A0A087XX59_POEFO Loading...

ADAM metallopeptidase domain 9a

AlphaFold DB , UniProt , Accession A0A087XX59, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 829 aa.

						>A0A087XX59_POEFO|A0A087XX59
MKMGGRGGAALLELCGILLLLTGSCHCRDSQQTEHLASYQLTAPRPIGGRLRRDAEGRPPNQVSFIIPVDGNDLLVHLQRNEVLLPPDFTVFTYGPNGSLITSRPPVQNHCQYQGFVQDMEGSAVAMSVCSGLRGVMHLTNDSYGIEPLGSAPEQHLLYRLQDVTSQPRGCGTPHYGHGDAAEHAQYDPEEIQHRRRSRVKRAVLHKTHYVELLLVVDNDRFKHMNGNETAVREQMIHLANLIDGIYMQLNVRVVLVGLDIWTKQNLINTEGGAGEVLSRFTQWREKELVPRRRHDSAQLILMKSFGVTAGMAFVSTVCSRSHGGGINAFLNNNVAAFASIVAHELGHNLGMNHDDGRTCSCPAAACIMHSGATGSKNFSSCSADDFEKMILSTGGTCLLNVPRPDEAYSAPYCGNRLVDVGEECDCGSEKECEEDPCCEYRTCKLRPGAQCASGECCSGCQFLPGGTVCRSKKDQECDLPEYCNGSTSFCQSDVFVQNGHPCRNQQAYCYNGRCQHLDGQCQALFGPKATAAPDICFKDVNSKGDRFGNCGYQHSGYKKCESRNAQCGKLQCLNVKGGTVFGILPSIITTPIHGATCFGVDFMLGSDVPDPGMVNEGTKCGDNKVCMNFECRSADVLSYDCDVETKCHGHGVCNSNRNCHCDYGWSPPSCKLSGYGGSVDSGPTWNDKDTSLRDGLLVFFFLVLPLLALAAFVFLRRNELLRRLGLSRRKRSQGYQADGATSTKPTNPGRAPPPRAQPPPAGRGTANFIVRDGHHAQLLPPLQVVETSETSERAPPFAARPPPPPLKPKPSAASQPLVPQRPAPAPPV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	31.4	Very low	243 Å²	243	133.8 Å²	133.8	100%	1.197	82%	0.82	S	S	*	*				0	126.9	0	-67.5	153.1	169	0	0	106.1
2	K	27.8	Very low	32	Very low	180 Å²	180	133.5 Å²	133.5	78%	0.783	81%	0.809	S	S	*	*			cis	87.3	95.6	46	-165.4	-171	-170.9	-173.7	0	112
3	M	25.4	Very low	32.5	Very low	175 Å²	175	135.4 Å²	135.4	86%	0.862	80%	0.803	S	S	*	*			trans	63	153.8	164.3	-63.4	158	168.2	0	0	116.7
4	G	27.5	Very low	32.8	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	80%	0.8	S	S	*	*			cis	144.6	120.3	-10.8	0	0	0	0	0	114.1
5	G	29	Very low	33.2	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	78%	0.781	S	S	*	*			trans	72.9	116.1	154.7	0	0	0	0	0	119.5
6	R	30.9	Very low	33.3	Very low	260 Å²	260	126.1 Å²	126.1	98%	0.981	76%	0.756	S	S	*	*				-177.8	120.9	110.6	-100.4	172.5	172.5	178.9	-2.9	111.4
7	G	29.3	Very low	33.6	Very low	78 Å²	78	125.4 Å²	125.4	80%	0.804	75%	0.746	S	S	*	*			trans	-159.9	177.9	172.5	0	0	0	0	0	111
8	G	35.6	Very low	33.6	Very low	52 Å²	52	125.2 Å²	125.2	54%	0.536	74%	0.74	S	S	.	*			trans	96	-19.4	162.1	0	0	0	0	0	118.4	A10	G8-A10 VanDerWaalsContact C-N 3.32Å; G8-A10 PolarHBondContact O-N 3.45Å
9	A	34.2	Very low	33.8	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-24.1	-170.9	0	0	0	0	0	115.8
10	A	35.3	Very low	34	Very low	88 Å²	88	125.9 Å²	125.9	73%	0.727	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	0.2	-171.2	0	0	0	0	0	115.3	G8	G8-A10 VanDerWaalsContact C-N 3.32Å; G8-A10 PolarHBondContact O-N 3.45Å
11	L	38.4	Very low	34	Very low	148 Å²	148	126.8 Å²	126.8	78%	0.775	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-8.3	-175.5	-98.9	153.7	0	0	0	114
12	L	38.5	Very low	34.3	Very low	130 Å²	130	119.8 Å²	119.8	68%	0.681	71%	0.707	S	S	*	*	S	Bend	trans	-84.2	-39.1	-179.2	-77	164.1	0	0	0	113.3	L14 C15 G16	L12-L14 PolarHBondContact O-N 3.21Å; L12-C15 PolarHBondContact O-N 2.76Å; L12-G16 PolarHBondContact O-N 3.16Å
13	E	37.8	Very low	34.7	Very low	158 Å²	158	114.8 Å²	114.8	74%	0.738	71%	0.706	S	S	*	*	H	α-helix	trans	-66.2	-39.7	-176.7	-65.1	-159.5	139.2	0	0	113.4	C15 G16 I17	E13-C15 PolarHBondContact O-N 2.97Å; E13-G16 PolarHBondContact O-N 2.92Å; E13-I17 PolarHBondContact O-N 3.07Å; E13-I17 VanDerWaalsContact O-N 3.09Å
14	L	37.7	Very low	35.2	Very low	145 Å²	145	110.8 Å²	110.8	76%	0.759	70%	0.696	S	S	*	*	H	α-helix	trans	-64.1	-23.1	175.5	-92.7	146.8	0	0	0	113.3	L12	L12-L14 PolarHBondContact O-N 3.21Å
15	C	37.7	Very low	35.2	Very low	76 Å²	76	112.8 Å²	112.8	51%	0.514	70%	0.696	S	S	.	*	H	α-helix	trans	-84.4	-39.8	172.7	-159.9	0	0	0	0	111.5	L12 E13 I17 L18 L19	L12-C15 PolarHBondContact O-N 2.76Å; E13-C15 PolarHBondContact O-N 2.97Å; C15-I17 PolarHBondContact O-N 3.46Å; C15-L18 PolarHBondContact O-N 2.87Å; C15-L19 PolarHBondContact O-N 3.02Å
16	G	35.4	Very low	35.3	Very low	37 Å²	37	117.1 Å²	117.1	38%	0.381	70%	0.696	S	S	.	*	H	α-helix	trans	-60.5	-40.1	177.9	0	0	0	0	0	113.9	L12 E13	L12-G16 PolarHBondContact O-N 3.16Å; E13-G16 PolarHBondContact O-N 2.92Å
17	I	38	Very low	35.4	Very low	113 Å²	113	108.9 Å²	108.9	58%	0.579	68%	0.678	S	S	*	*	H	α-helix	trans	-70.8	-34	-179.8	-65.4	171.8	0	0	0	111.9	E13 C15 L20	E13-I17 PolarHBondContact O-N 3.07Å; E13-I17 VanDerWaalsContact O-N 3.09Å; C15-I17 PolarHBondContact O-N 3.46Å; I17-L20 PolarHBondContact O-N 3.17Å
18	L	33.4	Very low	35.6	Very low	122 Å²	122	115.3 Å²	115.3	64%	0.639	68%	0.677	S	S	*	*	H	α-helix	trans	-77.4	-26	-179	-155.2	70.6	0	0	0	113	C15 L20 L21 T22	C15-L18 PolarHBondContact O-N 2.87Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L21 PolarHBondContact O-N 3.47Å; L18-T22 PolarHBondContact O-OG1 3.02Å
19	L	37.7	Very low	35.8	Very low	119 Å²	119	115.3 Å²	115.3	62%	0.623	67%	0.665	S	S	*	*	H	α-helix	trans	-70.6	-24.7	172.3	-80.5	163.5	0	0	0	113.1	C15 L21	C15-L19 PolarHBondContact O-N 3.02Å; L19-L21 VanDerWaalsContact C-N 3.27Å; L19-L21 PolarHBondContact O-N 3.04Å
20	L	36.9	Very low	36.7	Very low	146 Å²	146	113.4 Å²	113.4	76%	0.764	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-10.6	175.7	-70.6	169.1	0	0	0	113.8	I17 L18	I17-L20 PolarHBondContact O-N 3.17Å; L18-L20 VanDerWaalsContact C-N 3.31Å
21	L	35.2	Very low	38	Very low	144 Å²	144	117 Å²	117	75%	0.754	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	3.9	-178.8	-68.4	173	0	0	0	113.8	L18 L19	L18-L21 PolarHBondContact O-N 3.47Å; L19-L21 VanDerWaalsContact C-N 3.27Å; L19-L21 PolarHBondContact O-N 3.04Å
22	T	38.3	Very low	39.5	Very low	97 Å²	97	111.4 Å²	111.4	60%	0.595	62%	0.618	S	S	*	*			trans	-120.3	33.9	174	49.7	0	0	0	0	112.6	L18 S24	L18-T22 PolarHBondContact O-OG1 3.02Å; T22-S24 PolarHBondContact O-N 2.72Å
23	G	36.1	Very low	41.3	Very low	74 Å²	74	106.5 Å²	106.5	76%	0.763	59%	0.593	S	S	*	*			trans	-68.4	63.3	176.4	0	0	0	0	0	114.7
24	S	35.3	Very low	43.2	Very low	91 Å²	91	104.9 Å²	104.9	64%	0.636	59%	0.586	S	S	*	*			trans	-142.8	34	177.2	-75.2	0	0	0	0	112.6	T22 H26	T22-S24 PolarHBondContact O-N 2.72Å; S24-H26 PolarHBondContact O-N 3.07Å; S24-H26 PolarHBondContact O-ND1 3.37Å
25	C	28.9	Very low	44.9	Very low	117 Å²	117	100 Å²	100	79%	0.791	56%	0.559	S	S	*	*			trans	-65.5	100.2	163.6	-162.5	0	0	0	0	108.1	C27	C25-C27 PolarHBondContact O-N 3.06Å; C25-C27 PolarHBondContact O-SG 3.3Å
26	H	30.4	Very low	46.9	Very low	167 Å²	167	97.1 Å²	97.1	77%	0.773	54%	0.538	S	S	*	.			trans	-70.3	93.1	-176.3	-83.3	55.2	0	0	0	110	S24 R28	S24-H26 PolarHBondContact O-N 3.07Å; S24-H26 PolarHBondContact O-ND1 3.37Å; H26-R28 VanDerWaalsContact C-N 3.34Å; H26-R28 PolarHBondContact O-N 2.72Å
27	C	32.2	Very low	49	Very low	87 Å²	87	99.1 Å²	99.1	59%	0.588	55%	0.551	S	S	*	*			trans	-68.3	88.5	179.2	-66.3	0	0	0	0	110.4	C25 D29 S30	C25-C27 PolarHBondContact O-N 3.06Å; C25-C27 PolarHBondContact O-SG 3.3Å; C27-D29 PolarHBondContact O-N 3.37Å; C27-D29 VanDerWaalsContact O-N 3.14Å; C27-S30 VanDerWaalsContact O-CB 3.31Å; C27-S30 WeakPolarHBondContact O-CB 3.38Å; C27-S30 PolarHBondContact O-N 2.7Å
28	R	35.3	Very low	51.3	Low	212 Å²	212	96.8 Å²	96.8	80%	0.8	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.6	-179.8	-161.8	175.6	-175.5	-172.3	0.6	113	H26 S30	H26-R28 VanDerWaalsContact C-N 3.34Å; H26-R28 PolarHBondContact O-N 2.72Å; R28-S30 VanDerWaalsContact C-N 3.31Å; R28-S30 PolarHBondContact O-N 3.09Å
29	D	40.1	Very low	53.9	Low	53 Å²	53	96 Å²	96	28%	0.283	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-25.3	174.3	-56.7	-71.2	0	0	0	113.7	C27 Q31 Q32 T33 S151	C27-D29 PolarHBondContact O-N 3.37Å; C27-D29 VanDerWaalsContact O-N 3.14Å; D29-Q31 PolarHBondContact O-N 2.94Å; D29-Q32 PolarHBondContact O-N 3.15Å; D29-Q32 VanDerWaalsContact O-N 3.1Å; D29-T33 PolarHBondContact O-N 3.35Å; D29-T33 VanDerWaalsContact O-N 3.1Å; D29-T33 PolarHBondContact O-OG1 2.7Å; D29-S151 WeakPolarHBondContact OD1-CB 3.45Å; D29-S151 PolarHBondContact OD1-OG 3.17Å
30	S	53	Low	56.5	Low	58 Å²	58	92.9 Å²	92.9	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-54.5	-54.8	-178	-169.6	0	0	0	0	111.5	C27 R28 Q32 T33 E34	C27-S30 VanDerWaalsContact O-CB 3.31Å; C27-S30 WeakPolarHBondContact O-CB 3.38Å; C27-S30 PolarHBondContact O-N 2.7Å; R28-S30 VanDerWaalsContact C-N 3.31Å; R28-S30 PolarHBondContact O-N 3.09Å; S30-Q32 PolarHBondContact O-N 2.74Å; S30-Q32 VanDerWaalsContact O-N 3.09Å; S30-T33 PolarHBondContact O-N 2.72Å; S30-T33 VanDerWaalsContact O-N 3.1Å; S30-E34 VanDerWaalsContact CB-OE1 3.31Å; S30-E34 WeakPolarHBondContact CB-OE1 3.34Å; S30-E34 WeakPolarHBondContact O-CB 3.42Å; S30-E34 WeakPolarHBondContact O-CG 3.49Å; S30-E34 PolarHBondContact O-N 2.71Å; S30-E34 PolarHBondContact OG-OE1 2.8Å
31	Q	60.6	Low	59.1	Low	163 Å²	163	90.3 Å²	90.3	76%	0.762	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-21.7	-178.8	-73.2	-170.8	-25.1	0	0	114.1	D29 E34	D29-Q31 PolarHBondContact O-N 2.94Å; Q31-E34 PolarHBondContact N-OE1 2.73Å
32	Q	70.2	Confident	61.8	Low	31 Å²	31	83.8 Å²	83.8	15%	0.145	47%	0.469	C	S	.	.	H	α-helix	trans	-83.6	-36.3	176.9	-162.9	174.1	-0.7	0	0	111.4	D29 S30 H35 E147 P148 L157	D29-Q32 PolarHBondContact O-N 3.15Å; D29-Q32 VanDerWaalsContact O-N 3.1Å; S30-Q32 PolarHBondContact O-N 2.74Å; S30-Q32 VanDerWaalsContact O-N 3.09Å; Q32-H35 PolarHBondContact O-CE1 3.43Å; Q32-H35 PolarHBondContact O-ND1 3.09Å; Q32-E147 PolarHBondContact NE2-OE1 3.39Å; Q32-P148 PolarHBondContact NE2-O 2.83Å; Q32-L157 HydrophobicContact CG-CD1 3.72Å
33	T	77.6	Confident	64.3	Low	27 Å²	27	81.6 Å²	81.6	17%	0.166	46%	0.461	C	S	.	.	H	α-helix	trans	-96.6	-13.8	-176.7	56.8	0	0	0	0	114.9	D29 S30 H35 L36 Y39 L157	D29-T33 PolarHBondContact O-N 3.35Å; D29-T33 VanDerWaalsContact O-N 3.1Å; D29-T33 PolarHBondContact O-OG1 2.7Å; S30-T33 PolarHBondContact O-N 2.72Å; S30-T33 VanDerWaalsContact O-N 3.1Å; T33-H35 PolarHBondContact O-N 3.34Å; T33-L36 PolarHBondContact O-N 3.18Å; T33-Y39 HydrophobicContact CG2-CD1 4.29Å; T33-Y39 HydrophobicContact CG2-CE1 3.71Å; T33-Y39 HydrophobicContact CG2-CE2 4.27Å; T33-L157 HydrophobicContact CG2-CD1 4.06Å; T33-L157 HydrophobicContact CG2-CD2 3.96Å
34	E	77.4	Confident	66.9	Low	123 Å²	123	79 Å²	79	58%	0.575	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-20.7	175.2	-91.1	158.3	-138.7	0	0	115	S30 Q31	S30-E34 VanDerWaalsContact CB-OE1 3.31Å; S30-E34 WeakPolarHBondContact CB-OE1 3.34Å; S30-E34 WeakPolarHBondContact O-CB 3.42Å; S30-E34 WeakPolarHBondContact O-CG 3.49Å; S30-E34 PolarHBondContact O-N 2.71Å; S30-E34 PolarHBondContact OG-OE1 2.8Å; Q31-E34 PolarHBondContact N-OE1 2.73Å
35	H	73.6	Confident	69.5	Low	44 Å²	44	80 Å²	80	20%	0.204	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	15.8	-178.3	83	-73.9	0	0	0	114.5	Q32 T33 V164 T165 N334	Q32-H35 PolarHBondContact O-CE1 3.43Å; Q32-H35 PolarHBondContact O-ND1 3.09Å; T33-H35 PolarHBondContact O-N 3.34Å; H35-V164 CarbonylContact O-C 3.54Å; H35-T165 VanDerWaalsContact CA-OG1 3.25Å; H35-T165 WeakPolarHBondContact CA-OG1 3.39Å; H35-T165 PolarHBondContact O-N 2.9Å; H35-T165 PolarHBondContact O-OG1 3.17Å; H35-T165 VanDerWaalsContact O-OG1 3.12Å; H35-N334 PolarHBondContact CD2-ND2 2.93Å; H35-N334 VanDerWaalsContact CD2-ND2 3.34Å; H35-N334 PolarHBondContact NE2-ND2 2.91Å
36	L	78.8	Confident	72.3	Confident	15 Å²	15	76.7 Å²	76.7	8%	0.079	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-129	124.4	179.6	-57.3	175.2	0	0	0	110.5	T33 S38 Y39 L157 Y159 V164 T165	T33-L36 PolarHBondContact O-N 3.18Å; L36-S38 VanDerWaalsContact C-N 3.34Å; L36-Y39 HydrophobicContact CB-CD1 4.27Å; L36-Y39 HydrophobicContact CD1-CD1 4.36Å; L36-Y39 HydrophobicContact CD1-CG 4.44Å; L36-L157 HydrophobicContact CD1-CD1 4.47Å; L36-Y159 HydrophobicContact CD1-CD1 3.74Å; L36-Y159 HydrophobicContact CD1-CE1 4.25Å; L36-Y159 HydrophobicContact CD1-CG 4.06Å; L36-Y159 HydrophobicContact CD2-CD1 3.95Å; L36-Y159 HydrophobicContact CD2-CD2 3.63Å; L36-Y159 HydrophobicContact CD2-CE1 4.25Å; L36-Y159 HydrophobicContact CD2-CE2 3.96Å; L36-Y159 HydrophobicContact CD2-CG 3.62Å; L36-Y159 HydrophobicContact CG-CG 4.49Å; L36-V164 HydrophobicContact CD2-CG2 3.94Å; L36-T165 PolarHBondContact N-OG1 2.98Å
37	A	81.1	Confident	74.8	Confident	79 Å²	79	73.2 Å²	73.2	65%	0.653	38%	0.383	S	S	*	.	S	Bend	trans	-73.9	-27	171.9	0	0	0	0	0	112.6	D163 T165	A37-D163 PolarHBondContact N-O 3.24Å; A37-T165 HydrophobicContact CB-CG2 3.71Å
38	S	84.8	Confident	76.6	Confident	64 Å²	64	73.1 Å²	73.1	45%	0.448	40%	0.397	S	S	.	.			trans	-151.4	143.6	179.7	179.1	0	0	0	0	109.7	L36	L36-S38 VanDerWaalsContact C-N 3.34Å
39	Y	89.3	Confident	78	Confident	106 Å²	106	65 Å²	65	42%	0.416	38%	0.379	S	S	.	.			trans	-158.1	156.9	172.2	64.7	-90.2	0	0	0	110.2	T33 L36 L157 L158	T33-Y39 HydrophobicContact CG2-CD1 4.29Å; T33-Y39 HydrophobicContact CG2-CE1 3.71Å; T33-Y39 HydrophobicContact CG2-CE2 4.27Å; L36-Y39 HydrophobicContact CB-CD1 4.27Å; L36-Y39 HydrophobicContact CD1-CD1 4.36Å; L36-Y39 HydrophobicContact CD1-CG 4.44Å; Y39-L157 HydrophobicContact CD2-CD2 3.44Å; Y39-L157 VanDerWaalsContact CD2-CD2 3.44Å; Y39-L157 HydrophobicContact CE2-CD2 3.7Å; Y39-L157 HydrophobicContact CG-CD2 4.05Å; Y39-L158 WeakPolarHBondContact CA-O 3.38Å
40	Q	91.7	Very high	79	Confident	52 Å²	52	73.3 Å²	73.3	24%	0.243	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	154.2	165.9	74.8	-163.2	-77.1	0	0	110	D70 L158	Q40-D70 PolarHBondContact NE2-OD1 3.24Å; Q40-L158 HydrophobicContact CG-CB 3.88Å; Q40-L158 HydrophobicContact CG-CD2 3.81Å; Q40-L158 HydrophobicContact CG-CG 4.03Å; Q40-L158 PolarHBondContact N-O 2.91Å; Q40-L158 PolarHBondContact O-N 2.93Å
41	L	91.6	Very high	79.6	Confident	93 Å²	93	74.5 Å²	74.5	49%	0.487	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.6	169.7	-69.2	174.5	0	0	0	109.1	L149 L157	L41-L149 HydrophobicContact CD2-CD2 3.91Å; L41-L157 HydrophobicContact CD2-CD2 3.88Å
42	T	92.4	Very high	79.4	Confident	6 Å²	6	77.2 Å²	77.2	4%	0.037	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	159.4	177.1	-165.6	0	0	0	0	111.3	P44 I67 P68 I146 H156 L158	T42-P44 HydrophobicContact CG2-CG 4.29Å; T42-I67 HydrophobicContact CG2-CG2 4.27Å; T42-P68 WeakPolarHBondContact CB-O 3.33Å; T42-P68 WeakPolarHBondContact OG1-CD 3.45Å; T42-P68 PolarHBondContact OG1-O 2.79Å; T42-I146 HydrophobicContact CG2-CD1 4.05Å; T42-H156 HydrophobicContact CG2-CB 3.94Å; T42-H156 PolarHBondContact N-O 3.12Å; T42-H156 PolarHBondContact O-N 3.25Å; T42-L158 HydrophobicContact CG2-CB 3.75Å; T42-L158 HydrophobicContact CG2-CD2 4Å; T42-L158 HydrophobicContact CG2-CG 4.45Å
43	A	91	Very high	79	Confident	51 Å²	51	83.3 Å²	83.3	42%	0.421	43%	0.433	S	S	.	.			trans	-129.8	87	179.4	0	0	0	0	0	109.2	R45	A43-R45 PolarHBondContact O-N 2.75Å
44	P	90.8	Very high	77.9	Confident	19 Å²	19	84.4 Å²	84.4	12%	0.123	44%	0.438	C	S	.	.			trans	-62.4	131.3	-177.8	-24.5	36.6	0	0	0	112.6	T42 F65 I66 I67 L133 I146 H156	T42-P44 HydrophobicContact CG2-CG 4.29Å; P44-F65 HydrophobicContact CB-CD1 4.44Å; P44-I66 WeakPolarHBondContact CA-O 3.4Å; P44-I67 HydrophobicContact CB-CG1 4.2Å; P44-L133 HydrophobicContact CB-CD1 3.36Å; P44-L133 HydrophobicContact CG-CD1 3.71Å; P44-I146 HydrophobicContact CG-CD1 3.88Å; P44-H156 WeakPolarHBondContact CD-ND1 3.46Å; P44-H156 HydrophobicContact CG-CB 4.36Å
45	R	89.5	Confident	76.3	Confident	114 Å²	114	83.3 Å²	83.3	43%	0.43	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.2	-177.2	-72.1	172.6	-76.4	143.3	-3.5	111	A43 F65 I66 D73	A43-R45 PolarHBondContact O-N 2.75Å; R45-F65 WeakPolarHBondContact O-CA 3.42Å; R45-I66 HydrophobicContact CB-CB 4.38Å; R45-I66 PolarHBondContact N-O 2.93Å; R45-I66 PolarHBondContact O-N 2.82Å; R45-D73 IonicContact CZ-OD1 3.82Å; R45-D73 IonicContact CZ-OD2 3.69Å; R45-D73 IonicContact NH1-OD2 3.83Å; R45-D73 IonicContact NH2-OD1 3.92Å; R45-D73 PolarHBondContact NH2-OD1 3.39Å; R45-D73 IonicContact NH2-OD2 2.66Å; R45-D73 PolarHBondContact NH2-OD2 2.9Å
46	P	87.7	Confident	75.2	Confident	46 Å²	46	87.2 Å²	87.2	30%	0.299	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	132.9	175.8	26.7	-33.4	0	0	0	111.7	G49 L51 F65	P46-G49 WeakPolarHBondContact CB-O 3.37Å; P46-G49 VanDerWaalsContact CG-O 3.27Å; P46-G49 WeakPolarHBondContact CG-O 3.32Å; P46-L51 HydrophobicContact CB-CG 4.37Å; P46-F65 HydrophobicContact CB-CD1 3.9Å; P46-F65 HydrophobicContact CB-CE1 3.78Å; P46-F65 HydrophobicContact CG-CE1 4.46Å
47	I	83.1	Confident	74.4	Confident	94 Å²	94	87.8 Å²	87.8	48%	0.482	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	136.8	174.8	-65.2	179.2	0	0	0	109.3	S64 I66 L75	I47-S64 PolarHBondContact N-O 2.89Å; I47-I66 HydrophobicContact CD1-CD1 4.34Å; I47-I66 HydrophobicContact CD1-CG1 3.89Å; I47-I66 HydrophobicContact CG1-CD1 4.32Å; I47-I66 HydrophobicContact CG1-CG1 3.99Å; I47-L75 HydrophobicContact CD1-CD1 3.41Å; I47-L75 VanDerWaalsContact CD1-CD1 3.41Å
48	G	68.4	Low	73.7	Confident	85 Å²	85	87.4 Å²	87.4	88%	0.876	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-0.3	-171.4	0	0	0	0	0	114.6
49	G	64.8	Low	73	Confident	41 Å²	41	84.8 Å²	84.8	42%	0.423	44%	0.441	S	S	.	.	S	Bend	trans	94.3	-151.4	178.7	0	0	0	0	0	112.6	P46 L51	P46-G49 WeakPolarHBondContact CB-O 3.37Å; P46-G49 VanDerWaalsContact CG-O 3.27Å; P46-G49 WeakPolarHBondContact CG-O 3.32Å; G49-L51 PolarHBondContact O-N 3.22Å
50	R	62.3	Low	72.6	Confident	229 Å²	229	81.6 Å²	81.6	86%	0.864	43%	0.433	S	S	*	.	S	Bend	trans	-58.6	134.2	178.3	-81.6	-173.8	170.6	178	-3.2	110.7	R52	R50-R52 PolarHBondContact O-N 3.34Å
51	L	64.3	Low	72.1	Confident	83 Å²	83	83 Å²	83	44%	0.435	44%	0.442	S	S	.	.			trans	-53.5	95.7	171.7	-70.8	158.9	0	0	0	110.4	P46 G49 R53 V63 F65	P46-L51 HydrophobicContact CB-CG 4.37Å; G49-L51 PolarHBondContact O-N 3.22Å; L51-R53 PolarHBondContact O-N 2.74Å; L51-V63 HydrophobicContact CD2-CB 4.13Å; L51-V63 HydrophobicContact CD2-CG1 3.56Å; L51-F65 HydrophobicContact CD1-CE1 4.2Å; L51-F65 HydrophobicContact CD1-CZ 3.93Å; L51-F65 HydrophobicContact CD2-CZ 4.22Å
52	R	57.7	Low	71.8	Confident	220 Å²	220	85.1 Å²	85.1	83%	0.83	45%	0.45	S	S	*	.			trans	-78.1	118.2	173	-78	179	168.1	166.1	-3.6	108.2	R50	R50-R52 PolarHBondContact O-N 3.34Å
53	R	60.4	Low	71.7	Confident	158 Å²	158	85.5 Å²	85.5	60%	0.596	45%	0.452	S	S	*	.			trans	-60.4	153.2	157.6	-69.8	168	178.9	-96.9	1.8	108.7	L51 G57 R58	L51-R53 PolarHBondContact O-N 2.74Å; R53-G57 VanDerWaalsContact CD-O 3.28Å; R53-G57 WeakPolarHBondContact CD-O 3.45Å; R53-G57 PolarHBondContact NH1-O 3.14Å; R53-R58 WeakPolarHBondContact CA-O 3.24Å; R53-R58 WeakPolarHBondContact CB-O 3.46Å
54	D	55.1	Low	71.7	Confident	51 Å²	51	84.4 Å²	84.4	27%	0.273	44%	0.441	S	S	.	.			trans	-72.1	-177.5	174.3	66.1	13	0	0	0	112.3	E56 G57 R58	D54-E56 PolarHBondContact O-N 2.85Å; D54-E56 PolarHBondContact OD1-N 2.94Å; D54-E56 VanDerWaalsContact OD1-N 3.16Å; D54-G57 PolarHBondContact O-N 3.27Å; D54-G57 PolarHBondContact OD1-N 2.84Å; D54-G57 VanDerWaalsContact OD1-N 3.08Å; D54-R58 PolarHBondContact N-O 3.48Å; D54-R58 VanDerWaalsContact N-O 3.12Å; D54-R58 WeakPolarHBondContact OD1-CB 3.37Å; D54-R58 PolarHBondContact OD1-N 2.91Å; D54-R58 IonicContact OD1-NE 3.54Å; D54-R58 IonicContact OD2-CZ 3.23Å; D54-R58 IonicContact OD2-NE 3.48Å; D54-R58 PolarHBondContact OD2-NE 2.85Å; D54-R58 IonicContact OD2-NH2 3.48Å; D54-R58 PolarHBondContact OD2-NH2 2.85Å
55	A	44.7	Very low	71.8	Confident	99 Å²	99	83.9 Å²	83.9	82%	0.818	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.4	-177.8	0	0	0	0	0	113.2
56	E	51	Low	72	Confident	126 Å²	126	80.5 Å²	80.5	59%	0.589	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	0.3	176	-62.2	74.7	-127.1	0	0	112.8	D54 R58	D54-E56 PolarHBondContact O-N 2.85Å; D54-E56 PolarHBondContact OD1-N 2.94Å; D54-E56 VanDerWaalsContact OD1-N 3.16Å; E56-R58 HydrophobicContact CB-CG 4.37Å; E56-R58 IonicContact OE2-CZ 2.66Å; E56-R58 IonicContact OE2-NH2 3.23Å; E56-R58 PolarHBondContact OE2-NH2 2.88Å
57	G	60.6	Low	72.3	Confident	28 Å²	28	78.3 Å²	78.3	29%	0.289	41%	0.413	S	S	.	.	S	Bend	trans	84.2	10.6	178.2	0	0	0	0	0	115	R53 D54	R53-G57 VanDerWaalsContact CD-O 3.28Å; R53-G57 WeakPolarHBondContact CD-O 3.45Å; R53-G57 PolarHBondContact NH1-O 3.14Å; D54-G57 PolarHBondContact O-N 3.27Å; D54-G57 PolarHBondContact OD1-N 2.84Å; D54-G57 VanDerWaalsContact OD1-N 3.08Å
58	R	65.9	Low	72.8	Confident	70 Å²	70	75.5 Å²	75.5	26%	0.264	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-79.9	151.1	-179	-54.2	177.6	-65.6	-141.1	-10.3	111.6	R53 D54 E56	R53-R58 WeakPolarHBondContact CA-O 3.24Å; R53-R58 WeakPolarHBondContact CB-O 3.46Å; D54-R58 PolarHBondContact N-O 3.48Å; D54-R58 VanDerWaalsContact N-O 3.12Å; D54-R58 WeakPolarHBondContact OD1-CB 3.37Å; D54-R58 PolarHBondContact OD1-N 2.91Å; D54-R58 IonicContact OD1-NE 3.54Å; D54-R58 IonicContact OD2-CZ 3.23Å; D54-R58 IonicContact OD2-NE 3.48Å; D54-R58 PolarHBondContact OD2-NE 2.85Å; D54-R58 IonicContact OD2-NH2 3.48Å; D54-R58 PolarHBondContact OD2-NH2 2.85Å; E56-R58 HydrophobicContact CB-CG 4.37Å; E56-R58 IonicContact OE2-CZ 2.66Å; E56-R58 IonicContact OE2-NH2 3.23Å; E56-R58 PolarHBondContact OE2-NH2 2.88Å
59	P	71.8	Confident	73.8	Confident	10 Å²	10	71.8 Å²	71.8	7%	0.065	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-62.4	138.9	168.5	-20.5	34.1	0	0	0	111.1	R80 N109 Y113	P59-R80 PolarHBondContact O-NH1 2.93Å; P59-N109 WeakPolarHBondContact CG-O 3.4Å; P59-Y113 VanDerWaalsContact CB-OH 3.27Å; P59-Y113 WeakPolarHBondContact CB-OH 3.41Å
60	P	79.1	Confident	74.8	Confident	39 Å²	39	73.5 Å²	73.5	25%	0.253	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-64.8	142.5	-178.6	25.7	-34.6	0	0	0	112.6	Q62 V63 Y113	P60-Q62 PolarHBondContact O-N 3.03Å; P60-Q62 VanDerWaalsContact O-N 3.17Å; P60-V63 HydrophobicContact CG-CG1 3.64Å; P60-Y113 WeakPolarHBondContact O-CE1 3.32Å; P60-Y113 PolarHBondContact O-OH 2.84Å
61	N	81.4	Confident	75.7	Confident	80 Å²	80	66.4 Å²	66.4	43%	0.428	36%	0.358	S	S	.	.	S	Bend	trans	-60	-29.2	-172.9	-66.4	31.5	0	0	0	114.2	R80 E82	N61-R80 PolarHBondContact ND2-NH2 2.87Å; N61-R80 PolarHBondContact O-N 2.86Å; N61-R80 VanDerWaalsContact OD1-CZ 3.3Å; N61-R80 PolarHBondContact OD1-NH1 3.44Å; N61-R80 PolarHBondContact OD1-NH2 3.46Å; N61-E82 PolarHBondContact ND2-OE1 3.48Å
62	Q	86.9	Confident	76.8	Confident	138 Å²	138	67.6 Å²	67.6	65%	0.645	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.9	174.7	-71.6	178.3	-12.7	0	0	109.6	P60 L78 Q79	P60-Q62 PolarHBondContact O-N 3.03Å; P60-Q62 VanDerWaalsContact O-N 3.17Å; Q62-L78 CarbonylContact C-O 3.34Å; Q62-L78 WeakPolarHBondContact CA-O 3.44Å; Q62-Q79 HydrophobicContact CG-CB 4.35Å; Q62-Q79 HydrophobicContact CG-CG 4.31Å
63	V	90.1	Very high	78.5	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	161.9	173.4	-60	0	0	0	0	109.3	L51 P60 F65 L78 Y113	L51-V63 HydrophobicContact CD2-CB 4.13Å; L51-V63 HydrophobicContact CD2-CG1 3.56Å; P60-V63 HydrophobicContact CG-CG1 3.64Å; V63-F65 HydrophobicContact CB-CE2 4.2Å; V63-F65 HydrophobicContact CG2-CD2 4.3Å; V63-F65 HydrophobicContact CG2-CE2 3.62Å; V63-F65 HydrophobicContact CG2-CZ 4.47Å; V63-L78 HydrophobicContact CG2-CB 3.63Å; V63-L78 HydrophobicContact CG2-CD1 4.04Å; V63-L78 HydrophobicContact CG2-CG 4.43Å; V63-L78 PolarHBondContact N-O 3.03Å; V63-L78 PolarHBondContact O-N 3.27Å; V63-L78 VanDerWaalsContact O-O 3.12Å; V63-Y113 HydrophobicContact CG1-CE1 4.2Å; V63-Y113 HydrophobicContact CG2-CD1 3.97Å; V63-Y113 HydrophobicContact CG2-CE1 3.88Å
64	S	91.3	Very high	80.1	Confident	28 Å²	28	55.2 Å²	55.2	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	142.9	171.7	-58.5	0	0	0	0	110.3	I47 V76 H77	I47-S64 PolarHBondContact N-O 2.89Å; S64-V76 CarbonylContact C-O 3.56Å; S64-V76 WeakPolarHBondContact CA-O 3.43Å; S64-V76 WeakPolarHBondContact CB-O 3.04Å; S64-H77 PolarHBondContact OG-ND1 3.26Å
65	F	92.1	Very high	81.8	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.035	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.5	-177.1	-64.6	-91.7	0	0	0	110.2	P44 R45 P46 L51 V63 I67 V76 L78 V129 L133	P44-F65 HydrophobicContact CB-CD1 4.44Å; R45-F65 WeakPolarHBondContact O-CA 3.42Å; P46-F65 HydrophobicContact CB-CD1 3.9Å; P46-F65 HydrophobicContact CB-CE1 3.78Å; P46-F65 HydrophobicContact CG-CE1 4.46Å; L51-F65 HydrophobicContact CD1-CE1 4.2Å; L51-F65 HydrophobicContact CD1-CZ 3.93Å; L51-F65 HydrophobicContact CD2-CZ 4.22Å; V63-F65 HydrophobicContact CB-CE2 4.2Å; V63-F65 HydrophobicContact CG2-CD2 4.3Å; V63-F65 HydrophobicContact CG2-CE2 3.62Å; V63-F65 HydrophobicContact CG2-CZ 4.47Å; F65-I67 HydrophobicContact CB-CD1 4.44Å; F65-I67 HydrophobicContact CB-CG1 4.02Å; F65-V76 PolarHBondContact N-O 3.49Å; F65-V76 PolarHBondContact O-N 3.29Å; F65-L78 HydrophobicContact CD2-CD1 4Å; F65-L78 HydrophobicContact CE2-CD1 3.98Å; F65-V129 HydrophobicContact CE2-CG1 4.12Å; F65-V129 HydrophobicContact CZ-CG1 4.19Å; F65-L133 HydrophobicContact CD1-CD1 3.74Å; F65-L133 HydrophobicContact CD2-CD1 4.31Å; F65-L133 HydrophobicContact CD2-CD2 4.18Å; F65-L133 HydrophobicContact CE1-CD1 3.82Å; F65-L133 HydrophobicContact CE1-CG 4.32Å; F65-L133 HydrophobicContact CE2-CD1 4.38Å; F65-L133 HydrophobicContact CE2-CD2 3.84Å; F65-L133 HydrophobicContact CE2-CG 4.47Å; F65-L133 HydrophobicContact CG-CD1 3.99Å; F65-L133 HydrophobicContact CZ-CD1 4.14Å; F65-L133 HydrophobicContact CZ-CD2 4.03Å; F65-L133 HydrophobicContact CZ-CG 4.21Å
66	I	93.8	Very high	84.1	Confident	43 Å²	43	50.1 Å²	50.1	22%	0.221	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.3	162.1	-52.5	176.3	0	0	0	106.7	P44 R45 I47 D73 L74	P44-I66 WeakPolarHBondContact CA-O 3.4Å; R45-I66 HydrophobicContact CB-CB 4.38Å; R45-I66 PolarHBondContact N-O 2.93Å; R45-I66 PolarHBondContact O-N 2.82Å; I47-I66 HydrophobicContact CD1-CD1 4.34Å; I47-I66 HydrophobicContact CD1-CG1 3.89Å; I47-I66 HydrophobicContact CG1-CD1 4.32Å; I47-I66 HydrophobicContact CG1-CG1 3.99Å; I66-D73 HydrophobicContact CG2-CB 3.55Å; I66-D73 WeakPolarHBondContact CG2-OD1 3.49Å; I66-D73 WeakPolarHBondContact CG2-OD2 3.44Å; I66-L74 CarbonylContact C-O 3.6Å; I66-L74 WeakPolarHBondContact CA-O 3.19Å
67	I	93.6	Very high	85.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.2	179.4	-52	-168.1	0	0	0	108.2	T42 P44 F65 V69 L74 V76 M127 L133 M137 I146	T42-I67 HydrophobicContact CG2-CG2 4.27Å; P44-I67 HydrophobicContact CB-CG1 4.2Å; F65-I67 HydrophobicContact CB-CD1 4.44Å; F65-I67 HydrophobicContact CB-CG1 4.02Å; I67-V69 HydrophobicContact CG2-CG2 4.08Å; I67-V69 PolarHBondContact O-N 2.92Å; I67-L74 PolarHBondContact N-O 3.09Å; I67-L74 PolarHBondContact O-N 3.34Å; I67-V76 HydrophobicContact CB-CG2 4.47Å; I67-V76 HydrophobicContact CD1-CB 4.45Å; I67-V76 HydrophobicContact CD1-CG2 3.87Å; I67-V76 HydrophobicContact CG1-CG2 3.99Å; I67-M127 HydrophobicContact CD1-CE 4.01Å; I67-L133 HydrophobicContact CD1-CD1 4.44Å; I67-M137 HydrophobicContact CD1-SD 4.04Å; I67-M137 HydrophobicContact CG2-CE 4.32Å; I67-I146 HydrophobicContact CD1-CD1 4.25Å; I67-I146 HydrophobicContact CG2-CD1 4.2Å
68	P	92.9	Very high	87.4	Confident	35 Å²	35	45.1 Å²	45.1	23%	0.227	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	124.1	169.5	-21.8	30.6	0	0	0	111.2	T42 N72 L158	T42-P68 WeakPolarHBondContact CB-O 3.33Å; T42-P68 WeakPolarHBondContact OG1-CD 3.45Å; T42-P68 PolarHBondContact OG1-O 2.79Å; P68-N72 CarbonylContact C-O 3.57Å; P68-N72 WeakPolarHBondContact CA-O 3.39Å; P68-L158 WeakPolarHBondContact O-CD2 3.39Å
69	V	89.7	Confident	88.5	Confident	7 Å²	7	47 Å²	47	4%	0.042	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	121.3	177.2	-174.9	0	0	0	0	109.1	I67 G71 N72 L74 M137 Y144 L158	I67-V69 HydrophobicContact CG2-CG2 4.08Å; I67-V69 PolarHBondContact O-N 2.92Å; V69-G71 PolarHBondContact O-N 3.44Å; V69-N72 PolarHBondContact N-O 2.89Å; V69-N72 PolarHBondContact O-N 3.41Å; V69-L74 HydrophobicContact CB-CD1 3.94Å; V69-L74 HydrophobicContact CB-CG 4.11Å; V69-L74 HydrophobicContact CG1-CD1 4.45Å; V69-L74 HydrophobicContact CG2-CB 4.44Å; V69-L74 HydrophobicContact CG2-CD1 3.54Å; V69-L74 HydrophobicContact CG2-CG 3.86Å; V69-M137 HydrophobicContact CG2-CE 4.28Å; V69-Y144 HydrophobicContact CG1-CD1 4.11Å; V69-Y144 HydrophobicContact CG1-CE1 3.57Å; V69-Y144 HydrophobicContact CG1-CE2 4.17Å; V69-L158 HydrophobicContact CB-CD2 4.14Å; V69-L158 HydrophobicContact CG1-CD2 4.14Å; V69-L158 HydrophobicContact CG2-CD2 3.71Å
70	D	85.2	Confident	89.3	Confident	78 Å²	78	47.7 Å²	47.7	42%	0.417	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	34.1	175.4	-60.9	-8.5	0	0	0	112.9	Q40 N72 Y144 R160	Q40-D70 PolarHBondContact NE2-OD1 3.24Å; D70-N72 PolarHBondContact O-ND2 3.41Å; D70-Y144 PolarHBondContact OD2-OH 2.82Å; D70-R160 IonicContact OD2-CZ 2.72Å; D70-R160 IonicContact OD2-NE 3.57Å; D70-R160 IonicContact OD2-NH2 3.78Å; D70-R160 PolarHBondContact OD2-NH2 3.41Å
71	G	82.2	Confident	89.7	Confident	79 Å²	79	46.2 Å²	46.2	81%	0.814	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-5.2	-178.4	0	0	0	0	0	116.2	V69	V69-G71 PolarHBondContact O-N 3.44Å
72	N	88	Confident	89.7	Confident	109 Å²	109	47.2 Å²	47.2	58%	0.583	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.4	-179.8	-61.5	-79.3	0	0	0	111.6	P68 V69 D70 L74	P68-N72 CarbonylContact C-O 3.57Å; P68-N72 WeakPolarHBondContact CA-O 3.39Å; V69-N72 PolarHBondContact N-O 2.89Å; V69-N72 PolarHBondContact O-N 3.41Å; D70-N72 PolarHBondContact O-ND2 3.41Å; N72-L74 PolarHBondContact O-N 2.94Å
73	D	92.6	Very high	89.3	Confident	91 Å²	91	43.1 Å²	43.1	49%	0.487	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	100.1	175.2	-96.2	-9.9	0	0	0	110.4	R45 I66	R45-D73 IonicContact CZ-OD1 3.82Å; R45-D73 IonicContact CZ-OD2 3.69Å; R45-D73 IonicContact NH1-OD2 3.83Å; R45-D73 IonicContact NH2-OD1 3.92Å; R45-D73 PolarHBondContact NH2-OD1 3.39Å; R45-D73 IonicContact NH2-OD2 2.66Å; R45-D73 PolarHBondContact NH2-OD2 2.9Å; I66-D73 HydrophobicContact CG2-CB 3.55Å; I66-D73 WeakPolarHBondContact CG2-OD1 3.49Å; I66-D73 WeakPolarHBondContact CG2-OD2 3.44Å
74	L	93	Very high	89.1	Confident	27 Å²	27	42.4 Å²	42.4	14%	0.141	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.3	174	-61.2	-170.3	0	0	0	110.7	I66 I67 V69 N72 V76 V117 L139	I66-L74 CarbonylContact C-O 3.6Å; I66-L74 WeakPolarHBondContact CA-O 3.19Å; I67-L74 PolarHBondContact N-O 3.09Å; I67-L74 PolarHBondContact O-N 3.34Å; V69-L74 HydrophobicContact CB-CD1 3.94Å; V69-L74 HydrophobicContact CB-CG 4.11Å; V69-L74 HydrophobicContact CG1-CD1 4.45Å; V69-L74 HydrophobicContact CG2-CB 4.44Å; V69-L74 HydrophobicContact CG2-CD1 3.54Å; V69-L74 HydrophobicContact CG2-CG 3.86Å; N72-L74 PolarHBondContact O-N 2.94Å; L74-V76 PolarHBondContact O-N 2.03Å; L74-V117 HydrophobicContact CB-CG1 4.14Å; L74-V117 HydrophobicContact CD2-CG1 4.4Å; L74-L139 HydrophobicContact CD1-CD1 3.83Å; L74-L139 HydrophobicContact CD1-CD2 4.19Å
75	L	92.7	Very high	88.9	Confident	42 Å²	42	41.3 Å²	41.3	22%	0.22	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	105.7	173.3	175	43.1	0	0	0	110	I47 V117 Q118	I47-L75 HydrophobicContact CD1-CD1 3.41Å; I47-L75 VanDerWaalsContact CD1-CD1 3.41Å; L75-V117 WeakPolarHBondContact O-CA 3.17Å; L75-Q118 HydrophobicContact CB-CB 4.04Å; L75-Q118 HydrophobicContact CD2-CB 4.27Å; L75-Q118 VanDerWaalsContact CD2-OE1 3.26Å; L75-Q118 HydrophobicContact CG-CB 3.95Å; L75-Q118 PolarHBondContact O-N 2.57Å
76	V	92.2	Very high	88.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.4	-178.3	-174.6	0	0	0	0	109.9	S64 F65 I67 L74 L78 V117 V125 M137	S64-V76 CarbonylContact C-O 3.56Å; S64-V76 WeakPolarHBondContact CA-O 3.43Å; S64-V76 WeakPolarHBondContact CB-O 3.04Å; F65-V76 PolarHBondContact N-O 3.49Å; F65-V76 PolarHBondContact O-N 3.29Å; I67-V76 HydrophobicContact CB-CG2 4.47Å; I67-V76 HydrophobicContact CD1-CB 4.45Å; I67-V76 HydrophobicContact CD1-CG2 3.87Å; I67-V76 HydrophobicContact CG1-CG2 3.99Å; L74-V76 PolarHBondContact O-N 2.03Å; V76-L78 HydrophobicContact CG1-CD2 4.19Å; V76-L78 HydrophobicContact CG1-CG 4.12Å; V76-V117 HydrophobicContact CG2-CG2 4.37Å; V76-V125 HydrophobicContact CG1-CB 4.43Å; V76-V125 HydrophobicContact CG1-CG1 3.95Å; V76-V125 HydrophobicContact CG1-CG2 4.13Å; V76-M137 HydrophobicContact CG2-SD 3.87Å
77	H	89.3	Confident	87.6	Confident	44 Å²	44	42.5 Å²	42.5	20%	0.204	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.7	172.5	-61.7	-64.8	0	0	0	110.2	S64 G115 F116 Q118	S64-H77 PolarHBondContact OG-ND1 3.26Å; H77-G115 WeakPolarHBondContact O-CA 3.08Å; H77-F116 HydrophobicContact CB-CD1 4.46Å; H77-F116 HydrophobicContact CB-CE1 4.03Å; H77-F116 HydrophobicContact CB-CE2 4.4Å; H77-F116 HydrophobicContact CB-CZ 3.99Å; H77-F116 AromaticContact CD2-CE2 3.63Å; H77-F116 AromaticContact CD2-CZ 3.8Å; H77-F116 PolarHBondContact N-O 3.12Å; H77-F116 PolarHBondContact O-N 3.43Å; H77-F116 VanDerWaalsContact O-N 3.13Å; H77-Q118 PolarHBondContact NE2-OE1 3.16Å
78	L	90.9	Very high	86.5	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.4	-175.7	-71.2	179.1	0	0	0	110.8	Q62 V63 F65 V76 Y113 Q114 V125 M127	Q62-L78 CarbonylContact C-O 3.34Å; Q62-L78 WeakPolarHBondContact CA-O 3.44Å; V63-L78 HydrophobicContact CG2-CB 3.63Å; V63-L78 HydrophobicContact CG2-CD1 4.04Å; V63-L78 HydrophobicContact CG2-CG 4.43Å; V63-L78 PolarHBondContact N-O 3.03Å; V63-L78 PolarHBondContact O-N 3.27Å; V63-L78 VanDerWaalsContact O-O 3.12Å; F65-L78 HydrophobicContact CD2-CD1 4Å; F65-L78 HydrophobicContact CE2-CD1 3.98Å; V76-L78 HydrophobicContact CG1-CD2 4.19Å; V76-L78 HydrophobicContact CG1-CG 4.12Å; L78-Y113 HydrophobicContact CB-CD1 3.91Å; L78-Y113 HydrophobicContact CB-CG 4.21Å; L78-Q114 WeakPolarHBondContact CA-O 3.25Å; L78-V125 HydrophobicContact CD2-CB 4.25Å; L78-V125 HydrophobicContact CD2-CG1 3.68Å; L78-M127 HydrophobicContact CD1-CB 4.24Å; L78-M127 HydrophobicContact CD1-SD 4.06Å
79	Q	89.1	Confident	86.2	Confident	110 Å²	110	41.1 Å²	41.1	51%	0.514	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.7	169.9	-179.3	167.4	-18.4	0	0	109.5	Q62 N81 Y113 Q114	Q62-Q79 HydrophobicContact CG-CB 4.35Å; Q62-Q79 HydrophobicContact CG-CG 4.31Å; Q79-N81 PolarHBondContact O-N 2.83Å; Q79-Y113 CarbonylContact O-C 3.43Å; Q79-Y113 VanDerWaalsContact O-CA 3.23Å; Q79-Y113 WeakPolarHBondContact O-CA 3.42Å; Q79-Y113 WeakPolarHBondContact O-CB 3.33Å; Q79-Q114 PolarHBondContact N-O 3.1Å; Q79-Q114 PolarHBondContact O-N 3.15Å; Q79-Q114 VanDerWaalsContact O-O 3.08Å
80	R	88.4	Confident	86.1	Confident	25 Å²	25	40.9 Å²	40.9	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	132.8	179.2	-175.2	173.7	63.4	-139	-0.6	108.8	P59 N61 E82 H110 Y113	P59-R80 PolarHBondContact O-NH1 2.93Å; N61-R80 PolarHBondContact ND2-NH2 2.87Å; N61-R80 PolarHBondContact O-N 2.86Å; N61-R80 VanDerWaalsContact OD1-CZ 3.3Å; N61-R80 PolarHBondContact OD1-NH1 3.44Å; N61-R80 PolarHBondContact OD1-NH2 3.46Å; R80-E82 VanDerWaalsContact C-N 3.29Å; R80-E82 HydrophobicContact CB-CG 4.37Å; R80-E82 HydrophobicContact CG-CG 4.33Å; R80-E82 IonicContact CZ-OE1 3.69Å; R80-E82 IonicContact NE-OE1 2.68Å; R80-E82 PolarHBondContact NE-OE1 2.86Å; R80-E82 IonicContact NH2-OE1 3.13Å; R80-E82 PolarHBondContact NH2-OE1 2.88Å; R80-E82 PolarHBondContact O-N 2.78Å; R80-H110 VanDerWaalsContact CG-CE1 3.5Å; R80-H110 WeakPolarHBondContact CG-CE1 3.48Å; R80-Y113 HydrophobicContact CB-CD1 4.13Å; R80-Y113 HydrophobicContact CB-CE1 3.84Å
81	N	87.4	Confident	86.5	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.037	21%	0.214	C	C	.	.			trans	-82.4	75.3	-177.9	-173	5.9	0	0	0	110.7	Q79 V83 L84 H110 Q112 Q114 N241 D244 R253	Q79-N81 PolarHBondContact O-N 2.83Å; N81-V83 PolarHBondContact O-N 3.08Å; N81-V83 VanDerWaalsContact O-N 3.08Å; N81-L84 HydrophobicContact CB-CB 4.23Å; N81-L84 VanDerWaalsContact O-CB 3.25Å; N81-L84 WeakPolarHBondContact O-CB 3.17Å; N81-L84 PolarHBondContact O-N 2.95Å; N81-H110 PolarHBondContact O-CE1 2.95Å; N81-H110 PolarHBondContact O-NE2 2.66Å; N81-Q112 PolarHBondContact N-O 3.13Å; N81-Q114 HydrophobicContact CB-CG 4.35Å; N81-Q114 PolarHBondContact ND2-NE2 3.1Å; N81-Q114 VanDerWaalsContact ND2-NE2 3.14Å; N81-Q114 PolarHBondContact ND2-OE1 3.1Å; N81-N241 PolarHBondContact ND2-OD1 2.87Å; N81-D244 PolarHBondContact ND2-OD2 3.34Å; N81-R253 PolarHBondContact OD1-NH2 3.15Å
82	E	82.1	Confident	87.1	Confident	102 Å²	102	33.9 Å²	33.9	48%	0.477	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.1	-172.8	-55.1	-172.9	139.2	0	0	114.3	N61 R80	N61-E82 PolarHBondContact ND2-OE1 3.48Å; R80-E82 VanDerWaalsContact C-N 3.29Å; R80-E82 HydrophobicContact CB-CG 4.37Å; R80-E82 HydrophobicContact CG-CG 4.33Å; R80-E82 IonicContact CZ-OE1 3.69Å; R80-E82 IonicContact NE-OE1 2.68Å; R80-E82 PolarHBondContact NE-OE1 2.86Å; R80-E82 IonicContact NH2-OE1 3.13Å; R80-E82 PolarHBondContact NH2-OE1 2.88Å; R80-E82 PolarHBondContact O-N 2.78Å
83	V	77.9	Confident	87.4	Confident	51 Å²	51	29 Å²	29	31%	0.309	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-17.5	176.3	178.3	0	0	0	0	111.7	N81 L85 Y210 V255	N81-V83 PolarHBondContact O-N 3.08Å; N81-V83 VanDerWaalsContact O-N 3.08Å; V83-L85 PolarHBondContact O-N 3.38Å; V83-Y210 HydrophobicContact CG1-CE1 4.22Å; V83-V255 HydrophobicContact CG1-CG2 3.78Å; V83-V255 VanDerWaalsContact O-CG1 3.28Å; V83-V255 WeakPolarHBondContact O-CG1 3.46Å; V83-V255 VanDerWaalsContact O-CG2 3.3Å; V83-V255 WeakPolarHBondContact O-CG2 3.46Å
84	L	87.2	Confident	87.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-63.6	-40.4	-172.5	-178.4	64.5	0	0	0	114.2	N81 Q112 I237 A240 N241 L256	N81-L84 HydrophobicContact CB-CB 4.23Å; N81-L84 VanDerWaalsContact O-CB 3.25Å; N81-L84 WeakPolarHBondContact O-CB 3.17Å; N81-L84 PolarHBondContact O-N 2.95Å; L84-Q112 HydrophobicContact CD2-CB 3.57Å; L84-Q112 HydrophobicContact CD2-CG 3.64Å; L84-I237 HydrophobicContact CD2-CG2 4.35Å; L84-A240 HydrophobicContact CD1-CB 3.89Å; L84-N241 HydrophobicContact CD1-CB 4.33Å; L84-N241 HydrophobicContact CD2-CB 3.67Å; L84-L256 PolarHBondContact O-N 2.82Å
85	L	86.9	Confident	87.1	Confident	5 Å²	5	24.2 Å²	24.2	3%	0.026	13%	0.125	C	C	.	.	S	Bend	trans	-126.3	111.9	-176.5	-58.6	-177.5	0	0	0	108.8	V83 F89 V107 H110 I237 L256	V83-L85 PolarHBondContact O-N 3.38Å; L85-F89 HydrophobicContact CD2-CD1 4.48Å; L85-F89 HydrophobicContact CD2-CD2 4.39Å; L85-F89 HydrophobicContact CD2-CG 4.38Å; L85-V107 HydrophobicContact CB-CB 3.93Å; L85-V107 HydrophobicContact CB-CG1 4.01Å; L85-V107 HydrophobicContact CD1-CB 4.31Å; L85-V107 HydrophobicContact CD1-CG1 4.36Å; L85-H110 HydrophobicContact CD1-CB 3.98Å; L85-I237 HydrophobicContact CD1-CD1 3.95Å; L85-I237 HydrophobicContact CD1-CG1 4.2Å; L85-I237 HydrophobicContact CD1-CG2 3.98Å; L85-I237 HydrophobicContact CD2-CG1 4.09Å; L85-I237 HydrophobicContact CD2-CG2 4.44Å; L85-L256 HydrophobicContact CD2-CB 3.92Å; L85-L256 HydrophobicContact CD2-CD2 4Å; L85-L256 HydrophobicContact CD2-CG 4.32Å
86	P	82.6	Confident	86.6	Confident	6 Å²	6	28 Å²	28	4%	0.039	15%	0.152	C	C	.	.			trans	-67.3	145.8	174.8	30.7	-34.6	0	0	0	109.3	D88 F89 V255 L256 V257	P86-D88 WeakPolarHBondContact CB-OD1 3.45Å; P86-D88 WeakPolarHBondContact CG-OD1 3.47Å; P86-D88 PolarHBondContact O-N 2.83Å; P86-F89 HydrophobicContact CG-CB 4.38Å; P86-F89 VanDerWaalsContact O-CB 3.25Å; P86-F89 WeakPolarHBondContact O-CB 3.46Å; P86-F89 PolarHBondContact O-N 3.15Å; P86-V255 HydrophobicContact CG-CG1 4.36Å; P86-L256 WeakPolarHBondContact CD-O 3.33Å; P86-V257 HydrophobicContact CG-CG1 4.36Å
87	P	76.8	Confident	86.1	Confident	70 Å²	70	35.4 Å²	35.4	46%	0.455	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-18.7	172	-41	40.4	0	0	0	118.4	V107 P405	P87-V107 HydrophobicContact CG-CG2 4.37Å; P87-P405 HydrophobicContact CB-CB 3.98Å; P87-P405 HydrophobicContact CG-CB 3.72Å; P87-P405 HydrophobicContact CG-CG 4.14Å
88	D	70.5	Confident	85.5	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.027	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	6.5	175.8	75.8	-16.1	0	0	0	114.9	P86 T90 R293 A408 Y409	P86-D88 WeakPolarHBondContact CB-OD1 3.45Å; P86-D88 WeakPolarHBondContact CG-OD1 3.47Å; P86-D88 PolarHBondContact O-N 2.83Å; D88-T90 PolarHBondContact O-N 2.81Å; D88-T90 PolarHBondContact O-OG1 2.81Å; D88-R293 VanDerWaalsContact CG-NH1 3.31Å; D88-R293 PolarHBondContact O-NH1 3.48Å; D88-R293 IonicContact OD1-CZ 3.03Å; D88-R293 IonicContact OD1-NH1 3.97Å; D88-R293 IonicContact OD1-NH2 3.74Å; D88-R293 PolarHBondContact OD1-NH2 3.41Å; D88-R293 IonicContact OD2-CZ 2.65Å; D88-R293 IonicContact OD2-NH1 3.44Å; D88-R293 PolarHBondContact OD2-NH1 3.48Å; D88-R293 IonicContact OD2-NH2 2.75Å; D88-R293 PolarHBondContact OD2-NH2 2.92Å; D88-A408 VanDerWaalsContact OD2-CA 3.32Å; D88-A408 WeakPolarHBondContact OD2-CA 3.32Å; D88-A408 PolarHBondContact OD2-N 2.82Å; D88-Y409 PolarHBondContact OD2-N 3.04Å
89	F	85.9	Confident	85.1	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	23%	0.225	C	C	.	.			trans	-42.4	120.6	179.2	166.2	-116.3	0	0	0	111.6	L85 P86 V91 P105 V107 I237 L256 L259	L85-F89 HydrophobicContact CD2-CD1 4.48Å; L85-F89 HydrophobicContact CD2-CD2 4.39Å; L85-F89 HydrophobicContact CD2-CG 4.38Å; P86-F89 HydrophobicContact CG-CB 4.38Å; P86-F89 VanDerWaalsContact O-CB 3.25Å; P86-F89 WeakPolarHBondContact O-CB 3.46Å; P86-F89 PolarHBondContact O-N 3.15Å; F89-V91 HydrophobicContact CD1-CG2 4.29Å; F89-V91 HydrophobicContact CE1-CG2 3.52Å; F89-V91 HydrophobicContact CE2-CG2 4.43Å; F89-V91 HydrophobicContact CZ-CG2 3.6Å; F89-P105 HydrophobicContact CD1-CG 3.76Å; F89-P105 HydrophobicContact CE1-CG 3.76Å; F89-V107 HydrophobicContact CB-CG1 3.71Å; F89-V107 HydrophobicContact CD1-CG1 3.92Å; F89-V107 HydrophobicContact CG-CG1 4.27Å; F89-I237 HydrophobicContact CE1-CD1 4.07Å; F89-I237 HydrophobicContact CE1-CG1 4.49Å; F89-I237 HydrophobicContact CZ-CD1 4.38Å; F89-I237 HydrophobicContact CZ-CG1 4.35Å; F89-L256 HydrophobicContact CD2-CG 4.42Å; F89-L256 WeakPolarHBondContact CD2-O 3.49Å; F89-L256 HydrophobicContact CE2-CD2 3.91Å; F89-L256 HydrophobicContact CE2-CG 3.82Å; F89-L256 HydrophobicContact CZ-CD2 4.17Å; F89-L259 HydrophobicContact CE2-CB 4.05Å; F89-L259 HydrophobicContact CZ-CB 3.97Å
90	T	87.7	Confident	84.9	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.2	-168.8	-66.9	0	0	0	0	110.9	D88 F92 T102 G258 L259	D88-T90 PolarHBondContact O-N 2.81Å; D88-T90 PolarHBondContact O-OG1 2.81Å; T90-F92 HydrophobicContact CG2-CD1 4.23Å; T90-F92 HydrophobicContact CG2-CD2 4.34Å; T90-F92 HydrophobicContact CG2-CE1 3.71Å; T90-F92 HydrophobicContact CG2-CE2 3.82Å; T90-F92 HydrophobicContact CG2-CZ 3.48Å; T90-F92 VanDerWaalsContact CG2-CZ 3.48Å; T90-T102 HydrophobicContact CG2-CG2 3.46Å; T90-T102 VanDerWaalsContact CG2-CG2 3.46Å; T90-G258 CarbonylContact O-C 3.58Å; T90-G258 WeakPolarHBondContact O-CA 3.31Å; T90-L259 PolarHBondContact O-N 3.02Å
91	V	92.9	Very high	85	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.7	175	-174.9	0	0	0	0	109.3	F89 T93 S103 P105 L259 I261	F89-V91 HydrophobicContact CD1-CG2 4.29Å; F89-V91 HydrophobicContact CE1-CG2 3.52Å; F89-V91 HydrophobicContact CE2-CG2 4.43Å; F89-V91 HydrophobicContact CZ-CG2 3.6Å; V91-T93 HydrophobicContact CG1-CG2 4.32Å; V91-S103 PolarHBondContact N-O 3.12Å; V91-S103 PolarHBondContact O-N 3.3Å; V91-S103 PolarHBondContact O-OG 3.28Å; V91-S103 VanDerWaalsContact O-OG 3.04Å; V91-P105 HydrophobicContact CG2-CG 3.93Å; V91-L259 CarbonylContact C-O 3.57Å; V91-L259 VanDerWaalsContact CA-O 3.29Å; V91-L259 WeakPolarHBondContact CA-O 3.27Å; V91-L259 HydrophobicContact CG1-CD2 4.31Å; V91-L259 HydrophobicContact CG1-CG 4.4Å; V91-L259 HydrophobicContact CG2-CB 4.35Å; V91-I261 HydrophobicContact CG1-CD1 4.26Å
92	F	94.6	Very high	85	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.022	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.3	175.8	-56.4	-77.5	0	0	0	110.6	T90 L100 I101 T102 L259 D260 I261 R292 R293	T90-F92 HydrophobicContact CG2-CD1 4.23Å; T90-F92 HydrophobicContact CG2-CD2 4.34Å; T90-F92 HydrophobicContact CG2-CE1 3.71Å; T90-F92 HydrophobicContact CG2-CE2 3.82Å; T90-F92 HydrophobicContact CG2-CZ 3.48Å; T90-F92 VanDerWaalsContact CG2-CZ 3.48Å; F92-L100 HydrophobicContact CB-CD1 3.98Å; F92-L100 HydrophobicContact CD1-CD1 4.01Å; F92-L100 HydrophobicContact CD1-CD2 4.22Å; F92-L100 HydrophobicContact CD1-CG 4.31Å; F92-L100 HydrophobicContact CG-CD1 4.36Å; F92-I101 WeakPolarHBondContact CA-O 3.19Å; F92-T102 HydrophobicContact CD1-CG2 4.05Å; F92-T102 HydrophobicContact CE1-CG2 3.74Å; F92-L259 PolarHBondContact N-O 2.9Å; F92-D260 HydrophobicContact CB-CB 4.22Å; F92-D260 HydrophobicContact CD2-CB 4.24Å; F92-I261 PolarHBondContact O-N 2.93Å; F92-R292 HydrophobicContact CE1-CB 4.44Å; F92-R292 HydrophobicContact CZ-CB 4.11Å; F92-R293 HydrophobicContact CE2-CB 4.03Å; F92-R293 HydrophobicContact CZ-CB 4.06Å
93	T	94.3	Very high	85.2	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.043	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	177.3	171.2	71	0	0	0	0	109.8	V91 I101 E229 I261 T263	V91-T93 HydrophobicContact CG1-CG2 4.32Å; T93-I101 PolarHBondContact N-O 3.37Å; T93-I101 PolarHBondContact O-N 2.83Å; T93-E229 HydrophobicContact CG2-CG 4.38Å; T93-I261 HydrophobicContact CG2-CB 4.36Å; T93-I261 HydrophobicContact CG2-CD1 4.4Å; T93-T263 HydrophobicContact CG2-CG2 4.07Å
94	Y	92.4	Very high	85.5	Confident	15 Å²	15	43.3 Å²	43.3	6%	0.059	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.9	-173.2	-59.9	-91.3	0	0	0	111.8	L100 D260 I261 W262 T263 K264 L267 R292	Y94-L100 HydrophobicContact CD1-CD1 4.32Å; Y94-L100 HydrophobicContact CE1-CB 4.47Å; Y94-L100 HydrophobicContact CE1-CD1 3.55Å; Y94-D260 WeakPolarHBondContact CE2-OD1 3.34Å; Y94-D260 PolarHBondContact OH-OD1 2.8Å; Y94-D260 PolarHBondContact OH-OD2 2.9Å; Y94-D260 VanDerWaalsContact OH-OD2 3.06Å; Y94-I261 VanDerWaalsContact CD2-O 3.27Å; Y94-I261 WeakPolarHBondContact CD2-O 3.49Å; Y94-I261 WeakPolarHBondContact CE2-O 3.5Å; Y94-W262 AromaticContact CE2-CD1 3.88Å; Y94-T263 PolarHBondContact N-OG1 2.87Å; Y94-T263 PolarHBondContact O-OG1 3.29Å; Y94-K264 WeakPolarHBondContact O-CE 3.49Å; Y94-L267 HydrophobicContact CE1-CD1 3.91Å; Y94-L267 HydrophobicContact CE2-CD1 4.48Å; Y94-L267 WeakPolarHBondContact OH-CD1 3.22Å; Y94-R292 PolarHBondContact OH-NH1 2.81Å
95	G	87.1	Confident	85.2	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.031	26%	0.262	C	S	.	.			trans	-70.6	171.2	177.5	0	0	0	0	0	113.1	N97 G98 S99 K264	G95-N97 PolarHBondContact O-N 2.8Å; G95-N97 VanDerWaalsContact O-N 3.09Å; G95-G98 PolarHBondContact O-N 3.38Å; G95-S99 PolarHBondContact N-O 2.97Å; G95-K264 WeakPolarHBondContact O-CE 3.28Å
96	P	82.6	Confident	84.6	Confident	120 Å²	120	48.9 Å²	48.9	78%	0.779	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-30.8	179.4	-26.5	35.4	0	0	0	114.1	G98	P96-G98 VanDerWaalsContact C-N 3.34Å
97	N	82.1	Confident	84.1	Confident	157 Å²	157	49.3 Å²	49.3	84%	0.84	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	13.9	-178.5	-57.5	-0.6	0	0	0	112.9	G95 S99	G95-N97 PolarHBondContact O-N 2.8Å; G95-N97 VanDerWaalsContact O-N 3.09Å; N97-S99 PolarHBondContact O-N 2.89Å
98	G	76.4	Confident	83.5	Confident	47 Å²	47	51.5 Å²	51.5	49%	0.485	30%	0.298	S	S	.	.	S	Bend	trans	75.1	-1.2	-174.9	0	0	0	0	0	115.2	G95 P96 L100	G95-G98 PolarHBondContact O-N 3.38Å; P96-G98 VanDerWaalsContact C-N 3.34Å; G98-L100 PolarHBondContact O-N 3.21Å
99	S	81.4	Confident	83.5	Confident	65 Å²	65	54.9 Å²	54.9	46%	0.455	32%	0.316	S	S	.	.			trans	-62.7	129.6	177.4	55.7	0	0	0	0	111.9	G95 N97 I101	G95-S99 PolarHBondContact N-O 2.97Å; N97-S99 PolarHBondContact O-N 2.89Å; S99-I101 PolarHBondContact O-N 3.25Å
100	L	86.7	Confident	83.5	Confident	68 Å²	68	55.9 Å²	55.9	36%	0.356	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	130.9	172.8	-174	68.5	0	0	0	110.7	F92 Y94 G98	F92-L100 HydrophobicContact CB-CD1 3.98Å; F92-L100 HydrophobicContact CD1-CD1 4.01Å; F92-L100 HydrophobicContact CD1-CD2 4.22Å; F92-L100 HydrophobicContact CD1-CG 4.31Å; F92-L100 HydrophobicContact CG-CD1 4.36Å; Y94-L100 HydrophobicContact CD1-CD1 4.32Å; Y94-L100 HydrophobicContact CE1-CB 4.47Å; Y94-L100 HydrophobicContact CE1-CD1 3.55Å; G98-L100 PolarHBondContact O-N 3.21Å
101	I	88.7	Confident	83.5	Confident	77 Å²	77	56 Å²	56	40%	0.395	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.3	172.5	-60.9	176.4	0	0	0	107	F92 T93 S99	F92-I101 WeakPolarHBondContact CA-O 3.19Å; T93-I101 PolarHBondContact N-O 3.37Å; T93-I101 PolarHBondContact O-N 2.83Å; S99-I101 PolarHBondContact O-N 3.25Å
102	T	88.8	Confident	83.4	Confident	82 Å²	82	56 Å²	56	50%	0.503	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.1	178.8	-53.7	0	0	0	0	109.2	T90 F92	T90-T102 HydrophobicContact CG2-CG2 3.46Å; T90-T102 VanDerWaalsContact CG2-CG2 3.46Å; F92-T102 HydrophobicContact CD1-CG2 4.05Å; F92-T102 HydrophobicContact CE1-CG2 3.74Å
103	S	86.3	Confident	83.2	Confident	48 Å²	48	55.8 Å²	55.8	34%	0.336	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.9	-179.9	67.7	0	0	0	0	111.7	V91	V91-S103 PolarHBondContact N-O 3.12Å; V91-S103 PolarHBondContact O-N 3.3Å; V91-S103 PolarHBondContact O-OG 3.28Å; V91-S103 VanDerWaalsContact O-OG 3.04Å
104	R	83.6	Confident	83	Confident	122 Å²	122	56.4 Å²	56.4	46%	0.46	32%	0.323	S	S	.	.			trans	-120.6	102.1	171.5	-59.4	-169.9	-150.4	171.5	10.8	108.9	Y409	R104-Y409 VanDerWaalsContact CZ-CD2 3.46Å
105	P	81.9	Confident	82.8	Confident	25 Å²	25	56.9 Å²	56.9	16%	0.162	33%	0.332	C	S	.	.			trans	-71.8	153.2	177.1	30.8	-34.4	0	0	0	110.7	F89 V91 V107	F89-P105 HydrophobicContact CD1-CG 3.76Å; F89-P105 HydrophobicContact CE1-CG 3.76Å; V91-P105 HydrophobicContact CG2-CG 3.93Å; P105-V107 WeakPolarHBondContact O-CG1 3.24Å; P105-V107 PolarHBondContact O-N 2.88Å
106	P	73.4	Confident	82.8	Confident	97 Å²	97	61.9 Å²	61.9	63%	0.63	35%	0.353	S	S	*	.			trans	-70.2	96	-177.2	28.2	-35.2	0	0	0	111.8	Q108 N109	P106-Q108 PolarHBondContact O-N 2.99Å; P106-N109 PolarHBondContact O-N 2.8Å
107	V	72.3	Confident	83.1	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.091	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-68.7	-29.6	-171.2	-54.4	0	0	0	0	114.7	L85 P87 F89 P105 N109 H110	L85-V107 HydrophobicContact CB-CB 3.93Å; L85-V107 HydrophobicContact CB-CG1 4.01Å; L85-V107 HydrophobicContact CD1-CB 4.31Å; L85-V107 HydrophobicContact CD1-CG1 4.36Å; P87-V107 HydrophobicContact CG-CG2 4.37Å; F89-V107 HydrophobicContact CB-CG1 3.71Å; F89-V107 HydrophobicContact CD1-CG1 3.92Å; F89-V107 HydrophobicContact CG-CG1 4.27Å; P105-V107 WeakPolarHBondContact O-CG1 3.24Å; P105-V107 PolarHBondContact O-N 2.88Å; V107-N109 PolarHBondContact O-N 2.91Å; V107-H110 WeakPolarHBondContact O-CB 3.27Å; V107-H110 PolarHBondContact O-CD2 3.06Å; V107-H110 PolarHBondContact O-N 2.89Å
108	Q	64.7	Low	83.4	Confident	117 Å²	117	52.6 Å²	52.6	55%	0.547	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-60	-13.4	179.6	-63.3	-173.6	13.5	0	0	113.4	P106	P106-Q108 PolarHBondContact O-N 2.99Å
109	N	70.7	Confident	83.8	Confident	76 Å²	76	57.6 Å²	57.6	41%	0.406	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-90.5	3.5	178.2	-60.9	-5.2	0	0	0	112.9	P59 P106 V107	P59-N109 WeakPolarHBondContact CG-O 3.4Å; P106-N109 PolarHBondContact O-N 2.8Å; V107-N109 PolarHBondContact O-N 2.91Å
110	H	84	Confident	84	Confident	21 Å²	21	56.9 Å²	56.9	10%	0.097	30%	0.3	C	S	.	.			trans	-69.1	146.6	-174.4	77.4	62.6	0	0	0	113.5	R80 N81 L85 V107	R80-H110 VanDerWaalsContact CG-CE1 3.5Å; R80-H110 WeakPolarHBondContact CG-CE1 3.48Å; N81-H110 PolarHBondContact O-CE1 2.95Å; N81-H110 PolarHBondContact O-NE2 2.66Å; L85-H110 HydrophobicContact CD1-CB 3.98Å; V107-H110 WeakPolarHBondContact O-CB 3.27Å; V107-H110 PolarHBondContact O-CD2 3.06Å; V107-H110 PolarHBondContact O-N 2.89Å
111	C	88	Confident	83.5	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.034	33%	0.326	C	S	.	.			trans	-103.7	15.8	-174.2	65.1	0	0	0	0	113.9	Y113 S128 V129 C130	C111-Y113 WeakPolarHBondContact O-CD2 3.46Å; C111-Y113 WeakPolarHBondContact O-CE2 3.45Å; C111-S128 WeakPolarHBondContact O-CA 3.15Å; C111-S128 PolarHBondContact SG-OG 3.15Å; C111-S128 VanDerWaalsContact SG-OG 3.34Å; C111-V129 HydrophobicContact CB-CG2 4.02Å; C111-V129 PolarHBondContact O-N 2.94Å; C111-C130 HydrophobicContact CB-CB 3.81Å; C111-C130 WeakPolarHBondContact CB-SG 3.04Å; C111-C130 VanDerWaalsContact SG-CA 3.55Å; C111-C130 WeakPolarHBondContact SG-CB 3.4Å; C111-C130 PolarHBondContact SG-N 2.54Å; C111-C130 VanDerWaalsContact SG-N 3.42Å; C111-C130 CovalentContact SG-SG 2.01Å; C111-C130 PolarHBondContact SG-SG 3.19Å
112	Q	91.1	Very high	82.7	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.019	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.8	177.9	-55.9	-52.7	-43.3	0	0	111.5	N81 L84 S128 I237 H238 N241	N81-Q112 PolarHBondContact N-O 3.13Å; L84-Q112 HydrophobicContact CD2-CB 3.57Å; L84-Q112 HydrophobicContact CD2-CG 3.64Å; Q112-S128 PolarHBondContact NE2-OG 2.03Å; Q112-I237 HydrophobicContact CG-CG2 3.61Å; Q112-H238 PolarHBondContact OE1-ND1 2.74Å; Q112-N241 HydrophobicContact CB-CB 4.04Å; Q112-N241 HydrophobicContact CG-CB 4.15Å
113	Y	90.6	Very high	82.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154.9	-176.1	-67	-109.7	0	0	0	110.4	P59 P60 V63 L78 Q79 R80 C111 M127 V129 N241	P59-Y113 VanDerWaalsContact CB-OH 3.27Å; P59-Y113 WeakPolarHBondContact CB-OH 3.41Å; P60-Y113 WeakPolarHBondContact O-CE1 3.32Å; P60-Y113 PolarHBondContact O-OH 2.84Å; V63-Y113 HydrophobicContact CG1-CE1 4.2Å; V63-Y113 HydrophobicContact CG2-CD1 3.97Å; V63-Y113 HydrophobicContact CG2-CE1 3.88Å; L78-Y113 HydrophobicContact CB-CD1 3.91Å; L78-Y113 HydrophobicContact CB-CG 4.21Å; Q79-Y113 CarbonylContact O-C 3.43Å; Q79-Y113 VanDerWaalsContact O-CA 3.23Å; Q79-Y113 WeakPolarHBondContact O-CA 3.42Å; Q79-Y113 WeakPolarHBondContact O-CB 3.33Å; R80-Y113 HydrophobicContact CB-CD1 4.13Å; R80-Y113 HydrophobicContact CB-CE1 3.84Å; C111-Y113 WeakPolarHBondContact O-CD2 3.46Å; C111-Y113 WeakPolarHBondContact O-CE2 3.45Å; Y113-M127 PolarHBondContact N-O 3.02Å; Y113-M127 PolarHBondContact O-N 2.94Å; Y113-V129 HydrophobicContact CD2-CG1 4.17Å; Y113-V129 HydrophobicContact CD2-CG2 4Å; Y113-V129 HydrophobicContact CE2-CG1 4.35Å; Y113-V129 HydrophobicContact CE2-CG2 3.44Å; Y113-V129 VanDerWaalsContact CE2-CG2 3.44Å; Y113-N241 PolarHBondContact O-ND2 2.91Å
114	Q	89.3	Confident	82.3	Confident	21 Å²	21	59.1 Å²	59.1	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	163.1	166.4	-76.7	170	-18.2	0	0	109.6	L78 Q79 N81 V125 A126 D244 M248	L78-Q114 WeakPolarHBondContact CA-O 3.25Å; Q79-Q114 PolarHBondContact N-O 3.1Å; Q79-Q114 PolarHBondContact O-N 3.15Å; Q79-Q114 VanDerWaalsContact O-O 3.08Å; N81-Q114 HydrophobicContact CB-CG 4.35Å; N81-Q114 PolarHBondContact ND2-NE2 3.1Å; N81-Q114 VanDerWaalsContact ND2-NE2 3.14Å; N81-Q114 PolarHBondContact ND2-OE1 3.1Å; Q114-V125 CarbonylContact C-O 3.6Å; Q114-V125 WeakPolarHBondContact CA-O 3.31Å; Q114-A126 HydrophobicContact CG-CB 4.32Å; Q114-D244 PolarHBondContact NE2-OD2 2.01Å; Q114-D244 PolarHBondContact OE1-OD2 3.42Å; Q114-M248 PolarHBondContact OE1-SD 3.01Å
115	G	88.3	Confident	82.6	Confident	24 Å²	24	53.7 Å²	53.7	25%	0.247	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.2	-150.6	178.4	0	0	0	0	0	113.9	H77 A124 V125	H77-G115 WeakPolarHBondContact O-CA 3.08Å; G115-A124 CarbonylContact O-C 3.52Å; G115-V125 PolarHBondContact N-O 2.98Å; G115-V125 PolarHBondContact O-N 3.22Å
116	F	87.8	Confident	83	Confident	108 Å²	108	52.6 Å²	52.6	47%	0.474	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	167.6	-169.3	64	-83.8	0	0	0	111.1	H77	H77-F116 HydrophobicContact CB-CD1 4.46Å; H77-F116 HydrophobicContact CB-CE1 4.03Å; H77-F116 HydrophobicContact CB-CE2 4.4Å; H77-F116 HydrophobicContact CB-CZ 3.99Å; H77-F116 AromaticContact CD2-CE2 3.63Å; H77-F116 AromaticContact CD2-CZ 3.8Å; H77-F116 PolarHBondContact N-O 3.12Å; H77-F116 PolarHBondContact O-N 3.43Å; H77-F116 VanDerWaalsContact O-N 3.13Å
117	V	89	Confident	83.8	Confident	3 Å²	3	48 Å²	48	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.7	172.4	-173.2	0	0	0	0	108.7	L74 L75 V76 M120 S123 V125 L139	L74-V117 HydrophobicContact CB-CG1 4.14Å; L74-V117 HydrophobicContact CD2-CG1 4.4Å; L75-V117 WeakPolarHBondContact O-CA 3.17Å; V76-V117 HydrophobicContact CG2-CG2 4.37Å; V117-M120 HydrophobicContact CB-CB 4.32Å; V117-M120 PolarHBondContact O-N 2.6Å; V117-S123 PolarHBondContact N-OG 2.9Å; V117-S123 PolarHBondContact O-OG 2.96Å; V117-V125 HydrophobicContact CG2-CG2 4.02Å; V117-L139 HydrophobicContact CG2-CD2 3.71Å
118	Q	88.7	Confident	84.7	Confident	79 Å²	79	47.9 Å²	47.9	37%	0.369	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	144.6	179.6	-153.7	-167.7	-97.3	0	0	110.4	L75 H77 M120	L75-Q118 HydrophobicContact CB-CB 4.04Å; L75-Q118 HydrophobicContact CD2-CB 4.27Å; L75-Q118 VanDerWaalsContact CD2-OE1 3.26Å; L75-Q118 HydrophobicContact CG-CB 3.95Å; L75-Q118 PolarHBondContact O-N 2.57Å; H77-Q118 PolarHBondContact NE2-OE1 3.16Å; Q118-M120 PolarHBondContact O-N 3.5Å
119	D	84.9	Confident	85.8	Confident	152 Å²	152	43.5 Å²	43.5	81%	0.813	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	13.7	177.5	-49.3	-51.7	0	0	0	115.3
120	M	84.9	Confident	86.4	Confident	51 Å²	51	42.4 Å²	42.4	25%	0.251	25%	0.248	S	C	.	.			trans	-122.6	92.7	175.9	-168.6	177.4	-67.7	0	0	111.5	V117 Q118 S123 L139 T140	V117-M120 HydrophobicContact CB-CB 4.32Å; V117-M120 PolarHBondContact O-N 2.6Å; Q118-M120 PolarHBondContact O-N 3.5Å; M120-S123 WeakPolarHBondContact O-CB 3.45Å; M120-S123 PolarHBondContact O-N 3.46Å; M120-S123 PolarHBondContact O-OG 3.04Å; M120-L139 HydrophobicContact CE-CB 4.33Å; M120-L139 HydrophobicContact CE-CD1 4.47Å; M120-L139 HydrophobicContact CE-CD2 4.41Å; M120-L139 HydrophobicContact SD-CB 3.57Å; M120-L139 VanDerWaalsContact SD-CB 3.57Å; M120-L139 HydrophobicContact SD-CD2 3.77Å; M120-L139 HydrophobicContact SD-CG 4.14Å; M120-T140 WeakPolarHBondContact CG-OG1 3.27Å
121	E	77.1	Confident	86.4	Confident	193 Å²	193	45.6 Å²	45.6	90%	0.902	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	137.6	176.8	-171.9	174.2	-168.4	0	0	111.3	S123	E121-S123 PolarHBondContact O-N 3.14Å
122	G	71.7	Confident	86.3	Confident	77 Å²	77	46.9 Å²	46.9	79%	0.794	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-3.6	-177.1	0	0	0	0	0	115.4
123	S	82.7	Confident	86.2	Confident	13 Å²	13	47 Å²	47	9%	0.091	29%	0.287	C	S	.	.			trans	-67.4	144.1	173.6	65.9	0	0	0	0	112.2	V117 M120 E121 H138	V117-S123 PolarHBondContact N-OG 2.9Å; V117-S123 PolarHBondContact O-OG 2.96Å; M120-S123 WeakPolarHBondContact O-CB 3.45Å; M120-S123 PolarHBondContact O-N 3.46Å; M120-S123 PolarHBondContact O-OG 3.04Å; E121-S123 PolarHBondContact O-N 3.14Å; S123-H138 VanDerWaalsContact CA-O 3.24Å; S123-H138 WeakPolarHBondContact CA-O 3.44Å; S123-H138 WeakPolarHBondContact CB-O 3.15Å
124	A	84.6	Confident	86.2	Confident	39 Å²	39	51.4 Å²	51.4	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	138.6	-178.7	0	0	0	0	0	111	G115 H138	G115-A124 CarbonylContact O-C 3.52Å; A124-H138 HydrophobicContact CB-CB 4.44Å; A124-H138 PolarHBondContact N-O 3.45Å; A124-H138 WeakPolarHBondContact O-CB 3.32Å; A124-H138 PolarHBondContact O-N 2.79Å
125	V	89.5	Confident	86.3	Confident	7 Å²	7	50.5 Å²	50.5	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.9	-173.1	-178.3	0	0	0	0	109.8	V76 L78 Q114 G115 V117 M127 V136 M137	V76-V125 HydrophobicContact CG1-CB 4.43Å; V76-V125 HydrophobicContact CG1-CG1 3.95Å; V76-V125 HydrophobicContact CG1-CG2 4.13Å; L78-V125 HydrophobicContact CD2-CB 4.25Å; L78-V125 HydrophobicContact CD2-CG1 3.68Å; Q114-V125 CarbonylContact C-O 3.6Å; Q114-V125 WeakPolarHBondContact CA-O 3.31Å; G115-V125 PolarHBondContact N-O 2.98Å; G115-V125 PolarHBondContact O-N 3.22Å; V117-V125 HydrophobicContact CG2-CG2 4.02Å; V125-M127 HydrophobicContact CG1-CE 3.69Å; V125-M127 HydrophobicContact CG1-CG 3.8Å; V125-M127 HydrophobicContact CG1-SD 3.97Å; V125-V136 WeakPolarHBondContact CG1-O 3.38Å; V125-M137 HydrophobicContact CG1-CG 4.03Å; V125-M137 HydrophobicContact CG2-CB 4.34Å; V125-M137 HydrophobicContact CG2-CG 4.08Å
126	A	89.4	Confident	86.2	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	117	174	0	0	0	0	0	110.1	Q114 G135 V136 L242	Q114-A126 HydrophobicContact CG-CB 4.32Å; A126-G135 WeakPolarHBondContact O-CA 3.31Å; A126-V136 HydrophobicContact CB-CG2 4.24Å; A126-V136 PolarHBondContact N-O 3.03Å; A126-V136 VanDerWaalsContact N-O 3.08Å; A126-V136 PolarHBondContact O-N 3.27Å; A126-L242 HydrophobicContact CB-CD2 3.9Å
127	M	91.3	Very high	86.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.4	-169.6	-69.9	-173.3	179.7	0	0	114.3	I67 L78 Y113 V125 L133 R134 M137 I146	I67-M127 HydrophobicContact CD1-CE 4.01Å; L78-M127 HydrophobicContact CD1-CB 4.24Å; L78-M127 HydrophobicContact CD1-SD 4.06Å; Y113-M127 PolarHBondContact N-O 3.02Å; Y113-M127 PolarHBondContact O-N 2.94Å; V125-M127 HydrophobicContact CG1-CE 3.69Å; V125-M127 HydrophobicContact CG1-CG 3.8Å; V125-M127 HydrophobicContact CG1-SD 3.97Å; M127-L133 HydrophobicContact SD-CD2 3.62Å; M127-R134 CarbonylContact C-O 3.54Å; M127-R134 WeakPolarHBondContact CA-O 2.96Å; M127-M137 HydrophobicContact CE-CE 4.45Å; M127-M137 HydrophobicContact CE-CG 3.33Å; M127-M137 HydrophobicContact CE-SD 3.66Å; M127-I146 HydrophobicContact CE-CG2 3.73Å; M127-I146 HydrophobicContact SD-CG2 4.41Å
128	S	90.1	Very high	85.9	Confident	13 Å²	13	45.6 Å²	45.6	9%	0.091	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	139.3	162.7	179.9	0	0	0	0	109.7	C111 Q112 C130 L133 R134	C111-S128 WeakPolarHBondContact O-CA 3.15Å; C111-S128 PolarHBondContact SG-OG 3.15Å; C111-S128 VanDerWaalsContact SG-OG 3.34Å; Q112-S128 PolarHBondContact NE2-OG 2.03Å; S128-C130 PolarHBondContact OG-N 3Å; S128-L133 WeakPolarHBondContact O-CA 3.43Å; S128-R134 PolarHBondContact N-O 3.23Å; S128-R134 PolarHBondContact O-N 3.19Å
129	V	89.4	Confident	85.6	Confident	24 Å²	24	43.2 Å²	43.2	15%	0.145	26%	0.262	C	S	.	.			trans	-116	11.4	171.4	-52.4	0	0	0	0	113.4	F65 C111 Y113 S131 G132 L133	F65-V129 HydrophobicContact CE2-CG1 4.12Å; F65-V129 HydrophobicContact CZ-CG1 4.19Å; C111-V129 HydrophobicContact CB-CG2 4.02Å; C111-V129 PolarHBondContact O-N 2.94Å; Y113-V129 HydrophobicContact CD2-CG1 4.17Å; Y113-V129 HydrophobicContact CD2-CG2 4Å; Y113-V129 HydrophobicContact CE2-CG1 4.35Å; Y113-V129 HydrophobicContact CE2-CG2 3.44Å; Y113-V129 VanDerWaalsContact CE2-CG2 3.44Å; V129-S131 VanDerWaalsContact C-N 3.34Å; V129-S131 PolarHBondContact O-N 3.26Å; V129-G132 CarbonylContact C-O 3.55Å; V129-L133 HydrophobicContact CG1-CD2 3.85Å
130	C	83.2	Confident	85	Confident	54 Å²	54	40.8 Å²	40.8	37%	0.365	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-44.1	-173.9	-89.7	0	0	0	0	113.4	C111 S128	C111-C130 HydrophobicContact CB-CB 3.81Å; C111-C130 WeakPolarHBondContact CB-SG 3.04Å; C111-C130 VanDerWaalsContact SG-CA 3.55Å; C111-C130 WeakPolarHBondContact SG-CB 3.4Å; C111-C130 PolarHBondContact SG-N 2.54Å; C111-C130 VanDerWaalsContact SG-N 3.42Å; C111-C130 CovalentContact SG-SG 2.01Å; C111-C130 PolarHBondContact SG-SG 3.19Å; S128-C130 PolarHBondContact OG-N 3Å
131	S	82.5	Confident	84.4	Confident	87 Å²	87	45.3 Å²	45.3	61%	0.608	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.2	55.9	-163.4	-57.4	0	0	0	0	109	V129 P148	V129-S131 VanDerWaalsContact C-N 3.34Å; V129-S131 PolarHBondContact O-N 3.26Å; S131-P148 VanDerWaalsContact O-CG 3.23Å; S131-P148 WeakPolarHBondContact O-CG 3.4Å
132	G	86.2	Confident	84.3	Confident	32 Å²	32	38 Å²	38	33%	0.33	25%	0.245	S	C	.	.	S	Bend	trans	80.6	175.5	-159.7	0	0	0	0	0	112	V129	V129-G132 CarbonylContact C-O 3.55Å
133	L	89.9	Confident	84.7	Confident	7 Å²	7	35.9 Å²	35.9	4%	0.037	22%	0.218	C	C	.	.			trans	-77.9	124.9	176.7	-79.8	158.5	0	0	0	111.1	P44 F65 I67 M127 S128 V129 I146 E147 P148 H156	P44-L133 HydrophobicContact CB-CD1 3.36Å; P44-L133 HydrophobicContact CG-CD1 3.71Å; F65-L133 HydrophobicContact CD1-CD1 3.74Å; F65-L133 HydrophobicContact CD2-CD1 4.31Å; F65-L133 HydrophobicContact CD2-CD2 4.18Å; F65-L133 HydrophobicContact CE1-CD1 3.82Å; F65-L133 HydrophobicContact CE1-CG 4.32Å; F65-L133 HydrophobicContact CE2-CD1 4.38Å; F65-L133 HydrophobicContact CE2-CD2 3.84Å; F65-L133 HydrophobicContact CE2-CG 4.47Å; F65-L133 HydrophobicContact CG-CD1 3.99Å; F65-L133 HydrophobicContact CZ-CD1 4.14Å; F65-L133 HydrophobicContact CZ-CD2 4.03Å; F65-L133 HydrophobicContact CZ-CG 4.21Å; I67-L133 HydrophobicContact CD1-CD1 4.44Å; M127-L133 HydrophobicContact SD-CD2 3.62Å; S128-L133 WeakPolarHBondContact O-CA 3.43Å; V129-L133 HydrophobicContact CG1-CD2 3.85Å; L133-I146 HydrophobicContact CB-CD1 4.41Å; L133-E147 WeakPolarHBondContact O-CA 3.46Å; L133-P148 VanDerWaalsContact O-CD 3.27Å; L133-P148 WeakPolarHBondContact O-CD 3.36Å; L133-H156 PolarHBondContact N-NE2 3.07Å; L133-H156 PolarHBondContact O-CD2 3.45Å
134	R	90.9	Very high	84.9	Confident	92 Å²	92	35.8 Å²	35.8	35%	0.347	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.4	167.1	-179.7	177.4	-86.9	122.2	-3.3	110.2	M127 S128 I146 E147 H238	M127-R134 CarbonylContact C-O 3.54Å; M127-R134 WeakPolarHBondContact CA-O 2.96Å; S128-R134 PolarHBondContact N-O 3.23Å; S128-R134 PolarHBondContact O-N 3.19Å; R134-I146 CarbonylContact C-O 3.6Å; R134-I146 VanDerWaalsContact CA-O 3.27Å; R134-I146 WeakPolarHBondContact CA-O 3.33Å; R134-E147 HydrophobicContact CB-CB 4.33Å; R134-E147 HydrophobicContact CG-CB 3.93Å; R134-E147 IonicContact CZ-OE2 3.87Å; R134-E147 VanDerWaalsContact CZ-OE2 3.23Å; R134-E147 IonicContact NE-OE2 3.96Å; R134-E147 PolarHBondContact NE-OE2 3.19Å; R134-E147 IonicContact NH2-OE2 2.79Å; R134-E147 PolarHBondContact NH2-OE2 2.89Å; R134-H238 PolarHBondContact O-CE1 3.37Å
135	G	89.5	Confident	85.1	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.5	-151.7	175.1	0	0	0	0	0	113.5	A126 G145 I146	A126-G135 WeakPolarHBondContact O-CA 3.31Å; G135-G145 WeakPolarHBondContact O-CA 3.41Å; G135-I146 PolarHBondContact N-O 3.28Å; G135-I146 PolarHBondContact O-N 3.5Å
136	V	87.9	Confident	85.1	Confident	6 Å²	6	33.6 Å²	33.6	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.4	-175.7	-59.4	0	0	0	0	112.4	V125 A126 H138 Y144 L161 L242 A336	V125-V136 WeakPolarHBondContact CG1-O 3.38Å; A126-V136 HydrophobicContact CB-CG2 4.24Å; A126-V136 PolarHBondContact N-O 3.03Å; A126-V136 VanDerWaalsContact N-O 3.08Å; A126-V136 PolarHBondContact O-N 3.27Å; V136-H138 VanDerWaalsContact CG2-NE2 3.26Å; V136-H138 WeakPolarHBondContact CG2-NE2 3.31Å; V136-Y144 CarbonylContact C-O 3.55Å; V136-Y144 VanDerWaalsContact CA-O 3.28Å; V136-Y144 WeakPolarHBondContact CA-O 3.23Å; V136-L161 HydrophobicContact CG1-CD1 4.19Å; V136-L161 HydrophobicContact CG1-CD2 4.39Å; V136-L242 HydrophobicContact CG1-CD2 4.32Å; V136-L242 HydrophobicContact CG2-CD2 3.81Å; V136-A336 HydrophobicContact CG1-CB 3.78Å
137	M	88.3	Confident	85.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126	169.7	-62.3	-179.9	-69.5	0	0	109.2	I67 V69 V76 V125 M127 L139 S143 Y144 L158	I67-M137 HydrophobicContact CD1-SD 4.04Å; I67-M137 HydrophobicContact CG2-CE 4.32Å; V69-M137 HydrophobicContact CG2-CE 4.28Å; V76-M137 HydrophobicContact CG2-SD 3.87Å; V125-M137 HydrophobicContact CG1-CG 4.03Å; V125-M137 HydrophobicContact CG2-CB 4.34Å; V125-M137 HydrophobicContact CG2-CG 4.08Å; M127-M137 HydrophobicContact CE-CE 4.45Å; M127-M137 HydrophobicContact CE-CG 3.33Å; M127-M137 HydrophobicContact CE-SD 3.66Å; M137-L139 HydrophobicContact CB-CD2 4.4Å; M137-S143 CarbonylContact O-C 3.59Å; M137-S143 WeakPolarHBondContact O-CA 3.31Å; M137-Y144 PolarHBondContact N-O 3.06Å; M137-Y144 PolarHBondContact O-N 3.45Å; M137-L158 HydrophobicContact CE-CD1 3.79Å
138	H	81.1	Confident	85.1	Confident	25 Å²	25	35.3 Å²	35.3	12%	0.116	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113	172.6	-56.3	-53	0	0	0	108.2	S123 A124 V136 S143	S123-H138 VanDerWaalsContact CA-O 3.24Å; S123-H138 WeakPolarHBondContact CA-O 3.44Å; S123-H138 WeakPolarHBondContact CB-O 3.15Å; A124-H138 HydrophobicContact CB-CB 4.44Å; A124-H138 PolarHBondContact N-O 3.45Å; A124-H138 WeakPolarHBondContact O-CB 3.32Å; A124-H138 PolarHBondContact O-N 2.79Å; V136-H138 VanDerWaalsContact CG2-NE2 3.26Å; V136-H138 WeakPolarHBondContact CG2-NE2 3.31Å; H138-S143 WeakPolarHBondContact ND1-CB 3.19Å; H138-S143 PolarHBondContact ND1-OG 2.91Å
139	L	81.9	Confident	84.9	Confident	29 Å²	29	35.3 Å²	35.3	15%	0.152	21%	0.207	C	C	.	.			trans	-101.2	172	175.4	-49.2	-170.3	0	0	0	108.8	L74 V117 M120 M137 N141 D142 Y144	L74-L139 HydrophobicContact CD1-CD1 3.83Å; L74-L139 HydrophobicContact CD1-CD2 4.19Å; V117-L139 HydrophobicContact CG2-CD2 3.71Å; M120-L139 HydrophobicContact CE-CB 4.33Å; M120-L139 HydrophobicContact CE-CD1 4.47Å; M120-L139 HydrophobicContact CE-CD2 4.41Å; M120-L139 HydrophobicContact SD-CB 3.57Å; M120-L139 VanDerWaalsContact SD-CB 3.57Å; M120-L139 HydrophobicContact SD-CD2 3.77Å; M120-L139 HydrophobicContact SD-CG 4.14Å; M137-L139 HydrophobicContact CB-CD2 4.4Å; L139-N141 PolarHBondContact O-N 2.85Å; L139-N141 VanDerWaalsContact O-N 3.14Å; L139-D142 WeakPolarHBondContact CA-O 3.46Å; L139-D142 WeakPolarHBondContact CB-O 3.24Å; L139-D142 PolarHBondContact N-O 3.29Å; L139-Y144 HydrophobicContact CD1-CD2 3.97Å; L139-Y144 HydrophobicContact CD1-CE2 3.67Å; L139-Y144 HydrophobicContact CG-CD2 4.28Å; L139-Y144 HydrophobicContact CG-CE2 4.37Å
140	T	73	Confident	84.5	Confident	101 Å²	101	36.7 Å²	36.7	62%	0.62	23%	0.226	S	C	*	.	S	Bend	trans	-53.6	-37.8	-176	-41.2	0	0	0	0	114.1	M120	M120-T140 WeakPolarHBondContact CG-OG1 3.27Å
141	N	71.5	Confident	84.2	Confident	147 Å²	147	37.3 Å²	37.3	79%	0.786	23%	0.231	S	C	*	.	S	Bend	trans	-118.4	-15.9	-173.9	-61.8	-4.3	0	0	0	113.8	L139	L139-N141 PolarHBondContact O-N 2.85Å; L139-N141 VanDerWaalsContact O-N 3.14Å
142	D	75.6	Confident	84.2	Confident	38 Å²	38	34.5 Å²	34.5	20%	0.203	21%	0.213	C	C	.	.			trans	-142.9	153.1	-163.9	-93.1	-62.2	0	0	0	111.2	L139 Y144 R160	L139-D142 WeakPolarHBondContact CA-O 3.46Å; L139-D142 WeakPolarHBondContact CB-O 3.24Å; L139-D142 PolarHBondContact N-O 3.29Å; D142-Y144 HydrophobicContact CB-CD2 4.3Å; D142-Y144 HydrophobicContact CB-CE2 3.61Å; D142-R160 IonicContact OD1-CZ 3.5Å; D142-R160 IonicContact OD1-NH1 3.72Å; D142-R160 PolarHBondContact OD1-NH1 2.78Å; D142-R160 IonicContact OD2-CZ 3.95Å; D142-R160 IonicContact OD2-NH1 3.88Å; D142-R160 PolarHBondContact OD2-NH1 2.83Å; D142-R160 IonicContact OD2-NH2 2.75Å
143	S	81.1	Confident	83.5	Confident	34 Å²	34	37.7 Å²	37.7	24%	0.238	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128	174.2	-69.2	0	0	0	0	110.8	M137 H138 R160 L161	M137-S143 CarbonylContact O-C 3.59Å; M137-S143 WeakPolarHBondContact O-CA 3.31Å; H138-S143 WeakPolarHBondContact ND1-CB 3.19Å; H138-S143 PolarHBondContact ND1-OG 2.91Å; S143-R160 CarbonylContact O-C 3.56Å; S143-R160 WeakPolarHBondContact O-CA 3.39Å; S143-L161 PolarHBondContact O-N 2.71Å
144	Y	86	Confident	83	Confident	10 Å²	10	45.1 Å²	45.1	4%	0.039	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.8	-176.3	-65.7	-101.9	0	0	0	111.1	V69 D70 V136 M137 L139 D142 L158 Y159 R160	V69-Y144 HydrophobicContact CG1-CD1 4.11Å; V69-Y144 HydrophobicContact CG1-CE1 3.57Å; V69-Y144 HydrophobicContact CG1-CE2 4.17Å; D70-Y144 PolarHBondContact OD2-OH 2.82Å; V136-Y144 CarbonylContact C-O 3.55Å; V136-Y144 VanDerWaalsContact CA-O 3.28Å; V136-Y144 WeakPolarHBondContact CA-O 3.23Å; M137-Y144 PolarHBondContact N-O 3.06Å; M137-Y144 PolarHBondContact O-N 3.45Å; L139-Y144 HydrophobicContact CD1-CD2 3.97Å; L139-Y144 HydrophobicContact CD1-CE2 3.67Å; L139-Y144 HydrophobicContact CG-CD2 4.28Å; L139-Y144 HydrophobicContact CG-CE2 4.37Å; D142-Y144 HydrophobicContact CB-CD2 4.3Å; D142-Y144 HydrophobicContact CB-CE2 3.61Å; Y144-L158 HydrophobicContact CD1-CD1 4Å; Y144-L158 HydrophobicContact CD1-CG 4.23Å; Y144-L158 HydrophobicContact CG-CD1 4.28Å; Y144-Y159 CarbonylContact C-O 3.46Å; Y144-Y159 VanDerWaalsContact CA-O 3.24Å; Y144-Y159 WeakPolarHBondContact CA-O 3.49Å; Y144-R160 HydrophobicContact CD1-CG 4.05Å; Y144-R160 HydrophobicContact CE1-CG 3.72Å; Y144-R160 PolarHBondContact OH-NH2 3.22Å; Y144-R160 VanDerWaalsContact OH-NH2 3.09Å
145	G	88.5	Confident	83	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.9	162.5	0	0	0	0	0	110.1	G135 L158 Y159	G135-G145 WeakPolarHBondContact O-CA 3.41Å; G145-L158 WeakPolarHBondContact O-CA 3.32Å; G145-Y159 PolarHBondContact N-O 2.9Å; G145-Y159 PolarHBondContact O-N 2.99Å
146	I	90.4	Very high	83.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.5	171.4	-168.8	171.3	0	0	0	109.9	T42 P44 I67 M127 L133 R134 G135 H156 L157 L158	T42-I146 HydrophobicContact CG2-CD1 4.05Å; P44-I146 HydrophobicContact CG-CD1 3.88Å; I67-I146 HydrophobicContact CD1-CD1 4.25Å; I67-I146 HydrophobicContact CG2-CD1 4.2Å; M127-I146 HydrophobicContact CE-CG2 3.73Å; M127-I146 HydrophobicContact SD-CG2 4.41Å; L133-I146 HydrophobicContact CB-CD1 4.41Å; R134-I146 CarbonylContact C-O 3.6Å; R134-I146 VanDerWaalsContact CA-O 3.27Å; R134-I146 WeakPolarHBondContact CA-O 3.33Å; G135-I146 PolarHBondContact N-O 3.28Å; G135-I146 PolarHBondContact O-N 3.5Å; I146-H156 HydrophobicContact CD1-CB 3.96Å; I146-H156 HydrophobicContact CG1-CB 3.8Å; I146-L157 CarbonylContact C-O 3.56Å; I146-L157 VanDerWaalsContact CA-O 3.32Å; I146-L157 WeakPolarHBondContact CA-O 3.26Å; I146-L158 HydrophobicContact CB-CD1 4.29Å
147	E	89.9	Confident	83.3	Confident	20 Å²	20	44.7 Å²	44.7	9%	0.093	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	160.2	166.5	68.4	164.6	-166	0	0	113.9	Q32 L133 R134 H156 L157 Y159	Q32-E147 PolarHBondContact NE2-OE1 3.39Å; L133-E147 WeakPolarHBondContact O-CA 3.46Å; R134-E147 HydrophobicContact CB-CB 4.33Å; R134-E147 HydrophobicContact CG-CB 3.93Å; R134-E147 IonicContact CZ-OE2 3.87Å; R134-E147 VanDerWaalsContact CZ-OE2 3.23Å; R134-E147 IonicContact NE-OE2 3.96Å; R134-E147 PolarHBondContact NE-OE2 3.19Å; R134-E147 IonicContact NH2-OE2 2.79Å; R134-E147 PolarHBondContact NH2-OE2 2.89Å; E147-H156 CarbonylContact O-C 3.49Å; E147-H156 WeakPolarHBondContact O-CA 3.36Å; E147-H156 WeakPolarHBondContact O-CB 3.44Å; E147-L157 HydrophobicContact CG-CB 4.42Å; E147-L157 PolarHBondContact N-O 2.94Å; E147-L157 PolarHBondContact O-N 2.74Å; E147-Y159 HydrophobicContact CG-CE1 4.49Å
148	P	89.5	Confident	83.4	Confident	18 Å²	18	44.7 Å²	44.7	12%	0.117	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	139.6	-178.2	-12.3	27.8	0	0	0	111.5	Q32 S131 L133 H156	Q32-P148 PolarHBondContact NE2-O 2.83Å; S131-P148 VanDerWaalsContact O-CG 3.23Å; S131-P148 WeakPolarHBondContact O-CG 3.4Å; L133-P148 VanDerWaalsContact O-CD 3.27Å; L133-P148 WeakPolarHBondContact O-CD 3.36Å; P148-H156 VanDerWaalsContact CA-CD2 3.45Å; P148-H156 WeakPolarHBondContact CA-CD2 3.27Å
149	L	87.1	Confident	83.7	Confident	13 Å²	13	44 Å²	44	7%	0.068	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	126.7	175.6	-177.2	64.5	0	0	0	110.6	L41 S151 A152 Q155 L157	L41-L149 HydrophobicContact CD2-CD2 3.91Å; L149-S151 WeakPolarHBondContact CD2-OG 3.12Å; L149-S151 WeakPolarHBondContact CG-OG 3.32Å; L149-S151 PolarHBondContact O-N 2.85Å; L149-S151 VanDerWaalsContact O-N 3.16Å; L149-A152 HydrophobicContact CD2-CB 4.29Å; L149-A152 CarbonylContact O-C 3.54Å; L149-A152 PolarHBondContact O-N 3.25Å; L149-A152 VanDerWaalsContact O-N 3.12Å; L149-Q155 HydrophobicContact CB-CB 4.45Å; L149-Q155 PolarHBondContact N-O 2.63Å; L149-L157 HydrophobicContact CD1-CD1 4.19Å; L149-L157 HydrophobicContact CD1-CD2 4.09Å; L149-L157 HydrophobicContact CD1-CG 4Å
150	G	79.7	Confident	83.7	Confident	53 Å²	53	45.7 Å²	45.7	55%	0.546	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.7	-174.1	0	0	0	0	0	115.6
151	S	78.1	Confident	83.8	Confident	67 Å²	67	42 Å²	42	47%	0.469	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-23.1	174.5	55.1	0	0	0	0	114.2	D29 L149	D29-S151 WeakPolarHBondContact OD1-CB 3.45Å; D29-S151 PolarHBondContact OD1-OG 3.17Å; L149-S151 WeakPolarHBondContact CD2-OG 3.12Å; L149-S151 WeakPolarHBondContact CG-OG 3.32Å; L149-S151 PolarHBondContact O-N 2.85Å; L149-S151 VanDerWaalsContact O-N 3.16Å
152	A	81.9	Confident	83.8	Confident	29 Å²	29	41.9 Å²	41.9	24%	0.24	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	93.2	-175.6	0	0	0	0	0	111.4	L149 E154 Q155	L149-A152 HydrophobicContact CD2-CB 4.29Å; L149-A152 CarbonylContact O-C 3.54Å; L149-A152 PolarHBondContact O-N 3.25Å; L149-A152 VanDerWaalsContact O-N 3.12Å; A152-E154 PolarHBondContact O-N 3.34Å; A152-Q155 HydrophobicContact CB-CB 4.17Å; A152-Q155 HydrophobicContact CB-CG 4.29Å; A152-Q155 PolarHBondContact O-N 3.36Å
153	P	72.8	Confident	83.7	Confident	99 Å²	99	41.4 Å²	41.4	64%	0.643	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	-18.9	-171.8	-27.2	36	0	0	0	117	Q155	P153-Q155 VanDerWaalsContact C-N 3.34Å
154	E	79.2	Confident	83.2	Confident	162 Å²	162	40.8 Å²	40.8	76%	0.757	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	-4.8	175.8	-55.8	-73.1	177.3	0	0	112.4	A152	A152-E154 PolarHBondContact O-N 3.34Å
155	Q	90.1	Very high	82	Confident	82 Å²	82	43.7 Å²	43.7	38%	0.383	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	151	175.2	-67.4	-174.2	-11.7	0	0	111	L149 A152 P153	L149-Q155 HydrophobicContact CB-CB 4.45Å; L149-Q155 PolarHBondContact N-O 2.63Å; A152-Q155 HydrophobicContact CB-CB 4.17Å; A152-Q155 HydrophobicContact CB-CG 4.29Å; A152-Q155 PolarHBondContact O-N 3.36Å; P153-Q155 VanDerWaalsContact C-N 3.34Å
156	H	92.3	Very high	80.2	Confident	11 Å²	11	46.8 Å²	46.8	5%	0.051	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.8	-176.5	-63.6	72.9	0	0	0	110.4	T42 P44 L133 I146 E147 P148	T42-H156 HydrophobicContact CG2-CB 3.94Å; T42-H156 PolarHBondContact N-O 3.12Å; T42-H156 PolarHBondContact O-N 3.25Å; P44-H156 WeakPolarHBondContact CD-ND1 3.46Å; P44-H156 HydrophobicContact CG-CB 4.36Å; L133-H156 PolarHBondContact N-NE2 3.07Å; L133-H156 PolarHBondContact O-CD2 3.45Å; I146-H156 HydrophobicContact CD1-CB 3.96Å; I146-H156 HydrophobicContact CG1-CB 3.8Å; E147-H156 CarbonylContact O-C 3.49Å; E147-H156 WeakPolarHBondContact O-CA 3.36Å; E147-H156 WeakPolarHBondContact O-CB 3.44Å; P148-H156 VanDerWaalsContact CA-CD2 3.45Å; P148-H156 WeakPolarHBondContact CA-CD2 3.27Å
157	L	91.3	Very high	77.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.2	163	-68.4	172.9	0	0	0	107.9	Q32 T33 L36 Y39 L41 I146 E147 L149	Q32-L157 HydrophobicContact CG-CD1 3.72Å; T33-L157 HydrophobicContact CG2-CD1 4.06Å; T33-L157 HydrophobicContact CG2-CD2 3.96Å; L36-L157 HydrophobicContact CD1-CD1 4.47Å; Y39-L157 HydrophobicContact CD2-CD2 3.44Å; Y39-L157 VanDerWaalsContact CD2-CD2 3.44Å; Y39-L157 HydrophobicContact CE2-CD2 3.7Å; Y39-L157 HydrophobicContact CG-CD2 4.05Å; L41-L157 HydrophobicContact CD2-CD2 3.88Å; I146-L157 CarbonylContact C-O 3.56Å; I146-L157 VanDerWaalsContact CA-O 3.32Å; I146-L157 WeakPolarHBondContact CA-O 3.26Å; E147-L157 HydrophobicContact CG-CB 4.42Å; E147-L157 PolarHBondContact N-O 2.94Å; E147-L157 PolarHBondContact O-N 2.74Å; L149-L157 HydrophobicContact CD1-CD1 4.19Å; L149-L157 HydrophobicContact CD1-CD2 4.09Å; L149-L157 HydrophobicContact CD1-CG 4Å
158	L	90	Very high	75.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119.9	175.6	173.2	69.4	0	0	0	108.2	Y39 Q40 T42 P68 V69 M137 Y144 G145 I146	Y39-L158 WeakPolarHBondContact CA-O 3.38Å; Q40-L158 HydrophobicContact CG-CB 3.88Å; Q40-L158 HydrophobicContact CG-CD2 3.81Å; Q40-L158 HydrophobicContact CG-CG 4.03Å; Q40-L158 PolarHBondContact N-O 2.91Å; Q40-L158 PolarHBondContact O-N 2.93Å; T42-L158 HydrophobicContact CG2-CB 3.75Å; T42-L158 HydrophobicContact CG2-CD2 4Å; T42-L158 HydrophobicContact CG2-CG 4.45Å; P68-L158 WeakPolarHBondContact O-CD2 3.39Å; V69-L158 HydrophobicContact CB-CD2 4.14Å; V69-L158 HydrophobicContact CG1-CD2 4.14Å; V69-L158 HydrophobicContact CG2-CD2 3.71Å; M137-L158 HydrophobicContact CE-CD1 3.79Å; Y144-L158 HydrophobicContact CD1-CD1 4Å; Y144-L158 HydrophobicContact CD1-CG 4.23Å; Y144-L158 HydrophobicContact CG-CD1 4.28Å; G145-L158 WeakPolarHBondContact O-CA 3.32Å; I146-L158 HydrophobicContact CB-CD1 4.29Å
159	Y	87.1	Confident	73.2	Confident	9 Å²	9	61.1 Å²	61.1	4%	0.035	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.1	-172.1	53.3	-90.2	0	0	0	110.2	L36 Y144 G145 E147 L161 V164	L36-Y159 HydrophobicContact CD1-CD1 3.74Å; L36-Y159 HydrophobicContact CD1-CE1 4.25Å; L36-Y159 HydrophobicContact CD1-CG 4.06Å; L36-Y159 HydrophobicContact CD2-CD1 3.95Å; L36-Y159 HydrophobicContact CD2-CD2 3.63Å; L36-Y159 HydrophobicContact CD2-CE1 4.25Å; L36-Y159 HydrophobicContact CD2-CE2 3.96Å; L36-Y159 HydrophobicContact CD2-CG 3.62Å; L36-Y159 HydrophobicContact CG-CG 4.49Å; Y144-Y159 CarbonylContact C-O 3.46Å; Y144-Y159 VanDerWaalsContact CA-O 3.24Å; Y144-Y159 WeakPolarHBondContact CA-O 3.49Å; G145-Y159 PolarHBondContact N-O 2.9Å; G145-Y159 PolarHBondContact O-N 2.99Å; E147-Y159 HydrophobicContact CG-CE1 4.49Å; Y159-L161 HydrophobicContact CD2-CD2 4.47Å; Y159-L161 HydrophobicContact CE2-CD2 3.92Å; Y159-V164 HydrophobicContact CD2-CG2 3.71Å; Y159-V164 HydrophobicContact CE2-CG2 3.53Å
160	R	82.1	Confident	71	Confident	66 Å²	66	61.7 Å²	61.7	25%	0.249	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141	170.9	-56.4	173.6	174.9	-125.5	-6.3	107.7	D70 D142 S143 Y144 Q162 D163	D70-R160 IonicContact OD2-CZ 2.72Å; D70-R160 IonicContact OD2-NE 3.57Å; D70-R160 IonicContact OD2-NH2 3.78Å; D70-R160 PolarHBondContact OD2-NH2 3.41Å; D142-R160 IonicContact OD1-CZ 3.5Å; D142-R160 IonicContact OD1-NH1 3.72Å; D142-R160 PolarHBondContact OD1-NH1 2.78Å; D142-R160 IonicContact OD2-CZ 3.95Å; D142-R160 IonicContact OD2-NH1 3.88Å; D142-R160 PolarHBondContact OD2-NH1 2.83Å; D142-R160 IonicContact OD2-NH2 2.75Å; S143-R160 CarbonylContact O-C 3.56Å; S143-R160 WeakPolarHBondContact O-CA 3.39Å; Y144-R160 HydrophobicContact CD1-CG 4.05Å; Y144-R160 HydrophobicContact CE1-CG 3.72Å; Y144-R160 PolarHBondContact OH-NH2 3.22Å; Y144-R160 VanDerWaalsContact OH-NH2 3.09Å; R160-Q162 HydrophobicContact CB-CG 3.96Å; R160-Q162 PolarHBondContact O-N 2.68Å; R160-Q162 VanDerWaalsContact O-N 3.15Å; R160-D163 WeakPolarHBondContact CB-OD2 3.4Å; R160-D163 PolarHBondContact N-OD2 2.81Å; R160-D163 WeakPolarHBondContact O-CB 3.43Å; R160-D163 PolarHBondContact O-N 3.46Å
161	L	75.6	Confident	69.3	Low	24 Å²	24	59.5 Å²	59.5	13%	0.126	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-63.6	-22.8	-177.1	-65.5	-175.5	0	0	0	112.7	V136 S143 Y159 D163 V164 A336 K377	V136-L161 HydrophobicContact CG1-CD1 4.19Å; V136-L161 HydrophobicContact CG1-CD2 4.39Å; S143-L161 PolarHBondContact O-N 2.71Å; Y159-L161 HydrophobicContact CD2-CD2 4.47Å; Y159-L161 HydrophobicContact CE2-CD2 3.92Å; L161-D163 VanDerWaalsContact C-N 3.32Å; L161-V164 WeakPolarHBondContact O-CG2 3.41Å; L161-A336 HydrophobicContact CD2-CB 4.21Å; L161-K377 HydrophobicContact CD1-CG 4.3Å
162	Q	71.6	Confident	67.4	Low	143 Å²	143	56.4 Å²	56.4	67%	0.668	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-70.2	-24.8	171.5	77.1	-170	13.3	0	0	113.4	R160 V164	R160-Q162 HydrophobicContact CB-CG 3.96Å; R160-Q162 PolarHBondContact O-N 2.68Å; R160-Q162 VanDerWaalsContact O-N 3.15Å; Q162-V164 PolarHBondContact O-N 3.12Å
163	D	73.8	Confident	65	Low	29 Å²	29	56.8 Å²	56.8	16%	0.155	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-82.4	-1.4	-177	-54.8	-22.2	0	0	0	111.4	A37 R160 L161 T165	A37-D163 PolarHBondContact N-O 3.24Å; R160-D163 WeakPolarHBondContact CB-OD2 3.4Å; R160-D163 PolarHBondContact N-OD2 2.81Å; R160-D163 WeakPolarHBondContact O-CB 3.43Å; R160-D163 PolarHBondContact O-N 3.46Å; L161-D163 VanDerWaalsContact C-N 3.32Å; D163-T165 PolarHBondContact O-N 2.74Å
164	V	70.6	Confident	63	Low	20 Å²	20	54.9 Å²	54.9	12%	0.121	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-72.7	111.5	177.5	177.1	0	0	0	0	109.8	H35 L36 Y159 L161 Q162 S166	H35-V164 CarbonylContact O-C 3.54Å; L36-V164 HydrophobicContact CD2-CG2 3.94Å; Y159-V164 HydrophobicContact CD2-CG2 3.71Å; Y159-V164 HydrophobicContact CE2-CG2 3.53Å; L161-V164 WeakPolarHBondContact O-CG2 3.41Å; Q162-V164 PolarHBondContact O-N 3.12Å; V164-S166 PolarHBondContact O-N 2.92Å
165	T	59.8	Low	60.9	Low	71 Å²	71	54 Å²	54	44%	0.436	29%	0.288	S	S	.	.			trans	-77	62.6	178.3	49.4	0	0	0	0	111.7	H35 L36 A37 D163	H35-T165 VanDerWaalsContact CA-OG1 3.25Å; H35-T165 WeakPolarHBondContact CA-OG1 3.39Å; H35-T165 PolarHBondContact O-N 2.9Å; H35-T165 PolarHBondContact O-OG1 3.17Å; H35-T165 VanDerWaalsContact O-OG1 3.12Å; L36-T165 PolarHBondContact N-OG1 2.98Å; A37-T165 HydrophobicContact CB-CG2 3.71Å; D163-T165 PolarHBondContact O-N 2.74Å
166	S	51.3	Low	58	Low	65 Å²	65	60.5 Å²	60.5	46%	0.455	31%	0.31	S	S	.	.			trans	-59.8	138.2	158.1	69.4	0	0	0	0	109.3	V164	V164-S166 PolarHBondContact O-N 2.92Å
167	Q	39.3	Very low	55	Low	136 Å²	136	63 Å²	63	64%	0.636	34%	0.339	S	S	*	.			trans	-56.1	133.8	158.4	-72.2	179	-25.5	0	0	107.2	R169	Q167-R169 VanDerWaalsContact C-N 3.33Å; Q167-R169 PolarHBondContact O-N 3.41Å; Q167-R169 VanDerWaalsContact OE1-NH2 3.17Å
168	P	37.5	Very low	52.1	Low	128 Å²	128	72.5 Å²	72.5	83%	0.831	38%	0.382	S	S	*	.			trans	-66.3	90.5	-176	25.8	-34.5	0	0	0	111.1	G170	P168-G170 PolarHBondContact O-N 3.44Å
169	R	46.5	Very low	49.1	Very low	76 Å²	76	75.3 Å²	75.3	29%	0.287	41%	0.412	S	S	.	.			trans	-97.2	69.5	173.6	-66.4	179.4	-173	-136.4	0.4	108.4	Q167 S305 A373	Q167-R169 VanDerWaalsContact C-N 3.33Å; Q167-R169 PolarHBondContact O-N 3.41Å; Q167-R169 VanDerWaalsContact OE1-NH2 3.17Å; R169-S305 PolarHBondContact NH1-OG 2.77Å; R169-A373 WeakPolarHBondContact O-CB 3.45Å
170	G	41	Very low	46.5	Very low	25 Å²	25	83.1 Å²	83.1	26%	0.258	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-60.7	146.1	166.3	0	0	0	0	0	109.4	P168 G172 V308	P168-G170 PolarHBondContact O-N 3.44Å; G170-G172 PolarHBondContact O-N 3.25Å; G170-V308 CarbonylContact O-C 3.59Å; G170-V308 VanDerWaalsContact O-CB 3.31Å; G170-V308 WeakPolarHBondContact O-CB 3.27Å
171	C	44.3	Very low	43.8	Very low	7 Å²	7	84.7 Å²	84.7	5%	0.047	48%	0.481	C	S	.	.	S	Bend	trans	-81.2	60.8	-178.2	-152.1	0	0	0	0	111.9	S371 S607 D608	C171-S371 CarbonylContact C-O 3.56Å; C171-S371 VanDerWaalsContact CA-O 3.23Å; C171-S371 WeakPolarHBondContact CA-O 3.34Å; C171-S371 WeakPolarHBondContact CB-O 3.03Å; C171-S371 PolarHBondContact N-O 3.43Å; C171-S607 PolarHBondContact O-OG 3.49Å; C171-S607 PolarHBondContact SG-OG 3.21Å; C171-D608 WeakPolarHBondContact CB-OD2 3.35Å; C171-D608 VanDerWaalsContact SG-CB 3.56Å; C171-D608 PolarHBondContact SG-OD2 2.93Å
172	G	36.7	Very low	41.8	Very low	2 Å²	2	88.9 Å²	88.9	2%	0.021	52%	0.519	C	S	.	.	S	Bend	trans	82.3	30.2	164.1	0	0	0	0	0	116.7	G170 Y553 S607	G170-G172 PolarHBondContact O-N 3.25Å; G172-Y553 VanDerWaalsContact C-CE2 3.49Å; G172-Y553 VanDerWaalsContact CA-CE1 3.44Å; G172-Y553 VanDerWaalsContact CA-CZ 3.47Å; G172-Y553 WeakPolarHBondContact O-CD2 3.23Å; G172-Y553 WeakPolarHBondContact O-CE2 3.33Å; G172-Y553 VanDerWaalsContact O-CZ 3.3Å; G172-S607 WeakPolarHBondContact CA-OG 3.27Å; G172-S607 PolarHBondContact N-OG 2.92Å
173	T	33.2	Very low	39.6	Very low	38 Å²	38	90.7 Å²	90.7	23%	0.233	53%	0.528	C	S	.	.			trans	-133.8	117.6	167.8	50.8	0	0	0	0	111	S371	T173-S371 PolarHBondContact OG1-OG 3.2Å
174	P	30.5	Very low	37.7	Very low	58 Å²	58	98 Å²	98	38%	0.377	56%	0.561	S	S	.	*			trans	-89.6	113.7	161.7	15.6	3.9	0	0	0	107.1	Y176 Y553	P174-Y176 PolarHBondContact O-N 3.34Å; P174-Y553 WeakPolarHBondContact CD-OH 3.36Å; P174-Y553 WeakPolarHBondContact CG-OH 3.44Å
175	H	33.9	Very low	35.4	Very low	145 Å²	145	101.7 Å²	101.7	67%	0.671	59%	0.593	S	S	*	*			trans	-64.8	108.2	169.1	-68.6	-79.9	0	0	0	108.8	G177	H175-G177 PolarHBondContact O-N 2.88Å
176	Y	30.1	Very low	33.8	Very low	218 Å²	218	107.2 Å²	107.2	86%	0.855	61%	0.614	S	S	*	*			trans	-69.4	74.7	161.5	-83.8	-90	0	0	0	108.8	P174 H178	P174-Y176 PolarHBondContact O-N 3.34Å; Y176-H178 PolarHBondContact O-N 3.35Å
177	G	28.5	Very low	32.5	Very low	63 Å²	63	114.4 Å²	114.4	65%	0.649	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-60	125	154.9	0	0	0	0	0	107.6	H175 G179	H175-G177 PolarHBondContact O-N 2.88Å; G177-G179 PolarHBondContact O-N 3.13Å
178	H	30.3	Very low	31.7	Very low	199 Å²	199	114.2 Å²	114.2	92%	0.921	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-59.1	135.9	165.1	-99.9	-84	0	0	0	108.3	Y176	Y176-H178 PolarHBondContact O-N 3.35Å
179	G	27.3	Very low	31.3	Very low	60 Å²	60	113.5 Å²	113.5	62%	0.619	63%	0.632	S	S	*	*	S	Bend	trans	-67.2	168.5	-169.2	0	0	0	0	0	114.9	G177	G177-G179 PolarHBondContact O-N 3.13Å
180	D	32.1	Very low	30.2	Very low	173 Å²	173	118.3 Å²	118.3	93%	0.925	66%	0.657	S	S	*	*			trans	64.2	71.1	159.9	-52.2	-28.1	0	0	0	117.1
181	A	25.2	Very low	29.7	Very low	99 Å²	99	126 Å²	126	82%	0.818	69%	0.687	S	S	*	*			trans	-140	66	157.7	0	0	0	0	0	111.1	E183	A181-E183 VanDerWaalsContact C-N 3.33Å; A181-E183 PolarHBondContact O-N 2.85Å; A181-E183 VanDerWaalsContact O-N 3.15Å
182	A	33.8	Very low	28.9	Very low	112 Å²	112	133.1 Å²	133.1	93%	0.926	72%	0.723	S	S	*	*			trans	-82.1	77.2	170.3	0	0	0	0	0	110.3
183	E	27	Very low	28.4	Very low	180 Å²	180	141.2 Å²	141.2	84%	0.841	76%	0.76	S	S	*	*			trans	-144.6	157.1	177.3	-138.8	167.7	-149.4	0	0	112.9	A181 A185	A181-E183 VanDerWaalsContact C-N 3.33Å; A181-E183 PolarHBondContact O-N 2.85Å; A181-E183 VanDerWaalsContact O-N 3.15Å; E183-A185 PolarHBondContact O-N 2.71Å
184	H	32.3	Very low	28.3	Very low	183 Å²	183	147.9 Å²	147.9	85%	0.847	79%	0.788	S	S	*	*			trans	-77.2	95	-162.7	-66.9	-80	0	0	0	113.9	Q186	H184-Q186 PolarHBondContact O-N 2.78Å
185	A	23.1	Very low	28.1	Very low	98 Å²	98	156.1 Å²	156.1	81%	0.81	81%	0.812	S	S	*	*			trans	-73.6	74.5	164.9	0	0	0	0	0	111.4	E183 Y187	E183-A185 PolarHBondContact O-N 2.71Å; A185-Y187 PolarHBondContact O-N 2.86Å
186	Q	26.9	Very low	28.1	Very low	187 Å²	187	160.9 Å²	160.9	87%	0.874	82%	0.824	S	S	*	*			trans	-71.1	92.1	174.1	-176.7	175	-9.6	0	0	110	H184	H184-Q186 PolarHBondContact O-N 2.78Å
187	Y	23.1	Very low	28.2	Very low	215 Å²	215	161.6 Å²	161.6	84%	0.843	83%	0.825	S	S	*	*			trans	-87.2	111.1	-178	-155.9	-82.1	0	0	0	111.2	A185	A185-Y187 PolarHBondContact O-N 2.86Å
188	D	22.8	Very low	28.3	Very low	133 Å²	133	163.8 Å²	163.8	71%	0.711	83%	0.83	S	S	*	*			trans	-76.6	133.9	177.6	-147.6	13.2	0	0	0	109.8	E190	D188-E190 PolarHBondContact O-N 3.23Å
189	P	27.7	Very low	28.6	Very low	113 Å²	113	165.8 Å²	165.8	73%	0.734	83%	0.829	S	S	*	*			trans	-82.8	76.9	-172.1	33.2	-34.9	0	0	0	112.1	E191	P189-E191 PolarHBondContact O-N 3.09Å
190	E	25	Very low	28.9	Very low	177 Å²	177	168.6 Å²	168.6	83%	0.827	84%	0.835	S	S	*	*			trans	-62	132.1	167	-75.6	-156.8	142	0	0	111.1	D188 I192	D188-E190 PolarHBondContact O-N 3.23Å; E190-I192 PolarHBondContact O-N 2.88Å; E190-I192 VanDerWaalsContact O-N 3.16Å
191	E	28.8	Very low	28.9	Very low	186 Å²	186	169 Å²	169	87%	0.869	83%	0.828	S	S	*	*			trans	-60.7	115.8	-177.5	-64.7	-175	111.5	0	0	111.8	P189 Q193	P189-E191 PolarHBondContact O-N 3.09Å; E191-Q193 PolarHBondContact O-N 2.99Å
192	I	28.7	Very low	29.9	Very low	157 Å²	157	168.6 Å²	168.6	81%	0.805	81%	0.805	S	S	*	*			trans	-71.2	83.1	172.2	-56.6	-177.7	0	0	0	109.4	E190 H194	E190-I192 PolarHBondContact O-N 2.88Å; E190-I192 VanDerWaalsContact O-N 3.16Å; I192-H194 PolarHBondContact O-N 2.86Å
193	Q	25.1	Very low	30.2	Very low	171 Å²	171	166.8 Å²	166.8	80%	0.799	79%	0.791	S	S	*	*			trans	-56.6	112.6	-177.6	-166.2	178.1	84.4	0	0	110.4	E191 R195	E191-Q193 PolarHBondContact O-N 2.99Å; Q193-R195 VanDerWaalsContact C-N 3.34Å; Q193-R195 PolarHBondContact O-N 3.35Å
194	H	31.5	Very low	31	Very low	179 Å²	179	159.4 Å²	159.4	83%	0.829	76%	0.758	S	S	*	*			trans	-60.6	82.7	-171.2	-79.4	-43.4	0	0	0	114.1	I192 R196	I192-H194 PolarHBondContact O-N 2.86Å; H194-R196 VanDerWaalsContact C-N 3.35Å; H194-R196 PolarHBondContact O-N 3.37Å
195	R	27.3	Very low	31.9	Very low	230 Å²	230	151.7 Å²	151.7	87%	0.868	72%	0.723	S	S	*	*			trans	-67.2	92.8	165	-87.6	-174.1	164.1	-178	-3.8	109.6	Q193 R197	Q193-R195 VanDerWaalsContact C-N 3.34Å; Q193-R195 PolarHBondContact O-N 3.35Å; R195-R197 VanDerWaalsContact C-N 3.28Å; R195-R197 PolarHBondContact O-N 2.66Å
196	R	32.9	Very low	33.4	Very low	245 Å²	245	153.8 Å²	153.8	93%	0.925	72%	0.715	S	S	*	*			trans	-54.2	83.9	170.7	-69.6	-179.6	173.3	-178.7	-1.2	111.5	H194	H194-R196 VanDerWaalsContact C-N 3.35Å; H194-R196 PolarHBondContact O-N 3.37Å
197	R	32.9	Very low	34.9	Very low	234 Å²	234	151.5 Å²	151.5	88%	0.883	70%	0.703	S	S	*	*			trans	-65.8	150	160.1	-77.2	-176.1	167.9	174.5	-2.6	108.7	R195 R199	R195-R197 VanDerWaalsContact C-N 3.28Å; R195-R197 PolarHBondContact O-N 2.66Å; R197-R199 PolarHBondContact O-N 3.49Å
198	S	31.3	Very low	37	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	68%	0.678	S	S	*	*			trans	-55.4	132.3	-167	-170.4	0	0	0	0	112.4	V200	S198-V200 VanDerWaalsContact C-N 3.27Å; S198-V200 PolarHBondContact O-N 3.02Å
199	R	35.1	Very low	39.7	Very low	241 Å²	241	137.7 Å²	137.7	91%	0.909	65%	0.645	S	S	*	*			trans	-68.1	88.7	165	-74.7	-178.6	175.5	171.6	-4	108.4	R197 K201	R197-R199 PolarHBondContact O-N 3.49Å; R199-K201 PolarHBondContact O-N 2.85Å
200	V	34	Very low	42.2	Very low	120 Å²	120	134.1 Å²	134.1	73%	0.727	62%	0.617	S	S	*	*			trans	-57.3	121.7	160.8	180	0	0	0	0	106.6	S198 R202	S198-V200 VanDerWaalsContact C-N 3.27Å; S198-V200 PolarHBondContact O-N 3.02Å; V200-R202 PolarHBondContact O-N 2.87Å
201	K	33.3	Very low	45.4	Very low	182 Å²	182	125.7 Å²	125.7	79%	0.791	58%	0.578	S	S	*	*			trans	-72.4	94.5	175	-72.5	-174.5	175.8	-175.7	0	108.1	R199 A203	R199-K201 PolarHBondContact O-N 2.85Å; K201-A203 VanDerWaalsContact C-N 3.26Å; K201-A203 PolarHBondContact O-N 3.28Å
202	R	45.8	Very low	48.4	Very low	89 Å²	89	117.1 Å²	117.1	34%	0.336	54%	0.538	S	S	.	.			trans	-62.9	85.5	171.4	-68	-168.6	172.7	152	-12	109.4	V200 V204 L205 H206 D385 E388	V200-R202 PolarHBondContact O-N 2.87Å; R202-V204 PolarHBondContact O-N 2.73Å; R202-L205 HydrophobicContact CB-CB 4.25Å; R202-L205 HydrophobicContact CB-CD1 4.24Å; R202-L205 PolarHBondContact O-N 2.95Å; R202-H206 PolarHBondContact O-CD2 3.27Å; R202-D385 IonicContact CZ-OD1 2.7Å; R202-D385 VanDerWaalsContact CZ-OD1 3.32Å; R202-D385 IonicContact NE-OD1 3.99Å; R202-D385 PolarHBondContact NE-OD1 3.04Å; R202-D385 IonicContact NH2-OD1 2.96Å; R202-D385 PolarHBondContact NH2-OD1 2.91Å; R202-D385 IonicContact NH2-OD2 3.59Å; R202-E388 VanDerWaalsContact C-OE1 3.26Å; R202-E388 WeakPolarHBondContact CA-OE1 3.42Å; R202-E388 VanDerWaalsContact CB-OE2 3.3Å; R202-E388 WeakPolarHBondContact CB-OE2 3.37Å; R202-E388 WeakPolarHBondContact CD-OE2 3.31Å; R202-E388 WeakPolarHBondContact CG-OE2 3.5Å
203	A	39.7	Very low	51.6	Low	75 Å²	75	109.6 Å²	109.6	62%	0.62	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-24	-164.9	0	0	0	0	0	112.9	K201 E388	K201-A203 VanDerWaalsContact C-N 3.26Å; K201-A203 PolarHBondContact O-N 3.28Å; A203-E388 PolarHBondContact N-OE1 3.31Å
204	V	43.5	Very low	55	Low	24 Å²	24	101.5 Å²	101.5	15%	0.145	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-48.6	-179.9	-178.8	0	0	0	0	110.7	R202 H206 K207 E388 I391 L392	R202-V204 PolarHBondContact O-N 2.73Å; V204-H206 PolarHBondContact O-N 3.43Å; V204-K207 PolarHBondContact O-N 3.23Å; V204-E388 HydrophobicContact CB-CG 4.02Å; V204-E388 WeakPolarHBondContact CB-OE1 3.21Å; V204-E388 HydrophobicContact CG2-CG 4.11Å; V204-E388 PolarHBondContact N-OE1 3.02Å; V204-I391 HydrophobicContact CG1-CB 3.85Å; V204-I391 HydrophobicContact CG1-CG1 4.39Å; V204-I391 HydrophobicContact CG1-CG2 3.41Å; V204-I391 VanDerWaalsContact CG1-CG2 3.41Å; V204-L392 HydrophobicContact CG2-CD2 3.63Å; V204-L392 HydrophobicContact CG2-CG 3.89Å
205	L	52.2	Low	58.2	Low	22 Å²	22	93 Å²	93	12%	0.115	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-7.7	-177.4	-81.3	156	0	0	0	114.6	R202 K207 L250 N251 F387 E388	R202-L205 HydrophobicContact CB-CB 4.25Å; R202-L205 HydrophobicContact CB-CD1 4.24Å; R202-L205 PolarHBondContact O-N 2.95Å; L205-K207 VanDerWaalsContact C-N 3.31Å; L205-L250 WeakPolarHBondContact CD2-O 3.36Å; L205-N251 PolarHBondContact O-ND2 2.81Å; L205-F387 HydrophobicContact CD2-CD1 3.99Å; L205-F387 HydrophobicContact CD2-CE1 4.03Å; L205-E388 HydrophobicContact CD1-CB 4.03Å
206	H	53	Low	61.6	Low	142 Å²	142	82 Å²	82	66%	0.657	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.8	168.9	-72	-44.7	0	0	0	114	R202 V204	R202-H206 PolarHBondContact O-CD2 3.27Å; V204-H206 PolarHBondContact O-N 3.43Å
207	K	59.5	Low	64.8	Low	139 Å²	139	70.3 Å²	70.3	60%	0.604	34%	0.337	S	S	*	.	S	Bend	trans	-92	136	170.1	-71.8	-174.1	175.7	-175.2	0	110.4	V204 L205 H209 N251	V204-K207 PolarHBondContact O-N 3.23Å; L205-K207 VanDerWaalsContact C-N 3.31Å; K207-H209 PolarHBondContact O-CE1 3.37Å; K207-H209 PolarHBondContact O-N 2.96Å; K207-H209 PolarHBondContact O-ND1 3.2Å; K207-N251 VanDerWaalsContact C-ND2 3.27Å; K207-N251 PolarHBondContact O-ND2 3.22Å
208	T	67.8	Low	67.9	Low	54 Å²	54	59.3 Å²	59.3	33%	0.331	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-70.5	126.5	168.7	-52	0	0	0	0	109.1	Y210 N251 R253	T208-Y210 HydrophobicContact CG2-CE1 4.4Å; T208-Y210 HydrophobicContact CG2-CE2 3.74Å; T208-N251 VanDerWaalsContact CA-O 3.3Å; T208-N251 WeakPolarHBondContact CA-O 3.46Å; T208-N251 WeakPolarHBondContact CA-OD1 3.32Å; T208-N251 WeakPolarHBondContact CB-OD1 3.48Å; T208-N251 PolarHBondContact N-ND2 3.05Å; T208-N251 PolarHBondContact OG1-OD1 2.89Å; T208-R253 HydrophobicContact CG2-CG 3.7Å
209	H	78.8	Confident	71	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.019	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	156.3	173.9	-64.4	74.5	0	0	0	109.5	K207 N251 V252 R253 F387 L399	K207-H209 PolarHBondContact O-CE1 3.37Å; K207-H209 PolarHBondContact O-N 2.96Å; K207-H209 PolarHBondContact O-ND1 3.2Å; H209-N251 PolarHBondContact N-O 3.24Å; H209-V252 HydrophobicContact CB-CG2 4.34Å; H209-V252 CarbonylContact O-C 3.59Å; H209-V252 WeakPolarHBondContact O-CA 3.49Å; H209-R253 PolarHBondContact O-N 3.42Å; H209-F387 HydrophobicContact CB-CZ 4.38Å; H209-L399 CarbonylContact C-O 3.57Å; H209-L399 WeakPolarHBondContact CA-O 3.18Å; H209-L399 HydrophobicContact CB-CB 4.28Å; H209-L399 WeakPolarHBondContact CB-O 3.3Å
210	Y	80.9	Confident	73.9	Confident	38 Å²	38	46.2 Å²	46.2	15%	0.149	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.9	-177.3	-64.2	-96.5	0	0	0	109.5	V83 T208 R253 L399 N401 V402	V83-Y210 HydrophobicContact CG1-CE1 4.22Å; T208-Y210 HydrophobicContact CG2-CE1 4.4Å; T208-Y210 HydrophobicContact CG2-CE2 3.74Å; Y210-R253 CarbonylContact C-O 3.53Å; Y210-R253 VanDerWaalsContact CA-O 3.31Å; Y210-R253 WeakPolarHBondContact CA-O 3.21Å; Y210-R253 HydrophobicContact CD1-CB 3.65Å; Y210-R253 HydrophobicContact CD1-CG 4.26Å; Y210-R253 HydrophobicContact CE1-CB 3.75Å; Y210-R253 HydrophobicContact CE1-CG 3.85Å; Y210-R253 HydrophobicContact CG-CB 4.44Å; Y210-L399 PolarHBondContact N-O 2.84Å; Y210-L399 WeakPolarHBondContact O-CA 3.42Å; Y210-L399 WeakPolarHBondContact O-CB 3.19Å; Y210-L399 WeakPolarHBondContact O-CD2 3.03Å; Y210-N401 VanDerWaalsContact CB-O 3.31Å; Y210-N401 WeakPolarHBondContact CB-O 3.06Å; Y210-V402 HydrophobicContact CD1-CB 4.41Å; Y210-V402 HydrophobicContact CD1-CG1 4.06Å; Y210-V402 HydrophobicContact CD2-CG2 4.16Å; Y210-V402 HydrophobicContact CE1-CB 4.27Å; Y210-V402 HydrophobicContact CE1-CG1 3.78Å; Y210-V402 HydrophobicContact CE1-CG2 4.07Å; Y210-V402 HydrophobicContact CE2-CB 4.46Å; Y210-V402 HydrophobicContact CE2-CG2 3.68Å
211	V	91.1	Very high	76.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	114.2	175.3	179.6	0	0	0	0	108.4	L213 V252 R253 V254 V255 L346 L350 L399	V211-L213 PolarHBondContact O-N 2.86Å; V211-L213 VanDerWaalsContact O-N 3.07Å; V211-V252 HydrophobicContact CG2-CG1 3.72Å; V211-R253 PolarHBondContact N-O 2.75Å; V211-V254 HydrophobicContact CB-CG2 4.33Å; V211-V255 PolarHBondContact O-N 2.68Å; V211-L346 HydrophobicContact CG1-CD1 4.19Å; V211-L346 HydrophobicContact CG1-CD2 4.36Å; V211-L350 HydrophobicContact CG2-CD1 4.37Å; V211-L350 HydrophobicContact CG2-CD2 4.15Å; V211-L399 HydrophobicContact CG2-CD2 4.01Å
212	E	91.4	Very high	79.8	Confident	5 Å²	5	32.7 Å²	32.7	2%	0.023	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	92.1	166.9	-61.9	174.6	-163.6	0	0	109.1	V257 R294 H295 D296 S297 N401 P403	E212-V257 HydrophobicContact CB-CG1 3.84Å; E212-V257 HydrophobicContact CB-CG2 4.03Å; E212-V257 HydrophobicContact CG-CG1 4.01Å; E212-R294 IonicContact OE1-CZ 2.66Å; E212-R294 IonicContact OE1-NE 3.27Å; E212-R294 PolarHBondContact OE1-NE 2.83Å; E212-R294 IonicContact OE1-NH2 2.67Å; E212-R294 PolarHBondContact OE1-NH2 3.43Å; E212-R294 WeakPolarHBondContact OE2-CG 3.42Å; E212-R294 IonicContact OE2-CZ 3.38Å; E212-R294 IonicContact OE2-NE 2.73Å; E212-R294 PolarHBondContact OE2-NE 3.5Å; E212-R294 IonicContact OE2-NH2 3.91Å; E212-H295 HydrophobicContact CB-CB 4.4Å; E212-H295 CarbonylContact O-C 3.57Å; E212-H295 WeakPolarHBondContact O-CB 3.42Å; E212-D296 HydrophobicContact CB-CB 4.36Å; E212-D296 WeakPolarHBondContact CB-OD2 3.1Å; E212-D296 PolarHBondContact N-OD2 2.82Å; E212-D296 PolarHBondContact O-N 2.92Å; E212-S297 PolarHBondContact O-N 3.48Å; E212-N401 PolarHBondContact OE1-ND2 3.19Å; E212-P403 HydrophobicContact CG-CB 4.13Å; E212-P403 HydrophobicContact CG-CG 4.47Å
213	L	96.5	Very high	82.2	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.1	-179.2	177.4	63.1	0	0	0	111.3	V211 L215 V254 V255 L256 V257 Q299	V211-L213 PolarHBondContact O-N 2.86Å; V211-L213 VanDerWaalsContact O-N 3.07Å; L213-L215 HydrophobicContact CD1-CD2 4.32Å; L213-L215 HydrophobicContact CD2-CD2 4.08Å; L213-L215 HydrophobicContact CD2-CG 4.4Å; L213-L215 HydrophobicContact CG-CD2 4.25Å; L213-L215 HydrophobicContact CG-CG 4.45Å; L213-V254 HydrophobicContact CB-CG1 3.81Å; L213-V254 HydrophobicContact CD2-CG1 3.55Å; L213-V254 HydrophobicContact CG-CG1 4.32Å; L213-V255 PolarHBondContact N-O 3.48Å; L213-L256 CarbonylContact O-C 3.32Å; L213-L256 WeakPolarHBondContact O-CA 3.31Å; L213-V257 WeakPolarHBondContact O-CG2 3.44Å; L213-V257 PolarHBondContact O-N 3.42Å; L213-Q299 HydrophobicContact CD1-CB 4.31Å; L213-Q299 HydrophobicContact CD1-CG 3.73Å
214	L	97.5	Very high	84.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.2	170.1	-154.5	167.9	0	0	0	110.3	V216 G258 D260 L289 R293 H295 S297 A298 Q299	L214-V216 HydrophobicContact CD2-CG2 3.98Å; L214-G258 WeakPolarHBondContact CA-O 3.1Å; L214-D260 HydrophobicContact CD2-CB 4.47Å; L214-L289 HydrophobicContact CD1-CD1 3.86Å; L214-L289 HydrophobicContact CD1-CD2 3.91Å; L214-L289 HydrophobicContact CD1-CG 3.87Å; L214-L289 HydrophobicContact CD2-CD1 4.29Å; L214-L289 HydrophobicContact CD2-CD2 4Å; L214-L289 HydrophobicContact CG-CD2 4.43Å; L214-R293 HydrophobicContact CD1-CB 3.98Å; L214-R293 HydrophobicContact CD1-CG 3.99Å; L214-H295 HydrophobicContact CB-CB 3.87Å; L214-H295 HydrophobicContact CD1-CB 4.31Å; L214-S297 PolarHBondContact N-O 2.89Å; L214-S297 VanDerWaalsContact N-O 3.11Å; L214-A298 HydrophobicContact CB-CB 4.33Å; L214-A298 CarbonylContact O-C 3.31Å; L214-A298 WeakPolarHBondContact O-CA 3.5Å; L214-Q299 PolarHBondContact O-N 2.86Å
215	L	98.6	Very high	87.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.6	177.2	-66.6	179.2	0	0	0	110.7	L213 M236 L239 L256 G258 L259 D260 Q299 I301	L213-L215 HydrophobicContact CD1-CD2 4.32Å; L213-L215 HydrophobicContact CD2-CD2 4.08Å; L213-L215 HydrophobicContact CD2-CG 4.4Å; L213-L215 HydrophobicContact CG-CD2 4.25Å; L213-L215 HydrophobicContact CG-CG 4.45Å; L215-M236 HydrophobicContact CD1-CB 3.9Å; L215-M236 HydrophobicContact CD1-CG 4.46Å; L215-M236 HydrophobicContact CD1-SD 4.2Å; L215-L239 HydrophobicContact CD1-CD2 4.29Å; L215-L256 HydrophobicContact CB-CD1 4Å; L215-L256 HydrophobicContact CD1-CD1 3.73Å; L215-L256 HydrophobicContact CD1-CD2 4.48Å; L215-L256 HydrophobicContact CG-CD1 3.55Å; L215-G258 PolarHBondContact N-O 3.31Å; L215-G258 VanDerWaalsContact N-O 3.14Å; L215-L259 HydrophobicContact CB-CD1 4.08Å; L215-L259 CarbonylContact O-C 3.49Å; L215-L259 VanDerWaalsContact O-CA 3.29Å; L215-L259 WeakPolarHBondContact O-CA 3.35Å; L215-L259 WeakPolarHBondContact O-CD1 3.37Å; L215-D260 PolarHBondContact O-N 3.09Å; L215-Q299 HydrophobicContact CD2-CB 3.95Å; L215-I301 HydrophobicContact CD2-CD1 4.27Å
216	V	98.7	Very high	89.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.2	177	-174.1	0	0	0	0	108.6	L214 D260 W262 F281 W284 L289 Q299 L300 I301	L214-V216 HydrophobicContact CD2-CG2 3.98Å; V216-D260 CarbonylContact C-O 3.58Å; V216-D260 WeakPolarHBondContact CA-O 2.96Å; V216-D260 HydrophobicContact CG1-CB 4.25Å; V216-D260 HydrophobicContact CG2-CB 4.27Å; V216-W262 HydrophobicContact CG1-CD2 4.3Å; V216-W262 HydrophobicContact CG1-CH2 4.4Å; V216-W262 HydrophobicContact CG1-CZ2 3.67Å; V216-F281 HydrophobicContact CB-CE2 4.06Å; V216-F281 HydrophobicContact CB-CZ 4.34Å; V216-F281 HydrophobicContact CG1-CE2 4.31Å; V216-F281 HydrophobicContact CG2-CE2 3.93Å; V216-F281 HydrophobicContact CG2-CZ 4.03Å; V216-W284 HydrophobicContact CG1-CH2 4.2Å; V216-W284 HydrophobicContact CG1-CZ3 4.23Å; V216-W284 HydrophobicContact CG2-CH2 4.45Å; V216-W284 HydrophobicContact CG2-CZ3 4.19Å; V216-L289 HydrophobicContact CG2-CD2 3.85Å; V216-Q299 PolarHBondContact N-O 2.87Å; V216-L300 HydrophobicContact CB-CD1 3.77Å; V216-L300 HydrophobicContact CG1-CD1 3.54Å; V216-L300 CarbonylContact O-C 3.51Å; V216-L300 WeakPolarHBondContact O-CA 3.39Å; V216-I301 PolarHBondContact O-N 2.84Å
217	V	98.6	Very high	91.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.1	-174.4	-179	0	0	0	0	110	R221 V232 M236 L259 D260 I261 W262 I301	V217-R221 HydrophobicContact CG1-CB 3.83Å; V217-R221 HydrophobicContact CG1-CG 3.7Å; V217-V232 HydrophobicContact CB-CG1 4.2Å; V217-V232 HydrophobicContact CG1-CG1 3.95Å; V217-V232 HydrophobicContact CG2-CG1 3.93Å; V217-M236 HydrophobicContact CG2-CG 3.75Å; V217-M236 HydrophobicContact CG2-SD 3.84Å; V217-L259 HydrophobicContact CG2-CD1 3.88Å; V217-D260 PolarHBondContact N-O 2.82Å; V217-I261 HydrophobicContact CB-CG2 4.44Å; V217-W262 WeakPolarHBondContact O-CB 3.38Å; V217-W262 PolarHBondContact O-N 3.02Å; V217-I301 HydrophobicContact CG2-CB 4.38Å
218	D	97.7	Very high	92.8	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.011	17%	0.174	C	C	.	.			trans	-69.2	162.8	-178.9	85.5	-4.8	0	0	0	113.1	D220 R221 F222 W262 I301 L302 M303	D218-D220 PolarHBondContact O-N 3.2Å; D218-D220 PolarHBondContact OD1-N 3.1Å; D218-R221 PolarHBondContact O-N 3.16Å; D218-R221 WeakPolarHBondContact OD1-CA 3.12Å; D218-R221 WeakPolarHBondContact OD1-CB 3.37Å; D218-R221 PolarHBondContact OD1-N 2.89Å; D218-F222 WeakPolarHBondContact O-CB 3.3Å; D218-F222 PolarHBondContact O-N 2.78Å; D218-W262 HydrophobicContact CB-CE3 4.18Å; D218-I301 PolarHBondContact N-O 2.91Å; D218-I301 VanDerWaalsContact N-O 3.07Å; D218-L302 HydrophobicContact CB-CD2 4.05Å; D218-L302 WeakPolarHBondContact OD2-CA 2.94Å; D218-L302 WeakPolarHBondContact OD2-CD2 3.43Å; D218-M303 PolarHBondContact OD1-N 3.06Å; D218-M303 PolarHBondContact OD2-N 3.22Å
219	N	97.4	Very high	94	Very high	11 Å²	11	34.3 Å²	34.3	6%	0.059	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-28.7	-175.2	-175.1	-117.3	0	0	0	112.3	K223 W262 K264 N266	N219-K223 WeakPolarHBondContact O-CD 3.2Å; N219-K223 VanDerWaalsContact O-CG 3.26Å; N219-K223 WeakPolarHBondContact O-CG 3.45Å; N219-K223 PolarHBondContact O-N 3.3Å; N219-K223 WeakPolarHBondContact OD1-CE 3.5Å; N219-K223 PolarHBondContact OD1-NZ 2.93Å; N219-W262 WeakPolarHBondContact CA-O 3.45Å; N219-W262 VanDerWaalsContact CB-O 3.24Å; N219-W262 WeakPolarHBondContact CB-O 3.26Å; N219-W262 PolarHBondContact ND2-O 2.84Å; N219-K264 PolarHBondContact ND2-N 2.92Å; N219-K264 PolarHBondContact ND2-O 2.99Å; N219-K264 PolarHBondContact OD1-O 2.97Å; N219-N266 WeakPolarHBondContact CB-OD1 3.13Å; N219-N266 PolarHBondContact N-OD1 3.3Å
220	D	96.4	Very high	94.6	Very high	63 Å²	63	36.9 Å²	36.9	34%	0.337	19%	0.192	S	C	.	.	H	α-helix	trans	-82.4	-30.4	-177.6	-60.2	-59.5	0	0	0	112	D218 K223 H224 M303	D218-D220 PolarHBondContact O-N 3.2Å; D218-D220 PolarHBondContact OD1-N 3.1Å; D220-K223 PolarHBondContact O-N 3.46Å; D220-K223 WeakPolarHBondContact OD1-CD 3.4Å; D220-K223 IonicContact OD1-NZ 3.94Å; D220-K223 PolarHBondContact OD1-NZ 3.43Å; D220-H224 WeakPolarHBondContact O-CB 3.27Å; D220-H224 PolarHBondContact O-N 2.99Å; D220-M303 HydrophobicContact CB-CB 3.97Å
221	R	95.1	Very high	95.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.5	-39.3	166.3	-175.1	70	-162.4	167.9	12	110.8	V217 D218 H224 M225 M303 F330 N332 N333	V217-R221 HydrophobicContact CG1-CB 3.83Å; V217-R221 HydrophobicContact CG1-CG 3.7Å; D218-R221 PolarHBondContact O-N 3.16Å; D218-R221 WeakPolarHBondContact OD1-CA 3.12Å; D218-R221 WeakPolarHBondContact OD1-CB 3.37Å; D218-R221 PolarHBondContact OD1-N 2.89Å; R221-H224 PolarHBondContact O-N 3.48Å; R221-M225 WeakPolarHBondContact O-CG 3.37Å; R221-M225 PolarHBondContact O-N 2.76Å; R221-M303 HydrophobicContact CB-CB 4.01Å; R221-M303 VanDerWaalsContact N-CB 3.34Å; R221-F330 PolarHBondContact NH1-O 3.45Å; R221-F330 VanDerWaalsContact NH2-CE1 3.26Å; R221-N332 PolarHBondContact NH1-O 2.72Å; R221-N332 PolarHBondContact NH2-O 3.14Å; R221-N333 PolarHBondContact NH2-OD1 3.24Å
222	F	96.5	Very high	95.3	Very high	19 Å²	19	36.5 Å²	36.5	8%	0.083	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-45	171.7	173.8	-107.4	0	0	0	112	D218 M225 G227 E229 V232 I261 T263	D218-F222 WeakPolarHBondContact O-CB 3.3Å; D218-F222 PolarHBondContact O-N 2.78Å; F222-M225 CarbonylContact O-C 3.55Å; F222-M225 PolarHBondContact O-N 2.87Å; F222-G227 VanDerWaalsContact CE2-O 3.31Å; F222-G227 WeakPolarHBondContact CE2-O 3.15Å; F222-G227 VanDerWaalsContact CZ-C 3.43Å; F222-G227 WeakPolarHBondContact CZ-O 3.38Å; F222-G227 WeakPolarHBondContact O-CA 3.45Å; F222-G227 PolarHBondContact O-N 3.37Å; F222-E229 HydrophobicContact CE2-CB 4.5Å; F222-E229 HydrophobicContact CE2-CG 3.66Å; F222-E229 HydrophobicContact CZ-CG 4.1Å; F222-V232 HydrophobicContact CD2-CG2 4.16Å; F222-I261 HydrophobicContact CB-CG2 4.2Å; F222-I261 HydrophobicContact CD2-CG2 3.63Å; F222-I261 HydrophobicContact CE2-CG2 4.31Å; F222-I261 HydrophobicContact CG-CG2 4.11Å; F222-T263 HydrophobicContact CD1-CG2 4.43Å; F222-T263 HydrophobicContact CD2-CG2 4.04Å; F222-T263 HydrophobicContact CE1-CG2 4.05Å; F222-T263 WeakPolarHBondContact CE1-O 3.4Å; F222-T263 HydrophobicContact CE2-CG2 3.65Å; F222-T263 HydrophobicContact CG-CG2 4.41Å; F222-T263 HydrophobicContact CZ-CG2 3.63Å
223	K	95.9	Very high	95.4	Very high	116 Å²	116	39.2 Å²	39.2	50%	0.504	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-44.3	172.4	-74.6	156.3	174.7	152.8	0	112.4	N219 D220 M225 N226	N219-K223 WeakPolarHBondContact O-CD 3.2Å; N219-K223 VanDerWaalsContact O-CG 3.26Å; N219-K223 WeakPolarHBondContact O-CG 3.45Å; N219-K223 PolarHBondContact O-N 3.3Å; N219-K223 WeakPolarHBondContact OD1-CE 3.5Å; N219-K223 PolarHBondContact OD1-NZ 2.93Å; D220-K223 PolarHBondContact O-N 3.46Å; D220-K223 WeakPolarHBondContact OD1-CD 3.4Å; D220-K223 IonicContact OD1-NZ 3.94Å; D220-K223 PolarHBondContact OD1-NZ 3.43Å; K223-M225 PolarHBondContact O-N 3.05Å; K223-N226 WeakPolarHBondContact O-CA 3.45Å; K223-N226 PolarHBondContact O-N 3.14Å
224	H	92.9	Very high	95.1	Very high	91 Å²	91	43.2 Å²	43.2	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-58.8	-35.4	176	-178	75.1	0	0	0	112.1	D220 R221 N226 M303 N333	D220-H224 WeakPolarHBondContact O-CB 3.27Å; D220-H224 PolarHBondContact O-N 2.99Å; R221-H224 PolarHBondContact O-N 3.48Å; H224-N226 PolarHBondContact O-N 2.96Å; H224-N226 VanDerWaalsContact O-N 3.11Å; H224-M303 HydrophobicContact CB-CE 4.27Å; H224-M303 HydrophobicContact CB-CG 4.29Å; H224-M303 HydrophobicContact CB-SD 4.07Å; H224-M303 WeakPolarHBondContact ND1-CE 3.39Å; H224-N333 PolarHBondContact NE2-ND2 2.92Å; H224-N333 PolarHBondContact NE2-OD1 3.25Å
225	M	92.8	Very high	94.8	Very high	25 Å²	25	44.4 Å²	44.4	12%	0.123	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	28.2	171.2	-65	-70	-74.7	0	0	113.1	R221 F222 K223 G227 N228 A231 V232 Q235	R221-M225 WeakPolarHBondContact O-CG 3.37Å; R221-M225 PolarHBondContact O-N 2.76Å; F222-M225 CarbonylContact O-C 3.55Å; F222-M225 PolarHBondContact O-N 2.87Å; K223-M225 PolarHBondContact O-N 3.05Å; M225-G227 PolarHBondContact O-N 3.33Å; M225-G227 VanDerWaalsContact O-N 3.16Å; M225-N228 WeakPolarHBondContact O-CB 3.39Å; M225-N228 PolarHBondContact O-N 2.9Å; M225-N228 VanDerWaalsContact O-N 3.07Å; M225-A231 HydrophobicContact CE-CB 4Å; M225-A231 WeakPolarHBondContact CE-O 3.2Å; M225-V232 HydrophobicContact CB-CG2 3.57Å; M225-V232 HydrophobicContact CG-CG2 3.87Å; M225-Q235 HydrophobicContact CE-CB 4.08Å; M225-Q235 HydrophobicContact CE-CG 4.48Å
226	N	94.6	Very high	94.7	Very high	154 Å²	154	44.4 Å²	44.4	82%	0.824	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	26.3	-179.5	-59.6	-74.9	0	0	0	114.9	K223 H224 N228	K223-N226 WeakPolarHBondContact O-CA 3.45Å; K223-N226 PolarHBondContact O-N 3.14Å; H224-N226 PolarHBondContact O-N 2.96Å; H224-N226 VanDerWaalsContact O-N 3.11Å; N226-N228 PolarHBondContact O-N 2.76Å
227	G	94.3	Very high	94.5	Very high	35 Å²	35	45.2 Å²	45.2	36%	0.361	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	20.7	-175.9	0	0	0	0	0	114.2	F222 M225	F222-G227 VanDerWaalsContact CE2-O 3.31Å; F222-G227 WeakPolarHBondContact CE2-O 3.15Å; F222-G227 VanDerWaalsContact CZ-C 3.43Å; F222-G227 WeakPolarHBondContact CZ-O 3.38Å; F222-G227 WeakPolarHBondContact O-CA 3.45Å; F222-G227 PolarHBondContact O-N 3.37Å; M225-G227 PolarHBondContact O-N 3.33Å; M225-G227 VanDerWaalsContact O-N 3.16Å
228	N	95.4	Very high	94.2	Very high	78 Å²	78	45.6 Å²	45.6	42%	0.417	24%	0.237	S	C	.	.			trans	-94.1	100.7	-176.3	-176	-19.9	0	0	0	111.5	M225 N226 T230 A231 V232	M225-N228 WeakPolarHBondContact O-CB 3.39Å; M225-N228 PolarHBondContact O-N 2.9Å; M225-N228 VanDerWaalsContact O-N 3.07Å; N226-N228 PolarHBondContact O-N 2.76Å; N228-T230 PolarHBondContact O-N 3.49Å; N228-T230 WeakPolarHBondContact OD1-CB 3.19Å; N228-T230 PolarHBondContact OD1-N 3.29Å; N228-A231 HydrophobicContact CB-CB 3.89Å; N228-A231 PolarHBondContact O-N 2.77Å; N228-A231 PolarHBondContact OD1-N 3.19Å; N228-V232 PolarHBondContact O-N 3.38Å
229	E	93.5	Very high	94.1	Very high	80 Å²	80	45.5 Å²	45.5	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-55.6	-35.4	178.6	-62.7	-179	-179.2	0	0	113.1	T93 F222 R233 T263	T93-E229 HydrophobicContact CG2-CG 4.38Å; F222-E229 HydrophobicContact CE2-CB 4.5Å; F222-E229 HydrophobicContact CE2-CG 3.66Å; F222-E229 HydrophobicContact CZ-CG 4.1Å; E229-R233 VanDerWaalsContact O-CB 3.26Å; E229-R233 WeakPolarHBondContact O-CB 2.92Å; E229-R233 PolarHBondContact O-N 2.73Å; E229-T263 HydrophobicContact CG-CG2 3.96Å
230	T	91.1	Very high	94	Very high	57 Å²	57	45 Å²	45	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-72.9	-41.9	178.9	-68.7	0	0	0	0	111.6	N228 R233 E234	N228-T230 PolarHBondContact O-N 3.49Å; N228-T230 WeakPolarHBondContact OD1-CB 3.19Å; N228-T230 PolarHBondContact OD1-N 3.29Å; T230-R233 PolarHBondContact O-N 2.9Å; T230-R233 PolarHBondContact OG1-NH2 3.14Å; T230-R233 VanDerWaalsContact OG1-NH2 3.12Å; T230-E234 HydrophobicContact CG2-CG 4.45Å; T230-E234 WeakPolarHBondContact CG2-OE1 3.34Å; T230-E234 WeakPolarHBondContact O-CB 3.36Å; T230-E234 WeakPolarHBondContact O-CG 3.23Å; T230-E234 PolarHBondContact O-N 3.04Å
231	A	91.6	Very high	93.8	Very high	30 Å²	30	42 Å²	42	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-65.7	-38.7	176.9	0	0	0	0	0	112.2	M225 N228 Q235	M225-A231 HydrophobicContact CE-CB 4Å; M225-A231 WeakPolarHBondContact CE-O 3.2Å; N228-A231 HydrophobicContact CB-CB 3.89Å; N228-A231 PolarHBondContact O-N 2.77Å; N228-A231 PolarHBondContact OD1-N 3.19Å; A231-Q235 WeakPolarHBondContact O-CB 3.35Å; A231-Q235 PolarHBondContact O-N 3.25Å
232	V	95.1	Very high	93.7	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-50.5	171.1	172.3	0	0	0	0	110.5	V217 F222 M225 N228 E234 Q235 M236 I261	V217-V232 HydrophobicContact CB-CG1 4.2Å; V217-V232 HydrophobicContact CG1-CG1 3.95Å; V217-V232 HydrophobicContact CG2-CG1 3.93Å; F222-V232 HydrophobicContact CD2-CG2 4.16Å; M225-V232 HydrophobicContact CB-CG2 3.57Å; M225-V232 HydrophobicContact CG-CG2 3.87Å; N228-V232 PolarHBondContact O-N 3.38Å; V232-E234 PolarHBondContact O-N 3.29Å; V232-Q235 PolarHBondContact O-N 3.38Å; V232-M236 HydrophobicContact CG1-CG 4.21Å; V232-M236 WeakPolarHBondContact O-CG 3.17Å; V232-M236 PolarHBondContact O-N 3.21Å; V232-I261 HydrophobicContact CB-CD1 4.18Å; V232-I261 HydrophobicContact CG1-CD1 3.79Å; V232-I261 HydrophobicContact CG1-CG1 4.1Å; V232-I261 HydrophobicContact CG1-CG2 4.25Å
233	R	93.1	Very high	93.5	Very high	61 Å²	61	41.3 Å²	41.3	23%	0.23	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-46.6	179.7	-179.4	-179.1	66	-141.8	-7.1	112.4	E229 T230 M236 I237 L259	E229-R233 VanDerWaalsContact O-CB 3.26Å; E229-R233 WeakPolarHBondContact O-CB 2.92Å; E229-R233 PolarHBondContact O-N 2.73Å; T230-R233 PolarHBondContact O-N 2.9Å; T230-R233 PolarHBondContact OG1-NH2 3.14Å; T230-R233 VanDerWaalsContact OG1-NH2 3.12Å; R233-M236 PolarHBondContact O-N 3.38Å; R233-I237 HydrophobicContact CG-CD1 3.68Å; R233-I237 HydrophobicContact CG-CG1 4.43Å; R233-I237 WeakPolarHBondContact O-CB 3.45Å; R233-I237 VanDerWaalsContact O-CG1 3.22Å; R233-I237 WeakPolarHBondContact O-CG1 3.42Å; R233-I237 PolarHBondContact O-N 3.19Å; R233-L259 HydrophobicContact CB-CD2 3.95Å; R233-L259 HydrophobicContact CG-CD2 4.03Å
234	E	90.4	Very high	93.2	Very high	84 Å²	84	35.8 Å²	35.8	39%	0.393	19%	0.191	S	C	.	.	H	α-helix	trans	-66.5	-38.4	178.9	-73.2	174.8	-170.2	0	0	112.4	T230 V232 H238	T230-E234 HydrophobicContact CG2-CG 4.45Å; T230-E234 WeakPolarHBondContact CG2-OE1 3.34Å; T230-E234 WeakPolarHBondContact O-CB 3.36Å; T230-E234 WeakPolarHBondContact O-CG 3.23Å; T230-E234 PolarHBondContact O-N 3.04Å; V232-E234 PolarHBondContact O-N 3.29Å; E234-H238 WeakPolarHBondContact O-CB 3.49Å; E234-H238 PolarHBondContact O-N 2.79Å
235	Q	92.3	Very high	92.9	Very high	25 Å²	25	32.2 Å²	32.2	12%	0.117	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-41.1	175.1	-168.8	177.9	68	0	0	112	M225 A231 V232 H238 L239 F330 N333 V335	M225-Q235 HydrophobicContact CE-CB 4.08Å; M225-Q235 HydrophobicContact CE-CG 4.48Å; A231-Q235 WeakPolarHBondContact O-CB 3.35Å; A231-Q235 PolarHBondContact O-N 3.25Å; V232-Q235 PolarHBondContact O-N 3.38Å; Q235-H238 PolarHBondContact O-N 2.63Å; Q235-L239 WeakPolarHBondContact O-CB 3.37Å; Q235-L239 PolarHBondContact O-N 3.12Å; Q235-F330 HydrophobicContact CG-CE1 4.5Å; Q235-N333 PolarHBondContact NE2-OD1 3.07Å; Q235-V335 HydrophobicContact CG-CG2 3.76Å
236	M	96.1	Very high	92.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-73.3	-36.9	179.4	-66.4	-54.8	106.8	0	0	112.8	L215 V217 V232 R233 H238 L239 A240 L259 I301 F330	L215-M236 HydrophobicContact CD1-CB 3.9Å; L215-M236 HydrophobicContact CD1-CG 4.46Å; L215-M236 HydrophobicContact CD1-SD 4.2Å; V217-M236 HydrophobicContact CG2-CG 3.75Å; V217-M236 HydrophobicContact CG2-SD 3.84Å; V232-M236 HydrophobicContact CG1-CG 4.21Å; V232-M236 WeakPolarHBondContact O-CG 3.17Å; V232-M236 PolarHBondContact O-N 3.21Å; R233-M236 PolarHBondContact O-N 3.38Å; M236-H238 VanDerWaalsContact C-N 3.33Å; M236-L239 HydrophobicContact CE-CD2 4.21Å; M236-L239 WeakPolarHBondContact O-CB 3.38Å; M236-L239 PolarHBondContact O-N 2.79Å; M236-L239 HydrophobicContact SD-CD2 3.88Å; M236-A240 PolarHBondContact O-N 2.85Å; M236-L259 HydrophobicContact CB-CD1 4.05Å; M236-L259 HydrophobicContact CB-CD2 4.28Å; M236-L259 HydrophobicContact CG-CD1 3.89Å; M236-I301 HydrophobicContact SD-CG1 4.1Å; M236-I301 HydrophobicContact SD-CG2 4.42Å; M236-F330 HydrophobicContact CE-CD1 4.42Å; M236-F330 HydrophobicContact CE-CE1 4.2Å
237	I	93.8	Very high	92.4	Very high	18 Å²	18	24 Å²	24	9%	0.092	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-41	171.4	-72.4	169.1	0	0	0	110.7	L84 L85 F89 Q112 R233 A240 N241 L256	L84-I237 HydrophobicContact CD2-CG2 4.35Å; L85-I237 HydrophobicContact CD1-CD1 3.95Å; L85-I237 HydrophobicContact CD1-CG1 4.2Å; L85-I237 HydrophobicContact CD1-CG2 3.98Å; L85-I237 HydrophobicContact CD2-CG1 4.09Å; L85-I237 HydrophobicContact CD2-CG2 4.44Å; F89-I237 HydrophobicContact CE1-CD1 4.07Å; F89-I237 HydrophobicContact CE1-CG1 4.49Å; F89-I237 HydrophobicContact CZ-CD1 4.38Å; F89-I237 HydrophobicContact CZ-CG1 4.35Å; Q112-I237 HydrophobicContact CG-CG2 3.61Å; R233-I237 HydrophobicContact CG-CD1 3.68Å; R233-I237 HydrophobicContact CG-CG1 4.43Å; R233-I237 WeakPolarHBondContact O-CB 3.45Å; R233-I237 VanDerWaalsContact O-CG1 3.22Å; R233-I237 WeakPolarHBondContact O-CG1 3.42Å; R233-I237 PolarHBondContact O-N 3.19Å; I237-A240 PolarHBondContact O-N 2.99Å; I237-N241 PolarHBondContact O-N 3Å; I237-L256 HydrophobicContact CG1-CD2 3.97Å
238	H	92.7	Very high	91.8	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-67	-43.8	176	-176.1	51.4	0	0	0	112.1	Q112 R134 E234 Q235 M236 A240 N241 L242	Q112-H238 PolarHBondContact OE1-ND1 2.74Å; R134-H238 PolarHBondContact O-CE1 3.37Å; E234-H238 WeakPolarHBondContact O-CB 3.49Å; E234-H238 PolarHBondContact O-N 2.79Å; Q235-H238 PolarHBondContact O-N 2.63Å; M236-H238 VanDerWaalsContact C-N 3.33Å; H238-A240 VanDerWaalsContact C-N 3.32Å; H238-A240 PolarHBondContact O-N 3.22Å; H238-N241 WeakPolarHBondContact O-CB 3.01Å; H238-N241 PolarHBondContact O-N 3.24Å; H238-N241 VanDerWaalsContact O-N 3.13Å; H238-L242 WeakPolarHBondContact O-CG 3.01Å; H238-L242 PolarHBondContact O-N 2.9Å
239	L	95.1	Very high	91.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53.5	-47.6	173.4	174.7	60.5	0	0	0	111.8	L215 Q235 M236 N241 L242 I243 V335 F338 A339 V342	L215-L239 HydrophobicContact CD1-CD2 4.29Å; Q235-L239 WeakPolarHBondContact O-CB 3.37Å; Q235-L239 PolarHBondContact O-N 3.12Å; M236-L239 HydrophobicContact CE-CD2 4.21Å; M236-L239 WeakPolarHBondContact O-CB 3.38Å; M236-L239 PolarHBondContact O-N 2.79Å; M236-L239 HydrophobicContact SD-CD2 3.88Å; L239-N241 VanDerWaalsContact C-N 3.34Å; L239-N241 PolarHBondContact O-N 3.43Å; L239-L242 PolarHBondContact O-N 3.24Å; L239-I243 HydrophobicContact CD1-CD1 3.93Å; L239-I243 HydrophobicContact CD1-CG1 4.32Å; L239-I243 HydrophobicContact CG-CD1 3.82Å; L239-I243 WeakPolarHBondContact O-CG1 3.28Å; L239-I243 PolarHBondContact O-N 2.94Å; L239-V335 HydrophobicContact CB-CG1 3.76Å; L239-V335 HydrophobicContact CD1-CG1 4.01Å; L239-V335 HydrophobicContact CG-CG1 4.46Å; L239-F338 HydrophobicContact CD1-CD1 3.85Å; L239-F338 HydrophobicContact CD1-CE1 4.41Å; L239-F338 HydrophobicContact CD2-CD1 3.81Å; L239-F338 HydrophobicContact CD2-CE1 3.66Å; L239-F338 HydrophobicContact CG-CD1 4.5Å; L239-A339 HydrophobicContact CD1-CB 3.91Å; L239-V342 HydrophobicContact CD1-CG2 4.4Å; L239-V342 HydrophobicContact CD2-CG2 4.36Å
240	A	95.4	Very high	90.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-38.9	177	0	0	0	0	0	113	L84 M236 I237 H238 L242 I243 D244 L256	L84-A240 HydrophobicContact CD1-CB 3.89Å; M236-A240 PolarHBondContact O-N 2.85Å; I237-A240 PolarHBondContact O-N 2.99Å; H238-A240 VanDerWaalsContact C-N 3.32Å; H238-A240 PolarHBondContact O-N 3.22Å; A240-L242 VanDerWaalsContact C-N 3.29Å; A240-L242 PolarHBondContact O-N 3.39Å; A240-I243 PolarHBondContact O-N 3.32Å; A240-D244 WeakPolarHBondContact O-CB 3.41Å; A240-D244 PolarHBondContact O-N 3.49Å; A240-L256 HydrophobicContact CB-CB 3.87Å; A240-L256 HydrophobicContact CB-CD1 4.49Å; A240-L256 HydrophobicContact CB-CD2 4.04Å; A240-L256 HydrophobicContact CB-CG 4.36Å
241	N	93.1	Very high	90	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-33.7	177	-167	54.3	0	0	0	113	N81 L84 Q112 Y113 I237 H238 L239 G245	N81-N241 PolarHBondContact ND2-OD1 2.87Å; L84-N241 HydrophobicContact CD1-CB 4.33Å; L84-N241 HydrophobicContact CD2-CB 3.67Å; Q112-N241 HydrophobicContact CB-CB 4.04Å; Q112-N241 HydrophobicContact CG-CB 4.15Å; Y113-N241 PolarHBondContact O-ND2 2.91Å; I237-N241 PolarHBondContact O-N 3Å; H238-N241 WeakPolarHBondContact O-CB 3.01Å; H238-N241 PolarHBondContact O-N 3.24Å; H238-N241 VanDerWaalsContact O-N 3.13Å; L239-N241 VanDerWaalsContact C-N 3.34Å; L239-N241 PolarHBondContact O-N 3.43Å; N241-G245 PolarHBondContact O-N 2.94Å; N241-G245 VanDerWaalsContact O-N 3.16Å
242	L	91.3	Very high	89.7	Confident	5 Å²	5	22.1 Å²	22.1	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-73	-40	175.3	-59.3	-178	0	0	0	111.6	A126 V136 H238 L239 A240 G245 I246 V335 A339	A126-L242 HydrophobicContact CB-CD2 3.9Å; V136-L242 HydrophobicContact CG1-CD2 4.32Å; V136-L242 HydrophobicContact CG2-CD2 3.81Å; H238-L242 WeakPolarHBondContact O-CG 3.01Å; H238-L242 PolarHBondContact O-N 2.9Å; L239-L242 PolarHBondContact O-N 3.24Å; A240-L242 VanDerWaalsContact C-N 3.29Å; A240-L242 PolarHBondContact O-N 3.39Å; L242-G245 PolarHBondContact O-N 2.97Å; L242-I246 WeakPolarHBondContact O-CG1 3.45Å; L242-I246 PolarHBondContact O-N 2.75Å; L242-I246 VanDerWaalsContact O-N 3.1Å; L242-V335 HydrophobicContact CD1-CG1 4.15Å; L242-A339 HydrophobicContact CB-CB 3.73Å; L242-A339 HydrophobicContact CD1-CB 4.17Å
243	I	94.1	Very high	89.2	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.2	-44.5	176.3	-63.6	161.3	0	0	0	110.5	L239 A240 G245 I246 Y247 V254 A339 V342 L346	L239-I243 HydrophobicContact CD1-CD1 3.93Å; L239-I243 HydrophobicContact CD1-CG1 4.32Å; L239-I243 HydrophobicContact CG-CD1 3.82Å; L239-I243 WeakPolarHBondContact O-CG1 3.28Å; L239-I243 PolarHBondContact O-N 2.94Å; A240-I243 PolarHBondContact O-N 3.32Å; I243-G245 PolarHBondContact O-N 2.94Å; I243-I246 WeakPolarHBondContact O-CB 3.31Å; I243-I246 PolarHBondContact O-N 3.07Å; I243-Y247 HydrophobicContact CG2-CD2 3.81Å; I243-Y247 HydrophobicContact CG2-CE2 4.05Å; I243-Y247 WeakPolarHBondContact O-CD2 3.45Å; I243-Y247 PolarHBondContact O-N 3.02Å; I243-V254 HydrophobicContact CG2-CB 4.37Å; I243-V254 HydrophobicContact CG2-CG1 4.1Å; I243-V254 HydrophobicContact CG2-CG2 4.16Å; I243-A339 HydrophobicContact CG1-CB 4.36Å; I243-V342 HydrophobicContact CD1-CB 3.71Å; I243-V342 HydrophobicContact CD1-CG1 3.56Å; I243-V342 HydrophobicContact CD1-CG2 4.48Å; I243-V342 HydrophobicContact CG1-CB 4.39Å; I243-L346 HydrophobicContact CG2-CD2 4.29Å
244	D	89.9	Confident	89.1	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-44.5	175.1	-179.4	43.9	0	0	0	112	N81 Q114 A240 I246 Y247 M248 R253 V254	N81-D244 PolarHBondContact ND2-OD2 3.34Å; Q114-D244 PolarHBondContact NE2-OD2 2.01Å; Q114-D244 PolarHBondContact OE1-OD2 3.42Å; A240-D244 WeakPolarHBondContact O-CB 3.41Å; A240-D244 PolarHBondContact O-N 3.49Å; D244-I246 VanDerWaalsContact C-N 3.27Å; D244-I246 PolarHBondContact O-N 3.37Å; D244-Y247 PolarHBondContact O-N 2.97Å; D244-Y247 VanDerWaalsContact O-N 3.09Å; D244-M248 WeakPolarHBondContact O-CG 3.22Å; D244-M248 PolarHBondContact O-N 3.28Å; D244-R253 VanDerWaalsContact OD1-CA 3.27Å; D244-R253 WeakPolarHBondContact OD1-CA 3.43Å; D244-R253 IonicContact OD1-CZ 3.56Å; D244-R253 IonicContact OD1-NE 3.91Å; D244-R253 PolarHBondContact OD1-NE 2.88Å; D244-R253 IonicContact OD1-NH2 3.34Å; D244-R253 IonicContact OD2-CZ 3.25Å; D244-R253 IonicContact OD2-NE 2.88Å; D244-R253 PolarHBondContact OD2-NE 3Å; D244-R253 IonicContact OD2-NH2 3.61Å; D244-R253 PolarHBondContact OD2-NH2 3.09Å; D244-V254 HydrophobicContact CB-CB 4.04Å; D244-V254 PolarHBondContact OD1-N 2.93Å
245	G	85.8	Confident	89.1	Confident	16 Å²	16	17 Å²	17	17%	0.165	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-29.7	176.2	0	0	0	0	0	114.4	N241 L242 I243	N241-G245 PolarHBondContact O-N 2.94Å; N241-G245 VanDerWaalsContact O-N 3.16Å; L242-G245 PolarHBondContact O-N 2.97Å; I243-G245 PolarHBondContact O-N 2.94Å
246	I	87.4	Confident	89.2	Confident	5 Å²	5	15.9 Å²	15.9	3%	0.026	8%	0.08	C	C	.	.	H	α-helix	trans	-68.3	-48.6	170	-75.3	164.1	0	0	0	110.6	L242 I243 D244 M248 Q249 A339 A343 I368 K377 F379	L242-I246 WeakPolarHBondContact O-CG1 3.45Å; L242-I246 PolarHBondContact O-N 2.75Å; L242-I246 VanDerWaalsContact O-N 3.1Å; I243-I246 WeakPolarHBondContact O-CB 3.31Å; I243-I246 PolarHBondContact O-N 3.07Å; D244-I246 VanDerWaalsContact C-N 3.27Å; D244-I246 PolarHBondContact O-N 3.37Å; I246-M248 VanDerWaalsContact C-N 3.33Å; I246-M248 PolarHBondContact O-N 3.23Å; I246-Q249 PolarHBondContact O-N 3.49Å; I246-A339 HydrophobicContact CD1-CB 4.35Å; I246-A343 HydrophobicContact CD1-CB 4.01Å; I246-A343 HydrophobicContact CG2-CB 3.95Å; I246-I368 HydrophobicContact CG2-CD1 3.32Å; I246-K377 HydrophobicContact CD1-CD 3.79Å; I246-K377 HydrophobicContact CG1-CB 4.39Å; I246-K377 HydrophobicContact CG1-CD 4.07Å; I246-F379 HydrophobicContact CG2-CD2 4.39Å; I246-F379 HydrophobicContact CG2-CE2 3.61Å; I246-F379 HydrophobicContact CG2-CZ 4.13Å
247	Y	89.6	Confident	88.9	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-71.9	-21.4	-172.9	-92.5	-76.5	0	0	0	114.9	I243 D244 Q249 L250 V252 V254 A343 L346 G347 L350 M352 F379	I243-Y247 HydrophobicContact CG2-CD2 3.81Å; I243-Y247 HydrophobicContact CG2-CE2 4.05Å; I243-Y247 WeakPolarHBondContact O-CD2 3.45Å; I243-Y247 PolarHBondContact O-N 3.02Å; D244-Y247 PolarHBondContact O-N 2.97Å; D244-Y247 VanDerWaalsContact O-N 3.09Å; Y247-Q249 PolarHBondContact O-N 3.38Å; Y247-L250 PolarHBondContact O-N 2.99Å; Y247-V252 CarbonylContact C-O 3.45Å; Y247-V252 HydrophobicContact CD1-CB 3.88Å; Y247-V252 HydrophobicContact CD1-CG1 3.88Å; Y247-V252 HydrophobicContact CD1-CG2 4.37Å; Y247-V252 HydrophobicContact CG-CB 4.39Å; Y247-V252 HydrophobicContact CG-CG1 4.27Å; Y247-V252 PolarHBondContact O-N 3.36Å; Y247-V252 VanDerWaalsContact O-O 3.13Å; Y247-V254 HydrophobicContact CD2-CG2 3.75Å; Y247-V254 HydrophobicContact CG-CG2 3.83Å; Y247-A343 HydrophobicContact CE2-CB 3.98Å; Y247-A343 PolarHBondContact OH-O 3.38Å; Y247-L346 HydrophobicContact CD2-CD2 4.45Å; Y247-L346 HydrophobicContact CE2-CB 4.39Å; Y247-L346 HydrophobicContact CE2-CD2 3.91Å; Y247-L346 HydrophobicContact CE2-CG 4.31Å; Y247-G347 WeakPolarHBondContact OH-CA 3.24Å; Y247-G347 PolarHBondContact OH-N 3.45Å; Y247-L350 HydrophobicContact CD1-CD1 4.09Å; Y247-L350 HydrophobicContact CE1-CD1 3.28Å; Y247-M352 HydrophobicContact CE1-CE 3.89Å; Y247-F379 HydrophobicContact CD1-CE2 4.07Å; Y247-F379 HydrophobicContact CD1-CZ 4.32Å; Y247-F379 AromaticContact CE1-CE2 3.93Å; Y247-F379 HydrophobicContact CE1-CE2 3.93Å; Y247-F379 AromaticContact CE1-CZ 3.72Å; Y247-F379 HydrophobicContact CE1-CZ 3.72Å; Y247-F379 HydrophobicContact CE2-CE2 4.47Å; Y247-F379 HydrophobicContact CE2-CZ 4.13Å; Y247-F379 HydrophobicContact CG-CE2 4.41Å; Y247-F379 AromaticContact CZ-CZ 3.59Å
248	M	82.1	Confident	88.9	Confident	93 Å²	93	15.2 Å²	15.2	46%	0.458	8%	0.077	S	C	.	.	G	3₁₀ helix	trans	-52.7	-29.4	173.7	-76.6	176	69.5	0	0	113.6	Q114 D244 I246 L250 N251 V252	Q114-M248 PolarHBondContact OE1-SD 3.01Å; D244-M248 WeakPolarHBondContact O-CG 3.22Å; D244-M248 PolarHBondContact O-N 3.28Å; I246-M248 VanDerWaalsContact C-N 3.33Å; I246-M248 PolarHBondContact O-N 3.23Å; M248-L250 PolarHBondContact O-N 3.41Å; M248-N251 PolarHBondContact O-N 3.46Å; M248-V252 WeakPolarHBondContact CA-O 3.3Å; M248-V252 PolarHBondContact N-O 2.96Å
249	Q	80.2	Confident	89.2	Confident	90 Å²	90	14.8 Å²	14.8	42%	0.421	8%	0.075	S	C	.	.	G	3₁₀ helix	trans	-62.1	-27.3	177	-62.8	177.4	26	0	0	113.6	I246 Y247 K377 N378	I246-Q249 PolarHBondContact O-N 3.49Å; Y247-Q249 PolarHBondContact O-N 3.38Å; Q249-K377 PolarHBondContact NE2-O 2.86Å; Q249-N378 PolarHBondContact NE2-OD1 2.76Å
250	L	83.6	Confident	89.3	Confident	10 Å²	10	14.8 Å²	14.8	5%	0.052	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-98.4	12.8	176.7	-61.1	-178.8	0	0	0	112.3	L205 Y247 M248 V252 M352 F379 A384	L205-L250 WeakPolarHBondContact CD2-O 3.36Å; Y247-L250 PolarHBondContact O-N 2.99Å; M248-L250 PolarHBondContact O-N 3.41Å; L250-V252 HydrophobicContact CB-CG2 4.07Å; L250-V252 PolarHBondContact O-N 2.93Å; L250-M352 HydrophobicContact CD1-CE 3.33Å; L250-M352 HydrophobicContact CD1-SD 4.14Å; L250-F379 HydrophobicContact CD1-CB 4.2Å; L250-F379 HydrophobicContact CD1-CD1 4.18Å; L250-F379 HydrophobicContact CD1-CD2 3.53Å; L250-F379 HydrophobicContact CD1-CE1 4.46Å; L250-F379 HydrophobicContact CD1-CE2 3.84Å; L250-F379 HydrophobicContact CD1-CG 3.71Å; L250-F379 HydrophobicContact CD1-CZ 4.3Å; L250-F379 HydrophobicContact CD2-CB 4.03Å; L250-F379 HydrophobicContact CD2-CD2 4.47Å; L250-F379 HydrophobicContact CD2-CG 4.42Å; L250-F379 HydrophobicContact CG-CB 4.21Å; L250-F379 HydrophobicContact CG-CD2 3.72Å; L250-F379 HydrophobicContact CG-CE2 4.34Å; L250-F379 HydrophobicContact CG-CG 4.08Å; L250-A384 HydrophobicContact CD2-CB 3.63Å
251	N	77.6	Confident	89.4	Confident	48 Å²	48	14.8 Å²	14.8	26%	0.257	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	35.3	-170.4	-160	11.5	0	0	0	112.4	L205 K207 T208 H209 M248	L205-N251 PolarHBondContact O-ND2 2.81Å; K207-N251 VanDerWaalsContact C-ND2 3.27Å; K207-N251 PolarHBondContact O-ND2 3.22Å; T208-N251 VanDerWaalsContact CA-O 3.3Å; T208-N251 WeakPolarHBondContact CA-O 3.46Å; T208-N251 WeakPolarHBondContact CA-OD1 3.32Å; T208-N251 WeakPolarHBondContact CB-OD1 3.48Å; T208-N251 PolarHBondContact N-ND2 3.05Å; T208-N251 PolarHBondContact OG1-OD1 2.89Å; H209-N251 PolarHBondContact N-O 3.24Å; M248-N251 PolarHBondContact O-N 3.46Å
252	V	86.3	Confident	89.6	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.2	173.5	179.1	0	0	0	0	108.3	H209 V211 Y247 M248 L250 F387	H209-V252 HydrophobicContact CB-CG2 4.34Å; H209-V252 CarbonylContact O-C 3.59Å; H209-V252 WeakPolarHBondContact O-CA 3.49Å; V211-V252 HydrophobicContact CG2-CG1 3.72Å; Y247-V252 CarbonylContact C-O 3.45Å; Y247-V252 HydrophobicContact CD1-CB 3.88Å; Y247-V252 HydrophobicContact CD1-CG1 3.88Å; Y247-V252 HydrophobicContact CD1-CG2 4.37Å; Y247-V252 HydrophobicContact CG-CB 4.39Å; Y247-V252 HydrophobicContact CG-CG1 4.27Å; Y247-V252 PolarHBondContact O-N 3.36Å; Y247-V252 VanDerWaalsContact O-O 3.13Å; M248-V252 WeakPolarHBondContact CA-O 3.3Å; M248-V252 PolarHBondContact N-O 2.96Å; L250-V252 HydrophobicContact CB-CG2 4.07Å; L250-V252 PolarHBondContact O-N 2.93Å; V252-F387 HydrophobicContact CG2-CE1 3.63Å; V252-F387 HydrophobicContact CG2-CE2 4.36Å; V252-F387 HydrophobicContact CG2-CZ 3.55Å
253	R	83.3	Confident	89.9	Confident	39 Å²	39	14.9 Å²	14.9	15%	0.147	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.7	171.7	-62.4	-55.8	-53.4	-83	-2.5	109.7	N81 T208 H209 Y210 V211 D244	N81-R253 PolarHBondContact OD1-NH2 3.15Å; T208-R253 HydrophobicContact CG2-CG 3.7Å; H209-R253 PolarHBondContact O-N 3.42Å; Y210-R253 CarbonylContact C-O 3.53Å; Y210-R253 VanDerWaalsContact CA-O 3.31Å; Y210-R253 WeakPolarHBondContact CA-O 3.21Å; Y210-R253 HydrophobicContact CD1-CB 3.65Å; Y210-R253 HydrophobicContact CD1-CG 4.26Å; Y210-R253 HydrophobicContact CE1-CB 3.75Å; Y210-R253 HydrophobicContact CE1-CG 3.85Å; Y210-R253 HydrophobicContact CG-CB 4.44Å; V211-R253 PolarHBondContact N-O 2.75Å; D244-R253 VanDerWaalsContact OD1-CA 3.27Å; D244-R253 WeakPolarHBondContact OD1-CA 3.43Å; D244-R253 IonicContact OD1-CZ 3.56Å; D244-R253 IonicContact OD1-NE 3.91Å; D244-R253 PolarHBondContact OD1-NE 2.88Å; D244-R253 IonicContact OD1-NH2 3.34Å; D244-R253 IonicContact OD2-CZ 3.25Å; D244-R253 IonicContact OD2-NE 2.88Å; D244-R253 PolarHBondContact OD2-NE 3Å; D244-R253 IonicContact OD2-NH2 3.61Å; D244-R253 PolarHBondContact OD2-NH2 3.09Å
254	V	91.4	Very high	89.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.1	179.7	179.8	0	0	0	0	109.1	V211 L213 I243 D244 Y247 L346	V211-V254 HydrophobicContact CB-CG2 4.33Å; L213-V254 HydrophobicContact CB-CG1 3.81Å; L213-V254 HydrophobicContact CD2-CG1 3.55Å; L213-V254 HydrophobicContact CG-CG1 4.32Å; I243-V254 HydrophobicContact CG2-CB 4.37Å; I243-V254 HydrophobicContact CG2-CG1 4.1Å; I243-V254 HydrophobicContact CG2-CG2 4.16Å; D244-V254 HydrophobicContact CB-CB 4.04Å; D244-V254 PolarHBondContact OD1-N 2.93Å; Y247-V254 HydrophobicContact CD2-CG2 3.75Å; Y247-V254 HydrophobicContact CG-CG2 3.83Å; V254-L346 HydrophobicContact CG1-CD2 4.45Å; V254-L346 HydrophobicContact CG2-CD2 4.2Å
255	V	90.1	Very high	90.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.6	-174	-179.8	0	0	0	0	109.1	V83 P86 V211 L213 V257 P403	V83-V255 HydrophobicContact CG1-CG2 3.78Å; V83-V255 VanDerWaalsContact O-CG1 3.28Å; V83-V255 WeakPolarHBondContact O-CG1 3.46Å; V83-V255 VanDerWaalsContact O-CG2 3.3Å; V83-V255 WeakPolarHBondContact O-CG2 3.46Å; P86-V255 HydrophobicContact CG-CG1 4.36Å; V211-V255 PolarHBondContact O-N 2.68Å; L213-V255 PolarHBondContact N-O 3.48Å; V255-V257 HydrophobicContact CG1-CG1 4.2Å; V255-V257 PolarHBondContact O-N 3.44Å; V255-P403 HydrophobicContact CB-CG 3.59Å; V255-P403 HydrophobicContact CG1-CB 4.34Å; V255-P403 HydrophobicContact CG1-CG 3.59Å; V255-P403 HydrophobicContact CG2-CG 3.6Å
256	L	93.9	Very high	90.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	89.3	-179.5	-177.8	67.5	0	0	0	109.1	L84 L85 P86 F89 L213 L215 I237 A240 G258	L84-L256 PolarHBondContact O-N 2.82Å; L85-L256 HydrophobicContact CD2-CB 3.92Å; L85-L256 HydrophobicContact CD2-CD2 4Å; L85-L256 HydrophobicContact CD2-CG 4.32Å; P86-L256 WeakPolarHBondContact CD-O 3.33Å; F89-L256 HydrophobicContact CD2-CG 4.42Å; F89-L256 WeakPolarHBondContact CD2-O 3.49Å; F89-L256 HydrophobicContact CE2-CD2 3.91Å; F89-L256 HydrophobicContact CE2-CG 3.82Å; F89-L256 HydrophobicContact CZ-CD2 4.17Å; L213-L256 CarbonylContact O-C 3.32Å; L213-L256 WeakPolarHBondContact O-CA 3.31Å; L215-L256 HydrophobicContact CB-CD1 4Å; L215-L256 HydrophobicContact CD1-CD1 3.73Å; L215-L256 HydrophobicContact CD1-CD2 4.48Å; L215-L256 HydrophobicContact CG-CD1 3.55Å; I237-L256 HydrophobicContact CG1-CD2 3.97Å; A240-L256 HydrophobicContact CB-CB 3.87Å; A240-L256 HydrophobicContact CB-CD1 4.49Å; A240-L256 HydrophobicContact CB-CD2 4.04Å; A240-L256 HydrophobicContact CB-CG 4.36Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 VanDerWaalsContact CD1-O 3.31Å; L256-G258 WeakPolarHBondContact CD1-O 3.37Å; L256-G258 PolarHBondContact O-N 2.87Å
257	V	91.4	Very high	90.9	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.024	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-18.5	-178.5	-61.7	0	0	0	0	113	P86 E212 L213 V255 R293 H295 P403	P86-V257 HydrophobicContact CG-CG1 4.36Å; E212-V257 HydrophobicContact CB-CG1 3.84Å; E212-V257 HydrophobicContact CB-CG2 4.03Å; E212-V257 HydrophobicContact CG-CG1 4.01Å; L213-V257 WeakPolarHBondContact O-CG2 3.44Å; L213-V257 PolarHBondContact O-N 3.42Å; V255-V257 HydrophobicContact CG1-CG1 4.2Å; V255-V257 PolarHBondContact O-N 3.44Å; V257-R293 VanDerWaalsContact O-CZ 3.24Å; V257-R293 PolarHBondContact O-NE 3.46Å; V257-R293 PolarHBondContact O-NH2 3.45Å; V257-H295 HydrophobicContact CG2-CB 3.75Å; V257-P403 HydrophobicContact CG1-CB 4.18Å
258	G	93.8	Very high	91.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	166.2	175.7	0	0	0	0	0	115.1	T90 L214 L215 L256	T90-G258 CarbonylContact O-C 3.58Å; T90-G258 WeakPolarHBondContact O-CA 3.31Å; L214-G258 WeakPolarHBondContact CA-O 3.1Å; L215-G258 PolarHBondContact N-O 3.31Å; L215-G258 VanDerWaalsContact N-O 3.14Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 VanDerWaalsContact CD1-O 3.31Å; L256-G258 WeakPolarHBondContact CD1-O 3.37Å; L256-G258 PolarHBondContact O-N 2.87Å
259	L	97.6	Very high	91.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	118.3	179	171.8	62.8	0	0	0	109.8	F89 T90 V91 F92 L215 V217 R233 M236 I261	F89-L259 HydrophobicContact CE2-CB 4.05Å; F89-L259 HydrophobicContact CZ-CB 3.97Å; T90-L259 PolarHBondContact O-N 3.02Å; V91-L259 CarbonylContact C-O 3.57Å; V91-L259 VanDerWaalsContact CA-O 3.29Å; V91-L259 WeakPolarHBondContact CA-O 3.27Å; V91-L259 HydrophobicContact CG1-CD2 4.31Å; V91-L259 HydrophobicContact CG1-CG 4.4Å; V91-L259 HydrophobicContact CG2-CB 4.35Å; F92-L259 PolarHBondContact N-O 2.9Å; L215-L259 HydrophobicContact CB-CD1 4.08Å; L215-L259 CarbonylContact O-C 3.49Å; L215-L259 VanDerWaalsContact O-CA 3.29Å; L215-L259 WeakPolarHBondContact O-CA 3.35Å; L215-L259 WeakPolarHBondContact O-CD1 3.37Å; V217-L259 HydrophobicContact CG2-CD1 3.88Å; R233-L259 HydrophobicContact CB-CD2 3.95Å; R233-L259 HydrophobicContact CG-CD2 4.03Å; M236-L259 HydrophobicContact CB-CD1 4.05Å; M236-L259 HydrophobicContact CB-CD2 4.28Å; M236-L259 HydrophobicContact CG-CD1 3.89Å; L259-I261 HydrophobicContact CD1-CG1 4.17Å; L259-I261 HydrophobicContact CD2-CD1 4.01Å; L259-I261 HydrophobicContact CD2-CG1 4.14Å; L259-I261 HydrophobicContact CG-CD1 4.28Å; L259-I261 HydrophobicContact CG-CG1 3.85Å
260	D	97.8	Very high	91.9	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.9	173.9	-169.1	-15.1	0	0	0	109.6	F92 Y94 L214 L215 V216 V217 W284 L289 R292	F92-D260 HydrophobicContact CB-CB 4.22Å; F92-D260 HydrophobicContact CD2-CB 4.24Å; Y94-D260 WeakPolarHBondContact CE2-OD1 3.34Å; Y94-D260 PolarHBondContact OH-OD1 2.8Å; Y94-D260 PolarHBondContact OH-OD2 2.9Å; Y94-D260 VanDerWaalsContact OH-OD2 3.06Å; L214-D260 HydrophobicContact CD2-CB 4.47Å; L215-D260 PolarHBondContact O-N 3.09Å; V216-D260 CarbonylContact C-O 3.58Å; V216-D260 WeakPolarHBondContact CA-O 2.96Å; V216-D260 HydrophobicContact CG1-CB 4.25Å; V216-D260 HydrophobicContact CG2-CB 4.27Å; V217-D260 PolarHBondContact N-O 2.82Å; D260-W284 WeakPolarHBondContact OD2-CH2 3.39Å; D260-L289 HydrophobicContact CB-CD1 4.43Å; D260-R292 IonicContact OD2-NH1 3.73Å
261	I	98.1	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116	-179.6	-46.9	175.6	0	0	0	108.1	V91 F92 T93 Y94 V217 F222 V232 L259 T263	V91-I261 HydrophobicContact CG1-CD1 4.26Å; F92-I261 PolarHBondContact O-N 2.93Å; T93-I261 HydrophobicContact CG2-CB 4.36Å; T93-I261 HydrophobicContact CG2-CD1 4.4Å; Y94-I261 VanDerWaalsContact CD2-O 3.27Å; Y94-I261 WeakPolarHBondContact CD2-O 3.49Å; Y94-I261 WeakPolarHBondContact CE2-O 3.5Å; V217-I261 HydrophobicContact CB-CG2 4.44Å; F222-I261 HydrophobicContact CB-CG2 4.2Å; F222-I261 HydrophobicContact CD2-CG2 3.63Å; F222-I261 HydrophobicContact CE2-CG2 4.31Å; F222-I261 HydrophobicContact CG-CG2 4.11Å; V232-I261 HydrophobicContact CB-CD1 4.18Å; V232-I261 HydrophobicContact CG1-CD1 3.79Å; V232-I261 HydrophobicContact CG1-CG1 4.1Å; V232-I261 HydrophobicContact CG1-CG2 4.25Å; L259-I261 HydrophobicContact CD1-CG1 4.17Å; L259-I261 HydrophobicContact CD2-CD1 4.01Å; L259-I261 HydrophobicContact CD2-CG1 4.14Å; L259-I261 HydrophobicContact CG-CD1 4.28Å; L259-I261 HydrophobicContact CG-CG1 3.85Å; I261-T263 HydrophobicContact CB-CG2 3.94Å; I261-T263 HydrophobicContact CG2-CG2 3.63Å; I261-T263 WeakPolarHBondContact O-CG2 3.39Å; I261-T263 PolarHBondContact O-N 2.74Å
262	W	97.5	Very high	91.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.			trans	-77	66.8	-179.2	-66.9	-7.6	0	0	0	111.6	Y94 V216 V217 D218 N219 K264 N266 L267 I268 W284 L300	Y94-W262 AromaticContact CE2-CD1 3.88Å; V216-W262 HydrophobicContact CG1-CD2 4.3Å; V216-W262 HydrophobicContact CG1-CH2 4.4Å; V216-W262 HydrophobicContact CG1-CZ2 3.67Å; V217-W262 WeakPolarHBondContact O-CB 3.38Å; V217-W262 PolarHBondContact O-N 3.02Å; D218-W262 HydrophobicContact CB-CE3 4.18Å; N219-W262 WeakPolarHBondContact CA-O 3.45Å; N219-W262 VanDerWaalsContact CB-O 3.24Å; N219-W262 WeakPolarHBondContact CB-O 3.26Å; N219-W262 PolarHBondContact ND2-O 2.84Å; W262-K264 PolarHBondContact O-N 3.46Å; W262-N266 HydrophobicContact CE3-CB 3.81Å; W262-N266 HydrophobicContact CZ3-CB 3.99Å; W262-L267 HydrophobicContact CD2-CB 4.33Å; W262-L267 HydrophobicContact CD2-CG 4.28Å; W262-L267 HydrophobicContact CG-CG 4.27Å; W262-L267 HydrophobicContact CZ2-CB 3.97Å; W262-I268 HydrophobicContact CH2-CB 4.39Å; W262-I268 HydrophobicContact CH2-CD1 4.04Å; W262-I268 HydrophobicContact CH2-CG1 3.75Å; W262-I268 HydrophobicContact CH2-CG2 4.16Å; W262-I268 HydrophobicContact CZ3-CG1 3.99Å; W262-W284 HydrophobicContact CZ2-CD2 4.19Å; W262-W284 HydrophobicContact CZ2-CE3 4.1Å; W262-W284 AromaticContact CZ2-CH2 3.87Å; W262-W284 HydrophobicContact CZ2-CH2 3.87Å; W262-W284 AromaticContact CZ2-CZ2 3.96Å; W262-W284 HydrophobicContact CZ2-CZ2 3.96Å; W262-W284 AromaticContact CZ2-CZ3 3.94Å; W262-W284 HydrophobicContact CZ2-CZ3 3.94Å; W262-W284 AromaticContact NE1-CH2 3.84Å; W262-W284 AromaticContact NE1-CZ2 3.81Å; W262-L300 HydrophobicContact CH2-CD1 3.79Å; W262-L300 HydrophobicContact CH2-CD2 4.41Å; W262-L300 HydrophobicContact CZ2-CD1 4.27Å; W262-L300 HydrophobicContact CZ3-CD1 3.97Å
263	T	96.8	Very high	91.2	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.037	17%	0.17	C	C	.	.	S	Bend	trans	-68.9	-2.2	-168.4	64.4	0	0	0	0	116.3	T93 Y94 F222 E229 I261	T93-T263 HydrophobicContact CG2-CG2 4.07Å; Y94-T263 PolarHBondContact N-OG1 2.87Å; Y94-T263 PolarHBondContact O-OG1 3.29Å; F222-T263 HydrophobicContact CD1-CG2 4.43Å; F222-T263 HydrophobicContact CD2-CG2 4.04Å; F222-T263 HydrophobicContact CE1-CG2 4.05Å; F222-T263 WeakPolarHBondContact CE1-O 3.4Å; F222-T263 HydrophobicContact CE2-CG2 3.65Å; F222-T263 HydrophobicContact CG-CG2 4.41Å; F222-T263 HydrophobicContact CZ-CG2 3.63Å; E229-T263 HydrophobicContact CG-CG2 3.96Å; I261-T263 HydrophobicContact CB-CG2 3.94Å; I261-T263 HydrophobicContact CG2-CG2 3.63Å; I261-T263 WeakPolarHBondContact O-CG2 3.39Å; I261-T263 PolarHBondContact O-N 2.74Å
264	K	93.9	Very high	91.1	Very high	107 Å²	107	31 Å²	31	47%	0.465	17%	0.167	S	C	.	.	S	Bend	trans	-121.3	-52	178.7	-59.5	-62.2	164.6	-157.5	0	113.9	Y94 G95 N219 W262	Y94-K264 WeakPolarHBondContact O-CE 3.49Å; G95-K264 WeakPolarHBondContact O-CE 3.28Å; N219-K264 PolarHBondContact ND2-N 2.92Å; N219-K264 PolarHBondContact ND2-O 2.99Å; N219-K264 PolarHBondContact OD1-O 2.97Å; W262-K264 PolarHBondContact O-N 3.46Å
265	Q	93.6	Very high	90.4	Very high	135 Å²	135	32.5 Å²	32.5	63%	0.631	18%	0.182	S	C	*	.	S	Bend	trans	-157.2	159.8	179	66.4	-176.1	24.6	0	0	109.1
266	N	95.8	Very high	89.6	Confident	32 Å²	32	33.2 Å²	33.2	17%	0.171	19%	0.186	C	C	.	.			trans	-65.4	137	173.4	-62.7	-22.4	0	0	0	110.3	N219 W262 I268 T270	N219-N266 WeakPolarHBondContact CB-OD1 3.13Å; N219-N266 PolarHBondContact N-OD1 3.3Å; W262-N266 HydrophobicContact CE3-CB 3.81Å; W262-N266 HydrophobicContact CZ3-CB 3.99Å; N266-I268 VanDerWaalsContact C-N 3.34Å; N266-I268 WeakPolarHBondContact CB-O 3.42Å; N266-T270 HydrophobicContact CB-CG2 4.29Å; N266-T270 PolarHBondContact ND2-OG1 2.94Å; N266-T270 VanDerWaalsContact ND2-OG1 3.16Å
267	L	94	Very high	89.1	Confident	57 Å²	57	33.2 Å²	33.2	30%	0.298	19%	0.186	S	C	.	.	S	Bend	trans	-85.6	-9.3	178.8	-61.4	-170.6	0	0	0	113.5	Y94 W262 W284	Y94-L267 HydrophobicContact CE1-CD1 3.91Å; Y94-L267 HydrophobicContact CE2-CD1 4.48Å; Y94-L267 WeakPolarHBondContact OH-CD1 3.22Å; W262-L267 HydrophobicContact CD2-CB 4.33Å; W262-L267 HydrophobicContact CD2-CG 4.28Å; W262-L267 HydrophobicContact CG-CG 4.27Å; W262-L267 HydrophobicContact CZ2-CB 3.97Å; L267-W284 HydrophobicContact CB-CZ2 4.48Å; L267-W284 HydrophobicContact CD1-CZ2 3.85Å
268	I	94	Very high	89	Confident	18 Å²	18	33 Å²	33	9%	0.092	19%	0.185	C	C	.	.	S	Bend	trans	-122.1	158.5	167.4	73.6	-177.1	0	0	0	109.6	W262 N266 T270 V277 R280 F281 W284 L300	W262-I268 HydrophobicContact CH2-CB 4.39Å; W262-I268 HydrophobicContact CH2-CD1 4.04Å; W262-I268 HydrophobicContact CH2-CG1 3.75Å; W262-I268 HydrophobicContact CH2-CG2 4.16Å; W262-I268 HydrophobicContact CZ3-CG1 3.99Å; N266-I268 VanDerWaalsContact C-N 3.34Å; N266-I268 WeakPolarHBondContact CB-O 3.42Å; I268-T270 HydrophobicContact CG1-CG2 4.11Å; I268-T270 PolarHBondContact O-N 2.9Å; I268-V277 HydrophobicContact CD1-CG1 4.3Å; I268-R280 HydrophobicContact CB-CB 4.33Å; I268-R280 HydrophobicContact CD1-CB 4.3Å; I268-F281 HydrophobicContact CD1-CB 3.75Å; I268-F281 HydrophobicContact CD1-CD2 4.48Å; I268-W284 HydrophobicContact CG2-CB 3.44Å; I268-W284 VanDerWaalsContact CG2-CB 3.44Å; I268-W284 HydrophobicContact CG2-CD2 4.3Å; I268-W284 HydrophobicContact CG2-CG 3.63Å; I268-L300 HydrophobicContact CD1-CD2 3.85Å
269	N	88.1	Confident	88.3	Confident	95 Å²	95	34.6 Å²	34.6	51%	0.508	20%	0.196	S	C	.	.			trans	-72.2	110.5	165.4	-175.9	8.8	0	0	0	109.9	E271 R280	N269-E271 VanDerWaalsContact C-N 3.25Å; N269-E271 PolarHBondContact O-N 3.47Å; N269-E271 WeakPolarHBondContact OD1-CB 3.46Å; N269-E271 PolarHBondContact OD1-N 2.71Å; N269-R280 WeakPolarHBondContact O-CD 3.25Å; N269-R280 PolarHBondContact O-NH1 2.94Å
270	T	90.6	Very high	87.7	Confident	16 Å²	16	37.8 Å²	37.8	10%	0.098	21%	0.208	C	C	.	.			trans	-82	4.7	177.5	48.5	0	0	0	0	113.5	N266 I268 V277 L302 K304	N266-T270 HydrophobicContact CB-CG2 4.29Å; N266-T270 PolarHBondContact ND2-OG1 2.94Å; N266-T270 VanDerWaalsContact ND2-OG1 3.16Å; I268-T270 HydrophobicContact CG1-CG2 4.11Å; I268-T270 PolarHBondContact O-N 2.9Å; T270-V277 WeakPolarHBondContact O-CG2 3.38Å; T270-L302 HydrophobicContact CG2-CD2 3.78Å; T270-K304 WeakPolarHBondContact O-CD 3.21Å; T270-K304 PolarHBondContact O-NZ 3.2Å
271	E	82.5	Confident	87.6	Confident	116 Å²	116	37.8 Å²	37.8	54%	0.542	21%	0.208	S	C	.	.			trans	-78.9	162.5	175.1	-68.2	-58.6	172	0	0	115.4	N269 R280 K304	N269-E271 VanDerWaalsContact C-N 3.25Å; N269-E271 PolarHBondContact O-N 3.47Å; N269-E271 WeakPolarHBondContact OD1-CB 3.46Å; N269-E271 PolarHBondContact OD1-N 2.71Å; E271-R280 PolarHBondContact O-NH1 3.18Å; E271-K304 IonicContact OE2-NZ 3.83Å; E271-K304 PolarHBondContact OE2-NZ 3.42Å
272	G	76	Confident	87.1	Confident	28 Å²	28	37.9 Å²	37.9	29%	0.289	21%	0.209	S	C	.	.	S	Bend	trans	86.6	-169	-171.3	0	0	0	0	0	113.9	E276 K304	G272-E276 WeakPolarHBondContact CA-OE2 3.3Å; G272-K304 PolarHBondContact O-NZ 2.77Å
273	G	75.5	Confident	86.3	Confident	26 Å²	26	41.4 Å²	41.4	27%	0.268	23%	0.225	S	C	.	.			trans	-78.3	172.2	177.7	0	0	0	0	0	114.5	G275 E276 V277 N629	G273-G275 VanDerWaalsContact C-N 3.35Å; G273-G275 PolarHBondContact O-N 3.08Å; G273-E276 PolarHBondContact O-N 3.21Å; G273-V277 PolarHBondContact O-N 2.81Å; G273-N629 PolarHBondContact N-OD1 2.8Å
274	A	80.7	Confident	86.2	Confident	10 Å²	10	42.2 Å²	42.2	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-56.8	-43.1	-174.3	0	0	0	0	0	113.3	E276 V277 L278 F306 T309 M312 I327	A274-E276 PolarHBondContact O-N 2.65Å; A274-V277 PolarHBondContact O-N 3.04Å; A274-L278 WeakPolarHBondContact O-CB 3.39Å; A274-L278 PolarHBondContact O-N 2.77Å; A274-F306 HydrophobicContact CB-CB 4.23Å; A274-F306 HydrophobicContact CB-CD1 3.96Å; A274-F306 HydrophobicContact CB-CD2 4.17Å; A274-F306 HydrophobicContact CB-CE1 4.37Å; A274-F306 HydrophobicContact CB-CG 3.85Å; A274-T309 HydrophobicContact CB-CG2 3.97Å; A274-M312 VanDerWaalsContact C-SD 3.57Å; A274-M312 HydrophobicContact CB-CB 4.03Å; A274-M312 HydrophobicContact CB-CE 3.79Å; A274-M312 HydrophobicContact CB-CG 4.49Å; A274-M312 HydrophobicContact CB-SD 3.72Å; A274-I327 HydrophobicContact CB-CD1 4.16Å; A274-I327 VanDerWaalsContact O-CD1 3.23Å; A274-I327 WeakPolarHBondContact O-CD1 3.43Å
275	G	76.1	Confident	86.1	Confident	31 Å²	31	37.3 Å²	37.3	32%	0.32	21%	0.206	S	C	.	.	H	α-helix	trans	-64.5	-37.2	-179.4	0	0	0	0	0	114	G273 S279 M312	G273-G275 VanDerWaalsContact C-N 3.35Å; G273-G275 PolarHBondContact O-N 3.08Å; G275-S279 WeakPolarHBondContact O-CB 3.32Å; G275-S279 PolarHBondContact O-N 3.15Å; G275-M312 WeakPolarHBondContact CA-SD 3.36Å; G275-M312 PolarHBondContact N-SD 3.27Å
276	E	72.9	Confident	85.5	Confident	17 Å²	17	33.8 Å²	33.8	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-47.4	173	-73.2	-167.1	-178.7	0	0	111.1	G272 G273 A274 S279 R280 E617 N629	G272-E276 WeakPolarHBondContact CA-OE2 3.3Å; G273-E276 PolarHBondContact O-N 3.21Å; A274-E276 PolarHBondContact O-N 2.65Å; E276-S279 PolarHBondContact O-N 3Å; E276-R280 VanDerWaalsContact CD-NH2 3.28Å; E276-R280 WeakPolarHBondContact O-CG 3.33Å; E276-R280 PolarHBondContact O-N 2.94Å; E276-R280 IonicContact OE1-NH2 3.29Å; E276-R280 IonicContact OE2-CZ 2.73Å; E276-R280 VanDerWaalsContact OE2-CZ 3.27Å; E276-R280 IonicContact OE2-NH1 2.58Å; E276-R280 PolarHBondContact OE2-NH1 2.74Å; E276-R280 IonicContact OE2-NH2 3.96Å; E276-R280 PolarHBondContact OE2-NH2 2.67Å; E276-E617 WeakPolarHBondContact CG-OE2 3.42Å; E276-N629 PolarHBondContact OE1-ND2 3.44Å
277	V	85.3	Confident	84.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.7	-39.6	-177.3	179.4	0	0	0	0	110.8	I268 T270 G273 A274 R280 F281 L300 L302 F306 I327	I268-V277 HydrophobicContact CD1-CG1 4.3Å; T270-V277 WeakPolarHBondContact O-CG2 3.38Å; G273-V277 PolarHBondContact O-N 2.81Å; A274-V277 PolarHBondContact O-N 3.04Å; V277-R280 PolarHBondContact O-N 3.28Å; V277-F281 VanDerWaalsContact O-CB 3.24Å; V277-F281 WeakPolarHBondContact O-CB 3.28Å; V277-F281 PolarHBondContact O-N 3.45Å; V277-L300 HydrophobicContact CG1-CD2 4.39Å; V277-L302 HydrophobicContact CG1-CD1 4.17Å; V277-F306 HydrophobicContact CB-CE1 4.43Å; V277-F306 HydrophobicContact CB-CZ 4.17Å; V277-F306 HydrophobicContact CG1-CZ 4.29Å; V277-F306 HydrophobicContact CG2-CE1 4.01Å; V277-F306 HydrophobicContact CG2-CZ 4.12Å; V277-I327 HydrophobicContact CB-CD1 3.88Å; V277-I327 HydrophobicContact CG1-CD1 3.97Å
278	L	88.8	Confident	84	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-49.5	172.9	175.8	62.7	0	0	0	111.2	A274 R280 F281 T282 M312 F314 I327 P610	A274-L278 WeakPolarHBondContact O-CB 3.39Å; A274-L278 PolarHBondContact O-N 2.77Å; L278-R280 VanDerWaalsContact C-N 3.34Å; L278-R280 PolarHBondContact O-N 3.04Å; L278-F281 WeakPolarHBondContact O-CB 3.35Å; L278-F281 PolarHBondContact O-N 3.41Å; L278-F281 VanDerWaalsContact O-N 3.12Å; L278-T282 HydrophobicContact CD1-CG2 3.9Å; L278-T282 PolarHBondContact O-N 2.97Å; L278-M312 HydrophobicContact CD2-CB 4.41Å; L278-M312 HydrophobicContact CD2-CG 3.86Å; L278-M312 HydrophobicContact CD2-SD 4.36Å; L278-F314 HydrophobicContact CD1-CD2 4.42Å; L278-F314 HydrophobicContact CD1-CE2 4.28Å; L278-F314 HydrophobicContact CD2-CD2 3.91Å; L278-F314 HydrophobicContact CD2-CE1 4.41Å; L278-F314 HydrophobicContact CD2-CE2 3.72Å; L278-F314 HydrophobicContact CD2-CG 4.34Å; L278-F314 HydrophobicContact CD2-CZ 3.99Å; L278-F314 HydrophobicContact CG-CD2 4.18Å; L278-F314 HydrophobicContact CG-CE2 3.7Å; L278-F314 HydrophobicContact CG-CZ 4.2Å; L278-I327 HydrophobicContact CB-CD1 4.25Å; L278-I327 HydrophobicContact CB-CG1 4.41Å; L278-I327 HydrophobicContact CB-CG2 4.18Å; L278-I327 HydrophobicContact CD1-CG2 4.04Å; L278-P610 HydrophobicContact CD2-CG 4.12Å
279	S	78.1	Confident	83.7	Confident	33 Å²	33	37.5 Å²	37.5	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-41.2	-179.9	-172.1	0	0	0	0	112.3	G275 E276 T282 Q283	G275-S279 WeakPolarHBondContact O-CB 3.32Å; G275-S279 PolarHBondContact O-N 3.15Å; E276-S279 PolarHBondContact O-N 3Å; S279-T282 PolarHBondContact O-OG1 3.4Å; S279-Q283 WeakPolarHBondContact O-CB 3.48Å; S279-Q283 WeakPolarHBondContact O-CG 3.34Å; S279-Q283 PolarHBondContact O-N 3.22Å; S279-Q283 VanDerWaalsContact O-N 3.15Å; S279-Q283 PolarHBondContact O-NE2 3.12Å; S279-Q283 PolarHBondContact OG-NE2 3.15Å; S279-Q283 VanDerWaalsContact OG-NE2 3.16Å
280	R	86.3	Confident	83.3	Confident	66 Å²	66	34.7 Å²	34.7	25%	0.249	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-38.2	173.9	-68.4	174.1	-166.1	128.5	11.9	112.3	I268 N269 E271 E276 V277 L278 W284	I268-R280 HydrophobicContact CB-CB 4.33Å; I268-R280 HydrophobicContact CD1-CB 4.3Å; N269-R280 WeakPolarHBondContact O-CD 3.25Å; N269-R280 PolarHBondContact O-NH1 2.94Å; E271-R280 PolarHBondContact O-NH1 3.18Å; E276-R280 VanDerWaalsContact CD-NH2 3.28Å; E276-R280 WeakPolarHBondContact O-CG 3.33Å; E276-R280 PolarHBondContact O-N 2.94Å; E276-R280 IonicContact OE1-NH2 3.29Å; E276-R280 IonicContact OE2-CZ 2.73Å; E276-R280 VanDerWaalsContact OE2-CZ 3.27Å; E276-R280 IonicContact OE2-NH1 2.58Å; E276-R280 PolarHBondContact OE2-NH1 2.74Å; E276-R280 IonicContact OE2-NH2 3.96Å; E276-R280 PolarHBondContact OE2-NH2 2.67Å; V277-R280 PolarHBondContact O-N 3.28Å; L278-R280 VanDerWaalsContact C-N 3.34Å; L278-R280 PolarHBondContact O-N 3.04Å; R280-W284 VanDerWaalsContact O-CB 3.31Å; R280-W284 WeakPolarHBondContact O-CB 3.47Å; R280-W284 PolarHBondContact O-N 2.99Å
281	F	95.9	Very high	82.6	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-44.7	177.9	176.2	-118.8	0	0	0	112.1	V216 I268 V277 L278 W284 R285 A298 L300 G326 I327	V216-F281 HydrophobicContact CB-CE2 4.06Å; V216-F281 HydrophobicContact CB-CZ 4.34Å; V216-F281 HydrophobicContact CG1-CE2 4.31Å; V216-F281 HydrophobicContact CG2-CE2 3.93Å; V216-F281 HydrophobicContact CG2-CZ 4.03Å; I268-F281 HydrophobicContact CD1-CB 3.75Å; I268-F281 HydrophobicContact CD1-CD2 4.48Å; V277-F281 VanDerWaalsContact O-CB 3.24Å; V277-F281 WeakPolarHBondContact O-CB 3.28Å; V277-F281 PolarHBondContact O-N 3.45Å; L278-F281 WeakPolarHBondContact O-CB 3.35Å; L278-F281 PolarHBondContact O-N 3.41Å; L278-F281 VanDerWaalsContact O-N 3.12Å; F281-W284 AromaticContact CD2-CE3 3.91Å; F281-W284 HydrophobicContact CD2-CE3 3.91Å; F281-W284 HydrophobicContact CD2-CZ3 4.22Å; F281-W284 AromaticContact CE2-CE3 3.9Å; F281-W284 HydrophobicContact CE2-CE3 3.9Å; F281-W284 AromaticContact CE2-CZ3 3.75Å; F281-W284 HydrophobicContact CE2-CZ3 3.75Å; F281-W284 PolarHBondContact O-N 3.07Å; F281-R285 WeakPolarHBondContact O-CB 3.2Å; F281-R285 PolarHBondContact O-N 3.4Å; F281-A298 HydrophobicContact CE1-CB 4.23Å; F281-A298 WeakPolarHBondContact CE1-O 3.36Å; F281-A298 HydrophobicContact CZ-CB 3.77Å; F281-L300 HydrophobicContact CB-CD2 4.07Å; F281-L300 HydrophobicContact CD1-CB 3.95Å; F281-L300 HydrophobicContact CD2-CB 3.88Å; F281-L300 HydrophobicContact CD2-CD1 4.12Å; F281-L300 HydrophobicContact CD2-CD2 3.75Å; F281-L300 HydrophobicContact CD2-CG 4.13Å; F281-L300 HydrophobicContact CE1-CB 3.83Å; F281-L300 HydrophobicContact CE2-CB 3.75Å; F281-L300 HydrophobicContact CE2-CD1 3.97Å; F281-L300 HydrophobicContact CE2-CD2 4.35Å; F281-L300 HydrophobicContact CE2-CG 4.23Å; F281-L300 HydrophobicContact CG-CB 3.98Å; F281-L300 HydrophobicContact CG-CD2 3.89Å; F281-L300 HydrophobicContact CG-CG 4.47Å; F281-L300 HydrophobicContact CZ-CB 3.73Å; F281-G326 WeakPolarHBondContact CE1-O 3.31Å; F281-I327 HydrophobicContact CB-CG2 4.15Å; F281-I327 HydrophobicContact CD1-CG2 3.97Å; F281-I327 HydrophobicContact CG-CG2 4.28Å
282	T	87.6	Confident	82.6	Confident	3 Å²	3	36 Å²	36	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-72.1	-35	180	66.8	0	0	0	0	112.5	L278 S279 R285 E286 F314 S322	L278-T282 HydrophobicContact CD1-CG2 3.9Å; L278-T282 PolarHBondContact O-N 2.97Å; S279-T282 PolarHBondContact O-OG1 3.4Å; T282-R285 WeakPolarHBondContact O-CB 3.28Å; T282-R285 PolarHBondContact O-N 2.99Å; T282-E286 PolarHBondContact O-N 3.24Å; T282-F314 HydrophobicContact CG2-CD2 4.31Å; T282-F314 HydrophobicContact CG2-CE2 4.07Å; T282-S322 VanDerWaalsContact CB-O 3.25Å; T282-S322 WeakPolarHBondContact CB-O 3.41Å; T282-S322 PolarHBondContact OG1-O 3.19Å
283	Q	80.3	Confident	82.8	Confident	74 Å²	74	35 Å²	35	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-61.8	-45.4	170.1	-72.3	171.3	38.1	0	0	112.1	S279 E286 K287 N512	S279-Q283 WeakPolarHBondContact O-CB 3.48Å; S279-Q283 WeakPolarHBondContact O-CG 3.34Å; S279-Q283 PolarHBondContact O-N 3.22Å; S279-Q283 VanDerWaalsContact O-N 3.15Å; S279-Q283 PolarHBondContact O-NE2 3.12Å; S279-Q283 PolarHBondContact OG-NE2 3.15Å; S279-Q283 VanDerWaalsContact OG-NE2 3.16Å; Q283-E286 PolarHBondContact O-N 3.13Å; Q283-K287 WeakPolarHBondContact O-CB 3.27Å; Q283-K287 PolarHBondContact O-N 3.49Å; Q283-K287 VanDerWaalsContact O-N 3.13Å; Q283-N512 PolarHBondContact NE2-ND2 3.3Å
284	W	93.6	Very high	82.9	Confident	23 Å²	23	37.6 Å²	37.6	9%	0.087	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-41.7	174	171.7	86.4	0	0	0	111.4	V216 D260 W262 L267 I268 R280 F281 E286 K287 E288 L289	V216-W284 HydrophobicContact CG1-CH2 4.2Å; V216-W284 HydrophobicContact CG1-CZ3 4.23Å; V216-W284 HydrophobicContact CG2-CH2 4.45Å; V216-W284 HydrophobicContact CG2-CZ3 4.19Å; D260-W284 WeakPolarHBondContact OD2-CH2 3.39Å; W262-W284 HydrophobicContact CZ2-CD2 4.19Å; W262-W284 HydrophobicContact CZ2-CE3 4.1Å; W262-W284 AromaticContact CZ2-CH2 3.87Å; W262-W284 HydrophobicContact CZ2-CH2 3.87Å; W262-W284 AromaticContact CZ2-CZ2 3.96Å; W262-W284 HydrophobicContact CZ2-CZ2 3.96Å; W262-W284 AromaticContact CZ2-CZ3 3.94Å; W262-W284 HydrophobicContact CZ2-CZ3 3.94Å; W262-W284 AromaticContact NE1-CH2 3.84Å; W262-W284 AromaticContact NE1-CZ2 3.81Å; L267-W284 HydrophobicContact CB-CZ2 4.48Å; L267-W284 HydrophobicContact CD1-CZ2 3.85Å; I268-W284 HydrophobicContact CG2-CB 3.44Å; I268-W284 VanDerWaalsContact CG2-CB 3.44Å; I268-W284 HydrophobicContact CG2-CD2 4.3Å; I268-W284 HydrophobicContact CG2-CG 3.63Å; R280-W284 VanDerWaalsContact O-CB 3.31Å; R280-W284 WeakPolarHBondContact O-CB 3.47Å; R280-W284 PolarHBondContact O-N 2.99Å; F281-W284 AromaticContact CD2-CE3 3.91Å; F281-W284 HydrophobicContact CD2-CE3 3.91Å; F281-W284 HydrophobicContact CD2-CZ3 4.22Å; F281-W284 AromaticContact CE2-CE3 3.9Å; F281-W284 HydrophobicContact CE2-CE3 3.9Å; F281-W284 AromaticContact CE2-CZ3 3.75Å; F281-W284 HydrophobicContact CE2-CZ3 3.75Å; F281-W284 PolarHBondContact O-N 3.07Å; W284-E286 PolarHBondContact O-N 2.82Å; W284-K287 PolarHBondContact O-N 3.08Å; W284-E288 HydrophobicContact CD2-CB 4.46Å; W284-E288 HydrophobicContact CG-CB 4.41Å; W284-E288 HydrophobicContact CG-CG 4.47Å; W284-E288 WeakPolarHBondContact O-CA 3.33Å; W284-E288 VanDerWaalsContact O-CB 3.26Å; W284-E288 WeakPolarHBondContact O-CB 3.43Å; W284-E288 PolarHBondContact O-N 3.19Å; W284-L289 HydrophobicContact CH2-CB 4.01Å; W284-L289 HydrophobicContact CH2-CD1 4.04Å; W284-L289 HydrophobicContact CH2-CD2 4.07Å; W284-L289 HydrophobicContact CH2-CG 4.26Å; W284-L289 HydrophobicContact CZ3-CB 3.96Å; W284-L289 HydrophobicContact CZ3-CD2 3.79Å; W284-L289 HydrophobicContact CZ3-CG 4.32Å
285	R	93	Very high	83.3	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.015	19%	0.185	C	C	.	.	I	π-helix	trans	-56.1	-49.8	175.3	171.9	-173.1	175.7	-109.2	7.5	111.3	F281 T282 L289 V290 H295 D296 A298 S320 R321 G324	F281-R285 WeakPolarHBondContact O-CB 3.2Å; F281-R285 PolarHBondContact O-N 3.4Å; T282-R285 WeakPolarHBondContact O-CB 3.28Å; T282-R285 PolarHBondContact O-N 2.99Å; R285-L289 HydrophobicContact CG-CB 4.37Å; R285-L289 HydrophobicContact CG-CD2 4.44Å; R285-L289 PolarHBondContact O-N 3.08Å; R285-V290 HydrophobicContact CG-CG2 3.9Å; R285-V290 PolarHBondContact O-N 2.93Å; R285-H295 PolarHBondContact NE-CD2 2.92Å; R285-H295 PolarHBondContact NE-NE2 3.37Å; R285-H295 PolarHBondContact NH2-O 2.75Å; R285-D296 PolarHBondContact NH2-O 2.79Å; R285-A298 HydrophobicContact CG-CB 4.49Å; R285-S320 PolarHBondContact NH1-O 2.93Å; R285-R321 PolarHBondContact NH1-O 2.82Å; R285-G324 VanDerWaalsContact CD-O 3.32Å; R285-G324 WeakPolarHBondContact CD-O 3.4Å; R285-G324 PolarHBondContact NE-O 3.05Å; R285-G324 PolarHBondContact NH1-O 2.8Å
286	E	81.2	Confident	83.9	Confident	61 Å²	61	36.4 Å²	36.4	29%	0.285	17%	0.171	S	C	.	.	I	π-helix	trans	-63.2	-42.2	-177.8	172.2	154.8	-124.6	0	0	113.1	T282 Q283 W284 R321 S322	T282-E286 PolarHBondContact O-N 3.24Å; Q283-E286 PolarHBondContact O-N 3.13Å; W284-E286 PolarHBondContact O-N 2.82Å; E286-R321 HydrophobicContact CG-CG 4.06Å; E286-R321 WeakPolarHBondContact OE1-CG 3.33Å; E286-R321 IonicContact OE1-NE 3.27Å; E286-S322 VanDerWaalsContact CD-CB 3.46Å; E286-S322 WeakPolarHBondContact OE1-CB 3.27Å; E286-S322 WeakPolarHBondContact OE2-CA 3.31Å; E286-S322 WeakPolarHBondContact OE2-CB 3.44Å
287	K	74.9	Confident	84.9	Confident	113 Å²	113	35.6 Å²	35.6	49%	0.491	17%	0.168	S	C	.	.	I	π-helix	trans	-80.2	-40.2	-176.8	-176.4	173.2	178.8	172.1	0	113.1	Q283 W284 N657	Q283-K287 WeakPolarHBondContact O-CB 3.27Å; Q283-K287 PolarHBondContact O-N 3.49Å; Q283-K287 VanDerWaalsContact O-N 3.13Å; W284-K287 PolarHBondContact O-N 3.08Å; K287-N657 PolarHBondContact NZ-OD1 3.16Å; K287-N657 VanDerWaalsContact NZ-OD1 3.15Å
288	E	83.5	Confident	85.5	Confident	71 Å²	71	35.6 Å²	35.6	33%	0.332	17%	0.168	S	C	.	.	I	π-helix	trans	-113.3	-45.9	-167.4	-64.3	-66.2	149.4	0	0	113.3	W284 R292	W284-E288 HydrophobicContact CD2-CB 4.46Å; W284-E288 HydrophobicContact CG-CB 4.41Å; W284-E288 HydrophobicContact CG-CG 4.47Å; W284-E288 WeakPolarHBondContact O-CA 3.33Å; W284-E288 VanDerWaalsContact O-CB 3.26Å; W284-E288 WeakPolarHBondContact O-CB 3.43Å; W284-E288 PolarHBondContact O-N 3.19Å; E288-R292 WeakPolarHBondContact O-CD 3.27Å; E288-R292 WeakPolarHBondContact O-CG 3.28Å; E288-R292 PolarHBondContact O-NE 2.96Å; E288-R292 IonicContact OE2-CZ 3.42Å; E288-R292 IonicContact OE2-NE 2.67Å; E288-R292 IonicContact OE2-NH2 2.74Å; E288-R292 PolarHBondContact OE2-NH2 2.75Å
289	L	87.1	Confident	86	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	I	π-helix	trans	-85.4	-45.9	-169.3	-170.5	63.2	0	0	0	113.3	L214 V216 D260 W284 R285 R292 R293 A298	L214-L289 HydrophobicContact CD1-CD1 3.86Å; L214-L289 HydrophobicContact CD1-CD2 3.91Å; L214-L289 HydrophobicContact CD1-CG 3.87Å; L214-L289 HydrophobicContact CD2-CD1 4.29Å; L214-L289 HydrophobicContact CD2-CD2 4Å; L214-L289 HydrophobicContact CG-CD2 4.43Å; V216-L289 HydrophobicContact CG2-CD2 3.85Å; D260-L289 HydrophobicContact CB-CD1 4.43Å; W284-L289 HydrophobicContact CH2-CB 4.01Å; W284-L289 HydrophobicContact CH2-CD1 4.04Å; W284-L289 HydrophobicContact CH2-CD2 4.07Å; W284-L289 HydrophobicContact CH2-CG 4.26Å; W284-L289 HydrophobicContact CZ3-CB 3.96Å; W284-L289 HydrophobicContact CZ3-CD2 3.79Å; W284-L289 HydrophobicContact CZ3-CG 4.32Å; R285-L289 HydrophobicContact CG-CB 4.37Å; R285-L289 HydrophobicContact CG-CD2 4.44Å; R285-L289 PolarHBondContact O-N 3.08Å; L289-R292 WeakPolarHBondContact O-CB 3.29Å; L289-R292 PolarHBondContact O-N 3.27Å; L289-R293 PolarHBondContact O-N 2.9Å; L289-A298 HydrophobicContact CD2-CB 4.05Å
290	V	79.1	Confident	87	Confident	36 Å²	36	34 Å²	34	22%	0.218	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-41.1	179.1	170.1	0	0	0	0	111.9	R285 R292 R293 R321	R285-V290 HydrophobicContact CG-CG2 3.9Å; R285-V290 PolarHBondContact O-N 2.93Å; V290-R292 VanDerWaalsContact C-N 3.27Å; V290-R292 PolarHBondContact O-N 2.88Å; V290-R293 CarbonylContact O-C 3.53Å; V290-R321 HydrophobicContact CG1-CG 4.36Å
291	P	76.8	Confident	87.5	Confident	85 Å²	85	30.9 Å²	30.9	55%	0.552	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.3	173	-22.7	36.2	0	0	0	115.5
292	R	81.3	Confident	87.5	Confident	74 Å²	74	30.9 Å²	30.9	28%	0.279	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-33	177.8	-67.4	166.9	-162.6	-171.2	3	112.9	F92 Y94 D260 E288 L289 V290	F92-R292 HydrophobicContact CE1-CB 4.44Å; F92-R292 HydrophobicContact CZ-CB 4.11Å; Y94-R292 PolarHBondContact OH-NH1 2.81Å; D260-R292 IonicContact OD2-NH1 3.73Å; E288-R292 WeakPolarHBondContact O-CD 3.27Å; E288-R292 WeakPolarHBondContact O-CG 3.28Å; E288-R292 PolarHBondContact O-NE 2.96Å; E288-R292 IonicContact OE2-CZ 3.42Å; E288-R292 IonicContact OE2-NE 2.67Å; E288-R292 IonicContact OE2-NH2 2.74Å; E288-R292 PolarHBondContact OE2-NH2 2.75Å; L289-R292 WeakPolarHBondContact O-CB 3.29Å; L289-R292 PolarHBondContact O-N 3.27Å; V290-R292 VanDerWaalsContact C-N 3.27Å; V290-R292 PolarHBondContact O-N 2.88Å
293	R	81.3	Confident	87.8	Confident	8 Å²	8	33.2 Å²	33.2	3%	0.03	16%	0.156	C	C	.	.	S	Bend	trans	-157.3	125	-177.2	-174.2	67.6	173.6	168.2	7.2	109	D88 F92 L214 V257 L289 V290 H295 A408	D88-R293 VanDerWaalsContact CG-NH1 3.31Å; D88-R293 PolarHBondContact O-NH1 3.48Å; D88-R293 IonicContact OD1-CZ 3.03Å; D88-R293 IonicContact OD1-NH1 3.97Å; D88-R293 IonicContact OD1-NH2 3.74Å; D88-R293 PolarHBondContact OD1-NH2 3.41Å; D88-R293 IonicContact OD2-CZ 2.65Å; D88-R293 IonicContact OD2-NH1 3.44Å; D88-R293 PolarHBondContact OD2-NH1 3.48Å; D88-R293 IonicContact OD2-NH2 2.75Å; D88-R293 PolarHBondContact OD2-NH2 2.92Å; F92-R293 HydrophobicContact CE2-CB 4.03Å; F92-R293 HydrophobicContact CZ-CB 4.06Å; L214-R293 HydrophobicContact CD1-CB 3.98Å; L214-R293 HydrophobicContact CD1-CG 3.99Å; V257-R293 VanDerWaalsContact O-CZ 3.24Å; V257-R293 PolarHBondContact O-NE 3.46Å; V257-R293 PolarHBondContact O-NH2 3.45Å; L289-R293 PolarHBondContact O-N 2.9Å; V290-R293 CarbonylContact O-C 3.53Å; R293-H295 PolarHBondContact O-CE1 3.49Å; R293-H295 PolarHBondContact O-ND1 3.02Å; R293-A408 VanDerWaalsContact CZ-CB 3.45Å; R293-A408 VanDerWaalsContact NH1-C 3.28Å; R293-A408 PolarHBondContact NH1-O 2.98Å
294	R	77.4	Confident	88.1	Confident	81 Å²	81	31.6 Å²	31.6	31%	0.306	15%	0.148	S	C	.	.			trans	-61.7	138.4	170.9	-172.4	-169.9	140.7	150.9	3.1	110.4	E212 N401 A408	E212-R294 IonicContact OE1-CZ 2.66Å; E212-R294 IonicContact OE1-NE 3.27Å; E212-R294 PolarHBondContact OE1-NE 2.83Å; E212-R294 IonicContact OE1-NH2 2.67Å; E212-R294 PolarHBondContact OE1-NH2 3.43Å; E212-R294 WeakPolarHBondContact OE2-CG 3.42Å; E212-R294 IonicContact OE2-CZ 3.38Å; E212-R294 IonicContact OE2-NE 2.73Å; E212-R294 PolarHBondContact OE2-NE 3.5Å; E212-R294 IonicContact OE2-NH2 3.91Å; R294-N401 PolarHBondContact NH2-ND2 3.4Å; R294-N401 PolarHBondContact NH2-OD1 3.17Å; R294-A408 HydrophobicContact CB-CB 4.41Å
295	H	89.1	Confident	87.7	Confident	9 Å²	9	32.9 Å²	32.9	4%	0.042	16%	0.16	C	C	.	.			trans	-171.1	145.3	175.8	59.2	-73.7	0	0	0	111.4	E212 L214 V257 R285 R293	E212-H295 HydrophobicContact CB-CB 4.4Å; E212-H295 CarbonylContact O-C 3.57Å; E212-H295 WeakPolarHBondContact O-CB 3.42Å; L214-H295 HydrophobicContact CB-CB 3.87Å; L214-H295 HydrophobicContact CD1-CB 4.31Å; V257-H295 HydrophobicContact CG2-CB 3.75Å; R285-H295 PolarHBondContact NE-CD2 2.92Å; R285-H295 PolarHBondContact NE-NE2 3.37Å; R285-H295 PolarHBondContact NH2-O 2.75Å; R293-H295 PolarHBondContact O-CE1 3.49Å; R293-H295 PolarHBondContact O-ND1 3.02Å
296	D	88.5	Confident	87	Confident	7 Å²	7	33.8 Å²	33.8	4%	0.037	16%	0.164	C	C	.	.	S	Bend	trans	-78.9	-37.5	-174.3	-57.3	-37.7	0	0	0	112.9	E212 R285 V318 C319 C398 L399	E212-D296 HydrophobicContact CB-CB 4.36Å; E212-D296 WeakPolarHBondContact CB-OD2 3.1Å; E212-D296 PolarHBondContact N-OD2 2.82Å; E212-D296 PolarHBondContact O-N 2.92Å; R285-D296 PolarHBondContact NH2-O 2.79Å; D296-V318 HydrophobicContact CB-CG2 4.07Å; D296-C319 PolarHBondContact O-N 3.19Å; D296-C398 VanDerWaalsContact OD1-CB 3.25Å; D296-C398 WeakPolarHBondContact OD1-CB 3.03Å; D296-C398 PolarHBondContact OD1-SG 2.96Å; D296-L399 HydrophobicContact CB-CD2 4.28Å
297	S	94.8	Very high	86.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	142.1	175.4	174.5	0	0	0	0	110.5	E212 L214 Q299 G324 N349	E212-S297 PolarHBondContact O-N 3.48Å; L214-S297 PolarHBondContact N-O 2.89Å; L214-S297 VanDerWaalsContact N-O 3.11Å; S297-Q299 PolarHBondContact OG-NE2 3.5Å; S297-G324 WeakPolarHBondContact CA-O 3.42Å; S297-N349 PolarHBondContact OG-OD1 2.89Å
298	A	97.6	Very high	86.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	144.6	168	0	0	0	0	0	111.5	L214 F281 R285 L289 G324 G325 G326	L214-A298 HydrophobicContact CB-CB 4.33Å; L214-A298 CarbonylContact O-C 3.31Å; L214-A298 WeakPolarHBondContact O-CA 3.5Å; F281-A298 HydrophobicContact CE1-CB 4.23Å; F281-A298 WeakPolarHBondContact CE1-O 3.36Å; F281-A298 HydrophobicContact CZ-CB 3.77Å; R285-A298 HydrophobicContact CG-CB 4.49Å; L289-A298 HydrophobicContact CD2-CB 4.05Å; A298-G324 PolarHBondContact N-O 2.88Å; A298-G325 CarbonylContact O-C 3.43Å; A298-G325 WeakPolarHBondContact O-CA 3.2Å; A298-G326 PolarHBondContact O-N 2.91Å
299	Q	98.4	Very high	85.6	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.5	179.8	-63.3	-66	-32.7	0	0	110	L213 L214 L215 V216 S297 G326 N328 V342 N349	L213-Q299 HydrophobicContact CD1-CB 4.31Å; L213-Q299 HydrophobicContact CD1-CG 3.73Å; L214-Q299 PolarHBondContact O-N 2.86Å; L215-Q299 HydrophobicContact CD2-CB 3.95Å; V216-Q299 PolarHBondContact N-O 2.87Å; S297-Q299 PolarHBondContact OG-NE2 3.5Å; Q299-G326 WeakPolarHBondContact CA-O 3.37Å; Q299-G326 VanDerWaalsContact OE1-CA 3.26Å; Q299-G326 PolarHBondContact OE1-O 3.02Å; Q299-N328 PolarHBondContact OE1-ND2 2.82Å; Q299-V342 HydrophobicContact CB-CG1 4.08Å; Q299-V342 HydrophobicContact CG-CG1 3.97Å; Q299-N349 PolarHBondContact NE2-OD1 3.12Å; Q299-N349 VanDerWaalsContact NE2-OD1 3.14Å
300	L	98.6	Very high	85.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.5	177.9	-172.1	62.1	0	0	0	110.3	V216 W262 I268 V277 F281 L302 G326 I327 N328	V216-L300 HydrophobicContact CB-CD1 3.77Å; V216-L300 HydrophobicContact CG1-CD1 3.54Å; V216-L300 CarbonylContact O-C 3.51Å; V216-L300 WeakPolarHBondContact O-CA 3.39Å; W262-L300 HydrophobicContact CH2-CD1 3.79Å; W262-L300 HydrophobicContact CH2-CD2 4.41Å; W262-L300 HydrophobicContact CZ2-CD1 4.27Å; W262-L300 HydrophobicContact CZ3-CD1 3.97Å; I268-L300 HydrophobicContact CD1-CD2 3.85Å; V277-L300 HydrophobicContact CG1-CD2 4.39Å; F281-L300 HydrophobicContact CB-CD2 4.07Å; F281-L300 HydrophobicContact CD1-CB 3.95Å; F281-L300 HydrophobicContact CD2-CB 3.88Å; F281-L300 HydrophobicContact CD2-CD1 4.12Å; F281-L300 HydrophobicContact CD2-CD2 3.75Å; F281-L300 HydrophobicContact CD2-CG 4.13Å; F281-L300 HydrophobicContact CE1-CB 3.83Å; F281-L300 HydrophobicContact CE2-CB 3.75Å; F281-L300 HydrophobicContact CE2-CD1 3.97Å; F281-L300 HydrophobicContact CE2-CD2 4.35Å; F281-L300 HydrophobicContact CE2-CG 4.23Å; F281-L300 HydrophobicContact CG-CB 3.98Å; F281-L300 HydrophobicContact CG-CD2 3.89Å; F281-L300 HydrophobicContact CG-CG 4.47Å; F281-L300 HydrophobicContact CZ-CB 3.73Å; L300-L302 HydrophobicContact CD2-CD1 4.24Å; L300-L302 HydrophobicContact CD2-CD2 3.8Å; L300-L302 HydrophobicContact CD2-CG 4.13Å; L300-L302 HydrophobicContact CG-CD1 4.42Å; L300-L302 HydrophobicContact CG-CD2 4Å; L300-L302 HydrophobicContact CG-CG 3.98Å; L300-G326 PolarHBondContact N-O 2.85Å; L300-I327 HydrophobicContact CB-CB 4.33Å; L300-I327 HydrophobicContact CB-CG2 3.99Å; L300-I327 HydrophobicContact CD2-CG2 4.14Å; L300-I327 CarbonylContact O-C 3.53Å; L300-N328 PolarHBondContact O-N 2.81Å; L300-N328 PolarHBondContact O-ND2 2.98Å
301	I	98	Very high	85.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110.7	-176.4	-47.7	-53.3	0	0	0	108.1	L215 V216 V217 D218 M236 N328 F330 F338 V342	L215-I301 HydrophobicContact CD2-CD1 4.27Å; V216-I301 PolarHBondContact O-N 2.84Å; V217-I301 HydrophobicContact CG2-CB 4.38Å; D218-I301 PolarHBondContact N-O 2.91Å; D218-I301 VanDerWaalsContact N-O 3.07Å; M236-I301 HydrophobicContact SD-CG1 4.1Å; M236-I301 HydrophobicContact SD-CG2 4.42Å; I301-N328 HydrophobicContact CD1-CB 4.09Å; I301-F330 HydrophobicContact CG2-CB 3.87Å; I301-F330 HydrophobicContact CG2-CD1 3.92Å; I301-F330 HydrophobicContact CG2-CG 4.41Å; I301-F338 HydrophobicContact CD1-CE1 3.95Å; I301-F338 HydrophobicContact CD1-CZ 3.9Å; I301-F338 HydrophobicContact CG2-CE1 3.88Å; I301-F338 HydrophobicContact CG2-CZ 3.92Å; I301-V342 HydrophobicContact CD1-CG2 4.22Å
302	L	95.4	Very high	86.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.7	-166.3	-66.7	157	0	0	0	112.4	D218 T270 V277 L300 K304 F306 I327 N328 F330	D218-L302 HydrophobicContact CB-CD2 4.05Å; D218-L302 WeakPolarHBondContact OD2-CA 2.94Å; D218-L302 WeakPolarHBondContact OD2-CD2 3.43Å; T270-L302 HydrophobicContact CG2-CD2 3.78Å; V277-L302 HydrophobicContact CG1-CD1 4.17Å; L300-L302 HydrophobicContact CD2-CD1 4.24Å; L300-L302 HydrophobicContact CD2-CD2 3.8Å; L300-L302 HydrophobicContact CD2-CG 4.13Å; L300-L302 HydrophobicContact CG-CD1 4.42Å; L300-L302 HydrophobicContact CG-CD2 4Å; L300-L302 HydrophobicContact CG-CG 3.98Å; L302-K304 HydrophobicContact CB-CB 4.35Å; L302-K304 PolarHBondContact O-N 3.15Å; L302-F306 HydrophobicContact CD1-CE2 3.68Å; L302-F306 HydrophobicContact CD1-CZ 3.81Å; L302-I327 HydrophobicContact CD1-CB 3.96Å; L302-I327 HydrophobicContact CD1-CD1 4.26Å; L302-I327 HydrophobicContact CD1-CG1 4.49Å; L302-N328 PolarHBondContact N-O 3.15Å; L302-F330 PolarHBondContact O-N 3.32Å
303	M	93.3	Very high	86.8	Confident	52 Å²	52	16.2 Å²	16.2	26%	0.256	8%	0.083	S	C	.	.	S	Bend	trans	-88.3	36.6	165.4	-163.7	63.2	-168.3	0	0	111.7	D218 D220 R221 H224 F330 L331	D218-M303 PolarHBondContact OD1-N 3.06Å; D218-M303 PolarHBondContact OD2-N 3.22Å; D220-M303 HydrophobicContact CB-CB 3.97Å; R221-M303 HydrophobicContact CB-CB 4.01Å; R221-M303 VanDerWaalsContact N-CB 3.34Å; H224-M303 HydrophobicContact CB-CE 4.27Å; H224-M303 HydrophobicContact CB-CG 4.29Å; H224-M303 HydrophobicContact CB-SD 4.07Å; H224-M303 WeakPolarHBondContact ND1-CE 3.39Å; M303-F330 VanDerWaalsContact SD-O 3.37Å; M303-L331 VanDerWaalsContact C-CD2 3.48Å; M303-L331 HydrophobicContact SD-CD2 4.24Å
304	K	87.6	Confident	86.9	Confident	40 Å²	40	18 Å²	18	17%	0.174	9%	0.091	C	C	.	.			trans	-122.3	141.5	-178.5	-179.8	166.9	174	176.2	0	111.7	T270 E271 G272 L302 F306 A329	T270-K304 WeakPolarHBondContact O-CD 3.21Å; T270-K304 PolarHBondContact O-NZ 3.2Å; E271-K304 IonicContact OE2-NZ 3.83Å; E271-K304 PolarHBondContact OE2-NZ 3.42Å; G272-K304 PolarHBondContact O-NZ 2.77Å; L302-K304 HydrophobicContact CB-CB 4.35Å; L302-K304 PolarHBondContact O-N 3.15Å; K304-F306 HydrophobicContact CD-CE1 4.15Å; K304-F306 HydrophobicContact CD-CZ 4.39Å; K304-F306 HydrophobicContact CG-CE1 4.43Å; K304-F306 HydrophobicContact CG-CZ 4.49Å; K304-A329 WeakPolarHBondContact O-CB 3.4Å
305	S	83.9	Confident	87.2	Confident	50 Å²	50	15.8 Å²	15.8	35%	0.35	9%	0.087	S	C	.	.			trans	-90.6	128.2	171.7	-161.1	0	0	0	0	110.5	R169 G307	R169-S305 PolarHBondContact NH1-OG 2.77Å; S305-G307 VanDerWaalsContact C-N 3.33Å; S305-G307 PolarHBondContact OG-N 3.32Å; S305-G307 VanDerWaalsContact OG-N 3.15Å
306	F	78.3	Confident	86.8	Confident	23 Å²	23	18 Å²	18	10%	0.101	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-96.1	6	158.7	-53.4	-71.5	0	0	0	111.6	A274 V277 L302 K304 T309 I327 A329	A274-F306 HydrophobicContact CB-CB 4.23Å; A274-F306 HydrophobicContact CB-CD1 3.96Å; A274-F306 HydrophobicContact CB-CD2 4.17Å; A274-F306 HydrophobicContact CB-CE1 4.37Å; A274-F306 HydrophobicContact CB-CG 3.85Å; V277-F306 HydrophobicContact CB-CE1 4.43Å; V277-F306 HydrophobicContact CB-CZ 4.17Å; V277-F306 HydrophobicContact CG1-CZ 4.29Å; V277-F306 HydrophobicContact CG2-CE1 4.01Å; V277-F306 HydrophobicContact CG2-CZ 4.12Å; L302-F306 HydrophobicContact CD1-CE2 3.68Å; L302-F306 HydrophobicContact CD1-CZ 3.81Å; K304-F306 HydrophobicContact CD-CE1 4.15Å; K304-F306 HydrophobicContact CD-CZ 4.39Å; K304-F306 HydrophobicContact CG-CE1 4.43Å; K304-F306 HydrophobicContact CG-CZ 4.49Å; F306-T309 HydrophobicContact CB-CG2 4.43Å; F306-I327 HydrophobicContact CE2-CD1 3.72Å; F306-I327 HydrophobicContact CE2-CG1 4.45Å; F306-I327 HydrophobicContact CZ-CD1 3.77Å; F306-A329 HydrophobicContact CD2-CB 4.46Å
307	G	73.8	Confident	86.6	Confident	7 Å²	7	18.6 Å²	18.6	7%	0.072	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	-111.4	178.1	0	0	0	0	0	112.5	S305 H555	S305-G307 VanDerWaalsContact C-N 3.33Å; S305-G307 PolarHBondContact OG-N 3.32Å; S305-G307 VanDerWaalsContact OG-N 3.15Å; G307-H555 WeakPolarHBondContact CA-CE1 3.48Å; G307-H555 VanDerWaalsContact CA-NE2 3.31Å; G307-H555 WeakPolarHBondContact CA-NE2 3.23Å
308	V	66.8	Low	85.9	Confident	17 Å²	17	19 Å²	19	10%	0.103	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-45	170.9	-82.2	0	0	0	0	112.4	G170 A310 Y553	G170-V308 CarbonylContact O-C 3.59Å; G170-V308 VanDerWaalsContact O-CB 3.31Å; G170-V308 WeakPolarHBondContact O-CB 3.27Å; V308-A310 PolarHBondContact O-N 2.78Å; V308-Y553 HydrophobicContact CB-CE1 4.17Å; V308-Y553 HydrophobicContact CG1-CE1 4.15Å; V308-Y553 HydrophobicContact CG2-CD1 3.47Å; V308-Y553 VanDerWaalsContact CG2-CD1 3.47Å; V308-Y553 HydrophobicContact CG2-CE1 3.35Å
309	T	71.3	Confident	84.7	Confident	15 Å²	15	21.5 Å²	21.5	9%	0.092	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-62.1	105.2	-178.8	-55.3	0	0	0	0	109	A274 F306 G311 M312	A274-T309 HydrophobicContact CB-CG2 3.97Å; F306-T309 HydrophobicContact CB-CG2 4.43Å; T309-G311 WeakPolarHBondContact CG2-O 3.26Å; T309-M312 HydrophobicContact CG2-CE 4.4Å
310	A	82.8	Confident	83.5	Confident	11 Å²	11	23.1 Å²	23.1	9%	0.091	14%	0.138	C	C	.	.			trans	-83.3	-30.3	-174.6	0	0	0	0	0	112	V308 A329 I341	V308-A310 PolarHBondContact O-N 2.78Å; A310-A329 WeakPolarHBondContact O-CB 3.46Å; A310-A329 PolarHBondContact O-N 3.34Å; A310-I341 HydrophobicContact CB-CD1 3.93Å; A310-I341 HydrophobicContact CB-CG1 4.05Å; A310-I341 HydrophobicContact CB-CG2 4.01Å
311	G	88	Confident	82.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	-176.6	166.1	0	0	0	0	0	110.8	T309 I327 E345	T309-G311 WeakPolarHBondContact CG2-O 3.26Å; G311-I327 CarbonylContact C-O 3.58Å; G311-I327 WeakPolarHBondContact CA-O 3.24Å; G311-E345 WeakPolarHBondContact CA-OE1 3.48Å; G311-E345 PolarHBondContact N-OE1 2.61Å
312	M	89	Confident	80.5	Confident	20 Å²	20	31.7 Å²	31.7	10%	0.099	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	138	169.4	-170.3	177.8	-92.5	0	0	111	A274 G275 L278 T309 G326 I327 E345 S607 D608 P610	A274-M312 VanDerWaalsContact C-SD 3.57Å; A274-M312 HydrophobicContact CB-CB 4.03Å; A274-M312 HydrophobicContact CB-CE 3.79Å; A274-M312 HydrophobicContact CB-CG 4.49Å; A274-M312 HydrophobicContact CB-SD 3.72Å; G275-M312 WeakPolarHBondContact CA-SD 3.36Å; G275-M312 PolarHBondContact N-SD 3.27Å; L278-M312 HydrophobicContact CD2-CB 4.41Å; L278-M312 HydrophobicContact CD2-CG 3.86Å; L278-M312 HydrophobicContact CD2-SD 4.36Å; T309-M312 HydrophobicContact CG2-CE 4.4Å; M312-G326 CarbonylContact O-C 3.47Å; M312-G326 VanDerWaalsContact O-CA 3.25Å; M312-G326 WeakPolarHBondContact O-CA 3.29Å; M312-I327 HydrophobicContact CB-CD1 4.49Å; M312-I327 HydrophobicContact CB-CG1 4.06Å; M312-I327 PolarHBondContact N-O 3Å; M312-I327 PolarHBondContact O-N 2.89Å; M312-E345 WeakPolarHBondContact CA-OE2 3.48Å; M312-E345 VanDerWaalsContact N-CD 3.3Å; M312-E345 PolarHBondContact N-OE1 2.87Å; M312-E345 PolarHBondContact N-OE2 3.06Å; M312-S607 WeakPolarHBondContact CE-O 3.44Å; M312-D608 CarbonylContact C-O 3.6Å; M312-D608 WeakPolarHBondContact CA-O 3.18Å; M312-D608 WeakPolarHBondContact CG-O 3.39Å; M312-P610 HydrophobicContact CG-CG 4.19Å; M312-P610 HydrophobicContact SD-CG 3.92Å
313	A	89.8	Confident	79.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	162.6	-178.6	0	0	0	0	0	113	E345 H348 D608 P610	A313-E345 HydrophobicContact CB-CB 3.99Å; A313-E345 VanDerWaalsContact CB-O 3.26Å; A313-E345 WeakPolarHBondContact CB-O 3.49Å; A313-E345 WeakPolarHBondContact CB-OE2 3.16Å; A313-E345 PolarHBondContact N-OE2 2.87Å; A313-E345 VanDerWaalsContact N-OE2 3.08Å; A313-H348 HydrophobicContact CB-CB 3.99Å; A313-D608 PolarHBondContact N-O 3.09Å; A313-P610 WeakPolarHBondContact O-CD 3.49Å
314	F	82.8	Confident	79.5	Confident	45 Å²	45	32.9 Å²	32.9	20%	0.197	18%	0.18	C	C	.	.			trans	-89.5	144	171.1	-63.8	-73.1	0	0	0	111.4	L278 T282 T317 H323 H348 N349 P610	L278-F314 HydrophobicContact CD1-CD2 4.42Å; L278-F314 HydrophobicContact CD1-CE2 4.28Å; L278-F314 HydrophobicContact CD2-CD2 3.91Å; L278-F314 HydrophobicContact CD2-CE1 4.41Å; L278-F314 HydrophobicContact CD2-CE2 3.72Å; L278-F314 HydrophobicContact CD2-CG 4.34Å; L278-F314 HydrophobicContact CD2-CZ 3.99Å; L278-F314 HydrophobicContact CG-CD2 4.18Å; L278-F314 HydrophobicContact CG-CE2 3.7Å; L278-F314 HydrophobicContact CG-CZ 4.2Å; T282-F314 HydrophobicContact CG2-CD2 4.31Å; T282-F314 HydrophobicContact CG2-CE2 4.07Å; F314-T317 HydrophobicContact CB-CG2 3.47Å; F314-T317 VanDerWaalsContact CB-CG2 3.47Å; F314-T317 PolarHBondContact O-OG1 3.17Å; F314-H323 HydrophobicContact CD2-CB 4.05Å; F314-H323 AromaticContact CD2-CD2 3.87Å; F314-H323 AromaticContact CE2-CD2 3.75Å; F314-H323 HydrophobicContact CG-CB 4.45Å; F314-H323 AromaticContact CZ-CD2 3.95Å; F314-H348 CarbonylContact O-C 3.54Å; F314-N349 WeakPolarHBondContact O-CA 3.33Å; F314-N349 PolarHBondContact O-N 3.33Å; F314-N349 PolarHBondContact O-ND2 2.92Å; F314-P610 HydrophobicContact CD1-CG 4.16Å; F314-P610 HydrophobicContact CE1-CB 4.46Å; F314-P610 HydrophobicContact CE1-CG 3.9Å
315	V	84.4	Confident	79.7	Confident	35 Å²	35	31 Å²	31	21%	0.212	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	135.1	-177.2	-179.9	0	0	0	0	112	T317 H348 V609	V315-T317 VanDerWaalsContact C-N 3.33Å; V315-T317 PolarHBondContact O-N 3.26Å; V315-H348 CarbonylContact C-O 3.55Å; V315-H348 WeakPolarHBondContact CA-O 3.3Å; V315-H348 HydrophobicContact CG2-CB 4.02Å; V315-V609 HydrophobicContact CG2-CB 4.35Å; V315-V609 HydrophobicContact CG2-CG1 3.72Å; V315-V609 HydrophobicContact CG2-CG2 3.6Å
316	S	80.7	Confident	80.3	Confident	55 Å²	55	28.6 Å²	28.6	39%	0.385	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.7	-179	-55.2	0	0	0	0	114.7	H348 N349 G351	S316-H348 PolarHBondContact N-O 2.95Å; S316-N349 CarbonylContact C-O 3.36Å; S316-N349 WeakPolarHBondContact CA-O 3.45Å; S316-G351 VanDerWaalsContact OG-CA 3.24Å; S316-G351 WeakPolarHBondContact OG-CA 3.42Å
317	T	82.8	Confident	81.2	Confident	20 Å²	20	27.5 Å²	27.5	12%	0.123	15%	0.151	C	C	.	.			trans	-109.9	6.3	-176.4	62.7	0	0	0	0	115.3	F314 V315 S320 H323 G324 N349	F314-T317 HydrophobicContact CB-CG2 3.47Å; F314-T317 VanDerWaalsContact CB-CG2 3.47Å; F314-T317 PolarHBondContact O-OG1 3.17Å; V315-T317 VanDerWaalsContact C-N 3.33Å; V315-T317 PolarHBondContact O-N 3.26Å; T317-S320 WeakPolarHBondContact O-CB 3.43Å; T317-S320 PolarHBondContact O-N 2.83Å; T317-H323 VanDerWaalsContact CB-O 3.24Å; T317-H323 WeakPolarHBondContact CB-O 3.24Å; T317-H323 HydrophobicContact CG2-CB 3.75Å; T317-H323 PolarHBondContact OG1-O 3.18Å; T317-G324 WeakPolarHBondContact O-CA 3.49Å; T317-G324 PolarHBondContact O-N 3.05Å; T317-N349 PolarHBondContact N-O 2.75Å; T317-N349 PolarHBondContact OG1-ND2 2.98Å
318	V	79.9	Confident	82.2	Confident	10 Å²	10	27.1 Å²	27.1	6%	0.061	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	151	166	74.6	0	0	0	0	110.8	D296 S320 N349 L350 M390 L399	D296-V318 HydrophobicContact CB-CG2 4.07Å; V318-S320 PolarHBondContact O-N 2.95Å; V318-N349 HydrophobicContact CB-CB 4.34Å; V318-N349 WeakPolarHBondContact CB-O 3.19Å; V318-N349 WeakPolarHBondContact CG1-O 3.37Å; V318-N349 PolarHBondContact N-O 3.29Å; V318-L350 HydrophobicContact CB-CD2 4.31Å; V318-L350 HydrophobicContact CG1-CD2 4.17Å; V318-L350 HydrophobicContact CG2-CD2 4.08Å; V318-M390 HydrophobicContact CG1-CE 3.74Å; V318-M390 HydrophobicContact CG1-SD 3.63Å; V318-L399 HydrophobicContact CG1-CD1 3.96Å; V318-L399 HydrophobicContact CG2-CD1 4.23Å; V318-L399 HydrophobicContact CG2-CD2 3.75Å; V318-L399 HydrophobicContact CG2-CG 4.4Å
319	C	72.6	Confident	83.4	Confident	51 Å²	51	27 Å²	27	35%	0.345	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	-14.6	-166	-42.7	0	0	0	0	115.5	D296 R321 C398	D296-C319 PolarHBondContact O-N 3.19Å; C319-R321 PolarHBondContact O-N 3.14Å; C319-C398 WeakPolarHBondContact CA-SG 3.43Å; C319-C398 HydrophobicContact CB-CB 3.79Å; C319-C398 WeakPolarHBondContact CB-SG 3.38Å; C319-C398 WeakPolarHBondContact SG-CB 3.38Å; C319-C398 CovalentContact SG-SG 2.03Å; C319-C398 PolarHBondContact SG-SG 3.17Å
320	S	73.8	Confident	84.4	Confident	35 Å²	35	26.3 Å²	26.3	25%	0.245	14%	0.143	C	C	.	.			trans	-72.1	122.9	-178.8	-177.7	0	0	0	0	111.1	R285 T317 V318 S322 H323 G324	R285-S320 PolarHBondContact NH1-O 2.93Å; T317-S320 WeakPolarHBondContact O-CB 3.43Å; T317-S320 PolarHBondContact O-N 2.83Å; V318-S320 PolarHBondContact O-N 2.95Å; S320-S322 VanDerWaalsContact C-N 3.26Å; S320-S322 PolarHBondContact O-N 2.91Å; S320-S322 PolarHBondContact OG-OG 2.88Å; S320-H323 PolarHBondContact OG-N 3.28Å; S320-G324 WeakPolarHBondContact O-CA 3.29Å; S320-G324 PolarHBondContact O-N 2.93Å
321	R	70.8	Confident	84.5	Confident	145 Å²	145	28.2 Å²	28.2	55%	0.547	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-39.8	174.7	-172.2	-178.6	177.2	155.6	-0.2	112.7	R285 E286 V290 C319	R285-R321 PolarHBondContact NH1-O 2.82Å; E286-R321 HydrophobicContact CG-CG 4.06Å; E286-R321 WeakPolarHBondContact OE1-CG 3.33Å; E286-R321 IonicContact OE1-NE 3.27Å; V290-R321 HydrophobicContact CG1-CG 4.36Å; C319-R321 PolarHBondContact O-N 3.14Å
322	S	62.2	Low	84.2	Confident	34 Å²	34	31.8 Å²	31.8	24%	0.238	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-22.2	-171	52.7	0	0	0	0	115.3	T282 E286 S320	T282-S322 VanDerWaalsContact CB-O 3.25Å; T282-S322 WeakPolarHBondContact CB-O 3.41Å; T282-S322 PolarHBondContact OG1-O 3.19Å; E286-S322 VanDerWaalsContact CD-CB 3.46Å; E286-S322 WeakPolarHBondContact OE1-CB 3.27Å; E286-S322 WeakPolarHBondContact OE2-CA 3.31Å; E286-S322 WeakPolarHBondContact OE2-CB 3.44Å; S320-S322 VanDerWaalsContact C-N 3.26Å; S320-S322 PolarHBondContact O-N 2.91Å; S320-S322 PolarHBondContact OG-OG 2.88Å
323	H	80.6	Confident	83.8	Confident	77 Å²	77	34.6 Å²	34.6	36%	0.356	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	1.9	-172.2	-64	72.9	0	0	0	114.8	F314 T317 S320 G325	F314-H323 HydrophobicContact CD2-CB 4.05Å; F314-H323 AromaticContact CD2-CD2 3.87Å; F314-H323 AromaticContact CE2-CD2 3.75Å; F314-H323 HydrophobicContact CG-CB 4.45Å; F314-H323 AromaticContact CZ-CD2 3.95Å; T317-H323 VanDerWaalsContact CB-O 3.24Å; T317-H323 WeakPolarHBondContact CB-O 3.24Å; T317-H323 HydrophobicContact CG2-CB 3.75Å; T317-H323 PolarHBondContact OG1-O 3.18Å; S320-H323 PolarHBondContact OG-N 3.28Å; H323-G325 PolarHBondContact O-N 2.87Å
324	G	86.8	Confident	83.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.			trans	-73.2	81.4	178	0	0	0	0	0	112.7	R285 S297 A298 T317 S320	R285-G324 VanDerWaalsContact CD-O 3.32Å; R285-G324 WeakPolarHBondContact CD-O 3.4Å; R285-G324 PolarHBondContact NE-O 3.05Å; R285-G324 PolarHBondContact NH1-O 2.8Å; S297-G324 WeakPolarHBondContact CA-O 3.42Å; A298-G324 PolarHBondContact N-O 2.88Å; T317-G324 WeakPolarHBondContact O-CA 3.49Å; T317-G324 PolarHBondContact O-N 3.05Å; S320-G324 WeakPolarHBondContact O-CA 3.29Å; S320-G324 PolarHBondContact O-N 2.93Å
325	G	93.7	Very high	83.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	177.9	175.1	0	0	0	0	0	114.8	A298 H323 N349	A298-G325 CarbonylContact O-C 3.43Å; A298-G325 WeakPolarHBondContact O-CA 3.2Å; H323-G325 PolarHBondContact O-N 2.87Å; G325-N349 VanDerWaalsContact CA-OD1 3.29Å; G325-N349 WeakPolarHBondContact CA-OD1 3.32Å; G325-N349 PolarHBondContact N-OD1 3.47Å; G325-N349 PolarHBondContact O-ND2 3.4Å; G325-N349 PolarHBondContact O-OD1 3.27Å
326	G	95.8	Very high	83.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	170.2	178.5	0	0	0	0	0	112.3	F281 A298 Q299 L300 M312	F281-G326 WeakPolarHBondContact CE1-O 3.31Å; A298-G326 PolarHBondContact O-N 2.91Å; Q299-G326 WeakPolarHBondContact CA-O 3.37Å; Q299-G326 VanDerWaalsContact OE1-CA 3.26Å; Q299-G326 PolarHBondContact OE1-O 3.02Å; L300-G326 PolarHBondContact N-O 2.85Å; M312-G326 CarbonylContact O-C 3.47Å; M312-G326 VanDerWaalsContact O-CA 3.25Å; M312-G326 WeakPolarHBondContact O-CA 3.29Å
327	I	96.7	Very high	83.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.5	175.4	71	171	0	0	0	110.1	A274 V277 L278 F281 L300 L302 F306 G311 M312	A274-I327 HydrophobicContact CB-CD1 4.16Å; A274-I327 VanDerWaalsContact O-CD1 3.23Å; A274-I327 WeakPolarHBondContact O-CD1 3.43Å; V277-I327 HydrophobicContact CB-CD1 3.88Å; V277-I327 HydrophobicContact CG1-CD1 3.97Å; L278-I327 HydrophobicContact CB-CD1 4.25Å; L278-I327 HydrophobicContact CB-CG1 4.41Å; L278-I327 HydrophobicContact CB-CG2 4.18Å; L278-I327 HydrophobicContact CD1-CG2 4.04Å; F281-I327 HydrophobicContact CB-CG2 4.15Å; F281-I327 HydrophobicContact CD1-CG2 3.97Å; F281-I327 HydrophobicContact CG-CG2 4.28Å; L300-I327 HydrophobicContact CB-CB 4.33Å; L300-I327 HydrophobicContact CB-CG2 3.99Å; L300-I327 HydrophobicContact CD2-CG2 4.14Å; L300-I327 CarbonylContact O-C 3.53Å; L302-I327 HydrophobicContact CD1-CB 3.96Å; L302-I327 HydrophobicContact CD1-CD1 4.26Å; L302-I327 HydrophobicContact CD1-CG1 4.49Å; F306-I327 HydrophobicContact CE2-CD1 3.72Å; F306-I327 HydrophobicContact CE2-CG1 4.45Å; F306-I327 HydrophobicContact CZ-CD1 3.77Å; G311-I327 CarbonylContact C-O 3.58Å; G311-I327 WeakPolarHBondContact CA-O 3.24Å; M312-I327 HydrophobicContact CB-CD1 4.49Å; M312-I327 HydrophobicContact CB-CG1 4.06Å; M312-I327 PolarHBondContact N-O 3Å; M312-I327 PolarHBondContact O-N 2.89Å
328	N	95.1	Very high	83.7	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	126.9	-167.9	-59.8	-99.8	0	0	0	110.9	Q299 L300 I301 L302 F338 V342 E345	Q299-N328 PolarHBondContact OE1-ND2 2.82Å; L300-N328 PolarHBondContact O-N 2.81Å; L300-N328 PolarHBondContact O-ND2 2.98Å; I301-N328 HydrophobicContact CD1-CB 4.09Å; L302-N328 PolarHBondContact N-O 3.15Å; N328-F338 HydrophobicContact CB-CE2 3.83Å; N328-F338 HydrophobicContact CB-CZ 3.56Å; N328-V342 HydrophobicContact CB-CG2 4.27Å; N328-V342 VanDerWaalsContact OD1-CA 3.27Å; N328-V342 WeakPolarHBondContact OD1-CA 3.25Å; N328-V342 PolarHBondContact OD1-N 3.33Å; N328-E345 VanDerWaalsContact OD1-CG 3.28Å; N328-E345 WeakPolarHBondContact OD1-CG 3.3Å
329	A	91.9	Very high	84.2	Confident	13 Å²	13	29.6 Å²	29.6	11%	0.107	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	103.5	-177.1	0	0	0	0	0	112.1	K304 F306 A310	K304-A329 WeakPolarHBondContact O-CB 3.4Å; F306-A329 HydrophobicContact CD2-CB 4.46Å; A310-A329 WeakPolarHBondContact O-CB 3.46Å; A310-A329 PolarHBondContact O-N 3.34Å
330	F	91.7	Very high	85	Confident	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.147	C	C	.	.			trans	-108.9	83.2	-177.5	-164.1	-165.7	0	0	0	112.2	R221 Q235 M236 I301 L302 M303 N332 V335 F338	R221-F330 PolarHBondContact NH1-O 3.45Å; R221-F330 VanDerWaalsContact NH2-CE1 3.26Å; Q235-F330 HydrophobicContact CG-CE1 4.5Å; M236-F330 HydrophobicContact CE-CD1 4.42Å; M236-F330 HydrophobicContact CE-CE1 4.2Å; I301-F330 HydrophobicContact CG2-CB 3.87Å; I301-F330 HydrophobicContact CG2-CD1 3.92Å; I301-F330 HydrophobicContact CG2-CG 4.41Å; L302-F330 PolarHBondContact O-N 3.32Å; M303-F330 VanDerWaalsContact SD-O 3.37Å; F330-N332 WeakPolarHBondContact CD2-O 3.47Å; F330-N332 VanDerWaalsContact CE2-O 3.26Å; F330-N332 WeakPolarHBondContact CE2-O 3.37Å; F330-V335 HydrophobicContact CZ-CG2 4.21Å; F330-F338 HydrophobicContact CB-CD1 4.25Å; F330-F338 HydrophobicContact CB-CD2 3.94Å; F330-F338 HydrophobicContact CB-CE1 3.89Å; F330-F338 HydrophobicContact CB-CE2 3.58Å; F330-F338 HydrophobicContact CB-CG 4.28Å; F330-F338 HydrophobicContact CB-CZ 3.56Å; F330-F338 AromaticContact CD1-CD1 3.58Å; F330-F338 HydrophobicContact CD1-CD1 3.58Å; F330-F338 AromaticContact CD1-CE1 3.63Å; F330-F338 HydrophobicContact CD1-CE1 3.63Å; F330-F338 HydrophobicContact CD1-CG 4.11Å; F330-F338 HydrophobicContact CD1-CZ 4.22Å; F330-F338 HydrophobicContact CD2-CB 3.82Å; F330-F338 AromaticContact CD2-CD1 3.86Å; F330-F338 HydrophobicContact CD2-CD1 3.86Å; F330-F338 AromaticContact CD2-CD2 3.7Å; F330-F338 HydrophobicContact CD2-CD2 3.7Å; F330-F338 HydrophobicContact CD2-CE1 4.38Å; F330-F338 HydrophobicContact CD2-CE2 4.27Å; F330-F338 AromaticContact CD2-CG 3.49Å; F330-F338 HydrophobicContact CD2-CG 3.49Å; F330-F338 VanDerWaalsContact CD2-CG 3.49Å; F330-F338 AromaticContact CE1-CD1 3.79Å; F330-F338 HydrophobicContact CE1-CD1 3.79Å; F330-F338 HydrophobicContact CE1-CE1 4.23Å; F330-F338 HydrophobicContact CE1-CG 4.34Å; F330-F338 HydrophobicContact CE2-CB 3.61Å; F330-F338 HydrophobicContact CE2-CD1 4.05Å; F330-F338 HydrophobicContact CE2-CD2 4.38Å; F330-F338 AromaticContact CE2-CG 3.75Å; F330-F338 HydrophobicContact CE2-CG 3.75Å; F330-F338 HydrophobicContact CG-CB 4.48Å; F330-F338 AromaticContact CG-CD1 3.64Å; F330-F338 HydrophobicContact CG-CD1 3.64Å; F330-F338 AromaticContact CG-CD2 3.85Å; F330-F338 HydrophobicContact CG-CD2 3.85Å; F330-F338 AromaticContact CG-CE1 3.73Å; F330-F338 HydrophobicContact CG-CE1 3.73Å; F330-F338 AromaticContact CG-CE2 3.96Å; F330-F338 HydrophobicContact CG-CE2 3.96Å; F330-F338 AromaticContact CG-CG 3.71Å; F330-F338 HydrophobicContact CG-CG 3.71Å; F330-F338 AromaticContact CG-CZ 3.91Å; F330-F338 HydrophobicContact CG-CZ 3.91Å; F330-F338 HydrophobicContact CZ-CB 4.1Å; F330-F338 HydrophobicContact CZ-CD1 4.03Å; F330-F338 HydrophobicContact CZ-CG 4.18Å
331	L	85.8	Confident	85.7	Confident	51 Å²	51	27.4 Å²	27.4	27%	0.267	14%	0.143	S	C	.	.			trans	-91.5	-13	-174.5	-56.7	-172	0	0	0	115.7	M303	M303-L331 VanDerWaalsContact C-CD2 3.48Å; M303-L331 HydrophobicContact SD-CD2 4.24Å
332	N	80.4	Confident	86.9	Confident	75 Å²	75	20.5 Å²	20.5	40%	0.401	12%	0.117	S	C	.	.	S	Bend	trans	-117.1	-162.5	177.9	69.5	30.6	0	0	0	110.1	R221 F330 N334	R221-N332 PolarHBondContact NH1-O 2.72Å; R221-N332 PolarHBondContact NH2-O 3.14Å; F330-N332 WeakPolarHBondContact CD2-O 3.47Å; F330-N332 VanDerWaalsContact CE2-O 3.26Å; F330-N332 WeakPolarHBondContact CE2-O 3.37Å; N332-N334 PolarHBondContact OD1-N 3.25Å
333	N	80.9	Confident	88.4	Confident	80 Å²	80	18.9 Å²	18.9	43%	0.428	11%	0.106	S	C	.	.	S	Bend	trans	-120.1	10.9	176.3	-76.9	-52.1	0	0	0	114	R221 H224 Q235 V335	R221-N333 PolarHBondContact NH2-OD1 3.24Å; H224-N333 PolarHBondContact NE2-ND2 2.92Å; H224-N333 PolarHBondContact NE2-OD1 3.25Å; Q235-N333 PolarHBondContact NE2-OD1 3.07Å; N333-V335 PolarHBondContact O-N 3.42Å
334	N	82.7	Confident	89	Confident	9 Å²	9	15.8 Å²	15.8	5%	0.048	9%	0.091	C	C	.	.			trans	-79.9	89.7	176.8	-169.4	-52	0	0	0	109.9	H35 N332 A336 A337 F338	H35-N334 PolarHBondContact CD2-ND2 2.93Å; H35-N334 VanDerWaalsContact CD2-ND2 3.34Å; H35-N334 PolarHBondContact NE2-ND2 2.91Å; N332-N334 PolarHBondContact OD1-N 3.25Å; N334-A336 PolarHBondContact O-N 2.84Å; N334-A336 PolarHBondContact OD1-N 3.05Å; N334-A337 HydrophobicContact CB-CB 4.35Å; N334-A337 PolarHBondContact O-N 3.34Å; N334-A337 WeakPolarHBondContact OD1-CB 3.09Å; N334-A337 PolarHBondContact OD1-N 2.66Å; N334-F338 WeakPolarHBondContact O-CB 3.32Å; N334-F338 PolarHBondContact O-N 2.85Å; N334-F338 VanDerWaalsContact O-N 3.07Å
335	V	86.4	Confident	89.4	Confident	9 Å²	9	16 Å²	16	6%	0.055	9%	0.092	C	C	.	.	H	α-helix	trans	-62.8	-32	-179.5	-166.3	0	0	0	0	111.6	Q235 L239 L242 F330 N333 F338 A339	Q235-V335 HydrophobicContact CG-CG2 3.76Å; L239-V335 HydrophobicContact CB-CG1 3.76Å; L239-V335 HydrophobicContact CD1-CG1 4.01Å; L239-V335 HydrophobicContact CG-CG1 4.46Å; L242-V335 HydrophobicContact CD1-CG1 4.15Å; F330-V335 HydrophobicContact CZ-CG2 4.21Å; N333-V335 PolarHBondContact O-N 3.42Å; V335-F338 PolarHBondContact O-N 3Å; V335-A339 WeakPolarHBondContact O-CB 3.46Å; V335-A339 PolarHBondContact O-N 2.87Å
336	A	81.8	Confident	89.5	Confident	9 Å²	9	16 Å²	16	7%	0.074	9%	0.092	C	C	.	.	H	α-helix	trans	-67.5	-43.3	-179.3	0	0	0	0	0	112.3	V136 L161 N334 K377	V136-A336 HydrophobicContact CG1-CB 3.78Å; L161-A336 HydrophobicContact CD2-CB 4.21Å; N334-A336 PolarHBondContact O-N 2.84Å; N334-A336 PolarHBondContact OD1-N 3.05Å; A336-K377 WeakPolarHBondContact O-CE 3.35Å; A336-K377 PolarHBondContact O-NZ 2.91Å
337	A	81.4	Confident	89.5	Confident	27 Å²	27	16 Å²	16	22%	0.223	9%	0.092	C	C	.	.	H	α-helix	trans	-65.8	-47.1	171	0	0	0	0	0	110.8	N334 A339 S340	N334-A337 HydrophobicContact CB-CB 4.35Å; N334-A337 PolarHBondContact O-N 3.34Å; N334-A337 WeakPolarHBondContact OD1-CB 3.09Å; N334-A337 PolarHBondContact OD1-N 2.66Å; A337-A339 VanDerWaalsContact C-N 3.26Å; A337-A339 PolarHBondContact O-N 3.08Å; A337-S340 WeakPolarHBondContact O-CB 3.46Å; A337-S340 PolarHBondContact O-N 2.89Å
338	F	87.7	Confident	89.3	Confident	4 Å²	4	16 Å²	16	2%	0.018	9%	0.092	C	C	.	.	H	α-helix	trans	-61.4	-31.2	-177.9	-173.1	-118	0	0	0	113.7	L239 I301 N328 F330 N334 V335 S340 I341 V342	L239-F338 HydrophobicContact CD1-CD1 3.85Å; L239-F338 HydrophobicContact CD1-CE1 4.41Å; L239-F338 HydrophobicContact CD2-CD1 3.81Å; L239-F338 HydrophobicContact CD2-CE1 3.66Å; L239-F338 HydrophobicContact CG-CD1 4.5Å; I301-F338 HydrophobicContact CD1-CE1 3.95Å; I301-F338 HydrophobicContact CD1-CZ 3.9Å; I301-F338 HydrophobicContact CG2-CE1 3.88Å; I301-F338 HydrophobicContact CG2-CZ 3.92Å; N328-F338 HydrophobicContact CB-CE2 3.83Å; N328-F338 HydrophobicContact CB-CZ 3.56Å; F330-F338 HydrophobicContact CB-CD1 4.25Å; F330-F338 HydrophobicContact CB-CD2 3.94Å; F330-F338 HydrophobicContact CB-CE1 3.89Å; F330-F338 HydrophobicContact CB-CE2 3.58Å; F330-F338 HydrophobicContact CB-CG 4.28Å; F330-F338 HydrophobicContact CB-CZ 3.56Å; F330-F338 AromaticContact CD1-CD1 3.58Å; F330-F338 HydrophobicContact CD1-CD1 3.58Å; F330-F338 AromaticContact CD1-CE1 3.63Å; F330-F338 HydrophobicContact CD1-CE1 3.63Å; F330-F338 HydrophobicContact CD1-CG 4.11Å; F330-F338 HydrophobicContact CD1-CZ 4.22Å; F330-F338 HydrophobicContact CD2-CB 3.82Å; F330-F338 AromaticContact CD2-CD1 3.86Å; F330-F338 HydrophobicContact CD2-CD1 3.86Å; F330-F338 AromaticContact CD2-CD2 3.7Å; F330-F338 HydrophobicContact CD2-CD2 3.7Å; F330-F338 HydrophobicContact CD2-CE1 4.38Å; F330-F338 HydrophobicContact CD2-CE2 4.27Å; F330-F338 AromaticContact CD2-CG 3.49Å; F330-F338 HydrophobicContact CD2-CG 3.49Å; F330-F338 VanDerWaalsContact CD2-CG 3.49Å; F330-F338 AromaticContact CE1-CD1 3.79Å; F330-F338 HydrophobicContact CE1-CD1 3.79Å; F330-F338 HydrophobicContact CE1-CE1 4.23Å; F330-F338 HydrophobicContact CE1-CG 4.34Å; F330-F338 HydrophobicContact CE2-CB 3.61Å; F330-F338 HydrophobicContact CE2-CD1 4.05Å; F330-F338 HydrophobicContact CE2-CD2 4.38Å; F330-F338 AromaticContact CE2-CG 3.75Å; F330-F338 HydrophobicContact CE2-CG 3.75Å; F330-F338 HydrophobicContact CG-CB 4.48Å; F330-F338 AromaticContact CG-CD1 3.64Å; F330-F338 HydrophobicContact CG-CD1 3.64Å; F330-F338 AromaticContact CG-CD2 3.85Å; F330-F338 HydrophobicContact CG-CD2 3.85Å; F330-F338 AromaticContact CG-CE1 3.73Å; F330-F338 HydrophobicContact CG-CE1 3.73Å; F330-F338 AromaticContact CG-CE2 3.96Å; F330-F338 HydrophobicContact CG-CE2 3.96Å; F330-F338 AromaticContact CG-CG 3.71Å; F330-F338 HydrophobicContact CG-CG 3.71Å; F330-F338 AromaticContact CG-CZ 3.91Å; F330-F338 HydrophobicContact CG-CZ 3.91Å; F330-F338 HydrophobicContact CZ-CB 4.1Å; F330-F338 HydrophobicContact CZ-CD1 4.03Å; F330-F338 HydrophobicContact CZ-CG 4.18Å; N334-F338 WeakPolarHBondContact O-CB 3.32Å; N334-F338 PolarHBondContact O-N 2.85Å; N334-F338 VanDerWaalsContact O-N 3.07Å; V335-F338 PolarHBondContact O-N 3Å; F338-S340 PolarHBondContact O-N 3.49Å; F338-I341 HydrophobicContact CD2-CB 4.36Å; F338-I341 HydrophobicContact CD2-CD1 4.01Å; F338-I341 HydrophobicContact CE2-CB 4.49Å; F338-I341 PolarHBondContact O-N 3.39Å; F338-V342 HydrophobicContact CD1-CG2 4.05Å; F338-V342 HydrophobicContact CE1-CG2 3.52Å; F338-V342 HydrophobicContact CE2-CG2 4.2Å; F338-V342 HydrophobicContact CZ-CG2 3.58Å; F338-V342 PolarHBondContact O-N 3.01Å
339	A	90.4	Very high	89.2	Confident	1 Å²	1	16 Å²	16	1%	0.008	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-24.7	173.3	0	0	0	0	0	114.1	L239 L242 I243 I246 V335 A337 A343	L239-A339 HydrophobicContact CD1-CB 3.91Å; L242-A339 HydrophobicContact CB-CB 3.73Å; L242-A339 HydrophobicContact CD1-CB 4.17Å; I243-A339 HydrophobicContact CG1-CB 4.36Å; I246-A339 HydrophobicContact CD1-CB 4.35Å; V335-A339 WeakPolarHBondContact O-CB 3.46Å; V335-A339 PolarHBondContact O-N 2.87Å; A337-A339 VanDerWaalsContact C-N 3.26Å; A337-A339 PolarHBondContact O-N 3.08Å; A339-A343 WeakPolarHBondContact O-CB 3.2Å; A339-A343 PolarHBondContact O-N 3.2Å; A339-A343 VanDerWaalsContact O-N 3.14Å
340	S	87.8	Confident	89.2	Confident	11 Å²	11	15.3 Å²	15.3	8%	0.077	9%	0.087	C	C	.	.	H	α-helix	trans	-66.6	-40.7	170.1	-78.4	0	0	0	0	112	A337 F338 A343 H344 G375 S376 K377	A337-S340 WeakPolarHBondContact O-CB 3.46Å; A337-S340 PolarHBondContact O-N 2.89Å; F338-S340 PolarHBondContact O-N 3.49Å; S340-A343 PolarHBondContact O-N 3.49Å; S340-H344 WeakPolarHBondContact O-CB 3.36Å; S340-H344 PolarHBondContact O-N 2.94Å; S340-G375 PolarHBondContact OG-O 3.01Å; S340-G375 VanDerWaalsContact OG-O 3.12Å; S340-S376 PolarHBondContact OG-O 2.98Å; S340-K377 PolarHBondContact OG-NZ 2.85Å
341	I	89.9	Confident	88.9	Confident	29 Å²	29	15.4 Å²	15.4	15%	0.149	9%	0.088	C	C	.	.	H	α-helix	trans	-67.6	-52.6	-174.7	-62.4	161.3	0	0	0	108.7	A310 F338 A343 H344 E345	A310-I341 HydrophobicContact CB-CD1 3.93Å; A310-I341 HydrophobicContact CB-CG1 4.05Å; A310-I341 HydrophobicContact CB-CG2 4.01Å; F338-I341 HydrophobicContact CD2-CB 4.36Å; F338-I341 HydrophobicContact CD2-CD1 4.01Å; F338-I341 HydrophobicContact CE2-CB 4.49Å; F338-I341 PolarHBondContact O-N 3.39Å; I341-A343 PolarHBondContact O-N 2.92Å; I341-H344 WeakPolarHBondContact O-CA 3.39Å; I341-H344 WeakPolarHBondContact O-CB 3.29Å; I341-H344 PolarHBondContact O-N 3.24Å; I341-E345 WeakPolarHBondContact O-CG 3.28Å; I341-E345 PolarHBondContact O-N 3.48Å
342	V	94.8	Very high	89.2	Confident	0 Å²	0	13 Å²	13	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.6	-32.1	177.6	-167.5	0	0	0	0	112.1	L239 I243 Q299 I301 N328 F338 L346	L239-V342 HydrophobicContact CD1-CG2 4.4Å; L239-V342 HydrophobicContact CD2-CG2 4.36Å; I243-V342 HydrophobicContact CD1-CB 3.71Å; I243-V342 HydrophobicContact CD1-CG1 3.56Å; I243-V342 HydrophobicContact CD1-CG2 4.48Å; I243-V342 HydrophobicContact CG1-CB 4.39Å; Q299-V342 HydrophobicContact CB-CG1 4.08Å; Q299-V342 HydrophobicContact CG-CG1 3.97Å; I301-V342 HydrophobicContact CD1-CG2 4.22Å; N328-V342 HydrophobicContact CB-CG2 4.27Å; N328-V342 VanDerWaalsContact OD1-CA 3.27Å; N328-V342 WeakPolarHBondContact OD1-CA 3.25Å; N328-V342 PolarHBondContact OD1-N 3.33Å; F338-V342 HydrophobicContact CD1-CG2 4.05Å; F338-V342 HydrophobicContact CE1-CG2 3.52Å; F338-V342 HydrophobicContact CE2-CG2 4.2Å; F338-V342 HydrophobicContact CZ-CG2 3.58Å; F338-V342 PolarHBondContact O-N 3.01Å; V342-L346 WeakPolarHBondContact O-CB 3.08Å; V342-L346 PolarHBondContact O-N 2.77Å; V342-L346 VanDerWaalsContact O-N 3.07Å
343	A	94.3	Very high	89.5	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-69.5	-34.7	173.1	0	0	0	0	0	113.1	I246 Y247 A339 S340 I341 G347 I368	I246-A343 HydrophobicContact CD1-CB 4.01Å; I246-A343 HydrophobicContact CG2-CB 3.95Å; Y247-A343 HydrophobicContact CE2-CB 3.98Å; Y247-A343 PolarHBondContact OH-O 3.38Å; A339-A343 WeakPolarHBondContact O-CB 3.2Å; A339-A343 PolarHBondContact O-N 3.2Å; A339-A343 VanDerWaalsContact O-N 3.14Å; S340-A343 PolarHBondContact O-N 3.49Å; I341-A343 PolarHBondContact O-N 2.92Å; A343-G347 PolarHBondContact O-N 3.4Å; A343-I368 HydrophobicContact CB-CG2 4.47Å
344	H	93.4	Very high	89.9	Confident	13 Å²	13	7.3 Å²	7.3	6%	0.06	5%	0.045	C	C	.	.	H	α-helix	trans	-67.2	-50.4	174.9	-170.2	118.9	0	0	0	111.4	S340 I341 L346 G347 H348 H354 I368 H370 D608	S340-H344 WeakPolarHBondContact O-CB 3.36Å; S340-H344 PolarHBondContact O-N 2.94Å; I341-H344 WeakPolarHBondContact O-CA 3.39Å; I341-H344 WeakPolarHBondContact O-CB 3.29Å; I341-H344 PolarHBondContact O-N 3.24Å; H344-L346 VanDerWaalsContact C-N 3.33Å; H344-L346 PolarHBondContact O-N 2.86Å; H344-G347 CarbonylContact O-C 3.57Å; H344-G347 VanDerWaalsContact O-CA 3.26Å; H344-G347 WeakPolarHBondContact O-CA 3.45Å; H344-G347 PolarHBondContact O-N 2.68Å; H344-H348 AromaticContact CD2-CD2 3.78Å; H344-H348 AromaticContact CD2-NE2 3.45Å; H344-H348 PolarHBondContact CD2-NE2 2.82Å; H344-H348 AromaticContact NE2-CD2 4Å; H344-H348 AromaticContact NE2-CE1 3.54Å; H344-H348 AromaticContact NE2-NE2 3.18Å; H344-H348 PolarHBondContact NE2-NE2 3.31Å; H344-H348 VanDerWaalsContact NE2-NE2 3.18Å; H344-H348 PolarHBondContact O-N 2.92Å; H344-H354 AromaticContact CE1-CD2 3.53Å; H344-H354 AromaticContact CE1-NE2 3.29Å; H344-H354 PolarHBondContact CE1-NE2 2.87Å; H344-H354 VanDerWaalsContact CE1-NE2 3.29Å; H344-H354 AromaticContact NE2-CD2 3.38Å; H344-H354 PolarHBondContact NE2-CD2 3.23Å; H344-H354 AromaticContact NE2-NE2 2.94Å; H344-H354 PolarHBondContact NE2-NE2 3.11Å; H344-I368 HydrophobicContact CB-CG2 4.13Å; H344-I368 PolarHBondContact ND1-O 3Å; H344-H370 PolarHBondContact CE1-O 2.84Å; H344-H370 VanDerWaalsContact CE1-O 3.29Å; H344-D608 IonicContact CD2-OD2 3.83Å; H344-D608 IonicContact CE1-OD2 2.71Å; H344-D608 IonicContact NE2-OD2 3.49Å; H344-D608 PolarHBondContact NE2-OD2 2.77Å
345	E	95.3	Very high	89.9	Confident	3 Å²	3	7.6 Å²	7.6	1%	0.014	5%	0.046	C	C	.	.	H	α-helix	trans	-63.5	-38.4	179.5	-58.8	-47.1	149.8	0	0	112.3	G311 M312 A313 N328 I341 G347 H348 N349	G311-E345 WeakPolarHBondContact CA-OE1 3.48Å; G311-E345 PolarHBondContact N-OE1 2.61Å; M312-E345 WeakPolarHBondContact CA-OE2 3.48Å; M312-E345 VanDerWaalsContact N-CD 3.3Å; M312-E345 PolarHBondContact N-OE1 2.87Å; M312-E345 PolarHBondContact N-OE2 3.06Å; A313-E345 HydrophobicContact CB-CB 3.99Å; A313-E345 VanDerWaalsContact CB-O 3.26Å; A313-E345 WeakPolarHBondContact CB-O 3.49Å; A313-E345 WeakPolarHBondContact CB-OE2 3.16Å; A313-E345 PolarHBondContact N-OE2 2.87Å; A313-E345 VanDerWaalsContact N-OE2 3.08Å; N328-E345 VanDerWaalsContact OD1-CG 3.28Å; N328-E345 WeakPolarHBondContact OD1-CG 3.3Å; I341-E345 WeakPolarHBondContact O-CG 3.28Å; I341-E345 PolarHBondContact O-N 3.48Å; E345-G347 VanDerWaalsContact C-N 3.26Å; E345-G347 PolarHBondContact O-N 3.21Å; E345-H348 PolarHBondContact O-N 3.39Å; E345-H348 IonicContact OE2-CD2 3.63Å; E345-N349 PolarHBondContact O-N 2.87Å
346	L	96.3	Very high	89.5	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-67.4	-29.4	170.7	-173.2	59.5	0	0	0	111.8	V211 I243 Y247 V254 V342 H344 N349 L350	V211-L346 HydrophobicContact CG1-CD1 4.19Å; V211-L346 HydrophobicContact CG1-CD2 4.36Å; I243-L346 HydrophobicContact CG2-CD2 4.29Å; Y247-L346 HydrophobicContact CD2-CD2 4.45Å; Y247-L346 HydrophobicContact CE2-CB 4.39Å; Y247-L346 HydrophobicContact CE2-CD2 3.91Å; Y247-L346 HydrophobicContact CE2-CG 4.31Å; V254-L346 HydrophobicContact CG1-CD2 4.45Å; V254-L346 HydrophobicContact CG2-CD2 4.2Å; V342-L346 WeakPolarHBondContact O-CB 3.08Å; V342-L346 PolarHBondContact O-N 2.77Å; V342-L346 VanDerWaalsContact O-N 3.07Å; H344-L346 VanDerWaalsContact C-N 3.33Å; H344-L346 PolarHBondContact O-N 2.86Å; L346-N349 HydrophobicContact CD1-CB 4.44Å; L346-N349 WeakPolarHBondContact O-CB 3.19Å; L346-N349 PolarHBondContact O-N 3.07Å; L346-L350 HydrophobicContact CG-CD1 4.01Å; L346-L350 WeakPolarHBondContact O-CB 3.31Å; L346-L350 VanDerWaalsContact O-CG 3.32Å; L346-L350 WeakPolarHBondContact O-CG 3.17Å; L346-L350 PolarHBondContact O-N 3.04Å
347	G	95	Very high	89.1	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.8	-42	176.5	0	0	0	0	0	111.7	Y247 A343 H344 E345 L350 G351 M352	Y247-G347 WeakPolarHBondContact OH-CA 3.24Å; Y247-G347 PolarHBondContact OH-N 3.45Å; A343-G347 PolarHBondContact O-N 3.4Å; H344-G347 CarbonylContact O-C 3.57Å; H344-G347 VanDerWaalsContact O-CA 3.26Å; H344-G347 WeakPolarHBondContact O-CA 3.45Å; H344-G347 PolarHBondContact O-N 2.68Å; E345-G347 VanDerWaalsContact C-N 3.26Å; E345-G347 PolarHBondContact O-N 3.21Å; G347-L350 CarbonylContact O-C 3.52Å; G347-L350 VanDerWaalsContact O-C 3.29Å; G347-L350 WeakPolarHBondContact O-CA 3.26Å; G347-L350 PolarHBondContact O-N 3.29Å; G347-G351 PolarHBondContact O-N 3.43Å; G347-G351 VanDerWaalsContact O-N 3.14Å; G347-M352 VanDerWaalsContact O-CB 3.31Å; G347-M352 WeakPolarHBondContact O-CB 3.43Å; G347-M352 WeakPolarHBondContact O-CG 3.48Å; G347-M352 PolarHBondContact O-N 3.03Å
348	H	91.9	Very high	89	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.5	-50.8	167.9	-72	-35.1	0	0	0	111.5	A313 F314 V315 S316 H344 E345 L350 G351 M352 H354 M369 D608 V609	A313-H348 HydrophobicContact CB-CB 3.99Å; F314-H348 CarbonylContact O-C 3.54Å; V315-H348 CarbonylContact C-O 3.55Å; V315-H348 WeakPolarHBondContact CA-O 3.3Å; V315-H348 HydrophobicContact CG2-CB 4.02Å; S316-H348 PolarHBondContact N-O 2.95Å; H344-H348 AromaticContact CD2-CD2 3.78Å; H344-H348 AromaticContact CD2-NE2 3.45Å; H344-H348 PolarHBondContact CD2-NE2 2.82Å; H344-H348 AromaticContact NE2-CD2 4Å; H344-H348 AromaticContact NE2-CE1 3.54Å; H344-H348 AromaticContact NE2-NE2 3.18Å; H344-H348 PolarHBondContact NE2-NE2 3.31Å; H344-H348 VanDerWaalsContact NE2-NE2 3.18Å; H344-H348 PolarHBondContact O-N 2.92Å; E345-H348 PolarHBondContact O-N 3.39Å; E345-H348 IonicContact OE2-CD2 3.63Å; H348-L350 PolarHBondContact O-N 2.7Å; H348-G351 WeakPolarHBondContact O-CA 3.47Å; H348-G351 PolarHBondContact O-N 3Å; H348-M352 PolarHBondContact ND1-O 3.03Å; H348-H354 AromaticContact CE1-CD2 3.62Å; H348-H354 AromaticContact CE1-NE2 3.62Å; H348-H354 AromaticContact NE2-NE2 3.63Å; H348-M369 WeakPolarHBondContact ND1-CE 3.32Å; H348-D608 IonicContact NE2-OD1 2.79Å; H348-D608 IonicContact NE2-OD2 2.69Å; H348-V609 WeakPolarHBondContact CE1-CG2 3.42Å; H348-V609 VanDerWaalsContact NE2-CG2 3.32Å; H348-V609 WeakPolarHBondContact NE2-CG2 3.08Å
349	N	92.9	Very high	88.9	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.6	-37.9	176.2	-67.7	167.1	0	0	0	112	S297 Q299 F314 S316 T317 V318 G325 E345 L346 G351	S297-N349 PolarHBondContact OG-OD1 2.89Å; Q299-N349 PolarHBondContact NE2-OD1 3.12Å; Q299-N349 VanDerWaalsContact NE2-OD1 3.14Å; F314-N349 WeakPolarHBondContact O-CA 3.33Å; F314-N349 PolarHBondContact O-N 3.33Å; F314-N349 PolarHBondContact O-ND2 2.92Å; S316-N349 CarbonylContact C-O 3.36Å; S316-N349 WeakPolarHBondContact CA-O 3.45Å; T317-N349 PolarHBondContact N-O 2.75Å; T317-N349 PolarHBondContact OG1-ND2 2.98Å; V318-N349 HydrophobicContact CB-CB 4.34Å; V318-N349 WeakPolarHBondContact CB-O 3.19Å; V318-N349 WeakPolarHBondContact CG1-O 3.37Å; V318-N349 PolarHBondContact N-O 3.29Å; G325-N349 VanDerWaalsContact CA-OD1 3.29Å; G325-N349 WeakPolarHBondContact CA-OD1 3.32Å; G325-N349 PolarHBondContact N-OD1 3.47Å; G325-N349 PolarHBondContact O-ND2 3.4Å; G325-N349 PolarHBondContact O-OD1 3.27Å; E345-N349 PolarHBondContact O-N 2.87Å; L346-N349 HydrophobicContact CD1-CB 4.44Å; L346-N349 WeakPolarHBondContact O-CB 3.19Å; L346-N349 PolarHBondContact O-N 3.07Å; N349-G351 PolarHBondContact O-N 3.38Å
350	L	92.7	Very high	88.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	13.4	174.3	-67.5	164.4	0	0	0	114.3	V211 Y247 V318 L346 G347 H348 M352 F387 M390 L399	V211-L350 HydrophobicContact CG2-CD1 4.37Å; V211-L350 HydrophobicContact CG2-CD2 4.15Å; Y247-L350 HydrophobicContact CD1-CD1 4.09Å; Y247-L350 HydrophobicContact CE1-CD1 3.28Å; V318-L350 HydrophobicContact CB-CD2 4.31Å; V318-L350 HydrophobicContact CG1-CD2 4.17Å; V318-L350 HydrophobicContact CG2-CD2 4.08Å; L346-L350 HydrophobicContact CG-CD1 4.01Å; L346-L350 WeakPolarHBondContact O-CB 3.31Å; L346-L350 VanDerWaalsContact O-CG 3.32Å; L346-L350 WeakPolarHBondContact O-CG 3.17Å; L346-L350 PolarHBondContact O-N 3.04Å; G347-L350 CarbonylContact O-C 3.52Å; G347-L350 VanDerWaalsContact O-C 3.29Å; G347-L350 WeakPolarHBondContact O-CA 3.26Å; G347-L350 PolarHBondContact O-N 3.29Å; H348-L350 PolarHBondContact O-N 2.7Å; L350-M352 HydrophobicContact CB-CE 4.06Å; L350-M352 HydrophobicContact CD1-CE 4.45Å; L350-F387 HydrophobicContact CB-CD2 4.14Å; L350-F387 HydrophobicContact CB-CE2 4.5Å; L350-F387 HydrophobicContact CD2-CD2 4.4Å; L350-F387 HydrophobicContact CD2-CE2 3.92Å; L350-M390 HydrophobicContact CD2-CE 4.37Å; L350-L399 HydrophobicContact CD2-CD1 3.7Å
351	G	85.6	Confident	88.8	Confident	3 Å²	3	28.1 Å²	28.1	3%	0.031	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	3.3	169	0	0	0	0	0	116.2	S316 G347 H348 N349 N353	S316-G351 VanDerWaalsContact OG-CA 3.24Å; S316-G351 WeakPolarHBondContact OG-CA 3.42Å; G347-G351 PolarHBondContact O-N 3.43Å; G347-G351 VanDerWaalsContact O-N 3.14Å; H348-G351 WeakPolarHBondContact O-CA 3.47Å; H348-G351 PolarHBondContact O-N 3Å; N349-G351 PolarHBondContact O-N 3.38Å; G351-N353 PolarHBondContact O-ND2 3.17Å
352	M	91.5	Very high	88.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-76.2	131.9	-179.9	-50.2	-179.7	-151.5	0	0	111.1	Y247 L250 G347 H348 L350 M369 F379 F387	Y247-M352 HydrophobicContact CE1-CE 3.89Å; L250-M352 HydrophobicContact CD1-CE 3.33Å; L250-M352 HydrophobicContact CD1-SD 4.14Å; G347-M352 VanDerWaalsContact O-CB 3.31Å; G347-M352 WeakPolarHBondContact O-CB 3.43Å; G347-M352 WeakPolarHBondContact O-CG 3.48Å; G347-M352 PolarHBondContact O-N 3.03Å; H348-M352 PolarHBondContact ND1-O 3.03Å; L350-M352 HydrophobicContact CB-CE 4.06Å; L350-M352 HydrophobicContact CD1-CE 4.45Å; M352-M369 HydrophobicContact CB-CE 4.02Å; M352-M369 HydrophobicContact CB-CG 3.99Å; M352-M369 HydrophobicContact CB-SD 4.1Å; M352-M369 HydrophobicContact SD-CG 4.11Å; M352-M369 HydrophobicContact SD-SD 4.2Å; M352-F379 HydrophobicContact CE-CD1 4.5Å; M352-F379 HydrophobicContact CE-CE1 4.07Å; M352-F379 HydrophobicContact CE-CZ 4.27Å; M352-F379 HydrophobicContact SD-CD1 3.71Å; M352-F379 HydrophobicContact SD-CE1 3.49Å; M352-F379 WeakPolarHBondContact SD-CE1 3.26Å; M352-F379 HydrophobicContact SD-CZ 4.26Å; M352-F387 HydrophobicContact CE-CB 4.22Å; M352-F387 HydrophobicContact CG-CB 4.47Å
353	N	86.3	Confident	87.3	Confident	27 Å²	27	33.4 Å²	33.4	14%	0.144	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-97.4	171.6	170.4	-49.7	-93.8	0	0	0	108.9	G351 D386	G351-N353 PolarHBondContact O-ND2 3.17Å; N353-D386 PolarHBondContact N-OD2 3.39Å; N353-D386 PolarHBondContact ND2-OD2 3.01Å
354	H	89.2	Confident	86.3	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.037	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-60.4	154.5	175.9	-73.1	174.9	0	0	0	113.4	H344 H348 R358 M369 S371 L605 G606 D608	H344-H354 AromaticContact CE1-CD2 3.53Å; H344-H354 AromaticContact CE1-NE2 3.29Å; H344-H354 PolarHBondContact CE1-NE2 2.87Å; H344-H354 VanDerWaalsContact CE1-NE2 3.29Å; H344-H354 AromaticContact NE2-CD2 3.38Å; H344-H354 PolarHBondContact NE2-CD2 3.23Å; H344-H354 AromaticContact NE2-NE2 2.94Å; H344-H354 PolarHBondContact NE2-NE2 3.11Å; H348-H354 AromaticContact CE1-CD2 3.62Å; H348-H354 AromaticContact CE1-NE2 3.62Å; H348-H354 AromaticContact NE2-NE2 3.63Å; H354-R358 WeakPolarHBondContact O-CD 3.16Å; H354-R358 PolarHBondContact O-NH1 2.9Å; H354-M369 CarbonylContact C-O 3.58Å; H354-M369 WeakPolarHBondContact CA-O 3.43Å; H354-M369 PolarHBondContact CD2-O 3.28Å; H354-S371 VanDerWaalsContact ND1-CB 3.3Å; H354-S371 WeakPolarHBondContact ND1-CB 3.49Å; H354-L605 PolarHBondContact ND1-O 3.32Å; H354-G606 WeakPolarHBondContact CE1-CA 3.44Å; H354-G606 WeakPolarHBondContact ND1-CA 3.21Å; H354-D608 VanDerWaalsContact CE1-CG 3.47Å; H354-D608 IonicContact CE1-OD1 2.74Å; H354-D608 PolarHBondContact CE1-OD1 3.06Å; H354-D608 IonicContact CE1-OD2 2.81Å; H354-D608 PolarHBondContact CE1-OD2 3.28Å; H354-D608 VanDerWaalsContact NE2-CG 3.29Å; H354-D608 IonicContact NE2-OD1 2.63Å; H354-D608 PolarHBondContact NE2-OD1 2.03Å; H354-D608 VanDerWaalsContact NE2-OD1 3.12Å; H354-D608 IonicContact NE2-OD2 3.27Å; H354-D608 PolarHBondContact NE2-OD2 3.18Å
355	D	84.1	Confident	85.2	Confident	16 Å²	16	40.4 Å²	40.4	9%	0.086	28%	0.275	C	S	.	.			trans	-82.1	-17.3	173.9	-69.1	-40.5	0	0	0	112.1	G357 R358 C367 M369 S380 S383	D355-G357 PolarHBondContact O-N 3.34Å; D355-R358 WeakPolarHBondContact O-CB 3.45Å; D355-R358 PolarHBondContact O-N 3.07Å; D355-R358 VanDerWaalsContact O-N 3.15Å; D355-C367 VanDerWaalsContact OD2-CB 3.27Å; D355-C367 WeakPolarHBondContact OD2-CB 3.36Å; D355-M369 PolarHBondContact N-O 2.88Å; D355-S380 VanDerWaalsContact CG-OG 3.31Å; D355-S380 VanDerWaalsContact OD1-CB 3.31Å; D355-S380 WeakPolarHBondContact OD1-CB 3.37Å; D355-S380 PolarHBondContact OD1-OG 3.44Å; D355-S380 WeakPolarHBondContact OD2-CB 3.33Å; D355-S383 PolarHBondContact OD1-OG 2.91Å
356	D	78.4	Confident	84.4	Confident	40 Å²	40	41 Å²	41	21%	0.214	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	127.9	-171.8	-64	-119.9	0	0	0	114.1	R358 H370 S371	D356-R358 PolarHBondContact O-N 3.16Å; D356-H370 IonicContact OD1-CE1 2.8Å; D356-H370 PolarHBondContact OD1-CE1 2.99Å; D356-H370 VanDerWaalsContact OD1-CE1 3.25Å; D356-H370 IonicContact OD1-ND1 3.67Å; D356-H370 PolarHBondContact OD1-ND1 2.96Å; D356-H370 WeakPolarHBondContact OD2-CA 3.05Å; D356-H370 IonicContact OD2-CG 3.71Å; D356-H370 IonicContact OD2-ND1 2.72Å; D356-S371 VanDerWaalsContact CG-OG 3.27Å; D356-S371 WeakPolarHBondContact OD1-CB 3.24Å; D356-S371 PolarHBondContact OD1-OG 3.48Å; D356-S371 PolarHBondContact OD2-N 2.98Å
357	G	72.9	Confident	84	Confident	87 Å²	87	41.1 Å²	41.1	90%	0.897	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-0	-179	0	0	0	0	0	114.9	D355	D355-G357 PolarHBondContact O-N 3.34Å
358	R	79.6	Confident	83.7	Confident	92 Å²	92	41.4 Å²	41.4	35%	0.347	28%	0.283	S	S	.	.	S	Bend	trans	-94.3	154.6	175.4	-59.5	165.5	75	171.2	7.3	110.3	H354 D355 D356 C360 D386	H354-R358 WeakPolarHBondContact O-CD 3.16Å; H354-R358 PolarHBondContact O-NH1 2.9Å; D355-R358 WeakPolarHBondContact O-CB 3.45Å; D355-R358 PolarHBondContact O-N 3.07Å; D355-R358 VanDerWaalsContact O-N 3.15Å; D356-R358 PolarHBondContact O-N 3.16Å; R358-C360 WeakPolarHBondContact CB-SG 3.28Å; R358-C360 PolarHBondContact O-N 3.24Å; R358-D386 IonicContact CZ-OD1 3.89Å; R358-D386 IonicContact CZ-OD2 2.7Å; R358-D386 IonicContact NH1-OD1 3.01Å; R358-D386 IonicContact NH1-OD2 3.27Å; R358-D386 PolarHBondContact NH1-OD2 3.35Å; R358-D386 VanDerWaalsContact NH2-CG 3.31Å; R358-D386 IonicContact NH2-OD1 3.16Å; R358-D386 PolarHBondContact NH2-OD1 2.88Å; R358-D386 IonicContact NH2-OD2 3.32Å; R358-D386 PolarHBondContact NH2-OD2 2.9Å
359	T	85.3	Confident	83.6	Confident	152 Å²	152	41.4 Å²	41.4	93%	0.933	28%	0.283	S	S	*	.			trans	-84	64.5	176.7	45.1	0	0	0	0	111.5
360	C	86.3	Confident	83.2	Confident	34 Å²	34	43.8 Å²	43.8	23%	0.23	29%	0.294	C	S	.	.			trans	-91	142	-176.4	-53.2	0	0	0	0	112.5	R358 C382	R358-C360 WeakPolarHBondContact CB-SG 3.28Å; R358-C360 PolarHBondContact O-N 3.24Å; C360-C382 WeakPolarHBondContact CA-SG 3.5Å; C360-C382 HydrophobicContact CB-CB 3.93Å; C360-C382 WeakPolarHBondContact CB-SG 3.16Å; C360-C382 WeakPolarHBondContact SG-CB 2.92Å; C360-C382 CovalentContact SG-SG 2.03Å; C360-C382 PolarHBondContact SG-SG 2.86Å
361	S	89.3	Confident	82.2	Confident	87 Å²	87	43.9 Å²	43.9	61%	0.608	30%	0.295	S	S	*	.			trans	-85.1	112.7	167	-174	0	0	0	0	108.6	S380 S381	S361-S380 WeakPolarHBondContact O-CA 3.4Å; S361-S381 PolarHBondContact N-OG 2.92Å; S361-S381 PolarHBondContact O-N 3.08Å
362	C	82.7	Confident	81.4	Confident	40 Å²	40	44.4 Å²	44.4	27%	0.27	30%	0.3	S	S	.	.			trans	-115.4	134.3	171.2	-172.6	0	0	0	0	109.8	A364 A366 C367	C362-A364 PolarHBondContact O-N 3.24Å; C362-A364 PolarHBondContact SG-O 3.08Å; C362-A366 PolarHBondContact SG-O 2.92Å; C362-C367 VanDerWaalsContact CA-SG 3.56Å; C362-C367 HydrophobicContact CB-CB 4.07Å; C362-C367 WeakPolarHBondContact CB-SG 3.02Å; C362-C367 WeakPolarHBondContact SG-CA 3.03Å; C362-C367 WeakPolarHBondContact SG-CB 2.95Å; C362-C367 PolarHBondContact SG-N 2.03Å; C362-C367 CovalentContact SG-SG 2.03Å; C362-C367 PolarHBondContact SG-SG 3.45Å
363	P	71.5	Confident	80	Confident	99 Å²	99	46.5 Å²	46.5	64%	0.643	32%	0.317	S	S	*	.	S	Bend	trans	-81	8.6	176.8	33.6	-36.4	0	0	0	113.9	N378	P363-N378 HydrophobicContact CG-CB 3.75Å
364	A	72.4	Confident	78.8	Confident	42 Å²	42	48.4 Å²	48.4	35%	0.347	33%	0.33	S	S	.	.	S	Bend	trans	-139.3	170.7	176.3	0	0	0	0	0	109.5	C362 A366	C362-A364 PolarHBondContact O-N 3.24Å; C362-A364 PolarHBondContact SG-O 3.08Å; A364-A366 PolarHBondContact O-N 2.85Å; A364-A366 VanDerWaalsContact O-N 3.09Å
365	A	70.6	Confident	77.6	Confident	119 Å²	119	49.1 Å²	49.1	98%	0.983	34%	0.34	S	S	*	.	S	Bend	trans	-56.9	-26.7	179	0	0	0	0	0	113.6
366	A	78.1	Confident	76.9	Confident	15 Å²	15	49 Å²	49	12%	0.124	34%	0.34	C	S	.	.	S	Bend	trans	-149.6	155.8	169.8	0	0	0	0	0	109.9	C362 A364 H370 T374 S376	C362-A366 PolarHBondContact SG-O 2.92Å; A364-A366 PolarHBondContact O-N 2.85Å; A364-A366 VanDerWaalsContact O-N 3.09Å; A366-H370 HydrophobicContact CB-CB 4.17Å; A366-H370 VanDerWaalsContact CB-CD2 3.48Å; A366-H370 WeakPolarHBondContact CB-CD2 3.22Å; A366-T374 HydrophobicContact CB-CG2 3.49Å; A366-T374 VanDerWaalsContact CB-CG2 3.49Å; A366-S376 WeakPolarHBondContact O-CB 3.12Å; A366-S376 PolarHBondContact O-OG 3.05Å
367	C	87.1	Confident	76.7	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.02	33%	0.332	C	S	.	.			trans	-105.3	172.7	176.8	-89	0	0	0	0	111	D355 C362 M369 H370 N378 F379 S380	D355-C367 VanDerWaalsContact OD2-CB 3.27Å; D355-C367 WeakPolarHBondContact OD2-CB 3.36Å; C362-C367 VanDerWaalsContact CA-SG 3.56Å; C362-C367 HydrophobicContact CB-CB 4.07Å; C362-C367 WeakPolarHBondContact CB-SG 3.02Å; C362-C367 WeakPolarHBondContact SG-CA 3.03Å; C362-C367 WeakPolarHBondContact SG-CB 2.95Å; C362-C367 PolarHBondContact SG-N 2.03Å; C362-C367 CovalentContact SG-SG 2.03Å; C362-C367 PolarHBondContact SG-SG 3.45Å; C367-M369 VanDerWaalsContact C-N 3.26Å; C367-M369 PolarHBondContact O-N 2.88Å; C367-H370 WeakPolarHBondContact O-CB 3.46Å; C367-H370 PolarHBondContact O-N 2.81Å; C367-H370 VanDerWaalsContact O-N 3.12Å; C367-N378 CarbonylContact C-O 3.59Å; C367-N378 VanDerWaalsContact CA-O 3.31Å; C367-N378 WeakPolarHBondContact CA-O 3.47Å; C367-N378 VanDerWaalsContact CB-O 3.24Å; C367-N378 WeakPolarHBondContact CB-O 3.48Å; C367-N378 PolarHBondContact SG-O 2.98Å; C367-F379 VanDerWaalsContact SG-C 3.55Å; C367-S380 PolarHBondContact SG-N 3.2Å
368	I	88.6	Confident	77	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.031	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-44.9	-178.7	-71.1	158.6	0	0	0	111.1	I246 A343 H344 H370 S376 K377 N378 F379	I246-I368 HydrophobicContact CG2-CD1 3.32Å; A343-I368 HydrophobicContact CB-CG2 4.47Å; H344-I368 HydrophobicContact CB-CG2 4.13Å; H344-I368 PolarHBondContact ND1-O 3Å; I368-H370 PolarHBondContact O-N 2.79Å; I368-S376 VanDerWaalsContact CG1-O 3.27Å; I368-S376 WeakPolarHBondContact CG1-O 3.26Å; I368-K377 VanDerWaalsContact CD1-C 3.47Å; I368-N378 PolarHBondContact N-O 2.94Å; I368-F379 HydrophobicContact CB-CD1 4Å; I368-F379 HydrophobicContact CB-CE1 3.85Å; I368-F379 HydrophobicContact CB-CZ 4.42Å; I368-F379 HydrophobicContact CD1-CD1 4.02Å; I368-F379 HydrophobicContact CD1-CD2 3.77Å; I368-F379 HydrophobicContact CD1-CE1 3.87Å; I368-F379 HydrophobicContact CD1-CE2 3.64Å; I368-F379 HydrophobicContact CD1-CG 3.97Å; I368-F379 HydrophobicContact CD1-CZ 3.68Å; I368-F379 HydrophobicContact CG1-CE1 4.5Å; I368-F379 HydrophobicContact CG2-CD1 4.33Å; I368-F379 HydrophobicContact CG2-CE1 3.67Å; I368-F379 HydrophobicContact CG2-CZ 4.11Å
369	M	90.3	Very high	77.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	21	-177.7	-55.3	-51.4	-55	0	0	113.7	H348 M352 H354 D355 C367 F379	H348-M369 WeakPolarHBondContact ND1-CE 3.32Å; M352-M369 HydrophobicContact CB-CE 4.02Å; M352-M369 HydrophobicContact CB-CG 3.99Å; M352-M369 HydrophobicContact CB-SD 4.1Å; M352-M369 HydrophobicContact SD-CG 4.11Å; M352-M369 HydrophobicContact SD-SD 4.2Å; H354-M369 CarbonylContact C-O 3.58Å; H354-M369 WeakPolarHBondContact CA-O 3.43Å; H354-M369 PolarHBondContact CD2-O 3.28Å; D355-M369 PolarHBondContact N-O 2.88Å; C367-M369 VanDerWaalsContact C-N 3.26Å; C367-M369 PolarHBondContact O-N 2.88Å; M369-F379 HydrophobicContact CG-CD1 4.12Å; M369-F379 HydrophobicContact CG-CE1 4.13Å; M369-F379 HydrophobicContact SD-CE1 4.04Å
370	H	84.9	Confident	77.7	Confident	49 Å²	49	34.3 Å²	34.3	23%	0.227	24%	0.242	C	C	.	.	S	Bend	trans	-71.9	144.1	165.4	-168.2	-46.4	0	0	0	109.5	H344 D356 A366 C367 I368 G372 T374	H344-H370 PolarHBondContact CE1-O 2.84Å; H344-H370 VanDerWaalsContact CE1-O 3.29Å; D356-H370 IonicContact OD1-CE1 2.8Å; D356-H370 PolarHBondContact OD1-CE1 2.99Å; D356-H370 VanDerWaalsContact OD1-CE1 3.25Å; D356-H370 IonicContact OD1-ND1 3.67Å; D356-H370 PolarHBondContact OD1-ND1 2.96Å; D356-H370 WeakPolarHBondContact OD2-CA 3.05Å; D356-H370 IonicContact OD2-CG 3.71Å; D356-H370 IonicContact OD2-ND1 2.72Å; A366-H370 HydrophobicContact CB-CB 4.17Å; A366-H370 VanDerWaalsContact CB-CD2 3.48Å; A366-H370 WeakPolarHBondContact CB-CD2 3.22Å; C367-H370 WeakPolarHBondContact O-CB 3.46Å; C367-H370 PolarHBondContact O-N 2.81Å; C367-H370 VanDerWaalsContact O-N 3.12Å; I368-H370 PolarHBondContact O-N 2.79Å; H370-G372 PolarHBondContact ND1-N 3.45Å; H370-G372 PolarHBondContact O-N 3.08Å; H370-T374 HydrophobicContact CB-CG2 4.42Å
371	S	72.3	Confident	77.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.014	24%	0.243	C	C	.	.	S	Bend	trans	-63.4	20.2	173.3	75.8	0	0	0	0	115.2	C171 T173 H354 D356	C171-S371 CarbonylContact C-O 3.56Å; C171-S371 VanDerWaalsContact CA-O 3.23Å; C171-S371 WeakPolarHBondContact CA-O 3.34Å; C171-S371 WeakPolarHBondContact CB-O 3.03Å; C171-S371 PolarHBondContact N-O 3.43Å; T173-S371 PolarHBondContact OG1-OG 3.2Å; H354-S371 VanDerWaalsContact ND1-CB 3.3Å; H354-S371 WeakPolarHBondContact ND1-CB 3.49Å; D356-S371 VanDerWaalsContact CG-OG 3.27Å; D356-S371 WeakPolarHBondContact OD1-CB 3.24Å; D356-S371 PolarHBondContact OD1-OG 3.48Å; D356-S371 PolarHBondContact OD2-N 2.98Å
372	G	67.2	Low	77.9	Confident	14 Å²	14	30.9 Å²	30.9	14%	0.144	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-140.4	139.9	-178.3	0	0	0	0	0	111.2	H370 T374	H370-G372 PolarHBondContact ND1-N 3.45Å; H370-G372 PolarHBondContact O-N 3.08Å; G372-T374 WeakPolarHBondContact O-CG2 3.33Å; G372-T374 PolarHBondContact O-N 3.39Å
373	A	62.5	Low	78.3	Confident	44 Å²	44	29 Å²	29	36%	0.364	21%	0.205	S	C	.	.			trans	-71.3	77.9	173.5	0	0	0	0	0	110.7	R169 G375	R169-A373 WeakPolarHBondContact O-CB 3.45Å; A373-G375 VanDerWaalsContact C-N 3.26Å; A373-G375 PolarHBondContact O-N 2.96Å
374	T	62.4	Low	79.1	Confident	67 Å²	67	24.6 Å²	24.6	41%	0.411	18%	0.177	S	C	.	.			trans	-81.7	-1.8	-176.4	59.1	0	0	0	0	113.7	A366 H370 G372 S376	A366-T374 HydrophobicContact CB-CG2 3.49Å; A366-T374 VanDerWaalsContact CB-CG2 3.49Å; H370-T374 HydrophobicContact CB-CG2 4.42Å; G372-T374 WeakPolarHBondContact O-CG2 3.33Å; G372-T374 PolarHBondContact O-N 3.39Å; T374-S376 PolarHBondContact O-N 2.7Å; T374-S376 WeakPolarHBondContact OG1-CB 3.33Å; T374-S376 PolarHBondContact OG1-N 3.41Å
375	G	63.1	Low	79.8	Confident	23 Å²	23	26.2 Å²	26.2	24%	0.237	18%	0.18	C	C	.	.			trans	67.3	-1.9	-171.4	0	0	0	0	0	114.3	S340 A373 K377	S340-G375 PolarHBondContact OG-O 3.01Å; S340-G375 VanDerWaalsContact OG-O 3.12Å; A373-G375 VanDerWaalsContact C-N 3.26Å; A373-G375 PolarHBondContact O-N 2.96Å; G375-K377 WeakPolarHBondContact O-CE 3.03Å; G375-K377 PolarHBondContact O-NZ 2.04Å
376	S	70.3	Confident	80.6	Confident	15 Å²	15	21.2 Å²	21.2	11%	0.105	14%	0.136	C	C	.	.			trans	-60.3	148.7	-174	-170.7	0	0	0	0	112.6	S340 A366 I368 T374	S340-S376 PolarHBondContact OG-O 2.98Å; A366-S376 WeakPolarHBondContact O-CB 3.12Å; A366-S376 PolarHBondContact O-OG 3.05Å; I368-S376 VanDerWaalsContact CG1-O 3.27Å; I368-S376 WeakPolarHBondContact CG1-O 3.26Å; T374-S376 PolarHBondContact O-N 2.7Å; T374-S376 WeakPolarHBondContact OG1-CB 3.33Å; T374-S376 PolarHBondContact OG1-N 3.41Å
377	K	72.6	Confident	81.1	Confident	9 Å²	9	20.5 Å²	20.5	4%	0.039	13%	0.131	C	C	.	.			trans	-119.8	4.1	-174.1	-53.7	-60.1	178.3	-151.4	0	112.8	L161 I246 Q249 A336 S340 I368 G375	L161-K377 HydrophobicContact CD1-CG 4.3Å; I246-K377 HydrophobicContact CD1-CD 3.79Å; I246-K377 HydrophobicContact CG1-CB 4.39Å; I246-K377 HydrophobicContact CG1-CD 4.07Å; Q249-K377 PolarHBondContact NE2-O 2.86Å; A336-K377 WeakPolarHBondContact O-CE 3.35Å; A336-K377 PolarHBondContact O-NZ 2.91Å; S340-K377 PolarHBondContact OG-NZ 2.85Å; I368-K377 VanDerWaalsContact CD1-C 3.47Å; G375-K377 WeakPolarHBondContact O-CE 3.03Å; G375-K377 PolarHBondContact O-NZ 2.04Å
378	N	80.9	Confident	80.8	Confident	38 Å²	38	21.5 Å²	21.5	20%	0.203	14%	0.135	C	C	.	.			trans	-110.7	136.3	-176.4	-60.9	-22.4	0	0	0	110.1	Q249 P363 C367 I368	Q249-N378 PolarHBondContact NE2-OD1 2.76Å; P363-N378 HydrophobicContact CG-CB 3.75Å; C367-N378 CarbonylContact C-O 3.59Å; C367-N378 VanDerWaalsContact CA-O 3.31Å; C367-N378 WeakPolarHBondContact CA-O 3.47Å; C367-N378 VanDerWaalsContact CB-O 3.24Å; C367-N378 WeakPolarHBondContact CB-O 3.48Å; C367-N378 PolarHBondContact SG-O 2.98Å; I368-N378 PolarHBondContact N-O 2.94Å
379	F	88.2	Confident	80.2	Confident	12 Å²	12	26.5 Å²	26.5	5%	0.053	16%	0.157	C	C	.	.			trans	-84.6	149.7	168.4	-74.8	-71.4	0	0	0	110.5	I246 Y247 L250 M352 C367 I368 M369	I246-F379 HydrophobicContact CG2-CD2 4.39Å; I246-F379 HydrophobicContact CG2-CE2 3.61Å; I246-F379 HydrophobicContact CG2-CZ 4.13Å; Y247-F379 HydrophobicContact CD1-CE2 4.07Å; Y247-F379 HydrophobicContact CD1-CZ 4.32Å; Y247-F379 AromaticContact CE1-CE2 3.93Å; Y247-F379 HydrophobicContact CE1-CE2 3.93Å; Y247-F379 AromaticContact CE1-CZ 3.72Å; Y247-F379 HydrophobicContact CE1-CZ 3.72Å; Y247-F379 HydrophobicContact CE2-CE2 4.47Å; Y247-F379 HydrophobicContact CE2-CZ 4.13Å; Y247-F379 HydrophobicContact CG-CE2 4.41Å; Y247-F379 AromaticContact CZ-CZ 3.59Å; L250-F379 HydrophobicContact CD1-CB 4.2Å; L250-F379 HydrophobicContact CD1-CD1 4.18Å; L250-F379 HydrophobicContact CD1-CD2 3.53Å; L250-F379 HydrophobicContact CD1-CE1 4.46Å; L250-F379 HydrophobicContact CD1-CE2 3.84Å; L250-F379 HydrophobicContact CD1-CG 3.71Å; L250-F379 HydrophobicContact CD1-CZ 4.3Å; L250-F379 HydrophobicContact CD2-CB 4.03Å; L250-F379 HydrophobicContact CD2-CD2 4.47Å; L250-F379 HydrophobicContact CD2-CG 4.42Å; L250-F379 HydrophobicContact CG-CB 4.21Å; L250-F379 HydrophobicContact CG-CD2 3.72Å; L250-F379 HydrophobicContact CG-CE2 4.34Å; L250-F379 HydrophobicContact CG-CG 4.08Å; M352-F379 HydrophobicContact CE-CD1 4.5Å; M352-F379 HydrophobicContact CE-CE1 4.07Å; M352-F379 HydrophobicContact CE-CZ 4.27Å; M352-F379 HydrophobicContact SD-CD1 3.71Å; M352-F379 HydrophobicContact SD-CE1 3.49Å; M352-F379 WeakPolarHBondContact SD-CE1 3.26Å; M352-F379 HydrophobicContact SD-CZ 4.26Å; C367-F379 VanDerWaalsContact SG-C 3.55Å; I368-F379 HydrophobicContact CB-CD1 4Å; I368-F379 HydrophobicContact CB-CE1 3.85Å; I368-F379 HydrophobicContact CB-CZ 4.42Å; I368-F379 HydrophobicContact CD1-CD1 4.02Å; I368-F379 HydrophobicContact CD1-CD2 3.77Å; I368-F379 HydrophobicContact CD1-CE1 3.87Å; I368-F379 HydrophobicContact CD1-CE2 3.64Å; I368-F379 HydrophobicContact CD1-CG 3.97Å; I368-F379 HydrophobicContact CD1-CZ 3.68Å; I368-F379 HydrophobicContact CG1-CE1 4.5Å; I368-F379 HydrophobicContact CG2-CD1 4.33Å; I368-F379 HydrophobicContact CG2-CE1 3.67Å; I368-F379 HydrophobicContact CG2-CZ 4.11Å; M369-F379 HydrophobicContact CG-CD1 4.12Å; M369-F379 HydrophobicContact CG-CE1 4.13Å; M369-F379 HydrophobicContact SD-CE1 4.04Å
380	S	90.1	Very high	79.8	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.021	16%	0.158	C	C	.	.			trans	-85.2	169.6	178	94.1	0	0	0	0	111.1	D355 S361 C367 C382 S383 A384	D355-S380 VanDerWaalsContact CG-OG 3.31Å; D355-S380 VanDerWaalsContact OD1-CB 3.31Å; D355-S380 WeakPolarHBondContact OD1-CB 3.37Å; D355-S380 PolarHBondContact OD1-OG 3.44Å; D355-S380 WeakPolarHBondContact OD2-CB 3.33Å; S361-S380 WeakPolarHBondContact O-CA 3.4Å; C367-S380 PolarHBondContact SG-N 3.2Å; S380-C382 PolarHBondContact O-N 2.76Å; S380-C382 WeakPolarHBondContact OG-CB 3.42Å; S380-C382 PolarHBondContact OG-N 3.19Å; S380-S383 PolarHBondContact N-OG 3.05Å; S380-S383 PolarHBondContact O-N 3.2Å; S380-S383 PolarHBondContact OG-N 3.24Å; S380-S383 PolarHBondContact OG-OG 3.11Å; S380-A384 PolarHBondContact O-N 3.23Å
381	S	89.1	Confident	79.1	Confident	36 Å²	36	25 Å²	25	25%	0.252	15%	0.15	S	C	.	.	H	α-helix	trans	-55.6	-35.3	168.7	63.1	0	0	0	0	112.6	S361 D385	S361-S381 PolarHBondContact N-OG 2.92Å; S361-S381 PolarHBondContact O-N 3.08Å; S381-D385 VanDerWaalsContact O-CG 3.23Å; S381-D385 PolarHBondContact O-N 2.87Å; S381-D385 VanDerWaalsContact O-OD2 3.13Å
382	C	90.1	Very high	78.7	Confident	13 Å²	13	30.9 Å²	30.9	9%	0.088	18%	0.18	C	C	.	.	H	α-helix	trans	-71.3	-40.3	179.5	-63.8	0	0	0	0	112.4	C360 S380 A384 D385 D386	C360-C382 WeakPolarHBondContact CA-SG 3.5Å; C360-C382 HydrophobicContact CB-CB 3.93Å; C360-C382 WeakPolarHBondContact CB-SG 3.16Å; C360-C382 WeakPolarHBondContact SG-CB 2.92Å; C360-C382 CovalentContact SG-SG 2.03Å; C360-C382 PolarHBondContact SG-SG 2.86Å; S380-C382 PolarHBondContact O-N 2.76Å; S380-C382 WeakPolarHBondContact OG-CB 3.42Å; S380-C382 PolarHBondContact OG-N 3.19Å; C382-A384 VanDerWaalsContact C-N 3.27Å; C382-A384 PolarHBondContact O-N 2.86Å; C382-D385 PolarHBondContact O-N 2.03Å; C382-D386 WeakPolarHBondContact O-CB 3.36Å; C382-D386 PolarHBondContact O-N 3.44Å
383	S	91.4	Very high	78.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-38.3	176.8	-17.7	0	0	0	0	110.6	D355 S380 F387	D355-S383 PolarHBondContact OD1-OG 2.91Å; S380-S383 PolarHBondContact N-OG 3.05Å; S380-S383 PolarHBondContact O-N 3.2Å; S380-S383 PolarHBondContact OG-N 3.24Å; S380-S383 PolarHBondContact OG-OG 3.11Å; S383-F387 WeakPolarHBondContact O-CB 3.1Å; S383-F387 PolarHBondContact O-N 2.95Å; S383-F387 VanDerWaalsContact O-N 3.09Å
384	A	88.9	Confident	78	Confident	7 Å²	7	36.1 Å²	36.1	6%	0.058	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-42	173.7	0	0	0	0	0	113.4	L250 S380 C382 E388	L250-A384 HydrophobicContact CD2-CB 3.63Å; S380-A384 PolarHBondContact O-N 3.23Å; C382-A384 VanDerWaalsContact C-N 3.27Å; C382-A384 PolarHBondContact O-N 2.86Å; A384-E388 PolarHBondContact O-N 2.91Å
385	D	86.2	Confident	77.6	Confident	75 Å²	75	34.8 Å²	34.8	40%	0.401	21%	0.209	S	C	.	.	H	α-helix	trans	-69	-36.4	177.5	-70	-31.6	0	0	0	112	R202 S381 C382 K389	R202-D385 IonicContact CZ-OD1 2.7Å; R202-D385 VanDerWaalsContact CZ-OD1 3.32Å; R202-D385 IonicContact NE-OD1 3.99Å; R202-D385 PolarHBondContact NE-OD1 3.04Å; R202-D385 IonicContact NH2-OD1 2.96Å; R202-D385 PolarHBondContact NH2-OD1 2.91Å; R202-D385 IonicContact NH2-OD2 3.59Å; S381-D385 VanDerWaalsContact O-CG 3.23Å; S381-D385 PolarHBondContact O-N 2.87Å; S381-D385 VanDerWaalsContact O-OD2 3.13Å; C382-D385 PolarHBondContact O-N 2.03Å; D385-K389 VanDerWaalsContact O-CB 3.32Å; D385-K389 WeakPolarHBondContact O-CB 3.32Å; D385-K389 PolarHBondContact O-N 3.05Å
386	D	88.3	Confident	77.4	Confident	14 Å²	14	33.8 Å²	33.8	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-65.3	-42.4	174.5	-77.4	-0.5	0	0	0	111.5	N353 R358 C382 K389 M390	N353-D386 PolarHBondContact N-OD2 3.39Å; N353-D386 PolarHBondContact ND2-OD2 3.01Å; R358-D386 IonicContact CZ-OD1 3.89Å; R358-D386 IonicContact CZ-OD2 2.7Å; R358-D386 IonicContact NH1-OD1 3.01Å; R358-D386 IonicContact NH1-OD2 3.27Å; R358-D386 PolarHBondContact NH1-OD2 3.35Å; R358-D386 VanDerWaalsContact NH2-CG 3.31Å; R358-D386 IonicContact NH2-OD1 3.16Å; R358-D386 PolarHBondContact NH2-OD1 2.88Å; R358-D386 IonicContact NH2-OD2 3.32Å; R358-D386 PolarHBondContact NH2-OD2 2.9Å; C382-D386 WeakPolarHBondContact O-CB 3.36Å; C382-D386 PolarHBondContact O-N 3.44Å; D386-K389 WeakPolarHBondContact O-CB 3.46Å; D386-K389 PolarHBondContact O-N 2.98Å; D386-M390 PolarHBondContact O-N 2.79Å
387	F	87.7	Confident	77	Confident	1 Å²	1	38 Å²	38	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-44.1	175.2	173.5	-116.8	0	0	0	112.4	L205 H209 V252 L350 M352 S383 K389 M390 I391 L399	L205-F387 HydrophobicContact CD2-CD1 3.99Å; L205-F387 HydrophobicContact CD2-CE1 4.03Å; H209-F387 HydrophobicContact CB-CZ 4.38Å; V252-F387 HydrophobicContact CG2-CE1 3.63Å; V252-F387 HydrophobicContact CG2-CE2 4.36Å; V252-F387 HydrophobicContact CG2-CZ 3.55Å; L350-F387 HydrophobicContact CB-CD2 4.14Å; L350-F387 HydrophobicContact CB-CE2 4.5Å; L350-F387 HydrophobicContact CD2-CD2 4.4Å; L350-F387 HydrophobicContact CD2-CE2 3.92Å; M352-F387 HydrophobicContact CE-CB 4.22Å; M352-F387 HydrophobicContact CG-CB 4.47Å; S383-F387 WeakPolarHBondContact O-CB 3.1Å; S383-F387 PolarHBondContact O-N 2.95Å; S383-F387 VanDerWaalsContact O-N 3.09Å; F387-K389 VanDerWaalsContact C-N 3.31Å; F387-K389 PolarHBondContact O-N 3.14Å; F387-M390 HydrophobicContact CD2-CE 3.86Å; F387-M390 HydrophobicContact CE2-CE 3.86Å; F387-M390 PolarHBondContact O-N 3.32Å; F387-M390 VanDerWaalsContact O-N 3.15Å; F387-I391 HydrophobicContact CD2-CG1 4.18Å; F387-I391 HydrophobicContact CE1-CG1 4.41Å; F387-I391 HydrophobicContact CE2-CD1 3.74Å; F387-I391 HydrophobicContact CE2-CG1 3.71Å; F387-I391 HydrophobicContact CZ-CD1 3.98Å; F387-I391 HydrophobicContact CZ-CG1 3.83Å; F387-I391 WeakPolarHBondContact O-CG1 3.25Å; F387-I391 PolarHBondContact O-N 2.75Å; F387-L399 HydrophobicContact CE2-CD1 4.47Å
388	E	80.9	Confident	76.9	Confident	24 Å²	24	38.4 Å²	38.4	11%	0.112	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-39.7	174.1	-177.7	159.1	-134.8	0	0	111.2	R202 A203 V204 L205 A384 I391 L392	R202-E388 VanDerWaalsContact C-OE1 3.26Å; R202-E388 WeakPolarHBondContact CA-OE1 3.42Å; R202-E388 VanDerWaalsContact CB-OE2 3.3Å; R202-E388 WeakPolarHBondContact CB-OE2 3.37Å; R202-E388 WeakPolarHBondContact CD-OE2 3.31Å; R202-E388 WeakPolarHBondContact CG-OE2 3.5Å; A203-E388 PolarHBondContact N-OE1 3.31Å; V204-E388 HydrophobicContact CB-CG 4.02Å; V204-E388 WeakPolarHBondContact CB-OE1 3.21Å; V204-E388 HydrophobicContact CG2-CG 4.11Å; V204-E388 PolarHBondContact N-OE1 3.02Å; L205-E388 HydrophobicContact CD1-CB 4.03Å; A384-E388 PolarHBondContact O-N 2.91Å; E388-I391 PolarHBondContact O-N 3.03Å; E388-L392 HydrophobicContact CG-CD1 4Å; E388-L392 HydrophobicContact CG-CG 4.47Å; E388-L392 WeakPolarHBondContact O-CB 3.29Å; E388-L392 WeakPolarHBondContact O-CG 3.01Å; E388-L392 PolarHBondContact O-N 3.06Å
389	K	77.5	Confident	76.7	Confident	111 Å²	111	36.7 Å²	36.7	48%	0.483	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-40.5	172.2	-179.9	-171.7	173.4	-167	0	112.4	D385 D386 F387 S393 G583	D385-K389 VanDerWaalsContact O-CB 3.32Å; D385-K389 WeakPolarHBondContact O-CB 3.32Å; D385-K389 PolarHBondContact O-N 3.05Å; D386-K389 WeakPolarHBondContact O-CB 3.46Å; D386-K389 PolarHBondContact O-N 2.98Å; F387-K389 VanDerWaalsContact C-N 3.31Å; F387-K389 PolarHBondContact O-N 3.14Å; K389-S393 WeakPolarHBondContact O-CB 3.1Å; K389-S393 PolarHBondContact O-N 3.17Å; K389-S393 PolarHBondContact O-OG 3.47Å; K389-G583 PolarHBondContact NZ-O 3.39Å
390	M	81.3	Confident	75.8	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-55.8	175.6	-173.8	-156.5	60.4	0	0	110.4	V318 L350 D386 F387 L392 S393 T394 L399	V318-M390 HydrophobicContact CG1-CE 3.74Å; V318-M390 HydrophobicContact CG1-SD 3.63Å; L350-M390 HydrophobicContact CD2-CE 4.37Å; D386-M390 PolarHBondContact O-N 2.79Å; F387-M390 HydrophobicContact CD2-CE 3.86Å; F387-M390 HydrophobicContact CE2-CE 3.86Å; F387-M390 PolarHBondContact O-N 3.32Å; F387-M390 VanDerWaalsContact O-N 3.15Å; M390-L392 VanDerWaalsContact C-N 3.27Å; M390-L392 PolarHBondContact O-N 2.88Å; M390-S393 PolarHBondContact O-N 3.26Å; M390-S393 PolarHBondContact O-OG 3.4Å; M390-T394 HydrophobicContact CG-CG2 4.11Å; M390-T394 PolarHBondContact O-N 3.24Å; M390-T394 PolarHBondContact O-OG1 2.91Å; M390-L399 HydrophobicContact CE-CD1 4.18Å
391	I	69.8	Low	74.2	Confident	13 Å²	13	41.5 Å²	41.5	7%	0.067	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-40.3	-178.9	-60.2	-69.9	0	0	0	111.5	V204 F387 E388 S393 G395 L399	V204-I391 HydrophobicContact CG1-CB 3.85Å; V204-I391 HydrophobicContact CG1-CG1 4.39Å; V204-I391 HydrophobicContact CG1-CG2 3.41Å; V204-I391 VanDerWaalsContact CG1-CG2 3.41Å; F387-I391 HydrophobicContact CD2-CG1 4.18Å; F387-I391 HydrophobicContact CE1-CG1 4.41Å; F387-I391 HydrophobicContact CE2-CD1 3.74Å; F387-I391 HydrophobicContact CE2-CG1 3.71Å; F387-I391 HydrophobicContact CZ-CD1 3.98Å; F387-I391 HydrophobicContact CZ-CG1 3.83Å; F387-I391 WeakPolarHBondContact O-CG1 3.25Å; F387-I391 PolarHBondContact O-N 2.75Å; E388-I391 PolarHBondContact O-N 3.03Å; I391-S393 VanDerWaalsContact C-N 3.26Å; I391-S393 PolarHBondContact O-N 3.35Å; I391-G395 CarbonylContact O-C 3.46Å; I391-G395 VanDerWaalsContact O-CA 3.24Å; I391-G395 WeakPolarHBondContact O-CA 3.36Å; I391-G395 PolarHBondContact O-N 3.25Å; I391-L399 HydrophobicContact CD1-CD1 3.83Å
392	L	63.4	Low	72.6	Confident	125 Å²	125	43 Å²	43	65%	0.654	25%	0.251	S	S	*	.	H	α-helix	trans	-65.4	-23.3	175.8	-73.9	171.6	0	0	0	114.3	V204 E388 M390	V204-L392 HydrophobicContact CG2-CD2 3.63Å; V204-L392 HydrophobicContact CG2-CG 3.89Å; E388-L392 HydrophobicContact CG-CD1 4Å; E388-L392 HydrophobicContact CG-CG 4.47Å; E388-L392 WeakPolarHBondContact O-CB 3.29Å; E388-L392 WeakPolarHBondContact O-CG 3.01Å; E388-L392 PolarHBondContact O-N 3.06Å; M390-L392 VanDerWaalsContact C-N 3.27Å; M390-L392 PolarHBondContact O-N 2.88Å
393	S	58.1	Low	70.7	Confident	92 Å²	92	43.1 Å²	43.1	64%	0.643	25%	0.252	S	S	*	.	H	α-helix	trans	-101.5	-31.3	-176.5	64.8	0	0	0	0	114.3	K389 M390 I391	K389-S393 WeakPolarHBondContact O-CB 3.1Å; K389-S393 PolarHBondContact O-N 3.17Å; K389-S393 PolarHBondContact O-OG 3.47Å; M390-S393 PolarHBondContact O-N 3.26Å; M390-S393 PolarHBondContact O-OG 3.4Å; I391-S393 VanDerWaalsContact C-N 3.26Å; I391-S393 PolarHBondContact O-N 3.35Å
394	T	57.9	Low	68.4	Low	77 Å²	77	48.2 Å²	48.2	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-98.3	-14.3	177.3	66.2	0	0	0	0	113.2	M390 G396	M390-T394 HydrophobicContact CG-CG2 4.11Å; M390-T394 PolarHBondContact O-N 3.24Å; M390-T394 PolarHBondContact O-OG1 2.91Å; T394-G396 PolarHBondContact O-N 3.44Å; T394-G396 PolarHBondContact OG1-N 3.27Å
395	G	53.3	Low	66	Low	39 Å²	39	50.9 Å²	50.9	40%	0.402	29%	0.288	S	S	.	.			trans	79.7	-11.6	-170.9	0	0	0	0	0	114.2	I391 T397	I391-G395 CarbonylContact O-C 3.46Å; I391-G395 VanDerWaalsContact O-CA 3.24Å; I391-G395 WeakPolarHBondContact O-CA 3.36Å; I391-G395 PolarHBondContact O-N 3.25Å; G395-T397 PolarHBondContact O-N 3.3Å; G395-T397 VanDerWaalsContact O-N 3.08Å
396	G	58.8	Low	63.7	Low	1 Å²	1	51.3 Å²	51.3	1%	0.01	29%	0.29	C	S	.	.			trans	57.2	22.6	173.8	0	0	0	0	0	115.7	T394 C398 L399	T394-G396 PolarHBondContact O-N 3.44Å; T394-G396 PolarHBondContact OG1-N 3.27Å; G396-C398 PolarHBondContact O-N 3.22Å; G396-L399 WeakPolarHBondContact O-CB 3.24Å; G396-L399 PolarHBondContact O-N 2.86Å
397	T	62.3	Low	61.3	Low	104 Å²	104	51.3 Å²	51.3	64%	0.638	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.3	-30.4	-158.4	48.2	0	0	0	0	115.6	G395 L399	G395-T397 PolarHBondContact O-N 3.3Å; G395-T397 VanDerWaalsContact O-N 3.08Å; T397-L399 PolarHBondContact O-N 2.94Å
398	C	70.9	Confident	59	Low	18 Å²	18	52.6 Å²	52.6	12%	0.122	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-68.3	-26.5	173.6	76.4	0	0	0	0	112.4	D296 C319 G396 L400 N401	D296-C398 VanDerWaalsContact OD1-CB 3.25Å; D296-C398 WeakPolarHBondContact OD1-CB 3.03Å; D296-C398 PolarHBondContact OD1-SG 2.96Å; C319-C398 WeakPolarHBondContact CA-SG 3.43Å; C319-C398 HydrophobicContact CB-CB 3.79Å; C319-C398 WeakPolarHBondContact CB-SG 3.38Å; C319-C398 WeakPolarHBondContact SG-CB 3.38Å; C319-C398 CovalentContact SG-SG 2.03Å; C319-C398 PolarHBondContact SG-SG 3.17Å; G396-C398 PolarHBondContact O-N 3.22Å; C398-L400 PolarHBondContact O-N 2.97Å; C398-N401 PolarHBondContact O-OD1 2.94Å; C398-N401 VanDerWaalsContact O-OD1 3.08Å
399	L	77.3	Confident	57.2	Low	1 Å²	1	56.8 Å²	56.8	1%	0.005	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-84.8	13.7	-174.2	-53.1	178	0	0	0	113.7	H209 Y210 V211 D296 V318 L350 F387 M390 I391 G396 T397	H209-L399 CarbonylContact C-O 3.57Å; H209-L399 WeakPolarHBondContact CA-O 3.18Å; H209-L399 HydrophobicContact CB-CB 4.28Å; H209-L399 WeakPolarHBondContact CB-O 3.3Å; Y210-L399 PolarHBondContact N-O 2.84Å; Y210-L399 WeakPolarHBondContact O-CA 3.42Å; Y210-L399 WeakPolarHBondContact O-CB 3.19Å; Y210-L399 WeakPolarHBondContact O-CD2 3.03Å; V211-L399 HydrophobicContact CG2-CD2 4.01Å; D296-L399 HydrophobicContact CB-CD2 4.28Å; V318-L399 HydrophobicContact CG1-CD1 3.96Å; V318-L399 HydrophobicContact CG2-CD1 4.23Å; V318-L399 HydrophobicContact CG2-CD2 3.75Å; V318-L399 HydrophobicContact CG2-CG 4.4Å; L350-L399 HydrophobicContact CD2-CD1 3.7Å; F387-L399 HydrophobicContact CE2-CD1 4.47Å; M390-L399 HydrophobicContact CE-CD1 4.18Å; I391-L399 HydrophobicContact CD1-CD1 3.83Å; G396-L399 WeakPolarHBondContact O-CB 3.24Å; G396-L399 PolarHBondContact O-N 2.86Å; T397-L399 PolarHBondContact O-N 2.94Å
400	L	67.7	Low	55.4	Low	84 Å²	84	52 Å²	52	44%	0.44	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-112.8	-14.8	-173.3	-63.6	178.9	0	0	0	114.1	C398	C398-L400 PolarHBondContact O-N 2.97Å
401	N	57.3	Low	53.6	Low	33 Å²	33	55.7 Å²	55.7	18%	0.176	33%	0.327	C	S	.	.	S	Bend	trans	-84	129.9	165.9	60.3	-79.8	0	0	0	109.7	Y210 E212 R294 C398 P403 E407	Y210-N401 VanDerWaalsContact CB-O 3.31Å; Y210-N401 WeakPolarHBondContact CB-O 3.06Å; E212-N401 PolarHBondContact OE1-ND2 3.19Å; R294-N401 PolarHBondContact NH2-ND2 3.4Å; R294-N401 PolarHBondContact NH2-OD1 3.17Å; C398-N401 PolarHBondContact O-OD1 2.94Å; C398-N401 VanDerWaalsContact O-OD1 3.08Å; N401-P403 VanDerWaalsContact O-CD 3.29Å; N401-P403 WeakPolarHBondContact O-CD 3.49Å; N401-E407 PolarHBondContact ND2-OE2 3.02Å
402	V	54.6	Low	52.6	Low	67 Å²	67	58.1 Å²	58.1	41%	0.406	34%	0.344	S	S	.	.			trans	-62.8	119.2	155.5	-169.5	0	0	0	0	105	Y210 R404	Y210-V402 HydrophobicContact CD1-CB 4.41Å; Y210-V402 HydrophobicContact CD1-CG1 4.06Å; Y210-V402 HydrophobicContact CD2-CG2 4.16Å; Y210-V402 HydrophobicContact CE1-CB 4.27Å; Y210-V402 HydrophobicContact CE1-CG1 3.78Å; Y210-V402 HydrophobicContact CE1-CG2 4.07Å; Y210-V402 HydrophobicContact CE2-CB 4.46Å; Y210-V402 HydrophobicContact CE2-CG2 3.68Å; V402-R404 WeakPolarHBondContact O-CG 3.4Å; V402-R404 PolarHBondContact O-N 2.02Å
403	P	51.4	Low	52.5	Low	15 Å²	15	57.4 Å²	57.4	10%	0.097	33%	0.333	C	S	.	.			trans	-56.8	104.9	173.8	20.5	-31.5	0	0	0	108.7	E212 V255 V257 N401 E407	E212-P403 HydrophobicContact CG-CB 4.13Å; E212-P403 HydrophobicContact CG-CG 4.47Å; V255-P403 HydrophobicContact CB-CG 3.59Å; V255-P403 HydrophobicContact CG1-CB 4.34Å; V255-P403 HydrophobicContact CG1-CG 3.59Å; V255-P403 HydrophobicContact CG2-CG 3.6Å; V257-P403 HydrophobicContact CG1-CB 4.18Å; N401-P403 VanDerWaalsContact O-CD 3.29Å; N401-P403 WeakPolarHBondContact O-CD 3.49Å; P403-E407 VanDerWaalsContact CA-OE2 3.29Å; P403-E407 WeakPolarHBondContact CA-OE2 3.38Å
404	R	43.9	Very low	53	Low	108 Å²	108	54.4 Å²	54.4	41%	0.408	31%	0.312	S	S	.	.			trans	-66.4	158.2	-174.8	-60	175.7	-160.1	-164.2	-2.1	109.7	V402 D406 E407	V402-R404 WeakPolarHBondContact O-CG 3.4Å; V402-R404 PolarHBondContact O-N 2.02Å; R404-D406 PolarHBondContact O-N 3.36Å; R404-E407 HydrophobicContact CB-CB 3.9Å; R404-E407 HydrophobicContact CB-CG 4.12Å; R404-E407 WeakPolarHBondContact CD-OE1 3.24Å; R404-E407 HydrophobicContact CG-CB 4.5Å; R404-E407 HydrophobicContact CG-CG 4.21Å; R404-E407 WeakPolarHBondContact CG-OE1 3.46Å; R404-E407 IonicContact CZ-OE1 2.99Å; R404-E407 PolarHBondContact N-OE2 3.24Å; R404-E407 IonicContact NE-OE1 2.69Å; R404-E407 PolarHBondContact NE-OE1 3.21Å; R404-E407 IonicContact NH2-OE1 3.85Å; R404-E407 PolarHBondContact O-N 3.32Å
405	P	36.7	Very low	53.4	Low	63 Å²	63	51.6 Å²	51.6	41%	0.409	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-27.2	161.2	-31.4	39.3	0	0	0	114.4	P87	P87-P405 HydrophobicContact CB-CB 3.98Å; P87-P405 HydrophobicContact CG-CB 3.72Å; P87-P405 HydrophobicContact CG-CG 4.14Å
406	D	38	Very low	53.7	Low	83 Å²	83	51.7 Å²	51.7	44%	0.444	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	60.2	-172.6	-12.8	-92.9	0	0	0	109.1	R404 S410	R404-D406 PolarHBondContact O-N 3.36Å; D406-S410 VanDerWaalsContact C-CA 3.41Å; D406-S410 WeakPolarHBondContact O-CA 3.28Å; D406-S410 WeakPolarHBondContact O-CB 3.19Å; D406-S410 PolarHBondContact O-OG 3.4Å; D406-S410 VanDerWaalsContact O-OG 3.13Å
407	E	39.4	Very low	53.8	Low	15 Å²	15	59.5 Å²	59.5	7%	0.07	32%	0.318	C	S	.	.	S	Bend	trans	-137.4	0.5	179.8	-120.6	169.8	-149.1	0	0	117.3	N401 P403 R404	N401-E407 PolarHBondContact ND2-OE2 3.02Å; P403-E407 VanDerWaalsContact CA-OE2 3.29Å; P403-E407 WeakPolarHBondContact CA-OE2 3.38Å; R404-E407 HydrophobicContact CB-CB 3.9Å; R404-E407 HydrophobicContact CB-CG 4.12Å; R404-E407 WeakPolarHBondContact CD-OE1 3.24Å; R404-E407 HydrophobicContact CG-CB 4.5Å; R404-E407 HydrophobicContact CG-CG 4.21Å; R404-E407 WeakPolarHBondContact CG-OE1 3.46Å; R404-E407 IonicContact CZ-OE1 2.99Å; R404-E407 PolarHBondContact N-OE2 3.24Å; R404-E407 IonicContact NE-OE1 2.69Å; R404-E407 PolarHBondContact NE-OE1 3.21Å; R404-E407 IonicContact NH2-OE1 3.85Å; R404-E407 PolarHBondContact O-N 3.32Å
408	A	38.7	Very low	53.2	Low	27 Å²	27	57.9 Å²	57.9	22%	0.223	31%	0.306	C	S	.	.	S	Bend	trans	-144.6	1.4	161.8	0	0	0	0	0	114.1	D88 R293 R294	D88-A408 VanDerWaalsContact OD2-CA 3.32Å; D88-A408 WeakPolarHBondContact OD2-CA 3.32Å; D88-A408 PolarHBondContact OD2-N 2.82Å; R293-A408 VanDerWaalsContact CZ-CB 3.45Å; R293-A408 VanDerWaalsContact NH1-C 3.28Å; R293-A408 PolarHBondContact NH1-O 2.98Å; R294-A408 HydrophobicContact CB-CB 4.41Å
409	Y	43.7	Very low	52.7	Low	113 Å²	113	59.7 Å²	59.7	44%	0.443	32%	0.316	S	S	.	.	S	Bend		-129	97.5	115.2	-81.4	-100.4	0	0	0	108.9	D88 R104 V421	D88-Y409 PolarHBondContact OD2-N 3.04Å; R104-Y409 VanDerWaalsContact CZ-CD2 3.46Å; Y409-V421 HydrophobicContact CD1-CG2 4.4Å; Y409-V421 HydrophobicContact CE1-CB 4.42Å; Y409-V421 HydrophobicContact CE1-CG2 3.91Å
410	S	39.1	Very low	51.7	Low	11 Å²	11	60.5 Å²	60.5	8%	0.077	32%	0.32	C	S	.	.			trans	-53.6	151.1	153.8	-31.4	0	0	0	0	109.8	D406 D420	D406-S410 VanDerWaalsContact C-CA 3.41Å; D406-S410 WeakPolarHBondContact O-CA 3.28Å; D406-S410 WeakPolarHBondContact O-CB 3.19Å; D406-S410 PolarHBondContact O-OG 3.4Å; D406-S410 VanDerWaalsContact O-OG 3.13Å; S410-D420 WeakPolarHBondContact CB-OD2 3.02Å; S410-D420 VanDerWaalsContact OG-CG 3.28Å; S410-D420 PolarHBondContact OG-OD1 2.83Å; S410-D420 PolarHBondContact OG-OD2 2.81Å
411	A	42.9	Very low	51.1	Low	80 Å²	80	61.7 Å²	61.7	66%	0.661	33%	0.331	S	S	*	.	S	Bend	trans	-65.1	115.1	137.5	0	0	0	0	0	104.3	Y413	A411-Y413 PolarHBondContact O-N 2.68Å
412	P	49.9	Very low	51.6	Low	64 Å²	64	62.6 Å²	62.6	42%	0.416	35%	0.348	S	S	.	.			trans	-39.3	108.7	-158.2	4.7	-24.1	0	0	0	112.3	C414 D420 E423	P412-C414 PolarHBondContact O-N 2.74Å; P412-D420 HydrophobicContact CB-CB 3.72Å; P412-E423 VanDerWaalsContact C-OE1 3.24Å; P412-E423 HydrophobicContact CB-CG 3.73Å
413	Y	59.9	Low	52.7	Low	111 Å²	111	60.4 Å²	60.4	44%	0.435	33%	0.333	S	S	.	.			trans	-97.3	86.5	-166.7	178.7	-97.7	0	0	0	109.5	A411 G415 N416 D420 E423	A411-Y413 PolarHBondContact O-N 2.68Å; Y413-G415 PolarHBondContact O-N 2.79Å; Y413-N416 HydrophobicContact CD1-CB 3.87Å; Y413-N416 HydrophobicContact CE1-CB 4.37Å; Y413-N416 PolarHBondContact O-N 2.82Å; Y413-N416 PolarHBondContact O-ND2 3.35Å; Y413-D420 PolarHBondContact N-OD2 2.91Å; Y413-E423 PolarHBondContact N-OE1 3.33Å
414	C	68.6	Low	53.9	Low	29 Å²	29	64.3 Å²	64.3	20%	0.196	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	110.3	178.8	-172.4	0	0	0	0	111.7	P412 E423 Y441 C444	P412-C414 PolarHBondContact O-N 2.74Å; C414-E423 WeakPolarHBondContact CA-OE1 3.45Å; C414-E423 PolarHBondContact N-OE1 2.63Å; C414-Y441 VanDerWaalsContact SG-C 3.55Å; C414-Y441 PolarHBondContact SG-O 3.32Å; C414-C444 WeakPolarHBondContact CA-SG 3.44Å; C414-C444 HydrophobicContact CB-CB 3.55Å; C414-C444 WeakPolarHBondContact CB-SG 3.34Å; C414-C444 WeakPolarHBondContact SG-CA 3.5Å; C414-C444 WeakPolarHBondContact SG-CB 3.5Å; C414-C444 PolarHBondContact SG-N 2.97Å; C414-C444 CovalentContact SG-SG 2.03Å; C414-C444 PolarHBondContact SG-SG 2.97Å
415	G	67.5	Low	55.6	Low	17 Å²	17	59.1 Å²	59.1	18%	0.175	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	120.9	17.7	175.9	0	0	0	0	0	115.8	Y413 D426 G428	Y413-G415 PolarHBondContact O-N 2.79Å; G415-D426 WeakPolarHBondContact CA-OD1 3.35Å; G415-D426 WeakPolarHBondContact CA-OD2 3.44Å; G415-D426 PolarHBondContact N-OD1 3.46Å; G415-D426 PolarHBondContact N-OD2 2.8Å; G415-G428 WeakPolarHBondContact CA-O 3Å; G415-G428 CarbonylContact O-C 3.57Å
416	N	58.3	Low	57.5	Low	42 Å²	42	56.6 Å²	56.6	23%	0.225	31%	0.314	C	S	.	.	S	Bend	trans	-93.5	-3.9	168.7	62.5	32.9	0	0	0	113.8	Y413 L418 D420 D426	Y413-N416 HydrophobicContact CD1-CB 3.87Å; Y413-N416 HydrophobicContact CE1-CB 4.37Å; Y413-N416 PolarHBondContact O-N 2.82Å; Y413-N416 PolarHBondContact O-ND2 3.35Å; N416-L418 WeakPolarHBondContact OD1-CA 3.38Å; N416-L418 VanDerWaalsContact OD1-CB 3.29Å; N416-L418 WeakPolarHBondContact OD1-CB 3.25Å; N416-L418 PolarHBondContact OD1-N 2.69Å; N416-L418 PolarHBondContact OD1-O 2.9Å; N416-L418 VanDerWaalsContact OD1-O 3.06Å; N416-D420 PolarHBondContact ND2-OD2 3.33Å; N416-D426 PolarHBondContact N-OD2 3.46Å; N416-D426 PolarHBondContact OD1-OD2 3.37Å; N416-D426 VanDerWaalsContact OD1-OD2 3.09Å
417	R	61.8	Low	59.3	Low	164 Å²	164	53.5 Å²	53.5	62%	0.619	30%	0.298	S	S	*	.	S	Bend	trans	68.8	24.1	-173.7	-49.6	178.9	-174.1	177.2	5.5	115	D426 E432	R417-D426 VanDerWaalsContact CA-CG 3.48Å; R417-D426 WeakPolarHBondContact CA-OD1 3.31Å; R417-D426 PolarHBondContact N-OD1 3.03Å; R417-D426 PolarHBondContact N-OD2 2.99Å; R417-E432 IonicContact CZ-OE1 2.84Å; R417-E432 IonicContact CZ-OE2 2.74Å; R417-E432 IonicContact NE-OE2 3.75Å; R417-E432 PolarHBondContact NE-OE2 3.13Å; R417-E432 VanDerWaalsContact NE-OE2 3.17Å; R417-E432 IonicContact NH2-OE1 3.41Å; R417-E432 PolarHBondContact NH2-OE1 2.81Å; R417-E432 IonicContact NH2-OE2 3.71Å; R417-E432 PolarHBondContact NH2-OE2 3.27Å
418	L	50.2	Low	60.9	Low	71 Å²	71	52.9 Å²	52.9	37%	0.372	30%	0.295	S	S	.	.	S	Bend	trans	-129.7	126.1	174.1	178	66.6	0	0	0	109	N416 D420	N416-L418 WeakPolarHBondContact OD1-CA 3.38Å; N416-L418 VanDerWaalsContact OD1-CB 3.29Å; N416-L418 WeakPolarHBondContact OD1-CB 3.25Å; N416-L418 PolarHBondContact OD1-N 2.69Å; N416-L418 PolarHBondContact OD1-O 2.9Å; N416-L418 VanDerWaalsContact OD1-O 3.06Å; L418-D420 PolarHBondContact O-N 2.99Å
419	V	60.8	Low	62.8	Low	55 Å²	55	54.2 Å²	54.2	33%	0.333	30%	0.303	S	S	.	.			trans	-72.8	103	-178.6	-170.4	0	0	0	0	110.1	E423	V419-E423 HydrophobicContact CG1-CB 3.9Å
420	D	55.9	Low	64.5	Low	18 Å²	18	53.6 Å²	53.6	10%	0.096	31%	0.305	C	S	.	.			trans	-80.7	169.7	-178.5	-90.2	-45	0	0	0	113.3	S410 P412 Y413 N416 L418 G422 E423	S410-D420 WeakPolarHBondContact CB-OD2 3.02Å; S410-D420 VanDerWaalsContact OG-CG 3.28Å; S410-D420 PolarHBondContact OG-OD1 2.83Å; S410-D420 PolarHBondContact OG-OD2 2.81Å; P412-D420 HydrophobicContact CB-CB 3.72Å; Y413-D420 PolarHBondContact N-OD2 2.91Å; N416-D420 PolarHBondContact ND2-OD2 3.33Å; L418-D420 PolarHBondContact O-N 2.99Å; D420-G422 PolarHBondContact O-N 2.69Å; D420-E423 HydrophobicContact CB-CG 4.46Å; D420-E423 PolarHBondContact N-OE2 3.44Å; D420-E423 WeakPolarHBondContact O-CB 3.48Å; D420-E423 PolarHBondContact O-N 3.31Å
421	V	53.9	Low	66.5	Low	109 Å²	109	60.7 Å²	60.7	66%	0.661	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	95.3	-177.1	-178.5	0	0	0	0	111.6	Y409	Y409-V421 HydrophobicContact CD1-CG2 4.4Å; Y409-V421 HydrophobicContact CE1-CB 4.42Å; Y409-V421 HydrophobicContact CE1-CG2 3.91Å
422	G	67.9	Low	67.9	Low	52 Å²	52	60.6 Å²	60.6	54%	0.536	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	133.7	-18	-178.8	0	0	0	0	0	112.7	D420 K445	D420-G422 PolarHBondContact O-N 2.69Å; G422-K445 PolarHBondContact O-NZ 2.84Å
423	E	77.4	Confident	69.4	Low	22 Å²	22	57.5 Å²	57.5	10%	0.103	30%	0.3	C	S	.	.			trans	-87.5	170.1	178	-62	178.2	163.1	0	0	111.5	P412 Y413 C414 V419 D420 C444	P412-E423 VanDerWaalsContact C-OE1 3.24Å; P412-E423 HydrophobicContact CB-CG 3.73Å; Y413-E423 PolarHBondContact N-OE1 3.33Å; C414-E423 WeakPolarHBondContact CA-OE1 3.45Å; C414-E423 PolarHBondContact N-OE1 2.63Å; V419-E423 HydrophobicContact CG1-CB 3.9Å; D420-E423 HydrophobicContact CB-CG 4.46Å; D420-E423 PolarHBondContact N-OE2 3.44Å; D420-E423 WeakPolarHBondContact O-CB 3.48Å; D420-E423 PolarHBondContact O-N 3.31Å; E423-C444 WeakPolarHBondContact CA-O 3.31Å; E423-C444 HydrophobicContact CB-CB 3.89Å; E423-C444 VanDerWaalsContact CD-CB 3.44Å; E423-C444 HydrophobicContact CG-CB 3.55Å
424	E	77.4	Confident	70.4	Confident	96 Å²	96	58.7 Å²	58.7	45%	0.449	31%	0.31	S	S	.	.	S	Bend	trans	-125.4	-13.5	175.8	-67.5	156.7	-158.7	0	0	112	C444 K445 L446	E424-C444 PolarHBondContact N-O 2.94Å; E424-K445 HydrophobicContact CB-CD 4.5Å; E424-K445 VanDerWaalsContact CD-CD 3.42Å; E424-K445 HydrophobicContact CG-CD 4.08Å; E424-K445 VanDerWaalsContact OE1-CD 3.31Å; E424-K445 WeakPolarHBondContact OE1-CD 3.46Å; E424-K445 WeakPolarHBondContact OE1-CE 3.33Å; E424-K445 IonicContact OE1-NZ 3Å; E424-K445 PolarHBondContact OE1-NZ 2.04Å; E424-L446 HydrophobicContact CB-CD1 3.95Å; E424-L446 HydrophobicContact CB-CG 3.77Å; E424-L446 PolarHBondContact OE2-N 2.67Å
425	C	78.8	Confident	70.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.339	C	S	.	.			trans	-166	155.1	178.8	58.5	0	0	0	0	109.8	C439 C444 K445 L446 A453	C425-C439 HydrophobicContact CB-CB 3.63Å; C425-C439 WeakPolarHBondContact CB-SG 3.29Å; C425-C439 PolarHBondContact O-SG 2.93Å; C425-C439 VanDerWaalsContact O-SG 3.34Å; C425-C439 WeakPolarHBondContact SG-CA 3.48Å; C425-C439 WeakPolarHBondContact SG-CB 3.29Å; C425-C439 CovalentContact SG-SG 2.03Å; C425-C439 PolarHBondContact SG-SG 2.84Å; C425-C444 PolarHBondContact N-O 3.38Å; C425-C444 CarbonylContact O-C 3.05Å; C425-C444 WeakPolarHBondContact O-CA 3.35Å; C425-C444 WeakPolarHBondContact O-CB 3.35Å; C425-C444 PolarHBondContact O-SG 3.5Å; C425-K445 PolarHBondContact SG-O 2.85Å; C425-K445 VanDerWaalsContact SG-O 3.33Å; C425-L446 HydrophobicContact CB-CD2 3.93Å; C425-A453 HydrophobicContact CB-CB 3.49Å; C425-A453 VanDerWaalsContact CB-CB 3.49Å
426	D	77	Confident	71.6	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.053	34%	0.339	C	S	.	.			trans	-141.8	129.4	163.7	-174.9	-28.5	0	0	0	108.3	G415 N416 R417 G428	G415-D426 WeakPolarHBondContact CA-OD1 3.35Å; G415-D426 WeakPolarHBondContact CA-OD2 3.44Å; G415-D426 PolarHBondContact N-OD1 3.46Å; G415-D426 PolarHBondContact N-OD2 2.8Å; N416-D426 PolarHBondContact N-OD2 3.46Å; N416-D426 PolarHBondContact OD1-OD2 3.37Å; N416-D426 VanDerWaalsContact OD1-OD2 3.09Å; R417-D426 VanDerWaalsContact CA-CG 3.48Å; R417-D426 WeakPolarHBondContact CA-OD1 3.31Å; R417-D426 PolarHBondContact N-OD1 3.03Å; R417-D426 PolarHBondContact N-OD2 2.99Å; D426-G428 PolarHBondContact OD1-N 3.02Å
427	C	76.7	Confident	73.1	Confident	18 Å²	18	69 Å²	69	12%	0.122	36%	0.359	C	S	.	.			trans	-112.2	0.8	-176.9	40.5	0	0	0	0	113.7	C433 D436 C439	C427-C433 VanDerWaalsContact CA-SG 3.6Å; C427-C433 HydrophobicContact CB-CB 4.05Å; C427-C433 WeakPolarHBondContact CB-SG 3.46Å; C427-C433 VanDerWaalsContact SG-CA 3.58Å; C427-C433 WeakPolarHBondContact SG-CB 3.25Å; C427-C433 CovalentContact SG-SG 2.02Å; C427-C433 PolarHBondContact SG-SG 3.39Å; C427-D436 HydrophobicContact CB-CB 3.7Å; C427-D436 WeakPolarHBondContact CB-OD2 3.44Å; C427-C439 HydrophobicContact CB-CB 4.18Å; C427-C439 VanDerWaalsContact SG-CB 3.55Å
428	G	73	Confident	74.5	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.01	33%	0.332	C	S	.	.			trans	97.1	-152.4	-179.5	0	0	0	0	0	113.6	G415 D426 E432 C433	G415-G428 WeakPolarHBondContact CA-O 3Å; G415-G428 CarbonylContact O-C 3.57Å; D426-G428 PolarHBondContact OD1-N 3.02Å; G428-E432 WeakPolarHBondContact CA-OE2 3.4Å; G428-C433 PolarHBondContact O-SG 2.9Å
429	S	77.6	Confident	76.4	Confident	56 Å²	56	58.3 Å²	58.3	39%	0.392	32%	0.315	S	S	.	.	S	Bend	trans	-64.7	161.7	-174.1	72.6	0	0	0	0	112.4	K431 E432 C433	S429-K431 PolarHBondContact O-N 3.35Å; S429-E432 PolarHBondContact N-OE2 3.35Å; S429-E432 WeakPolarHBondContact O-CA 3.49Å; S429-E432 WeakPolarHBondContact O-CB 3.21Å; S429-E432 PolarHBondContact O-N 3.41Å; S429-E432 WeakPolarHBondContact OG-CG 3.44Å; S429-C433 PolarHBondContact O-N 3.02Å
430	E	80.8	Confident	77.7	Confident	100 Å²	100	59.6 Å²	59.6	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-39.1	-46.3	178	174	168	-142.9	0	0	113.7	E434 Y441	E430-E434 WeakPolarHBondContact O-CG 3.48Å; E430-E434 PolarHBondContact O-N 3.24Å; E430-Y441 HydrophobicContact CB-CD2 3.64Å; E430-Y441 HydrophobicContact CB-CE2 3.63Å; E430-Y441 HydrophobicContact CB-CG 4.34Å; E430-Y441 VanDerWaalsContact CD-CE2 3.48Å; E430-Y441 HydrophobicContact CG-CD2 3.83Å; E430-Y441 HydrophobicContact CG-CE1 4.23Å; E430-Y441 HydrophobicContact CG-CE2 3.38Å; E430-Y441 HydrophobicContact CG-CG 4.4Å; E430-Y441 WeakPolarHBondContact OE1-CE2 3.18Å; E430-Y441 PolarHBondContact OE1-OH 2.73Å
431	K	79.8	Confident	78.9	Confident	159 Å²	159	61.5 Å²	61.5	69%	0.691	32%	0.323	S	S	*	.	H	α-helix	trans	-74.5	-23.2	-179.7	-66.2	-172.9	174.9	-173.5	0	115.5	S429	S429-K431 PolarHBondContact O-N 3.35Å
432	E	73.1	Confident	80.3	Confident	78 Å²	78	65.4 Å²	65.4	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-82	-41.4	177.9	-60.7	173.8	158.8	0	0	108.7	R417 G428 S429 E434 E435 D436	R417-E432 IonicContact CZ-OE1 2.84Å; R417-E432 IonicContact CZ-OE2 2.74Å; R417-E432 IonicContact NE-OE2 3.75Å; R417-E432 PolarHBondContact NE-OE2 3.13Å; R417-E432 VanDerWaalsContact NE-OE2 3.17Å; R417-E432 IonicContact NH2-OE1 3.41Å; R417-E432 PolarHBondContact NH2-OE1 2.81Å; R417-E432 IonicContact NH2-OE2 3.71Å; R417-E432 PolarHBondContact NH2-OE2 3.27Å; G428-E432 WeakPolarHBondContact CA-OE2 3.4Å; S429-E432 PolarHBondContact N-OE2 3.35Å; S429-E432 WeakPolarHBondContact O-CA 3.49Å; S429-E432 WeakPolarHBondContact O-CB 3.21Å; S429-E432 PolarHBondContact O-N 3.41Å; S429-E432 WeakPolarHBondContact OG-CG 3.44Å; E432-E434 VanDerWaalsContact C-N 3.31Å; E432-E434 PolarHBondContact O-N 3.33Å; E432-E435 PolarHBondContact O-N 3.36Å; E432-D436 PolarHBondContact O-N 3Å
433	C	81.2	Confident	81.1	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-71.9	-15.6	170.8	-67.3	0	0	0	0	115.1	C427 G428 S429 E435 D436 Y441 R447	C427-C433 VanDerWaalsContact CA-SG 3.6Å; C427-C433 HydrophobicContact CB-CB 4.05Å; C427-C433 WeakPolarHBondContact CB-SG 3.46Å; C427-C433 VanDerWaalsContact SG-CA 3.58Å; C427-C433 WeakPolarHBondContact SG-CB 3.25Å; C427-C433 CovalentContact SG-SG 2.02Å; C427-C433 PolarHBondContact SG-SG 3.39Å; G428-C433 PolarHBondContact O-SG 2.9Å; S429-C433 PolarHBondContact O-N 3.02Å; C433-E435 PolarHBondContact O-N 3.47Å; C433-D436 PolarHBondContact O-N 3.19Å; C433-Y441 HydrophobicContact CB-CG 4.45Å; C433-R447 PolarHBondContact O-NH2 2.96Å
434	E	81.3	Confident	81.4	Confident	136 Å²	136	64.8 Å²	64.8	64%	0.636	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-29	167	-86.4	178.4	152.4	0	0	111.6	E430 E432	E430-E434 WeakPolarHBondContact O-CG 3.48Å; E430-E434 PolarHBondContact O-N 3.24Å; E432-E434 VanDerWaalsContact C-N 3.31Å; E432-E434 PolarHBondContact O-N 3.33Å
435	E	79.4	Confident	82.1	Confident	173 Å²	173	63.7 Å²	63.7	81%	0.808	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-14	175	-58.7	-169	163.3	0	0	113	E432 C433 P437	E432-E435 PolarHBondContact O-N 3.36Å; C433-E435 PolarHBondContact O-N 3.47Å; E435-P437 WeakPolarHBondContact O-CD 3.45Å
436	D	81.1	Confident	82.6	Confident	35 Å²	35	65.4 Å²	65.4	19%	0.187	32%	0.316	C	S	.	.			trans	-83.2	115.7	-179.3	-169	-62.6	0	0	0	112.6	C427 E432 C433 C438 C439 R447	C427-D436 HydrophobicContact CB-CB 3.7Å; C427-D436 WeakPolarHBondContact CB-OD2 3.44Å; E432-D436 PolarHBondContact O-N 3Å; C433-D436 PolarHBondContact O-N 3.19Å; D436-C438 VanDerWaalsContact C-N 3.29Å; D436-C438 PolarHBondContact O-N 3.38Å; D436-C438 VanDerWaalsContact OD1-CA 3.28Å; D436-C438 WeakPolarHBondContact OD1-CA 3.47Å; D436-C438 VanDerWaalsContact OD1-CB 3.31Å; D436-C438 WeakPolarHBondContact OD1-CB 3.23Å; D436-C438 PolarHBondContact OD1-N 3.01Å; D436-C439 PolarHBondContact OD1-N 2.99Å; D436-R447 PolarHBondContact O-NE 3.49Å; D436-R447 PolarHBondContact O-NH2 3.5Å
437	P	89.4	Confident	83.3	Confident	97 Å²	97	68.8 Å²	68.8	63%	0.63	33%	0.328	S	S	*	.	S	Bend	trans	-83.3	-0.4	-177.8	34.6	-34.6	0	0	0	113.8	E435 R447 C461	E435-P437 WeakPolarHBondContact O-CD 3.45Å; P437-R447 WeakPolarHBondContact O-CD 3.31Å; P437-C461 VanDerWaalsContact C-SG 3.54Å; P437-C461 PolarHBondContact O-SG 2.66Å
438	C	91.9	Very high	84	Confident	10 Å²	10	74.8 Å²	74.8	7%	0.068	37%	0.367	C	S	.	.	S	Bend	trans	-113.7	-31.5	-169.9	-51.7	0	0	0	0	113.4	D436 L446 R447 A453 C461	D436-C438 VanDerWaalsContact C-N 3.29Å; D436-C438 PolarHBondContact O-N 3.38Å; D436-C438 VanDerWaalsContact OD1-CA 3.28Å; D436-C438 WeakPolarHBondContact OD1-CA 3.47Å; D436-C438 VanDerWaalsContact OD1-CB 3.31Å; D436-C438 WeakPolarHBondContact OD1-CB 3.23Å; D436-C438 PolarHBondContact OD1-N 3.01Å; C438-L446 WeakPolarHBondContact O-CA 3.34Å; C438-R447 PolarHBondContact O-N 3.29Å; C438-A453 HydrophobicContact CB-CB 3.69Å; C438-C461 WeakPolarHBondContact CA-SG 3.42Å; C438-C461 HydrophobicContact CB-CB 3.58Å; C438-C461 WeakPolarHBondContact CB-SG 3.42Å; C438-C461 WeakPolarHBondContact SG-CA 3.47Å; C438-C461 WeakPolarHBondContact SG-CB 3.33Å; C438-C461 PolarHBondContact SG-N 3.31Å; C438-C461 CovalentContact SG-SG 2.03Å; C438-C461 PolarHBondContact SG-SG 2.74Å
439	C	89.1	Confident	84.7	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.8	-171	-166.1	0	0	0	0	113.5	C425 C427 D436 R447 A453	C425-C439 HydrophobicContact CB-CB 3.63Å; C425-C439 WeakPolarHBondContact CB-SG 3.29Å; C425-C439 PolarHBondContact O-SG 2.93Å; C425-C439 VanDerWaalsContact O-SG 3.34Å; C425-C439 WeakPolarHBondContact SG-CA 3.48Å; C425-C439 WeakPolarHBondContact SG-CB 3.29Å; C425-C439 CovalentContact SG-SG 2.03Å; C425-C439 PolarHBondContact SG-SG 2.84Å; C427-C439 HydrophobicContact CB-CB 4.18Å; C427-C439 VanDerWaalsContact SG-CB 3.55Å; D436-C439 PolarHBondContact OD1-N 2.99Å; C439-R447 PolarHBondContact O-NE 3.39Å; C439-R447 PolarHBondContact O-NH2 3.16Å; C439-A453 HydrophobicContact CB-CB 4.03Å
440	E	89.3	Confident	85.4	Confident	82 Å²	82	76.1 Å²	76.1	38%	0.383	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.4	178.6	-178	178.4	-111.1	0	0	113	R442 T443 C444 K445 R447	E440-R442 PolarHBondContact O-N 3.46Å; E440-T443 WeakPolarHBondContact CB-OG1 3.49Å; E440-T443 PolarHBondContact O-N 2.76Å; E440-T443 VanDerWaalsContact O-N 3.12Å; E440-T443 PolarHBondContact O-OG1 3.47Å; E440-T443 WeakPolarHBondContact OE2-CG2 3.44Å; E440-T443 PolarHBondContact OE2-OG1 2.71Å; E440-C444 WeakPolarHBondContact O-CA 3.4Å; E440-C444 PolarHBondContact O-N 2.87Å; E440-K445 PolarHBondContact N-O 3.47Å; E440-R447 HydrophobicContact CB-CG 4.34Å
441	Y	81.6	Confident	85.8	Confident	58 Å²	58	75.2 Å²	75.2	23%	0.227	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.8	-173.5	91	-88.1	0	0	0	117.2	C414 E430 C433	C414-Y441 VanDerWaalsContact SG-C 3.55Å; C414-Y441 PolarHBondContact SG-O 3.32Å; E430-Y441 HydrophobicContact CB-CD2 3.64Å; E430-Y441 HydrophobicContact CB-CE2 3.63Å; E430-Y441 HydrophobicContact CB-CG 4.34Å; E430-Y441 VanDerWaalsContact CD-CE2 3.48Å; E430-Y441 HydrophobicContact CG-CD2 3.83Å; E430-Y441 HydrophobicContact CG-CE1 4.23Å; E430-Y441 HydrophobicContact CG-CE2 3.38Å; E430-Y441 HydrophobicContact CG-CG 4.4Å; E430-Y441 WeakPolarHBondContact OE1-CE2 3.18Å; E430-Y441 PolarHBondContact OE1-OH 2.73Å; C433-Y441 HydrophobicContact CB-CG 4.45Å
442	R	82.3	Confident	85.9	Confident	190 Å²	190	67.8 Å²	67.8	72%	0.717	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-15.3	-179.7	-69.2	-167.5	178	-175.8	0.6	113.6	E440	E440-R442 PolarHBondContact O-N 3.46Å
443	T	85.9	Confident	86	Confident	61 Å²	61	65.2 Å²	65.2	37%	0.374	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.2	-18.8	-164.5	58	0	0	0	0	112.4	E440 K445	E440-T443 WeakPolarHBondContact CB-OG1 3.49Å; E440-T443 PolarHBondContact O-N 2.76Å; E440-T443 VanDerWaalsContact O-N 3.12Å; E440-T443 PolarHBondContact O-OG1 3.47Å; E440-T443 WeakPolarHBondContact OE2-CG2 3.44Å; E440-T443 PolarHBondContact OE2-OG1 2.71Å; T443-K445 PolarHBondContact O-N 2.87Å; T443-K445 PolarHBondContact OG1-N 2.88Å
444	C	83.6	Confident	85.4	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	40.8	-170.4	-84.4	0	0	0	0	112	C414 E423 E424 C425 E440	C414-C444 WeakPolarHBondContact CA-SG 3.44Å; C414-C444 HydrophobicContact CB-CB 3.55Å; C414-C444 WeakPolarHBondContact CB-SG 3.34Å; C414-C444 WeakPolarHBondContact SG-CA 3.5Å; C414-C444 WeakPolarHBondContact SG-CB 3.5Å; C414-C444 PolarHBondContact SG-N 2.97Å; C414-C444 CovalentContact SG-SG 2.03Å; C414-C444 PolarHBondContact SG-SG 2.97Å; E423-C444 WeakPolarHBondContact CA-O 3.31Å; E423-C444 HydrophobicContact CB-CB 3.89Å; E423-C444 VanDerWaalsContact CD-CB 3.44Å; E423-C444 HydrophobicContact CG-CB 3.55Å; E424-C444 PolarHBondContact N-O 2.94Å; C425-C444 PolarHBondContact N-O 3.38Å; C425-C444 CarbonylContact O-C 3.05Å; C425-C444 WeakPolarHBondContact O-CA 3.35Å; C425-C444 WeakPolarHBondContact O-CB 3.35Å; C425-C444 PolarHBondContact O-SG 3.5Å; E440-C444 WeakPolarHBondContact O-CA 3.4Å; E440-C444 PolarHBondContact O-N 2.87Å
445	K	91.3	Very high	84.6	Confident	74 Å²	74	62.3 Å²	62.3	32%	0.322	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	149.4	173.4	-65.1	-53.4	-169.9	176.4	0	110.5	G422 E424 C425 E440 T443 R447	G422-K445 PolarHBondContact O-NZ 2.84Å; E424-K445 HydrophobicContact CB-CD 4.5Å; E424-K445 VanDerWaalsContact CD-CD 3.42Å; E424-K445 HydrophobicContact CG-CD 4.08Å; E424-K445 VanDerWaalsContact OE1-CD 3.31Å; E424-K445 WeakPolarHBondContact OE1-CD 3.46Å; E424-K445 WeakPolarHBondContact OE1-CE 3.33Å; E424-K445 IonicContact OE1-NZ 3Å; E424-K445 PolarHBondContact OE1-NZ 2.04Å; C425-K445 PolarHBondContact SG-O 2.85Å; C425-K445 VanDerWaalsContact SG-O 3.33Å; E440-K445 PolarHBondContact N-O 3.47Å; T443-K445 PolarHBondContact O-N 2.87Å; T443-K445 PolarHBondContact OG1-N 2.88Å; K445-R447 PolarHBondContact O-N 2.74Å
446	L	88.9	Confident	84.3	Confident	36 Å²	36	59.2 Å²	59.2	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	130.2	175.7	-71.7	168.2	0	0	0	109.4	E424 C425 C438 A450 Q451 A453	E424-L446 HydrophobicContact CB-CD1 3.95Å; E424-L446 HydrophobicContact CB-CG 3.77Å; E424-L446 PolarHBondContact OE2-N 2.67Å; C425-L446 HydrophobicContact CB-CD2 3.93Å; C438-L446 WeakPolarHBondContact O-CA 3.34Å; L446-A450 HydrophobicContact CB-CB 4.04Å; L446-A450 HydrophobicContact CD2-CB 4.07Å; L446-Q451 WeakPolarHBondContact CD1-O 3.32Å; L446-A453 HydrophobicContact CD2-CB 4.22Å
447	R	91.4	Very high	84.3	Confident	80 Å²	80	57.6 Å²	57.6	30%	0.302	32%	0.32	S	S	.	.			trans	-59.9	147.2	176.5	-65.6	-176.3	-167.9	-96.6	11.8	109.5	C433 D436 P437 C438 C439 E440 K445 G449 A450	C433-R447 PolarHBondContact O-NH2 2.96Å; D436-R447 PolarHBondContact O-NE 3.49Å; D436-R447 PolarHBondContact O-NH2 3.5Å; P437-R447 WeakPolarHBondContact O-CD 3.31Å; C438-R447 PolarHBondContact O-N 3.29Å; C439-R447 PolarHBondContact O-NE 3.39Å; C439-R447 PolarHBondContact O-NH2 3.16Å; E440-R447 HydrophobicContact CB-CG 4.34Å; K445-R447 PolarHBondContact O-N 2.74Å; R447-G449 PolarHBondContact O-N 3.28Å; R447-A450 VanDerWaalsContact O-CB 3.3Å; R447-A450 WeakPolarHBondContact O-CB 3.11Å; R447-A450 PolarHBondContact O-N 3Å
448	P	91.3	Very high	83.9	Confident	144 Å²	144	54 Å²	54	94%	0.935	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	114	-174.4	-30.1	36.3	0	0	0	113.8
449	G	88.5	Confident	83.7	Confident	65 Å²	65	57 Å²	57	67%	0.67	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.4	-13.7	-177.6	0	0	0	0	0	115.1	R447 Q462	R447-G449 PolarHBondContact O-N 3.28Å; G449-Q462 PolarHBondContact O-NE2 2.73Å
450	A	92.4	Very high	83.8	Confident	21 Å²	21	60.1 Å²	60.1	17%	0.174	35%	0.35	C	S	.	.			trans	-74.9	149	171.1	0	0	0	0	0	112	L446 R447 C461	L446-A450 HydrophobicContact CB-CB 4.04Å; L446-A450 HydrophobicContact CD2-CB 4.07Å; R447-A450 VanDerWaalsContact O-CB 3.3Å; R447-A450 WeakPolarHBondContact O-CB 3.11Å; R447-A450 PolarHBondContact O-N 3Å; A450-C461 CarbonylContact C-O 3.39Å; A450-C461 WeakPolarHBondContact CA-O 3.12Å; A450-C461 HydrophobicContact CB-CB 3.63Å
451	Q	89.4	Confident	83.9	Confident	81 Å²	81	56.9 Å²	56.9	38%	0.379	34%	0.336	S	S	.	.	S	Bend	trans	-114.3	-19	174.2	-59.5	179.3	7.5	0	0	111.8	L446 C461 F463	L446-Q451 WeakPolarHBondContact CD1-O 3.32Å; Q451-C461 PolarHBondContact N-O 2.82Å; Q451-F463 HydrophobicContact CB-CD2 3.87Å; Q451-F463 HydrophobicContact CB-CE2 3.84Å; Q451-F463 HydrophobicContact CB-CG 4.34Å; Q451-F463 HydrophobicContact CB-CZ 4.27Å; Q451-F463 WeakPolarHBondContact O-CE1 3.43Å; Q451-F463 WeakPolarHBondContact O-CZ 3.36Å; Q451-F463 VanDerWaalsContact OE1-CD2 3.31Å
452	C	82	Confident	84.5	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.02	34%	0.342	C	S	.	.			trans	-159.3	167.7	177.1	60.7	0	0	0	0	110.2	C458 C461 Q462 F463	C452-C458 HydrophobicContact CB-CB 3.88Å; C452-C458 WeakPolarHBondContact CB-SG 3.18Å; C452-C458 WeakPolarHBondContact SG-CA 3.46Å; C452-C458 WeakPolarHBondContact SG-CB 3.13Å; C452-C458 CovalentContact SG-SG 2.04Å; C452-C458 PolarHBondContact SG-SG 3.12Å; C452-C461 PolarHBondContact N-O 2.91Å; C452-C461 CarbonylContact O-C 3.55Å; C452-C461 VanDerWaalsContact O-CA 3.32Å; C452-C461 WeakPolarHBondContact O-CA 3.35Å; C452-Q462 PolarHBondContact SG-O 2.99Å; C452-F463 HydrophobicContact CB-CD1 3.97Å; C452-F463 HydrophobicContact CB-CE1 3.8Å
453	A	74.2	Confident	84.7	Confident	24 Å²	24	50.9 Å²	50.9	20%	0.198	32%	0.318	C	S	.	.	S	Bend	trans	-124.4	-39.5	166.7	0	0	0	0	0	112.4	C425 C438 C439 L446 C458	C425-A453 HydrophobicContact CB-CB 3.49Å; C425-A453 VanDerWaalsContact CB-CB 3.49Å; C438-A453 HydrophobicContact CB-CB 3.69Å; C439-A453 HydrophobicContact CB-CB 4.03Å; L446-A453 HydrophobicContact CD2-CB 4.22Å; A453-C458 VanDerWaalsContact C-SG 3.6Å
454	S	69.2	Low	84.8	Confident	46 Å²	46	50 Å²	50	32%	0.322	31%	0.31	S	S	.	.	S	Bend	trans	-128.6	151.8	-171.1	57.9	0	0	0	0	113.6	S489	S454-S489 WeakPolarHBondContact O-CB 3.48Å; S454-S489 PolarHBondContact O-OG 2.59Å
455	G	63.6	Low	85	Confident	29 Å²	29	52.2 Å²	52.2	30%	0.299	33%	0.325	S	S	.	.	S	Bend	trans	115.7	160.5	178.9	0	0	0	0	0	113	C457 C458 S489	G455-C457 PolarHBondContact O-N 2.99Å; G455-C458 PolarHBondContact O-N 3.37Å; G455-C458 VanDerWaalsContact O-N 3.08Å; G455-S489 CarbonylContact C-O 3.49Å; G455-S489 VanDerWaalsContact CA-O 3.23Å; G455-S489 WeakPolarHBondContact CA-O 3.37Å
456	E	73.4	Confident	84.9	Confident	108 Å²	108	49.1 Å²	49.1	51%	0.505	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.7	-172.3	-48.4	80.8	-177.5	0	0	113.3	L464 C470 S489 F490 C491	E456-L464 WeakPolarHBondContact O-CD1 3.48Å; E456-C470 HydrophobicContact CB-CB 4.05Å; E456-S489 PolarHBondContact N-O 2.78Å; E456-F490 WeakPolarHBondContact OE2-CA 3.05Å; E456-C491 HydrophobicContact CB-CB 4.24Å; E456-C491 HydrophobicContact CG-CB 4.38Å; E456-C491 PolarHBondContact OE2-N 3.38Å
457	C	81.1	Confident	84.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	20.4	176.4	-68.5	0	0	0	0	113.2	G455 F463 L464 C470 C484 T488 S489	G455-C457 PolarHBondContact O-N 2.99Å; C457-F463 WeakPolarHBondContact O-CA 3.26Å; C457-L464 PolarHBondContact O-N 3.39Å; C457-C470 VanDerWaalsContact SG-CB 3.53Å; C457-C470 VanDerWaalsContact SG-SG 3.69Å; C457-C484 WeakPolarHBondContact CA-SG 3.32Å; C457-C484 HydrophobicContact CB-CB 3.78Å; C457-C484 WeakPolarHBondContact CB-SG 3.27Å; C457-C484 WeakPolarHBondContact SG-CA 3.4Å; C457-C484 WeakPolarHBondContact SG-CB 3.38Å; C457-C484 CovalentContact SG-SG 2.04Å; C457-C484 PolarHBondContact SG-SG 2.8Å; C457-T488 WeakPolarHBondContact CB-O 3.4Å; C457-S489 CarbonylContact C-O 3.29Å; C457-S489 VanDerWaalsContact CA-O 3.27Å; C457-S489 WeakPolarHBondContact CA-O 3.39Å; C457-S489 WeakPolarHBondContact CB-O 3.12Å; C457-S489 PolarHBondContact N-O 3.48Å
458	C	82.1	Confident	84.8	Confident	22 Å²	22	46.5 Å²	46.5	15%	0.149	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.3	172.2	-163.8	0	0	0	0	112	C452 A453 G455	C452-C458 HydrophobicContact CB-CB 3.88Å; C452-C458 WeakPolarHBondContact CB-SG 3.18Å; C452-C458 WeakPolarHBondContact SG-CA 3.46Å; C452-C458 WeakPolarHBondContact SG-CB 3.13Å; C452-C458 CovalentContact SG-SG 2.04Å; C452-C458 PolarHBondContact SG-SG 3.12Å; A453-C458 VanDerWaalsContact C-SG 3.6Å; G455-C458 PolarHBondContact O-N 3.37Å; G455-C458 VanDerWaalsContact O-N 3.08Å
459	S	88.4	Confident	84.6	Confident	73 Å²	73	43 Å²	43	51%	0.51	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	136.5	171.1	-174.7	0	0	0	0	111.3	C461 Q462 L464	S459-C461 PolarHBondContact O-N 3.04Å; S459-Q462 PolarHBondContact N-O 2.88Å; S459-Q462 PolarHBondContact O-N 3.24Å; S459-Q462 VanDerWaalsContact O-O 3.1Å; S459-L464 VanDerWaalsContact CB-CD2 3.49Å
460	G	89.5	Confident	84.1	Confident	66 Å²	66	41.1 Å²	41.1	68%	0.68	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	34	-177.1	0	0	0	0	0	113.1	Q462	G460-Q462 PolarHBondContact O-N 3.06Å
461	C	92.4	Very high	83.6	Confident	14 Å²	14	42.1 Å²	42.1	10%	0.095	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	12.2	-174	-37.9	0	0	0	0	115.8	P437 C438 A450 Q451 C452 S459	P437-C461 VanDerWaalsContact C-SG 3.54Å; P437-C461 PolarHBondContact O-SG 2.66Å; C438-C461 WeakPolarHBondContact CA-SG 3.42Å; C438-C461 HydrophobicContact CB-CB 3.58Å; C438-C461 WeakPolarHBondContact CB-SG 3.42Å; C438-C461 WeakPolarHBondContact SG-CA 3.47Å; C438-C461 WeakPolarHBondContact SG-CB 3.33Å; C438-C461 PolarHBondContact SG-N 3.31Å; C438-C461 CovalentContact SG-SG 2.03Å; C438-C461 PolarHBondContact SG-SG 2.74Å; A450-C461 CarbonylContact C-O 3.39Å; A450-C461 WeakPolarHBondContact CA-O 3.12Å; A450-C461 HydrophobicContact CB-CB 3.63Å; Q451-C461 PolarHBondContact N-O 2.82Å; C452-C461 PolarHBondContact N-O 2.91Å; C452-C461 CarbonylContact O-C 3.55Å; C452-C461 VanDerWaalsContact O-CA 3.32Å; C452-C461 WeakPolarHBondContact O-CA 3.35Å; S459-C461 PolarHBondContact O-N 3.04Å
462	Q	93.6	Very high	83.3	Confident	73 Å²	73	42.4 Å²	42.4	34%	0.341	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.2	177.1	-54.9	-58	-59.4	0	0	110.6	G449 C452 S459 G460 L464	G449-Q462 PolarHBondContact O-NE2 2.73Å; C452-Q462 PolarHBondContact SG-O 2.99Å; S459-Q462 PolarHBondContact N-O 2.88Å; S459-Q462 PolarHBondContact O-N 3.24Å; S459-Q462 VanDerWaalsContact O-O 3.1Å; G460-Q462 PolarHBondContact O-N 3.06Å; Q462-L464 PolarHBondContact O-N 3.11Å
463	F	87.6	Confident	83.4	Confident	48 Å²	48	45.2 Å²	45.2	21%	0.211	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	130	168	-61.2	-53.5	0	0	0	109.8	Q451 C452 C457 S487 T488	Q451-F463 HydrophobicContact CB-CD2 3.87Å; Q451-F463 HydrophobicContact CB-CE2 3.84Å; Q451-F463 HydrophobicContact CB-CG 4.34Å; Q451-F463 HydrophobicContact CB-CZ 4.27Å; Q451-F463 WeakPolarHBondContact O-CE1 3.43Å; Q451-F463 WeakPolarHBondContact O-CZ 3.36Å; Q451-F463 VanDerWaalsContact OE1-CD2 3.31Å; C452-F463 HydrophobicContact CB-CD1 3.97Å; C452-F463 HydrophobicContact CB-CE1 3.8Å; C457-F463 WeakPolarHBondContact O-CA 3.26Å; F463-S487 WeakPolarHBondContact CE2-O 3.49Å; F463-S487 WeakPolarHBondContact CZ-O 3.34Å; F463-T488 VanDerWaalsContact CD1-C 3.4Å; F463-T488 VanDerWaalsContact CE1-C 3.49Å
464	L	86.3	Confident	83.5	Confident	42 Å²	42	50.5 Å²	50.5	22%	0.22	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-57.6	140.6	169.6	-73.7	179.7	0	0	0	109.6	E456 C457 S459 Q462 T468 C484 G486	E456-L464 WeakPolarHBondContact O-CD1 3.48Å; C457-L464 PolarHBondContact O-N 3.39Å; S459-L464 VanDerWaalsContact CB-CD2 3.49Å; Q462-L464 PolarHBondContact O-N 3.11Å; L464-T468 HydrophobicContact CB-CG2 4.18Å; L464-T468 HydrophobicContact CD1-CG2 3.94Å; L464-T468 HydrophobicContact CG-CG2 4.49Å; L464-C484 HydrophobicContact CB-CB 4.32Å; L464-G486 WeakPolarHBondContact O-CA 3.37Å
465	P	88.9	Confident	84.3	Confident	48 Å²	48	49.8 Å²	49.8	31%	0.312	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-60.4	158.2	-174.3	19.6	-28.4	0	0	0	112.8	G467 T468 N687	P465-G467 PolarHBondContact O-N 2.67Å; P465-T468 WeakPolarHBondContact CD-OG1 3.25Å; P465-T468 WeakPolarHBondContact CG-OG1 3.4Å; P465-T468 WeakPolarHBondContact O-CB 3.46Å; P465-T468 PolarHBondContact O-N 3.39Å; P465-T468 VanDerWaalsContact O-N 3.13Å; P465-T468 PolarHBondContact O-OG1 2.91Å; P465-N687 HydrophobicContact CB-CB 4.17Å; P465-N687 VanDerWaalsContact CB-CG 3.42Å; P465-N687 WeakPolarHBondContact CB-ND2 3.41Å; P465-N687 WeakPolarHBondContact CB-OD1 3.41Å
466	G	89.2	Confident	85.6	Confident	8 Å²	8	55.4 Å²	55.4	8%	0.082	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	139.5	170.9	0	0	0	0	0	110.8	T468 C484 W686 N687	G466-T468 VanDerWaalsContact C-N 3.3Å; G466-T468 PolarHBondContact O-N 3.45Å; G466-C484 VanDerWaalsContact CA-O 3.29Å; G466-C484 WeakPolarHBondContact CA-O 3.21Å; G466-W686 VanDerWaalsContact C-C 3.45Å; G466-W686 CarbonylContact C-O 3.42Å; G466-W686 WeakPolarHBondContact CA-O 3.32Å; G466-W686 CarbonylContact O-C 3.37Å; G466-N687 WeakPolarHBondContact O-CA 3.29Å; G466-N687 VanDerWaalsContact O-CB 3.25Å; G466-N687 WeakPolarHBondContact O-CB 3.19Å; G466-N687 PolarHBondContact O-N 3.03Å
467	G	88.3	Confident	86.6	Confident	22 Å²	22	55 Å²	55	23%	0.227	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	3.9	-177.8	0	0	0	0	0	115.7	P465 V469 Y483 C484 P684 W686	P465-G467 PolarHBondContact O-N 2.67Å; G467-V469 PolarHBondContact O-N 2.92Å; G467-Y483 WeakPolarHBondContact O-CD1 3.36Å; G467-C484 PolarHBondContact N-O 2.67Å; G467-C484 VanDerWaalsContact N-O 3.11Å; G467-P684 WeakPolarHBondContact CA-O 3.22Å; G467-P684 PolarHBondContact N-O 3.26Å; G467-W686 PolarHBondContact N-O 2.74Å
468	T	89.1	Confident	87.1	Confident	40 Å²	40	55 Å²	55	25%	0.245	32%	0.315	C	S	.	.			trans	-74.8	119.9	168.7	-49.2	0	0	0	0	109.4	L464 P465 G466 C470 Y483 C484	L464-T468 HydrophobicContact CB-CG2 4.18Å; L464-T468 HydrophobicContact CD1-CG2 3.94Å; L464-T468 HydrophobicContact CG-CG2 4.49Å; P465-T468 WeakPolarHBondContact CD-OG1 3.25Å; P465-T468 WeakPolarHBondContact CG-OG1 3.4Å; P465-T468 WeakPolarHBondContact O-CB 3.46Å; P465-T468 PolarHBondContact O-N 3.39Å; P465-T468 VanDerWaalsContact O-N 3.13Å; P465-T468 PolarHBondContact O-OG1 2.91Å; G466-T468 VanDerWaalsContact C-N 3.3Å; G466-T468 PolarHBondContact O-N 3.45Å; T468-C470 PolarHBondContact O-N 2.92Å; T468-Y483 CarbonylContact O-C 3.49Å; T468-Y483 VanDerWaalsContact O-CA 3.3Å; T468-Y483 WeakPolarHBondContact O-CA 3.35Å; T468-C484 PolarHBondContact O-N 2.85Å; T468-C484 PolarHBondContact O-SG 2.81Å
469	V	88.1	Confident	87.5	Confident	69 Å²	69	54 Å²	54	42%	0.418	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	121.3	175.4	178.8	0	0	0	0	109.3	G467 R471 Y483	G467-V469 PolarHBondContact O-N 2.92Å; V469-R471 WeakPolarHBondContact CG1-O 3.47Å; V469-Y483 HydrophobicContact CG2-CD1 3.81Å; V469-Y483 HydrophobicContact CG2-CE1 3.46Å; V469-Y483 VanDerWaalsContact CG2-CE1 3.46Å
470	C	76.4	Confident	87.5	Confident	27 Å²	27	50.7 Å²	50.7	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-28.4	177	53	0	0	0	0	112.9	E456 C457 T468 E482 C491	E456-C470 HydrophobicContact CB-CB 4.05Å; C457-C470 VanDerWaalsContact SG-CB 3.53Å; C457-C470 VanDerWaalsContact SG-SG 3.69Å; T468-C470 PolarHBondContact O-N 2.92Å; C470-E482 PolarHBondContact N-O 2.97Å; C470-E482 PolarHBondContact SG-O 3.18Å; C470-C491 VanDerWaalsContact C-SG 3.56Å; C470-C491 HydrophobicContact CB-CB 3.65Å; C470-C491 WeakPolarHBondContact CB-SG 3.36Å; C470-C491 WeakPolarHBondContact SG-CA 3.24Å; C470-C491 WeakPolarHBondContact SG-CB 3.46Å; C470-C491 CovalentContact SG-SG 2.04Å; C470-C491 PolarHBondContact SG-SG 2.99Å
471	R	83	Confident	87.5	Confident	41 Å²	41	48.4 Å²	48.4	16%	0.155	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.4	166.1	-168.7	-170.5	71.3	94.2	-15.5	110.1	V469 K474 D479 L480 P481 E482 C491 D494 V495	V469-R471 WeakPolarHBondContact CG1-O 3.47Å; R471-K474 VanDerWaalsContact NH1-CE 3.28Å; R471-D479 IonicContact CZ-OD1 3.12Å; R471-D479 IonicContact CZ-OD2 3.46Å; R471-D479 VanDerWaalsContact NH1-CG 3.34Å; R471-D479 IonicContact NH1-OD1 3.65Å; R471-D479 PolarHBondContact NH1-OD1 3.01Å; R471-D479 IonicContact NH1-OD2 3.24Å; R471-D479 PolarHBondContact NH1-OD2 3.17Å; R471-D479 IonicContact NH2-OD1 3.04Å; R471-D479 PolarHBondContact NH2-OD1 3Å; R471-D479 IonicContact NH2-OD2 2.79Å; R471-L480 PolarHBondContact NH2-O 3.2Å; R471-P481 WeakPolarHBondContact O-CA 3.03Å; R471-E482 WeakPolarHBondContact CB-OE2 3.01Å; R471-E482 IonicContact CZ-OE1 2.69Å; R471-E482 IonicContact CZ-OE2 2.85Å; R471-E482 PolarHBondContact N-O 3.16Å; R471-E482 IonicContact NE-OE1 3.55Å; R471-E482 IonicContact NE-OE2 3.12Å; R471-E482 PolarHBondContact NE-OE2 3.02Å; R471-E482 VanDerWaalsContact NH2-CD 3.35Å; R471-E482 IonicContact NH2-OE1 3.47Å; R471-E482 PolarHBondContact NH2-OE1 2.75Å; R471-E482 IonicContact NH2-OE2 3.74Å; R471-E482 PolarHBondContact NH2-OE2 3.38Å; R471-E482 PolarHBondContact O-N 3.22Å; R471-C491 PolarHBondContact N-SG 3.25Å; R471-D494 WeakPolarHBondContact CD-OD2 3.15Å; R471-D494 IonicContact CZ-OD1 3.78Å; R471-D494 IonicContact CZ-OD2 2.63Å; R471-D494 VanDerWaalsContact CZ-OD2 3.29Å; R471-D494 IonicContact NE-OD2 3.15Å; R471-D494 PolarHBondContact NE-OD2 3.36Å; R471-D494 IonicContact NH1-OD2 3.19Å; R471-D494 IonicContact NH2-OD1 2.71Å; R471-D494 PolarHBondContact NH2-OD1 3.41Å; R471-D494 IonicContact NH2-OD2 3.63Å; R471-V495 PolarHBondContact NH2-O 3.2Å
472	S	82.4	Confident	87.2	Confident	87 Å²	87	47.7 Å²	47.7	61%	0.608	25%	0.253	S	S	*	.			trans	-84	152.6	172.9	-63.7	0	0	0	0	111.6	K474	S472-K474 PolarHBondContact O-N 2.78Å
473	K	84.4	Confident	86.9	Confident	62 Å²	62	46.1 Å²	46.1	27%	0.27	24%	0.244	S	C	.	.			trans	-53.5	130.1	168.4	-69	-169.4	173	-131.5	0	111.7	Q476 D479 P481	K473-Q476 PolarHBondContact NZ-O 3.45Å; K473-D479 HydrophobicContact CB-CB 4.36Å; K473-D479 WeakPolarHBondContact CD-O 3.38Å; K473-D479 WeakPolarHBondContact CE-O 3.22Å; K473-D479 PolarHBondContact NZ-O 2.49Å; K473-P481 HydrophobicContact CG-CB 4.49Å
474	K	77.2	Confident	86.8	Confident	136 Å²	136	43.8 Å²	43.8	59%	0.591	23%	0.234	S	C	*	.	S	Bend	trans	-83.6	-33	168.2	-56.3	155.6	-167.3	146.1	0	111.1	R471 S472 D479 D494	R471-K474 VanDerWaalsContact NH1-CE 3.28Å; S472-K474 PolarHBondContact O-N 2.78Å; K474-D479 VanDerWaalsContact CB-OD2 3.27Å; K474-D479 WeakPolarHBondContact CB-OD2 3.46Å; K474-D479 WeakPolarHBondContact CD-OD2 3.39Å; K474-D479 WeakPolarHBondContact CG-OD2 3.36Å; K474-D479 PolarHBondContact N-OD2 3.07Å; K474-D494 IonicContact NZ-OD1 3.69Å; K474-D494 IonicContact NZ-OD2 2.73Å; K474-D494 PolarHBondContact NZ-OD2 3.32Å
475	D	86.3	Confident	86.7	Confident	31 Å²	31	43.7 Å²	43.7	17%	0.166	23%	0.234	C	C	.	.	S	Bend	trans	-123.9	129.1	174.2	-175.9	-57.6	0	0	0	108.8	E477 C478 D479 G513 R514 C515	D475-E477 VanDerWaalsContact C-N 3.33Å; D475-E477 PolarHBondContact O-N 3.31Å; D475-E477 PolarHBondContact OD1-N 2.8Å; D475-C478 HydrophobicContact CB-CB 4.49Å; D475-C478 PolarHBondContact OD1-N 2.96Å; D475-D479 HydrophobicContact CB-CB 4.01Å; D475-D479 VanDerWaalsContact O-CB 3.23Å; D475-D479 WeakPolarHBondContact O-CB 3.35Å; D475-D479 PolarHBondContact O-N 3.15Å; D475-G513 WeakPolarHBondContact CB-O 3.33Å; D475-R514 WeakPolarHBondContact OD2-CA 3.5Å; D475-C515 PolarHBondContact OD2-N 2.72Å
476	Q	89.8	Confident	86.7	Confident	147 Å²	147	41.9 Å²	41.9	69%	0.687	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-30.1	-171.6	-64.8	-59.4	-37	0	0	113.5	K473	K473-Q476 PolarHBondContact NZ-O 3.45Å
477	E	93.8	Very high	86.3	Confident	98 Å²	98	45.1 Å²	45.1	46%	0.458	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-44.5	-178.6	-66.5	-173.4	-123.4	0	0	111.5	D475 V497 C503 R504	D475-E477 VanDerWaalsContact C-N 3.33Å; D475-E477 PolarHBondContact O-N 3.31Å; D475-E477 PolarHBondContact OD1-N 2.8Å; E477-V497 WeakPolarHBondContact O-CG2 3.24Å; E477-C503 HydrophobicContact CB-CB 4.14Å; E477-C503 WeakPolarHBondContact OE2-CA 3.35Å; E477-C503 VanDerWaalsContact OE2-CB 3.32Å; E477-C503 WeakPolarHBondContact OE2-CB 3.32Å; E477-R504 VanDerWaalsContact CD-N 3.35Å; E477-R504 PolarHBondContact OE1-N 2.99Å; E477-R504 PolarHBondContact OE2-N 2.86Å
478	C	93.3	Very high	85.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-10.4	-167.2	-65.6	0	0	0	0	115.9	D475 V497 C510 C515	D475-C478 HydrophobicContact CB-CB 4.49Å; D475-C478 PolarHBondContact OD1-N 2.96Å; C478-V497 WeakPolarHBondContact O-CB 3.43Å; C478-V497 PolarHBondContact O-N 3.34Å; C478-C510 WeakPolarHBondContact CA-SG 3.07Å; C478-C510 HydrophobicContact CB-CB 3.62Å; C478-C510 WeakPolarHBondContact CB-SG 3.24Å; C478-C510 WeakPolarHBondContact SG-CA 3.43Å; C478-C510 WeakPolarHBondContact SG-CB 3.29Å; C478-C510 CovalentContact SG-SG 2.03Å; C478-C510 PolarHBondContact SG-SG 2.86Å; C478-C515 WeakPolarHBondContact SG-CA 3.47Å; C478-C515 VanDerWaalsContact SG-CB 3.55Å; C478-C515 PolarHBondContact SG-N 3.26Å
479	D	89.4	Confident	85	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.011	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-102	158	171.8	-161.7	5.5	0	0	0	110.4	R471 K473 K474 D475	R471-D479 IonicContact CZ-OD1 3.12Å; R471-D479 IonicContact CZ-OD2 3.46Å; R471-D479 VanDerWaalsContact NH1-CG 3.34Å; R471-D479 IonicContact NH1-OD1 3.65Å; R471-D479 PolarHBondContact NH1-OD1 3.01Å; R471-D479 IonicContact NH1-OD2 3.24Å; R471-D479 PolarHBondContact NH1-OD2 3.17Å; R471-D479 IonicContact NH2-OD1 3.04Å; R471-D479 PolarHBondContact NH2-OD1 3Å; R471-D479 IonicContact NH2-OD2 2.79Å; K473-D479 HydrophobicContact CB-CB 4.36Å; K473-D479 WeakPolarHBondContact CD-O 3.38Å; K473-D479 WeakPolarHBondContact CE-O 3.22Å; K473-D479 PolarHBondContact NZ-O 2.49Å; K474-D479 VanDerWaalsContact CB-OD2 3.27Å; K474-D479 WeakPolarHBondContact CB-OD2 3.46Å; K474-D479 WeakPolarHBondContact CD-OD2 3.39Å; K474-D479 WeakPolarHBondContact CG-OD2 3.36Å; K474-D479 PolarHBondContact N-OD2 3.07Å; D475-D479 HydrophobicContact CB-CB 4.01Å; D475-D479 VanDerWaalsContact O-CB 3.23Å; D475-D479 WeakPolarHBondContact O-CB 3.35Å; D475-D479 PolarHBondContact O-N 3.15Å
480	L	89.5	Confident	84.1	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.249	C	C	.	.			trans	-112.8	164.6	175.5	-57.9	170.4	0	0	0	110.2	R471 V495 V497 V653 N655 H661	R471-L480 PolarHBondContact NH2-O 3.2Å; L480-V495 WeakPolarHBondContact CB-O 3.4Å; L480-V495 HydrophobicContact CD1-CG2 4.25Å; L480-V497 HydrophobicContact CD2-CG2 3.74Å; L480-V497 HydrophobicContact CG-CG2 4.07Å; L480-V653 HydrophobicContact CD2-CG2 4.13Å; L480-N655 HydrophobicContact CD1-CB 3.63Å; L480-H661 HydrophobicContact CD1-CB 3.97Å; L480-H661 HydrophobicContact CD2-CB 4.25Å
481	P	88.7	Confident	84	Confident	17 Å²	17	47.9 Å²	47.9	11%	0.11	25%	0.249	C	C	.	.			trans	-98.2	147	168.3	35.1	-28.1	0	0	0	111	R471 K473 Y483	R471-P481 WeakPolarHBondContact O-CA 3.03Å; K473-P481 HydrophobicContact CG-CB 4.49Å; P481-Y483 HydrophobicContact CB-CE2 4.18Å; P481-Y483 HydrophobicContact CG-CE2 3.8Å; P481-Y483 WeakPolarHBondContact CG-OH 3.01Å; P481-Y483 WeakPolarHBondContact O-CE2 3.44Å
482	E	85.7	Confident	83.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.8	173.6	-65	78.5	-175	0	0	111	C470 R471 Q492 D494 V495 S682	C470-E482 PolarHBondContact N-O 2.97Å; C470-E482 PolarHBondContact SG-O 3.18Å; R471-E482 WeakPolarHBondContact CB-OE2 3.01Å; R471-E482 IonicContact CZ-OE1 2.69Å; R471-E482 IonicContact CZ-OE2 2.85Å; R471-E482 PolarHBondContact N-O 3.16Å; R471-E482 IonicContact NE-OE1 3.55Å; R471-E482 IonicContact NE-OE2 3.12Å; R471-E482 PolarHBondContact NE-OE2 3.02Å; R471-E482 VanDerWaalsContact NH2-CD 3.35Å; R471-E482 IonicContact NH2-OE1 3.47Å; R471-E482 PolarHBondContact NH2-OE1 2.75Å; R471-E482 IonicContact NH2-OE2 3.74Å; R471-E482 PolarHBondContact NH2-OE2 3.38Å; R471-E482 PolarHBondContact O-N 3.22Å; E482-Q492 HydrophobicContact CB-CB 4.34Å; E482-Q492 HydrophobicContact CG-CB 4.46Å; E482-D494 WeakPolarHBondContact OE1-CA 3.43Å; E482-V495 HydrophobicContact CG-CG2 4.47Å; E482-V495 PolarHBondContact OE1-N 3Å; E482-S682 WeakPolarHBondContact CA-O 3.33Å
483	Y	88.3	Confident	82.9	Confident	39 Å²	39	48.5 Å²	48.5	15%	0.153	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.7	-167.8	-58	-93.8	0	0	0	110.9	G467 T468 V469 P481 N485 Q492 S682 P684 T685	G467-Y483 WeakPolarHBondContact O-CD1 3.36Å; T468-Y483 CarbonylContact O-C 3.49Å; T468-Y483 VanDerWaalsContact O-CA 3.3Å; T468-Y483 WeakPolarHBondContact O-CA 3.35Å; V469-Y483 HydrophobicContact CG2-CD1 3.81Å; V469-Y483 HydrophobicContact CG2-CE1 3.46Å; V469-Y483 VanDerWaalsContact CG2-CE1 3.46Å; P481-Y483 HydrophobicContact CB-CE2 4.18Å; P481-Y483 HydrophobicContact CG-CE2 3.8Å; P481-Y483 WeakPolarHBondContact CG-OH 3.01Å; P481-Y483 WeakPolarHBondContact O-CE2 3.44Å; Y483-N485 PolarHBondContact O-N 2.81Å; Y483-Q492 WeakPolarHBondContact O-CG 3.34Å; Y483-S682 PolarHBondContact N-O 3Å; Y483-P684 WeakPolarHBondContact CB-O 3.41Å; Y483-T685 HydrophobicContact CD2-CG2 4.04Å; Y483-T685 HydrophobicContact CE1-CG2 4.12Å; Y483-T685 HydrophobicContact CE2-CG2 3.62Å; Y483-T685 HydrophobicContact CG-CG2 4.48Å
484	C	85.7	Confident	82.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.			trans	-56.7	137.6	166.7	-57.5	0	0	0	0	110.2	C457 L464 G466 G467 T468	C457-C484 WeakPolarHBondContact CA-SG 3.32Å; C457-C484 HydrophobicContact CB-CB 3.78Å; C457-C484 WeakPolarHBondContact CB-SG 3.27Å; C457-C484 WeakPolarHBondContact SG-CA 3.4Å; C457-C484 WeakPolarHBondContact SG-CB 3.38Å; C457-C484 CovalentContact SG-SG 2.04Å; C457-C484 PolarHBondContact SG-SG 2.8Å; L464-C484 HydrophobicContact CB-CB 4.32Å; G466-C484 VanDerWaalsContact CA-O 3.29Å; G466-C484 WeakPolarHBondContact CA-O 3.21Å; G467-C484 PolarHBondContact N-O 2.67Å; G467-C484 VanDerWaalsContact N-O 3.11Å; T468-C484 PolarHBondContact O-N 2.85Å; T468-C484 PolarHBondContact O-SG 2.81Å
485	N	83.9	Confident	82.3	Confident	40 Å²	40	42.5 Å²	42.5	21%	0.214	23%	0.231	C	C	.	.			trans	-87.9	-6.2	176.8	58.2	21.9	0	0	0	113.3	Y483 S487 T488 Q492 P684	Y483-N485 PolarHBondContact O-N 2.81Å; N485-S487 VanDerWaalsContact C-N 3.3Å; N485-S487 PolarHBondContact O-N 3.09Å; N485-S487 PolarHBondContact OD1-N 2.97Å; N485-S487 PolarHBondContact OD1-OG 3.31Å; N485-T488 PolarHBondContact ND2-OG1 3.06Å; N485-T488 PolarHBondContact OD1-N 3.07Å; N485-T488 PolarHBondContact OD1-OG1 3.05Å; N485-T488 VanDerWaalsContact OD1-OG1 3.13Å; N485-Q492 PolarHBondContact ND2-NE2 3.22Å; N485-Q492 PolarHBondContact ND2-OE1 3.23Å; N485-P684 HydrophobicContact CB-CG 4.39Å
486	G	87.4	Confident	82.2	Confident	9 Å²	9	42.6 Å²	42.6	9%	0.093	23%	0.23	C	C	.	.	S	Bend	trans	76.1	11.6	-177.7	0	0	0	0	0	115.3	L464 K689	L464-G486 WeakPolarHBondContact O-CA 3.37Å; G486-K689 PolarHBondContact O-NZ 3.41Å
487	S	82.2	Confident	82.4	Confident	76 Å²	76	35.7 Å²	35.7	53%	0.531	20%	0.198	S	C	.	.	S	Bend	trans	-141.1	-5.7	-178.5	58.7	0	0	0	0	115.6	F463 N485	F463-S487 WeakPolarHBondContact CE2-O 3.49Å; F463-S487 WeakPolarHBondContact CZ-O 3.34Å; N485-S487 VanDerWaalsContact C-N 3.3Å; N485-S487 PolarHBondContact O-N 3.09Å; N485-S487 PolarHBondContact OD1-N 2.97Å; N485-S487 PolarHBondContact OD1-OG 3.31Å
488	T	76.3	Confident	82.3	Confident	57 Å²	57	31.5 Å²	31.5	35%	0.35	18%	0.178	S	C	.	.			trans	-131.8	150.9	172.5	62.4	0	0	0	0	111.4	C457 F463 N485 F490	C457-T488 WeakPolarHBondContact CB-O 3.4Å; F463-T488 VanDerWaalsContact CD1-C 3.4Å; F463-T488 VanDerWaalsContact CE1-C 3.49Å; N485-T488 PolarHBondContact ND2-OG1 3.06Å; N485-T488 PolarHBondContact OD1-N 3.07Å; N485-T488 PolarHBondContact OD1-OG1 3.05Å; N485-T488 VanDerWaalsContact OD1-OG1 3.13Å; T488-F490 PolarHBondContact OG1-O 3.26Å
489	S	73.1	Confident	82	Confident	20 Å²	20	33.1 Å²	33.1	14%	0.14	19%	0.187	C	C	.	.	S	Bend	trans	-85.9	-14.8	-177	64.2	0	0	0	0	114.8	S454 G455 E456 C457	S454-S489 WeakPolarHBondContact O-CB 3.48Å; S454-S489 PolarHBondContact O-OG 2.59Å; G455-S489 CarbonylContact C-O 3.49Å; G455-S489 VanDerWaalsContact CA-O 3.23Å; G455-S489 WeakPolarHBondContact CA-O 3.37Å; E456-S489 PolarHBondContact N-O 2.78Å; C457-S489 CarbonylContact C-O 3.29Å; C457-S489 VanDerWaalsContact CA-O 3.27Å; C457-S489 WeakPolarHBondContact CA-O 3.39Å; C457-S489 WeakPolarHBondContact CB-O 3.12Å; C457-S489 PolarHBondContact N-O 3.48Å
490	F	68.6	Low	82.1	Confident	113 Å²	113	33.4 Å²	33.4	50%	0.496	19%	0.19	S	C	.	.	S	Bend	trans	-97.8	153.2	175.8	-61.2	-73.8	0	0	0	111.9	E456 T488	E456-F490 WeakPolarHBondContact OE2-CA 3.05Å; T488-F490 PolarHBondContact OG1-O 3.26Å
491	C	74.6	Confident	82.3	Confident	26 Å²	26	34.9 Å²	34.9	18%	0.176	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-62.4	160	170.3	-158.2	0	0	0	0	112	E456 C470 R471	E456-C491 HydrophobicContact CB-CB 4.24Å; E456-C491 HydrophobicContact CG-CB 4.38Å; E456-C491 PolarHBondContact OE2-N 3.38Å; C470-C491 VanDerWaalsContact C-SG 3.56Å; C470-C491 HydrophobicContact CB-CB 3.65Å; C470-C491 WeakPolarHBondContact CB-SG 3.36Å; C470-C491 WeakPolarHBondContact SG-CA 3.24Å; C470-C491 WeakPolarHBondContact SG-CB 3.46Å; C470-C491 CovalentContact SG-SG 2.04Å; C470-C491 PolarHBondContact SG-SG 2.99Å; R471-C491 PolarHBondContact N-SG 3.25Å
492	Q	75.9	Confident	82.6	Confident	56 Å²	56	36.6 Å²	36.6	26%	0.262	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-75	166.2	173.6	-51.2	-57.3	-103.4	0	0	110.7	E482 Y483 N485 D494	E482-Q492 HydrophobicContact CB-CB 4.34Å; E482-Q492 HydrophobicContact CG-CB 4.46Å; Y483-Q492 WeakPolarHBondContact O-CG 3.34Å; N485-Q492 PolarHBondContact ND2-NE2 3.22Å; N485-Q492 PolarHBondContact ND2-OE1 3.23Å; Q492-D494 PolarHBondContact O-N 2.8Å
493	S	66.9	Low	83	Confident	85 Å²	85	36.7 Å²	36.7	59%	0.594	21%	0.209	S	C	*	.	P	Polyproline II helix	trans	-60.7	134	-178.3	-59.5	0	0	0	0	112.2	V495	S493-V495 PolarHBondContact O-N 2.86Å; S493-V495 VanDerWaalsContact O-N 3.16Å
494	D	69.4	Low	83.2	Confident	70 Å²	70	38.9 Å²	38.9	37%	0.374	22%	0.217	S	C	.	.			trans	-54	115.6	174.5	-161.9	-59.5	0	0	0	110.5	R471 K474 E482 Q492	R471-D494 WeakPolarHBondContact CD-OD2 3.15Å; R471-D494 IonicContact CZ-OD1 3.78Å; R471-D494 IonicContact CZ-OD2 2.63Å; R471-D494 VanDerWaalsContact CZ-OD2 3.29Å; R471-D494 IonicContact NE-OD2 3.15Å; R471-D494 PolarHBondContact NE-OD2 3.36Å; R471-D494 IonicContact NH1-OD2 3.19Å; R471-D494 IonicContact NH2-OD1 2.71Å; R471-D494 PolarHBondContact NH2-OD1 3.41Å; R471-D494 IonicContact NH2-OD2 3.63Å; K474-D494 IonicContact NZ-OD1 3.69Å; K474-D494 IonicContact NZ-OD2 2.73Å; K474-D494 PolarHBondContact NZ-OD2 3.32Å; E482-D494 WeakPolarHBondContact OE1-CA 3.43Å; Q492-D494 PolarHBondContact O-N 2.8Å
495	V	79.3	Confident	83.4	Confident	2 Å²	2	46 Å²	46	1%	0.012	26%	0.255	C	S	.	.			trans	-127.3	143.9	175.3	-71.6	0	0	0	0	110	R471 L480 E482 S493 N655 D681 S682	R471-V495 PolarHBondContact NH2-O 3.2Å; L480-V495 WeakPolarHBondContact CB-O 3.4Å; L480-V495 HydrophobicContact CD1-CG2 4.25Å; E482-V495 HydrophobicContact CG-CG2 4.47Å; E482-V495 PolarHBondContact OE1-N 3Å; S493-V495 PolarHBondContact O-N 2.86Å; S493-V495 VanDerWaalsContact O-N 3.16Å; V495-N655 HydrophobicContact CB-CB 4.5Å; V495-D681 HydrophobicContact CG1-CB 4.02Å; V495-D681 HydrophobicContact CG2-CB 4.39Å; V495-S682 VanDerWaalsContact CG2-OG 3.28Å; V495-S682 WeakPolarHBondContact CG2-OG 3.22Å
496	F	84.8	Confident	83.7	Confident	34 Å²	34	51.1 Å²	51.1	15%	0.149	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-129.1	169.3	-176.1	49.8	-92	0	0	0	110.7	N499 N655 S656	F496-N499 WeakPolarHBondContact CE2-OD1 3.48Å; F496-N655 CarbonylContact O-C 3.44Å; F496-N655 VanDerWaalsContact O-C 3.31Å; F496-N655 WeakPolarHBondContact O-CA 3.36Å; F496-S656 PolarHBondContact O-N 3.26Å
497	V	92.8	Very high	83.8	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-66.8	136.7	178.5	-177.5	0	0	0	0	110.2	E477 C478 L480 N499 H501 V653	E477-V497 WeakPolarHBondContact O-CG2 3.24Å; C478-V497 WeakPolarHBondContact O-CB 3.43Å; C478-V497 PolarHBondContact O-N 3.34Å; L480-V497 HydrophobicContact CD2-CG2 3.74Å; L480-V497 HydrophobicContact CG-CG2 4.07Å; V497-N499 PolarHBondContact O-N 3.13Å; V497-H501 HydrophobicContact CG1-CB 3.53Å; V497-H501 VanDerWaalsContact CG1-CG 3.49Å; V497-V653 HydrophobicContact CG1-CB 4.39Å; V497-V653 HydrophobicContact CG1-CG2 4.38Å; V497-V653 HydrophobicContact CG2-CG2 4.01Å
498	Q	92	Very high	84.5	Confident	10 Å²	10	52.7 Å²	52.7	5%	0.047	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-53.8	132.6	-172.7	-173.8	173.2	-16.8	0	0	112.3	G500 H501 Y640 D641 C654	Q498-G500 PolarHBondContact O-N 3.44Å; Q498-H501 WeakPolarHBondContact O-CB 3.11Å; Q498-H501 PolarHBondContact O-N 3.15Å; Q498-Y640 HydrophobicContact CB-CD2 4.29Å; Q498-Y640 HydrophobicContact CB-CE2 4.19Å; Q498-Y640 HydrophobicContact CG-CD2 4.04Å; Q498-Y640 HydrophobicContact CG-CE2 4.39Å; Q498-D641 PolarHBondContact NE2-OD1 3.14Å; Q498-C654 HydrophobicContact CB-CB 4.07Å; Q498-C654 PolarHBondContact N-O 3.32Å; Q498-C654 VanDerWaalsContact OE1-CB 3.24Å
499	N	87.9	Confident	85.3	Confident	35 Å²	35	51.1 Å²	51.1	19%	0.187	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	128.3	179.7	-71.7	-0.9	0	0	0	111.1	F496 V497 C510 Y511 N512 Y640	F496-N499 WeakPolarHBondContact CE2-OD1 3.48Å; V497-N499 PolarHBondContact O-N 3.13Å; N499-C510 CarbonylContact C-O 3.52Å; N499-C510 WeakPolarHBondContact CA-O 3.38Å; N499-Y511 HydrophobicContact CB-CD2 4.15Å; N499-Y511 WeakPolarHBondContact OD1-CA 3.42Å; N499-N512 PolarHBondContact ND2-OD1 2.89Å; N499-N512 PolarHBondContact OD1-N 3.43Å; N499-Y640 WeakPolarHBondContact O-CD2 3.3Å
500	G	91.4	Very high	86.3	Confident	8 Å²	8	50.2 Å²	50.2	8%	0.082	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-4.4	-175	0	0	0	0	0	115.5	Q498 Y509 C510 L638	Q498-G500 PolarHBondContact O-N 3.44Å; G500-Y509 WeakPolarHBondContact O-CD1 2.95Å; G500-C510 PolarHBondContact N-O 3.4Å; G500-L638 VanDerWaalsContact CA-CD1 3.46Å
501	H	94.3	Very high	87.2	Confident	34 Å²	34	46.1 Å²	46.1	16%	0.157	24%	0.237	C	C	.	.			trans	-60.2	133	166.2	-166.7	-69.4	0	0	0	109.9	V497 Q498 Y509 C510 Y640 V653	V497-H501 HydrophobicContact CG1-CB 3.53Å; V497-H501 VanDerWaalsContact CG1-CG 3.49Å; Q498-H501 WeakPolarHBondContact O-CB 3.11Å; Q498-H501 PolarHBondContact O-N 3.15Å; H501-Y509 CarbonylContact O-C 3.44Å; H501-Y509 WeakPolarHBondContact O-CA 3.35Å; H501-C510 HydrophobicContact CB-CB 4.19Å; H501-C510 PolarHBondContact O-N 3.1Å; H501-Y640 HydrophobicContact CB-CE2 3.78Å; H501-Y640 PolarHBondContact CD2-OH 2.95Å; H501-V653 WeakPolarHBondContact NE2-CG1 3.29Å
502	P	93.8	Very high	87.4	Confident	53 Å²	53	47.2 Å²	47.2	34%	0.344	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	144	176.5	27.7	-34.3	0	0	0	111.6	Q506	P502-Q506 HydrophobicContact CB-CB 4.35Å; P502-Q506 HydrophobicContact CB-CG 4.14Å
503	C	94.1	Very high	87.5	Confident	2 Å²	2	45 Å²	45	1%	0.014	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	173.7	175.4	65	0	0	0	0	110.9	E477 N505 Q506 Q507 A508 Y509 C515	E477-C503 HydrophobicContact CB-CB 4.14Å; E477-C503 WeakPolarHBondContact OE2-CA 3.35Å; E477-C503 VanDerWaalsContact OE2-CB 3.32Å; E477-C503 WeakPolarHBondContact OE2-CB 3.32Å; C503-N505 PolarHBondContact O-N 2.96Å; C503-Q506 PolarHBondContact O-N 3.32Å; C503-Q506 VanDerWaalsContact O-N 3.09Å; C503-Q507 PolarHBondContact O-N 2.81Å; C503-A508 PolarHBondContact N-O 2.97Å; C503-A508 PolarHBondContact O-N 3.4Å; C503-A508 VanDerWaalsContact SG-C 3.5Å; C503-A508 VanDerWaalsContact SG-CB 3.55Å; C503-Y509 PolarHBondContact SG-N 3.43Å; C503-C515 HydrophobicContact CB-CB 3.9Å; C503-C515 WeakPolarHBondContact CB-SG 3.35Å; C503-C515 WeakPolarHBondContact SG-CA 3.04Å; C503-C515 WeakPolarHBondContact SG-CB 3.37Å; C503-C515 CovalentContact SG-SG 2.04Å; C503-C515 PolarHBondContact SG-SG 2.04Å
504	R	92.9	Very high	88.3	Confident	86 Å²	86	48.3 Å²	48.3	33%	0.325	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	52	-176.3	-164.9	-175.7	-178.4	-164.7	4.6	111.2	E477 Q506 Q507 A508 H517 D519	E477-R504 VanDerWaalsContact CD-N 3.35Å; E477-R504 PolarHBondContact OE1-N 2.99Å; E477-R504 PolarHBondContact OE2-N 2.86Å; R504-Q506 PolarHBondContact O-N 3.02Å; R504-Q507 HydrophobicContact CB-CB 4.44Å; R504-Q507 HydrophobicContact CG-CB 4.45Å; R504-Q507 WeakPolarHBondContact O-CB 3.38Å; R504-Q507 VanDerWaalsContact O-CG 3.22Å; R504-Q507 WeakPolarHBondContact O-CG 3.22Å; R504-Q507 PolarHBondContact O-N 2.8Å; R504-Q507 VanDerWaalsContact O-N 3.12Å; R504-A508 HydrophobicContact CB-CB 4.23Å; R504-H517 PolarHBondContact NH1-CD2 2.83Å; R504-D519 IonicContact CZ-OD2 3.7Å; R504-D519 VanDerWaalsContact CZ-OD2 3.32Å; R504-D519 IonicContact NH1-OD2 3.6Å; R504-D519 PolarHBondContact NH1-OD2 3.09Å; R504-D519 IonicContact NH2-OD2 3.59Å; R504-D519 PolarHBondContact NH2-OD2 3.45Å
505	N	90.4	Very high	89.4	Confident	149 Å²	149	45.5 Å²	45.5	80%	0.797	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	48	-173.8	-60.6	-38.6	0	0	0	113.5	C503 Q507	C503-N505 PolarHBondContact O-N 2.96Å; N505-Q507 PolarHBondContact O-N 3.06Å
506	Q	89.1	Confident	89.9	Confident	148 Å²	148	46.5 Å²	46.5	69%	0.692	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	10.9	-178.3	-46	176.2	15.2	0	0	114.9	P502 C503 R504 A508 K620	P502-Q506 HydrophobicContact CB-CB 4.35Å; P502-Q506 HydrophobicContact CB-CG 4.14Å; C503-Q506 PolarHBondContact O-N 3.32Å; C503-Q506 VanDerWaalsContact O-N 3.09Å; R504-Q506 PolarHBondContact O-N 3.02Å; Q506-A508 VanDerWaalsContact C-N 3.34Å; Q506-K620 PolarHBondContact O-NZ 2.98Å
507	Q	91.1	Very high	90.3	Very high	117 Å²	117	47 Å²	47	55%	0.547	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-11.6	175.4	-58.3	178.8	-0.5	0	0	113	C503 R504 N505 K620	C503-Q507 PolarHBondContact O-N 2.81Å; R504-Q507 HydrophobicContact CB-CB 4.44Å; R504-Q507 HydrophobicContact CG-CB 4.45Å; R504-Q507 WeakPolarHBondContact O-CB 3.38Å; R504-Q507 VanDerWaalsContact O-CG 3.22Å; R504-Q507 WeakPolarHBondContact O-CG 3.22Å; R504-Q507 PolarHBondContact O-N 2.8Å; R504-Q507 VanDerWaalsContact O-N 3.12Å; N505-Q507 PolarHBondContact O-N 3.06Å; Q507-K620 WeakPolarHBondContact O-CD 2.99Å
508	A	95.1	Very high	90.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	178.4	179.5	0	0	0	0	0	111.1	C503 R504 Q506 C515 H517	C503-A508 PolarHBondContact N-O 2.97Å; C503-A508 PolarHBondContact O-N 3.4Å; C503-A508 VanDerWaalsContact SG-C 3.5Å; C503-A508 VanDerWaalsContact SG-CB 3.55Å; R504-A508 HydrophobicContact CB-CB 4.23Å; Q506-A508 VanDerWaalsContact C-N 3.34Å; A508-C515 VanDerWaalsContact CB-SG 3.59Å; A508-H517 HydrophobicContact CB-CB 4.05Å
509	Y	94.4	Very high	90.5	Very high	25 Å²	25	49.3 Å²	49.3	10%	0.098	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.3	176.2	-62.1	-81.4	0	0	0	111.4	G500 H501 C503 Q516 K620 V626 A635	G500-Y509 WeakPolarHBondContact O-CD1 2.95Å; H501-Y509 CarbonylContact O-C 3.44Å; H501-Y509 WeakPolarHBondContact O-CA 3.35Å; C503-Y509 PolarHBondContact SG-N 3.43Å; Y509-Q516 PolarHBondContact O-N 3.27Å; Y509-K620 HydrophobicContact CD2-CB 4.1Å; Y509-K620 HydrophobicContact CD2-CG 4.3Å; Y509-K620 HydrophobicContact CE2-CB 4.24Å; Y509-K620 HydrophobicContact CE2-CD 4.1Å; Y509-K620 HydrophobicContact CE2-CG 3.92Å; Y509-V626 HydrophobicContact CD2-CG1 3.39Å; Y509-V626 HydrophobicContact CE2-CG1 3.74Å; Y509-V626 HydrophobicContact CG-CG1 4.17Å; Y509-A635 HydrophobicContact CE1-CB 4.48Å; Y509-A635 HydrophobicContact CE2-CB 4.41Å
510	C	92.6	Very high	90.6	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.8	168.8	-61.8	0	0	0	0	110.5	C478 N499 G500 H501 R514	C478-C510 WeakPolarHBondContact CA-SG 3.07Å; C478-C510 HydrophobicContact CB-CB 3.62Å; C478-C510 WeakPolarHBondContact CB-SG 3.24Å; C478-C510 WeakPolarHBondContact SG-CA 3.43Å; C478-C510 WeakPolarHBondContact SG-CB 3.29Å; C478-C510 CovalentContact SG-SG 2.03Å; C478-C510 PolarHBondContact SG-SG 2.86Å; N499-C510 CarbonylContact C-O 3.52Å; N499-C510 WeakPolarHBondContact CA-O 3.38Å; G500-C510 PolarHBondContact N-O 3.4Å; H501-C510 HydrophobicContact CB-CB 4.19Å; H501-C510 PolarHBondContact O-N 3.1Å; C510-R514 WeakPolarHBondContact CA-O 3.43Å
511	Y	87.6	Confident	90.5	Very high	26 Å²	26	48.9 Å²	48.9	10%	0.102	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	118.7	171.5	-172.1	-98	0	0	0	110.1	N499 G513 R514 Q516 E617 M628 L638	N499-Y511 HydrophobicContact CB-CD2 4.15Å; N499-Y511 WeakPolarHBondContact OD1-CA 3.42Å; Y511-G513 PolarHBondContact O-N 2.88Å; Y511-R514 PolarHBondContact N-O 2.73Å; Y511-R514 PolarHBondContact O-N 3.49Å; Y511-Q516 PolarHBondContact O-NE2 2.95Å; Y511-Q516 VanDerWaalsContact O-NE2 3.14Å; Y511-E617 WeakPolarHBondContact CD1-O 3.47Å; Y511-E617 HydrophobicContact CE1-CB 3.99Å; Y511-M628 HydrophobicContact CE2-CE 3.79Å; Y511-L638 HydrophobicContact CD2-CD2 3.57Å; Y511-L638 HydrophobicContact CE2-CD2 3.6Å
512	N	78.8	Confident	90.4	Very high	49 Å²	49	47.2 Å²	47.2	26%	0.262	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	52.6	-177.9	-58.3	-11.5	0	0	0	112.4	Q283 N499 R514	Q283-N512 PolarHBondContact NE2-ND2 3.3Å; N499-N512 PolarHBondContact ND2-OD1 2.89Å; N499-N512 PolarHBondContact OD1-N 3.43Å; N512-R514 VanDerWaalsContact C-N 3.33Å; N512-R514 PolarHBondContact O-N 2.97Å
513	G	78.7	Confident	90.2	Very high	9 Å²	9	48.5 Å²	48.5	9%	0.093	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	13.9	175.3	0	0	0	0	0	116.4	D475 Y511	D475-G513 WeakPolarHBondContact CB-O 3.33Å; Y511-G513 PolarHBondContact O-N 2.88Å
514	R	83.1	Confident	89.7	Confident	156 Å²	156	51.3 Å²	51.3	59%	0.589	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.3	175.9	-69.3	-178.5	175.8	163.3	0	112.3	D475 C510 Y511 N512 Q516	D475-R514 WeakPolarHBondContact OD2-CA 3.5Å; C510-R514 WeakPolarHBondContact CA-O 3.43Å; Y511-R514 PolarHBondContact N-O 2.73Å; Y511-R514 PolarHBondContact O-N 3.49Å; N512-R514 VanDerWaalsContact C-N 3.33Å; N512-R514 PolarHBondContact O-N 2.97Å; R514-Q516 PolarHBondContact O-N 3.08Å
515	C	92.7	Very high	89.1	Confident	11 Å²	11	47.7 Å²	47.7	7%	0.074	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	97.3	171.2	-175.2	0	0	0	0	109.6	D475 C478 C503 A508 H517	D475-C515 PolarHBondContact OD2-N 2.72Å; C478-C515 WeakPolarHBondContact SG-CA 3.47Å; C478-C515 VanDerWaalsContact SG-CB 3.55Å; C478-C515 PolarHBondContact SG-N 3.26Å; C503-C515 HydrophobicContact CB-CB 3.9Å; C503-C515 WeakPolarHBondContact CB-SG 3.35Å; C503-C515 WeakPolarHBondContact SG-CA 3.04Å; C503-C515 WeakPolarHBondContact SG-CB 3.37Å; C503-C515 CovalentContact SG-SG 2.04Å; C503-C515 PolarHBondContact SG-SG 2.04Å; A508-C515 VanDerWaalsContact CB-SG 3.59Å; C515-H517 PolarHBondContact O-N 2.89Å; C515-H517 PolarHBondContact O-ND1 3.44Å
516	Q	90.8	Very high	88.8	Confident	22 Å²	22	41.7 Å²	41.7	10%	0.103	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115.1	-169.2	-60	-66.9	-8.1	0	0	111.9	Y509 Y511 R514 N616 E617	Y509-Q516 PolarHBondContact O-N 3.27Å; Y511-Q516 PolarHBondContact O-NE2 2.95Å; Y511-Q516 VanDerWaalsContact O-NE2 3.14Å; R514-Q516 PolarHBondContact O-N 3.08Å; Q516-N616 PolarHBondContact OE1-ND2 2.69Å; Q516-E617 WeakPolarHBondContact CG-O 3.39Å
517	H	93.3	Very high	88.6	Confident	46 Å²	46	35.7 Å²	35.7	21%	0.213	19%	0.187	C	C	.	.			trans	-153	147	179.8	65.3	-77.1	0	0	0	112.1	R504 A508 C515 D519 G520 Q521	R504-H517 PolarHBondContact NH1-CD2 2.83Å; A508-H517 HydrophobicContact CB-CB 4.05Å; C515-H517 PolarHBondContact O-N 2.89Å; C515-H517 PolarHBondContact O-ND1 3.44Å; H517-D519 PolarHBondContact O-N 3.1Å; H517-G520 PolarHBondContact CD2-N 3.18Å; H517-G520 WeakPolarHBondContact NE2-CA 3.18Å; H517-G520 PolarHBondContact NE2-N 3.48Å; H517-G520 PolarHBondContact O-N 3.33Å; H517-Q521 PolarHBondContact O-N 3.44Å
518	L	94.7	Very high	88.4	Confident	23 Å²	23	35.7 Å²	35.7	12%	0.12	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-39.9	-172.1	-62.8	171.4	0	0	0	113.5	G520 Q521 C522 A532 F538 L571 V615 T619	L518-G520 PolarHBondContact O-N 2.77Å; L518-Q521 PolarHBondContact O-N 3.14Å; L518-C522 PolarHBondContact O-N 2.02Å; L518-C522 PolarHBondContact O-SG 2.03Å; L518-A532 HydrophobicContact CB-CB 3.56Å; L518-A532 HydrophobicContact CD1-CB 4.43Å; L518-F538 HydrophobicContact CD1-CE2 4.32Å; L518-F538 HydrophobicContact CD1-CZ 4.03Å; L518-F538 HydrophobicContact CD2-CE1 4.32Å; L518-F538 HydrophobicContact CD2-CZ 4.09Å; L518-L571 HydrophobicContact CD2-CD1 3.73Å; L518-V615 HydrophobicContact CD2-CB 4.29Å; L518-V615 HydrophobicContact CD2-CG1 3.64Å; L518-V615 HydrophobicContact CD2-CG2 3.61Å; L518-T619 HydrophobicContact CD2-CG2 3.86Å; L518-T619 HydrophobicContact CG-CG2 3.93Å
519	D	93.2	Very high	88	Confident	35 Å²	35	43.4 Å²	43.4	19%	0.187	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-46.6	178.5	-54.8	-54.9	0	0	0	111.8	R504 H517 Q521 C522 Q523 A532	R504-D519 IonicContact CZ-OD2 3.7Å; R504-D519 VanDerWaalsContact CZ-OD2 3.32Å; R504-D519 IonicContact NH1-OD2 3.6Å; R504-D519 PolarHBondContact NH1-OD2 3.09Å; R504-D519 IonicContact NH2-OD2 3.59Å; R504-D519 PolarHBondContact NH2-OD2 3.45Å; H517-D519 PolarHBondContact O-N 3.1Å; D519-Q521 VanDerWaalsContact C-N 3.3Å; D519-Q521 PolarHBondContact O-N 2.99Å; D519-C522 WeakPolarHBondContact O-CB 3.45Å; D519-C522 PolarHBondContact O-N 3.01Å; D519-Q523 WeakPolarHBondContact O-CB 3.42Å; D519-Q523 VanDerWaalsContact O-CG 3.24Å; D519-Q523 WeakPolarHBondContact O-CG 3.26Å; D519-Q523 PolarHBondContact O-N 3.36Å; D519-A532 WeakPolarHBondContact OD1-CB 3.5Å; D519-A532 PolarHBondContact OD1-N 2.58Å
520	G	89.9	Confident	87.9	Confident	22 Å²	22	42.2 Å²	42.2	23%	0.227	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-36.2	-178.7	0	0	0	0	0	112.2	H517 L518 Q523 A524	H517-G520 PolarHBondContact CD2-N 3.18Å; H517-G520 WeakPolarHBondContact NE2-CA 3.18Å; H517-G520 PolarHBondContact NE2-N 3.48Å; H517-G520 PolarHBondContact O-N 3.33Å; L518-G520 PolarHBondContact O-N 2.77Å; G520-Q523 PolarHBondContact O-N 2.86Å; G520-A524 WeakPolarHBondContact O-CB 3.46Å; G520-A524 PolarHBondContact O-N 3.34Å
521	Q	90.6	Very high	87.9	Confident	12 Å²	12	44.4 Å²	44.4	6%	0.056	24%	0.24	C	C	.	.	H	α-helix	trans	-68.4	-45	172.8	-163.7	178.4	-10.9	0	0	111.4	H517 L518 D519 Q523 A524 L525 L571 P612 M614 N616	H517-Q521 PolarHBondContact O-N 3.44Å; L518-Q521 PolarHBondContact O-N 3.14Å; D519-Q521 VanDerWaalsContact C-N 3.3Å; D519-Q521 PolarHBondContact O-N 2.99Å; Q521-Q523 VanDerWaalsContact C-N 3.3Å; Q521-Q523 PolarHBondContact O-N 3.12Å; Q521-A524 PolarHBondContact O-N 2.03Å; Q521-L525 HydrophobicContact CG-CD1 4.12Å; Q521-L525 VanDerWaalsContact O-CG 3.28Å; Q521-L525 WeakPolarHBondContact O-CG 3.46Å; Q521-L525 PolarHBondContact O-N 3.18Å; Q521-L571 HydrophobicContact CB-CD2 4.12Å; Q521-L571 HydrophobicContact CG-CD2 3.79Å; Q521-P612 PolarHBondContact NE2-O 3.4Å; Q521-M614 PolarHBondContact NE2-O 3.02Å; Q521-N616 PolarHBondContact NE2-OD1 2.92Å
522	C	91.3	Very high	88.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-41.1	173.1	-73	0	0	0	0	112.4	L518 D519 L525 F526 A530 T531 C573	L518-C522 PolarHBondContact O-N 2.02Å; L518-C522 PolarHBondContact O-SG 2.03Å; D519-C522 WeakPolarHBondContact O-CB 3.45Å; D519-C522 PolarHBondContact O-N 3.01Å; C522-L525 PolarHBondContact O-N 3.25Å; C522-F526 WeakPolarHBondContact O-CB 3.1Å; C522-F526 PolarHBondContact O-N 3.21Å; C522-A530 HydrophobicContact CB-CB 4.11Å; C522-A530 WeakPolarHBondContact O-CB 3.26Å; C522-T531 PolarHBondContact SG-O 2.8Å; C522-T531 VanDerWaalsContact SG-O 3.36Å; C522-C573 VanDerWaalsContact CA-SG 3.52Å; C522-C573 HydrophobicContact CB-CB 3.83Å; C522-C573 WeakPolarHBondContact CB-SG 3.27Å; C522-C573 VanDerWaalsContact SG-CA 3.58Å; C522-C573 WeakPolarHBondContact SG-CB 3.23Å; C522-C573 CovalentContact SG-SG 2.04Å; C522-C573 PolarHBondContact SG-SG 3.45Å
523	Q	89.5	Confident	89	Confident	79 Å²	79	42.3 Å²	42.3	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-68.7	-36.1	177.8	-71.6	170.3	14.4	0	0	112.7	D519 G520 Q521 G527 A530	D519-Q523 WeakPolarHBondContact O-CB 3.42Å; D519-Q523 VanDerWaalsContact O-CG 3.24Å; D519-Q523 WeakPolarHBondContact O-CG 3.26Å; D519-Q523 PolarHBondContact O-N 3.36Å; G520-Q523 PolarHBondContact O-N 2.86Å; Q521-Q523 VanDerWaalsContact C-N 3.3Å; Q521-Q523 PolarHBondContact O-N 3.12Å; Q523-G527 WeakPolarHBondContact CA-O 3.41Å; Q523-G527 CarbonylContact O-C 3.57Å; Q523-G527 VanDerWaalsContact O-C 3.32Å; Q523-G527 WeakPolarHBondContact O-CA 3.12Å; Q523-G527 PolarHBondContact O-N 2.9Å; Q523-A530 WeakPolarHBondContact CG-O 3.36Å; Q523-A530 PolarHBondContact NE2-O 2.81Å
524	A	83.4	Confident	89.7	Confident	61 Å²	61	44.9 Å²	44.9	50%	0.504	25%	0.25	S	C	.	.	H	α-helix	trans	-64.3	-43.1	173	0	0	0	0	0	111.5	G520 Q521 V581	G520-A524 WeakPolarHBondContact O-CB 3.46Å; G520-A524 PolarHBondContact O-N 3.34Å; Q521-A524 PolarHBondContact O-N 2.03Å; A524-V581 WeakPolarHBondContact O-CG1 3.46Å; A524-V581 WeakPolarHBondContact O-CG2 3.31Å
525	L	80.9	Confident	90.1	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-81.4	-26.7	-174.8	-62.9	171.8	0	0	0	114.8	Q521 C522 L571 V581 F582 V601 F603 P612	Q521-L525 HydrophobicContact CG-CD1 4.12Å; Q521-L525 VanDerWaalsContact O-CG 3.28Å; Q521-L525 WeakPolarHBondContact O-CG 3.46Å; Q521-L525 PolarHBondContact O-N 3.18Å; C522-L525 PolarHBondContact O-N 3.25Å; L525-L571 HydrophobicContact CD1-CD2 3.48Å; L525-L571 VanDerWaalsContact CD1-CD2 3.48Å; L525-V581 WeakPolarHBondContact O-CG2 3.35Å; L525-F582 HydrophobicContact CD2-CE2 4.01Å; L525-V601 HydrophobicContact CD1-CG1 4.45Å; L525-F603 HydrophobicContact CD2-CE2 4.17Å; L525-F603 HydrophobicContact CD2-CZ 3.98Å; L525-P612 WeakPolarHBondContact CD1-O 3.44Å; L525-P612 HydrophobicContact CD2-CB 3.96Å
526	F	84.4	Confident	90.1	Very high	22 Å²	22	43.2 Å²	43.2	10%	0.096	25%	0.251	C	S	.	.	H	α-helix	trans	-132.2	4.3	-171.7	-60.4	-62.8	0	0	0	114.5	C522 A530 C573 V576 I588 V601	C522-F526 WeakPolarHBondContact O-CB 3.1Å; C522-F526 PolarHBondContact O-N 3.21Å; F526-A530 HydrophobicContact CB-CB 3.74Å; F526-C573 HydrophobicContact CD2-CB 4.05Å; F526-C573 HydrophobicContact CE2-CB 3.93Å; F526-V576 HydrophobicContact CB-CG1 4.38Å; F526-V576 HydrophobicContact CB-CG2 4.18Å; F526-V576 HydrophobicContact CD1-CB 4.33Å; F526-V576 HydrophobicContact CD1-CG1 3.43Å; F526-V576 VanDerWaalsContact CD1-CG1 3.43Å; F526-V576 HydrophobicContact CD1-CG2 4.07Å; F526-V576 HydrophobicContact CD2-CG1 4.4Å; F526-V576 HydrophobicContact CD2-CG2 3.47Å; F526-V576 VanDerWaalsContact CD2-CG2 3.47Å; F526-V576 HydrophobicContact CE1-CG1 3.52Å; F526-V576 HydrophobicContact CE1-CG2 4.19Å; F526-V576 HydrophobicContact CE2-CG1 4.47Å; F526-V576 HydrophobicContact CE2-CG2 3.6Å; F526-V576 HydrophobicContact CG-CB 4.28Å; F526-V576 HydrophobicContact CG-CG1 3.86Å; F526-V576 HydrophobicContact CG-CG2 3.67Å; F526-V576 HydrophobicContact CZ-CG1 4.02Å; F526-V576 HydrophobicContact CZ-CG2 3.92Å; F526-I588 HydrophobicContact CE1-CD1 4.3Å; F526-I588 HydrophobicContact CE1-CG1 4.27Å; F526-V601 HydrophobicContact CE1-CG2 4.38Å; F526-V601 HydrophobicContact CZ-CB 3.86Å; F526-V601 HydrophobicContact CZ-CG2 4.21Å
527	G	84.1	Confident	90.2	Very high	22 Å²	22	42.1 Å²	42.1	23%	0.227	25%	0.246	C	C	.	.			trans	86.6	167.8	-178.9	0	0	0	0	0	114.3	Q523 K529 A530	Q523-G527 WeakPolarHBondContact CA-O 3.41Å; Q523-G527 CarbonylContact O-C 3.57Å; Q523-G527 VanDerWaalsContact O-C 3.32Å; Q523-G527 WeakPolarHBondContact O-CA 3.12Å; Q523-G527 PolarHBondContact O-N 2.9Å; G527-K529 PolarHBondContact O-N 3.01Å; G527-A530 PolarHBondContact O-N 2.88Å
528	P	86.4	Confident	90.3	Very high	118 Å²	118	40 Å²	40	77%	0.766	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	8.7	-161.2	28.9	-38.3	0	0	0	116.3
529	K	88.8	Confident	90.3	Very high	162 Å²	162	42.2 Å²	42.2	70%	0.704	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	-11.4	172.7	-63.7	-160.8	175.7	-162.8	0	113.4	G527 N575	G527-K529 PolarHBondContact O-N 3.01Å; K529-N575 WeakPolarHBondContact O-CB 3.15Å
530	A	90.9	Very high	90.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.252	C	S	.	.			trans	-72.2	153.4	172.7	0	0	0	0	0	111.2	C522 Q523 F526 G527 L574	C522-A530 HydrophobicContact CB-CB 4.11Å; C522-A530 WeakPolarHBondContact O-CB 3.26Å; Q523-A530 WeakPolarHBondContact CG-O 3.36Å; Q523-A530 PolarHBondContact NE2-O 2.81Å; F526-A530 HydrophobicContact CB-CB 3.74Å; G527-A530 PolarHBondContact O-N 2.88Å; A530-L574 WeakPolarHBondContact CA-O 3.45Å
531	T	93.9	Very high	90.5	Very high	46 Å²	46	42.6 Å²	42.6	28%	0.282	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	165.9	176.6	61.1	0	0	0	0	108.8	C522 C573 L574	C522-T531 PolarHBondContact SG-O 2.8Å; C522-T531 VanDerWaalsContact SG-O 3.36Å; T531-C573 CarbonylContact O-C 3.58Å; T531-C573 VanDerWaalsContact O-CA 3.24Å; T531-C573 WeakPolarHBondContact O-CA 2.95Å; T531-C573 WeakPolarHBondContact O-CB 3.34Å; T531-L574 PolarHBondContact N-O 3.33Å; T531-L574 PolarHBondContact O-N 2.04Å
532	A	94.4	Very high	90.8	Very high	22 Å²	22	42 Å²	42	18%	0.182	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	148.6	167.6	0	0	0	0	0	111	L518 D519	L518-A532 HydrophobicContact CB-CB 3.56Å; L518-A532 HydrophobicContact CD1-CB 4.43Å; D519-A532 WeakPolarHBondContact OD1-CB 3.5Å; D519-A532 PolarHBondContact OD1-N 2.58Å
533	A	94.2	Very high	90.9	Very high	9 Å²	9	44.8 Å²	44.8	7%	0.074	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-84.6	159.2	169.9	0	0	0	0	0	112	C537 F538 Q572 L574	A533-C537 HydrophobicContact CB-CB 3.71Å; A533-F538 HydrophobicContact CB-CE2 4.36Å; A533-F538 WeakPolarHBondContact O-CE2 3.14Å; A533-Q572 HydrophobicContact CB-CB 3.76Å; A533-Q572 VanDerWaalsContact CB-O 3.31Å; A533-Q572 WeakPolarHBondContact CB-O 3.22Å; A533-Q572 PolarHBondContact N-O 2.63Å; A533-L574 HydrophobicContact CB-CD2 4.27Å; A533-L574 HydrophobicContact CB-CG 4.21Å
534	P	93.1	Very high	91	Very high	63 Å²	63	45.4 Å²	45.4	41%	0.409	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-62.7	153.1	175.7	-21.1	33.4	0	0	0	111.9	I536 C537	P534-I536 HydrophobicContact CB-CG2 4.45Å; P534-I536 PolarHBondContact O-N 3.27Å; P534-C537 VanDerWaalsContact O-CB 3.31Å; P534-C537 WeakPolarHBondContact O-CB 3.28Å; P534-C537 PolarHBondContact O-N 2.97Å
535	D	92.1	Very high	91.3	Very high	69 Å²	69	43.4 Å²	43.4	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-40.5	-38.4	177.3	-99.3	44.2	0	0	0	115.8	C537 F538 K539 Q567	D535-C537 VanDerWaalsContact C-N 3.32Å; D535-C537 PolarHBondContact O-N 2.04Å; D535-F538 PolarHBondContact O-N 3.49Å; D535-K539 HydrophobicContact CB-CD 4.44Å; D535-K539 WeakPolarHBondContact O-CB 3.31Å; D535-K539 WeakPolarHBondContact O-CG 3.06Å; D535-K539 PolarHBondContact O-N 2.91Å; D535-K539 IonicContact OD2-NZ 3.18Å; D535-K539 PolarHBondContact OD2-NZ 3.38Å; D535-Q567 PolarHBondContact OD1-NE2 3.08Å
536	I	92.2	Very high	91.5	Very high	63 Å²	63	45.3 Å²	45.3	32%	0.323	26%	0.255	S	S	.	.	H	α-helix	trans	-65.8	-34.3	-178.6	-160.3	159.4	0	0	0	112.1	P534 K539 D540 I593 H594	P534-I536 HydrophobicContact CB-CG2 4.45Å; P534-I536 PolarHBondContact O-N 3.27Å; I536-K539 PolarHBondContact O-N 3.27Å; I536-D540 WeakPolarHBondContact CG1-OD2 3.49Å; I536-D540 VanDerWaalsContact O-CB 3.26Å; I536-D540 WeakPolarHBondContact O-CB 3.38Å; I536-D540 PolarHBondContact O-N 3.38Å; I536-I593 HydrophobicContact CG1-CG2 4.15Å; I536-I593 HydrophobicContact CG2-CG2 4.3Å; I536-H594 HydrophobicContact CD1-CB 4Å; I536-H594 VanDerWaalsContact CD1-CD2 3.43Å; I536-H594 WeakPolarHBondContact CD1-CD2 3.35Å
537	C	94.1	Very high	91.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-48.1	172.3	-67.5	0	0	0	0	111.1	A533 P534 D535 V541 Q572 C598	A533-C537 HydrophobicContact CB-CB 3.71Å; P534-C537 VanDerWaalsContact O-CB 3.31Å; P534-C537 WeakPolarHBondContact O-CB 3.28Å; P534-C537 PolarHBondContact O-N 2.97Å; D535-C537 VanDerWaalsContact C-N 3.32Å; D535-C537 PolarHBondContact O-N 2.04Å; C537-V541 WeakPolarHBondContact O-CB 3.29Å; C537-V541 VanDerWaalsContact O-CG2 3.24Å; C537-V541 WeakPolarHBondContact O-CG2 3.46Å; C537-V541 PolarHBondContact O-N 3.47Å; C537-Q572 HydrophobicContact CB-CB 3.94Å; C537-Q572 HydrophobicContact CB-CG 4.23Å; C537-C598 VanDerWaalsContact CA-SG 3.59Å; C537-C598 HydrophobicContact CB-CB 3.63Å; C537-C598 WeakPolarHBondContact CB-SG 3.32Å; C537-C598 WeakPolarHBondContact SG-CB 3.18Å; C537-C598 CovalentContact SG-SG 2.03Å; C537-C598 PolarHBondContact SG-SG 3.06Å
538	F	95.2	Very high	91.5	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-44	178.1	-74.6	-90.3	0	0	0	111.7	L518 A533 D535 N542 A566 L571 Q572 V615	L518-F538 HydrophobicContact CD1-CE2 4.32Å; L518-F538 HydrophobicContact CD1-CZ 4.03Å; L518-F538 HydrophobicContact CD2-CE1 4.32Å; L518-F538 HydrophobicContact CD2-CZ 4.09Å; A533-F538 HydrophobicContact CB-CE2 4.36Å; A533-F538 WeakPolarHBondContact O-CE2 3.14Å; D535-F538 PolarHBondContact O-N 3.49Å; F538-N542 WeakPolarHBondContact O-CB 2.96Å; F538-N542 PolarHBondContact O-N 2.89Å; F538-A566 HydrophobicContact CB-CB 4.37Å; F538-L571 HydrophobicContact CE1-CD1 4.44Å; F538-L571 HydrophobicContact CZ-CD1 4.23Å; F538-Q572 HydrophobicContact CD1-CB 4.32Å; F538-Q572 HydrophobicContact CD1-CG 4.07Å; F538-Q572 HydrophobicContact CD2-CB 4.06Å; F538-Q572 HydrophobicContact CD2-CG 4.42Å; F538-Q572 HydrophobicContact CE1-CB 4.2Å; F538-Q572 HydrophobicContact CE1-CG 4.33Å; F538-Q572 HydrophobicContact CE2-CB 3.91Å; F538-Q572 WeakPolarHBondContact CE2-O 3.5Å; F538-Q572 HydrophobicContact CG-CB 4.26Å; F538-Q572 HydrophobicContact CG-CG 4.13Å; F538-Q572 HydrophobicContact CZ-CB 3.99Å; F538-Q572 WeakPolarHBondContact CZ-O 3.02Å; F538-V615 HydrophobicContact CE1-CG2 3.95Å
539	K	94.2	Very high	91.7	Very high	70 Å²	70	45 Å²	45	30%	0.304	23%	0.233	S	C	.	.	H	α-helix	trans	-68.1	-44.9	-178.2	-75.1	161.6	176.1	158.8	0	112.5	D535 I536 S543 S563 A566	D535-K539 HydrophobicContact CB-CD 4.44Å; D535-K539 WeakPolarHBondContact O-CB 3.31Å; D535-K539 WeakPolarHBondContact O-CG 3.06Å; D535-K539 PolarHBondContact O-N 2.91Å; D535-K539 IonicContact OD2-NZ 3.18Å; D535-K539 PolarHBondContact OD2-NZ 3.38Å; I536-K539 PolarHBondContact O-N 3.27Å; K539-S543 WeakPolarHBondContact O-CB 3.42Å; K539-S543 PolarHBondContact O-N 3.29Å; K539-S543 PolarHBondContact O-OG 3.15Å; K539-S563 WeakPolarHBondContact CE-O 3.3Å; K539-A566 HydrophobicContact CB-CB 4.36Å; K539-A566 HydrophobicContact CG-CB 3.67Å
540	D	93.2	Very high	91.9	Very high	62 Å²	62	37.4 Å²	37.4	33%	0.332	20%	0.2	S	C	.	.	H	α-helix	trans	-80.6	-29.5	-176.2	-68.2	2.4	0	0	0	112.8	I536 K544 I593 H594	I536-D540 WeakPolarHBondContact CG1-OD2 3.49Å; I536-D540 VanDerWaalsContact O-CB 3.26Å; I536-D540 WeakPolarHBondContact O-CB 3.38Å; I536-D540 PolarHBondContact O-N 3.38Å; D540-K544 WeakPolarHBondContact O-CE 3.39Å; D540-I593 HydrophobicContact CB-CD1 3.86Å; D540-I593 HydrophobicContact CB-CG2 4.15Å; D540-I593 WeakPolarHBondContact OD2-CG2 3.34Å; D540-H594 IonicContact OD2-CD2 3.43Å
541	V	94.1	Very high	91.9	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-78.8	-52.1	172.9	178.8	0	0	0	0	110.4	C537 S543 K544 G549 Q572 I593	C537-V541 WeakPolarHBondContact O-CB 3.29Å; C537-V541 VanDerWaalsContact O-CG2 3.24Å; C537-V541 WeakPolarHBondContact O-CG2 3.46Å; C537-V541 PolarHBondContact O-N 3.47Å; V541-S543 PolarHBondContact O-N 2.85Å; V541-K544 WeakPolarHBondContact O-CB 3.07Å; V541-K544 VanDerWaalsContact O-CG 3.28Å; V541-K544 WeakPolarHBondContact O-CG 3Å; V541-K544 PolarHBondContact O-N 2.93Å; V541-G549 WeakPolarHBondContact O-CA 3.46Å; V541-Q572 HydrophobicContact CB-CG 4.47Å; V541-I593 HydrophobicContact CG2-CD1 3.73Å
542	N	96	Very high	91.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-80.9	-12.3	-169.1	-57.2	-26.1	0	0	0	114.8	F538 K544 G549 C561 A566 K570	F538-N542 WeakPolarHBondContact O-CB 2.96Å; F538-N542 PolarHBondContact O-N 2.89Å; N542-K544 VanDerWaalsContact C-N 3.25Å; N542-K544 PolarHBondContact O-N 3.18Å; N542-G549 VanDerWaalsContact OD1-CA 3.24Å; N542-G549 WeakPolarHBondContact OD1-CA 3.48Å; N542-C561 HydrophobicContact CB-CB 4Å; N542-C561 WeakPolarHBondContact CB-SG 3.39Å; N542-C561 WeakPolarHBondContact O-CB 3.33Å; N542-C561 PolarHBondContact O-N 3.49Å; N542-A566 PolarHBondContact ND2-O 3.26Å; N542-K570 PolarHBondContact ND2-N 2.82Å; N542-K570 PolarHBondContact ND2-O 2.84Å; N542-K570 PolarHBondContact OD1-O 2.73Å
543	S	94.2	Very high	89.9	Confident	57 Å²	57	36.5 Å²	36.5	40%	0.399	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-14	169.2	58.2	0	0	0	0	113.8	K539 V541 G545 K560	K539-S543 WeakPolarHBondContact O-CB 3.42Å; K539-S543 PolarHBondContact O-N 3.29Å; K539-S543 PolarHBondContact O-OG 3.15Å; V541-S543 PolarHBondContact O-N 2.85Å; S543-G545 VanDerWaalsContact C-N 3.35Å; S543-K560 WeakPolarHBondContact O-CG 2.98Å
544	K	91.8	Very high	88.5	Confident	93 Å²	93	40.6 Å²	40.6	40%	0.404	21%	0.206	S	C	.	.	S	Bend	trans	-65	-37.1	176.5	-62.8	176.6	-173.4	176	0	112.5	D540 V541 N542 D546 K560	D540-K544 WeakPolarHBondContact O-CE 3.39Å; V541-K544 WeakPolarHBondContact O-CB 3.07Å; V541-K544 VanDerWaalsContact O-CG 3.28Å; V541-K544 WeakPolarHBondContact O-CG 3Å; V541-K544 PolarHBondContact O-N 2.93Å; N542-K544 VanDerWaalsContact C-N 3.25Å; N542-K544 PolarHBondContact O-N 3.18Å; K544-D546 VanDerWaalsContact C-N 3.34Å; K544-D546 HydrophobicContact CB-CB 4.44Å; K544-D546 VanDerWaalsContact CB-OD2 3.28Å; K544-D546 WeakPolarHBondContact CB-OD2 3.02Å; K544-D546 WeakPolarHBondContact CD-OD2 3.5Å; K544-K560 WeakPolarHBondContact O-CE 3.38Å
545	G	88.6	Confident	86.4	Confident	18 Å²	18	43.8 Å²	43.8	19%	0.186	22%	0.216	C	C	.	.			trans	63	43.8	-174.1	0	0	0	0	0	111.4	S543 G549 Y558	S543-G545 VanDerWaalsContact C-N 3.35Å; G545-G549 CarbonylContact C-O 3.55Å; G545-G549 VanDerWaalsContact CA-O 3.27Å; G545-G549 WeakPolarHBondContact CA-O 3.36Å; G545-G549 PolarHBondContact N-O 3.23Å; G545-Y558 WeakPolarHBondContact O-CB 3.46Å
546	D	86.3	Confident	84.7	Confident	51 Å²	51	46 Å²	46	27%	0.273	24%	0.236	S	C	.	.	S	Bend	trans	-115.8	178.9	175.3	70.1	41.4	0	0	0	110.5	K544 F548 G549 N550	K544-D546 VanDerWaalsContact C-N 3.34Å; K544-D546 HydrophobicContact CB-CB 4.44Å; K544-D546 VanDerWaalsContact CB-OD2 3.28Å; K544-D546 WeakPolarHBondContact CB-OD2 3.02Å; K544-D546 WeakPolarHBondContact CD-OD2 3.5Å; D546-F548 PolarHBondContact O-N 3.4Å; D546-F548 VanDerWaalsContact O-N 3.15Å; D546-F548 WeakPolarHBondContact OD1-CA 3.49Å; D546-F548 WeakPolarHBondContact OD1-CB 3.49Å; D546-F548 PolarHBondContact OD1-N 3.3Å; D546-G549 PolarHBondContact N-O 2.84Å; D546-G549 CarbonylContact O-C 3.09Å; D546-G549 PolarHBondContact O-N 3.47Å; D546-G549 PolarHBondContact OD1-N 3.5Å; D546-N550 WeakPolarHBondContact O-CB 2.99Å; D546-N550 PolarHBondContact O-ND2 3.29Å
547	R	81.2	Confident	83.5	Confident	75 Å²	75	43.5 Å²	43.5	28%	0.283	23%	0.226	S	C	.	.	S	Bend	trans	-55	-29.5	-179.8	179.2	174.7	173.4	121.8	12.2	114.3	Y558 D602 M604	R547-Y558 HydrophobicContact CB-CD2 4.41Å; R547-Y558 HydrophobicContact CB-CE2 3.76Å; R547-Y558 HydrophobicContact CG-CE2 4.35Å; R547-D602 IonicContact CZ-OD2 2.7Å; R547-D602 VanDerWaalsContact CZ-OD2 3.24Å; R547-D602 IonicContact NE-OD2 2.76Å; R547-D602 PolarHBondContact NE-OD2 3.12Å; R547-D602 IonicContact NH2-OD1 3.67Å; R547-D602 IonicContact NH2-OD2 3.19Å; R547-D602 PolarHBondContact NH2-OD2 3.41Å; R547-M604 VanDerWaalsContact NH2-CG 3.27Å
548	F	87.3	Confident	82.9	Confident	80 Å²	80	46.6 Å²	46.6	35%	0.351	24%	0.238	S	C	.	.	S	Bend	trans	-100.5	-19.7	-174.5	-46.8	-60.8	0	0	0	112.5	D546 K570 I589 D602	D546-F548 PolarHBondContact O-N 3.4Å; D546-F548 VanDerWaalsContact O-N 3.15Å; D546-F548 WeakPolarHBondContact OD1-CA 3.49Å; D546-F548 WeakPolarHBondContact OD1-CB 3.49Å; D546-F548 PolarHBondContact OD1-N 3.3Å; F548-K570 WeakPolarHBondContact O-CB 3.27Å; F548-I589 HydrophobicContact CB-CD1 4.41Å; F548-I589 HydrophobicContact CB-CG1 4.15Å; F548-I589 HydrophobicContact CB-CG2 4.39Å; F548-I589 HydrophobicContact CD1-CD1 3.7Å; F548-I589 HydrophobicContact CD1-CG1 3.61Å; F548-I589 HydrophobicContact CE1-CD1 4.43Å; F548-I589 HydrophobicContact CE1-CG1 4.25Å; F548-I589 HydrophobicContact CG-CD1 4.37Å; F548-I589 HydrophobicContact CG-CG1 3.97Å; F548-D602 HydrophobicContact CD1-CB 4.1Å; F548-D602 HydrophobicContact CE1-CB 4.19Å
549	G	90.9	Very high	82.5	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-146.9	108.1	175	0	0	0	0	0	114.3	V541 N542 G545 D546	V541-G549 WeakPolarHBondContact O-CA 3.46Å; N542-G549 VanDerWaalsContact OD1-CA 3.24Å; N542-G549 WeakPolarHBondContact OD1-CA 3.48Å; G545-G549 CarbonylContact C-O 3.55Å; G545-G549 VanDerWaalsContact CA-O 3.27Å; G545-G549 WeakPolarHBondContact CA-O 3.36Å; G545-G549 PolarHBondContact N-O 3.23Å; D546-G549 PolarHBondContact N-O 2.84Å; D546-G549 CarbonylContact O-C 3.09Å; D546-G549 PolarHBondContact O-N 3.47Å; D546-G549 PolarHBondContact OD1-N 3.5Å
550	N	92.2	Very high	82.4	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.263	C	S	.	.			trans	-157.6	169.1	-177.5	60.8	79.2	0	0	0	112.5	D546 G552 Y558 K559 C561 G569 K570	D546-N550 WeakPolarHBondContact O-CB 2.99Å; D546-N550 PolarHBondContact O-ND2 3.29Å; N550-G552 VanDerWaalsContact OD1-CA 3.28Å; N550-G552 WeakPolarHBondContact OD1-CA 3.06Å; N550-G552 PolarHBondContact OD1-N 2.57Å; N550-G552 PolarHBondContact OD1-O 3.15Å; N550-Y558 HydrophobicContact CB-CD1 4.12Å; N550-Y558 HydrophobicContact CB-CG 4.35Å; N550-Y558 VanDerWaalsContact ND2-CD1 3.29Å; N550-Y558 WeakPolarHBondContact ND2-CD1 3.13Å; N550-K559 CarbonylContact C-O 3.59Å; N550-K559 WeakPolarHBondContact CA-O 3.27Å; N550-K559 WeakPolarHBondContact CB-O 3.39Å; N550-C561 VanDerWaalsContact C-SG 3.54Å; N550-G569 CarbonylContact O-C 3.54Å; N550-G569 WeakPolarHBondContact O-CA 3.33Å; N550-K570 PolarHBondContact O-N 3.45Å
551	C	90.8	Very high	82.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.007	25%	0.25	C	C	.	.	S	Bend	trans	-102.8	57.1	168.1	-89.1	0	0	0	0	110.4	K559 C561 N565 F630	C551-K559 HydrophobicContact CB-CD 4.19Å; C551-K559 HydrophobicContact CB-CG 4.42Å; C551-K559 PolarHBondContact N-O 2.77Å; C551-C561 WeakPolarHBondContact CA-SG 3.03Å; C551-C561 HydrophobicContact CB-CB 4.05Å; C551-C561 WeakPolarHBondContact CB-SG 3.48Å; C551-C561 PolarHBondContact N-SG 2.92Å; C551-C561 WeakPolarHBondContact SG-CA 3.41Å; C551-C561 WeakPolarHBondContact SG-CB 3.4Å; C551-C561 CovalentContact SG-SG 2.02Å; C551-C561 PolarHBondContact SG-SG 2.73Å; C551-N565 PolarHBondContact SG-O 3.27Å; C551-N565 VanDerWaalsContact SG-O 3.4Å; C551-F630 VanDerWaalsContact C-CB 3.49Å; C551-F630 HydrophobicContact CB-CB 4.15Å; C551-F630 WeakPolarHBondContact O-CB 3.41Å; C551-F630 PolarHBondContact SG-O 3Å; C551-F630 VanDerWaalsContact SG-O 3.36Å
552	G	77.3	Confident	82.4	Confident	4 Å²	4	53.9 Å²	53.9	4%	0.041	27%	0.27	C	S	.	.			trans	78	179.9	-177.3	0	0	0	0	0	113.7	N550 K559	N550-G552 VanDerWaalsContact OD1-CA 3.28Å; N550-G552 WeakPolarHBondContact OD1-CA 3.06Å; N550-G552 PolarHBondContact OD1-N 2.57Å; N550-G552 PolarHBondContact OD1-O 3.15Å; G552-K559 WeakPolarHBondContact O-CB 3.39Å; G552-K559 PolarHBondContact O-N 3.19Å
553	Y	69.4	Low	82.3	Confident	44 Å²	44	57.8 Å²	57.8	17%	0.173	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.1	-179.9	-163.4	-83.2	0	0	0	111.2	G172 P174 V308 G557 Y558	G172-Y553 VanDerWaalsContact C-CE2 3.49Å; G172-Y553 VanDerWaalsContact CA-CE1 3.44Å; G172-Y553 VanDerWaalsContact CA-CZ 3.47Å; G172-Y553 WeakPolarHBondContact O-CD2 3.23Å; G172-Y553 WeakPolarHBondContact O-CE2 3.33Å; G172-Y553 VanDerWaalsContact O-CZ 3.3Å; P174-Y553 WeakPolarHBondContact CD-OH 3.36Å; P174-Y553 WeakPolarHBondContact CG-OH 3.44Å; V308-Y553 HydrophobicContact CB-CE1 4.17Å; V308-Y553 HydrophobicContact CG1-CE1 4.15Å; V308-Y553 HydrophobicContact CG2-CD1 3.47Å; V308-Y553 VanDerWaalsContact CG2-CD1 3.47Å; V308-Y553 HydrophobicContact CG2-CE1 3.35Å; Y553-G557 VanDerWaalsContact CE2-C 3.48Å; Y553-G557 VanDerWaalsContact CZ-CA 3.48Å; Y553-Y558 AromaticContact CD2-CD1 3.66Å; Y553-Y558 HydrophobicContact CD2-CD1 3.66Å; Y553-Y558 HydrophobicContact CD2-CD2 4.23Å; Y553-Y558 AromaticContact CD2-CE1 3.72Å; Y553-Y558 HydrophobicContact CD2-CE1 3.72Å; Y553-Y558 HydrophobicContact CD2-CE2 4.27Å; Y553-Y558 AromaticContact CD2-CG 3.93Å; Y553-Y558 HydrophobicContact CD2-CG 3.93Å; Y553-Y558 HydrophobicContact CE2-CD1 4.45Å; Y553-Y558 HydrophobicContact CE2-CD2 4.22Å; Y553-Y558 HydrophobicContact CE2-CE1 4.48Å; Y553-Y558 HydrophobicContact CE2-CE2 4.25Å; Y553-Y558 HydrophobicContact CE2-CG 4.32Å
554	Q	63.8	Low	82.2	Confident	95 Å²	95	63.6 Å²	63.6	44%	0.444	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	172.4	175.6	-71.2	-165.1	-34.6	0	0	110.8	S556 G557 K559	Q554-S556 PolarHBondContact O-N 2.96Å; Q554-G557 PolarHBondContact N-O 3.26Å; Q554-G557 PolarHBondContact O-N 3.31Å; Q554-G557 VanDerWaalsContact O-O 3.09Å; Q554-K559 HydrophobicContact CG-CB 4.26Å; Q554-K559 HydrophobicContact CG-CD 4.36Å
555	H	49.1	Very low	82.4	Confident	130 Å²	130	59.3 Å²	59.3	60%	0.602	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.1	-164.1	-55.2	18.1	0	0	0	114.8	G307	G307-H555 WeakPolarHBondContact CA-CE1 3.48Å; G307-H555 VanDerWaalsContact CA-NE2 3.31Å; G307-H555 WeakPolarHBondContact CA-NE2 3.23Å
556	S	56.7	Low	82.7	Confident	115 Å²	115	58.5 Å²	58.5	80%	0.804	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	3.8	179.3	51.6	0	0	0	0	114.8	Q554	Q554-S556 PolarHBondContact O-N 2.96Å
557	G	67.4	Low	83.1	Confident	11 Å²	11	58 Å²	58	11%	0.113	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.6	-171.7	-177	0	0	0	0	0	114.2	Y553 Q554 K559	Y553-G557 VanDerWaalsContact CE2-C 3.48Å; Y553-G557 VanDerWaalsContact CZ-CA 3.48Å; Q554-G557 PolarHBondContact N-O 3.26Å; Q554-G557 PolarHBondContact O-N 3.31Å; Q554-G557 VanDerWaalsContact O-O 3.09Å; G557-K559 PolarHBondContact O-N 2.89Å
558	Y	81.6	Confident	83.8	Confident	65 Å²	65	54.5 Å²	54.5	26%	0.255	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	130	172.7	-67.8	-74.1	0	0	0	111.5	G545 R547 N550 Y553	G545-Y558 WeakPolarHBondContact O-CB 3.46Å; R547-Y558 HydrophobicContact CB-CD2 4.41Å; R547-Y558 HydrophobicContact CB-CE2 3.76Å; R547-Y558 HydrophobicContact CG-CE2 4.35Å; N550-Y558 HydrophobicContact CB-CD1 4.12Å; N550-Y558 HydrophobicContact CB-CG 4.35Å; N550-Y558 VanDerWaalsContact ND2-CD1 3.29Å; N550-Y558 WeakPolarHBondContact ND2-CD1 3.13Å; Y553-Y558 AromaticContact CD2-CD1 3.66Å; Y553-Y558 HydrophobicContact CD2-CD1 3.66Å; Y553-Y558 HydrophobicContact CD2-CD2 4.23Å; Y553-Y558 AromaticContact CD2-CE1 3.72Å; Y553-Y558 HydrophobicContact CD2-CE1 3.72Å; Y553-Y558 HydrophobicContact CD2-CE2 4.27Å; Y553-Y558 AromaticContact CD2-CG 3.93Å; Y553-Y558 HydrophobicContact CD2-CG 3.93Å; Y553-Y558 HydrophobicContact CE2-CD1 4.45Å; Y553-Y558 HydrophobicContact CE2-CD2 4.22Å; Y553-Y558 HydrophobicContact CE2-CE1 4.48Å; Y553-Y558 HydrophobicContact CE2-CE2 4.25Å; Y553-Y558 HydrophobicContact CE2-CG 4.32Å
559	K	85.5	Confident	84.1	Confident	45 Å²	45	50.7 Å²	50.7	20%	0.196	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-78.1	125.8	-179.5	-176.2	-174	-179.2	-176.8	0	110.2	N550 C551 G552 Q554 G557 C561 E631	N550-K559 CarbonylContact C-O 3.59Å; N550-K559 WeakPolarHBondContact CA-O 3.27Å; N550-K559 WeakPolarHBondContact CB-O 3.39Å; C551-K559 HydrophobicContact CB-CD 4.19Å; C551-K559 HydrophobicContact CB-CG 4.42Å; C551-K559 PolarHBondContact N-O 2.77Å; G552-K559 WeakPolarHBondContact O-CB 3.39Å; G552-K559 PolarHBondContact O-N 3.19Å; Q554-K559 HydrophobicContact CG-CB 4.26Å; Q554-K559 HydrophobicContact CG-CD 4.36Å; G557-K559 PolarHBondContact O-N 2.89Å; K559-C561 PolarHBondContact O-N 2.83Å; K559-E631 IonicContact NZ-OE1 2.8Å; K559-E631 PolarHBondContact NZ-OE1 2.87Å
560	K	92.3	Very high	84.2	Confident	143 Å²	143	50.9 Å²	50.9	62%	0.622	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-61.3	127.3	166.5	-73	-176	167.7	176	0	109.8	S543 K544 E562	S543-K560 WeakPolarHBondContact O-CG 2.98Å; K544-K560 WeakPolarHBondContact O-CE 3.38Å; K560-E562 PolarHBondContact O-N 2.03Å
561	C	94.6	Very high	84.4	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.061	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-68.2	132.2	170.1	-72	0	0	0	0	110.8	N542 N550 C551 K559 A566	N542-C561 HydrophobicContact CB-CB 4Å; N542-C561 WeakPolarHBondContact CB-SG 3.39Å; N542-C561 WeakPolarHBondContact O-CB 3.33Å; N542-C561 PolarHBondContact O-N 3.49Å; N550-C561 VanDerWaalsContact C-SG 3.54Å; C551-C561 WeakPolarHBondContact CA-SG 3.03Å; C551-C561 HydrophobicContact CB-CB 4.05Å; C551-C561 WeakPolarHBondContact CB-SG 3.48Å; C551-C561 PolarHBondContact N-SG 2.92Å; C551-C561 WeakPolarHBondContact SG-CA 3.41Å; C551-C561 WeakPolarHBondContact SG-CB 3.4Å; C551-C561 CovalentContact SG-SG 2.02Å; C551-C561 PolarHBondContact SG-SG 2.73Å; K559-C561 PolarHBondContact O-N 2.83Å; C561-A566 HydrophobicContact CB-CB 4.39Å
562	E	94.1	Very high	84.6	Confident	93 Å²	93	50.9 Å²	50.9	44%	0.435	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-62.4	147.7	153.4	-60.7	177.7	150.9	0	0	109.3	K560 R564 N565 A566	K560-E562 PolarHBondContact O-N 2.03Å; E562-R564 HydrophobicContact CB-CG 4.16Å; E562-R564 PolarHBondContact O-N 2.9Å; E562-R564 IonicContact OE1-NH2 3.24Å; E562-R564 PolarHBondContact OE1-NH2 2.99Å; E562-R564 IonicContact OE2-CZ 3.17Å; E562-R564 IonicContact OE2-NE 3.32Å; E562-R564 PolarHBondContact OE2-NE 3.4Å; E562-R564 IonicContact OE2-NH2 2.86Å; E562-R564 PolarHBondContact OE2-NH2 3Å; E562-N565 WeakPolarHBondContact O-CA 3.17Å; E562-N565 PolarHBondContact O-N 2.69Å; E562-N565 PolarHBondContact OE2-ND2 3.42Å; E562-A566 PolarHBondContact O-N 2.8Å
563	S	92.6	Very high	85.4	Confident	82 Å²	82	50.7 Å²	50.7	57%	0.573	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.2	-177	-174.3	0	0	0	0	114.1	K539	K539-S563 WeakPolarHBondContact CE-O 3.3Å
564	R	93.4	Very high	86.4	Confident	178 Å²	178	50.6 Å²	50.6	67%	0.672	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-22.7	174	64	171.7	173.2	-177.2	-5.5	114.6	E562 C632	E562-R564 HydrophobicContact CB-CG 4.16Å; E562-R564 PolarHBondContact O-N 2.9Å; E562-R564 IonicContact OE1-NH2 3.24Å; E562-R564 PolarHBondContact OE1-NH2 2.99Å; E562-R564 IonicContact OE2-CZ 3.17Å; E562-R564 IonicContact OE2-NE 3.32Å; E562-R564 PolarHBondContact OE2-NE 3.4Å; E562-R564 IonicContact OE2-NH2 2.86Å; E562-R564 PolarHBondContact OE2-NH2 3Å; R564-C632 WeakPolarHBondContact O-CB 3.4Å
565	N	95.3	Very high	87.5	Confident	4 Å²	4	51 Å²	51	2%	0.021	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-4.6	-178.2	-67	-20.8	0	0	0	112.3	C551 E562 Q567 C568 C632	C551-N565 PolarHBondContact SG-O 3.27Å; C551-N565 VanDerWaalsContact SG-O 3.4Å; E562-N565 WeakPolarHBondContact O-CA 3.17Å; E562-N565 PolarHBondContact O-N 2.69Å; E562-N565 PolarHBondContact OE2-ND2 3.42Å; N565-Q567 VanDerWaalsContact C-N 3.27Å; N565-Q567 PolarHBondContact O-N 3.33Å; N565-C568 WeakPolarHBondContact O-CA 3.31Å; N565-C568 WeakPolarHBondContact O-CB 3Å; N565-C568 PolarHBondContact O-N 3.4Å; N565-C632 PolarHBondContact OD1-N 3.46Å
566	A	95.3	Very high	89	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-56.5	-35	-173	0	0	0	0	0	114.6	F538 K539 N542 C561 E562 C568 G569	F538-A566 HydrophobicContact CB-CB 4.37Å; K539-A566 HydrophobicContact CB-CB 4.36Å; K539-A566 HydrophobicContact CG-CB 3.67Å; N542-A566 PolarHBondContact ND2-O 3.26Å; C561-A566 HydrophobicContact CB-CB 4.39Å; E562-A566 PolarHBondContact O-N 2.8Å; A566-C568 PolarHBondContact O-N 3.18Å; A566-G569 PolarHBondContact O-N 2.89Å
567	Q	95.4	Very high	89.6	Confident	41 Å²	41	47.5 Å²	47.5	19%	0.192	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-69.9	-6.1	174.2	-74.9	-175.1	-10.5	0	0	114.1	D535 N565 V615 C621	D535-Q567 PolarHBondContact OD1-NE2 3.08Å; N565-Q567 VanDerWaalsContact C-N 3.27Å; N565-Q567 PolarHBondContact O-N 3.33Å; Q567-V615 WeakPolarHBondContact O-CG1 3.35Å; Q567-V615 WeakPolarHBondContact O-CG2 3.48Å; Q567-C621 HydrophobicContact CB-CB 4.24Å; Q567-C621 VanDerWaalsContact OE1-C 3.29Å; Q567-C621 PolarHBondContact OE1-O 2.97Å; Q567-C621 VanDerWaalsContact OE1-O 3.1Å
568	C	95.6	Very high	89.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-111.9	12.4	177.4	-57.3	0	0	0	0	113.2	N565 A566 C627 F630	N565-C568 WeakPolarHBondContact O-CA 3.31Å; N565-C568 WeakPolarHBondContact O-CB 3Å; N565-C568 PolarHBondContact O-N 3.4Å; A566-C568 PolarHBondContact O-N 3.18Å; C568-C627 WeakPolarHBondContact CA-SG 3.16Å; C568-C627 HydrophobicContact CB-CB 3.63Å; C568-C627 WeakPolarHBondContact CB-SG 3.41Å; C568-C627 WeakPolarHBondContact SG-CA 3.36Å; C568-C627 WeakPolarHBondContact SG-CB 3.43Å; C568-C627 CovalentContact SG-SG 2.04Å; C568-C627 PolarHBondContact SG-SG 3.27Å; C568-F630 WeakPolarHBondContact O-CA 3.03Å
569	G	93.7	Very high	88	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-91.1	-146.7	175.1	0	0	0	0	0	113.5	N550 A566 L571 M614 V615	N550-G569 CarbonylContact O-C 3.54Å; N550-G569 WeakPolarHBondContact O-CA 3.33Å; A566-G569 PolarHBondContact O-N 2.89Å; G569-L571 PolarHBondContact O-N 2.74Å; G569-M614 VanDerWaalsContact C-CE 3.46Å; G569-V615 WeakPolarHBondContact O-CG2 3.28Å; G569-V615 PolarHBondContact O-N 2.75Å
570	K	93.3	Very high	86.3	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.017	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-60.8	130.8	169.2	-65.8	-80.2	-73.9	-175.3	0	110.2	N542 F548 N550 Q572 V601 D611 G613 M614	N542-K570 PolarHBondContact ND2-N 2.82Å; N542-K570 PolarHBondContact ND2-O 2.84Å; N542-K570 PolarHBondContact OD1-O 2.73Å; F548-K570 WeakPolarHBondContact O-CB 3.27Å; N550-K570 PolarHBondContact O-N 3.45Å; K570-Q572 PolarHBondContact O-NE2 3.19Å; K570-V601 VanDerWaalsContact CE-O 3.25Å; K570-V601 WeakPolarHBondContact CE-O 3.02Å; K570-V601 PolarHBondContact NZ-O 3.16Å; K570-D611 IonicContact NZ-OD1 2.83Å; K570-D611 IonicContact NZ-OD2 2.68Å; K570-D611 PolarHBondContact NZ-OD2 2.73Å; K570-G613 CarbonylContact C-O 3.06Å; K570-G613 WeakPolarHBondContact CA-O 3.46Å; K570-M614 HydrophobicContact CB-SD 4.28Å; K570-M614 HydrophobicContact CD-CG 4.29Å; K570-M614 HydrophobicContact CD-SD 3.3Å; K570-M614 WeakPolarHBondContact CD-SD 3.47Å; K570-M614 HydrophobicContact CG-SD 3.59Å; K570-M614 VanDerWaalsContact CG-SD 3.59Å
571	L	94.9	Very high	84.3	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.271	C	S	.	.			trans	-63.8	133.6	179.9	-177.1	75.5	0	0	0	111	L518 Q521 L525 F538 G569 G613 V615	L518-L571 HydrophobicContact CD2-CD1 3.73Å; Q521-L571 HydrophobicContact CB-CD2 4.12Å; Q521-L571 HydrophobicContact CG-CD2 3.79Å; L525-L571 HydrophobicContact CD1-CD2 3.48Å; L525-L571 VanDerWaalsContact CD1-CD2 3.48Å; F538-L571 HydrophobicContact CE1-CD1 4.44Å; F538-L571 HydrophobicContact CZ-CD1 4.23Å; G569-L571 PolarHBondContact O-N 2.74Å; L571-G613 WeakPolarHBondContact CB-O 3.41Å; L571-G613 PolarHBondContact N-O 3.42Å; L571-V615 HydrophobicContact CB-CG2 4.07Å; L571-V615 HydrophobicContact CD1-CG2 3.78Å
572	Q	95	Very high	82.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	29%	0.292	C	S	.	.			trans	-116.8	130.1	173.5	-54.4	-58.3	-48.8	0	0	109.8	A533 C537 F538 V541 K570	A533-Q572 HydrophobicContact CB-CB 3.76Å; A533-Q572 VanDerWaalsContact CB-O 3.31Å; A533-Q572 WeakPolarHBondContact CB-O 3.22Å; A533-Q572 PolarHBondContact N-O 2.63Å; C537-Q572 HydrophobicContact CB-CB 3.94Å; C537-Q572 HydrophobicContact CB-CG 4.23Å; F538-Q572 HydrophobicContact CD1-CB 4.32Å; F538-Q572 HydrophobicContact CD1-CG 4.07Å; F538-Q572 HydrophobicContact CD2-CB 4.06Å; F538-Q572 HydrophobicContact CD2-CG 4.42Å; F538-Q572 HydrophobicContact CE1-CB 4.2Å; F538-Q572 HydrophobicContact CE1-CG 4.33Å; F538-Q572 HydrophobicContact CE2-CB 3.91Å; F538-Q572 WeakPolarHBondContact CE2-O 3.5Å; F538-Q572 HydrophobicContact CG-CB 4.26Å; F538-Q572 HydrophobicContact CG-CG 4.13Å; F538-Q572 HydrophobicContact CZ-CB 3.99Å; F538-Q572 WeakPolarHBondContact CZ-O 3.02Å; V541-Q572 HydrophobicContact CB-CG 4.47Å; K570-Q572 PolarHBondContact O-NE2 3.19Å
573	C	93.5	Very high	79.8	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	164	-176.2	-57.2	0	0	0	0	112.3	C522 F526 T531 V576 F599	C522-C573 VanDerWaalsContact CA-SG 3.52Å; C522-C573 HydrophobicContact CB-CB 3.83Å; C522-C573 WeakPolarHBondContact CB-SG 3.27Å; C522-C573 VanDerWaalsContact SG-CA 3.58Å; C522-C573 WeakPolarHBondContact SG-CB 3.23Å; C522-C573 CovalentContact SG-SG 2.04Å; C522-C573 PolarHBondContact SG-SG 3.45Å; F526-C573 HydrophobicContact CD2-CB 4.05Å; F526-C573 HydrophobicContact CE2-CB 3.93Å; T531-C573 CarbonylContact O-C 3.58Å; T531-C573 VanDerWaalsContact O-CA 3.24Å; T531-C573 WeakPolarHBondContact O-CA 2.95Å; T531-C573 WeakPolarHBondContact O-CB 3.34Å; C573-V576 HydrophobicContact CB-CG2 3.93Å; C573-F599 PolarHBondContact N-O 3.19Å; C573-F599 PolarHBondContact O-N 3.47Å
574	L	91.4	Very high	78	Confident	42 Å²	42	49 Å²	49	22%	0.22	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	171	166	-62.4	-178.9	0	0	0	111.1	A530 T531 A533 V576 T597	A530-L574 WeakPolarHBondContact CA-O 3.45Å; T531-L574 PolarHBondContact N-O 3.33Å; T531-L574 PolarHBondContact O-N 2.04Å; A533-L574 HydrophobicContact CB-CD2 4.27Å; A533-L574 HydrophobicContact CB-CG 4.21Å; L574-V576 PolarHBondContact O-N 3.23Å; L574-V576 VanDerWaalsContact O-N 3.08Å; L574-T597 WeakPolarHBondContact CD2-O 3.22Å
575	N	86.3	Confident	76.4	Confident	102 Å²	102	47.6 Å²	47.6	55%	0.545	29%	0.285	S	S	.	.	S	Bend	trans	58.3	21.9	172.3	-58.8	-41.7	0	0	0	115	K529	K529-N575 WeakPolarHBondContact O-CB 3.15Å
576	V	81.6	Confident	75.3	Confident	19 Å²	19	48.7 Å²	48.7	12%	0.115	29%	0.292	C	S	.	.			trans	-62.2	134.3	179.5	172.5	0	0	0	0	110.7	F526 C573 L574 I588 F599	F526-V576 HydrophobicContact CB-CG1 4.38Å; F526-V576 HydrophobicContact CB-CG2 4.18Å; F526-V576 HydrophobicContact CD1-CB 4.33Å; F526-V576 HydrophobicContact CD1-CG1 3.43Å; F526-V576 VanDerWaalsContact CD1-CG1 3.43Å; F526-V576 HydrophobicContact CD1-CG2 4.07Å; F526-V576 HydrophobicContact CD2-CG1 4.4Å; F526-V576 HydrophobicContact CD2-CG2 3.47Å; F526-V576 VanDerWaalsContact CD2-CG2 3.47Å; F526-V576 HydrophobicContact CE1-CG1 3.52Å; F526-V576 HydrophobicContact CE1-CG2 4.19Å; F526-V576 HydrophobicContact CE2-CG1 4.47Å; F526-V576 HydrophobicContact CE2-CG2 3.6Å; F526-V576 HydrophobicContact CG-CB 4.28Å; F526-V576 HydrophobicContact CG-CG1 3.86Å; F526-V576 HydrophobicContact CG-CG2 3.67Å; F526-V576 HydrophobicContact CZ-CG1 4.02Å; F526-V576 HydrophobicContact CZ-CG2 3.92Å; C573-V576 HydrophobicContact CB-CG2 3.93Å; L574-V576 PolarHBondContact O-N 3.23Å; L574-V576 VanDerWaalsContact O-N 3.08Å; V576-I588 HydrophobicContact CG1-CD1 4.13Å; V576-I588 HydrophobicContact CG1-CG2 4.01Å; V576-F599 HydrophobicContact CB-CB 3.89Å; V576-F599 HydrophobicContact CB-CD1 4.04Å; V576-F599 HydrophobicContact CB-CD2 4.1Å; V576-F599 HydrophobicContact CB-CG 3.74Å; V576-F599 HydrophobicContact CG1-CB 4.5Å; V576-F599 HydrophobicContact CG1-CD1 4.46Å; V576-F599 HydrophobicContact CG2-CB 3.46Å; V576-F599 VanDerWaalsContact CG2-CB 3.46Å; V576-F599 HydrophobicContact CG2-CD2 4.15Å; V576-F599 HydrophobicContact CG2-CG 3.83Å
577	K	68.9	Low	74.4	Confident	153 Å²	153	51.3 Å²	51.3	67%	0.665	31%	0.311	S	S	*	.			trans	-112.2	147	164.9	-64	-166.1	173.3	-159.5	0	108.6	G579	K577-G579 VanDerWaalsContact C-N 3.29Å; K577-G579 PolarHBondContact O-N 2.89Å
578	G	59.2	Low	73.8	Confident	79 Å²	79	52.1 Å²	52.1	81%	0.814	32%	0.315	S	S	*	.			trans	-67.3	85	175.7	0	0	0	0	0	111.6
579	G	55.5	Low	73.3	Confident	40 Å²	40	53.7 Å²	53.7	41%	0.412	32%	0.323	S	S	.	.			trans	-129.2	139.4	177.9	0	0	0	0	0	110.9	K577	K577-G579 VanDerWaalsContact C-N 3.29Å; K577-G579 PolarHBondContact O-N 2.89Å
580	T	50.2	Low	73	Confident	82 Å²	82	57.5 Å²	57.5	50%	0.503	35%	0.347	S	S	.	.			trans	-90.3	115.3	179	52.1	0	0	0	0	110.4	L585	T580-L585 HydrophobicContact CG2-CD1 3.77Å; T580-L585 HydrophobicContact CG2-CG 3.91Å
581	V	50.6	Low	72.7	Confident	66 Å²	66	58.4 Å²	58.4	40%	0.4	35%	0.353	S	S	.	.	S	Bend	trans	-88.4	-28.2	177.4	172.2	0	0	0	0	113.1	A524 L525	A524-V581 WeakPolarHBondContact O-CG1 3.46Å; A524-V581 WeakPolarHBondContact O-CG2 3.31Å; L525-V581 WeakPolarHBondContact O-CG2 3.35Å
582	F	51	Low	72.3	Confident	118 Å²	118	63.4 Å²	63.4	52%	0.518	39%	0.386	S	S	.	.	S	Bend	trans	-123.2	21.5	-170.2	-63.8	-66.8	0	0	0	115.4	L525 I584 F603	L525-F582 HydrophobicContact CD2-CE2 4.01Å; F582-I584 PolarHBondContact O-N 2.96Å; F582-F603 HydrophobicContact CD2-CE1 4.27Å; F582-F603 HydrophobicContact CD2-CZ 4.48Å
583	G	43	Very low	71.8	Confident	50 Å²	50	64 Å²	64	52%	0.515	39%	0.389	S	S	.	.	S	Bend	trans	65.4	11.3	-179.3	0	0	0	0	0	115	K389	K389-G583 PolarHBondContact NZ-O 3.39Å
584	I	54.4	Low	71	Confident	45 Å²	45	71.8 Å²	71.8	23%	0.231	43%	0.425	C	S	.	.	S	Bend	trans	-114	144	169.8	-59.7	173.9	0	0	0	106.3	F582 P586 L605	F582-I584 PolarHBondContact O-N 2.96Å; I584-P586 VanDerWaalsContact O-CD 3.29Å; I584-P586 WeakPolarHBondContact O-CD 3.44Å; I584-L605 HydrophobicContact CD1-CD2 3.88Å
585	L	60	Low	70.3	Confident	149 Å²	149	74 Å²	74	78%	0.78	46%	0.457	S	S	*	.			trans	-90.5	108.9	167.9	-89.7	75.3	0	0	0	108.8	T580	T580-L585 HydrophobicContact CG2-CD1 3.77Å; T580-L585 HydrophobicContact CG2-CG 3.91Å
586	P	72.8	Confident	69.9	Low	26 Å²	26	70.4 Å²	70.4	17%	0.169	44%	0.442	C	S	.	.			trans	-74.9	155.8	170.5	31	-34	0	0	0	111.7	I584 V601 D602 F603	I584-P586 VanDerWaalsContact O-CD 3.29Å; I584-P586 WeakPolarHBondContact O-CD 3.44Å; P586-V601 HydrophobicContact CB-CG2 3.49Å; P586-V601 VanDerWaalsContact CB-CG2 3.49Å; P586-V601 HydrophobicContact CG-CG2 3.99Å; P586-D602 WeakPolarHBondContact CA-O 3.48Å; P586-F603 HydrophobicContact CB-CD1 3.71Å; P586-F603 HydrophobicContact CB-CE1 3.78Å; P586-F603 HydrophobicContact CB-CG 4.2Å; P586-F603 HydrophobicContact CB-CZ 4.35Å; P586-F603 HydrophobicContact CG-CD1 4.32Å; P586-F603 HydrophobicContact CG-CE1 3.95Å
587	S	76.4	Confident	70.2	Confident	57 Å²	57	72.6 Å²	72.6	40%	0.399	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122.7	160.6	-70	0	0	0	0	109.5	I589 D602	S587-I589 WeakPolarHBondContact O-CD1 3.04Å; S587-D602 PolarHBondContact N-O 3.4Å; S587-D602 PolarHBondContact O-N 3.19Å
588	I	82.6	Confident	71.3	Confident	57 Å²	57	65.3 Å²	65.3	29%	0.292	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	108.5	176.3	-60.3	175.8	0	0	0	108.4	F526 V576 T590 F599	F526-I588 HydrophobicContact CE1-CD1 4.3Å; F526-I588 HydrophobicContact CE1-CG1 4.27Å; V576-I588 HydrophobicContact CG1-CD1 4.13Å; V576-I588 HydrophobicContact CG1-CG2 4.01Å; I588-T590 PolarHBondContact O-N 2.71Å; I588-F599 HydrophobicContact CG2-CD1 3.97Å
589	I	84.9	Confident	72.8	Confident	33 Å²	33	63.4 Å²	63.4	17%	0.169	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	111.5	-176.5	-55.6	94.5	0	0	0	108.8	F548 S587 F599 G600 D602	F548-I589 HydrophobicContact CB-CD1 4.41Å; F548-I589 HydrophobicContact CB-CG1 4.15Å; F548-I589 HydrophobicContact CB-CG2 4.39Å; F548-I589 HydrophobicContact CD1-CD1 3.7Å; F548-I589 HydrophobicContact CD1-CG1 3.61Å; F548-I589 HydrophobicContact CE1-CD1 4.43Å; F548-I589 HydrophobicContact CE1-CG1 4.25Å; F548-I589 HydrophobicContact CG-CD1 4.37Å; F548-I589 HydrophobicContact CG-CG1 3.97Å; S587-I589 WeakPolarHBondContact O-CD1 3.04Å; I589-F599 WeakPolarHBondContact O-CA 3.2Å; I589-G600 PolarHBondContact N-O 2.79Å; I589-G600 PolarHBondContact O-N 3.24Å; I589-D602 HydrophobicContact CD1-CB 3.82Å
590	T	88.4	Confident	74.4	Confident	80 Å²	80	61.6 Å²	61.6	49%	0.491	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	114.5	179.1	-55.2	0	0	0	0	109.7	I588 T597 F599	I588-T590 PolarHBondContact O-N 2.71Å; T590-T597 HydrophobicContact CG2-CG2 3.48Å; T590-T597 VanDerWaalsContact CG2-CG2 3.48Å; T590-F599 HydrophobicContact CG2-CD1 4.22Å; T590-F599 HydrophobicContact CG2-CE1 3.73Å; T590-F599 HydrophobicContact CG2-CZ 4.27Å; T590-F599 WeakPolarHBondContact OG1-CE1 3.36Å
591	T	85.8	Confident	76	Confident	24 Å²	24	57.8 Å²	57.8	15%	0.147	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.9	-179.7	-43.8	0	0	0	0	110.9	I593 C598	T591-I593 HydrophobicContact CG2-CD1 3.75Å; T591-I593 HydrophobicContact CG2-CG1 3.72Å; T591-C598 PolarHBondContact N-O 2.82Å; T591-C598 WeakPolarHBondContact O-CB 3.23Å; T591-C598 PolarHBondContact O-N 2.85Å
592	P	86.9	Confident	77.5	Confident	107 Å²	107	55.1 Å²	55.1	70%	0.695	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.9	172.9	30.5	-31.7	0	0	0	110.2	A596	P592-A596 WeakPolarHBondContact CA-O 3.46Å
593	I	84.7	Confident	78.5	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.077	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	118	-174.2	-57.6	-174.1	0	0	0	109.1	I536 D540 V541 T591 G595 A596 C598	I536-I593 HydrophobicContact CG1-CG2 4.15Å; I536-I593 HydrophobicContact CG2-CG2 4.3Å; D540-I593 HydrophobicContact CB-CD1 3.86Å; D540-I593 HydrophobicContact CB-CG2 4.15Å; D540-I593 WeakPolarHBondContact OD2-CG2 3.34Å; V541-I593 HydrophobicContact CG2-CD1 3.73Å; T591-I593 HydrophobicContact CG2-CD1 3.75Å; T591-I593 HydrophobicContact CG2-CG1 3.72Å; I593-G595 PolarHBondContact O-N 2.75Å; I593-A596 PolarHBondContact N-O 3.04Å; I593-A596 WeakPolarHBondContact O-CB 3.09Å; I593-A596 PolarHBondContact O-N 3.47Å; I593-C598 HydrophobicContact CD1-CB 4.49Å
594	H	77.3	Confident	79.7	Confident	164 Å²	164	52.1 Å²	52.1	76%	0.759	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	34.7	175.4	-75.1	-83.4	0	0	0	115.5	I536 D540	I536-H594 HydrophobicContact CD1-CB 4Å; I536-H594 VanDerWaalsContact CD1-CD2 3.43Å; I536-H594 WeakPolarHBondContact CD1-CD2 3.35Å; D540-H594 IonicContact OD2-CD2 3.43Å
595	G	75.6	Confident	80.2	Confident	87 Å²	87	50.9 Å²	50.9	90%	0.897	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-11.9	-179.2	0	0	0	0	0	115.2	I593	I593-G595 PolarHBondContact O-N 2.75Å
596	A	79.1	Confident	80.3	Confident	27 Å²	27	45.1 Å²	45.1	22%	0.223	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	154.7	166	0	0	0	0	0	111	P592 I593	P592-A596 WeakPolarHBondContact CA-O 3.46Å; I593-A596 PolarHBondContact N-O 3.04Å; I593-A596 WeakPolarHBondContact O-CB 3.09Å; I593-A596 PolarHBondContact O-N 3.47Å
597	T	87.2	Confident	79.7	Confident	65 Å²	65	44.7 Å²	44.7	40%	0.399	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	100.9	168.1	-56.8	0	0	0	0	108	L574 T590 F599	L574-T597 WeakPolarHBondContact CD2-O 3.22Å; T590-T597 HydrophobicContact CG2-CG2 3.48Å; T590-T597 VanDerWaalsContact CG2-CG2 3.48Å; T597-F599 HydrophobicContact CG2-CE1 4.22Å; T597-F599 HydrophobicContact CG2-CE2 3.75Å; T597-F599 HydrophobicContact CG2-CZ 3.57Å; T597-F599 VanDerWaalsContact O-CD2 3.32Å; T597-F599 WeakPolarHBondContact O-CD2 3.04Å; T597-F599 VanDerWaalsContact O-CE2 3.31Å; T597-F599 WeakPolarHBondContact O-CE2 3.47Å
598	C	90.9	Very high	78.7	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135.8	-179	-45.1	0	0	0	0	109.8	C537 T591 I593	C537-C598 VanDerWaalsContact CA-SG 3.59Å; C537-C598 HydrophobicContact CB-CB 3.63Å; C537-C598 WeakPolarHBondContact CB-SG 3.32Å; C537-C598 WeakPolarHBondContact SG-CB 3.18Å; C537-C598 CovalentContact SG-SG 2.03Å; C537-C598 PolarHBondContact SG-SG 3.06Å; T591-C598 PolarHBondContact N-O 2.82Å; T591-C598 WeakPolarHBondContact O-CB 3.23Å; T591-C598 PolarHBondContact O-N 2.85Å; I593-C598 HydrophobicContact CD1-CB 4.49Å
599	F	91.1	Very high	77.7	Confident	39 Å²	39	39.8 Å²	39.8	17%	0.171	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114.7	176.2	-62.4	-88.7	0	0	0	110.7	C573 V576 I588 I589 T590 T597	C573-F599 PolarHBondContact N-O 3.19Å; C573-F599 PolarHBondContact O-N 3.47Å; V576-F599 HydrophobicContact CB-CB 3.89Å; V576-F599 HydrophobicContact CB-CD1 4.04Å; V576-F599 HydrophobicContact CB-CD2 4.1Å; V576-F599 HydrophobicContact CB-CG 3.74Å; V576-F599 HydrophobicContact CG1-CB 4.5Å; V576-F599 HydrophobicContact CG1-CD1 4.46Å; V576-F599 HydrophobicContact CG2-CB 3.46Å; V576-F599 VanDerWaalsContact CG2-CB 3.46Å; V576-F599 HydrophobicContact CG2-CD2 4.15Å; V576-F599 HydrophobicContact CG2-CG 3.83Å; I588-F599 HydrophobicContact CG2-CD1 3.97Å; I589-F599 WeakPolarHBondContact O-CA 3.2Å; T590-F599 HydrophobicContact CG2-CD1 4.22Å; T590-F599 HydrophobicContact CG2-CE1 3.73Å; T590-F599 HydrophobicContact CG2-CZ 4.27Å; T590-F599 WeakPolarHBondContact OG1-CE1 3.36Å; T597-F599 HydrophobicContact CG2-CE1 4.22Å; T597-F599 HydrophobicContact CG2-CE2 3.75Å; T597-F599 HydrophobicContact CG2-CZ 3.57Å; T597-F599 VanDerWaalsContact O-CD2 3.32Å; T597-F599 WeakPolarHBondContact O-CD2 3.04Å; T597-F599 VanDerWaalsContact O-CE2 3.31Å; T597-F599 WeakPolarHBondContact O-CE2 3.47Å
600	G	89.1	Confident	76.9	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	168.9	167.8	0	0	0	0	0	111.6	I589	I589-G600 PolarHBondContact N-O 2.79Å; I589-G600 PolarHBondContact O-N 3.24Å
601	V	84.4	Confident	76.3	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.4	176.8	73.7	0	0	0	0	111.4	L525 F526 K570 P586 F603	L525-V601 HydrophobicContact CD1-CG1 4.45Å; F526-V601 HydrophobicContact CE1-CG2 4.38Å; F526-V601 HydrophobicContact CZ-CB 3.86Å; F526-V601 HydrophobicContact CZ-CG2 4.21Å; K570-V601 VanDerWaalsContact CE-O 3.25Å; K570-V601 WeakPolarHBondContact CE-O 3.02Å; K570-V601 PolarHBondContact NZ-O 3.16Å; P586-V601 HydrophobicContact CB-CG2 3.49Å; P586-V601 VanDerWaalsContact CB-CG2 3.49Å; P586-V601 HydrophobicContact CG-CG2 3.99Å; V601-F603 HydrophobicContact CB-CE2 4.24Å; V601-F603 HydrophobicContact CG1-CD2 4.12Å; V601-F603 HydrophobicContact CG1-CE2 3.58Å; V601-F603 HydrophobicContact CG1-CZ 4.42Å; V601-F603 HydrophobicContact CG2-CD2 4.03Å; V601-F603 HydrophobicContact CG2-CE1 4.41Å; V601-F603 HydrophobicContact CG2-CE2 3.58Å; V601-F603 HydrophobicContact CG2-CZ 3.79Å
602	D	82	Confident	76	Confident	11 Å²	11	39.1 Å²	39.1	6%	0.059	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.3	165.3	177.8	24.8	0	0	0	109.3	R547 F548 P586 S587 I589 M604	R547-D602 IonicContact CZ-OD2 2.7Å; R547-D602 VanDerWaalsContact CZ-OD2 3.24Å; R547-D602 IonicContact NE-OD2 2.76Å; R547-D602 PolarHBondContact NE-OD2 3.12Å; R547-D602 IonicContact NH2-OD1 3.67Å; R547-D602 IonicContact NH2-OD2 3.19Å; R547-D602 PolarHBondContact NH2-OD2 3.41Å; F548-D602 HydrophobicContact CD1-CB 4.1Å; F548-D602 HydrophobicContact CE1-CB 4.19Å; P586-D602 WeakPolarHBondContact CA-O 3.48Å; S587-D602 PolarHBondContact N-O 3.4Å; S587-D602 PolarHBondContact O-N 3.19Å; I589-D602 HydrophobicContact CD1-CB 3.82Å; D602-M604 PolarHBondContact OD1-N 3.41Å
603	F	71.8	Confident	75.9	Confident	14 Å²	14	34 Å²	34	6%	0.061	21%	0.212	C	C	.	.			trans	-87.1	-6.3	176.7	-69.3	-85.7	0	0	0	113	L525 F582 P586 V601 L605 P612	L525-F603 HydrophobicContact CD2-CE2 4.17Å; L525-F603 HydrophobicContact CD2-CZ 3.98Å; F582-F603 HydrophobicContact CD2-CE1 4.27Å; F582-F603 HydrophobicContact CD2-CZ 4.48Å; P586-F603 HydrophobicContact CB-CD1 3.71Å; P586-F603 HydrophobicContact CB-CE1 3.78Å; P586-F603 HydrophobicContact CB-CG 4.2Å; P586-F603 HydrophobicContact CB-CZ 4.35Å; P586-F603 HydrophobicContact CG-CD1 4.32Å; P586-F603 HydrophobicContact CG-CE1 3.95Å; V601-F603 HydrophobicContact CB-CE2 4.24Å; V601-F603 HydrophobicContact CG1-CD2 4.12Å; V601-F603 HydrophobicContact CG1-CE2 3.58Å; V601-F603 HydrophobicContact CG1-CZ 4.42Å; V601-F603 HydrophobicContact CG2-CD2 4.03Å; V601-F603 HydrophobicContact CG2-CE1 4.41Å; V601-F603 HydrophobicContact CG2-CE2 3.58Å; V601-F603 HydrophobicContact CG2-CZ 3.79Å; F603-L605 HydrophobicContact CB-CD1 3.64Å; F603-L605 HydrophobicContact CB-CD2 4.06Å; F603-L605 HydrophobicContact CB-CG 3.5Å; F603-L605 VanDerWaalsContact CB-CG 3.5Å; F603-L605 HydrophobicContact CG-CD1 4.34Å; F603-L605 PolarHBondContact O-N 2.74Å; F603-P612 HydrophobicContact CD2-CB 4.24Å; F603-P612 HydrophobicContact CD2-CG 4.24Å; F603-P612 HydrophobicContact CE2-CB 3.86Å; F603-P612 HydrophobicContact CE2-CG 4.28Å; F603-P612 HydrophobicContact CZ-CB 4.45Å
604	M	67.8	Low	76.2	Confident	91 Å²	91	34.2 Å²	34.2	45%	0.448	21%	0.213	S	C	.	.			trans	59.3	26.1	-179	-45.6	-168.6	57	0	0	115.4	R547 D602	R547-M604 VanDerWaalsContact NH2-CG 3.27Å; D602-M604 PolarHBondContact OD1-N 3.41Å
605	L	65.9	Low	76.9	Confident	18 Å²	18	26.8 Å²	26.8	9%	0.094	18%	0.179	C	C	.	.			trans	-79.1	-23.8	-166.7	-56.8	171.2	0	0	0	115.5	H354 I584 F603 V609 P612	H354-L605 PolarHBondContact ND1-O 3.32Å; I584-L605 HydrophobicContact CD1-CD2 3.88Å; F603-L605 HydrophobicContact CB-CD1 3.64Å; F603-L605 HydrophobicContact CB-CD2 4.06Å; F603-L605 HydrophobicContact CB-CG 3.5Å; F603-L605 VanDerWaalsContact CB-CG 3.5Å; F603-L605 HydrophobicContact CG-CD1 4.34Å; F603-L605 PolarHBondContact O-N 2.74Å; L605-V609 HydrophobicContact CB-CB 3.69Å; L605-V609 HydrophobicContact CB-CG1 3.83Å; L605-V609 HydrophobicContact CB-CG2 4.11Å; L605-V609 HydrophobicContact CD1-CG1 3.81Å; L605-V609 HydrophobicContact CG-CG1 4.36Å; L605-V609 WeakPolarHBondContact O-CG2 3.31Å; L605-P612 HydrophobicContact CD1-CG 4.25Å
606	G	62.7	Low	77.5	Confident	29 Å²	29	25.4 Å²	25.4	30%	0.299	15%	0.151	S	C	.	.			trans	124.6	-156.4	-174.5	0	0	0	0	0	114.2	H354 D608	H354-G606 WeakPolarHBondContact CE1-CA 3.44Å; H354-G606 WeakPolarHBondContact ND1-CA 3.21Å; G606-D608 WeakPolarHBondContact CA-OD1 3.34Å
607	S	60.1	Low	77.9	Confident	17 Å²	17	26.1 Å²	26.1	12%	0.119	15%	0.15	C	C	.	.	S	Bend	trans	-128.6	-5.6	169.1	77.8	0	0	0	0	114	C171 G172 M312	C171-S607 PolarHBondContact O-OG 3.49Å; C171-S607 PolarHBondContact SG-OG 3.21Å; G172-S607 WeakPolarHBondContact CA-OG 3.27Å; G172-S607 PolarHBondContact N-OG 2.92Å; M312-S607 WeakPolarHBondContact CE-O 3.44Å
608	D	54.8	Low	78	Confident	1 Å²	1	23 Å²	23	1%	0.005	13%	0.131	C	C	.	.	S	Bend	trans	-81.8	-17	161.6	33	25.4	0	0	0	112.5	C171 M312 A313 H344 H348 H354 G606	C171-D608 WeakPolarHBondContact CB-OD2 3.35Å; C171-D608 VanDerWaalsContact SG-CB 3.56Å; C171-D608 PolarHBondContact SG-OD2 2.93Å; M312-D608 CarbonylContact C-O 3.6Å; M312-D608 WeakPolarHBondContact CA-O 3.18Å; M312-D608 WeakPolarHBondContact CG-O 3.39Å; A313-D608 PolarHBondContact N-O 3.09Å; H344-D608 IonicContact CD2-OD2 3.83Å; H344-D608 IonicContact CE1-OD2 2.71Å; H344-D608 IonicContact NE2-OD2 3.49Å; H344-D608 PolarHBondContact NE2-OD2 2.77Å; H348-D608 IonicContact NE2-OD1 2.79Å; H348-D608 IonicContact NE2-OD2 2.69Å; H354-D608 VanDerWaalsContact CE1-CG 3.47Å; H354-D608 IonicContact CE1-OD1 2.74Å; H354-D608 PolarHBondContact CE1-OD1 3.06Å; H354-D608 IonicContact CE1-OD2 2.81Å; H354-D608 PolarHBondContact CE1-OD2 3.28Å; H354-D608 VanDerWaalsContact NE2-CG 3.29Å; H354-D608 IonicContact NE2-OD1 2.63Å; H354-D608 PolarHBondContact NE2-OD1 2.03Å; H354-D608 VanDerWaalsContact NE2-OD1 3.12Å; H354-D608 IonicContact NE2-OD2 3.27Å; H354-D608 PolarHBondContact NE2-OD2 3.18Å; G606-D608 WeakPolarHBondContact CA-OD1 3.34Å
609	V	60.5	Low	78.1	Confident	10 Å²	10	23.1 Å²	23.1	6%	0.061	13%	0.132	C	C	.	.	S	Bend	trans	-105.2	130	168	-173.5	0	0	0	0	110.3	V315 H348 L605 D611	V315-V609 HydrophobicContact CG2-CB 4.35Å; V315-V609 HydrophobicContact CG2-CG1 3.72Å; V315-V609 HydrophobicContact CG2-CG2 3.6Å; H348-V609 WeakPolarHBondContact CE1-CG2 3.42Å; H348-V609 VanDerWaalsContact NE2-CG2 3.32Å; H348-V609 WeakPolarHBondContact NE2-CG2 3.08Å; L605-V609 HydrophobicContact CB-CB 3.69Å; L605-V609 HydrophobicContact CB-CG1 3.83Å; L605-V609 HydrophobicContact CB-CG2 4.11Å; L605-V609 HydrophobicContact CD1-CG1 3.81Å; L605-V609 HydrophobicContact CG-CG1 4.36Å; L605-V609 WeakPolarHBondContact O-CG2 3.31Å; V609-D611 PolarHBondContact O-N 2.9Å
610	P	68.1	Low	78.3	Confident	43 Å²	43	23.7 Å²	23.7	28%	0.279	13%	0.134	S	C	.	.			trans	-60.2	106	170.7	-24.1	34.3	0	0	0	111.8	L278 M312 A313 F314 P612	L278-P610 HydrophobicContact CD2-CG 4.12Å; M312-P610 HydrophobicContact CG-CG 4.19Å; M312-P610 HydrophobicContact SD-CG 3.92Å; A313-P610 WeakPolarHBondContact O-CD 3.49Å; F314-P610 HydrophobicContact CD1-CG 4.16Å; F314-P610 HydrophobicContact CE1-CB 4.46Å; F314-P610 HydrophobicContact CE1-CG 3.9Å; P610-P612 WeakPolarHBondContact O-CD 3.3Å
611	D	76.6	Confident	78.6	Confident	40 Å²	40	24.1 Å²	24.1	21%	0.214	14%	0.137	C	C	.	.			trans	-62.8	113	-178.3	174.9	19.5	0	0	0	112	K570 V609 G613 M614	K570-D611 IonicContact NZ-OD1 2.83Å; K570-D611 IonicContact NZ-OD2 2.68Å; K570-D611 PolarHBondContact NZ-OD2 2.73Å; V609-D611 PolarHBondContact O-N 2.9Å; D611-G613 PolarHBondContact O-N 2.87Å; D611-G613 WeakPolarHBondContact OD1-CA 3.43Å; D611-G613 PolarHBondContact OD1-N 3.03Å; D611-M614 HydrophobicContact CB-CG 4.02Å; D611-M614 PolarHBondContact O-N 3.26Å
612	P	79.3	Confident	78.9	Confident	40 Å²	40	25.4 Å²	25.4	26%	0.26	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.9	177.8	-19.4	32.8	0	0	0	113.5	Q521 L525 F603 L605 P610	Q521-P612 PolarHBondContact NE2-O 3.4Å; L525-P612 WeakPolarHBondContact CD1-O 3.44Å; L525-P612 HydrophobicContact CD2-CB 3.96Å; F603-P612 HydrophobicContact CD2-CB 4.24Å; F603-P612 HydrophobicContact CD2-CG 4.24Å; F603-P612 HydrophobicContact CE2-CB 3.86Å; F603-P612 HydrophobicContact CE2-CG 4.28Å; F603-P612 HydrophobicContact CZ-CB 4.45Å; L605-P612 HydrophobicContact CD1-CG 4.25Å; P610-P612 WeakPolarHBondContact O-CD 3.3Å
613	G	85.7	Confident	79.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1	173.8	0	0	0	0	0	115.5	K570 L571 D611	K570-G613 CarbonylContact C-O 3.06Å; K570-G613 WeakPolarHBondContact CA-O 3.46Å; L571-G613 WeakPolarHBondContact CB-O 3.41Å; L571-G613 PolarHBondContact N-O 3.42Å; D611-G613 PolarHBondContact O-N 2.87Å; D611-G613 WeakPolarHBondContact OD1-CA 3.43Å; D611-G613 PolarHBondContact OD1-N 3.03Å
614	M	89.6	Confident	80.3	Confident	19 Å²	19	34.8 Å²	34.8	9%	0.094	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-87.4	145.4	166.3	-68.4	-61.2	-67.5	0	0	110.4	Q521 G569 K570 D611 N616 F630	Q521-M614 PolarHBondContact NE2-O 3.02Å; G569-M614 VanDerWaalsContact C-CE 3.46Å; K570-M614 HydrophobicContact CB-SD 4.28Å; K570-M614 HydrophobicContact CD-CG 4.29Å; K570-M614 HydrophobicContact CD-SD 3.3Å; K570-M614 WeakPolarHBondContact CD-SD 3.47Å; K570-M614 HydrophobicContact CG-SD 3.59Å; K570-M614 VanDerWaalsContact CG-SD 3.59Å; D611-M614 HydrophobicContact CB-CG 4.02Å; D611-M614 PolarHBondContact O-N 3.26Å; M614-N616 PolarHBondContact O-N 2.86Å; M614-F630 HydrophobicContact CB-CE1 4.34Å; M614-F630 HydrophobicContact CE-CD1 3.28Å; M614-F630 HydrophobicContact CE-CE1 3.54Å; M614-F630 HydrophobicContact CE-CG 4.13Å; M614-F630 HydrophobicContact CG-CE1 4.25Å
615	V	92.9	Very high	81.6	Confident	7 Å²	7	35 Å²	35	4%	0.042	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-62.2	127.4	176.4	171.5	0	0	0	0	110.6	L518 F538 Q567 G569 L571 T619 C627	L518-V615 HydrophobicContact CD2-CB 4.29Å; L518-V615 HydrophobicContact CD2-CG1 3.64Å; L518-V615 HydrophobicContact CD2-CG2 3.61Å; F538-V615 HydrophobicContact CE1-CG2 3.95Å; Q567-V615 WeakPolarHBondContact O-CG1 3.35Å; Q567-V615 WeakPolarHBondContact O-CG2 3.48Å; G569-V615 WeakPolarHBondContact O-CG2 3.28Å; G569-V615 PolarHBondContact O-N 2.75Å; L571-V615 HydrophobicContact CB-CG2 4.07Å; L571-V615 HydrophobicContact CD1-CG2 3.78Å; V615-T619 HydrophobicContact CG1-CG2 3.82Å; V615-C627 HydrophobicContact CG1-CB 4.49Å
616	N	88.3	Confident	83	Confident	58 Å²	58	34.2 Å²	34.2	31%	0.31	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-56.1	142.1	-179.3	-73.1	-10.7	0	0	0	112.4	Q516 Q521 M614 T619	Q516-N616 PolarHBondContact OE1-ND2 2.69Å; Q521-N616 PolarHBondContact NE2-OD1 2.92Å; M614-N616 PolarHBondContact O-N 2.86Å; N616-T619 WeakPolarHBondContact O-CB 3.32Å; N616-T619 PolarHBondContact O-N 2.74Å; N616-T619 PolarHBondContact O-OG1 3.26Å
617	E	87.6	Confident	84.5	Confident	43 Å²	43	32.9 Å²	32.9	20%	0.201	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	150.9	169.8	-61.5	-165.9	132.1	0	0	111.9	E276 Y511 Q516 T619 C627 M628 N629	E276-E617 WeakPolarHBondContact CG-OE2 3.42Å; Y511-E617 WeakPolarHBondContact CD1-O 3.47Å; Y511-E617 HydrophobicContact CE1-CB 3.99Å; Q516-E617 WeakPolarHBondContact CG-O 3.39Å; E617-T619 PolarHBondContact O-N 3.21Å; E617-C627 WeakPolarHBondContact CA-O 3.05Å; E617-M628 HydrophobicContact CB-CE 4.42Å; E617-M628 HydrophobicContact CB-SD 4.08Å; E617-M628 HydrophobicContact CG-SD 4.38Å; E617-N629 PolarHBondContact OE1-N 2.9Å
618	G	88.1	Confident	85.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	-13.4	-170.5	0	0	0	0	0	114.7	K620 C627	G618-K620 PolarHBondContact O-N 2.89Å; G618-C627 PolarHBondContact N-O 3.18Å
619	T	94.6	Very high	87.2	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.012	19%	0.19	C	C	.	.			trans	-58.6	131	174.6	-59.7	0	0	0	0	111	L518 V615 N616 E617 C621 V626 C627	L518-T619 HydrophobicContact CD2-CG2 3.86Å; L518-T619 HydrophobicContact CG-CG2 3.93Å; V615-T619 HydrophobicContact CG1-CG2 3.82Å; N616-T619 WeakPolarHBondContact O-CB 3.32Å; N616-T619 PolarHBondContact O-N 2.74Å; N616-T619 PolarHBondContact O-OG1 3.26Å; E617-T619 PolarHBondContact O-N 3.21Å; T619-C621 PolarHBondContact O-N 3.45Å; T619-V626 CarbonylContact O-C 3.35Å; T619-V626 VanDerWaalsContact O-CA 3.26Å; T619-V626 WeakPolarHBondContact O-CA 3.4Å; T619-C627 PolarHBondContact O-N 3.02Å
620	K	94.6	Very high	88.5	Confident	51 Å²	51	38 Å²	38	22%	0.222	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	128.8	176.4	-169.8	178.5	-168.6	-176.2	0	110.8	Q506 Q507 Y509 G618 G622 K625	Q506-K620 PolarHBondContact O-NZ 2.98Å; Q507-K620 WeakPolarHBondContact O-CD 2.99Å; Y509-K620 HydrophobicContact CD2-CB 4.1Å; Y509-K620 HydrophobicContact CD2-CG 4.3Å; Y509-K620 HydrophobicContact CE2-CB 4.24Å; Y509-K620 HydrophobicContact CE2-CD 4.1Å; Y509-K620 HydrophobicContact CE2-CG 3.92Å; G618-K620 PolarHBondContact O-N 2.89Å; K620-G622 VanDerWaalsContact CE-O 3.23Å; K620-G622 WeakPolarHBondContact CE-O 3.46Å; K620-G622 WeakPolarHBondContact CG-O 3.3Å; K620-K625 WeakPolarHBondContact CA-O 3.06Å
621	C	94.5	Very high	89.7	Confident	11 Å²	11	39 Å²	39	7%	0.074	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	11.9	-179.2	62.3	0	0	0	0	113.4	Q567 T619 K625 C632	Q567-C621 HydrophobicContact CB-CB 4.24Å; Q567-C621 VanDerWaalsContact OE1-C 3.29Å; Q567-C621 PolarHBondContact OE1-O 2.97Å; Q567-C621 VanDerWaalsContact OE1-O 3.1Å; T619-C621 PolarHBondContact O-N 3.45Å; C621-K625 PolarHBondContact N-O 3.26Å; C621-K625 VanDerWaalsContact N-O 3.08Å; C621-C632 HydrophobicContact CB-CB 3.9Å; C621-C632 WeakPolarHBondContact CB-SG 3.47Å; C621-C632 PolarHBondContact O-SG 3.32Å; C621-C632 WeakPolarHBondContact SG-CA 3.35Å; C621-C632 WeakPolarHBondContact SG-CB 3.42Å; C621-C632 CovalentContact SG-SG 2.04Å; C621-C632 PolarHBondContact SG-SG 3.47Å
622	G	92	Very high	90.6	Very high	29 Å²	29	38 Å²	38	30%	0.299	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	159	-179.3	-178.9	0	0	0	0	0	111.7	K620 N624 K625	K620-G622 VanDerWaalsContact CE-O 3.23Å; K620-G622 WeakPolarHBondContact CE-O 3.46Å; K620-G622 WeakPolarHBondContact CG-O 3.3Å; G622-N624 PolarHBondContact O-N 3.35Å; G622-K625 PolarHBondContact O-N 2.94Å
623	D	91.8	Very high	91.3	Very high	139 Å²	139	41.6 Å²	41.6	74%	0.743	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	126.7	179.2	-59.9	-49.4	0	0	0	111.3	K625	D623-K625 WeakPolarHBondContact O-CG 3.44Å; D623-K625 PolarHBondContact O-N 2.04Å
624	N	91.4	Very high	91.8	Very high	82 Å²	82	44 Å²	44	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	37.3	-166.2	-154	60.3	0	0	0	114.9	G622 S634 A635 D636	G622-N624 PolarHBondContact O-N 3.35Å; N624-S634 PolarHBondContact ND2-OG 2.87Å; N624-S634 WeakPolarHBondContact O-CA 3.28Å; N624-A635 PolarHBondContact O-N 3.04Å; N624-D636 PolarHBondContact ND2-OD1 3.39Å
625	K	94.9	Very high	91.9	Very high	97 Å²	97	43.5 Å²	43.5	42%	0.422	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145.8	-178.8	-67.1	175.2	-167.9	171.9	0	114.5	K620 C621 G622 D623 R633	K620-K625 WeakPolarHBondContact CA-O 3.06Å; C621-K625 PolarHBondContact N-O 3.26Å; C621-K625 VanDerWaalsContact N-O 3.08Å; G622-K625 PolarHBondContact O-N 2.94Å; D623-K625 WeakPolarHBondContact O-CG 3.44Å; D623-K625 PolarHBondContact O-N 2.04Å; K625-R633 CarbonylContact C-O 3.56Å; K625-R633 WeakPolarHBondContact CA-O 3.01Å; K625-R633 VanDerWaalsContact CB-O 3.28Å; K625-R633 WeakPolarHBondContact CB-O 3.33Å
626	V	95.4	Very high	91.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	154.2	178.4	-59.4	0	0	0	0	112.2	Y509 T619 M628 R633 A635 V637 L638	Y509-V626 HydrophobicContact CD2-CG1 3.39Å; Y509-V626 HydrophobicContact CE2-CG1 3.74Å; Y509-V626 HydrophobicContact CG-CG1 4.17Å; T619-V626 CarbonylContact O-C 3.35Å; T619-V626 VanDerWaalsContact O-CA 3.26Å; T619-V626 WeakPolarHBondContact O-CA 3.4Å; V626-M628 HydrophobicContact CG2-CE 4.36Å; V626-R633 PolarHBondContact N-O 3.31Å; V626-R633 PolarHBondContact O-N 2.77Å; V626-A635 HydrophobicContact CG1-CB 4.35Å; V626-V637 HydrophobicContact CG2-CG1 3.84Å; V626-L638 HydrophobicContact CG1-CD1 4.1Å; V626-L638 HydrophobicContact CG2-CD1 4.19Å; V626-L638 HydrophobicContact CG2-CD2 4.36Å; V626-L638 HydrophobicContact CG2-CG 4.13Å
627	C	94.6	Very high	91.9	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.2	170.3	-62.7	0	0	0	0	111.1	C568 V615 E617 G618 T619 E631	C568-C627 WeakPolarHBondContact CA-SG 3.16Å; C568-C627 HydrophobicContact CB-CB 3.63Å; C568-C627 WeakPolarHBondContact CB-SG 3.41Å; C568-C627 WeakPolarHBondContact SG-CA 3.36Å; C568-C627 WeakPolarHBondContact SG-CB 3.43Å; C568-C627 CovalentContact SG-SG 2.04Å; C568-C627 PolarHBondContact SG-SG 3.27Å; V615-C627 HydrophobicContact CG1-CB 4.49Å; E617-C627 WeakPolarHBondContact CA-O 3.05Å; G618-C627 PolarHBondContact N-O 3.18Å; T619-C627 PolarHBondContact O-N 3.02Å; C627-E631 WeakPolarHBondContact CA-O 3.49Å
628	M	88.1	Confident	91.8	Very high	8 Å²	8	47 Å²	47	4%	0.039	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	128.5	174.9	-157.8	66.2	57.5	0	0	109.2	Y511 E617 V626 F630 E631 V637 L638	Y511-M628 HydrophobicContact CE2-CE 3.79Å; E617-M628 HydrophobicContact CB-CE 4.42Å; E617-M628 HydrophobicContact CB-SD 4.08Å; E617-M628 HydrophobicContact CG-SD 4.38Å; V626-M628 HydrophobicContact CG2-CE 4.36Å; M628-F630 PolarHBondContact O-N 3.47Å; M628-E631 PolarHBondContact N-O 2.83Å; M628-E631 PolarHBondContact O-N 2.04Å; M628-E631 VanDerWaalsContact O-N 3.11Å; M628-V637 HydrophobicContact CB-CG1 4.37Å; M628-V637 HydrophobicContact CE-CG1 4.16Å; M628-V637 HydrophobicContact CG-CG1 4.4Å; M628-V637 HydrophobicContact CG-CG2 4.34Å; M628-L638 HydrophobicContact CE-CD2 3.42Å; M628-L638 VanDerWaalsContact CE-CD2 3.42Å
629	N	81.9	Confident	91.7	Very high	49 Å²	49	50.5 Å²	50.5	26%	0.262	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	43.4	-169.1	-58.1	-102.7	0	0	0	113.1	G273 E276 E617 E631	G273-N629 PolarHBondContact N-OD1 2.8Å; E276-N629 PolarHBondContact OE1-ND2 3.44Å; E617-N629 PolarHBondContact OE1-N 2.9Å; N629-E631 PolarHBondContact O-N 3.43Å
630	F	89	Confident	91.6	Very high	77 Å²	77	53.8 Å²	53.8	34%	0.338	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	17	-178	-39.2	-69.9	0	0	0	115.7	C551 C568 M614 M628	C551-F630 VanDerWaalsContact C-CB 3.49Å; C551-F630 HydrophobicContact CB-CB 4.15Å; C551-F630 WeakPolarHBondContact O-CB 3.41Å; C551-F630 PolarHBondContact SG-O 3Å; C551-F630 VanDerWaalsContact SG-O 3.36Å; C568-F630 WeakPolarHBondContact O-CA 3.03Å; M614-F630 HydrophobicContact CB-CE1 4.34Å; M614-F630 HydrophobicContact CE-CD1 3.28Å; M614-F630 HydrophobicContact CE-CE1 3.54Å; M614-F630 HydrophobicContact CE-CG 4.13Å; M614-F630 HydrophobicContact CG-CE1 4.25Å; M628-F630 PolarHBondContact O-N 3.47Å
631	E	92.3	Very high	91.4	Very high	65 Å²	65	55.3 Å²	55.3	30%	0.304	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.3	176.2	-60.7	-165.8	162.1	0	0	111.7	K559 C627 M628 N629 R633	K559-E631 IonicContact NZ-OE1 2.8Å; K559-E631 PolarHBondContact NZ-OE1 2.87Å; C627-E631 WeakPolarHBondContact CA-O 3.49Å; M628-E631 PolarHBondContact N-O 2.83Å; M628-E631 PolarHBondContact O-N 2.04Å; M628-E631 VanDerWaalsContact O-N 3.11Å; N629-E631 PolarHBondContact O-N 3.43Å; E631-R633 HydrophobicContact CB-CG 3.93Å; E631-R633 PolarHBondContact O-N 3.47Å
632	C	95.8	Very high	91.2	Very high	18 Å²	18	55 Å²	55	12%	0.122	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	90.4	178.2	-174.6	0	0	0	0	110.1	R564 N565 C621	R564-C632 WeakPolarHBondContact O-CB 3.4Å; N565-C632 PolarHBondContact OD1-N 3.46Å; C621-C632 HydrophobicContact CB-CB 3.9Å; C621-C632 WeakPolarHBondContact CB-SG 3.47Å; C621-C632 PolarHBondContact O-SG 3.32Å; C621-C632 WeakPolarHBondContact SG-CA 3.35Å; C621-C632 WeakPolarHBondContact SG-CB 3.42Å; C621-C632 CovalentContact SG-SG 2.04Å; C621-C632 PolarHBondContact SG-SG 3.47Å
633	R	94.4	Very high	91.1	Very high	117 Å²	117	57.5 Å²	57.5	44%	0.442	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	164.4	-171.3	-57.8	-176.6	70.6	-162.2	-0.3	110.8	K625 V626 E631	K625-R633 CarbonylContact C-O 3.56Å; K625-R633 WeakPolarHBondContact CA-O 3.01Å; K625-R633 VanDerWaalsContact CB-O 3.28Å; K625-R633 WeakPolarHBondContact CB-O 3.33Å; V626-R633 PolarHBondContact N-O 3.31Å; V626-R633 PolarHBondContact O-N 2.77Å; E631-R633 HydrophobicContact CB-CG 3.93Å; E631-R633 PolarHBondContact O-N 3.47Å
634	S	95.4	Very high	91.1	Very high	50 Å²	50	52.3 Å²	52.3	35%	0.35	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	141.9	177	-159.8	0	0	0	0	111	N624 D636 V637	N624-S634 PolarHBondContact ND2-OG 2.87Å; N624-S634 WeakPolarHBondContact O-CA 3.28Å; S634-D636 WeakPolarHBondContact CB-OD2 3.38Å; S634-D636 PolarHBondContact O-N 3.13Å; S634-D636 VanDerWaalsContact O-N 3.1Å; S634-D636 PolarHBondContact OG-OD1 3.19Å; S634-D636 PolarHBondContact OG-OD2 2.79Å; S634-V637 VanDerWaalsContact O-CG1 3.29Å; S634-V637 WeakPolarHBondContact O-CG1 2.97Å; S634-V637 PolarHBondContact O-N 2.87Å; S634-V637 VanDerWaalsContact O-N 3.14Å
635	A	93.1	Very high	91.2	Very high	9 Å²	9	54.9 Å²	54.9	7%	0.074	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.6	-23.7	-179.7	0	0	0	0	0	112.8	Y509 N624 V626 V637 L638	Y509-A635 HydrophobicContact CE1-CB 4.48Å; Y509-A635 HydrophobicContact CE2-CB 4.41Å; N624-A635 PolarHBondContact O-N 3.04Å; V626-A635 HydrophobicContact CG1-CB 4.35Å; A635-V637 PolarHBondContact O-N 2.77Å; A635-L638 VanDerWaalsContact O-CB 3.3Å; A635-L638 WeakPolarHBondContact O-CB 3.36Å; A635-L638 WeakPolarHBondContact O-CG 3.44Å; A635-L638 PolarHBondContact O-N 3.47Å
636	D	91	Very high	91.1	Very high	108 Å²	108	55 Å²	55	58%	0.578	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-51.5	-25.6	174.6	-32.1	-39.8	0	0	0	113.2	N624 S634 L638 S639	N624-D636 PolarHBondContact ND2-OD1 3.39Å; S634-D636 WeakPolarHBondContact CB-OD2 3.38Å; S634-D636 PolarHBondContact O-N 3.13Å; S634-D636 VanDerWaalsContact O-N 3.1Å; S634-D636 PolarHBondContact OG-OD1 3.19Å; S634-D636 PolarHBondContact OG-OD2 2.79Å; D636-L638 PolarHBondContact O-N 3.36Å; D636-L638 VanDerWaalsContact O-N 3.15Å; D636-S639 PolarHBondContact O-N 3.32Å
637	V	88.8	Confident	90.9	Very high	54 Å²	54	58.2 Å²	58.2	33%	0.327	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-57.3	-26.5	174.3	75.3	0	0	0	0	112.8	V626 M628 S634 A635 S639	V626-V637 HydrophobicContact CG2-CG1 3.84Å; M628-V637 HydrophobicContact CB-CG1 4.37Å; M628-V637 HydrophobicContact CE-CG1 4.16Å; M628-V637 HydrophobicContact CG-CG1 4.4Å; M628-V637 HydrophobicContact CG-CG2 4.34Å; S634-V637 VanDerWaalsContact O-CG1 3.29Å; S634-V637 WeakPolarHBondContact O-CG1 2.97Å; S634-V637 PolarHBondContact O-N 2.87Å; S634-V637 VanDerWaalsContact O-N 3.14Å; A635-V637 PolarHBondContact O-N 2.77Å; V637-S639 PolarHBondContact O-N 3.26Å
638	L	85.9	Confident	91	Very high	19 Å²	19	58.1 Å²	58.1	10%	0.099	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-72.7	-9.4	176.9	-59.3	-178.1	0	0	0	113.5	G500 Y511 V626 M628 A635 D636 Y640	G500-L638 VanDerWaalsContact CA-CD1 3.46Å; Y511-L638 HydrophobicContact CD2-CD2 3.57Å; Y511-L638 HydrophobicContact CE2-CD2 3.6Å; V626-L638 HydrophobicContact CG1-CD1 4.1Å; V626-L638 HydrophobicContact CG2-CD1 4.19Å; V626-L638 HydrophobicContact CG2-CD2 4.36Å; V626-L638 HydrophobicContact CG2-CG 4.13Å; M628-L638 HydrophobicContact CE-CD2 3.42Å; M628-L638 VanDerWaalsContact CE-CD2 3.42Å; A635-L638 VanDerWaalsContact O-CB 3.3Å; A635-L638 WeakPolarHBondContact O-CB 3.36Å; A635-L638 WeakPolarHBondContact O-CG 3.44Å; A635-L638 PolarHBondContact O-N 3.47Å; D636-L638 PolarHBondContact O-N 3.36Å; D636-L638 VanDerWaalsContact O-N 3.15Å; L638-Y640 PolarHBondContact O-N 3.43Å
639	S	87.3	Confident	91.3	Very high	73 Å²	73	60.4 Å²	60.4	51%	0.51	31%	0.313	S	S	.	.			trans	56.3	37.2	178	-52.7	0	0	0	0	113.6	D636 V637 D641	D636-S639 PolarHBondContact O-N 3.32Å; V637-S639 PolarHBondContact O-N 3.26Å; S639-D641 PolarHBondContact O-N 2.83Å
640	Y	91.3	Very high	91.9	Very high	71 Å²	71	59.4 Å²	59.4	28%	0.278	31%	0.314	S	S	.	.			trans	-72.2	109.3	176.4	-174.2	-97.1	0	0	0	110.2	Q498 N499 H501 L638 C642	Q498-Y640 HydrophobicContact CB-CD2 4.29Å; Q498-Y640 HydrophobicContact CB-CE2 4.19Å; Q498-Y640 HydrophobicContact CG-CD2 4.04Å; Q498-Y640 HydrophobicContact CG-CE2 4.39Å; N499-Y640 WeakPolarHBondContact O-CD2 3.3Å; H501-Y640 HydrophobicContact CB-CE2 3.78Å; H501-Y640 PolarHBondContact CD2-OH 2.95Å; L638-Y640 PolarHBondContact O-N 3.43Å; Y640-C642 HydrophobicContact CE1-CB 4.22Å; Y640-C642 WeakPolarHBondContact CE1-O 3.49Å; Y640-C642 HydrophobicContact CE2-CB 3.99Å; Y640-C642 PolarHBondContact OH-O 3.4Å; Y640-C642 VanDerWaalsContact OH-O 3.1Å
641	D	89.6	Confident	92.2	Very high	83 Å²	83	58.4 Å²	58.4	44%	0.444	31%	0.311	S	S	.	.			trans	-114.8	14.2	-175.7	70.1	-23.9	0	0	0	113	Q498 S639 R658	Q498-D641 PolarHBondContact NE2-OD1 3.14Å; S639-D641 PolarHBondContact O-N 2.83Å; D641-R658 IonicContact OD1-NH1 3.67Å; D641-R658 PolarHBondContact OD1-NH1 2.98Å; D641-R658 IonicContact OD2-CZ 2.94Å; D641-R658 IonicContact OD2-NH1 3.96Å; D641-R658 PolarHBondContact OD2-NH1 3.1Å
642	C	90.3	Very high	92.3	Very high	6 Å²	6	55.5 Å²	55.5	4%	0.041	30%	0.298	C	S	.	.			trans	-96.8	95	-177.1	-173	0	0	0	0	112.3	Y640 V644 C654	Y640-C642 HydrophobicContact CE1-CB 4.22Å; Y640-C642 WeakPolarHBondContact CE1-O 3.49Å; Y640-C642 HydrophobicContact CE2-CB 3.99Å; Y640-C642 PolarHBondContact OH-O 3.4Å; Y640-C642 VanDerWaalsContact OH-O 3.1Å; C642-V644 PolarHBondContact O-N 3.17Å; C642-C654 HydrophobicContact CB-CB 3.52Å; C642-C654 WeakPolarHBondContact CB-SG 3.42Å; C642-C654 WeakPolarHBondContact SG-CB 3.17Å; C642-C654 CovalentContact SG-SG 2.02Å; C642-C654 PolarHBondContact SG-SG 2.83Å
643	D	91.4	Very high	92.3	Very high	80 Å²	80	56.3 Å²	56.3	43%	0.428	30%	0.302	S	S	.	.			trans	-73.7	104	157	174.1	10	0	0	0	109.1	E645 T646 K647	D643-E645 VanDerWaalsContact C-N 3.29Å; D643-E645 PolarHBondContact O-N 3.39Å; D643-E645 PolarHBondContact OD1-N 3.47Å; D643-T646 PolarHBondContact OD1-N 3.36Å; D643-T646 WeakPolarHBondContact OD2-CB 3.11Å; D643-T646 WeakPolarHBondContact OD2-CG2 2.99Å; D643-T646 PolarHBondContact OD2-OG1 3.1Å; D643-K647 WeakPolarHBondContact O-CB 3.12Å; D643-K647 PolarHBondContact O-N 2.8Å
644	V	92.1	Very high	92.3	Very high	30 Å²	30	50.8 Å²	50.8	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-33.5	-177.9	168.1	0	0	0	0	112.2	C642 C648 H649 G650 G652	C642-V644 PolarHBondContact O-N 3.17Å; V644-C648 HydrophobicContact CG1-CB 4.48Å; V644-C648 CarbonylContact O-C 3.45Å; V644-C648 WeakPolarHBondContact O-CA 3.4Å; V644-C648 PolarHBondContact O-N 3.27Å; V644-H649 PolarHBondContact O-N 2.02Å; V644-H649 VanDerWaalsContact O-N 3.1Å; V644-G650 PolarHBondContact O-N 2.92Å; V644-G652 WeakPolarHBondContact CG1-O 3.17Å
645	E	93.1	Very high	92.1	Very high	136 Å²	136	48.4 Å²	48.4	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-70.4	-40.8	-177.2	-64.9	-59.6	146	0	0	111.6	D643 H649	D643-E645 VanDerWaalsContact C-N 3.29Å; D643-E645 PolarHBondContact O-N 3.39Å; D643-E645 PolarHBondContact OD1-N 3.47Å; E645-H649 WeakPolarHBondContact O-CA 3.49Å; E645-H649 PolarHBondContact O-N 2.79Å
646	T	91.7	Very high	91.7	Very high	99 Å²	99	49.8 Å²	49.8	61%	0.607	27%	0.274	S	S	*	.	H	α-helix	trans	-90.1	-34.6	179.3	61.2	0	0	0	0	113.9	D643	D643-T646 PolarHBondContact OD1-N 3.36Å; D643-T646 WeakPolarHBondContact OD2-CB 3.11Å; D643-T646 WeakPolarHBondContact OD2-CG2 2.99Å; D643-T646 PolarHBondContact OD2-OG1 3.1Å
647	K	92.6	Very high	91.3	Very high	68 Å²	68	47.6 Å²	47.6	30%	0.296	26%	0.262	S	S	.	.	H	α-helix	trans	-85.6	-43.6	-175.6	-169.3	174	169.8	-172.1	0	112.7	D643 C654 R658 C660	D643-K647 WeakPolarHBondContact O-CB 3.12Å; D643-K647 PolarHBondContact O-N 2.8Å; K647-C654 PolarHBondContact NZ-SG 2.94Å; K647-C654 VanDerWaalsContact NZ-SG 3.39Å; K647-R658 WeakPolarHBondContact CE-O 3.21Å; K647-R658 PolarHBondContact NZ-O 3.41Å; K647-C660 PolarHBondContact O-SG 3.22Å
648	C	95.1	Very high	91.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-113.4	17.6	-178.3	-51.7	0	0	0	0	112.6	V644 G650 H651 C660 S670 C671	V644-C648 HydrophobicContact CG1-CB 4.48Å; V644-C648 CarbonylContact O-C 3.45Å; V644-C648 WeakPolarHBondContact O-CA 3.4Å; V644-C648 PolarHBondContact O-N 3.27Å; C648-G650 PolarHBondContact O-N 3Å; C648-H651 PolarHBondContact O-N 3.43Å; C648-C660 WeakPolarHBondContact CA-SG 3.34Å; C648-C660 HydrophobicContact CB-CB 3.89Å; C648-C660 WeakPolarHBondContact CB-SG 3.41Å; C648-C660 WeakPolarHBondContact SG-CB 3.37Å; C648-C660 CovalentContact SG-SG 2.04Å; C648-C660 PolarHBondContact SG-SG 2.86Å; C648-S670 CarbonylContact C-O 3.5Å; C648-C671 WeakPolarHBondContact O-CB 3.17Å
649	H	94.9	Very high	91.7	Very high	57 Å²	57	52.6 Å²	52.6	26%	0.264	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	25.5	174.7	-63.6	73.9	0	0	0	115	V644 E645 H651 S670 K672	V644-H649 PolarHBondContact O-N 2.02Å; V644-H649 VanDerWaalsContact O-N 3.1Å; E645-H649 WeakPolarHBondContact O-CA 3.49Å; E645-H649 PolarHBondContact O-N 2.79Å; H649-H651 VanDerWaalsContact C-N 3.25Å; H649-H651 PolarHBondContact O-CD2 2.71Å; H649-H651 VanDerWaalsContact O-CD2 3.24Å; H649-H651 PolarHBondContact O-CE1 3.44Å; H649-H651 VanDerWaalsContact O-CG 3.28Å; H649-H651 PolarHBondContact O-N 3.11Å; H649-H651 PolarHBondContact O-ND1 3.2Å; H649-H651 PolarHBondContact O-NE2 3.13Å; H649-S670 PolarHBondContact ND1-O 3.42Å; H649-K672 WeakPolarHBondContact NE2-CD 3.38Å; H649-K672 PolarHBondContact NE2-NZ 3.48Å
650	G	94.4	Very high	92	Very high	27 Å²	27	49.3 Å²	49.3	28%	0.278	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	19.1	-175.7	0	0	0	0	0	114.1	V644 C648	V644-G650 PolarHBondContact O-N 2.92Å; C648-G650 PolarHBondContact O-N 3Å
651	H	95.4	Very high	92.2	Very high	57 Å²	57	46.7 Å²	46.7	26%	0.264	25%	0.246	S	C	.	.	S	Bend	trans	-133.1	33.1	-165.4	-63.7	-18	0	0	0	113	C648 H649 C662 D663 W666 C671	C648-H651 PolarHBondContact O-N 3.43Å; H649-H651 VanDerWaalsContact C-N 3.25Å; H649-H651 PolarHBondContact O-CD2 2.71Å; H649-H651 VanDerWaalsContact O-CD2 3.24Å; H649-H651 PolarHBondContact O-CE1 3.44Å; H649-H651 VanDerWaalsContact O-CG 3.28Å; H649-H651 PolarHBondContact O-N 3.11Å; H649-H651 PolarHBondContact O-ND1 3.2Å; H649-H651 PolarHBondContact O-NE2 3.13Å; H651-C662 WeakPolarHBondContact O-CA 3.06Å; H651-D663 PolarHBondContact O-N 2.77Å; H651-W666 HydrophobicContact CB-CB 4.25Å; H651-W666 HydrophobicContact CB-CD2 3.93Å; H651-W666 HydrophobicContact CB-CG 3.67Å; H651-W666 AromaticContact CD2-CD2 3.42Å; H651-W666 VanDerWaalsContact CD2-CD2 3.42Å; H651-W666 AromaticContact CD2-CE2 3.22Å; H651-W666 AromaticContact CD2-CE3 3.64Å; H651-W666 AromaticContact CD2-CH2 3.5Å; H651-W666 AromaticContact CD2-CZ2 3.29Å; H651-W666 WeakPolarHBondContact CD2-CZ2 3.41Å; H651-W666 AromaticContact CD2-CZ3 3.67Å; H651-W666 AromaticContact CD2-NE1 3.77Å; H651-W666 AromaticContact CE1-CZ2 3.81Å; H651-W666 AromaticContact CG-CD1 3.87Å; H651-W666 AromaticContact CG-CD2 3.76Å; H651-W666 AromaticContact CG-CE2 3.5Å; H651-W666 VanDerWaalsContact CG-CE2 3.5Å; H651-W666 AromaticContact CG-CZ2 3.94Å; H651-W666 AromaticContact CG-NE1 3.53Å; H651-W666 AromaticContact ND1-CE2 4Å; H651-W666 AromaticContact ND1-NE1 3.86Å; H651-W666 AromaticContact NE2-CE2 3.62Å; H651-W666 AromaticContact NE2-CH2 3.41Å; H651-W666 WeakPolarHBondContact NE2-CH2 3.35Å; H651-W666 AromaticContact NE2-CZ2 3.19Å; H651-W666 WeakPolarHBondContact NE2-CZ2 3.25Å; H651-C671 HydrophobicContact CB-CB 3.79Å; H651-C671 WeakPolarHBondContact O-CB 3.45Å; H651-C671 PolarHBondContact O-SG 3.49Å
652	G	94.1	Very high	92.4	Very high	4 Å²	4	42.9 Å²	42.9	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165	-167.6	178.2	0	0	0	0	0	112.1	V644 H661 D663	V644-G652 WeakPolarHBondContact CG1-O 3.17Å; G652-H661 CarbonylContact C-O 3.56Å; G652-H661 WeakPolarHBondContact CA-O 3.13Å; G652-D663 WeakPolarHBondContact CA-OD2 3.41Å; G652-D663 PolarHBondContact N-OD2 2.93Å
653	V	95.5	Very high	92.6	Very high	35 Å²	35	47 Å²	47	21%	0.212	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.8	179.2	-61.1	0	0	0	0	111.3	L480 V497 H501 C660 H661	L480-V653 HydrophobicContact CD2-CG2 4.13Å; V497-V653 HydrophobicContact CG1-CB 4.39Å; V497-V653 HydrophobicContact CG1-CG2 4.38Å; V497-V653 HydrophobicContact CG2-CG2 4.01Å; H501-V653 WeakPolarHBondContact NE2-CG1 3.29Å; V653-C660 CarbonylContact O-C 3.55Å; V653-C660 WeakPolarHBondContact O-CA 3.11Å; V653-H661 HydrophobicContact CG2-CB 4.45Å; V653-H661 PolarHBondContact N-O 2.98Å; V653-H661 PolarHBondContact O-N 3.17Å
654	C	95.3	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	139	169	-72.9	0	0	0	0	112	Q498 C642 K647 N659	Q498-C654 HydrophobicContact CB-CB 4.07Å; Q498-C654 PolarHBondContact N-O 3.32Å; Q498-C654 VanDerWaalsContact OE1-CB 3.24Å; C642-C654 HydrophobicContact CB-CB 3.52Å; C642-C654 WeakPolarHBondContact CB-SG 3.42Å; C642-C654 WeakPolarHBondContact SG-CB 3.17Å; C642-C654 CovalentContact SG-SG 2.02Å; C642-C654 PolarHBondContact SG-SG 2.83Å; K647-C654 PolarHBondContact NZ-SG 2.94Å; K647-C654 VanDerWaalsContact NZ-SG 3.39Å; C654-N659 CarbonylContact C-O 3.2Å; C654-N659 WeakPolarHBondContact CA-O 3.42Å
655	N	90.4	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-90	176.8	171.6	72.8	17	0	0	0	112.5	L480 V495 F496 N657 R658 N659 S679 D681	L480-N655 HydrophobicContact CD1-CB 3.63Å; V495-N655 HydrophobicContact CB-CB 4.5Å; F496-N655 CarbonylContact O-C 3.44Å; F496-N655 VanDerWaalsContact O-C 3.31Å; F496-N655 WeakPolarHBondContact O-CA 3.36Å; N655-N657 PolarHBondContact O-N 2.78Å; N655-N657 WeakPolarHBondContact OD1-CA 3.4Å; N655-N657 PolarHBondContact OD1-N 2.04Å; N655-R658 WeakPolarHBondContact O-CA 3.41Å; N655-R658 PolarHBondContact O-N 3.18Å; N655-R658 PolarHBondContact OD1-N 3.05Å; N655-N659 VanDerWaalsContact CG-O 3.32Å; N655-N659 PolarHBondContact N-O 2.92Å; N655-N659 PolarHBondContact OD1-N 3.03Å; N655-N659 PolarHBondContact OD1-O 2.6Å; N655-S679 PolarHBondContact ND2-OG 2.69Å; N655-D681 PolarHBondContact ND2-OD2 2.82Å
656	S	85.6	Confident	92.5	Very high	39 Å²	39	47.9 Å²	47.9	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.4	180	52.8	0	0	0	0	114.6	F496 R658	F496-S656 PolarHBondContact O-N 3.26Å; S656-R658 VanDerWaalsContact C-N 3.26Å
657	N	82.5	Confident	92.5	Very high	61 Å²	61	44.4 Å²	44.4	33%	0.326	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	5.9	170.5	-67.3	-22.5	0	0	0	112.8	K287 N655 N659 D681	K287-N657 PolarHBondContact NZ-OD1 3.16Å; K287-N657 VanDerWaalsContact NZ-OD1 3.15Å; N655-N657 PolarHBondContact O-N 2.78Å; N655-N657 WeakPolarHBondContact OD1-CA 3.4Å; N655-N657 PolarHBondContact OD1-N 2.04Å; N657-N659 VanDerWaalsContact C-N 3.28Å; N657-N659 PolarHBondContact O-N 3.47Å; N657-D681 PolarHBondContact ND2-OD1 3.48Å
658	R	89.8	Confident	92.4	Very high	117 Å²	117	42.9 Å²	42.9	44%	0.442	22%	0.219	S	C	.	.	S	Bend	trans	65.5	15.7	-176.5	-50.6	-171.4	-171.2	-152	-2	115.6	D641 K647 N655 S656	D641-R658 IonicContact OD1-NH1 3.67Å; D641-R658 PolarHBondContact OD1-NH1 2.98Å; D641-R658 IonicContact OD2-CZ 2.94Å; D641-R658 IonicContact OD2-NH1 3.96Å; D641-R658 PolarHBondContact OD2-NH1 3.1Å; K647-R658 WeakPolarHBondContact CE-O 3.21Å; K647-R658 PolarHBondContact NZ-O 3.41Å; N655-R658 WeakPolarHBondContact O-CA 3.41Å; N655-R658 PolarHBondContact O-N 3.18Å; N655-R658 PolarHBondContact OD1-N 3.05Å; S656-R658 VanDerWaalsContact C-N 3.26Å
659	N	92.6	Very high	92.3	Very high	61 Å²	61	47.1 Å²	47.1	33%	0.326	25%	0.247	S	C	.	.			trans	-90.1	158.4	171.8	-64.5	-43.4	0	0	0	111	C654 N655 N657 V680 D681	C654-N659 CarbonylContact C-O 3.2Å; C654-N659 WeakPolarHBondContact CA-O 3.42Å; N655-N659 VanDerWaalsContact CG-O 3.32Å; N655-N659 PolarHBondContact N-O 2.92Å; N655-N659 PolarHBondContact OD1-N 3.03Å; N655-N659 PolarHBondContact OD1-O 2.6Å; N657-N659 VanDerWaalsContact C-N 3.28Å; N657-N659 PolarHBondContact O-N 3.47Å; N659-V680 HydrophobicContact CB-CG2 3.92Å; N659-V680 WeakPolarHBondContact ND2-CG2 3.49Å; N659-D681 VanDerWaalsContact CB-OD2 3.3Å; N659-D681 WeakPolarHBondContact CB-OD2 3.36Å; N659-D681 PolarHBondContact ND2-OD1 2.84Å; N659-D681 PolarHBondContact ND2-OD2 3.44Å
660	C	95.2	Very high	92.2	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.027	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	137.8	173.8	-58.6	0	0	0	0	111.6	K647 C648 V653 P669 C671 S679	K647-C660 PolarHBondContact O-SG 3.22Å; C648-C660 WeakPolarHBondContact CA-SG 3.34Å; C648-C660 HydrophobicContact CB-CB 3.89Å; C648-C660 WeakPolarHBondContact CB-SG 3.41Å; C648-C660 WeakPolarHBondContact SG-CB 3.37Å; C648-C660 CovalentContact SG-SG 2.04Å; C648-C660 PolarHBondContact SG-SG 2.86Å; V653-C660 CarbonylContact O-C 3.55Å; V653-C660 WeakPolarHBondContact O-CA 3.11Å; C660-P669 WeakPolarHBondContact CB-O 3.33Å; C660-C671 VanDerWaalsContact CB-SG 3.6Å; C660-S679 WeakPolarHBondContact O-CB 3.02Å; C660-S679 PolarHBondContact O-OG 3.24Å
661	H	94.6	Very high	92.2	Very high	17 Å²	17	45.1 Å²	45.1	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.4	161.1	-171.7	112.6	0	0	0	106.9	L480 G652 V653 S682	L480-H661 HydrophobicContact CD1-CB 3.97Å; L480-H661 HydrophobicContact CD2-CB 4.25Å; G652-H661 CarbonylContact C-O 3.56Å; G652-H661 WeakPolarHBondContact CA-O 3.13Å; V653-H661 HydrophobicContact CG2-CB 4.45Å; V653-H661 PolarHBondContact N-O 2.98Å; V653-H661 PolarHBondContact O-N 3.17Å; H661-S682 PolarHBondContact ND1-OG 2.59Å
662	C	94.9	Very high	92.2	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	150.7	-168.4	-56	0	0	0	0	113.1	H651 W666 S667 C671 G677 G678	H651-C662 WeakPolarHBondContact O-CA 3.06Å; C662-W666 HydrophobicContact CB-CB 4.22Å; C662-S667 VanDerWaalsContact SG-C 3.51Å; C662-C671 WeakPolarHBondContact CA-SG 3.08Å; C662-C671 HydrophobicContact CB-CB 3.75Å; C662-C671 WeakPolarHBondContact CB-SG 3.42Å; C662-C671 WeakPolarHBondContact SG-CA 3.05Å; C662-C671 WeakPolarHBondContact SG-CB 3.12Å; C662-C671 PolarHBondContact SG-N 3.04Å; C662-C671 VanDerWaalsContact SG-N 3.42Å; C662-C671 CovalentContact SG-SG 2.04Å; C662-C671 PolarHBondContact SG-SG 3.3Å; C662-G677 CarbonylContact O-C 3.39Å; C662-G677 WeakPolarHBondContact O-CA 3.42Å; C662-G678 PolarHBondContact N-O 3.45Å; C662-G678 PolarHBondContact O-N 3.43Å
663	D	93.7	Very high	92.1	Very high	91 Å²	91	54.2 Å²	54.2	49%	0.487	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-70.9	156.3	172.9	-65.3	-53.3	0	0	0	112.1	H651 G652 G665 W666 G677	H651-D663 PolarHBondContact O-N 2.77Å; G652-D663 WeakPolarHBondContact CA-OD2 3.41Å; G652-D663 PolarHBondContact N-OD2 2.93Å; D663-G665 PolarHBondContact O-N 3.01Å; D663-W666 PolarHBondContact O-N 2.79Å; D663-G677 VanDerWaalsContact O-CA 3.25Å; D663-G677 WeakPolarHBondContact O-CA 3.35Å
664	Y	90.8	Very high	91.8	Very high	164 Å²	164	56 Å²	56	64%	0.643	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	128.7	173.8	179.1	-89	0	0	0	110.4	Y676	Y664-Y676 WeakPolarHBondContact CD2-O 3.25Å; Y664-Y676 HydrophobicContact CE2-CD1 4.11Å
665	G	90.6	Very high	91.5	Very high	19 Å²	19	56.3 Å²	56.3	20%	0.196	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	109.6	-15.8	-169.3	0	0	0	0	0	113.4	D663 S674 G675	D663-G665 PolarHBondContact O-N 3.01Å; G665-S674 CarbonylContact O-C 3.53Å; G665-S674 WeakPolarHBondContact O-CA 3.44Å; G665-S674 WeakPolarHBondContact O-CB 3.32Å; G665-S674 PolarHBondContact O-OG 3.48Å; G665-G675 CarbonylContact C-O 3.09Å; G665-G675 WeakPolarHBondContact CA-O 3.2Å; G665-G675 PolarHBondContact N-O 2.95Å; G665-G675 PolarHBondContact O-N 2.97Å
666	W	93.8	Very high	91.4	Very high	82 Å²	82	57.8 Å²	57.8	31%	0.311	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	172.9	-177	-58.6	100.6	0	0	0	112.7	H651 C662 D663 C671 L673 G675 Y676 G677	H651-W666 HydrophobicContact CB-CB 4.25Å; H651-W666 HydrophobicContact CB-CD2 3.93Å; H651-W666 HydrophobicContact CB-CG 3.67Å; H651-W666 AromaticContact CD2-CD2 3.42Å; H651-W666 VanDerWaalsContact CD2-CD2 3.42Å; H651-W666 AromaticContact CD2-CE2 3.22Å; H651-W666 AromaticContact CD2-CE3 3.64Å; H651-W666 AromaticContact CD2-CH2 3.5Å; H651-W666 AromaticContact CD2-CZ2 3.29Å; H651-W666 WeakPolarHBondContact CD2-CZ2 3.41Å; H651-W666 AromaticContact CD2-CZ3 3.67Å; H651-W666 AromaticContact CD2-NE1 3.77Å; H651-W666 AromaticContact CE1-CZ2 3.81Å; H651-W666 AromaticContact CG-CD1 3.87Å; H651-W666 AromaticContact CG-CD2 3.76Å; H651-W666 AromaticContact CG-CE2 3.5Å; H651-W666 VanDerWaalsContact CG-CE2 3.5Å; H651-W666 AromaticContact CG-CZ2 3.94Å; H651-W666 AromaticContact CG-NE1 3.53Å; H651-W666 AromaticContact ND1-CE2 4Å; H651-W666 AromaticContact ND1-NE1 3.86Å; H651-W666 AromaticContact NE2-CE2 3.62Å; H651-W666 AromaticContact NE2-CH2 3.41Å; H651-W666 WeakPolarHBondContact NE2-CH2 3.35Å; H651-W666 AromaticContact NE2-CZ2 3.19Å; H651-W666 WeakPolarHBondContact NE2-CZ2 3.25Å; C662-W666 HydrophobicContact CB-CB 4.22Å; D663-W666 PolarHBondContact O-N 2.79Å; W666-C671 HydrophobicContact CB-CB 4.17Å; W666-L673 CarbonylContact C-O 3.17Å; W666-L673 WeakPolarHBondContact CA-O 3.43Å; W666-G675 PolarHBondContact N-O 2.83Å; W666-G675 CarbonylContact O-C 3.12Å; W666-G675 VanDerWaalsContact O-CA 3.29Å; W666-G675 WeakPolarHBondContact O-CA 3.36Å; W666-Y676 PolarHBondContact O-N 3.05Å; W666-Y676 VanDerWaalsContact O-N 3.09Å; W666-G677 WeakPolarHBondContact O-CA 3.05Å; W666-G677 PolarHBondContact O-N 3.39Å
667	S	90.7	Very high	91.6	Very high	27 Å²	27	56.1 Å²	56.1	19%	0.189	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	137.6	-175.5	53.9	0	0	0	0	114.2	C662 C671 L673	C662-S667 VanDerWaalsContact SG-C 3.51Å; S667-C671 WeakPolarHBondContact O-CA 3.36Å; S667-C671 PolarHBondContact O-N 2.04Å; S667-L673 PolarHBondContact N-O 3.42Å; S667-L673 WeakPolarHBondContact OG-CB 3.42Å; S667-L673 PolarHBondContact OG-O 2.93Å
668	P	91.6	Very high	92	Very high	35 Å²	35	53.2 Å²	53.2	23%	0.227	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	156.7	170.8	26.9	-33.5	0	0	0	111.2	V680	P668-V680 HydrophobicContact CB-CG1 4.07Å
669	P	92.1	Very high	92	Very high	90 Å²	90	47.9 Å²	47.9	58%	0.584	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.3	-9.4	15.6	34.8	-37.3	0	0	0	116	C660 V680	C660-P669 WeakPolarHBondContact CB-O 3.33Å; P669-V680 HydrophobicContact CB-CG1 4.07Å
670	S	92.5	Very high	91.8	Very high	42 Å²	42	49.1 Å²	49.1	29%	0.294	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	6.2	-170.7	61.6	0	0	0	0	115.2	C648 H649 K672	C648-S670 CarbonylContact C-O 3.5Å; H649-S670 PolarHBondContact ND1-O 3.42Å; S670-K672 PolarHBondContact O-N 3.41Å
671	C	94.7	Very high	91.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	59.9	12.5	178.2	-37.6	0	0	0	0	115.5	C648 H651 C660 C662 W666 S667	C648-C671 WeakPolarHBondContact O-CB 3.17Å; H651-C671 HydrophobicContact CB-CB 3.79Å; H651-C671 WeakPolarHBondContact O-CB 3.45Å; H651-C671 PolarHBondContact O-SG 3.49Å; C660-C671 VanDerWaalsContact CB-SG 3.6Å; C662-C671 WeakPolarHBondContact CA-SG 3.08Å; C662-C671 HydrophobicContact CB-CB 3.75Å; C662-C671 WeakPolarHBondContact CB-SG 3.42Å; C662-C671 WeakPolarHBondContact SG-CA 3.05Å; C662-C671 WeakPolarHBondContact SG-CB 3.12Å; C662-C671 PolarHBondContact SG-N 3.04Å; C662-C671 VanDerWaalsContact SG-N 3.42Å; C662-C671 CovalentContact SG-SG 2.04Å; C662-C671 PolarHBondContact SG-SG 3.3Å; W666-C671 HydrophobicContact CB-CB 4.17Å; S667-C671 WeakPolarHBondContact O-CA 3.36Å; S667-C671 PolarHBondContact O-N 2.04Å
672	K	94.6	Very high	90.4	Very high	128 Å²	128	49.8 Å²	49.8	56%	0.557	27%	0.269	S	S	*	.			trans	-73.6	-29.5	-179.4	-170.9	174.7	-164	134	0	114.6	H649 S670	H649-K672 WeakPolarHBondContact NE2-CD 3.38Å; H649-K672 PolarHBondContact NE2-NZ 3.48Å; S670-K672 PolarHBondContact O-N 3.41Å
673	L	92.1	Very high	89.6	Confident	123 Å²	123	50.1 Å²	50.1	64%	0.644	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	146.2	-174.8	-60.6	177.5	0	0	0	109.4	W666 S667	W666-L673 CarbonylContact C-O 3.17Å; W666-L673 WeakPolarHBondContact CA-O 3.43Å; S667-L673 PolarHBondContact N-O 3.42Å; S667-L673 WeakPolarHBondContact OG-CB 3.42Å; S667-L673 PolarHBondContact OG-O 2.93Å
674	S	89.7	Confident	89.1	Confident	73 Å²	73	47.2 Å²	47.2	51%	0.51	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	147.5	179.8	-171.6	0	0	0	0	112.1	G665	G665-S674 CarbonylContact O-C 3.53Å; G665-S674 WeakPolarHBondContact O-CA 3.44Å; G665-S674 WeakPolarHBondContact O-CB 3.32Å; G665-S674 PolarHBondContact O-OG 3.48Å
675	G	88.9	Confident	88.7	Confident	7 Å²	7	40.7 Å²	40.7	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-151.8	-174.9	0	0	0	0	0	113	G665 W666	G665-G675 CarbonylContact C-O 3.09Å; G665-G675 WeakPolarHBondContact CA-O 3.2Å; G665-G675 PolarHBondContact N-O 2.95Å; G665-G675 PolarHBondContact O-N 2.97Å; W666-G675 PolarHBondContact N-O 2.83Å; W666-G675 CarbonylContact O-C 3.12Å; W666-G675 VanDerWaalsContact O-CA 3.29Å; W666-G675 WeakPolarHBondContact O-CA 3.36Å
676	Y	87.5	Confident	88.2	Confident	31 Å²	31	42.8 Å²	42.8	12%	0.122	24%	0.238	C	C	.	.	S	Bend	trans	-110.9	1.2	-170.9	-65.3	-86.9	0	0	0	114.2	Y664 W666 T685 W686 R801 P802	Y664-Y676 WeakPolarHBondContact CD2-O 3.25Å; Y664-Y676 HydrophobicContact CE2-CD1 4.11Å; W666-Y676 PolarHBondContact O-N 3.05Å; W666-Y676 VanDerWaalsContact O-N 3.09Å; Y676-T685 WeakPolarHBondContact CB-OG1 3.29Å; Y676-T685 WeakPolarHBondContact O-CB 3.13Å; Y676-T685 PolarHBondContact O-OG1 3.22Å; Y676-W686 HydrophobicContact CD1-CB 3.98Å; Y676-W686 HydrophobicContact CD2-CB 3.97Å; Y676-W686 AromaticContact CD2-CD2 3.86Å; Y676-W686 HydrophobicContact CD2-CD2 3.86Å; Y676-W686 HydrophobicContact CD2-CE3 4.14Å; Y676-W686 AromaticContact CD2-CG 3.77Å; Y676-W686 HydrophobicContact CD2-CG 3.77Å; Y676-W686 HydrophobicContact CE2-CG 4.36Å; Y676-W686 HydrophobicContact CG-CB 3.66Å; Y676-W686 HydrophobicContact CG-CD2 4.22Å; Y676-W686 HydrophobicContact CG-CE3 4.29Å; Y676-W686 AromaticContact CG-CG 3.97Å; Y676-W686 HydrophobicContact CG-CG 3.97Å; Y676-R801 HydrophobicContact CE1-CG 4.42Å; Y676-P802 PolarHBondContact OH-O 3.04Å
677	G	90.7	Very high	87.3	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.031	24%	0.237	C	C	.	.			trans	90.6	-170.7	-176.6	0	0	0	0	0	113.9	C662 D663 W666 T685	C662-G677 CarbonylContact O-C 3.39Å; C662-G677 WeakPolarHBondContact O-CA 3.42Å; D663-G677 VanDerWaalsContact O-CA 3.25Å; D663-G677 WeakPolarHBondContact O-CA 3.35Å; W666-G677 WeakPolarHBondContact O-CA 3.05Å; W666-G677 PolarHBondContact O-N 3.39Å; G677-T685 VanDerWaalsContact C-CG2 3.48Å; G677-T685 WeakPolarHBondContact O-CG2 3.12Å; G677-T685 PolarHBondContact O-OG1 3.09Å
678	G	90.1	Very high	86	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88	-174.8	176.4	0	0	0	0	0	114.6	C662	C662-G678 PolarHBondContact N-O 3.45Å; C662-G678 PolarHBondContact O-N 3.43Å
679	S	91.1	Very high	84.5	Confident	5 Å²	5	49.7 Å²	49.7	4%	0.035	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	164.5	-175.3	-163.8	0	0	0	0	112.2	N655 C660 D681 S682	N655-S679 PolarHBondContact ND2-OG 2.69Å; C660-S679 WeakPolarHBondContact O-CB 3.02Å; C660-S679 PolarHBondContact O-OG 3.24Å; S679-D681 PolarHBondContact O-N 3.02Å; S679-S682 WeakPolarHBondContact CB-OG 3.35Å; S679-S682 PolarHBondContact O-N 3.16Å
680	V	88.9	Confident	82.9	Confident	86 Å²	86	49.1 Å²	49.1	52%	0.521	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.6	169.2	-61.4	0	0	0	0	112.5	N659 P668 P669	N659-V680 HydrophobicContact CB-CG2 3.92Å; N659-V680 WeakPolarHBondContact ND2-CG2 3.49Å; P668-V680 HydrophobicContact CB-CG1 4.07Å; P669-V680 HydrophobicContact CB-CG1 4.07Å
681	D	80.8	Confident	81.4	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.193	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-28.6	179.4	-51.5	-92.2	0	0	0	113.5	V495 N655 N657 N659 S679	V495-D681 HydrophobicContact CG1-CB 4.02Å; V495-D681 HydrophobicContact CG2-CB 4.39Å; N655-D681 PolarHBondContact ND2-OD2 2.82Å; N657-D681 PolarHBondContact ND2-OD1 3.48Å; N659-D681 VanDerWaalsContact CB-OD2 3.3Å; N659-D681 WeakPolarHBondContact CB-OD2 3.36Å; N659-D681 PolarHBondContact ND2-OD1 2.84Å; N659-D681 PolarHBondContact ND2-OD2 3.44Å; S679-D681 PolarHBondContact O-N 3.02Å
682	S	78.1	Confident	80	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-4	-169.6	-50.9	0	0	0	0	114.5	E482 Y483 V495 H661 S679	E482-S682 WeakPolarHBondContact CA-O 3.33Å; Y483-S682 PolarHBondContact N-O 3Å; V495-S682 VanDerWaalsContact CG2-OG 3.28Å; V495-S682 WeakPolarHBondContact CG2-OG 3.22Å; H661-S682 PolarHBondContact ND1-OG 2.59Å; S679-S682 WeakPolarHBondContact CB-OG 3.35Å; S679-S682 PolarHBondContact O-N 3.16Å
683	G	77.7	Confident	78.8	Confident	9 Å²	9	53.3 Å²	53.3	9%	0.093	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	83.4	166.5	-170.6	0	0	0	0	0	113.9
684	P	83.6	Confident	77.9	Confident	31 Å²	31	54.3 Å²	54.3	20%	0.201	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	140.3	179.6	31.4	-34.3	0	0	0	111.1	G467 Y483 N485 W686	G467-P684 WeakPolarHBondContact CA-O 3.22Å; G467-P684 PolarHBondContact N-O 3.26Å; Y483-P684 WeakPolarHBondContact CB-O 3.41Å; N485-P684 HydrophobicContact CB-CG 4.39Å; P684-W686 VanDerWaalsContact C-N 3.32Å; P684-W686 HydrophobicContact CB-CD2 4.41Å; P684-W686 HydrophobicContact CB-CE3 4.05Å; P684-W686 HydrophobicContact CB-CH2 4.22Å; P684-W686 HydrophobicContact CB-CZ3 3.96Å
685	T	83.5	Confident	77.1	Confident	27 Å²	27	53.4 Å²	53.4	17%	0.166	28%	0.281	C	S	.	.	S	Bend	trans	-83	-1.8	177.9	42.4	0	0	0	0	114.4	Y483 Y676 G677	Y483-T685 HydrophobicContact CD2-CG2 4.04Å; Y483-T685 HydrophobicContact CE1-CG2 4.12Å; Y483-T685 HydrophobicContact CE2-CG2 3.62Å; Y483-T685 HydrophobicContact CG-CG2 4.48Å; Y676-T685 WeakPolarHBondContact CB-OG1 3.29Å; Y676-T685 WeakPolarHBondContact O-CB 3.13Å; Y676-T685 PolarHBondContact O-OG1 3.22Å; G677-T685 VanDerWaalsContact C-CG2 3.48Å; G677-T685 WeakPolarHBondContact O-CG2 3.12Å; G677-T685 PolarHBondContact O-OG1 3.09Å
686	W	78.8	Confident	76.7	Confident	62 Å²	62	55 Å²	55	24%	0.235	30%	0.298	C	S	.	.	S	Bend	trans	-135.5	158.7	-173.8	75.2	93.1	0	0	0	112.6	G466 G467 Y676 P684 D688	G466-W686 VanDerWaalsContact C-C 3.45Å; G466-W686 CarbonylContact C-O 3.42Å; G466-W686 WeakPolarHBondContact CA-O 3.32Å; G466-W686 CarbonylContact O-C 3.37Å; G467-W686 PolarHBondContact N-O 2.74Å; Y676-W686 HydrophobicContact CD1-CB 3.98Å; Y676-W686 HydrophobicContact CD2-CB 3.97Å; Y676-W686 AromaticContact CD2-CD2 3.86Å; Y676-W686 HydrophobicContact CD2-CD2 3.86Å; Y676-W686 HydrophobicContact CD2-CE3 4.14Å; Y676-W686 AromaticContact CD2-CG 3.77Å; Y676-W686 HydrophobicContact CD2-CG 3.77Å; Y676-W686 HydrophobicContact CE2-CG 4.36Å; Y676-W686 HydrophobicContact CG-CB 3.66Å; Y676-W686 HydrophobicContact CG-CD2 4.22Å; Y676-W686 HydrophobicContact CG-CE3 4.29Å; Y676-W686 AromaticContact CG-CG 3.97Å; Y676-W686 HydrophobicContact CG-CG 3.97Å; P684-W686 VanDerWaalsContact C-N 3.32Å; P684-W686 HydrophobicContact CB-CD2 4.41Å; P684-W686 HydrophobicContact CB-CE3 4.05Å; P684-W686 HydrophobicContact CB-CH2 4.22Å; P684-W686 HydrophobicContact CB-CZ3 3.96Å; W686-D688 PolarHBondContact NE1-OD1 2.96Å
687	N	75.6	Confident	76.5	Confident	53 Å²	53	58.2 Å²	58.2	28%	0.283	32%	0.317	S	S	.	.			trans	-97.6	106.5	178.9	-175.9	18	0	0	0	111.4	P465 G466 K689 D690	P465-N687 HydrophobicContact CB-CB 4.17Å; P465-N687 VanDerWaalsContact CB-CG 3.42Å; P465-N687 WeakPolarHBondContact CB-ND2 3.41Å; P465-N687 WeakPolarHBondContact CB-OD1 3.41Å; G466-N687 WeakPolarHBondContact O-CA 3.29Å; G466-N687 VanDerWaalsContact O-CB 3.25Å; G466-N687 WeakPolarHBondContact O-CB 3.19Å; G466-N687 PolarHBondContact O-N 3.03Å; N687-K689 PolarHBondContact O-N 3.01Å; N687-K689 VanDerWaalsContact O-N 3.09Å; N687-K689 VanDerWaalsContact OD1-CB 3.32Å; N687-K689 WeakPolarHBondContact OD1-CB 3.48Å; N687-K689 PolarHBondContact OD1-N 2.75Å; N687-D690 HydrophobicContact CB-CB 4.21Å; N687-D690 PolarHBondContact ND2-N 3.43Å; N687-D690 PolarHBondContact O-N 2.77Å
688	D	63.6	Low	76.3	Confident	120 Å²	120	61.9 Å²	61.9	64%	0.642	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.9	171.8	-72.3	-42.9	0	0	0	113.8	W686	W686-D688 PolarHBondContact NE1-OD1 2.96Å
689	K	59.4	Low	76.2	Confident	116 Å²	116	65.6 Å²	65.6	50%	0.504	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2	-178.9	-52.4	173.8	-170.9	166.3	0	113.7	G486 N687 T691	G486-K689 PolarHBondContact O-NZ 3.41Å; N687-K689 PolarHBondContact O-N 3.01Å; N687-K689 VanDerWaalsContact O-N 3.09Å; N687-K689 VanDerWaalsContact OD1-CB 3.32Å; N687-K689 WeakPolarHBondContact OD1-CB 3.48Å; N687-K689 PolarHBondContact OD1-N 2.75Å; K689-T691 PolarHBondContact O-N 3.18Å
690	D	59.3	Low	76.1	Confident	78 Å²	78	70 Å²	70	42%	0.417	38%	0.376	S	S	.	.			trans	-78.8	80.1	-179	-177.5	20.4	0	0	0	112.4	N687 S692	N687-D690 HydrophobicContact CB-CB 4.21Å; N687-D690 PolarHBondContact ND2-N 3.43Å; N687-D690 PolarHBondContact O-N 2.77Å; D690-S692 VanDerWaalsContact C-N 3.29Å; D690-S692 WeakPolarHBondContact OD1-CB 3.44Å; D690-S692 PolarHBondContact OD1-N 2.91Å; D690-S692 PolarHBondContact OD1-OG 2.73Å
691	T	61.2	Low	76.2	Confident	51 Å²	51	71.8 Å²	71.8	31%	0.313	38%	0.377	S	S	.	.			trans	-84.7	1.4	176	60.5	0	0	0	0	113.8	K689 L693 R694 D695	K689-T691 PolarHBondContact O-N 3.18Å; T691-L693 VanDerWaalsContact C-N 3.32Å; T691-L693 PolarHBondContact O-N 3.5Å; T691-L693 VanDerWaalsContact O-N 3.15Å; T691-R694 WeakPolarHBondContact O-CA 3.38Å; T691-R694 WeakPolarHBondContact O-CB 3.14Å; T691-R694 PolarHBondContact O-N 3.26Å; T691-D695 WeakPolarHBondContact CB-OD2 3.5Å; T691-D695 PolarHBondContact O-N 3.09Å; T691-D695 PolarHBondContact OG1-OD2 3.36Å
692	S	65.8	Low	76.6	Confident	83 Å²	83	77.8 Å²	77.8	58%	0.58	40%	0.402	S	S	*	.	H	α-helix	trans	-52.5	-42.8	-168.6	-45.4	0	0	0	0	114	D690 G696	D690-S692 VanDerWaalsContact C-N 3.29Å; D690-S692 WeakPolarHBondContact OD1-CB 3.44Å; D690-S692 PolarHBondContact OD1-N 2.91Å; D690-S692 PolarHBondContact OD1-OG 2.73Å; S692-G696 PolarHBondContact O-N 3.45Å
693	L	68.2	Low	77.1	Confident	124 Å²	124	82.3 Å²	82.3	65%	0.649	43%	0.425	S	S	*	.	H	α-helix	trans	-67.4	-42.3	177.3	-86.6	167.5	0	0	0	112.5	T691 L697	T691-L693 VanDerWaalsContact C-N 3.32Å; T691-L693 PolarHBondContact O-N 3.5Å; T691-L693 VanDerWaalsContact O-N 3.15Å; L693-L697 WeakPolarHBondContact O-CB 3.39Å; L693-L697 WeakPolarHBondContact O-CD1 3.45Å; L693-L697 VanDerWaalsContact O-CG 3.29Å; L693-L697 WeakPolarHBondContact O-CG 3.42Å; L693-L697 PolarHBondContact O-N 2.61Å
694	R	74	Confident	77.8	Confident	144 Å²	144	84.6 Å²	84.6	54%	0.543	44%	0.437	S	S	.	.	H	α-helix	trans	-66.1	-46.8	178.5	-175.9	-163.2	69.4	-162.3	-3.1	110.3	T691 L697 L698	T691-R694 WeakPolarHBondContact O-CA 3.38Å; T691-R694 WeakPolarHBondContact O-CB 3.14Å; T691-R694 PolarHBondContact O-N 3.26Å; R694-L697 WeakPolarHBondContact O-CB 3.45Å; R694-L697 PolarHBondContact O-N 2.88Å; R694-L698 HydrophobicContact CG-CD1 4.29Å; R694-L698 WeakPolarHBondContact O-CG 3.17Å; R694-L698 PolarHBondContact O-N 3.48Å
695	D	73	Confident	78.2	Confident	54 Å²	54	86.3 Å²	86.3	29%	0.289	45%	0.445	S	S	.	.	H	α-helix	trans	-75.4	-33.1	-173.7	-60.6	-15.8	0	0	0	110.9	T691 L698 V699	T691-D695 WeakPolarHBondContact CB-OD2 3.5Å; T691-D695 PolarHBondContact O-N 3.09Å; T691-D695 PolarHBondContact OG1-OD2 3.36Å; D695-L698 PolarHBondContact O-N 2.83Å; D695-V699 WeakPolarHBondContact O-CG2 3.38Å; D695-V699 PolarHBondContact O-N 3.39Å
696	G	80.4	Confident	78.6	Confident	42 Å²	42	88 Å²	88	43%	0.433	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-43.4	166.6	0	0	0	0	0	113.1	S692 V699 F700	S692-G696 PolarHBondContact O-N 3.45Å; G696-V699 PolarHBondContact O-N 2.94Å; G696-F700 WeakPolarHBondContact O-CB 3.37Å; G696-F700 PolarHBondContact O-N 3.15Å
697	L	83.9	Confident	79.3	Confident	97 Å²	97	89.9 Å²	89.9	51%	0.508	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-42.9	172.5	-78.3	164.5	0	0	0	111.7	L693 R694 F700 F701	L693-L697 WeakPolarHBondContact O-CB 3.39Å; L693-L697 WeakPolarHBondContact O-CD1 3.45Å; L693-L697 VanDerWaalsContact O-CG 3.29Å; L693-L697 WeakPolarHBondContact O-CG 3.42Å; L693-L697 PolarHBondContact O-N 2.61Å; R694-L697 WeakPolarHBondContact O-CB 3.45Å; R694-L697 PolarHBondContact O-N 2.88Å; L697-F700 PolarHBondContact O-N 3.09Å; L697-F701 HydrophobicContact CD2-CD2 4.41Å; L697-F701 HydrophobicContact CD2-CE2 3.99Å; L697-F701 WeakPolarHBondContact O-CD2 3.29Å; L697-F701 PolarHBondContact O-N 3.47Å
698	L	85.8	Confident	80	Confident	81 Å²	81	92.4 Å²	92.4	42%	0.424	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-45.5	177.3	-70.3	172.2	0	0	0	111.8	R694 D695 F700 F701 F702	R694-L698 HydrophobicContact CG-CD1 4.29Å; R694-L698 WeakPolarHBondContact O-CG 3.17Å; R694-L698 PolarHBondContact O-N 3.48Å; D695-L698 PolarHBondContact O-N 2.83Å; L698-F700 VanDerWaalsContact C-N 3.32Å; L698-F700 PolarHBondContact O-N 2.93Å; L698-F701 PolarHBondContact O-N 2.91Å; L698-F702 HydrophobicContact CB-CD2 4.48Å; L698-F702 HydrophobicContact CD2-CD2 3.9Å; L698-F702 HydrophobicContact CD2-CE2 3.66Å; L698-F702 WeakPolarHBondContact O-CB 3.32Å; L698-F702 WeakPolarHBondContact O-CD2 3.32Å; L698-F702 PolarHBondContact O-N 2.9Å
699	V	87	Confident	81.3	Confident	78 Å²	78	89.7 Å²	89.7	47%	0.473	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-39.6	174.8	171.6	0	0	0	0	111.2	D695 G696 L703 V704	D695-V699 WeakPolarHBondContact O-CG2 3.38Å; D695-V699 PolarHBondContact O-N 3.39Å; G696-V699 PolarHBondContact O-N 2.94Å; V699-L703 HydrophobicContact CG1-CB 4.3Å; V699-L703 WeakPolarHBondContact O-CA 3.36Å; V699-L703 WeakPolarHBondContact O-CB 3.45Å; V699-L703 PolarHBondContact O-N 3.31Å; V699-V704 HydrophobicContact CG1-CG2 4.41Å; V699-V704 PolarHBondContact O-N 3.26Å
700	F	89.4	Confident	82.7	Confident	99 Å²	99	88.9 Å²	88.9	43%	0.434	48%	0.478	S	S	.	.	I	π-helix	trans	-63.3	-48.5	176.7	-173.5	-99.6	0	0	0	112.4	G696 L697 L698 V704 L705	G696-F700 WeakPolarHBondContact O-CB 3.37Å; G696-F700 PolarHBondContact O-N 3.15Å; L697-F700 PolarHBondContact O-N 3.09Å; L698-F700 VanDerWaalsContact C-N 3.32Å; L698-F700 PolarHBondContact O-N 2.93Å; F700-V704 HydrophobicContact CD2-CB 4.22Å; F700-V704 HydrophobicContact CD2-CG1 4.31Å; F700-V704 HydrophobicContact CE2-CG1 4.4Å; F700-V704 PolarHBondContact O-N 2.89Å; F700-L705 HydrophobicContact CD1-CD1 3.92Å; F700-L705 HydrophobicContact CD1-CG 4.45Å; F700-L705 HydrophobicContact CE1-CD1 3.61Å; F700-L705 HydrophobicContact CE1-CG 4.05Å; F700-L705 HydrophobicContact CZ-CD1 4.39Å; F700-L705 HydrophobicContact CZ-CG 4.38Å; F700-L705 WeakPolarHBondContact O-CB 3.27Å; F700-L705 PolarHBondContact O-N 3.17Å
701	F	90.9	Very high	84	Confident	122 Å²	122	88 Å²	88	54%	0.535	48%	0.482	S	S	.	.	I	π-helix	trans	-78.3	-34	-176.6	-81.4	-71	0	0	0	114.9	L697 L698 L705 P706	L697-F701 HydrophobicContact CD2-CD2 4.41Å; L697-F701 HydrophobicContact CD2-CE2 3.99Å; L697-F701 WeakPolarHBondContact O-CD2 3.29Å; L697-F701 PolarHBondContact O-N 3.47Å; L698-F701 PolarHBondContact O-N 2.91Å; F701-L705 HydrophobicContact CD1-CD1 3.48Å; F701-L705 VanDerWaalsContact CD1-CD1 3.48Å; F701-L705 HydrophobicContact CE1-CD1 3.71Å; F701-L705 HydrophobicContact CG-CD1 4.3Å; F701-P706 VanDerWaalsContact O-CD 3.31Å; F701-P706 WeakPolarHBondContact O-CD 3.29Å
702	F	89.3	Confident	85.3	Confident	163 Å²	163	87.9 Å²	87.9	72%	0.715	49%	0.485	S	S	*	.	I	π-helix	trans	-101.9	-11.9	-176.1	-68.6	-76.5	0	0	0	114.7	L698	L698-F702 HydrophobicContact CB-CD2 4.48Å; L698-F702 HydrophobicContact CD2-CD2 3.9Å; L698-F702 HydrophobicContact CD2-CE2 3.66Å; L698-F702 WeakPolarHBondContact O-CB 3.32Å; L698-F702 WeakPolarHBondContact O-CD2 3.32Å; L698-F702 PolarHBondContact O-N 2.9Å
703	L	88.5	Confident	86.2	Confident	94 Å²	94	89.5 Å²	89.5	49%	0.492	48%	0.482	S	S	.	.	I	π-helix	trans	-124.5	-55.7	-178.3	-142.1	171.4	0	0	0	111.8	V699 L707	V699-L703 HydrophobicContact CG1-CB 4.3Å; V699-L703 WeakPolarHBondContact O-CA 3.36Å; V699-L703 WeakPolarHBondContact O-CB 3.45Å; V699-L703 PolarHBondContact O-N 3.31Å; L703-L707 HydrophobicContact CD2-CD1 3.52Å; L703-L707 HydrophobicContact CD2-CG 4.24Å; L703-L707 WeakPolarHBondContact O-CB 3.39Å; L703-L707 VanDerWaalsContact O-CG 3.29Å; L703-L707 WeakPolarHBondContact O-CG 3.42Å; L703-L707 PolarHBondContact O-N 3.03Å; L703-L707 VanDerWaalsContact O-N 3.16Å
704	V	91.7	Very high	87	Confident	57 Å²	57	87 Å²	87	35%	0.345	47%	0.472	S	S	.	.	I	π-helix	trans	-69.3	-52.9	-176.4	-176.3	0	0	0	0	111.8	V699 F700 L707 L708	V699-V704 HydrophobicContact CG1-CG2 4.41Å; V699-V704 PolarHBondContact O-N 3.26Å; F700-V704 HydrophobicContact CD2-CB 4.22Å; F700-V704 HydrophobicContact CD2-CG1 4.31Å; F700-V704 HydrophobicContact CE2-CG1 4.4Å; F700-V704 PolarHBondContact O-N 2.89Å; V704-L707 PolarHBondContact O-N 3.38Å; V704-L708 HydrophobicContact CG1-CD1 3.92Å; V704-L708 HydrophobicContact CG1-CG 4.37Å; V704-L708 WeakPolarHBondContact O-CG 3.46Å; V704-L708 PolarHBondContact O-N 3.16Å
705	L	93.8	Very high	87.4	Confident	68 Å²	68	87.2 Å²	87.2	36%	0.356	48%	0.477	S	S	.	.	H	α-helix	trans	-59.9	-45.4	-180	-92.3	165.7	0	0	0	113.2	F700 F701 L707 L708 A709	F700-L705 HydrophobicContact CD1-CD1 3.92Å; F700-L705 HydrophobicContact CD1-CG 4.45Å; F700-L705 HydrophobicContact CE1-CD1 3.61Å; F700-L705 HydrophobicContact CE1-CG 4.05Å; F700-L705 HydrophobicContact CZ-CD1 4.39Å; F700-L705 HydrophobicContact CZ-CG 4.38Å; F700-L705 WeakPolarHBondContact O-CB 3.27Å; F700-L705 PolarHBondContact O-N 3.17Å; F701-L705 HydrophobicContact CD1-CD1 3.48Å; F701-L705 VanDerWaalsContact CD1-CD1 3.48Å; F701-L705 HydrophobicContact CE1-CD1 3.71Å; F701-L705 HydrophobicContact CG-CD1 4.3Å; L705-L707 PolarHBondContact O-N 3.17Å; L705-L708 PolarHBondContact O-N 3Å; L705-A709 WeakPolarHBondContact O-CB 3.36Å; L705-A709 PolarHBondContact O-N 2.9Å
706	P	91.9	Very high	87.8	Confident	63 Å²	63	91.4 Å²	91.4	41%	0.409	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-36.9	174.9	-28	38.9	0	0	0	113.8	F701 A709 L710	F701-P706 VanDerWaalsContact O-CD 3.31Å; F701-P706 WeakPolarHBondContact O-CD 3.29Å; P706-A709 PolarHBondContact O-N 3.41Å; P706-L710 VanDerWaalsContact O-CB 3.28Å; P706-L710 WeakPolarHBondContact O-CB 3.23Å; P706-L710 PolarHBondContact O-N 3.28Å
707	L	91.8	Very high	87.8	Confident	101 Å²	101	95.1 Å²	95.1	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-67.9	-38.8	174.2	-75.4	179.2	0	0	0	112.4	L703 V704 L705 L710 A711	L703-L707 HydrophobicContact CD2-CD1 3.52Å; L703-L707 HydrophobicContact CD2-CG 4.24Å; L703-L707 WeakPolarHBondContact O-CB 3.39Å; L703-L707 VanDerWaalsContact O-CG 3.29Å; L703-L707 WeakPolarHBondContact O-CG 3.42Å; L703-L707 PolarHBondContact O-N 3.03Å; L703-L707 VanDerWaalsContact O-N 3.16Å; V704-L707 PolarHBondContact O-N 3.38Å; L705-L707 PolarHBondContact O-N 3.17Å; L707-L710 PolarHBondContact O-N 2.99Å; L707-A711 VanDerWaalsContact O-CB 3.27Å; L707-A711 WeakPolarHBondContact O-CB 3.32Å; L707-A711 PolarHBondContact O-N 3.46Å
708	L	91.9	Very high	87.2	Confident	106 Å²	106	97.5 Å²	97.5	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-64.7	-42.3	173.7	-70.6	172.6	0	0	0	111.5	V704 L705 A711 A712	V704-L708 HydrophobicContact CG1-CD1 3.92Å; V704-L708 HydrophobicContact CG1-CG 4.37Å; V704-L708 WeakPolarHBondContact O-CG 3.46Å; V704-L708 PolarHBondContact O-N 3.16Å; L705-L708 PolarHBondContact O-N 3Å; L708-A711 PolarHBondContact O-N 3.45Å; L708-A712 WeakPolarHBondContact O-CB 3.43Å; L708-A712 PolarHBondContact O-N 3.32Å
709	A	90.4	Very high	86.3	Confident	62 Å²	62	99.7 Å²	99.7	51%	0.512	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-41.1	174.7	0	0	0	0	0	112.2	L705 P706 A712 F713	L705-A709 WeakPolarHBondContact O-CB 3.36Å; L705-A709 PolarHBondContact O-N 2.9Å; P706-A709 PolarHBondContact O-N 3.41Å; A709-A712 PolarHBondContact O-N 2.93Å; A709-F713 WeakPolarHBondContact O-CB 3.31Å; A709-F713 PolarHBondContact O-N 2.83Å
710	L	88.3	Confident	85.4	Confident	100 Å²	100	100 Å²	100	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-43.7	175.2	-173.1	72.7	0	0	0	111.5	P706 L707 F713 V714	P706-L710 VanDerWaalsContact O-CB 3.28Å; P706-L710 WeakPolarHBondContact O-CB 3.23Å; P706-L710 PolarHBondContact O-N 3.28Å; L707-L710 PolarHBondContact O-N 2.99Å; L710-F713 PolarHBondContact O-N 3.41Å; L710-V714 WeakPolarHBondContact O-CB 3.32Å; L710-V714 WeakPolarHBondContact O-CG2 3.28Å; L710-V714 PolarHBondContact O-N 3.49Å
711	A	86.8	Confident	84.1	Confident	60 Å²	60	98.3 Å²	98.3	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-43.8	176.6	0	0	0	0	0	111.3	L707 L708 V714 F715	L707-A711 VanDerWaalsContact O-CB 3.27Å; L707-A711 WeakPolarHBondContact O-CB 3.32Å; L707-A711 PolarHBondContact O-N 3.46Å; L708-A711 PolarHBondContact O-N 3.45Å; A711-V714 PolarHBondContact O-N 2.86Å; A711-F715 VanDerWaalsContact O-CB 3.23Å; A711-F715 WeakPolarHBondContact O-CB 3.48Å; A711-F715 PolarHBondContact O-N 2.89Å
712	A	87.8	Confident	82.7	Confident	47 Å²	47	96.4 Å²	96.4	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-62	-44.4	173.1	0	0	0	0	0	111.8	L708 A709 F715 L716	L708-A712 WeakPolarHBondContact O-CB 3.43Å; L708-A712 PolarHBondContact O-N 3.32Å; A709-A712 PolarHBondContact O-N 2.93Å; A712-F715 PolarHBondContact O-N 3.27Å; A712-L716 WeakPolarHBondContact O-CB 3.21Å; A712-L716 VanDerWaalsContact O-CG 3.23Å; A712-L716 WeakPolarHBondContact O-CG 3.31Å; A712-L716 PolarHBondContact O-N 2.87Å
713	F	86	Confident	81.2	Confident	117 Å²	117	98.9 Å²	98.9	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-46.1	176.5	179.1	-93.6	0	0	0	112.3	A709 L710 F715 L716 R717	A709-F713 WeakPolarHBondContact O-CB 3.31Å; A709-F713 PolarHBondContact O-N 2.83Å; L710-F713 PolarHBondContact O-N 3.41Å; F713-F715 VanDerWaalsContact C-N 3.35Å; F713-L716 PolarHBondContact O-N 3.33Å; F713-R717 HydrophobicContact CD2-CG 4.39Å; F713-R717 HydrophobicContact CE1-CG 4.19Å; F713-R717 HydrophobicContact CE2-CG 4.03Å; F713-R717 HydrophobicContact CZ-CG 3.92Å; F713-R717 WeakPolarHBondContact O-CB 3.35Å; F713-R717 PolarHBondContact O-N 3.46Å
714	V	83.8	Confident	79.9	Confident	71 Å²	71	104.4 Å²	104.4	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-37.1	177.1	170.3	0	0	0	0	111.3	L710 A711 R718 L721	L710-V714 WeakPolarHBondContact O-CB 3.32Å; L710-V714 WeakPolarHBondContact O-CG2 3.28Å; L710-V714 PolarHBondContact O-N 3.49Å; A711-V714 PolarHBondContact O-N 2.86Å; V714-R718 VanDerWaalsContact O-CA 3.25Å; V714-R718 WeakPolarHBondContact O-CA 3.43Å; V714-R718 WeakPolarHBondContact O-CB 3.16Å; V714-R718 PolarHBondContact O-N 2.87Å; V714-L721 HydrophobicContact CB-CD1 4.5Å; V714-L721 HydrophobicContact CG1-CD1 4.25Å; V714-L721 HydrophobicContact CG2-CD1 4.38Å
715	F	83.4	Confident	78.4	Confident	149 Å²	149	107.6 Å²	107.6	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-47.3	174.4	-177.5	-94.5	0	0	0	111.8	A711 A712 F713 R718	A711-F715 VanDerWaalsContact O-CB 3.23Å; A711-F715 WeakPolarHBondContact O-CB 3.48Å; A711-F715 PolarHBondContact O-N 2.89Å; A712-F715 PolarHBondContact O-N 3.27Å; F713-F715 VanDerWaalsContact C-N 3.35Å; F715-R718 WeakPolarHBondContact O-CB 3.36Å; F715-R718 PolarHBondContact O-N 3.27Å
716	L	81.6	Confident	76.7	Confident	142 Å²	142	107.4 Å²	107.4	74%	0.743	55%	0.548	S	S	*	.	H	α-helix	trans	-68.7	-38.9	179.2	-68.7	169	0	0	0	112.6	A712 F713 R718	A712-L716 WeakPolarHBondContact O-CB 3.21Å; A712-L716 VanDerWaalsContact O-CG 3.23Å; A712-L716 WeakPolarHBondContact O-CG 3.31Å; A712-L716 PolarHBondContact O-N 2.87Å; F713-L716 PolarHBondContact O-N 3.33Å; L716-R718 VanDerWaalsContact C-N 3.34Å
717	R	79.5	Confident	75	Confident	121 Å²	121	111.4 Å²	111.4	46%	0.457	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.2	4.2	175.9	-67.8	-70.7	-174	168.7	-0.2	113.8	F713 N719 E720 L721	F713-R717 HydrophobicContact CD2-CG 4.39Å; F713-R717 HydrophobicContact CE1-CG 4.19Å; F713-R717 HydrophobicContact CE2-CG 4.03Å; F713-R717 HydrophobicContact CZ-CG 3.92Å; F713-R717 WeakPolarHBondContact O-CB 3.35Å; F713-R717 PolarHBondContact O-N 3.46Å; R717-N719 VanDerWaalsContact C-N 3.32Å; R717-N719 PolarHBondContact O-N 2.91Å; R717-E720 WeakPolarHBondContact CD-OE2 3.23Å; R717-E720 IonicContact CZ-OE2 2.68Å; R717-E720 IonicContact NE-OE2 3.86Å; R717-E720 IonicContact NH1-OE1 3.28Å; R717-E720 IonicContact NH1-OE2 3.9Å; R717-E720 PolarHBondContact NH1-OE2 2.9Å; R717-E720 WeakPolarHBondContact O-CA 3.25Å; R717-E720 WeakPolarHBondContact O-CB 3.48Å; R717-E720 PolarHBondContact O-N 3.41Å; R717-L721 HydrophobicContact CB-CD1 4.07Å; R717-L721 HydrophobicContact CB-CG 4.28Å; R717-L721 PolarHBondContact O-N 3.45Å
718	R	72.5	Confident	72.8	Confident	147 Å²	147	111.3 Å²	111.3	56%	0.555	57%	0.573	S	S	*	*	H	α-helix	trans	-49.4	-48.1	-173.6	-177.9	176.9	176.7	-168.7	-0.7	113.2	V714 F715 L716 E720 L722	V714-R718 VanDerWaalsContact O-CA 3.25Å; V714-R718 WeakPolarHBondContact O-CA 3.43Å; V714-R718 WeakPolarHBondContact O-CB 3.16Å; V714-R718 PolarHBondContact O-N 2.87Å; F715-R718 WeakPolarHBondContact O-CB 3.36Å; F715-R718 PolarHBondContact O-N 3.27Å; L716-R718 VanDerWaalsContact C-N 3.34Å; R718-E720 PolarHBondContact O-N 3.49Å; R718-L722 HydrophobicContact CG-CD1 3.96Å; R718-L722 VanDerWaalsContact O-CB 3.31Å; R718-L722 WeakPolarHBondContact O-CB 3.38Å; R718-L722 WeakPolarHBondContact O-CD1 3.44Å; R718-L722 WeakPolarHBondContact O-CG 3.32Å; R718-L722 PolarHBondContact O-N 2.85Å
719	N	66.9	Low	70.6	Confident	127 Å²	127	118.2 Å²	118.2	68%	0.679	59%	0.592	S	S	*	*	H	α-helix	trans	-69.1	-17.2	-178.3	-68.5	-15.2	0	0	0	113.8	R717 R723	R717-N719 VanDerWaalsContact C-N 3.32Å; R717-N719 PolarHBondContact O-N 2.91Å; N719-R723 WeakPolarHBondContact O-CG 3.5Å
720	E	66.4	Low	68.4	Low	85 Å²	85	126.4 Å²	126.4	40%	0.397	61%	0.609	S	S	.	*	H	α-helix	trans	-99.9	-36.9	-178.9	-162.5	170.6	-164.1	0	0	111.6	R717 R718 R723 R724	R717-E720 WeakPolarHBondContact CD-OE2 3.23Å; R717-E720 IonicContact CZ-OE2 2.68Å; R717-E720 IonicContact NE-OE2 3.86Å; R717-E720 IonicContact NH1-OE1 3.28Å; R717-E720 IonicContact NH1-OE2 3.9Å; R717-E720 PolarHBondContact NH1-OE2 2.9Å; R717-E720 WeakPolarHBondContact O-CA 3.25Å; R717-E720 WeakPolarHBondContact O-CB 3.48Å; R717-E720 PolarHBondContact O-N 3.41Å; R718-E720 PolarHBondContact O-N 3.49Å; E720-R723 WeakPolarHBondContact O-CB 3.45Å; E720-R723 PolarHBondContact O-N 2.92Å; E720-R723 VanDerWaalsContact O-N 3.16Å; E720-R724 PolarHBondContact O-N 2.92Å
721	L	63	Low	65.8	Low	62 Å²	62	132 Å²	132	33%	0.325	63%	0.63	S	S	.	*	H	α-helix	trans	-60	-44.3	166	-72.3	165.5	0	0	0	111.1	V714 R717 R723 R724 L725	V714-L721 HydrophobicContact CB-CD1 4.5Å; V714-L721 HydrophobicContact CG1-CD1 4.25Å; V714-L721 HydrophobicContact CG2-CD1 4.38Å; R717-L721 HydrophobicContact CB-CD1 4.07Å; R717-L721 HydrophobicContact CB-CG 4.28Å; R717-L721 PolarHBondContact O-N 3.45Å; L721-R723 PolarHBondContact O-N 3.36Å; L721-R724 PolarHBondContact O-N 2.96Å; L721-R724 VanDerWaalsContact O-N 3.13Å; L721-L725 WeakPolarHBondContact O-CB 3.48Å; L721-L725 WeakPolarHBondContact O-CG 3.34Å; L721-L725 PolarHBondContact O-N 3.26Å
722	L	60.9	Low	63.4	Low	82 Å²	82	140 Å²	140	43%	0.429	65%	0.647	S	S	.	*	H	α-helix	trans	-62	-27.7	173.7	-75	169.2	0	0	0	113.4	R718	R718-L722 HydrophobicContact CG-CD1 3.96Å; R718-L722 VanDerWaalsContact O-CB 3.31Å; R718-L722 WeakPolarHBondContact O-CB 3.38Å; R718-L722 WeakPolarHBondContact O-CD1 3.44Å; R718-L722 WeakPolarHBondContact O-CG 3.32Å; R718-L722 PolarHBondContact O-N 2.85Å
723	R	58	Low	61	Low	215 Å²	215	141.9 Å²	141.9	81%	0.811	66%	0.657	S	S	*	*	H	α-helix	trans	-74.9	-38.2	172.1	-80.3	177.4	173.1	-174.6	-1.1	112.4	N719 E720 L721	N719-R723 WeakPolarHBondContact O-CG 3.5Å; E720-R723 WeakPolarHBondContact O-CB 3.45Å; E720-R723 PolarHBondContact O-N 2.92Å; E720-R723 VanDerWaalsContact O-N 3.16Å; L721-R723 PolarHBondContact O-N 3.36Å
724	R	62.6	Low	58.7	Low	210 Å²	210	145.3 Å²	145.3	79%	0.792	68%	0.675	S	S	*	*	H	α-helix	trans	-75.7	-32.3	179	-69.4	-171.9	-178.7	-147.6	1.2	113.5	E720 L721 G726	E720-R724 PolarHBondContact O-N 2.92Å; L721-R724 PolarHBondContact O-N 2.96Å; L721-R724 VanDerWaalsContact O-N 3.13Å; R724-G726 VanDerWaalsContact C-N 3.27Å; R724-G726 PolarHBondContact O-N 2.84Å
725	L	60.1	Low	56.2	Low	125 Å²	125	145.6 Å²	145.6	65%	0.654	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	11.5	-177.9	-71.1	167.2	0	0	0	114.5	L721 L727	L721-L725 WeakPolarHBondContact O-CB 3.48Å; L721-L725 WeakPolarHBondContact O-CG 3.34Å; L721-L725 PolarHBondContact O-N 3.26Å; L725-L727 PolarHBondContact O-N 3.4Å
726	G	57.1	Low	53.7	Low	64 Å²	64	149 Å²	149	66%	0.66	70%	0.703	S	S	*	*			trans	70.2	-9.1	168.8	0	0	0	0	0	117.4	R724 S728	R724-G726 VanDerWaalsContact C-N 3.27Å; R724-G726 PolarHBondContact O-N 2.84Å; G726-S728 PolarHBondContact O-N 2.88Å
727	L	56	Low	51.4	Low	146 Å²	146	150.2 Å²	150.2	76%	0.764	70%	0.704	S	S	*	*			trans	-75.3	37.4	-174.9	-68.9	172.8	0	0	0	114.7	L725 R729	L725-L727 PolarHBondContact O-N 3.4Å; L727-R729 PolarHBondContact O-N 2.83Å
728	S	46.6	Very low	49.3	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	71%	0.713	S	S	*	*			trans	-94.9	78.8	175.7	-168.8	0	0	0	0	111.3	G726 R730	G726-S728 PolarHBondContact O-N 2.88Å; S728-R730 PolarHBondContact O-N 3.1Å; S728-R730 VanDerWaalsContact O-N 3.1Å
729	R	45	Very low	47.5	Very low	250 Å²	250	149.2 Å²	149.2	94%	0.943	73%	0.73	S	S	*	*			trans	-74.2	100.5	175.8	-123.7	-177.8	-174.9	-174.1	2.3	110.2	L727	L727-R729 PolarHBondContact O-N 2.83Å
730	R	43.9	Very low	45.8	Very low	234 Å²	234	147 Å²	147	88%	0.883	74%	0.736	S	S	*	*			trans	-51.2	140	176.6	-66.1	174.2	172.2	174.7	-3.3	112.9	S728	S728-R730 PolarHBondContact O-N 3.1Å; S728-R730 VanDerWaalsContact O-N 3.1Å
731	K	34.5	Very low	44.2	Very low	218 Å²	218	147.1 Å²	147.1	95%	0.948	75%	0.752	S	S	*	*			trans	-149.4	141.1	133.4	-105.4	177.6	-178.8	-175.8	0	108.9
732	R	34.9	Very low	42.7	Very low	228 Å²	228	150.8 Å²	150.8	86%	0.86	78%	0.777	S	S	*	*			trans	-144.1	148.2	-177.5	176	-174.9	168.3	175.7	-1.4	108.5
733	S	38.2	Very low	41.3	Very low	87 Å²	87	152.6 Å²	152.6	61%	0.608	80%	0.797	S	S	*	*			trans	60.2	118.7	171.9	37.2	0	0	0	0	115.4
734	Q	37.1	Very low	40	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	79%	0.792	S	S	*	*				71	109.4	62.7	-68.5	174.8	-52	0	0	113.2
735	G	31.5	Very low	38.5	Very low	77 Å²	77	147 Å²	147	79%	0.794	79%	0.794	S	S	*	*			trans	-101.8	169.7	151.6	0	0	0	0	0	109.9
736	Y	32	Very low	38.3	Very low	221 Å²	221	145.9 Å²	145.9	87%	0.867	79%	0.794	S	S	*	*			trans	-103	170.2	-161.7	-119.1	-111.4	0	0	0	115.5
737	Q	32.7	Very low	37.3	Very low	166 Å²	166	149 Å²	149	78%	0.776	80%	0.801	S	S	*	*			trans	-44.4	162	155.6	-77.9	161.8	-92	0	0	114.1
738	A	35.2	Very low	36.6	Very low	77 Å²	77	149.4 Å²	149.4	64%	0.636	80%	0.803	S	S	*	*			cis	-169	-170.1	-10	0	0	0	0	0	110.5
739	D	34.5	Very low	37.2	Very low	171 Å²	171	150.4 Å²	150.4	91%	0.914	81%	0.808	S	S	*	*			trans	79.4	142.3	162.7	-56.3	-25.1	0	0	0	119.8
740	G	31.1	Very low	36.7	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	80%	0.801	S	S	*	*			trans	154.5	79.9	-177.3	0	0	0	0	0	114.4
741	A	32.6	Very low	36.3	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	81%	0.806	S	S	*	*			trans	-57.9	152.2	-167.7	0	0	0	0	0	119
742	T	33.1	Very low	36.4	Very low	139 Å²	139	137.3 Å²	137.3	85%	0.853	80%	0.795	S	S	*	*			trans	55.1	122	146.9	52.2	0	0	0	0	121.9
743	S	30.9	Very low	37.4	Very low	120 Å²	120	132.3 Å²	132.3	84%	0.839	79%	0.792	S	S	*	*				-166.1	-179.5	104.6	-161.3	0	0	0	0	111.4
744	T	31.5	Very low	38.7	Very low	115 Å²	115	133.6 Å²	133.6	71%	0.706	80%	0.798	S	S	*	*			trans	-131.4	160.8	-167.9	66.3	0	0	0	0	114.8
745	K	31	Very low	39.8	Very low	192 Å²	192	130.4 Å²	130.4	84%	0.835	79%	0.794	S	S	*	*			trans	70	171.6	160	-74.2	-179.7	174.7	179.4	0	116.8
746	P	55.7	Low	40	Very low	101 Å²	101	138.2 Å²	138.2	66%	0.656	80%	0.799	S	S	*	*			cis	-141.9	172.2	-48.4	40.7	-24.8	0	0	0	115.9
747	T	34.7	Very low	40.2	Very low	130 Å²	130	131.7 Å²	131.7	80%	0.798	79%	0.792	S	S	*	*			trans	53.8	129.6	145.6	49.3	0	0	0	0	125
748	N	41.7	Very low	40.6	Very low	154 Å²	154	132.7 Å²	132.7	82%	0.824	80%	0.796	S	S	*	*			trans	-10.6	169.4	133.7	-90.2	-4.9	0	0	0	120.8
749	P	59.4	Low	41.1	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	80%	0.802	S	S	*	*			cis	-142.3	172.5	-6.3	35	-14.4	0	0	0	118.2
750	G	35.4	Very low	42.2	Very low	77 Å²	77	131.7 Å²	131.7	79%	0.794	79%	0.793	S	S	*	*			trans	126.9	152.1	130.8	0	0	0	0	0	123.2
751	R	34.9	Very low	43	Very low	262 Å²	262	133.8 Å²	133.8	99%	0.989	79%	0.792	S	S	*	*			trans	88.7	157.6	161.9	-126.1	168.8	-173	164.8	1.4	120.3
752	A	36.8	Very low	43.2	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	80%	0.8	S	S	*	*			trans	-133.2	-164.3	-166.3	0	0	0	0	0	111.5
753	P	54.9	Low	43.3	Very low	123 Å²	123	132.1 Å²	132.1	80%	0.799	80%	0.8	S	S	*	*			cis	-151.1	-137.4	40.6	49.8	-24.3	0	0	0	116.4
754	P	66.6	Low	43.5	Very low	115 Å²	115	138.8 Å²	138.8	75%	0.747	81%	0.807	S	S	*	*			trans	-116.6	-150.3	-146.2	40.5	-14.6	0	0	0	112.9
755	P	60.4	Low	43.5	Very low	121 Å²	121	137 Å²	137	79%	0.786	81%	0.811	S	S	*	*			cis	-124.4	-147.9	4.2	35.7	-9.7	0	0	0	113.2
756	R	36.1	Very low	43.7	Very low	241 Å²	241	134.6 Å²	134.6	91%	0.909	81%	0.813	S	S	*	*			cis	-155.9	-170.9	10.5	-154.2	-178.6	168	163.2	-2	111.2
757	A	35.6	Very low	42.6	Very low	85 Å²	85	134.3 Å²	134.3	70%	0.702	82%	0.819	S	S	*	*			trans	-157.7	-175.4	-171.2	0	0	0	0	0	116.1
758	Q	40	Very low	42.4	Very low	186 Å²	186	134.6 Å²	134.6	87%	0.869	82%	0.816	S	S	*	*			trans	79.4	158.3	166.5	-82.9	-175.6	7.9	0	0	118.4
759	P	47.1	Very low	42	Very low	116 Å²	116	136.2 Å²	136.2	75%	0.753	82%	0.816	S	S	*	*			cis	-139.8	-151.3	39.1	37.5	-12.1	0	0	0	115.7
760	P	56.6	Low	40.7	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	82%	0.819	S	S	*	*				-128.9	178.2	-70.9	39.4	-24.1	0	0	0	115
761	P	48.2	Very low	40.4	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	81%	0.814	S	S	*	*			trans	-111.6	169.6	170.1	40.1	-32.2	0	0	0	115.6
762	A	37.2	Very low	40.1	Very low	110 Å²	110	139.3 Å²	139.3	91%	0.909	81%	0.811	S	S	*	*			trans	75.5	129.5	161.7	0	0	0	0	0	120.2
763	G	33.8	Very low	39.9	Very low	84 Å²	84	141.2 Å²	141.2	87%	0.866	81%	0.809	S	S	*	*			trans	-162.3	131.5	166.9	0	0	0	0	0	109.9
764	R	35.7	Very low	38.6	Very low	260 Å²	260	138.9 Å²	138.9	98%	0.981	81%	0.807	S	S	*	*			trans	-119.5	119.7	-173.2	-164.1	-177.4	-166.3	-179.9	4.4	108.8
765	G	32.5	Very low	36.9	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	81%	0.81	S	S	*	*			trans	-154	144.1	-177.6	0	0	0	0	0	112.2
766	T	33.8	Very low	35.5	Very low	142 Å²	142	144.9 Å²	144.9	87%	0.871	81%	0.814	S	S	*	*			trans	-124.2	122.5	-170	47.8	0	0	0	0	112
767	A	32.6	Very low	35.1	Very low	94 Å²	94	138.2 Å²	138.2	78%	0.777	81%	0.81	S	S	*	*			trans	-176.1	108.3	147.3	0	0	0	0	0	113.5
768	N	32.1	Very low	34.9	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	82%	0.815	S	S	*	*			trans	43.3	125.4	133	-64.8	5.2	0	0	0	123.9
769	F	31.6	Very low	34.3	Very low	189 Å²	189	140.9 Å²	140.9	83%	0.829	81%	0.812	S	S	*	*			trans	63.1	137.2	157.1	-51.7	-61.5	0	0	0	117
770	I	32.3	Very low	33.5	Very low	167 Å²	167	143.3 Å²	143.3	86%	0.856	82%	0.818	S	S	*	*			cis	-133.2	153.1	31.7	-71.5	166.8	0	0	0	111.3
771	V	30.5	Very low	32.5	Very low	113 Å²	113	143.2 Å²	143.2	69%	0.685	82%	0.818	S	S	*	*			trans	-100.6	138.3	179.3	174.8	0	0	0	0	111.8
772	R	28.8	Very low	31.7	Very low	246 Å²	246	143.4 Å²	143.4	93%	0.928	82%	0.819	S	S	*	*			trans	-156	81	153.1	-160.2	174.9	-167.1	176.9	4.1	111.8
773	D	31.4	Very low	31.4	Very low	127 Å²	127	146.3 Å²	146.3	68%	0.679	82%	0.818	S	S	*	*			trans	-66.6	146	172.8	-68	-65.5	0	0	0	112.3
774	G	28.3	Very low	31.1	Very low	74 Å²	74	151.1 Å²	151.1	76%	0.763	82%	0.818	S	S	*	*			trans	-120.9	127.6	160.8	0	0	0	0	0	108.6
775	H	31.3	Very low	30.8	Very low	175 Å²	175	145.2 Å²	145.2	81%	0.81	81%	0.811	S	S	*	*			trans	-109.5	137.6	179.9	-86.7	-72.9	0	0	0	112.4
776	H	29.9	Very low	30.6	Very low	186 Å²	186	147.4 Å²	147.4	86%	0.861	81%	0.808	S	S	*	*			trans	-65.6	147.3	173.9	-77.7	-89.8	0	0	0	112.3
777	A	28.7	Very low	30.4	Very low	101 Å²	101	149.6 Å²	149.6	84%	0.835	81%	0.809	S	S	*	*			trans	-76.9	144.9	158.1	0	0	0	0	0	110.5
778	Q	29.9	Very low	30.2	Very low	171 Å²	171	151.1 Å²	151.1	80%	0.799	81%	0.809	S	S	*	*			trans	-129.4	130.2	169.5	-88.7	-172.2	-31.1	0	0	111.3
779	L	28.2	Very low	30	Very low	156 Å²	156	150 Å²	150	82%	0.817	81%	0.811	S	S	*	*			trans	55	117.2	140.6	-59.6	166.9	0	0	0	119.5
780	L	29.3	Very low	30	Very low	167 Å²	167	150.3 Å²	150.3	87%	0.874	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-103	161.7	151.2	-78.9	169.5	0	0	0	110.1
781	P	36	Very low	29.8	Very low	110 Å²	110	148.8 Å²	148.8	71%	0.714	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-79.1	163.7	-167.4	-13.2	30.6	0	0	0	114.6
782	P	30.8	Very low	30.1	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.7	147.7	177.1	32.1	-35.2	0	0	0	112.8
783	L	31.3	Very low	30.3	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.3	148.8	169.1	-83.4	162.9	0	0	0	111.4
784	Q	28.7	Very low	30.4	Very low	186 Å²	186	151.4 Å²	151.4	87%	0.869	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73	135.8	173.2	-66.8	174.6	-65.3	0	0	110.5
785	V	28.4	Very low	30.5	Very low	136 Å²	136	152.2 Å²	152.2	82%	0.824	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-81.1	127.1	167.3	-178.3	0	0	0	0	107.9
786	V	28.7	Very low	30.8	Very low	122 Å²	122	149.3 Å²	149.3	74%	0.739	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-96	122.2	165.8	176.5	0	0	0	0	107.6
787	E	29.1	Very low	31.3	Very low	189 Å²	189	146.3 Å²	146.3	88%	0.883	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.1	130	171.4	-66.8	-179.9	118.1	0	0	110.2
788	T	28.6	Very low	31.7	Very low	126 Å²	126	151.6 Å²	151.6	77%	0.773	83%	0.826	S	S	*	*			trans	-127.7	123.4	163.4	52.3	0	0	0	0	108.5
789	S	28.1	Very low	31.9	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	83%	0.828	S	S	*	*			trans	-62.7	144.4	-171.1	51.2	0	0	0	0	114.3	T791	S789-T791 PolarHBondContact O-N 3.4Å
790	E	31	Very low	32.5	Very low	196 Å²	196	145.2 Å²	145.2	92%	0.916	83%	0.825	S	S	*	*			trans	-63.4	130.2	169.8	-65.5	-172.1	116.7	0	0	112.4
791	T	28.1	Very low	33.1	Very low	135 Å²	135	144.6 Å²	144.6	83%	0.828	81%	0.811	S	S	*	*			trans	-131.6	120	150.4	48.4	0	0	0	0	108.5	S789 E793	S789-T791 PolarHBondContact O-N 3.4Å; T791-E793 PolarHBondContact O-N 2.83Å
792	S	37.7	Very low	33.5	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	79%	0.785	S	S	*	*			trans	-77.8	111.4	-169.4	151.9	0	0	0	0	113.2
793	E	33.3	Very low	34.2	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	78%	0.781	S	S	*	*			trans	-132.7	107.1	151.7	-75.1	-147.9	107.4	0	0	112.9	T791	T791-E793 PolarHBondContact O-N 2.83Å
794	R	33.5	Very low	34.8	Very low	233 Å²	233	136.1 Å²	136.1	88%	0.879	77%	0.766	S	S	*	*			trans	42.6	92.2	142.1	-156.4	177.8	-160.3	174.7	4.8	118.5
795	A	30.2	Very low	35.5	Very low	91 Å²	91	131.4 Å²	131.4	75%	0.752	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59.2	140.9	168.1	0	0	0	0	0	113.3
796	P	37.1	Very low	35.9	Very low	114 Å²	114	130.8 Å²	130.8	74%	0.74	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-73	159	167.7	31.8	-34.4	0	0	0	111.4
797	P	40.2	Very low	36.4	Very low	124 Å²	124	133.1 Å²	133.1	81%	0.805	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.7	148.7	-179	29.6	-35.5	0	0	0	112.3	A799	P797-A799 PolarHBondContact O-N 3.3Å
798	F	36.8	Very low	36.7	Very low	212 Å²	212	133.5 Å²	133.5	93%	0.93	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-55	118.9	170.5	-74.3	-94.3	0	0	0	110.7	A800	F798-A800 PolarHBondContact O-N 3.16Å
799	A	34.3	Very low	37	Very low	102 Å²	102	133.1 Å²	133.1	84%	0.843	76%	0.756	S	S	*	*			trans	-65.9	113.8	172.3	0	0	0	0	0	109.6	P797	P797-A799 PolarHBondContact O-N 3.3Å
800	A	42.3	Very low	37.4	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.7	142.1	174	0	0	0	0	0	110.3	F798	F798-A800 PolarHBondContact O-N 3.16Å
801	R	41.6	Very low	37.5	Very low	153 Å²	153	133.9 Å²	133.9	58%	0.577	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-54.9	128	177.6	-162.3	-174.8	-150.7	-164	5.9	109.4	Y676	Y676-R801 HydrophobicContact CE1-CG 4.42Å
802	P	44.2	Very low	37.8	Very low	24 Å²	24	132 Å²	132	16%	0.156	75%	0.748	C	S	.	*	P	Polyproline II helix	trans	-62.7	137.4	-175.8	23.3	-32.9	0	0	0	111.1	Y676	Y676-P802 PolarHBondContact OH-O 3.04Å
803	P	44.5	Very low	38	Very low	113 Å²	113	131.7 Å²	131.7	73%	0.734	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-65.4	147.5	177.3	28.7	-34.7	0	0	0	110.4
804	P	44.6	Very low	38.4	Very low	92 Å²	92	126.9 Å²	126.9	60%	0.597	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.2	150.2	176.5	28.1	-35.1	0	0	0	111.1
805	P	42.7	Very low	38.5	Very low	88 Å²	88	120.6 Å²	120.6	57%	0.571	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-62.2	145.8	176.9	27	-34.6	0	0	0	111	L807	P805-L807 PolarHBondContact O-N 3.34Å
806	P	37.9	Very low	38.8	Very low	122 Å²	122	125.2 Å²	125.2	79%	0.792	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-63.4	132.9	177.5	26.4	-33.8	0	0	0	110.6	K808	P806-K808 PolarHBondContact O-N 2.91Å; P806-K808 VanDerWaalsContact O-N 3.09Å
807	L	37.8	Very low	38.7	Very low	171 Å²	171	125.3 Å²	125.3	90%	0.895	74%	0.744	S	S	*	*			trans	-53.9	115.5	176.8	-73.1	166	0	0	0	110.4	P805	P805-L807 PolarHBondContact O-N 3.34Å
808	K	37.1	Very low	38.3	Very low	197 Å²	197	127.7 Å²	127.7	86%	0.857	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-60.8	126.6	166.3	-71.6	-178.8	179.6	175.3	0	107.9	P806 K810	P806-K808 PolarHBondContact O-N 2.91Å; P806-K808 VanDerWaalsContact O-N 3.09Å; K808-K810 PolarHBondContact O-N 3.13Å
809	P	34.1	Very low	38.5	Very low	118 Å²	118	123.6 Å²	123.6	77%	0.766	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.6	141	175.6	25.6	-33.1	0	0	0	109.7
810	K	36.6	Very low	38.4	Very low	196 Å²	196	124.5 Å²	124.5	85%	0.852	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-55.6	135.6	168.3	-76	-175.9	174.5	-177.8	0	108.6	K808 S812	K808-K810 PolarHBondContact O-N 3.13Å; K810-S812 PolarHBondContact O-N 3.04Å
811	P	33.9	Very low	38.2	Very low	127 Å²	127	129.3 Å²	129.3	83%	0.825	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-59.5	128	169.6	25.9	-32.8	0	0	0	108.9
812	S	34.4	Very low	38.1	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-67.4	143.9	174.3	-172.1	0	0	0	0	109.7	K810 A814	K810-S812 PolarHBondContact O-N 3.04Å; S812-A814 PolarHBondContact O-N 3.18Å
813	A	41.1	Very low	37.9	Very low	114 Å²	114	137.8 Å²	137.8	94%	0.942	79%	0.789	S	S	*	*	S	Bend	trans	-76.5	41	-176.5	0	0	0	0	0	113.3
814	A	41.1	Very low	37.7	Very low	86 Å²	86	136.7 Å²	136.7	71%	0.711	79%	0.79	S	S	*	*			trans	-143.4	34.1	-167.5	0	0	0	0	0	113.9	S812	S812-A814 PolarHBondContact O-N 3.18Å
815	S	36.5	Very low	37.8	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	80%	0.801	S	S	*	*			trans	-156.2	53.7	174.9	52.8	0	0	0	0	114.2
816	Q	36.8	Very low	38	Very low	189 Å²	189	138.5 Å²	138.5	88%	0.883	81%	0.809	S	S	*	*			trans	-73.2	131.2	162.5	-74.5	-173.6	-11.9	0	0	110.3	L818	Q816-L818 PolarHBondContact O-N 2.89Å
817	P	33.1	Very low	38.2	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	81%	0.806	S	S	*	*			trans	-67.7	126.2	164.6	-14.1	29.1	0	0	0	109.6	V819	P817-V819 PolarHBondContact O-N 2.89Å; P817-V819 VanDerWaalsContact O-N 3.16Å
818	L	33.9	Very low	38.9	Very low	174 Å²	174	136.1 Å²	136.1	91%	0.911	80%	0.804	S	S	*	*			trans	-66.2	112.2	173.9	-82.8	160.4	0	0	0	110.3	Q816	Q816-L818 PolarHBondContact O-N 2.89Å
819	V	39.6	Very low	39.2	Very low	125 Å²	125	137 Å²	137	76%	0.758	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70.2	129.1	167.1	-179.6	0	0	0	0	108.3	P817 Q821	P817-V819 PolarHBondContact O-N 2.89Å; P817-V819 VanDerWaalsContact O-N 3.16Å; V819-Q821 PolarHBondContact O-N 2.68Å
820	P	32.8	Very low	39.4	Very low	121 Å²	121	137.9 Å²	137.9	79%	0.786	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-61.6	121.4	179.1	-23.5	34	0	0	0	111.7
821	Q	37.3	Very low	39.6	Very low	192 Å²	192	134.8 Å²	134.8	90%	0.897	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71.2	132.4	171.8	-71.3	-167.3	-5.6	0	0	110.4	V819	V819-Q821 PolarHBondContact O-N 2.68Å
822	R	40.6	Very low	39.9	Very low	237 Å²	237	135.3 Å²	135.3	89%	0.894	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.1	134.9	173.8	-156	179.9	-161.3	-177.3	5.2	108.9
823	P	39.1	Very low	40.2	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-58.2	147	176.6	-25.5	34.9	0	0	0	112.6
824	A	40.5	Very low	40.2	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-68.6	151.1	174.9	0	0	0	0	0	111.6
825	P	47.7	Very low	40.1	Very low	127 Å²	127	142.6 Å²	142.6	83%	0.825	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-62.4	149	171.4	-19.4	32.4	0	0	0	112
826	A	46.3	Very low	40.3	Very low	90 Å²	90	145.6 Å²	145.6	74%	0.744	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-68.2	150.4	168.9	0	0	0	0	0	111
827	P	42.5	Very low	40.6	Very low	114 Å²	114	142.2 Å²	142.2	74%	0.74	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-64.4	152.7	173.6	28.8	-35.3	0	0	0	111.4
828	P	51.2	Low	41.2	Very low	130 Å²	130	144.4 Å²	144.4	84%	0.844	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-69.6	154.5	-178.1	29.6	-35.7	0	0	0	112.9
829	V	43.5	Very low	41.9	Very low	214 Å²	214	141.7 Å²	141.7	100%	1.297	85%	0.846	S	S	*	*			trans	-113.9	0	166.5	179.7	0	0	0	0	107.6

Retrieved 829 of 829 residues in 3353.8 ms (Link to these results)

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