.3Å; I443-W488 HydrophobicContact CD1-CH2 4.47Å; I443-W488 HydrophobicContact CD1-CZ2 3.7Å; I457-W488 HydrophobicContact CG2-CH2 3.96Å; I457-W488 HydrophobicContact CG2-CZ3 3.73Å; A460-W488 HydrophobicContact CB-CH2 3.57Å; A460-W488 HydrophobicContact CB-CZ2 3.68Å; A475-W488 WeakPolarHBondContact CA-O 3.24Å; L476-W488 HydrophobicContact CB-CB 4.16Å; L476-W488 HydrophobicContact CD2-CG 4.38Å; L476-W488 PolarHBondContact N-O 3.01Å; L476-W488 VanDerWaalsContact O-CD1 3.29Å; L476-W488 PolarHBondContact O-N 3.5Å; S478-W488 PolarHBondContact OG-NE1 3.28Å; I486-W488 HydrophobicContact CB-CZ2 3.95Å; I486-W488 HydrophobicContact CD1-CZ2 4.21Å; I486-W488 HydrophobicContact CG2-CD2 4.19Å; I486-W488 HydrophobicContact CG2-CH2 4.08Å; I486-W488 HydrophobicContact CG2-CZ2 3.47Å; I486-W488 VanDerWaalsContact CG2-CZ2 3.47Å; I486-W488 PolarHBondContact O-NE1 3.23Å; W488-Q493 VanDerWaalsContact CA-O 3.3Å; W488-Q493 WeakPolarHBondContact CA-O 3.42Å; W488-Q494 HydrophobicContact CE3-CB 4.13Å; W488-Q494 HydrophobicContact CZ3-CB 3.94Å
489	D	91.1	Very high	92.5	Very high	51 Å²	51	52.8 Å²	52.8	27%	0.273	27%	0.266	S	S	.	.			trans	-76.5	178.4	174.1	75.2	6.7	0	0	0	112.3	S491 Y492 Q493 I495	D489-S491 PolarHBondContact O-N 3.46Å; D489-S491 VanDerWaalsContact O-N 3.16Å; D489-S491 WeakPolarHBondContact OD1-CA 3.42Å; D489-S491 VanDerWaalsContact OD1-CB 3.3Å; D489-S491 WeakPolarHBondContact OD1-CB 3.41Å; D489-S491 PolarHBondContact OD1-N 2.99Å; D489-Y492 WeakPolarHBondContact O-CA 3.44Å; D489-Y492 PolarHBondContact O-N 3.14Å; D489-Y492 PolarHBondContact OD1-N 3.24Å; D489-Q493 PolarHBondContact N-O 2.9Å; D489-Q493 PolarHBondContact OD1-N 3.41Å; D489-I495 HydrophobicContact CB-CD1 3.79Å; D489-I495 HydrophobicContact CB-CG1 3.92Å
490	S	86.8	Confident	92.3	Very high	104 Å²	104	53 Å²	53	73%	0.727	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.9	176.7	63.4	0	0	0	0	113.8	Y492	S490-Y492 VanDerWaalsContact C-N 3.35Å
491	S	88.2	Confident	92.3	Very high	56 Å²	56	58.6 Å²	58.6	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	5.7	173.8	-62.8	0	0	0	0	112.5	R455 D489 Q493	R455-S491 PolarHBondContact NH1-O 3.42Å; D489-S491 PolarHBondContact O-N 3.46Å; D489-S491 VanDerWaalsContact O-N 3.16Å; D489-S491 WeakPolarHBondContact OD1-CA 3.42Å; D489-S491 VanDerWaalsContact OD1-CB 3.3Å; D489-S491 WeakPolarHBondContact OD1-CB 3.41Å; D489-S491 PolarHBondContact OD1-N 2.99Å; S491-Q493 PolarHBondContact O-N 2.99Å
492	Y	89.9	Confident	92.1	Very high	20 Å²	20	58.7 Å²	58.7	8%	0.078	30%	0.299	C	S	.	.			trans	55.2	33.3	-173.5	-46.6	-84.1	0	0	0	114.1	I435 V445 I457 L476 D489 S490	I435-Y492 HydrophobicContact CD1-CE1 3.82Å; I435-Y492 HydrophobicContact CG1-CE1 4.34Å; V445-Y492 HydrophobicContact CG1-CE2 4.41Å; V445-Y492 HydrophobicContact CG2-CD1 4.4Å; V445-Y492 HydrophobicContact CG2-CD2 4.38Å; V445-Y492 HydrophobicContact CG2-CE1 3.96Å; V445-Y492 HydrophobicContact CG2-CE2 3.93Å; I457-Y492 VanDerWaalsContact CD1-CB 3.47Å; I457-Y492 HydrophobicContact CD1-CD1 4.08Å; I457-Y492 HydrophobicContact CD1-CG 3.89Å; L476-Y492 HydrophobicContact CD2-CD1 4.11Å; L476-Y492 HydrophobicContact CD2-CE1 4.25Å; D489-Y492 WeakPolarHBondContact O-CA 3.44Å; D489-Y492 PolarHBondContact O-N 3.14Å; D489-Y492 PolarHBondContact OD1-N 3.24Å; S490-Y492 VanDerWaalsContact C-N 3.35Å
493	Q	91	Very high	91.8	Very high	116 Å²	116	62 Å²	62	54%	0.542	31%	0.313	S	S	.	.			trans	-86	140.2	164.3	-61.2	-57.4	-63.5	0	0	109.3	W488 D489 S491 I495	W488-Q493 VanDerWaalsContact CA-O 3.3Å; W488-Q493 WeakPolarHBondContact CA-O 3.42Å; D489-Q493 PolarHBondContact N-O 2.9Å; D489-Q493 PolarHBondContact OD1-N 3.41Å; S491-Q493 PolarHBondContact O-N 2.99Å; Q493-I495 PolarHBondContact O-N 2.96Å
494	Q	92.7	Very high	91.7	Very high	111 Å²	111	60.2 Å²	60.2	52%	0.519	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	122.9	177.8	177.5	176.6	-18.2	0	0	109.9	I486 W488 T497	I486-Q494 HydrophobicContact CG2-CB 4.49Å; I486-Q494 HydrophobicContact CG2-CG 3.7Å; W488-Q494 HydrophobicContact CE3-CB 4.13Å; W488-Q494 HydrophobicContact CZ3-CB 3.94Å; Q494-T497 PolarHBondContact NE2-OG1 2.95Å
495	I	90.9	Very high	91.6	Very high	103 Å²	103	56.5 Å²	56.5	53%	0.528	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-53.9	175.8	-56.5	172.7	0	0	0	109.3	S487 D489 Q493	S487-I495 PolarHBondContact O-N 2.9Å; D489-I495 HydrophobicContact CB-CD1 3.79Å; D489-I495 HydrophobicContact CB-CG1 3.92Å; Q493-I495 PolarHBondContact O-N 2.96Å
496	Q	90.5	Very high	91.6	Very high	56 Å²	56	58.1 Å²	58.1	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.1	-168.9	-172.3	167.4	26.8	0	0	111.5	I486 S487 L532 D533	I486-Q496 WeakPolarHBondContact CA-O 3.36Å; S487-Q496 PolarHBondContact N-O 3.14Å; S487-Q496 PolarHBondContact O-N 3.49Å; Q496-L532 PolarHBondContact NE2-O 3.42Å; Q496-L532 PolarHBondContact OE1-O 3Å; Q496-D533 PolarHBondContact NE2-OD1 3.05Å; Q496-D533 PolarHBondContact OE1-OD1 2.52Å
497	T	92.4	Very high	91.7	Very high	56 Å²	56	58 Å²	58	34%	0.344	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131.9	174.6	-59.7	0	0	0	0	110.3	R484 L485 I486 Q494	R484-T497 HydrophobicContact CB-CG2 4.1Å; R484-T497 HydrophobicContact CG-CG2 4.21Å; L485-T497 CarbonylContact O-C 3.56Å; L485-T497 WeakPolarHBondContact O-CA 3.41Å; I486-T497 HydrophobicContact CG1-CG2 4.01Å; Q494-T497 PolarHBondContact NE2-OG1 2.95Å
498	V	92.8	Very high	91.7	Very high	23 Å²	23	58.6 Å²	58.6	14%	0.139	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.5	172.5	-173	0	0	0	0	108.4	R484 L485 L532 F536	R484-V498 CarbonylContact C-O 3.6Å; R484-V498 WeakPolarHBondContact CA-O 3.35Å; L485-V498 PolarHBondContact N-O 2.92Å; L485-V498 PolarHBondContact O-N 2.93Å; V498-L532 WeakPolarHBondContact CG2-O 3.29Å; V498-F536 HydrophobicContact CB-CE2 4.31Å; V498-F536 HydrophobicContact CG1-CD2 4.04Å; V498-F536 HydrophobicContact CG1-CE2 3.83Å
499	E	92.6	Very high	91.7	Very high	103 Å²	103	58.4 Å²	58.4	48%	0.481	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.1	173.8	-170.7	174.2	169	0	0	110.4	R483	R483-E499 IonicContact CZ-OE1 3.93Å; R483-E499 IonicContact NE-OE1 2.66Å; R483-E499 IonicContact NH2-OE1 2.95Å; R483-E499 PolarHBondContact NH2-OE1 2.99Å
500	V	92.6	Very high	92	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-78.9	134.9	172.7	177.7	0	0	0	0	109.3	R483 E502 F504 I507 I520 L528	R483-V500 HydrophobicContact CB-CB 4.4Å; R483-V500 PolarHBondContact O-N 2.88Å; V500-E502 PolarHBondContact O-N 3.37Å; V500-F504 HydrophobicContact CG1-CB 3.92Å; V500-F504 HydrophobicContact CG1-CD2 3.93Å; V500-F504 HydrophobicContact CG1-CG 4.43Å; V500-I507 HydrophobicContact CG2-CD1 3.96Å; V500-I507 HydrophobicContact CG2-CG1 4.11Å; V500-I520 HydrophobicContact CG2-CD1 3.83Å; V500-L528 HydrophobicContact CG1-CD1 3.6Å
501	L	91.1	Very high	92.3	Very high	119 Å²	119	52.2 Å²	52.2	62%	0.623	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-53.3	139.3	179.8	-66.3	175.4	0	0	0	112.1	F503 F504 G505	L501-F503 PolarHBondContact O-N 3Å; L501-F504 HydrophobicContact CB-CD2 3.87Å; L501-F504 HydrophobicContact CB-CE2 4.08Å; L501-F504 HydrophobicContact CD1-CE2 3.95Å; L501-F504 HydrophobicContact CG-CE2 4.38Å; L501-F504 PolarHBondContact O-N 3.37Å; L501-G505 PolarHBondContact O-N 2.91Å
502	E	90.1	Very high	92.5	Very high	135 Å²	135	51.8 Å²	51.8	63%	0.631	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-34	178.3	-177.6	152.4	171.5	0	0	113.8	R483 V500 F504 G505 K524	R483-E502 IonicContact CZ-OE2 2.86Å; R483-E502 IonicContact NH1-OE1 3.34Å; R483-E502 IonicContact NH1-OE2 3.8Å; R483-E502 PolarHBondContact NH1-OE2 3.47Å; R483-E502 IonicContact NH2-OE2 3.89Å; V500-E502 PolarHBondContact O-N 3.37Å; E502-F504 VanDerWaalsContact C-N 3.29Å; E502-F504 PolarHBondContact O-N 3.19Å; E502-G505 PolarHBondContact O-N 3.08Å; E502-G505 VanDerWaalsContact O-N 3.12Å; E502-K524 PolarHBondContact O-NZ 2.95Å; E502-K524 VanDerWaalsContact O-NZ 3.15Å
503	F	89	Confident	92.4	Very high	93 Å²	93	50.9 Å²	50.9	41%	0.408	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-45.3	177.8	178.8	-101.7	0	0	0	111.6	L501 G505 K524 F526 T581	L501-F503 PolarHBondContact O-N 3Å; F503-G505 VanDerWaalsContact C-N 3.35Å; F503-K524 WeakPolarHBondContact O-CD 3.2Å; F503-K524 PolarHBondContact O-NZ 2.63Å; F503-F526 HydrophobicContact CD1-CZ 4.43Å; F503-F526 HydrophobicContact CE1-CE1 4.07Å; F503-F526 HydrophobicContact CE1-CE2 4.44Å; F503-F526 AromaticContact CE1-CZ 3.64Å; F503-F526 HydrophobicContact CE1-CZ 3.64Å; F503-F526 HydrophobicContact CZ-CZ 4.1Å; F503-T581 HydrophobicContact CE2-CG2 4.31Å; F503-T581 HydrophobicContact CZ-CG2 3.81Å
504	F	90.9	Very high	92.1	Very high	17 Å²	17	53.9 Å²	53.9	8%	0.075	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-20.3	179.9	-54.8	-51.8	0	0	0	113.7	V500 L501 E502 T522 K524 F526 L528 P538	V500-F504 HydrophobicContact CG1-CB 3.92Å; V500-F504 HydrophobicContact CG1-CD2 3.93Å; V500-F504 HydrophobicContact CG1-CG 4.43Å; L501-F504 HydrophobicContact CB-CD2 3.87Å; L501-F504 HydrophobicContact CB-CE2 4.08Å; L501-F504 HydrophobicContact CD1-CE2 3.95Å; L501-F504 HydrophobicContact CG-CE2 4.38Å; L501-F504 PolarHBondContact O-N 3.37Å; E502-F504 VanDerWaalsContact C-N 3.29Å; E502-F504 PolarHBondContact O-N 3.19Å; F504-T522 HydrophobicContact CB-CG2 4.16Å; F504-T522 WeakPolarHBondContact O-CB 3.41Å; F504-T522 PolarHBondContact O-OG1 3.08Å; F504-K524 WeakPolarHBondContact O-CB 3.39Å; F504-F526 HydrophobicContact CB-CD2 4.46Å; F504-F526 HydrophobicContact CD1-CB 4.5Å; F504-F526 AromaticContact CD1-CD1 3.73Å; F504-F526 HydrophobicContact CD1-CD1 3.73Å; F504-F526 HydrophobicContact CD1-CD2 4.19Å; F504-F526 AromaticContact CD1-CE1 3.93Å; F504-F526 HydrophobicContact CD1-CE1 3.93Å; F504-F526 HydrophobicContact CD1-CE2 4.37Å; F504-F526 AromaticContact CD1-CG 3.88Å; F504-F526 HydrophobicContact CD1-CG 3.88Å; F504-F526 HydrophobicContact CD1-CZ 4.26Å; F504-F526 HydrophobicContact CE1-CD1 4.11Å; F504-F526 HydrophobicContact CE1-CE1 4.14Å; F504-L528 HydrophobicContact CB-CD1 4.03Å; F504-L528 HydrophobicContact CB-CD2 4.48Å; F504-L528 HydrophobicContact CD1-CD2 3.88Å; F504-L528 HydrophobicContact CD2-CD1 3.71Å; F504-L528 HydrophobicContact CD2-CD2 4.06Å; F504-L528 HydrophobicContact CE1-CD2 4.05Å; F504-L528 HydrophobicContact CE2-CD1 4.34Å; F504-L528 HydrophobicContact CE2-CD2 4.2Å; F504-L528 HydrophobicContact CG-CD1 3.94Å; F504-L528 HydrophobicContact CG-CD2 3.9Å; F504-L528 HydrophobicContact CZ-CD2 4.2Å; F504-P538 HydrophobicContact CE1-CB 4.16Å; F504-P538 HydrophobicContact CE1-CG 4.06Å; F504-P538 HydrophobicContact CZ-CG 4.18Å
505	G	92.4	Very high	91.8	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.021	26%	0.263	C	S	.	.			trans	79.2	-175.3	177.2	0	0	0	0	0	114.9	L501 E502 F503	L501-G505 PolarHBondContact O-N 2.91Å; E502-G505 PolarHBondContact O-N 3.08Å; E502-G505 VanDerWaalsContact O-N 3.12Å; F503-G505 VanDerWaalsContact C-N 3.35Å
506	P	95.1	Very high	91.5	Very high	34 Å²	34	54.2 Å²	54.2	22%	0.221	27%	0.274	C	S	.	.	S	Bend	trans	-56	148	-178.3	-29.1	34.2	0	0	0	115.5	T522 T523	P506-T522 CarbonylContact O-C 3.36Å; P506-T522 VanDerWaalsContact O-CA 3.23Å; P506-T522 WeakPolarHBondContact O-CA 3.37Å; P506-T522 WeakPolarHBondContact O-CB 3.4Å; P506-T523 HydrophobicContact CB-CG2 3.99Å; P506-T523 VanDerWaalsContact CD-OG1 3.3Å; P506-T523 WeakPolarHBondContact CD-OG1 3.46Å; P506-T523 PolarHBondContact O-N 3.09Å
507	I	95.8	Very high	91.5	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.5	174.6	-62.5	170.6	0	0	0	108.9	F466 G480 L485 V500 I510 I520	F466-I507 WeakPolarHBondContact CD2-O 3.38Å; G480-I507 PolarHBondContact O-N 2.83Å; L485-I507 HydrophobicContact CB-CD1 4Å; L485-I507 HydrophobicContact CD1-CD1 4.1Å; V500-I507 HydrophobicContact CG2-CD1 3.96Å; V500-I507 HydrophobicContact CG2-CG1 4.11Å; I507-I510 HydrophobicContact CG2-CD1 4.24Å; I507-I510 HydrophobicContact CG2-CG1 3.88Å; I507-I520 HydrophobicContact CB-CG2 4.3Å; I507-I520 HydrophobicContact CD1-CD1 4.38Å; I507-I520 HydrophobicContact CG1-CG2 3.87Å; I507-I520 HydrophobicContact CG2-CG2 3.95Å
508	R	95.3	Very high	91.6	Very high	19 Å²	19	50.4 Å²	50.4	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-41.4	178.2	-175.5	64.4	161.1	-116.5	-8	112.8	G233 R234 D235 C236 G521 T523	G233-R508 WeakPolarHBondContact O-CG 3.27Å; R234-R508 PolarHBondContact O-NH1 2.71Å; R234-R508 PolarHBondContact O-NH2 3.25Å; D235-R508 PolarHBondContact O-NH2 3.48Å; C236-R508 PolarHBondContact O-NE 3.49Å; C236-R508 PolarHBondContact O-NH2 2.96Å; R508-G521 WeakPolarHBondContact CA-O 3.38Å; R508-G521 WeakPolarHBondContact CB-O 3.23Å; R508-G521 PolarHBondContact N-O 2.53Å; R508-T523 HydrophobicContact CB-CG2 4.09Å
509	T	95.4	Very high	91.7	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.5	-179.2	57.6	0	0	0	0	109.8	Y231 N239 I520 G521	Y231-T509 PolarHBondContact OH-OG1 3.01Å; N239-T509 WeakPolarHBondContact OD1-CG2 3.39Å; T509-I520 WeakPolarHBondContact O-CA 2.94Å; T509-G521 PolarHBondContact N-O 2.86Å; T509-G521 PolarHBondContact O-N 3.04Å; T509-G521 VanDerWaalsContact OG1-CA 3.26Å; T509-G521 WeakPolarHBondContact OG1-CA 3.25Å; T509-G521 PolarHBondContact OG1-N 2.99Å
510	I	95.6	Very high	91.8	Very high	18 Å²	18	44.5 Å²	44.5	9%	0.092	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.9	174.4	-61.4	163.6	0	0	0	106.2	A467 C469 V477 L485 I507 V518 L519	A467-I510 HydrophobicContact CB-CB 4.17Å; A467-I510 HydrophobicContact CB-CD1 3.72Å; A467-I510 HydrophobicContact CB-CG1 3.74Å; C469-I510 HydrophobicContact CB-CB 4.04Å; C469-I510 HydrophobicContact CB-CG2 3.7Å; V477-I510 HydrophobicContact CG1-CD1 4.28Å; V477-I510 HydrophobicContact CG1-CG2 4.39Å; L485-I510 HydrophobicContact CD1-CD1 3.5Å; L485-I510 HydrophobicContact CD1-CG1 3.91Å; I507-I510 HydrophobicContact CG2-CD1 4.24Å; I507-I510 HydrophobicContact CG2-CG1 3.88Å; I510-V518 HydrophobicContact CG2-CG1 3.73Å; I510-L519 WeakPolarHBondContact CA-O 3.29Å
511	A	94.4	Very high	92	Very high	7 Å²	7	44.4 Å²	44.4	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.7	172.9	0	0	0	0	0	110.1	L240 L519	L240-A511 HydrophobicContact CD2-CB 4.48Å; L240-A511 HydrophobicContact CG-CB 4.17Å; L240-A511 WeakPolarHBondContact O-CB 3.25Å; A511-L519 HydrophobicContact CB-CB 4.24Å; A511-L519 PolarHBondContact N-O 3.39Å; A511-L519 PolarHBondContact O-N 2.93Å
512	E	92	Very high	92.2	Very high	47 Å²	47	38.7 Å²	38.7	22%	0.22	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133	173.8	-176.2	178.2	172.4	0	0	110.5	L242 L471 R472	L242-E512 WeakPolarHBondContact CB-O 3.47Å; L471-E512 HydrophobicContact CD2-CB 3.96Å; L471-E512 HydrophobicContact CD2-CG 3.89Å; R472-E512 WeakPolarHBondContact CB-OE1 3.04Å; R472-E512 WeakPolarHBondContact CG-OE1 3.43Å; R472-E512 WeakPolarHBondContact CG-OE2 3.39Å; R472-E512 IonicContact CZ-OE1 3.83Å; R472-E512 VanDerWaalsContact CZ-OE1 3.24Å; R472-E512 PolarHBondContact N-OE2 2.8Å; R472-E512 IonicContact NE-OE1 3.69Å; R472-E512 PolarHBondContact NE-OE1 3.17Å; R472-E512 IonicContact NE-OE2 3.62Å; R472-E512 IonicContact NH2-OE1 3.33Å; R472-E512 PolarHBondContact NH2-OE1 2.85Å
513	G	88.1	Confident	92.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.01	17%	0.174	C	C	.	.			trans	-93.6	-165.3	177.2	0	0	0	0	0	114	L242 R472 T517	L242-G513 VanDerWaalsContact CD2-CA 3.45Å; R472-G513 PolarHBondContact NH2-O 3Å; G513-T517 WeakPolarHBondContact CA-O 3.3Å; G513-T517 WeakPolarHBondContact CA-OG1 3.19Å; G513-T517 PolarHBondContact N-O 3.42Å
514	R	84.9	Confident	92.5	Very high	179 Å²	179	33.1 Å²	33.1	68%	0.675	17%	0.171	S	C	*	.	S	Bend	trans	-81.9	127.2	172.9	-172	178.1	-179.2	-176	1.7	109.4	L242 D262 E516 T517	L242-R514 HydrophobicContact CD2-CB 4.18Å; L242-R514 VanDerWaalsContact CD2-N 3.26Å; D262-R514 IonicContact OD2-NH1 2.67Å; R514-E516 PolarHBondContact O-N 2.81Å; R514-T517 PolarHBondContact N-OG1 3.04Å; R514-T517 PolarHBondContact O-N 2.89Å; R514-T517 PolarHBondContact O-OG1 3.49Å
515	G	85.1	Confident	92.6	Very high	60 Å²	60	32.3 Å²	32.3	62%	0.619	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	-125.3	-176.7	0	0	0	0	0	111.4	T517	G515-T517 VanDerWaalsContact C-N 3.34Å
516	E	84.8	Confident	92.7	Very high	160 Å²	160	32.9 Å²	32.9	75%	0.748	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	5.2	-179.5	-62.6	179.7	165.7	0	0	113.5	R514	R514-E516 PolarHBondContact O-N 2.81Å
517	T	90.9	Very high	92.7	Very high	32 Å²	32	31.3 Å²	31.3	20%	0.196	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	150.1	-179.8	60.6	0	0	0	0	111.7	G513 R514 G515 G530 T531	G513-T517 WeakPolarHBondContact CA-O 3.3Å; G513-T517 WeakPolarHBondContact CA-OG1 3.19Å; G513-T517 PolarHBondContact N-O 3.42Å; R514-T517 PolarHBondContact N-OG1 3.04Å; R514-T517 PolarHBondContact O-N 2.89Å; R514-T517 PolarHBondContact O-OG1 3.49Å; G515-T517 VanDerWaalsContact C-N 3.34Å; T517-G530 CarbonylContact C-O 3.59Å; T517-G530 VanDerWaalsContact CA-O 3.27Å; T517-G530 WeakPolarHBondContact CA-O 3.41Å; T517-T531 HydrophobicContact CG2-CG2 4.08Å
518	V	93.8	Very high	92.7	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.9	176.2	178.8	0	0	0	0	108.2	L485 I510 I520 G530 L532 F536	L485-V518 HydrophobicContact CD2-CG1 4.37Å; I510-V518 HydrophobicContact CG2-CG1 3.73Å; V518-I520 HydrophobicContact CG1-CG1 4.47Å; V518-G530 PolarHBondContact N-O 2.94Å; V518-G530 PolarHBondContact O-N 3.2Å; V518-G530 VanDerWaalsContact O-N 3.12Å; V518-L532 HydrophobicContact CG2-CG 4.47Å; V518-F536 HydrophobicContact CB-CE1 4.49Å
519	L	95.4	Very high	92.6	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.6	173.4	-59.3	175	0	0	0	109.7	L240 L242 T248 I510 A511 L528 Q529 I539	L240-L519 HydrophobicContact CD2-CB 3.96Å; L242-L519 HydrophobicContact CB-CD1 4.04Å; L242-L519 HydrophobicContact CD1-CD1 4.36Å; T248-L519 HydrophobicContact CG2-CD1 3.82Å; I510-L519 WeakPolarHBondContact CA-O 3.29Å; A511-L519 HydrophobicContact CB-CB 4.24Å; A511-L519 PolarHBondContact N-O 3.39Å; A511-L519 PolarHBondContact O-N 2.93Å; L519-L528 CarbonylContact C-O 3.56Å; L519-L528 VanDerWaalsContact CA-O 3.32Å; L519-L528 WeakPolarHBondContact CA-O 3.33Å; L519-Q529 HydrophobicContact CD2-CB 3.7Å; L519-Q529 HydrophobicContact CD2-CG 3.78Å; L519-I539 HydrophobicContact CD2-CD1 4.23Å
520	I	95.8	Very high	92.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.5	179.4	-60.2	179.8	0	0	0	108.8	L485 V500 I507 T509 V518 T522 V527 L528 F536	L485-I520 HydrophobicContact CD1-CD1 4.34Å; L485-I520 HydrophobicContact CD2-CD1 4.11Å; V500-I520 HydrophobicContact CG2-CD1 3.83Å; I507-I520 HydrophobicContact CB-CG2 4.3Å; I507-I520 HydrophobicContact CD1-CD1 4.38Å; I507-I520 HydrophobicContact CG1-CG2 3.87Å; I507-I520 HydrophobicContact CG2-CG2 3.95Å; T509-I520 WeakPolarHBondContact O-CA 2.94Å; V518-I520 HydrophobicContact CG1-CG1 4.47Å; I520-T522 HydrophobicContact CG2-CG2 4.16Å; I520-V527 CarbonylContact O-C 3.59Å; I520-V527 WeakPolarHBondContact O-CA 3.35Å; I520-L528 HydrophobicContact CB-CB 4.27Å; I520-L528 PolarHBondContact N-O 2.74Å; I520-L528 PolarHBondContact O-N 2.89Å; I520-F536 HydrophobicContact CD1-CD1 3.64Å; I520-F536 HydrophobicContact CD1-CD2 4.28Å; I520-F536 HydrophobicContact CD1-CE1 3.36Å; I520-F536 HydrophobicContact CD1-CE2 4.03Å; I520-F536 HydrophobicContact CD1-CG 4.11Å; I520-F536 HydrophobicContact CD1-CZ 3.58Å; I520-F536 HydrophobicContact CG1-CD1 4.14Å; I520-F536 HydrophobicContact CG1-CE1 3.75Å; I520-F536 HydrophobicContact CG1-CZ 4.31Å
521	G	96.1	Very high	92.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.5	163.8	0	0	0	0	0	110.2	R508 T509 F526	R508-G521 WeakPolarHBondContact CA-O 3.38Å; R508-G521 WeakPolarHBondContact CB-O 3.23Å; R508-G521 PolarHBondContact N-O 2.53Å; T509-G521 PolarHBondContact N-O 2.86Å; T509-G521 PolarHBondContact O-N 3.04Å; T509-G521 VanDerWaalsContact OG1-CA 3.26Å; T509-G521 WeakPolarHBondContact OG1-CA 3.25Å; T509-G521 PolarHBondContact OG1-N 2.99Å; G521-F526 WeakPolarHBondContact CA-O 3.45Å
522	T	95.7	Very high	91.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	164	-178.4	81.2	0	0	0	0	112.7	G233 F504 P506 I520 K524 N525 F526 L528	G233-T522 WeakPolarHBondContact CA-O 3.12Å; F504-T522 HydrophobicContact CB-CG2 4.16Å; F504-T522 WeakPolarHBondContact O-CB 3.41Å; F504-T522 PolarHBondContact O-OG1 3.08Å; P506-T522 CarbonylContact O-C 3.36Å; P506-T522 VanDerWaalsContact O-CA 3.23Å; P506-T522 WeakPolarHBondContact O-CA 3.37Å; P506-T522 WeakPolarHBondContact O-CB 3.4Å; I520-T522 HydrophobicContact CG2-CG2 4.16Å; T522-K524 PolarHBondContact O-N 2.87Å; T522-K524 PolarHBondContact OG1-N 3.03Å; T522-N525 PolarHBondContact O-N 3.31Å; T522-F526 HydrophobicContact CG2-CB 4.15Å; T522-F526 PolarHBondContact N-O 2.78Å; T522-F526 WeakPolarHBondContact OG1-CB 3.3Å; T522-F526 PolarHBondContact OG1-N 3.15Å; T522-L528 HydrophobicContact CG2-CD1 4Å; T522-L528 HydrophobicContact CG2-CG 4.21Å
523	T	93.3	Very high	91.3	Very high	31 Å²	31	38.7 Å²	38.7	19%	0.19	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-11.2	175.3	62.7	0	0	0	0	113.6	R234 P506 R508 N525	R234-T523 WeakPolarHBondContact CA-O 3.44Å; P506-T523 HydrophobicContact CB-CG2 3.99Å; P506-T523 VanDerWaalsContact CD-OG1 3.3Å; P506-T523 WeakPolarHBondContact CD-OG1 3.46Å; P506-T523 PolarHBondContact O-N 3.09Å; R508-T523 HydrophobicContact CB-CG2 4.09Å; T523-N525 VanDerWaalsContact C-N 3.34Å
524	K	91.9	Very high	90.8	Very high	79 Å²	79	40 Å²	40	34%	0.343	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	26.5	173.5	-63.9	-177.3	177.7	172.4	0	112.2	E502 F503 F504 T522 F526 T544	E502-K524 PolarHBondContact O-NZ 2.95Å; E502-K524 VanDerWaalsContact O-NZ 3.15Å; F503-K524 WeakPolarHBondContact O-CD 3.2Å; F503-K524 PolarHBondContact O-NZ 2.63Å; F504-K524 WeakPolarHBondContact O-CB 3.39Å; T522-K524 PolarHBondContact O-N 2.87Å; T522-K524 PolarHBondContact OG1-N 3.03Å; K524-F526 HydrophobicContact CB-CD2 3.89Å; K524-F526 HydrophobicContact CB-CE2 4.01Å; K524-F526 WeakPolarHBondContact O-CD2 3.09Å; K524-F526 WeakPolarHBondContact O-CE2 2.98Å; K524-F526 PolarHBondContact O-N 3.4Å; K524-T544 VanDerWaalsContact C-CG2 3.42Å; K524-T544 HydrophobicContact CB-CG2 3.99Å; K524-T544 VanDerWaalsContact O-CG2 3.26Å; K524-T544 WeakPolarHBondContact O-CG2 3.07Å
525	N	93.8	Very high	90.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.222	C	C	.	.	S	Bend	trans	62.7	27.4	172.8	-65.4	-4.4	0	0	0	114.3	Y231 G233 R234 T522 T523 H543 T544	Y231-N525 VanDerWaalsContact O-CA 3.29Å; Y231-N525 WeakPolarHBondContact O-CA 3.38Å; Y231-N525 WeakPolarHBondContact O-CB 3.13Å; Y231-N525 PolarHBondContact O-ND2 3.34Å; Y231-N525 PolarHBondContact O-OD1 2.92Å; G233-N525 PolarHBondContact N-OD1 2.83Å; R234-N525 PolarHBondContact N-OD1 3.22Å; T522-N525 PolarHBondContact O-N 3.31Å; T523-N525 VanDerWaalsContact C-N 3.34Å; N525-H543 PolarHBondContact ND2-O 2.85Å; N525-T544 HydrophobicContact CB-CG2 4.11Å
526	F	93.8	Very high	91.2	Very high	14 Å²	14	37.8 Å²	37.8	6%	0.061	20%	0.197	C	C	.	.			trans	-94.2	144.4	168.2	-68.4	-93.4	0	0	0	110.7	F503 F504 G521 T522 K524 L528 P538 T540 Q541	F503-F526 HydrophobicContact CD1-CZ 4.43Å; F503-F526 HydrophobicContact CE1-CE1 4.07Å; F503-F526 HydrophobicContact CE1-CE2 4.44Å; F503-F526 AromaticContact CE1-CZ 3.64Å; F503-F526 HydrophobicContact CE1-CZ 3.64Å; F503-F526 HydrophobicContact CZ-CZ 4.1Å; F504-F526 HydrophobicContact CB-CD2 4.46Å; F504-F526 HydrophobicContact CD1-CB 4.5Å; F504-F526 AromaticContact CD1-CD1 3.73Å; F504-F526 HydrophobicContact CD1-CD1 3.73Å; F504-F526 HydrophobicContact CD1-CD2 4.19Å; F504-F526 AromaticContact CD1-CE1 3.93Å; F504-F526 HydrophobicContact CD1-CE1 3.93Å; F504-F526 HydrophobicContact CD1-CE2 4.37Å; F504-F526 AromaticContact CD1-CG 3.88Å; F504-F526 HydrophobicContact CD1-CG 3.88Å; F504-F526 HydrophobicContact CD1-CZ 4.26Å; F504-F526 HydrophobicContact CE1-CD1 4.11Å; F504-F526 HydrophobicContact CE1-CE1 4.14Å; G521-F526 WeakPolarHBondContact CA-O 3.45Å; T522-F526 HydrophobicContact CG2-CB 4.15Å; T522-F526 PolarHBondContact N-O 2.78Å; T522-F526 WeakPolarHBondContact OG1-CB 3.3Å; T522-F526 PolarHBondContact OG1-N 3.15Å; K524-F526 HydrophobicContact CB-CD2 3.89Å; K524-F526 HydrophobicContact CB-CE2 4.01Å; K524-F526 WeakPolarHBondContact O-CD2 3.09Å; K524-F526 WeakPolarHBondContact O-CE2 2.98Å; K524-F526 PolarHBondContact O-N 3.4Å; F526-L528 HydrophobicContact CB-CD2 3.93Å; F526-L528 HydrophobicContact CB-CG 4.47Å; F526-P538 HydrophobicContact CD1-CB 4.09Å; F526-T540 WeakPolarHBondContact CA-O 3.42Å; F526-Q541 HydrophobicContact CD1-CB 3.47Å; F526-Q541 VanDerWaalsContact CD1-CB 3.47Å; F526-Q541 HydrophobicContact CE1-CB 3.4Å; F526-Q541 HydrophobicContact CE1-CG 4.31Å; F526-Q541 HydrophobicContact CG-CB 4.34Å; F526-Q541 HydrophobicContact CZ-CB 4.2Å
527	V	95.3	Very high	91.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.6	160	-173.8	0	0	0	0	107.2	Y231 L240 I520 P538 I539 T540	Y231-V527 HydrophobicContact CD1-CG2 3.77Å; Y231-V527 HydrophobicContact CD2-CG2 3.88Å; Y231-V527 HydrophobicContact CE1-CG2 4.42Å; Y231-V527 HydrophobicContact CG-CG2 3.45Å; Y231-V527 VanDerWaalsContact CG-CG2 3.45Å; L240-V527 HydrophobicContact CD1-CG1 3.9Å; L240-V527 HydrophobicContact CD1-CG2 4.39Å; L240-V527 HydrophobicContact CD2-CG1 4.02Å; I520-V527 CarbonylContact O-C 3.59Å; I520-V527 WeakPolarHBondContact O-CA 3.35Å; V527-P538 WeakPolarHBondContact O-CA 3.49Å; V527-I539 HydrophobicContact CB-CD1 4.39Å; V527-I539 HydrophobicContact CB-CG1 3.93Å; V527-I539 HydrophobicContact CG1-CD1 3.73Å; V527-I539 HydrophobicContact CG1-CG1 3.76Å; V527-I539 WeakPolarHBondContact O-CG1 3.18Å; V527-I539 PolarHBondContact O-N 2.94Å; V527-T540 PolarHBondContact N-O 2.77Å; V527-T540 PolarHBondContact O-N 2.97Å
528	L	94.8	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.3	179.7	-45.5	177.3	0	0	0	109.7	V500 F504 L519 I520 T522 F526 F536 I537 P538	V500-L528 HydrophobicContact CG1-CD1 3.6Å; F504-L528 HydrophobicContact CB-CD1 4.03Å; F504-L528 HydrophobicContact CB-CD2 4.48Å; F504-L528 HydrophobicContact CD1-CD2 3.88Å; F504-L528 HydrophobicContact CD2-CD1 3.71Å; F504-L528 HydrophobicContact CD2-CD2 4.06Å; F504-L528 HydrophobicContact CE1-CD2 4.05Å; F504-L528 HydrophobicContact CE2-CD1 4.34Å; F504-L528 HydrophobicContact CE2-CD2 4.2Å; F504-L528 HydrophobicContact CG-CD1 3.94Å; F504-L528 HydrophobicContact CG-CD2 3.9Å; F504-L528 HydrophobicContact CZ-CD2 4.2Å; L519-L528 CarbonylContact C-O 3.56Å; L519-L528 VanDerWaalsContact CA-O 3.32Å; L519-L528 WeakPolarHBondContact CA-O 3.33Å; I520-L528 HydrophobicContact CB-CB 4.27Å; I520-L528 PolarHBondContact N-O 2.74Å; I520-L528 PolarHBondContact O-N 2.89Å; T522-L528 HydrophobicContact CG2-CD1 4Å; T522-L528 HydrophobicContact CG2-CG 4.21Å; F526-L528 HydrophobicContact CB-CD2 3.93Å; F526-L528 HydrophobicContact CB-CG 4.47Å; L528-F536 HydrophobicContact CB-CB 4.1Å; L528-F536 HydrophobicContact CB-CD1 4.13Å; L528-F536 HydrophobicContact CD1-CB 4.14Å; L528-I537 CarbonylContact C-O 3.58Å; L528-I537 VanDerWaalsContact CA-O 3.26Å; L528-I537 WeakPolarHBondContact CA-O 3.48Å; L528-P538 HydrophobicContact CD2-CB 3.8Å
529	Q	94.4	Very high	91.4	Very high	48 Å²	48	37.7 Å²	37.7	22%	0.224	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.8	171.1	-179	175.9	-33.9	0	0	108.7	L519 I537 I539	L519-Q529 HydrophobicContact CD2-CB 3.7Å; L519-Q529 HydrophobicContact CD2-CG 3.78Å; Q529-I537 PolarHBondContact N-O 3.42Å; Q529-I537 VanDerWaalsContact O-CG1 3.28Å; Q529-I537 WeakPolarHBondContact O-CG1 3.43Å; Q529-I537 PolarHBondContact O-N 3.18Å; Q529-I539 HydrophobicContact CB-CG2 3.64Å
530	G	92.3	Very high	91.1	Very high	9 Å²	9	38.2 Å²	38.2	9%	0.093	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	-173.1	178.5	0	0	0	0	0	111.4	T517 V518	T517-G530 CarbonylContact C-O 3.59Å; T517-G530 VanDerWaalsContact CA-O 3.27Å; T517-G530 WeakPolarHBondContact CA-O 3.41Å; V518-G530 PolarHBondContact N-O 2.94Å; V518-G530 PolarHBondContact O-N 3.2Å; V518-G530 VanDerWaalsContact O-N 3.12Å
531	T	90.6	Very high	90.8	Very high	46 Å²	46	39.9 Å²	39.9	28%	0.282	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	164.1	171.2	58	0	0	0	0	109	T517 D533 G534	T517-T531 HydrophobicContact CG2-CG2 4.08Å; T531-D533 PolarHBondContact O-N 3.08Å; T531-G534 PolarHBondContact O-N 3.39Å; T531-G534 WeakPolarHBondContact OG1-CA 3.23Å; T531-G534 PolarHBondContact OG1-N 3.26Å
532	L	85.6	Confident	90.4	Very high	23 Å²	23	40.5 Å²	40.5	12%	0.12	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.5	176.2	-65.3	171.3	0	0	0	112.5	V477 L485 Q496 V498 V518	V477-L532 HydrophobicContact CG1-CD2 4.49Å; V477-L532 HydrophobicContact CG2-CD1 4.45Å; L485-L532 HydrophobicContact CD2-CD2 3.54Å; L485-L532 HydrophobicContact CG-CD2 4.27Å; Q496-L532 PolarHBondContact NE2-O 3.42Å; Q496-L532 PolarHBondContact OE1-O 3Å; V498-L532 WeakPolarHBondContact CG2-O 3.29Å; V518-L532 HydrophobicContact CG2-CG 4.47Å
533	D	82.2	Confident	90.2	Very high	127 Å²	127	40.6 Å²	40.6	68%	0.679	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-10	177	-63.9	-54.2	0	0	0	114.2	Q496 T531	Q496-D533 PolarHBondContact NE2-OD1 3.05Å; Q496-D533 PolarHBondContact OE1-OD1 2.52Å; T531-D533 PolarHBondContact O-N 3.08Å
534	G	77.3	Confident	90.2	Very high	28 Å²	28	40.3 Å²	40.3	29%	0.289	22%	0.219	S	C	.	.	S	Bend	trans	-116.3	-173.8	-167.9	0	0	0	0	0	113.7	T531	T531-G534 PolarHBondContact O-N 3.39Å; T531-G534 WeakPolarHBondContact OG1-CA 3.23Å; T531-G534 PolarHBondContact OG1-N 3.26Å
535	E	85.6	Confident	90.3	Very high	172 Å²	172	39.2 Å²	39.2	80%	0.804	22%	0.216	S	C	*	.			trans	-86.8	148.4	173.5	-64.9	-172.1	165.3	0	0	111.1
536	F	92.4	Very high	90.3	Very high	21 Å²	21	40.6 Å²	40.6	9%	0.092	22%	0.223	C	C	.	.			trans	-92.2	121.1	173.7	-78.7	-83.4	0	0	0	110.2	L485 V498 V518 I520 L528	L485-F536 HydrophobicContact CD2-CE2 4.1Å; L485-F536 HydrophobicContact CD2-CZ 3.63Å; V498-F536 HydrophobicContact CB-CE2 4.31Å; V498-F536 HydrophobicContact CG1-CD2 4.04Å; V498-F536 HydrophobicContact CG1-CE2 3.83Å; V518-F536 HydrophobicContact CB-CE1 4.49Å; I520-F536 HydrophobicContact CD1-CD1 3.64Å; I520-F536 HydrophobicContact CD1-CD2 4.28Å; I520-F536 HydrophobicContact CD1-CE1 3.36Å; I520-F536 HydrophobicContact CD1-CE2 4.03Å; I520-F536 HydrophobicContact CD1-CG 4.11Å; I520-F536 HydrophobicContact CD1-CZ 3.58Å; I520-F536 HydrophobicContact CG1-CD1 4.14Å; I520-F536 HydrophobicContact CG1-CE1 3.75Å; I520-F536 HydrophobicContact CG1-CZ 4.31Å; L528-F536 HydrophobicContact CB-CB 4.1Å; L528-F536 HydrophobicContact CB-CD1 4.13Å; L528-F536 HydrophobicContact CD1-CB 4.14Å
537	I	91.6	Very high	90.3	Very high	103 Å²	103	39.9 Å²	39.9	53%	0.528	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.9	177.8	55.1	168.7	0	0	0	110.9	L528 Q529 I539	L528-I537 CarbonylContact C-O 3.58Å; L528-I537 VanDerWaalsContact CA-O 3.26Å; L528-I537 WeakPolarHBondContact CA-O 3.48Å; Q529-I537 PolarHBondContact N-O 3.42Å; Q529-I537 VanDerWaalsContact O-CG1 3.28Å; Q529-I537 WeakPolarHBondContact O-CG1 3.43Å; Q529-I537 PolarHBondContact O-N 3.18Å; I537-I539 PolarHBondContact O-N 3.38Å
538	P	91.4	Very high	90.3	Very high	60 Å²	60	42.7 Å²	42.7	39%	0.39	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	125.2	176.9	30.2	-33.2	0	0	0	110.7	F504 F526 V527 L528	F504-P538 HydrophobicContact CE1-CB 4.16Å; F504-P538 HydrophobicContact CE1-CG 4.06Å; F504-P538 HydrophobicContact CZ-CG 4.18Å; F526-P538 HydrophobicContact CD1-CB 4.09Å; V527-P538 WeakPolarHBondContact O-CA 3.49Å; L528-P538 HydrophobicContact CD2-CB 3.8Å
539	I	90.4	Very high	90.3	Very high	28 Å²	28	42.7 Å²	42.7	14%	0.144	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-23.4	173.1	64.9	166.2	0	0	0	111.7	T248 F259 V261 L519 V527 Q529 I537	T248-I539 HydrophobicContact CG2-CD1 4.35Å; F259-I539 HydrophobicContact CD1-CD1 4.27Å; F259-I539 HydrophobicContact CE1-CB 4.1Å; F259-I539 HydrophobicContact CE1-CD1 4.31Å; F259-I539 HydrophobicContact CE1-CG1 4.42Å; F259-I539 WeakPolarHBondContact CE1-O 3.48Å; V261-I539 HydrophobicContact CG1-CG2 4.16Å; V261-I539 HydrophobicContact CG2-CD1 3.78Å; L519-I539 HydrophobicContact CD2-CD1 4.23Å; V527-I539 HydrophobicContact CB-CD1 4.39Å; V527-I539 HydrophobicContact CB-CG1 3.93Å; V527-I539 HydrophobicContact CG1-CD1 3.73Å; V527-I539 HydrophobicContact CG1-CG1 3.76Å; V527-I539 WeakPolarHBondContact O-CG1 3.18Å; V527-I539 PolarHBondContact O-N 2.94Å; Q529-I539 HydrophobicContact CB-CG2 3.64Å; I537-I539 PolarHBondContact O-N 3.38Å
540	T	89.3	Confident	90.4	Very high	13 Å²	13	40.9 Å²	40.9	8%	0.08	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	144.5	176	-57.1	0	0	0	0	109.2	Y250 F526 V527	Y250-T540 HydrophobicContact CE2-CG2 4.34Å; Y250-T540 WeakPolarHBondContact OH-CG2 3.39Å; Y250-T540 PolarHBondContact OH-OG1 2.96Å; F526-T540 WeakPolarHBondContact CA-O 3.42Å; V527-T540 PolarHBondContact N-O 2.77Å; V527-T540 PolarHBondContact O-N 2.97Å
541	Q	89.4	Confident	90.6	Very high	35 Å²	35	40.8 Å²	40.8	16%	0.164	22%	0.221	C	C	.	.			trans	-148.1	160.4	175.5	68.7	-170.9	-57.9	0	0	110.6	G230 F526 W571 L578	G230-Q541 WeakPolarHBondContact CA-O 3.35Å; G230-Q541 PolarHBondContact N-O 3.4Å; G230-Q541 VanDerWaalsContact N-O 3.15Å; F526-Q541 HydrophobicContact CD1-CB 3.47Å; F526-Q541 VanDerWaalsContact CD1-CB 3.47Å; F526-Q541 HydrophobicContact CE1-CB 3.4Å; F526-Q541 HydrophobicContact CE1-CG 4.31Å; F526-Q541 HydrophobicContact CG-CB 4.34Å; F526-Q541 HydrophobicContact CZ-CB 4.2Å; Q541-W571 HydrophobicContact CG-CH2 3.71Å; Q541-W571 HydrophobicContact CG-CZ3 3.78Å; Q541-L578 VanDerWaalsContact OE1-CD2 3.24Å
542	G	87.6	Confident	90.9	Very high	13 Å²	13	39.8 Å²	39.8	13%	0.134	22%	0.215	C	C	.	.			trans	-163.5	179.9	175.6	0	0	0	0	0	111.9
543	H	92.3	Very high	91.4	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.209	C	C	.	.			trans	-70.2	157.9	176.5	-74.8	-82.8	0	0	0	111.2	N525 T561 D565	N525-H543 PolarHBondContact ND2-O 2.85Å; H543-T561 PolarHBondContact NE2-OG1 3.11Å; H543-D565 WeakPolarHBondContact CA-OD2 3.32Å; H543-D565 VanDerWaalsContact CB-OD2 3.31Å; H543-D565 WeakPolarHBondContact CB-OD2 3.19Å; H543-D565 IonicContact CE1-OD1 2.92Å; H543-D565 IonicContact CG-OD2 3.15Å; H543-D565 IonicContact ND1-OD1 2.87Å; H543-D565 PolarHBondContact ND1-OD1 3.26Å; H543-D565 VanDerWaalsContact ND1-OD1 3.16Å; H543-D565 IonicContact ND1-OD2 2.77Å; H543-D565 PolarHBondContact ND1-OD2 2.89Å
544	T	92.4	Very high	91.9	Very high	25 Å²	25	34.7 Å²	34.7	15%	0.153	19%	0.189	C	C	.	.	S	Bend	trans	-115.4	2	-175.6	63.5	0	0	0	0	114.2	R234 K524 N525 D565 M808	R234-T544 WeakPolarHBondContact CD-O 3.27Å; R234-T544 PolarHBondContact NH1-O 2.87Å; K524-T544 VanDerWaalsContact C-CG2 3.42Å; K524-T544 HydrophobicContact CB-CG2 3.99Å; K524-T544 VanDerWaalsContact O-CG2 3.26Å; K524-T544 WeakPolarHBondContact O-CG2 3.07Å; N525-T544 HydrophobicContact CB-CG2 4.11Å; T544-D565 PolarHBondContact N-OD2 2.85Å; T544-D565 WeakPolarHBondContact OG1-CB 3.28Å; T544-M808 VanDerWaalsContact C-SD 3.6Å
545	D	93.8	Very high	92.6	Very high	55 Å²	55	40.9 Å²	40.9	29%	0.294	20%	0.204	S	C	.	.	S	Bend	trans	-151.9	-178.4	180	-141.2	-37.8	0	0	0	109.7	L547 D565	D545-L547 PolarHBondContact O-N 2.98Å; D545-D565 HydrophobicContact CB-CB 3.95Å
546	E	94.1	Very high	93	Very high	30 Å²	30	36.1 Å²	36.1	14%	0.14	18%	0.181	C	C	.	.			trans	-56.1	130.6	-174.7	-166.1	173	162.3	0	0	113	W548 G563 Y564 G805 K806	E546-W548 PolarHBondContact OE1-NE1 2.78Å; E546-G563 WeakPolarHBondContact O-CA 3.46Å; E546-Y564 HydrophobicContact CB-CD2 3.67Å; E546-Y564 HydrophobicContact CB-CE2 3.94Å; E546-Y564 HydrophobicContact CB-CG 4.22Å; E546-Y564 HydrophobicContact CG-CD2 4.43Å; E546-Y564 HydrophobicContact CG-CE2 4.2Å; E546-Y564 PolarHBondContact O-N 3.34Å; E546-G805 WeakPolarHBondContact CA-O 3.42Å; E546-K806 HydrophobicContact CB-CG 4.31Å; E546-K806 HydrophobicContact CG-CG 3.86Å; E546-K806 WeakPolarHBondContact OE2-CE 3.34Å
547	L	93.9	Very high	93.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.8	-173.2	-175.6	67.5	0	0	0	112.3	D545 C562 T789 T803 G805 V810	D545-L547 PolarHBondContact O-N 2.98Å; L547-C562 VanDerWaalsContact CD1-C 3.45Å; L547-C562 VanDerWaalsContact CD1-O 3.23Å; L547-C562 WeakPolarHBondContact CD1-O 3.38Å; L547-T789 WeakPolarHBondContact O-CB 3.42Å; L547-T789 PolarHBondContact O-OG1 2.91Å; L547-T803 HydrophobicContact CD2-CG2 3.51Å; L547-T803 HydrophobicContact CG-CG2 3.93Å; L547-G805 PolarHBondContact N-O 3.42Å; L547-G805 VanDerWaalsContact N-O 3.08Å; L547-G805 VanDerWaalsContact O-CA 3.3Å; L547-G805 WeakPolarHBondContact O-CA 3.47Å; L547-G805 PolarHBondContact O-N 3.32Å; L547-V810 HydrophobicContact CD2-CG2 3.43Å; L547-V810 VanDerWaalsContact CD2-CG2 3.43Å
548	W	95.5	Very high	93.2	Very high	58 Å²	58	33.6 Å²	33.6	22%	0.22	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	-35.6	179.9	-77.3	88.3	0	0	0	113.4	E546 L550 Y564 Q589 T789 N790	E546-W548 PolarHBondContact OE1-NE1 2.78Å; W548-L550 PolarHBondContact O-N 2.83Å; W548-Y564 AromaticContact CD1-CE1 3.99Å; W548-Y564 AromaticContact CD1-CZ 3.77Å; W548-Y564 AromaticContact NE1-CZ 4Å; W548-Q589 CarbonylContact C-O 3.55Å; W548-Q589 VanDerWaalsContact CB-O 3.23Å; W548-Q589 WeakPolarHBondContact CB-O 3.48Å; W548-T789 HydrophobicContact CD2-CG2 3.71Å; W548-T789 HydrophobicContact CE3-CG2 3.9Å; W548-T789 HydrophobicContact CG-CG2 4.32Å; W548-T789 HydrophobicContact CH2-CG2 3.89Å; W548-T789 HydrophobicContact CZ2-CG2 3.7Å; W548-T789 HydrophobicContact CZ3-CG2 3.99Å; W548-N790 PolarHBondContact O-ND2 3.35Å
549	G	94.6	Very high	93.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.3	-175.5	0	0	0	0	0	111.3	T561 C562 Q589	G549-T561 VanDerWaalsContact O-CA 3.25Å; G549-T561 WeakPolarHBondContact O-CA 3.13Å; G549-C562 WeakPolarHBondContact CA-O 3.45Å; G549-C562 PolarHBondContact N-O 3.3Å; G549-C562 PolarHBondContact O-N 2.99Å; G549-Q589 WeakPolarHBondContact CA-O 3.47Å; G549-Q589 PolarHBondContact N-O 3.2Å; G549-Q589 VanDerWaalsContact N-O 3.08Å
550	L	97.1	Very high	93.8	Very high	11 Å²	11	29.4 Å²	29.4	6%	0.058	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	128.2	171.4	177.6	63.7	0	0	0	108.3	W548 F559 L560 T561 N790 V801 T803	W548-L550 PolarHBondContact O-N 2.83Å; L550-F559 HydrophobicContact CD1-CD2 4.17Å; L550-L560 WeakPolarHBondContact CA-O 3.36Å; L550-T561 HydrophobicContact CD1-CG2 4.06Å; L550-N790 HydrophobicContact CB-CB 3.97Å; L550-N790 HydrophobicContact CD2-CB 4.36Å; L550-V801 HydrophobicContact CD1-CB 4.23Å; L550-V801 HydrophobicContact CD1-CG1 3.72Å; L550-V801 HydrophobicContact CD2-CB 4.29Å; L550-V801 HydrophobicContact CD2-CG1 4.25Å; L550-V801 WeakPolarHBondContact CD2-O 3.48Å; L550-T803 HydrophobicContact CB-CG2 4.03Å; L550-T803 HydrophobicContact CD1-CG2 4.38Å; L550-T803 HydrophobicContact CD2-CG2 4.38Å; L550-T803 HydrophobicContact CG-CG2 4.5Å
551	A	96.4	Very high	94.1	Very high	7 Å²	7	28.8 Å²	28.8	6%	0.058	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	136	173.3	0	0	0	0	0	109.7	F559 L560 A591 F593	A551-F559 CarbonylContact O-C 3.59Å; A551-F559 WeakPolarHBondContact O-CA 3.11Å; A551-L560 PolarHBondContact N-O 3.22Å; A551-L560 PolarHBondContact O-N 2.77Å; A551-A591 HydrophobicContact CB-CB 3.89Å; A551-F593 HydrophobicContact CB-CD2 3.69Å; A551-F593 HydrophobicContact CB-CE2 3.94Å; A551-F593 WeakPolarHBondContact O-CE2 3.19Å
552	V	95.9	Very high	94.4	Very high	25 Å²	25	27.1 Å²	27.1	15%	0.152	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.4	179.4	168.6	0	0	0	0	109.8	F559 F593 S792 F793 L794	V552-F559 HydrophobicContact CG2-CB 4.18Å; V552-F593 VanDerWaalsContact C-CD2 3.43Å; V552-F593 WeakPolarHBondContact O-CD2 3.48Å; V552-S792 WeakPolarHBondContact CG2-OG 3.46Å; V552-F793 WeakPolarHBondContact CG2-O 3.4Å; V552-L794 HydrophobicContact CG1-CD2 4.06Å; V552-L794 HydrophobicContact CG2-CD2 4.06Å
553	H	95.9	Very high	94.7	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	13%	0.128	C	C	.	.			trans	-70.4	134.1	176.9	-172.9	-76.6	0	0	0	110.3	W555 K556 Q558 F593 G597	H553-W555 VanDerWaalsContact C-N 3.33Å; H553-W555 AromaticContact CE1-CD1 3.51Å; H553-W555 PolarHBondContact ND1-N 2.83Å; H553-W555 VanDerWaalsContact ND1-N 3.2Å; H553-W555 PolarHBondContact O-N 2.97Å; H553-K556 HydrophobicContact CB-CB 4.47Å; H553-K556 VanDerWaalsContact CE1-CG 3.48Å; H553-K556 WeakPolarHBondContact CE1-CG 3.36Å; H553-K556 WeakPolarHBondContact ND1-CB 3.18Å; H553-K556 PolarHBondContact ND1-N 2.76Å; H553-Q558 HydrophobicContact CB-CB 3.84Å; H553-Q558 VanDerWaalsContact CB-O 3.23Å; H553-Q558 WeakPolarHBondContact CB-O 3.12Å; H553-Q558 PolarHBondContact N-O 3Å; H553-F593 HydrophobicContact CB-CE2 4.39Å; H553-F593 HydrophobicContact CB-CZ 4.37Å; H553-F593 AromaticContact CD2-CE1 3.91Å; H553-G597 PolarHBondContact NE2-O 3.49Å
554	P	93.1	Very high	94.9	Very high	40 Å²	40	28.5 Å²	28.5	26%	0.26	14%	0.135	S	C	.	.	S	Bend	trans	-65.5	-25.5	-171	-26.7	37.2	0	0	0	116.3	F593 P595 H795	P554-F593 HydrophobicContact CG-CB 4.18Å; P554-P595 WeakPolarHBondContact CB-O 3.45Å; P554-P595 WeakPolarHBondContact CG-O 3.49Å; P554-H795 WeakPolarHBondContact O-CB 3.4Å
555	W	92.6	Very high	94.9	Very high	158 Å²	158	28.4 Å²	28.4	60%	0.598	13%	0.134	S	C	*	.	S	Bend	trans	-132.8	-6.7	-173.3	-13	109.8	0	0	0	116.3	H553 P595 S596 H795	H553-W555 VanDerWaalsContact C-N 3.33Å; H553-W555 AromaticContact CE1-CD1 3.51Å; H553-W555 PolarHBondContact ND1-N 2.83Å; H553-W555 VanDerWaalsContact ND1-N 3.2Å; H553-W555 PolarHBondContact O-N 2.97Å; W555-P595 WeakPolarHBondContact CH2-O 3.13Å; W555-P595 WeakPolarHBondContact CZ2-O 3.31Å; W555-P595 PolarHBondContact NE1-O 3.13Å; W555-S596 PolarHBondContact NE1-O 3Å; W555-H795 VanDerWaalsContact C-CD2 3.41Å; W555-H795 PolarHBondContact O-CD2 3.39Å
556	K	94.1	Very high	95	Very high	72 Å²	72	31.7 Å²	31.7	31%	0.313	14%	0.142	S	C	.	.	S	Bend	trans	-120.8	150.6	-173.3	-66.6	177.1	-175.6	170.7	0	106.4	H553 Q558 D615 H795	H553-K556 HydrophobicContact CB-CB 4.47Å; H553-K556 VanDerWaalsContact CE1-CG 3.48Å; H553-K556 WeakPolarHBondContact CE1-CG 3.36Å; H553-K556 WeakPolarHBondContact ND1-CB 3.18Å; H553-K556 PolarHBondContact ND1-N 2.76Å; K556-Q558 HydrophobicContact CB-CB 4.37Å; K556-Q558 HydrophobicContact CB-CG 4.04Å; K556-Q558 PolarHBondContact O-N 3.22Å; K556-D615 IonicContact NZ-OD1 2.71Å; K556-D615 PolarHBondContact NZ-OD1 3.32Å; K556-H795 PolarHBondContact O-ND1 3.25Å
557	P	93.3	Very high	94.9	Very high	43 Å²	43	32.1 Å²	32.1	28%	0.279	14%	0.144	S	C	.	.	S	Bend	trans	-74	61.7	173.4	33.3	-36.6	0	0	0	109.8	S573 S574	P557-S573 WeakPolarHBondContact O-CB 3.48Å; P557-S573 PolarHBondContact O-N 3.34Å; P557-S574 WeakPolarHBondContact CB-OG 3.5Å; P557-S574 WeakPolarHBondContact CG-OG 3.09Å
558	Q	94.9	Very high	95	Very high	29 Å²	29	32.1 Å²	32.1	14%	0.136	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.7	-177.2	-66.3	177.3	-8.2	0	0	109.3	H553 K556 L570 W571 I579	H553-Q558 HydrophobicContact CB-CB 3.84Å; H553-Q558 VanDerWaalsContact CB-O 3.23Å; H553-Q558 WeakPolarHBondContact CB-O 3.12Å; H553-Q558 PolarHBondContact N-O 3Å; K556-Q558 HydrophobicContact CB-CB 4.37Å; K556-Q558 HydrophobicContact CB-CG 4.04Å; K556-Q558 PolarHBondContact O-N 3.22Å; Q558-L570 HydrophobicContact CB-CD1 4.41Å; Q558-W571 WeakPolarHBondContact CA-O 3.42Å; Q558-W571 WeakPolarHBondContact CB-O 3.37Å; Q558-I579 HydrophobicContact CG-CD1 3.82Å
559	F	95.9	Very high	95	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	155.1	173	65.1	-90	0	0	0	109.6	Y229 L550 A551 V552 T561 W571 L794 V801 V810	Y229-F559 HydrophobicContact CD2-CZ 4.39Å; Y229-F559 HydrophobicContact CE1-CZ 4.28Å; Y229-F559 HydrophobicContact CE2-CE1 4.35Å; Y229-F559 AromaticContact CE2-CZ 3.69Å; Y229-F559 HydrophobicContact CE2-CZ 3.69Å; Y229-F559 AromaticContact CZ-CZ 3.61Å; L550-F559 HydrophobicContact CD1-CD2 4.17Å; A551-F559 CarbonylContact O-C 3.59Å; A551-F559 WeakPolarHBondContact O-CA 3.11Å; V552-F559 HydrophobicContact CG2-CB 4.18Å; F559-T561 HydrophobicContact CD2-CG2 3.87Å; F559-T561 HydrophobicContact CE2-CG2 3.9Å; F559-W571 HydrophobicContact CD1-CB 4.21Å; F559-W571 HydrophobicContact CD2-CB 4.16Å; F559-W571 AromaticContact CD2-CD1 3.7Å; F559-W571 HydrophobicContact CD2-CG 4.21Å; F559-W571 HydrophobicContact CE1-CB 3.77Å; F559-W571 HydrophobicContact CE1-CG 4.49Å; F559-W571 HydrophobicContact CE2-CB 3.7Å; F559-W571 AromaticContact CE2-CD1 3.29Å; F559-W571 AromaticContact CE2-CG 3.57Å; F559-W571 HydrophobicContact CE2-CG 3.57Å; F559-W571 HydrophobicContact CG-CB 4.4Å; F559-W571 HydrophobicContact CZ-CB 3.48Å; F559-W571 VanDerWaalsContact CZ-CB 3.48Å; F559-W571 AromaticContact CZ-CD1 3.96Å; F559-W571 AromaticContact CZ-CG 3.74Å; F559-W571 HydrophobicContact CZ-CG 3.74Å; F559-W571 PolarHBondContact N-O 3.26Å; F559-W571 VanDerWaalsContact N-O 3.11Å; F559-W571 PolarHBondContact O-N 2.9Å; F559-L794 HydrophobicContact CB-CD2 4.42Å; F559-L794 HydrophobicContact CD1-CD2 4.31Å; F559-V801 HydrophobicContact CD1-CG2 4Å; F559-V801 HydrophobicContact CD2-CG1 4.12Å; F559-V801 HydrophobicContact CE1-CG2 4.21Å; F559-V801 HydrophobicContact CE2-CG1 4.09Å; F559-V801 HydrophobicContact CG-CG2 4.21Å; F559-V801 HydrophobicContact CZ-CG1 4.45Å; F559-V810 HydrophobicContact CE2-CG1 4Å; F559-V810 HydrophobicContact CZ-CG1 4.43Å
560	L	96.8	Very high	95.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.5	-178.3	179.4	144	0	0	0	109.6	L550 A551 V568 C569 L570 W580 A591 F593 V600	L550-L560 WeakPolarHBondContact CA-O 3.36Å; A551-L560 PolarHBondContact N-O 3.22Å; A551-L560 PolarHBondContact O-N 2.77Å; L560-V568 HydrophobicContact CD1-CG1 3.55Å; L560-V568 HydrophobicContact CD2-CG1 3.87Å; L560-V568 HydrophobicContact CG-CG1 3.82Å; L560-C569 CarbonylContact C-O 3.55Å; L560-C569 VanDerWaalsContact CA-O 3.28Å; L560-C569 WeakPolarHBondContact CA-O 2.95Å; L560-L570 HydrophobicContact CB-CD1 4.07Å; L560-L570 HydrophobicContact CD1-CD1 4.45Å; L560-W580 HydrophobicContact CD1-CH2 3.97Å; L560-W580 HydrophobicContact CD1-CZ2 4.41Å; L560-A591 HydrophobicContact CD2-CB 3.51Å; L560-F593 HydrophobicContact CB-CE2 3.76Å; L560-F593 HydrophobicContact CB-CZ 3.88Å; L560-F593 HydrophobicContact CD1-CZ 4.42Å; L560-V600 HydrophobicContact CD1-CB 4.34Å; L560-V600 HydrophobicContact CD1-CG1 3.77Å; L560-V600 HydrophobicContact CD1-CG2 3.91Å; L560-V600 HydrophobicContact CD2-CG2 4.26Å
561	T	96.8	Very high	94.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.6	175.6	61.7	0	0	0	0	110.8	H543 G549 L550 F559 V568 C569 W571 V810	H543-T561 PolarHBondContact NE2-OG1 3.11Å; G549-T561 VanDerWaalsContact O-CA 3.25Å; G549-T561 WeakPolarHBondContact O-CA 3.13Å; L550-T561 HydrophobicContact CD1-CG2 4.06Å; F559-T561 HydrophobicContact CD2-CG2 3.87Å; F559-T561 HydrophobicContact CE2-CG2 3.9Å; T561-V568 WeakPolarHBondContact O-CA 3.45Å; T561-C569 PolarHBondContact N-O 3.47Å; T561-C569 PolarHBondContact O-N 3.16Å; T561-W571 PolarHBondContact OG1-NE1 3.43Å; T561-V810 HydrophobicContact CG2-CG1 4.41Å; T561-V810 HydrophobicContact CG2-CG2 4.01Å
562	C	95.6	Very high	94.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	143.1	175.7	66.3	0	0	0	0	112.4	L547 G549 Q567 V568 A588 V602	L547-C562 VanDerWaalsContact CD1-C 3.45Å; L547-C562 VanDerWaalsContact CD1-O 3.23Å; L547-C562 WeakPolarHBondContact CD1-O 3.38Å; G549-C562 WeakPolarHBondContact CA-O 3.45Å; G549-C562 PolarHBondContact N-O 3.3Å; G549-C562 PolarHBondContact O-N 2.99Å; C562-Q567 WeakPolarHBondContact CA-O 3.4Å; C562-V568 HydrophobicContact CB-CB 4.42Å; C562-V568 HydrophobicContact CB-CG2 3.87Å; C562-A588 HydrophobicContact CB-CB 3.55Å; C562-V602 HydrophobicContact CB-CG1 4.38Å
563	G	94.8	Very high	94.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-166.4	-173.6	0	0	0	0	0	114.7	E546 D565 R566 A588	E546-G563 WeakPolarHBondContact O-CA 3.46Å; G563-D565 PolarHBondContact O-N 3.29Å; G563-R566 PolarHBondContact O-N 3.29Å; G563-R566 VanDerWaalsContact O-N 3.15Å; G563-A588 CarbonylContact C-O 3.5Å; G563-A588 PolarHBondContact O-N 2.83Å; G563-A588 VanDerWaalsContact O-N 3.13Å
564	Y	95.5	Very high	94	Very high	44 Å²	44	33.3 Å²	33.3	17%	0.173	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-9.5	-174.2	-64.1	-1.3	0	0	0	113.6	E546 W548 R566 T587 A588 Q589 Q605	E546-Y564 HydrophobicContact CB-CD2 3.67Å; E546-Y564 HydrophobicContact CB-CE2 3.94Å; E546-Y564 HydrophobicContact CB-CG 4.22Å; E546-Y564 HydrophobicContact CG-CD2 4.43Å; E546-Y564 HydrophobicContact CG-CE2 4.2Å; E546-Y564 PolarHBondContact O-N 3.34Å; W548-Y564 AromaticContact CD1-CE1 3.99Å; W548-Y564 AromaticContact CD1-CZ 3.77Å; W548-Y564 AromaticContact NE1-CZ 4Å; Y564-R566 PolarHBondContact O-N 3.31Å; Y564-T587 WeakPolarHBondContact O-CG2 3.32Å; Y564-A588 WeakPolarHBondContact CD1-O 3.47Å; Y564-Q589 PolarHBondContact OH-OE1 2.97Å; Y564-Q605 HydrophobicContact CE1-CG 4.15Å; Y564-Q605 PolarHBondContact OH-NE2 3.26Å
565	D	93.3	Very high	93.6	Very high	22 Å²	22	34.4 Å²	34.4	12%	0.118	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	1.5	168.3	63.7	1.6	0	0	0	113.4	H543 T544 D545 G563 Q567	H543-D565 WeakPolarHBondContact CA-OD2 3.32Å; H543-D565 VanDerWaalsContact CB-OD2 3.31Å; H543-D565 WeakPolarHBondContact CB-OD2 3.19Å; H543-D565 IonicContact CE1-OD1 2.92Å; H543-D565 IonicContact CG-OD2 3.15Å; H543-D565 IonicContact ND1-OD1 2.87Å; H543-D565 PolarHBondContact ND1-OD1 3.26Å; H543-D565 VanDerWaalsContact ND1-OD1 3.16Å; H543-D565 IonicContact ND1-OD2 2.77Å; H543-D565 PolarHBondContact ND1-OD2 2.89Å; T544-D565 PolarHBondContact N-OD2 2.85Å; T544-D565 WeakPolarHBondContact OG1-CB 3.28Å; D545-D565 HydrophobicContact CB-CB 3.95Å; G563-D565 PolarHBondContact O-N 3.29Å; D565-Q567 HydrophobicContact CB-CG 4.47Å; D565-Q567 PolarHBondContact O-N 3.3Å; D565-Q567 WeakPolarHBondContact OD1-CB 3.44Å; D565-Q567 PolarHBondContact OD1-N 3.19Å
566	R	94.5	Very high	93.2	Very high	124 Å²	124	28.2 Å²	28.2	47%	0.468	14%	0.143	S	C	.	.			trans	63	15.4	-178.8	-44.1	-179.4	-172.5	-171.9	4.1	112.7	G563 Y564 T583 L584 E585 T587	G563-R566 PolarHBondContact O-N 3.29Å; G563-R566 VanDerWaalsContact O-N 3.15Å; Y564-R566 PolarHBondContact O-N 3.31Å; R566-T583 CarbonylContact O-C 3.41Å; R566-T583 WeakPolarHBondContact O-CA 3.41Å; R566-L584 PolarHBondContact O-N 3.15Å; R566-E585 WeakPolarHBondContact CD-O 3.26Å; R566-E585 PolarHBondContact NH1-O 3.11Å; R566-T587 HydrophobicContact CG-CG2 4.22Å
567	Q	93.4	Very high	92.7	Very high	39 Å²	39	30.2 Å²	30.2	18%	0.182	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.5	175.8	-61.8	-59.3	-38.8	0	0	109.8	C562 D565 T581 T583	C562-Q567 WeakPolarHBondContact CA-O 3.4Å; D565-Q567 HydrophobicContact CB-CG 4.47Å; D565-Q567 PolarHBondContact O-N 3.3Å; D565-Q567 WeakPolarHBondContact OD1-CB 3.44Å; D565-Q567 PolarHBondContact OD1-N 3.19Å; Q567-T581 PolarHBondContact OE1-OG1 3.35Å; Q567-T583 PolarHBondContact NE2-OG1 2.88Å; Q567-T583 PolarHBondContact OE1-OG1 2.83Å
568	V	95.6	Very high	92.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.9	165.8	179.5	0	0	0	0	107.2	L560 T561 C562 W580 T581 K582 L584 V602 L612	L560-V568 HydrophobicContact CD1-CG1 3.55Å; L560-V568 HydrophobicContact CD2-CG1 3.87Å; L560-V568 HydrophobicContact CG-CG1 3.82Å; T561-V568 WeakPolarHBondContact O-CA 3.45Å; C562-V568 HydrophobicContact CB-CB 4.42Å; C562-V568 HydrophobicContact CB-CG2 3.87Å; V568-W580 HydrophobicContact CB-CZ3 4.41Å; V568-W580 HydrophobicContact CG1-CH2 4.05Å; V568-W580 HydrophobicContact CG1-CZ3 3.98Å; V568-T581 CarbonylContact O-C 3.58Å; V568-T581 VanDerWaalsContact O-CA 3.23Å; V568-T581 WeakPolarHBondContact O-CA 3.39Å; V568-T581 PolarHBondContact O-OG1 3.47Å; V568-K582 HydrophobicContact CB-CB 4.49Å; V568-K582 PolarHBondContact N-O 2.74Å; V568-K582 PolarHBondContact O-N 3.48Å; V568-L584 HydrophobicContact CG2-CD1 3.47Å; V568-L584 VanDerWaalsContact CG2-CD1 3.47Å; V568-L584 HydrophobicContact CG2-CD2 4.22Å; V568-L584 HydrophobicContact CG2-CG 3.74Å; V568-V602 HydrophobicContact CG1-CG2 4.14Å; V568-V602 HydrophobicContact CG2-CG1 4.05Å; V568-V602 HydrophobicContact CG2-CG2 4.15Å; V568-L612 HydrophobicContact CG1-CD1 4.38Å
569	C	95.1	Very high	92.4	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.054	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.6	-174	-67.3	0	0	0	0	109.5	L560 T561 W571 L578 T581	L560-C569 CarbonylContact C-O 3.55Å; L560-C569 VanDerWaalsContact CA-O 3.28Å; L560-C569 WeakPolarHBondContact CA-O 2.95Å; T561-C569 PolarHBondContact N-O 3.47Å; T561-C569 PolarHBondContact O-N 3.16Å; C569-W571 HydrophobicContact CB-CZ2 3.63Å; C569-W571 PolarHBondContact O-NE1 2.93Å; C569-L578 HydrophobicContact CB-CD1 3.55Å; C569-T581 PolarHBondContact SG-OG1 3.46Å
570	L	95.9	Very high	92.3	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.2	169.9	-176	71.4	0	0	0	109.1	Q558 L560 L578 I579 W580 F593 T614	Q558-L570 HydrophobicContact CB-CD1 4.41Å; L560-L570 HydrophobicContact CB-CD1 4.07Å; L560-L570 HydrophobicContact CD1-CD1 4.45Å; L570-L578 WeakPolarHBondContact O-CD1 3.18Å; L570-I579 HydrophobicContact CD2-CB 4.24Å; L570-I579 HydrophobicContact CD2-CD1 4.03Å; L570-I579 HydrophobicContact CD2-CG2 4.27Å; L570-I579 HydrophobicContact CG-CB 4.37Å; L570-I579 HydrophobicContact CG-CD1 4.14Å; L570-I579 PolarHBondContact O-N 3.08Å; L570-W580 HydrophobicContact CB-CD2 3.92Å; L570-W580 HydrophobicContact CB-CE3 4.46Å; L570-W580 HydrophobicContact CB-CG 4.31Å; L570-W580 HydrophobicContact CB-CH2 4.37Å; L570-W580 HydrophobicContact CB-CZ2 3.84Å; L570-W580 HydrophobicContact CD2-CZ2 4.16Å; L570-W580 PolarHBondContact N-O 2.61Å; L570-F593 HydrophobicContact CD1-CZ 3.83Å; L570-T614 HydrophobicContact CD2-CG2 4.09Å
571	W	93.9	Very high	92.1	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	142.1	-176	-51.5	91	0	0	0	110.6	Y229 Q541 Q558 F559 T561 C569 L578	Y229-W571 HydrophobicContact CD1-CD2 4.31Å; Y229-W571 AromaticContact CD1-CE3 3.73Å; Y229-W571 HydrophobicContact CD1-CE3 3.73Å; Y229-W571 HydrophobicContact CD1-CH2 4.39Å; Y229-W571 AromaticContact CD1-CZ3 3.77Å; Y229-W571 HydrophobicContact CD1-CZ3 3.77Å; Y229-W571 HydrophobicContact CE1-CD2 4.37Å; Y229-W571 AromaticContact CE1-CE3 3.84Å; Y229-W571 HydrophobicContact CE1-CE3 3.84Å; Y229-W571 HydrophobicContact CE1-CZ3 4.32Å; Q541-W571 HydrophobicContact CG-CH2 3.71Å; Q541-W571 HydrophobicContact CG-CZ3 3.78Å; Q558-W571 WeakPolarHBondContact CA-O 3.42Å; Q558-W571 WeakPolarHBondContact CB-O 3.37Å; F559-W571 HydrophobicContact CD1-CB 4.21Å; F559-W571 HydrophobicContact CD2-CB 4.16Å; F559-W571 AromaticContact CD2-CD1 3.7Å; F559-W571 HydrophobicContact CD2-CG 4.21Å; F559-W571 HydrophobicContact CE1-CB 3.77Å; F559-W571 HydrophobicContact CE1-CG 4.49Å; F559-W571 HydrophobicContact CE2-CB 3.7Å; F559-W571 AromaticContact CE2-CD1 3.29Å; F559-W571 AromaticContact CE2-CG 3.57Å; F559-W571 HydrophobicContact CE2-CG 3.57Å; F559-W571 HydrophobicContact CG-CB 4.4Å; F559-W571 HydrophobicContact CZ-CB 3.48Å; F559-W571 VanDerWaalsContact CZ-CB 3.48Å; F559-W571 AromaticContact CZ-CD1 3.96Å; F559-W571 AromaticContact CZ-CG 3.74Å; F559-W571 HydrophobicContact CZ-CG 3.74Å; F559-W571 PolarHBondContact N-O 3.26Å; F559-W571 VanDerWaalsContact N-O 3.11Å; F559-W571 PolarHBondContact O-N 2.9Å; T561-W571 PolarHBondContact OG1-NE1 3.43Å; C569-W571 HydrophobicContact CB-CZ2 3.63Å; C569-W571 PolarHBondContact O-NE1 2.93Å; W571-L578 HydrophobicContact CD2-CD1 4.01Å; W571-L578 HydrophobicContact CE3-CB 4.09Å; W571-L578 HydrophobicContact CE3-CD1 3.98Å; W571-L578 HydrophobicContact CH2-CD1 4.2Å; W571-L578 HydrophobicContact CZ2-CD1 4.17Å; W571-L578 HydrophobicContact CZ3-CB 4.06Å; W571-L578 HydrophobicContact CZ3-CD1 4.08Å
572	D	91.9	Very high	92	Very high	34 Å²	34	37.9 Å²	37.9	18%	0.182	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.1	162.2	-179.5	-10.4	0	0	0	108	S574 T575 H576 Q577 I579	D572-S574 WeakPolarHBondContact OD1-CB 2.96Å; D572-S574 PolarHBondContact OD1-N 3.15Å; D572-T575 WeakPolarHBondContact CB-OG1 3.33Å; D572-T575 PolarHBondContact OD1-N 2.95Å; D572-T575 WeakPolarHBondContact OD2-CG2 3.45Å; D572-T575 PolarHBondContact OD2-OG1 2.9Å; D572-H576 WeakPolarHBondContact O-CA 3.44Å; D572-H576 PolarHBondContact O-N 2.9Å; D572-Q577 PolarHBondContact N-O 2.92Å; D572-I579 HydrophobicContact CB-CD1 4Å; D572-I579 HydrophobicContact CB-CG1 3.99Å
573	S	89.2	Confident	91.9	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-11.4	-178.5	-165.5	0	0	0	0	113.8	P557 H576 L794 Q812	P557-S573 WeakPolarHBondContact O-CB 3.48Å; P557-S573 PolarHBondContact O-N 3.34Å; S573-H576 PolarHBondContact O-CD2 2.91Å; S573-H576 PolarHBondContact O-CE1 3.38Å; S573-H576 PolarHBondContact O-ND1 3.3Å; S573-H576 PolarHBondContact O-NE2 3.16Å; S573-H576 VanDerWaalsContact O-NE2 3.13Å; S573-L794 WeakPolarHBondContact OG-CD1 3.34Å; S573-Q812 PolarHBondContact O-NE2 2.93Å; S573-Q812 PolarHBondContact OG-NE2 2.98Å; S573-Q812 PolarHBondContact OG-OE1 3.08Å
574	S	87.8	Confident	91.9	Very high	79 Å²	79	42.7 Å²	42.7	55%	0.552	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-40.3	179.1	-54.2	0	0	0	0	112.2	P557 D572 H576	P557-S574 WeakPolarHBondContact CB-OG 3.5Å; P557-S574 WeakPolarHBondContact CG-OG 3.09Å; D572-S574 WeakPolarHBondContact OD1-CB 2.96Å; D572-S574 PolarHBondContact OD1-N 3.15Å; S574-H576 VanDerWaalsContact C-CD2 3.48Å; S574-H576 PolarHBondContact O-CD2 3.02Å; S574-H576 VanDerWaalsContact O-CD2 3.3Å
575	T	84.7	Confident	91.7	Very high	63 Å²	63	47 Å²	47	39%	0.387	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-19.1	175.7	63.1	0	0	0	0	112.2	W226 D572 Q577	W226-T575 PolarHBondContact NE1-O 3.33Å; D572-T575 WeakPolarHBondContact CB-OG1 3.33Å; D572-T575 PolarHBondContact OD1-N 2.95Å; D572-T575 WeakPolarHBondContact OD2-CG2 3.45Å; D572-T575 PolarHBondContact OD2-OG1 2.9Å; T575-Q577 PolarHBondContact O-N 2.96Å
576	H	84.9	Confident	91.7	Very high	27 Å²	27	48 Å²	48	13%	0.125	24%	0.243	C	C	.	.			trans	51.6	36.4	-176.7	-34.3	-131.1	0	0	0	113.9	W226 N227 Y229 D572 S573 S574 Q812	W226-H576 AromaticContact CD1-CD2 2.76Å; W226-H576 AromaticContact CD1-CE1 3.52Å; W226-H576 AromaticContact CD1-CG 2.85Å; W226-H576 AromaticContact CD1-ND1 3.36Å; W226-H576 AromaticContact CD1-NE2 3.2Å; W226-H576 HydrophobicContact CG-CB 4.35Å; W226-H576 AromaticContact CG-CD2 3.45Å; W226-H576 VanDerWaalsContact CG-CD2 3.45Å; W226-H576 AromaticContact CG-CE1 3.92Å; W226-H576 AromaticContact CG-CG 3.88Å; W226-H576 AromaticContact CG-NE2 3.47Å; W226-H576 AromaticContact NE1-CD2 2.98Å; W226-H576 PolarHBondContact NE1-CD2 2.84Å; W226-H576 AromaticContact NE1-CG 3.2Å; W226-H576 AromaticContact NE1-NE2 3.84Å; W226-H576 PolarHBondContact O-ND1 2.78Å; N227-H576 PolarHBondContact OD1-CE1 2.8Å; Y229-H576 HydrophobicContact CE1-CB 3.63Å; Y229-H576 AromaticContact CZ-ND1 3.72Å; Y229-H576 VanDerWaalsContact OH-CB 3.24Å; Y229-H576 WeakPolarHBondContact OH-CB 3.43Å; Y229-H576 PolarHBondContact OH-ND1 3.31Å; D572-H576 WeakPolarHBondContact O-CA 3.44Å; D572-H576 PolarHBondContact O-N 2.9Å; S573-H576 PolarHBondContact O-CD2 2.91Å; S573-H576 PolarHBondContact O-CE1 3.38Å; S573-H576 PolarHBondContact O-ND1 3.3Å; S573-H576 PolarHBondContact O-NE2 3.16Å; S573-H576 VanDerWaalsContact O-NE2 3.13Å; S574-H576 VanDerWaalsContact C-CD2 3.48Å; S574-H576 PolarHBondContact O-CD2 3.02Å; S574-H576 VanDerWaalsContact O-CD2 3.3Å; H576-Q812 PolarHBondContact CE1-NE2 3.41Å; H576-Q812 PolarHBondContact CE1-OE1 3.31Å; H576-Q812 VanDerWaalsContact CE1-OE1 3.31Å; H576-Q812 PolarHBondContact ND1-OE1 2.93Å
577	Q	84.1	Confident	91.7	Very high	115 Å²	115	43.3 Å²	43.3	54%	0.537	23%	0.229	S	C	.	.			trans	-100.1	153.8	166.5	-62.5	-173.3	-6.8	0	0	109.3	D572 T575	D572-Q577 PolarHBondContact N-O 2.92Å; T575-Q577 PolarHBondContact O-N 2.96Å
578	L	89.4	Confident	91.9	Very high	35 Å²	35	41.4 Å²	41.4	18%	0.183	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	126.7	169.4	-177.8	80.8	0	0	0	108.6	Q541 C569 L570 W571 W580 T581	Q541-L578 VanDerWaalsContact OE1-CD2 3.24Å; C569-L578 HydrophobicContact CB-CD1 3.55Å; L570-L578 WeakPolarHBondContact O-CD1 3.18Å; W571-L578 HydrophobicContact CD2-CD1 4.01Å; W571-L578 HydrophobicContact CE3-CB 4.09Å; W571-L578 HydrophobicContact CE3-CD1 3.98Å; W571-L578 HydrophobicContact CH2-CD1 4.2Å; W571-L578 HydrophobicContact CZ2-CD1 4.17Å; W571-L578 HydrophobicContact CZ3-CB 4.06Å; W571-L578 HydrophobicContact CZ3-CD1 4.08Å; L578-W580 WeakPolarHBondContact CD1-O 3.49Å; L578-T581 HydrophobicContact CD2-CG2 3.75Å
579	I	92.4	Very high	91.8	Very high	78 Å²	78	41.9 Å²	41.9	40%	0.4	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-52.8	173.1	-58.2	177.4	0	0	0	109	Q558 L570 D572	Q558-I579 HydrophobicContact CG-CD1 3.82Å; L570-I579 HydrophobicContact CD2-CB 4.24Å; L570-I579 HydrophobicContact CD2-CD1 4.03Å; L570-I579 HydrophobicContact CD2-CG2 4.27Å; L570-I579 HydrophobicContact CG-CB 4.37Å; L570-I579 HydrophobicContact CG-CD1 4.14Å; L570-I579 PolarHBondContact O-N 3.08Å; D572-I579 HydrophobicContact CB-CD1 4Å; D572-I579 HydrophobicContact CB-CG1 3.99Å
580	W	93.7	Very high	91.9	Very high	26 Å²	26	41.8 Å²	41.8	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	158.9	173.1	58.8	-106.4	0	0	0	111.7	L560 V568 L570 L578 K582 L612 T614 K617	L560-W580 HydrophobicContact CD1-CH2 3.97Å; L560-W580 HydrophobicContact CD1-CZ2 4.41Å; V568-W580 HydrophobicContact CB-CZ3 4.41Å; V568-W580 HydrophobicContact CG1-CH2 4.05Å; V568-W580 HydrophobicContact CG1-CZ3 3.98Å; L570-W580 HydrophobicContact CB-CD2 3.92Å; L570-W580 HydrophobicContact CB-CE3 4.46Å; L570-W580 HydrophobicContact CB-CG 4.31Å; L570-W580 HydrophobicContact CB-CH2 4.37Å; L570-W580 HydrophobicContact CB-CZ2 3.84Å; L570-W580 HydrophobicContact CD2-CZ2 4.16Å; L570-W580 PolarHBondContact N-O 2.61Å; L578-W580 WeakPolarHBondContact CD1-O 3.49Å; W580-K582 HydrophobicContact CE3-CB 4.24Å; W580-K582 HydrophobicContact CZ3-CB 3.88Å; W580-L612 HydrophobicContact CH2-CD1 3.97Å; W580-L612 HydrophobicContact CZ3-CD1 4.29Å; W580-T614 PolarHBondContact NE1-O 2.78Å; W580-K617 HydrophobicContact CB-CD 4.32Å; W580-K617 HydrophobicContact CD2-CB 4.13Å; W580-K617 HydrophobicContact CD2-CD 4.32Å; W580-K617 HydrophobicContact CD2-CG 4.19Å; W580-K617 HydrophobicContact CE3-CB 4.39Å; W580-K617 HydrophobicContact CE3-CD 4.11Å; W580-K617 HydrophobicContact CE3-CG 3.96Å; W580-K617 HydrophobicContact CG-CB 4.38Å; W580-K617 HydrophobicContact CG-CD 4.43Å; W580-K617 HydrophobicContact CZ3-CG 4.35Å
581	T	92.6	Very high	92	Very high	21 Å²	21	42.2 Å²	42.2	13%	0.129	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.4	171.5	179.9	0	0	0	0	111.7	F503 Q567 V568 C569 L578 K617	F503-T581 HydrophobicContact CE2-CG2 4.31Å; F503-T581 HydrophobicContact CZ-CG2 3.81Å; Q567-T581 PolarHBondContact OE1-OG1 3.35Å; V568-T581 CarbonylContact O-C 3.58Å; V568-T581 VanDerWaalsContact O-CA 3.23Å; V568-T581 WeakPolarHBondContact O-CA 3.39Å; V568-T581 PolarHBondContact O-OG1 3.47Å; C569-T581 PolarHBondContact SG-OG1 3.46Å; L578-T581 HydrophobicContact CD2-CG2 3.75Å; T581-K617 WeakPolarHBondContact O-CE 3.36Å; T581-K617 PolarHBondContact O-NZ 2.87Å
582	K	93.8	Very high	92.1	Very high	73 Å²	73	42.4 Å²	42.4	32%	0.317	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.7	178	-176.8	76.5	-179.7	-168.6	0	109.7	V568 W580 L584 L612 K617	V568-K582 HydrophobicContact CB-CB 4.49Å; V568-K582 PolarHBondContact N-O 2.74Å; V568-K582 PolarHBondContact O-N 3.48Å; W580-K582 HydrophobicContact CE3-CB 4.24Å; W580-K582 HydrophobicContact CZ3-CB 3.88Å; K582-L584 HydrophobicContact CG-CD2 4.17Å; K582-L612 HydrophobicContact CB-CD1 4.47Å; K582-L612 HydrophobicContact CG-CD1 4.41Å; K582-K617 HydrophobicContact CB-CD 4.48Å; K582-K617 HydrophobicContact CB-CG 4.24Å; K582-K617 HydrophobicContact CD-CD 4.3Å; K582-K617 HydrophobicContact CD-CG 4.01Å
583	T	94	Very high	92.3	Very high	84 Å²	84	41.7 Å²	41.7	52%	0.515	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.5	167.1	-47.8	0	0	0	0	110.3	R566 Q567	R566-T583 CarbonylContact O-C 3.41Å; R566-T583 WeakPolarHBondContact O-CA 3.41Å; Q567-T583 PolarHBondContact NE2-OG1 2.88Å; Q567-T583 PolarHBondContact OE1-OG1 2.83Å
584	L	93.6	Very high	92.7	Very high	16 Å²	16	41.6 Å²	41.6	8%	0.084	22%	0.223	C	C	.	.			trans	-96.3	164.2	173.4	-58.5	-174.3	0	0	0	111.6	R566 V568 K582 A588 V602 L610	R566-L584 PolarHBondContact O-N 3.15Å; V568-L584 HydrophobicContact CG2-CD1 3.47Å; V568-L584 VanDerWaalsContact CG2-CD1 3.47Å; V568-L584 HydrophobicContact CG2-CD2 4.22Å; V568-L584 HydrophobicContact CG2-CG 3.74Å; K582-L584 HydrophobicContact CG-CD2 4.17Å; L584-A588 HydrophobicContact CD1-CB 4.19Å; L584-V602 HydrophobicContact CD1-CG1 3.87Å; L584-L610 HydrophobicContact CD1-CD2 3.96Å; L584-L610 HydrophobicContact CD2-CD1 4.14Å; L584-L610 HydrophobicContact CD2-CD2 3.62Å; L584-L610 HydrophobicContact CG-CD2 4.32Å
585	E	91.9	Very high	93	Very high	135 Å²	135	39 Å²	39	63%	0.631	21%	0.205	S	C	*	.	S	Bend	trans	-73.1	-41.8	174.3	-68.4	176.3	175.9	0	0	111.3	R566 R608	R566-E585 WeakPolarHBondContact CD-O 3.26Å; R566-E585 PolarHBondContact NH1-O 3.11Å; E585-R608 IonicContact OE2-CZ 3.57Å; E585-R608 VanDerWaalsContact OE2-CZ 3.26Å; E585-R608 IonicContact OE2-NH1 3.02Å; E585-R608 PolarHBondContact OE2-NH1 3.04Å; E585-R608 IonicContact OE2-NH2 2.88Å; E585-R608 PolarHBondContact OE2-NH2 3.16Å
586	D	93.6	Very high	93.4	Very high	42 Å²	42	37.9 Å²	37.9	23%	0.225	20%	0.199	C	C	.	.	S	Bend	trans	-108.4	162.5	-176.8	-58.8	-60.5	0	0	0	111.7	T604 T606 R608	D586-T604 HydrophobicContact CB-CG2 3.93Å; D586-T606 HydrophobicContact CB-CG2 4.35Å; D586-R608 VanDerWaalsContact OD2-CD 3.29Å; D586-R608 WeakPolarHBondContact OD2-CD 3.27Å; D586-R608 IonicContact OD2-CZ 3.91Å; D586-R608 IonicContact OD2-NH1 3.4Å; D586-R608 PolarHBondContact OD2-NH1 2.91Å
587	T	95.3	Very high	93.8	Very high	26 Å²	26	36.8 Å²	36.8	16%	0.16	20%	0.195	C	C	.	.			trans	-69.2	131.6	175.7	47.4	0	0	0	0	110.9	Y564 R566 T604 Q605	Y564-T587 WeakPolarHBondContact O-CG2 3.32Å; R566-T587 HydrophobicContact CG-CG2 4.22Å; T587-T604 CarbonylContact O-C 3.58Å; T587-T604 WeakPolarHBondContact O-CA 3.32Å; T587-T604 WeakPolarHBondContact O-CB 3.39Å; T587-Q605 PolarHBondContact O-N 3.02Å; T587-Q605 WeakPolarHBondContact OG1-CB 3.41Å; T587-Q605 VanDerWaalsContact OG1-CD 3.27Å; T587-Q605 WeakPolarHBondContact OG1-CG 3.3Å; T587-Q605 PolarHBondContact OG1-OE1 2.62Å
588	A	95.8	Very high	94.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.8	-179.5	0	0	0	0	0	111.1	C562 G563 Y564 L584 V602	C562-A588 HydrophobicContact CB-CB 3.55Å; G563-A588 CarbonylContact C-O 3.5Å; G563-A588 PolarHBondContact O-N 2.83Å; G563-A588 VanDerWaalsContact O-N 3.13Å; Y564-A588 WeakPolarHBondContact CD1-O 3.47Å; L584-A588 HydrophobicContact CD1-CB 4.19Å; A588-V602 HydrophobicContact CB-CG1 3.87Å
589	Q	95.4	Very high	94.6	Very high	9 Å²	9	31 Å²	31	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	-45.8	-177.8	-178	65.1	18.5	0	0	112.1	W548 G549 Y564 G603 L630	W548-Q589 CarbonylContact C-O 3.55Å; W548-Q589 VanDerWaalsContact CB-O 3.23Å; W548-Q589 WeakPolarHBondContact CB-O 3.48Å; G549-Q589 WeakPolarHBondContact CA-O 3.47Å; G549-Q589 PolarHBondContact N-O 3.2Å; G549-Q589 VanDerWaalsContact N-O 3.08Å; Y564-Q589 PolarHBondContact OH-OE1 2.97Å; Q589-G603 PolarHBondContact N-O 3.01Å; Q589-L630 WeakPolarHBondContact CB-O 3.33Å; Q589-L630 WeakPolarHBondContact CG-O 3.34Å
590	S	96.4	Very high	94.8	Very high	7 Å²	7	27.2 Å²	27.2	5%	0.049	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.5	-171.8	63.6	0	0	0	0	111.3	V602 G603 L630 S631	S590-V602 WeakPolarHBondContact O-CA 3.26Å; S590-G603 PolarHBondContact N-O 3.39Å; S590-G603 PolarHBondContact O-N 2.93Å; S590-L630 WeakPolarHBondContact CB-O 3.21Å; S590-L630 PolarHBondContact OG-O 2.76Å; S590-S631 WeakPolarHBondContact CB-O 3.43Å
591	A	97.2	Very high	95	Very high	11 Å²	11	26 Å²	26	9%	0.091	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.8	175.9	0	0	0	0	0	111	A551 L560 V600 A601 V602	A551-A591 HydrophobicContact CB-CB 3.89Å; L560-A591 HydrophobicContact CD2-CB 3.51Å; A591-V600 HydrophobicContact CB-CG2 4.49Å; A591-A601 CarbonylContact C-O 3.49Å; A591-A601 WeakPolarHBondContact CA-O 3.17Å; A591-A601 WeakPolarHBondContact CB-O 3.31Å; A591-V602 HydrophobicContact CB-CG2 4.4Å
592	G	96.8	Very high	95.2	Very high	8 Å²	8	25 Å²	25	8%	0.082	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	132.2	174.8	0	0	0	0	0	111.2	A601 Y635	G592-A601 PolarHBondContact N-O 3.4Å; G592-A601 PolarHBondContact O-N 2.79Å; G592-Y635 WeakPolarHBondContact O-CE2 3.39Å
593	F	97	Very high	95.4	Very high	19 Å²	19	21.5 Å²	21.5	8%	0.083	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141.9	173	-81.2	-82.4	0	0	0	110.8	A551 V552 H553 P554 L560 L570 V600 T614 Y635	A551-F593 HydrophobicContact CB-CD2 3.69Å; A551-F593 HydrophobicContact CB-CE2 3.94Å; A551-F593 WeakPolarHBondContact O-CE2 3.19Å; V552-F593 VanDerWaalsContact C-CD2 3.43Å; V552-F593 WeakPolarHBondContact O-CD2 3.48Å; H553-F593 HydrophobicContact CB-CE2 4.39Å; H553-F593 HydrophobicContact CB-CZ 4.37Å; H553-F593 AromaticContact CD2-CE1 3.91Å; P554-F593 HydrophobicContact CG-CB 4.18Å; L560-F593 HydrophobicContact CB-CE2 3.76Å; L560-F593 HydrophobicContact CB-CZ 3.88Å; L560-F593 HydrophobicContact CD1-CZ 4.42Å; L570-F593 HydrophobicContact CD1-CZ 3.83Å; F593-V600 HydrophobicContact CD1-CB 3.83Å; F593-V600 HydrophobicContact CD1-CG2 4.19Å; F593-V600 HydrophobicContact CD2-CG2 4.35Å; F593-V600 HydrophobicContact CE1-CB 3.74Å; F593-V600 HydrophobicContact CE1-CG1 4.46Å; F593-V600 HydrophobicContact CE1-CG2 4.14Å; F593-V600 HydrophobicContact CE2-CG2 4.31Å; F593-V600 HydrophobicContact CG-CB 4.4Å; F593-V600 HydrophobicContact CG-CG2 4.3Å; F593-V600 HydrophobicContact CZ-CB 4.23Å; F593-V600 HydrophobicContact CZ-CG2 4.2Å; F593-T614 HydrophobicContact CE1-CG2 3.97Å; F593-Y635 VanDerWaalsContact C-CD2 3.46Å; F593-Y635 WeakPolarHBondContact O-CD2 3.21Å
594	N	96.1	Very high	95.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.			trans	-64.5	142.5	162	-177.2	-84.6	0	0	0	108.5	S596 G597 V599 Y635 S639	N594-S596 PolarHBondContact O-N 3.44Å; N594-S596 VanDerWaalsContact O-N 3.1Å; N594-S596 WeakPolarHBondContact OD1-CB 3.42Å; N594-S596 PolarHBondContact OD1-N 3.35Å; N594-S596 PolarHBondContact OD1-OG 3.5Å; N594-G597 WeakPolarHBondContact O-CA 3.19Å; N594-G597 PolarHBondContact O-N 3.48Å; N594-V599 HydrophobicContact CB-CG2 3.6Å; N594-V599 PolarHBondContact N-O 2.91Å; N594-Y635 HydrophobicContact CB-CD1 4.23Å; N594-Y635 HydrophobicContact CB-CD2 4.3Å; N594-Y635 HydrophobicContact CB-CE1 4.16Å; N594-Y635 HydrophobicContact CB-CE2 4.25Å; N594-Y635 HydrophobicContact CB-CG 4.28Å; N594-Y635 WeakPolarHBondContact ND2-CD1 3.48Å; N594-S639 PolarHBondContact OD1-OG 2.81Å
595	P	94.2	Very high	95.5	Very high	25 Å²	25	19.7 Å²	19.7	16%	0.162	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-37.4	179.2	-25.7	31.1	0	0	0	111.7	P554 W555 G597 G636 S639	P554-P595 WeakPolarHBondContact CB-O 3.45Å; P554-P595 WeakPolarHBondContact CG-O 3.49Å; W555-P595 WeakPolarHBondContact CH2-O 3.13Å; W555-P595 WeakPolarHBondContact CZ2-O 3.31Å; W555-P595 PolarHBondContact NE1-O 3.13Å; P595-G597 PolarHBondContact O-N 2.74Å; P595-G636 VanDerWaalsContact CG-O 3.24Å; P595-G636 WeakPolarHBondContact CG-O 3.47Å; P595-S639 WeakPolarHBondContact CB-OG 3.2Å; P595-S639 VanDerWaalsContact CD-OG 3.3Å; P595-S639 WeakPolarHBondContact CD-OG 3.26Å; P595-S639 VanDerWaalsContact CG-OG 3.26Å; P595-S639 WeakPolarHBondContact CG-OG 3.19Å
596	S	92.9	Very high	95.6	Very high	38 Å²	38	16.1 Å²	16.1	27%	0.266	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.5	174.8	70.8	0	0	0	0	115.4	W555 N594 A598	W555-S596 PolarHBondContact NE1-O 3Å; N594-S596 PolarHBondContact O-N 3.44Å; N594-S596 VanDerWaalsContact O-N 3.1Å; N594-S596 WeakPolarHBondContact OD1-CB 3.42Å; N594-S596 PolarHBondContact OD1-N 3.35Å; N594-S596 PolarHBondContact OD1-OG 3.5Å; S596-A598 PolarHBondContact O-N 3.06Å; S596-A598 PolarHBondContact OG-N 2.86Å
597	G	92.9	Very high	95.6	Very high	4 Å²	4	14.1 Å²	14.1	4%	0.041	9%	0.089	C	C	.	.	S	Bend	trans	75.8	-7.1	-175.1	0	0	0	0	0	114.4	H553 N594 P595 V599 T614	H553-G597 PolarHBondContact NE2-O 3.49Å; N594-G597 WeakPolarHBondContact O-CA 3.19Å; N594-G597 PolarHBondContact O-N 3.48Å; P595-G597 PolarHBondContact O-N 2.74Å; G597-V599 VanDerWaalsContact C-N 3.32Å; G597-V599 PolarHBondContact O-N 3.17Å; G597-T614 WeakPolarHBondContact O-CB 3.47Å; G597-T614 PolarHBondContact O-OG1 3.05Å
598	A	93.6	Very high	95.6	Very high	28 Å²	28	15.5 Å²	15.5	23%	0.231	9%	0.091	C	C	.	.	S	Bend	trans	-69.6	-29.3	-175.1	0	0	0	0	0	113.5	S596 T614	S596-A598 PolarHBondContact O-N 3.06Å; S596-A598 PolarHBondContact OG-N 2.86Å; A598-T614 PolarHBondContact O-N 3.17Å; A598-T614 PolarHBondContact O-OG1 3.4Å
599	V	96.7	Very high	95.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	156.8	-178.2	-57.4	0	0	0	0	111.7	N594 G597 V611 L612 T614 V620 R661	N594-V599 HydrophobicContact CB-CG2 3.6Å; N594-V599 PolarHBondContact N-O 2.91Å; G597-V599 VanDerWaalsContact C-N 3.32Å; G597-V599 PolarHBondContact O-N 3.17Å; V599-V611 HydrophobicContact CB-CG1 3.67Å; V599-V611 HydrophobicContact CG1-CG1 4.23Å; V599-V611 HydrophobicContact CG2-CG1 3.92Å; V599-L612 VanDerWaalsContact CA-O 3.28Å; V599-L612 WeakPolarHBondContact CA-O 3.36Å; V599-L612 WeakPolarHBondContact CB-O 3.41Å; V599-T614 PolarHBondContact N-OG1 3.08Å; V599-V620 HydrophobicContact CG1-CG2 4.27Å; V599-R661 HydrophobicContact CG1-CG 4.49Å
600	V	97	Very high	95.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.2	173.4	61.1	0	0	0	0	110	L560 A591 F593 V611 L612	L560-V600 HydrophobicContact CD1-CB 4.34Å; L560-V600 HydrophobicContact CD1-CG1 3.77Å; L560-V600 HydrophobicContact CD1-CG2 3.91Å; L560-V600 HydrophobicContact CD2-CG2 4.26Å; A591-V600 HydrophobicContact CB-CG2 4.49Å; F593-V600 HydrophobicContact CD1-CB 3.83Å; F593-V600 HydrophobicContact CD1-CG2 4.19Å; F593-V600 HydrophobicContact CD2-CG2 4.35Å; F593-V600 HydrophobicContact CE1-CB 3.74Å; F593-V600 HydrophobicContact CE1-CG1 4.46Å; F593-V600 HydrophobicContact CE1-CG2 4.14Å; F593-V600 HydrophobicContact CE2-CG2 4.31Å; F593-V600 HydrophobicContact CG-CB 4.4Å; F593-V600 HydrophobicContact CG-CG2 4.3Å; F593-V600 HydrophobicContact CZ-CB 4.23Å; F593-V600 HydrophobicContact CZ-CG2 4.2Å; V600-V611 CarbonylContact O-C 3.52Å; V600-V611 WeakPolarHBondContact O-CA 3.47Å; V600-L612 HydrophobicContact CG1-CB 4Å; V600-L612 PolarHBondContact N-O 2.78Å; V600-L612 PolarHBondContact O-N 3.37Å
601	A	97.4	Very high	95.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.1	170.3	0	0	0	0	0	109.4	A591 G592 L610 V611 M633 Y635 L642	A591-A601 CarbonylContact C-O 3.49Å; A591-A601 WeakPolarHBondContact CA-O 3.17Å; A591-A601 WeakPolarHBondContact CB-O 3.31Å; G592-A601 PolarHBondContact N-O 3.4Å; G592-A601 PolarHBondContact O-N 2.79Å; A601-L610 CarbonylContact C-O 3.5Å; A601-L610 WeakPolarHBondContact CA-O 3.42Å; A601-V611 HydrophobicContact CB-CG2 4.12Å; A601-M633 HydrophobicContact CB-CE 3.31Å; A601-M633 HydrophobicContact CB-SD 4.35Å; A601-M633 WeakPolarHBondContact O-CE 3.46Å; A601-Y635 HydrophobicContact CB-CE2 3.82Å; A601-Y635 WeakPolarHBondContact CB-OH 3.4Å; A601-L642 HydrophobicContact CB-CD2 4.43Å
602	V	97.8	Very high	95.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.4	169.9	-176.3	0	0	0	0	111.1	C562 V568 L584 A588 S590 A591 W609 L610	C562-V602 HydrophobicContact CB-CG1 4.38Å; V568-V602 HydrophobicContact CG1-CG2 4.14Å; V568-V602 HydrophobicContact CG2-CG1 4.05Å; V568-V602 HydrophobicContact CG2-CG2 4.15Å; L584-V602 HydrophobicContact CD1-CG1 3.87Å; A588-V602 HydrophobicContact CB-CG1 3.87Å; S590-V602 WeakPolarHBondContact O-CA 3.26Å; A591-V602 HydrophobicContact CB-CG2 4.4Å; V602-W609 VanDerWaalsContact O-CA 3.29Å; V602-W609 WeakPolarHBondContact O-CA 3.45Å; V602-W609 WeakPolarHBondContact O-CB 3.46Å; V602-L610 HydrophobicContact CB-CD1 4.06Å; V602-L610 HydrophobicContact CB-CG 4.32Å; V602-L610 HydrophobicContact CG2-CD1 4.46Å; V602-L610 PolarHBondContact N-O 2.8Å; V602-L610 PolarHBondContact O-N 3.12Å
603	G	97.1	Very high	95.7	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.5	-178.3	0	0	0	0	0	110.3	Q589 S590	Q589-G603 PolarHBondContact N-O 3.01Å; S590-G603 PolarHBondContact N-O 3.39Å; S590-G603 PolarHBondContact O-N 2.93Å
604	T	96.6	Very high	95.6	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.006	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	173.2	-174.7	77	0	0	0	0	111.9	D586 T587 T606 R608 L630	D586-T604 HydrophobicContact CB-CG2 3.93Å; T587-T604 CarbonylContact O-C 3.58Å; T587-T604 WeakPolarHBondContact O-CA 3.32Å; T587-T604 WeakPolarHBondContact O-CB 3.39Å; T604-T606 PolarHBondContact O-N 2.8Å; T604-T606 PolarHBondContact OG1-N 2.78Å; T604-T606 PolarHBondContact OG1-OG1 2.82Å; T604-R608 WeakPolarHBondContact CB-O 3.3Å; T604-R608 WeakPolarHBondContact CG2-O 3.32Å; T604-R608 PolarHBondContact N-O 3.06Å; T604-R608 PolarHBondContact OG1-N 2.63Å; T604-R608 PolarHBondContact OG1-O 3.41Å; T604-L630 PolarHBondContact O-N 3.31Å
605	Q	94.8	Very high	95.4	Very high	60 Å²	60	19.6 Å²	19.6	28%	0.28	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.9	173.2	-66.8	-172.9	-38.3	0	0	114.3	Y564 T587 E628 Q629	Y564-Q605 HydrophobicContact CE1-CG 4.15Å; Y564-Q605 PolarHBondContact OH-NE2 3.26Å; T587-Q605 PolarHBondContact O-N 3.02Å; T587-Q605 WeakPolarHBondContact OG1-CB 3.41Å; T587-Q605 VanDerWaalsContact OG1-CD 3.27Å; T587-Q605 WeakPolarHBondContact OG1-CG 3.3Å; T587-Q605 PolarHBondContact OG1-OE1 2.62Å; Q605-E628 CarbonylContact O-C 3.56Å; Q605-Q629 HydrophobicContact CB-CB 4.35Å; Q605-Q629 HydrophobicContact CG-CB 4.42Å; Q605-Q629 WeakPolarHBondContact O-CA 3.3Å; Q605-Q629 PolarHBondContact O-N 2.8Å
606	T	93.4	Very high	95.2	Very high	61 Å²	61	21.1 Å²	21.1	37%	0.374	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	7.8	-170.9	56.9	0	0	0	0	113.6	D586 T604 R608	D586-T606 HydrophobicContact CB-CG2 4.35Å; T604-T606 PolarHBondContact O-N 2.8Å; T604-T606 PolarHBondContact OG1-N 2.78Å; T604-T606 PolarHBondContact OG1-OG1 2.82Å; T606-R608 PolarHBondContact O-N 3.44Å
607	G	93.1	Very high	95.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	77.9	-0.3	-170.8	0	0	0	0	0	113.3	T624 D625 E628	G607-T624 WeakPolarHBondContact O-CA 3.18Å; G607-D625 WeakPolarHBondContact CA-O 3.48Å; G607-D625 PolarHBondContact O-N 2.89Å; G607-D625 VanDerWaalsContact O-O 3.1Å; G607-E628 WeakPolarHBondContact CA-O 3.37Å; G607-E628 PolarHBondContact N-O 2.86Å
608	R	96.2	Very high	95.3	Very high	55 Å²	55	27.2 Å²	27.2	21%	0.208	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	143.3	175.1	-170.4	-176.3	177.9	-175.2	3	109.8	E585 D586 T604 T606 V622 H623 L630	E585-R608 IonicContact OE2-CZ 3.57Å; E585-R608 VanDerWaalsContact OE2-CZ 3.26Å; E585-R608 IonicContact OE2-NH1 3.02Å; E585-R608 PolarHBondContact OE2-NH1 3.04Å; E585-R608 IonicContact OE2-NH2 2.88Å; E585-R608 PolarHBondContact OE2-NH2 3.16Å; D586-R608 VanDerWaalsContact OD2-CD 3.29Å; D586-R608 WeakPolarHBondContact OD2-CD 3.27Å; D586-R608 IonicContact OD2-CZ 3.91Å; D586-R608 IonicContact OD2-NH1 3.4Å; D586-R608 PolarHBondContact OD2-NH1 2.91Å; T604-R608 WeakPolarHBondContact CB-O 3.3Å; T604-R608 WeakPolarHBondContact CG2-O 3.32Å; T604-R608 PolarHBondContact N-O 3.06Å; T604-R608 PolarHBondContact OG1-N 2.63Å; T604-R608 PolarHBondContact OG1-O 3.41Å; T606-R608 PolarHBondContact O-N 3.44Å; R608-V622 HydrophobicContact CG-CG1 3.97Å; R608-H623 WeakPolarHBondContact CA-O 3.23Å; R608-H623 WeakPolarHBondContact CG-O 3.48Å; R608-L630 WeakPolarHBondContact O-CD1 3.3Å
609	W	97.1	Very high	95.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	155.3	169.6	59.1	-83.5	0	0	0	110	V602 V611 T621 V622 H623 D625 L630 M633 L642 I644 Y654 Y663	V602-W609 VanDerWaalsContact O-CA 3.29Å; V602-W609 WeakPolarHBondContact O-CA 3.45Å; V602-W609 WeakPolarHBondContact O-CB 3.46Å; W609-V611 HydrophobicContact CE3-CG2 4.03Å; W609-V611 HydrophobicContact CZ3-CG2 3.64Å; W609-T621 HydrophobicContact CZ3-CG2 4.2Å; W609-V622 WeakPolarHBondContact O-CA 3.32Å; W609-H623 HydrophobicContact CD2-CB 4.06Å; W609-H623 HydrophobicContact CH2-CB 4.15Å; W609-H623 AromaticContact CH2-CD2 3.27Å; W609-H623 WeakPolarHBondContact CH2-CD2 3.45Å; W609-H623 AromaticContact CH2-CG 3.89Å; W609-H623 HydrophobicContact CZ2-CB 3.41Å; W609-H623 VanDerWaalsContact CZ2-CB 3.41Å; W609-H623 AromaticContact CZ2-CD2 3.44Å; W609-H623 VanDerWaalsContact CZ2-CD2 3.44Å; W609-H623 WeakPolarHBondContact CZ2-CD2 3.21Å; W609-H623 AromaticContact CZ2-CG 3.54Å; W609-H623 AromaticContact CZ3-CD2 3.85Å; W609-H623 PolarHBondContact N-O 3.47Å; W609-H623 PolarHBondContact O-N 2.95Å; W609-H623 VanDerWaalsContact O-O 3.11Å; W609-D625 PolarHBondContact NE1-OD2 3.15Å; W609-L630 HydrophobicContact CB-CD1 3.67Å; W609-L630 HydrophobicContact CG-CD1 4.09Å; W609-M633 HydrophobicContact CB-SD 3.89Å; W609-M633 HydrophobicContact CG-SD 4.48Å; W609-L642 HydrophobicContact CE3-CD2 4.36Å; W609-L642 HydrophobicContact CH2-CD2 4.13Å; W609-L642 HydrophobicContact CZ3-CD2 3.88Å; W609-I644 HydrophobicContact CD2-CD1 3.7Å; W609-I644 VanDerWaalsContact CE2-CD1 3.4Å; W609-I644 HydrophobicContact CE3-CD1 4.37Å; W609-I644 HydrophobicContact CG-CD1 3.92Å; W609-I644 HydrophobicContact CZ2-CD1 3.9Å; W609-Y654 HydrophobicContact CH2-CD1 4.27Å; W609-Y654 HydrophobicContact CH2-CE1 4.4Å; W609-Y654 HydrophobicContact CH2-CG 4.33Å; W609-Y654 HydrophobicContact CZ2-CD1 4.01Å; W609-Y654 AromaticContact CZ2-CD2 3.87Å; W609-Y654 HydrophobicContact CZ2-CD2 3.87Å; W609-Y654 AromaticContact CZ2-CE1 3.8Å; W609-Y654 HydrophobicContact CZ2-CE1 3.8Å; W609-Y654 AromaticContact CZ2-CE2 3.64Å; W609-Y654 HydrophobicContact CZ2-CE2 3.64Å; W609-Y654 HydrophobicContact CZ2-CG 4.05Å; W609-Y654 AromaticContact CZ2-CZ 3.61Å; W609-Y663 AromaticContact CH2-CD1 3.82Å; W609-Y663 HydrophobicContact CH2-CD1 3.82Å; W609-Y663 HydrophobicContact CH2-CE1 4.44Å; W609-Y663 AromaticContact CH2-CG 3.99Å; W609-Y663 HydrophobicContact CH2-CG 3.99Å; W609-Y663 HydrophobicContact CZ3-CD1 4.15Å; W609-Y663 HydrophobicContact CZ3-CE1 4.34Å; W609-Y663 HydrophobicContact CZ3-CG 4.4Å
610	L	97	Very high	95.4	Very high	10 Å²	10	32.6 Å²	32.6	5%	0.052	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	157.3	-176.5	60.6	92.7	0	0	0	110.1	L584 A601 V602 L612 L619 T621 V622	L584-L610 HydrophobicContact CD1-CD2 3.96Å; L584-L610 HydrophobicContact CD2-CD1 4.14Å; L584-L610 HydrophobicContact CD2-CD2 3.62Å; L584-L610 HydrophobicContact CG-CD2 4.32Å; A601-L610 CarbonylContact C-O 3.5Å; A601-L610 WeakPolarHBondContact CA-O 3.42Å; V602-L610 HydrophobicContact CB-CD1 4.06Å; V602-L610 HydrophobicContact CB-CG 4.32Å; V602-L610 HydrophobicContact CG2-CD1 4.46Å; V602-L610 PolarHBondContact N-O 2.8Å; V602-L610 PolarHBondContact O-N 3.12Å; L610-L612 HydrophobicContact CD1-CD1 3.98Å; L610-L612 HydrophobicContact CD1-CD2 3.65Å; L610-L612 HydrophobicContact CD1-CG 3.52Å; L610-L619 HydrophobicContact CB-CD1 3.91Å; L610-L619 HydrophobicContact CD1-CD1 4.39Å; L610-T621 VanDerWaalsContact CA-O 3.28Å; L610-T621 WeakPolarHBondContact CA-O 3.32Å; L610-V622 HydrophobicContact CB-CG2 4.11Å
611	V	97.4	Very high	95.3	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.8	176.3	-180	0	0	0	0	108	V599 V600 A601 W609 V620 T621 Y663	V599-V611 HydrophobicContact CB-CG1 3.67Å; V599-V611 HydrophobicContact CG1-CG1 4.23Å; V599-V611 HydrophobicContact CG2-CG1 3.92Å; V600-V611 CarbonylContact O-C 3.52Å; V600-V611 WeakPolarHBondContact O-CA 3.47Å; A601-V611 HydrophobicContact CB-CG2 4.12Å; W609-V611 HydrophobicContact CE3-CG2 4.03Å; W609-V611 HydrophobicContact CZ3-CG2 3.64Å; V611-V620 HydrophobicContact CB-CB 4.12Å; V611-V620 HydrophobicContact CG1-CB 4.01Å; V611-V620 HydrophobicContact CG1-CG1 4.3Å; V611-V620 HydrophobicContact CG1-CG2 4.36Å; V611-V620 WeakPolarHBondContact O-CB 3.41Å; V611-V620 PolarHBondContact O-N 3Å; V611-T621 HydrophobicContact CB-CG2 3.89Å; V611-T621 HydrophobicContact CG2-CG2 3.7Å; V611-T621 PolarHBondContact N-O 2.83Å; V611-Y663 HydrophobicContact CB-CE2 4.28Å; V611-Y663 HydrophobicContact CG1-CE2 4.24Å; V611-Y663 HydrophobicContact CG2-CE1 4.34Å; V611-Y663 HydrophobicContact CG2-CE2 3.8Å
612	L	96.8	Very high	95.2	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	144	176.9	-58.5	176.5	0	0	0	109.5	V568 W580 K582 V599 V600 L610 D618 L619	V568-L612 HydrophobicContact CG1-CD1 4.38Å; W580-L612 HydrophobicContact CH2-CD1 3.97Å; W580-L612 HydrophobicContact CZ3-CD1 4.29Å; K582-L612 HydrophobicContact CB-CD1 4.47Å; K582-L612 HydrophobicContact CG-CD1 4.41Å; V599-L612 VanDerWaalsContact CA-O 3.28Å; V599-L612 WeakPolarHBondContact CA-O 3.36Å; V599-L612 WeakPolarHBondContact CB-O 3.41Å; V600-L612 HydrophobicContact CG1-CB 4Å; V600-L612 PolarHBondContact N-O 2.78Å; V600-L612 PolarHBondContact O-N 3.37Å; L610-L612 HydrophobicContact CD1-CD1 3.98Å; L610-L612 HydrophobicContact CD1-CD2 3.65Å; L610-L612 HydrophobicContact CD1-CG 3.52Å; L612-D618 WeakPolarHBondContact CA-O 3.46Å; L612-L619 HydrophobicContact CD2-CD1 4.07Å
613	D	95.6	Very high	95.2	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.064	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.5	164.8	-168	-77.4	0	0	0	109.3	D615 S616 K617 D618 V620 R661	D613-D615 VanDerWaalsContact C-N 3.35Å; D613-D615 PolarHBondContact O-N 2.95Å; D613-D615 PolarHBondContact OD1-N 2.89Å; D613-D615 VanDerWaalsContact OD1-N 3.09Å; D613-S616 WeakPolarHBondContact CB-OG 3.32Å; D613-S616 PolarHBondContact OD1-N 3.31Å; D613-K617 VanDerWaalsContact O-CA 3.28Å; D613-K617 WeakPolarHBondContact O-CA 3.15Å; D613-K617 PolarHBondContact O-N 3.17Å; D613-D618 PolarHBondContact N-O 3.17Å; D613-V620 HydrophobicContact CB-CG2 4.19Å; D613-R661 IonicContact OD2-CZ 3.42Å; D613-R661 IonicContact OD2-NH1 2.74Å; D613-R661 PolarHBondContact OD2-NH1 2.78Å; D613-R661 IonicContact OD2-NH2 2.85Å; D613-R661 PolarHBondContact OD2-NH2 2.79Å
614	T	93.9	Very high	95.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-38	-174.6	-57.3	0	0	0	0	112.1	L570 W580 F593 G597 A598 V599	L570-T614 HydrophobicContact CD2-CG2 4.09Å; W580-T614 PolarHBondContact NE1-O 2.78Å; F593-T614 HydrophobicContact CE1-CG2 3.97Å; G597-T614 WeakPolarHBondContact O-CB 3.47Å; G597-T614 PolarHBondContact O-OG1 3.05Å; A598-T614 PolarHBondContact O-N 3.17Å; A598-T614 PolarHBondContact O-OG1 3.4Å; V599-T614 PolarHBondContact N-OG1 3.08Å
615	D	91.4	Very high	95	Very high	115 Å²	115	43.2 Å²	43.2	62%	0.615	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-41	-173.7	-65	-41.8	0	0	0	111.1	K556 D613	K556-D615 IonicContact NZ-OD1 2.71Å; K556-D615 PolarHBondContact NZ-OD1 3.32Å; D613-D615 VanDerWaalsContact C-N 3.35Å; D613-D615 PolarHBondContact O-N 2.95Å; D613-D615 PolarHBondContact OD1-N 2.89Å; D613-D615 VanDerWaalsContact OD1-N 3.09Å
616	S	90.9	Very high	94.8	Very high	57 Å²	57	41.9 Å²	41.9	40%	0.399	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-13.3	-177.2	88	0	0	0	0	114.6	D613 D618	D613-S616 WeakPolarHBondContact CB-OG 3.32Å; D613-S616 PolarHBondContact OD1-N 3.31Å; S616-D618 WeakPolarHBondContact CB-OD2 3.34Å; S616-D618 PolarHBondContact O-N 3.24Å; S616-D618 VanDerWaalsContact O-N 3.1Å; S616-D618 VanDerWaalsContact OG-CB 3.29Å; S616-D618 WeakPolarHBondContact OG-CB 3.37Å; S616-D618 PolarHBondContact OG-N 3.36Å; S616-D618 PolarHBondContact OG-OD2 3.2Å
617	K	93.6	Very high	94.7	Very high	70 Å²	70	45.1 Å²	45.1	30%	0.304	25%	0.251	S	S	.	.			trans	64.1	3.1	-173.8	173.2	-169.9	174	-174.3	0	113.7	W580 T581 K582 D613	W580-K617 HydrophobicContact CB-CD 4.32Å; W580-K617 HydrophobicContact CD2-CB 4.13Å; W580-K617 HydrophobicContact CD2-CD 4.32Å; W580-K617 HydrophobicContact CD2-CG 4.19Å; W580-K617 HydrophobicContact CE3-CB 4.39Å; W580-K617 HydrophobicContact CE3-CD 4.11Å; W580-K617 HydrophobicContact CE3-CG 3.96Å; W580-K617 HydrophobicContact CG-CB 4.38Å; W580-K617 HydrophobicContact CG-CD 4.43Å; W580-K617 HydrophobicContact CZ3-CG 4.35Å; T581-K617 WeakPolarHBondContact O-CE 3.36Å; T581-K617 PolarHBondContact O-NZ 2.87Å; K582-K617 HydrophobicContact CB-CD 4.48Å; K582-K617 HydrophobicContact CB-CG 4.24Å; K582-K617 HydrophobicContact CD-CD 4.3Å; K582-K617 HydrophobicContact CD-CG 4.01Å; D613-K617 VanDerWaalsContact O-CA 3.28Å; D613-K617 WeakPolarHBondContact O-CA 3.15Å; D613-K617 PolarHBondContact O-N 3.17Å
618	D	94.6	Very high	94.8	Very high	101 Å²	101	49.2 Å²	49.2	54%	0.54	27%	0.271	S	S	.	.			trans	-70.6	149.1	-177.4	-66.4	-45	0	0	0	111.8	L612 D613 S616 V620	L612-D618 WeakPolarHBondContact CA-O 3.46Å; D613-D618 PolarHBondContact N-O 3.17Å; S616-D618 WeakPolarHBondContact CB-OD2 3.34Å; S616-D618 PolarHBondContact O-N 3.24Å; S616-D618 VanDerWaalsContact O-N 3.1Å; S616-D618 VanDerWaalsContact OG-CB 3.29Å; S616-D618 WeakPolarHBondContact OG-CB 3.37Å; S616-D618 PolarHBondContact OG-N 3.36Å; S616-D618 PolarHBondContact OG-OD2 3.2Å; D618-V620 PolarHBondContact O-N 2.97Å
619	L	95.8	Very high	94.7	Very high	100 Å²	100	48.8 Å²	48.8	52%	0.524	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	120.5	175.4	-177.7	66.9	0	0	0	109.6	L610 L612 V622	L610-L619 HydrophobicContact CB-CD1 3.91Å; L610-L619 HydrophobicContact CD1-CD1 4.39Å; L612-L619 HydrophobicContact CD2-CD1 4.07Å; L619-V622 HydrophobicContact CD1-CG2 3.68Å; L619-V622 HydrophobicContact CD2-CG2 3.67Å; L619-V622 HydrophobicContact CG-CG2 4.03Å
620	V	95.6	Very high	94.7	Very high	40 Å²	40	48.8 Å²	48.8	24%	0.242	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-51.8	179.2	176	0	0	0	0	110.7	V599 V611 D613 D618 R661	V599-V620 HydrophobicContact CG1-CG2 4.27Å; V611-V620 HydrophobicContact CB-CB 4.12Å; V611-V620 HydrophobicContact CG1-CB 4.01Å; V611-V620 HydrophobicContact CG1-CG1 4.3Å; V611-V620 HydrophobicContact CG1-CG2 4.36Å; V611-V620 WeakPolarHBondContact O-CB 3.41Å; V611-V620 PolarHBondContact O-N 3Å; D613-V620 HydrophobicContact CB-CG2 4.19Å; D618-V620 PolarHBondContact O-N 2.97Å; V620-R661 HydrophobicContact CG1-CB 4.21Å; V620-R661 HydrophobicContact CG1-CG 4.37Å
621	T	95.3	Very high	94.6	Very high	31 Å²	31	49.4 Å²	49.4	19%	0.19	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	161.9	176.8	-166.7	0	0	0	0	111.6	W609 L610 V611 H623 Y663	W609-T621 HydrophobicContact CZ3-CG2 4.2Å; L610-T621 VanDerWaalsContact CA-O 3.28Å; L610-T621 WeakPolarHBondContact CA-O 3.32Å; V611-T621 HydrophobicContact CB-CG2 3.89Å; V611-T621 HydrophobicContact CG2-CG2 3.7Å; V611-T621 PolarHBondContact N-O 2.83Å; T621-H623 PolarHBondContact OG1-CD2 2.98Å; T621-H623 VanDerWaalsContact OG1-CD2 3.31Å; T621-H623 PolarHBondContact OG1-NE2 3.15Å; T621-Y663 HydrophobicContact CG2-CD2 3.42Å; T621-Y663 VanDerWaalsContact CG2-CD2 3.42Å; T621-Y663 HydrophobicContact CG2-CE2 3.73Å; T621-Y663 HydrophobicContact CG2-CG 4.21Å
622	V	96.4	Very high	94.6	Very high	51 Å²	51	50 Å²	50	31%	0.309	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133.8	171.6	179.9	0	0	0	0	108	R608 W609 L610 L619	R608-V622 HydrophobicContact CG-CG1 3.97Å; W609-V622 WeakPolarHBondContact O-CA 3.32Å; L610-V622 HydrophobicContact CB-CG2 4.11Å; L619-V622 HydrophobicContact CD1-CG2 3.68Å; L619-V622 HydrophobicContact CD2-CG2 3.67Å; L619-V622 HydrophobicContact CG-CG2 4.03Å
623	H	96.3	Very high	94.5	Very high	51 Å²	51	50.1 Å²	50.1	24%	0.236	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	165.2	174.5	-65.5	-85.6	0	0	0	109.8	R608 W609 T621	R608-H623 WeakPolarHBondContact CA-O 3.23Å; R608-H623 WeakPolarHBondContact CG-O 3.48Å; W609-H623 HydrophobicContact CD2-CB 4.06Å; W609-H623 HydrophobicContact CH2-CB 4.15Å; W609-H623 AromaticContact CH2-CD2 3.27Å; W609-H623 WeakPolarHBondContact CH2-CD2 3.45Å; W609-H623 AromaticContact CH2-CG 3.89Å; W609-H623 HydrophobicContact CZ2-CB 3.41Å; W609-H623 VanDerWaalsContact CZ2-CB 3.41Å; W609-H623 AromaticContact CZ2-CD2 3.44Å; W609-H623 VanDerWaalsContact CZ2-CD2 3.44Å; W609-H623 WeakPolarHBondContact CZ2-CD2 3.21Å; W609-H623 AromaticContact CZ2-CG 3.54Å; W609-H623 AromaticContact CZ3-CD2 3.85Å; W609-H623 PolarHBondContact N-O 3.47Å; W609-H623 PolarHBondContact O-N 2.95Å; W609-H623 VanDerWaalsContact O-O 3.11Å; T621-H623 PolarHBondContact OG1-CD2 2.98Å; T621-H623 VanDerWaalsContact OG1-CD2 3.31Å; T621-H623 PolarHBondContact OG1-NE2 3.15Å
624	T	96.2	Very high	94.6	Very high	89 Å²	89	52 Å²	52	55%	0.546	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	121.9	177.5	-52.8	0	0	0	0	108.1	G607	G607-T624 WeakPolarHBondContact O-CA 3.18Å
625	D	93	Very high	94.7	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.011	29%	0.288	C	S	.	.			trans	-132.1	119.2	178.5	-67.7	-72.2	0	0	0	108.7	G607 W609 Y652 Y654 R665	G607-D625 WeakPolarHBondContact CA-O 3.48Å; G607-D625 PolarHBondContact O-N 2.89Å; G607-D625 VanDerWaalsContact O-O 3.1Å; W609-D625 PolarHBondContact NE1-OD2 3.15Å; D625-Y652 HydrophobicContact CB-CD1 3.9Å; D625-Y652 HydrophobicContact CB-CD2 3.8Å; D625-Y652 HydrophobicContact CB-CE1 3.97Å; D625-Y652 HydrophobicContact CB-CE2 3.86Å; D625-Y652 HydrophobicContact CB-CG 3.81Å; D625-Y654 PolarHBondContact OD1-OH 2.73Å; D625-Y654 WeakPolarHBondContact OD2-CE2 3.41Å; D625-Y654 VanDerWaalsContact OD2-CZ 3.23Å; D625-Y654 PolarHBondContact OD2-OH 3.33Å; D625-R665 IonicContact OD1-CZ 4Å; D625-R665 IonicContact OD1-NE 3.41Å; D625-R665 IonicContact OD1-NH1 3.48Å; D625-R665 PolarHBondContact OD1-NH1 2.88Å
626	G	90.4	Very high	94.9	Very high	33 Å²	33	47 Å²	47	34%	0.34	26%	0.259	S	S	.	.	S	Bend	trans	73.5	-165.8	-173.5	0	0	0	0	0	112.5	Y652	G626-Y652 PolarHBondContact N-OH 3.01Å
627	N	92.1	Very high	95	Very high	128 Å²	128	45.9 Å²	45.9	68%	0.684	25%	0.25	S	C	*	.	S	Bend	trans	-137	11.4	178.6	66.5	-32.7	0	0	0	112.4
628	E	94.9	Very high	95	Very high	87 Å²	87	45.4 Å²	45.4	41%	0.407	25%	0.251	S	S	.	.	S	Bend	trans	-116.7	175.6	-178.1	-63.6	-157.4	-153.6	0	0	111.3	Q605 G607 H647 D648	Q605-E628 CarbonylContact O-C 3.56Å; G607-E628 WeakPolarHBondContact CA-O 3.37Å; G607-E628 PolarHBondContact N-O 2.86Å; E628-H647 HydrophobicContact CB-CB 3.89Å; E628-H647 WeakPolarHBondContact OE2-CB 3.23Å; E628-D648 HydrophobicContact CB-CB 4.48Å; E628-D648 HydrophobicContact CG-CB 4.42Å
629	Q	95.3	Very high	94.9	Very high	46 Å²	46	41.9 Å²	41.9	22%	0.215	23%	0.234	C	C	.	.			trans	-66.3	141.5	-176.3	72.9	174.3	52.9	0	0	112.8	Q605 S631 S646 H647	Q605-Q629 HydrophobicContact CB-CB 4.35Å; Q605-Q629 HydrophobicContact CG-CB 4.42Å; Q605-Q629 WeakPolarHBondContact O-CA 3.3Å; Q605-Q629 PolarHBondContact O-N 2.8Å; Q629-S631 PolarHBondContact O-N 3.42Å; Q629-S646 CarbonylContact O-C 3.55Å; Q629-S646 WeakPolarHBondContact O-CA 3.12Å; Q629-H647 HydrophobicContact CG-CB 3.75Å; Q629-H647 WeakPolarHBondContact CG-CD2 3.35Å; Q629-H647 WeakPolarHBondContact CG-ND1 3.19Å; Q629-H647 PolarHBondContact NE2-CE1 3.2Å; Q629-H647 PolarHBondContact NE2-NE2 3.22Å; Q629-H647 PolarHBondContact O-N 3.06Å
630	L	97	Very high	94.8	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	95.4	173.1	-55.8	-177.9	0	0	0	109.2	Q589 S590 T604 R608 W609 I644 G645	Q589-L630 WeakPolarHBondContact CB-O 3.33Å; Q589-L630 WeakPolarHBondContact CG-O 3.34Å; S590-L630 WeakPolarHBondContact CB-O 3.21Å; S590-L630 PolarHBondContact OG-O 2.76Å; T604-L630 PolarHBondContact O-N 3.31Å; R608-L630 WeakPolarHBondContact O-CD1 3.3Å; W609-L630 HydrophobicContact CB-CD1 3.67Å; W609-L630 HydrophobicContact CG-CD1 4.09Å; L630-I644 HydrophobicContact CB-CG2 4.23Å; L630-I644 HydrophobicContact CD1-CG2 4.01Å; L630-I644 HydrophobicContact CD2-CG2 3.82Å; L630-I644 HydrophobicContact CG-CG2 4.24Å; L630-G645 CarbonylContact C-O 3.59Å; L630-G645 WeakPolarHBondContact CA-O 3.22Å
631	S	95.1	Very high	94.8	Very high	22 Å²	22	41 Å²	41	15%	0.154	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-33.4	-173.4	53.3	0	0	0	0	113.4	S590 Q629 G645 I676	S590-S631 WeakPolarHBondContact CB-O 3.43Å; Q629-S631 PolarHBondContact O-N 3.42Å; S631-G645 PolarHBondContact N-O 2.82Å; S631-G645 PolarHBondContact OG-O 3.01Å; S631-I676 WeakPolarHBondContact CB-O 3.17Å; S631-I676 PolarHBondContact OG-O 3.2Å
632	V	95.9	Very high	94.9	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	136.5	-174.5	-173.2	0	0	0	0	110.5	I644 G645 T677 L679	V632-I644 CarbonylContact O-C 3.58Å; V632-I644 WeakPolarHBondContact O-CA 3.23Å; V632-G645 PolarHBondContact N-O 2.82Å; V632-G645 PolarHBondContact O-N 2.78Å; V632-T677 WeakPolarHBondContact CG2-O 3.28Å; V632-L679 HydrophobicContact CB-CD1 4.2Å; V632-L679 HydrophobicContact CB-CG 4.33Å; V632-L679 HydrophobicContact CG1-CB 4.04Å; V632-L679 HydrophobicContact CG1-CD1 4.2Å; V632-L679 HydrophobicContact CG1-CG 4.21Å
633	M	96.1	Very high	95	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.025	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	122.9	168.6	-61.2	-153.4	-47.7	0	0	110.7	A601 W609 I644	A601-M633 HydrophobicContact CB-CE 3.31Å; A601-M633 HydrophobicContact CB-SD 4.35Å; A601-M633 WeakPolarHBondContact O-CE 3.46Å; W609-M633 HydrophobicContact CB-SD 3.89Å; W609-M633 HydrophobicContact CG-SD 4.48Å; M633-I644 HydrophobicContact CG-CG1 4.39Å; M633-I644 HydrophobicContact CG-CG2 4.19Å; M633-I644 HydrophobicContact SD-CD1 4.44Å; M633-I644 HydrophobicContact SD-CG1 4.32Å; M633-I644 HydrophobicContact SD-CG2 4.38Å
634	R	96.4	Very high	95.1	Very high	51 Å²	51	34.7 Å²	34.7	19%	0.192	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	126.9	-176.5	-162.5	165	-63.2	170.7	15.5	113	A643 L679 D680 W681 T721 T723	R634-A643 PolarHBondContact N-O 2.94Å; R634-A643 PolarHBondContact O-N 2.89Å; R634-L679 PolarHBondContact NH1-O 2.84Å; R634-L679 PolarHBondContact NH2-O 3.43Å; R634-D680 IonicContact CZ-OD1 2.84Å; R634-D680 IonicContact NH1-OD1 3.26Å; R634-D680 PolarHBondContact NH1-OD1 3.25Å; R634-W681 PolarHBondContact O-NE1 3.13Å; R634-T721 PolarHBondContact NH1-OG1 3.06Å; R634-T723 VanDerWaalsContact CZ-OG1 3.27Å; R634-T723 PolarHBondContact NH1-OG1 2.81Å; R634-T723 PolarHBondContact NH2-OG1 3.3Å
635	Y	96.9	Very high	95.1	Very high	11 Å²	11	30.5 Å²	30.5	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	145.9	171.1	-68.6	-92.9	0	0	0	110.9	G592 F593 N594 A601 F641 L642 V656 Y663	G592-Y635 WeakPolarHBondContact O-CE2 3.39Å; F593-Y635 VanDerWaalsContact C-CD2 3.46Å; F593-Y635 WeakPolarHBondContact O-CD2 3.21Å; N594-Y635 HydrophobicContact CB-CD1 4.23Å; N594-Y635 HydrophobicContact CB-CD2 4.3Å; N594-Y635 HydrophobicContact CB-CE1 4.16Å; N594-Y635 HydrophobicContact CB-CE2 4.25Å; N594-Y635 HydrophobicContact CB-CG 4.28Å; N594-Y635 WeakPolarHBondContact ND2-CD1 3.48Å; A601-Y635 HydrophobicContact CB-CE2 3.82Å; A601-Y635 WeakPolarHBondContact CB-OH 3.4Å; Y635-F641 CarbonylContact C-O 3.36Å; Y635-F641 VanDerWaalsContact CA-O 3.31Å; Y635-F641 WeakPolarHBondContact CA-O 3.39Å; Y635-L642 HydrophobicContact CD1-CB 4.03Å; Y635-L642 HydrophobicContact CD1-CD1 4.15Å; Y635-L642 HydrophobicContact CD2-CD1 3.89Å; Y635-L642 HydrophobicContact CE1-CB 4.04Å; Y635-L642 HydrophobicContact CE1-CD1 4.15Å; Y635-L642 HydrophobicContact CE1-CD2 4.29Å; Y635-L642 HydrophobicContact CE1-CG 4.39Å; Y635-L642 HydrophobicContact CE2-CD1 3.87Å; Y635-L642 HydrophobicContact CG-CD1 4.03Å; Y635-V656 HydrophobicContact CD1-CG2 4.2Å; Y635-V656 HydrophobicContact CE1-CG1 4.18Å; Y635-V656 HydrophobicContact CE1-CG2 4.07Å; Y635-Y663 AromaticContact CE1-CE1 3.93Å; Y635-Y663 HydrophobicContact CE1-CE1 3.93Å; Y635-Y663 PolarHBondContact OH-OH 2.61Å
636	G	94.8	Very high	95.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.166	C	C	.	.			trans	-64.8	149.8	168	0	0	0	0	0	110.9	P595 D638 S639 F641	P595-G636 VanDerWaalsContact CG-O 3.24Å; P595-G636 WeakPolarHBondContact CG-O 3.47Å; G636-D638 PolarHBondContact O-N 3.4Å; G636-D638 VanDerWaalsContact O-N 3.15Å; G636-S639 PolarHBondContact O-N 3.44Å; G636-F641 PolarHBondContact N-O 3.02Å
637	P	93.9	Very high	95.6	Very high	32 Å²	32	30.7 Å²	30.7	21%	0.208	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.4	178.1	-27.1	33	0	0	0	113.9	S639 W681 S685 F720	P637-S639 PolarHBondContact O-N 2.66Å; P637-W681 HydrophobicContact CG-CB 4.31Å; P637-S685 VanDerWaalsContact CD-OG 3.27Å; P637-S685 WeakPolarHBondContact CD-OG 3.22Å; P637-F720 HydrophobicContact CB-CD2 4.21Å; P637-F720 HydrophobicContact CB-CE2 4.33Å; P637-F720 HydrophobicContact CB-CG 4.31Å; P637-F720 HydrophobicContact CG-CB 3.83Å; P637-F720 HydrophobicContact CG-CD1 3.76Å; P637-F720 HydrophobicContact CG-CD2 3.89Å; P637-F720 HydrophobicContact CG-CE1 4.3Å; P637-F720 HydrophobicContact CG-CE2 4.41Å; P637-F720 HydrophobicContact CG-CG 3.54Å
638	D	92.1	Very high	95.7	Very high	60 Å²	60	25.6 Å²	25.6	32%	0.321	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.5	176.6	71.5	-7.6	0	0	0	114.8	G636 N640 S685	G636-D638 PolarHBondContact O-N 3.4Å; G636-D638 VanDerWaalsContact O-N 3.15Å; D638-N640 PolarHBondContact O-N 3.34Å; D638-N640 VanDerWaalsContact O-N 3.15Å; D638-N640 PolarHBondContact OD1-N 2.86Å; D638-N640 WeakPolarHBondContact OD2-CB 3.31Å; D638-N640 PolarHBondContact OD2-ND2 2.9Å; D638-S685 WeakPolarHBondContact CB-OG 3.5Å; D638-S685 VanDerWaalsContact CG-CB 3.5Å; D638-S685 PolarHBondContact N-OG 3.45Å; D638-S685 VanDerWaalsContact N-OG 3.13Å
639	S	93.2	Very high	95.8	Very high	27 Å²	27	24 Å²	24	19%	0.189	13%	0.125	C	C	.	.	S	Bend	trans	60.6	9.7	-174.1	-53.5	0	0	0	0	115.6	N594 P595 G636 P637 V656	N594-S639 PolarHBondContact OD1-OG 2.81Å; P595-S639 WeakPolarHBondContact CB-OG 3.2Å; P595-S639 VanDerWaalsContact CD-OG 3.3Å; P595-S639 WeakPolarHBondContact CD-OG 3.26Å; P595-S639 VanDerWaalsContact CG-OG 3.26Å; P595-S639 WeakPolarHBondContact CG-OG 3.19Å; G636-S639 PolarHBondContact O-N 3.44Å; P637-S639 PolarHBondContact O-N 2.66Å; S639-V656 WeakPolarHBondContact O-CB 3.25Å; S639-V656 WeakPolarHBondContact O-CG1 3.37Å
640	N	94.1	Very high	95.8	Very high	83 Å²	83	25.6 Å²	25.6	44%	0.444	13%	0.129	S	C	.	.	S	Bend	trans	-91.4	-17.9	-176.7	-64.7	-43.1	0	0	0	113.2	D638 A655 V656	D638-N640 PolarHBondContact O-N 3.34Å; D638-N640 VanDerWaalsContact O-N 3.15Å; D638-N640 PolarHBondContact OD1-N 2.86Å; D638-N640 WeakPolarHBondContact OD2-CB 3.31Å; D638-N640 PolarHBondContact OD2-ND2 2.9Å; N640-A655 CarbonylContact O-C 3.56Å; N640-A655 WeakPolarHBondContact O-CA 3.45Å; N640-V656 PolarHBondContact O-N 2.84Å
641	F	96.2	Very high	95.8	Very high	40 Å²	40	25.6 Å²	25.6	18%	0.175	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.7	179.8	-63.9	-79.1	0	0	0	112.2	Y635 G636 I653 Y654 V666 W681	Y635-F641 CarbonylContact C-O 3.36Å; Y635-F641 VanDerWaalsContact CA-O 3.31Å; Y635-F641 WeakPolarHBondContact CA-O 3.39Å; G636-F641 PolarHBondContact N-O 3.02Å; F641-I653 HydrophobicContact CD1-CG2 3.93Å; F641-Y654 CarbonylContact C-O 3.56Å; F641-Y654 WeakPolarHBondContact CA-O 3.35Å; F641-V666 HydrophobicContact CD1-CG2 4.37Å; F641-V666 HydrophobicContact CE1-CG2 4.09Å; F641-W681 HydrophobicContact CB-CH2 3.39Å; F641-W681 HydrophobicContact CB-CZ2 3.91Å; F641-W681 HydrophobicContact CB-CZ3 4.21Å; F641-W681 HydrophobicContact CG-CH2 4.16Å
642	L	97.3	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.8	167.8	171.8	62.6	0	0	0	107.8	A601 W609 Y635 I644 I653 Y654 V656 Y663	A601-L642 HydrophobicContact CB-CD2 4.43Å; W609-L642 HydrophobicContact CE3-CD2 4.36Å; W609-L642 HydrophobicContact CH2-CD2 4.13Å; W609-L642 HydrophobicContact CZ3-CD2 3.88Å; Y635-L642 HydrophobicContact CD1-CB 4.03Å; Y635-L642 HydrophobicContact CD1-CD1 4.15Å; Y635-L642 HydrophobicContact CD2-CD1 3.89Å; Y635-L642 HydrophobicContact CE1-CB 4.04Å; Y635-L642 HydrophobicContact CE1-CD1 4.15Å; Y635-L642 HydrophobicContact CE1-CD2 4.29Å; Y635-L642 HydrophobicContact CE1-CG 4.39Å; Y635-L642 HydrophobicContact CE2-CD1 3.87Å; Y635-L642 HydrophobicContact CG-CD1 4.03Å; L642-I644 HydrophobicContact CD1-CG1 4.46Å; L642-I644 HydrophobicContact CD2-CD1 4.09Å; L642-I644 HydrophobicContact CD2-CG1 4.23Å; L642-I644 HydrophobicContact CG-CD1 4.33Å; L642-I644 HydrophobicContact CG-CG1 3.96Å; L642-I653 WeakPolarHBondContact O-CA 3.49Å; L642-Y654 PolarHBondContact N-O 2.98Å; L642-Y654 PolarHBondContact O-N 2.89Å; L642-V656 HydrophobicContact CB-CG2 3.73Å; L642-Y663 HydrophobicContact CD2-CD1 4.24Å; L642-Y663 HydrophobicContact CD2-CE1 3.86Å
643	A	97.6	Very high	96.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.7	171.6	0	0	0	0	0	109.8	R634 I651 I653 L679 W681 L688	R634-A643 PolarHBondContact N-O 2.94Å; R634-A643 PolarHBondContact O-N 2.89Å; A643-I651 HydrophobicContact CB-CG2 4.29Å; A643-I653 HydrophobicContact CB-CD1 3.73Å; A643-L679 HydrophobicContact CB-CD1 4.23Å; A643-W681 HydrophobicContact CB-CZ2 3.57Å; A643-L688 HydrophobicContact CB-CD1 4.24Å; A643-L688 HydrophobicContact CB-CD2 3.91Å
644	I	97.9	Very high	96.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.6	-179.5	-55.3	175.9	0	0	0	107.8	W609 L630 V632 M633 L642 I651 Y652 Y654	W609-I644 HydrophobicContact CD2-CD1 3.7Å; W609-I644 VanDerWaalsContact CE2-CD1 3.4Å; W609-I644 HydrophobicContact CE3-CD1 4.37Å; W609-I644 HydrophobicContact CG-CD1 3.92Å; W609-I644 HydrophobicContact CZ2-CD1 3.9Å; L630-I644 HydrophobicContact CB-CG2 4.23Å; L630-I644 HydrophobicContact CD1-CG2 4.01Å; L630-I644 HydrophobicContact CD2-CG2 3.82Å; L630-I644 HydrophobicContact CG-CG2 4.24Å; V632-I644 CarbonylContact O-C 3.58Å; V632-I644 WeakPolarHBondContact O-CA 3.23Å; M633-I644 HydrophobicContact CG-CG1 4.39Å; M633-I644 HydrophobicContact CG-CG2 4.19Å; M633-I644 HydrophobicContact SD-CD1 4.44Å; M633-I644 HydrophobicContact SD-CG1 4.32Å; M633-I644 HydrophobicContact SD-CG2 4.38Å; L642-I644 HydrophobicContact CD1-CG1 4.46Å; L642-I644 HydrophobicContact CD2-CD1 4.09Å; L642-I644 HydrophobicContact CD2-CG1 4.23Å; L642-I644 HydrophobicContact CG-CD1 4.33Å; L642-I644 HydrophobicContact CG-CG1 3.96Å; I644-I651 CarbonylContact O-C 3.57Å; I644-I651 VanDerWaalsContact O-CA 3.29Å; I644-I651 WeakPolarHBondContact O-CA 3.44Å; I644-Y652 PolarHBondContact N-O 3.18Å; I644-Y652 PolarHBondContact O-N 3.01Å; I644-Y654 HydrophobicContact CD1-CD2 4.18Å; I644-Y654 HydrophobicContact CD1-CE2 4.34Å
645	G	97	Very high	96.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.7	173.1	0	0	0	0	0	110.3	L630 S631 V632	L630-G645 CarbonylContact C-O 3.59Å; L630-G645 WeakPolarHBondContact CA-O 3.22Å; S631-G645 PolarHBondContact N-O 2.82Å; S631-G645 PolarHBondContact OG-O 3.01Å; V632-G645 PolarHBondContact N-O 2.82Å; V632-G645 PolarHBondContact O-N 2.78Å
646	S	96.8	Very high	96.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	158.4	-179.5	-179.8	0	0	0	0	111.1	Q629 D648 Y650 I676	Q629-S646 CarbonylContact O-C 3.55Å; Q629-S646 WeakPolarHBondContact O-CA 3.12Å; S646-D648 WeakPolarHBondContact CB-OD1 3.24Å; S646-D648 PolarHBondContact OG-N 3.32Å; S646-D648 PolarHBondContact OG-OD1 3.42Å; S646-D648 PolarHBondContact OG-OD2 3.38Å; S646-Y650 PolarHBondContact N-O 3.31Å; S646-Y650 VanDerWaalsContact N-O 3.13Å; S646-I676 WeakPolarHBondContact O-CG1 3.39Å; S646-I676 PolarHBondContact O-N 3.02Å
647	H	96.4	Very high	96	Very high	40 Å²	40	26.1 Å²	26.1	19%	0.185	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-10	172.7	-87.4	-140.4	0	0	0	114.2	E628 Q629 N649 F675	E628-H647 HydrophobicContact CB-CB 3.89Å; E628-H647 WeakPolarHBondContact OE2-CB 3.23Å; Q629-H647 HydrophobicContact CG-CB 3.75Å; Q629-H647 WeakPolarHBondContact CG-CD2 3.35Å; Q629-H647 WeakPolarHBondContact CG-ND1 3.19Å; Q629-H647 PolarHBondContact NE2-CE1 3.2Å; Q629-H647 PolarHBondContact NE2-NE2 3.22Å; Q629-H647 PolarHBondContact O-N 3.06Å; H647-N649 PolarHBondContact O-N 3.01Å; H647-N649 PolarHBondContact O-OD1 2.94Å; H647-F675 HydrophobicContact CB-CB 3.9Å; H647-F675 AromaticContact CE1-CD2 3.64Å; H647-F675 AromaticContact CE1-CG 3.86Å; H647-F675 AromaticContact ND1-CG 3.95Å; H647-F675 AromaticContact NE2-CD2 3.65Å
648	D	95.1	Very high	95.8	Very high	21 Å²	21	30.6 Å²	30.6	11%	0.112	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	13.3	170.2	61.6	29.7	0	0	0	114.6	E628 S646 Y650 Y652	E628-D648 HydrophobicContact CB-CB 4.48Å; E628-D648 HydrophobicContact CG-CB 4.42Å; S646-D648 WeakPolarHBondContact CB-OD1 3.24Å; S646-D648 PolarHBondContact OG-N 3.32Å; S646-D648 PolarHBondContact OG-OD1 3.42Å; S646-D648 PolarHBondContact OG-OD2 3.38Å; D648-Y650 HydrophobicContact CB-CD2 4.16Å; D648-Y650 VanDerWaalsContact O-CD2 3.23Å; D648-Y650 WeakPolarHBondContact O-CD2 3.39Å; D648-Y650 WeakPolarHBondContact O-CE2 3.39Å; D648-Y650 PolarHBondContact O-N 3.25Å; D648-Y650 VanDerWaalsContact OD1-CB 3.29Å; D648-Y650 WeakPolarHBondContact OD1-CB 3.21Å; D648-Y650 VanDerWaalsContact OD1-CD2 3.3Å; D648-Y650 WeakPolarHBondContact OD1-CD2 3.23Å; D648-Y650 PolarHBondContact OD1-N 3.31Å; D648-Y652 WeakPolarHBondContact OD2-CE2 3.39Å; D648-Y652 PolarHBondContact OD2-OH 2.95Å
649	N	95.8	Very high	95.4	Very high	52 Å²	52	33 Å²	33	28%	0.278	18%	0.176	S	C	.	.	S	Bend	trans	69.4	4.9	-177.9	-47	-14.3	0	0	0	115.3	H647 S673 S674 F675	H647-N649 PolarHBondContact O-N 3.01Å; H647-N649 PolarHBondContact O-OD1 2.94Å; N649-S673 PolarHBondContact ND2-O 3.44Å; N649-S674 VanDerWaalsContact OD1-CA 3.31Å; N649-S674 WeakPolarHBondContact OD1-CA 3.5Å; N649-S674 PolarHBondContact OD1-O 3.33Å; N649-F675 PolarHBondContact OD1-N 3.2Å
650	Y	96.5	Very high	95.1	Very high	80 Å²	80	31.7 Å²	31.7	31%	0.314	17%	0.167	S	C	.	.			trans	-100.8	155.6	177.4	-58	-69.5	0	0	0	112.6	S646 D648 K668	S646-Y650 PolarHBondContact N-O 3.31Å; S646-Y650 VanDerWaalsContact N-O 3.13Å; D648-Y650 HydrophobicContact CB-CD2 4.16Å; D648-Y650 VanDerWaalsContact O-CD2 3.23Å; D648-Y650 WeakPolarHBondContact O-CD2 3.39Å; D648-Y650 WeakPolarHBondContact O-CE2 3.39Å; D648-Y650 PolarHBondContact O-N 3.25Å; D648-Y650 VanDerWaalsContact OD1-CB 3.29Å; D648-Y650 WeakPolarHBondContact OD1-CB 3.21Å; D648-Y650 VanDerWaalsContact OD1-CD2 3.3Å; D648-Y650 WeakPolarHBondContact OD1-CD2 3.23Å; D648-Y650 PolarHBondContact OD1-N 3.31Å; Y650-K668 HydrophobicContact CD1-CD 4.03Å; Y650-K668 HydrophobicContact CE1-CD 4.29Å; Y650-K668 HydrophobicContact CG-CD 4.29Å
651	I	97.7	Very high	94.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.5	165.7	-50.1	160.6	0	0	0	107.6	A643 I644 I653 K668 C669 I676 L679 L688 W700	A643-I651 HydrophobicContact CB-CG2 4.29Å; I644-I651 CarbonylContact O-C 3.57Å; I644-I651 VanDerWaalsContact O-CA 3.29Å; I644-I651 WeakPolarHBondContact O-CA 3.44Å; I651-I653 HydrophobicContact CG2-CD1 3.94Å; I651-K668 CarbonylContact O-C 3.45Å; I651-K668 WeakPolarHBondContact O-CA 3.48Å; I651-C669 HydrophobicContact CB-CB 4.03Å; I651-C669 HydrophobicContact CD1-CB 4.48Å; I651-C669 PolarHBondContact N-O 2.89Å; I651-C669 PolarHBondContact O-N 3.04Å; I651-I676 HydrophobicContact CD1-CD1 4.27Å; I651-I676 HydrophobicContact CG1-CD1 3.88Å; I651-I676 HydrophobicContact CG1-CG1 3.9Å; I651-I676 HydrophobicContact CG1-CG2 4.46Å; I651-L679 HydrophobicContact CD1-CD2 3.61Å; I651-L679 HydrophobicContact CG1-CD2 4.04Å; I651-L679 HydrophobicContact CG2-CD1 3.86Å; I651-L679 HydrophobicContact CG2-CD2 4.34Å; I651-L688 HydrophobicContact CD1-CD2 4.45Å; I651-L688 HydrophobicContact CG2-CD2 4.07Å; I651-W700 HydrophobicContact CD1-CZ2 4.44Å
652	Y	97.8	Very high	94.8	Very high	13 Å²	13	37.5 Å²	37.5	5%	0.051	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.7	178.4	-61	-80.7	0	0	0	110.3	D625 G626 I644 D648 K668	D625-Y652 HydrophobicContact CB-CD1 3.9Å; D625-Y652 HydrophobicContact CB-CD2 3.8Å; D625-Y652 HydrophobicContact CB-CE1 3.97Å; D625-Y652 HydrophobicContact CB-CE2 3.86Å; D625-Y652 HydrophobicContact CB-CG 3.81Å; G626-Y652 PolarHBondContact N-OH 3.01Å; I644-Y652 PolarHBondContact N-O 3.18Å; I644-Y652 PolarHBondContact O-N 3.01Å; D648-Y652 WeakPolarHBondContact OD2-CE2 3.39Å; D648-Y652 PolarHBondContact OD2-OH 2.95Å; Y652-K668 HydrophobicContact CD1-CB 4.11Å; Y652-K668 HydrophobicContact CE1-CB 4.27Å
653	I	97.9	Very high	94.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	-179.9	-52.7	-58	0	0	0	109.8	F641 L642 A643 I651 V666 G667 P702	F641-I653 HydrophobicContact CD1-CG2 3.93Å; L642-I653 WeakPolarHBondContact O-CA 3.49Å; A643-I653 HydrophobicContact CB-CD1 3.73Å; I651-I653 HydrophobicContact CG2-CD1 3.94Å; I653-V666 HydrophobicContact CB-CB 4.41Å; I653-V666 HydrophobicContact CG2-CB 4.19Å; I653-V666 HydrophobicContact CG2-CG2 4.38Å; I653-V666 WeakPolarHBondContact O-CB 3.36Å; I653-V666 PolarHBondContact O-N 3.02Å; I653-G667 PolarHBondContact N-O 3.44Å; I653-G667 VanDerWaalsContact N-O 3.16Å; I653-G667 PolarHBondContact O-N 2.71Å; I653-P702 HydrophobicContact CD1-CB 4Å; I653-P702 HydrophobicContact CG1-CB 4.15Å; I653-P702 HydrophobicContact CG2-CB 3.99Å
654	Y	97.6	Very high	94.7	Very high	9 Å²	9	42.2 Å²	42.2	4%	0.035	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.8	175.4	-80.8	-97.5	0	0	0	110.5	W609 D625 F641 L642 I644 S664 R665	W609-Y654 HydrophobicContact CH2-CD1 4.27Å; W609-Y654 HydrophobicContact CH2-CE1 4.4Å; W609-Y654 HydrophobicContact CH2-CG 4.33Å; W609-Y654 HydrophobicContact CZ2-CD1 4.01Å; W609-Y654 AromaticContact CZ2-CD2 3.87Å; W609-Y654 HydrophobicContact CZ2-CD2 3.87Å; W609-Y654 AromaticContact CZ2-CE1 3.8Å; W609-Y654 HydrophobicContact CZ2-CE1 3.8Å; W609-Y654 AromaticContact CZ2-CE2 3.64Å; W609-Y654 HydrophobicContact CZ2-CE2 3.64Å; W609-Y654 HydrophobicContact CZ2-CG 4.05Å; W609-Y654 AromaticContact CZ2-CZ 3.61Å; D625-Y654 PolarHBondContact OD1-OH 2.73Å; D625-Y654 WeakPolarHBondContact OD2-CE2 3.41Å; D625-Y654 VanDerWaalsContact OD2-CZ 3.23Å; D625-Y654 PolarHBondContact OD2-OH 3.33Å; F641-Y654 CarbonylContact C-O 3.56Å; F641-Y654 WeakPolarHBondContact CA-O 3.35Å; L642-Y654 PolarHBondContact N-O 2.98Å; L642-Y654 PolarHBondContact O-N 2.89Å; I644-Y654 HydrophobicContact CD1-CD2 4.18Å; I644-Y654 HydrophobicContact CD1-CE2 4.34Å; Y654-S664 CarbonylContact C-O 3.54Å; Y654-S664 WeakPolarHBondContact CA-O 3.39Å; Y654-S664 VanDerWaalsContact CD1-C 3.5Å; Y654-R665 HydrophobicContact CD1-CB 4.06Å; Y654-R665 HydrophobicContact CE1-CB 3.54Å; Y654-R665 HydrophobicContact CE1-CG 4.18Å; Y654-R665 HydrophobicContact CE2-CB 4.49Å; Y654-R665 HydrophobicContact CE2-CG 4.25Å
655	A	96.3	Very high	94.6	Very high	33 Å²	33	47.9 Å²	47.9	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.7	164.4	0	0	0	0	0	108.3	N640 Y663 S664 V666	N640-A655 CarbonylContact O-C 3.56Å; N640-A655 WeakPolarHBondContact O-CA 3.45Å; A655-Y663 WeakPolarHBondContact O-CA 3.34Å; A655-S664 PolarHBondContact N-O 2.96Å; A655-S664 PolarHBondContact O-N 2.82Å; A655-V666 HydrophobicContact CB-CG2 3.68Å
656	V	95.6	Very high	94.5	Very high	9 Å²	9	50.6 Å²	50.6	6%	0.055	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.5	-173.5	-175.7	0	0	0	0	107.7	Y635 S639 N640 L642 G660 K662 Y663	Y635-V656 HydrophobicContact CD1-CG2 4.2Å; Y635-V656 HydrophobicContact CE1-CG1 4.18Å; Y635-V656 HydrophobicContact CE1-CG2 4.07Å; S639-V656 WeakPolarHBondContact O-CB 3.25Å; S639-V656 WeakPolarHBondContact O-CG1 3.37Å; N640-V656 PolarHBondContact O-N 2.84Å; L642-V656 HydrophobicContact CB-CG2 3.73Å; V656-G660 VanDerWaalsContact CG1-CA 3.46Å; V656-K662 WeakPolarHBondContact CA-O 3.2Å; V656-Y663 HydrophobicContact CB-CE1 4.44Å; V656-Y663 HydrophobicContact CG1-CE1 4.02Å; V656-Y663 HydrophobicContact CG2-CD1 3.89Å; V656-Y663 HydrophobicContact CG2-CE1 3.7Å
657	A	92.7	Very high	94.4	Very high	48 Å²	48	51.5 Å²	51.5	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	169.7	177.3	0	0	0	0	0	110.4	N659 G660 R661 K662	A657-N659 VanDerWaalsContact C-N 3.34Å; A657-N659 PolarHBondContact O-N 3.2Å; A657-G660 PolarHBondContact O-N 2.84Å; A657-R661 PolarHBondContact O-N 2.9Å; A657-K662 HydrophobicContact CB-CB 4.29Å; A657-K662 PolarHBondContact N-O 3.13Å; A657-K662 PolarHBondContact O-N 3.15Å; A657-K662 VanDerWaalsContact O-N 3.14Å
658	E	89.3	Confident	94.4	Very high	127 Å²	127	54 Å²	54	59%	0.593	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	47.4	175.9	-60.4	173	-155.5	0	0	112.2	G660 R661 K662	E658-G660 VanDerWaalsContact C-N 3.29Å; E658-G660 PolarHBondContact O-N 3.12Å; E658-R661 HydrophobicContact CB-CB 4.26Å; E658-R661 WeakPolarHBondContact O-CB 3.49Å; E658-R661 WeakPolarHBondContact O-CG 3.3Å; E658-R661 PolarHBondContact O-N 2.76Å; E658-R661 VanDerWaalsContact O-N 3.12Å; E658-K662 HydrophobicContact CB-CB 4.47Å; E658-K662 WeakPolarHBondContact OE1-CD 3Å; E658-K662 IonicContact OE1-NZ 3.93Å
659	N	84.9	Confident	94.4	Very high	110 Å²	110	53 Å²	53	59%	0.588	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.4	-178.5	-63	-11.1	0	0	0	113.8	A657	A657-N659 VanDerWaalsContact C-N 3.34Å; A657-N659 PolarHBondContact O-N 3.2Å
660	G	86.4	Confident	94.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	15.2	179.5	0	0	0	0	0	114.6	V656 A657 E658 Y663	V656-G660 VanDerWaalsContact CG1-CA 3.46Å; A657-G660 PolarHBondContact O-N 2.84Å; E658-G660 VanDerWaalsContact C-N 3.29Å; E658-G660 PolarHBondContact O-N 3.12Å; G660-Y663 WeakPolarHBondContact CA-OH 3.36Å; G660-Y663 WeakPolarHBondContact O-CE2 3.23Å; G660-Y663 PolarHBondContact O-OH 3.28Å
661	R	90.8	Very high	94.2	Very high	124 Å²	124	52 Å²	52	47%	0.468	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-15	175.5	-63.3	-172.6	-174.4	-89.9	-3.2	114.3	V599 D613 V620 A657 E658	V599-R661 HydrophobicContact CG1-CG 4.49Å; D613-R661 IonicContact OD2-CZ 3.42Å; D613-R661 IonicContact OD2-NH1 2.74Å; D613-R661 PolarHBondContact OD2-NH1 2.78Å; D613-R661 IonicContact OD2-NH2 2.85Å; D613-R661 PolarHBondContact OD2-NH2 2.79Å; V620-R661 HydrophobicContact CG1-CB 4.21Å; V620-R661 HydrophobicContact CG1-CG 4.37Å; A657-R661 PolarHBondContact O-N 2.9Å; E658-R661 HydrophobicContact CB-CB 4.26Å; E658-R661 WeakPolarHBondContact O-CB 3.49Å; E658-R661 WeakPolarHBondContact O-CG 3.3Å; E658-R661 PolarHBondContact O-N 2.76Å; E658-R661 VanDerWaalsContact O-N 3.12Å
662	K	93.7	Very high	94.1	Very high	120 Å²	120	52.6 Å²	52.6	52%	0.522	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.2	-179	-172	175.3	-175.4	175.2	0	111.5	V656 A657 E658	V656-K662 WeakPolarHBondContact CA-O 3.2Å; A657-K662 HydrophobicContact CB-CB 4.29Å; A657-K662 PolarHBondContact N-O 3.13Å; A657-K662 PolarHBondContact O-N 3.15Å; A657-K662 VanDerWaalsContact O-N 3.14Å; E658-K662 HydrophobicContact CB-CB 4.47Å; E658-K662 WeakPolarHBondContact OE1-CD 3Å; E658-K662 IonicContact OE1-NZ 3.93Å
663	Y	96.3	Very high	93.9	Very high	23 Å²	23	55.4 Å²	55.4	9%	0.09	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.1	-175.5	-63.7	-95.4	0	0	0	110.9	W609 V611 T621 Y635 L642 A655 V656 G660	W609-Y663 AromaticContact CH2-CD1 3.82Å; W609-Y663 HydrophobicContact CH2-CD1 3.82Å; W609-Y663 HydrophobicContact CH2-CE1 4.44Å; W609-Y663 AromaticContact CH2-CG 3.99Å; W609-Y663 HydrophobicContact CH2-CG 3.99Å; W609-Y663 HydrophobicContact CZ3-CD1 4.15Å; W609-Y663 HydrophobicContact CZ3-CE1 4.34Å; W609-Y663 HydrophobicContact CZ3-CG 4.4Å; V611-Y663 HydrophobicContact CB-CE2 4.28Å; V611-Y663 HydrophobicContact CG1-CE2 4.24Å; V611-Y663 HydrophobicContact CG2-CE1 4.34Å; V611-Y663 HydrophobicContact CG2-CE2 3.8Å; T621-Y663 HydrophobicContact CG2-CD2 3.42Å; T621-Y663 VanDerWaalsContact CG2-CD2 3.42Å; T621-Y663 HydrophobicContact CG2-CE2 3.73Å; T621-Y663 HydrophobicContact CG2-CG 4.21Å; Y635-Y663 AromaticContact CE1-CE1 3.93Å; Y635-Y663 HydrophobicContact CE1-CE1 3.93Å; Y635-Y663 PolarHBondContact OH-OH 2.61Å; L642-Y663 HydrophobicContact CD2-CD1 4.24Å; L642-Y663 HydrophobicContact CD2-CE1 3.86Å; A655-Y663 WeakPolarHBondContact O-CA 3.34Å; V656-Y663 HydrophobicContact CB-CE1 4.44Å; V656-Y663 HydrophobicContact CG1-CE1 4.02Å; V656-Y663 HydrophobicContact CG2-CD1 3.89Å; V656-Y663 HydrophobicContact CG2-CE1 3.7Å; G660-Y663 WeakPolarHBondContact CA-OH 3.36Å; G660-Y663 WeakPolarHBondContact O-CE2 3.23Å; G660-Y663 PolarHBondContact O-OH 3.28Å
664	S	95.4	Very high	93.8	Very high	76 Å²	76	56.4 Å²	56.4	53%	0.531	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.9	175.1	174.1	0	0	0	0	109.4	Y654 A655 V666	Y654-S664 CarbonylContact C-O 3.54Å; Y654-S664 WeakPolarHBondContact CA-O 3.39Å; Y654-S664 VanDerWaalsContact CD1-C 3.5Å; A655-S664 PolarHBondContact N-O 2.96Å; A655-S664 PolarHBondContact O-N 2.82Å; S664-V666 PolarHBondContact O-N 3.44Å
665	R	96.1	Very high	93.7	Very high	119 Å²	119	59.8 Å²	59.8	45%	0.449	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.7	-179.4	-172	168.9	169	175.8	-10.3	110.3	D625 Y654	D625-R665 IonicContact OD1-CZ 4Å; D625-R665 IonicContact OD1-NE 3.41Å; D625-R665 IonicContact OD1-NH1 3.48Å; D625-R665 PolarHBondContact OD1-NH1 2.88Å; Y654-R665 HydrophobicContact CD1-CB 4.06Å; Y654-R665 HydrophobicContact CE1-CB 3.54Å; Y654-R665 HydrophobicContact CE1-CG 4.18Å; Y654-R665 HydrophobicContact CE2-CB 4.49Å; Y654-R665 HydrophobicContact CE2-CG 4.25Å
666	V	95.8	Very high	93.7	Very high	58 Å²	58	58.2 Å²	58.2	35%	0.352	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-47	175.3	178.3	0	0	0	0	109.6	F641 I653 A655 S664	F641-V666 HydrophobicContact CD1-CG2 4.37Å; F641-V666 HydrophobicContact CE1-CG2 4.09Å; I653-V666 HydrophobicContact CB-CB 4.41Å; I653-V666 HydrophobicContact CG2-CB 4.19Å; I653-V666 HydrophobicContact CG2-CG2 4.38Å; I653-V666 WeakPolarHBondContact O-CB 3.36Å; I653-V666 PolarHBondContact O-N 3.02Å; A655-V666 HydrophobicContact CB-CG2 3.68Å; S664-V666 PolarHBondContact O-N 3.44Å
667	G	95.3	Very high	93.7	Very high	18 Å²	18	59.5 Å²	59.5	19%	0.186	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	-158.9	-177.2	0	0	0	0	0	113.1	I653 C705	I653-G667 PolarHBondContact N-O 3.44Å; I653-G667 VanDerWaalsContact N-O 3.16Å; I653-G667 PolarHBondContact O-N 2.71Å; G667-C705 VanDerWaalsContact C-SG 3.59Å; G667-C705 VanDerWaalsContact CA-SG 3.56Å
668	K	95.2	Very high	93.9	Very high	92 Å²	92	58.5 Å²	58.5	40%	0.4	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137	173.8	63.5	175.9	-173.5	167.5	0	109.6	Y650 I651 Y652	Y650-K668 HydrophobicContact CD1-CD 4.03Å; Y650-K668 HydrophobicContact CE1-CD 4.29Å; Y650-K668 HydrophobicContact CG-CD 4.29Å; I651-K668 CarbonylContact O-C 3.45Å; I651-K668 WeakPolarHBondContact O-CA 3.48Å; Y652-K668 HydrophobicContact CD1-CB 4.11Å; Y652-K668 HydrophobicContact CE1-CB 4.27Å
669	C	95.4	Very high	94.3	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	125.1	168.1	-63.9	0	0	0	0	108.5	I651 W700	I651-C669 HydrophobicContact CB-CB 4.03Å; I651-C669 HydrophobicContact CD1-CB 4.48Å; I651-C669 PolarHBondContact N-O 2.89Å; I651-C669 PolarHBondContact O-N 3.04Å; C669-W700 HydrophobicContact CB-CD2 3.72Å; C669-W700 HydrophobicContact CB-CE3 3.43Å; C669-W700 VanDerWaalsContact CB-CE3 3.43Å; C669-W700 HydrophobicContact CB-CG 4.36Å; C669-W700 HydrophobicContact CB-CH2 4.19Å; C669-W700 HydrophobicContact CB-CZ2 4.43Å; C669-W700 HydrophobicContact CB-CZ3 3.68Å
670	S	94.6	Very high	94.9	Very high	70 Å²	70	47.3 Å²	47.3	49%	0.49	25%	0.254	S	S	.	.			trans	-123.8	131.7	179.4	58.9	0	0	0	0	110.3	W700	S670-W700 WeakPolarHBondContact O-CH2 3.34Å
671	G	93	Very high	95.4	Very high	41 Å²	41	47.4 Å²	47.4	42%	0.423	25%	0.254	S	S	.	.			trans	163.7	-18.9	176.2	0	0	0	0	0	114.8
672	H	95.9	Very high	95.7	Very high	14 Å²	14	41.5 Å²	41.5	7%	0.065	23%	0.232	C	C	.	.			trans	-68	144.1	171.4	-82	-69.2	0	0	0	112	I676 S690 S692 E696 L698 W700	H672-I676 HydrophobicContact CB-CD1 3.97Å; H672-I676 WeakPolarHBondContact CD2-CD1 3.28Å; H672-S690 WeakPolarHBondContact NE2-CB 3.38Å; H672-S690 PolarHBondContact NE2-OG 3.09Å; H672-S692 VanDerWaalsContact ND1-CB 3.3Å; H672-S692 WeakPolarHBondContact ND1-CB 3.38Å; H672-S692 PolarHBondContact ND1-OG 2.5Å; H672-E696 IonicContact ND1-OE2 3.05Å; H672-L698 HydrophobicContact CB-CD1 4.45Å; H672-L698 VanDerWaalsContact CE1-CG 3.46Å; H672-L698 WeakPolarHBondContact CE1-CG 3.3Å; H672-W700 AromaticContact CD2-CZ2 3.79Å
673	S	94.2	Very high	95.8	Very high	71 Å²	71	39.1 Å²	39.1	50%	0.497	23%	0.227	S	C	.	.	S	Bend	trans	-86.8	-15	177.9	-56.5	0	0	0	0	113.4	N649 D694 E696	N649-S673 PolarHBondContact ND2-O 3.44Å; S673-D694 VanDerWaalsContact CB-OD2 3.29Å; S673-D694 WeakPolarHBondContact CB-OD2 3.15Å; S673-E696 PolarHBondContact N-OE2 2.93Å; S673-E696 VanDerWaalsContact N-OE2 3.09Å; S673-E696 PolarHBondContact OG-OE1 2.9Å; S673-E696 PolarHBondContact OG-OE2 2.85Å
674	S	94.9	Very high	95.7	Very high	21 Å²	21	42 Å²	42	15%	0.147	25%	0.245	C	C	.	.	S	Bend	trans	-146.1	177.9	-175.8	-172.8	0	0	0	0	111.7	N649 D694	N649-S674 VanDerWaalsContact OD1-CA 3.31Å; N649-S674 WeakPolarHBondContact OD1-CA 3.5Å; N649-S674 PolarHBondContact OD1-O 3.33Å; S674-D694 WeakPolarHBondContact CB-OD2 3.13Å
675	F	95.5	Very high	95.6	Very high	80 Å²	80	39 Å²	39	35%	0.351	22%	0.223	S	C	.	.			trans	-60.6	144.9	-173.9	54.6	-91.9	0	0	0	111.9	H647 N649 T677 S692 G693	H647-F675 HydrophobicContact CB-CB 3.9Å; H647-F675 AromaticContact CE1-CD2 3.64Å; H647-F675 AromaticContact CE1-CG 3.86Å; H647-F675 AromaticContact ND1-CG 3.95Å; H647-F675 AromaticContact NE2-CD2 3.65Å; N649-F675 PolarHBondContact OD1-N 3.2Å; F675-T677 HydrophobicContact CD2-CG2 3.84Å; F675-T677 HydrophobicContact CE2-CG2 3.66Å; F675-S692 CarbonylContact O-C 3.55Å; F675-S692 WeakPolarHBondContact O-CA 3.49Å; F675-S692 WeakPolarHBondContact O-CB 3.44Å; F675-G693 PolarHBondContact O-N 3.45Å
676	I	97.3	Very high	95.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132.2	179.1	-53.1	-56.5	0	0	0	109.8	S631 S646 I651 H672 L679	S631-I676 WeakPolarHBondContact CB-O 3.17Å; S631-I676 PolarHBondContact OG-O 3.2Å; S646-I676 WeakPolarHBondContact O-CG1 3.39Å; S646-I676 PolarHBondContact O-N 3.02Å; I651-I676 HydrophobicContact CD1-CD1 4.27Å; I651-I676 HydrophobicContact CG1-CD1 3.88Å; I651-I676 HydrophobicContact CG1-CG1 3.9Å; I651-I676 HydrophobicContact CG1-CG2 4.46Å; H672-I676 HydrophobicContact CB-CD1 3.97Å; H672-I676 WeakPolarHBondContact CD2-CD1 3.28Å; I676-L679 HydrophobicContact CG2-CD1 4.44Å; I676-L679 HydrophobicContact CG2-CD2 3.8Å; I676-L679 HydrophobicContact CG2-CG 3.98Å
677	T	95.5	Very high	95.7	Very high	37 Å²	37	37.8 Å²	37.8	23%	0.227	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-43.9	178.7	54.8	0	0	0	0	112.8	V632 F675 N691	V632-T677 WeakPolarHBondContact CG2-O 3.28Å; F675-T677 HydrophobicContact CD2-CG2 3.84Å; F675-T677 HydrophobicContact CE2-CG2 3.66Å; T677-N691 PolarHBondContact N-O 3.02Å; T677-N691 VanDerWaalsContact OG1-C 3.31Å; T677-N691 WeakPolarHBondContact OG1-CB 3.35Å; T677-N691 PolarHBondContact OG1-O 3.29Å
678	H	96.6	Very high	95.7	Very high	26 Å²	26	36.9 Å²	36.9	12%	0.12	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151	-176.6	-55.5	-67.5	0	0	0	111.6	S690 N691 T723 C724 N744	H678-S690 WeakPolarHBondContact O-CA 3.31Å; H678-N691 HydrophobicContact CB-CB 4.21Å; H678-N691 PolarHBondContact O-N 3.49Å; H678-T723 PolarHBondContact ND1-O 3.18Å; H678-C724 HydrophobicContact CB-CB 4.29Å; H678-N744 PolarHBondContact CE1-O 2.91Å
679	L	97.5	Very high	95.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	134.7	175.6	-61.9	175.5	0	0	0	109.5	V632 R634 A643 I651 I676 L688 V689 S690 T723	V632-L679 HydrophobicContact CB-CD1 4.2Å; V632-L679 HydrophobicContact CB-CG 4.33Å; V632-L679 HydrophobicContact CG1-CB 4.04Å; V632-L679 HydrophobicContact CG1-CD1 4.2Å; V632-L679 HydrophobicContact CG1-CG 4.21Å; R634-L679 PolarHBondContact NH1-O 2.84Å; R634-L679 PolarHBondContact NH2-O 3.43Å; A643-L679 HydrophobicContact CB-CD1 4.23Å; I651-L679 HydrophobicContact CD1-CD2 3.61Å; I651-L679 HydrophobicContact CG1-CD2 4.04Å; I651-L679 HydrophobicContact CG2-CD1 3.86Å; I651-L679 HydrophobicContact CG2-CD2 4.34Å; I676-L679 HydrophobicContact CG2-CD1 4.44Å; I676-L679 HydrophobicContact CG2-CD2 3.8Å; I676-L679 HydrophobicContact CG2-CG 3.98Å; L679-L688 HydrophobicContact CB-CD1 4.42Å; L679-L688 HydrophobicContact CD1-CD2 4.48Å; L679-L688 HydrophobicContact CD2-CD2 3.96Å; L679-L688 HydrophobicContact CD2-CG 4.48Å; L679-V689 WeakPolarHBondContact CA-O 3.45Å; L679-S690 VanDerWaalsContact CD2-CB 3.41Å; L679-T723 PolarHBondContact O-OG1 3.48Å
680	D	97.3	Very high	95.9	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.7	171.6	-72.6	-51.8	0	0	0	111.1	R634 L688 V689 T721 T723 C724	R634-D680 IonicContact CZ-OD1 2.84Å; R634-D680 IonicContact NH1-OD1 3.26Å; R634-D680 PolarHBondContact NH1-OD1 3.25Å; D680-L688 CarbonylContact O-C 3.49Å; D680-L688 WeakPolarHBondContact O-CA 3.48Å; D680-L688 WeakPolarHBondContact O-CD1 3.33Å; D680-V689 HydrophobicContact CB-CG1 3.61Å; D680-V689 PolarHBondContact N-O 2.9Å; D680-V689 PolarHBondContact O-N 3.09Å; D680-T721 WeakPolarHBondContact CB-O 3.36Å; D680-T721 VanDerWaalsContact OD1-C 3.32Å; D680-T721 WeakPolarHBondContact OD1-CB 3.49Å; D680-T721 PolarHBondContact OD1-OG1 2.88Å; D680-T723 VanDerWaalsContact CG-N 3.31Å; D680-T723 PolarHBondContact OD1-N 3.14Å; D680-T723 PolarHBondContact OD1-OG1 3.27Å; D680-T723 PolarHBondContact OD2-N 3.34Å; D680-C724 VanDerWaalsContact OD2-CB 3.31Å; D680-C724 WeakPolarHBondContact OD2-CB 3.33Å; D680-C724 PolarHBondContact OD2-N 3.32Å; D680-C724 PolarHBondContact OD2-SG 3.15Å; D680-C724 VanDerWaalsContact OD2-SG 3.39Å
681	W	97.2	Very high	96	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	148.9	176	-74.2	91.5	0	0	0	111.2	R634 P637 F641 A643 L688 P702 F720	R634-W681 PolarHBondContact O-NE1 3.13Å; P637-W681 HydrophobicContact CG-CB 4.31Å; F641-W681 HydrophobicContact CB-CH2 3.39Å; F641-W681 HydrophobicContact CB-CZ2 3.91Å; F641-W681 HydrophobicContact CB-CZ3 4.21Å; F641-W681 HydrophobicContact CG-CH2 4.16Å; A643-W681 HydrophobicContact CB-CZ2 3.57Å; W681-L688 HydrophobicContact CB-CD1 4.45Å; W681-L688 HydrophobicContact CD2-CD1 3.58Å; W681-L688 HydrophobicContact CE3-CD1 4.21Å; W681-L688 HydrophobicContact CG-CD1 3.68Å; W681-L688 HydrophobicContact CZ2-CD1 4.23Å; W681-P702 HydrophobicContact CE3-CG 4.32Å; W681-P702 HydrophobicContact CH2-CB 3.57Å; W681-P702 HydrophobicContact CH2-CG 3.61Å; W681-P702 HydrophobicContact CZ3-CB 3.85Å; W681-P702 HydrophobicContact CZ3-CG 3.49Å; W681-P702 VanDerWaalsContact CZ3-CG 3.49Å; W681-F720 VanDerWaalsContact O-CB 3.3Å; W681-F720 WeakPolarHBondContact O-CB 3.33Å; W681-F720 PolarHBondContact O-N 2.89Å
682	S	96.9	Very high	96.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-73.1	155.7	167.6	59.8	0	0	0	0	111.5	D684 S685 Q686 Y687	S682-D684 WeakPolarHBondContact CB-OD1 3.06Å; S682-D684 PolarHBondContact O-N 2.9Å; S682-D684 PolarHBondContact OG-OD1 3.02Å; S682-S685 PolarHBondContact O-N 2.81Å; S682-Q686 PolarHBondContact OG-N 3.36Å; S682-Y687 PolarHBondContact N-O 3.31Å; S682-Y687 PolarHBondContact OG-N 2.8Å; S682-Y687 PolarHBondContact OG-O 3.4Å
683	V	95.1	Very high	95.9	Very high	70 Å²	70	27.9 Å²	27.9	42%	0.424	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.1	179.4	175.4	0	0	0	0	112	S685 Q718 F720	V683-S685 VanDerWaalsContact C-N 3.28Å; V683-S685 PolarHBondContact O-N 3.44Å; V683-Q718 HydrophobicContact CG2-CB 4.29Å; V683-Q718 WeakPolarHBondContact CG2-O 3.24Å; V683-Q718 PolarHBondContact N-O 3.3Å; V683-F720 HydrophobicContact CG2-CB 4.26Å
684	D	94.1	Very high	95.7	Very high	84 Å²	84	26.9 Å²	26.9	45%	0.449	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.6	177.6	65.8	-1	0	0	0	114	S682 Q686	S682-D684 WeakPolarHBondContact CB-OD1 3.06Å; S682-D684 PolarHBondContact O-N 2.9Å; S682-D684 PolarHBondContact OG-OD1 3.02Å; D684-Q686 HydrophobicContact CB-CG 4.23Å; D684-Q686 PolarHBondContact O-N 3.1Å; D684-Q686 VanDerWaalsContact O-N 3.13Å; D684-Q686 PolarHBondContact OD1-N 3.37Å
685	S	95.1	Very high	95.5	Very high	12 Å²	12	27.5 Å²	27.5	8%	0.084	14%	0.143	C	C	.	.	S	Bend	trans	59.7	12.6	-176.3	-48.6	0	0	0	0	115.4	P637 D638 S682 V683	P637-S685 VanDerWaalsContact CD-OG 3.27Å; P637-S685 WeakPolarHBondContact CD-OG 3.22Å; D638-S685 WeakPolarHBondContact CB-OG 3.5Å; D638-S685 VanDerWaalsContact CG-CB 3.5Å; D638-S685 PolarHBondContact N-OG 3.45Å; D638-S685 VanDerWaalsContact N-OG 3.13Å; S682-S685 PolarHBondContact O-N 2.81Å; V683-S685 VanDerWaalsContact C-N 3.28Å; V683-S685 PolarHBondContact O-N 3.44Å
686	Q	95.4	Very high	95.4	Very high	109 Å²	109	26.6 Å²	26.6	51%	0.509	14%	0.14	S	C	.	.	S	Bend	trans	-88.1	-27.1	-177	-62.3	-170.5	15.3	0	0	113.7	S682 D684 P702	S682-Q686 PolarHBondContact OG-N 3.36Å; D684-Q686 HydrophobicContact CB-CG 4.23Å; D684-Q686 PolarHBondContact O-N 3.1Å; D684-Q686 VanDerWaalsContact O-N 3.13Å; D684-Q686 PolarHBondContact OD1-N 3.37Å; Q686-P702 VanDerWaalsContact O-CD 3.23Å; Q686-P702 WeakPolarHBondContact O-CD 3.5Å
687	Y	96.7	Very high	95.3	Very high	43 Å²	43	27.9 Å²	27.9	17%	0.169	15%	0.146	C	C	.	.			trans	-125.8	153.7	-172.5	-59.9	-81.8	0	0	0	111.7	S682 W700 I701 V708 I717	S682-Y687 PolarHBondContact N-O 3.31Å; S682-Y687 PolarHBondContact OG-N 2.8Å; S682-Y687 PolarHBondContact OG-O 3.4Å; Y687-W700 VanDerWaalsContact CA-O 3.29Å; Y687-W700 WeakPolarHBondContact CA-O 3.45Å; Y687-I701 HydrophobicContact CD1-CG1 3.83Å; Y687-I701 HydrophobicContact CE1-CD1 4.09Å; Y687-I701 HydrophobicContact CE1-CG1 3.66Å; Y687-V708 HydrophobicContact CD1-CG2 4.19Å; Y687-V708 HydrophobicContact CE1-CG2 4.11Å; Y687-I717 HydrophobicContact CD1-CD1 4.01Å; Y687-I717 HydrophobicContact CD2-CD1 3.81Å; Y687-I717 HydrophobicContact CD2-CG1 4.45Å; Y687-I717 HydrophobicContact CE2-CD1 4.33Å; Y687-I717 HydrophobicContact CG-CD1 3.63Å
688	L	97.1	Very high	95.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.9	173.8	-166.3	79.1	0	0	0	108.8	A643 I651 L679 D680 W681 Y699 W700 P702	A643-L688 HydrophobicContact CB-CD1 4.24Å; A643-L688 HydrophobicContact CB-CD2 3.91Å; I651-L688 HydrophobicContact CD1-CD2 4.45Å; I651-L688 HydrophobicContact CG2-CD2 4.07Å; L679-L688 HydrophobicContact CB-CD1 4.42Å; L679-L688 HydrophobicContact CD1-CD2 4.48Å; L679-L688 HydrophobicContact CD2-CD2 3.96Å; L679-L688 HydrophobicContact CD2-CG 4.48Å; D680-L688 CarbonylContact O-C 3.49Å; D680-L688 WeakPolarHBondContact O-CA 3.48Å; D680-L688 WeakPolarHBondContact O-CD1 3.33Å; W681-L688 HydrophobicContact CB-CD1 4.45Å; W681-L688 HydrophobicContact CD2-CD1 3.58Å; W681-L688 HydrophobicContact CE3-CD1 4.21Å; W681-L688 HydrophobicContact CG-CD1 3.68Å; W681-L688 HydrophobicContact CZ2-CD1 4.23Å; L688-Y699 CarbonylContact O-C 3.57Å; L688-Y699 VanDerWaalsContact O-CA 3.3Å; L688-Y699 WeakPolarHBondContact O-CA 3.45Å; L688-W700 HydrophobicContact CB-CB 4.3Å; L688-W700 PolarHBondContact N-O 3.04Å; L688-W700 PolarHBondContact O-N 3.22Å; L688-P702 HydrophobicContact CB-CG 3.76Å
689	V	97.2	Very high	95.4	Very high	8 Å²	8	27.7 Å²	27.7	5%	0.048	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	150.2	165.2	62.5	0	0	0	0	109.1	L679 D680 I697 L698 Y699 W719	L679-V689 WeakPolarHBondContact CA-O 3.45Å; D680-V689 HydrophobicContact CB-CG1 3.61Å; D680-V689 PolarHBondContact N-O 2.9Å; D680-V689 PolarHBondContact O-N 3.09Å; V689-I697 HydrophobicContact CG2-CG2 3.7Å; V689-L698 WeakPolarHBondContact CA-O 3.5Å; V689-Y699 HydrophobicContact CB-CD1 3.92Å; V689-Y699 HydrophobicContact CB-CE1 3.96Å; V689-Y699 HydrophobicContact CG2-CD1 3.91Å; V689-Y699 HydrophobicContact CG2-CE1 3.6Å; V689-W719 HydrophobicContact CB-CD2 4.41Å; V689-W719 HydrophobicContact CB-CE3 4.16Å; V689-W719 HydrophobicContact CB-CH2 3.55Å; V689-W719 HydrophobicContact CB-CZ2 3.79Å; V689-W719 HydrophobicContact CB-CZ3 3.73Å; V689-W719 HydrophobicContact CG1-CD2 3.81Å; V689-W719 HydrophobicContact CG1-CE3 3.62Å; V689-W719 HydrophobicContact CG1-CH2 3.96Å; V689-W719 HydrophobicContact CG1-CZ2 4.11Å; V689-W719 HydrophobicContact CG1-CZ3 3.7Å; V689-W719 VanDerWaalsContact N-CZ3 3.31Å
690	S	97.1	Very high	95.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142.3	-175.8	55	0	0	0	0	111.2	H672 H678 L679 I697 L698 W700	H672-S690 WeakPolarHBondContact NE2-CB 3.38Å; H672-S690 PolarHBondContact NE2-OG 3.09Å; H678-S690 WeakPolarHBondContact O-CA 3.31Å; L679-S690 VanDerWaalsContact CD2-CB 3.41Å; S690-I697 WeakPolarHBondContact O-CA 3.46Å; S690-L698 PolarHBondContact N-O 3.46Å; S690-L698 PolarHBondContact O-N 3.18Å; S690-L698 VanDerWaalsContact O-N 3.12Å; S690-L698 PolarHBondContact OG-O 2.93Å; S690-W700 PolarHBondContact OG-NE1 3.05Å
691	N	96.1	Very high	95.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.3	170.1	-62.3	161.9	0	0	0	109.9	T677 H678 E696 C724 T725 L726	T677-N691 PolarHBondContact N-O 3.02Å; T677-N691 VanDerWaalsContact OG1-C 3.31Å; T677-N691 WeakPolarHBondContact OG1-CB 3.35Å; T677-N691 PolarHBondContact OG1-O 3.29Å; H678-N691 HydrophobicContact CB-CB 4.21Å; H678-N691 PolarHBondContact O-N 3.49Å; N691-E696 WeakPolarHBondContact CA-O 3.32Å; N691-C724 VanDerWaalsContact OD1-CA 3.24Å; N691-C724 WeakPolarHBondContact OD1-CA 3.21Å; N691-C724 WeakPolarHBondContact OD1-CB 3.27Å; N691-T725 PolarHBondContact OD1-N 3.1Å; N691-L726 HydrophobicContact CB-CD1 4.44Å; N691-L726 PolarHBondContact ND2-O 3.23Å; N691-L726 PolarHBondContact OD1-N 3.05Å
692	S	94.7	Very high	95.2	Very high	2 Å²	2	30 Å²	30	1%	0.014	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	166.1	176	65.7	0	0	0	0	112.4	H672 F675 D694 Y695 E696	H672-S692 VanDerWaalsContact ND1-CB 3.3Å; H672-S692 WeakPolarHBondContact ND1-CB 3.38Å; H672-S692 PolarHBondContact ND1-OG 2.5Å; F675-S692 CarbonylContact O-C 3.55Å; F675-S692 WeakPolarHBondContact O-CA 3.49Å; F675-S692 WeakPolarHBondContact O-CB 3.44Å; S692-D694 PolarHBondContact O-N 3.07Å; S692-D694 VanDerWaalsContact O-N 3.15Å; S692-Y695 PolarHBondContact O-N 3.25Å; S692-E696 PolarHBondContact N-O 3.02Å; S692-E696 PolarHBondContact OG-N 2.84Å
693	G	92	Very high	95	Very high	18 Å²	18	32.9 Å²	32.9	19%	0.186	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-14.5	173.9	0	0	0	0	0	114.6	F675 Y695	F675-G693 PolarHBondContact O-N 3.45Å; G693-Y695 VanDerWaalsContact C-N 3.29Å
694	D	90.6	Very high	95	Very high	51 Å²	51	33.5 Å²	33.5	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	4.8	173	-94	-34.6	0	0	0	113.6	R194 S673 S674 S692 E696	R194-D694 IonicContact CZ-OD1 3.77Å; R194-D694 IonicContact NH1-OD1 2.99Å; R194-D694 PolarHBondContact NH1-OD1 2.97Å; S673-D694 VanDerWaalsContact CB-OD2 3.29Å; S673-D694 WeakPolarHBondContact CB-OD2 3.15Å; S674-D694 WeakPolarHBondContact CB-OD2 3.13Å; S692-D694 PolarHBondContact O-N 3.07Å; S692-D694 VanDerWaalsContact O-N 3.15Å; D694-E696 VanDerWaalsContact C-N 3.34Å; D694-E696 HydrophobicContact CB-CG 4.14Å
695	Y	91.6	Very high	95	Very high	34 Å²	34	30.6 Å²	30.6	13%	0.133	17%	0.165	C	C	.	.			trans	67.5	30.7	-179.4	-40.3	-41.7	0	0	0	113.7	L191 S692 G693 D739 G740	L191-Y695 HydrophobicContact CB-CD2 4.13Å; L191-Y695 HydrophobicContact CB-CE2 4.21Å; L191-Y695 HydrophobicContact CD1-CG 4.32Å; S692-Y695 PolarHBondContact O-N 3.25Å; G693-Y695 VanDerWaalsContact C-N 3.29Å; Y695-D739 PolarHBondContact OH-OD1 2.84Å; Y695-G740 PolarHBondContact OH-N 3.13Å
696	E	91.8	Very high	95	Very high	60 Å²	60	36.8 Å²	36.8	28%	0.28	19%	0.19	S	C	.	.			trans	-89.9	140.7	177.7	-56	177.8	134.3	0	0	110.9	H672 S673 N691 S692 D694 L698	H672-E696 IonicContact ND1-OE2 3.05Å; S673-E696 PolarHBondContact N-OE2 2.93Å; S673-E696 VanDerWaalsContact N-OE2 3.09Å; S673-E696 PolarHBondContact OG-OE1 2.9Å; S673-E696 PolarHBondContact OG-OE2 2.85Å; N691-E696 WeakPolarHBondContact CA-O 3.32Å; S692-E696 PolarHBondContact N-O 3.02Å; S692-E696 PolarHBondContact OG-N 2.84Å; D694-E696 VanDerWaalsContact C-N 3.34Å; D694-E696 HydrophobicContact CB-CG 4.14Å; E696-L698 HydrophobicContact CB-CG 4.47Å
697	I	95.5	Very high	95	Very high	27 Å²	27	35.4 Å²	35.4	14%	0.138	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	105.6	172.5	-53.1	173	0	0	0	107.7	V196 M198 V689 S690 Y699 L726	V196-I697 HydrophobicContact CG1-CD1 4.05Å; V196-I697 HydrophobicContact CG1-CG1 4.41Å; M198-I697 HydrophobicContact CG-CD1 3.73Å; V689-I697 HydrophobicContact CG2-CG2 3.7Å; S690-I697 WeakPolarHBondContact O-CA 3.46Å; I697-Y699 HydrophobicContact CG2-CE1 4.44Å; I697-Y699 HydrophobicContact CG2-CE2 4.23Å; I697-L726 HydrophobicContact CD1-CB 3.97Å; I697-L726 HydrophobicContact CG1-CB 3.91Å
698	L	96.6	Very high	94.9	Very high	25 Å²	25	34.2 Å²	34.2	13%	0.131	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	148	179.1	-57	-170.8	0	0	0	111.4	H672 V689 S690 E696 W700	H672-L698 HydrophobicContact CB-CD1 4.45Å; H672-L698 VanDerWaalsContact CE1-CG 3.46Å; H672-L698 WeakPolarHBondContact CE1-CG 3.3Å; V689-L698 WeakPolarHBondContact CA-O 3.5Å; S690-L698 PolarHBondContact N-O 3.46Å; S690-L698 PolarHBondContact O-N 3.18Å; S690-L698 VanDerWaalsContact O-N 3.12Å; S690-L698 PolarHBondContact OG-O 2.93Å; E696-L698 HydrophobicContact CB-CG 4.47Å; L698-W700 HydrophobicContact CB-CZ2 3.88Å; L698-W700 HydrophobicContact CD1-CH2 4.25Å; L698-W700 HydrophobicContact CD1-CZ2 3.74Å; L698-W700 HydrophobicContact CG-CZ2 4.48Å
699	Y	97.2	Very high	94.8	Very high	34 Å²	34	39.7 Å²	39.7	13%	0.133	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146	179.9	-54.9	-83.6	0	0	0	110.8	L688 V689 I697 Q707 V708 T714 W719	L688-Y699 CarbonylContact O-C 3.57Å; L688-Y699 VanDerWaalsContact O-CA 3.3Å; L688-Y699 WeakPolarHBondContact O-CA 3.45Å; V689-Y699 HydrophobicContact CB-CD1 3.92Å; V689-Y699 HydrophobicContact CB-CE1 3.96Å; V689-Y699 HydrophobicContact CG2-CD1 3.91Å; V689-Y699 HydrophobicContact CG2-CE1 3.6Å; I697-Y699 HydrophobicContact CG2-CE1 4.44Å; I697-Y699 HydrophobicContact CG2-CE2 4.23Å; Y699-Q707 CarbonylContact O-C 3.56Å; Y699-Q707 WeakPolarHBondContact O-CA 3.41Å; Y699-Q707 WeakPolarHBondContact O-CG 3.29Å; Y699-V708 PolarHBondContact O-N 2.9Å; Y699-T714 HydrophobicContact CD1-CG2 4.03Å; Y699-T714 HydrophobicContact CD2-CG2 3.71Å; Y699-T714 HydrophobicContact CE2-CG2 4.39Å; Y699-T714 HydrophobicContact CG-CG2 3.5Å; Y699-W719 AromaticContact CD1-CH2 3.73Å; Y699-W719 HydrophobicContact CD1-CH2 3.73Å; Y699-W719 AromaticContact CD1-CZ2 3.67Å; Y699-W719 HydrophobicContact CD1-CZ2 3.67Å; Y699-W719 HydrophobicContact CE1-CH2 4.07Å; Y699-W719 AromaticContact CE1-CZ2 3.52Å; Y699-W719 HydrophobicContact CE1-CZ2 3.52Å
700	W	97.4	Very high	94.5	Very high	2 Å²	2	42 Å²	42	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154	-174.1	-48.8	90.4	0	0	0	111.7	I651 C669 S670 H672 Y687 L688 S690 L698 P702 K706 Q707	I651-W700 HydrophobicContact CD1-CZ2 4.44Å; C669-W700 HydrophobicContact CB-CD2 3.72Å; C669-W700 HydrophobicContact CB-CE3 3.43Å; C669-W700 VanDerWaalsContact CB-CE3 3.43Å; C669-W700 HydrophobicContact CB-CG 4.36Å; C669-W700 HydrophobicContact CB-CH2 4.19Å; C669-W700 HydrophobicContact CB-CZ2 4.43Å; C669-W700 HydrophobicContact CB-CZ3 3.68Å; S670-W700 WeakPolarHBondContact O-CH2 3.34Å; H672-W700 AromaticContact CD2-CZ2 3.79Å; Y687-W700 VanDerWaalsContact CA-O 3.29Å; Y687-W700 WeakPolarHBondContact CA-O 3.45Å; L688-W700 HydrophobicContact CB-CB 4.3Å; L688-W700 PolarHBondContact N-O 3.04Å; L688-W700 PolarHBondContact O-N 3.22Å; S690-W700 PolarHBondContact OG-NE1 3.05Å; L698-W700 HydrophobicContact CB-CZ2 3.88Å; L698-W700 HydrophobicContact CD1-CH2 4.25Å; L698-W700 HydrophobicContact CD1-CZ2 3.74Å; L698-W700 HydrophobicContact CG-CZ2 4.48Å; W700-P702 WeakPolarHBondContact O-CD 3.43Å; W700-K706 CarbonylContact C-O 3.51Å; W700-K706 WeakPolarHBondContact CA-O 3.15Å; W700-Q707 HydrophobicContact CE3-CB 3.77Å; W700-Q707 HydrophobicContact CE3-CG 4.2Å; W700-Q707 HydrophobicContact CH2-CB 4.2Å; W700-Q707 HydrophobicContact CH2-CG 4.18Å; W700-Q707 HydrophobicContact CZ3-CB 3.54Å; W700-Q707 HydrophobicContact CZ3-CG 3.98Å
701	I	96.7	Very high	94.2	Very high	50 Å²	50	43.9 Å²	43.9	26%	0.256	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	102.6	161.1	-63.5	162.9	0	0	0	106.9	Y687 S703 V704 C705 K706 V708	Y687-I701 HydrophobicContact CD1-CG1 3.83Å; Y687-I701 HydrophobicContact CE1-CD1 4.09Å; Y687-I701 HydrophobicContact CE1-CG1 3.66Å; I701-S703 VanDerWaalsContact C-N 3.31Å; I701-S703 WeakPolarHBondContact CG2-OG 3.36Å; I701-S703 PolarHBondContact O-N 2.9Å; I701-V704 HydrophobicContact CB-CG2 3.93Å; I701-V704 HydrophobicContact CG2-CG2 3.75Å; I701-V704 PolarHBondContact O-N 2.8Å; I701-C705 PolarHBondContact O-N 3.17Å; I701-K706 PolarHBondContact N-O 2.87Å; I701-K706 PolarHBondContact O-N 3.01Å; I701-V708 HydrophobicContact CD1-CG2 3.67Å; I701-V708 HydrophobicContact CG1-CG2 3.5Å
702	P	93.6	Very high	93.8	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.7	-34.9	-172.2	-29.5	41.2	0	0	0	113.8	I653 W681 Q686 L688 W700 V704 C705	I653-P702 HydrophobicContact CD1-CB 4Å; I653-P702 HydrophobicContact CG1-CB 4.15Å; I653-P702 HydrophobicContact CG2-CB 3.99Å; W681-P702 HydrophobicContact CE3-CG 4.32Å; W681-P702 HydrophobicContact CH2-CB 3.57Å; W681-P702 HydrophobicContact CH2-CG 3.61Å; W681-P702 HydrophobicContact CZ3-CB 3.85Å; W681-P702 HydrophobicContact CZ3-CG 3.49Å; W681-P702 VanDerWaalsContact CZ3-CG 3.49Å; Q686-P702 VanDerWaalsContact O-CD 3.23Å; Q686-P702 WeakPolarHBondContact O-CD 3.5Å; L688-P702 HydrophobicContact CB-CG 3.76Å; W700-P702 WeakPolarHBondContact O-CD 3.43Å; P702-V704 PolarHBondContact O-N 3.21Å; P702-V704 VanDerWaalsContact O-N 3.16Å; P702-C705 PolarHBondContact O-N 2.98Å; P702-C705 VanDerWaalsContact O-N 3.17Å; P702-C705 PolarHBondContact O-SG 2.84Å; P702-C705 VanDerWaalsContact O-SG 3.38Å
703	S	93.7	Very high	93.6	Very high	61 Å²	61	53.1 Å²	53.1	43%	0.427	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-60.1	-28.1	-178.3	60.6	0	0	0	0	114	I701	I701-S703 VanDerWaalsContact C-N 3.31Å; I701-S703 WeakPolarHBondContact CG2-OG 3.36Å; I701-S703 PolarHBondContact O-N 2.9Å
704	V	94.7	Very high	93.5	Very high	83 Å²	83	52.4 Å²	52.4	50%	0.503	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-116.4	-0.5	176.9	-62.2	0	0	0	0	113.2	I701 P702 K706	I701-V704 HydrophobicContact CB-CG2 3.93Å; I701-V704 HydrophobicContact CG2-CG2 3.75Å; I701-V704 PolarHBondContact O-N 2.8Å; P702-V704 PolarHBondContact O-N 3.21Å; P702-V704 VanDerWaalsContact O-N 3.16Å; V704-K706 VanDerWaalsContact C-N 3.3Å; V704-K706 HydrophobicContact CB-CG 4.5Å; V704-K706 HydrophobicContact CG2-CB 3.95Å; V704-K706 HydrophobicContact CG2-CD 4.31Å; V704-K706 HydrophobicContact CG2-CG 4.03Å; V704-K706 PolarHBondContact O-N 2.82Å
705	C	94.3	Very high	93.6	Very high	23 Å²	23	52 Å²	52	16%	0.155	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.4	-177.2	-64.2	0	0	0	0	113.6	G667 I701 P702	G667-C705 VanDerWaalsContact C-SG 3.59Å; G667-C705 VanDerWaalsContact CA-SG 3.56Å; I701-C705 PolarHBondContact O-N 3.17Å; P702-C705 PolarHBondContact O-N 2.98Å; P702-C705 VanDerWaalsContact O-N 3.17Å; P702-C705 PolarHBondContact O-SG 2.84Å; P702-C705 VanDerWaalsContact O-SG 3.38Å
706	K	94.8	Very high	93.6	Very high	141 Å²	141	53.5 Å²	53.5	61%	0.613	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.9	179.2	-69.1	-172.5	178.5	-178.6	0	112.2	W700 I701 V704	W700-K706 CarbonylContact C-O 3.51Å; W700-K706 WeakPolarHBondContact CA-O 3.15Å; I701-K706 PolarHBondContact N-O 2.87Å; I701-K706 PolarHBondContact O-N 3.01Å; V704-K706 VanDerWaalsContact C-N 3.3Å; V704-K706 HydrophobicContact CB-CG 4.5Å; V704-K706 HydrophobicContact CG2-CB 3.95Å; V704-K706 HydrophobicContact CG2-CD 4.31Å; V704-K706 HydrophobicContact CG2-CG 4.03Å; V704-K706 PolarHBondContact O-N 2.82Å
707	Q	95.9	Very high	93.7	Very high	80 Å²	80	51.9 Å²	51.9	37%	0.374	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.5	174.6	-165.1	-179.3	0.4	0	0	111.1	Y699 W700 V709	Y699-Q707 CarbonylContact O-C 3.56Å; Y699-Q707 WeakPolarHBondContact O-CA 3.41Å; Y699-Q707 WeakPolarHBondContact O-CG 3.29Å; W700-Q707 HydrophobicContact CE3-CB 3.77Å; W700-Q707 HydrophobicContact CE3-CG 4.2Å; W700-Q707 HydrophobicContact CH2-CB 4.2Å; W700-Q707 HydrophobicContact CH2-CG 4.18Å; W700-Q707 HydrophobicContact CZ3-CB 3.54Å; W700-Q707 HydrophobicContact CZ3-CG 3.98Å; Q707-V709 HydrophobicContact CG-CG2 4.27Å
708	V	95	Very high	93.6	Very high	19 Å²	19	57.5 Å²	57.5	12%	0.115	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	114.6	170.5	-173	0	0	0	0	108.5	Y687 Y699 I701 T714	Y687-V708 HydrophobicContact CD1-CG2 4.19Å; Y687-V708 HydrophobicContact CE1-CG2 4.11Å; Y699-V708 PolarHBondContact O-N 2.9Å; I701-V708 HydrophobicContact CD1-CG2 3.67Å; I701-V708 HydrophobicContact CG1-CG2 3.5Å; V708-T714 HydrophobicContact CB-CG2 4.06Å; V708-T714 HydrophobicContact CG1-CG2 3.61Å
709	V	93.5	Very high	93.5	Very high	115 Å²	115	57.7 Å²	57.7	70%	0.697	30%	0.304	S	S	*	.			trans	-100.1	-14	-179.6	-169.8	0	0	0	0	111.5	Q707 V711	Q707-V709 HydrophobicContact CG-CG2 4.27Å; V709-V711 PolarHBondContact O-N 2.89Å; V709-V711 VanDerWaalsContact O-N 3.12Å
710	S	92.3	Very high	93.3	Very high	56 Å²	56	61.3 Å²	61.3	39%	0.392	32%	0.32	S	S	.	.			trans	-70	106.5	179.7	178.7	0	0	0	0	111.5	E712 T713 T714	S710-E712 VanDerWaalsContact C-N 3.3Å; S710-E712 PolarHBondContact O-N 3.12Å; S710-T713 WeakPolarHBondContact CB-OG1 3.33Å; S710-T713 PolarHBondContact O-N 2.82Å; S710-T713 PolarHBondContact OG-OG1 3.13Å; S710-T714 PolarHBondContact O-N 2.82Å; S710-T714 PolarHBondContact O-OG1 2.91Å
711	V	89.9	Confident	93.1	Very high	40 Å²	40	63 Å²	63	24%	0.242	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-34.7	178.4	-176.6	0	0	0	0	112.2	F199 V709 T713 T714 R715	F199-V711 HydrophobicContact CB-CG1 3.98Å; F199-V711 HydrophobicContact CD1-CG1 3.32Å; F199-V711 HydrophobicContact CD2-CG1 3.61Å; F199-V711 HydrophobicContact CD2-CG2 4.3Å; F199-V711 HydrophobicContact CE1-CG1 3.58Å; F199-V711 HydrophobicContact CE1-CG2 4.34Å; F199-V711 HydrophobicContact CE2-CG1 3.84Å; F199-V711 HydrophobicContact CE2-CG2 3.81Å; F199-V711 HydrophobicContact CG-CG1 3.33Å; F199-V711 HydrophobicContact CZ-CG1 3.83Å; F199-V711 HydrophobicContact CZ-CG2 3.83Å; V709-V711 PolarHBondContact O-N 2.89Å; V709-V711 VanDerWaalsContact O-N 3.12Å; V711-T713 PolarHBondContact O-N 2.9Å; V711-T714 PolarHBondContact O-N 2.82Å; V711-R715 VanDerWaalsContact CG1-NH2 3.29Å; V711-R715 VanDerWaalsContact O-CB 3.31Å; V711-R715 WeakPolarHBondContact O-CB 3.31Å; V711-R715 VanDerWaalsContact O-CG 3.28Å; V711-R715 WeakPolarHBondContact O-CG 2.65Å; V711-R715 PolarHBondContact O-N 3.01Å; V711-R715 PolarHBondContact O-NE 2.88Å
712	E	88.3	Confident	92.9	Very high	133 Å²	133	61.3 Å²	61.3	62%	0.621	32%	0.322	S	S	*	.	H	α-helix	trans	-63.8	-28.8	178.2	-65.8	-175.4	-179.1	0	0	112.4	S710	S710-E712 VanDerWaalsContact C-N 3.3Å; S710-E712 PolarHBondContact O-N 3.12Å
713	T	89.8	Confident	93	Very high	62 Å²	62	62.2 Å²	62.2	38%	0.38	33%	0.327	S	S	.	.	H	α-helix	trans	-81.7	-40.1	176.8	-50.5	0	0	0	0	111	S710 V711 I717	S710-T713 WeakPolarHBondContact CB-OG1 3.33Å; S710-T713 PolarHBondContact O-N 2.82Å; S710-T713 PolarHBondContact OG-OG1 3.13Å; V711-T713 PolarHBondContact O-N 2.9Å; T713-I717 WeakPolarHBondContact O-CG1 3.26Å
714	T	91.4	Very high	93.1	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-87.5	-26.1	-169.4	56.6	0	0	0	0	114.7	Y699 V708 S710 V711 D716 I717	Y699-T714 HydrophobicContact CD1-CG2 4.03Å; Y699-T714 HydrophobicContact CD2-CG2 3.71Å; Y699-T714 HydrophobicContact CE2-CG2 4.39Å; Y699-T714 HydrophobicContact CG-CG2 3.5Å; V708-T714 HydrophobicContact CB-CG2 4.06Å; V708-T714 HydrophobicContact CG1-CG2 3.61Å; S710-T714 PolarHBondContact O-N 2.82Å; S710-T714 PolarHBondContact O-OG1 2.91Å; V711-T714 PolarHBondContact O-N 2.82Å; T714-D716 VanDerWaalsContact C-N 3.31Å; T714-D716 PolarHBondContact O-N 2.87Å; T714-I717 HydrophobicContact CG2-CD1 4.19Å; T714-I717 PolarHBondContact O-N 2.84Å
715	R	90.9	Very high	93	Very high	42 Å²	42	56 Å²	56	16%	0.158	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.4	-175.4	71.6	175.1	66.9	-162.4	0.6	114.8	E184 F199 V711	E184-R715 PolarHBondContact O-NH1 3.4Å; E184-R715 PolarHBondContact O-NH2 3.16Å; F199-R715 HydrophobicContact CB-CB 4.03Å; V711-R715 VanDerWaalsContact CG1-NH2 3.29Å; V711-R715 VanDerWaalsContact O-CB 3.31Å; V711-R715 WeakPolarHBondContact O-CB 3.31Å; V711-R715 VanDerWaalsContact O-CG 3.28Å; V711-R715 WeakPolarHBondContact O-CG 2.65Å; V711-R715 PolarHBondContact O-N 3.01Å; V711-R715 PolarHBondContact O-NE 2.88Å
716	D	91.9	Very high	93	Very high	66 Å²	66	55.2 Å²	55.2	35%	0.353	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	5.6	-175.7	-63.5	-52.6	0	0	0	112.4	P201 K202 T714 Q718	P201-D716 WeakPolarHBondContact CA-OD1 3.32Å; P201-D716 WeakPolarHBondContact CB-OD1 3.3Å; K202-D716 PolarHBondContact N-OD1 3.36Å; T714-D716 VanDerWaalsContact C-N 3.31Å; T714-D716 PolarHBondContact O-N 2.87Å; D716-Q718 PolarHBondContact O-N 3.21Å
717	I	94.2	Very high	92.9	Very high	26 Å²	26	49.3 Å²	49.3	13%	0.133	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-66.9	131.7	178.3	-63.7	177.1	0	0	0	109.8	Y687 T713 T714 W719	Y687-I717 HydrophobicContact CD1-CD1 4.01Å; Y687-I717 HydrophobicContact CD2-CD1 3.81Å; Y687-I717 HydrophobicContact CD2-CG1 4.45Å; Y687-I717 HydrophobicContact CE2-CD1 4.33Å; Y687-I717 HydrophobicContact CG-CD1 3.63Å; T713-I717 WeakPolarHBondContact O-CG1 3.26Å; T714-I717 HydrophobicContact CG2-CD1 4.19Å; T714-I717 PolarHBondContact O-N 2.84Å; I717-W719 HydrophobicContact CB-CH2 4.33Å; I717-W719 HydrophobicContact CB-CZ2 3.85Å; I717-W719 HydrophobicContact CD1-CH2 4.15Å; I717-W719 HydrophobicContact CD1-CZ2 4.22Å; I717-W719 HydrophobicContact CG2-CD2 4.12Å; I717-W719 HydrophobicContact CG2-CE3 4.22Å; I717-W719 HydrophobicContact CG2-CH2 3.79Å; I717-W719 HydrophobicContact CG2-CZ2 3.69Å; I717-W719 HydrophobicContact CG2-CZ3 4.08Å
718	Q	93.6	Very high	92.8	Very high	145 Å²	145	46 Å²	46	68%	0.678	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-88.1	116.4	170.4	-64.4	-172.4	-2.7	0	0	110.2	V683 D716	V683-Q718 HydrophobicContact CG2-CB 4.29Å; V683-Q718 WeakPolarHBondContact CG2-O 3.24Å; V683-Q718 PolarHBondContact N-O 3.3Å; D716-Q718 PolarHBondContact O-N 3.21Å
719	W	94.7	Very high	92.6	Very high	30 Å²	30	46.7 Å²	46.7	11%	0.114	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-80.5	141.4	177	-54.6	101.8	0	0	0	111.1	V689 Y699 I717 T721 K752	V689-W719 HydrophobicContact CB-CD2 4.41Å; V689-W719 HydrophobicContact CB-CE3 4.16Å; V689-W719 HydrophobicContact CB-CH2 3.55Å; V689-W719 HydrophobicContact CB-CZ2 3.79Å; V689-W719 HydrophobicContact CB-CZ3 3.73Å; V689-W719 HydrophobicContact CG1-CD2 3.81Å; V689-W719 HydrophobicContact CG1-CE3 3.62Å; V689-W719 HydrophobicContact CG1-CH2 3.96Å; V689-W719 HydrophobicContact CG1-CZ2 4.11Å; V689-W719 HydrophobicContact CG1-CZ3 3.7Å; V689-W719 VanDerWaalsContact N-CZ3 3.31Å; Y699-W719 AromaticContact CD1-CH2 3.73Å; Y699-W719 HydrophobicContact CD1-CH2 3.73Å; Y699-W719 AromaticContact CD1-CZ2 3.67Å; Y699-W719 HydrophobicContact CD1-CZ2 3.67Å; Y699-W719 HydrophobicContact CE1-CH2 4.07Å; Y699-W719 AromaticContact CE1-CZ2 3.52Å; Y699-W719 HydrophobicContact CE1-CZ2 3.52Å; I717-W719 HydrophobicContact CB-CH2 4.33Å; I717-W719 HydrophobicContact CB-CZ2 3.85Å; I717-W719 HydrophobicContact CD1-CH2 4.15Å; I717-W719 HydrophobicContact CD1-CZ2 4.22Å; I717-W719 HydrophobicContact CG2-CD2 4.12Å; I717-W719 HydrophobicContact CG2-CE3 4.22Å; I717-W719 HydrophobicContact CG2-CH2 3.79Å; I717-W719 HydrophobicContact CG2-CZ2 3.69Å; I717-W719 HydrophobicContact CG2-CZ3 4.08Å; W719-T721 WeakPolarHBondContact CB-O 3.28Å; W719-K752 PolarHBondContact O-NZ 2.86Å
720	F	93.4	Very high	92.6	Very high	110 Å²	110	41.4 Å²	41.4	48%	0.482	22%	0.215	S	C	.	.	S	Bend	trans	-72.7	-54.3	176.3	-179.6	-107	0	0	0	109.9	P637 W681 V683	P637-F720 HydrophobicContact CB-CD2 4.21Å; P637-F720 HydrophobicContact CB-CE2 4.33Å; P637-F720 HydrophobicContact CB-CG 4.31Å; P637-F720 HydrophobicContact CG-CB 3.83Å; P637-F720 HydrophobicContact CG-CD1 3.76Å; P637-F720 HydrophobicContact CG-CD2 3.89Å; P637-F720 HydrophobicContact CG-CE1 4.3Å; P637-F720 HydrophobicContact CG-CE2 4.41Å; P637-F720 HydrophobicContact CG-CG 3.54Å; W681-F720 VanDerWaalsContact O-CB 3.3Å; W681-F720 WeakPolarHBondContact O-CB 3.33Å; W681-F720 PolarHBondContact O-N 2.89Å; V683-F720 HydrophobicContact CG2-CB 4.26Å
721	T	92.5	Very high	92.6	Very high	37 Å²	37	38.8 Å²	38.8	23%	0.227	20%	0.197	C	C	.	.			trans	-110.5	157	175.6	53	0	0	0	0	110.5	R634 D680 W719	R634-T721 PolarHBondContact NH1-OG1 3.06Å; D680-T721 WeakPolarHBondContact CB-O 3.36Å; D680-T721 VanDerWaalsContact OD1-C 3.32Å; D680-T721 WeakPolarHBondContact OD1-CB 3.49Å; D680-T721 PolarHBondContact OD1-OG1 2.88Å; W719-T721 WeakPolarHBondContact CB-O 3.28Å
722	H	93.3	Very high	92.5	Very high	15 Å²	15	37 Å²	37	7%	0.069	19%	0.186	C	C	.	.			trans	-127.2	84.3	172	-64.7	82	0	0	0	108.9	V730 C747 A748 Y769	H722-V730 HydrophobicContact CB-CG1 4.35Å; H722-C747 CarbonylContact O-C 3.46Å; H722-C747 VanDerWaalsContact O-CA 3.32Å; H722-C747 WeakPolarHBondContact O-CA 3.28Å; H722-A748 HydrophobicContact CB-CB 3.78Å; H722-A748 PolarHBondContact O-N 2.91Å; H722-Y769 HydrophobicContact CB-CE2 4.45Å; H722-Y769 AromaticContact CD2-CE2 3.94Å; H722-Y769 AromaticContact CE1-CZ 3.81Å; H722-Y769 PolarHBondContact CE1-OH 3.38Å; H722-Y769 AromaticContact CG-CE2 3.89Å; H722-Y769 AromaticContact NE2-CZ 3.83Å; H722-Y769 PolarHBondContact NE2-OH 3.08Å
723	T	94.7	Very high	92.7	Very high	19 Å²	19	31 Å²	31	12%	0.117	16%	0.158	C	C	.	.			trans	-113.3	-18.3	175.9	65.6	0	0	0	0	113.3	R634 H678 L679 D680 T725 A746	R634-T723 VanDerWaalsContact CZ-OG1 3.27Å; R634-T723 PolarHBondContact NH1-OG1 2.81Å; R634-T723 PolarHBondContact NH2-OG1 3.3Å; H678-T723 PolarHBondContact ND1-O 3.18Å; L679-T723 PolarHBondContact O-OG1 3.48Å; D680-T723 VanDerWaalsContact CG-N 3.31Å; D680-T723 PolarHBondContact OD1-N 3.14Å; D680-T723 PolarHBondContact OD1-OG1 3.27Å; D680-T723 PolarHBondContact OD2-N 3.34Å; T723-T725 PolarHBondContact O-N 3.49Å; T723-A746 WeakPolarHBondContact CA-O 3.44Å; T723-A746 WeakPolarHBondContact CB-O 3.41Å
724	C	95.5	Very high	92.7	Very high	8 Å²	8	28.3 Å²	28.3	5%	0.054	14%	0.141	C	C	.	.			trans	-57.9	122.5	165.7	-77.5	0	0	0	0	109.7	H678 D680 N691 L726 V730	H678-C724 HydrophobicContact CB-CB 4.29Å; D680-C724 VanDerWaalsContact OD2-CB 3.31Å; D680-C724 WeakPolarHBondContact OD2-CB 3.33Å; D680-C724 PolarHBondContact OD2-N 3.32Å; D680-C724 PolarHBondContact OD2-SG 3.15Å; D680-C724 VanDerWaalsContact OD2-SG 3.39Å; N691-C724 VanDerWaalsContact OD1-CA 3.24Å; N691-C724 WeakPolarHBondContact OD1-CA 3.21Å; N691-C724 WeakPolarHBondContact OD1-CB 3.27Å; C724-L726 VanDerWaalsContact C-N 3.3Å; C724-V730 WeakPolarHBondContact O-CG2 3.16Å
725	T	94.4	Very high	92.4	Very high	6 Å²	6	31.9 Å²	31.9	4%	0.037	16%	0.164	C	C	.	.	S	Bend	trans	-78	-18.5	175.9	53.6	0	0	0	0	112	N691 T723 W734 I743 A746	N691-T725 PolarHBondContact OD1-N 3.1Å; T723-T725 PolarHBondContact O-N 3.49Å; T725-W734 PolarHBondContact O-NE1 2.9Å; T725-I743 HydrophobicContact CG2-CG2 3.94Å; T725-A746 HydrophobicContact CG2-CB 4.01Å
726	L	93.7	Very high	91.8	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	18%	0.176	C	C	.	.	S	Bend	trans	-107.9	110.1	177.2	-52.8	176.2	0	0	0	110.3	M189 L191 N691 I697 C724 W734	M189-L726 HydrophobicContact CE-CD2 4.13Å; L191-L726 HydrophobicContact CD1-CD2 3.68Å; N691-L726 HydrophobicContact CB-CD1 4.44Å; N691-L726 PolarHBondContact ND2-O 3.23Å; N691-L726 PolarHBondContact OD1-N 3.05Å; I697-L726 HydrophobicContact CD1-CB 3.97Å; I697-L726 HydrophobicContact CG1-CB 3.91Å; C724-L726 VanDerWaalsContact C-N 3.3Å; L726-W734 HydrophobicContact CD2-CZ2 3.74Å
727	G	93.3	Very high	91.1	Very high	17 Å²	17	32.4 Å²	32.4	18%	0.175	18%	0.18	C	C	.	.	S	Bend	trans	175.6	156.7	177.3	0	0	0	0	0	112.4	Q729 V730 F731	G727-Q729 VanDerWaalsContact C-N 3.3Å; G727-Q729 PolarHBondContact O-N 3.31Å; G727-V730 VanDerWaalsContact O-CG2 3.26Å; G727-V730 WeakPolarHBondContact O-CG2 3.48Å; G727-V730 PolarHBondContact O-N 3.36Å; G727-V730 VanDerWaalsContact O-N 3.15Å; G727-F731 WeakPolarHBondContact O-CB 3.31Å; G727-F731 PolarHBondContact O-N 3.48Å
728	F	92.8	Very high	90.5	Very high	11 Å²	11	31.4 Å²	31.4	5%	0.048	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-33.1	-175.3	175.7	-97.2	0	0	0	113.7	V187 M198 F199 M200 Y208 V730 F731 S772	V187-F728 HydrophobicContact CB-CD2 4.33Å; V187-F728 HydrophobicContact CB-CE2 4.44Å; V187-F728 HydrophobicContact CG2-CD2 4.13Å; V187-F728 HydrophobicContact CG2-CE2 3.76Å; M198-F728 HydrophobicContact CB-CB 4.1Å; F199-F728 WeakPolarHBondContact O-CB 3.36Å; M200-F728 HydrophobicContact CB-CD1 3.53Å; M200-F728 HydrophobicContact CB-CD2 3.76Å; M200-F728 HydrophobicContact CB-CE1 3.47Å; M200-F728 VanDerWaalsContact CB-CE1 3.47Å; M200-F728 HydrophobicContact CB-CE2 3.7Å; M200-F728 HydrophobicContact CB-CG 3.67Å; M200-F728 HydrophobicContact CB-CZ 3.54Å; M200-F728 HydrophobicContact CE-CD2 4.23Å; M200-F728 HydrophobicContact CE-CE2 3.56Å; M200-F728 HydrophobicContact CE-CZ 4Å; M200-F728 HydrophobicContact CG-CZ 4.41Å; M200-F728 HydrophobicContact SD-CE2 4.23Å; M200-F728 HydrophobicContact SD-CZ 4.08Å; Y208-F728 HydrophobicContact CD2-CE2 4.34Å; Y208-F728 AromaticContact CD2-CZ 3.81Å; Y208-F728 HydrophobicContact CD2-CZ 3.81Å; Y208-F728 AromaticContact CE2-CE2 3.89Å; Y208-F728 HydrophobicContact CE2-CE2 3.89Å; Y208-F728 AromaticContact CE2-CZ 3.63Å; Y208-F728 HydrophobicContact CE2-CZ 3.63Å; Y208-F728 AromaticContact CZ-CE2 3.99Å; F728-V730 PolarHBondContact O-N 3.07Å; F728-F731 HydrophobicContact CD2-CD1 4.43Å; F728-F731 HydrophobicContact CD2-CE1 4.17Å; F728-F731 HydrophobicContact CE2-CE1 4.21Å; F728-F731 VanDerWaalsContact O-CD1 3.3Å; F728-F731 WeakPolarHBondContact O-CD1 3.5Å; F728-S772 WeakPolarHBondContact O-CB 3.42Å; F728-S772 PolarHBondContact O-OG 3Å
729	Q	91.9	Very high	89.9	Confident	33 Å²	33	26 Å²	26	15%	0.154	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.4	-179.6	-60.7	-60.4	-15.4	0	0	113.6	G727 Y769 C771 S772	G727-Q729 VanDerWaalsContact C-N 3.3Å; G727-Q729 PolarHBondContact O-N 3.31Å; Q729-Y769 HydrophobicContact CB-CE2 4.2Å; Q729-C771 CarbonylContact O-C 3.52Å; Q729-C771 PolarHBondContact O-N 2.93Å; Q729-S772 WeakPolarHBondContact CA-OG 3.38Å; Q729-S772 PolarHBondContact OE1-OG 3.41Å
730	V	93.1	Very high	89.3	Confident	4 Å²	4	25.2 Å²	25.2	2%	0.024	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-17.4	-167.9	-62.6	0	0	0	0	113.5	H722 C724 G727 F728 G732 L733 L755 C771	H722-V730 HydrophobicContact CB-CG1 4.35Å; C724-V730 WeakPolarHBondContact O-CG2 3.16Å; G727-V730 VanDerWaalsContact O-CG2 3.26Å; G727-V730 WeakPolarHBondContact O-CG2 3.48Å; G727-V730 PolarHBondContact O-N 3.36Å; G727-V730 VanDerWaalsContact O-N 3.15Å; F728-V730 PolarHBondContact O-N 3.07Å; V730-G732 PolarHBondContact O-N 2.95Å; V730-L733 HydrophobicContact CB-CD2 3.78Å; V730-L733 HydrophobicContact CG2-CD2 4.21Å; V730-L733 WeakPolarHBondContact O-CB 3.22Å; V730-L733 WeakPolarHBondContact O-CD2 3.29Å; V730-L733 WeakPolarHBondContact O-CG 3.36Å; V730-L733 PolarHBondContact O-N 3.07Å; V730-L755 HydrophobicContact CB-CD2 4.17Å; V730-L755 HydrophobicContact CG1-CD1 4.11Å; V730-L755 HydrophobicContact CG1-CD2 4.09Å; V730-C771 CarbonylContact C-O 3.59Å; V730-C771 VanDerWaalsContact C-O 3.23Å
731	F	92.3	Very high	89	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-57.8	-21	-167.9	84.1	-87.4	0	0	0	115.7	V187 M189 M198 Y208 G727 F728 L733 W734 C771 S772 F774	V187-F731 HydrophobicContact CG1-CE1 4.34Å; V187-F731 HydrophobicContact CG1-CE2 4.08Å; V187-F731 HydrophobicContact CG1-CZ 3.91Å; M189-F731 HydrophobicContact CE-CB 4.34Å; M189-F731 HydrophobicContact SD-CB 4.28Å; M189-F731 HydrophobicContact SD-CD2 4.29Å; M198-F731 HydrophobicContact CE-CB 3.53Å; M198-F731 HydrophobicContact CE-CD1 4.15Å; M198-F731 HydrophobicContact CE-CD2 4.03Å; M198-F731 HydrophobicContact CE-CG 3.64Å; M198-F731 HydrophobicContact SD-CB 3.47Å; M198-F731 WeakPolarHBondContact SD-CB 3.38Å; M198-F731 HydrophobicContact SD-CG 4.15Å; Y208-F731 WeakPolarHBondContact OH-CZ 3.28Å; G727-F731 WeakPolarHBondContact O-CB 3.31Å; G727-F731 PolarHBondContact O-N 3.48Å; F728-F731 HydrophobicContact CD2-CD1 4.43Å; F728-F731 HydrophobicContact CD2-CE1 4.17Å; F728-F731 HydrophobicContact CE2-CE1 4.21Å; F728-F731 VanDerWaalsContact O-CD1 3.3Å; F728-F731 WeakPolarHBondContact O-CD1 3.5Å; F731-L733 PolarHBondContact O-N 2.67Å; F731-L733 VanDerWaalsContact O-N 3.09Å; F731-W734 PolarHBondContact O-N 3.46Å; F731-C771 PolarHBondContact N-O 3.27Å; F731-S772 WeakPolarHBondContact CE1-O 3.44Å; F731-S772 WeakPolarHBondContact CZ-O 3Å; F731-F774 HydrophobicContact CE2-CB 4.47Å
732	G	87.9	Confident	88.8	Confident	3 Å²	3	22.9 Å²	22.9	3%	0.031	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-61.3	-13.1	174.2	0	0	0	0	0	114.1	V730 W734 C771 Q773 A776	V730-G732 PolarHBondContact O-N 2.95Å; G732-W734 VanDerWaalsContact C-N 3.25Å; G732-W734 PolarHBondContact O-N 3.06Å; G732-C771 VanDerWaalsContact C-SG 3.51Å; G732-C771 WeakPolarHBondContact CA-O 3.49Å; G732-C771 PolarHBondContact N-O 3.31Å; G732-Q773 WeakPolarHBondContact CA-O 3.42Å; G732-A776 WeakPolarHBondContact O-CB 3.47Å
733	L	91	Very high	88.8	Confident	5 Å²	5	22.6 Å²	22.6	3%	0.026	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-64	-26.4	173.6	64.1	87.2	0	0	0	114	V730 F731 P735 I743 A746 L755 T757 F767	V730-L733 HydrophobicContact CB-CD2 3.78Å; V730-L733 HydrophobicContact CG2-CD2 4.21Å; V730-L733 WeakPolarHBondContact O-CB 3.22Å; V730-L733 WeakPolarHBondContact O-CD2 3.29Å; V730-L733 WeakPolarHBondContact O-CG 3.36Å; V730-L733 PolarHBondContact O-N 3.07Å; F731-L733 PolarHBondContact O-N 2.67Å; F731-L733 VanDerWaalsContact O-N 3.09Å; L733-P735 VanDerWaalsContact O-CD 3.31Å; L733-P735 WeakPolarHBondContact O-CD 3.49Å; L733-I743 HydrophobicContact CB-CD1 4.49Å; L733-I743 HydrophobicContact CD1-CB 4.36Å; L733-I743 HydrophobicContact CD1-CD1 3.25Å; L733-I743 HydrophobicContact CD1-CG1 4.36Å; L733-I743 HydrophobicContact CD1-CG2 4.12Å; L733-I743 HydrophobicContact CG-CD1 4.43Å; L733-I743 VanDerWaalsContact O-CD1 3.31Å; L733-I743 WeakPolarHBondContact O-CD1 3.36Å; L733-A746 HydrophobicContact CD2-CB 4.29Å; L733-L755 HydrophobicContact CD2-CD2 4.46Å; L733-T757 HydrophobicContact CB-CG2 3.8Å; L733-T757 HydrophobicContact CD1-CG2 4.47Å; L733-T757 HydrophobicContact CD2-CG2 3.96Å; L733-T757 HydrophobicContact CG-CG2 4.31Å; L733-F767 HydrophobicContact CB-CE2 4.44Å
734	W	90.3	Very high	88.8	Confident	7 Å²	7	23 Å²	23	3%	0.027	15%	0.147	C	C	.	.	S	Bend	trans	-80	120.8	-174.9	-67.4	95.9	0	0	0	110.8	M189 L191 T725 L726 F731 G732 D739 G740 D742 I743	M189-W734 VanDerWaalsContact CE-CD1 3.48Å; M189-W734 HydrophobicContact CE-CG 4.02Å; M189-W734 HydrophobicContact SD-CB 3.9Å; M189-W734 HydrophobicContact SD-CG 3.93Å; L191-W734 HydrophobicContact CD1-CZ2 4.49Å; L191-W734 HydrophobicContact CD2-CD2 4.11Å; L191-W734 HydrophobicContact CD2-CE3 4.08Å; L191-W734 HydrophobicContact CD2-CG 4.4Å; T725-W734 PolarHBondContact O-NE1 2.9Å; L726-W734 HydrophobicContact CD2-CZ2 3.74Å; F731-W734 PolarHBondContact O-N 3.46Å; G732-W734 VanDerWaalsContact C-N 3.25Å; G732-W734 PolarHBondContact O-N 3.06Å; W734-D739 WeakPolarHBondContact CZ3-O 3.37Å; W734-G740 WeakPolarHBondContact CH2-O 3.3Å; W734-D742 HydrophobicContact CZ3-CB 4.49Å; W734-I743 HydrophobicContact CD2-CD1 4.1Å; W734-I743 HydrophobicContact CE3-CB 4.39Å; W734-I743 HydrophobicContact CE3-CD1 3.84Å; W734-I743 HydrophobicContact CE3-CG1 4.14Å; W734-I743 HydrophobicContact CH2-CB 3.88Å; W734-I743 HydrophobicContact CZ2-CB 4.43Å; W734-I743 HydrophobicContact CZ3-CB 3.84Å; W734-I743 HydrophobicContact CZ3-CD1 4.18Å; W734-I743 HydrophobicContact CZ3-CG1 3.98Å
735	P	84.8	Confident	88.8	Confident	77 Å²	77	22.9 Å²	22.9	50%	0.5	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-63.5	162.9	172.8	-21.6	33.2	0	0	0	112.5	L733 G737 S738	L733-P735 VanDerWaalsContact O-CD 3.31Å; L733-P735 WeakPolarHBondContact O-CD 3.49Å; P735-G737 PolarHBondContact O-N 3.15Å; P735-S738 WeakPolarHBondContact O-CB 3.46Å; P735-S738 PolarHBondContact O-N 3.48Å
736	D	79.5	Confident	88.9	Confident	76 Å²	76	22.7 Å²	22.7	41%	0.406	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	127.3	174	-70.6	-4.7	0	0	0	111.2	S738 F774 R775	D736-S738 PolarHBondContact O-N 2.63Å; D736-F774 WeakPolarHBondContact OD1-CE2 3.39Å; D736-F774 WeakPolarHBondContact OD1-CZ 3.37Å; D736-R775 VanDerWaalsContact CG-NE 3.27Å; D736-R775 VanDerWaalsContact OD1-CG 3.26Å; D736-R775 WeakPolarHBondContact OD1-CG 3.23Å; D736-R775 IonicContact OD1-CZ 3.45Å; D736-R775 IonicContact OD1-NE 2.69Å; D736-R775 PolarHBondContact OD1-NE 3.24Å; D736-R775 IonicContact OD1-NH2 3.79Å; D736-R775 IonicContact OD2-CZ 3.01Å; D736-R775 IonicContact OD2-NE 3.99Å; D736-R775 PolarHBondContact OD2-NE 3.28Å; D736-R775 IonicContact OD2-NH2 3.78Å; D736-R775 PolarHBondContact OD2-NH2 3.21Å
737	G	76.6	Confident	89	Confident	43 Å²	43	23 Å²	23	44%	0.443	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	12.8	175.9	0	0	0	0	0	115.1	P735	P735-G737 PolarHBondContact O-N 3.15Å
738	S	81.6	Confident	89.1	Confident	5 Å²	5	22.7 Å²	22.7	4%	0.035	14%	0.144	C	C	.	.			trans	-60.8	144.5	-179.8	-169.8	0	0	0	0	112.4	P735 D736 D742	P735-S738 WeakPolarHBondContact O-CB 3.46Å; P735-S738 PolarHBondContact O-N 3.48Å; D736-S738 PolarHBondContact O-N 2.63Å; S738-D742 WeakPolarHBondContact CA-OD2 3.36Å; S738-D742 WeakPolarHBondContact CB-OD2 3.29Å; S738-D742 VanDerWaalsContact OG-CB 3.31Å; S738-D742 WeakPolarHBondContact OG-CB 3.44Å; S738-D742 PolarHBondContact OG-OD2 2.69Å
739	D	81.9	Confident	89.2	Confident	31 Å²	31	22.3 Å²	22.3	17%	0.166	14%	0.143	C	C	.	.			trans	-79.8	145.5	165.4	-167.4	7.3	0	0	0	109.5	K192 Y695 W734 T741 D742	K192-D739 WeakPolarHBondContact CD-OD1 3.25Å; K192-D739 WeakPolarHBondContact CE-OD1 3.38Å; K192-D739 WeakPolarHBondContact CE-OD2 3.16Å; K192-D739 IonicContact NZ-OD1 3.17Å; K192-D739 PolarHBondContact NZ-OD1 3.24Å; K192-D739 IonicContact NZ-OD2 2.67Å; K192-D739 PolarHBondContact NZ-OD2 3.1Å; Y695-D739 PolarHBondContact OH-OD1 2.84Å; W734-D739 WeakPolarHBondContact CZ3-O 3.37Å; D739-T741 PolarHBondContact O-N 2.72Å; D739-T741 PolarHBondContact OD2-OG1 2.8Å; D739-D742 WeakPolarHBondContact CB-OD1 3.18Å; D739-D742 PolarHBondContact N-OD2 3.4Å; D739-D742 WeakPolarHBondContact O-CB 3.37Å; D739-D742 PolarHBondContact O-N 2.91Å
740	G	81.4	Confident	89.2	Confident	14 Å²	14	25.5 Å²	25.5	14%	0.144	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	1.4	179.5	0	0	0	0	0	114.5	Y695 W734	Y695-G740 PolarHBondContact OH-N 3.13Å; W734-G740 WeakPolarHBondContact CH2-O 3.3Å
741	T	86.9	Confident	89.1	Confident	68 Å²	68	30.1 Å²	30.1	42%	0.417	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-12.8	171.3	60	0	0	0	0	113.2	D739 I743	D739-T741 PolarHBondContact O-N 2.72Å; D739-T741 PolarHBondContact OD2-OG1 2.8Å; T741-I743 PolarHBondContact O-N 2.81Å; T741-I743 VanDerWaalsContact O-N 3.08Å
742	D	88.4	Confident	89	Confident	30 Å²	30	33.5 Å²	33.5	16%	0.16	20%	0.2	C	C	.	.	S	Bend	trans	-62.8	-22.7	-173.8	-69.7	-20.3	0	0	0	112.8	W734 S738 D739 D759 D760 F761	W734-D742 HydrophobicContact CZ3-CB 4.49Å; S738-D742 WeakPolarHBondContact CA-OD2 3.36Å; S738-D742 WeakPolarHBondContact CB-OD2 3.29Å; S738-D742 VanDerWaalsContact OG-CB 3.31Å; S738-D742 WeakPolarHBondContact OG-CB 3.44Å; S738-D742 PolarHBondContact OG-OD2 2.69Å; D739-D742 WeakPolarHBondContact CB-OD1 3.18Å; D739-D742 PolarHBondContact N-OD2 3.4Å; D739-D742 WeakPolarHBondContact O-CB 3.37Å; D739-D742 PolarHBondContact O-N 2.91Å; D742-D759 CarbonylContact O-C 3.57Å; D742-D759 WeakPolarHBondContact O-CA 3.29Å; D742-D759 WeakPolarHBondContact O-CB 3.37Å; D742-D760 PolarHBondContact O-N 2.68Å; D742-F761 HydrophobicContact CB-CE2 4.29Å
743	I	93.4	Very high	89.2	Confident	9 Å²	9	35.5 Å²	35.5	5%	0.046	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	112.7	-179.5	-61.1	176.8	0	0	0	108.9	T725 L733 W734 T741 T757	T725-I743 HydrophobicContact CG2-CG2 3.94Å; L733-I743 HydrophobicContact CB-CD1 4.49Å; L733-I743 HydrophobicContact CD1-CB 4.36Å; L733-I743 HydrophobicContact CD1-CD1 3.25Å; L733-I743 HydrophobicContact CD1-CG1 4.36Å; L733-I743 HydrophobicContact CD1-CG2 4.12Å; L733-I743 HydrophobicContact CG-CD1 4.43Å; L733-I743 VanDerWaalsContact O-CD1 3.31Å; L733-I743 WeakPolarHBondContact O-CD1 3.36Å; W734-I743 HydrophobicContact CD2-CD1 4.1Å; W734-I743 HydrophobicContact CE3-CB 4.39Å; W734-I743 HydrophobicContact CE3-CD1 3.84Å; W734-I743 HydrophobicContact CE3-CG1 4.14Å; W734-I743 HydrophobicContact CH2-CB 3.88Å; W734-I743 HydrophobicContact CZ2-CB 4.43Å; W734-I743 HydrophobicContact CZ3-CB 3.84Å; W734-I743 HydrophobicContact CZ3-CD1 4.18Å; W734-I743 HydrophobicContact CZ3-CG1 3.98Å; T741-I743 PolarHBondContact O-N 2.81Å; T741-I743 VanDerWaalsContact O-N 3.08Å; I743-T757 HydrophobicContact CG2-CG2 4.25Å
744	N	94.8	Very high	89.4	Confident	29 Å²	29	35.7 Å²	35.7	16%	0.155	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-31.3	-175.6	-65.9	-56.5	0	0	0	113	H678 G758 D760 V788	H678-N744 PolarHBondContact CE1-O 2.91Å; N744-G758 PolarHBondContact N-O 2.89Å; N744-D760 PolarHBondContact ND2-OD1 3.46Å; N744-D760 PolarHBondContact OD1-OD1 3.23Å; N744-V788 VanDerWaalsContact CB-O 3.29Å; N744-V788 WeakPolarHBondContact CB-O 3.4Å; N744-V788 PolarHBondContact ND2-O 3.35Å
745	A	95.4	Very high	89.7	Confident	4 Å²	4	35.3 Å²	35.3	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	146.2	-174.3	0	0	0	0	0	111.9	T757 G758 V791	A745-T757 VanDerWaalsContact O-CA 3.23Å; A745-T757 WeakPolarHBondContact O-CA 3.42Å; A745-T757 WeakPolarHBondContact O-CB 3.33Å; A745-G758 PolarHBondContact O-N 3.21Å; A745-V791 HydrophobicContact CB-CG2 3.86Å
746	A	96.5	Very high	90.3	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.4	169	0	0	0	0	0	109.5	T723 T725 L733 V756 T757	T723-A746 WeakPolarHBondContact CA-O 3.44Å; T723-A746 WeakPolarHBondContact CB-O 3.41Å; T725-A746 HydrophobicContact CG2-CB 4.01Å; L733-A746 HydrophobicContact CD2-CB 4.29Å; A746-V756 CarbonylContact C-O 3.58Å; A746-V756 VanDerWaalsContact CA-O 3.25Å; A746-V756 WeakPolarHBondContact CA-O 3.3Å; A746-T757 HydrophobicContact CB-CG2 3.99Å
747	C	96.1	Very high	91.1	Very high	13 Å²	13	28.1 Å²	28.1	9%	0.088	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	132.9	171.3	-172.9	0	0	0	0	109.3	H722 V756 V791 F793	H722-C747 CarbonylContact O-C 3.46Å; H722-C747 VanDerWaalsContact O-CA 3.32Å; H722-C747 WeakPolarHBondContact O-CA 3.28Å; C747-V756 HydrophobicContact CB-CG1 3.82Å; C747-V756 PolarHBondContact N-O 2.81Å; C747-V756 WeakPolarHBondContact O-CG1 3.29Å; C747-V756 PolarHBondContact O-N 2.99Å; C747-V791 HydrophobicContact CB-CG2 4.35Å; C747-V791 WeakPolarHBondContact CB-O 3.37Å; C747-F793 HydrophobicContact CB-CD2 4.38Å; C747-F793 WeakPolarHBondContact O-CE2 3.32Å
748	A	95.4	Very high	92	Very high	11 Å²	11	26.1 Å²	26.1	9%	0.091	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	149.5	167.1	0	0	0	0	0	110.2	H722 L754 L755 Y769	H722-A748 HydrophobicContact CB-CB 3.78Å; H722-A748 PolarHBondContact O-N 2.91Å; A748-L754 WeakPolarHBondContact CA-O 3.23Å; A748-L755 HydrophobicContact CB-CD1 4.13Å; A748-Y769 HydrophobicContact CB-CD2 4.01Å; A748-Y769 HydrophobicContact CB-CE2 4.26Å
749	S	95	Very high	92.5	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.021	15%	0.151	C	C	.	.			trans	-63.4	157.8	171.9	56.9	0	0	0	0	111.4	D751 K752 S753 L754	S749-D751 VanDerWaalsContact C-N 3.27Å; S749-D751 VanDerWaalsContact CB-OD1 3.26Å; S749-D751 WeakPolarHBondContact CB-OD1 3.46Å; S749-D751 PolarHBondContact O-N 2.97Å; S749-D751 PolarHBondContact OG-OD1 3.34Å; S749-K752 PolarHBondContact O-N 3.33Å; S749-S753 PolarHBondContact OG-N 3.16Å; S749-S753 VanDerWaalsContact OG-N 3.16Å; S749-L754 PolarHBondContact N-O 2.66Å; S749-L754 PolarHBondContact OG-N 2.85Å; S749-L754 PolarHBondContact OG-O 2.96Å
750	N	91.2	Very high	92.9	Very high	99 Å²	99	26.7 Å²	26.7	53%	0.529	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-33.8	-178	-61.9	-66.2	0	0	0	111.7	K752 L794 D797	N750-K752 PolarHBondContact O-N 3.37Å; N750-L794 PolarHBondContact ND2-O 2.99Å; N750-D797 WeakPolarHBondContact CB-OD2 3.44Å; N750-D797 PolarHBondContact N-OD1 2.92Å; N750-D797 PolarHBondContact N-OD2 3.44Å; N750-D797 PolarHBondContact ND2-OD1 3.33Å
751	D	90.9	Very high	93.3	Very high	102 Å²	102	29.8 Å²	29.8	55%	0.545	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.8	172.9	76.4	-13.2	0	0	0	114.6	S749 S753 D797	S749-D751 VanDerWaalsContact C-N 3.27Å; S749-D751 VanDerWaalsContact CB-OD1 3.26Å; S749-D751 WeakPolarHBondContact CB-OD1 3.46Å; S749-D751 PolarHBondContact O-N 2.97Å; S749-D751 PolarHBondContact OG-OD1 3.34Å; D751-S753 VanDerWaalsContact C-N 3.3Å; D751-S753 PolarHBondContact O-N 2.92Å; D751-S753 WeakPolarHBondContact OD1-CB 3.49Å; D751-S753 PolarHBondContact OD1-N 2.84Å; D751-S753 PolarHBondContact OD1-OG 2.92Å; D751-S753 WeakPolarHBondContact OD2-CB 3.37Å; D751-S753 PolarHBondContact OD2-OG 2.95Å; D751-D797 PolarHBondContact N-OD2 2.95Å; D751-D797 VanDerWaalsContact N-OD2 3.08Å
752	K	90.3	Very high	93.4	Very high	72 Å²	72	26.7 Å²	26.7	31%	0.313	14%	0.143	S	C	.	.	S	Bend	trans	58.1	35.2	-176.8	-54.2	-179.4	176.2	-174	0	113.7	W719 S749 N750 Y769	W719-K752 PolarHBondContact O-NZ 2.86Å; S749-K752 PolarHBondContact O-N 3.33Å; N750-K752 PolarHBondContact O-N 3.37Å; K752-Y769 HydrophobicContact CB-CD1 3.96Å; K752-Y769 HydrophobicContact CB-CE1 4.03Å; K752-Y769 WeakPolarHBondContact O-CD1 3.39Å
753	S	92.6	Very high	93.6	Very high	46 Å²	46	26.9 Å²	26.9	32%	0.322	14%	0.143	S	C	.	.	S	Bend	trans	-98.4	-26.1	173.3	70	0	0	0	0	113.5	S749 D751 Y769	S749-S753 PolarHBondContact OG-N 3.16Å; S749-S753 VanDerWaalsContact OG-N 3.16Å; D751-S753 VanDerWaalsContact C-N 3.3Å; D751-S753 PolarHBondContact O-N 2.92Å; D751-S753 WeakPolarHBondContact OD1-CB 3.49Å; D751-S753 PolarHBondContact OD1-N 2.84Å; D751-S753 PolarHBondContact OD1-OG 2.92Å; D751-S753 WeakPolarHBondContact OD2-CB 3.37Å; D751-S753 PolarHBondContact OD2-OG 2.95Å; S753-Y769 PolarHBondContact O-N 3.45Å
754	L	95.6	Very high	93.7	Very high	8 Å²	8	26.5 Å²	26.5	4%	0.042	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	152.4	-174.7	-60.7	173.7	0	0	0	111.4	P217 N219 A748 S749 L766 F793 I815	P217-L754 HydrophobicContact CB-CD2 3.61Å; N219-L754 HydrophobicContact CB-CD1 4.04Å; N219-L754 HydrophobicContact CB-CD2 4.3Å; A748-L754 WeakPolarHBondContact CA-O 3.23Å; S749-L754 PolarHBondContact N-O 2.66Å; S749-L754 PolarHBondContact OG-N 2.85Å; S749-L754 PolarHBondContact OG-O 2.96Å; L754-L766 HydrophobicContact CB-CD1 4.21Å; L754-L766 HydrophobicContact CD1-CD1 4.41Å; L754-F793 HydrophobicContact CB-CZ 4.18Å; L754-I815 HydrophobicContact CD1-CD1 4.05Å; L754-I815 HydrophobicContact CD1-CG2 4.14Å
755	L	95.6	Very high	93.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.1	171.4	-178	74	0	0	0	108.5	V730 L733 A748 F767 Y769 C771	V730-L755 HydrophobicContact CB-CD2 4.17Å; V730-L755 HydrophobicContact CG1-CD1 4.11Å; V730-L755 HydrophobicContact CG1-CD2 4.09Å; L733-L755 HydrophobicContact CD2-CD2 4.46Å; A748-L755 HydrophobicContact CB-CD1 4.13Å; L755-F767 HydrophobicContact CB-CB 4.27Å; L755-F767 PolarHBondContact N-O 3.02Å; L755-F767 PolarHBondContact O-N 3.16Å; L755-Y769 HydrophobicContact CB-CD2 4.47Å; L755-Y769 HydrophobicContact CD1-CD2 4.49Å; L755-C771 HydrophobicContact CD2-CB 3.53Å
756	V	96.8	Very high	93.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.3	176	69.2	0	0	0	0	110.3	A746 C747 V764 H765 L766 V791 F793 L800	A746-V756 CarbonylContact C-O 3.58Å; A746-V756 VanDerWaalsContact CA-O 3.25Å; A746-V756 WeakPolarHBondContact CA-O 3.3Å; C747-V756 HydrophobicContact CB-CG1 3.82Å; C747-V756 PolarHBondContact N-O 2.81Å; C747-V756 WeakPolarHBondContact O-CG1 3.29Å; C747-V756 PolarHBondContact O-N 2.99Å; V756-V764 HydrophobicContact CG2-CG1 3.51Å; V756-H765 CarbonylContact C-O 3.48Å; V756-H765 WeakPolarHBondContact CA-O 3.37Å; V756-H765 WeakPolarHBondContact CG2-O 3.39Å; V756-L766 HydrophobicContact CB-CD1 4.49Å; V756-V791 HydrophobicContact CG1-CB 4.03Å; V756-V791 HydrophobicContact CG1-CG2 3.8Å; V756-F793 HydrophobicContact CB-CE2 4.09Å; V756-F793 HydrophobicContact CB-CZ 3.97Å; V756-F793 HydrophobicContact CG1-CD2 4.33Å; V756-F793 HydrophobicContact CG1-CE2 3.63Å; V756-F793 HydrophobicContact CG1-CZ 3.94Å; V756-L800 HydrophobicContact CB-CD1 4.34Å; V756-L800 HydrophobicContact CB-CD2 4.39Å; V756-L800 HydrophobicContact CG1-CD1 3.66Å; V756-L800 HydrophobicContact CG2-CD1 4.2Å; V756-L800 HydrophobicContact CG2-CD2 3.57Å
757	T	96.3	Very high	93.7	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.8	168	65.5	0	0	0	0	112.6	L733 I743 A745 A746 V764 H765 F767	L733-T757 HydrophobicContact CB-CG2 3.8Å; L733-T757 HydrophobicContact CD1-CG2 4.47Å; L733-T757 HydrophobicContact CD2-CG2 3.96Å; L733-T757 HydrophobicContact CG-CG2 4.31Å; I743-T757 HydrophobicContact CG2-CG2 4.25Å; A745-T757 VanDerWaalsContact O-CA 3.23Å; A745-T757 WeakPolarHBondContact O-CA 3.42Å; A745-T757 WeakPolarHBondContact O-CB 3.33Å; A746-T757 HydrophobicContact CB-CG2 3.99Å; T757-V764 WeakPolarHBondContact O-CA 3.29Å; T757-H765 PolarHBondContact N-O 3.11Å; T757-H765 PolarHBondContact O-N 3.42Å; T757-F767 HydrophobicContact CG2-CE2 4.33Å
758	G	95.6	Very high	93.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.9	168.4	0	0	0	0	0	110.3	N744 A745	N744-G758 PolarHBondContact N-O 2.89Å; A745-G758 PolarHBondContact O-N 3.21Å
759	D	92.8	Very high	93.5	Very high	11 Å²	11	28.9 Å²	28.9	6%	0.059	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	168.2	-178.2	77.1	9	0	0	0	113.5	D742 F761 G762 K763 H765 V788	D742-D759 CarbonylContact O-C 3.57Å; D742-D759 WeakPolarHBondContact O-CA 3.29Å; D742-D759 WeakPolarHBondContact O-CB 3.37Å; D759-F761 HydrophobicContact CB-CD2 4.26Å; D759-F761 PolarHBondContact O-N 2.93Å; D759-F761 VanDerWaalsContact OD1-C 3.22Å; D759-F761 VanDerWaalsContact OD1-CA 3.29Å; D759-F761 WeakPolarHBondContact OD1-CA 3.46Å; D759-F761 WeakPolarHBondContact OD1-CB 3.47Å; D759-F761 PolarHBondContact OD1-N 3.4Å; D759-F761 WeakPolarHBondContact OD2-CD2 3.42Å; D759-G762 PolarHBondContact OD1-N 3.31Å; D759-K763 PolarHBondContact N-O 3.04Å; D759-K763 VanDerWaalsContact N-O 3.11Å; D759-K763 WeakPolarHBondContact OD1-CA 3.44Å; D759-K763 PolarHBondContact OD1-N 3.49Å; D759-K763 WeakPolarHBondContact OD2-CB 3.39Å; D759-H765 IonicContact OD2-CD2 3.71Å; D759-H765 IonicContact OD2-NE2 3.6Å; D759-H765 PolarHBondContact OD2-NE2 2.93Å; D759-V788 PolarHBondContact O-N 2.74Å
760	D	90.9	Very high	93.4	Very high	38 Å²	38	31.9 Å²	31.9	20%	0.203	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-7.1	173.5	-95.6	-4.9	0	0	0	113.3	D742 N744 H787	D742-D760 PolarHBondContact O-N 2.68Å; N744-D760 PolarHBondContact ND2-OD1 3.46Å; N744-D760 PolarHBondContact OD1-OD1 3.23Å; D760-H787 PolarHBondContact O-CE1 2.86Å; D760-H787 PolarHBondContact O-ND1 3.38Å; D760-H787 IonicContact OD1-CD2 3.31Å; D760-H787 IonicContact OD1-CG 3.72Å; D760-H787 VanDerWaalsContact OD1-CG 3.32Å; D760-H787 IonicContact OD1-ND1 3.86Å; D760-H787 PolarHBondContact OD1-ND1 2.91Å
761	F	89.1	Confident	93.4	Very high	79 Å²	79	27.3 Å²	27.3	35%	0.346	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	11.6	-177.4	-49.5	-69.2	0	0	0	113.1	D742 D759	D742-F761 HydrophobicContact CB-CE2 4.29Å; D759-F761 HydrophobicContact CB-CD2 4.26Å; D759-F761 PolarHBondContact O-N 2.93Å; D759-F761 VanDerWaalsContact OD1-C 3.22Å; D759-F761 VanDerWaalsContact OD1-CA 3.29Å; D759-F761 WeakPolarHBondContact OD1-CA 3.46Å; D759-F761 WeakPolarHBondContact OD1-CB 3.47Å; D759-F761 PolarHBondContact OD1-N 3.4Å; D759-F761 WeakPolarHBondContact OD2-CD2 3.42Å
762	G	89.9	Confident	93.4	Very high	2 Å²	2	22.9 Å²	22.9	2%	0.021	12%	0.12	C	C	.	.	S	Bend	trans	76.3	21.1	177.8	0	0	0	0	0	114.7	D759 S786	D759-G762 PolarHBondContact OD1-N 3.31Å; G762-S786 WeakPolarHBondContact CA-O 3.21Å; G762-S786 PolarHBondContact N-O 3.27Å
763	K	92	Very high	93.4	Very high	35 Å²	35	21.1 Å²	21.1	15%	0.152	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143.5	-179.4	-56.1	167.5	-174.4	165.6	0	111.3	D759 V780 Y781	D759-K763 PolarHBondContact N-O 3.04Å; D759-K763 VanDerWaalsContact N-O 3.11Å; D759-K763 WeakPolarHBondContact OD1-CA 3.44Å; D759-K763 PolarHBondContact OD1-N 3.49Å; D759-K763 WeakPolarHBondContact OD2-CB 3.39Å; K763-V780 HydrophobicContact CB-CG1 4Å; K763-V780 HydrophobicContact CD-CG1 3.8Å; K763-V780 HydrophobicContact CG-CG1 4.09Å; K763-Y781 WeakPolarHBondContact CA-O 3.29Å
764	V	95.3	Very high	93.1	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.7	168.4	-179.6	0	0	0	0	107.5	L221 V756 T757 Y781 V788 L800 W813	L221-V764 HydrophobicContact CD1-CG1 4.05Å; V756-V764 HydrophobicContact CG2-CG1 3.51Å; T757-V764 WeakPolarHBondContact O-CA 3.29Å; V764-Y781 PolarHBondContact N-O 3.29Å; V764-Y781 WeakPolarHBondContact O-CD2 3.37Å; V764-Y781 PolarHBondContact O-N 2.76Å; V764-V788 HydrophobicContact CG2-CG1 4.17Å; V764-V788 HydrophobicContact CG2-CG2 4.23Å; V764-L800 HydrophobicContact CG1-CD2 3.9Å; V764-W813 HydrophobicContact CB-CZ2 4.44Å; V764-W813 HydrophobicContact CG2-CZ2 3.84Å
765	H	95.3	Very high	92.7	Very high	31 Å²	31	27.9 Å²	27.9	14%	0.144	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.6	179.2	-70	-106.7	0	0	0	110.4	V756 T757 D759 F767 S778 H779	V756-H765 CarbonylContact C-O 3.48Å; V756-H765 WeakPolarHBondContact CA-O 3.37Å; V756-H765 WeakPolarHBondContact CG2-O 3.39Å; T757-H765 PolarHBondContact N-O 3.11Å; T757-H765 PolarHBondContact O-N 3.42Å; D759-H765 IonicContact OD2-CD2 3.71Å; D759-H765 IonicContact OD2-NE2 3.6Å; D759-H765 PolarHBondContact OD2-NE2 2.93Å; H765-F767 HydrophobicContact CB-CD2 4.14Å; H765-F767 HydrophobicContact CB-CE2 3.37Å; H765-F767 HydrophobicContact CB-CZ 3.94Å; H765-S778 PolarHBondContact ND1-OG 3.36Å; H765-H779 WeakPolarHBondContact CA-O 3.43Å
766	L	96.4	Very high	92.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127	172.7	-172.5	72.7	0	0	0	110.4	P217 N219 L221 L754 V756 S778 H779 Y781 F793	P217-L766 HydrophobicContact CB-CD2 4.47Å; P217-L766 HydrophobicContact CG-CD2 4.19Å; P217-L766 HydrophobicContact CG-CG 4.06Å; N219-L766 WeakPolarHBondContact O-CD2 3.45Å; L221-L766 HydrophobicContact CD1-CB 4.32Å; L221-L766 HydrophobicContact CD2-CD1 4.39Å; L221-L766 HydrophobicContact CD2-CD2 4.21Å; L221-L766 HydrophobicContact CG-CB 4.36Å; L221-L766 HydrophobicContact CG-CD2 4.04Å; L754-L766 HydrophobicContact CB-CD1 4.21Å; L754-L766 HydrophobicContact CD1-CD1 4.41Å; V756-L766 HydrophobicContact CB-CD1 4.49Å; L766-S778 WeakPolarHBondContact O-CA 3.28Å; L766-S778 VanDerWaalsContact O-CB 3.24Å; L766-S778 WeakPolarHBondContact O-CB 3.43Å; L766-H779 PolarHBondContact N-O 2.89Å; L766-H779 PolarHBondContact O-N 3.14Å; L766-Y781 HydrophobicContact CB-CE2 3.88Å; L766-F793 HydrophobicContact CD1-CZ 4.27Å
767	F	95.4	Very high	92.2	Very high	7 Å²	7	30.8 Å²	30.8	3%	0.031	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	162.9	179.7	-58.9	-96.4	0	0	0	110.7	L733 L755 T757 H765 A776 P777 S778	L733-F767 HydrophobicContact CB-CE2 4.44Å; L755-F767 HydrophobicContact CB-CB 4.27Å; L755-F767 PolarHBondContact N-O 3.02Å; L755-F767 PolarHBondContact O-N 3.16Å; T757-F767 HydrophobicContact CG2-CE2 4.33Å; H765-F767 HydrophobicContact CB-CD2 4.14Å; H765-F767 HydrophobicContact CB-CE2 3.37Å; H765-F767 HydrophobicContact CB-CZ 3.94Å; F767-A776 HydrophobicContact CD1-CB 3.88Å; F767-A776 HydrophobicContact CE1-CB 4.08Å; F767-A776 WeakPolarHBondContact CE1-O 3.21Å; F767-P777 WeakPolarHBondContact CD1-O 3.27Å; F767-S778 VanDerWaalsContact CE1-CB 3.41Å
768	S	94.1	Very high	92.1	Very high	30 Å²	30	32.3 Å²	32.3	21%	0.21	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	143.2	164.2	59.5	0	0	0	0	110.5	E215 P770	E215-S768 PolarHBondContact O-OG 3.42Å; S768-P770 CarbonylContact O-C 3.36Å
769	Y	92.8	Very high	92	Very high	40 Å²	40	34.2 Å²	34.2	16%	0.157	17%	0.172	C	C	.	.	S	Bend	trans	-99	137.5	169.1	-176.4	-81.9	0	0	0	110.5	H722 Q729 A748 K752 S753 L755	H722-Y769 HydrophobicContact CB-CE2 4.45Å; H722-Y769 AromaticContact CD2-CE2 3.94Å; H722-Y769 AromaticContact CE1-CZ 3.81Å; H722-Y769 PolarHBondContact CE1-OH 3.38Å; H722-Y769 AromaticContact CG-CE2 3.89Å; H722-Y769 AromaticContact NE2-CZ 3.83Å; H722-Y769 PolarHBondContact NE2-OH 3.08Å; Q729-Y769 HydrophobicContact CB-CE2 4.2Å; A748-Y769 HydrophobicContact CB-CD2 4.01Å; A748-Y769 HydrophobicContact CB-CE2 4.26Å; K752-Y769 HydrophobicContact CB-CD1 3.96Å; K752-Y769 HydrophobicContact CB-CE1 4.03Å; K752-Y769 WeakPolarHBondContact O-CD1 3.39Å; S753-Y769 PolarHBondContact O-N 3.45Å; L755-Y769 HydrophobicContact CB-CD2 4.47Å; L755-Y769 HydrophobicContact CD1-CD2 4.49Å
770	P	92.1	Very high	92	Very high	67 Å²	67	37.1 Å²	37.1	44%	0.435	19%	0.19	S	C	.	.	S	Bend	cis	-75.8	148.3	-3.3	31.5	-35.1	0	0	0	112.9	S768 S772	S768-P770 CarbonylContact O-C 3.36Å; P770-S772 PolarHBondContact O-N 2.87Å
771	C	91.7	Very high	92.1	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.014	19%	0.187	C	C	.	.			trans	-102.9	64.1	178.1	-165.9	0	0	0	0	110	Q729 V730 F731 G732 L755 A776	Q729-C771 CarbonylContact O-C 3.52Å; Q729-C771 PolarHBondContact O-N 2.93Å; V730-C771 CarbonylContact C-O 3.59Å; V730-C771 VanDerWaalsContact C-O 3.23Å; F731-C771 PolarHBondContact N-O 3.27Å; G732-C771 VanDerWaalsContact C-SG 3.51Å; G732-C771 WeakPolarHBondContact CA-O 3.49Å; G732-C771 PolarHBondContact N-O 3.31Å; L755-C771 HydrophobicContact CD2-CB 3.53Å; C771-A776 WeakPolarHBondContact SG-CB 3.4Å
772	S	91.1	Very high	92.1	Very high	9 Å²	9	39.1 Å²	39.1	6%	0.063	19%	0.193	C	C	.	.			trans	-102.4	15.7	-173.5	-59.9	0	0	0	0	114.2	Y208 F728 Q729 F731 P770	Y208-S772 WeakPolarHBondContact CE2-O 3.42Å; Y208-S772 PolarHBondContact OH-O 3.24Å; F728-S772 WeakPolarHBondContact O-CB 3.42Å; F728-S772 PolarHBondContact O-OG 3Å; Q729-S772 WeakPolarHBondContact CA-OG 3.38Å; Q729-S772 PolarHBondContact OE1-OG 3.41Å; F731-S772 WeakPolarHBondContact CE1-O 3.44Å; F731-S772 WeakPolarHBondContact CZ-O 3Å; P770-S772 PolarHBondContact O-N 2.87Å
773	Q	89.7	Confident	91.9	Very high	36 Å²	36	39 Å²	39	17%	0.168	19%	0.192	C	C	.	.	S	Bend	trans	-114.3	141.3	180	-62.5	-57.2	-21.5	0	0	110.6	S209 A212 G732	S209-Q773 PolarHBondContact O-OE1 2.98Å; A212-Q773 PolarHBondContact O-OE1 3.12Å; G732-Q773 WeakPolarHBondContact CA-O 3.42Å
774	F	87.3	Confident	91.9	Very high	44 Å²	44	37.7 Å²	37.7	19%	0.193	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	140.4	175.7	-176.9	-128.9	0	0	0	110.2	P178 F731 D736	P178-F774 HydrophobicContact CG-CB 3.84Å; P178-F774 HydrophobicContact CG-CD1 3.86Å; P178-F774 HydrophobicContact CG-CD2 3.58Å; P178-F774 HydrophobicContact CG-CE1 4.27Å; P178-F774 HydrophobicContact CG-CE2 4.04Å; P178-F774 HydrophobicContact CG-CG 3.48Å; P178-F774 VanDerWaalsContact CG-CG 3.48Å; P178-F774 HydrophobicContact CG-CZ 4.35Å; F731-F774 HydrophobicContact CE2-CB 4.47Å; D736-F774 WeakPolarHBondContact OD1-CE2 3.39Å; D736-F774 WeakPolarHBondContact OD1-CZ 3.37Å
775	R	87.4	Confident	91.6	Very high	152 Å²	152	38.5 Å²	38.5	57%	0.574	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	50.2	-175.6	-60.9	172.2	172.4	162.6	0.1	112.8	D736	D736-R775 VanDerWaalsContact CG-NE 3.27Å; D736-R775 VanDerWaalsContact OD1-CG 3.26Å; D736-R775 WeakPolarHBondContact OD1-CG 3.23Å; D736-R775 IonicContact OD1-CZ 3.45Å; D736-R775 IonicContact OD1-NE 2.69Å; D736-R775 PolarHBondContact OD1-NE 3.24Å; D736-R775 IonicContact OD1-NH2 3.79Å; D736-R775 IonicContact OD2-CZ 3.01Å; D736-R775 IonicContact OD2-NE 3.99Å; D736-R775 PolarHBondContact OD2-NE 3.28Å; D736-R775 IonicContact OD2-NH2 3.78Å; D736-R775 PolarHBondContact OD2-NH2 3.21Å
776	A	89	Confident	91.2	Very high	16 Å²	16	38.1 Å²	38.1	13%	0.132	19%	0.193	C	C	.	.			trans	-61.5	134	176.5	0	0	0	0	0	110.4	G732 F767 C771	G732-A776 WeakPolarHBondContact O-CB 3.47Å; F767-A776 HydrophobicContact CD1-CB 3.88Å; F767-A776 HydrophobicContact CE1-CB 4.08Å; F767-A776 WeakPolarHBondContact CE1-O 3.21Å; C771-A776 WeakPolarHBondContact SG-CB 3.4Å
777	P	92	Very high	91	Very high	45 Å²	45	41.2 Å²	41.2	29%	0.292	21%	0.208	S	C	.	.			trans	-74.8	142.6	177.7	33.9	-36.5	0	0	0	110.3	G214 L216 F767	G214-P777 WeakPolarHBondContact O-CD 3.28Å; G214-P777 WeakPolarHBondContact O-CG 3.32Å; L216-P777 HydrophobicContact CD2-CB 3.68Å; L216-P777 HydrophobicContact CD2-CG 4.18Å; L216-P777 HydrophobicContact CG-CB 3.79Å; L216-P777 HydrophobicContact CG-CG 3.95Å; F767-P777 WeakPolarHBondContact CD1-O 3.27Å
778	S	94.1	Very high	91	Very high	33 Å²	33	40.9 Å²	40.9	23%	0.231	21%	0.206	C	C	.	.			trans	-134	155.5	176.6	45.8	0	0	0	0	112.7	H765 L766 F767	H765-S778 PolarHBondContact ND1-OG 3.36Å; L766-S778 WeakPolarHBondContact O-CA 3.28Å; L766-S778 VanDerWaalsContact O-CB 3.24Å; L766-S778 WeakPolarHBondContact O-CB 3.43Å; F767-S778 VanDerWaalsContact CE1-CB 3.41Å
779	H	94.2	Very high	91.1	Very high	40 Å²	40	39.7 Å²	39.7	19%	0.185	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	132.8	159.7	-60.3	-56.8	0	0	0	109	P217 H765 L766 Y781	P217-H779 PolarHBondContact O-NE2 2.75Å; P217-H779 VanDerWaalsContact O-NE2 3.14Å; H765-H779 WeakPolarHBondContact CA-O 3.43Å; L766-H779 PolarHBondContact N-O 2.89Å; L766-H779 PolarHBondContact O-N 3.14Å; H779-Y781 HydrophobicContact CB-CE2 3.61Å; H779-Y781 WeakPolarHBondContact CB-OH 3.47Å; H779-Y781 WeakPolarHBondContact O-CE2 3.43Å
780	V	92.8	Very high	91.2	Very high	72 Å²	72	39.9 Å²	39.9	44%	0.436	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.2	-175	-173	0	0	0	0	109.8	K763	K763-V780 HydrophobicContact CB-CG1 4Å; K763-V780 HydrophobicContact CD-CG1 3.8Å; K763-V780 HydrophobicContact CG-CG1 4.09Å
781	Y	92.4	Very high	91.5	Very high	34 Å²	34	36.9 Å²	36.9	13%	0.133	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.1	-179	-52.9	-82.7	0	0	0	110.6	K220 L221 K763 V764 L766 H779 W813	K220-Y781 WeakPolarHBondContact CA-OH 3.43Å; L221-Y781 HydrophobicContact CB-CD1 4.01Å; L221-Y781 HydrophobicContact CB-CD2 3.92Å; L221-Y781 HydrophobicContact CB-CE1 3.71Å; L221-Y781 HydrophobicContact CB-CE2 3.6Å; L221-Y781 HydrophobicContact CB-CG 4.11Å; L221-Y781 VanDerWaalsContact CB-CZ 3.49Å; L221-Y781 HydrophobicContact CD1-CD2 3.64Å; L221-Y781 HydrophobicContact CD1-CE2 3.65Å; L221-Y781 HydrophobicContact CD1-CG 4.38Å; L221-Y781 HydrophobicContact CG-CD2 4.06Å; L221-Y781 HydrophobicContact CG-CE2 3.61Å; L221-Y781 VanDerWaalsContact N-CZ 3.29Å; L221-Y781 PolarHBondContact N-OH 2.91Å; L221-Y781 WeakPolarHBondContact O-CE1 3.43Å; K763-Y781 WeakPolarHBondContact CA-O 3.29Å; V764-Y781 PolarHBondContact N-O 3.29Å; V764-Y781 WeakPolarHBondContact O-CD2 3.37Å; V764-Y781 PolarHBondContact O-N 2.76Å; L766-Y781 HydrophobicContact CB-CE2 3.88Å; H779-Y781 HydrophobicContact CB-CE2 3.61Å; H779-Y781 WeakPolarHBondContact CB-OH 3.47Å; H779-Y781 WeakPolarHBondContact O-CE2 3.43Å; Y781-W813 HydrophobicContact CG-CZ3 4.44Å
782	R	88.8	Confident	91.7	Very high	125 Å²	125	38 Å²	38	47%	0.472	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	149.8	-179.8	-63	-176.1	-178.9	-144.6	0.2	110.1
783	G	86.7	Confident	91.9	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.01	19%	0.188	C	C	.	.			trans	172.4	-44.2	173.7	0	0	0	0	0	111	A253 S254	A253-G783 WeakPolarHBondContact CB-O 3.14Å; S254-G783 PolarHBondContact N-O 2.88Å; S254-G783 VanDerWaalsContact OG-C 3.25Å; S254-G783 PolarHBondContact OG-O 3.31Å
784	H	92.4	Very high	92.2	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.028	18%	0.18	C	C	.	.			trans	-66.4	144.1	168.5	-68.1	-58.9	0	0	0	111	V788 S802 G804 D807 S809	H784-V788 HydrophobicContact CB-CG2 3.91Å; H784-S802 PolarHBondContact NE2-OG 2.92Å; H784-G804 VanDerWaalsContact CE1-CA 3.41Å; H784-G804 WeakPolarHBondContact CE1-CA 3.46Å; H784-G804 PolarHBondContact CE1-N 3.38Å; H784-G804 VanDerWaalsContact CE1-N 3.28Å; H784-G804 WeakPolarHBondContact ND1-CA 3.43Å; H784-D807 WeakPolarHBondContact CA-OD2 3.48Å; H784-D807 WeakPolarHBondContact CB-OD2 3.21Å; H784-D807 IonicContact CG-OD2 3.76Å; H784-D807 IonicContact ND1-OD1 3.7Å; H784-D807 IonicContact ND1-OD2 2.69Å; H784-D807 PolarHBondContact ND1-OD2 3.17Å; H784-S809 PolarHBondContact CE1-OG 3.37Å; H784-S809 PolarHBondContact ND1-OG 3.16Å
785	S	87.2	Confident	92.4	Very high	18 Å²	18	36.8 Å²	36.8	13%	0.126	18%	0.183	C	C	.	.	S	Bend	trans	-106.4	-20.7	177.9	51.6	0	0	0	0	112.7	A253 D275 D807	A253-S785 WeakPolarHBondContact CA-OG 3.48Å; D275-S785 WeakPolarHBondContact OD1-CB 3.49Å; D275-S785 PolarHBondContact OD1-OG 2.6Å; S785-D807 PolarHBondContact N-OD2 2.88Å; S785-D807 VanDerWaalsContact N-OD2 3.13Å; S785-D807 WeakPolarHBondContact OG-CB 3.41Å
786	S	87	Confident	92.6	Very high	24 Å²	24	33.5 Å²	33.5	17%	0.168	18%	0.177	C	C	.	.	S	Bend	trans	-112.5	-159.6	173.5	-166.3	0	0	0	0	110	G762 V788	G762-S786 WeakPolarHBondContact CA-O 3.21Å; G762-S786 PolarHBondContact N-O 3.27Å; S786-V788 PolarHBondContact O-N 2.86Å
787	H	92.1	Very high	92.8	Very high	65 Å²	65	34.1 Å²	34.1	30%	0.301	18%	0.178	S	C	.	.			trans	-65.5	131.8	-179.3	-48.1	-35.9	0	0	0	110.7	D760 T789 G804 G805	D760-H787 PolarHBondContact O-CE1 2.86Å; D760-H787 PolarHBondContact O-ND1 3.38Å; D760-H787 IonicContact OD1-CD2 3.31Å; D760-H787 IonicContact OD1-CG 3.72Å; D760-H787 VanDerWaalsContact OD1-CG 3.32Å; D760-H787 IonicContact OD1-ND1 3.86Å; D760-H787 PolarHBondContact OD1-ND1 2.91Å; H787-T789 HydrophobicContact CB-CG2 4.49Å; H787-T789 PolarHBondContact O-N 2.94Å; H787-T789 VanDerWaalsContact O-N 3.14Å; H787-G804 CarbonylContact O-C 3.49Å; H787-G804 WeakPolarHBondContact O-CA 3.32Å; H787-G805 PolarHBondContact O-N 3.36Å
788	V	95.8	Very high	92.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.			trans	-77.9	99.6	167.3	-173.4	0	0	0	0	106.9	N744 D759 V764 H784 S786 V791 T803	N744-V788 VanDerWaalsContact CB-O 3.29Å; N744-V788 WeakPolarHBondContact CB-O 3.4Å; N744-V788 PolarHBondContact ND2-O 3.35Å; D759-V788 PolarHBondContact O-N 2.74Å; V764-V788 HydrophobicContact CG2-CG1 4.17Å; V764-V788 HydrophobicContact CG2-CG2 4.23Å; H784-V788 HydrophobicContact CB-CG2 3.91Å; S786-V788 PolarHBondContact O-N 2.86Å; V788-V791 HydrophobicContact CG1-CG1 3.77Å; V788-T803 CarbonylContact C-O 3.48Å; V788-T803 WeakPolarHBondContact CA-O 3.43Å
789	T	95.9	Very high	92.7	Very high	4 Å²	4	34.6 Å²	34.6	3%	0.025	18%	0.175	C	C	.	.			trans	-77.8	-29	-170.6	50.2	0	0	0	0	113.1	L547 W548 H787 T803 G805	L547-T789 WeakPolarHBondContact O-CB 3.42Å; L547-T789 PolarHBondContact O-OG1 2.91Å; W548-T789 HydrophobicContact CD2-CG2 3.71Å; W548-T789 HydrophobicContact CE3-CG2 3.9Å; W548-T789 HydrophobicContact CG-CG2 4.32Å; W548-T789 HydrophobicContact CH2-CG2 3.89Å; W548-T789 HydrophobicContact CZ2-CG2 3.7Å; W548-T789 HydrophobicContact CZ3-CG2 3.99Å; H787-T789 HydrophobicContact CB-CG2 4.49Å; H787-T789 PolarHBondContact O-N 2.94Å; H787-T789 VanDerWaalsContact O-N 3.14Å; T789-T803 PolarHBondContact N-O 2.7Å; T789-T803 PolarHBondContact OG1-O 3.2Å; T789-T803 PolarHBondContact OG1-OG1 2.89Å; T789-G805 VanDerWaalsContact CG2-CA 3.44Å; T789-G805 PolarHBondContact OG1-N 2.87Å
790	N	96.7	Very high	92.7	Very high	45 Å²	45	32.7 Å²	32.7	24%	0.241	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	152.1	-178.3	-145.4	-24.1	0	0	0	112.1	W548 L550 S802 T803	W548-N790 PolarHBondContact O-ND2 3.35Å; L550-N790 HydrophobicContact CB-CB 3.97Å; L550-N790 HydrophobicContact CD2-CB 4.36Å; N790-S802 VanDerWaalsContact O-CA 3.3Å; N790-S802 WeakPolarHBondContact O-CA 3.4Å; N790-T803 WeakPolarHBondContact CB-OG1 3.44Å; N790-T803 PolarHBondContact N-OG1 3.15Å; N790-T803 VanDerWaalsContact N-OG1 3.13Å; N790-T803 PolarHBondContact O-N 3.21Å; N790-T803 PolarHBondContact O-OG1 3.46Å
791	V	96.8	Very high	92.9	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	135.8	178.9	-68.1	0	0	0	0	109.9	A745 C747 V756 V788 L800 V801	A745-V791 HydrophobicContact CB-CG2 3.86Å; C747-V791 HydrophobicContact CB-CG2 4.35Å; C747-V791 WeakPolarHBondContact CB-O 3.37Å; V756-V791 HydrophobicContact CG1-CB 4.03Å; V756-V791 HydrophobicContact CG1-CG2 3.8Å; V788-V791 HydrophobicContact CG1-CG1 3.77Å; V791-L800 HydrophobicContact CB-CD1 4.33Å; V791-V801 CarbonylContact C-O 3.54Å; V791-V801 WeakPolarHBondContact CA-O 3.47Å
792	S	96.2	Very high	93	Very high	25 Å²	25	27.7 Å²	27.7	18%	0.175	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	133.3	176.8	-171.8	0	0	0	0	112.4	V552 V801	V552-S792 WeakPolarHBondContact CG2-OG 3.46Å; S792-V801 PolarHBondContact N-O 3.41Å; S792-V801 PolarHBondContact O-N 2.99Å
793	F	96.3	Very high	93.4	Very high	7 Å²	7	21.7 Å²	21.7	3%	0.031	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	147.2	168.2	-68.2	-76.5	0	0	0	110.9	V552 C747 L754 V756 L766 L800 I815	V552-F793 WeakPolarHBondContact CG2-O 3.4Å; C747-F793 HydrophobicContact CB-CD2 4.38Å; C747-F793 WeakPolarHBondContact O-CE2 3.32Å; L754-F793 HydrophobicContact CB-CZ 4.18Å; V756-F793 HydrophobicContact CB-CE2 4.09Å; V756-F793 HydrophobicContact CB-CZ 3.97Å; V756-F793 HydrophobicContact CG1-CD2 4.33Å; V756-F793 HydrophobicContact CG1-CE2 3.63Å; V756-F793 HydrophobicContact CG1-CZ 3.94Å; L766-F793 HydrophobicContact CD1-CZ 4.27Å; F793-L800 HydrophobicContact CD1-CB 4.12Å; F793-L800 HydrophobicContact CD1-CD1 4.23Å; F793-L800 HydrophobicContact CE1-CB 4.17Å; F793-L800 HydrophobicContact CE1-CD1 4.26Å; F793-L800 HydrophobicContact CG-CD1 4.41Å; F793-L800 HydrophobicContact CZ-CD1 4.49Å; F793-I815 HydrophobicContact CD1-CD1 3.72Å; F793-I815 HydrophobicContact CE1-CD1 3.45Å; F793-I815 VanDerWaalsContact CE1-CD1 3.45Å
794	L	94.6	Very high	93.6	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.116	C	C	.	.			trans	-70	165.6	168.4	-66.1	-171.8	0	0	0	111.1	V552 F559 S573 N750 D796 D797 Y799 V801	V552-L794 HydrophobicContact CG1-CD2 4.06Å; V552-L794 HydrophobicContact CG2-CD2 4.06Å; F559-L794 HydrophobicContact CB-CD2 4.42Å; F559-L794 HydrophobicContact CD1-CD2 4.31Å; S573-L794 WeakPolarHBondContact OG-CD1 3.34Å; N750-L794 PolarHBondContact ND2-O 2.99Å; L794-D796 PolarHBondContact O-N 2.89Å; L794-D797 PolarHBondContact O-N 3.02Å; L794-D797 VanDerWaalsContact O-N 3.09Å; L794-Y799 HydrophobicContact CD1-CD2 4.03Å; L794-Y799 HydrophobicContact CD1-CG 4.26Å; L794-Y799 PolarHBondContact N-O 3.5Å; L794-V801 HydrophobicContact CD2-CG2 3.88Å; L794-V801 HydrophobicContact CG-CG2 4.43Å
795	H	91.8	Very high	93.7	Very high	56 Å²	56	21.4 Å²	21.4	26%	0.259	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-23.9	-177.4	72	-55.9	0	0	0	116.4	P554 W555 K556	P554-H795 WeakPolarHBondContact O-CB 3.4Å; W555-H795 VanDerWaalsContact C-CD2 3.41Å; W555-H795 PolarHBondContact O-CD2 3.39Å; K556-H795 PolarHBondContact O-ND1 3.25Å
796	D	92.4	Very high	93.9	Very high	84 Å²	84	26.1 Å²	26.1	45%	0.449	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	9.2	-175.7	65	-13.6	0	0	0	112.8	L794 S798	L794-D796 PolarHBondContact O-N 2.89Å; D796-S798 PolarHBondContact O-N 2.83Å; D796-S798 WeakPolarHBondContact OD1-CB 3.45Å; D796-S798 PolarHBondContact OD1-N 2.98Å; D796-S798 VanDerWaalsContact OD1-N 3.12Å; D796-S798 PolarHBondContact OD1-OG 3.37Å; D796-S798 WeakPolarHBondContact OD2-CB 3.5Å; D796-S798 PolarHBondContact OD2-OG 2.9Å
797	D	92.6	Very high	94.1	Very high	29 Å²	29	25.2 Å²	25.2	16%	0.155	13%	0.126	C	C	.	.	S	Bend	trans	54.9	17.1	-174.9	-60.1	-32.5	0	0	0	113.9	N750 D751 L794 I815	N750-D797 WeakPolarHBondContact CB-OD2 3.44Å; N750-D797 PolarHBondContact N-OD1 2.92Å; N750-D797 PolarHBondContact N-OD2 3.44Å; N750-D797 PolarHBondContact ND2-OD1 3.33Å; D751-D797 PolarHBondContact N-OD2 2.95Å; D751-D797 VanDerWaalsContact N-OD2 3.08Å; L794-D797 PolarHBondContact O-N 3.02Å; L794-D797 VanDerWaalsContact O-N 3.09Å; D797-I815 WeakPolarHBondContact O-CD1 3.41Å
798	S	91.1	Very high	94.1	Very high	38 Å²	38	23.3 Å²	23.3	27%	0.266	12%	0.118	S	C	.	.	S	Bend	trans	-76.1	-34.4	-179.6	64	0	0	0	0	112.4	D796 I815	D796-S798 PolarHBondContact O-N 2.83Å; D796-S798 WeakPolarHBondContact OD1-CB 3.45Å; D796-S798 PolarHBondContact OD1-N 2.98Å; D796-S798 VanDerWaalsContact OD1-N 3.12Å; D796-S798 PolarHBondContact OD1-OG 3.37Å; D796-S798 WeakPolarHBondContact OD2-CB 3.5Å; D796-S798 PolarHBondContact OD2-OG 2.9Å; S798-I815 PolarHBondContact O-N 3.27Å
799	Y	93.1	Very high	93.9	Very high	50 Å²	50	23.3 Å²	23.3	20%	0.196	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.6	175.7	-58.2	-98	0	0	0	111.7	L794 Q812 W813 R814	L794-Y799 HydrophobicContact CD1-CD2 4.03Å; L794-Y799 HydrophobicContact CD1-CG 4.26Å; L794-Y799 PolarHBondContact N-O 3.5Å; Y799-Q812 HydrophobicContact CD1-CG 3.72Å; Y799-Q812 HydrophobicContact CG-CG 4.01Å; Y799-Q812 VanDerWaalsContact CG-NE2 3.29Å; Y799-W813 CarbonylContact C-O 2.97Å; Y799-W813 WeakPolarHBondContact CA-O 3.5Å; Y799-W813 WeakPolarHBondContact CB-O 3.38Å; Y799-R814 VanDerWaalsContact CD1-CA 3.48Å; Y799-R814 HydrophobicContact CD1-CB 3.7Å; Y799-R814 HydrophobicContact CD1-CG 4.2Å; Y799-R814 HydrophobicContact CE1-CB 3.55Å; Y799-R814 HydrophobicContact CE1-CG 3.84Å
800	L	94.5	Very high	93.9	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	-111.8	144.1	168.1	166.1	74.9	0	0	0	108.3	L221 V756 V764 V791 F793 Q812 W813	L221-L800 HydrophobicContact CD1-CD2 3.5Å; L221-L800 HydrophobicContact CD2-CD2 4.33Å; V756-L800 HydrophobicContact CB-CD1 4.34Å; V756-L800 HydrophobicContact CB-CD2 4.39Å; V756-L800 HydrophobicContact CG1-CD1 3.66Å; V756-L800 HydrophobicContact CG2-CD1 4.2Å; V756-L800 HydrophobicContact CG2-CD2 3.57Å; V764-L800 HydrophobicContact CG1-CD2 3.9Å; V791-L800 HydrophobicContact CB-CD1 4.33Å; F793-L800 HydrophobicContact CD1-CB 4.12Å; F793-L800 HydrophobicContact CD1-CD1 4.23Å; F793-L800 HydrophobicContact CE1-CB 4.17Å; F793-L800 HydrophobicContact CE1-CD1 4.26Å; F793-L800 HydrophobicContact CG-CD1 4.41Å; F793-L800 HydrophobicContact CZ-CD1 4.49Å; L800-Q812 CarbonylContact O-C 3.59Å; L800-Q812 VanDerWaalsContact O-CA 3.3Å; L800-Q812 WeakPolarHBondContact O-CA 3.19Å; L800-W813 HydrophobicContact CB-CB 4.14Å; L800-W813 HydrophobicContact CD2-CB 4.26Å; L800-W813 HydrophobicContact CD2-CG 4.08Å; L800-W813 HydrophobicContact CG-CG 4.49Å; L800-W813 PolarHBondContact N-O 2.98Å; L800-W813 PolarHBondContact O-N 3.38Å
801	V	95.5	Very high	93.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137.9	171.1	-177.4	0	0	0	0	109.2	L550 F559 V791 S792 L794 V810 L811 Q812	L550-V801 HydrophobicContact CD1-CB 4.23Å; L550-V801 HydrophobicContact CD1-CG1 3.72Å; L550-V801 HydrophobicContact CD2-CB 4.29Å; L550-V801 HydrophobicContact CD2-CG1 4.25Å; L550-V801 WeakPolarHBondContact CD2-O 3.48Å; F559-V801 HydrophobicContact CD1-CG2 4Å; F559-V801 HydrophobicContact CD2-CG1 4.12Å; F559-V801 HydrophobicContact CE1-CG2 4.21Å; F559-V801 HydrophobicContact CE2-CG1 4.09Å; F559-V801 HydrophobicContact CG-CG2 4.21Å; F559-V801 HydrophobicContact CZ-CG1 4.45Å; V791-V801 CarbonylContact C-O 3.54Å; V791-V801 WeakPolarHBondContact CA-O 3.47Å; S792-V801 PolarHBondContact N-O 3.41Å; S792-V801 PolarHBondContact O-N 2.99Å; L794-V801 HydrophobicContact CD2-CG2 3.88Å; L794-V801 HydrophobicContact CG-CG2 4.43Å; V801-V810 HydrophobicContact CG1-CG1 3.47Å; V801-V810 VanDerWaalsContact CG1-CG1 3.47Å; V801-L811 CarbonylContact C-O 3.48Å; V801-L811 WeakPolarHBondContact CA-O 3.44Å; V801-Q812 HydrophobicContact CG2-CG 4.48Å
802	S	96.1	Very high	93.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.8	173.5	64.7	0	0	0	0	111.9	H784 N790 V810 L811 W813	H784-S802 PolarHBondContact NE2-OG 2.92Å; N790-S802 VanDerWaalsContact O-CA 3.3Å; N790-S802 WeakPolarHBondContact O-CA 3.4Å; S802-V810 WeakPolarHBondContact O-CA 3.46Å; S802-L811 PolarHBondContact N-O 3.33Å; S802-L811 PolarHBondContact O-N 3.39Å; S802-L811 PolarHBondContact OG-O 2.97Å; S802-W813 PolarHBondContact OG-NE1 3.23Å
803	T	96.1	Very high	93.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.5	177.1	56	0	0	0	0	110.4	L547 L550 V788 T789 N790	L547-T803 HydrophobicContact CD2-CG2 3.51Å; L547-T803 HydrophobicContact CG-CG2 3.93Å; L550-T803 HydrophobicContact CB-CG2 4.03Å; L550-T803 HydrophobicContact CD1-CG2 4.38Å; L550-T803 HydrophobicContact CD2-CG2 4.38Å; L550-T803 HydrophobicContact CG-CG2 4.5Å; V788-T803 CarbonylContact C-O 3.48Å; V788-T803 WeakPolarHBondContact CA-O 3.43Å; T789-T803 PolarHBondContact N-O 2.7Å; T789-T803 PolarHBondContact OG1-O 3.2Å; T789-T803 PolarHBondContact OG1-OG1 2.89Å; N790-T803 WeakPolarHBondContact CB-OG1 3.44Å; N790-T803 PolarHBondContact N-OG1 3.15Å; N790-T803 VanDerWaalsContact N-OG1 3.13Å; N790-T803 PolarHBondContact O-N 3.21Å; N790-T803 PolarHBondContact O-OG1 3.46Å
804	G	92.3	Very high	93.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.116	C	C	.	.			trans	-101.6	22.7	-171.4	0	0	0	0	0	116.4	H784 H787 K806 D807 S809	H784-G804 VanDerWaalsContact CE1-CA 3.41Å; H784-G804 WeakPolarHBondContact CE1-CA 3.46Å; H784-G804 PolarHBondContact CE1-N 3.38Å; H784-G804 VanDerWaalsContact CE1-N 3.28Å; H784-G804 WeakPolarHBondContact ND1-CA 3.43Å; H787-G804 CarbonylContact O-C 3.49Å; H787-G804 WeakPolarHBondContact O-CA 3.32Å; G804-K806 PolarHBondContact O-N 2.98Å; G804-D807 WeakPolarHBondContact CA-OD1 3.38Å; G804-D807 PolarHBondContact O-N 3.04Å; G804-D807 VanDerWaalsContact O-OD1 3.11Å; G804-S809 PolarHBondContact N-O 2.89Å
805	G	93.4	Very high	93	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	55.6	-114.3	176	0	0	0	0	0	112.1	E546 L547 H787 T789 D807 M808	E546-G805 WeakPolarHBondContact CA-O 3.42Å; L547-G805 PolarHBondContact N-O 3.42Å; L547-G805 VanDerWaalsContact N-O 3.08Å; L547-G805 VanDerWaalsContact O-CA 3.3Å; L547-G805 WeakPolarHBondContact O-CA 3.47Å; L547-G805 PolarHBondContact O-N 3.32Å; H787-G805 PolarHBondContact O-N 3.36Å; T789-G805 VanDerWaalsContact CG2-CA 3.44Å; T789-G805 PolarHBondContact OG1-N 2.87Å; G805-D807 VanDerWaalsContact C-N 3.29Å; G805-D807 PolarHBondContact O-N 3.19Å; G805-M808 PolarHBondContact O-N 3.23Å
806	K	92.4	Very high	92.9	Very high	118 Å²	118	28.4 Å²	28.4	51%	0.513	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-14.4	-176.7	-68.3	179.7	179.6	165.9	0	114.6	E546 G804 M808	E546-K806 HydrophobicContact CB-CG 4.31Å; E546-K806 HydrophobicContact CG-CG 3.86Å; E546-K806 WeakPolarHBondContact OE2-CE 3.34Å; G804-K806 PolarHBondContact O-N 2.98Å; K806-M808 PolarHBondContact O-N 2.96Å
807	D	90.2	Very high	92.9	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.021	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.7	172.4	78.5	21.3	0	0	0	112.9	A253 H784 S785 G804 G805 S809	A253-D807 HydrophobicContact CB-CB 3.72Å; H784-D807 WeakPolarHBondContact CA-OD2 3.48Å; H784-D807 WeakPolarHBondContact CB-OD2 3.21Å; H784-D807 IonicContact CG-OD2 3.76Å; H784-D807 IonicContact ND1-OD1 3.7Å; H784-D807 IonicContact ND1-OD2 2.69Å; H784-D807 PolarHBondContact ND1-OD2 3.17Å; S785-D807 PolarHBondContact N-OD2 2.88Å; S785-D807 VanDerWaalsContact N-OD2 3.13Å; S785-D807 WeakPolarHBondContact OG-CB 3.41Å; G804-D807 WeakPolarHBondContact CA-OD1 3.38Å; G804-D807 PolarHBondContact O-N 3.04Å; G804-D807 VanDerWaalsContact O-OD1 3.11Å; G805-D807 VanDerWaalsContact C-N 3.29Å; G805-D807 PolarHBondContact O-N 3.19Å; D807-S809 VanDerWaalsContact CG-OG 3.24Å; D807-S809 PolarHBondContact O-N 3.42Å; D807-S809 VanDerWaalsContact O-N 3.14Å; D807-S809 WeakPolarHBondContact OD1-CB 3.36Å; D807-S809 PolarHBondContact OD1-N 3.33Å; D807-S809 PolarHBondContact OD1-OG 2.88Å; D807-S809 PolarHBondContact OD2-OG 3.36Å
808	M	91.6	Very high	92.9	Very high	26 Å²	26	25.5 Å²	25.5	13%	0.128	12%	0.123	C	C	.	.			trans	64	10.1	174.5	-49.2	169.5	-171.9	0	0	114.5	T544 G805 K806	T544-M808 VanDerWaalsContact C-SD 3.6Å; G805-M808 PolarHBondContact O-N 3.23Å; K806-M808 PolarHBondContact O-N 2.96Å
809	S	92.8	Very high	93	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.115	C	C	.	.			trans	-95.8	151.1	-176	70.9	0	0	0	0	112.4	H784 G804 D807	H784-S809 PolarHBondContact CE1-OG 3.37Å; H784-S809 PolarHBondContact ND1-OG 3.16Å; G804-S809 PolarHBondContact N-O 2.89Å; D807-S809 VanDerWaalsContact CG-OG 3.24Å; D807-S809 PolarHBondContact O-N 3.42Å; D807-S809 VanDerWaalsContact O-N 3.14Å; D807-S809 WeakPolarHBondContact OD1-CB 3.36Å; D807-S809 PolarHBondContact OD1-N 3.33Å; D807-S809 PolarHBondContact OD1-OG 2.88Å; D807-S809 PolarHBondContact OD2-OG 3.36Å
810	V	94.6	Very high	93	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.6	162.7	-174	0	0	0	0	106.7	Y229 L547 F559 T561 V801 S802	Y229-V810 HydrophobicContact CD2-CB 3.98Å; Y229-V810 HydrophobicContact CD2-CG1 4.11Å; Y229-V810 WeakPolarHBondContact CD2-O 3.31Å; Y229-V810 HydrophobicContact CG-CB 4.34Å; Y229-V810 PolarHBondContact N-O 3.32Å; Y229-V810 PolarHBondContact O-N 2.88Å; L547-V810 HydrophobicContact CD2-CG2 3.43Å; L547-V810 VanDerWaalsContact CD2-CG2 3.43Å; F559-V810 HydrophobicContact CE2-CG1 4Å; F559-V810 HydrophobicContact CZ-CG1 4.43Å; T561-V810 HydrophobicContact CG2-CG1 4.41Å; T561-V810 HydrophobicContact CG2-CG2 4.01Å; V801-V810 HydrophobicContact CG1-CG1 3.47Å; V801-V810 VanDerWaalsContact CG1-CG1 3.47Å; S802-V810 WeakPolarHBondContact O-CA 3.46Å
811	L	93.6	Very high	93	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.2	178	-59.1	-178	0	0	0	109.5	L223 N227 C228 V801 S802 W813	L223-L811 HydrophobicContact CD1-CB 4.22Å; L223-L811 HydrophobicContact CD1-CD2 4.4Å; N227-L811 CarbonylContact O-C 3.54Å; N227-L811 WeakPolarHBondContact O-CA 3.47Å; C228-L811 HydrophobicContact CB-CD2 4.15Å; C228-L811 WeakPolarHBondContact SG-CD2 3.44Å; V801-L811 CarbonylContact C-O 3.48Å; V801-L811 WeakPolarHBondContact CA-O 3.44Å; S802-L811 PolarHBondContact N-O 3.33Å; S802-L811 PolarHBondContact O-N 3.39Å; S802-L811 PolarHBondContact OG-O 2.97Å; L811-W813 HydrophobicContact CB-CZ2 3.87Å; L811-W813 HydrophobicContact CD1-CH2 4.05Å; L811-W813 HydrophobicContact CD1-CZ2 3.63Å; L811-W813 HydrophobicContact CG-CZ2 4.41Å; L811-W813 PolarHBondContact O-NE1 3.26Å
812	Q	93.4	Very high	92.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	143.3	171.7	-177.5	175.1	-28.2	0	0	109.1	L223 N227 Y229 S573 H576 Y799 L800 V801	L223-Q812 WeakPolarHBondContact CD1-O 3.44Å; N227-Q812 HydrophobicContact CB-CB 3.77Å; N227-Q812 WeakPolarHBondContact CB-O 3.47Å; N227-Q812 PolarHBondContact ND2-O 2.69Å; N227-Q812 PolarHBondContact O-N 3.45Å; Y229-Q812 HydrophobicContact CE2-CB 4.27Å; Y229-Q812 PolarHBondContact OH-OE1 2.87Å; Y229-Q812 VanDerWaalsContact OH-OE1 3.05Å; S573-Q812 PolarHBondContact O-NE2 2.93Å; S573-Q812 PolarHBondContact OG-NE2 2.98Å; S573-Q812 PolarHBondContact OG-OE1 3.08Å; H576-Q812 PolarHBondContact CE1-NE2 3.41Å; H576-Q812 PolarHBondContact CE1-OE1 3.31Å; H576-Q812 VanDerWaalsContact CE1-OE1 3.31Å; H576-Q812 PolarHBondContact ND1-OE1 2.93Å; Y799-Q812 HydrophobicContact CD1-CG 3.72Å; Y799-Q812 HydrophobicContact CG-CG 4.01Å; Y799-Q812 VanDerWaalsContact CG-NE2 3.29Å; L800-Q812 CarbonylContact O-C 3.59Å; L800-Q812 VanDerWaalsContact O-CA 3.3Å; L800-Q812 WeakPolarHBondContact O-CA 3.19Å; V801-Q812 HydrophobicContact CG2-CG 4.48Å
813	W	92.6	Very high	92.5	Very high	5 Å²	5	28.3 Å²	28.3	2%	0.019	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	122.1	-176.5	-44.9	79.4	0	0	0	107.8	L221 L223 V764 Y781 Y799 L800 S802 L811	L221-W813 HydrophobicContact CB-CB 4.14Å; L221-W813 HydrophobicContact CD1-CB 4.31Å; L221-W813 HydrophobicContact CD1-CG 4.48Å; L221-W813 HydrophobicContact CD2-CB 4.3Å; L221-W813 HydrophobicContact CG-CB 4.48Å; L223-W813 HydrophobicContact CB-CE3 4.29Å; L223-W813 HydrophobicContact CB-CZ3 4.29Å; L223-W813 HydrophobicContact CD1-CD2 4.15Å; L223-W813 HydrophobicContact CD1-CE3 3.85Å; L223-W813 HydrophobicContact CD1-CH2 4.13Å; L223-W813 HydrophobicContact CD1-CZ2 4.41Å; L223-W813 HydrophobicContact CD1-CZ3 3.84Å; V764-W813 HydrophobicContact CB-CZ2 4.44Å; V764-W813 HydrophobicContact CG2-CZ2 3.84Å; Y781-W813 HydrophobicContact CG-CZ3 4.44Å; Y799-W813 CarbonylContact C-O 2.97Å; Y799-W813 WeakPolarHBondContact CA-O 3.5Å; Y799-W813 WeakPolarHBondContact CB-O 3.38Å; L800-W813 HydrophobicContact CB-CB 4.14Å; L800-W813 HydrophobicContact CD2-CB 4.26Å; L800-W813 HydrophobicContact CD2-CG 4.08Å; L800-W813 HydrophobicContact CG-CG 4.49Å; L800-W813 PolarHBondContact N-O 2.98Å; L800-W813 PolarHBondContact O-N 3.38Å; S802-W813 PolarHBondContact OG-NE1 3.23Å; L811-W813 HydrophobicContact CB-CZ2 3.87Å; L811-W813 HydrophobicContact CD1-CH2 4.05Å; L811-W813 HydrophobicContact CD1-CZ2 3.63Å; L811-W813 HydrophobicContact CG-CZ2 4.41Å; L811-W813 PolarHBondContact O-NE1 3.26Å
814	R	92.2	Very high	92.3	Very high	110 Å²	110	30.5 Å²	30.5	42%	0.415	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.1	175.2	-175.2	169.9	174.5	178.3	4.4	109.7	L221 K222 D224 Y799 V816	L221-R814 CarbonylContact C-O 3.23Å; L221-R814 WeakPolarHBondContact CA-O 3.26Å; K222-R814 PolarHBondContact N-O 3.32Å; K222-R814 PolarHBondContact O-N 2.96Å; D224-R814 HydrophobicContact CB-CB 3.79Å; D224-R814 WeakPolarHBondContact OD2-CD 3.43Å; D224-R814 IonicContact OD2-CZ 2.8Å; D224-R814 IonicContact OD2-NE 3.24Å; D224-R814 IonicContact OD2-NH1 2.95Å; D224-R814 PolarHBondContact OD2-NH1 3.02Å; Y799-R814 VanDerWaalsContact CD1-CA 3.48Å; Y799-R814 HydrophobicContact CD1-CB 3.7Å; Y799-R814 HydrophobicContact CD1-CG 4.2Å; Y799-R814 HydrophobicContact CE1-CB 3.55Å; Y799-R814 HydrophobicContact CE1-CG 3.84Å; R814-V816 HydrophobicContact CG-CG1 4.13Å
815	I	91.1	Very high	92.3	Very high	27 Å²	27	33 Å²	33	14%	0.138	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	127.4	170.4	-48.4	-165.6	0	0	0	108.6	N219 K220 L221 L754 F793 D797 S798	N219-I815 HydrophobicContact CB-CG2 3.7Å; K220-I815 WeakPolarHBondContact O-CA 3.48Å; L221-I815 HydrophobicContact CD2-CG1 4.05Å; L754-I815 HydrophobicContact CD1-CD1 4.05Å; L754-I815 HydrophobicContact CD1-CG2 4.14Å; F793-I815 HydrophobicContact CD1-CD1 3.72Å; F793-I815 HydrophobicContact CE1-CD1 3.45Å; F793-I815 VanDerWaalsContact CE1-CD1 3.45Å; D797-I815 WeakPolarHBondContact O-CD1 3.41Å; S798-I815 PolarHBondContact O-N 3.27Å
816	V	89.4	Confident	92.2	Very high	103 Å²	103	36 Å²	36	62%	0.624	17%	0.171	S	C	*	.			trans	-127.7	0	-177.9	-62.6	0	0	0	0	113	N219 K220 K222 R814	N219-V816 CarbonylContact C-O 3.59Å; N219-V816 VanDerWaalsContact CA-O 3.31Å; N219-V816 WeakPolarHBondContact CA-O 3.39Å; K220-V816 HydrophobicContact CB-CG2 3.93Å; K220-V816 PolarHBondContact N-O 3.42Å; K220-V816 WeakPolarHBondContact O-CG2 3.44Å; K220-V816 PolarHBondContact O-N 2.97Å; K222-V816 HydrophobicContact CB-CG1 4.24Å; K222-V816 HydrophobicContact CB-CG2 4.27Å; R814-V816 HydrophobicContact CG-CG1 4.13Å

Retrieved 816 of 816 residues in 334.7 ms (Link to these results)

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