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Isoform 17 of Protocadherin-15 AlphaSync

Canonical isoform description: Calcium-dependent cell-adhesion protein. Required for inner ear neuroepithelial cell elaboration and cochlear function. Probably involved in the maintenance of normal retinal function.

AlphaFold DB , UniProt , Accession Q99PJ1-17 (canonical: Q99PJ1), Species MOUSE (Mus musculus, Mouse), Gene Pcdh15, Length 981 aa.

						>PCD15_MOUSE|Q99PJ1-17|Pcdh15
MFLQFAVWKCLPHGILIASLLVVSWGQYDDDCKLARGGPPATIVAIDEESRNGTILVDNMLIKGTAGGPDPTIELSLKDNVDYWVLLDPVKQMLFLNSTGRVLDRDPPMNIHSIVVQVQCVNKKVGTVIYHEVRIVVRDRNDNSPTFKHESYYATVNELTPVGTTIFTGFSGDNGATDIDDGPNGQIEYVIQYNPEDPTSNDTFEIPLMLTGNVVLRKRLNYEDKTRYYVIIQANDRAQNLNERRTTTTTLTVDVLDGDDLGPMFLPCVLVPNTRDCRPLTYQAAIPELRTPEELNPILVTPPIQAIDQDRNIQPPSDRPGILYSILVGTPEDYPRFFHMHPRTAELTLLEPVNRDFHQKFDLVIKAEQDNGHPLPAFASLHIEILDENNQSPYFTMPSYQGYILESAPVGATISESLNLTTPLRIVALDKDIEDTKDPELHLFLNDYTSVFTVTPTGITRYLTLLQPVDREEQQTYTFLITAFDGVQESEPVVVNIRVMDANDNTPTFPEISYDVYVYTDMSPGDSVIQLTAVDADEGSNGEISYEILVGGKGDFVINKTTGLVSIAPGVELIVGQTYALTVQASDNAPPAERRHSICTVYIEVLPPNNQSPPRFPQLMYSLEVSEAMRIGAILLNLQATDREGDPITYAIENGDPQRVFNLSETTGILSLGKALDRESTDRYILIVTASDGRPDGVEPEKVKKPKVEIREPSEEEVVVTVEKPPAAEPTYPTWKRARIFPMIFKKVRGLAEKRGIDLEGEEWRRRLDEEDKDYLQLTLDQEEATESTVESEEESSDYTEYTETESEFSESETTEESESETPSEEAEESSTPESEESESTESEGEKARKNIVLARRRPVVEEIQEVKGKREEPPVEEEEEPPLEEEERAEEGEESEAAPMDESTDLEAQDVPEEGSAESVSMERGVESEESESELSSSSSTSESLSGGPWGFQVPEYDRRKDEEPKKSPGANSEGYNTAL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	50.7	Low	38.3	Very low	230 Å²	230	154.8 Å²	154.8	100%	1.133	77%	0.772	S	S	*	*				0	87.6	0	-98.4	168.2	172.9	0	0	106.5
2	F	46.3	Very low	38.4	Very low	187 Å²	187	150.2 Å²	150.2	82%	0.82	76%	0.761	S	S	*	*				72.1	87.1	103.2	-79.1	-73.2	0	0	0	110
3	L	36.7	Very low	38.5	Very low	135 Å²	135	150 Å²	150	71%	0.707	76%	0.755	S	S	*	*				71.2	134.2	95.4	-117.9	90	0	0	0	110.5
4	Q	37.3	Very low	38.5	Very low	151 Å²	151	143.9 Å²	143.9	71%	0.706	75%	0.749	S	S	*	*				175.7	139.1	86.6	-90.2	-164.4	-14.3	0	0	113.3
5	F	38.1	Very low	39	Very low	168 Å²	168	144 Å²	144	74%	0.737	75%	0.749	S	S	*	*			trans	61.5	146.6	134.2	-65.1	-57.3	0	0	0	120.8
6	A	40.5	Very low	39.3	Very low	74 Å²	74	141.1 Å²	141.1	61%	0.612	73%	0.734	S	S	*	*			cis	-173.6	141.8	0	0	0	0	0	0	109.1
7	V	35.8	Very low	39.8	Very low	127 Å²	127	139.1 Å²	139.1	77%	0.77	72%	0.723	S	S	*	*				60	121.9	113.3	-170.7	0	0	0	0	114.6
8	W	33.8	Very low	40.1	Very low	213 Å²	213	135 Å²	135	81%	0.807	71%	0.713	S	S	*	*			cis	176.6	154.1	46.2	-149.9	-11.2	0	0	0	112.4
9	K	33.1	Very low	40.4	Very low	162 Å²	162	130.6 Å²	130.6	70%	0.704	69%	0.694	S	S	*	*			trans	85.3	130.7	154.9	-56	-179.1	-177.6	-177.6	0	119.2
10	C	35.4	Very low	40.5	Very low	101 Å²	101	130 Å²	130	68%	0.682	69%	0.69	S	S	*	*			cis	-167.3	135.6	-5.3	-95.6	0	0	0	0	108.9
11	L	33.1	Very low	40.5	Very low	155 Å²	155	129.8 Å²	129.8	81%	0.812	69%	0.689	S	S	*	*	S	Bend	trans	41.5	121.3	162.1	-69.5	100.3	0	0	0	120
12	P	39.5	Very low	40	Very low	99 Å²	99	124 Å²	124	64%	0.643	67%	0.666	S	S	*	*			cis	-127.9	102.4	38.9	34.4	-16.1	0	0	0	111.7
13	H	40.2	Very low	39.8	Very low	148 Å²	148	119.8 Å²	119.8	69%	0.685	66%	0.656	S	S	*	*			trans	-119.7	28.2	-168.5	-73.9	2.6	0	0	0	114.1
14	G	39	Very low	39.9	Very low	65 Å²	65	116.7 Å²	116.7	67%	0.67	65%	0.645	S	S	*	*	S	Bend	trans	-100.9	-19.3	173.8	0	0	0	0	0	115.4
15	I	45	Very low	40	Very low	145 Å²	145	120 Å²	120	74%	0.744	65%	0.652	S	S	*	*	S	Bend	trans	-113.1	-17.8	-171.4	-64.8	168.8	0	0	0	112.3	S19	I15-S19 PolarHBondContact O-N 2.82Å; I15-S19 PolarHBondContact O-OG 3.39Å
16	L	44.8	Very low	40.3	Very low	98 Å²	98	114 Å²	114	51%	0.513	64%	0.637	S	S	.	*	H	α-helix	trans	-82.1	-21.8	179.1	-92.7	150.7	0	0	0	114.4	S19 L20	L16-S19 VanDerWaalsContact CA-OG 3.22Å; L16-S19 WeakPolarHBondContact CA-OG 3.47Å; L16-S19 PolarHBondContact O-OG 3.22Å; L16-L20 WeakPolarHBondContact O-CB 2.9Å; L16-L20 WeakPolarHBondContact O-CD1 3.3Å; L16-L20 PolarHBondContact O-N 3.11Å
17	I	47.4	Very low	40.7	Very low	107 Å²	107	117.5 Å²	117.5	55%	0.549	64%	0.641	S	S	.	*	H	α-helix	trans	-88.4	-29.3	179.4	-58.9	174.9	0	0	0	111.4	S19 L21	I17-S19 VanDerWaalsContact C-N 3.33Å; I17-L21 HydrophobicContact CG2-CD1 4.18Å; I17-L21 PolarHBondContact O-N 3.49Å
18	A	44.9	Very low	41.5	Very low	65 Å²	65	117.3 Å²	117.3	54%	0.537	63%	0.627	S	S	.	*	H	α-helix	trans	-70.7	-29.4	167.5	0	0	0	0	0	112.1	V22	A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.9Å
19	S	45.8	Very low	43	Very low	51 Å²	51	111.5 Å²	111.5	36%	0.357	61%	0.612	S	S	.	*	H	α-helix	trans	-80.7	-29.4	174.3	39.5	0	0	0	0	113.2	I15 L16 I17 V23	I15-S19 PolarHBondContact O-N 2.82Å; I15-S19 PolarHBondContact O-OG 3.39Å; L16-S19 VanDerWaalsContact CA-OG 3.22Å; L16-S19 WeakPolarHBondContact CA-OG 3.47Å; L16-S19 PolarHBondContact O-OG 3.22Å; I17-S19 VanDerWaalsContact C-N 3.33Å; S19-V23 VanDerWaalsContact O-CB 3.28Å; S19-V23 WeakPolarHBondContact O-CB 3.18Å; S19-V23 WeakPolarHBondContact O-CG2 3.36Å; S19-V23 PolarHBondContact O-N 2.9Å
20	L	42.6	Very low	45.3	Very low	118 Å²	118	106.4 Å²	106.4	62%	0.618	59%	0.592	S	S	*	*	H	α-helix	trans	-80.2	-21.8	175.7	-82.1	157.6	0	0	0	114.7	L16	L16-L20 WeakPolarHBondContact O-CB 2.9Å; L16-L20 WeakPolarHBondContact O-CD1 3.3Å; L16-L20 PolarHBondContact O-N 3.11Å
21	L	39.7	Very low	47.7	Very low	126 Å²	126	102.6 Å²	102.6	66%	0.66	57%	0.565	S	S	*	*	H	α-helix	trans	-89	-21	173.2	-81.8	159.4	0	0	0	113.8	I17	I17-L21 HydrophobicContact CG2-CD1 4.18Å; I17-L21 PolarHBondContact O-N 3.49Å
22	V	42.1	Very low	50.5	Low	108 Å²	108	95.2 Å²	95.2	66%	0.655	53%	0.526	S	S	*	.	H	α-helix	trans	-81.5	-26.5	169.7	175.3	0	0	0	0	111.5	A18 S24 G26	A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.9Å; V22-S24 VanDerWaalsContact C-N 3.34Å; V22-S24 PolarHBondContact O-N 2.78Å; V22-G26 PolarHBondContact O-N 2.63Å
23	V	41	Very low	52.9	Low	100 Å²	100	94.3 Å²	94.3	61%	0.606	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.6	-179.2	166.9	0	0	0	0	113.8	S19	S19-V23 VanDerWaalsContact O-CB 3.28Å; S19-V23 WeakPolarHBondContact O-CB 3.18Å; S19-V23 WeakPolarHBondContact O-CG2 3.36Å; S19-V23 PolarHBondContact O-N 2.9Å
24	S	39.3	Very low	55.3	Low	70 Å²	70	89 Å²	89	49%	0.49	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-11.2	177.6	151	0	0	0	0	114.6	V22	V22-S24 VanDerWaalsContact C-N 3.34Å; V22-S24 PolarHBondContact O-N 2.78Å
25	W	38.2	Very low	57.7	Low	221 Å²	221	89 Å²	89	84%	0.837	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-12.3	178.6	-77.6	26.2	0	0	0	113.2
26	G	44.6	Very low	59.7	Low	42 Å²	42	85.3 Å²	85.3	43%	0.433	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-13.9	178.3	0	0	0	0	0	115.7	V22 Y28	V22-G26 PolarHBondContact O-N 2.63Å; G26-Y28 VanDerWaalsContact C-N 3.33Å; G26-Y28 PolarHBondContact O-N 3.1Å
27	Q	49.9	Very low	61.4	Low	147 Å²	147	83.9 Å²	83.9	69%	0.687	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-19.5	-176.6	-99.5	173	-34.2	0	0	114.3
28	Y	52.3	Low	63.1	Low	123 Å²	123	81.9 Å²	81.9	48%	0.482	47%	0.474	S	S	.	.	S	Bend	trans	-88.1	-19.6	-177.3	-67.5	-69.4	0	0	0	113.8	G26 D30 N122 K124	G26-Y28 VanDerWaalsContact C-N 3.33Å; G26-Y28 PolarHBondContact O-N 3.1Å; Y28-D30 VanDerWaalsContact C-N 3.25Å; Y28-D30 PolarHBondContact O-N 2.79Å; Y28-N122 PolarHBondContact O-ND2 3.16Å; Y28-N122 VanDerWaalsContact O-ND2 3.11Å; Y28-K124 HydrophobicContact CD1-CD 3.23Å; Y28-K124 VanDerWaalsContact CD1-NZ 3.32Å; Y28-K124 HydrophobicContact CE1-CD 3.65Å; Y28-K124 HydrophobicContact CG-CD 4.23Å
29	D	64.2	Low	65.1	Low	91 Å²	91	82.9 Å²	82.9	49%	0.487	47%	0.474	S	S	.	.	S	Bend	trans	-84.9	-1.1	178.5	-159.5	27	0	0	0	112.7	K33	D29-K33 WeakPolarHBondContact O-CE 3.13Å; D29-K33 PolarHBondContact O-NZ 3.08Å
30	D	82.8	Confident	67.1	Low	54 Å²	54	85.3 Å²	85.3	29%	0.289	49%	0.489	S	S	.	.	S	Bend	trans	-99.7	-18.1	-176.8	-101.6	15.2	0	0	0	113.8	Y28 K33 K63	Y28-D30 VanDerWaalsContact C-N 3.25Å; Y28-D30 PolarHBondContact O-N 2.79Å; D30-K33 WeakPolarHBondContact O-CB 3.48Å; D30-K33 PolarHBondContact O-N 2.98Å; D30-K33 VanDerWaalsContact O-N 3.08Å; D30-K33 IonicContact OD1-NZ 3.9Å; D30-K33 PolarHBondContact OD1-NZ 2.7Å; D30-K63 HydrophobicContact CB-CD 4.08Å; D30-K63 WeakPolarHBondContact O-CB 3.48Å; D30-K63 WeakPolarHBondContact O-CD 3.43Å; D30-K63 IonicContact OD2-NZ 3.72Å; D30-K63 PolarHBondContact OD2-NZ 3.22Å
31	D	86.4	Confident	69.4	Low	21 Å²	21	80.4 Å²	80.4	11%	0.112	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	141.1	173.7	-82	-3.1	0	0	0	109.8	K33 G64 T72 I73 N122 K124	D31-K33 VanDerWaalsContact C-N 3.32Å; D31-G64 WeakPolarHBondContact OD1-CA 3.24Å; D31-T72 WeakPolarHBondContact OD2-CB 3.42Å; D31-T72 PolarHBondContact OD2-OG1 2.8Å; D31-I73 HydrophobicContact CB-CG2 3.83Å; D31-N122 WeakPolarHBondContact CB-ND2 3.42Å; D31-N122 PolarHBondContact O-ND2 2.9Å; D31-N122 VanDerWaalsContact O-ND2 3.11Å; D31-K124 IonicContact OD2-NZ 3.12Å
32	C	90.1	Very high	71.9	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	74	-7.8	-166	-67.7	0	0	0	0	117.7	K63 I73 C120 N122 I129 H131	C32-K63 PolarHBondContact N-O 3.46Å; C32-I73 VanDerWaalsContact SG-CG2 3.57Å; C32-C120 WeakPolarHBondContact CA-SG 3.31Å; C32-C120 HydrophobicContact CB-CB 3.61Å; C32-C120 WeakPolarHBondContact CB-SG 3.46Å; C32-C120 WeakPolarHBondContact SG-CB 3.44Å; C32-C120 PolarHBondContact SG-O 3.28Å; C32-C120 CovalentContact SG-SG 2.03Å; C32-C120 PolarHBondContact SG-SG 3.38Å; C32-N122 HydrophobicContact CB-CB 4.5Å; C32-N122 PolarHBondContact SG-N 3.32Å; C32-N122 VanDerWaalsContact SG-N 3.37Å; C32-I129 HydrophobicContact CB-CB 4.2Å; C32-I129 HydrophobicContact CB-CD1 3.88Å; C32-I129 HydrophobicContact CB-CG1 4.19Å; C32-H131 PolarHBondContact O-CE1 3.22Å; C32-H131 PolarHBondContact O-NE2 3.12Å
33	K	91.3	Very high	74.3	Confident	80 Å²	80	75.1 Å²	75.1	35%	0.348	43%	0.434	S	S	.	.	S	Bend	trans	-79.6	156.1	171.1	-60.8	179.5	-168.3	155	0	110.9	D29 D30 D31 A35 K63 I129	D29-K33 WeakPolarHBondContact O-CE 3.13Å; D29-K33 PolarHBondContact O-NZ 3.08Å; D30-K33 WeakPolarHBondContact O-CB 3.48Å; D30-K33 PolarHBondContact O-N 2.98Å; D30-K33 VanDerWaalsContact O-N 3.08Å; D30-K33 IonicContact OD1-NZ 3.9Å; D30-K33 PolarHBondContact OD1-NZ 2.7Å; D31-K33 VanDerWaalsContact C-N 3.32Å; K33-A35 PolarHBondContact O-N 3.31Å; K33-K63 WeakPolarHBondContact O-CB 3.21Å; K33-K63 WeakPolarHBondContact O-CG 3.32Å; K33-K63 PolarHBondContact O-N 3.4Å; K33-I129 HydrophobicContact CG-CD1 3.97Å
34	L	90.2	Very high	76.8	Confident	38 Å²	38	72 Å²	72	20%	0.199	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-64.1	133.5	173.5	-70.1	169.2	0	0	0	110.5	R36	L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 HydrophobicContact CB-CG 4.22Å; L34-R36 HydrophobicContact CD2-CG 4.35Å
35	A	88.4	Confident	79.4	Confident	63 Å²	63	70.9 Å²	70.9	52%	0.521	41%	0.409	S	S	.	.	S	Bend	trans	-85.8	-1.1	170.9	0	0	0	0	0	112.4	K33 L61 K63	K33-A35 PolarHBondContact O-N 3.31Å; A35-L61 HydrophobicContact CB-CB 4.4Å; A35-L61 VanDerWaalsContact CB-O 3.29Å; A35-L61 WeakPolarHBondContact CB-O 3.22Å; A35-L61 PolarHBondContact N-O 2.96Å; A35-K63 HydrophobicContact CB-CG 3.86Å
36	R	87.6	Confident	82.2	Confident	69 Å²	69	61 Å²	61	26%	0.26	37%	0.373	S	S	.	.	S	Bend	trans	-107.1	155.4	175.6	64.5	173.4	-178.2	79.6	-5.5	112	L34 P39 A41 T42 L61	L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 HydrophobicContact CB-CG 4.22Å; L34-R36 HydrophobicContact CD2-CG 4.35Å; R36-P39 PolarHBondContact NH1-O 3.15Å; R36-P39 PolarHBondContact NH2-O 3.04Å; R36-A41 PolarHBondContact NH2-O 3.35Å; R36-T42 PolarHBondContact NH2-OG1 2.89Å; R36-L61 HydrophobicContact CB-CB 4.41Å; R36-L61 HydrophobicContact CB-CD1 3.95Å; R36-L61 HydrophobicContact CG-CB 4.48Å
37	G	80.7	Confident	84.5	Confident	68 Å²	68	60.7 Å²	60.7	70%	0.701	36%	0.362	S	S	*	.			trans	-76.2	170.9	161.3	0	0	0	0	0	112
38	G	82.8	Confident	86.6	Confident	65 Å²	65	54 Å²	54	67%	0.67	33%	0.33	S	S	*	.	S	Bend	trans	104.3	-173.9	177.3	0	0	0	0	0	114.1
39	P	87	Confident	88.6	Confident	85 Å²	85	52.6 Å²	52.6	55%	0.552	33%	0.328	S	S	*	.			trans	-64.9	156.9	-178.3	27.7	-34.4	0	0	0	111.8	R36 A41	R36-P39 PolarHBondContact NH1-O 3.15Å; R36-P39 PolarHBondContact NH2-O 3.04Å; P39-A41 VanDerWaalsContact C-N 3.26Å; P39-A41 PolarHBondContact O-N 3.36Å
40	P	88.1	Confident	90	Very high	102 Å²	102	49.3 Å²	49.3	66%	0.662	31%	0.312	S	S	*	.	S	Bend	trans	-65.1	-30.9	-178.8	26.2	-34.3	0	0	0	112.6
41	A	90.2	Very high	90.6	Very high	15 Å²	15	57 Å²	57	12%	0.124	34%	0.337	C	S	.	.	S	Bend	trans	-76	138.7	176.2	0	0	0	0	0	111.1	R36 P39 I43 E132	R36-A41 PolarHBondContact NH2-O 3.35Å; P39-A41 VanDerWaalsContact C-N 3.26Å; P39-A41 PolarHBondContact O-N 3.36Å; A41-I43 HydrophobicContact CB-CG1 4.29Å; A41-E132 CarbonylContact C-O 3.57Å; A41-E132 WeakPolarHBondContact CA-O 3.35Å; A41-E132 HydrophobicContact CB-CB 4.42Å
42	T	92.3	Very high	90.9	Very high	15 Å²	15	59.7 Å²	59.7	9%	0.092	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112.8	166.9	-62.5	0	0	0	0	107.6	R36 V44 V57 M60 E132 V133 R134	R36-T42 PolarHBondContact NH2-OG1 2.89Å; T42-V44 HydrophobicContact CG2-CG1 4.37Å; T42-V57 HydrophobicContact CG2-CG1 4.15Å; T42-V57 HydrophobicContact CG2-CG2 3.99Å; T42-M60 HydrophobicContact CG2-SD 4.44Å; T42-E132 PolarHBondContact N-O 3.37Å; T42-V133 CarbonylContact O-C 3.57Å; T42-V133 VanDerWaalsContact O-CA 3.29Å; T42-V133 WeakPolarHBondContact O-CA 3.23Å; T42-R134 PolarHBondContact O-N 3.11Å
43	I	92.7	Very high	91.1	Very high	109 Å²	109	61.5 Å²	61.5	56%	0.559	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.2	-178.2	-53.2	175.9	0	0	0	108.2	A41 R134 V136	A41-I43 HydrophobicContact CB-CG1 4.29Å; I43-R134 WeakPolarHBondContact CA-O 3.3Å; I43-R134 HydrophobicContact CG1-CB 4.3Å; I43-R134 HydrophobicContact CG2-CB 4.5Å; I43-V136 HydrophobicContact CG2-CG2 4.36Å
44	V	93.8	Very high	91.3	Very high	35 Å²	35	59.7 Å²	59.7	21%	0.212	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.6	178.7	-65.1	0	0	0	0	109.6	T42 L56 V57 R134 I135 V136	T42-V44 HydrophobicContact CG2-CG1 4.37Å; V44-L56 WeakPolarHBondContact CG1-O 2.99Å; V44-L56 WeakPolarHBondContact CG2-O 3.36Å; V44-V57 HydrophobicContact CG1-CG2 4.08Å; V44-V57 HydrophobicContact CG2-CG2 4.3Å; V44-R134 PolarHBondContact N-O 3.45Å; V44-I135 HydrophobicContact CG2-CB 4.2Å; V44-I135 HydrophobicContact CG2-CG1 3.67Å; V44-I135 HydrophobicContact CG2-CG2 4.29Å; V44-I135 CarbonylContact O-C 3.58Å; V44-I135 WeakPolarHBondContact O-CA 3.37Å; V44-V136 PolarHBondContact O-N 2.99Å
45	A	94.8	Very high	91.5	Very high	45 Å²	45	62 Å²	62	37%	0.372	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.6	178.4	0	0	0	0	0	110.3	V136 R138	A45-V136 VanDerWaalsContact CA-O 3.25Å; A45-V136 WeakPolarHBondContact CA-O 3.26Å; A45-V136 HydrophobicContact CB-CB 4.28Å; A45-R138 HydrophobicContact CB-CG 4.3Å; A45-R138 VanDerWaalsContact CB-NH1 3.29Å; A45-R138 PolarHBondContact O-NH1 3.38Å
46	I	95.3	Very high	91.8	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.4	177.4	59.7	165.8	0	0	0	109.3	L56 L96 L103 I135 V136 R138	I46-L56 HydrophobicContact CD1-CD2 3.6Å; I46-L56 HydrophobicContact CG1-CD2 4.43Å; I46-L56 HydrophobicContact CG2-CD2 3.96Å; I46-L96 HydrophobicContact CD1-CD1 4.5Å; I46-L96 HydrophobicContact CD1-CD2 4.24Å; I46-L103 HydrophobicContact CD1-CD2 3.41Å; I46-L103 VanDerWaalsContact CD1-CD2 3.41Å; I46-L103 HydrophobicContact CG1-CD2 4.28Å; I46-I135 HydrophobicContact CD1-CG2 3.9Å; I46-I135 HydrophobicContact CG1-CG2 3.67Å; I46-V136 PolarHBondContact N-O 3.5Å; I46-R138 PolarHBondContact O-N 3.02Å
47	D	94.1	Very high	92.2	Very high	36 Å²	36	56.6 Å²	56.6	19%	0.193	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.1	172.3	-58.3	-11.9	0	0	0	108.8	S50 R138 R140	D47-S50 WeakPolarHBondContact O-CB 3.18Å; D47-S50 PolarHBondContact O-OG 2.85Å; D47-R138 IonicContact OD1-CZ 2.89Å; D47-R138 IonicContact OD1-NE 3.89Å; D47-R138 PolarHBondContact OD1-NE 3.01Å; D47-R138 IonicContact OD1-NH2 3.97Å; D47-R138 PolarHBondContact OD1-NH2 3.14Å; D47-R140 HydrophobicContact CB-CG 4.04Å; D47-R140 IonicContact OD2-CZ 3.97Å; D47-R140 IonicContact OD2-NE 3.45Å; D47-R140 PolarHBondContact OD2-NE 3.05Å; D47-R140 VanDerWaalsContact OD2-NE 3.1Å; D47-R140 IonicContact OD2-NH2 2.76Å; D47-R140 PolarHBondContact OD2-NH2 3.46Å
48	E	94.5	Very high	92.8	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.028	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	162.9	165.7	77.1	-175.4	97.3	0	0	112.1	S50 L103 R105 V137 R138 D139 R140	E48-S50 PolarHBondContact O-N 2.75Å; E48-L103 CarbonylContact C-O 3.43Å; E48-L103 WeakPolarHBondContact CA-O 3.42Å; E48-L103 VanDerWaalsContact CB-O 3.28Å; E48-L103 WeakPolarHBondContact CB-O 3.34Å; E48-R105 HydrophobicContact CB-CB 3.96Å; E48-R105 HydrophobicContact CG-CB 4.49Å; E48-R105 WeakPolarHBondContact OE2-CB 3.28Å; E48-R105 PolarHBondContact OE2-N 3.09Å; E48-V137 HydrophobicContact CB-CG1 3.64Å; E48-R138 PolarHBondContact N-O 2.98Å; E48-D139 WeakPolarHBondContact OE1-CA 3.33Å; E48-R140 HydrophobicContact CG-CB 3.85Å; E48-R140 HydrophobicContact CG-CG 4.19Å; E48-R140 PolarHBondContact OE1-N 2.8Å
49	E	93.1	Very high	93.3	Very high	94 Å²	94	59.1 Å²	59.1	44%	0.439	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	16.8	-174.5	-53.9	-148.7	139.5	0	0	115.1	R51 V102 L103	E49-R51 PolarHBondContact O-N 2.84Å; E49-V102 HydrophobicContact CG-CB 4.35Å; E49-L103 PolarHBondContact N-O 3.21Å
50	S	94.5	Very high	93.5	Very high	21 Å²	21	55.1 Å²	55.1	15%	0.147	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-52.9	135.5	178.1	-80.6	0	0	0	0	110.9	D47 E48 L96 S98	D47-S50 WeakPolarHBondContact O-CB 3.18Å; D47-S50 PolarHBondContact O-OG 2.85Å; E48-S50 PolarHBondContact O-N 2.75Å; S50-L96 VanDerWaalsContact O-CD2 3.28Å; S50-L96 WeakPolarHBondContact O-CD2 3.45Å; S50-S98 PolarHBondContact O-OG 2.85Å
51	R	94.2	Very high	93.8	Very high	215 Å²	215	53.9 Å²	53.9	81%	0.811	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-57.5	145.2	-174.9	-62.1	-179.2	-177	-178.8	1	111.1	E49 G53 T54	E49-R51 PolarHBondContact O-N 2.84Å; R51-G53 PolarHBondContact O-N 3.43Å; R51-T54 WeakPolarHBondContact O-CB 3.23Å; R51-T54 PolarHBondContact O-N 2.76Å; R51-T54 PolarHBondContact O-OG1 3.34Å
52	N	94.2	Very high	93.9	Very high	78 Å²	78	53.5 Å²	53.5	42%	0.417	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	135.5	174.3	177	67.1	0	0	0	111.3	L96 N97 S98 T99	N52-L96 PolarHBondContact OD1-O 3Å; N52-N97 WeakPolarHBondContact OD1-CA 3.37Å; N52-S98 WeakPolarHBondContact CA-OG 3.4Å; N52-S98 WeakPolarHBondContact CB-OG 3.37Å; N52-S98 PolarHBondContact N-OG 2.73Å; N52-S98 VanDerWaalsContact N-OG 3.11Å; N52-S98 PolarHBondContact OD1-N 2.9Å; N52-T99 HydrophobicContact CB-CG2 4.39Å; N52-T99 VanDerWaalsContact CG-CG2 3.44Å; N52-T99 VanDerWaalsContact ND2-CG2 3.27Å; N52-T99 WeakPolarHBondContact ND2-CG2 3.43Å; N52-T99 WeakPolarHBondContact OD1-CG2 3.15Å; N52-T99 PolarHBondContact OD1-N 2.67Å
53	G	93.4	Very high	93.9	Very high	39 Å²	39	56.2 Å²	56.2	40%	0.402	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	3.9	-174.5	0	0	0	0	0	114.9	R51 I55 L96	R51-G53 PolarHBondContact O-N 3.43Å; G53-I55 PolarHBondContact O-N 2.78Å; G53-L96 WeakPolarHBondContact CA-O 3.47Å; G53-L96 PolarHBondContact N-O 2.9Å
54	T	94.9	Very high	93.7	Very high	42 Å²	42	52.1 Å²	52.1	26%	0.258	28%	0.28	S	S	.	.			trans	-55.1	132	172.3	-66.8	0	0	0	0	110.5	R51 L56 F95 L96	R51-T54 WeakPolarHBondContact O-CB 3.23Å; R51-T54 PolarHBondContact O-N 2.76Å; R51-T54 PolarHBondContact O-OG1 3.34Å; T54-L56 PolarHBondContact O-N 3.27Å; T54-F95 CarbonylContact O-C 3.58Å; T54-F95 WeakPolarHBondContact O-CA 3.38Å; T54-L96 PolarHBondContact O-N 3.47Å
55	I	95.5	Very high	93.6	Very high	86 Å²	86	54.2 Å²	54.2	44%	0.441	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	112.9	179.2	-59.1	169.7	0	0	0	108.1	G53 D58 M93 F95	G53-I55 PolarHBondContact O-N 2.78Å; I55-D58 HydrophobicContact CG2-CB 4.13Å; I55-M93 HydrophobicContact CD1-CE 3.83Å; I55-M93 HydrophobicContact CG1-CE 4.03Å; I55-M93 HydrophobicContact CG2-CE 3.93Å; I55-F95 HydrophobicContact CG1-CD1 4.07Å; I55-F95 HydrophobicContact CG1-CE1 3.91Å
56	L	95	Very high	93.4	Very high	8 Å²	8	53.2 Å²	53.2	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-46.2	176	-60.7	177.6	0	0	0	110.6	V44 I46 T54 V85 L94 L96 I135	V44-L56 WeakPolarHBondContact CG1-O 2.99Å; V44-L56 WeakPolarHBondContact CG2-O 3.36Å; I46-L56 HydrophobicContact CD1-CD2 3.6Å; I46-L56 HydrophobicContact CG1-CD2 4.43Å; I46-L56 HydrophobicContact CG2-CD2 3.96Å; T54-L56 PolarHBondContact O-N 3.27Å; L56-V85 HydrophobicContact CD1-CB 4.3Å; L56-V85 HydrophobicContact CD1-CG1 4.05Å; L56-V85 HydrophobicContact CD1-CG2 3.72Å; L56-L94 HydrophobicContact CB-CB 4.12Å; L56-L94 PolarHBondContact N-O 3.41Å; L56-L96 HydrophobicContact CD1-CB 4.37Å; L56-L96 HydrophobicContact CD2-CB 4.02Å; L56-L96 HydrophobicContact CG-CB 4.2Å; L56-I135 HydrophobicContact CD1-CD1 4.39Å; L56-I135 HydrophobicContact CD1-CG1 4.32Å; L56-I135 HydrophobicContact CD2-CG1 4.5Å; L56-I135 HydrophobicContact CD2-CG2 4.19Å
57	V	94.4	Very high	92.9	Very high	11 Å²	11	53.9 Å²	53.9	7%	0.067	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	118.2	177.4	-176.6	0	0	0	0	108.1	T42 V44 M60 M93 L94 V133	T42-V57 HydrophobicContact CG2-CG1 4.15Å; T42-V57 HydrophobicContact CG2-CG2 3.99Å; V44-V57 HydrophobicContact CG1-CG2 4.08Å; V44-V57 HydrophobicContact CG2-CG2 4.3Å; V57-M60 HydrophobicContact CB-SD 4.45Å; V57-M60 HydrophobicContact CG1-CG 4.25Å; V57-M60 HydrophobicContact CG1-SD 3.89Å; V57-M60 HydrophobicContact CG2-SD 4.48Å; V57-M93 CarbonylContact O-C 3.56Å; V57-M93 WeakPolarHBondContact O-CA 3.35Å; V57-L94 HydrophobicContact CB-CB 4.01Å; V57-L94 HydrophobicContact CB-CD1 4.19Å; V57-L94 HydrophobicContact CB-CG 4.19Å; V57-L94 HydrophobicContact CG2-CB 4.3Å; V57-L94 HydrophobicContact CG2-CD1 3.93Å; V57-L94 HydrophobicContact CG2-CG 4.44Å; V57-L94 PolarHBondContact N-O 3.29Å; V57-L94 PolarHBondContact O-N 3.02Å; V57-V133 HydrophobicContact CG2-CG1 3.9Å
58	D	93.4	Very high	92.4	Very high	111 Å²	111	55 Å²	55	59%	0.594	32%	0.315	S	S	*	.	S	Bend	trans	-73.1	-29.9	-177.9	-171.5	48	0	0	0	112.9	I55 M93	I55-D58 HydrophobicContact CG2-CB 4.13Å; D58-M93 WeakPolarHBondContact O-CG 3.39Å; D58-M93 WeakPolarHBondContact OD1-CE 3.5Å
59	N	93.5	Very high	92	Very high	74 Å²	74	61.6 Å²	61.6	40%	0.396	36%	0.359	S	S	.	.			trans	-160.7	122.2	172.5	-166.6	-28.7	0	0	0	110.3	L61	N59-L61 HydrophobicContact CB-CD2 4.37Å; N59-L61 HydrophobicContact CB-CG 4.36Å; N59-L61 PolarHBondContact O-N 2.79Å; N59-L61 PolarHBondContact OD1-N 2.81Å
60	M	92.6	Very high	91.7	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	37%	0.37	C	S	.	.			trans	-68.5	-16.5	176.8	-74	-70.3	-64	0	0	113.6	T42 V57 I62 Q92 L94 V118 H131 V133	T42-M60 HydrophobicContact CG2-SD 4.44Å; V57-M60 HydrophobicContact CB-SD 4.45Å; V57-M60 HydrophobicContact CG1-CG 4.25Å; V57-M60 HydrophobicContact CG1-SD 3.89Å; V57-M60 HydrophobicContact CG2-SD 4.48Å; M60-I62 VanDerWaalsContact C-N 3.31Å; M60-I62 HydrophobicContact CB-CD1 3.75Å; M60-I62 HydrophobicContact CB-CG1 3.84Å; M60-I62 HydrophobicContact CE-CD1 4.25Å; M60-I62 HydrophobicContact CG-CD1 4.43Å; M60-I62 PolarHBondContact O-N 2.8Å; M60-Q92 HydrophobicContact CB-CB 4.06Å; M60-Q92 WeakPolarHBondContact CG-O 3.45Å; M60-Q92 PolarHBondContact N-O 2.86Å; M60-L94 HydrophobicContact SD-CD1 4.05Å; M60-V118 HydrophobicContact CE-CB 4.07Å; M60-V118 HydrophobicContact CE-CG2 3.82Å; M60-V118 HydrophobicContact CG-CG2 4.49Å; M60-V118 HydrophobicContact SD-CG2 4.27Å; M60-H131 HydrophobicContact CE-CB 3.59Å; M60-V133 HydrophobicContact CE-CG2 3.63Å; M60-V133 HydrophobicContact SD-CG2 3.65Å
61	L	93.5	Very high	91.4	Very high	75 Å²	75	63.8 Å²	63.8	39%	0.393	37%	0.374	S	S	.	.			trans	54	46.7	-179.4	-62.4	170.7	0	0	0	111.6	A35 R36 N59	A35-L61 HydrophobicContact CB-CB 4.4Å; A35-L61 VanDerWaalsContact CB-O 3.29Å; A35-L61 WeakPolarHBondContact CB-O 3.22Å; A35-L61 PolarHBondContact N-O 2.96Å; R36-L61 HydrophobicContact CB-CB 4.41Å; R36-L61 HydrophobicContact CB-CD1 3.95Å; R36-L61 HydrophobicContact CG-CB 4.48Å; N59-L61 HydrophobicContact CB-CD2 4.37Å; N59-L61 HydrophobicContact CB-CG 4.36Å; N59-L61 PolarHBondContact O-N 2.79Å; N59-L61 PolarHBondContact OD1-N 2.81Å
62	I	93	Very high	91.3	Very high	7 Å²	7	54.3 Å²	54.3	4%	0.036	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-90.9	128.6	174.6	-59.4	167.6	0	0	0	108.3	M60 G64 I73 L75 Q92 V118 C120 H131	M60-I62 VanDerWaalsContact C-N 3.31Å; M60-I62 HydrophobicContact CB-CD1 3.75Å; M60-I62 HydrophobicContact CB-CG1 3.84Å; M60-I62 HydrophobicContact CE-CD1 4.25Å; M60-I62 HydrophobicContact CG-CD1 4.43Å; M60-I62 PolarHBondContact O-N 2.8Å; I62-G64 PolarHBondContact O-N 3.41Å; I62-I73 HydrophobicContact CG2-CD1 4.25Å; I62-L75 HydrophobicContact CD1-CD2 3.78Å; I62-L75 HydrophobicContact CG2-CD2 4.44Å; I62-Q92 PolarHBondContact O-NE2 3.3Å; I62-Q92 PolarHBondContact O-OE1 3.25Å; I62-V118 HydrophobicContact CD1-CG1 3.96Å; I62-C120 HydrophobicContact CG2-CB 4.34Å; I62-H131 VanDerWaalsContact CD1-CD2 3.5Å; I62-H131 WeakPolarHBondContact CD1-CD2 3.32Å
63	K	91.9	Very high	91.2	Very high	72 Å²	72	50.7 Å²	50.7	31%	0.313	32%	0.32	S	S	.	.	S	Bend	trans	-63.6	134.1	176.5	-69.9	-179.8	176.4	176	0	110.7	D30 C32 K33 A35	D30-K63 HydrophobicContact CB-CD 4.08Å; D30-K63 WeakPolarHBondContact O-CB 3.48Å; D30-K63 WeakPolarHBondContact O-CD 3.43Å; D30-K63 IonicContact OD2-NZ 3.72Å; D30-K63 PolarHBondContact OD2-NZ 3.22Å; C32-K63 PolarHBondContact N-O 3.46Å; K33-K63 WeakPolarHBondContact O-CB 3.21Å; K33-K63 WeakPolarHBondContact O-CG 3.32Å; K33-K63 PolarHBondContact O-N 3.4Å; A35-K63 HydrophobicContact CB-CG 3.86Å
64	G	89.2	Confident	91.2	Very high	24 Å²	24	53.7 Å²	53.7	25%	0.247	32%	0.324	C	S	.	.	S	Bend	trans	118	167.4	178.1	0	0	0	0	0	113.1	D31 I62 T72	D31-G64 WeakPolarHBondContact OD1-CA 3.24Å; I62-G64 PolarHBondContact O-N 3.41Å; G64-T72 VanDerWaalsContact CA-OG1 3.31Å; G64-T72 WeakPolarHBondContact CA-OG1 3.15Å
65	T	91.1	Very high	91.2	Very high	78 Å²	78	52.4 Å²	52.4	48%	0.479	32%	0.316	S	S	.	.			trans	-114.2	116.2	-179.6	52	0	0	0	0	110.7	P71 T72 I73	T65-P71 CarbonylContact O-C 3.37Å; T65-P71 WeakPolarHBondContact O-CA 3.41Å; T65-P71 WeakPolarHBondContact O-CB 3.39Å; T65-T72 PolarHBondContact N-OG1 2.9Å; T65-T72 PolarHBondContact O-N 2.73Å; T65-I73 PolarHBondContact O-N 2.77Å
66	A	89.6	Confident	91.2	Very high	25 Å²	25	50 Å²	50	21%	0.207	31%	0.306	C	S	.	.	S	Bend	trans	-85.8	-20.4	178.4	0	0	0	0	0	113.7	I73 L75 P89	A66-I73 WeakPolarHBondContact CA-O 3.26Å; A66-I73 HydrophobicContact CB-CD1 4.47Å; A66-I73 HydrophobicContact CB-CG1 4.08Å; A66-L75 HydrophobicContact CB-CD1 4.28Å; A66-L75 HydrophobicContact CB-CG 4.34Å; A66-P89 HydrophobicContact CB-CB 4.21Å; A66-P89 VanDerWaalsContact CB-O 3.32Å; A66-P89 WeakPolarHBondContact CB-O 3.22Å
67	G	85	Confident	91.3	Very high	27 Å²	27	51.4 Å²	51.4	28%	0.278	31%	0.313	S	S	.	.	S	Bend	trans	-113.9	172.4	177	0	0	0	0	0	112.9
68	G	84.8	Confident	91.3	Very high	60 Å²	60	55 Å²	55	62%	0.619	33%	0.328	S	S	*	.	S	Bend	trans	95.8	-177	-177.2	0	0	0	0	0	113.5	D70	G68-D70 VanDerWaalsContact C-N 3.32Å; G68-D70 PolarHBondContact O-N 3.45Å
69	P	85.3	Confident	91.3	Very high	144 Å²	144	54.5 Å²	54.5	94%	0.935	33%	0.326	S	S	*	.	S	Bend	trans	-72.2	-21.4	-173.3	27.8	-34.4	0	0	0	114.2
70	D	86.8	Confident	91.3	Very high	126 Å²	126	52.3 Å²	52.3	67%	0.674	31%	0.314	S	S	*	.	S	Bend	trans	-137.4	76.4	-178.7	-165.5	8.3	0	0	0	110.6	G68 T72	G68-D70 VanDerWaalsContact C-N 3.32Å; G68-D70 PolarHBondContact O-N 3.45Å; D70-T72 PolarHBondContact O-N 3.08Å
71	P	89	Confident	91.2	Very high	36 Å²	36	56.9 Å²	56.9	23%	0.234	34%	0.342	C	S	.	.			trans	-70.4	128.9	-177.4	29.1	-34.1	0	0	0	110.7	T65	T65-P71 CarbonylContact O-C 3.37Å; T65-P71 WeakPolarHBondContact O-CA 3.41Å; T65-P71 WeakPolarHBondContact O-CB 3.39Å
72	T	90.8	Very high	91.2	Very high	16 Å²	16	58 Å²	58	10%	0.098	35%	0.348	C	S	.	.	S	Bend	trans	-89.4	-21.5	-178.7	74.4	0	0	0	0	112.9	D31 G64 T65 D70 K123	D31-T72 WeakPolarHBondContact OD2-CB 3.42Å; D31-T72 PolarHBondContact OD2-OG1 2.8Å; G64-T72 VanDerWaalsContact CA-OG1 3.31Å; G64-T72 WeakPolarHBondContact CA-OG1 3.15Å; T65-T72 PolarHBondContact N-OG1 2.9Å; T65-T72 PolarHBondContact O-N 2.73Å; D70-T72 PolarHBondContact O-N 3.08Å; T72-K123 PolarHBondContact O-N 3.35Å
73	I	93	Very high	91.2	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	159.9	179.3	61.5	172.3	0	0	0	111	D31 C32 I62 T65 A66 L75 V121	D31-I73 HydrophobicContact CB-CG2 3.83Å; C32-I73 VanDerWaalsContact SG-CG2 3.57Å; I62-I73 HydrophobicContact CG2-CD1 4.25Å; T65-I73 PolarHBondContact O-N 2.77Å; A66-I73 WeakPolarHBondContact CA-O 3.26Å; A66-I73 HydrophobicContact CB-CD1 4.47Å; A66-I73 HydrophobicContact CB-CG1 4.08Å; I73-L75 HydrophobicContact CD1-CD1 4.26Å; I73-L75 HydrophobicContact CD1-CD2 4.19Å; I73-L75 HydrophobicContact CD1-CG 4.14Å; I73-V121 CarbonylContact C-O 3.2Å; I73-V121 VanDerWaalsContact CA-O 3.24Å; I73-V121 WeakPolarHBondContact CA-O 3.4Å
74	E	93.2	Very high	91.4	Very high	102 Å²	102	63 Å²	63	48%	0.477	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.7	169	-170.2	169.7	153.3	0	0	109.1	C120 V121 K123	E74-C120 CarbonylContact O-C 3.47Å; E74-C120 WeakPolarHBondContact O-CA 3.36Å; E74-V121 HydrophobicContact CB-CB 4.21Å; E74-V121 PolarHBondContact N-O 3.13Å; E74-V121 PolarHBondContact O-N 3.06Å; E74-K123 WeakPolarHBondContact OE2-CE 3.28Å; E74-K123 IonicContact OE2-NZ 3.83Å; E74-K123 PolarHBondContact OE2-NZ 3.06Å
75	L	95.4	Very high	91.7	Very high	16 Å²	16	61.8 Å²	61.8	8%	0.084	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.5	-179.2	-61.8	177	0	0	0	109.9	I62 A66 I73 L87 P89 Q92 V118 Q119 C120	I62-L75 HydrophobicContact CD1-CD2 3.78Å; I62-L75 HydrophobicContact CG2-CD2 4.44Å; A66-L75 HydrophobicContact CB-CD1 4.28Å; A66-L75 HydrophobicContact CB-CG 4.34Å; I73-L75 HydrophobicContact CD1-CD1 4.26Å; I73-L75 HydrophobicContact CD1-CD2 4.19Å; I73-L75 HydrophobicContact CD1-CG 4.14Å; L75-L87 HydrophobicContact CB-CD2 3.95Å; L75-P89 HydrophobicContact CB-CB 4.06Å; L75-Q92 HydrophobicContact CD1-CB 4.4Å; L75-Q92 HydrophobicContact CD1-CG 3.79Å; L75-V118 HydrophobicContact CB-CG1 4.49Å; L75-V118 HydrophobicContact CD2-CG1 4.07Å; L75-Q119 WeakPolarHBondContact CA-O 3.32Å; L75-C120 HydrophobicContact CD2-CB 3.58Å; L75-C120 VanDerWaalsContact CD2-SG 3.55Å
76	S	94.9	Very high	91.9	Very high	35 Å²	35	62.2 Å²	62.2	25%	0.245	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.2	173.5	68.2	0	0	0	0	111.3	V118 Q119	S76-V118 CarbonylContact O-C 3.54Å; S76-Q119 PolarHBondContact N-O 2.99Å; S76-Q119 PolarHBondContact O-N 3.46Å; S76-Q119 PolarHBondContact OG-OE1 2.8Å
77	L	96.1	Very high	92.2	Very high	37 Å²	37	62.8 Å²	62.8	19%	0.194	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.2	174.8	-68.7	172.8	0	0	0	110.8	N80 V85 L87 L94 V116 Q117 V118	L77-N80 HydrophobicContact CB-CB 4.2Å; L77-V85 HydrophobicContact CD1-CB 4.15Å; L77-V85 HydrophobicContact CD1-CG1 3.95Å; L77-V85 VanDerWaalsContact CD1-O 3.24Å; L77-V85 WeakPolarHBondContact CD1-O 3.43Å; L77-V85 HydrophobicContact CD2-CG1 4.35Å; L77-L87 HydrophobicContact CD1-CB 3.8Å; L77-L87 HydrophobicContact CD2-CB 4.33Å; L77-L87 HydrophobicContact CG-CB 3.81Å; L77-L87 HydrophobicContact CG-CD2 4.27Å; L77-L94 HydrophobicContact CD2-CD2 3.99Å; L77-V116 HydrophobicContact CD2-CG2 4.2Å; L77-Q117 CarbonylContact C-O 3.59Å; L77-Q117 WeakPolarHBondContact CA-O 2.92Å; L77-V118 HydrophobicContact CD2-CG2 3.93Å
78	K	94.4	Very high	92.7	Very high	88 Å²	88	63.4 Å²	63.4	38%	0.383	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.8	168.9	-59.3	-61.1	174.7	-167.3	0	108.9	N80 Q117 Q119 Y130	K78-N80 PolarHBondContact O-N 3.21Å; K78-Q117 HydrophobicContact CB-CB 4.18Å; K78-Q117 PolarHBondContact N-O 3.49Å; K78-Q117 PolarHBondContact O-N 3.03Å; K78-Q119 HydrophobicContact CG-CB 3.92Å; K78-Y130 HydrophobicContact CG-CE1 4.25Å
79	D	93.8	Very high	93.1	Very high	100 Å²	100	62.9 Å²	62.9	54%	0.535	33%	0.334	S	S	.	.	S	Bend	trans	54.1	26.7	-177.9	-50.5	-21	0	0	0	113.6	V81	D79-V81 PolarHBondContact O-N 3.09Å
80	N	94.2	Very high	93.5	Very high	28 Å²	28	60.8 Å²	60.8	15%	0.15	32%	0.319	C	S	.	.			trans	-80.2	69.5	178.2	-173.5	24.3	0	0	0	110.8	L77 K78 D82 Y83 W84 V85 V116	L77-N80 HydrophobicContact CB-CB 4.2Å; K78-N80 PolarHBondContact O-N 3.21Å; N80-D82 PolarHBondContact O-N 2.83Å; N80-Y83 PolarHBondContact O-N 2.77Å; N80-Y83 VanDerWaalsContact O-N 3.07Å; N80-W84 PolarHBondContact OD1-N 3.33Å; N80-V85 PolarHBondContact ND2-O 3.2Å; N80-V85 PolarHBondContact OD1-N 3.29Å; N80-V116 HydrophobicContact CB-CG1 4.13Å
81	V	91.1	Very high	93.8	Very high	98 Å²	98	60.7 Å²	60.7	59%	0.594	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-55	133	179	-176.9	0	0	0	0	109.5	D79 Y83 W84	D79-V81 PolarHBondContact O-N 3.09Å; V81-Y83 PolarHBondContact O-N 2.9Å; V81-W84 VanDerWaalsContact O-CD1 3.32Å
82	D	92	Very high	94.1	Very high	99 Å²	99	59.8 Å²	59.8	53%	0.529	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	53.5	12.6	-175.7	-54.3	-33.8	0	0	0	115.8	N80 W84 R101	N80-D82 PolarHBondContact O-N 2.83Å; D82-W84 VanDerWaalsContact C-N 3.29Å; D82-W84 PolarHBondContact O-N 3.36Å; D82-R101 PolarHBondContact O-NH1 3.43Å; D82-R101 PolarHBondContact O-NH2 2.9Å
83	Y	94.4	Very high	94.3	Very high	170 Å²	170	60 Å²	60	67%	0.667	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	58.2	36.9	179.2	-50.2	-83	0	0	0	114.1	N80 V81 V85 N97 R101	N80-Y83 PolarHBondContact O-N 2.77Å; N80-Y83 VanDerWaalsContact O-N 3.07Å; V81-Y83 PolarHBondContact O-N 2.9Å; Y83-V85 PolarHBondContact O-N 2.86Å; Y83-N97 WeakPolarHBondContact O-CB 3.23Å; Y83-N97 PolarHBondContact O-ND2 2.86Å; Y83-R101 PolarHBondContact O-NH2 3.21Å; Y83-R101 VanDerWaalsContact O-NH2 3.12Å
84	W	94.7	Very high	94.5	Very high	12 Å²	12	60 Å²	60	5%	0.045	31%	0.305	C	S	.	.			trans	-63.4	-26.1	175.6	-74.9	112.7	0	0	0	113.2	N80 V81 D82 L96 N97 R101 V102 L103 M109 I111 I114	N80-W84 PolarHBondContact OD1-N 3.33Å; V81-W84 VanDerWaalsContact O-CD1 3.32Å; D82-W84 VanDerWaalsContact C-N 3.29Å; D82-W84 PolarHBondContact O-N 3.36Å; W84-L96 HydrophobicContact CE3-CD1 4.02Å; W84-L96 CarbonylContact O-C 3.55Å; W84-L96 WeakPolarHBondContact O-CA 3.38Å; W84-N97 PolarHBondContact O-N 2.81Å; W84-R101 HydrophobicContact CH2-CB 4.4Å; W84-R101 VanDerWaalsContact CH2-CD 3.48Å; W84-R101 HydrophobicContact CH2-CG 3.76Å; W84-R101 HydrophobicContact CZ3-CG 3.91Å; W84-V102 VanDerWaalsContact CH2-O 3.27Å; W84-V102 WeakPolarHBondContact CH2-O 3Å; W84-L103 HydrophobicContact CD2-CD1 4.26Å; W84-L103 HydrophobicContact CE3-CD1 4.22Å; W84-L103 HydrophobicContact CH2-CB 4.44Å; W84-L103 HydrophobicContact CH2-CD1 4.35Å; W84-L103 HydrophobicContact CZ2-CD1 4.4Å; W84-L103 HydrophobicContact CZ3-CB 4.09Å; W84-L103 HydrophobicContact CZ3-CD1 4.26Å; W84-M109 HydrophobicContact CZ2-CE 4.38Å; W84-I111 HydrophobicContact CH2-CD1 4.39Å; W84-I111 HydrophobicContact CZ2-CD1 3.54Å; W84-I114 HydrophobicContact CB-CD1 3.69Å; W84-I114 HydrophobicContact CB-CG1 4.34Å; W84-I114 HydrophobicContact CB-CG2 4.15Å; W84-I114 HydrophobicContact CD2-CD1 4.29Å; W84-I114 HydrophobicContact CG-CD1 3.79Å; W84-I114 HydrophobicContact CG-CG1 4.28Å
85	V	96	Very high	94.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.2	-176.2	-174.6	0	0	0	0	110.9	L56 L77 N80 Y83 L94 F95 I114 V116 I135	L56-V85 HydrophobicContact CD1-CB 4.3Å; L56-V85 HydrophobicContact CD1-CG1 4.05Å; L56-V85 HydrophobicContact CD1-CG2 3.72Å; L77-V85 HydrophobicContact CD1-CB 4.15Å; L77-V85 HydrophobicContact CD1-CG1 3.95Å; L77-V85 VanDerWaalsContact CD1-O 3.24Å; L77-V85 WeakPolarHBondContact CD1-O 3.43Å; L77-V85 HydrophobicContact CD2-CG1 4.35Å; N80-V85 PolarHBondContact ND2-O 3.2Å; N80-V85 PolarHBondContact OD1-N 3.29Å; Y83-V85 PolarHBondContact O-N 2.86Å; V85-L94 HydrophobicContact CG1-CB 3.88Å; V85-L94 HydrophobicContact CG1-CD1 4.19Å; V85-L94 HydrophobicContact CG1-CD2 3.84Å; V85-L94 HydrophobicContact CG1-CG 4.19Å; V85-F95 CarbonylContact C-O 3.53Å; V85-F95 WeakPolarHBondContact CA-O 3.15Å; V85-I114 HydrophobicContact CG2-CG2 4.13Å; V85-V116 HydrophobicContact CB-CG1 4.13Å; V85-V116 HydrophobicContact CB-CG2 4.34Å; V85-V116 HydrophobicContact CG1-CG2 4.3Å; V85-V116 HydrophobicContact CG2-CB 4.49Å; V85-V116 HydrophobicContact CG2-CG1 3.63Å; V85-V116 HydrophobicContact CG2-CG2 4.03Å; V85-I135 HydrophobicContact CG2-CD1 4.06Å
86	L	95.5	Very high	94.6	Very high	87 Å²	87	56.7 Å²	56.7	46%	0.455	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143	167.2	-66.9	171.9	0	0	0	109.6	L94 F95 N97	L86-L94 CarbonylContact O-C 3.51Å; L86-L94 VanDerWaalsContact O-CA 3.27Å; L86-L94 WeakPolarHBondContact O-CA 3.27Å; L86-F95 HydrophobicContact CB-CB 4.43Å; L86-F95 PolarHBondContact N-O 2.83Å; L86-F95 PolarHBondContact O-N 3.4Å; L86-N97 HydrophobicContact CD1-CB 3.79Å; L86-N97 HydrophobicContact CG-CB 3.78Å
87	L	95.9	Very high	94.7	Very high	36 Å²	36	56.2 Å²	56.2	19%	0.188	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.3	-179.7	168.9	67.5	0	0	0	110.2	L75 L77 P89 M93 L94	L75-L87 HydrophobicContact CB-CD2 3.95Å; L77-L87 HydrophobicContact CD1-CB 3.8Å; L77-L87 HydrophobicContact CD2-CB 4.33Å; L77-L87 HydrophobicContact CG-CB 3.81Å; L77-L87 HydrophobicContact CG-CD2 4.27Å; L87-P89 HydrophobicContact CG-CB 4.47Å; L87-P89 WeakPolarHBondContact O-CD 3.43Å; L87-M93 WeakPolarHBondContact CA-O 3.48Å; L87-L94 HydrophobicContact CB-CD2 3.79Å; L87-L94 HydrophobicContact CD1-CD2 3.55Å; L87-L94 HydrophobicContact CG-CD2 4.23Å
88	D	95.6	Very high	94.5	Very high	40 Å²	40	55 Å²	55	21%	0.214	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	103.3	157.4	179.5	-20.2	0	0	0	107.6	V90 K91 Q92 M93 F95	D88-V90 VanDerWaalsContact C-N 3.26Å; D88-V90 PolarHBondContact O-N 2.97Å; D88-V90 PolarHBondContact OD1-N 2.84Å; D88-K91 HydrophobicContact CB-CB 4.41Å; D88-K91 PolarHBondContact OD1-N 3.27Å; D88-K91 VanDerWaalsContact OD1-N 3.13Å; D88-K91 VanDerWaalsContact OD2-CD 3.25Å; D88-K91 WeakPolarHBondContact OD2-CD 3.4Å; D88-K91 WeakPolarHBondContact OD2-CE 3.38Å; D88-K91 WeakPolarHBondContact OD2-CG 3.42Å; D88-K91 IonicContact OD2-NZ 3.62Å; D88-Q92 VanDerWaalsContact O-CA 3.24Å; D88-Q92 WeakPolarHBondContact O-CA 3.49Å; D88-Q92 PolarHBondContact O-N 3.33Å; D88-M93 HydrophobicContact CB-CB 4.29Å; D88-M93 PolarHBondContact N-O 2.72Å; D88-M93 PolarHBondContact O-N 2.75Å; D88-M93 VanDerWaalsContact O-N 3.11Å; D88-F95 HydrophobicContact CB-CE2 3.9Å
89	P	93.8	Very high	94.4	Very high	49 Å²	49	55 Å²	55	32%	0.318	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-25.7	-174.5	28.2	-35.2	0	0	0	112.5	A66 L75 L87	A66-P89 HydrophobicContact CB-CB 4.21Å; A66-P89 VanDerWaalsContact CB-O 3.32Å; A66-P89 WeakPolarHBondContact CB-O 3.22Å; L75-P89 HydrophobicContact CB-CB 4.06Å; L87-P89 HydrophobicContact CG-CB 4.47Å; L87-P89 WeakPolarHBondContact O-CD 3.43Å
90	V	92.7	Very high	94.3	Very high	100 Å²	100	54.7 Å²	54.7	61%	0.606	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-43.4	-178.1	-177.9	0	0	0	0	110.2	D88 Q92	D88-V90 VanDerWaalsContact C-N 3.26Å; D88-V90 PolarHBondContact O-N 2.97Å; D88-V90 PolarHBondContact OD1-N 2.84Å; V90-Q92 VanDerWaalsContact C-N 3.34Å
91	K	93.6	Very high	94.2	Very high	124 Å²	124	57 Å²	57	54%	0.539	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.1	176	-60.4	-177	-169.6	166.5	0	113.3	D88 M93	D88-K91 HydrophobicContact CB-CB 4.41Å; D88-K91 PolarHBondContact OD1-N 3.27Å; D88-K91 VanDerWaalsContact OD1-N 3.13Å; D88-K91 VanDerWaalsContact OD2-CD 3.25Å; D88-K91 WeakPolarHBondContact OD2-CD 3.4Å; D88-K91 WeakPolarHBondContact OD2-CE 3.38Å; D88-K91 WeakPolarHBondContact OD2-CG 3.42Å; D88-K91 IonicContact OD2-NZ 3.62Å; K91-M93 HydrophobicContact CB-CB 4.1Å; K91-M93 HydrophobicContact CB-CG 3.69Å; K91-M93 HydrophobicContact CB-SD 3.8Å; K91-M93 HydrophobicContact CD-SD 3.59Å; K91-M93 VanDerWaalsContact CD-SD 3.59Å; K91-M93 HydrophobicContact CG-SD 4.36Å; K91-M93 PolarHBondContact O-N 3.5Å
92	Q	94.3	Very high	94.3	Very high	17 Å²	17	55.2 Å²	55.2	8%	0.079	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	36.4	-170.1	-46	-174.3	1.4	0	0	112.2	M60 I62 L75 D88 V90	M60-Q92 HydrophobicContact CB-CB 4.06Å; M60-Q92 WeakPolarHBondContact CG-O 3.45Å; M60-Q92 PolarHBondContact N-O 2.86Å; I62-Q92 PolarHBondContact O-NE2 3.3Å; I62-Q92 PolarHBondContact O-OE1 3.25Å; L75-Q92 HydrophobicContact CD1-CB 4.4Å; L75-Q92 HydrophobicContact CD1-CG 3.79Å; D88-Q92 VanDerWaalsContact O-CA 3.24Å; D88-Q92 WeakPolarHBondContact O-CA 3.49Å; D88-Q92 PolarHBondContact O-N 3.33Å; V90-Q92 VanDerWaalsContact C-N 3.34Å
93	M	95.8	Very high	94.3	Very high	21 Å²	21	50.5 Å²	50.5	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	141.2	-177.5	-79.4	179	84.3	0	0	110.8	I55 V57 D58 L87 D88 K91 F95	I55-M93 HydrophobicContact CD1-CE 3.83Å; I55-M93 HydrophobicContact CG1-CE 4.03Å; I55-M93 HydrophobicContact CG2-CE 3.93Å; V57-M93 CarbonylContact O-C 3.56Å; V57-M93 WeakPolarHBondContact O-CA 3.35Å; D58-M93 WeakPolarHBondContact O-CG 3.39Å; D58-M93 WeakPolarHBondContact OD1-CE 3.5Å; L87-M93 WeakPolarHBondContact CA-O 3.48Å; D88-M93 HydrophobicContact CB-CB 4.29Å; D88-M93 PolarHBondContact N-O 2.72Å; D88-M93 PolarHBondContact O-N 2.75Å; D88-M93 VanDerWaalsContact O-N 3.11Å; K91-M93 HydrophobicContact CB-CB 4.1Å; K91-M93 HydrophobicContact CB-CG 3.69Å; K91-M93 HydrophobicContact CB-SD 3.8Å; K91-M93 HydrophobicContact CD-SD 3.59Å; K91-M93 VanDerWaalsContact CD-SD 3.59Å; K91-M93 HydrophobicContact CG-SD 4.36Å; K91-M93 PolarHBondContact O-N 3.5Å; M93-F95 HydrophobicContact CB-CD2 4.5Å; M93-F95 HydrophobicContact CB-CE2 3.63Å; M93-F95 HydrophobicContact CB-CZ 3.73Å; M93-F95 HydrophobicContact CE-CE1 3.75Å; M93-F95 HydrophobicContact CE-CZ 3.62Å; M93-F95 HydrophobicContact CG-CZ 4.4Å; M93-F95 HydrophobicContact SD-CZ 3.91Å
94	L	96.4	Very high	94.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.2	172.9	-60.2	-178.8	0	0	0	110.4	L56 V57 M60 L77 V85 L86 L87 V118 V133	L56-L94 HydrophobicContact CB-CB 4.12Å; L56-L94 PolarHBondContact N-O 3.41Å; V57-L94 HydrophobicContact CB-CB 4.01Å; V57-L94 HydrophobicContact CB-CD1 4.19Å; V57-L94 HydrophobicContact CB-CG 4.19Å; V57-L94 HydrophobicContact CG2-CB 4.3Å; V57-L94 HydrophobicContact CG2-CD1 3.93Å; V57-L94 HydrophobicContact CG2-CG 4.44Å; V57-L94 PolarHBondContact N-O 3.29Å; V57-L94 PolarHBondContact O-N 3.02Å; M60-L94 HydrophobicContact SD-CD1 4.05Å; L77-L94 HydrophobicContact CD2-CD2 3.99Å; V85-L94 HydrophobicContact CG1-CB 3.88Å; V85-L94 HydrophobicContact CG1-CD1 4.19Å; V85-L94 HydrophobicContact CG1-CD2 3.84Å; V85-L94 HydrophobicContact CG1-CG 4.19Å; L86-L94 CarbonylContact O-C 3.51Å; L86-L94 VanDerWaalsContact O-CA 3.27Å; L86-L94 WeakPolarHBondContact O-CA 3.27Å; L87-L94 HydrophobicContact CB-CD2 3.79Å; L87-L94 HydrophobicContact CD1-CD2 3.55Å; L87-L94 HydrophobicContact CG-CD2 4.23Å; L94-V118 HydrophobicContact CD1-CG2 4.12Å; L94-V118 HydrophobicContact CD2-CG2 4.34Å; L94-V133 HydrophobicContact CD1-CB 4.25Å; L94-V133 HydrophobicContact CD1-CG1 3.95Å; L94-V133 HydrophobicContact CD1-CG2 3.79Å
95	F	96.1	Very high	94.4	Very high	50 Å²	50	44.4 Å²	44.4	22%	0.219	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.9	180	-54.5	-90.6	0	0	0	110.9	T54 I55 V85 L86 D88 M93	T54-F95 CarbonylContact O-C 3.58Å; T54-F95 WeakPolarHBondContact O-CA 3.38Å; I55-F95 HydrophobicContact CG1-CD1 4.07Å; I55-F95 HydrophobicContact CG1-CE1 3.91Å; V85-F95 CarbonylContact C-O 3.53Å; V85-F95 WeakPolarHBondContact CA-O 3.15Å; L86-F95 HydrophobicContact CB-CB 4.43Å; L86-F95 PolarHBondContact N-O 2.83Å; L86-F95 PolarHBondContact O-N 3.4Å; D88-F95 HydrophobicContact CB-CE2 3.9Å; M93-F95 HydrophobicContact CB-CD2 4.5Å; M93-F95 HydrophobicContact CB-CE2 3.63Å; M93-F95 HydrophobicContact CB-CZ 3.73Å; M93-F95 HydrophobicContact CE-CE1 3.75Å; M93-F95 HydrophobicContact CE-CZ 3.62Å; M93-F95 HydrophobicContact CG-CZ 4.4Å; M93-F95 HydrophobicContact SD-CZ 3.91Å
96	L	96.3	Very high	94.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	131.8	171.3	-175.8	65.9	0	0	0	110.3	I46 S50 N52 G53 T54 L56 W84 L103	I46-L96 HydrophobicContact CD1-CD1 4.5Å; I46-L96 HydrophobicContact CD1-CD2 4.24Å; S50-L96 VanDerWaalsContact O-CD2 3.28Å; S50-L96 WeakPolarHBondContact O-CD2 3.45Å; N52-L96 PolarHBondContact OD1-O 3Å; G53-L96 WeakPolarHBondContact CA-O 3.47Å; G53-L96 PolarHBondContact N-O 2.9Å; T54-L96 PolarHBondContact O-N 3.47Å; L56-L96 HydrophobicContact CD1-CB 4.37Å; L56-L96 HydrophobicContact CD2-CB 4.02Å; L56-L96 HydrophobicContact CG-CB 4.2Å; W84-L96 HydrophobicContact CE3-CD1 4.02Å; W84-L96 CarbonylContact O-C 3.55Å; W84-L96 WeakPolarHBondContact O-CA 3.38Å; L96-L103 HydrophobicContact CD1-CD2 4.03Å; L96-L103 HydrophobicContact CD2-CD2 4.31Å
97	N	95.2	Very high	94.2	Very high	25 Å²	25	43.5 Å²	43.5	13%	0.134	25%	0.253	C	S	.	.			trans	-110.7	90.1	171.1	175.3	32.4	0	0	0	110.6	N52 Y83 W84 L86 T99 R101	N52-N97 WeakPolarHBondContact OD1-CA 3.37Å; Y83-N97 WeakPolarHBondContact O-CB 3.23Å; Y83-N97 PolarHBondContact O-ND2 2.86Å; W84-N97 PolarHBondContact O-N 2.81Å; L86-N97 HydrophobicContact CD1-CB 3.79Å; L86-N97 HydrophobicContact CG-CB 3.78Å; N97-T99 PolarHBondContact OD1-OG1 2.98Å; N97-R101 PolarHBondContact O-NE 3.13Å; N97-R101 PolarHBondContact O-NH2 3.35Å
98	S	93.6	Very high	94	Very high	11 Å²	11	47.4 Å²	47.4	8%	0.077	28%	0.28	C	S	.	.			trans	-111.8	31.7	175	53	0	0	0	0	111	S50 N52 G100 R101	S50-S98 PolarHBondContact O-OG 2.85Å; N52-S98 WeakPolarHBondContact CA-OG 3.4Å; N52-S98 WeakPolarHBondContact CB-OG 3.37Å; N52-S98 PolarHBondContact N-OG 2.73Å; N52-S98 VanDerWaalsContact N-OG 3.11Å; N52-S98 PolarHBondContact OD1-N 2.9Å; S98-G100 PolarHBondContact O-N 3.26Å; S98-G100 VanDerWaalsContact O-N 3.17Å; S98-R101 CarbonylContact C-O 3.59Å; S98-R101 WeakPolarHBondContact CB-O 3.32Å; S98-R101 PolarHBondContact O-N 2.96Å
99	T	91.5	Very high	93.9	Very high	89 Å²	89	49.2 Å²	49.2	55%	0.546	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	118.3	173.9	47.3	0	0	0	0	110.9	N52 N97 R101	N52-T99 HydrophobicContact CB-CG2 4.39Å; N52-T99 VanDerWaalsContact CG-CG2 3.44Å; N52-T99 VanDerWaalsContact ND2-CG2 3.27Å; N52-T99 WeakPolarHBondContact ND2-CG2 3.43Å; N52-T99 WeakPolarHBondContact OD1-CG2 3.15Å; N52-T99 PolarHBondContact OD1-N 2.67Å; N97-T99 PolarHBondContact OD1-OG1 2.98Å; T99-R101 VanDerWaalsContact C-N 3.3Å; T99-R101 PolarHBondContact O-N 3Å
100	G	91.3	Very high	93.8	Very high	92 Å²	92	50.9 Å²	50.9	95%	0.948	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	13.3	178.3	0	0	0	0	0	115.5	S98	S98-G100 PolarHBondContact O-N 3.26Å; S98-G100 VanDerWaalsContact O-N 3.17Å
101	R	92.2	Very high	93.9	Very high	78 Å²	78	47.6 Å²	47.6	29%	0.294	27%	0.273	S	S	.	.	S	Bend	trans	-153.9	163.4	-179.5	58.7	-175.7	179.1	-179.8	-2	110.5	D82 Y83 W84 N97 S98 T99	D82-R101 PolarHBondContact O-NH1 3.43Å; D82-R101 PolarHBondContact O-NH2 2.9Å; Y83-R101 PolarHBondContact O-NH2 3.21Å; Y83-R101 VanDerWaalsContact O-NH2 3.12Å; W84-R101 HydrophobicContact CH2-CB 4.4Å; W84-R101 VanDerWaalsContact CH2-CD 3.48Å; W84-R101 HydrophobicContact CH2-CG 3.76Å; W84-R101 HydrophobicContact CZ3-CG 3.91Å; N97-R101 PolarHBondContact O-NE 3.13Å; N97-R101 PolarHBondContact O-NH2 3.35Å; S98-R101 CarbonylContact C-O 3.59Å; S98-R101 WeakPolarHBondContact CB-O 3.32Å; S98-R101 PolarHBondContact O-N 2.96Å; T99-R101 VanDerWaalsContact C-N 3.3Å; T99-R101 PolarHBondContact O-N 3Å
102	V	92.4	Very high	93.9	Very high	60 Å²	60	46 Å²	46	36%	0.364	27%	0.268	S	S	.	.			trans	-110.4	144.9	175.4	-71	0	0	0	0	109.9	E49 W84 D104 M109	E49-V102 HydrophobicContact CG-CB 4.35Å; W84-V102 VanDerWaalsContact CH2-O 3.27Å; W84-V102 WeakPolarHBondContact CH2-O 3Å; V102-D104 HydrophobicContact CG2-CB 3.86Å; V102-D104 PolarHBondContact O-N 2.92Å; V102-D104 VanDerWaalsContact O-N 3.14Å; V102-M109 HydrophobicContact CG2-SD 4.42Å; V102-M109 VanDerWaalsContact O-CE 3.3Å; V102-M109 WeakPolarHBondContact O-CE 2.95Å
103	L	94	Very high	93.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.287	C	S	.	.			trans	-84.3	78.1	170	179.2	63.8	0	0	0	107.2	I46 E48 E49 W84 L96 I111 I114 V137	I46-L103 HydrophobicContact CD1-CD2 3.41Å; I46-L103 VanDerWaalsContact CD1-CD2 3.41Å; I46-L103 HydrophobicContact CG1-CD2 4.28Å; E48-L103 CarbonylContact C-O 3.43Å; E48-L103 WeakPolarHBondContact CA-O 3.42Å; E48-L103 VanDerWaalsContact CB-O 3.28Å; E48-L103 WeakPolarHBondContact CB-O 3.34Å; E49-L103 PolarHBondContact N-O 3.21Å; W84-L103 HydrophobicContact CD2-CD1 4.26Å; W84-L103 HydrophobicContact CE3-CD1 4.22Å; W84-L103 HydrophobicContact CH2-CB 4.44Å; W84-L103 HydrophobicContact CH2-CD1 4.35Å; W84-L103 HydrophobicContact CZ2-CD1 4.4Å; W84-L103 HydrophobicContact CZ3-CB 4.09Å; W84-L103 HydrophobicContact CZ3-CD1 4.26Å; L96-L103 HydrophobicContact CD1-CD2 4.03Å; L96-L103 HydrophobicContact CD2-CD2 4.31Å; L103-I111 HydrophobicContact CD1-CB 4.08Å; L103-I111 HydrophobicContact CD1-CD1 4.19Å; L103-I111 HydrophobicContact CD1-CG2 3.58Å; L103-I114 HydrophobicContact CD1-CD1 3.59Å; L103-I114 HydrophobicContact CD1-CG1 4.33Å; L103-I114 HydrophobicContact CD2-CD1 4.05Å; L103-I114 HydrophobicContact CG-CD1 4.49Å; L103-V137 HydrophobicContact CD1-CG2 4.23Å; L103-V137 HydrophobicContact CD2-CG1 4.25Å; L103-V137 HydrophobicContact CD2-CG2 3.83Å; L103-V137 HydrophobicContact CG-CG1 4.21Å; L103-V137 HydrophobicContact CG-CG2 4.11Å
104	D	94.7	Very high	93.8	Very high	24 Å²	24	48 Å²	48	13%	0.128	29%	0.285	C	S	.	.			trans	-90.3	120.5	-173.3	173.4	11.9	0	0	0	109.8	V102 D106 M109 I111	V102-D104 HydrophobicContact CG2-CB 3.86Å; V102-D104 PolarHBondContact O-N 2.92Å; V102-D104 VanDerWaalsContact O-N 3.14Å; D104-D106 PolarHBondContact OD1-N 3.29Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.21Å; D104-M109 HydrophobicContact CB-CG 4.14Å; D104-M109 HydrophobicContact CB-SD 3.77Å; D104-M109 WeakPolarHBondContact O-CB 3.32Å; D104-I111 WeakPolarHBondContact O-CB 3.4Å; D104-I111 PolarHBondContact O-N 3.28Å; D104-I111 VanDerWaalsContact O-N 3.16Å
105	R	95.2	Very high	93.8	Very high	29 Å²	29	51.1 Å²	51.1	11%	0.109	30%	0.304	C	S	.	.			trans	-82.4	-28.5	-179.7	-171.1	-176.5	175	-77.4	-6.6	110.6	E48 N110 H112 V137 D139 D181	E48-R105 HydrophobicContact CB-CB 3.96Å; E48-R105 HydrophobicContact CG-CB 4.49Å; E48-R105 WeakPolarHBondContact OE2-CB 3.28Å; E48-R105 PolarHBondContact OE2-N 3.09Å; R105-N110 CarbonylContact O-C 3.56Å; R105-N110 WeakPolarHBondContact O-CA 3.43Å; R105-H112 PolarHBondContact O-CD2 3.27Å; R105-V137 HydrophobicContact CB-CG1 4.02Å; R105-V137 WeakPolarHBondContact CD-O 3.31Å; R105-V137 HydrophobicContact CG-CG1 4.36Å; R105-V137 PolarHBondContact NE-O 3.34Å; R105-D139 IonicContact CZ-OD1 3.7Å; R105-D139 IonicContact NH1-OD1 2.76Å; R105-D139 PolarHBondContact NH1-OD1 2.83Å; R105-D181 IonicContact CZ-OD2 2.64Å; R105-D181 IonicContact NH1-OD2 3.37Å; R105-D181 PolarHBondContact NH1-OD2 2.94Å; R105-D181 IonicContact NH2-OD2 3.9Å; R105-D181 PolarHBondContact NH2-OD2 2.95Å
106	D	94	Very high	93.7	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	29%	0.293	C	S	.	.	S	Bend	trans	-81.4	166.3	-170.6	-59.9	-36.7	0	0	0	112.4	D104 M109 N110 N143 I179	D104-D106 PolarHBondContact OD1-N 3.29Å; D106-M109 PolarHBondContact O-N 3.48Å; D106-N110 PolarHBondContact O-N 3.23Å; D106-N143 PolarHBondContact OD2-ND2 3.39Å; D106-I179 HydrophobicContact CB-CD1 4.44Å
107	P	93.1	Very high	93.7	Very high	66 Å²	66	51.1 Å²	51.1	43%	0.429	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	133.2	170.6	-22.7	34.4	0	0	0	111
108	P	93.1	Very high	93.7	Very high	117 Å²	117	49.9 Å²	49.9	76%	0.76	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	cis	-96.2	-7.1	16.3	35.6	-35.3	0	0	0	115.3	N110	P108-N110 VanDerWaalsContact C-ND2 3.29Å; P108-N110 PolarHBondContact O-ND2 2.94Å
109	M	92.3	Very high	93.8	Very high	78 Å²	78	50.9 Å²	50.9	38%	0.384	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-34.8	-172.3	-73.6	-163.2	44.7	0	0	113.7	W84 V102 D104 D106 I111	W84-M109 HydrophobicContact CZ2-CE 4.38Å; V102-M109 HydrophobicContact CG2-SD 4.42Å; V102-M109 VanDerWaalsContact O-CE 3.3Å; V102-M109 WeakPolarHBondContact O-CE 2.95Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.21Å; D104-M109 HydrophobicContact CB-CG 4.14Å; D104-M109 HydrophobicContact CB-SD 3.77Å; D104-M109 WeakPolarHBondContact O-CB 3.32Å; D106-M109 PolarHBondContact O-N 3.48Å; M109-I111 VanDerWaalsContact C-N 3.27Å; M109-I111 HydrophobicContact CB-CG1 4.29Å; M109-I111 HydrophobicContact CE-CD1 3.35Å; M109-I111 HydrophobicContact CE-CG1 4.18Å; M109-I111 PolarHBondContact O-N 2.76Å
110	N	93	Very high	94	Very high	85 Å²	85	46.6 Å²	46.6	46%	0.455	28%	0.275	S	S	.	.			trans	54.2	34.1	172.1	-61.6	-81.6	0	0	0	114.4	R105 D106 P108 H112	R105-N110 CarbonylContact O-C 3.56Å; R105-N110 WeakPolarHBondContact O-CA 3.43Å; D106-N110 PolarHBondContact O-N 3.23Å; P108-N110 VanDerWaalsContact C-ND2 3.29Å; P108-N110 PolarHBondContact O-ND2 2.94Å; N110-H112 VanDerWaalsContact C-CD2 3.49Å; N110-H112 PolarHBondContact O-CD2 2.74Å; N110-H112 PolarHBondContact O-N 2.87Å
111	I	93.6	Very high	94.1	Very high	30 Å²	30	44.1 Å²	44.1	15%	0.154	24%	0.241	C	C	.	.			trans	-85.3	78.5	-176.8	-50.3	-178.1	0	0	0	110.7	W84 L103 D104 M109 I114 V137	W84-I111 HydrophobicContact CH2-CD1 4.39Å; W84-I111 HydrophobicContact CZ2-CD1 3.54Å; L103-I111 HydrophobicContact CD1-CB 4.08Å; L103-I111 HydrophobicContact CD1-CD1 4.19Å; L103-I111 HydrophobicContact CD1-CG2 3.58Å; D104-I111 WeakPolarHBondContact O-CB 3.4Å; D104-I111 PolarHBondContact O-N 3.28Å; D104-I111 VanDerWaalsContact O-N 3.16Å; M109-I111 VanDerWaalsContact C-N 3.27Å; M109-I111 HydrophobicContact CB-CG1 4.29Å; M109-I111 HydrophobicContact CE-CD1 3.35Å; M109-I111 HydrophobicContact CE-CG1 4.18Å; M109-I111 PolarHBondContact O-N 2.76Å; I111-I114 HydrophobicContact CG2-CG1 4.13Å; I111-V137 VanDerWaalsContact O-CB 3.28Å; I111-V137 WeakPolarHBondContact O-CB 3.32Å; I111-V137 VanDerWaalsContact O-CG2 3.25Å; I111-V137 WeakPolarHBondContact O-CG2 3.35Å
112	H	94	Very high	94.2	Very high	91 Å²	91	40.4 Å²	40.4	42%	0.421	23%	0.227	S	C	.	.			trans	-76.7	-25.1	-176.9	-57	-178.6	0	0	0	113.4	R105 N110 V137	R105-H112 PolarHBondContact O-CD2 3.27Å; N110-H112 VanDerWaalsContact C-CD2 3.49Å; N110-H112 PolarHBondContact O-CD2 2.74Å; N110-H112 PolarHBondContact O-N 2.87Å; H112-V137 PolarHBondContact O-N 3.31Å
113	S	94.6	Very high	94	Very high	69 Å²	69	42.8 Å²	42.8	48%	0.483	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	150.5	178.1	68.3	0	0	0	0	112.4	I135	S113-I135 CarbonylContact C-O 3.54Å; S113-I135 WeakPolarHBondContact CA-O 3.43Å; S113-I135 WeakPolarHBondContact CB-O 3.48Å
114	I	94.2	Very high	93.6	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.056	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.7	171.3	-59.8	157.7	0	0	0	107.7	W84 V85 L103 I111 V116 I135	W84-I114 HydrophobicContact CB-CD1 3.69Å; W84-I114 HydrophobicContact CB-CG1 4.34Å; W84-I114 HydrophobicContact CB-CG2 4.15Å; W84-I114 HydrophobicContact CD2-CD1 4.29Å; W84-I114 HydrophobicContact CG-CD1 3.79Å; W84-I114 HydrophobicContact CG-CG1 4.28Å; V85-I114 HydrophobicContact CG2-CG2 4.13Å; L103-I114 HydrophobicContact CD1-CD1 3.59Å; L103-I114 HydrophobicContact CD1-CG1 4.33Å; L103-I114 HydrophobicContact CD2-CD1 4.05Å; L103-I114 HydrophobicContact CG-CD1 4.49Å; I111-I114 HydrophobicContact CG2-CG1 4.13Å; I114-V116 HydrophobicContact CG2-CG1 4Å; I114-I135 HydrophobicContact CB-CB 4.23Å; I114-I135 HydrophobicContact CB-CD1 4.15Å; I114-I135 HydrophobicContact CG2-CD1 4.15Å; I114-I135 PolarHBondContact N-O 3.39Å; I114-I135 WeakPolarHBondContact O-CD1 3.38Å; I114-I135 PolarHBondContact O-N 3.2Å
115	V	95.2	Very high	93.2	Very high	66 Å²	66	49.5 Å²	49.5	40%	0.4	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.1	175.2	-175.3	0	0	0	0	108.7	E132 V133 R134	V115-E132 HydrophobicContact CG1-CG 3.99Å; V115-V133 WeakPolarHBondContact CA-O 3.38Å; V115-R134 HydrophobicContact CG1-CG 4.35Å; V115-R134 HydrophobicContact CG2-CG 4.18Å
116	V	95.4	Very high	92.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.1	175.6	-56.8	0	0	0	0	110.2	L77 N80 V85 I114 V133 I135	L77-V116 HydrophobicContact CD2-CG2 4.2Å; N80-V116 HydrophobicContact CB-CG1 4.13Å; V85-V116 HydrophobicContact CB-CG1 4.13Å; V85-V116 HydrophobicContact CB-CG2 4.34Å; V85-V116 HydrophobicContact CG1-CG2 4.3Å; V85-V116 HydrophobicContact CG2-CB 4.49Å; V85-V116 HydrophobicContact CG2-CG1 3.63Å; V85-V116 HydrophobicContact CG2-CG2 4.03Å; I114-V116 HydrophobicContact CG2-CG1 4Å; V116-V133 HydrophobicContact CG2-CB 3.83Å; V116-V133 HydrophobicContact CG2-CG1 4.46Å; V116-V133 HydrophobicContact CG2-CG2 4.45Å; V116-V133 PolarHBondContact N-O 2.99Å; V116-V133 PolarHBondContact O-N 3.08Å; V116-I135 HydrophobicContact CG2-CD1 4.48Å
117	Q	95.1	Very high	92.6	Very high	49 Å²	49	53.1 Å²	53.1	23%	0.229	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.4	174.2	-62.6	-166.5	-2.9	0	0	110.5	L77 K78 Q119 Y130	L77-Q117 CarbonylContact C-O 3.59Å; L77-Q117 WeakPolarHBondContact CA-O 2.92Å; K78-Q117 HydrophobicContact CB-CB 4.18Å; K78-Q117 PolarHBondContact N-O 3.49Å; K78-Q117 PolarHBondContact O-N 3.03Å; Q117-Q119 PolarHBondContact O-N 3.18Å; Q117-Y130 HydrophobicContact CB-CD1 4.26Å
118	V	95.4	Very high	92.6	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	101.1	168.2	-177.2	0	0	0	0	107.5	M60 I62 L75 S76 L77 L94 C120 H131 V133	M60-V118 HydrophobicContact CE-CB 4.07Å; M60-V118 HydrophobicContact CE-CG2 3.82Å; M60-V118 HydrophobicContact CG-CG2 4.49Å; M60-V118 HydrophobicContact SD-CG2 4.27Å; I62-V118 HydrophobicContact CD1-CG1 3.96Å; L75-V118 HydrophobicContact CB-CG1 4.49Å; L75-V118 HydrophobicContact CD2-CG1 4.07Å; S76-V118 CarbonylContact O-C 3.54Å; L77-V118 HydrophobicContact CD2-CG2 3.93Å; L94-V118 HydrophobicContact CD1-CG2 4.12Å; L94-V118 HydrophobicContact CD2-CG2 4.34Å; V118-C120 PolarHBondContact O-N 3.14Å; V118-H131 HydrophobicContact CB-CB 4.28Å; V118-H131 PolarHBondContact N-O 3.34Å; V118-H131 PolarHBondContact O-N 3.08Å; V118-V133 HydrophobicContact CG2-CG2 3.99Å
119	Q	95.8	Very high	92.6	Very high	31 Å²	31	49.8 Å²	49.8	15%	0.145	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	121	173.1	-177.8	-175.6	28.1	0	0	109	L75 S76 K78 Q117 V121 V128 Y130	L75-Q119 WeakPolarHBondContact CA-O 3.32Å; S76-Q119 PolarHBondContact N-O 2.99Å; S76-Q119 PolarHBondContact O-N 3.46Å; S76-Q119 PolarHBondContact OG-OE1 2.8Å; K78-Q119 HydrophobicContact CG-CB 3.92Å; Q117-Q119 PolarHBondContact O-N 3.18Å; Q119-V121 HydrophobicContact CG-CG2 4.27Å; Q119-V128 HydrophobicContact CG-CG1 3.73Å; Q119-Y130 HydrophobicContact CB-CD1 4.01Å; Q119-Y130 HydrophobicContact CB-CE1 3.86Å; Q119-Y130 HydrophobicContact CG-CD1 4.22Å; Q119-Y130 HydrophobicContact CG-CE1 3.74Å; Q119-Y130 PolarHBondContact NE2-OH 3.45Å
120	C	95.1	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.8	170.6	-170.9	0	0	0	0	110.3	C32 I62 E74 L75 V118 V128 I129	C32-C120 WeakPolarHBondContact CA-SG 3.31Å; C32-C120 HydrophobicContact CB-CB 3.61Å; C32-C120 WeakPolarHBondContact CB-SG 3.46Å; C32-C120 WeakPolarHBondContact SG-CB 3.44Å; C32-C120 PolarHBondContact SG-O 3.28Å; C32-C120 CovalentContact SG-SG 2.03Å; C32-C120 PolarHBondContact SG-SG 3.38Å; I62-C120 HydrophobicContact CG2-CB 4.34Å; E74-C120 CarbonylContact O-C 3.47Å; E74-C120 WeakPolarHBondContact O-CA 3.36Å; L75-C120 HydrophobicContact CD2-CB 3.58Å; L75-C120 VanDerWaalsContact CD2-SG 3.55Å; V118-C120 PolarHBondContact O-N 3.14Å; C120-V128 WeakPolarHBondContact O-CA 3.4Å; C120-I129 PolarHBondContact N-O 3.06Å; C120-I129 PolarHBondContact O-N 3.28Å
121	V	94.4	Very high	92.8	Very high	39 Å²	39	48.1 Å²	48.1	24%	0.236	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.5	173.4	-175.3	0	0	0	0	108.8	I73 E74 Q119 K123 V128	I73-V121 CarbonylContact C-O 3.2Å; I73-V121 VanDerWaalsContact CA-O 3.24Å; I73-V121 WeakPolarHBondContact CA-O 3.4Å; E74-V121 HydrophobicContact CB-CB 4.21Å; E74-V121 PolarHBondContact N-O 3.13Å; E74-V121 PolarHBondContact O-N 3.06Å; Q119-V121 HydrophobicContact CG-CG2 4.27Å; V121-K123 PolarHBondContact O-N 3.49Å; V121-V128 HydrophobicContact CG1-CG2 4.48Å; V121-V128 HydrophobicContact CG2-CG2 4.27Å
122	N	92.8	Very high	92.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	111.5	173.6	-178.4	-32.6	0	0	0	108.6	Y28 D31 C32 K124 V125 G126 T127	Y28-N122 PolarHBondContact O-ND2 3.16Å; Y28-N122 VanDerWaalsContact O-ND2 3.11Å; D31-N122 WeakPolarHBondContact CB-ND2 3.42Å; D31-N122 PolarHBondContact O-ND2 2.9Å; D31-N122 VanDerWaalsContact O-ND2 3.11Å; C32-N122 HydrophobicContact CB-CB 4.5Å; C32-N122 PolarHBondContact SG-N 3.32Å; C32-N122 VanDerWaalsContact SG-N 3.37Å; N122-K124 PolarHBondContact O-N 3.18Å; N122-K124 PolarHBondContact OD1-N 3.37Å; N122-V125 HydrophobicContact CB-CG2 3.9Å; N122-V125 VanDerWaalsContact ND2-CG2 3.3Å; N122-V125 WeakPolarHBondContact ND2-CG2 3.08Å; N122-V125 PolarHBondContact OD1-N 2.97Å; N122-G126 VanDerWaalsContact O-CA 3.25Å; N122-G126 WeakPolarHBondContact O-CA 3.31Å; N122-G126 PolarHBondContact O-N 3.42Å; N122-T127 WeakPolarHBondContact CB-OG1 3.39Å; N122-T127 PolarHBondContact N-O 3.43Å
123	K	89.8	Confident	92.9	Very high	110 Å²	110	44.9 Å²	44.9	48%	0.478	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.7	-173.1	-67.2	-163	175.7	-170.1	0	113.8	T72 E74 V121	T72-K123 PolarHBondContact O-N 3.35Å; E74-K123 WeakPolarHBondContact OE2-CE 3.28Å; E74-K123 IonicContact OE2-NZ 3.83Å; E74-K123 PolarHBondContact OE2-NZ 3.06Å; V121-K123 PolarHBondContact O-N 3.49Å
124	K	85.3	Confident	93	Very high	94 Å²	94	47.3 Å²	47.3	41%	0.409	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-39.9	-175	-63.9	176	-178	151.8	0	112.7	Y28 D31 N122	Y28-K124 HydrophobicContact CD1-CD 3.23Å; Y28-K124 VanDerWaalsContact CD1-NZ 3.32Å; Y28-K124 HydrophobicContact CE1-CD 3.65Å; Y28-K124 HydrophobicContact CG-CD 4.23Å; D31-K124 IonicContact OD2-NZ 3.12Å; N122-K124 PolarHBondContact O-N 3.18Å; N122-K124 PolarHBondContact OD1-N 3.37Å
125	V	86.6	Confident	93	Very high	72 Å²	72	46.8 Å²	46.8	44%	0.436	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-9.9	-179	-65.7	0	0	0	0	113.7	N122 T127	N122-V125 HydrophobicContact CB-CG2 3.9Å; N122-V125 VanDerWaalsContact ND2-CG2 3.3Å; N122-V125 WeakPolarHBondContact ND2-CG2 3.08Å; N122-V125 PolarHBondContact OD1-N 2.97Å; V125-T127 VanDerWaalsContact C-N 3.26Å; V125-T127 HydrophobicContact CB-CG2 4.44Å; V125-T127 HydrophobicContact CG2-CG2 3.8Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.43Å; V125-T127 PolarHBondContact O-N 3.27Å
126	G	85.6	Confident	93	Very high	54 Å²	54	46.8 Å²	46.8	56%	0.557	24%	0.241	S	C	*	.			trans	73.9	12.5	179.6	0	0	0	0	0	114.5	N122	N122-G126 VanDerWaalsContact O-CA 3.25Å; N122-G126 WeakPolarHBondContact O-CA 3.31Å; N122-G126 PolarHBondContact O-N 3.42Å
127	T	90.2	Very high	93	Very high	53 Å²	53	47 Å²	47	33%	0.325	24%	0.242	S	C	.	.			trans	-72.9	143.9	175.7	55.6	0	0	0	0	110.7	N122 V125	N122-T127 WeakPolarHBondContact CB-OG1 3.39Å; N122-T127 PolarHBondContact N-O 3.43Å; V125-T127 VanDerWaalsContact C-N 3.26Å; V125-T127 HydrophobicContact CB-CG2 4.44Å; V125-T127 HydrophobicContact CG2-CG2 3.8Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.43Å; V125-T127 PolarHBondContact O-N 3.27Å
128	V	92.7	Very high	93	Very high	63 Å²	63	50.2 Å²	50.2	38%	0.382	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.3	177.9	-176.2	0	0	0	0	108.1	Q119 C120 V121 Y130	Q119-V128 HydrophobicContact CG-CG1 3.73Å; C120-V128 WeakPolarHBondContact O-CA 3.4Å; V121-V128 HydrophobicContact CG1-CG2 4.48Å; V121-V128 HydrophobicContact CG2-CG2 4.27Å; V128-Y130 HydrophobicContact CG1-CD2 4.34Å; V128-Y130 HydrophobicContact CG1-CE2 3.68Å
129	I	93.2	Very high	92.9	Very high	51 Å²	51	51.8 Å²	51.8	26%	0.262	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.8	177.2	-59.7	178.3	0	0	0	108.1	C32 K33 C120	C32-I129 HydrophobicContact CB-CB 4.2Å; C32-I129 HydrophobicContact CB-CD1 3.88Å; C32-I129 HydrophobicContact CB-CG1 4.19Å; K33-I129 HydrophobicContact CG-CD1 3.97Å; C120-I129 PolarHBondContact N-O 3.06Å; C120-I129 PolarHBondContact O-N 3.28Å
130	Y	94.5	Very high	92.8	Very high	121 Å²	121	55.1 Å²	55.1	48%	0.475	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.5	175.8	-64.3	-88.3	0	0	0	109.1	K78 Q117 Q119 V128	K78-Y130 HydrophobicContact CG-CE1 4.25Å; Q117-Y130 HydrophobicContact CB-CD1 4.26Å; Q119-Y130 HydrophobicContact CB-CD1 4.01Å; Q119-Y130 HydrophobicContact CB-CE1 3.86Å; Q119-Y130 HydrophobicContact CG-CD1 4.22Å; Q119-Y130 HydrophobicContact CG-CE1 3.74Å; Q119-Y130 PolarHBondContact NE2-OH 3.45Å; V128-Y130 HydrophobicContact CG1-CD2 4.34Å; V128-Y130 HydrophobicContact CG1-CE2 3.68Å
131	H	94.5	Very high	92.8	Very high	7 Å²	7	55.7 Å²	55.7	3%	0.032	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	109.6	173.2	-61.1	-77	0	0	0	108.7	C32 M60 I62 V118	C32-H131 PolarHBondContact O-CE1 3.22Å; C32-H131 PolarHBondContact O-NE2 3.12Å; M60-H131 HydrophobicContact CE-CB 3.59Å; I62-H131 VanDerWaalsContact CD1-CD2 3.5Å; I62-H131 WeakPolarHBondContact CD1-CD2 3.32Å; V118-H131 HydrophobicContact CB-CB 4.28Å; V118-H131 PolarHBondContact N-O 3.34Å; V118-H131 PolarHBondContact O-N 3.08Å
132	E	95.3	Very high	92.7	Very high	53 Å²	53	55.7 Å²	55.7	25%	0.248	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133	178.7	-170	-178.8	90.5	0	0	110.5	A41 T42 V115 R134	A41-E132 CarbonylContact C-O 3.57Å; A41-E132 WeakPolarHBondContact CA-O 3.35Å; A41-E132 HydrophobicContact CB-CB 4.42Å; T42-E132 PolarHBondContact N-O 3.37Å; V115-E132 HydrophobicContact CG1-CG 3.99Å; E132-R134 HydrophobicContact CG-CG 4.34Å; E132-R134 IonicContact OE1-CZ 2.76Å; E132-R134 IonicContact OE1-NE 3.78Å; E132-R134 PolarHBondContact OE1-NE 2.78Å; E132-R134 IonicContact OE1-NH2 3.68Å; E132-R134 PolarHBondContact OE1-NH2 3.29Å; E132-R134 IonicContact OE2-NH2 2.69Å
133	V	95.2	Very high	92.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.6	174.4	-175.6	0	0	0	0	108	T42 V57 M60 L94 V115 V116 V118 I135	T42-V133 CarbonylContact O-C 3.57Å; T42-V133 VanDerWaalsContact O-CA 3.29Å; T42-V133 WeakPolarHBondContact O-CA 3.23Å; V57-V133 HydrophobicContact CG2-CG1 3.9Å; M60-V133 HydrophobicContact CE-CG2 3.63Å; M60-V133 HydrophobicContact SD-CG2 3.65Å; L94-V133 HydrophobicContact CD1-CB 4.25Å; L94-V133 HydrophobicContact CD1-CG1 3.95Å; L94-V133 HydrophobicContact CD1-CG2 3.79Å; V115-V133 WeakPolarHBondContact CA-O 3.38Å; V116-V133 HydrophobicContact CG2-CB 3.83Å; V116-V133 HydrophobicContact CG2-CG1 4.46Å; V116-V133 HydrophobicContact CG2-CG2 4.45Å; V116-V133 PolarHBondContact N-O 2.99Å; V116-V133 PolarHBondContact O-N 3.08Å; V118-V133 HydrophobicContact CG2-CG2 3.99Å; V133-I135 HydrophobicContact CG1-CD1 3.88Å; V133-I135 HydrophobicContact CG1-CG1 4.28Å
134	R	95.8	Very high	93.1	Very high	120 Å²	120	54.7 Å²	54.7	45%	0.453	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117	174.8	-58	-172	-175.1	-167.1	-2.4	108.9	T42 I43 V44 V115 E132	T42-R134 PolarHBondContact O-N 3.11Å; I43-R134 WeakPolarHBondContact CA-O 3.3Å; I43-R134 HydrophobicContact CG1-CB 4.3Å; I43-R134 HydrophobicContact CG2-CB 4.5Å; V44-R134 PolarHBondContact N-O 3.45Å; V115-R134 HydrophobicContact CG1-CG 4.35Å; V115-R134 HydrophobicContact CG2-CG 4.18Å; E132-R134 HydrophobicContact CG-CG 4.34Å; E132-R134 IonicContact OE1-CZ 2.76Å; E132-R134 IonicContact OE1-NE 3.78Å; E132-R134 PolarHBondContact OE1-NE 2.78Å; E132-R134 IonicContact OE1-NH2 3.68Å; E132-R134 PolarHBondContact OE1-NH2 3.29Å; E132-R134 IonicContact OE2-NH2 2.69Å
135	I	95.1	Very high	93.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.9	173.3	-55.9	99.3	0	0	0	107.2	V44 I46 L56 V85 S113 I114 V116 V133	V44-I135 HydrophobicContact CG2-CB 4.2Å; V44-I135 HydrophobicContact CG2-CG1 3.67Å; V44-I135 HydrophobicContact CG2-CG2 4.29Å; V44-I135 CarbonylContact O-C 3.58Å; V44-I135 WeakPolarHBondContact O-CA 3.37Å; I46-I135 HydrophobicContact CD1-CG2 3.9Å; I46-I135 HydrophobicContact CG1-CG2 3.67Å; L56-I135 HydrophobicContact CD1-CD1 4.39Å; L56-I135 HydrophobicContact CD1-CG1 4.32Å; L56-I135 HydrophobicContact CD2-CG1 4.5Å; L56-I135 HydrophobicContact CD2-CG2 4.19Å; V85-I135 HydrophobicContact CG2-CD1 4.06Å; S113-I135 CarbonylContact C-O 3.54Å; S113-I135 WeakPolarHBondContact CA-O 3.43Å; S113-I135 WeakPolarHBondContact CB-O 3.48Å; I114-I135 HydrophobicContact CB-CB 4.23Å; I114-I135 HydrophobicContact CB-CD1 4.15Å; I114-I135 HydrophobicContact CG2-CD1 4.15Å; I114-I135 PolarHBondContact N-O 3.39Å; I114-I135 WeakPolarHBondContact O-CD1 3.38Å; I114-I135 PolarHBondContact O-N 3.2Å; V116-I135 HydrophobicContact CG2-CD1 4.48Å; V133-I135 HydrophobicContact CG1-CD1 3.88Å; V133-I135 HydrophobicContact CG1-CG1 4.28Å
136	V	95.7	Very high	94	Very high	66 Å²	66	50.6 Å²	50.6	40%	0.4	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.4	172.4	-178.3	0	0	0	0	108.1	I43 V44 A45 I46	I43-V136 HydrophobicContact CG2-CG2 4.36Å; V44-V136 PolarHBondContact O-N 2.99Å; A45-V136 VanDerWaalsContact CA-O 3.25Å; A45-V136 WeakPolarHBondContact CA-O 3.26Å; A45-V136 HydrophobicContact CB-CB 4.28Å; I46-V136 PolarHBondContact N-O 3.5Å
137	V	95.3	Very high	94.6	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.2	176.8	-172.2	0	0	0	0	107.9	E48 L103 R105 I111 H112	E48-V137 HydrophobicContact CB-CG1 3.64Å; L103-V137 HydrophobicContact CD1-CG2 4.23Å; L103-V137 HydrophobicContact CD2-CG1 4.25Å; L103-V137 HydrophobicContact CD2-CG2 3.83Å; L103-V137 HydrophobicContact CG-CG1 4.21Å; L103-V137 HydrophobicContact CG-CG2 4.11Å; R105-V137 HydrophobicContact CB-CG1 4.02Å; R105-V137 WeakPolarHBondContact CD-O 3.31Å; R105-V137 HydrophobicContact CG-CG1 4.36Å; R105-V137 PolarHBondContact NE-O 3.34Å; I111-V137 VanDerWaalsContact O-CB 3.28Å; I111-V137 WeakPolarHBondContact O-CB 3.32Å; I111-V137 VanDerWaalsContact O-CG2 3.25Å; I111-V137 WeakPolarHBondContact O-CG2 3.35Å; H112-V137 PolarHBondContact O-N 3.31Å
138	R	94.2	Very high	94.8	Very high	118 Å²	118	52.9 Å²	52.9	45%	0.445	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.6	177.4	-66.7	-170	-66	-101.1	-3.8	109.5	A45 I46 D47 E48	A45-R138 HydrophobicContact CB-CG 4.3Å; A45-R138 VanDerWaalsContact CB-NH1 3.29Å; A45-R138 PolarHBondContact O-NH1 3.38Å; I46-R138 PolarHBondContact O-N 3.02Å; D47-R138 IonicContact OD1-CZ 2.89Å; D47-R138 IonicContact OD1-NE 3.89Å; D47-R138 PolarHBondContact OD1-NE 3.01Å; D47-R138 IonicContact OD1-NH2 3.97Å; D47-R138 PolarHBondContact OD1-NH2 3.14Å; E48-R138 PolarHBondContact N-O 2.98Å
139	D	94.4	Very high	94.9	Very high	33 Å²	33	53.9 Å²	53.9	18%	0.176	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-56.8	136.7	172.2	-160.9	83.2	0	0	0	112	E48 R105 D181 N184	E48-D139 WeakPolarHBondContact OE1-CA 3.33Å; R105-D139 IonicContact CZ-OD1 3.7Å; R105-D139 IonicContact NH1-OD1 2.76Å; R105-D139 PolarHBondContact NH1-OD1 2.83Å; D139-D181 WeakPolarHBondContact OD1-CB 3.34Å; D139-D181 PolarHBondContact OD1-N 3.29Å; D139-D181 PolarHBondContact OD2-N 2.78Å; D139-N184 WeakPolarHBondContact OD2-CB 2.97Å; D139-N184 PolarHBondContact OD2-ND2 3.45Å
140	R	93.3	Very high	94.9	Very high	101 Å²	101	60.6 Å²	60.6	38%	0.381	28%	0.281	S	S	.	.			trans	-115.5	154.1	166.4	-83.2	-71	-170	174.3	-1.4	109	D47 E48 D142 E243	D47-R140 HydrophobicContact CB-CG 4.04Å; D47-R140 IonicContact OD2-CZ 3.97Å; D47-R140 IonicContact OD2-NE 3.45Å; D47-R140 PolarHBondContact OD2-NE 3.05Å; D47-R140 VanDerWaalsContact OD2-NE 3.1Å; D47-R140 IonicContact OD2-NH2 2.76Å; D47-R140 PolarHBondContact OD2-NH2 3.46Å; E48-R140 HydrophobicContact CG-CB 3.85Å; E48-R140 HydrophobicContact CG-CG 4.19Å; E48-R140 PolarHBondContact OE1-N 2.8Å; R140-D142 WeakPolarHBondContact CB-OD1 3.34Å; R140-D142 PolarHBondContact O-N 3.39Å; R140-D142 VanDerWaalsContact O-OD1 3.1Å; R140-E243 IonicContact NH1-OE1 3.5Å; R140-E243 IonicContact NH1-OE2 3.11Å
141	N	94.5	Very high	94.9	Very high	12 Å²	12	58.5 Å²	58.5	6%	0.064	28%	0.284	C	S	.	.			trans	-84.3	65.6	176.1	-160.5	64.9	0	0	0	109.5	D180 N184 D236 A238 E243 R245	N141-D180 VanDerWaalsContact CA-OD2 3.29Å; N141-D180 WeakPolarHBondContact CA-OD2 3.38Å; N141-D180 PolarHBondContact OD1-OD2 2.91Å; N141-N184 HydrophobicContact CB-CB 4.24Å; N141-N184 PolarHBondContact N-ND2 3.02Å; N141-N184 WeakPolarHBondContact OD1-CA 3.45Å; N141-N184 WeakPolarHBondContact OD1-CB 3.36Å; N141-D236 VanDerWaalsContact ND2-CG 3.28Å; N141-D236 PolarHBondContact ND2-OD1 3.28Å; N141-D236 PolarHBondContact ND2-OD2 3.03Å; N141-D236 PolarHBondContact OD1-OD2 3.14Å; N141-A238 HydrophobicContact CB-CB 4.13Å; N141-E243 PolarHBondContact ND2-O 3.14Å; N141-R245 WeakPolarHBondContact O-CD 3.46Å; N141-R245 PolarHBondContact O-NE 2.95Å
142	D	93	Very high	95.1	Very high	38 Å²	38	58.9 Å²	58.9	20%	0.203	29%	0.285	C	S	.	.			trans	-100.8	-4.9	-177.3	60.4	-74.6	0	0	0	115.2	R140 D180 R245	R140-D142 WeakPolarHBondContact CB-OD1 3.34Å; R140-D142 PolarHBondContact O-N 3.39Å; R140-D142 VanDerWaalsContact O-OD1 3.1Å; D142-D180 PolarHBondContact N-OD2 3.44Å; D142-R245 VanDerWaalsContact C-CZ 3.41Å; D142-R245 VanDerWaalsContact C-NH1 3.32Å; D142-R245 VanDerWaalsContact CA-NH2 3.34Å; D142-R245 PolarHBondContact O-NH1 3.23Å; D142-R245 PolarHBondContact O-NH2 3.06Å; D142-R245 VanDerWaalsContact O-NH2 3.1Å
143	N	94.5	Very high	95.1	Very high	46 Å²	46	62.4 Å²	62.4	25%	0.246	30%	0.297	C	S	.	.	S	Bend	trans	-107.8	159.5	167.2	-59.2	-79.1	0	0	0	111.6	D106 I179 D180 R245	D106-N143 PolarHBondContact OD2-ND2 3.39Å; N143-I179 HydrophobicContact CB-CD1 4.15Å; N143-I179 HydrophobicContact CB-CG1 3.57Å; N143-I179 VanDerWaalsContact CG-CG1 3.43Å; N143-D180 WeakPolarHBondContact CB-OD1 3.22Å; N143-D180 PolarHBondContact N-OD1 2.86Å; N143-D180 PolarHBondContact N-OD2 3.36Å; N143-D180 VanDerWaalsContact N-OD2 3.16Å; N143-D180 PolarHBondContact ND2-OD1 3.1Å; N143-R245 WeakPolarHBondContact O-CD 3.34Å
144	S	95.3	Very high	95.2	Very high	44 Å²	44	62.9 Å²	62.9	31%	0.308	30%	0.301	S	S	.	.			trans	-114.2	150.5	179.5	-64.3	0	0	0	0	109.1	T146 R245	S144-T146 PolarHBondContact O-N 3.36Å; S144-R245 WeakPolarHBondContact OG-CB 3.47Å; S144-R245 WeakPolarHBondContact OG-CD 3.47Å; S144-R245 PolarHBondContact OG-NH1 2.98Å
145	P	96.2	Very high	95.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.3	C	S	.	.			trans	-58.3	139.6	175.8	-24.5	33	0	0	0	110.1	A176 D178 I187 A234 D236 T247	P145-A176 HydrophobicContact CB-CB 4.26Å; P145-D178 WeakPolarHBondContact CD-OD2 3.49Å; P145-D178 HydrophobicContact CG-CB 4.42Å; P145-D178 WeakPolarHBondContact CG-OD2 3.4Å; P145-I187 HydrophobicContact CB-CD1 4.06Å; P145-I187 HydrophobicContact CB-CG1 4.25Å; P145-I187 HydrophobicContact CG-CG1 4.37Å; P145-A234 HydrophobicContact CB-CB 4.12Å; P145-D236 HydrophobicContact CG-CB 4.19Å; P145-T247 WeakPolarHBondContact O-CB 3.41Å; P145-T247 PolarHBondContact O-OG1 3.07Å
146	T	96.2	Very high	95.2	Very high	79 Å²	79	60.8 Å²	60.8	49%	0.485	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.5	179.9	50.6	0	0	0	0	110.3	S144 A176 T177	S144-T146 PolarHBondContact O-N 3.36Å; T146-A176 CarbonylContact O-C 3.58Å; T146-A176 WeakPolarHBondContact O-CA 3.26Å; T146-T177 PolarHBondContact N-O 2.81Å; T146-T177 PolarHBondContact O-N 2.91Å; T146-T177 PolarHBondContact OG1-O 2.88Å; T146-T177 VanDerWaalsContact OG1-O 3.14Å
147	F	96.6	Very high	95.2	Very high	29 Å²	29	60.3 Å²	60.3	13%	0.127	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.7	172.2	-78.2	-79.2	0	0	0	110.5	H149 Y152 F170 A176 Y189 I232 A234 T247 T249	F147-H149 VanDerWaalsContact C-N 3.33Å; F147-H149 WeakPolarHBondContact CB-O 3.09Å; F147-H149 PolarHBondContact O-N 3.15Å; F147-Y152 HydrophobicContact CB-CE2 4.46Å; F147-Y152 AromaticContact CD1-CE2 3.81Å; F147-Y152 HydrophobicContact CD1-CE2 3.81Å; F147-Y152 HydrophobicContact CE1-CE2 4.43Å; F147-Y152 HydrophobicContact CG-CE2 4.38Å; F147-F170 HydrophobicContact CD1-CE1 4.32Å; F147-F170 HydrophobicContact CE1-CD1 4.21Å; F147-F170 AromaticContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CZ 4.17Å; F147-A176 HydrophobicContact CD1-CB 3.87Å; F147-A176 HydrophobicContact CD2-CB 4.32Å; F147-A176 HydrophobicContact CE1-CB 3.91Å; F147-A176 HydrophobicContact CE2-CB 4.34Å; F147-A176 HydrophobicContact CG-CB 4.09Å; F147-A176 HydrophobicContact CZ-CB 4.15Å; F147-Y189 HydrophobicContact CE1-CD1 4.25Å; F147-Y189 AromaticContact CE1-CE1 3.66Å; F147-Y189 HydrophobicContact CE1-CE1 3.66Å; F147-Y189 HydrophobicContact CZ-CD1 4.15Å; F147-Y189 AromaticContact CZ-CE1 3.91Å; F147-Y189 HydrophobicContact CZ-CE1 3.91Å; F147-I232 HydrophobicContact CZ-CG2 4.39Å; F147-A234 HydrophobicContact CE1-CB 4.5Å; F147-A234 HydrophobicContact CE2-CB 3.75Å; F147-A234 HydrophobicContact CZ-CB 3.66Å; F147-T247 HydrophobicContact CD2-CG2 4.02Å; F147-T249 HydrophobicContact CD1-CG2 3.78Å; F147-T249 HydrophobicContact CD2-CG2 3.93Å; F147-T249 HydrophobicContact CE1-CG2 3.47Å; F147-T249 VanDerWaalsContact CE1-CG2 3.47Å; F147-T249 HydrophobicContact CE2-CG2 3.65Å; F147-T249 HydrophobicContact CG-CG2 4Å; F147-T249 HydrophobicContact CZ-CG2 3.4Å; F147-T249 VanDerWaalsContact CZ-CG2 3.4Å
148	K	94.6	Very high	95.2	Very high	127 Å²	127	60.1 Å²	60.1	55%	0.552	30%	0.296	S	S	*	.	S	Bend	trans	-65.2	-35.6	177.1	-172.5	174.6	-175	175.5	0	113.6	D173 G175	K148-D173 WeakPolarHBondContact CD-O 3.48Å; K148-G175 PolarHBondContact N-O 3.37Å
149	H	95.2	Very high	95.3	Very high	83 Å²	83	58.1 Å²	58.1	38%	0.384	29%	0.293	S	S	.	.	S	Bend	trans	-118.4	146.7	178.6	-52.9	-77.7	0	0	0	110.1	F147 S151 Y152 N174	F147-H149 VanDerWaalsContact C-N 3.33Å; F147-H149 WeakPolarHBondContact CB-O 3.09Å; F147-H149 PolarHBondContact O-N 3.15Å; H149-S151 VanDerWaalsContact C-N 3.27Å; H149-S151 PolarHBondContact O-N 3.39Å; H149-Y152 HydrophobicContact CB-CE1 4.23Å; H149-Y152 HydrophobicContact CB-CE2 4.21Å; H149-Y152 AromaticContact CD2-CE1 3.65Å; H149-Y152 AromaticContact CD2-CZ 3.93Å; H149-Y152 PolarHBondContact N-OH 2.85Å; H149-N174 PolarHBondContact NE2-OD1 3.17Å
150	E	93.7	Very high	95.3	Very high	192 Å²	192	57.7 Å²	57.7	90%	0.897	29%	0.292	S	S	*	.	S	Bend	trans	-67.5	-28.6	177.1	-65.3	-173.4	165	0	0	112.8	T249	E150-T249 PolarHBondContact O-OG1 3.24Å; E150-T249 VanDerWaalsContact O-OG1 3.14Å
151	S	95.1	Very high	95.5	Very high	78 Å²	78	57.1 Å²	57.1	55%	0.545	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	153.2	179.8	64.4	0	0	0	0	111.1	H149 T250	H149-S151 VanDerWaalsContact C-N 3.27Å; H149-S151 PolarHBondContact O-N 3.39Å; S151-T250 WeakPolarHBondContact CA-O 3.43Å
152	Y	97.1	Very high	95.5	Very high	14 Å²	14	60.5 Å²	60.5	6%	0.055	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.6	177	-62.4	-97.8	0	0	0	110	F147 H149 F167 F170 N174 T249 T250 L251 T252	F147-Y152 HydrophobicContact CB-CE2 4.46Å; F147-Y152 AromaticContact CD1-CE2 3.81Å; F147-Y152 HydrophobicContact CD1-CE2 3.81Å; F147-Y152 HydrophobicContact CE1-CE2 4.43Å; F147-Y152 HydrophobicContact CG-CE2 4.38Å; H149-Y152 HydrophobicContact CB-CE1 4.23Å; H149-Y152 HydrophobicContact CB-CE2 4.21Å; H149-Y152 AromaticContact CD2-CE1 3.65Å; H149-Y152 AromaticContact CD2-CZ 3.93Å; H149-Y152 PolarHBondContact N-OH 2.85Å; Y152-F167 HydrophobicContact CD1-CE2 4.48Å; Y152-F167 AromaticContact CD1-CZ 3.67Å; Y152-F167 HydrophobicContact CD1-CZ 3.67Å; Y152-F167 AromaticContact CG-CZ 3.97Å; Y152-F167 HydrophobicContact CG-CZ 3.97Å; Y152-F170 HydrophobicContact CD1-CD1 4.31Å; Y152-F170 AromaticContact CD1-CE1 3.96Å; Y152-F170 HydrophobicContact CD1-CE1 3.96Å; Y152-F170 AromaticContact CD2-CE1 3.74Å; Y152-F170 HydrophobicContact CD2-CE1 3.74Å; Y152-F170 HydrophobicContact CD2-CZ 4.48Å; Y152-F170 AromaticContact CE1-CD1 3.95Å; Y152-F170 HydrophobicContact CE1-CD1 3.95Å; Y152-F170 AromaticContact CE1-CE1 3.87Å; Y152-F170 HydrophobicContact CE1-CE1 3.87Å; Y152-F170 HydrophobicContact CE2-CD1 4.43Å; Y152-F170 AromaticContact CE2-CE1 3.72Å; Y152-F170 HydrophobicContact CE2-CE1 3.72Å; Y152-F170 AromaticContact CG-CE1 3.88Å; Y152-F170 HydrophobicContact CG-CE1 3.88Å; Y152-F170 AromaticContact CZ-CE1 3.78Å; Y152-N174 WeakPolarHBondContact CE1-O 3.31Å; Y152-N174 PolarHBondContact OH-O 3.12Å; Y152-T249 HydrophobicContact CD2-CG2 3.81Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.38Å; Y152-T249 HydrophobicContact CE2-CG2 3.8Å; Y152-T249 WeakPolarHBondContact CE2-OG1 3.41Å; Y152-T250 PolarHBondContact N-O 2.92Å; Y152-L251 WeakPolarHBondContact O-CA 3.27Å; Y152-T252 PolarHBondContact O-N 2.79Å
153	Y	96.6	Very high	95.6	Very high	128 Å²	128	61.1 Å²	61.1	50%	0.502	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.3	-177.8	-177.6	-103.1	0	0	0	110.7	T155 T252 D254	Y153-T155 HydrophobicContact CE1-CG2 3.56Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.4Å; Y153-T252 WeakPolarHBondContact CA-O 3.08Å; Y153-T252 HydrophobicContact CD2-CG2 4.27Å; Y153-T252 HydrophobicContact CE2-CG2 4.43Å; Y153-D254 HydrophobicContact CE2-CB 4.22Å; Y153-D254 VanDerWaalsContact CE2-OD2 3.23Å; Y153-D254 WeakPolarHBondContact CE2-OD2 3.42Å; Y153-D254 WeakPolarHBondContact OH-CB 3.31Å; Y153-D254 VanDerWaalsContact OH-CG 3.3Å; Y153-D254 PolarHBondContact OH-OD2 2.8Å
154	A	96.2	Very high	95.7	Very high	9 Å²	9	61.5 Å²	61.5	7%	0.074	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.7	173.2	0	0	0	0	0	110.4	F167 L251 T252 V253 D254	A154-F167 HydrophobicContact CB-CB 4.43Å; A154-F167 HydrophobicContact CB-CD2 3.97Å; A154-L251 HydrophobicContact CB-CD1 4.1Å; A154-T252 PolarHBondContact N-O 2.84Å; A154-V253 WeakPolarHBondContact O-CA 3.21Å; A154-D254 PolarHBondContact O-N 3.04Å
155	T	95.7	Very high	95.7	Very high	71 Å²	71	62.7 Å²	62.7	44%	0.436	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.5	172.1	53	0	0	0	0	109	Y153 D254 L256	Y153-T155 HydrophobicContact CE1-CG2 3.56Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.4Å; T155-D254 CarbonylContact C-O 3.51Å; T155-D254 WeakPolarHBondContact CA-O 3.02Å; T155-D254 HydrophobicContact CG2-CB 4.4Å; T155-L256 HydrophobicContact CG2-CD2 4.35Å
156	V	96.4	Very high	95.7	Very high	6 Å²	6	64 Å²	64	4%	0.036	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.9	-179.3	-176	0	0	0	0	108.5	T160 I166 L220 V253 D254 V255 L256	V156-T160 HydrophobicContact CG1-CG2 4.08Å; V156-T160 WeakPolarHBondContact CG1-OG1 3.22Å; V156-I166 HydrophobicContact CB-CG2 4.4Å; V156-I166 HydrophobicContact CG1-CG2 3.77Å; V156-I166 HydrophobicContact CG2-CB 3.59Å; V156-I166 HydrophobicContact CG2-CD1 3.93Å; V156-I166 HydrophobicContact CG2-CG1 4.38Å; V156-I166 HydrophobicContact CG2-CG2 3.62Å; V156-L220 HydrophobicContact CB-CD1 4.04Å; V156-L220 HydrophobicContact CG1-CD1 3.62Å; V156-V253 HydrophobicContact CB-CG1 4.31Å; V156-V253 HydrophobicContact CG2-CG1 3.7Å; V156-D254 PolarHBondContact N-O 2.85Å; V156-V255 CarbonylContact O-C 3.55Å; V156-V255 VanDerWaalsContact O-CA 3.26Å; V156-V255 WeakPolarHBondContact O-CA 3.19Å; V156-L256 PolarHBondContact O-N 2.88Å
157	N	95.1	Very high	95.7	Very high	55 Å²	55	61.3 Å²	61.3	29%	0.294	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.4	173.4	-177.9	-77	0	0	0	109.9	L159 T160 L256	N157-L159 PolarHBondContact O-N 2.8Å; N157-L159 WeakPolarHBondContact OD1-CB 3.39Å; N157-L159 VanDerWaalsContact OD1-CG 3.3Å; N157-L159 WeakPolarHBondContact OD1-CG 3.5Å; N157-L159 PolarHBondContact OD1-N 2.59Å; N157-T160 WeakPolarHBondContact O-CB 3.44Å; N157-T160 PolarHBondContact O-N 2.81Å; N157-T160 PolarHBondContact O-OG1 2.82Å; N157-L256 WeakPolarHBondContact CA-O 3.31Å; N157-L256 HydrophobicContact CB-CB 4.47Å
158	E	96.1	Very high	95.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27	-175.1	77.4	-171.5	104.5	0	0	114.7	T160 L220 N221 Y222 V255 L256 D257 G258	E158-T160 PolarHBondContact O-N 2.73Å; E158-L220 HydrophobicContact CB-CB 4.1Å; E158-N221 WeakPolarHBondContact OE2-CA 3.46Å; E158-Y222 WeakPolarHBondContact OE1-CB 3.35Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.17Å; E158-Y222 PolarHBondContact OE2-N 2.74Å; E158-V255 HydrophobicContact CB-CG1 3.71Å; E158-L256 PolarHBondContact N-O 2.84Å; E158-D257 WeakPolarHBondContact OE1-CA 3.3Å; E158-G258 PolarHBondContact OE1-N 2.77Å
159	L	95.4	Very high	95.5	Very high	75 Å²	75	58.3 Å²	58.3	39%	0.393	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.3	176.2	-49.1	-179.5	0	0	0	112.6	N157 P161 D260	N157-L159 PolarHBondContact O-N 2.8Å; N157-L159 WeakPolarHBondContact OD1-CB 3.39Å; N157-L159 VanDerWaalsContact OD1-CG 3.3Å; N157-L159 WeakPolarHBondContact OD1-CG 3.5Å; N157-L159 PolarHBondContact OD1-N 2.59Å; L159-P161 WeakPolarHBondContact O-CD 3.39Å; L159-D260 HydrophobicContact CD2-CB 3.66Å
160	T	95.1	Very high	95.4	Very high	25 Å²	25	54.8 Å²	54.8	15%	0.153	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-60.1	122.9	179.1	-60.5	0	0	0	0	110.2	V156 N157 E158 T164 I166 L216	V156-T160 HydrophobicContact CG1-CG2 4.08Å; V156-T160 WeakPolarHBondContact CG1-OG1 3.22Å; N157-T160 WeakPolarHBondContact O-CB 3.44Å; N157-T160 PolarHBondContact O-N 2.81Å; N157-T160 PolarHBondContact O-OG1 2.82Å; E158-T160 PolarHBondContact O-N 2.73Å; T160-T164 HydrophobicContact CG2-CG2 3.77Å; T160-I166 HydrophobicContact CG2-CG2 4.48Å; T160-L216 HydrophobicContact CG2-CD2 4.1Å; T160-L216 VanDerWaalsContact O-CD2 3.23Å; T160-L216 WeakPolarHBondContact O-CD2 3.45Å
161	P	96.7	Very high	95.3	Very high	89 Å²	89	49 Å²	49	58%	0.578	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-63.2	143.9	179.7	-23.9	34.2	0	0	0	112.5	L159 G163 T164	L159-P161 WeakPolarHBondContact O-CD 3.39Å; P161-G163 PolarHBondContact O-N 3.47Å; P161-T164 VanDerWaalsContact O-CB 3.26Å; P161-T164 WeakPolarHBondContact O-CB 3.48Å; P161-T164 PolarHBondContact O-N 2.83Å; P161-T164 PolarHBondContact O-OG1 3.28Å
162	V	95.7	Very high	95	Very high	82 Å²	82	48.8 Å²	48.8	50%	0.497	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	137.3	170.7	177.2	0	0	0	0	110.2	R217 R219	V162-R217 VanDerWaalsContact CG1-O 3.25Å; V162-R217 WeakPolarHBondContact CG1-O 3.34Å; V162-R219 HydrophobicContact CG2-CB 4.32Å
163	G	94.2	Very high	94.6	Very high	51 Å²	51	54.1 Å²	54.1	53%	0.526	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-6.2	-174	0	0	0	0	0	114.2	P161 V215 L216	P161-G163 PolarHBondContact O-N 3.47Å; G163-V215 VanDerWaalsContact C-CG1 3.47Å; G163-V215 WeakPolarHBondContact O-CG1 3.44Å; G163-L216 PolarHBondContact N-O 2.8Å
164	T	96.2	Very high	94.5	Very high	55 Å²	55	50.4 Å²	50.4	34%	0.337	33%	0.327	S	S	.	.			trans	-72.3	136.2	175.9	-54.7	0	0	0	0	110.9	T160 P161 I166 V215 L216	T160-T164 HydrophobicContact CG2-CG2 3.77Å; P161-T164 VanDerWaalsContact O-CB 3.26Å; P161-T164 WeakPolarHBondContact O-CB 3.48Å; P161-T164 PolarHBondContact O-N 2.83Å; P161-T164 PolarHBondContact O-OG1 3.28Å; T164-I166 PolarHBondContact O-N 2.93Å; T164-V215 WeakPolarHBondContact O-CA 3.29Å; T164-L216 PolarHBondContact O-N 2.92Å
165	T	96.5	Very high	94.3	Very high	69 Å²	69	50 Å²	50	42%	0.423	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	113.7	170.3	-58.8	0	0	0	0	109.2	T168 N213 V214	T165-T168 HydrophobicContact CG2-CG2 3.63Å; T165-N213 HydrophobicContact CG2-CB 4.01Å; T165-V214 CarbonylContact C-O 3.5Å; T165-V214 WeakPolarHBondContact CA-O 3.14Å
166	I	95.5	Very high	94.3	Very high	28 Å²	28	47 Å²	47	14%	0.144	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-19.7	-176.2	58.5	137.7	0	0	0	113.2	V156 T160 T164 F204 V214 L216 V253	V156-I166 HydrophobicContact CB-CG2 4.4Å; V156-I166 HydrophobicContact CG1-CG2 3.77Å; V156-I166 HydrophobicContact CG2-CB 3.59Å; V156-I166 HydrophobicContact CG2-CD1 3.93Å; V156-I166 HydrophobicContact CG2-CG1 4.38Å; V156-I166 HydrophobicContact CG2-CG2 3.62Å; T160-I166 HydrophobicContact CG2-CG2 4.48Å; T164-I166 PolarHBondContact O-N 2.93Å; I166-F204 HydrophobicContact CD1-CD1 3.53Å; I166-F204 HydrophobicContact CD1-CE1 3.59Å; I166-F204 HydrophobicContact CG1-CD1 4.33Å; I166-V214 HydrophobicContact CD1-CB 4.42Å; I166-V214 HydrophobicContact CD1-CG1 3.92Å; I166-V214 HydrophobicContact CG1-CB 4.18Å; I166-V214 HydrophobicContact CG1-CG1 3.98Å; I166-V214 WeakPolarHBondContact CG1-O 2.98Å; I166-V214 PolarHBondContact N-O 2.86Å; I166-L216 HydrophobicContact CG2-CB 4.04Å; I166-V253 HydrophobicContact CD1-CG1 4.3Å; I166-V253 HydrophobicContact CD1-CG2 4.23Å
167	F	96.2	Very high	94.3	Very high	21 Å²	21	49.1 Å²	49.1	9%	0.092	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	128.4	-176.3	179.4	-97.8	0	0	0	111.7	Y152 A154 F170 N213 V214 L251	Y152-F167 HydrophobicContact CD1-CE2 4.48Å; Y152-F167 AromaticContact CD1-CZ 3.67Å; Y152-F167 HydrophobicContact CD1-CZ 3.67Å; Y152-F167 AromaticContact CG-CZ 3.97Å; Y152-F167 HydrophobicContact CG-CZ 3.97Å; A154-F167 HydrophobicContact CB-CB 4.43Å; A154-F167 HydrophobicContact CB-CD2 3.97Å; F167-F170 HydrophobicContact CD1-CE2 4.39Å; F167-F170 AromaticContact CE1-CD1 3.87Å; F167-F170 HydrophobicContact CE1-CD1 3.87Å; F167-F170 HydrophobicContact CE1-CD2 4.03Å; F167-F170 AromaticContact CE1-CE1 3.74Å; F167-F170 HydrophobicContact CE1-CE1 3.74Å; F167-F170 AromaticContact CE1-CE2 3.87Å; F167-F170 HydrophobicContact CE1-CE2 3.87Å; F167-F170 HydrophobicContact CE1-CG 4.04Å; F167-F170 AromaticContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CZ-CD1 4.36Å; F167-F170 HydrophobicContact CZ-CE1 4.19Å; F167-N213 WeakPolarHBondContact O-CA 3.5Å; F167-V214 HydrophobicContact CB-CB 4.09Å; F167-V214 HydrophobicContact CB-CG2 4.38Å; F167-V214 HydrophobicContact CD1-CG2 4.06Å; F167-V214 PolarHBondContact N-O 2.9Å; F167-V214 PolarHBondContact O-N 2.91Å; F167-L251 HydrophobicContact CB-CD2 4.26Å; F167-L251 HydrophobicContact CD1-CD1 4.48Å; F167-L251 HydrophobicContact CD1-CD2 4.04Å; F167-L251 HydrophobicContact CD2-CD1 3.94Å; F167-L251 HydrophobicContact CE1-CD1 4.45Å; F167-L251 HydrophobicContact CE2-CD1 3.89Å; F167-L251 HydrophobicContact CG-CD1 4.22Å; F167-L251 HydrophobicContact CG-CD2 4.06Å; F167-L251 HydrophobicContact CZ-CD1 4.15Å
168	T	95.1	Very high	94.3	Very high	75 Å²	75	47.4 Å²	47.4	46%	0.46	31%	0.31	S	S	.	.			trans	-124.2	18.1	177.3	60.3	0	0	0	0	111.9	T165 F170 S171	T165-T168 HydrophobicContact CG2-CG2 3.63Å; T168-F170 PolarHBondContact O-N 2.82Å; T168-F170 VanDerWaalsContact O-N 3.11Å; T168-S171 WeakPolarHBondContact O-CB 3.47Å; T168-S171 PolarHBondContact O-N 2.76Å; T168-S171 VanDerWaalsContact O-N 3.16Å; T168-S171 PolarHBondContact O-OG 2.85Å
169	G	91.7	Very high	94.3	Very high	19 Å²	19	51.1 Å²	51.1	20%	0.196	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-4.4	-169.8	0	0	0	0	0	115.2	N174	G169-N174 WeakPolarHBondContact O-CB 3.39Å; G169-N174 PolarHBondContact O-ND2 3.45Å
170	F	94.1	Very high	94.3	Very high	8 Å²	8	48 Å²	48	4%	0.035	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.8	172.7	-58.2	-35.9	0	0	0	114.3	F147 Y152 F167 T168 G175 Y189 G212 I232 T249	F147-F170 HydrophobicContact CD1-CE1 4.32Å; F147-F170 HydrophobicContact CE1-CD1 4.21Å; F147-F170 AromaticContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CZ 4.17Å; Y152-F170 HydrophobicContact CD1-CD1 4.31Å; Y152-F170 AromaticContact CD1-CE1 3.96Å; Y152-F170 HydrophobicContact CD1-CE1 3.96Å; Y152-F170 AromaticContact CD2-CE1 3.74Å; Y152-F170 HydrophobicContact CD2-CE1 3.74Å; Y152-F170 HydrophobicContact CD2-CZ 4.48Å; Y152-F170 AromaticContact CE1-CD1 3.95Å; Y152-F170 HydrophobicContact CE1-CD1 3.95Å; Y152-F170 AromaticContact CE1-CE1 3.87Å; Y152-F170 HydrophobicContact CE1-CE1 3.87Å; Y152-F170 HydrophobicContact CE2-CD1 4.43Å; Y152-F170 AromaticContact CE2-CE1 3.72Å; Y152-F170 HydrophobicContact CE2-CE1 3.72Å; Y152-F170 AromaticContact CG-CE1 3.88Å; Y152-F170 HydrophobicContact CG-CE1 3.88Å; Y152-F170 AromaticContact CZ-CE1 3.78Å; F167-F170 HydrophobicContact CD1-CE2 4.39Å; F167-F170 AromaticContact CE1-CD1 3.87Å; F167-F170 HydrophobicContact CE1-CD1 3.87Å; F167-F170 HydrophobicContact CE1-CD2 4.03Å; F167-F170 AromaticContact CE1-CE1 3.74Å; F167-F170 HydrophobicContact CE1-CE1 3.74Å; F167-F170 AromaticContact CE1-CE2 3.87Å; F167-F170 HydrophobicContact CE1-CE2 3.87Å; F167-F170 HydrophobicContact CE1-CG 4.04Å; F167-F170 AromaticContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CZ-CD1 4.36Å; F167-F170 HydrophobicContact CZ-CE1 4.19Å; T168-F170 PolarHBondContact O-N 2.82Å; T168-F170 VanDerWaalsContact O-N 3.11Å; F170-G175 PolarHBondContact O-N 2.92Å; F170-Y189 HydrophobicContact CB-CE1 4.46Å; F170-Y189 HydrophobicContact CB-CE2 4.4Å; F170-Y189 HydrophobicContact CD2-CD1 4.13Å; F170-Y189 HydrophobicContact CD2-CE1 4.17Å; F170-Y189 HydrophobicContact CD2-CG 4.44Å; F170-Y189 HydrophobicContact CE2-CD1 4.35Å; F170-Y189 HydrophobicContact CG-CE1 4.21Å; F170-G212 WeakPolarHBondContact CD2-O 3.01Å; F170-I232 HydrophobicContact CE2-CD1 3.67Å; F170-I232 HydrophobicContact CE2-CG2 3.79Å; F170-I232 HydrophobicContact CZ-CB 4.3Å; F170-I232 HydrophobicContact CZ-CD1 3.53Å; F170-I232 HydrophobicContact CZ-CG1 4.48Å; F170-I232 HydrophobicContact CZ-CG2 3.94Å; F170-T249 HydrophobicContact CE1-CG2 4.37Å; F170-T249 HydrophobicContact CZ-CG2 4.28Å
171	S	91.5	Very high	94.2	Very high	71 Å²	71	50.9 Å²	50.9	50%	0.497	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	152.8	178	60.3	0	0	0	0	112.6	T168 N174	T168-S171 WeakPolarHBondContact O-CB 3.47Å; T168-S171 PolarHBondContact O-N 2.76Å; T168-S171 VanDerWaalsContact O-N 3.16Å; T168-S171 PolarHBondContact O-OG 2.85Å; S171-N174 VanDerWaalsContact O-CB 3.29Å; S171-N174 WeakPolarHBondContact O-CB 3.37Å; S171-N174 PolarHBondContact O-N 3.47Å
172	G	88.1	Confident	94	Very high	73 Å²	73	48 Å²	48	75%	0.753	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	51.9	171.6	0	0	0	0	0	115	N174	G172-N174 PolarHBondContact O-N 2.89Å
173	D	89	Confident	93.9	Very high	127 Å²	127	47.3 Å²	47.3	68%	0.679	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	21.2	-178.6	-51.2	-20.1	0	0	0	113.7	K148 T177	K148-D173 WeakPolarHBondContact CD-O 3.48Å; D173-T177 HydrophobicContact CB-CG2 4.11Å
174	N	93.6	Very high	93.9	Very high	49 Å²	49	46 Å²	46	26%	0.262	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-9.5	175.3	-161.1	62.5	0	0	0	112.8	H149 Y152 G169 S171 G172	H149-N174 PolarHBondContact NE2-OD1 3.17Å; Y152-N174 WeakPolarHBondContact CE1-O 3.31Å; Y152-N174 PolarHBondContact OH-O 3.12Å; G169-N174 WeakPolarHBondContact O-CB 3.39Å; G169-N174 PolarHBondContact O-ND2 3.45Å; S171-N174 VanDerWaalsContact O-CB 3.29Å; S171-N174 WeakPolarHBondContact O-CB 3.37Å; S171-N174 PolarHBondContact O-N 3.47Å; G172-N174 PolarHBondContact O-N 2.89Å
175	G	93.5	Very high	93.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-90.5	-135.4	171.6	0	0	0	0	0	112.8	K148 F170	K148-G175 PolarHBondContact N-O 3.37Å; F170-G175 PolarHBondContact O-N 2.92Å
176	A	95.3	Very high	93.6	Very high	8 Å²	8	45 Å²	45	7%	0.066	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	144.4	169.7	0	0	0	0	0	111.2	P145 T146 F147 I187 Y189 A234	P145-A176 HydrophobicContact CB-CB 4.26Å; T146-A176 CarbonylContact O-C 3.58Å; T146-A176 WeakPolarHBondContact O-CA 3.26Å; F147-A176 HydrophobicContact CD1-CB 3.87Å; F147-A176 HydrophobicContact CD2-CB 4.32Å; F147-A176 HydrophobicContact CE1-CB 3.91Å; F147-A176 HydrophobicContact CE2-CB 4.34Å; F147-A176 HydrophobicContact CG-CB 4.09Å; F147-A176 HydrophobicContact CZ-CB 4.15Å; A176-I187 HydrophobicContact CB-CD1 3.85Å; A176-I187 HydrophobicContact CB-CG2 4.36Å; A176-I187 WeakPolarHBondContact O-CD1 3.44Å; A176-Y189 HydrophobicContact CB-CE1 3.95Å; A176-Y189 PolarHBondContact N-OH 2.88Å; A176-Y189 PolarHBondContact O-OH 3.1Å; A176-A234 HydrophobicContact CB-CB 3.47Å; A176-A234 VanDerWaalsContact CB-CB 3.47Å
177	T	95.5	Very high	93.6	Very high	51 Å²	51	44.6 Å²	44.6	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.4	171.7	53	0	0	0	0	109.7	T146 D173	T146-T177 PolarHBondContact N-O 2.81Å; T146-T177 PolarHBondContact O-N 2.91Å; T146-T177 PolarHBondContact OG1-O 2.88Å; T146-T177 VanDerWaalsContact OG1-O 3.14Å; D173-T177 HydrophobicContact CB-CG2 4.11Å
178	D	96.2	Very high	93.6	Very high	19 Å²	19	45.3 Å²	45.3	10%	0.102	29%	0.286	C	S	.	.			trans	-121.2	138.5	174.9	-158.7	-41.2	0	0	0	108.1	P145 D180 I187	P145-D178 WeakPolarHBondContact CD-OD2 3.49Å; P145-D178 HydrophobicContact CG-CB 4.42Å; P145-D178 WeakPolarHBondContact CG-OD2 3.4Å; D178-D180 PolarHBondContact OD1-N 3.07Å; D178-I187 HydrophobicContact CB-CD1 4.21Å; D178-I187 HydrophobicContact CB-CG1 4.35Å
179	I	95.5	Very high	93.7	Very high	79 Å²	79	42.2 Å²	42.2	41%	0.405	27%	0.266	S	S	.	.			trans	-90.4	-14.6	-173	65.3	168.7	0	0	0	112.8	D106 N143	D106-I179 HydrophobicContact CB-CD1 4.44Å; N143-I179 HydrophobicContact CB-CD1 4.15Å; N143-I179 HydrophobicContact CB-CG1 3.57Å; N143-I179 VanDerWaalsContact CG-CG1 3.43Å
180	D	95.3	Very high	93.9	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	27%	0.269	C	S	.	.	S	Bend	trans	-63.1	163.1	172.5	-61.8	-14.1	0	0	0	110	N141 D142 N143 D178 N184 G185	N141-D180 VanDerWaalsContact CA-OD2 3.29Å; N141-D180 WeakPolarHBondContact CA-OD2 3.38Å; N141-D180 PolarHBondContact OD1-OD2 2.91Å; D142-D180 PolarHBondContact N-OD2 3.44Å; N143-D180 WeakPolarHBondContact CB-OD1 3.22Å; N143-D180 PolarHBondContact N-OD1 2.86Å; N143-D180 PolarHBondContact N-OD2 3.36Å; N143-D180 VanDerWaalsContact N-OD2 3.16Å; N143-D180 PolarHBondContact ND2-OD1 3.1Å; D178-D180 PolarHBondContact OD1-N 3.07Å; D180-N184 HydrophobicContact CB-CB 3.51Å; D180-G185 WeakPolarHBondContact O-CA 3.24Å; D180-G185 PolarHBondContact O-N 2.93Å
181	D	93.2	Very high	94	Very high	86 Å²	86	44.1 Å²	44.1	46%	0.46	27%	0.273	S	S	.	.			trans	-99.4	160.1	-177	-167.2	15.6	0	0	0	113.7	R105 D139 N184 G185	R105-D181 IonicContact CZ-OD2 2.64Å; R105-D181 IonicContact NH1-OD2 3.37Å; R105-D181 PolarHBondContact NH1-OD2 2.94Å; R105-D181 IonicContact NH2-OD2 3.9Å; R105-D181 PolarHBondContact NH2-OD2 2.95Å; D139-D181 WeakPolarHBondContact OD1-CB 3.34Å; D139-D181 PolarHBondContact OD1-N 3.29Å; D139-D181 PolarHBondContact OD2-N 2.78Å; D181-N184 PolarHBondContact O-N 2.54Å; D181-G185 PolarHBondContact O-N 2.97Å
182	G	91.9	Very high	94.2	Very high	29 Å²	29	44.1 Å²	44.1	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	59.6	-131.8	174.1	0	0	0	0	0	112.8	N184 G185 Q186	G182-N184 VanDerWaalsContact C-N 3.3Å; G182-N184 PolarHBondContact O-N 2.81Å; G182-G185 PolarHBondContact O-N 3.46Å; G182-Q186 VanDerWaalsContact O-CG 3.29Å; G182-Q186 WeakPolarHBondContact O-CG 3.09Å; G182-Q186 PolarHBondContact O-N 3.47Å
183	P	93.9	Very high	94.5	Very high	68 Å²	68	46.5 Å²	46.5	44%	0.442	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-28.4	178.5	-22.4	34.5	0	0	0	114.6	G185 Q186 R237	P183-G185 VanDerWaalsContact C-N 3.32Å; P183-Q186 PolarHBondContact O-N 3.47Å; P183-R237 HydrophobicContact CB-CB 4.36Å; P183-R237 WeakPolarHBondContact CB-O 3.41Å; P183-R237 CarbonylContact O-C 3.55Å; P183-R237 VanDerWaalsContact O-CA 3.22Å; P183-R237 WeakPolarHBondContact O-CA 3.04Å; P183-R237 VanDerWaalsContact O-CB 3.25Å; P183-R237 WeakPolarHBondContact O-CB 3.31Å; P183-R237 PolarHBondContact O-N 3.25Å
184	N	94.4	Very high	94.9	Very high	23 Å²	23	40.9 Å²	40.9	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-70.4	-34.4	176.3	-64.5	-14.7	0	0	0	110	D139 N141 D180 D181 G182 D236 A238	D139-N184 WeakPolarHBondContact OD2-CB 2.97Å; D139-N184 PolarHBondContact OD2-ND2 3.45Å; N141-N184 HydrophobicContact CB-CB 4.24Å; N141-N184 PolarHBondContact N-ND2 3.02Å; N141-N184 WeakPolarHBondContact OD1-CA 3.45Å; N141-N184 WeakPolarHBondContact OD1-CB 3.36Å; D180-N184 HydrophobicContact CB-CB 3.51Å; D181-N184 PolarHBondContact O-N 2.54Å; G182-N184 VanDerWaalsContact C-N 3.3Å; G182-N184 PolarHBondContact O-N 2.81Å; N184-D236 WeakPolarHBondContact O-CB 3.39Å; N184-A238 WeakPolarHBondContact OD1-CA 3.47Å
185	G	92.7	Very high	94.9	Very high	21 Å²	21	43 Å²	43	22%	0.216	24%	0.239	C	C	.	.	H	α-helix	trans	-77.6	-13.8	171.7	0	0	0	0	0	116.6	D180 D181 G182 P183	D180-G185 WeakPolarHBondContact O-CA 3.24Å; D180-G185 PolarHBondContact O-N 2.93Å; D181-G185 PolarHBondContact O-N 2.97Å; G182-G185 PolarHBondContact O-N 3.46Å; P183-G185 VanDerWaalsContact C-N 3.32Å
186	Q	94.3	Very high	94.9	Very high	82 Å²	82	51.4 Å²	51.4	38%	0.383	28%	0.278	S	S	.	.			trans	-87.6	140.2	-175.8	-79.7	171.1	29	0	0	111.5	G182 P183 D236 R237	G182-Q186 VanDerWaalsContact O-CG 3.29Å; G182-Q186 WeakPolarHBondContact O-CG 3.09Å; G182-Q186 PolarHBondContact O-N 3.47Å; P183-Q186 PolarHBondContact O-N 3.47Å; Q186-D236 CarbonylContact O-C 3.53Å; Q186-D236 WeakPolarHBondContact O-CA 3.49Å; Q186-R237 HydrophobicContact CB-CB 4.3Å; Q186-R237 HydrophobicContact CB-CG 4.07Å; Q186-R237 WeakPolarHBondContact O-CG 3.4Å; Q186-R237 PolarHBondContact O-N 3.27Å
187	I	95.3	Very high	94.9	Very high	20 Å²	20	51.2 Å²	51.2	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.7	-172.5	-65.5	167	0	0	0	112.2	P145 A176 D178 Y189 L210 A234 N235	P145-I187 HydrophobicContact CB-CD1 4.06Å; P145-I187 HydrophobicContact CB-CG1 4.25Å; P145-I187 HydrophobicContact CG-CG1 4.37Å; A176-I187 HydrophobicContact CB-CD1 3.85Å; A176-I187 HydrophobicContact CB-CG2 4.36Å; A176-I187 WeakPolarHBondContact O-CD1 3.44Å; D178-I187 HydrophobicContact CB-CD1 4.21Å; D178-I187 HydrophobicContact CB-CG1 4.35Å; I187-Y189 HydrophobicContact CG2-CD1 4.4Å; I187-Y189 HydrophobicContact CG2-CD2 4.23Å; I187-Y189 HydrophobicContact CG2-CE1 4.04Å; I187-Y189 HydrophobicContact CG2-CE2 3.85Å; I187-Y189 HydrophobicContact CG2-CG 4.49Å; I187-L210 WeakPolarHBondContact O-CD2 3.43Å; I187-A234 HydrophobicContact CG2-CB 3.77Å; I187-N235 CarbonylContact C-O 3.59Å; I187-N235 WeakPolarHBondContact CA-O 3.11Å
188	E	95.5	Very high	94.8	Very high	35 Å²	35	51.9 Å²	51.9	16%	0.164	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.3	168.7	-75.6	171.7	174.6	0	0	109.9	M209 L210 N235 R237 R244	E188-M209 HydrophobicContact CB-CB 4.26Å; E188-M209 HydrophobicContact CG-CB 4.39Å; E188-L210 HydrophobicContact CG-CD2 3.82Å; E188-N235 PolarHBondContact N-O 3.27Å; E188-N235 PolarHBondContact O-N 2.91Å; E188-N235 PolarHBondContact O-ND2 3.11Å; E188-N235 VanDerWaalsContact O-ND2 3.16Å; E188-R237 HydrophobicContact CG-CG 3.75Å; E188-R237 WeakPolarHBondContact OE1-CD 3.38Å; E188-R237 IonicContact OE1-CZ 3.27Å; E188-R237 IonicContact OE1-NE 2.84Å; E188-R237 PolarHBondContact OE1-NE 3.05Å; E188-R237 IonicContact OE1-NH2 2.83Å; E188-R244 IonicContact OE2-CZ 2.85Å; E188-R244 IonicContact OE2-NH1 3.19Å; E188-R244 PolarHBondContact OE2-NH1 3.04Å; E188-R244 IonicContact OE2-NH2 2.7Å
189	Y	96.8	Very high	94.7	Very high	11 Å²	11	54 Å²	54	4%	0.043	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.5	176.1	-61.9	-82.3	0	0	0	111.9	F147 F170 A176 I187 M209 G212 I232 Q233 A234	F147-Y189 HydrophobicContact CE1-CD1 4.25Å; F147-Y189 AromaticContact CE1-CE1 3.66Å; F147-Y189 HydrophobicContact CE1-CE1 3.66Å; F147-Y189 HydrophobicContact CZ-CD1 4.15Å; F147-Y189 AromaticContact CZ-CE1 3.91Å; F147-Y189 HydrophobicContact CZ-CE1 3.91Å; F170-Y189 HydrophobicContact CB-CE1 4.46Å; F170-Y189 HydrophobicContact CB-CE2 4.4Å; F170-Y189 HydrophobicContact CD2-CD1 4.13Å; F170-Y189 HydrophobicContact CD2-CE1 4.17Å; F170-Y189 HydrophobicContact CD2-CG 4.44Å; F170-Y189 HydrophobicContact CE2-CD1 4.35Å; F170-Y189 HydrophobicContact CG-CE1 4.21Å; A176-Y189 HydrophobicContact CB-CE1 3.95Å; A176-Y189 PolarHBondContact N-OH 2.88Å; A176-Y189 PolarHBondContact O-OH 3.1Å; I187-Y189 HydrophobicContact CG2-CD1 4.4Å; I187-Y189 HydrophobicContact CG2-CD2 4.23Å; I187-Y189 HydrophobicContact CG2-CE1 4.04Å; I187-Y189 HydrophobicContact CG2-CE2 3.85Å; I187-Y189 HydrophobicContact CG2-CG 4.49Å; Y189-M209 VanDerWaalsContact CD2-O 3.3Å; Y189-M209 WeakPolarHBondContact CD2-O 3.16Å; Y189-M209 PolarHBondContact N-O 3.09Å; Y189-M209 WeakPolarHBondContact O-CB 3.48Å; Y189-M209 WeakPolarHBondContact O-CG 3.36Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; Y189-I232 HydrophobicContact CD1-CG2 4.16Å; Y189-Q233 CarbonylContact C-O 3.57Å; Y189-Q233 WeakPolarHBondContact CA-O 3.31Å; Y189-A234 HydrophobicContact CD1-CB 4.07Å; Y189-A234 HydrophobicContact CE1-CB 3.95Å
190	V	96.3	Very high	94.6	Very high	42 Å²	42	50.2 Å²	50.2	26%	0.255	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.8	178.3	-178.7	0	0	0	0	109.7	M209 Q233	V190-M209 HydrophobicContact CG2-CE 4.4Å; V190-M209 HydrophobicContact CG2-SD 4.1Å; V190-Q233 PolarHBondContact N-O 3.11Å; V190-Q233 PolarHBondContact O-N 3.3Å
191	I	96.5	Very high	94.5	Very high	24 Å²	24	52.2 Å²	52.2	12%	0.123	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.7	169.4	-69.4	174.7	0	0	0	108.9	N201 F204 I206 V214 V230 I231 I232	I191-N201 HydrophobicContact CG2-CB 3.78Å; I191-F204 HydrophobicContact CD1-CB 3.99Å; I191-I206 HydrophobicContact CD1-CD1 4.3Å; I191-I206 HydrophobicContact CD1-CG1 3.89Å; I191-I206 HydrophobicContact CG1-CD1 3.79Å; I191-I206 HydrophobicContact CG1-CG1 3.88Å; I191-V214 HydrophobicContact CD1-CG1 4.13Å; I191-V230 HydrophobicContact CB-CG1 4.39Å; I191-V230 HydrophobicContact CD1-CG1 3.74Å; I191-V230 HydrophobicContact CG1-CG1 3.81Å; I191-V230 HydrophobicContact CG2-CG1 3.7Å; I191-I231 WeakPolarHBondContact CA-O 3.33Å; I191-I232 HydrophobicContact CG1-CG1 4.23Å
192	Q	94.7	Very high	94.5	Very high	72 Å²	72	51 Å²	51	34%	0.336	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	155.6	176.8	-70.8	-63.8	-29.7	0	0	111	N194 I231 Q233	Q192-N194 PolarHBondContact O-N 2.84Å; Q192-I231 HydrophobicContact CB-CB 4.27Å; Q192-I231 HydrophobicContact CB-CG2 4.03Å; Q192-I231 PolarHBondContact N-O 3.38Å; Q192-Q233 HydrophobicContact CG-CB 3.79Å
193	Y	96.1	Very high	94.8	Very high	123 Å²	123	50 Å²	50	48%	0.482	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-64.5	125.6	168.7	176	-104.3	0	0	0	109.4	P195 P198	Y193-P195 HydrophobicContact CD1-CG 4.11Å; Y193-P195 HydrophobicContact CE1-CB 4.14Å; Y193-P195 HydrophobicContact CE1-CG 3.96Å; Y193-P195 WeakPolarHBondContact O-CD 3.21Å; Y193-P198 HydrophobicContact CE2-CB 3.77Å; Y193-P198 WeakPolarHBondContact OH-CB 3.22Å
194	N	95.7	Very high	94.9	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.043	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-98.3	112.1	171.9	-175.1	-0.6	0	0	0	109.5	Q192 E196 D197 P198 Y229 I231	Q192-N194 PolarHBondContact O-N 2.84Å; N194-E196 PolarHBondContact O-N 2.89Å; N194-E196 WeakPolarHBondContact OD1-CB 3.13Å; N194-E196 PolarHBondContact OD1-N 2.92Å; N194-D197 HydrophobicContact CB-CB 4.4Å; N194-D197 CarbonylContact O-C 3.59Å; N194-D197 PolarHBondContact O-N 2.78Å; N194-D197 VanDerWaalsContact O-N 3.08Å; N194-P198 WeakPolarHBondContact O-CA 2.99Å; N194-P198 VanDerWaalsContact O-N 3.12Å; N194-Y229 PolarHBondContact ND2-O 2.77Å; N194-I231 HydrophobicContact CB-CD1 3.74Å; N194-I231 HydrophobicContact CB-CG1 3.95Å
195	P	94.6	Very high	95	Very high	94 Å²	94	49.2 Å²	49.2	61%	0.61	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.4	175.7	-22.6	34	0	0	0	113.8	Y193	Y193-P195 HydrophobicContact CD1-CG 4.11Å; Y193-P195 HydrophobicContact CE1-CB 4.14Å; Y193-P195 HydrophobicContact CE1-CG 3.96Å; Y193-P195 WeakPolarHBondContact O-CD 3.21Å
196	E	93.5	Very high	95.2	Very high	177 Å²	177	49 Å²	49	83%	0.827	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.7	177.1	-59	-174.6	166.8	0	0	112.3	N194	N194-E196 PolarHBondContact O-N 2.89Å; N194-E196 WeakPolarHBondContact OD1-CB 3.13Å; N194-E196 PolarHBondContact OD1-N 2.92Å
197	D	94.3	Very high	95.2	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-139.1	76.8	173.7	-172.4	10.4	0	0	0	111.4	N194 T199 S200 K225 Y228 Y229	N194-D197 HydrophobicContact CB-CB 4.4Å; N194-D197 CarbonylContact O-C 3.59Å; N194-D197 PolarHBondContact O-N 2.78Å; N194-D197 VanDerWaalsContact O-N 3.08Å; D197-T199 PolarHBondContact O-N 2.75Å; D197-T199 PolarHBondContact OD1-OG1 2.94Å; D197-S200 WeakPolarHBondContact O-CB 3.12Å; D197-S200 PolarHBondContact O-N 3.5Å; D197-S200 PolarHBondContact O-OG 3.41Å; D197-K225 WeakPolarHBondContact OD1-CE 3.45Å; D197-K225 IonicContact OD1-NZ 3.55Å; D197-K225 PolarHBondContact OD1-NZ 2.76Å; D197-K225 IonicContact OD2-NZ 2.77Å; D197-Y228 WeakPolarHBondContact OD2-CA 3.36Å; D197-Y229 PolarHBondContact OD2-N 2.7Å
198	P	93.6	Very high	95.2	Very high	64 Å²	64	53 Å²	53	42%	0.416	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.2	-172.3	-28.9	37.7	0	0	0	115	Y193 N194 N201	Y193-P198 HydrophobicContact CE2-CB 3.77Å; Y193-P198 WeakPolarHBondContact OH-CB 3.22Å; N194-P198 WeakPolarHBondContact O-CA 2.99Å; N194-P198 VanDerWaalsContact O-N 3.12Å; P198-N201 PolarHBondContact O-OD1 3.02Å
199	T	93.9	Very high	95.1	Very high	64 Å²	64	55.8 Å²	55.8	39%	0.393	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.1	-177.5	62.1	0	0	0	0	113	D197 N201 D202 T203 Y228	D197-T199 PolarHBondContact O-N 2.75Å; D197-T199 PolarHBondContact OD1-OG1 2.94Å; T199-N201 PolarHBondContact O-N 3.17Å; T199-D202 PolarHBondContact O-N 3.42Å; T199-T203 WeakPolarHBondContact O-CB 3.42Å; T199-T203 PolarHBondContact O-N 3.4Å; T199-T203 PolarHBondContact O-OG1 2.75Å; T199-Y228 WeakPolarHBondContact OG1-CE1 3.3Å
200	S	95.1	Very high	94.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.7	-49.5	-175.3	57.5	0	0	0	0	113.3	D197 D202 T203 F204	D197-S200 WeakPolarHBondContact O-CB 3.12Å; D197-S200 PolarHBondContact O-N 3.5Å; D197-S200 PolarHBondContact O-OG 3.41Å; S200-D202 PolarHBondContact O-N 2.71Å; S200-T203 PolarHBondContact O-N 3.13Å; S200-F204 WeakPolarHBondContact O-CD2 3.41Å; S200-F204 PolarHBondContact O-N 3.08Å
201	N	92.3	Very high	94.8	Very high	50 Å²	50	61 Å²	61	27%	0.267	32%	0.322	S	S	.	.	H	α-helix	trans	-73.7	-12.9	-178.3	74	-25.2	0	0	0	114.3	I191 P198 T199	I191-N201 HydrophobicContact CG2-CB 3.78Å; P198-N201 PolarHBondContact O-OD1 3.02Å; T199-N201 PolarHBondContact O-N 3.17Å
202	D	94.2	Very high	94.6	Very high	61 Å²	61	59.9 Å²	59.9	33%	0.326	32%	0.316	S	S	.	.	H	α-helix	trans	-96.2	-19.1	174.1	-165.3	26.4	0	0	0	111.7	T199 S200 R217 K218	T199-D202 PolarHBondContact O-N 3.42Å; S200-D202 PolarHBondContact O-N 2.71Å; D202-R217 IonicContact OD1-CZ 3.76Å; D202-R217 IonicContact OD1-NH1 2.76Å; D202-K218 VanDerWaalsContact CG-NZ 3.34Å; D202-K218 WeakPolarHBondContact O-CD 3.5Å; D202-K218 WeakPolarHBondContact O-CG 3.27Å; D202-K218 IonicContact OD1-NZ 2.66Å; D202-K218 VanDerWaalsContact OD2-CE 3.26Å; D202-K218 WeakPolarHBondContact OD2-CE 3.47Å; D202-K218 IonicContact OD2-NZ 3.49Å; D202-K218 PolarHBondContact OD2-NZ 3.16Å
203	T	96.7	Very high	94.7	Very high	7 Å²	7	58.6 Å²	58.6	4%	0.043	31%	0.311	C	S	.	.	H	α-helix	trans	-91.9	-33	178.7	-52.7	0	0	0	0	112.2	T199 S200 L216 R217 K218 L220 Y228	T199-T203 WeakPolarHBondContact O-CB 3.42Å; T199-T203 PolarHBondContact O-N 3.4Å; T199-T203 PolarHBondContact O-OG1 2.75Å; S200-T203 PolarHBondContact O-N 3.13Å; T203-L216 HydrophobicContact CG2-CD1 4.32Å; T203-R217 WeakPolarHBondContact O-CA 3.41Å; T203-R217 WeakPolarHBondContact O-CB 3.23Å; T203-R217 PolarHBondContact O-N 3.06Å; T203-K218 HydrophobicContact CG2-CB 4.42Å; T203-K218 PolarHBondContact O-N 2.9Å; T203-L220 HydrophobicContact CG2-CD2 3.56Å; T203-Y228 HydrophobicContact CG2-CE1 3.99Å
204	F	97.2	Very high	94.7	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.1	-179.6	-52.9	-76.3	0	0	0	111.5	I166 I191 S200 V214 V215 L216 L220 Y228 V230 V253	I166-F204 HydrophobicContact CD1-CD1 3.53Å; I166-F204 HydrophobicContact CD1-CE1 3.59Å; I166-F204 HydrophobicContact CG1-CD1 4.33Å; I191-F204 HydrophobicContact CD1-CB 3.99Å; S200-F204 WeakPolarHBondContact O-CD2 3.41Å; S200-F204 PolarHBondContact O-N 3.08Å; F204-V214 HydrophobicContact CB-CG1 3.79Å; F204-V214 HydrophobicContact CD1-CG1 4.39Å; F204-V214 HydrophobicContact CG-CG1 4.38Å; F204-V215 WeakPolarHBondContact CA-O 3.31Å; F204-L216 HydrophobicContact CD1-CD1 3.99Å; F204-L216 HydrophobicContact CE1-CD1 3.65Å; F204-L220 HydrophobicContact CZ-CD2 4.29Å; F204-Y228 AromaticContact CE2-CD1 3.86Å; F204-Y228 HydrophobicContact CE2-CD1 3.86Å; F204-Y228 HydrophobicContact CE2-CD2 4.01Å; F204-Y228 HydrophobicContact CE2-CE1 4.49Å; F204-Y228 AromaticContact CE2-CG 3.57Å; F204-Y228 HydrophobicContact CE2-CG 3.57Å; F204-Y228 HydrophobicContact CZ-CD2 4.1Å; F204-Y228 HydrophobicContact CZ-CG 4.14Å; F204-V230 HydrophobicContact CD2-CG2 3.5Å; F204-V230 VanDerWaalsContact CD2-CG2 3.5Å; F204-V230 HydrophobicContact CE2-CG2 4Å; F204-V230 HydrophobicContact CG-CG2 4.22Å; F204-V253 HydrophobicContact CE1-CG1 4.15Å; F204-V253 HydrophobicContact CE2-CB 4.43Å; F204-V253 HydrophobicContact CE2-CG2 4.43Å; F204-V253 HydrophobicContact CZ-CB 4.05Å; F204-V253 HydrophobicContact CZ-CG1 3.84Å; F204-V253 HydrophobicContact CZ-CG2 4.25Å
205	E	96.1	Very high	94.8	Very high	73 Å²	73	52.9 Å²	52.9	34%	0.341	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.1	176.3	65.8	176.1	-160.5	0	0	112.5	V214 V215 R217	E205-V214 WeakPolarHBondContact O-CA 3.42Å; E205-V215 HydrophobicContact CG-CB 4.36Å; E205-V215 PolarHBondContact N-O 2.9Å; E205-V215 PolarHBondContact O-N 3.16Å; E205-R217 HydrophobicContact CG-CB 4.19Å; E205-R217 HydrophobicContact CG-CG 4.49Å; E205-R217 WeakPolarHBondContact OE2-CD 3.27Å; E205-R217 IonicContact OE2-NE 3.1Å
206	I	96.7	Very high	94.9	Very high	17 Å²	17	48.5 Å²	48.5	9%	0.087	26%	0.261	C	S	.	.			trans	-114.1	95.8	168.9	-63.9	173.1	0	0	0	107	I191 L208 V214 I232	I191-I206 HydrophobicContact CD1-CD1 4.3Å; I191-I206 HydrophobicContact CD1-CG1 3.89Å; I191-I206 HydrophobicContact CG1-CD1 3.79Å; I191-I206 HydrophobicContact CG1-CG1 3.88Å; I206-L208 VanDerWaalsContact C-N 3.32Å; I206-L208 PolarHBondContact O-N 3.41Å; I206-V214 HydrophobicContact CD1-CG2 4.19Å; I206-V214 HydrophobicContact CG1-CG2 3.95Å; I206-I232 HydrophobicContact CD1-CG2 4.13Å
207	P	94.8	Very high	95	Very high	73 Å²	73	45.6 Å²	45.6	47%	0.474	24%	0.242	S	C	.	.	S	Bend	trans	-72	-28.5	-177.1	26.9	-32.5	0	0	0	112.3	V215	P207-V215 HydrophobicContact CG-CB 4.24Å; P207-V215 HydrophobicContact CG-CG2 3.66Å
208	L	94.5	Very high	95.1	Very high	114 Å²	114	49.9 Å²	49.9	60%	0.597	26%	0.26	S	S	*	.	S	Bend	trans	-117.4	89.1	178.9	-66.2	178.5	0	0	0	110.6	I206 L210 T211 G212	I206-L208 VanDerWaalsContact C-N 3.32Å; I206-L208 PolarHBondContact O-N 3.41Å; L208-L210 PolarHBondContact O-N 2.8Å; L208-L210 VanDerWaalsContact O-N 3.11Å; L208-T211 HydrophobicContact CB-CG2 4.2Å; L208-T211 WeakPolarHBondContact CB-OG1 3.34Å; L208-T211 PolarHBondContact O-N 3.17Å; L208-T211 PolarHBondContact O-OG1 3.41Å; L208-G212 PolarHBondContact O-N 3.01Å
209	M	94.1	Very high	95.2	Very high	92 Å²	92	54.9 Å²	54.9	45%	0.453	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.3	-173.1	-59.8	-176.9	-179.9	0	0	114.4	E188 Y189 V190 T211	E188-M209 HydrophobicContact CB-CB 4.26Å; E188-M209 HydrophobicContact CG-CB 4.39Å; Y189-M209 VanDerWaalsContact CD2-O 3.3Å; Y189-M209 WeakPolarHBondContact CD2-O 3.16Å; Y189-M209 PolarHBondContact N-O 3.09Å; Y189-M209 WeakPolarHBondContact O-CB 3.48Å; Y189-M209 WeakPolarHBondContact O-CG 3.36Å; V190-M209 HydrophobicContact CG2-CE 4.4Å; V190-M209 HydrophobicContact CG2-SD 4.1Å; M209-T211 VanDerWaalsContact C-N 3.32Å; M209-T211 PolarHBondContact O-N 2.94Å
210	L	93.1	Very high	95.3	Very high	109 Å²	109	52 Å²	52	57%	0.571	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.7	178.7	-62.2	177.3	0	0	0	113.6	I187 E188 L208	I187-L210 WeakPolarHBondContact O-CD2 3.43Å; E188-L210 HydrophobicContact CG-CD2 3.82Å; L208-L210 PolarHBondContact O-N 2.8Å; L208-L210 VanDerWaalsContact O-N 3.11Å
211	T	93.1	Very high	95.3	Very high	55 Å²	55	54.5 Å²	54.5	34%	0.337	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-30.7	-179.9	65.1	0	0	0	0	112.2	L208 M209 N213	L208-T211 HydrophobicContact CB-CG2 4.2Å; L208-T211 WeakPolarHBondContact CB-OG1 3.34Å; L208-T211 PolarHBondContact O-N 3.17Å; L208-T211 PolarHBondContact O-OG1 3.41Å; M209-T211 VanDerWaalsContact C-N 3.32Å; M209-T211 PolarHBondContact O-N 2.94Å; T211-N213 PolarHBondContact O-N 3.48Å; T211-N213 PolarHBondContact OG1-N 3.42Å
212	G	93.4	Very high	95.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	11.7	-173.4	0	0	0	0	0	114.3	F170 Y189 L208 V214	F170-G212 WeakPolarHBondContact CD2-O 3.01Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; L208-G212 PolarHBondContact O-N 3.01Å; G212-V214 PolarHBondContact O-N 3.17Å
213	N	95.7	Very high	95.4	Very high	45 Å²	45	54.1 Å²	54.1	24%	0.241	26%	0.26	C	S	.	.			trans	-66.4	123.7	176.9	-69.8	-7.8	0	0	0	110.1	T165 F167 T211	T165-N213 HydrophobicContact CG2-CB 4.01Å; F167-N213 WeakPolarHBondContact O-CA 3.5Å; T211-N213 PolarHBondContact O-N 3.48Å; T211-N213 PolarHBondContact OG1-N 3.42Å
214	V	96.5	Very high	95.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.3	178.3	-175.1	0	0	0	0	109.1	T165 I166 F167 I191 F204 E205 I206 G212 I232 L251	T165-V214 CarbonylContact C-O 3.5Å; T165-V214 WeakPolarHBondContact CA-O 3.14Å; I166-V214 HydrophobicContact CD1-CB 4.42Å; I166-V214 HydrophobicContact CD1-CG1 3.92Å; I166-V214 HydrophobicContact CG1-CB 4.18Å; I166-V214 HydrophobicContact CG1-CG1 3.98Å; I166-V214 WeakPolarHBondContact CG1-O 2.98Å; I166-V214 PolarHBondContact N-O 2.86Å; F167-V214 HydrophobicContact CB-CB 4.09Å; F167-V214 HydrophobicContact CB-CG2 4.38Å; F167-V214 HydrophobicContact CD1-CG2 4.06Å; F167-V214 PolarHBondContact N-O 2.9Å; F167-V214 PolarHBondContact O-N 2.91Å; I191-V214 HydrophobicContact CD1-CG1 4.13Å; F204-V214 HydrophobicContact CB-CG1 3.79Å; F204-V214 HydrophobicContact CD1-CG1 4.39Å; F204-V214 HydrophobicContact CG-CG1 4.38Å; E205-V214 WeakPolarHBondContact O-CA 3.42Å; I206-V214 HydrophobicContact CD1-CG2 4.19Å; I206-V214 HydrophobicContact CG1-CG2 3.95Å; G212-V214 PolarHBondContact O-N 3.17Å; V214-I232 HydrophobicContact CG2-CD1 4.14Å; V214-L251 HydrophobicContact CB-CD2 4.45Å; V214-L251 HydrophobicContact CG2-CD2 3.91Å
215	V	96.7	Very high	95.1	Very high	11 Å²	11	61.6 Å²	61.6	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.1	-176.6	177.9	0	0	0	0	109.6	G163 T164 F204 E205 P207	G163-V215 VanDerWaalsContact C-CG1 3.47Å; G163-V215 WeakPolarHBondContact O-CG1 3.44Å; T164-V215 WeakPolarHBondContact O-CA 3.29Å; F204-V215 WeakPolarHBondContact CA-O 3.31Å; E205-V215 HydrophobicContact CG-CB 4.36Å; E205-V215 PolarHBondContact N-O 2.9Å; E205-V215 PolarHBondContact O-N 3.16Å; P207-V215 HydrophobicContact CG-CB 4.24Å; P207-V215 HydrophobicContact CG-CG2 3.66Å
216	L	97.4	Very high	95	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.8	175.7	-172.7	65.9	0	0	0	110.7	T160 G163 T164 I166 T203 F204 K218 L220	T160-L216 HydrophobicContact CG2-CD2 4.1Å; T160-L216 VanDerWaalsContact O-CD2 3.23Å; T160-L216 WeakPolarHBondContact O-CD2 3.45Å; G163-L216 PolarHBondContact N-O 2.8Å; T164-L216 PolarHBondContact O-N 2.92Å; I166-L216 HydrophobicContact CG2-CB 4.04Å; T203-L216 HydrophobicContact CG2-CD1 4.32Å; F204-L216 HydrophobicContact CD1-CD1 3.99Å; F204-L216 HydrophobicContact CE1-CD1 3.65Å; L216-K218 WeakPolarHBondContact CD1-O 3.42Å; L216-K218 WeakPolarHBondContact CG-O 3.37Å; L216-L220 HydrophobicContact CD1-CD1 4.03Å; L216-L220 HydrophobicContact CD1-CD2 3.83Å; L216-L220 HydrophobicContact CD1-CG 3.82Å; L216-L220 HydrophobicContact CD2-CD1 4.4Å; L216-L220 HydrophobicContact CD2-CG 4.29Å
217	R	96.1	Very high	95	Very high	117 Å²	117	65.7 Å²	65.7	44%	0.442	32%	0.315	S	S	.	.			trans	-102.2	-27.1	-178	-170.2	177.4	174.5	-159.3	-7.6	113.3	V162 D202 T203 E205	V162-R217 VanDerWaalsContact CG1-O 3.25Å; V162-R217 WeakPolarHBondContact CG1-O 3.34Å; D202-R217 IonicContact OD1-CZ 3.76Å; D202-R217 IonicContact OD1-NH1 2.76Å; T203-R217 WeakPolarHBondContact O-CA 3.41Å; T203-R217 WeakPolarHBondContact O-CB 3.23Å; T203-R217 PolarHBondContact O-N 3.06Å; E205-R217 HydrophobicContact CG-CB 4.19Å; E205-R217 HydrophobicContact CG-CG 4.49Å; E205-R217 WeakPolarHBondContact OE2-CD 3.27Å; E205-R217 IonicContact OE2-NE 3.1Å
218	K	95.4	Very high	95.1	Very high	93 Å²	93	63.1 Å²	63.1	40%	0.404	30%	0.296	S	S	.	.	S	Bend	trans	-128.4	149.6	177.7	-71.8	-175.1	170	-170.2	0	111	D202 T203 L216	D202-K218 VanDerWaalsContact CG-NZ 3.34Å; D202-K218 WeakPolarHBondContact O-CD 3.5Å; D202-K218 WeakPolarHBondContact O-CG 3.27Å; D202-K218 IonicContact OD1-NZ 2.66Å; D202-K218 VanDerWaalsContact OD2-CE 3.26Å; D202-K218 WeakPolarHBondContact OD2-CE 3.47Å; D202-K218 IonicContact OD2-NZ 3.49Å; D202-K218 PolarHBondContact OD2-NZ 3.16Å; T203-K218 HydrophobicContact CG2-CB 4.42Å; T203-K218 PolarHBondContact O-N 2.9Å; L216-K218 WeakPolarHBondContact CD1-O 3.42Å; L216-K218 WeakPolarHBondContact CG-O 3.37Å
219	R	95.4	Very high	95.3	Very high	169 Å²	169	62.4 Å²	62.4	64%	0.638	29%	0.286	S	S	*	.			trans	-62.4	137.5	171.7	-174	175.9	174	-176.1	-5	108.4	V162 D260	V162-R219 HydrophobicContact CG2-CB 4.32Å; R219-D260 IonicContact NH2-OD2 2.74Å; R219-D260 PolarHBondContact NH2-OD2 2.89Å
220	L	96.2	Very high	95.4	Very high	3 Å²	3	58 Å²	58	2%	0.016	27%	0.265	C	S	.	.			trans	-87.5	158.2	177.1	-58.7	174.4	0	0	0	109.3	V156 E158 T203 F204 L216 Y228 V255	V156-L220 HydrophobicContact CB-CD1 4.04Å; V156-L220 HydrophobicContact CG1-CD1 3.62Å; E158-L220 HydrophobicContact CB-CB 4.1Å; T203-L220 HydrophobicContact CG2-CD2 3.56Å; F204-L220 HydrophobicContact CZ-CD2 4.29Å; L216-L220 HydrophobicContact CD1-CD1 4.03Å; L216-L220 HydrophobicContact CD1-CD2 3.83Å; L216-L220 HydrophobicContact CD1-CG 3.82Å; L216-L220 HydrophobicContact CD2-CD1 4.4Å; L216-L220 HydrophobicContact CD2-CG 4.29Å; L220-Y228 HydrophobicContact CD2-CE2 4.02Å; L220-V255 HydrophobicContact CB-CG1 4.21Å; L220-V255 HydrophobicContact CD1-CG1 4.31Å; L220-V255 HydrophobicContact CD1-CG2 4.19Å
221	N	95	Very high	95.6	Very high	54 Å²	54	54.8 Å²	54.8	29%	0.289	25%	0.248	S	C	.	.			trans	-145.8	112.3	174.5	-178.8	-7.8	0	0	0	107	E158 E223 D224 K225	E158-N221 WeakPolarHBondContact OE2-CA 3.46Å; N221-E223 VanDerWaalsContact C-N 3.3Å; N221-E223 PolarHBondContact O-N 3.36Å; N221-E223 PolarHBondContact OD1-N 3.39Å; N221-E223 PolarHBondContact OD1-OE2 3.01Å; N221-E223 VanDerWaalsContact OD1-OE2 3.11Å; N221-D224 HydrophobicContact CB-CB 4.16Å; N221-D224 PolarHBondContact ND2-OD2 2.87Å; N221-D224 PolarHBondContact O-N 3.5Å; N221-K225 PolarHBondContact O-N 3.15Å; N221-K225 VanDerWaalsContact O-N 3.11Å
222	Y	96	Very high	95.8	Very high	44 Å²	44	52.1 Å²	52.1	17%	0.173	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-37.7	-175.3	-178.7	-95.6	0	0	0	111.1	E158 D224 T226 V255 D257 N312	E158-Y222 WeakPolarHBondContact OE1-CB 3.35Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.17Å; E158-Y222 PolarHBondContact OE2-N 2.74Å; Y222-D224 PolarHBondContact O-N 3.11Å; Y222-D224 VanDerWaalsContact O-N 3.17Å; Y222-T226 HydrophobicContact CD1-CG2 4.3Å; Y222-T226 HydrophobicContact CD2-CG2 3.68Å; Y222-T226 HydrophobicContact CE1-CG2 4.13Å; Y222-T226 HydrophobicContact CE2-CG2 3.47Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.47Å; Y222-T226 HydrophobicContact CG-CG2 4.08Å; Y222-T226 VanDerWaalsContact O-CG2 3.27Å; Y222-T226 WeakPolarHBondContact O-CG2 3.16Å; Y222-V255 HydrophobicContact CD2-CB 4.28Å; Y222-V255 HydrophobicContact CD2-CG1 4.22Å; Y222-V255 WeakPolarHBondContact CD2-O 3.02Å; Y222-V255 WeakPolarHBondContact CE2-O 3.07Å; Y222-D257 HydrophobicContact CD1-CB 3.73Å; Y222-D257 VanDerWaalsContact CD1-CG 3.44Å; Y222-D257 HydrophobicContact CD2-CB 3.87Å; Y222-D257 HydrophobicContact CE1-CB 3.77Å; Y222-D257 VanDerWaalsContact CE1-OD2 3.31Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.29Å; Y222-D257 HydrophobicContact CE2-CB 3.91Å; Y222-D257 HydrophobicContact CG-CB 3.79Å; Y222-N312 HydrophobicContact CE1-CB 4.3Å; Y222-N312 WeakPolarHBondContact OH-CB 3.16Å; Y222-N312 PolarHBondContact OH-ND2 3.44Å
223	E	93	Very high	95.9	Very high	59 Å²	59	53.8 Å²	53.8	28%	0.276	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.8	178.5	-73.2	50.5	-112.8	0	0	112.5	N221 L261	N221-E223 VanDerWaalsContact C-N 3.3Å; N221-E223 PolarHBondContact O-N 3.36Å; N221-E223 PolarHBondContact OD1-N 3.39Å; N221-E223 PolarHBondContact OD1-OE2 3.01Å; N221-E223 VanDerWaalsContact OD1-OE2 3.11Å; E223-L261 HydrophobicContact CG-CD1 4.04Å
224	D	92.7	Very high	96	Very high	102 Å²	102	51.7 Å²	51.7	55%	0.545	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-47.9	179.2	-69.3	-17.8	0	0	0	112.5	N221 Y222 R275	N221-D224 HydrophobicContact CB-CB 4.16Å; N221-D224 PolarHBondContact ND2-OD2 2.87Å; N221-D224 PolarHBondContact O-N 3.5Å; Y222-D224 PolarHBondContact O-N 3.11Å; Y222-D224 VanDerWaalsContact O-N 3.17Å; D224-R275 IonicContact OD1-CZ 2.79Å; D224-R275 IonicContact OD1-NH1 3.5Å; D224-R275 PolarHBondContact OD1-NH1 3.03Å; D224-R275 IonicContact OD1-NH2 3.21Å; D224-R275 PolarHBondContact OD1-NH2 2.96Å
225	K	94.2	Very high	95.9	Very high	63 Å²	63	52.6 Å²	52.6	27%	0.274	23%	0.233	S	C	.	.			trans	-156.7	116.6	-177.7	-174	171.4	166.3	74.1	0	112.2	D197 N221 R227 Y228 V255	D197-K225 WeakPolarHBondContact OD1-CE 3.45Å; D197-K225 IonicContact OD1-NZ 3.55Å; D197-K225 PolarHBondContact OD1-NZ 2.76Å; D197-K225 IonicContact OD2-NZ 2.77Å; N221-K225 PolarHBondContact O-N 3.15Å; N221-K225 VanDerWaalsContact O-N 3.11Å; K225-R227 WeakPolarHBondContact CE-O 3.06Å; K225-R227 PolarHBondContact NZ-O 2.76Å; K225-Y228 HydrophobicContact CB-CE2 4.36Å; K225-Y228 HydrophobicContact CD-CD1 4.07Å; K225-Y228 HydrophobicContact CD-CE1 3.61Å; K225-Y228 HydrophobicContact CD-CE2 4.15Å; K225-Y228 HydrophobicContact CG-CE1 4.4Å; K225-Y228 HydrophobicContact CG-CE2 4.03Å; K225-V255 WeakPolarHBondContact O-CG2 3.36Å
226	T	95.4	Very high	95.8	Very high	68 Å²	68	52 Å²	52	42%	0.417	23%	0.23	S	C	.	.	S	Bend	trans	-91.3	-13.5	-175.4	60.8	0	0	0	0	115	Y222 V255	Y222-T226 HydrophobicContact CD1-CG2 4.3Å; Y222-T226 HydrophobicContact CD2-CG2 3.68Å; Y222-T226 HydrophobicContact CE1-CG2 4.13Å; Y222-T226 HydrophobicContact CE2-CG2 3.47Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.47Å; Y222-T226 HydrophobicContact CG-CG2 4.08Å; Y222-T226 VanDerWaalsContact O-CG2 3.27Å; Y222-T226 WeakPolarHBondContact O-CG2 3.16Å; T226-V255 PolarHBondContact O-N 2.8Å
227	R	96.8	Very high	95.7	Very high	108 Å²	108	55.9 Å²	55.9	41%	0.408	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	134.8	-176.7	-180	170.5	-72.3	173.7	-3.8	112.6	K225 Y229 T252 V253 D254	K225-R227 WeakPolarHBondContact CE-O 3.06Å; K225-R227 PolarHBondContact NZ-O 2.76Å; R227-Y229 WeakPolarHBondContact CD-OH 3.4Å; R227-Y229 HydrophobicContact CG-CE1 4.25Å; R227-Y229 HydrophobicContact CG-CE2 4.25Å; R227-T252 HydrophobicContact CG-CG2 4.04Å; R227-V253 WeakPolarHBondContact CA-O 3.08Å; R227-D254 WeakPolarHBondContact CG-OD1 3.42Å; R227-D254 IonicContact CZ-OD1 3.88Å; R227-D254 IonicContact CZ-OD2 2.7Å; R227-D254 IonicContact NE-OD1 3.99Å; R227-D254 PolarHBondContact NE-OD1 2.87Å; R227-D254 IonicContact NE-OD2 3.33Å; R227-D254 VanDerWaalsContact NH2-CG 3.35Å; R227-D254 IonicContact NH2-OD1 3.73Å; R227-D254 PolarHBondContact NH2-OD1 3.12Å; R227-D254 VanDerWaalsContact NH2-OD1 3.17Å; R227-D254 IonicContact NH2-OD2 3.41Å; R227-D254 PolarHBondContact NH2-OD2 2.94Å
228	Y	97.3	Very high	95.6	Very high	19 Å²	19	50.4 Å²	50.4	8%	0.075	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.3	175.9	-66.9	-98.5	0	0	0	112.2	D197 T199 T203 F204 L220 K225 T252 V253 V255	D197-Y228 WeakPolarHBondContact OD2-CA 3.36Å; T199-Y228 WeakPolarHBondContact OG1-CE1 3.3Å; T203-Y228 HydrophobicContact CG2-CE1 3.99Å; F204-Y228 AromaticContact CE2-CD1 3.86Å; F204-Y228 HydrophobicContact CE2-CD1 3.86Å; F204-Y228 HydrophobicContact CE2-CD2 4.01Å; F204-Y228 HydrophobicContact CE2-CE1 4.49Å; F204-Y228 AromaticContact CE2-CG 3.57Å; F204-Y228 HydrophobicContact CE2-CG 3.57Å; F204-Y228 HydrophobicContact CZ-CD2 4.1Å; F204-Y228 HydrophobicContact CZ-CG 4.14Å; L220-Y228 HydrophobicContact CD2-CE2 4.02Å; K225-Y228 HydrophobicContact CB-CE2 4.36Å; K225-Y228 HydrophobicContact CD-CD1 4.07Å; K225-Y228 HydrophobicContact CD-CE1 3.61Å; K225-Y228 HydrophobicContact CD-CE2 4.15Å; K225-Y228 HydrophobicContact CG-CE1 4.4Å; K225-Y228 HydrophobicContact CG-CE2 4.03Å; Y228-T252 WeakPolarHBondContact O-CA 3.35Å; Y228-V253 PolarHBondContact N-O 3.3Å; Y228-V253 PolarHBondContact O-N 3.31Å; Y228-V255 HydrophobicContact CD2-CG2 4.11Å; Y228-V255 HydrophobicContact CE2-CG2 3.89Å
229	Y	97.3	Very high	95.3	Very high	98 Å²	98	55.2 Å²	55.2	38%	0.384	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	97.5	176.7	-61.1	-71.8	0	0	0	109.9	N194 D197 R227 T250 T252	N194-Y229 PolarHBondContact ND2-O 2.77Å; D197-Y229 PolarHBondContact OD2-N 2.7Å; R227-Y229 WeakPolarHBondContact CD-OH 3.4Å; R227-Y229 HydrophobicContact CG-CE1 4.25Å; R227-Y229 HydrophobicContact CG-CE2 4.25Å; Y229-T250 HydrophobicContact CD1-CG2 4.47Å; Y229-T252 HydrophobicContact CD1-CG2 4.16Å; Y229-T252 HydrophobicContact CE1-CG2 3.93Å
230	V	96.8	Very high	95	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.9	-175	-171.2	0	0	0	0	109.5	I191 F204 I232 T250 L251 V253	I191-V230 HydrophobicContact CB-CG1 4.39Å; I191-V230 HydrophobicContact CD1-CG1 3.74Å; I191-V230 HydrophobicContact CG1-CG1 3.81Å; I191-V230 HydrophobicContact CG2-CG1 3.7Å; F204-V230 HydrophobicContact CD2-CG2 3.5Å; F204-V230 VanDerWaalsContact CD2-CG2 3.5Å; F204-V230 HydrophobicContact CE2-CG2 4Å; F204-V230 HydrophobicContact CG-CG2 4.22Å; V230-I232 HydrophobicContact CG1-CD1 4.38Å; V230-I232 HydrophobicContact CG1-CG1 4.04Å; V230-T250 WeakPolarHBondContact O-CA 3.27Å; V230-L251 HydrophobicContact CB-CB 4.24Å; V230-L251 PolarHBondContact N-O 2.99Å; V230-L251 PolarHBondContact O-N 3.03Å; V230-V253 HydrophobicContact CG2-CG2 4.17Å
231	I	96.7	Very high	94.7	Very high	41 Å²	41	56.9 Å²	56.9	21%	0.21	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	122.8	174.3	-60.9	176.5	0	0	0	108.7	I191 Q192 N194 T248	I191-I231 WeakPolarHBondContact CA-O 3.33Å; Q192-I231 HydrophobicContact CB-CB 4.27Å; Q192-I231 HydrophobicContact CB-CG2 4.03Å; Q192-I231 PolarHBondContact N-O 3.38Å; N194-I231 HydrophobicContact CB-CD1 3.74Å; N194-I231 HydrophobicContact CB-CG1 3.95Å; I231-T248 HydrophobicContact CG2-CG2 4.26Å
232	I	96.9	Very high	94.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.8	-178.1	-58.7	174.2	0	0	0	108.5	F147 F170 Y189 I191 I206 V214 V230 T248 T249 L251	F147-I232 HydrophobicContact CZ-CG2 4.39Å; F170-I232 HydrophobicContact CE2-CD1 3.67Å; F170-I232 HydrophobicContact CE2-CG2 3.79Å; F170-I232 HydrophobicContact CZ-CB 4.3Å; F170-I232 HydrophobicContact CZ-CD1 3.53Å; F170-I232 HydrophobicContact CZ-CG1 4.48Å; F170-I232 HydrophobicContact CZ-CG2 3.94Å; Y189-I232 HydrophobicContact CD1-CG2 4.16Å; I191-I232 HydrophobicContact CG1-CG1 4.23Å; I206-I232 HydrophobicContact CD1-CG2 4.13Å; V214-I232 HydrophobicContact CG2-CD1 4.14Å; V230-I232 HydrophobicContact CG1-CD1 4.38Å; V230-I232 HydrophobicContact CG1-CG1 4.04Å; I232-T248 CarbonylContact O-C 3.56Å; I232-T248 VanDerWaalsContact O-CA 3.26Å; I232-T248 WeakPolarHBondContact O-CA 3.32Å; I232-T249 HydrophobicContact CB-CG2 4.08Å; I232-T249 PolarHBondContact N-O 2.95Å; I232-T249 PolarHBondContact O-N 2.83Å; I232-L251 HydrophobicContact CD1-CB 3.58Å; I232-L251 HydrophobicContact CD1-CD2 3.87Å; I232-L251 HydrophobicContact CD1-CG 4.37Å; I232-L251 HydrophobicContact CG1-CB 4.48Å
233	Q	96.5	Very high	94.2	Very high	35 Å²	35	63 Å²	63	16%	0.164	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123	177	-172.7	-176.5	34.3	0	0	109.9	Y189 V190 Q192 N235 T246 T247 T248	Y189-Q233 CarbonylContact C-O 3.57Å; Y189-Q233 WeakPolarHBondContact CA-O 3.31Å; V190-Q233 PolarHBondContact N-O 3.11Å; V190-Q233 PolarHBondContact O-N 3.3Å; Q192-Q233 HydrophobicContact CG-CB 3.79Å; Q233-N235 WeakPolarHBondContact CG-OD1 3.38Å; Q233-N235 PolarHBondContact NE2-OD1 3.03Å; Q233-N235 PolarHBondContact OE1-OD1 2.74Å; Q233-T246 VanDerWaalsContact NE2-CB 3.3Å; Q233-T246 PolarHBondContact NE2-OG1 3.36Å; Q233-T246 VanDerWaalsContact NE2-OG1 3.16Å; Q233-T247 CarbonylContact C-O 3.56Å; Q233-T247 WeakPolarHBondContact CA-O 3.05Å; Q233-T248 HydrophobicContact CB-CG2 3.99Å; Q233-T248 HydrophobicContact CG-CG2 4.04Å
234	A	96.7	Very high	94.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	129	165.1	0	0	0	0	0	108.8	P145 F147 A176 I187 Y189 T246 T247	P145-A234 HydrophobicContact CB-CB 4.12Å; F147-A234 HydrophobicContact CE1-CB 4.5Å; F147-A234 HydrophobicContact CE2-CB 3.75Å; F147-A234 HydrophobicContact CZ-CB 3.66Å; A176-A234 HydrophobicContact CB-CB 3.47Å; A176-A234 VanDerWaalsContact CB-CB 3.47Å; I187-A234 HydrophobicContact CG2-CB 3.77Å; Y189-A234 HydrophobicContact CD1-CB 4.07Å; Y189-A234 HydrophobicContact CE1-CB 3.95Å; A234-T246 CarbonylContact O-C 3.56Å; A234-T246 WeakPolarHBondContact O-CA 3.39Å; A234-T247 PolarHBondContact N-O 2.81Å; A234-T247 PolarHBondContact O-N 2.94Å
235	N	95.4	Very high	94.4	Very high	19 Å²	19	63.5 Å²	63.5	10%	0.102	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137	177.1	-46.6	-85.6	0	0	0	108.3	I187 E188 Q233 R245 T246	I187-N235 CarbonylContact C-O 3.59Å; I187-N235 WeakPolarHBondContact CA-O 3.11Å; E188-N235 PolarHBondContact N-O 3.27Å; E188-N235 PolarHBondContact O-N 2.91Å; E188-N235 PolarHBondContact O-ND2 3.11Å; E188-N235 VanDerWaalsContact O-ND2 3.16Å; Q233-N235 WeakPolarHBondContact CG-OD1 3.38Å; Q233-N235 PolarHBondContact NE2-OD1 3.03Å; Q233-N235 PolarHBondContact OE1-OD1 2.74Å; N235-R245 WeakPolarHBondContact CA-O 3.4Å; N235-T246 HydrophobicContact CB-CG2 4.24Å; N235-T246 WeakPolarHBondContact OD1-CB 3.45Å; N235-T246 WeakPolarHBondContact OD1-CG2 3.2Å
236	D	95.5	Very high	94.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	172.8	165.6	66	55.6	0	0	0	111.6	N141 P145 N184 Q186 A238 R244 R245	N141-D236 VanDerWaalsContact ND2-CG 3.28Å; N141-D236 PolarHBondContact ND2-OD1 3.28Å; N141-D236 PolarHBondContact ND2-OD2 3.03Å; N141-D236 PolarHBondContact OD1-OD2 3.14Å; P145-D236 HydrophobicContact CG-CB 4.19Å; N184-D236 WeakPolarHBondContact O-CB 3.39Å; Q186-D236 CarbonylContact O-C 3.53Å; Q186-D236 WeakPolarHBondContact O-CA 3.49Å; D236-A238 VanDerWaalsContact OD1-CB 3.25Å; D236-A238 WeakPolarHBondContact OD1-CB 3.49Å; D236-A238 PolarHBondContact OD1-N 3.34Å; D236-R244 WeakPolarHBondContact O-CD 3.49Å; D236-R244 VanDerWaalsContact OD1-CA 3.26Å; D236-R244 WeakPolarHBondContact OD1-CA 3.1Å; D236-R244 WeakPolarHBondContact OD1-CG 3.34Å; D236-R245 PolarHBondContact N-O 3.34Å; D236-R245 VanDerWaalsContact N-O 3.13Å; D236-R245 WeakPolarHBondContact OD2-CA 3.34Å; D236-R245 VanDerWaalsContact OD2-CB 3.28Å; D236-R245 WeakPolarHBondContact OD2-CB 3.38Å; D236-R245 PolarHBondContact OD2-N 3.35Å
237	R	94.6	Very high	94.5	Very high	82 Å²	82	62.3 Å²	62.3	31%	0.309	29%	0.291	S	S	.	.			trans	-108.6	34.8	178.8	-56.4	178.9	76.4	-137.1	-3.7	112.5	P183 Q186 E188 Q239	P183-R237 HydrophobicContact CB-CB 4.36Å; P183-R237 WeakPolarHBondContact CB-O 3.41Å; P183-R237 CarbonylContact O-C 3.55Å; P183-R237 VanDerWaalsContact O-CA 3.22Å; P183-R237 WeakPolarHBondContact O-CA 3.04Å; P183-R237 VanDerWaalsContact O-CB 3.25Å; P183-R237 WeakPolarHBondContact O-CB 3.31Å; P183-R237 PolarHBondContact O-N 3.25Å; Q186-R237 HydrophobicContact CB-CB 4.3Å; Q186-R237 HydrophobicContact CB-CG 4.07Å; Q186-R237 WeakPolarHBondContact O-CG 3.4Å; Q186-R237 PolarHBondContact O-N 3.27Å; E188-R237 HydrophobicContact CG-CG 3.75Å; E188-R237 WeakPolarHBondContact OE1-CD 3.38Å; E188-R237 IonicContact OE1-CZ 3.27Å; E188-R237 IonicContact OE1-NE 2.84Å; E188-R237 PolarHBondContact OE1-NE 3.05Å; E188-R237 IonicContact OE1-NH2 2.83Å; R237-Q239 PolarHBondContact O-N 2.75Å
238	A	93	Very high	94.5	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.008	30%	0.296	C	S	.	.			trans	-47.8	134.8	173.3	0	0	0	0	0	111	N141 N184 D236 N240 E243 R244	N141-A238 HydrophobicContact CB-CB 4.13Å; N184-A238 WeakPolarHBondContact OD1-CA 3.47Å; D236-A238 VanDerWaalsContact OD1-CB 3.25Å; D236-A238 WeakPolarHBondContact OD1-CB 3.49Å; D236-A238 PolarHBondContact OD1-N 3.34Å; A238-N240 PolarHBondContact O-N 2.68Å; A238-E243 HydrophobicContact CB-CB 4.23Å; A238-R244 HydrophobicContact CB-CG 3.91Å; A238-R244 PolarHBondContact O-NE 2.7Å
239	Q	90.6	Very high	94.4	Very high	195 Å²	195	60.6 Å²	60.6	91%	0.911	30%	0.295	S	S	*	.	S	Bend	trans	-62.2	-33.9	-172.8	-172.8	178.3	12.5	0	0	111.7	R237	R237-Q239 PolarHBondContact O-N 2.75Å
240	N	89.5	Confident	94.4	Very high	72 Å²	72	58.3 Å²	58.3	39%	0.385	29%	0.291	S	S	.	.	S	Bend	trans	-89.3	116.9	170.7	-176.1	2.1	0	0	0	109.1	A238 N242 E243 R244	A238-N240 PolarHBondContact O-N 2.68Å; N240-N242 PolarHBondContact O-N 3.48Å; N240-N242 VanDerWaalsContact O-N 3.09Å; N240-N242 PolarHBondContact OD1-N 3Å; N240-E243 HydrophobicContact CB-CB 4.16Å; N240-E243 HydrophobicContact CB-CG 4.07Å; N240-E243 PolarHBondContact ND2-OE1 2.88Å; N240-E243 PolarHBondContact O-N 2.81Å; N240-R244 PolarHBondContact O-N 2.98Å
241	L	89.3	Confident	94.4	Very high	134 Å²	134	58.3 Å²	58.3	70%	0.702	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.4	-179.2	-75.9	138.6	0	0	0	113.4	E243 R244	L241-E243 VanDerWaalsContact C-N 3.31Å; L241-R244 PolarHBondContact O-N 2.73Å
242	N	90.7	Very high	94.5	Very high	150 Å²	150	57.7 Å²	57.7	80%	0.802	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.3	179.5	-63.4	-18.2	0	0	0	113.3	N240	N240-N242 PolarHBondContact O-N 3.48Å; N240-N242 VanDerWaalsContact O-N 3.09Å; N240-N242 PolarHBondContact OD1-N 3Å
243	E	90.5	Very high	94.5	Very high	77 Å²	77	57.7 Å²	57.7	36%	0.36	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-11.7	176.1	-71.5	172.3	-146.3	0	0	111.4	R140 N141 A238 N240 L241 R245	R140-E243 IonicContact NH1-OE1 3.5Å; R140-E243 IonicContact NH1-OE2 3.11Å; N141-E243 PolarHBondContact ND2-O 3.14Å; A238-E243 HydrophobicContact CB-CB 4.23Å; N240-E243 HydrophobicContact CB-CB 4.16Å; N240-E243 HydrophobicContact CB-CG 4.07Å; N240-E243 PolarHBondContact ND2-OE1 2.88Å; N240-E243 PolarHBondContact O-N 2.81Å; L241-E243 VanDerWaalsContact C-N 3.31Å; E243-R245 PolarHBondContact O-N 3.21Å
244	R	93.7	Very high	94.5	Very high	77 Å²	77	56.9 Å²	56.9	29%	0.291	29%	0.286	S	S	.	.			trans	-60.6	129.7	177	-68.5	-172.6	176.1	-152.6	-3.1	110.9	E188 D236 A238 N240 L241	E188-R244 IonicContact OE2-CZ 2.85Å; E188-R244 IonicContact OE2-NH1 3.19Å; E188-R244 PolarHBondContact OE2-NH1 3.04Å; E188-R244 IonicContact OE2-NH2 2.7Å; D236-R244 WeakPolarHBondContact O-CD 3.49Å; D236-R244 VanDerWaalsContact OD1-CA 3.26Å; D236-R244 WeakPolarHBondContact OD1-CA 3.1Å; D236-R244 WeakPolarHBondContact OD1-CG 3.34Å; A238-R244 HydrophobicContact CB-CG 3.91Å; A238-R244 PolarHBondContact O-NE 2.7Å; N240-R244 PolarHBondContact O-N 2.98Å; L241-R244 PolarHBondContact O-N 2.73Å
245	R	95	Very high	94.5	Very high	94 Å²	94	57.2 Å²	57.2	36%	0.355	29%	0.288	S	S	.	.			trans	-105.2	151.5	175	-67.3	165.3	166.9	-130.6	12.1	109	N141 D142 N143 S144 N235 D236 E243	N141-R245 WeakPolarHBondContact O-CD 3.46Å; N141-R245 PolarHBondContact O-NE 2.95Å; D142-R245 VanDerWaalsContact C-CZ 3.41Å; D142-R245 VanDerWaalsContact C-NH1 3.32Å; D142-R245 VanDerWaalsContact CA-NH2 3.34Å; D142-R245 PolarHBondContact O-NH1 3.23Å; D142-R245 PolarHBondContact O-NH2 3.06Å; D142-R245 VanDerWaalsContact O-NH2 3.1Å; N143-R245 WeakPolarHBondContact O-CD 3.34Å; S144-R245 WeakPolarHBondContact OG-CB 3.47Å; S144-R245 WeakPolarHBondContact OG-CD 3.47Å; S144-R245 PolarHBondContact OG-NH1 2.98Å; N235-R245 WeakPolarHBondContact CA-O 3.4Å; D236-R245 PolarHBondContact N-O 3.34Å; D236-R245 VanDerWaalsContact N-O 3.13Å; D236-R245 WeakPolarHBondContact OD2-CA 3.34Å; D236-R245 VanDerWaalsContact OD2-CB 3.28Å; D236-R245 WeakPolarHBondContact OD2-CB 3.38Å; D236-R245 PolarHBondContact OD2-N 3.35Å; E243-R245 PolarHBondContact O-N 3.21Å
246	T	95.4	Very high	94.5	Very high	64 Å²	64	59.3 Å²	59.3	39%	0.393	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144.1	-168.1	77.7	0	0	0	0	110.9	Q233 A234 N235	Q233-T246 VanDerWaalsContact NE2-CB 3.3Å; Q233-T246 PolarHBondContact NE2-OG1 3.36Å; Q233-T246 VanDerWaalsContact NE2-OG1 3.16Å; A234-T246 CarbonylContact O-C 3.56Å; A234-T246 WeakPolarHBondContact O-CA 3.39Å; N235-T246 HydrophobicContact CB-CG2 4.24Å; N235-T246 WeakPolarHBondContact OD1-CB 3.45Å; N235-T246 WeakPolarHBondContact OD1-CG2 3.2Å
247	T	96.3	Very high	94.5	Very high	43 Å²	43	59.5 Å²	59.5	26%	0.264	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.7	173.7	-61.2	0	0	0	0	109	P145 F147 Q233 A234	P145-T247 WeakPolarHBondContact O-CB 3.41Å; P145-T247 PolarHBondContact O-OG1 3.07Å; F147-T247 HydrophobicContact CD2-CG2 4.02Å; Q233-T247 CarbonylContact C-O 3.56Å; Q233-T247 WeakPolarHBondContact CA-O 3.05Å; A234-T247 PolarHBondContact N-O 2.81Å; A234-T247 PolarHBondContact O-N 2.94Å
248	T	96.4	Very high	94.5	Very high	83 Å²	83	55.7 Å²	55.7	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150	-179.6	54.8	0	0	0	0	111.8	I231 I232 Q233	I231-T248 HydrophobicContact CG2-CG2 4.26Å; I232-T248 CarbonylContact O-C 3.56Å; I232-T248 VanDerWaalsContact O-CA 3.26Å; I232-T248 WeakPolarHBondContact O-CA 3.32Å; Q233-T248 HydrophobicContact CB-CG2 3.99Å; Q233-T248 HydrophobicContact CG-CG2 4.04Å
249	T	96.4	Very high	94.5	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.043	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	162.5	168.6	-170.4	0	0	0	0	109.2	F147 E150 Y152 F170 I232	F147-T249 HydrophobicContact CD1-CG2 3.78Å; F147-T249 HydrophobicContact CD2-CG2 3.93Å; F147-T249 HydrophobicContact CE1-CG2 3.47Å; F147-T249 VanDerWaalsContact CE1-CG2 3.47Å; F147-T249 HydrophobicContact CE2-CG2 3.65Å; F147-T249 HydrophobicContact CG-CG2 4Å; F147-T249 HydrophobicContact CZ-CG2 3.4Å; F147-T249 VanDerWaalsContact CZ-CG2 3.4Å; E150-T249 PolarHBondContact O-OG1 3.24Å; E150-T249 VanDerWaalsContact O-OG1 3.14Å; Y152-T249 HydrophobicContact CD2-CG2 3.81Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.38Å; Y152-T249 HydrophobicContact CE2-CG2 3.8Å; Y152-T249 WeakPolarHBondContact CE2-OG1 3.41Å; F170-T249 HydrophobicContact CE1-CG2 4.37Å; F170-T249 HydrophobicContact CZ-CG2 4.28Å; I232-T249 HydrophobicContact CB-CG2 4.08Å; I232-T249 PolarHBondContact N-O 2.95Å; I232-T249 PolarHBondContact O-N 2.83Å
250	T	96.5	Very high	94.7	Very high	51 Å²	51	50 Å²	50	31%	0.313	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.3	171.9	-53.6	0	0	0	0	110.3	S151 Y152 Y229 V230	S151-T250 WeakPolarHBondContact CA-O 3.43Å; Y152-T250 PolarHBondContact N-O 2.92Å; Y229-T250 HydrophobicContact CD1-CG2 4.47Å; V230-T250 WeakPolarHBondContact O-CA 3.27Å
251	L	97.3	Very high	94.9	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.9	164.9	170.3	65.9	0	0	0	108.1	Y152 A154 F167 V214 V230 I232 V253	Y152-L251 WeakPolarHBondContact O-CA 3.27Å; A154-L251 HydrophobicContact CB-CD1 4.1Å; F167-L251 HydrophobicContact CB-CD2 4.26Å; F167-L251 HydrophobicContact CD1-CD1 4.48Å; F167-L251 HydrophobicContact CD1-CD2 4.04Å; F167-L251 HydrophobicContact CD2-CD1 3.94Å; F167-L251 HydrophobicContact CE1-CD1 4.45Å; F167-L251 HydrophobicContact CE2-CD1 3.89Å; F167-L251 HydrophobicContact CG-CD1 4.22Å; F167-L251 HydrophobicContact CG-CD2 4.06Å; F167-L251 HydrophobicContact CZ-CD1 4.15Å; V214-L251 HydrophobicContact CB-CD2 4.45Å; V214-L251 HydrophobicContact CG2-CD2 3.91Å; V230-L251 HydrophobicContact CB-CB 4.24Å; V230-L251 PolarHBondContact N-O 2.99Å; V230-L251 PolarHBondContact O-N 3.03Å; I232-L251 HydrophobicContact CD1-CB 3.58Å; I232-L251 HydrophobicContact CD1-CD2 3.87Å; I232-L251 HydrophobicContact CD1-CG 4.37Å; I232-L251 HydrophobicContact CG1-CB 4.48Å; L251-V253 HydrophobicContact CD2-CG2 4.08Å; L251-V253 HydrophobicContact CG-CG2 3.88Å
252	T	97.4	Very high	95.1	Very high	28 Å²	28	43 Å²	43	17%	0.172	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.3	172.8	-55.1	0	0	0	0	108.6	Y152 Y153 A154 R227 Y228 Y229	Y152-T252 PolarHBondContact O-N 2.79Å; Y153-T252 WeakPolarHBondContact CA-O 3.08Å; Y153-T252 HydrophobicContact CD2-CG2 4.27Å; Y153-T252 HydrophobicContact CE2-CG2 4.43Å; A154-T252 PolarHBondContact N-O 2.84Å; R227-T252 HydrophobicContact CG-CG2 4.04Å; Y228-T252 WeakPolarHBondContact O-CA 3.35Å; Y229-T252 HydrophobicContact CD1-CG2 4.16Å; Y229-T252 HydrophobicContact CE1-CG2 3.93Å
253	V	97.3	Very high	95.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	116.1	178.6	-172.7	0	0	0	0	109	A154 V156 I166 F204 R227 Y228 V230 L251	A154-V253 WeakPolarHBondContact O-CA 3.21Å; V156-V253 HydrophobicContact CB-CG1 4.31Å; V156-V253 HydrophobicContact CG2-CG1 3.7Å; I166-V253 HydrophobicContact CD1-CG1 4.3Å; I166-V253 HydrophobicContact CD1-CG2 4.23Å; F204-V253 HydrophobicContact CE1-CG1 4.15Å; F204-V253 HydrophobicContact CE2-CB 4.43Å; F204-V253 HydrophobicContact CE2-CG2 4.43Å; F204-V253 HydrophobicContact CZ-CB 4.05Å; F204-V253 HydrophobicContact CZ-CG1 3.84Å; F204-V253 HydrophobicContact CZ-CG2 4.25Å; R227-V253 WeakPolarHBondContact CA-O 3.08Å; Y228-V253 PolarHBondContact N-O 3.3Å; Y228-V253 PolarHBondContact O-N 3.31Å; V230-V253 HydrophobicContact CG2-CG2 4.17Å; L251-V253 HydrophobicContact CD2-CG2 4.08Å; L251-V253 HydrophobicContact CG-CG2 3.88Å
254	D	96.8	Very high	95.6	Very high	18 Å²	18	33.7 Å²	33.7	10%	0.096	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.5	173.1	-73.4	-5.2	0	0	0	110	Y153 A154 T155 V156 R227	Y153-D254 HydrophobicContact CE2-CB 4.22Å; Y153-D254 VanDerWaalsContact CE2-OD2 3.23Å; Y153-D254 WeakPolarHBondContact CE2-OD2 3.42Å; Y153-D254 WeakPolarHBondContact OH-CB 3.31Å; Y153-D254 VanDerWaalsContact OH-CG 3.3Å; Y153-D254 PolarHBondContact OH-OD2 2.8Å; A154-D254 PolarHBondContact O-N 3.04Å; T155-D254 CarbonylContact C-O 3.51Å; T155-D254 WeakPolarHBondContact CA-O 3.02Å; T155-D254 HydrophobicContact CG2-CB 4.4Å; V156-D254 PolarHBondContact N-O 2.85Å; R227-D254 WeakPolarHBondContact CG-OD1 3.42Å; R227-D254 IonicContact CZ-OD1 3.88Å; R227-D254 IonicContact CZ-OD2 2.7Å; R227-D254 IonicContact NE-OD1 3.99Å; R227-D254 PolarHBondContact NE-OD1 2.87Å; R227-D254 IonicContact NE-OD2 3.33Å; R227-D254 VanDerWaalsContact NH2-CG 3.35Å; R227-D254 IonicContact NH2-OD1 3.73Å; R227-D254 PolarHBondContact NH2-OD1 3.12Å; R227-D254 VanDerWaalsContact NH2-OD1 3.17Å; R227-D254 IonicContact NH2-OD2 3.41Å; R227-D254 PolarHBondContact NH2-OD2 2.94Å
255	V	96.6	Very high	95.7	Very high	6 Å²	6	30.7 Å²	30.7	4%	0.036	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.5	173.7	-172.2	0	0	0	0	108	V156 E158 L220 Y222 K225 T226 Y228	V156-V255 CarbonylContact O-C 3.55Å; V156-V255 VanDerWaalsContact O-CA 3.26Å; V156-V255 WeakPolarHBondContact O-CA 3.19Å; E158-V255 HydrophobicContact CB-CG1 3.71Å; L220-V255 HydrophobicContact CB-CG1 4.21Å; L220-V255 HydrophobicContact CD1-CG1 4.31Å; L220-V255 HydrophobicContact CD1-CG2 4.19Å; Y222-V255 HydrophobicContact CD2-CB 4.28Å; Y222-V255 HydrophobicContact CD2-CG1 4.22Å; Y222-V255 WeakPolarHBondContact CD2-O 3.02Å; Y222-V255 WeakPolarHBondContact CE2-O 3.07Å; K225-V255 WeakPolarHBondContact O-CG2 3.36Å; T226-V255 PolarHBondContact O-N 2.8Å; Y228-V255 HydrophobicContact CD2-CG2 4.11Å; Y228-V255 HydrophobicContact CE2-CG2 3.89Å
256	L	95.6	Very high	95.7	Very high	63 Å²	63	28.2 Å²	28.2	33%	0.33	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.3	171.1	-53.4	177.2	0	0	0	108.4	T155 V156 N157 E158 G258	T155-L256 HydrophobicContact CG2-CD2 4.35Å; V156-L256 PolarHBondContact O-N 2.88Å; N157-L256 WeakPolarHBondContact CA-O 3.31Å; N157-L256 HydrophobicContact CB-CB 4.47Å; E158-L256 PolarHBondContact N-O 2.84Å; L256-G258 PolarHBondContact O-N 2.93Å
257	D	95.9	Very high	95.8	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-55.7	123.7	173.1	-162.2	-16.4	0	0	0	109.4	E158 Y222 R311 N312	E158-D257 WeakPolarHBondContact OE1-CA 3.3Å; Y222-D257 HydrophobicContact CD1-CB 3.73Å; Y222-D257 VanDerWaalsContact CD1-CG 3.44Å; Y222-D257 HydrophobicContact CD2-CB 3.87Å; Y222-D257 HydrophobicContact CE1-CB 3.77Å; Y222-D257 VanDerWaalsContact CE1-OD2 3.31Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.29Å; Y222-D257 HydrophobicContact CE2-CB 3.91Å; Y222-D257 HydrophobicContact CG-CB 3.79Å; D257-R311 PolarHBondContact OD2-N 3.15Å; D257-N312 HydrophobicContact CB-CB 4.22Å; D257-N312 WeakPolarHBondContact CB-O 3.41Å; D257-N312 VanDerWaalsContact OD2-CA 3.27Å; D257-N312 WeakPolarHBondContact OD2-CA 3.36Å; D257-N312 WeakPolarHBondContact OD2-CB 3.33Å; D257-N312 PolarHBondContact OD2-N 2.87Å
258	G	93.8	Very high	95.6	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.021	16%	0.163	C	C	.	.			trans	-122.1	151.9	-178	0	0	0	0	0	110.5	E158 L256 D260	E158-G258 PolarHBondContact OE1-N 2.77Å; L256-G258 PolarHBondContact O-N 2.93Å; G258-D260 PolarHBondContact O-N 3.35Å
259	D	94.4	Very high	95.5	Very high	33 Å²	33	28.3 Å²	28.3	18%	0.176	16%	0.164	C	C	.	.	S	Bend	trans	-68	84.8	-177.5	179.9	36.4	0	0	0	112.7	D310 I313 Q369 N371	D259-D310 VanDerWaalsContact CA-OD2 3.27Å; D259-D310 WeakPolarHBondContact CA-OD2 3.14Å; D259-I313 HydrophobicContact CB-CD1 4.09Å; D259-Q369 PolarHBondContact OD1-NE2 3.13Å; D259-Q369 PolarHBondContact OD1-OE1 3.18Å; D259-N371 PolarHBondContact OD2-ND2 2.83Å
260	D	94	Very high	95.3	Very high	44 Å²	44	33 Å²	33	24%	0.235	19%	0.189	C	C	.	.			trans	-123.3	-5.3	168.9	75.3	-12.1	0	0	0	115.6	L159 R219 G258 D310 L375	L159-D260 HydrophobicContact CD2-CB 3.66Å; R219-D260 IonicContact NH2-OD2 2.74Å; R219-D260 PolarHBondContact NH2-OD2 2.89Å; G258-D260 PolarHBondContact O-N 3.35Å; D260-D310 PolarHBondContact N-OD2 3.13Å; D260-L375 WeakPolarHBondContact O-CD1 3.29Å
261	L	94.4	Very high	95.1	Very high	52 Å²	52	33.1 Å²	33.1	27%	0.272	19%	0.189	S	C	.	.	S	Bend	trans	-113.3	144.4	171.7	-50.7	176.1	0	0	0	110.8	E223 Q309 D310 Q369	E223-L261 HydrophobicContact CG-CD1 4.04Å; L261-Q309 HydrophobicContact CB-CB 3.5Å; L261-Q309 HydrophobicContact CB-CG 4.48Å; L261-Q309 HydrophobicContact CD1-CB 3.91Å; L261-Q309 HydrophobicContact CG-CB 4.36Å; L261-D310 WeakPolarHBondContact CB-OD1 3.12Å; L261-D310 WeakPolarHBondContact CG-OD1 3.33Å; L261-D310 PolarHBondContact N-OD1 3.4Å; L261-D310 PolarHBondContact N-OD2 3.24Å; L261-D310 VanDerWaalsContact N-OD2 3.1Å; L261-D310 VanDerWaalsContact O-OD2 3.08Å; L261-Q369 PolarHBondContact O-NE2 3.33Å; L261-Q369 VanDerWaalsContact O-NE2 3.14Å
262	G	93.5	Very high	94.7	Very high	7 Å²	7	38.2 Å²	38.2	7%	0.072	22%	0.222	C	C	.	.			trans	-90.6	-175.6	178.3	0	0	0	0	0	113.7	Q309 L375	G262-Q309 WeakPolarHBondContact O-CB 3.39Å; G262-Q309 WeakPolarHBondContact O-CG 3.34Å; G262-Q309 PolarHBondContact O-N 3.44Å; G262-Q309 PolarHBondContact O-NE2 3.17Å; G262-L375 VanDerWaalsContact CA-O 3.27Å; G262-L375 WeakPolarHBondContact CA-O 3.48Å
263	P	95.7	Very high	94.4	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.013	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	154.6	175.8	-19.9	35.1	0	0	0	112.2	A306 I307 I322 A367 Q369 L375 A377	P263-A306 HydrophobicContact CB-CB 4.11Å; P263-I307 CarbonylContact C-O 3.6Å; P263-I307 WeakPolarHBondContact CA-O 3.42Å; P263-I322 HydrophobicContact CB-CD1 4.15Å; P263-I322 HydrophobicContact CB-CG1 4.41Å; P263-I322 HydrophobicContact CB-CG2 4.36Å; P263-I322 HydrophobicContact CG-CD1 4.39Å; P263-I322 HydrophobicContact CG-CG1 4.13Å; P263-I322 HydrophobicContact CG-CG2 4.22Å; P263-A367 HydrophobicContact CB-CB 4.26Å; P263-Q369 HydrophobicContact CG-CG 4Å; P263-L375 WeakPolarHBondContact CD-O 3.43Å; P263-A377 WeakPolarHBondContact O-CB 3.43Å
264	M	94.8	Very high	94	Very high	30 Å²	30	48 Å²	48	15%	0.148	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.7	166	58	158.8	72	0	0	110.1	L266 C268 A306 I307 Q309	M264-L266 HydrophobicContact SD-CD2 4.46Å; M264-C268 HydrophobicContact SD-CB 3.59Å; M264-C268 VanDerWaalsContact SD-CB 3.59Å; M264-C268 VanDerWaalsContact SD-SG 3.69Å; M264-A306 CarbonylContact O-C 3.56Å; M264-A306 WeakPolarHBondContact O-CA 3.49Å; M264-A306 VanDerWaalsContact O-CB 3.32Å; M264-A306 WeakPolarHBondContact O-CB 3.46Å; M264-I307 HydrophobicContact CG-CG2 3.86Å; M264-I307 WeakPolarHBondContact CG-O 3.11Å; M264-I307 PolarHBondContact N-O 2.96Å; M264-I307 PolarHBondContact O-N 3.27Å; M264-I307 HydrophobicContact SD-CG2 4.37Å; M264-Q309 HydrophobicContact CB-CG 3.93Å; M264-Q309 HydrophobicContact CE-CG 3.48Å; M264-Q309 VanDerWaalsContact CE-CG 3.48Å; M264-Q309 HydrophobicContact CG-CG 3.79Å; M264-Q309 HydrophobicContact SD-CG 4.44Å
265	F	96.6	Very high	93.5	Very high	13 Å²	13	54.2 Å²	54.2	6%	0.057	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	146.8	174.3	-77.8	-75.1	0	0	0	111.6	Y282 I304 A306 Y324 I365 A367 A377 F378 A379	F265-Y282 HydrophobicContact CD1-CE2 4.07Å; F265-Y282 HydrophobicContact CE1-CE2 4.47Å; F265-I304 HydrophobicContact CE1-CG2 4.08Å; F265-A306 HydrophobicContact CD1-CB 4.11Å; F265-A306 HydrophobicContact CE1-CB 4.42Å; F265-Y324 HydrophobicContact CE1-CD1 4.24Å; F265-Y324 HydrophobicContact CE1-CE1 4.08Å; F265-I365 HydrophobicContact CE1-CG2 4.15Å; F265-I365 HydrophobicContact CZ-CB 4.2Å; F265-I365 HydrophobicContact CZ-CG2 3.87Å; F265-A367 HydrophobicContact CE1-CB 3.98Å; F265-A367 HydrophobicContact CE2-CB 4Å; F265-A367 HydrophobicContact CZ-CB 3.55Å; F265-A377 HydrophobicContact CD2-CB 4.13Å; F265-A377 HydrophobicContact CE2-CB 4.21Å; F265-A377 WeakPolarHBondContact CE2-O 3.41Å; F265-F378 VanDerWaalsContact CE2-C 3.42Å; F265-A379 HydrophobicContact CB-CB 4.43Å; F265-A379 HydrophobicContact CD1-CB 4.2Å; F265-A379 HydrophobicContact CD2-CB 3.55Å; F265-A379 HydrophobicContact CE1-CB 4.32Å; F265-A379 HydrophobicContact CE2-CB 3.7Å; F265-A379 HydrophobicContact CG-CB 3.81Å; F265-A379 HydrophobicContact CZ-CB 4.09Å
266	L	95.5	Very high	93.2	Very high	43 Å²	43	58.9 Å²	58.9	23%	0.225	32%	0.322	C	S	.	.	S	Bend	trans	-112.2	147.6	179.2	-56.2	176.1	0	0	0	112.3	M264 C268 Y282 Q305 I307	M264-L266 HydrophobicContact SD-CD2 4.46Å; L266-C268 HydrophobicContact CD2-CB 4.15Å; L266-Y282 PolarHBondContact O-OH 2.91Å; L266-Y282 VanDerWaalsContact O-OH 3.12Å; L266-Q305 HydrophobicContact CB-CG 3.72Å; L266-Q305 HydrophobicContact CD1-CG 4.01Å; L266-Q305 HydrophobicContact CG-CG 4.24Å; L266-Q305 PolarHBondContact N-O 3.29Å; L266-I307 HydrophobicContact CD1-CB 4.31Å; L266-I307 HydrophobicContact CD1-CG2 4.07Å; L266-I307 HydrophobicContact CD2-CG2 3.96Å; L266-I307 HydrophobicContact CG-CG2 4.21Å
267	P	95.9	Very high	93	Very high	69 Å²	69	57.5 Å²	57.5	45%	0.448	32%	0.318	S	S	.	.	S	Bend	cis	-66.9	132	-4.1	25.8	-37.7	0	0	0	114.3	V269 L280 P302	P267-V269 PolarHBondContact O-N 3.17Å; P267-L280 HydrophobicContact CG-CD1 4.06Å; P267-L280 WeakPolarHBondContact O-CD1 3.24Å; P267-P302 HydrophobicContact CG-CG 4.43Å
268	C	93.4	Very high	92.8	Very high	36 Å²	36	66 Å²	66	24%	0.243	35%	0.349	C	S	.	.			trans	-86.7	105.9	169.2	175.6	0	0	0	0	109.6	M264 L266 C277	M264-C268 HydrophobicContact SD-CB 3.59Å; M264-C268 VanDerWaalsContact SD-CB 3.59Å; M264-C268 VanDerWaalsContact SD-SG 3.69Å; L266-C268 HydrophobicContact CD2-CB 4.15Å; C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.45Å; C268-C277 WeakPolarHBondContact SG-CB 3.36Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 2.81Å
269	V	93.5	Very high	92.6	Very high	87 Å²	87	71.7 Å²	71.7	53%	0.527	39%	0.386	S	S	.	.			trans	-100.6	112.5	170.1	-179.1	0	0	0	0	107.9	P267 R278	P267-V269 PolarHBondContact O-N 3.17Å; V269-R278 WeakPolarHBondContact O-CB 3.33Å; V269-R278 PolarHBondContact O-N 3.48Å
270	L	91.7	Very high	92.5	Very high	106 Å²	106	71.3 Å²	71.3	56%	0.555	38%	0.384	S	S	*	.	B	Isolated β-bridge	trans	-61.3	136.3	-177.4	-71.7	170	0	0	0	111.8	R275 D276	L270-R275 WeakPolarHBondContact CD2-O 3.26Å; L270-D276 WeakPolarHBondContact CA-O 3.38Å
271	V	92.3	Very high	92.6	Very high	52 Å²	52	72.9 Å²	72.9	32%	0.315	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-71.5	135.4	169.3	178.4	0	0	0	0	108.8	N273 T274 D276 R278	V271-N273 PolarHBondContact O-N 2.77Å; V271-T274 HydrophobicContact CG1-CG2 4.32Å; V271-T274 PolarHBondContact O-N 3.37Å; V271-D276 PolarHBondContact N-O 2.94Å; V271-R278 HydrophobicContact CG2-CB 4.27Å
272	P	90	Very high	92.7	Very high	108 Å²	108	70.4 Å²	70.4	70%	0.701	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	129.9	-179.8	-26.9	34.6	0	0	0	112.6	T274	P272-T274 VanDerWaalsContact C-N 3.27Å; P272-T274 PolarHBondContact O-N 2.85Å
273	N	90	Very high	92.9	Very high	175 Å²	175	74.2 Å²	74.2	94%	0.936	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	12.3	-177.2	-51.1	-53.5	0	0	0	116.3	V271	V271-N273 PolarHBondContact O-N 2.77Å
274	T	88.9	Confident	92.9	Very high	57 Å²	57	74.5 Å²	74.5	35%	0.35	40%	0.401	S	S	.	.	S	Bend	trans	-126.5	168	170.6	89.8	0	0	0	0	111.1	V271 P272 D276	V271-T274 HydrophobicContact CG1-CG2 4.32Å; V271-T274 PolarHBondContact O-N 3.37Å; P272-T274 VanDerWaalsContact C-N 3.27Å; P272-T274 PolarHBondContact O-N 2.85Å; T274-D276 VanDerWaalsContact C-N 3.31Å; T274-D276 VanDerWaalsContact CB-OD2 3.22Å; T274-D276 WeakPolarHBondContact CB-OD2 3.41Å; T274-D276 WeakPolarHBondContact OG1-CB 3.31Å; T274-D276 PolarHBondContact OG1-N 3Å; T274-D276 VanDerWaalsContact OG1-N 3.1Å; T274-D276 PolarHBondContact OG1-OD2 2.88Å
275	R	87.1	Confident	92.9	Very high	149 Å²	149	75.7 Å²	75.7	56%	0.562	42%	0.416	S	S	*	.	S	Bend	trans	-94	8.2	171.1	-70.2	-171.3	176.5	164	4.2	111.8	D224 L270	D224-R275 IonicContact OD1-CZ 2.79Å; D224-R275 IonicContact OD1-NH1 3.5Å; D224-R275 PolarHBondContact OD1-NH1 3.03Å; D224-R275 IonicContact OD1-NH2 3.21Å; D224-R275 PolarHBondContact OD1-NH2 2.96Å; L270-R275 WeakPolarHBondContact CD2-O 3.26Å
276	D	89.3	Confident	92.8	Very high	104 Å²	104	75.3 Å²	75.3	56%	0.556	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-90.8	141.4	-173.9	-43.8	-55.6	0	0	0	110.9	L270 V271 T274	L270-D276 WeakPolarHBondContact CA-O 3.38Å; V271-D276 PolarHBondContact N-O 2.94Å; T274-D276 VanDerWaalsContact C-N 3.31Å; T274-D276 VanDerWaalsContact CB-OD2 3.22Å; T274-D276 WeakPolarHBondContact CB-OD2 3.41Å; T274-D276 WeakPolarHBondContact OG1-CB 3.31Å; T274-D276 PolarHBondContact OG1-N 3Å; T274-D276 VanDerWaalsContact OG1-N 3.1Å; T274-D276 PolarHBondContact OG1-OD2 2.88Å
277	C	91.8	Very high	92.6	Very high	35 Å²	35	74.9 Å²	74.9	24%	0.236	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-73.4	140.7	170.8	-50.9	0	0	0	0	110.1	C268	C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.45Å; C268-C277 WeakPolarHBondContact SG-CB 3.36Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 2.81Å
278	R	91.7	Very high	92.4	Very high	181 Å²	181	71.6 Å²	71.6	68%	0.683	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-58.4	134.8	170.1	-168.1	176.5	-151.9	157.7	4.7	109.4	V269 V271 L280	V269-R278 WeakPolarHBondContact O-CB 3.33Å; V269-R278 PolarHBondContact O-N 3.48Å; V271-R278 HydrophobicContact CG2-CB 4.27Å; R278-L280 PolarHBondContact O-N 3.29Å
279	P	90.9	Very high	92.2	Very high	122 Å²	122	73.6 Å²	73.6	79%	0.792	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-53.1	135	176.1	-26.7	34.5	0	0	0	111.4
280	L	92.4	Very high	92.1	Very high	25 Å²	25	73.9 Å²	73.9	13%	0.131	39%	0.392	C	S	.	.			trans	-111.5	131.3	-172.6	-163.5	153.8	0	0	0	110.4	P267 R278 Y282 P302 S380	P267-L280 HydrophobicContact CG-CD1 4.06Å; P267-L280 WeakPolarHBondContact O-CD1 3.24Å; R278-L280 PolarHBondContact O-N 3.29Å; L280-Y282 HydrophobicContact CD2-CD1 3.56Å; L280-Y282 HydrophobicContact CD2-CD2 3.6Å; L280-Y282 HydrophobicContact CD2-CE1 3.47Å; L280-Y282 VanDerWaalsContact CD2-CE1 3.47Å; L280-Y282 HydrophobicContact CD2-CE2 3.5Å; L280-Y282 VanDerWaalsContact CD2-CE2 3.5Å; L280-Y282 HydrophobicContact CD2-CG 3.64Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.42Å; L280-P302 HydrophobicContact CD2-CG 4.31Å; L280-S380 PolarHBondContact O-N 3.5Å
281	T	95.2	Very high	92.1	Very high	78 Å²	78	71.1 Å²	71.1	48%	0.479	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.2	172.4	-52.7	0	0	0	0	109.2	S380 H382	T281-S380 CarbonylContact C-O 3.58Å; T281-S380 WeakPolarHBondContact CA-O 3.2Å; T281-H382 HydrophobicContact CG2-CB 4.49Å
282	Y	96.5	Very high	92.2	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	151.3	171.4	-67.1	-72.8	0	0	0	110.8	F265 L266 L280 V300 P302 I304 I365 A379 S380 L381 H382	F265-Y282 HydrophobicContact CD1-CE2 4.07Å; F265-Y282 HydrophobicContact CE1-CE2 4.47Å; L266-Y282 PolarHBondContact O-OH 2.91Å; L266-Y282 VanDerWaalsContact O-OH 3.12Å; L280-Y282 HydrophobicContact CD2-CD1 3.56Å; L280-Y282 HydrophobicContact CD2-CD2 3.6Å; L280-Y282 HydrophobicContact CD2-CE1 3.47Å; L280-Y282 VanDerWaalsContact CD2-CE1 3.47Å; L280-Y282 HydrophobicContact CD2-CE2 3.5Å; L280-Y282 VanDerWaalsContact CD2-CE2 3.5Å; L280-Y282 HydrophobicContact CD2-CG 3.64Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.42Å; Y282-V300 HydrophobicContact CD1-CG1 4Å; Y282-V300 HydrophobicContact CG-CG1 4.06Å; Y282-P302 HydrophobicContact CD1-CG 3.98Å; Y282-P302 WeakPolarHBondContact CD1-O 3.21Å; Y282-P302 HydrophobicContact CE1-CG 3.84Å; Y282-P302 WeakPolarHBondContact CE1-O 3.35Å; Y282-I304 HydrophobicContact CD1-CG1 3.98Å; Y282-I304 HydrophobicContact CD2-CG1 4.09Å; Y282-I304 HydrophobicContact CE1-CB 4.38Å; Y282-I304 HydrophobicContact CE1-CG1 4Å; Y282-I304 HydrophobicContact CE2-CG1 4.11Å; Y282-I304 HydrophobicContact CE2-CG2 4.22Å; Y282-I304 HydrophobicContact CG-CG1 4.01Å; Y282-I365 HydrophobicContact CD2-CD1 4.03Å; Y282-I365 HydrophobicContact CE2-CD1 4.46Å; Y282-A379 HydrophobicContact CD2-CB 4Å; Y282-A379 HydrophobicContact CE2-CB 3.66Å; Y282-S380 PolarHBondContact N-O 2.8Å; Y282-L381 WeakPolarHBondContact O-CA 2.99Å; Y282-H382 PolarHBondContact O-N 3.35Å
283	Q	96.9	Very high	92.3	Very high	86 Å²	86	72.1 Å²	72.1	40%	0.402	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.6	-177.8	-64.1	-69.2	-18.8	0	0	110.1	T301 H382	Q283-T301 PolarHBondContact N-O 2.92Å; Q283-T301 PolarHBondContact O-N 2.92Å; Q283-H382 CarbonylContact C-O 3.54Å; Q283-H382 WeakPolarHBondContact CA-O 3.33Å; Q283-H382 PolarHBondContact OE1-CD2 2.82Å
284	A	96.4	Very high	92.4	Very high	8 Å²	8	69.4 Å²	69.4	7%	0.066	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.4	170.4	0	0	0	0	0	109.7	I298 V300 L381 H382 I383 E384	A284-I298 HydrophobicContact CB-CG2 3.89Å; A284-V300 HydrophobicContact CB-CG2 4.29Å; A284-L381 HydrophobicContact CB-CD1 4.5Å; A284-H382 PolarHBondContact N-O 2.89Å; A284-I383 HydrophobicContact CB-CG1 4.37Å; A284-I383 HydrophobicContact CB-CG2 4.34Å; A284-I383 CarbonylContact O-C 3.54Å; A284-I383 WeakPolarHBondContact O-CA 3.36Å; A284-E384 PolarHBondContact O-N 3.38Å
285	A	95	Very high	92.5	Very high	56 Å²	56	68.5 Å²	68.5	46%	0.463	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131	175.7	0	0	0	0	0	109.1	E384 L386	A285-E384 CarbonylContact C-O 3.58Å; A285-E384 WeakPolarHBondContact CA-O 3.36Å; A285-L386 HydrophobicContact CB-CD1 4Å; A285-L386 HydrophobicContact CB-CD2 4.31Å; A285-L386 HydrophobicContact CB-CG 4.14Å
286	I	93.9	Very high	92.8	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.2	-173.2	-66.8	175	0	0	0	108.8	L295 I298 F338 L349 I383 E384 I385 L386	I286-L295 HydrophobicContact CG2-CD1 3.54Å; I286-I298 HydrophobicContact CD1-CD1 3.55Å; I286-I298 HydrophobicContact CD1-CG1 3.87Å; I286-I298 HydrophobicContact CD1-CG2 3.98Å; I286-I298 HydrophobicContact CG1-CG1 4.45Å; I286-I298 HydrophobicContact CG1-CG2 4.13Å; I286-F338 HydrophobicContact CD1-CE1 3.57Å; I286-F338 HydrophobicContact CD1-CZ 4.12Å; I286-L349 HydrophobicContact CD1-CD1 4.5Å; I286-I383 HydrophobicContact CD1-CG2 3.66Å; I286-I383 HydrophobicContact CG1-CG2 4.12Å; I286-E384 PolarHBondContact N-O 2.7Å; I286-I385 HydrophobicContact CB-CD1 4.02Å; I286-I385 HydrophobicContact CG2-CD1 4.37Å; I286-I385 CarbonylContact O-C 3.58Å; I286-I385 WeakPolarHBondContact O-CA 3.28Å; I286-L386 PolarHBondContact O-N 3.2Å
287	P	92.3	Very high	93.1	Very high	34 Å²	34	62.7 Å²	62.7	22%	0.221	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	135.8	169.1	-16.7	29.9	0	0	0	110.8	R290 E388	P287-R290 HydrophobicContact CB-CG 3.87Å; P287-E388 HydrophobicContact CB-CG 4.36Å
288	E	91.4	Very high	93.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	162.1	178.5	74.7	173.7	128.6	0	0	112.8	R290 V353 R355 I385 L386 D387 E388 N390	E288-R290 PolarHBondContact O-N 2.88Å; E288-V353 CarbonylContact C-O 3.57Å; E288-V353 VanDerWaalsContact CA-O 3.3Å; E288-V353 WeakPolarHBondContact CA-O 2.93Å; E288-V353 WeakPolarHBondContact CB-O 3.42Å; E288-R355 HydrophobicContact CB-CB 4.05Å; E288-R355 HydrophobicContact CG-CB 4.38Å; E288-R355 VanDerWaalsContact OE2-CB 3.27Å; E288-R355 WeakPolarHBondContact OE2-CB 3.25Å; E288-R355 PolarHBondContact OE2-N 2.81Å; E288-I385 HydrophobicContact CB-CG2 3.84Å; E288-L386 PolarHBondContact N-O 3.26Å; E288-D387 WeakPolarHBondContact OE1-CA 3.46Å; E288-E388 HydrophobicContact CG-CB 4.07Å; E288-E388 HydrophobicContact CG-CG 4.23Å; E288-E388 PolarHBondContact OE1-N 2.69Å; E288-N390 PolarHBondContact OE1-ND2 3.46Å; E288-N390 PolarHBondContact OE2-ND2 3.3Å
289	L	90.1	Very high	93.4	Very high	79 Å²	79	59.9 Å²	59.9	41%	0.414	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	-4.2	176.1	-57	178.8	0	0	0	116.5	V353 N354 N390	L289-V353 PolarHBondContact N-O 2.86Å; L289-N354 HydrophobicContact CD2-CB 3.82Å; L289-N390 HydrophobicContact CD1-CB 4.19Å
290	R	90.6	Very high	93.6	Very high	93 Å²	93	54.6 Å²	54.6	35%	0.351	29%	0.293	S	S	.	.			trans	-69.2	145.7	174.9	-63.8	-53.4	-170.9	91.5	13.4	112.5	P287 E288 E294 L295 P352 E388	P287-R290 HydrophobicContact CB-CG 3.87Å; E288-R290 PolarHBondContact O-N 2.88Å; R290-E294 WeakPolarHBondContact CD-OE2 3.46Å; R290-E294 IonicContact NH1-OE2 3.72Å; R290-L295 HydrophobicContact CB-CD1 3.5Å; R290-L295 VanDerWaalsContact CB-CD1 3.5Å; R290-L295 HydrophobicContact CB-CD2 4.21Å; R290-L295 HydrophobicContact CB-CG 3.74Å; R290-L295 HydrophobicContact CG-CD1 4.38Å; R290-L295 HydrophobicContact CG-CD2 4.49Å; R290-P352 WeakPolarHBondContact O-CA 3.42Å; R290-P352 WeakPolarHBondContact O-CB 3.44Å; R290-E388 IonicContact CZ-OE1 3.17Å; R290-E388 IonicContact NE-OE1 3.39Å; R290-E388 PolarHBondContact NE-OE1 3.16Å; R290-E388 IonicContact NE-OE2 3.9Å; R290-E388 IonicContact NH2-OE1 3.74Å; R290-E388 PolarHBondContact NH2-OE1 2.84Å
291	T	92.4	Very high	93.7	Very high	47 Å²	47	57.7 Å²	57.7	29%	0.288	31%	0.313	S	S	.	.			trans	-77.9	149.8	-176.8	61.6	0	0	0	0	111.8	E293 E294 L295	T291-E293 WeakPolarHBondContact CB-OE2 3.48Å; T291-E293 PolarHBondContact O-N 2.9Å; T291-E294 PolarHBondContact O-N 3.3Å; T291-E294 VanDerWaalsContact OG1-CG 3.31Å; T291-E294 WeakPolarHBondContact OG1-CG 3.38Å; T291-E294 PolarHBondContact OG1-OE1 3.12Å; T291-L295 PolarHBondContact O-N 2.64Å
292	P	93.5	Very high	93.7	Very high	21 Å²	21	56 Å²	56	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-50.5	-36.1	172.3	-32	38.8	0	0	0	114	E294 N296 L349 L350	P292-E294 VanDerWaalsContact C-N 3.28Å; P292-E294 PolarHBondContact O-N 3.09Å; P292-N296 WeakPolarHBondContact O-CB 3.28Å; P292-N296 PolarHBondContact O-N 3.11Å; P292-N296 PolarHBondContact O-ND2 2.76Å; P292-L349 WeakPolarHBondContact CB-O 3.38Å; P292-L350 WeakPolarHBondContact CG-O 3.32Å
293	E	92.8	Very high	93.7	Very high	160 Å²	160	60.1 Å²	60.1	75%	0.748	33%	0.33	S	S	*	.	H	α-helix	trans	-67	-28.6	-179.7	-64.7	77.8	-169.1	0	0	113.3	T291	T291-E293 WeakPolarHBondContact CB-OE2 3.48Å; T291-E293 PolarHBondContact O-N 2.9Å
294	E	91.1	Very high	93.7	Very high	119 Å²	119	56.9 Å²	56.9	56%	0.556	32%	0.315	S	S	*	.	H	α-helix	trans	-84.1	-32.8	-179.4	-72.2	171.7	-152.7	0	0	112.7	R290 T291 P292	R290-E294 WeakPolarHBondContact CD-OE2 3.46Å; R290-E294 IonicContact NH1-OE2 3.72Å; T291-E294 PolarHBondContact O-N 3.3Å; T291-E294 VanDerWaalsContact OG1-CG 3.31Å; T291-E294 WeakPolarHBondContact OG1-CG 3.38Å; T291-E294 PolarHBondContact OG1-OE1 3.12Å; P292-E294 VanDerWaalsContact C-N 3.28Å; P292-E294 PolarHBondContact O-N 3.09Å
295	L	92.3	Very high	93.7	Very high	38 Å²	38	61 Å²	61	20%	0.199	33%	0.333	C	S	.	.	H	α-helix	trans	-101.6	-21.2	-172.1	-66.4	-179	0	0	0	114.6	I286 R290 T291 P297 L349	I286-L295 HydrophobicContact CG2-CD1 3.54Å; R290-L295 HydrophobicContact CB-CD1 3.5Å; R290-L295 VanDerWaalsContact CB-CD1 3.5Å; R290-L295 HydrophobicContact CB-CD2 4.21Å; R290-L295 HydrophobicContact CB-CG 3.74Å; R290-L295 HydrophobicContact CG-CD1 4.38Å; R290-L295 HydrophobicContact CG-CD2 4.49Å; T291-L295 PolarHBondContact O-N 2.64Å; L295-P297 CarbonylContact O-C 3.58Å; L295-P297 VanDerWaalsContact O-O 3.07Å; L295-L349 HydrophobicContact CD1-CD2 3.79Å
296	N	93.6	Very high	93.7	Very high	58 Å²	58	59 Å²	59	31%	0.31	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-78.2	138.5	-174	-76.6	-29.6	0	0	0	113.4	P292 T348 L349	P292-N296 WeakPolarHBondContact O-CB 3.28Å; P292-N296 PolarHBondContact O-N 3.11Å; P292-N296 PolarHBondContact O-ND2 2.76Å; N296-T348 WeakPolarHBondContact OD1-CA 3.35Å; N296-L349 PolarHBondContact ND2-O 3.46Å; N296-L349 PolarHBondContact OD1-N 3.3Å
297	P	94.2	Very high	93.7	Very high	72 Å²	72	63.2 Å²	63.2	47%	0.468	34%	0.338	S	S	.	.	S	Bend	cis	-78.1	147.7	-5.7	32.2	-34.9	0	0	0	112.7	L295 L299 E346	L295-P297 CarbonylContact O-C 3.58Å; L295-P297 VanDerWaalsContact O-O 3.07Å; P297-L299 PolarHBondContact O-N 3.29Å; P297-E346 HydrophobicContact CB-CG 3.41Å; P297-E346 VanDerWaalsContact CB-CG 3.41Å; P297-E346 HydrophobicContact CG-CG 4.31Å
298	I	94.9	Very high	93.8	Very high	12 Å²	12	62.7 Å²	62.7	6%	0.062	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-64.3	122.2	176.7	-63.6	160.5	0	0	0	108.7	A284 I286 V300 F338 L347 L349	A284-I298 HydrophobicContact CB-CG2 3.89Å; I286-I298 HydrophobicContact CD1-CD1 3.55Å; I286-I298 HydrophobicContact CD1-CG1 3.87Å; I286-I298 HydrophobicContact CD1-CG2 3.98Å; I286-I298 HydrophobicContact CG1-CG1 4.45Å; I286-I298 HydrophobicContact CG1-CG2 4.13Å; I298-V300 HydrophobicContact CG2-CG2 4.5Å; I298-V300 PolarHBondContact O-N 2.68Å; I298-F338 HydrophobicContact CD1-CD1 3.64Å; I298-F338 HydrophobicContact CD1-CE1 3.69Å; I298-L347 HydrophobicContact CB-CB 4.32Å; I298-L347 HydrophobicContact CB-CD2 4.2Å; I298-L347 HydrophobicContact CB-CG 4.38Å; I298-L347 WeakPolarHBondContact CB-O 3.3Å; I298-L347 HydrophobicContact CD1-CD2 3.98Å; I298-L347 HydrophobicContact CD1-CG 3.94Å; I298-L347 HydrophobicContact CG2-CD2 4.1Å; I298-L347 PolarHBondContact N-O 3.31Å; I298-L349 HydrophobicContact CD1-CB 3.98Å; I298-L349 HydrophobicContact CD1-CD1 4.5Å; I298-L349 HydrophobicContact CG1-CB 4.39Å
299	L	94.9	Very high	94	Very high	145 Å²	145	65.4 Å²	65.4	76%	0.759	35%	0.346	S	S	*	.			trans	-75.3	115.9	177.9	-173.3	67.2	0	0	0	110.2	P297	P297-L299 PolarHBondContact O-N 3.29Å
300	V	96.4	Very high	94.2	Very high	12 Å²	12	62 Å²	62	7%	0.073	33%	0.328	C	S	.	.			trans	-105.5	136.4	177.7	-176.3	0	0	0	0	110	Y282 A284 I298 P302 I304 L347 L381	Y282-V300 HydrophobicContact CD1-CG1 4Å; Y282-V300 HydrophobicContact CG-CG1 4.06Å; A284-V300 HydrophobicContact CB-CG2 4.29Å; I298-V300 HydrophobicContact CG2-CG2 4.5Å; I298-V300 PolarHBondContact O-N 2.68Å; V300-P302 CarbonylContact C-O 3.59Å; V300-P302 CarbonylContact O-C 3.59Å; V300-P302 VanDerWaalsContact O-C 3.22Å; V300-P302 VanDerWaalsContact O-O 3.13Å; V300-I304 HydrophobicContact CB-CD1 4.13Å; V300-I304 HydrophobicContact CB-CG1 4.18Å; V300-I304 HydrophobicContact CG1-CD1 3.91Å; V300-I304 HydrophobicContact CG1-CG1 3.77Å; V300-I304 HydrophobicContact CG2-CD1 3.95Å; V300-L347 HydrophobicContact CG2-CB 4.35Å; V300-L347 HydrophobicContact CG2-CD2 4.11Å; V300-L381 HydrophobicContact CG1-CD1 3.7Å; V300-L381 HydrophobicContact CG2-CD1 4.32Å
301	T	93.9	Very high	94.1	Very high	90 Å²	90	67.7 Å²	67.7	55%	0.552	35%	0.35	S	S	*	.	B	Isolated β-bridge	trans	-117.6	125.4	-178.4	-52.1	0	0	0	0	111.3	Q283	Q283-T301 PolarHBondContact N-O 2.92Å; Q283-T301 PolarHBondContact O-N 2.92Å
302	P	95.6	Very high	94.2	Very high	43 Å²	43	68.4 Å²	68.4	28%	0.279	35%	0.352	S	S	.	.	S	Bend	cis	-63.5	170.1	-16.1	27.5	-31.6	0	0	0	112	P267 L280 Y282 V300 I304	P267-P302 HydrophobicContact CG-CG 4.43Å; L280-P302 HydrophobicContact CD2-CG 4.31Å; Y282-P302 HydrophobicContact CD1-CG 3.98Å; Y282-P302 WeakPolarHBondContact CD1-O 3.21Å; Y282-P302 HydrophobicContact CE1-CG 3.84Å; Y282-P302 WeakPolarHBondContact CE1-O 3.35Å; V300-P302 CarbonylContact C-O 3.59Å; V300-P302 CarbonylContact O-C 3.59Å; V300-P302 VanDerWaalsContact O-C 3.22Å; V300-P302 VanDerWaalsContact O-O 3.13Å; P302-I304 PolarHBondContact O-N 2.6Å
303	P	95.8	Very high	94.2	Very high	86 Å²	86	67.8 Å²	67.8	56%	0.558	35%	0.347	S	S	*	.			trans	-58.6	132.5	177.4	-24.7	34.5	0	0	0	112	Q305	P303-Q305 PolarHBondContact O-N 3.45Å
304	I	96.7	Very high	94	Very high	17 Å²	17	64.3 Å²	64.3	9%	0.087	33%	0.331	C	S	.	.			trans	-68.9	115.7	179.3	-57.1	160.8	0	0	0	109.1	F265 Y282 V300 P302 Y324 M340 A345 I365	F265-I304 HydrophobicContact CE1-CG2 4.08Å; Y282-I304 HydrophobicContact CD1-CG1 3.98Å; Y282-I304 HydrophobicContact CD2-CG1 4.09Å; Y282-I304 HydrophobicContact CE1-CB 4.38Å; Y282-I304 HydrophobicContact CE1-CG1 4Å; Y282-I304 HydrophobicContact CE2-CG1 4.11Å; Y282-I304 HydrophobicContact CE2-CG2 4.22Å; Y282-I304 HydrophobicContact CG-CG1 4.01Å; V300-I304 HydrophobicContact CB-CD1 4.13Å; V300-I304 HydrophobicContact CB-CG1 4.18Å; V300-I304 HydrophobicContact CG1-CD1 3.91Å; V300-I304 HydrophobicContact CG1-CG1 3.77Å; V300-I304 HydrophobicContact CG2-CD1 3.95Å; P302-I304 PolarHBondContact O-N 2.6Å; I304-Y324 HydrophobicContact CG2-CD1 4.47Å; I304-Y324 HydrophobicContact CG2-CE1 4.49Å; I304-M340 HydrophobicContact CD1-CE 4.01Å; I304-A345 HydrophobicContact CB-CB 3.86Å; I304-A345 HydrophobicContact CG2-CB 3.54Å; I304-I365 HydrophobicContact CD1-CD1 3.55Å; I304-I365 HydrophobicContact CG1-CD1 4.04Å; I304-I365 HydrophobicContact CG2-CD1 4.25Å
305	Q	95.5	Very high	94	Very high	95 Å²	95	61.8 Å²	61.8	44%	0.444	32%	0.324	S	S	.	.			trans	-154.1	150.9	174.5	67.1	-171.1	-30.7	0	0	109.4	L266 P303	L266-Q305 HydrophobicContact CB-CG 3.72Å; L266-Q305 HydrophobicContact CD1-CG 4.01Å; L266-Q305 HydrophobicContact CG-CG 4.24Å; L266-Q305 PolarHBondContact N-O 3.29Å; P303-Q305 PolarHBondContact O-N 3.45Å
306	A	95.9	Very high	93.9	Very high	13 Å²	13	63.6 Å²	63.6	11%	0.107	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.5	173.5	0	0	0	0	0	109.5	P263 M264 F265 I322 Y324 A367	P263-A306 HydrophobicContact CB-CB 4.11Å; M264-A306 CarbonylContact O-C 3.56Å; M264-A306 WeakPolarHBondContact O-CA 3.49Å; M264-A306 VanDerWaalsContact O-CB 3.32Å; M264-A306 WeakPolarHBondContact O-CB 3.46Å; F265-A306 HydrophobicContact CD1-CB 4.11Å; F265-A306 HydrophobicContact CE1-CB 4.42Å; A306-I322 HydrophobicContact CB-CD1 4.4Å; A306-I322 HydrophobicContact CB-CG2 4.36Å; A306-I322 VanDerWaalsContact O-CD1 3.26Å; A306-I322 WeakPolarHBondContact O-CD1 3.24Å; A306-Y324 HydrophobicContact CB-CE1 3.82Å; A306-Y324 PolarHBondContact N-OH 3.28Å; A306-Y324 PolarHBondContact O-OH 3.27Å; A306-A367 HydrophobicContact CB-CB 3.85Å
307	I	94.8	Very high	93.9	Very high	93 Å²	93	65.4 Å²	65.4	48%	0.477	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.9	175.3	-167.6	169.1	0	0	0	108.9	P263 M264 L266	P263-I307 CarbonylContact C-O 3.6Å; P263-I307 WeakPolarHBondContact CA-O 3.42Å; M264-I307 HydrophobicContact CG-CG2 3.86Å; M264-I307 WeakPolarHBondContact CG-O 3.11Å; M264-I307 PolarHBondContact N-O 2.96Å; M264-I307 PolarHBondContact O-N 3.27Å; M264-I307 HydrophobicContact SD-CG2 4.37Å; L266-I307 HydrophobicContact CD1-CB 4.31Å; L266-I307 HydrophobicContact CD1-CG2 4.07Å; L266-I307 HydrophobicContact CD2-CG2 3.96Å; L266-I307 HydrophobicContact CG-CG2 4.21Å
308	D	94.6	Very high	93.7	Very high	23 Å²	23	66.5 Å²	66.5	12%	0.123	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	138.6	171.8	-155.9	-31	0	0	0	110.4	D310 P320 Q369	D308-D310 VanDerWaalsContact C-N 3.3Å; D308-D310 PolarHBondContact OD1-N 3.12Å; D308-D310 VanDerWaalsContact OD1-N 3.1Å; D308-P320 WeakPolarHBondContact OD2-CD 3.26Å; D308-P320 WeakPolarHBondContact OD2-CG 3.43Å; D308-Q369 PolarHBondContact OD1-NE2 2.99Å; D308-Q369 PolarHBondContact OD2-NE2 3.11Å
309	Q	94.3	Very high	93.7	Very high	58 Å²	58	71.5 Å²	71.5	27%	0.271	38%	0.376	S	S	.	.	S	Bend	trans	-74.1	-26.6	177.6	-73.9	-175.4	78.8	0	0	111.8	L261 G262 M264 R311	L261-Q309 HydrophobicContact CB-CB 3.5Å; L261-Q309 HydrophobicContact CB-CG 4.48Å; L261-Q309 HydrophobicContact CD1-CB 3.91Å; L261-Q309 HydrophobicContact CG-CB 4.36Å; G262-Q309 WeakPolarHBondContact O-CB 3.39Å; G262-Q309 WeakPolarHBondContact O-CG 3.34Å; G262-Q309 PolarHBondContact O-N 3.44Å; G262-Q309 PolarHBondContact O-NE2 3.17Å; M264-Q309 HydrophobicContact CB-CG 3.93Å; M264-Q309 HydrophobicContact CE-CG 3.48Å; M264-Q309 VanDerWaalsContact CE-CG 3.48Å; M264-Q309 HydrophobicContact CG-CG 3.79Å; M264-Q309 HydrophobicContact SD-CG 4.44Å; Q309-R311 WeakPolarHBondContact O-CG 3.45Å; Q309-R311 PolarHBondContact O-N 2.96Å; Q309-R311 VanDerWaalsContact O-N 3.15Å
310	D	94.3	Very high	93.6	Very high	8 Å²	8	65.4 Å²	65.4	4%	0.043	35%	0.345	C	S	.	.			trans	-79.3	96.2	178.6	-61.1	-26.5	0	0	0	110.1	D259 D260 L261 D308 N312 I313	D259-D310 VanDerWaalsContact CA-OD2 3.27Å; D259-D310 WeakPolarHBondContact CA-OD2 3.14Å; D260-D310 PolarHBondContact N-OD2 3.13Å; L261-D310 WeakPolarHBondContact CB-OD1 3.12Å; L261-D310 WeakPolarHBondContact CG-OD1 3.33Å; L261-D310 PolarHBondContact N-OD1 3.4Å; L261-D310 PolarHBondContact N-OD2 3.24Å; L261-D310 VanDerWaalsContact N-OD2 3.1Å; L261-D310 VanDerWaalsContact O-OD2 3.08Å; D308-D310 VanDerWaalsContact C-N 3.3Å; D308-D310 PolarHBondContact OD1-N 3.12Å; D308-D310 VanDerWaalsContact OD1-N 3.1Å; D310-N312 VanDerWaalsContact C-N 3.33Å; D310-N312 PolarHBondContact O-N 2.78Å; D310-I313 HydrophobicContact CB-CD1 3.61Å; D310-I313 HydrophobicContact CB-CG1 3.66Å
311	R	89.8	Confident	93.4	Very high	212 Å²	212	66.1 Å²	66.1	80%	0.8	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.3	-163.6	-63	-169.4	175	-178.7	-1.9	113.8	D257 Q309	D257-R311 PolarHBondContact OD2-N 3.15Å; Q309-R311 WeakPolarHBondContact O-CG 3.45Å; Q309-R311 PolarHBondContact O-N 2.96Å; Q309-R311 VanDerWaalsContact O-N 3.15Å
312	N	93.1	Very high	93.5	Very high	62 Å²	62	63.2 Å²	63.2	33%	0.332	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	36.3	-168.4	-167.9	35.9	0	0	0	113	Y222 D257 D310 Q314	Y222-N312 HydrophobicContact CE1-CB 4.3Å; Y222-N312 WeakPolarHBondContact OH-CB 3.16Å; Y222-N312 PolarHBondContact OH-ND2 3.44Å; D257-N312 HydrophobicContact CB-CB 4.22Å; D257-N312 WeakPolarHBondContact CB-O 3.41Å; D257-N312 VanDerWaalsContact OD2-CA 3.27Å; D257-N312 WeakPolarHBondContact OD2-CA 3.36Å; D257-N312 WeakPolarHBondContact OD2-CB 3.33Å; D257-N312 PolarHBondContact OD2-N 2.87Å; D310-N312 VanDerWaalsContact C-N 3.33Å; D310-N312 PolarHBondContact O-N 2.78Å; N312-Q314 WeakPolarHBondContact O-CG 3.12Å; N312-Q314 PolarHBondContact O-N 2.79Å; N312-Q314 VanDerWaalsContact O-N 3.14Å; N312-Q314 PolarHBondContact OD1-NE2 3.27Å
313	I	93.1	Very high	93.6	Very high	7 Å²	7	63.5 Å²	63.5	4%	0.036	33%	0.334	C	S	.	.			trans	-54.3	123.9	166.7	-62.9	178.3	0	0	0	109.2	D259 D310 D318 R319	D259-I313 HydrophobicContact CB-CD1 4.09Å; D310-I313 HydrophobicContact CB-CD1 3.61Å; D310-I313 HydrophobicContact CB-CG1 3.66Å; I313-D318 HydrophobicContact CG2-CB 3.83Å; I313-R319 HydrophobicContact CB-CG 3.93Å; I313-R319 HydrophobicContact CG2-CG 4.2Å; I313-R319 PolarHBondContact O-NE 2.97Å; I313-R319 VanDerWaalsContact O-NE 3.14Å
314	Q	88.7	Confident	93.7	Very high	88 Å²	88	60.3 Å²	60.3	41%	0.411	31%	0.311	S	S	.	.	S	Bend	trans	-125.2	136.5	179.1	-66.5	-59.9	-31.3	0	0	110.7	N312	N312-Q314 WeakPolarHBondContact O-CG 3.12Å; N312-Q314 PolarHBondContact O-N 2.79Å; N312-Q314 VanDerWaalsContact O-N 3.14Å; N312-Q314 PolarHBondContact OD1-NE2 3.27Å
315	P	92.2	Very high	93.7	Very high	65 Å²	65	61.3 Å²	61.3	42%	0.422	32%	0.32	S	S	.	.	S	Bend	cis	-68.5	162.8	-5.2	29.8	-36.7	0	0	0	112.7	S317 D318	P315-S317 VanDerWaalsContact CG-OG 3.29Å; P315-S317 WeakPolarHBondContact CG-OG 3.4Å; P315-S317 PolarHBondContact O-N 3.16Å; P315-D318 PolarHBondContact O-N 2.82Å
316	P	90.8	Very high	93.8	Very high	76 Å²	76	58.1 Å²	58.1	49%	0.494	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-61.4	-13.9	179.2	-24.1	35.6	0	0	0	114.7	D318 R319	P316-D318 PolarHBondContact O-N 2.86Å; P316-R319 WeakPolarHBondContact O-CB 3.49Å; P316-R319 PolarHBondContact O-N 2.9Å
317	S	92.1	Very high	93.8	Very high	97 Å²	97	61.4 Å²	61.4	68%	0.678	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-67.6	-20.5	172.6	54.8	0	0	0	0	113.6	P315	P315-S317 VanDerWaalsContact CG-OG 3.29Å; P315-S317 WeakPolarHBondContact CG-OG 3.4Å; P315-S317 PolarHBondContact O-N 3.16Å
318	D	91.4	Very high	93.8	Very high	95 Å²	95	60.8 Å²	60.8	51%	0.508	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-91.9	-6.1	-177.8	-64.1	8.6	0	0	0	111.2	I313 P315 P316 P320	I313-D318 HydrophobicContact CG2-CB 3.83Å; P315-D318 PolarHBondContact O-N 2.82Å; P316-D318 PolarHBondContact O-N 2.86Å; D318-P320 WeakPolarHBondContact O-CD 3.49Å
319	R	92.9	Very high	93.8	Very high	116 Å²	116	60.1 Å²	60.1	44%	0.438	32%	0.32	S	S	.	.	S	Bend	trans	-66.4	119.6	173.7	-68.1	172.9	-172	-165.7	-4.1	109.2	I313 P316	I313-R319 HydrophobicContact CB-CG 3.93Å; I313-R319 HydrophobicContact CG2-CG 4.2Å; I313-R319 PolarHBondContact O-NE 2.97Å; I313-R319 VanDerWaalsContact O-NE 3.14Å; P316-R319 WeakPolarHBondContact O-CB 3.49Å; P316-R319 PolarHBondContact O-N 2.9Å
320	P	93.2	Very high	93.8	Very high	18 Å²	18	61.4 Å²	61.4	12%	0.117	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-67.4	151.5	179.2	26.1	-31.1	0	0	0	111.3	D308 D318 Q369 N371	D308-P320 WeakPolarHBondContact OD2-CD 3.26Å; D308-P320 WeakPolarHBondContact OD2-CG 3.43Å; D318-P320 WeakPolarHBondContact O-CD 3.49Å; P320-Q369 HydrophobicContact CB-CB 3.74Å; P320-Q369 HydrophobicContact CB-CG 3.94Å; P320-Q369 HydrophobicContact CG-CB 3.91Å; P320-Q369 HydrophobicContact CG-CG 3.54Å; P320-N371 HydrophobicContact CB-CB 4.03Å
321	G	93.4	Very high	93.9	Very high	26 Å²	26	63.5 Å²	63.5	27%	0.268	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-73.8	158.5	160.4	0	0	0	0	0	110.3	Q369 D370	G321-Q369 CarbonylContact O-C 3.2Å; G321-Q369 WeakPolarHBondContact O-CA 3.35Å; G321-D370 WeakPolarHBondContact CA-OD1 3.32Å; G321-D370 PolarHBondContact N-OD1 3.35Å; G321-D370 PolarHBondContact O-N 3.1Å
322	I	96.3	Very high	94.1	Very high	29 Å²	29	61.9 Å²	61.9	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.5	175.9	-59.9	171.1	0	0	0	108.6	P263 A306 Y324 A367 E368	P263-I322 HydrophobicContact CB-CD1 4.15Å; P263-I322 HydrophobicContact CB-CG1 4.41Å; P263-I322 HydrophobicContact CB-CG2 4.36Å; P263-I322 HydrophobicContact CG-CD1 4.39Å; P263-I322 HydrophobicContact CG-CG1 4.13Å; P263-I322 HydrophobicContact CG-CG2 4.22Å; A306-I322 HydrophobicContact CB-CD1 4.4Å; A306-I322 HydrophobicContact CB-CG2 4.36Å; A306-I322 VanDerWaalsContact O-CD1 3.26Å; A306-I322 WeakPolarHBondContact O-CD1 3.24Å; I322-Y324 HydrophobicContact CB-CE2 4.39Å; I322-Y324 HydrophobicContact CG2-CD2 4.46Å; I322-Y324 HydrophobicContact CG2-CE1 4.11Å; I322-Y324 HydrophobicContact CG2-CE2 3.9Å; I322-A367 HydrophobicContact CG2-CB 3.94Å; I322-E368 CarbonylContact C-O 3.55Å; I322-E368 WeakPolarHBondContact CA-O 3.4Å
323	L	96.9	Very high	94.2	Very high	50 Å²	50	61.8 Å²	61.8	26%	0.262	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.3	174.1	-67.4	171.7	0	0	0	110.5	P342 R343 A367 E368 D370	L323-P342 CarbonylContact C-O 3.56Å; L323-P342 VanDerWaalsContact CA-O 3.24Å; L323-P342 WeakPolarHBondContact CA-O 3.31Å; L323-P342 HydrophobicContact CD2-CB 4.24Å; L323-R343 HydrophobicContact CD2-CG 4.25Å; L323-A367 CarbonylContact O-C 3.46Å; L323-A367 WeakPolarHBondContact O-CA 3.31Å; L323-E368 HydrophobicContact CB-CG 4.26Å; L323-E368 PolarHBondContact N-O 3.39Å; L323-E368 PolarHBondContact O-N 3.45Å; L323-D370 HydrophobicContact CD1-CB 3.63Å; L323-D370 HydrophobicContact CG-CB 3.86Å
324	Y	97.6	Very high	94.3	Very high	19 Å²	19	63 Å²	63	8%	0.075	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.2	175.4	-58.5	-87.5	0	0	0	110.7	F265 I304 A306 I322 P342 A345 K366 A367	F265-Y324 HydrophobicContact CE1-CD1 4.24Å; F265-Y324 HydrophobicContact CE1-CE1 4.08Å; I304-Y324 HydrophobicContact CG2-CD1 4.47Å; I304-Y324 HydrophobicContact CG2-CE1 4.49Å; A306-Y324 HydrophobicContact CB-CE1 3.82Å; A306-Y324 PolarHBondContact N-OH 3.28Å; A306-Y324 PolarHBondContact O-OH 3.27Å; I322-Y324 HydrophobicContact CB-CE2 4.39Å; I322-Y324 HydrophobicContact CG2-CD2 4.46Å; I322-Y324 HydrophobicContact CG2-CE1 4.11Å; I322-Y324 HydrophobicContact CG2-CE2 3.9Å; Y324-P342 PolarHBondContact N-O 2.86Å; Y324-P342 WeakPolarHBondContact O-CA 3.41Å; Y324-A345 HydrophobicContact CD1-CB 3.75Å; Y324-A345 HydrophobicContact CD2-CB 3.75Å; Y324-A345 HydrophobicContact CE1-CB 4.03Å; Y324-A345 HydrophobicContact CE2-CB 4.04Å; Y324-A345 HydrophobicContact CG-CB 3.59Å; Y324-K366 CarbonylContact C-O 3.57Å; Y324-K366 WeakPolarHBondContact CA-O 3.46Å; Y324-A367 HydrophobicContact CD1-CB 3.92Å; Y324-A367 HydrophobicContact CE1-CB 3.85Å
325	S	97.1	Very high	94.7	Very high	37 Å²	37	62.2 Å²	62.2	26%	0.259	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.9	173.6	52	0	0	0	0	110.2	I365 K366	S325-I365 WeakPolarHBondContact O-CA 3.27Å; S325-K366 PolarHBondContact N-O 3.32Å; S325-K366 PolarHBondContact O-N 3.28Å; S325-K366 WeakPolarHBondContact OG-CE 3.38Å
326	I	97.2	Very high	94.9	Very high	28 Å²	28	66 Å²	66	14%	0.144	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.3	166.1	-55.7	163	0	0	0	106.4	Y334 F338 M340 L347 L363	I326-Y334 HydrophobicContact CB-CE2 3.86Å; I326-Y334 HydrophobicContact CD1-CD2 4.32Å; I326-Y334 HydrophobicContact CD1-CE2 4.1Å; I326-Y334 HydrophobicContact CG2-CD2 4.06Å; I326-Y334 HydrophobicContact CG2-CE2 3.33Å; I326-F338 HydrophobicContact CD1-CB 4.49Å; I326-M340 HydrophobicContact CD1-CB 4.03Å; I326-M340 HydrophobicContact CG1-CB 3.99Å; I326-M340 HydrophobicContact CG1-CE 4Å; I326-M340 HydrophobicContact CG1-SD 4.32Å; I326-L347 HydrophobicContact CD1-CD1 4.23Å; I326-L363 HydrophobicContact CD1-CD1 4.16Å; I326-L363 HydrophobicContact CG2-CB 4.16Å; I326-L363 HydrophobicContact CG2-CD1 4.37Å
327	L	95.5	Very high	95.2	Very high	82 Å²	82	62.7 Å²	62.7	43%	0.429	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-52.5	-177.5	179.1	67.6	0	0	0	110.9	V364 K366 F378	L327-V364 HydrophobicContact CD2-CG1 4.35Å; L327-V364 PolarHBondContact N-O 2.86Å; L327-K366 HydrophobicContact CB-CB 4.28Å; L327-K366 HydrophobicContact CD1-CD 4.49Å; L327-F378 HydrophobicContact CD2-CD1 3.94Å; L327-F378 HydrophobicContact CD2-CE1 3.72Å
328	V	95.2	Very high	95.4	Very high	80 Å²	80	58.4 Å²	58.4	49%	0.485	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	161.9	-178.6	-71.4	0	0	0	0	109.2	V364	V328-V364 HydrophobicContact CG2-CB 3.8Å; V328-V364 HydrophobicContact CG2-CG2 3.83Å; V328-V364 PolarHBondContact O-N 3.22Å
329	G	94.8	Very high	95.6	Very high	10 Å²	10	58.4 Å²	58.4	10%	0.103	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	155	176.1	0	0	0	0	0	112.3	P331 Y334 D362	G329-P331 CarbonylContact C-O 3.57Å; G329-P331 CarbonylContact O-C 3.56Å; G329-Y334 VanDerWaalsContact N-CE1 3.34Å; G329-D362 CarbonylContact C-O 3.41Å; G329-D362 VanDerWaalsContact CA-O 3.23Å; G329-D362 WeakPolarHBondContact CA-O 3.29Å
330	T	95.1	Very high	95.8	Very high	85 Å²	85	53.4 Å²	53.4	52%	0.521	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.2	174.3	55.2	0	0	0	0	109.2	D362	T330-D362 PolarHBondContact N-O 2.77Å; T330-D362 PolarHBondContact O-N 2.78Å
331	P	95.7	Very high	96	Very high	52 Å²	52	56.5 Å²	56.5	34%	0.338	30%	0.298	S	S	.	.	S	Bend	cis	-58.6	154.5	-4.7	-29	39.7	0	0	0	115.4	G329 D333 Y334 K360	G329-P331 CarbonylContact C-O 3.57Å; G329-P331 CarbonylContact O-C 3.56Å; P331-D333 WeakPolarHBondContact CB-OD1 3.41Å; P331-D333 PolarHBondContact O-N 3.44Å; P331-Y334 PolarHBondContact O-N 2.83Å; P331-K360 VanDerWaalsContact CD-O 3.29Å; P331-K360 WeakPolarHBondContact CD-O 3.43Å
332	E	93.6	Very high	96.1	Very high	177 Å²	177	58 Å²	58	83%	0.827	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.8	-175.5	-69.6	-170.2	168.7	0	0	113.8	Y334 P335	E332-Y334 VanDerWaalsContact C-N 3.27Å; E332-Y334 PolarHBondContact O-N 3.07Å; E332-P335 WeakPolarHBondContact O-CD 3.15Å
333	D	95.5	Very high	96.1	Very high	61 Å²	61	64 Å²	64	33%	0.326	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	8.5	178.2	65.2	-30.5	0	0	0	113.6	P331 P335 R336 H358	P331-D333 WeakPolarHBondContact CB-OD1 3.41Å; P331-D333 PolarHBondContact O-N 3.44Å; D333-P335 WeakPolarHBondContact O-CD 3.24Å; D333-P335 VanDerWaalsContact O-N 3.08Å; D333-R336 VanDerWaalsContact O-CB 3.23Å; D333-R336 WeakPolarHBondContact O-CB 3.35Å; D333-R336 PolarHBondContact O-N 2.97Å; D333-H358 IonicContact OD1-CD2 3.17Å; D333-H358 IonicContact OD1-NE2 2.8Å; D333-H358 PolarHBondContact OD1-NE2 2.7Å; D333-H358 IonicContact OD2-CD2 3.64Å; D333-H358 IonicContact OD2-CE1 3.08Å; D333-H358 PolarHBondContact OD2-CE1 2.83Å; D333-H358 IonicContact OD2-NE2 2.99Å; D333-H358 PolarHBondContact OD2-NE2 3.09Å
334	Y	96	Very high	96	Very high	32 Å²	32	65.3 Å²	65.3	13%	0.125	33%	0.334	C	S	.	.	H	α-helix	trans	-46.5	-33.8	170.3	81.3	-93.6	0	0	0	115.2	I326 G329 P331 E332 R336 F337 F338 L363	I326-Y334 HydrophobicContact CB-CE2 3.86Å; I326-Y334 HydrophobicContact CD1-CD2 4.32Å; I326-Y334 HydrophobicContact CD1-CE2 4.1Å; I326-Y334 HydrophobicContact CG2-CD2 4.06Å; I326-Y334 HydrophobicContact CG2-CE2 3.33Å; G329-Y334 VanDerWaalsContact N-CE1 3.34Å; P331-Y334 PolarHBondContact O-N 2.83Å; E332-Y334 VanDerWaalsContact C-N 3.27Å; E332-Y334 PolarHBondContact O-N 3.07Å; Y334-R336 PolarHBondContact O-N 2.66Å; Y334-R336 VanDerWaalsContact O-N 3.1Å; Y334-F337 PolarHBondContact O-N 3.32Å; Y334-F338 PolarHBondContact O-N 3.3Å; Y334-L363 HydrophobicContact CD1-CD2 4.05Å; Y334-L363 HydrophobicContact CD2-CD1 4.46Å; Y334-L363 HydrophobicContact CD2-CD2 3.91Å; Y334-L363 HydrophobicContact CG-CD2 3.57Å
335	P	96.2	Very high	95.9	Very high	71 Å²	71	64.6 Å²	64.6	46%	0.461	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-15.5	-179.9	-20.7	34.2	0	0	0	113.4	E332 D333	E332-P335 WeakPolarHBondContact O-CD 3.15Å; D333-P335 WeakPolarHBondContact O-CD 3.24Å; D333-P335 VanDerWaalsContact O-N 3.08Å
336	R	96	Very high	95.9	Very high	144 Å²	144	67.1 Å²	67.1	54%	0.543	34%	0.34	S	S	.	.	H	α-helix	trans	-73.1	-33.7	173.3	-174.6	179.8	169.1	-166.4	-9.9	111.9	D333 Y334 L350 E351	D333-R336 VanDerWaalsContact O-CB 3.23Å; D333-R336 WeakPolarHBondContact O-CB 3.35Å; D333-R336 PolarHBondContact O-N 2.97Å; Y334-R336 PolarHBondContact O-N 2.66Å; Y334-R336 VanDerWaalsContact O-N 3.1Å; R336-L350 WeakPolarHBondContact O-CB 3.12Å; R336-E351 IonicContact CZ-OE2 3.63Å; R336-E351 VanDerWaalsContact CZ-OE2 3.27Å; R336-E351 IonicContact NE-OE1 3.72Å; R336-E351 IonicContact NE-OE2 2.82Å; R336-E351 PolarHBondContact NE-OE2 2.91Å; R336-E351 IonicContact NH2-OE2 3.2Å; R336-E351 PolarHBondContact NH2-OE2 3.46Å
337	F	96.8	Very high	95.8	Very high	8 Å²	8	65.9 Å²	65.9	4%	0.035	33%	0.333	C	S	.	.	H	α-helix	trans	-100.9	-32.9	-173.8	-60.2	-74.3	0	0	0	112.7	Y334 L349 L350 E351 V353 H358 F361	Y334-F337 PolarHBondContact O-N 3.32Å; F337-L349 CarbonylContact O-C 3.52Å; F337-L349 VanDerWaalsContact O-CA 3.3Å; F337-L349 WeakPolarHBondContact O-CA 3.09Å; F337-L350 PolarHBondContact O-N 2.97Å; F337-E351 HydrophobicContact CD1-CB 4.29Å; F337-V353 HydrophobicContact CB-CG2 4.25Å; F337-V353 HydrophobicContact CD1-CG2 3.62Å; F337-V353 HydrophobicContact CE1-CG2 4.17Å; F337-V353 HydrophobicContact CG-CG2 4.04Å; F337-H358 AromaticContact CE2-CE1 3.57Å; F337-H358 AromaticContact CE2-ND1 3.96Å; F337-H358 AromaticContact CE2-NE2 3.63Å; F337-H358 AromaticContact CZ-CE1 3.55Å; F337-H358 AromaticContact CZ-ND1 3.75Å; F337-F361 AromaticContact CD2-CE1 3.81Å; F337-F361 HydrophobicContact CD2-CE1 3.81Å; F337-F361 AromaticContact CD2-CZ 3.61Å; F337-F361 HydrophobicContact CD2-CZ 3.61Å; F337-F361 HydrophobicContact CE2-CE1 4.28Å; F337-F361 AromaticContact CE2-CZ 3.98Å; F337-F361 HydrophobicContact CE2-CZ 3.98Å; F337-F361 HydrophobicContact CG-CZ 4.17Å
338	F	97.1	Very high	95.9	Very high	6 Å²	6	63.3 Å²	63.3	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.9	-171.2	-55.5	-71.6	0	0	0	112.6	I286 I298 I326 Y334 L347 T348 L349 F361 I383	I286-F338 HydrophobicContact CD1-CE1 3.57Å; I286-F338 HydrophobicContact CD1-CZ 4.12Å; I298-F338 HydrophobicContact CD1-CD1 3.64Å; I298-F338 HydrophobicContact CD1-CE1 3.69Å; I326-F338 HydrophobicContact CD1-CB 4.49Å; Y334-F338 PolarHBondContact O-N 3.3Å; F338-L347 HydrophobicContact CB-CD1 4.13Å; F338-L347 HydrophobicContact CD1-CD2 4.5Å; F338-T348 WeakPolarHBondContact CA-O 3.27Å; F338-L349 HydrophobicContact CD1-CD1 4.17Å; F338-L349 HydrophobicContact CE1-CD1 3.67Å; F338-L349 HydrophobicContact CZ-CD1 4.28Å; F338-F361 HydrophobicContact CD2-CD1 4.45Å; F338-F361 HydrophobicContact CD2-CG 4.41Å; F338-F361 HydrophobicContact CE2-CB 4.12Å; F338-F361 AromaticContact CE2-CD1 3.83Å; F338-F361 HydrophobicContact CE2-CD1 3.83Å; F338-F361 AromaticContact CE2-CD2 3.44Å; F338-F361 HydrophobicContact CE2-CD2 3.44Å; F338-F361 VanDerWaalsContact CE2-CD2 3.44Å; F338-F361 HydrophobicContact CE2-CE1 4.05Å; F338-F361 AromaticContact CE2-CE2 3.67Å; F338-F361 HydrophobicContact CE2-CE2 3.67Å; F338-F361 AromaticContact CE2-CG 3.52Å; F338-F361 HydrophobicContact CE2-CG 3.52Å; F338-F361 AromaticContact CE2-CZ 3.96Å; F338-F361 HydrophobicContact CE2-CZ 3.96Å; F338-F361 AromaticContact CZ-CD2 3.78Å; F338-F361 HydrophobicContact CZ-CD2 3.78Å; F338-F361 AromaticContact CZ-CE2 3.97Å; F338-F361 HydrophobicContact CZ-CE2 3.97Å; F338-F361 HydrophobicContact CZ-CG 4.27Å; F338-I383 HydrophobicContact CD1-CD1 4.06Å; F338-I383 HydrophobicContact CD2-CD1 4.22Å; F338-I383 HydrophobicContact CE1-CD1 3.83Å; F338-I383 HydrophobicContact CE1-CG2 4.45Å; F338-I383 HydrophobicContact CE2-CD1 4Å; F338-I383 HydrophobicContact CG-CD1 4.25Å; F338-I383 HydrophobicContact CZ-CD1 3.79Å; F338-I383 HydrophobicContact CZ-CG2 4.16Å
339	H	96.3	Very high	96	Very high	95 Å²	95	59.6 Å²	59.6	44%	0.44	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.9	168.8	171.6	-91.5	0	0	0	109.5	T348 L350	H339-T348 PolarHBondContact N-O 2.87Å; H339-T348 PolarHBondContact O-N 2.78Å; H339-T348 PolarHBondContact O-OG1 3.22Å; H339-T348 VanDerWaalsContact O-OG1 3.1Å; H339-L350 HydrophobicContact CB-CD1 4.08Å; H339-L350 HydrophobicContact CB-CD2 3.86Å; H339-L350 HydrophobicContact CB-CG 4.08Å
340	M	97.2	Very high	96	Very high	12 Å²	12	63.1 Å²	63.1	6%	0.059	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.5	176.6	-179.1	175	-72.5	0	0	110	I304 I326 P342 E346 L347 I365	I304-M340 HydrophobicContact CD1-CE 4.01Å; I326-M340 HydrophobicContact CD1-CB 4.03Å; I326-M340 HydrophobicContact CG1-CB 3.99Å; I326-M340 HydrophobicContact CG1-CE 4Å; I326-M340 HydrophobicContact CG1-SD 4.32Å; M340-P342 WeakPolarHBondContact O-CD 3.13Å; M340-E346 CarbonylContact C-O 3.51Å; M340-E346 WeakPolarHBondContact CA-O 3.49Å; M340-L347 HydrophobicContact CB-CD1 4.38Å; M340-L347 HydrophobicContact CE-CD1 4.22Å; M340-I365 HydrophobicContact CE-CB 4.5Å; M340-I365 HydrophobicContact CE-CD1 3.75Å; M340-I365 HydrophobicContact CE-CG1 3.82Å; M340-I365 HydrophobicContact CE-CG2 3.9Å; M340-I365 HydrophobicContact SD-CG2 3.73Å
341	H	96.8	Very high	96	Very high	83 Å²	83	62.8 Å²	62.8	38%	0.384	31%	0.307	S	S	.	.			trans	-69.7	121.6	177.8	-171.5	4.6	0	0	0	110.4	R343 T344 A345 E346	H341-R343 PolarHBondContact O-N 2.77Å; H341-T344 WeakPolarHBondContact CB-OG1 3.4Å; H341-T344 PolarHBondContact CD2-OG1 3.41Å; H341-T344 PolarHBondContact O-N 3.34Å; H341-A345 PolarHBondContact O-N 3.32Å; H341-E346 HydrophobicContact CB-CB 4.18Å; H341-E346 PolarHBondContact N-O 3.06Å
342	P	96.4	Very high	95.9	Very high	57 Å²	57	63 Å²	63	37%	0.37	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.8	-170.2	19.2	-36	0	0	0	116.8	L323 Y324 M340	L323-P342 CarbonylContact C-O 3.56Å; L323-P342 VanDerWaalsContact CA-O 3.24Å; L323-P342 WeakPolarHBondContact CA-O 3.31Å; L323-P342 HydrophobicContact CD2-CB 4.24Å; Y324-P342 PolarHBondContact N-O 2.86Å; Y324-P342 WeakPolarHBondContact O-CA 3.41Å; M340-P342 WeakPolarHBondContact O-CD 3.13Å
343	R	95	Very high	95.9	Very high	156 Å²	156	54.7 Å²	54.7	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-24.9	-179.3	-69.1	-169.2	-177.9	-84.1	-0.3	114.3	L323 H341 D370	L323-R343 HydrophobicContact CD2-CG 4.25Å; H341-R343 PolarHBondContact O-N 2.77Å; R343-D370 IonicContact CZ-OD2 3.66Å; R343-D370 IonicContact NH1-OD2 3.16Å; R343-D370 PolarHBondContact NH1-OD2 3.48Å; R343-D370 VanDerWaalsContact NH1-OD2 3.12Å; R343-D370 IonicContact NH2-OD2 3.9Å
344	T	95.3	Very high	95.7	Very high	76 Å²	76	53.3 Å²	53.3	47%	0.466	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-10.4	-176.7	61.6	0	0	0	0	113	H341 E346	H341-T344 WeakPolarHBondContact CB-OG1 3.4Å; H341-T344 PolarHBondContact CD2-OG1 3.41Å; H341-T344 PolarHBondContact O-N 3.34Å; T344-E346 PolarHBondContact O-N 3.18Å; T344-E346 VanDerWaalsContact O-N 3.15Å; T344-E346 WeakPolarHBondContact OG1-CB 3.37Å; T344-E346 PolarHBondContact OG1-N 3.06Å
345	A	95.6	Very high	95.4	Very high	5 Å²	5	54 Å²	54	4%	0.041	27%	0.265	C	S	.	.			trans	58.2	14.5	-169.8	0	0	0	0	0	114.4	I304 Y324 H341 L347	I304-A345 HydrophobicContact CB-CB 3.86Å; I304-A345 HydrophobicContact CG2-CB 3.54Å; Y324-A345 HydrophobicContact CD1-CB 3.75Å; Y324-A345 HydrophobicContact CD2-CB 3.75Å; Y324-A345 HydrophobicContact CE1-CB 4.03Å; Y324-A345 HydrophobicContact CE2-CB 4.04Å; Y324-A345 HydrophobicContact CG-CB 3.59Å; H341-A345 PolarHBondContact O-N 3.32Å; A345-L347 PolarHBondContact O-N 3.01Å
346	E	95.9	Very high	94.8	Very high	90 Å²	90	53.6 Å²	53.6	42%	0.421	26%	0.259	S	S	.	.			trans	-65.3	125.2	177.1	-171.8	178.2	106.4	0	0	109.8	P297 M340 H341 T344	P297-E346 HydrophobicContact CB-CG 3.41Å; P297-E346 VanDerWaalsContact CB-CG 3.41Å; P297-E346 HydrophobicContact CG-CG 4.31Å; M340-E346 CarbonylContact C-O 3.51Å; M340-E346 WeakPolarHBondContact CA-O 3.49Å; H341-E346 HydrophobicContact CB-CB 4.18Å; H341-E346 PolarHBondContact N-O 3.06Å; T344-E346 PolarHBondContact O-N 3.18Å; T344-E346 VanDerWaalsContact O-N 3.15Å; T344-E346 WeakPolarHBondContact OG1-CB 3.37Å; T344-E346 PolarHBondContact OG1-N 3.06Å
347	L	96.9	Very high	94.4	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.3	179	-171.6	71.8	0	0	0	109.3	I298 V300 I326 F338 M340 A345 L381 I383	I298-L347 HydrophobicContact CB-CB 4.32Å; I298-L347 HydrophobicContact CB-CD2 4.2Å; I298-L347 HydrophobicContact CB-CG 4.38Å; I298-L347 WeakPolarHBondContact CB-O 3.3Å; I298-L347 HydrophobicContact CD1-CD2 3.98Å; I298-L347 HydrophobicContact CD1-CG 3.94Å; I298-L347 HydrophobicContact CG2-CD2 4.1Å; I298-L347 PolarHBondContact N-O 3.31Å; V300-L347 HydrophobicContact CG2-CB 4.35Å; V300-L347 HydrophobicContact CG2-CD2 4.11Å; I326-L347 HydrophobicContact CD1-CD1 4.23Å; F338-L347 HydrophobicContact CB-CD1 4.13Å; F338-L347 HydrophobicContact CD1-CD2 4.5Å; M340-L347 HydrophobicContact CB-CD1 4.38Å; M340-L347 HydrophobicContact CE-CD1 4.22Å; A345-L347 PolarHBondContact O-N 3.01Å; L347-L381 HydrophobicContact CD2-CD2 3.75Å; L347-I383 HydrophobicContact CD2-CD1 3.94Å
348	T	96.6	Very high	94.2	Very high	27 Å²	27	55.2 Å²	55.2	17%	0.166	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136	179.6	55.9	0	0	0	0	111	N296 F338 H339	N296-T348 WeakPolarHBondContact OD1-CA 3.35Å; F338-T348 WeakPolarHBondContact CA-O 3.27Å; H339-T348 PolarHBondContact N-O 2.87Å; H339-T348 PolarHBondContact O-N 2.78Å; H339-T348 PolarHBondContact O-OG1 3.22Å; H339-T348 VanDerWaalsContact O-OG1 3.1Å
349	L	97	Very high	93.9	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	135.5	167.3	-164.9	68.4	0	0	0	110.3	I286 P292 L295 N296 I298 F337 F338 E351 V353	I286-L349 HydrophobicContact CD1-CD1 4.5Å; P292-L349 WeakPolarHBondContact CB-O 3.38Å; L295-L349 HydrophobicContact CD1-CD2 3.79Å; N296-L349 PolarHBondContact ND2-O 3.46Å; N296-L349 PolarHBondContact OD1-N 3.3Å; I298-L349 HydrophobicContact CD1-CB 3.98Å; I298-L349 HydrophobicContact CD1-CD1 4.5Å; I298-L349 HydrophobicContact CG1-CB 4.39Å; F337-L349 CarbonylContact O-C 3.52Å; F337-L349 VanDerWaalsContact O-CA 3.3Å; F337-L349 WeakPolarHBondContact O-CA 3.09Å; F338-L349 HydrophobicContact CD1-CD1 4.17Å; F338-L349 HydrophobicContact CE1-CD1 3.67Å; F338-L349 HydrophobicContact CZ-CD1 4.28Å; L349-E351 WeakPolarHBondContact CD1-O 3.33Å; L349-E351 WeakPolarHBondContact CG-O 3.39Å; L349-V353 HydrophobicContact CD1-CG2 3.95Å
350	L	96.2	Very high	93.8	Very high	84 Å²	84	61.8 Å²	61.8	44%	0.44	30%	0.299	S	S	.	.			trans	-103.2	-36.3	-179.8	-64.1	179.8	0	0	0	112.5	P292 R336 F337 H339	P292-L350 WeakPolarHBondContact CG-O 3.32Å; R336-L350 WeakPolarHBondContact O-CB 3.12Å; F337-L350 PolarHBondContact O-N 2.97Å; H339-L350 HydrophobicContact CB-CD1 4.08Å; H339-L350 HydrophobicContact CB-CD2 3.86Å; H339-L350 HydrophobicContact CB-CG 4.08Å
351	E	93.6	Very high	93.9	Very high	77 Å²	77	61.2 Å²	61.2	36%	0.36	30%	0.297	S	S	.	.	S	Bend	trans	-139	147.8	179.1	-68.8	-177.2	-170.6	0	0	108.8	R336 F337 L349	R336-E351 IonicContact CZ-OE2 3.63Å; R336-E351 VanDerWaalsContact CZ-OE2 3.27Å; R336-E351 IonicContact NE-OE1 3.72Å; R336-E351 IonicContact NE-OE2 2.82Å; R336-E351 PolarHBondContact NE-OE2 2.91Å; R336-E351 IonicContact NH2-OE2 3.2Å; R336-E351 PolarHBondContact NH2-OE2 3.46Å; F337-E351 HydrophobicContact CD1-CB 4.29Å; L349-E351 WeakPolarHBondContact CD1-O 3.33Å; L349-E351 WeakPolarHBondContact CG-O 3.39Å
352	P	94.5	Very high	93.9	Very high	57 Å²	57	60 Å²	60	37%	0.37	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-54.7	139.9	169.7	-22	32.3	0	0	0	111	R290	R290-P352 WeakPolarHBondContact O-CA 3.42Å; R290-P352 WeakPolarHBondContact O-CB 3.44Å
353	V	93.3	Very high	93.9	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.012	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-99.3	131.6	176.3	-175.9	0	0	0	0	107.9	E288 L289 F337 L349 H358 F361 I385	E288-V353 CarbonylContact C-O 3.57Å; E288-V353 VanDerWaalsContact CA-O 3.3Å; E288-V353 WeakPolarHBondContact CA-O 2.93Å; E288-V353 WeakPolarHBondContact CB-O 3.42Å; L289-V353 PolarHBondContact N-O 2.86Å; F337-V353 HydrophobicContact CB-CG2 4.25Å; F337-V353 HydrophobicContact CD1-CG2 3.62Å; F337-V353 HydrophobicContact CE1-CG2 4.17Å; F337-V353 HydrophobicContact CG-CG2 4.04Å; L349-V353 HydrophobicContact CD1-CG2 3.95Å; V353-H358 HydrophobicContact CG1-CB 3.69Å; V353-F361 HydrophobicContact CG1-CE2 3.98Å; V353-F361 HydrophobicContact CG1-CZ 4.34Å; V353-F361 HydrophobicContact CG2-CE2 4.36Å; V353-I385 HydrophobicContact CB-CD1 4.28Å; V353-I385 HydrophobicContact CB-CG2 4.5Å; V353-I385 HydrophobicContact CG1-CD1 4.04Å; V353-I385 HydrophobicContact CG1-CG1 3.95Å; V353-I385 HydrophobicContact CG1-CG2 4.13Å; V353-I385 HydrophobicContact CG2-CD1 4.37Å
354	N	90.7	Very high	94.1	Very high	33 Å²	33	52 Å²	52	18%	0.176	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-97.8	129.5	168.3	163.4	-63.8	0	0	0	107.8	L289 D356 F357 H358	L289-N354 HydrophobicContact CD2-CB 3.82Å; N354-D356 VanDerWaalsContact C-N 3.33Å; N354-D356 PolarHBondContact ND2-OD2 3.42Å; N354-D356 PolarHBondContact O-N 2.89Å; N354-D356 WeakPolarHBondContact OD1-CA 3.3Å; N354-D356 WeakPolarHBondContact OD1-CB 3.48Å; N354-D356 PolarHBondContact OD1-N 2.76Å; N354-D356 PolarHBondContact OD1-OD2 2.84Å; N354-F357 HydrophobicContact CB-CD2 4Å; N354-F357 PolarHBondContact O-N 3.47Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.32Å; N354-F357 PolarHBondContact OD1-N 2.93Å; N354-H358 PolarHBondContact O-N 3.29Å; N354-H358 VanDerWaalsContact O-N 3.09Å
355	R	89.3	Confident	94.1	Very high	47 Å²	47	48.4 Å²	48.4	18%	0.177	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-29.6	-173.2	-173.4	178	165.3	-95.6	-0.1	112.7	E288 F357 H358 Q359 I385 D387 D432	E288-R355 HydrophobicContact CB-CB 4.05Å; E288-R355 HydrophobicContact CG-CB 4.38Å; E288-R355 VanDerWaalsContact OE2-CB 3.27Å; E288-R355 WeakPolarHBondContact OE2-CB 3.25Å; E288-R355 PolarHBondContact OE2-N 2.81Å; R355-F357 PolarHBondContact O-N 2.85Å; R355-F357 VanDerWaalsContact O-N 3.17Å; R355-H358 CarbonylContact O-C 2.97Å; R355-H358 PolarHBondContact O-N 2.75Å; R355-Q359 HydrophobicContact CG-CG 4.35Å; R355-Q359 WeakPolarHBondContact O-CG 3.22Å; R355-Q359 PolarHBondContact O-N 3.36Å; R355-I385 HydrophobicContact CB-CG2 3.92Å; R355-I385 WeakPolarHBondContact CD-O 3.21Å; R355-I385 HydrophobicContact CG-CB 4.44Å; R355-I385 HydrophobicContact CG-CG2 4.19Å; R355-D387 VanDerWaalsContact CD-CA 3.43Å; R355-D387 VanDerWaalsContact CD-CB 3.49Å; R355-D387 WeakPolarHBondContact CD-OD1 3.38Å; R355-D387 IonicContact CZ-OD1 3.73Å; R355-D387 IonicContact NE-OD1 3.67Å; R355-D387 VanDerWaalsContact NH1-CG 3.34Å; R355-D387 IonicContact NH1-OD1 3.71Å; R355-D387 PolarHBondContact NH1-OD1 2.85Å; R355-D432 PolarHBondContact NH1-O 2.03Å
356	D	84.2	Confident	94.2	Very high	62 Å²	62	49.8 Å²	49.8	33%	0.332	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-34.4	176.4	-53.6	-58.1	0	0	0	111.9	N354	N354-D356 VanDerWaalsContact C-N 3.33Å; N354-D356 PolarHBondContact ND2-OD2 3.42Å; N354-D356 PolarHBondContact O-N 2.89Å; N354-D356 WeakPolarHBondContact OD1-CA 3.3Å; N354-D356 WeakPolarHBondContact OD1-CB 3.48Å; N354-D356 PolarHBondContact OD1-N 2.76Å; N354-D356 PolarHBondContact OD1-OD2 2.84Å
357	F	88.8	Confident	94.3	Very high	161 Å²	161	45.5 Å²	45.5	71%	0.706	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-34.2	178	-57.1	-66.7	0	0	0	112.9	N354 R355	N354-F357 HydrophobicContact CB-CD2 4Å; N354-F357 PolarHBondContact O-N 3.47Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.32Å; N354-F357 PolarHBondContact OD1-N 2.93Å; R355-F357 PolarHBondContact O-N 2.85Å; R355-F357 VanDerWaalsContact O-N 3.17Å
358	H	91.6	Very high	94.3	Very high	25 Å²	25	47.6 Å²	47.6	12%	0.116	23%	0.233	C	C	.	.			trans	-137.6	92	-172.3	-60.9	93.7	0	0	0	111	D333 F337 V353 N354 R355 F361 I385	D333-H358 IonicContact OD1-CD2 3.17Å; D333-H358 IonicContact OD1-NE2 2.8Å; D333-H358 PolarHBondContact OD1-NE2 2.7Å; D333-H358 IonicContact OD2-CD2 3.64Å; D333-H358 IonicContact OD2-CE1 3.08Å; D333-H358 PolarHBondContact OD2-CE1 2.83Å; D333-H358 IonicContact OD2-NE2 2.99Å; D333-H358 PolarHBondContact OD2-NE2 3.09Å; F337-H358 AromaticContact CE2-CE1 3.57Å; F337-H358 AromaticContact CE2-ND1 3.96Å; F337-H358 AromaticContact CE2-NE2 3.63Å; F337-H358 AromaticContact CZ-CE1 3.55Å; F337-H358 AromaticContact CZ-ND1 3.75Å; V353-H358 HydrophobicContact CG1-CB 3.69Å; N354-H358 PolarHBondContact O-N 3.29Å; N354-H358 VanDerWaalsContact O-N 3.09Å; R355-H358 CarbonylContact O-C 2.97Å; R355-H358 PolarHBondContact O-N 2.75Å; H358-F361 HydrophobicContact CB-CE2 3.82Å; H358-F361 HydrophobicContact CB-CZ 3.59Å; H358-F361 AromaticContact CD2-CE1 3.78Å; H358-F361 AromaticContact CD2-CZ 3.56Å; H358-F361 AromaticContact CG-CZ 3.7Å; H358-I385 WeakPolarHBondContact O-CB 3.08Å; H358-I385 WeakPolarHBondContact O-CG1 3.46Å
359	Q	91.4	Very high	94.3	Very high	129 Å²	129	46.6 Å²	46.6	60%	0.603	23%	0.227	S	C	*	.	S	Bend	trans	-74.7	-29.1	179.2	-64.1	167.9	16	0	0	113.1	R355 I385	R355-Q359 HydrophobicContact CG-CG 4.35Å; R355-Q359 WeakPolarHBondContact O-CG 3.22Å; R355-Q359 PolarHBondContact O-N 3.36Å; Q359-I385 WeakPolarHBondContact O-CB 3.23Å; Q359-I385 PolarHBondContact O-N 2.8Å
360	K	94.8	Very high	94.2	Very high	109 Å²	109	49.5 Å²	49.5	47%	0.474	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	161.5	-178.1	61.2	171.6	177.5	174.9	0	112.8	P331 D362 I383	P331-K360 VanDerWaalsContact CD-O 3.29Å; P331-K360 WeakPolarHBondContact CD-O 3.43Å; K360-D362 IonicContact NZ-OD2 3.62Å; K360-I383 CarbonylContact C-O 3.55Å; K360-I383 VanDerWaalsContact CA-O 3.24Å; K360-I383 WeakPolarHBondContact CA-O 3.38Å; K360-I383 WeakPolarHBondContact CB-O 3.21Å
361	F	97.4	Very high	94	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.9	169.8	-59.8	-96.6	0	0	0	111	F337 F338 V353 H358 L363 I383 I385	F337-F361 AromaticContact CD2-CE1 3.81Å; F337-F361 HydrophobicContact CD2-CE1 3.81Å; F337-F361 AromaticContact CD2-CZ 3.61Å; F337-F361 HydrophobicContact CD2-CZ 3.61Å; F337-F361 HydrophobicContact CE2-CE1 4.28Å; F337-F361 AromaticContact CE2-CZ 3.98Å; F337-F361 HydrophobicContact CE2-CZ 3.98Å; F337-F361 HydrophobicContact CG-CZ 4.17Å; F338-F361 HydrophobicContact CD2-CD1 4.45Å; F338-F361 HydrophobicContact CD2-CG 4.41Å; F338-F361 HydrophobicContact CE2-CB 4.12Å; F338-F361 AromaticContact CE2-CD1 3.83Å; F338-F361 HydrophobicContact CE2-CD1 3.83Å; F338-F361 AromaticContact CE2-CD2 3.44Å; F338-F361 HydrophobicContact CE2-CD2 3.44Å; F338-F361 VanDerWaalsContact CE2-CD2 3.44Å; F338-F361 HydrophobicContact CE2-CE1 4.05Å; F338-F361 AromaticContact CE2-CE2 3.67Å; F338-F361 HydrophobicContact CE2-CE2 3.67Å; F338-F361 AromaticContact CE2-CG 3.52Å; F338-F361 HydrophobicContact CE2-CG 3.52Å; F338-F361 AromaticContact CE2-CZ 3.96Å; F338-F361 HydrophobicContact CE2-CZ 3.96Å; F338-F361 AromaticContact CZ-CD2 3.78Å; F338-F361 HydrophobicContact CZ-CD2 3.78Å; F338-F361 AromaticContact CZ-CE2 3.97Å; F338-F361 HydrophobicContact CZ-CE2 3.97Å; F338-F361 HydrophobicContact CZ-CG 4.27Å; V353-F361 HydrophobicContact CG1-CE2 3.98Å; V353-F361 HydrophobicContact CG1-CZ 4.34Å; V353-F361 HydrophobicContact CG2-CE2 4.36Å; H358-F361 HydrophobicContact CB-CE2 3.82Å; H358-F361 HydrophobicContact CB-CZ 3.59Å; H358-F361 AromaticContact CD2-CE1 3.78Å; H358-F361 AromaticContact CD2-CZ 3.56Å; H358-F361 AromaticContact CG-CZ 3.7Å; F361-L363 HydrophobicContact CB-CD2 4.25Å; F361-L363 HydrophobicContact CB-CG 4.48Å; F361-I383 HydrophobicContact CB-CB 4.2Å; F361-I383 HydrophobicContact CB-CD1 4.41Å; F361-I383 PolarHBondContact N-O 3.23Å; F361-I383 PolarHBondContact O-N 2.86Å; F361-I385 HydrophobicContact CD2-CD1 4.16Å; F361-I385 HydrophobicContact CD2-CG1 4.26Å; F361-I385 HydrophobicContact CE2-CD1 4.06Å; F361-I385 HydrophobicContact CE2-CG1 4.09Å
362	D	97.6	Very high	93.8	Very high	58 Å²	58	47.9 Å²	47.9	31%	0.31	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	108.2	175.3	-74.5	-59.4	0	0	0	108.7	G329 T330 K360 H382	G329-D362 CarbonylContact C-O 3.41Å; G329-D362 VanDerWaalsContact CA-O 3.23Å; G329-D362 WeakPolarHBondContact CA-O 3.29Å; T330-D362 PolarHBondContact N-O 2.77Å; T330-D362 PolarHBondContact O-N 2.78Å; K360-D362 IonicContact NZ-OD2 3.62Å; D362-H382 IonicContact OD1-CE1 3.6Å; D362-H382 IonicContact OD1-CG 2.75Å; D362-H382 IonicContact OD1-ND1 2.81Å; D362-H382 PolarHBondContact OD1-ND1 3.17Å
363	L	97.4	Very high	93.6	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	155.2	-174.3	-49.1	-174.9	0	0	0	111.6	I326 Y334 F361 S380 L381 I383	I326-L363 HydrophobicContact CD1-CD1 4.16Å; I326-L363 HydrophobicContact CG2-CB 4.16Å; I326-L363 HydrophobicContact CG2-CD1 4.37Å; Y334-L363 HydrophobicContact CD1-CD2 4.05Å; Y334-L363 HydrophobicContact CD2-CD1 4.46Å; Y334-L363 HydrophobicContact CD2-CD2 3.91Å; Y334-L363 HydrophobicContact CG-CD2 3.57Å; F361-L363 HydrophobicContact CB-CD2 4.25Å; F361-L363 HydrophobicContact CB-CG 4.48Å; L363-S380 CarbonylContact O-C 3.53Å; L363-S380 WeakPolarHBondContact O-CA 3.45Å; L363-L381 HydrophobicContact CB-CB 4.28Å; L363-L381 HydrophobicContact CD1-CD2 4.15Å; L363-L381 PolarHBondContact N-O 3.15Å; L363-L381 PolarHBondContact O-N 3.45Å; L363-I383 HydrophobicContact CD1-CD1 3.85Å; L363-I383 HydrophobicContact CG-CD1 4.47Å
364	V	97.4	Very high	93.5	Very high	42 Å²	42	53.7 Å²	53.7	26%	0.255	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.9	170.3	-178.8	0	0	0	0	109	L327 V328 F378 A379	L327-V364 HydrophobicContact CD2-CG1 4.35Å; L327-V364 PolarHBondContact N-O 2.86Å; V328-V364 HydrophobicContact CG2-CB 3.8Å; V328-V364 HydrophobicContact CG2-CG2 3.83Å; V328-V364 PolarHBondContact O-N 3.22Å; V364-F378 HydrophobicContact CG1-CB 4.35Å; V364-A379 CarbonylContact C-O 3.2Å; V364-A379 WeakPolarHBondContact CA-O 3.36Å
365	I	97	Very high	93.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.4	179	-50.8	171.8	0	0	0	108.9	F265 Y282 I304 S325 M340 F378 A379 L381	F265-I365 HydrophobicContact CE1-CG2 4.15Å; F265-I365 HydrophobicContact CZ-CB 4.2Å; F265-I365 HydrophobicContact CZ-CG2 3.87Å; Y282-I365 HydrophobicContact CD2-CD1 4.03Å; Y282-I365 HydrophobicContact CE2-CD1 4.46Å; I304-I365 HydrophobicContact CD1-CD1 3.55Å; I304-I365 HydrophobicContact CG1-CD1 4.04Å; I304-I365 HydrophobicContact CG2-CD1 4.25Å; S325-I365 WeakPolarHBondContact O-CA 3.27Å; M340-I365 HydrophobicContact CE-CB 4.5Å; M340-I365 HydrophobicContact CE-CD1 3.75Å; M340-I365 HydrophobicContact CE-CG1 3.82Å; M340-I365 HydrophobicContact CE-CG2 3.9Å; M340-I365 HydrophobicContact SD-CG2 3.73Å; I365-F378 VanDerWaalsContact O-CA 3.28Å; I365-F378 WeakPolarHBondContact O-CA 3.44Å; I365-A379 PolarHBondContact N-O 2.76Å; I365-A379 PolarHBondContact O-N 3.23Å; I365-L381 HydrophobicContact CD1-CB 3.69Å; I365-L381 HydrophobicContact CD1-CD2 3.98Å; I365-L381 HydrophobicContact CD1-CG 4.39Å; I365-L381 HydrophobicContact CG1-CB 4.04Å; I365-L381 HydrophobicContact CG1-CD2 4.47Å
366	K	97.3	Very high	94	Very high	35 Å²	35	55.8 Å²	55.8	15%	0.152	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.1	173	-177.6	-174	67.3	154	0	110.1	Y324 S325 L327 E368 P376 A377 F378	Y324-K366 CarbonylContact C-O 3.57Å; Y324-K366 WeakPolarHBondContact CA-O 3.46Å; S325-K366 PolarHBondContact N-O 3.32Å; S325-K366 PolarHBondContact O-N 3.28Å; S325-K366 WeakPolarHBondContact OG-CE 3.38Å; L327-K366 HydrophobicContact CB-CB 4.28Å; L327-K366 HydrophobicContact CD1-CD 4.49Å; K366-E368 WeakPolarHBondContact CE-OE2 3.23Å; K366-E368 IonicContact NZ-OE1 3.49Å; K366-E368 PolarHBondContact NZ-OE1 2.82Å; K366-E368 IonicContact NZ-OE2 3.52Å; K366-E368 PolarHBondContact NZ-OE2 2.89Å; K366-P376 HydrophobicContact CD-CB 3.96Å; K366-P376 HydrophobicContact CG-CB 3.85Å; K366-A377 WeakPolarHBondContact CA-O 3.46Å; K366-F378 HydrophobicContact CB-CD1 4.09Å; K366-F378 HydrophobicContact CB-CE1 4.12Å; K366-F378 HydrophobicContact CD-CE1 4.02Å; K366-F378 HydrophobicContact CG-CD1 4.11Å; K366-F378 HydrophobicContact CG-CE1 3.73Å
367	A	97.3	Very high	94.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.4	168	0	0	0	0	0	109.4	P263 F265 A306 I322 L323 Y324 P376 A377	P263-A367 HydrophobicContact CB-CB 4.26Å; F265-A367 HydrophobicContact CE1-CB 3.98Å; F265-A367 HydrophobicContact CE2-CB 4Å; F265-A367 HydrophobicContact CZ-CB 3.55Å; A306-A367 HydrophobicContact CB-CB 3.85Å; I322-A367 HydrophobicContact CG2-CB 3.94Å; L323-A367 CarbonylContact O-C 3.46Å; L323-A367 WeakPolarHBondContact O-CA 3.31Å; Y324-A367 HydrophobicContact CD1-CB 3.92Å; Y324-A367 HydrophobicContact CE1-CB 3.85Å; A367-P376 CarbonylContact O-C 3.6Å; A367-P376 VanDerWaalsContact O-CA 3.32Å; A367-P376 WeakPolarHBondContact O-CA 3.24Å; A367-A377 PolarHBondContact N-O 3.45Å; A367-A377 PolarHBondContact O-N 2.88Å
368	E	96.8	Very high	94.9	Very high	46 Å²	46	51.4 Å²	51.4	22%	0.215	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.7	-177.7	72.1	-172.8	164.8	0	0	112.5	I322 L323 K366 P374 P376	I322-E368 CarbonylContact C-O 3.55Å; I322-E368 WeakPolarHBondContact CA-O 3.4Å; L323-E368 HydrophobicContact CB-CG 4.26Å; L323-E368 PolarHBondContact N-O 3.39Å; L323-E368 PolarHBondContact O-N 3.45Å; K366-E368 WeakPolarHBondContact CE-OE2 3.23Å; K366-E368 IonicContact NZ-OE1 3.49Å; K366-E368 PolarHBondContact NZ-OE1 2.82Å; K366-E368 IonicContact NZ-OE2 3.52Å; K366-E368 PolarHBondContact NZ-OE2 2.89Å; E368-P374 CarbonylContact C-O 3.56Å; E368-P374 VanDerWaalsContact CA-O 3.29Å; E368-P374 WeakPolarHBondContact CA-O 3.33Å; E368-P374 HydrophobicContact CB-CB 3.84Å; E368-P374 WeakPolarHBondContact CB-O 3.42Å; E368-P374 HydrophobicContact CG-CB 4.24Å; E368-P376 HydrophobicContact CB-CB 4.19Å
369	Q	96.9	Very high	95.2	Very high	6 Å²	6	50.5 Å²	50.5	3%	0.028	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	144.7	177.9	-69	163.6	-52.3	0	0	112	D259 L261 P263 D308 P320 G321 H373 P374	D259-Q369 PolarHBondContact OD1-NE2 3.13Å; D259-Q369 PolarHBondContact OD1-OE1 3.18Å; L261-Q369 PolarHBondContact O-NE2 3.33Å; L261-Q369 VanDerWaalsContact O-NE2 3.14Å; P263-Q369 HydrophobicContact CG-CG 4Å; D308-Q369 PolarHBondContact OD1-NE2 2.99Å; D308-Q369 PolarHBondContact OD2-NE2 3.11Å; P320-Q369 HydrophobicContact CB-CB 3.74Å; P320-Q369 HydrophobicContact CB-CG 3.94Å; P320-Q369 HydrophobicContact CG-CB 3.91Å; P320-Q369 HydrophobicContact CG-CG 3.54Å; G321-Q369 CarbonylContact O-C 3.2Å; G321-Q369 WeakPolarHBondContact O-CA 3.35Å; Q369-H373 PolarHBondContact OE1-O 3.36Å; Q369-P374 PolarHBondContact N-O 3.05Å
370	D	94.7	Very high	95.4	Very high	64 Å²	64	46.9 Å²	46.9	34%	0.342	26%	0.263	S	S	.	.	S	Bend	trans	-94.9	11.4	-175.8	76.7	-3.7	0	0	0	115.6	G321 L323 R343	G321-D370 WeakPolarHBondContact CA-OD1 3.32Å; G321-D370 PolarHBondContact N-OD1 3.35Å; G321-D370 PolarHBondContact O-N 3.1Å; L323-D370 HydrophobicContact CD1-CB 3.63Å; L323-D370 HydrophobicContact CG-CB 3.86Å; R343-D370 IonicContact CZ-OD2 3.66Å; R343-D370 IonicContact NH1-OD2 3.16Å; R343-D370 PolarHBondContact NH1-OD2 3.48Å; R343-D370 VanDerWaalsContact NH1-OD2 3.12Å; R343-D370 IonicContact NH2-OD2 3.9Å
371	N	91.8	Very high	95.6	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.332	24%	0.241	S	C	.	.	S	Bend	trans	-94.8	2.5	-176.5	65.8	1.8	0	0	0	114.8	D259 P320 H373	D259-N371 PolarHBondContact OD2-ND2 2.83Å; P320-N371 HydrophobicContact CB-CB 4.03Å; N371-H373 PolarHBondContact OD1-N 2.91Å; N371-H373 PolarHBondContact OD1-O 2.83Å
372	G	89.1	Confident	95.6	Very high	65 Å²	65	43.8 Å²	43.8	67%	0.67	25%	0.25	S	C	*	.	S	Bend	trans	95.2	-4.3	-177.9	0	0	0	0	0	114.9	P374	G372-P374 WeakPolarHBondContact O-CD 3.42Å
373	H	91.7	Very high	95.5	Very high	125 Å²	125	41 Å²	41	58%	0.579	24%	0.235	S	C	*	.			trans	-115.9	81	170.5	-66.5	-81.1	0	0	0	108.2	Q369 N371 L375	Q369-H373 PolarHBondContact OE1-O 3.36Å; N371-H373 PolarHBondContact OD1-N 2.91Å; N371-H373 PolarHBondContact OD1-O 2.83Å; H373-L375 PolarHBondContact O-N 2.91Å
374	P	91.2	Very high	95.4	Very high	55 Å²	55	45.8 Å²	45.8	36%	0.357	26%	0.257	S	S	.	.			trans	-68.1	-31.4	-160.5	23.1	-33.8	0	0	0	115.5	E368 Q369 G372	E368-P374 CarbonylContact C-O 3.56Å; E368-P374 VanDerWaalsContact CA-O 3.29Å; E368-P374 WeakPolarHBondContact CA-O 3.33Å; E368-P374 HydrophobicContact CB-CB 3.84Å; E368-P374 WeakPolarHBondContact CB-O 3.42Å; E368-P374 HydrophobicContact CG-CB 4.24Å; Q369-P374 PolarHBondContact N-O 3.05Å; G372-P374 WeakPolarHBondContact O-CD 3.42Å
375	L	93.9	Very high	95.2	Very high	67 Å²	67	43.9 Å²	43.9	35%	0.351	25%	0.246	S	C	.	.			trans	35.1	64.3	-178	-58.8	175.7	0	0	0	113.2	D260 G262 P263 H373	D260-L375 WeakPolarHBondContact O-CD1 3.29Å; G262-L375 VanDerWaalsContact CA-O 3.27Å; G262-L375 WeakPolarHBondContact CA-O 3.48Å; P263-L375 WeakPolarHBondContact CD-O 3.43Å; H373-L375 PolarHBondContact O-N 2.91Å
376	P	95.5	Very high	94.9	Very high	58 Å²	58	47.3 Å²	47.3	38%	0.377	26%	0.264	S	S	.	.			trans	-71.5	146.5	-164.5	29.5	-36.4	0	0	0	113.6	K366 A367 E368 F378	K366-P376 HydrophobicContact CD-CB 3.96Å; K366-P376 HydrophobicContact CG-CB 3.85Å; A367-P376 CarbonylContact O-C 3.6Å; A367-P376 VanDerWaalsContact O-CA 3.32Å; A367-P376 WeakPolarHBondContact O-CA 3.24Å; E368-P376 HydrophobicContact CB-CB 4.19Å; P376-F378 HydrophobicContact CB-CE1 4.3Å; P376-F378 HydrophobicContact CB-CZ 3.97Å; P376-F378 HydrophobicContact CG-CE2 4.45Å; P376-F378 HydrophobicContact CG-CZ 3.92Å
377	A	96	Very high	94.3	Very high	18 Å²	18	48 Å²	48	15%	0.149	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	156.9	164.4	0	0	0	0	0	111.6	P263 F265 K366 A367	P263-A377 WeakPolarHBondContact O-CB 3.43Å; F265-A377 HydrophobicContact CD2-CB 4.13Å; F265-A377 HydrophobicContact CE2-CB 4.21Å; F265-A377 WeakPolarHBondContact CE2-O 3.41Å; K366-A377 WeakPolarHBondContact CA-O 3.46Å; A367-A377 PolarHBondContact N-O 3.45Å; A367-A377 PolarHBondContact O-N 2.88Å
378	F	96.6	Very high	93.5	Very high	113 Å²	113	50.9 Å²	50.9	50%	0.496	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.1	-175.7	-50.8	-74.6	0	0	0	112.2	F265 L327 V364 I365 K366 P376	F265-F378 VanDerWaalsContact CE2-C 3.42Å; L327-F378 HydrophobicContact CD2-CD1 3.94Å; L327-F378 HydrophobicContact CD2-CE1 3.72Å; V364-F378 HydrophobicContact CG1-CB 4.35Å; I365-F378 VanDerWaalsContact O-CA 3.28Å; I365-F378 WeakPolarHBondContact O-CA 3.44Å; K366-F378 HydrophobicContact CB-CD1 4.09Å; K366-F378 HydrophobicContact CB-CE1 4.12Å; K366-F378 HydrophobicContact CD-CE1 4.02Å; K366-F378 HydrophobicContact CG-CD1 4.11Å; K366-F378 HydrophobicContact CG-CE1 3.73Å; P376-F378 HydrophobicContact CB-CE1 4.3Å; P376-F378 HydrophobicContact CB-CZ 3.97Å; P376-F378 HydrophobicContact CG-CE2 4.45Å; P376-F378 HydrophobicContact CG-CZ 3.92Å
379	A	96.8	Very high	92.9	Very high	5 Å²	5	51.7 Å²	51.7	4%	0.041	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	153	171.5	0	0	0	0	0	110.3	F265 Y282 V364 I365	F265-A379 HydrophobicContact CB-CB 4.43Å; F265-A379 HydrophobicContact CD1-CB 4.2Å; F265-A379 HydrophobicContact CD2-CB 3.55Å; F265-A379 HydrophobicContact CE1-CB 4.32Å; F265-A379 HydrophobicContact CE2-CB 3.7Å; F265-A379 HydrophobicContact CG-CB 3.81Å; F265-A379 HydrophobicContact CZ-CB 4.09Å; Y282-A379 HydrophobicContact CD2-CB 4Å; Y282-A379 HydrophobicContact CE2-CB 3.66Å; V364-A379 CarbonylContact C-O 3.2Å; V364-A379 WeakPolarHBondContact CA-O 3.36Å; I365-A379 PolarHBondContact N-O 2.76Å; I365-A379 PolarHBondContact O-N 3.23Å
380	S	97	Very high	92.1	Very high	54 Å²	54	53.3 Å²	53.3	38%	0.378	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	147	176.2	-65.5	0	0	0	0	110.3	L280 T281 Y282 L363	L280-S380 PolarHBondContact O-N 3.5Å; T281-S380 CarbonylContact C-O 3.58Å; T281-S380 WeakPolarHBondContact CA-O 3.2Å; Y282-S380 PolarHBondContact N-O 2.8Å; L363-S380 CarbonylContact O-C 3.53Å; L363-S380 WeakPolarHBondContact O-CA 3.45Å
381	L	97.5	Very high	91.6	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	116.1	173.1	166.6	65.1	0	0	0	108.8	Y282 A284 V300 L347 L363 I365 I383	Y282-L381 WeakPolarHBondContact O-CA 2.99Å; A284-L381 HydrophobicContact CB-CD1 4.5Å; V300-L381 HydrophobicContact CG1-CD1 3.7Å; V300-L381 HydrophobicContact CG2-CD1 4.32Å; L347-L381 HydrophobicContact CD2-CD2 3.75Å; L363-L381 HydrophobicContact CB-CB 4.28Å; L363-L381 HydrophobicContact CD1-CD2 4.15Å; L363-L381 PolarHBondContact N-O 3.15Å; L363-L381 PolarHBondContact O-N 3.45Å; I365-L381 HydrophobicContact CD1-CB 3.69Å; I365-L381 HydrophobicContact CD1-CD2 3.98Å; I365-L381 HydrophobicContact CD1-CG 4.39Å; I365-L381 HydrophobicContact CG1-CB 4.04Å; I365-L381 HydrophobicContact CG1-CD2 4.47Å; L381-I383 HydrophobicContact CD1-CG1 4.3Å; L381-I383 HydrophobicContact CD2-CD1 4.2Å; L381-I383 HydrophobicContact CD2-CG1 4.31Å; L381-I383 HydrophobicContact CG-CD1 4.42Å; L381-I383 HydrophobicContact CG-CG1 4Å
382	H	97.5	Very high	91.5	Very high	41 Å²	41	52.5 Å²	52.5	19%	0.19	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.1	174.6	-176	78.2	0	0	0	109.3	T281 Y282 Q283 A284 D362	T281-H382 HydrophobicContact CG2-CB 4.49Å; Y282-H382 PolarHBondContact O-N 3.35Å; Q283-H382 CarbonylContact C-O 3.54Å; Q283-H382 WeakPolarHBondContact CA-O 3.33Å; Q283-H382 PolarHBondContact OE1-CD2 2.82Å; A284-H382 PolarHBondContact N-O 2.89Å; D362-H382 IonicContact OD1-CE1 3.6Å; D362-H382 IonicContact OD1-CG 2.75Å; D362-H382 IonicContact OD1-ND1 2.81Å; D362-H382 PolarHBondContact OD1-ND1 3.17Å
383	I	96.9	Very high	91.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	115.5	178.5	-47.8	179.3	0	0	0	107.8	A284 I286 F338 L347 K360 F361 L363 L381 I385	A284-I383 HydrophobicContact CB-CG1 4.37Å; A284-I383 HydrophobicContact CB-CG2 4.34Å; A284-I383 CarbonylContact O-C 3.54Å; A284-I383 WeakPolarHBondContact O-CA 3.36Å; I286-I383 HydrophobicContact CD1-CG2 3.66Å; I286-I383 HydrophobicContact CG1-CG2 4.12Å; F338-I383 HydrophobicContact CD1-CD1 4.06Å; F338-I383 HydrophobicContact CD2-CD1 4.22Å; F338-I383 HydrophobicContact CE1-CD1 3.83Å; F338-I383 HydrophobicContact CE1-CG2 4.45Å; F338-I383 HydrophobicContact CE2-CD1 4Å; F338-I383 HydrophobicContact CG-CD1 4.25Å; F338-I383 HydrophobicContact CZ-CD1 3.79Å; F338-I383 HydrophobicContact CZ-CG2 4.16Å; L347-I383 HydrophobicContact CD2-CD1 3.94Å; K360-I383 CarbonylContact C-O 3.55Å; K360-I383 VanDerWaalsContact CA-O 3.24Å; K360-I383 WeakPolarHBondContact CA-O 3.38Å; K360-I383 WeakPolarHBondContact CB-O 3.21Å; F361-I383 HydrophobicContact CB-CB 4.2Å; F361-I383 HydrophobicContact CB-CD1 4.41Å; F361-I383 PolarHBondContact N-O 3.23Å; F361-I383 PolarHBondContact O-N 2.86Å; L363-I383 HydrophobicContact CD1-CD1 3.85Å; L363-I383 HydrophobicContact CG-CD1 4.47Å; L381-I383 HydrophobicContact CD1-CG1 4.3Å; L381-I383 HydrophobicContact CD2-CD1 4.2Å; L381-I383 HydrophobicContact CD2-CG1 4.31Å; L381-I383 HydrophobicContact CG-CD1 4.42Å; L381-I383 HydrophobicContact CG-CG1 4Å; I383-I385 HydrophobicContact CG2-CD1 4.25Å
384	E	94.8	Very high	91.8	Very high	103 Å²	103	47.3 Å²	47.3	48%	0.481	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.1	174.8	-171.6	174.7	-166.9	0	0	109.9	A284 A285 I286 L386	A284-E384 PolarHBondContact O-N 3.38Å; A285-E384 CarbonylContact C-O 3.58Å; A285-E384 WeakPolarHBondContact CA-O 3.36Å; I286-E384 PolarHBondContact N-O 2.7Å; E384-L386 HydrophobicContact CG-CD2 4.33Å
385	I	93.9	Very high	91.9	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.3	174.1	-52.3	-56.9	0	0	0	107.8	I286 E288 V353 R355 H358 Q359 F361 I383	I286-I385 HydrophobicContact CB-CD1 4.02Å; I286-I385 HydrophobicContact CG2-CD1 4.37Å; I286-I385 CarbonylContact O-C 3.58Å; I286-I385 WeakPolarHBondContact O-CA 3.28Å; E288-I385 HydrophobicContact CB-CG2 3.84Å; V353-I385 HydrophobicContact CB-CD1 4.28Å; V353-I385 HydrophobicContact CB-CG2 4.5Å; V353-I385 HydrophobicContact CG1-CD1 4.04Å; V353-I385 HydrophobicContact CG1-CG1 3.95Å; V353-I385 HydrophobicContact CG1-CG2 4.13Å; V353-I385 HydrophobicContact CG2-CD1 4.37Å; R355-I385 HydrophobicContact CB-CG2 3.92Å; R355-I385 WeakPolarHBondContact CD-O 3.21Å; R355-I385 HydrophobicContact CG-CB 4.44Å; R355-I385 HydrophobicContact CG-CG2 4.19Å; H358-I385 WeakPolarHBondContact O-CB 3.08Å; H358-I385 WeakPolarHBondContact O-CG1 3.46Å; Q359-I385 WeakPolarHBondContact O-CB 3.23Å; Q359-I385 PolarHBondContact O-N 2.8Å; F361-I385 HydrophobicContact CD2-CD1 4.16Å; F361-I385 HydrophobicContact CD2-CG1 4.26Å; F361-I385 HydrophobicContact CE2-CD1 4.06Å; F361-I385 HydrophobicContact CE2-CG1 4.09Å; I383-I385 HydrophobicContact CG2-CD1 4.25Å
386	L	89.2	Confident	91.9	Very high	72 Å²	72	45.7 Å²	45.7	38%	0.377	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132	-179.1	-55.6	176.3	0	0	0	109.1	A285 I286 E288 E384	A285-L386 HydrophobicContact CB-CD1 4Å; A285-L386 HydrophobicContact CB-CD2 4.31Å; A285-L386 HydrophobicContact CB-CG 4.14Å; I286-L386 PolarHBondContact O-N 3.2Å; E288-L386 PolarHBondContact N-O 3.26Å; E384-L386 HydrophobicContact CG-CD2 4.33Å
387	D	85.1	Confident	91.8	Very high	50 Å²	50	47.8 Å²	47.8	27%	0.267	25%	0.248	S	C	.	.			trans	-68.1	137.7	177.4	-163.9	77.6	0	0	0	111	E288 R355 D432	E288-D387 WeakPolarHBondContact OE1-CA 3.46Å; R355-D387 VanDerWaalsContact CD-CA 3.43Å; R355-D387 VanDerWaalsContact CD-CB 3.49Å; R355-D387 WeakPolarHBondContact CD-OD1 3.38Å; R355-D387 IonicContact CZ-OD1 3.73Å; R355-D387 IonicContact NE-OD1 3.67Å; R355-D387 VanDerWaalsContact NH1-CG 3.34Å; R355-D387 IonicContact NH1-OD1 3.71Å; R355-D387 PolarHBondContact NH1-OD1 2.85Å; D387-D432 VanDerWaalsContact OD2-CA 3.24Å; D387-D432 WeakPolarHBondContact OD2-CA 3.4Å; D387-D432 WeakPolarHBondContact OD2-CB 3.36Å
388	E	81	Confident	91.6	Very high	61 Å²	61	52.2 Å²	52.2	29%	0.285	28%	0.275	S	S	.	.			trans	-115.2	132.1	165.3	-67	-160.5	158.7	0	0	107.8	P287 E288 R290 N390	P287-E388 HydrophobicContact CB-CG 4.36Å; E288-E388 HydrophobicContact CG-CB 4.07Å; E288-E388 HydrophobicContact CG-CG 4.23Å; E288-E388 PolarHBondContact OE1-N 2.69Å; R290-E388 IonicContact CZ-OE1 3.17Å; R290-E388 IonicContact NE-OE1 3.39Å; R290-E388 PolarHBondContact NE-OE1 3.16Å; R290-E388 IonicContact NE-OE2 3.9Å; R290-E388 IonicContact NH2-OE1 3.74Å; R290-E388 PolarHBondContact NH2-OE1 2.84Å; E388-N390 WeakPolarHBondContact O-CB 3.45Å; E388-N390 PolarHBondContact O-N 2.92Å; E388-N390 PolarHBondContact O-ND2 3.2Å
389	N	82.9	Confident	91.6	Very high	63 Å²	63	49.9 Å²	49.9	34%	0.337	27%	0.273	S	S	.	.	S	Bend	trans	-59.2	98.8	178.5	174	-22.4	0	0	0	110.2	D432 D485 Q488	N389-D432 WeakPolarHBondContact CA-OD2 3.41Å; N389-D432 PolarHBondContact OD1-OD2 2.8Å; N389-D485 VanDerWaalsContact ND2-CG 3.29Å; N389-D485 PolarHBondContact ND2-OD1 2.77Å; N389-Q488 PolarHBondContact OD1-NE2 2.74Å; N389-Q488 VanDerWaalsContact OD1-NE2 3.13Å
390	N	81.2	Confident	91.5	Very high	40 Å²	40	50.1 Å²	50.1	21%	0.214	27%	0.272	C	S	.	.			trans	-138.5	-6.2	-172.2	76.4	65.4	0	0	0	112.6	E288 L289 E388 D432 Q488	E288-N390 PolarHBondContact OE1-ND2 3.46Å; E288-N390 PolarHBondContact OE2-ND2 3.3Å; L289-N390 HydrophobicContact CD1-CB 4.19Å; E388-N390 WeakPolarHBondContact O-CB 3.45Å; E388-N390 PolarHBondContact O-N 2.92Å; E388-N390 PolarHBondContact O-ND2 3.2Å; N390-D432 PolarHBondContact N-OD2 2.77Å; N390-Q488 PolarHBondContact O-NE2 3.23Å
391	Q	84.2	Confident	91.5	Very high	52 Å²	52	51.2 Å²	51.2	24%	0.243	27%	0.272	C	S	.	.	S	Bend	trans	-104.2	131.3	173.7	-61.7	-64.3	-52.6	0	0	109.8	K431 D432 Q488	Q391-K431 HydrophobicContact CB-CB 4.04Å; Q391-K431 HydrophobicContact CG-CB 4Å; Q391-D432 VanDerWaalsContact CB-OD1 3.29Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.47Å; Q391-D432 VanDerWaalsContact CG-OD1 3.27Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.24Å; Q391-D432 PolarHBondContact N-OD1 3.1Å; Q391-D432 VanDerWaalsContact N-OD1 3.15Å; Q391-D432 PolarHBondContact N-OD2 2.98Å; Q391-Q488 VanDerWaalsContact C-NE2 3.29Å; Q391-Q488 PolarHBondContact O-NE2 2.65Å
392	S	89.5	Confident	91.4	Very high	57 Å²	57	51.1 Å²	51.1	40%	0.399	27%	0.271	S	S	.	.			trans	-70.1	145.6	174.3	58.3	0	0	0	0	110.6
393	P	93.8	Very high	91.3	Very high	1 Å²	1	51 Å²	51	1%	0.006	27%	0.269	C	S	.	.			trans	-61.9	156.3	176.3	-21.2	34.6	0	0	0	111.2	L429 L441 A483 D485 S490	P393-L429 CarbonylContact C-O 3.55Å; P393-L429 WeakPolarHBondContact CA-O 3.34Å; P393-L441 HydrophobicContact CB-CD1 3.92Å; P393-L441 HydrophobicContact CB-CD2 3.85Å; P393-L441 HydrophobicContact CG-CD2 3.61Å; P393-A483 HydrophobicContact CB-CB 4.01Å; P393-D485 WeakPolarHBondContact CD-OD2 3.49Å; P393-D485 HydrophobicContact CG-CB 3.76Å; P393-D485 WeakPolarHBondContact CG-OD2 3.43Å; P393-S490 VanDerWaalsContact O-CA 3.25Å; P393-S490 WeakPolarHBondContact O-CA 3.14Å; P393-S490 WeakPolarHBondContact O-CB 3.34Å
394	Y	92.5	Very high	91.2	Very high	80 Å²	80	51.2 Å²	51.2	31%	0.314	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.4	179.1	70.2	-83.7	0	0	0	112.6	A428 L429 K431	Y394-A428 CarbonylContact O-C 3.53Å; Y394-A428 VanDerWaalsContact O-CA 3.26Å; Y394-A428 WeakPolarHBondContact O-CA 3.36Å; Y394-L429 WeakPolarHBondContact CD1-O 3.4Å; Y394-L429 HydrophobicContact CE1-CB 3.93Å; Y394-L429 HydrophobicContact CE2-CB 4.33Å; Y394-L429 PolarHBondContact N-O 2.79Å; Y394-L429 PolarHBondContact O-N 3.03Å; Y394-K431 HydrophobicContact CE1-CG 3.83Å
395	F	94.8	Very high	91.2	Very high	22 Å²	22	48.9 Å²	48.9	10%	0.096	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	141.1	171.8	-69.1	-83	0	0	0	110.9	M397 Y400 I426 A428 L443 I481 A483 S490 V493	F395-M397 PolarHBondContact O-N 3.04Å; F395-Y400 AromaticContact CD1-CE2 3.94Å; F395-Y400 HydrophobicContact CD1-CE2 3.94Å; F395-Y400 HydrophobicContact CG-CE2 4.45Å; F395-I426 HydrophobicContact CD1-CG2 4.11Å; F395-I426 HydrophobicContact CE1-CG2 3.88Å; F395-A428 HydrophobicContact CD1-CB 3.83Å; F395-A428 HydrophobicContact CE1-CB 3.82Å; F395-A428 HydrophobicContact CG-CB 4.45Å; F395-A428 HydrophobicContact CZ-CB 4.43Å; F395-L443 HydrophobicContact CE1-CD2 3.99Å; F395-L443 HydrophobicContact CZ-CD2 3.89Å; F395-I481 HydrophobicContact CE1-CG1 4.47Å; F395-I481 HydrophobicContact CE1-CG2 3.87Å; F395-I481 HydrophobicContact CE2-CG2 4.23Å; F395-I481 WeakPolarHBondContact CE2-O 3.36Å; F395-I481 HydrophobicContact CZ-CB 4.31Å; F395-I481 HydrophobicContact CZ-CG1 4.1Å; F395-I481 HydrophobicContact CZ-CG2 3.66Å; F395-A483 HydrophobicContact CE2-CB 4.16Å; F395-A483 HydrophobicContact CZ-CB 3.95Å; F395-S490 VanDerWaalsContact CE2-OG 3.28Å; F395-S490 WeakPolarHBondContact CE2-OG 3.35Å; F395-V493 HydrophobicContact CB-CG2 3.8Å; F395-V493 HydrophobicContact CD2-CB 3.93Å; F395-V493 HydrophobicContact CD2-CG2 3.5Å; F395-V493 HydrophobicContact CE2-CB 4.36Å; F395-V493 HydrophobicContact CE2-CG2 4.33Å; F395-V493 HydrophobicContact CG-CB 4.22Å; F395-V493 HydrophobicContact CG-CG2 3.84Å
396	T	93.1	Very high	91.2	Very high	65 Å²	65	49.1 Å²	49.1	40%	0.399	26%	0.262	S	S	.	.	S	Bend	trans	-71	-17.3	177.9	52.5	0	0	0	0	113.8	V427 L429	T396-V427 HydrophobicContact CG2-CB 4.08Å; T396-V427 HydrophobicContact CG2-CG1 3.77Å; T396-V427 PolarHBondContact N-O 3.45Å; T396-V427 WeakPolarHBondContact OG1-CB 3.13Å; T396-V427 PolarHBondContact OG1-O 3.48Å; T396-L429 HydrophobicContact CG2-CD1 3.92Å; T396-L429 HydrophobicContact CG2-CG 4.21Å
397	M	93.3	Very high	91.3	Very high	103 Å²	103	49.3 Å²	49.3	51%	0.507	27%	0.269	S	S	.	.	S	Bend	trans	-127.6	144.9	179.4	-63.9	-65.1	-71.4	0	0	110.4	F395 S399 Y400	F395-M397 PolarHBondContact O-N 3.04Å; M397-S399 VanDerWaalsContact C-N 3.31Å; M397-S399 PolarHBondContact O-N 3.29Å; M397-Y400 HydrophobicContact CB-CD1 4.41Å; M397-Y400 HydrophobicContact CB-CE1 3.78Å; M397-Y400 HydrophobicContact CG-CE1 4.02Å
398	P	93	Very high	91.7	Very high	110 Å²	110	47.8 Å²	47.8	71%	0.714	26%	0.263	S	S	*	.	S	Bend	trans	-77.1	-14.3	-178.6	31.5	-36.7	0	0	0	114.1	V493	P398-V493 WeakPolarHBondContact O-CG1 3.44Å
399	S	95.4	Very high	92.3	Very high	65 Å²	65	49.5 Å²	49.5	46%	0.455	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	151.7	177.1	61.3	0	0	0	0	110.2	M397 V494	M397-S399 VanDerWaalsContact C-N 3.31Å; M397-S399 PolarHBondContact O-N 3.29Å; S399-V494 CarbonylContact C-O 3.59Å; S399-V494 VanDerWaalsContact CA-O 3.28Å; S399-V494 WeakPolarHBondContact CA-O 3.42Å
400	Y	95.6	Very high	92.8	Very high	10 Å²	10	50.6 Å²	50.6	4%	0.039	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.3	177.1	-63.5	-79.2	0	0	0	111.6	F395 M397 L424 R425 I426 V427 V493 V494 V495 N496	F395-Y400 AromaticContact CD1-CE2 3.94Å; F395-Y400 HydrophobicContact CD1-CE2 3.94Å; F395-Y400 HydrophobicContact CG-CE2 4.45Å; M397-Y400 HydrophobicContact CB-CD1 4.41Å; M397-Y400 HydrophobicContact CB-CE1 3.78Å; M397-Y400 HydrophobicContact CG-CE1 4.02Å; Y400-L424 HydrophobicContact CD1-CD1 4.28Å; Y400-R425 WeakPolarHBondContact CE1-O 3.49Å; Y400-I426 HydrophobicContact CD1-CG1 4.19Å; Y400-I426 HydrophobicContact CD2-CG1 4.39Å; Y400-I426 HydrophobicContact CE1-CB 4.48Å; Y400-I426 HydrophobicContact CE1-CG1 4.28Å; Y400-I426 HydrophobicContact CE2-CG1 4.47Å; Y400-I426 HydrophobicContact CE2-CG2 3.96Å; Y400-I426 HydrophobicContact CG-CG1 4.25Å; Y400-V427 PolarHBondContact OH-N 3.25Å; Y400-V427 PolarHBondContact OH-O 2.81Å; Y400-V493 HydrophobicContact CD2-CG1 3.77Å; Y400-V493 HydrophobicContact CE2-CG1 3.85Å; Y400-V494 PolarHBondContact N-O 3.03Å; Y400-V495 HydrophobicContact CD2-CG2 4.27Å; Y400-V495 WeakPolarHBondContact O-CA 3.46Å; Y400-N496 PolarHBondContact O-N 3.38Å
401	Q	95.7	Very high	93.3	Very high	77 Å²	77	51 Å²	51	36%	0.36	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.2	176	-177.5	66.6	40	0	0	110	Y403 L424 N496	Q401-Y403 HydrophobicContact CG-CE2 3.96Å; Q401-L424 WeakPolarHBondContact O-CD1 3.45Å; Q401-N496 CarbonylContact C-O 3.49Å; Q401-N496 WeakPolarHBondContact CA-O 3.21Å; Q401-N496 PolarHBondContact NE2-O 2.63Å
402	G	95.3	Very high	93.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	158.4	-178.8	0	0	0	0	0	113.7	S415 N496 I497 R498	G402-S415 CarbonylContact C-O 3.59Å; G402-S415 VanDerWaalsContact CA-O 3.24Å; G402-S415 WeakPolarHBondContact CA-O 3.26Å; G402-N496 PolarHBondContact N-O 2.98Å; G402-I497 WeakPolarHBondContact O-CA 3.47Å; G402-R498 PolarHBondContact O-N 3.17Å
403	Y	96.3	Very high	93.9	Very high	37 Å²	37	50.6 Å²	50.6	15%	0.145	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.2	176.5	-55.9	-86.4	0	0	0	109.9	Q401 S415 E416 L418 R498	Q401-Y403 HydrophobicContact CG-CE2 3.96Å; Y403-S415 PolarHBondContact N-O 2.82Å; Y403-S415 PolarHBondContact O-N 3.04Å; Y403-E416 WeakPolarHBondContact CE2-O 3.47Å; Y403-L418 HydrophobicContact CD1-CG 3.99Å; Y403-L418 HydrophobicContact CE1-CD1 4.04Å; Y403-L418 HydrophobicContact CE1-CD2 4.18Å; Y403-L418 HydrophobicContact CE1-CG 3.69Å; Y403-L418 HydrophobicContact CE2-CD1 4.12Å; Y403-L418 HydrophobicContact CE2-CG 4.28Å; Y403-L418 HydrophobicContact CG-CG 4.4Å; Y403-R498 WeakPolarHBondContact CA-O 3.39Å; Y403-R498 HydrophobicContact CD1-CB 3.98Å; Y403-R498 HydrophobicContact CE1-CB 4.19Å
404	I	95.4	Very high	94	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	147	174.1	-172.7	154.5	0	0	0	109.5	A408 A412 I414 L465 V469 I497 R498 V499 M500	I404-A408 HydrophobicContact CD1-CB 3.88Å; I404-A408 HydrophobicContact CG1-CB 3.7Å; I404-A412 HydrophobicContact CD1-CB 4.23Å; I404-I414 HydrophobicContact CB-CD1 3.87Å; I404-I414 HydrophobicContact CD1-CD1 3.57Å; I404-I414 HydrophobicContact CG1-CD1 4.3Å; I404-I414 HydrophobicContact CG2-CD1 4.1Å; I404-L465 HydrophobicContact CD1-CB 4.24Å; I404-L465 HydrophobicContact CD1-CD1 4.34Å; I404-L465 HydrophobicContact CD1-CD2 4.13Å; I404-L465 HydrophobicContact CD1-CG 4.48Å; I404-V469 HydrophobicContact CG2-CG2 4.35Å; I404-I497 HydrophobicContact CG2-CG2 3.93Å; I404-R498 PolarHBondContact N-O 2.97Å; I404-V499 HydrophobicContact CG2-CG2 4.42Å; I404-V499 CarbonylContact O-C 3.58Å; I404-V499 WeakPolarHBondContact O-CA 3.5Å; I404-M500 PolarHBondContact O-N 2.95Å
405	L	94	Very high	94.2	Very high	54 Å²	54	47 Å²	47	28%	0.283	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.3	173.6	-163.7	68.9	0	0	0	109.5	S407 A408 L420 M500 D501 A502	L405-S407 WeakPolarHBondContact CD2-OG 3.43Å; L405-S407 WeakPolarHBondContact CG-OG 3.33Å; L405-S407 PolarHBondContact O-N 2.81Å; L405-A408 WeakPolarHBondContact O-CB 3.32Å; L405-A408 PolarHBondContact O-N 2.79Å; L405-L420 HydrophobicContact CB-CD1 4Å; L405-M500 HydrophobicContact CD1-CB 3.97Å; L405-D501 WeakPolarHBondContact CD1-O 3.28Å; L405-A502 HydrophobicContact CD1-CB 4.34Å; L405-A502 HydrophobicContact CG-CB 4.3Å
406	E	94.2	Very high	94.1	Very high	8 Å²	8	51 Å²	51	4%	0.037	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.5	180	70.9	-165.3	125.1	0	0	113.7	A408 V469 R471 V499 M500 D501 A502	E406-A408 PolarHBondContact O-N 3.34Å; E406-A408 VanDerWaalsContact O-N 3.12Å; E406-V469 VanDerWaalsContact O-O 3.11Å; E406-R471 HydrophobicContact CB-CB 4.35Å; E406-R471 WeakPolarHBondContact OE2-CA 3.31Å; E406-R471 WeakPolarHBondContact OE2-CB 3.36Å; E406-R471 PolarHBondContact OE2-N 3.1Å; E406-V499 HydrophobicContact CB-CG1 3.66Å; E406-M500 PolarHBondContact N-O 2.88Å; E406-D501 WeakPolarHBondContact OE1-CA 3.36Å; E406-A502 HydrophobicContact CG-CB 3.77Å; E406-A502 PolarHBondContact OE1-N 3.18Å
407	S	92	Very high	94	Very high	75 Å²	75	49.3 Å²	49.3	52%	0.524	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	5.5	172.6	60.1	0	0	0	0	114.4	L405	L405-S407 WeakPolarHBondContact CD2-OG 3.43Å; L405-S407 WeakPolarHBondContact CG-OG 3.33Å; L405-S407 PolarHBondContact O-N 2.81Å
408	A	92.4	Very high	93.8	Very high	18 Å²	18	49 Å²	49	15%	0.149	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-67.9	133.6	178.2	0	0	0	0	0	111.4	I404 L405 E406 A412	I404-A408 HydrophobicContact CD1-CB 3.88Å; I404-A408 HydrophobicContact CG1-CB 3.7Å; L405-A408 WeakPolarHBondContact O-CB 3.32Å; L405-A408 PolarHBondContact O-N 2.79Å; E406-A408 PolarHBondContact O-N 3.34Å; E406-A408 VanDerWaalsContact O-N 3.12Å; A408-A412 HydrophobicContact CB-CB 3.88Å
409	P	93.7	Very high	93.5	Very high	98 Å²	98	50.3 Å²	50.3	64%	0.636	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-70.9	155.5	178.6	30	-35.4	0	0	0	111.8	G411 A412	P409-G411 PolarHBondContact O-N 2.79Å; P409-A412 WeakPolarHBondContact O-CB 3.46Å; P409-A412 PolarHBondContact O-N 2.9Å
410	V	92.8	Very high	93.2	Very high	86 Å²	86	50.7 Å²	50.7	52%	0.521	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	130.5	168	175.1	0	0	0	0	109.7	L466	V410-L466 VanDerWaalsContact CG1-O 3.27Å; V410-L466 WeakPolarHBondContact CG1-O 3.27Å
411	G	91.5	Very high	92.8	Very high	47 Å²	47	55.3 Å²	55.3	49%	0.485	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	97	-6.7	-172.9	0	0	0	0	0	114.6	P409 L465	P409-G411 PolarHBondContact O-N 2.79Å; G411-L465 WeakPolarHBondContact CA-O 3.43Å; G411-L465 PolarHBondContact N-O 3.48Å
412	A	93.2	Very high	92.6	Very high	24 Å²	24	54 Å²	54	20%	0.198	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-63	139.2	174.4	0	0	0	0	0	111.8	I404 A408 P409 T464 L465	I404-A412 HydrophobicContact CD1-CB 4.23Å; A408-A412 HydrophobicContact CB-CB 3.88Å; P409-A412 WeakPolarHBondContact O-CB 3.46Å; P409-A412 PolarHBondContact O-N 2.9Å; A412-T464 CarbonylContact O-C 3.5Å; A412-T464 VanDerWaalsContact O-CA 3.27Å; A412-T464 WeakPolarHBondContact O-CA 3.42Å; A412-L465 PolarHBondContact O-N 3.14Å
413	T	94.9	Very high	92.5	Very high	77 Å²	77	55.8 Å²	55.8	47%	0.472	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-84.4	134.3	176.3	51.3	0	0	0	0	110.9	L463 T464	T413-L463 WeakPolarHBondContact CA-O 3.27Å; T413-T464 HydrophobicContact CG2-CG2 3.73Å
414	I	95.4	Very high	92.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-62.6	137.4	174.3	-52.5	-59.9	0	0	0	110.1	I404 P423 L424 F452 L463 I497	I404-I414 HydrophobicContact CB-CD1 3.87Å; I404-I414 HydrophobicContact CD1-CD1 3.57Å; I404-I414 HydrophobicContact CG1-CD1 4.3Å; I404-I414 HydrophobicContact CG2-CD1 4.1Å; I414-P423 CarbonylContact O-C 3.54Å; I414-P423 WeakPolarHBondContact O-CA 3.34Å; I414-L424 HydrophobicContact CG2-CB 4.41Å; I414-L424 HydrophobicContact CG2-CD2 4.19Å; I414-L424 PolarHBondContact O-N 3.12Å; I414-F452 HydrophobicContact CD1-CD1 4.06Å; I414-F452 HydrophobicContact CD1-CE1 3.76Å; I414-F452 HydrophobicContact CG1-CD1 4.48Å; I414-L463 HydrophobicContact CB-CB 4.16Å; I414-L463 HydrophobicContact CG1-CB 3.64Å; I414-L463 PolarHBondContact N-O 2.95Å; I414-I497 HydrophobicContact CD1-CD1 4.18Å; I414-I497 HydrophobicContact CD1-CG2 4.21Å; I414-I497 HydrophobicContact CG1-CD1 4.1Å; I414-I497 HydrophobicContact CG2-CD1 4.46Å; I414-I497 HydrophobicContact CG2-CG1 4.39Å; I414-I497 HydrophobicContact CG2-CG2 4.28Å
415	S	95.6	Very high	92.4	Very high	6 Å²	6	59.6 Å²	59.6	4%	0.042	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-95.5	147.8	178.8	-171.1	0	0	0	0	112.2	G402 Y403 S417 L420 T422	G402-S415 CarbonylContact C-O 3.59Å; G402-S415 VanDerWaalsContact CA-O 3.24Å; G402-S415 WeakPolarHBondContact CA-O 3.26Å; Y403-S415 PolarHBondContact N-O 2.82Å; Y403-S415 PolarHBondContact O-N 3.04Å; S415-S417 PolarHBondContact OG-N 3.44Å; S415-S417 PolarHBondContact OG-O 3.39Å; S415-L420 WeakPolarHBondContact OG-CA 3.11Å; S415-T422 CarbonylContact C-O 3.48Å; S415-T422 WeakPolarHBondContact CA-O 3.09Å; S415-T422 WeakPolarHBondContact CB-O 3.42Å; S415-T422 PolarHBondContact OG-O 2.8Å
416	E	93.4	Very high	92.4	Very high	105 Å²	105	57 Å²	57	49%	0.491	34%	0.336	S	S	.	.	S	Bend	trans	-79	-20.3	171.6	-170.2	177.9	-150	0	0	112.7	Y403 T422 L424	Y403-E416 WeakPolarHBondContact CE2-O 3.47Å; E416-T422 PolarHBondContact N-O 2.8Å; E416-L424 HydrophobicContact CB-CB 4.46Å; E416-L424 HydrophobicContact CB-CD1 4.16Å; E416-L424 HydrophobicContact CG-CD1 4.11Å
417	S	90.3	Very high	92.4	Very high	30 Å²	30	58 Å²	58	21%	0.21	34%	0.342	C	S	.	.	S	Bend	trans	-118.4	147.7	-173.5	65	0	0	0	0	112.2	S415 N419 L420 T421 T422	S415-S417 PolarHBondContact OG-N 3.44Å; S415-S417 PolarHBondContact OG-O 3.39Å; S417-N419 PolarHBondContact O-N 3.33Å; S417-N419 VanDerWaalsContact O-N 3.11Å; S417-L420 PolarHBondContact O-N 3.12Å; S417-T421 PolarHBondContact OG-OG1 2.82Å; S417-T422 PolarHBondContact OG-OG1 2.94Å
418	L	88.9	Confident	92.4	Very high	96 Å²	96	54.7 Å²	54.7	50%	0.503	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.1	175.7	-73.3	102.2	0	0	0	113.5	Y403 L420 M500	Y403-L418 HydrophobicContact CD1-CG 3.99Å; Y403-L418 HydrophobicContact CE1-CD1 4.04Å; Y403-L418 HydrophobicContact CE1-CD2 4.18Å; Y403-L418 HydrophobicContact CE1-CG 3.69Å; Y403-L418 HydrophobicContact CE2-CD1 4.12Å; Y403-L418 HydrophobicContact CE2-CG 4.28Å; Y403-L418 HydrophobicContact CG-CG 4.4Å; L418-L420 PolarHBondContact O-N 2.77Å; L418-M500 WeakPolarHBondContact O-CE 3.26Å
419	N	87.8	Confident	92.4	Very high	138 Å²	138	54.6 Å²	54.6	74%	0.738	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	2.1	177.6	-64.8	-26.3	0	0	0	112.8	S417 T421	S417-N419 PolarHBondContact O-N 3.33Å; S417-N419 VanDerWaalsContact O-N 3.11Å; N419-T421 HydrophobicContact CB-CG2 3.93Å; N419-T421 WeakPolarHBondContact O-CG2 3.04Å; N419-T421 PolarHBondContact O-N 2.93Å
420	L	89	Confident	92.3	Very high	72 Å²	72	50.1 Å²	50.1	38%	0.377	29%	0.288	S	S	.	.	S	Bend	trans	56.6	31.2	178.1	-52.9	177	0	0	0	113.8	L405 S415 S417 L418 M500	L405-L420 HydrophobicContact CB-CD1 4Å; S415-L420 WeakPolarHBondContact OG-CA 3.11Å; S417-L420 PolarHBondContact O-N 3.12Å; L418-L420 PolarHBondContact O-N 2.77Å; L420-M500 HydrophobicContact CD1-SD 4.23Å; L420-M500 HydrophobicContact CD2-SD 3.83Å; L420-M500 HydrophobicContact CG-SD 4.06Å
421	T	87.6	Confident	91.9	Very high	107 Å²	107	51.4 Å²	51.4	66%	0.656	29%	0.286	S	S	*	.			trans	-95.7	-25	-173.4	59	0	0	0	0	114.3	S417 N419	S417-T421 PolarHBondContact OG-OG1 2.82Å; N419-T421 HydrophobicContact CB-CG2 3.93Å; N419-T421 WeakPolarHBondContact O-CG2 3.04Å; N419-T421 PolarHBondContact O-N 2.93Å
422	T	90.7	Very high	91.5	Very high	49 Å²	49	49.5 Å²	49.5	30%	0.301	27%	0.265	S	S	.	.	S	Bend	trans	-127.6	130.5	-174	51.7	0	0	0	0	110.5	S415 E416 S417	S415-T422 CarbonylContact C-O 3.48Å; S415-T422 WeakPolarHBondContact CA-O 3.09Å; S415-T422 WeakPolarHBondContact CB-O 3.42Å; S415-T422 PolarHBondContact OG-O 2.8Å; E416-T422 PolarHBondContact N-O 2.8Å; S417-T422 PolarHBondContact OG-OG1 2.94Å
423	P	93.3	Very high	91	Very high	39 Å²	39	51.5 Å²	51.5	25%	0.253	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-69.8	144.4	176.8	30.8	-35.4	0	0	0	110.5	I414 R425 Y462	I414-P423 CarbonylContact O-C 3.54Å; I414-P423 WeakPolarHBondContact O-CA 3.34Å; P423-R425 PolarHBondContact O-N 2.83Å; P423-Y462 HydrophobicContact CB-CD1 3.78Å; P423-Y462 HydrophobicContact CB-CE1 3.87Å; P423-Y462 HydrophobicContact CG-CD1 4.18Å; P423-Y462 HydrophobicContact CG-CE1 3.73Å
424	L	94.7	Very high	90.1	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.8	116.2	174.2	179	62.2	0	0	0	109.8	Y400 Q401 I414 E416 Y462 L463	Y400-L424 HydrophobicContact CD1-CD1 4.28Å; Q401-L424 WeakPolarHBondContact O-CD1 3.45Å; I414-L424 HydrophobicContact CG2-CB 4.41Å; I414-L424 HydrophobicContact CG2-CD2 4.19Å; I414-L424 PolarHBondContact O-N 3.12Å; E416-L424 HydrophobicContact CB-CB 4.46Å; E416-L424 HydrophobicContact CB-CD1 4.16Å; E416-L424 HydrophobicContact CG-CD1 4.11Å; L424-Y462 WeakPolarHBondContact O-CD1 3.48Å; L424-L463 HydrophobicContact CD2-CD1 4.38Å
425	R	94.2	Very high	89.5	Confident	120 Å²	120	57.1 Å²	57.1	45%	0.453	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	118	-179.6	-62.8	-178.6	-152.4	-84.8	-1.5	109.6	Y400 P423 T460 Y462	Y400-R425 WeakPolarHBondContact CE1-O 3.49Å; P423-R425 PolarHBondContact O-N 2.83Å; R425-T460 HydrophobicContact CB-CG2 3.65Å; R425-T460 HydrophobicContact CG-CG2 3.74Å; R425-Y462 HydrophobicContact CG-CE1 3.98Å; R425-Y462 PolarHBondContact NH1-OH 3.39Å
426	I	94.9	Very high	88.8	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.9	171.8	-59.8	178.2	0	0	0	107.1	F395 Y400 L443 R461 L463 I481	F395-I426 HydrophobicContact CD1-CG2 4.11Å; F395-I426 HydrophobicContact CE1-CG2 3.88Å; Y400-I426 HydrophobicContact CD1-CG1 4.19Å; Y400-I426 HydrophobicContact CD2-CG1 4.39Å; Y400-I426 HydrophobicContact CE1-CB 4.48Å; Y400-I426 HydrophobicContact CE1-CG1 4.28Å; Y400-I426 HydrophobicContact CE2-CG1 4.47Å; Y400-I426 HydrophobicContact CE2-CG2 3.96Å; Y400-I426 HydrophobicContact CG-CG1 4.25Å; I426-L443 HydrophobicContact CG2-CD1 4.32Å; I426-R461 HydrophobicContact CB-CB 4.3Å; I426-R461 PolarHBondContact N-O 2.96Å; I426-R461 PolarHBondContact O-N 2.99Å; I426-L463 HydrophobicContact CD1-CD1 3.65Å; I426-L463 HydrophobicContact CD1-CD2 4.41Å; I426-L463 HydrophobicContact CD1-CG 3.67Å; I426-I481 HydrophobicContact CD1-CD1 4.14Å; I426-I481 HydrophobicContact CG2-CD1 4.36Å
427	V	94.2	Very high	88.2	Confident	27 Å²	27	63 Å²	63	16%	0.164	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	112.7	-179	-179.3	0	0	0	0	107.7	T396 Y400 L429 I459 T460	T396-V427 HydrophobicContact CG2-CB 4.08Å; T396-V427 HydrophobicContact CG2-CG1 3.77Å; T396-V427 PolarHBondContact N-O 3.45Å; T396-V427 WeakPolarHBondContact OG1-CB 3.13Å; T396-V427 PolarHBondContact OG1-O 3.48Å; Y400-V427 PolarHBondContact OH-N 3.25Å; Y400-V427 PolarHBondContact OH-O 2.81Å; V427-L429 HydrophobicContact CG1-CD2 4.08Å; V427-L429 HydrophobicContact CG1-CG 4.07Å; V427-I459 HydrophobicContact CG1-CG2 4.05Å; V427-T460 HydrophobicContact CG2-CG2 4.22Å
428	A	92.6	Very high	88	Confident	6 Å²	6	63.8 Å²	63.8	5%	0.05	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	168.9	0	0	0	0	0	108.1	Y394 F395 L441 L443 A483	Y394-A428 CarbonylContact O-C 3.53Å; Y394-A428 VanDerWaalsContact O-CA 3.26Å; Y394-A428 WeakPolarHBondContact O-CA 3.36Å; F395-A428 HydrophobicContact CD1-CB 3.83Å; F395-A428 HydrophobicContact CE1-CB 3.82Å; F395-A428 HydrophobicContact CG-CB 4.45Å; F395-A428 HydrophobicContact CZ-CB 4.43Å; A428-L441 HydrophobicContact CB-CD1 3.76Å; A428-L443 HydrophobicContact CB-CD2 4.18Å; A428-A483 HydrophobicContact CB-CB 3.98Å
429	L	92.8	Very high	87.8	Confident	17 Å²	17	59.8 Å²	59.8	9%	0.089	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	166.6	-179.4	-62.5	176.6	0	0	0	109.2	P393 Y394 T396 V427 D435 I459	P393-L429 CarbonylContact C-O 3.55Å; P393-L429 WeakPolarHBondContact CA-O 3.34Å; Y394-L429 WeakPolarHBondContact CD1-O 3.4Å; Y394-L429 HydrophobicContact CE1-CB 3.93Å; Y394-L429 HydrophobicContact CE2-CB 4.33Å; Y394-L429 PolarHBondContact N-O 2.79Å; Y394-L429 PolarHBondContact O-N 3.03Å; T396-L429 HydrophobicContact CG2-CD1 3.92Å; T396-L429 HydrophobicContact CG2-CG 4.21Å; V427-L429 HydrophobicContact CG1-CD2 4.08Å; V427-L429 HydrophobicContact CG1-CG 4.07Å; L429-D435 HydrophobicContact CD1-CB 4.45Å; L429-I459 HydrophobicContact CD2-CG2 3.91Å
430	D	90.2	Very high	87.8	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	31%	0.309	C	S	.	.			trans	-137	133	175.8	-167.6	-24	0	0	0	107.5	D432 I433 P439	D430-D432 VanDerWaalsContact C-N 3.26Å; D430-D432 PolarHBondContact O-N 3.35Å; D430-D432 WeakPolarHBondContact OD1-CB 3.39Å; D430-D432 PolarHBondContact OD1-N 2.8Å; D430-D432 VanDerWaalsContact OD1-N 3.16Å; D430-I433 PolarHBondContact O-N 2.92Å; D430-P439 HydrophobicContact CB-CB 3.82Å; D430-P439 HydrophobicContact CB-CG 4.34Å
431	K	85.8	Confident	87.9	Confident	112 Å²	112	57.3 Å²	57.3	49%	0.487	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.7	-175.3	-71.1	-176.1	-177.4	168.7	0	113.1	Q391 Y394 I433	Q391-K431 HydrophobicContact CB-CB 4.04Å; Q391-K431 HydrophobicContact CG-CB 4Å; Y394-K431 HydrophobicContact CE1-CG 3.83Å; K431-I433 PolarHBondContact O-N 2.99Å
432	D	83.3	Confident	88.1	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.037	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.7	174.1	-67.7	-19.9	0	0	0	110.2	R355 D387 N389 N390 Q391 D430	R355-D432 PolarHBondContact NH1-O 2.03Å; D387-D432 VanDerWaalsContact OD2-CA 3.24Å; D387-D432 WeakPolarHBondContact OD2-CA 3.4Å; D387-D432 WeakPolarHBondContact OD2-CB 3.36Å; N389-D432 WeakPolarHBondContact CA-OD2 3.41Å; N389-D432 PolarHBondContact OD1-OD2 2.8Å; N390-D432 PolarHBondContact N-OD2 2.77Å; Q391-D432 VanDerWaalsContact CB-OD1 3.29Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.47Å; Q391-D432 VanDerWaalsContact CG-OD1 3.27Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.24Å; Q391-D432 PolarHBondContact N-OD1 3.1Å; Q391-D432 VanDerWaalsContact N-OD1 3.15Å; Q391-D432 PolarHBondContact N-OD2 2.98Å; D430-D432 VanDerWaalsContact C-N 3.26Å; D430-D432 PolarHBondContact O-N 3.35Å; D430-D432 WeakPolarHBondContact OD1-CB 3.39Å; D430-D432 PolarHBondContact OD1-N 2.8Å; D430-D432 VanDerWaalsContact OD1-N 3.16Å
433	I	81.3	Confident	88.3	Confident	66 Å²	66	56 Å²	56	34%	0.338	28%	0.276	S	S	.	.	S	Bend	trans	-112.1	146.1	179.9	-63.7	170.9	0	0	0	110.4	D430 K431 D435 K437 P439	D430-I433 PolarHBondContact O-N 2.92Å; K431-I433 PolarHBondContact O-N 2.99Å; I433-D435 PolarHBondContact O-N 2.98Å; I433-K437 HydrophobicContact CG2-CB 3.85Å; I433-P439 HydrophobicContact CB-CB 4.44Å; I433-P439 HydrophobicContact CD1-CB 3.9Å
434	E	77.2	Confident	88.2	Confident	101 Å²	101	59.6 Å²	59.6	47%	0.472	29%	0.287	S	S	.	.			trans	-59.7	131.7	174.6	-67	173.5	154.5	0	0	111	T436 K437	E434-T436 PolarHBondContact O-N 2.78Å; E434-K437 PolarHBondContact O-N 2.92Å; E434-K437 WeakPolarHBondContact OE2-CE 3.45Å; E434-K437 IonicContact OE2-NZ 3.65Å; E434-K437 PolarHBondContact OE2-NZ 2.86Å
435	D	81.8	Confident	88.2	Confident	96 Å²	96	60.5 Å²	60.5	51%	0.513	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-18	-179.5	-67.6	-15.2	0	0	0	115.9	L429 I433	L429-D435 HydrophobicContact CD1-CB 4.45Å; I433-D435 PolarHBondContact O-N 2.98Å
436	T	80.7	Confident	88.1	Confident	114 Å²	114	59.4 Å²	59.4	70%	0.699	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-11.1	-179.9	63.5	0	0	0	0	114.1	E434 I459	E434-T436 PolarHBondContact O-N 2.78Å; T436-I459 VanDerWaalsContact O-CD1 3.31Å; T436-I459 WeakPolarHBondContact O-CD1 3.49Å
437	K	82	Confident	88	Confident	119 Å²	119	63.4 Å²	63.4	52%	0.517	32%	0.317	S	S	.	.	S	Bend	trans	-106.8	149.4	178.6	-67.6	175.3	179	147.5	0	109.1	I433 E434 P439	I433-K437 HydrophobicContact CG2-CB 3.85Å; E434-K437 PolarHBondContact O-N 2.92Å; E434-K437 WeakPolarHBondContact OE2-CE 3.45Å; E434-K437 IonicContact OE2-NZ 3.65Å; E434-K437 PolarHBondContact OE2-NZ 2.86Å; K437-P439 VanDerWaalsContact O-CD 3.24Å; K437-P439 WeakPolarHBondContact O-CD 3.42Å
438	D	84.7	Confident	87.9	Confident	47 Å²	47	64.7 Å²	64.7	25%	0.251	32%	0.319	S	S	.	.			trans	-72.9	119.6	174.4	-174.5	7.3	0	0	0	108.7	E440 G458 I459 R461	D438-E440 PolarHBondContact O-N 2.69Å; D438-E440 VanDerWaalsContact O-N 3.09Å; D438-E440 PolarHBondContact OD1-N 2.83Å; D438-E440 VanDerWaalsContact OD1-N 3.12Å; D438-G458 WeakPolarHBondContact OD2-CA 3.44Å; D438-G458 PolarHBondContact OD2-N 3.44Å; D438-I459 HydrophobicContact CB-CG1 3.94Å; D438-R461 IonicContact OD1-NH2 2.74Å
439	P	85.3	Confident	87.8	Confident	12 Å²	12	68.8 Å²	68.8	8%	0.078	34%	0.344	C	S	.	.			trans	-70.2	4.3	174.9	24.7	-29	0	0	0	113.7	D430 I433 K437 L441	D430-P439 HydrophobicContact CB-CB 3.82Å; D430-P439 HydrophobicContact CB-CG 4.34Å; I433-P439 HydrophobicContact CB-CB 4.44Å; I433-P439 HydrophobicContact CD1-CB 3.9Å; K437-P439 VanDerWaalsContact O-CD 3.24Å; K437-P439 WeakPolarHBondContact O-CD 3.42Å; P439-L441 HydrophobicContact CB-CD1 4.24Å; P439-L441 HydrophobicContact CB-CD2 4.18Å; P439-L441 HydrophobicContact CB-CG 3.86Å; P439-L441 HydrophobicContact CG-CD1 3.64Å; P439-L441 HydrophobicContact CG-CD2 4.47Å; P439-L441 HydrophobicContact CG-CG 3.69Å; P439-L441 PolarHBondContact O-N 3.14Å; P439-L441 VanDerWaalsContact O-N 3.16Å
440	E	87.6	Confident	87.8	Confident	155 Å²	155	71.2 Å²	71.2	72%	0.724	36%	0.362	S	S	*	.			trans	57.4	29.3	178.6	-60.9	-167.5	160.8	0	0	113.7	D438	D438-E440 PolarHBondContact O-N 2.69Å; D438-E440 VanDerWaalsContact O-N 3.09Å; D438-E440 PolarHBondContact OD1-N 2.83Å; D438-E440 VanDerWaalsContact OD1-N 3.12Å
441	L	91.7	Very high	88	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.016	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.7	-175.8	-59.7	170.3	0	0	0	112.7	P393 A428 P439 R461 A483 F484 D485	P393-L441 HydrophobicContact CB-CD1 3.92Å; P393-L441 HydrophobicContact CB-CD2 3.85Å; P393-L441 HydrophobicContact CG-CD2 3.61Å; A428-L441 HydrophobicContact CB-CD1 3.76Å; P439-L441 HydrophobicContact CB-CD1 4.24Å; P439-L441 HydrophobicContact CB-CD2 4.18Å; P439-L441 HydrophobicContact CB-CG 3.86Å; P439-L441 HydrophobicContact CG-CD1 3.64Å; P439-L441 HydrophobicContact CG-CD2 4.47Å; P439-L441 HydrophobicContact CG-CG 3.69Å; P439-L441 PolarHBondContact O-N 3.14Å; P439-L441 VanDerWaalsContact O-N 3.16Å; L441-R461 PolarHBondContact O-NH1 3.43Å; L441-R461 VanDerWaalsContact O-NH1 3.11Å; L441-R461 PolarHBondContact O-NH2 2.84Å; L441-A483 HydrophobicContact CD1-CB 4.25Å; L441-F484 WeakPolarHBondContact CA-O 3.43Å; L441-D485 HydrophobicContact CD2-CB 3.59Å
442	H	92.2	Very high	88.4	Confident	111 Å²	111	66.6 Å²	66.6	51%	0.514	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	117.4	167.7	-67	-63.1	0	0	0	109.7	F444 F484	H442-F444 HydrophobicContact CB-CE2 4.06Å; H442-F444 HydrophobicContact CB-CZ 4.12Å; H442-F484 PolarHBondContact N-O 2.62Å; H442-F484 PolarHBondContact O-N 2.93Å
443	L	93.6	Very high	89	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.099	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.4	177.5	-65	-174.5	0	0	0	110.4	F395 I426 A428 V454 R461 I481 T482 A483	F395-L443 HydrophobicContact CE1-CD2 3.99Å; F395-L443 HydrophobicContact CZ-CD2 3.89Å; I426-L443 HydrophobicContact CG2-CD1 4.32Å; A428-L443 HydrophobicContact CB-CD2 4.18Å; L443-V454 HydrophobicContact CB-CG1 3.73Å; L443-V454 HydrophobicContact CD1-CG1 4.48Å; L443-V454 HydrophobicContact CD1-CG2 3.74Å; L443-R461 HydrophobicContact CD1-CB 3.88Å; L443-R461 HydrophobicContact CD1-CG 3.63Å; L443-I481 HydrophobicContact CB-CD1 4.23Å; L443-I481 HydrophobicContact CB-CG1 4.38Å; L443-I481 HydrophobicContact CD1-CD1 4Å; L443-T482 CarbonylContact C-O 3.51Å; L443-T482 WeakPolarHBondContact CA-O 3.16Å; L443-A483 HydrophobicContact CD2-CB 3.42Å; L443-A483 VanDerWaalsContact CD2-CB 3.42Å
444	F	91.7	Very high	89.6	Confident	113 Å²	113	66.5 Å²	66.5	50%	0.496	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.7	177.5	-61.2	-77.1	0	0	0	110.5	H442 I481 T482 F484	H442-F444 HydrophobicContact CB-CE2 4.06Å; H442-F444 HydrophobicContact CB-CZ 4.12Å; F444-I481 WeakPolarHBondContact O-CA 3.26Å; F444-T482 PolarHBondContact N-O 2.76Å; F444-T482 PolarHBondContact O-N 2.85Å; F444-F484 HydrophobicContact CD2-CB 4.12Å; F444-F484 HydrophobicContact CE2-CB 3.6Å; F444-F484 HydrophobicContact CE2-CD1 4.06Å; F444-F484 HydrophobicContact CE2-CG 4.11Å
445	L	94.5	Very high	90.3	Very high	21 Å²	21	63.5 Å²	63.5	11%	0.11	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.5	169.9	-72.9	68.3	0	0	0	107.5	D447 T449 F452 V454 L463 F479 I481	L445-D447 VanDerWaalsContact C-N 3.3Å; L445-D447 PolarHBondContact O-N 3.36Å; L445-T449 HydrophobicContact CB-CG2 3.9Å; L445-T449 VanDerWaalsContact O-CG2 3.31Å; L445-T449 WeakPolarHBondContact O-CG2 3.18Å; L445-F452 HydrophobicContact CD2-CB 4.15Å; L445-V454 HydrophobicContact CD1-CB 4.2Å; L445-V454 HydrophobicContact CD1-CG1 3.84Å; L445-L463 HydrophobicContact CD2-CD2 4.14Å; L445-F479 HydrophobicContact CB-CD2 4.28Å; L445-F479 HydrophobicContact CB-CE2 4.45Å; L445-F479 HydrophobicContact CD2-CD2 4Å; L445-F479 HydrophobicContact CD2-CE2 3.42Å; L445-F479 VanDerWaalsContact CD2-CE2 3.42Å; L445-F479 HydrophobicContact CD2-CZ 3.85Å; L445-F479 HydrophobicContact CG-CD2 3.99Å; L445-F479 HydrophobicContact CG-CE2 3.69Å; L445-I481 HydrophobicContact CD1-CD1 4.26Å; L445-I481 HydrophobicContact CD1-CG1 4.37Å
446	N	92.9	Very high	90.6	Very high	98 Å²	98	63.6 Å²	63.6	52%	0.524	34%	0.34	S	S	.	.	S	Bend	trans	-73.1	-23	-179.3	73.6	-25.1	0	0	0	113.3	F479 L480	N446-F479 WeakPolarHBondContact OD1-CB 3.29Å; N446-L480 HydrophobicContact CB-CB 4.34Å; N446-L480 PolarHBondContact N-O 2.87Å; N446-L480 WeakPolarHBondContact ND2-CB 3.48Å; N446-L480 WeakPolarHBondContact ND2-CG 3.15Å; N446-L480 PolarHBondContact OD1-N 2.84Å; N446-L480 PolarHBondContact OD1-O 2.71Å
447	D	92.5	Very high	91	Very high	84 Å²	84	63 Å²	63	45%	0.449	34%	0.337	S	S	.	.	S	Bend	trans	-147.5	166.6	-178.5	-157.8	-2.1	0	0	0	110.7	L445 T449 F479	L445-D447 VanDerWaalsContact C-N 3.3Å; L445-D447 PolarHBondContact O-N 3.36Å; D447-T449 PolarHBondContact O-N 3.37Å; D447-T449 VanDerWaalsContact O-N 3.17Å; D447-F479 HydrophobicContact CB-CB 4.15Å
448	Y	92.4	Very high	91.2	Very high	53 Å²	53	58.6 Å²	58.6	21%	0.208	33%	0.325	C	S	.	.			trans	56.3	26.3	179.9	-52.7	-77	0	0	0	115.4	S450 V451 F452 Q474 Y477 F479	Y448-S450 PolarHBondContact O-N 2.91Å; Y448-S450 VanDerWaalsContact O-N 3.16Å; Y448-V451 HydrophobicContact CD1-CG2 4.43Å; Y448-V451 PolarHBondContact O-N 3.25Å; Y448-F452 PolarHBondContact O-N 3.15Å; Y448-Q474 PolarHBondContact OH-NE2 3.1Å; Y448-Q474 VanDerWaalsContact OH-NE2 3.09Å; Y448-Y477 AromaticContact CD1-CD1 3.48Å; Y448-Y477 HydrophobicContact CD1-CD1 3.48Å; Y448-Y477 VanDerWaalsContact CD1-CD1 3.48Å; Y448-Y477 AromaticContact CD1-CE1 3.84Å; Y448-Y477 HydrophobicContact CD1-CE1 3.84Å; Y448-Y477 HydrophobicContact CD2-CD1 4.34Å; Y448-Y477 AromaticContact CE1-CD1 3.5Å; Y448-Y477 HydrophobicContact CE1-CD1 3.5Å; Y448-Y477 VanDerWaalsContact CE1-CD1 3.5Å; Y448-Y477 AromaticContact CE1-CE1 3.85Å; Y448-Y477 HydrophobicContact CE1-CE1 3.85Å; Y448-Y477 HydrophobicContact CE2-CD1 4.38Å; Y448-Y477 AromaticContact CG-CD1 3.92Å; Y448-Y477 HydrophobicContact CG-CD1 3.92Å; Y448-Y477 AromaticContact CZ-CD1 3.97Å; Y448-F479 HydrophobicContact CD2-CB 4Å; Y448-F479 AromaticContact CD2-CD1 3.82Å; Y448-F479 HydrophobicContact CD2-CD1 3.82Å; Y448-F479 HydrophobicContact CD2-CG 4.29Å
449	T	90.6	Very high	91.4	Very high	93 Å²	93	59 Å²	59	57%	0.571	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-17	175.1	52.3	0	0	0	0	113.8	L445 D447 L466	L445-T449 HydrophobicContact CB-CG2 3.9Å; L445-T449 VanDerWaalsContact O-CG2 3.31Å; L445-T449 WeakPolarHBondContact O-CG2 3.18Å; D447-T449 PolarHBondContact O-N 3.37Å; D447-T449 VanDerWaalsContact O-N 3.17Å; T449-L466 WeakPolarHBondContact O-CD1 3.32Å
450	S	91.9	Very high	91.8	Very high	68 Å²	68	60.6 Å²	60.6	48%	0.476	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-21.5	170.8	57.5	0	0	0	0	113.6	Y448 Q467	Y448-S450 PolarHBondContact O-N 2.91Å; Y448-S450 VanDerWaalsContact O-N 3.16Å; S450-Q467 WeakPolarHBondContact O-CG 3.27Å
451	V	93.6	Very high	92	Very high	16 Å²	16	53.5 Å²	53.5	10%	0.097	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-41	-174.8	-175.4	0	0	0	0	111.3	Y448 L465 L466 V469 Y477	Y448-V451 HydrophobicContact CD1-CG2 4.43Å; Y448-V451 PolarHBondContact O-N 3.25Å; V451-L465 HydrophobicContact CG1-CD1 4.24Å; V451-L466 WeakPolarHBondContact O-CB 3.34Å; V451-L466 PolarHBondContact O-N 3.3Å; V451-V469 HydrophobicContact CG1-CG1 3.7Å; V451-Y477 HydrophobicContact CG1-CE1 4.38Å
452	F	95.5	Very high	92.2	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.009	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	148.7	-179.7	-55	-72.4	0	0	0	111.5	I414 L445 Y448 T464 L465 Y477 F479 I497	I414-F452 HydrophobicContact CD1-CD1 4.06Å; I414-F452 HydrophobicContact CD1-CE1 3.76Å; I414-F452 HydrophobicContact CG1-CD1 4.48Å; L445-F452 HydrophobicContact CD2-CB 4.15Å; Y448-F452 PolarHBondContact O-N 3.15Å; F452-T464 WeakPolarHBondContact CA-O 3.09Å; F452-L465 HydrophobicContact CD1-CD1 4.07Å; F452-L465 HydrophobicContact CE1-CD1 3.71Å; F452-Y477 AromaticContact CE2-CD1 3.77Å; F452-Y477 HydrophobicContact CE2-CD1 3.77Å; F452-Y477 HydrophobicContact CE2-CD2 4.22Å; F452-Y477 HydrophobicContact CE2-CE1 4.42Å; F452-Y477 AromaticContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CZ-CD1 4.32Å; F452-Y477 HydrophobicContact CZ-CD2 4.01Å; F452-Y477 AromaticContact CZ-CG 3.92Å; F452-Y477 HydrophobicContact CZ-CG 3.92Å; F452-F479 AromaticContact CD2-CE1 3.8Å; F452-F479 HydrophobicContact CD2-CE1 3.8Å; F452-F479 HydrophobicContact CD2-CZ 4.31Å; F452-F479 HydrophobicContact CE2-CE1 4.17Å; F452-I497 HydrophobicContact CD1-CD1 3.9Å; F452-I497 HydrophobicContact CD2-CD1 4.07Å; F452-I497 HydrophobicContact CE1-CD1 3.67Å; F452-I497 HydrophobicContact CE1-CG2 4.5Å; F452-I497 HydrophobicContact CE2-CD1 3.86Å; F452-I497 HydrophobicContact CG-CD1 4.1Å; F452-I497 HydrophobicContact CZ-CD1 3.65Å; F452-I497 HydrophobicContact CZ-CG2 4.29Å
453	T	94.3	Very high	92.3	Very high	55 Å²	55	51.1 Å²	51.1	34%	0.337	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.4	166.3	-171.9	0	0	0	0	109.8	L463 T464 L466	T453-L463 CarbonylContact O-C 3.56Å; T453-L463 WeakPolarHBondContact O-CA 3.09Å; T453-T464 WeakPolarHBondContact CG2-OG1 3.33Å; T453-T464 PolarHBondContact N-O 2.72Å; T453-T464 PolarHBondContact O-N 3.1Å; T453-L466 HydrophobicContact CG2-CD1 4.37Å; T453-L466 HydrophobicContact CG2-CD2 3.75Å; T453-L466 HydrophobicContact CG2-CG 3.88Å
454	V	94.2	Very high	92.3	Very high	16 Å²	16	51.6 Å²	51.6	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	147.3	173.2	65.3	0	0	0	0	109.6	L443 L445 R461 Y462 L463	L443-V454 HydrophobicContact CB-CG1 3.73Å; L443-V454 HydrophobicContact CD1-CG1 4.48Å; L443-V454 HydrophobicContact CD1-CG2 3.74Å; L445-V454 HydrophobicContact CD1-CB 4.2Å; L445-V454 HydrophobicContact CD1-CG1 3.84Å; V454-R461 HydrophobicContact CG2-CB 3.77Å; V454-Y462 WeakPolarHBondContact CA-O 3.42Å; V454-L463 HydrophobicContact CB-CD2 3.97Å; V454-L463 HydrophobicContact CG2-CD2 4.41Å
455	T	91.8	Very high	92.5	Very high	38 Å²	38	46.2 Å²	46.2	23%	0.233	27%	0.27	C	S	.	.			trans	-60.5	137.2	175.6	52.9	0	0	0	0	110.6	R461 Y462	T455-R461 VanDerWaalsContact O-CD 3.31Å; T455-R461 WeakPolarHBondContact O-CD 3.47Å; T455-R461 PolarHBondContact O-NH1 3.41Å; T455-R461 VanDerWaalsContact OG1-CA 3.26Å; T455-R461 WeakPolarHBondContact OG1-CA 3.36Å; T455-Y462 HydrophobicContact CG2-CD2 4.47Å; T455-Y462 PolarHBondContact N-O 2.9Å; T455-Y462 PolarHBondContact OG1-N 3.05Å
456	P	88.8	Confident	92.5	Very high	98 Å²	98	49 Å²	49	64%	0.636	28%	0.284	S	S	*	.	S	Bend	trans	-82.5	-13.7	-172	31.7	-36.6	0	0	0	114.3	R461	P456-R461 VanDerWaalsContact O-CZ 3.31Å; P456-R461 PolarHBondContact O-NH1 3.27Å; P456-R461 PolarHBondContact O-NH2 2.97Å
457	T	88.2	Confident	92.5	Very high	102 Å²	102	49.1 Å²	49.1	63%	0.626	28%	0.282	S	S	*	.	S	Bend	trans	-137.8	163.1	-177.6	58.7	0	0	0	0	111.3	R461	T457-R461 WeakPolarHBondContact O-CD 3.22Å; T457-R461 PolarHBondContact O-NE 3.39Å
458	G	87.1	Confident	92.5	Very high	27 Å²	27	50 Å²	50	28%	0.278	29%	0.292	S	S	.	.	S	Bend	trans	100.7	147.8	177.9	0	0	0	0	0	113.7	D438 T460 R461	D438-G458 WeakPolarHBondContact OD2-CA 3.44Å; D438-G458 PolarHBondContact OD2-N 3.44Å; G458-T460 PolarHBondContact O-N 2.98Å; G458-R461 WeakPolarHBondContact O-CD 3.29Å; G458-R461 PolarHBondContact O-NE 2.66Å
459	I	89.3	Confident	92.6	Very high	54 Å²	54	47.9 Å²	47.9	28%	0.277	28%	0.284	S	S	.	.	S	Bend	trans	-59	-39.6	174.4	-62.3	167	0	0	0	111.3	V427 L429 T436 D438	V427-I459 HydrophobicContact CG1-CG2 4.05Å; L429-I459 HydrophobicContact CD2-CG2 3.91Å; T436-I459 VanDerWaalsContact O-CD1 3.31Å; T436-I459 WeakPolarHBondContact O-CD1 3.49Å; D438-I459 HydrophobicContact CB-CG1 3.94Å
460	T	92.4	Very high	92.7	Very high	46 Å²	46	46 Å²	46	28%	0.282	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117.5	174.1	-53.4	0	0	0	0	110.3	R425 V427 G458 Y462	R425-T460 HydrophobicContact CB-CG2 3.65Å; R425-T460 HydrophobicContact CG-CG2 3.74Å; V427-T460 HydrophobicContact CG2-CG2 4.22Å; G458-T460 PolarHBondContact O-N 2.98Å; T460-Y462 HydrophobicContact CG2-CE1 4.04Å; T460-Y462 HydrophobicContact CG2-CE2 4.14Å
461	R	93.3	Very high	92.9	Very high	7 Å²	7	43.4 Å²	43.4	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	150.1	177.9	-52.4	-61.7	-173.2	98.4	-1.2	111.1	I426 D438 L441 L443 V454 T455 P456 T457 G458	I426-R461 HydrophobicContact CB-CB 4.3Å; I426-R461 PolarHBondContact N-O 2.96Å; I426-R461 PolarHBondContact O-N 2.99Å; D438-R461 IonicContact OD1-NH2 2.74Å; L441-R461 PolarHBondContact O-NH1 3.43Å; L441-R461 VanDerWaalsContact O-NH1 3.11Å; L441-R461 PolarHBondContact O-NH2 2.84Å; L443-R461 HydrophobicContact CD1-CB 3.88Å; L443-R461 HydrophobicContact CD1-CG 3.63Å; V454-R461 HydrophobicContact CG2-CB 3.77Å; T455-R461 VanDerWaalsContact O-CD 3.31Å; T455-R461 WeakPolarHBondContact O-CD 3.47Å; T455-R461 PolarHBondContact O-NH1 3.41Å; T455-R461 VanDerWaalsContact OG1-CA 3.26Å; T455-R461 WeakPolarHBondContact OG1-CA 3.36Å; P456-R461 VanDerWaalsContact O-CZ 3.31Å; P456-R461 PolarHBondContact O-NH1 3.27Å; P456-R461 PolarHBondContact O-NH2 2.97Å; T457-R461 WeakPolarHBondContact O-CD 3.22Å; T457-R461 PolarHBondContact O-NE 3.39Å; G458-R461 WeakPolarHBondContact O-CD 3.29Å; G458-R461 PolarHBondContact O-NE 2.66Å
462	Y	94.9	Very high	92.9	Very high	63 Å²	63	45.3 Å²	45.3	25%	0.247	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.7	-179.4	-58.4	-79.4	0	0	0	110.3	P423 L424 R425 V454 T455 T460	P423-Y462 HydrophobicContact CB-CD1 3.78Å; P423-Y462 HydrophobicContact CB-CE1 3.87Å; P423-Y462 HydrophobicContact CG-CD1 4.18Å; P423-Y462 HydrophobicContact CG-CE1 3.73Å; L424-Y462 WeakPolarHBondContact O-CD1 3.48Å; R425-Y462 HydrophobicContact CG-CE1 3.98Å; R425-Y462 PolarHBondContact NH1-OH 3.39Å; V454-Y462 WeakPolarHBondContact CA-O 3.42Å; T455-Y462 HydrophobicContact CG2-CD2 4.47Å; T455-Y462 PolarHBondContact N-O 2.9Å; T455-Y462 PolarHBondContact OG1-N 3.05Å; T460-Y462 HydrophobicContact CG2-CE1 4.04Å; T460-Y462 HydrophobicContact CG2-CE2 4.14Å
463	L	94.8	Very high	92.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	133.9	169.9	-72.9	168.8	0	0	0	110.1	T413 I414 L424 I426 L445 T453 V454 F479 V495 I497	T413-L463 WeakPolarHBondContact CA-O 3.27Å; I414-L463 HydrophobicContact CB-CB 4.16Å; I414-L463 HydrophobicContact CG1-CB 3.64Å; I414-L463 PolarHBondContact N-O 2.95Å; L424-L463 HydrophobicContact CD2-CD1 4.38Å; I426-L463 HydrophobicContact CD1-CD1 3.65Å; I426-L463 HydrophobicContact CD1-CD2 4.41Å; I426-L463 HydrophobicContact CD1-CG 3.67Å; L445-L463 HydrophobicContact CD2-CD2 4.14Å; T453-L463 CarbonylContact O-C 3.56Å; T453-L463 WeakPolarHBondContact O-CA 3.09Å; V454-L463 HydrophobicContact CB-CD2 3.97Å; V454-L463 HydrophobicContact CG2-CD2 4.41Å; L463-F479 HydrophobicContact CD1-CZ 4.07Å; L463-V495 HydrophobicContact CD1-CG1 3.81Å; L463-I497 HydrophobicContact CD1-CD1 4.29Å
464	T	94.4	Very high	92.8	Very high	28 Å²	28	53.4 Å²	53.4	17%	0.172	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	154.9	175.6	56	0	0	0	0	111.8	A412 T413 F452 T453	A412-T464 CarbonylContact O-C 3.5Å; A412-T464 VanDerWaalsContact O-CA 3.27Å; A412-T464 WeakPolarHBondContact O-CA 3.42Å; T413-T464 HydrophobicContact CG2-CG2 3.73Å; F452-T464 WeakPolarHBondContact CA-O 3.09Å; T453-T464 WeakPolarHBondContact CG2-OG1 3.33Å; T453-T464 PolarHBondContact N-O 2.72Å; T453-T464 PolarHBondContact O-N 3.1Å
465	L	95	Very high	92.7	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	129.3	-178.4	-164.9	69.2	0	0	0	111.7	I404 G411 A412 V451 F452 Q467 V469	I404-L465 HydrophobicContact CD1-CB 4.24Å; I404-L465 HydrophobicContact CD1-CD1 4.34Å; I404-L465 HydrophobicContact CD1-CD2 4.13Å; I404-L465 HydrophobicContact CD1-CG 4.48Å; G411-L465 WeakPolarHBondContact CA-O 3.43Å; G411-L465 PolarHBondContact N-O 3.48Å; A412-L465 PolarHBondContact O-N 3.14Å; V451-L465 HydrophobicContact CG1-CD1 4.24Å; F452-L465 HydrophobicContact CD1-CD1 4.07Å; F452-L465 HydrophobicContact CE1-CD1 3.71Å; L465-Q467 WeakPolarHBondContact CD1-O 3.36Å; L465-Q467 WeakPolarHBondContact CD2-O 3.33Å; L465-Q467 WeakPolarHBondContact CG-O 3.21Å; L465-V469 HydrophobicContact CD1-CG1 3.76Å; L465-V469 HydrophobicContact CD1-CG2 4.23Å; L465-V469 HydrophobicContact CD2-CG2 4.28Å
466	L	93.8	Very high	92.9	Very high	79 Å²	79	59.3 Å²	59.3	41%	0.414	32%	0.321	S	S	.	.	S	Bend	trans	-99.7	-29.7	174.2	-73.2	-179.4	0	0	0	113.2	V410 T449 V451 T453	V410-L466 VanDerWaalsContact CG1-O 3.27Å; V410-L466 WeakPolarHBondContact CG1-O 3.27Å; T449-L466 WeakPolarHBondContact O-CD1 3.32Å; V451-L466 WeakPolarHBondContact O-CB 3.34Å; V451-L466 PolarHBondContact O-N 3.3Å; T453-L466 HydrophobicContact CG2-CD1 4.37Å; T453-L466 HydrophobicContact CG2-CD2 3.75Å; T453-L466 HydrophobicContact CG2-CG 3.88Å
467	Q	93	Very high	93.2	Very high	100 Å²	100	55.4 Å²	55.4	47%	0.467	29%	0.294	S	S	.	.	S	Bend	trans	-132	146.7	178.9	-72.1	-177.5	-3.7	0	0	109.8	S450 L465	S450-Q467 WeakPolarHBondContact O-CG 3.27Å; L465-Q467 WeakPolarHBondContact CD1-O 3.36Å; L465-Q467 WeakPolarHBondContact CD2-O 3.33Å; L465-Q467 WeakPolarHBondContact CG-O 3.21Å
468	P	93.3	Very high	93.5	Very high	102 Å²	102	54 Å²	54	66%	0.662	29%	0.285	S	S	*	.			trans	-55.9	143.6	173.4	27.1	-34.4	0	0	0	109.9
469	V	93.6	Very high	94	Very high	9 Å²	9	53 Å²	53	6%	0.055	27%	0.273	C	S	.	.			trans	-111.2	146.7	176.1	-75.8	0	0	0	0	108.6	I404 E406 V451 L465 Y477 V499	I404-V469 HydrophobicContact CG2-CG2 4.35Å; E406-V469 VanDerWaalsContact O-O 3.11Å; V451-V469 HydrophobicContact CG1-CG1 3.7Å; L465-V469 HydrophobicContact CD1-CG1 3.76Å; L465-V469 HydrophobicContact CD1-CG2 4.23Å; L465-V469 HydrophobicContact CD2-CG2 4.28Å; V469-Y477 HydrophobicContact CG1-CE2 4.03Å; V469-V499 HydrophobicContact CB-CG2 4.45Å; V469-V499 HydrophobicContact CG2-CG1 4.32Å; V469-V499 HydrophobicContact CG2-CG2 4.49Å
470	D	94.2	Very high	94.3	Very high	53 Å²	53	53.3 Å²	53.3	28%	0.283	28%	0.275	S	S	.	.			trans	-125.7	125.5	179.6	178.5	-26.2	0	0	0	107.2	E472 E473 Q474	D470-E472 WeakPolarHBondContact OD1-CA 3.27Å; D470-E472 WeakPolarHBondContact OD1-CB 3.46Å; D470-E472 PolarHBondContact OD1-N 3.14Å; D470-E473 HydrophobicContact CB-CB 4.16Å; D470-E473 HydrophobicContact CB-CG 4.14Å; D470-E473 PolarHBondContact OD1-N 3.49Å; D470-Q474 PolarHBondContact O-N 3.11Å
471	R	95.2	Very high	94.4	Very high	14 Å²	14	51.1 Å²	51.1	5%	0.053	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-34.6	-176.9	-170.3	-151.4	68.2	95.7	6.1	110.9	E406 E473 Q474 Q475 V499 D501 A536 E538	E406-R471 HydrophobicContact CB-CB 4.35Å; E406-R471 WeakPolarHBondContact OE2-CA 3.31Å; E406-R471 WeakPolarHBondContact OE2-CB 3.36Å; E406-R471 PolarHBondContact OE2-N 3.1Å; R471-E473 VanDerWaalsContact C-N 3.27Å; R471-E473 PolarHBondContact O-N 3.01Å; R471-Q474 CarbonylContact O-C 3.6Å; R471-Q474 PolarHBondContact O-N 3.17Å; R471-Q475 HydrophobicContact CG-CG 4.2Å; R471-Q475 VanDerWaalsContact O-CG 3.27Å; R471-Q475 WeakPolarHBondContact O-CG 3.21Å; R471-Q475 PolarHBondContact O-N 3.48Å; R471-V499 HydrophobicContact CB-CB 4.29Å; R471-V499 HydrophobicContact CB-CG1 3.82Å; R471-V499 HydrophobicContact CG-CB 4.27Å; R471-V499 HydrophobicContact CG-CG1 4.26Å; R471-D501 IonicContact CZ-OD1 2.65Å; R471-D501 IonicContact NE-OD1 3.52Å; R471-D501 PolarHBondContact NE-OD1 2.88Å; R471-D501 VanDerWaalsContact NE-OD1 3.16Å; R471-D501 IonicContact NH2-OD1 3.06Å; R471-A536 PolarHBondContact NH2-O 3.24Å; R471-E538 IonicContact NH1-OE2 3.39Å; R471-E538 PolarHBondContact NH1-OE2 3.22Å; R471-E538 VanDerWaalsContact NH1-OE2 3.17Å
472	E	93.9	Very high	94.5	Very high	57 Å²	57	51.8 Å²	51.8	27%	0.266	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.5	177.6	-74.8	68.4	-115.3	0	0	111.6	D470 N505 A536	D470-E472 WeakPolarHBondContact OD1-CA 3.27Å; D470-E472 WeakPolarHBondContact OD1-CB 3.46Å; D470-E472 PolarHBondContact OD1-N 3.14Å; E472-N505 VanDerWaalsContact CD-ND2 3.31Å; E472-N505 PolarHBondContact OE2-ND2 3.49Å; E472-A536 HydrophobicContact CG-CB 3.65Å
473	E	92.9	Very high	94.5	Very high	166 Å²	166	48.8 Å²	48.8	78%	0.776	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-50.2	171.4	-69.1	-169.4	164.7	0	0	112.3	D470 R471	D470-E473 HydrophobicContact CB-CB 4.16Å; D470-E473 HydrophobicContact CB-CG 4.14Å; D470-E473 PolarHBondContact OD1-N 3.49Å; R471-E473 VanDerWaalsContact C-N 3.27Å; R471-E473 PolarHBondContact O-N 3.01Å
474	Q	93.7	Very high	94.4	Very high	60 Å²	60	51.2 Å²	51.2	28%	0.28	27%	0.265	S	S	.	.			trans	-150	105.4	-177.2	-175.6	166.9	-17.2	0	0	113.5	Y448 D470 R471 T476 Y477	Y448-Q474 PolarHBondContact OH-NE2 3.1Å; Y448-Q474 VanDerWaalsContact OH-NE2 3.09Å; D470-Q474 PolarHBondContact O-N 3.11Å; R471-Q474 CarbonylContact O-C 3.6Å; R471-Q474 PolarHBondContact O-N 3.17Å; Q474-T476 WeakPolarHBondContact CG-O 3.3Å; Q474-T476 PolarHBondContact NE2-O 3.22Å; Q474-T476 PolarHBondContact O-N 3.17Å; Q474-Y477 HydrophobicContact CB-CE2 4.3Å; Q474-Y477 VanDerWaalsContact CD-CE1 3.5Å; Q474-Y477 HydrophobicContact CG-CD1 4.5Å; Q474-Y477 HydrophobicContact CG-CD2 4.47Å; Q474-Y477 HydrophobicContact CG-CE1 4.1Å; Q474-Y477 HydrophobicContact CG-CE2 4.04Å
475	Q	92.8	Very high	94.2	Very high	112 Å²	112	51.3 Å²	51.3	52%	0.523	27%	0.265	S	S	.	.	S	Bend	trans	-70.6	-26.8	-177.5	-61.2	-178	-9.2	0	0	114.7	R471 V499	R471-Q475 HydrophobicContact CG-CG 4.2Å; R471-Q475 VanDerWaalsContact O-CG 3.27Å; R471-Q475 WeakPolarHBondContact O-CG 3.21Å; R471-Q475 PolarHBondContact O-N 3.48Å; Q475-V499 PolarHBondContact O-N 3.2Å
476	T	95.3	Very high	93.8	Very high	66 Å²	66	53.6 Å²	53.6	41%	0.405	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	136.3	-173.4	-58.1	0	0	0	0	111.5	Q474 I497	Q474-T476 WeakPolarHBondContact CG-O 3.3Å; Q474-T476 PolarHBondContact NE2-O 3.22Å; Q474-T476 PolarHBondContact O-N 3.17Å; T476-I497 CarbonylContact C-O 3.52Å; T476-I497 WeakPolarHBondContact CA-O 3.45Å
477	Y	95.7	Very high	93.4	Very high	17 Å²	17	54.8 Å²	54.8	7%	0.067	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120	174.6	-63.9	-96.1	0	0	0	108.9	Y448 V451 F452 V469 Q474 N496 I497 V499	Y448-Y477 AromaticContact CD1-CD1 3.48Å; Y448-Y477 HydrophobicContact CD1-CD1 3.48Å; Y448-Y477 VanDerWaalsContact CD1-CD1 3.48Å; Y448-Y477 AromaticContact CD1-CE1 3.84Å; Y448-Y477 HydrophobicContact CD1-CE1 3.84Å; Y448-Y477 HydrophobicContact CD2-CD1 4.34Å; Y448-Y477 AromaticContact CE1-CD1 3.5Å; Y448-Y477 HydrophobicContact CE1-CD1 3.5Å; Y448-Y477 VanDerWaalsContact CE1-CD1 3.5Å; Y448-Y477 AromaticContact CE1-CE1 3.85Å; Y448-Y477 HydrophobicContact CE1-CE1 3.85Å; Y448-Y477 HydrophobicContact CE2-CD1 4.38Å; Y448-Y477 AromaticContact CG-CD1 3.92Å; Y448-Y477 HydrophobicContact CG-CD1 3.92Å; Y448-Y477 AromaticContact CZ-CD1 3.97Å; V451-Y477 HydrophobicContact CG1-CE1 4.38Å; F452-Y477 AromaticContact CE2-CD1 3.77Å; F452-Y477 HydrophobicContact CE2-CD1 3.77Å; F452-Y477 HydrophobicContact CE2-CD2 4.22Å; F452-Y477 HydrophobicContact CE2-CE1 4.42Å; F452-Y477 AromaticContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CZ-CD1 4.32Å; F452-Y477 HydrophobicContact CZ-CD2 4.01Å; F452-Y477 AromaticContact CZ-CG 3.92Å; F452-Y477 HydrophobicContact CZ-CG 3.92Å; V469-Y477 HydrophobicContact CG1-CE2 4.03Å; Q474-Y477 HydrophobicContact CB-CE2 4.3Å; Q474-Y477 VanDerWaalsContact CD-CE1 3.5Å; Q474-Y477 HydrophobicContact CG-CD1 4.5Å; Q474-Y477 HydrophobicContact CG-CD2 4.47Å; Q474-Y477 HydrophobicContact CG-CE1 4.1Å; Q474-Y477 HydrophobicContact CG-CE2 4.04Å; Y477-N496 CarbonylContact O-C 3.55Å; Y477-N496 WeakPolarHBondContact O-CA 3.23Å; Y477-I497 PolarHBondContact N-O 3.2Å; Y477-I497 PolarHBondContact O-N 2.91Å; Y477-V499 HydrophobicContact CD2-CG2 3.93Å; Y477-V499 HydrophobicContact CE2-CG2 3.6Å
478	T	95.9	Very high	93.2	Very high	73 Å²	73	52.8 Å²	52.8	45%	0.448	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.2	178.4	-63.1	0	0	0	0	109.2	V494 V495 N496	T478-V494 HydrophobicContact CG2-CG1 4.03Å; T478-V495 WeakPolarHBondContact CA-O 3.41Å; T478-N496 WeakPolarHBondContact CB-OD1 3.5Å; T478-N496 WeakPolarHBondContact CG2-OD1 3.32Å; T478-N496 PolarHBondContact OG1-OD1 2.83Å
479	F	95.8	Very high	93.2	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	169.7	178.5	56.2	-91.1	0	0	0	111	L445 N446 D447 Y448 F452 L463 V495 I497	L445-F479 HydrophobicContact CB-CD2 4.28Å; L445-F479 HydrophobicContact CB-CE2 4.45Å; L445-F479 HydrophobicContact CD2-CD2 4Å; L445-F479 HydrophobicContact CD2-CE2 3.42Å; L445-F479 VanDerWaalsContact CD2-CE2 3.42Å; L445-F479 HydrophobicContact CD2-CZ 3.85Å; L445-F479 HydrophobicContact CG-CD2 3.99Å; L445-F479 HydrophobicContact CG-CE2 3.69Å; N446-F479 WeakPolarHBondContact OD1-CB 3.29Å; D447-F479 HydrophobicContact CB-CB 4.15Å; Y448-F479 HydrophobicContact CD2-CB 4Å; Y448-F479 AromaticContact CD2-CD1 3.82Å; Y448-F479 HydrophobicContact CD2-CD1 3.82Å; Y448-F479 HydrophobicContact CD2-CG 4.29Å; F452-F479 AromaticContact CD2-CE1 3.8Å; F452-F479 HydrophobicContact CD2-CE1 3.8Å; F452-F479 HydrophobicContact CD2-CZ 4.31Å; F452-F479 HydrophobicContact CE2-CE1 4.17Å; L463-F479 HydrophobicContact CD1-CZ 4.07Å; F479-V495 HydrophobicContact CD2-CB 4.11Å; F479-V495 HydrophobicContact CD2-CG2 4.45Å; F479-V495 HydrophobicContact CE1-CB 4.48Å; F479-V495 HydrophobicContact CE1-CG1 4.31Å; F479-V495 HydrophobicContact CE2-CB 3.74Å; F479-V495 HydrophobicContact CE2-CG1 4Å; F479-V495 HydrophobicContact CE2-CG2 4.03Å; F479-V495 HydrophobicContact CZ-CB 3.96Å; F479-V495 HydrophobicContact CZ-CG1 3.75Å; F479-V495 PolarHBondContact N-O 2.99Å; F479-V495 PolarHBondContact O-N 3.06Å; F479-I497 HydrophobicContact CE1-CD1 3.74Å; F479-I497 HydrophobicContact CE1-CG1 4.29Å; F479-I497 HydrophobicContact CZ-CD1 3.94Å
480	L	96.3	Very high	93.2	Very high	60 Å²	60	54 Å²	54	31%	0.314	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.1	175.1	-55.9	175.5	0	0	0	110.1	N446 P492 V493 V494	N446-L480 HydrophobicContact CB-CB 4.34Å; N446-L480 PolarHBondContact N-O 2.87Å; N446-L480 WeakPolarHBondContact ND2-CB 3.48Å; N446-L480 WeakPolarHBondContact ND2-CG 3.15Å; N446-L480 PolarHBondContact OD1-N 2.84Å; N446-L480 PolarHBondContact OD1-O 2.71Å; L480-P492 HydrophobicContact CB-CB 4.13Å; L480-P492 HydrophobicContact CD1-CB 4.1Å; L480-V493 CarbonylContact C-O 3.55Å; L480-V493 VanDerWaalsContact CA-O 3.31Å; L480-V493 WeakPolarHBondContact CA-O 3.39Å; L480-V494 HydrophobicContact CD2-CB 4.25Å; L480-V494 HydrophobicContact CD2-CG2 3.55Å
481	I	95.1	Very high	93.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.1	170.4	-164.2	169	0	0	0	109.7	F395 I426 L443 F444 L445 V493 V495	F395-I481 HydrophobicContact CE1-CG1 4.47Å; F395-I481 HydrophobicContact CE1-CG2 3.87Å; F395-I481 HydrophobicContact CE2-CG2 4.23Å; F395-I481 WeakPolarHBondContact CE2-O 3.36Å; F395-I481 HydrophobicContact CZ-CB 4.31Å; F395-I481 HydrophobicContact CZ-CG1 4.1Å; F395-I481 HydrophobicContact CZ-CG2 3.66Å; I426-I481 HydrophobicContact CD1-CD1 4.14Å; I426-I481 HydrophobicContact CG2-CD1 4.36Å; L443-I481 HydrophobicContact CB-CD1 4.23Å; L443-I481 HydrophobicContact CB-CG1 4.38Å; L443-I481 HydrophobicContact CD1-CD1 4Å; F444-I481 WeakPolarHBondContact O-CA 3.26Å; L445-I481 HydrophobicContact CD1-CD1 4.26Å; L445-I481 HydrophobicContact CD1-CG1 4.37Å; I481-V493 HydrophobicContact CG2-CB 4.23Å; I481-V493 PolarHBondContact N-O 2.83Å; I481-V493 PolarHBondContact O-N 3.41Å; I481-V495 HydrophobicContact CB-CG2 4.11Å; I481-V495 HydrophobicContact CG2-CG2 3.69Å
482	T	95.1	Very high	93.1	Very high	20 Å²	20	61.8 Å²	61.8	12%	0.123	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.3	178.8	-57.8	0	0	0	0	109.1	L443 F444 E489	L443-T482 CarbonylContact C-O 3.51Å; L443-T482 WeakPolarHBondContact CA-O 3.16Å; F444-T482 PolarHBondContact N-O 2.76Å; F444-T482 PolarHBondContact O-N 2.85Å; T482-E489 HydrophobicContact CG2-CB 4.08Å; T482-E489 HydrophobicContact CG2-CG 4.47Å
483	A	94.7	Very high	93.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.9	174.9	0	0	0	0	0	111.1	P393 F395 A428 L441 L443 E489 S490	P393-A483 HydrophobicContact CB-CB 4.01Å; F395-A483 HydrophobicContact CE2-CB 4.16Å; F395-A483 HydrophobicContact CZ-CB 3.95Å; A428-A483 HydrophobicContact CB-CB 3.98Å; L441-A483 HydrophobicContact CD1-CB 4.25Å; L443-A483 HydrophobicContact CD2-CB 3.42Å; L443-A483 VanDerWaalsContact CD2-CB 3.42Å; A483-E489 CarbonylContact O-C 3.54Å; A483-E489 WeakPolarHBondContact O-CA 3.4Å; A483-S490 PolarHBondContact N-OG 3.11Å; A483-S490 PolarHBondContact O-N 2.89Å
484	F	93.5	Very high	93.4	Very high	53 Å²	53	54.4 Å²	54.4	23%	0.232	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.8	-179.2	179.4	-117.8	0	0	0	110.5	L441 H442 F444 G486 Q488 E489	L441-F484 WeakPolarHBondContact CA-O 3.43Å; H442-F484 PolarHBondContact N-O 2.62Å; H442-F484 PolarHBondContact O-N 2.93Å; F444-F484 HydrophobicContact CD2-CB 4.12Å; F444-F484 HydrophobicContact CE2-CB 3.6Å; F444-F484 HydrophobicContact CE2-CD1 4.06Å; F444-F484 HydrophobicContact CE2-CG 4.11Å; F484-G486 VanDerWaalsContact CZ-O 3.3Å; F484-G486 WeakPolarHBondContact CZ-O 3.19Å; F484-Q488 WeakPolarHBondContact CA-O 3.11Å; F484-Q488 WeakPolarHBondContact CD2-O 3.48Å; F484-E489 HydrophobicContact CB-CG 4.46Å; F484-E489 HydrophobicContact CD2-CG 3.62Å; F484-E489 HydrophobicContact CE2-CG 4.33Å; F484-E489 HydrophobicContact CG-CG 4.43Å
485	D	90.6	Very high	93.5	Very high	30 Å²	30	51.6 Å²	51.6	16%	0.16	28%	0.284	C	S	.	.			trans	-96.8	-3.9	-179	59.6	36.2	0	0	0	114.1	N389 P393 L441 V487 Q488	N389-D485 VanDerWaalsContact ND2-CG 3.29Å; N389-D485 PolarHBondContact ND2-OD1 2.77Å; P393-D485 WeakPolarHBondContact CD-OD2 3.49Å; P393-D485 HydrophobicContact CG-CB 3.76Å; P393-D485 WeakPolarHBondContact CG-OD2 3.43Å; L441-D485 HydrophobicContact CD2-CB 3.59Å; D485-V487 WeakPolarHBondContact OD1-CA 3.19Å; D485-V487 PolarHBondContact OD1-N 2.84Å; D485-Q488 PolarHBondContact N-O 2.83Å; D485-Q488 PolarHBondContact OD1-N 2.9Å
486	G	85.3	Confident	93.6	Very high	49 Å²	49	48.4 Å²	48.4	51%	0.505	27%	0.271	S	S	.	.	S	Bend	trans	109.8	-20.1	-173.3	0	0	0	0	0	114.4	F484	F484-G486 VanDerWaalsContact CZ-O 3.3Å; F484-G486 WeakPolarHBondContact CZ-O 3.19Å
487	V	86.3	Confident	93.7	Very high	104 Å²	104	45.2 Å²	45.2	63%	0.63	25%	0.252	S	S	*	.	S	Bend	trans	-124.7	-46.5	-178.6	-172.6	0	0	0	0	111	D485	D485-V487 WeakPolarHBondContact OD1-CA 3.19Å; D485-V487 PolarHBondContact OD1-N 2.84Å
488	Q	88.3	Confident	93.7	Very high	57 Å²	57	49.9 Å²	49.9	27%	0.266	27%	0.269	S	S	.	.			trans	-125.9	152.6	-173.1	-58	179.4	86.5	0	0	112.4	N389 N390 Q391 F484 D485	N389-Q488 PolarHBondContact OD1-NE2 2.74Å; N389-Q488 VanDerWaalsContact OD1-NE2 3.13Å; N390-Q488 PolarHBondContact O-NE2 3.23Å; Q391-Q488 VanDerWaalsContact C-NE2 3.29Å; Q391-Q488 PolarHBondContact O-NE2 2.65Å; F484-Q488 WeakPolarHBondContact CA-O 3.11Å; F484-Q488 WeakPolarHBondContact CD2-O 3.48Å; D485-Q488 PolarHBondContact N-O 2.83Å; D485-Q488 PolarHBondContact OD1-N 2.9Å
489	E	92.2	Very high	93.6	Very high	130 Å²	130	46.5 Å²	46.5	61%	0.607	25%	0.248	S	C	*	.	B	Isolated β-bridge	trans	-108.2	146.3	176.2	-69.3	-178.8	-162.9	0	0	110.7	T482 A483 F484	T482-E489 HydrophobicContact CG2-CB 4.08Å; T482-E489 HydrophobicContact CG2-CG 4.47Å; A483-E489 CarbonylContact O-C 3.54Å; A483-E489 WeakPolarHBondContact O-CA 3.4Å; F484-E489 HydrophobicContact CB-CG 4.46Å; F484-E489 HydrophobicContact CD2-CG 3.62Å; F484-E489 HydrophobicContact CE2-CG 4.33Å; F484-E489 HydrophobicContact CG-CG 4.43Å
490	S	94.2	Very high	93.5	Very high	7 Å²	7	48.5 Å²	48.5	5%	0.049	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-74.5	162.5	173.2	76.9	0	0	0	0	112.2	P393 F395 A483	P393-S490 VanDerWaalsContact O-CA 3.25Å; P393-S490 WeakPolarHBondContact O-CA 3.14Å; P393-S490 WeakPolarHBondContact O-CB 3.34Å; F395-S490 VanDerWaalsContact CE2-OG 3.28Å; F395-S490 WeakPolarHBondContact CE2-OG 3.35Å; A483-S490 PolarHBondContact N-OG 3.11Å; A483-S490 PolarHBondContact O-N 2.89Å
491	E	93.5	Very high	93.3	Very high	164 Å²	164	47 Å²	47	77%	0.766	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-60.4	134.3	160.6	-69.9	-62.9	137.5	0	0	110.1
492	P	94.9	Very high	93.1	Very high	66 Å²	66	47.6 Å²	47.6	43%	0.429	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-67.9	140.1	-179	-20.3	31.8	0	0	0	112.9	L480	L480-P492 HydrophobicContact CB-CB 4.13Å; L480-P492 HydrophobicContact CD1-CB 4.1Å
493	V	95.5	Very high	93	Very high	14 Å²	14	47.3 Å²	47.3	9%	0.085	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.2	178.6	167.7	0	0	0	0	111.8	F395 P398 Y400 L480 I481	F395-V493 HydrophobicContact CB-CG2 3.8Å; F395-V493 HydrophobicContact CD2-CB 3.93Å; F395-V493 HydrophobicContact CD2-CG2 3.5Å; F395-V493 HydrophobicContact CE2-CB 4.36Å; F395-V493 HydrophobicContact CE2-CG2 4.33Å; F395-V493 HydrophobicContact CG-CB 4.22Å; F395-V493 HydrophobicContact CG-CG2 3.84Å; P398-V493 WeakPolarHBondContact O-CG1 3.44Å; Y400-V493 HydrophobicContact CD2-CG1 3.77Å; Y400-V493 HydrophobicContact CE2-CG1 3.85Å; L480-V493 CarbonylContact C-O 3.55Å; L480-V493 VanDerWaalsContact CA-O 3.31Å; L480-V493 WeakPolarHBondContact CA-O 3.39Å; I481-V493 HydrophobicContact CG2-CB 4.23Å; I481-V493 PolarHBondContact N-O 2.83Å; I481-V493 PolarHBondContact O-N 3.41Å
494	V	96.3	Very high	92.9	Very high	55 Å²	55	50.5 Å²	50.5	33%	0.333	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.4	179.4	-177.6	0	0	0	0	111.4	S399 Y400 T478 L480	S399-V494 CarbonylContact C-O 3.59Å; S399-V494 VanDerWaalsContact CA-O 3.28Å; S399-V494 WeakPolarHBondContact CA-O 3.42Å; Y400-V494 PolarHBondContact N-O 3.03Å; T478-V494 HydrophobicContact CG2-CG1 4.03Å; L480-V494 HydrophobicContact CD2-CB 4.25Å; L480-V494 HydrophobicContact CD2-CG2 3.55Å
495	V	96.2	Very high	92.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.2	170.9	-174.9	0	0	0	0	109	Y400 L463 T478 F479 I481 I497	Y400-V495 HydrophobicContact CD2-CG2 4.27Å; Y400-V495 WeakPolarHBondContact O-CA 3.46Å; L463-V495 HydrophobicContact CD1-CG1 3.81Å; T478-V495 WeakPolarHBondContact CA-O 3.41Å; F479-V495 HydrophobicContact CD2-CB 4.11Å; F479-V495 HydrophobicContact CD2-CG2 4.45Å; F479-V495 HydrophobicContact CE1-CB 4.48Å; F479-V495 HydrophobicContact CE1-CG1 4.31Å; F479-V495 HydrophobicContact CE2-CB 3.74Å; F479-V495 HydrophobicContact CE2-CG1 4Å; F479-V495 HydrophobicContact CE2-CG2 4.03Å; F479-V495 HydrophobicContact CZ-CB 3.96Å; F479-V495 HydrophobicContact CZ-CG1 3.75Å; F479-V495 PolarHBondContact N-O 2.99Å; F479-V495 PolarHBondContact O-N 3.06Å; I481-V495 HydrophobicContact CB-CG2 4.11Å; I481-V495 HydrophobicContact CG2-CG2 3.69Å; V495-I497 HydrophobicContact CG1-CG1 4.19Å
496	N	96.2	Very high	93	Very high	45 Å²	45	51.3 Å²	51.3	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.9	177.3	-72.8	-40.7	0	0	0	109.9	Y400 Q401 G402 Y477 T478	Y400-N496 PolarHBondContact O-N 3.38Å; Q401-N496 CarbonylContact C-O 3.49Å; Q401-N496 WeakPolarHBondContact CA-O 3.21Å; Q401-N496 PolarHBondContact NE2-O 2.63Å; G402-N496 PolarHBondContact N-O 2.98Å; Y477-N496 CarbonylContact O-C 3.55Å; Y477-N496 WeakPolarHBondContact O-CA 3.23Å; T478-N496 WeakPolarHBondContact CB-OD1 3.5Å; T478-N496 WeakPolarHBondContact CG2-OD1 3.32Å; T478-N496 PolarHBondContact OG1-OD1 2.83Å
497	I	95.7	Very high	93.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.9	176.9	-55.6	177.2	0	0	0	108.6	G402 I404 I414 F452 L463 T476 Y477 F479 V495	G402-I497 WeakPolarHBondContact O-CA 3.47Å; I404-I497 HydrophobicContact CG2-CG2 3.93Å; I414-I497 HydrophobicContact CD1-CD1 4.18Å; I414-I497 HydrophobicContact CD1-CG2 4.21Å; I414-I497 HydrophobicContact CG1-CD1 4.1Å; I414-I497 HydrophobicContact CG2-CD1 4.46Å; I414-I497 HydrophobicContact CG2-CG1 4.39Å; I414-I497 HydrophobicContact CG2-CG2 4.28Å; F452-I497 HydrophobicContact CD1-CD1 3.9Å; F452-I497 HydrophobicContact CD2-CD1 4.07Å; F452-I497 HydrophobicContact CE1-CD1 3.67Å; F452-I497 HydrophobicContact CE1-CG2 4.5Å; F452-I497 HydrophobicContact CE2-CD1 3.86Å; F452-I497 HydrophobicContact CG-CD1 4.1Å; F452-I497 HydrophobicContact CZ-CD1 3.65Å; F452-I497 HydrophobicContact CZ-CG2 4.29Å; L463-I497 HydrophobicContact CD1-CD1 4.29Å; T476-I497 CarbonylContact C-O 3.52Å; T476-I497 WeakPolarHBondContact CA-O 3.45Å; Y477-I497 PolarHBondContact N-O 3.2Å; Y477-I497 PolarHBondContact O-N 2.91Å; F479-I497 HydrophobicContact CE1-CD1 3.74Å; F479-I497 HydrophobicContact CE1-CG1 4.29Å; F479-I497 HydrophobicContact CZ-CD1 3.94Å; V495-I497 HydrophobicContact CG1-CG1 4.19Å
498	R	95.5	Very high	93.8	Very high	115 Å²	115	47.9 Å²	47.9	43%	0.434	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.7	173	-175.8	174.4	178.5	179	-1.2	110.1	G402 Y403 I404 E538	G402-R498 PolarHBondContact O-N 3.17Å; Y403-R498 WeakPolarHBondContact CA-O 3.39Å; Y403-R498 HydrophobicContact CD1-CB 3.98Å; Y403-R498 HydrophobicContact CE1-CB 4.19Å; I404-R498 PolarHBondContact N-O 2.97Å; R498-E538 IonicContact NH2-OE1 2.58Å
499	V	95	Very high	94.1	Very high	2 Å²	2	46 Å²	46	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.1	172.5	-170.5	0	0	0	0	108.8	I404 E406 V469 R471 Q475 Y477	I404-V499 HydrophobicContact CG2-CG2 4.42Å; I404-V499 CarbonylContact O-C 3.58Å; I404-V499 WeakPolarHBondContact O-CA 3.5Å; E406-V499 HydrophobicContact CB-CG1 3.66Å; V469-V499 HydrophobicContact CB-CG2 4.45Å; V469-V499 HydrophobicContact CG2-CG1 4.32Å; V469-V499 HydrophobicContact CG2-CG2 4.49Å; R471-V499 HydrophobicContact CB-CB 4.29Å; R471-V499 HydrophobicContact CB-CG1 3.82Å; R471-V499 HydrophobicContact CG-CB 4.27Å; R471-V499 HydrophobicContact CG-CG1 4.26Å; Q475-V499 PolarHBondContact O-N 3.2Å; Y477-V499 HydrophobicContact CD2-CG2 3.93Å; Y477-V499 HydrophobicContact CE2-CG2 3.6Å
500	M	93	Very high	94.1	Very high	48 Å²	48	44.2 Å²	44.2	24%	0.236	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.3	178.7	-64.2	-178.8	59	0	0	109.8	I404 L405 E406 L418 L420	I404-M500 PolarHBondContact O-N 2.95Å; L405-M500 HydrophobicContact CD1-CB 3.97Å; E406-M500 PolarHBondContact N-O 2.88Å; L418-M500 WeakPolarHBondContact O-CE 3.26Å; L420-M500 HydrophobicContact CD1-SD 4.23Å; L420-M500 HydrophobicContact CD2-SD 3.83Å; L420-M500 HydrophobicContact CG-SD 4.06Å
501	D	93	Very high	94	Very high	27 Å²	27	49 Å²	49	14%	0.144	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-61.9	134.4	179.2	-171.9	88.2	0	0	0	113.1	L405 E406 R471 D537 E538 N541	L405-D501 WeakPolarHBondContact CD1-O 3.28Å; E406-D501 WeakPolarHBondContact OE1-CA 3.36Å; R471-D501 IonicContact CZ-OD1 2.65Å; R471-D501 IonicContact NE-OD1 3.52Å; R471-D501 PolarHBondContact NE-OD1 2.88Å; R471-D501 VanDerWaalsContact NE-OD1 3.16Å; R471-D501 IonicContact NH2-OD1 3.06Å; D501-D537 WeakPolarHBondContact OD1-CA 3.3Å; D501-E538 HydrophobicContact CB-CB 3.79Å; D501-E538 VanDerWaalsContact CG-N 3.31Å; D501-E538 PolarHBondContact OD1-N 2.87Å; D501-N541 WeakPolarHBondContact OD2-CB 3.19Å; D501-N541 PolarHBondContact OD2-ND2 2.93Å
502	A	91.2	Very high	93.8	Very high	14 Å²	14	48.4 Å²	48.4	12%	0.116	26%	0.261	C	S	.	.			trans	-119.7	142.8	163.8	0	0	0	0	0	107.6	L405 E406 D504	L405-A502 HydrophobicContact CD1-CB 4.34Å; L405-A502 HydrophobicContact CG-CB 4.3Å; E406-A502 HydrophobicContact CG-CB 3.77Å; E406-A502 PolarHBondContact OE1-N 3.18Å; A502-D504 VanDerWaalsContact C-N 3.29Å; A502-D504 PolarHBondContact O-N 3.08Å
503	N	92.9	Very high	93.7	Very high	14 Å²	14	47.6 Å²	47.6	8%	0.075	26%	0.258	C	S	.	.	S	Bend	trans	-68.7	89.2	176.6	-177.2	-29.8	0	0	0	110.1	N505 D537 N541 D587 A589 E593 R595	N503-N505 PolarHBondContact OD1-O 2.68Å; N503-D537 VanDerWaalsContact CA-OD2 3.29Å; N503-D537 WeakPolarHBondContact CA-OD2 3.2Å; N503-D537 PolarHBondContact OD1-OD2 2.58Å; N503-N541 HydrophobicContact CB-CB 4.02Å; N503-D587 PolarHBondContact ND2-OD2 2.86Å; N503-A589 WeakPolarHBondContact ND2-CB 3.36Å; N503-E593 PolarHBondContact ND2-O 2.89Å; N503-R595 PolarHBondContact O-NE 3.28Å; N503-R595 VanDerWaalsContact O-NE 3.08Å; N503-R595 PolarHBondContact O-NH2 3.1Å; N503-R595 WeakPolarHBondContact OD1-CD 3.48Å; N503-R595 WeakPolarHBondContact OD1-CG 3.23Å; N503-R595 PolarHBondContact OD1-NE 3.02Å; N503-R595 VanDerWaalsContact OD1-NE 3.11Å
504	D	91.6	Very high	93.6	Very high	66 Å²	66	48.3 Å²	48.3	35%	0.353	26%	0.259	S	S	.	.			trans	-123.9	-8.9	-178.7	84.9	-9.8	0	0	0	116.1	A502 D537 R595	A502-D504 VanDerWaalsContact C-N 3.29Å; A502-D504 PolarHBondContact O-N 3.08Å; D504-D537 PolarHBondContact N-OD2 2.97Å; D504-R595 VanDerWaalsContact CA-CZ 3.44Å; D504-R595 PolarHBondContact O-NH1 3.26Å
505	N	92.4	Very high	93.4	Very high	51 Å²	51	51.3 Å²	51.3	27%	0.273	27%	0.273	S	S	.	.	S	Bend	trans	-96.7	158.9	166.4	-62	-84	0	0	0	111.4	E472 N503 D535 A536 D537 R595	E472-N505 VanDerWaalsContact CD-ND2 3.31Å; E472-N505 PolarHBondContact OE2-ND2 3.49Å; N503-N505 PolarHBondContact OD1-O 2.68Å; N505-D535 WeakPolarHBondContact CB-OD1 3.47Å; N505-A536 HydrophobicContact CB-CB 4.17Å; N505-D537 WeakPolarHBondContact CB-OD1 3.4Å; N505-D537 PolarHBondContact N-OD1 3.06Å; N505-D537 PolarHBondContact N-OD2 3Å; N505-D537 PolarHBondContact ND2-OD1 3.2Å; N505-R595 WeakPolarHBondContact O-CD 3.41Å
506	T	93.5	Very high	93.1	Very high	49 Å²	49	52.2 Å²	52.2	30%	0.301	28%	0.278	S	S	.	.			trans	-121.6	136.8	-179.1	-61.7	0	0	0	0	108.6	T508 R595	T506-T508 PolarHBondContact O-N 3.25Å; T506-T508 PolarHBondContact O-OG1 2.69Å; T506-R595 HydrophobicContact CG2-CB 4.08Å; T506-R595 WeakPolarHBondContact OG1-CD 3.39Å
507	P	95.5	Very high	92.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.293	C	S	.	.			trans	-55.8	121.5	178.4	-19.2	25.7	0	0	0	109.3	A533 V534 D535 I544 A585 D587 S597	P507-A533 HydrophobicContact CB-CB 4.45Å; P507-V534 CarbonylContact C-O 3.59Å; P507-V534 WeakPolarHBondContact CA-O 3.46Å; P507-D535 HydrophobicContact CB-CB 4.4Å; P507-D535 WeakPolarHBondContact CD-OD2 3.21Å; P507-D535 HydrophobicContact CG-CB 4.43Å; P507-D535 WeakPolarHBondContact CG-OD2 3.08Å; P507-D535 VanDerWaalsContact N-OD2 3.16Å; P507-I544 HydrophobicContact CB-CD1 4.24Å; P507-I544 HydrophobicContact CB-CG1 4.18Å; P507-I544 HydrophobicContact CB-CG2 4.33Å; P507-A585 HydrophobicContact CB-CB 4.03Å; P507-D587 HydrophobicContact CG-CB 4.1Å; P507-S597 WeakPolarHBondContact O-CB 3.49Å; P507-S597 PolarHBondContact O-OG 2.7Å
508	T	93.7	Very high	92.4	Very high	82 Å²	82	56.7 Å²	56.7	50%	0.503	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-122.5	127.9	-170.3	-63.7	0	0	0	0	111.2	T506 A533 V534	T506-T508 PolarHBondContact O-N 3.25Å; T506-T508 PolarHBondContact O-OG1 2.69Å; T508-A533 CarbonylContact O-C 3.59Å; T508-A533 WeakPolarHBondContact O-CA 3.48Å; T508-V534 PolarHBondContact N-O 3.31Å; T508-V534 PolarHBondContact O-N 2.96Å
509	F	94.7	Very high	91.9	Very high	17 Å²	17	54.6 Å²	54.6	8%	0.075	29%	0.286	C	S	.	.			trans	-79.1	139.6	171.4	-65.4	-79.7	0	0	0	110.7	E511 L531 A533 Y546 V583 A585 S597 C599	F509-E511 VanDerWaalsContact C-N 3.31Å; F509-E511 WeakPolarHBondContact CB-O 3.47Å; F509-E511 PolarHBondContact O-N 3.49Å; F509-L531 HydrophobicContact CE1-CB 4.21Å; F509-A533 HydrophobicContact CD1-CB 3.97Å; F509-A533 HydrophobicContact CE1-CB 4.03Å; F509-A533 HydrophobicContact CG-CB 4.33Å; F509-A533 HydrophobicContact CZ-CB 4.44Å; F509-Y546 HydrophobicContact CE1-CD1 4.19Å; F509-Y546 AromaticContact CE1-CE1 3.92Å; F509-Y546 HydrophobicContact CE1-CE1 3.92Å; F509-Y546 HydrophobicContact CZ-CD1 4.28Å; F509-Y546 HydrophobicContact CZ-CE1 4.34Å; F509-V583 HydrophobicContact CZ-CG1 4.44Å; F509-A585 HydrophobicContact CD2-CB 4.5Å; F509-A585 HydrophobicContact CE1-CB 4.11Å; F509-A585 HydrophobicContact CE2-CB 3.59Å; F509-A585 HydrophobicContact CZ-CB 3.36Å; F509-S597 WeakPolarHBondContact CD2-OG 3.44Å; F509-C599 HydrophobicContact CB-CB 4.2Å; F509-C599 HydrophobicContact CD1-CB 4.34Å; F509-C599 HydrophobicContact CD2-CB 3.71Å; F509-C599 HydrophobicContact CE2-CB 4.1Å; F509-C599 HydrophobicContact CG-CB 3.83Å
510	P	91.8	Very high	91.4	Very high	93 Å²	93	56.7 Å²	56.7	60%	0.604	30%	0.298	S	S	*	.	S	Bend	trans	-58.6	-38.6	174.5	-26.7	33.9	0	0	0	113.8	T532	P510-T532 WeakPolarHBondContact CD-O 3.26Å
511	E	91.3	Very high	90.8	Very high	108 Å²	108	59 Å²	59	51%	0.505	31%	0.312	S	S	.	.			trans	-119.4	144.6	177.4	-57.8	176.6	-167.8	0	0	111.2	F509 S513 Y514	F509-E511 VanDerWaalsContact C-N 3.31Å; F509-E511 WeakPolarHBondContact CB-O 3.47Å; F509-E511 PolarHBondContact O-N 3.49Å; E511-S513 VanDerWaalsContact C-N 3.32Å; E511-Y514 HydrophobicContact CB-CD1 4.31Å; E511-Y514 HydrophobicContact CB-CE1 3.76Å; E511-Y514 HydrophobicContact CB-CE2 4.17Å; E511-Y514 HydrophobicContact CG-CE1 4.05Å; E511-Y514 PolarHBondContact N-OH 3.18Å; E511-Y514 WeakPolarHBondContact O-CE2 3.33Å; E511-Y514 WeakPolarHBondContact OE2-CD1 3.45Å
512	I	90.1	Very high	90.4	Very high	150 Å²	150	59.9 Å²	59.9	77%	0.769	32%	0.315	S	S	*	.	S	Bend	trans	-74.7	-28.5	179	-54.9	170	0	0	0	110.6	C599 T600	I512-C599 WeakPolarHBondContact O-CA 3.46Å; I512-T600 PolarHBondContact O-N 3.34Å
513	S	92.6	Very high	90.1	Very high	50 Å²	50	62.4 Å²	62.4	35%	0.35	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	146.1	177.7	55.7	0	0	0	0	112.1	E511 T600	E511-S513 VanDerWaalsContact C-N 3.32Å; S513-T600 CarbonylContact C-O 3.54Å; S513-T600 WeakPolarHBondContact CA-O 3.48Å; S513-T600 WeakPolarHBondContact CB-O 3.35Å
514	Y	93	Very high	89.7	Confident	28 Å²	28	65.2 Å²	65.2	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.8	177.4	-59.9	-90.9	0	0	0	109.8	E511 I529 L531 C599 T600 V601 Y602	E511-Y514 HydrophobicContact CB-CD1 4.31Å; E511-Y514 HydrophobicContact CB-CE1 3.76Å; E511-Y514 HydrophobicContact CB-CE2 4.17Å; E511-Y514 HydrophobicContact CG-CE1 4.05Å; E511-Y514 PolarHBondContact N-OH 3.18Å; E511-Y514 WeakPolarHBondContact O-CE2 3.33Å; E511-Y514 WeakPolarHBondContact OE2-CD1 3.45Å; Y514-I529 HydrophobicContact CD1-CD1 3.94Å; Y514-I529 HydrophobicContact CG-CD1 3.92Å; Y514-L531 HydrophobicContact CD2-CD2 3.58Å; Y514-L531 HydrophobicContact CE2-CD2 3.61Å; Y514-L531 HydrophobicContact CG-CD2 4.1Å; Y514-C599 HydrophobicContact CE2-CB 4.16Å; Y514-T600 PolarHBondContact N-O 2.97Å; Y514-V601 HydrophobicContact CD2-CG2 4.41Å; Y514-V601 CarbonylContact O-C 3.58Å; Y514-V601 WeakPolarHBondContact O-CA 3.37Å; Y514-Y602 PolarHBondContact O-N 2.85Å
515	D	92.4	Very high	89.4	Confident	118 Å²	118	64.3 Å²	64.3	63%	0.631	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	125.4	174.9	-66.8	-70.3	0	0	0	110.4	Y602	D515-Y602 WeakPolarHBondContact OD1-CB 3.26Å
516	V	90.8	Very high	89.1	Confident	19 Å²	19	65 Å²	65	12%	0.115	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.4	-174.3	-170.6	0	0	0	0	110.6	V528 I529 V601 Y602 I603 E604	V516-V528 HydrophobicContact CB-CG1 4.44Å; V516-V528 HydrophobicContact CG1-CG1 3.73Å; V516-I529 HydrophobicContact CG2-CB 3.97Å; V516-I529 HydrophobicContact CG2-CD1 3.59Å; V516-I529 HydrophobicContact CG2-CG1 4.32Å; V516-I529 HydrophobicContact CG2-CG2 4.25Å; V516-V601 HydrophobicContact CG2-CG1 3.88Å; V516-Y602 PolarHBondContact N-O 2.74Å; V516-I603 VanDerWaalsContact O-CA 3.3Å; V516-I603 WeakPolarHBondContact O-CA 3.45Å; V516-E604 PolarHBondContact O-N 3.39Å
517	Y	88.6	Confident	88.9	Confident	138 Å²	138	66.1 Å²	66.1	54%	0.541	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.2	172.7	-57.3	-70.7	0	0	0	110	E604 L606	Y517-E604 HydrophobicContact CD1-CB 4Å; Y517-E604 HydrophobicContact CE1-CB 4.26Å; Y517-E604 WeakPolarHBondContact CE1-OE2 3.45Å; Y517-L606 HydrophobicContact CD1-CD1 3.7Å; Y517-L606 HydrophobicContact CD1-CG 4.11Å; Y517-L606 HydrophobicContact CG-CD1 3.9Å
518	V	88.8	Confident	88.7	Confident	1 Å²	1	67 Å²	67	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.8	174	-64	0	0	0	0	109.7	M522 V528 L573 I603 E604 V605 L606	V518-M522 HydrophobicContact CB-SD 3.78Å; V518-M522 HydrophobicContact CG1-SD 4.12Å; V518-V528 HydrophobicContact CG1-CB 4.33Å; V518-V528 HydrophobicContact CG1-CG1 3.66Å; V518-V528 HydrophobicContact CG1-CG2 3.99Å; V518-L573 HydrophobicContact CB-CD1 4.12Å; V518-L573 HydrophobicContact CG2-CD1 3.88Å; V518-I603 HydrophobicContact CB-CG2 4.25Å; V518-I603 HydrophobicContact CG1-CG2 3.77Å; V518-I603 HydrophobicContact CG2-CG2 3.48Å; V518-I603 VanDerWaalsContact CG2-CG2 3.48Å; V518-E604 PolarHBondContact N-O 2.87Å; V518-V605 HydrophobicContact CG2-CB 4.24Å; V518-V605 HydrophobicContact CG2-CG1 4.48Å; V518-V605 HydrophobicContact CG2-CG2 3.73Å; V518-V605 CarbonylContact O-C 3.54Å; V518-V605 WeakPolarHBondContact O-CA 3.49Å; V518-L606 PolarHBondContact O-N 3.32Å
519	Y	84.9	Confident	88.7	Confident	72 Å²	72	64.7 Å²	64.7	28%	0.282	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.6	-176	-55.7	-81.6	0	0	0	111.4	D521 M522 L606 P607 N609	Y519-D521 WeakPolarHBondContact CB-OD1 3.29Å; Y519-D521 PolarHBondContact O-N 3.4Å; Y519-D521 VanDerWaalsContact O-N 3.15Å; Y519-M522 PolarHBondContact N-SD 3.47Å; Y519-M522 VanDerWaalsContact N-SD 3.36Å; Y519-M522 WeakPolarHBondContact O-CB 3.39Å; Y519-M522 WeakPolarHBondContact O-CG 3.41Å; Y519-M522 PolarHBondContact O-N 3.44Å; Y519-L606 WeakPolarHBondContact CA-O 3.27Å; Y519-L606 HydrophobicContact CD1-CB 3.84Å; Y519-L606 HydrophobicContact CE1-CB 3.97Å; Y519-L606 HydrophobicContact CE1-CD1 4.08Å; Y519-P607 WeakPolarHBondContact CD1-O 3.39Å; Y519-N609 HydrophobicContact CD1-CB 4.16Å; Y519-N609 HydrophobicContact CE1-CB 3.88Å
520	T	83.6	Confident	88.6	Confident	45 Å²	45	69.5 Å²	69.5	28%	0.276	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.8	-178.1	56.4	0	0	0	0	115.1	L573 V575 V605 L606 P608	T520-L573 HydrophobicContact CG2-CB 4.42Å; T520-L573 WeakPolarHBondContact CG2-O 3.37Å; T520-V575 HydrophobicContact CG2-CB 4.41Å; T520-V575 HydrophobicContact CG2-CG2 3.44Å; T520-V575 VanDerWaalsContact CG2-CG2 3.44Å; T520-V605 HydrophobicContact CG2-CG1 3.6Å; T520-L606 PolarHBondContact N-O 3.3Å; T520-L606 VanDerWaalsContact N-O 3.11Å; T520-P608 VanDerWaalsContact OG1-CD 3.23Å; T520-P608 WeakPolarHBondContact OG1-CD 3.28Å; T520-P608 WeakPolarHBondContact OG1-CG 3.25Å
521	D	81.3	Confident	88.7	Confident	98 Å²	98	65.1 Å²	65.1	52%	0.524	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.2	172.6	59.9	-31.2	0	0	0	113.6	Y519 P608	Y519-D521 WeakPolarHBondContact CB-OD1 3.29Å; Y519-D521 PolarHBondContact O-N 3.4Å; Y519-D521 VanDerWaalsContact O-N 3.15Å; D521-P608 HydrophobicContact CB-CB 4.07Å; D521-P608 HydrophobicContact CB-CG 4.05Å
522	M	83.9	Confident	88.8	Confident	44 Å²	44	63.5 Å²	63.5	22%	0.217	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-67.7	135.9	171.2	-64.6	178.4	71.4	0	0	110.9	V518 Y519 D526 S527 I567	V518-M522 HydrophobicContact CB-SD 3.78Å; V518-M522 HydrophobicContact CG1-SD 4.12Å; Y519-M522 PolarHBondContact N-SD 3.47Å; Y519-M522 VanDerWaalsContact N-SD 3.36Å; Y519-M522 WeakPolarHBondContact O-CB 3.39Å; Y519-M522 WeakPolarHBondContact O-CG 3.41Å; Y519-M522 PolarHBondContact O-N 3.44Å; M522-D526 WeakPolarHBondContact CA-OD2 3.48Å; M522-D526 HydrophobicContact CB-CB 4.27Å; M522-D526 HydrophobicContact CE-CB 3.83Å; M522-S527 WeakPolarHBondContact CE-O 3.38Å; M522-I567 HydrophobicContact CB-CD1 3.45Å; M522-I567 VanDerWaalsContact CB-CD1 3.45Å; M522-I567 HydrophobicContact CE-CD1 4.11Å; M522-I567 HydrophobicContact CG-CD1 4.48Å; M522-I567 HydrophobicContact SD-CD1 4.38Å
523	S	83.8	Confident	89	Confident	68 Å²	68	56.9 Å²	56.9	48%	0.476	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-86.3	152.6	-179.8	-66.5	0	0	0	0	112.1	G525 D526	S523-G525 PolarHBondContact O-N 2.98Å; S523-D526 PolarHBondContact N-OD2 3.14Å; S523-D526 WeakPolarHBondContact O-CB 3.42Å; S523-D526 PolarHBondContact O-N 2.8Å
524	P	85.2	Confident	89	Confident	72 Å²	72	59.2 Å²	59.2	47%	0.468	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	129.9	170.1	-25.4	34.2	0	0	0	111.6
525	G	84.9	Confident	89.1	Confident	47 Å²	47	58.9 Å²	58.9	49%	0.485	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-10.7	-172.1	0	0	0	0	0	115	S523 I567	S523-G525 PolarHBondContact O-N 2.98Å; G525-I567 PolarHBondContact N-O 3.36Å
526	D	87.4	Confident	89.2	Confident	65 Å²	65	55.6 Å²	55.6	35%	0.348	32%	0.321	S	S	.	.			trans	-64.1	143.3	173.5	-72.2	-5.2	0	0	0	110.7	M522 S523 S566 I567	M522-D526 WeakPolarHBondContact CA-OD2 3.48Å; M522-D526 HydrophobicContact CB-CB 4.27Å; M522-D526 HydrophobicContact CE-CB 3.83Å; S523-D526 PolarHBondContact N-OD2 3.14Å; S523-D526 WeakPolarHBondContact O-CB 3.42Å; S523-D526 PolarHBondContact O-N 2.8Å; D526-S566 VanDerWaalsContact O-CA 3.26Å; D526-S566 WeakPolarHBondContact O-CA 3.19Å; D526-S566 VanDerWaalsContact O-CB 3.31Å; D526-S566 WeakPolarHBondContact O-CB 3.07Å; D526-I567 HydrophobicContact CB-CD1 4.37Å; D526-I567 PolarHBondContact O-N 3.41Å; D526-I567 VanDerWaalsContact O-N 3.1Å
527	S	89.1	Confident	89.3	Confident	73 Å²	73	55.2 Å²	55.2	51%	0.51	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.9	-177.3	-62.2	0	0	0	0	110.7	M522	M522-S527 WeakPolarHBondContact CE-O 3.38Å
528	V	91.1	Very high	89.5	Confident	20 Å²	20	52.7 Å²	52.7	12%	0.121	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-58.7	178.6	176.3	0	0	0	0	109.9	V516 V518 F556 V565 I567 I603	V516-V528 HydrophobicContact CB-CG1 4.44Å; V516-V528 HydrophobicContact CG1-CG1 3.73Å; V518-V528 HydrophobicContact CG1-CB 4.33Å; V518-V528 HydrophobicContact CG1-CG1 3.66Å; V518-V528 HydrophobicContact CG1-CG2 3.99Å; V528-F556 HydrophobicContact CG2-CD1 3.96Å; V528-F556 HydrophobicContact CG2-CE1 3.89Å; V528-V565 HydrophobicContact CB-CB 4.48Å; V528-V565 HydrophobicContact CB-CG1 4.29Å; V528-V565 WeakPolarHBondContact CB-O 3.25Å; V528-V565 PolarHBondContact N-O 2.85Å; V528-I567 HydrophobicContact CG2-CG1 3.97Å; V528-I603 HydrophobicContact CG1-CD1 4.05Å; V528-I603 HydrophobicContact CG1-CG1 4.47Å
529	I	92.6	Very high	89.5	Confident	32 Å²	32	55.3 Å²	55.3	16%	0.164	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	149.4	178	-175	164.7	0	0	0	109	Y514 V516 L531 V565 V601	Y514-I529 HydrophobicContact CD1-CD1 3.94Å; Y514-I529 HydrophobicContact CG-CD1 3.92Å; V516-I529 HydrophobicContact CG2-CB 3.97Å; V516-I529 HydrophobicContact CG2-CD1 3.59Å; V516-I529 HydrophobicContact CG2-CG1 4.32Å; V516-I529 HydrophobicContact CG2-CG2 4.25Å; I529-L531 HydrophobicContact CD1-CD2 4.21Å; I529-L531 HydrophobicContact CG1-CD2 4.42Å; I529-L531 HydrophobicContact CG2-CG 4.48Å; I529-V565 HydrophobicContact CG2-CB 3.91Å; I529-V565 HydrophobicContact CG2-CG2 4Å; I529-V565 PolarHBondContact N-O 2.89Å; I529-V565 PolarHBondContact O-N 2.82Å; I529-V601 HydrophobicContact CG2-CG1 4.07Å
530	Q	93.5	Very high	89.8	Confident	119 Å²	119	54.7 Å²	54.7	56%	0.556	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	113.3	169.1	-174.7	166.9	10.1	0	0	109.1	T562 L564	Q530-T562 PolarHBondContact NE2-O 2.69Å; Q530-T562 VanDerWaalsContact NE2-O 3.12Å; Q530-L564 HydrophobicContact CB-CD1 4.07Å
531	L	94	Very high	90.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	34%	0.337	C	S	.	.			trans	-86.6	139.5	176.1	-62.6	172	0	0	0	109.4	F509 Y514 I529 I558 G563 V565 V583 V601	F509-L531 HydrophobicContact CE1-CB 4.21Å; Y514-L531 HydrophobicContact CD2-CD2 3.58Å; Y514-L531 HydrophobicContact CE2-CD2 3.61Å; Y514-L531 HydrophobicContact CG-CD2 4.1Å; I529-L531 HydrophobicContact CD1-CD2 4.21Å; I529-L531 HydrophobicContact CG1-CD2 4.42Å; I529-L531 HydrophobicContact CG2-CG 4.48Å; L531-I558 HydrophobicContact CD1-CD1 4.16Å; L531-G563 PolarHBondContact N-O 2.79Å; L531-G563 WeakPolarHBondContact O-CA 3.2Å; L531-V565 HydrophobicContact CD1-CG2 4.07Å; L531-V565 HydrophobicContact CG-CG2 4.46Å; L531-V583 HydrophobicContact CD1-CB 3.86Å; L531-V583 HydrophobicContact CD1-CG1 3.69Å; L531-V583 HydrophobicContact CD1-CG2 3.76Å; L531-V601 HydrophobicContact CD1-CG2 3.94Å; L531-V601 HydrophobicContact CD2-CG2 3.97Å; L531-V601 HydrophobicContact CG-CG2 4.48Å
532	T	93.6	Very high	90.7	Very high	75 Å²	75	49.7 Å²	49.7	46%	0.46	32%	0.321	S	S	.	.			trans	-131.8	119.4	175.7	55.8	0	0	0	0	108.7	P510	P510-T532 WeakPolarHBondContact CD-O 3.26Å
533	A	93.7	Very high	91.2	Very high	11 Å²	11	53 Å²	53	9%	0.091	34%	0.336	C	S	.	.			trans	-101.3	157.6	165.3	0	0	0	0	0	109.3	P507 T508 F509 I544 Y546 A585	P507-A533 HydrophobicContact CB-CB 4.45Å; T508-A533 CarbonylContact O-C 3.59Å; T508-A533 WeakPolarHBondContact O-CA 3.48Å; F509-A533 HydrophobicContact CD1-CB 3.97Å; F509-A533 HydrophobicContact CE1-CB 4.03Å; F509-A533 HydrophobicContact CG-CB 4.33Å; F509-A533 HydrophobicContact CZ-CB 4.44Å; A533-I544 VanDerWaalsContact C-CD1 3.45Å; A533-I544 HydrophobicContact CB-CD1 3.97Å; A533-I544 HydrophobicContact CB-CG2 4.33Å; A533-I544 WeakPolarHBondContact O-CD1 3.36Å; A533-Y546 HydrophobicContact CB-CE1 4.03Å; A533-Y546 PolarHBondContact N-OH 3.2Å; A533-A585 HydrophobicContact CB-CB 3.62Å
534	V	93.5	Very high	91.7	Very high	99 Å²	99	51 Å²	51	60%	0.6	32%	0.32	S	S	*	.	B	Isolated β-bridge	trans	-122.3	134.8	177.7	-177.4	0	0	0	0	108.7	P507 T508	P507-V534 CarbonylContact C-O 3.59Å; P507-V534 WeakPolarHBondContact CA-O 3.46Å; T508-V534 PolarHBondContact N-O 3.31Å; T508-V534 PolarHBondContact O-N 2.96Å
535	D	94.9	Very high	92.1	Very high	21 Å²	21	49.4 Å²	49.4	11%	0.112	31%	0.311	C	S	.	.			trans	-131.4	134.9	172.8	-158.2	-28.6	0	0	0	107.6	N505 P507 D537 I544	N505-D535 WeakPolarHBondContact CB-OD1 3.47Å; P507-D535 HydrophobicContact CB-CB 4.4Å; P507-D535 WeakPolarHBondContact CD-OD2 3.21Å; P507-D535 HydrophobicContact CG-CB 4.43Å; P507-D535 WeakPolarHBondContact CG-OD2 3.08Å; P507-D535 VanDerWaalsContact N-OD2 3.16Å; D535-D537 PolarHBondContact OD1-N 3.47Å; D535-I544 HydrophobicContact CB-CD1 3.98Å; D535-I544 HydrophobicContact CB-CG1 4.02Å
536	A	93.1	Very high	92.6	Very high	48 Å²	48	48 Å²	48	40%	0.397	29%	0.291	S	S	.	.			trans	-91.8	-16.4	-171.4	0	0	0	0	0	112.9	R471 E472 N505	R471-A536 PolarHBondContact NH2-O 3.24Å; E472-A536 HydrophobicContact CG-CB 3.65Å; N505-A536 HydrophobicContact CB-CB 4.17Å
537	D	94.5	Very high	93	Very high	11 Å²	11	50 Å²	50	6%	0.059	30%	0.298	C	S	.	.	S	Bend	trans	-64.2	162	-179	-62.9	-13.4	0	0	0	112.7	D501 N503 D504 N505 D535 N541 G542	D501-D537 WeakPolarHBondContact OD1-CA 3.3Å; N503-D537 VanDerWaalsContact CA-OD2 3.29Å; N503-D537 WeakPolarHBondContact CA-OD2 3.2Å; N503-D537 PolarHBondContact OD1-OD2 2.58Å; D504-D537 PolarHBondContact N-OD2 2.97Å; N505-D537 WeakPolarHBondContact CB-OD1 3.4Å; N505-D537 PolarHBondContact N-OD1 3.06Å; N505-D537 PolarHBondContact N-OD2 3Å; N505-D537 PolarHBondContact ND2-OD1 3.2Å; D535-D537 PolarHBondContact OD1-N 3.47Å; D537-N541 HydrophobicContact CB-CB 3.53Å; D537-G542 VanDerWaalsContact O-CA 3.29Å; D537-G542 WeakPolarHBondContact O-CA 3.38Å
538	E	91.4	Very high	93.2	Very high	85 Å²	85	48.1 Å²	48.1	40%	0.397	28%	0.282	S	S	.	.			trans	-90.1	146	-179.5	-162	174.9	160.1	0	0	113.2	R471 R498 D501 S540 N541	R471-E538 IonicContact NH1-OE2 3.39Å; R471-E538 PolarHBondContact NH1-OE2 3.22Å; R471-E538 VanDerWaalsContact NH1-OE2 3.17Å; R498-E538 IonicContact NH2-OE1 2.58Å; D501-E538 HydrophobicContact CB-CB 3.79Å; D501-E538 VanDerWaalsContact CG-N 3.31Å; D501-E538 PolarHBondContact OD1-N 2.87Å; E538-S540 PolarHBondContact O-N 3.06Å; E538-N541 PolarHBondContact O-N 3.33Å
539	G	90.4	Very high	93.3	Very high	56 Å²	56	50.8 Å²	50.8	58%	0.577	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	-129.4	169.7	0	0	0	0	0	112.9	N541 G542 E543	G539-N541 PolarHBondContact O-N 3.21Å; G539-G542 PolarHBondContact O-N 2.77Å; G539-E543 WeakPolarHBondContact O-CB 3.44Å; G539-E543 PolarHBondContact O-N 3.25Å; G539-E543 VanDerWaalsContact O-N 3.11Å
540	S	91.1	Very high	93.1	Very high	59 Å²	59	54.1 Å²	54.1	41%	0.413	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.6	-179.4	53.5	0	0	0	0	113.7	E538 N588 A589	E538-S540 PolarHBondContact O-N 3.06Å; S540-N588 CarbonylContact O-C 3.55Å; S540-N588 VanDerWaalsContact O-CA 3.3Å; S540-N588 WeakPolarHBondContact O-CA 3.41Å; S540-N588 WeakPolarHBondContact O-CB 3.35Å; S540-N588 PolarHBondContact O-N 2.91Å; S540-A589 PolarHBondContact O-N 2.79Å
541	N	91.6	Very high	92.7	Very high	21 Å²	21	49.6 Å²	49.6	11%	0.112	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-31.9	179	-59.6	-15.8	0	0	0	110.5	D501 N503 D537 E538 G539 D587 A589	D501-N541 WeakPolarHBondContact OD2-CB 3.19Å; D501-N541 PolarHBondContact OD2-ND2 2.93Å; N503-N541 HydrophobicContact CB-CB 4.02Å; D537-N541 HydrophobicContact CB-CB 3.53Å; E538-N541 PolarHBondContact O-N 3.33Å; G539-N541 PolarHBondContact O-N 3.21Å; N541-D587 WeakPolarHBondContact O-CB 3.09Å; N541-A589 WeakPolarHBondContact OD1-CB 3.17Å
542	G	91.6	Very high	91.8	Very high	18 Å²	18	50 Å²	50	19%	0.186	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-3.4	172.7	0	0	0	0	0	115.9	D537 G539 I544	D537-G542 VanDerWaalsContact O-CA 3.29Å; D537-G542 WeakPolarHBondContact O-CA 3.38Å; G539-G542 PolarHBondContact O-N 2.77Å; G542-I544 PolarHBondContact O-N 3.16Å
543	E	93.3	Very high	91.1	Very high	112 Å²	112	53.3 Å²	53.3	52%	0.523	31%	0.314	S	S	.	.			trans	-83.3	111.5	-178.1	-168.9	-175	-160.5	0	0	111.3	G539 D587 N588	G539-E543 WeakPolarHBondContact O-CB 3.44Å; G539-E543 PolarHBondContact O-N 3.25Å; G539-E543 VanDerWaalsContact O-N 3.11Å; E543-D587 CarbonylContact O-C 3.58Å; E543-D587 WeakPolarHBondContact O-CA 3.36Å; E543-N588 HydrophobicContact CB-CB 4.28Å; E543-N588 WeakPolarHBondContact CG-ND2 3.39Å; E543-N588 VanDerWaalsContact O-CG 3.31Å; E543-N588 PolarHBondContact O-N 2.93Å; E543-N588 PolarHBondContact O-ND2 3.32Å; E543-N588 PolarHBondContact OE2-ND2 3.17Å
544	I	94.5	Very high	90.7	Very high	28 Å²	28	55.4 Å²	55.4	14%	0.144	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.5	-170.2	-53.3	172.5	0	0	0	112.2	P507 A533 D535 G542 Y546 A585 S586	P507-I544 HydrophobicContact CB-CD1 4.24Å; P507-I544 HydrophobicContact CB-CG1 4.18Å; P507-I544 HydrophobicContact CB-CG2 4.33Å; A533-I544 VanDerWaalsContact C-CD1 3.45Å; A533-I544 HydrophobicContact CB-CD1 3.97Å; A533-I544 HydrophobicContact CB-CG2 4.33Å; A533-I544 WeakPolarHBondContact O-CD1 3.36Å; D535-I544 HydrophobicContact CB-CD1 3.98Å; D535-I544 HydrophobicContact CB-CG1 4.02Å; G542-I544 PolarHBondContact O-N 3.16Å; I544-Y546 HydrophobicContact CG2-CE1 4.06Å; I544-Y546 HydrophobicContact CG2-CE2 4.1Å; I544-A585 HydrophobicContact CG2-CB 3.81Å; I544-S586 CarbonylContact C-O 3.57Å
545	S	94.9	Very high	90.5	Very high	38 Å²	38	52.2 Å²	52.2	27%	0.266	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.4	170.6	65.7	0	0	0	0	111.7	K560 A585 S586	S545-K560 WeakPolarHBondContact CA-O 2.95Å; S545-A585 WeakPolarHBondContact O-CA 3.45Å; S545-S586 PolarHBondContact N-O 3.11Å; S545-S586 PolarHBondContact O-N 3.16Å; S545-S586 PolarHBondContact OG-O 3.49Å; S545-S586 VanDerWaalsContact OG-O 3.06Å
546	Y	95.6	Very high	90.4	Very high	17 Å²	17	51.7 Å²	51.7	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140.7	-177.1	-56.5	-87.4	0	0	0	112.9	F509 A533 I544 I558 K560 G563 Q584 A585	F509-Y546 HydrophobicContact CE1-CD1 4.19Å; F509-Y546 AromaticContact CE1-CE1 3.92Å; F509-Y546 HydrophobicContact CE1-CE1 3.92Å; F509-Y546 HydrophobicContact CZ-CD1 4.28Å; F509-Y546 HydrophobicContact CZ-CE1 4.34Å; A533-Y546 HydrophobicContact CB-CE1 4.03Å; A533-Y546 PolarHBondContact N-OH 3.2Å; I544-Y546 HydrophobicContact CG2-CE1 4.06Å; I544-Y546 HydrophobicContact CG2-CE2 4.1Å; Y546-I558 HydrophobicContact CG-CD1 4.39Å; Y546-K560 WeakPolarHBondContact CD2-O 3.47Å; Y546-K560 PolarHBondContact N-O 2.85Å; Y546-G563 VanDerWaalsContact CD2-CA 3.5Å; Y546-Q584 WeakPolarHBondContact CA-O 3.26Å; Y546-A585 HydrophobicContact CD1-CB 4.1Å; Y546-A585 HydrophobicContact CE1-CB 4.06Å
547	E	94.6	Very high	90.3	Very high	106 Å²	106	52.8 Å²	52.8	50%	0.495	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	136.7	177.7	-177.7	168.6	-161.1	0	0	112.1	L549 V583 Q584	E547-L549 PolarHBondContact O-N 2.97Å; E547-V583 CarbonylContact O-C 3.51Å; E547-V583 WeakPolarHBondContact O-CA 3.25Å; E547-Q584 PolarHBondContact N-O 3.46Å; E547-Q584 PolarHBondContact O-N 3.34Å
548	I	93.8	Very high	90.3	Very high	35 Å²	35	53.2 Å²	53.2	18%	0.179	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	110.6	168.7	-63.5	162.2	0	0	0	107.6	F556 I558 V583	I548-F556 HydrophobicContact CD1-CB 4.4Å; I548-I558 HydrophobicContact CB-CG2 4.47Å; I548-I558 HydrophobicContact CD1-CB 3.82Å; I548-I558 HydrophobicContact CD1-CG2 3.96Å; I548-I558 HydrophobicContact CG1-CB 3.89Å; I548-I558 HydrophobicContact CG1-CG2 3.69Å; I548-V583 HydrophobicContact CG1-CG2 4.17Å
549	L	92.5	Very high	90.5	Very high	76 Å²	76	52.6 Å²	52.6	40%	0.398	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-48.4	179.1	-64.2	179.2	0	0	0	111.7	E547 T582 Q584 I598	E547-L549 PolarHBondContact O-N 2.97Å; L549-T582 HydrophobicContact CD1-CG2 4.36Å; L549-T582 PolarHBondContact N-O 2.94Å; L549-Q584 HydrophobicContact CD1-CB 3.91Å; L549-Q584 HydrophobicContact CD2-CB 4.18Å; L549-Q584 HydrophobicContact CG-CB 3.88Å; L549-I598 HydrophobicContact CD1-CG2 4.08Å
550	V	90.1	Very high	90.6	Very high	101 Å²	101	56.8 Å²	56.8	61%	0.612	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.6	-172.7	-173	0	0	0	0	110	T582	V550-T582 PolarHBondContact O-N 3.45Å
551	G	83.2	Confident	90.7	Very high	25 Å²	25	59.1 Å²	59.1	26%	0.258	33%	0.33	S	S	.	.	S	Bend	trans	98	-15.7	166.3	0	0	0	0	0	115.9	K553 A580 L581	G551-K553 PolarHBondContact O-N 2.95Å; G551-A580 VanDerWaalsContact CA-O 3.31Å; G551-A580 WeakPolarHBondContact CA-O 3.28Å; G551-L581 VanDerWaalsContact C-CD2 3.43Å; G551-L581 WeakPolarHBondContact O-CD2 3.34Å
552	G	75.5	Confident	90.7	Very high	7 Å²	7	60.8 Å²	60.8	7%	0.072	34%	0.342	C	S	.	.			trans	-74.5	-18.4	-178.1	0	0	0	0	0	116.3	G554 D555	G552-G554 PolarHBondContact O-N 2.8Å; G552-D555 WeakPolarHBondContact O-CB 3.21Å; G552-D555 PolarHBondContact O-N 3.29Å
553	K	79.6	Confident	90.7	Very high	145 Å²	145	60 Å²	60	63%	0.63	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	9.5	-175.2	-60	-177.5	-170.4	158.5	0	116.1	G551 D555 Y579	G551-K553 PolarHBondContact O-N 2.95Å; K553-D555 VanDerWaalsContact C-N 3.34Å; K553-Y579 HydrophobicContact CB-CE1 4.3Å; K553-Y579 HydrophobicContact CD-CD1 4.25Å; K553-Y579 HydrophobicContact CD-CE1 3.9Å; K553-Y579 HydrophobicContact CG-CD1 4.45Å; K553-Y579 HydrophobicContact CG-CE1 4.33Å
554	G	84.2	Confident	90.8	Very high	56 Å²	56	56.9 Å²	56.9	58%	0.577	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	-0	-170.1	0	0	0	0	0	114.4	G552 A568	G552-G554 PolarHBondContact O-N 2.8Å; G554-A568 WeakPolarHBondContact O-CB 3.37Å
555	D	89.6	Confident	90.7	Very high	31 Å²	31	55.5 Å²	55.5	17%	0.166	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-18.8	-176	-64.1	-19.5	0	0	0	113.3	G552 K553 A568 V571 Y579	G552-D555 WeakPolarHBondContact O-CB 3.21Å; G552-D555 PolarHBondContact O-N 3.29Å; K553-D555 VanDerWaalsContact C-N 3.34Å; D555-A568 WeakPolarHBondContact O-CB 3.42Å; D555-A568 PolarHBondContact O-N 2.79Å; D555-V571 HydrophobicContact CB-CG1 3.84Å; D555-V571 WeakPolarHBondContact OD1-CG1 3.29Å; D555-Y579 HydrophobicContact CB-CE1 3.96Å; D555-Y579 WeakPolarHBondContact OD2-CE1 2.87Å; D555-Y579 PolarHBondContact OD2-OH 3.16Å
556	F	92.9	Very high	90.6	Very high	10 Å²	10	55 Å²	55	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.8	-179.4	-57	-81	0	0	0	111.4	V528 I548 V565 S566 L573 Y579 L581 I603	V528-F556 HydrophobicContact CG2-CD1 3.96Å; V528-F556 HydrophobicContact CG2-CE1 3.89Å; I548-F556 HydrophobicContact CD1-CB 4.4Å; F556-V565 HydrophobicContact CB-CG1 4.05Å; F556-V565 HydrophobicContact CD1-CG1 4.31Å; F556-V565 HydrophobicContact CG-CG1 4.5Å; F556-S566 WeakPolarHBondContact CA-O 3.2Å; F556-L573 HydrophobicContact CZ-CD2 4.31Å; F556-Y579 HydrophobicContact CD2-CD1 4.27Å; F556-Y579 HydrophobicContact CD2-CG 4.4Å; F556-Y579 AromaticContact CE2-CD1 3.65Å; F556-Y579 HydrophobicContact CE2-CD1 3.65Å; F556-Y579 AromaticContact CE2-CD2 3.61Å; F556-Y579 HydrophobicContact CE2-CD2 3.61Å; F556-Y579 AromaticContact CE2-CE1 3.85Å; F556-Y579 HydrophobicContact CE2-CE1 3.85Å; F556-Y579 AromaticContact CE2-CE2 3.85Å; F556-Y579 HydrophobicContact CE2-CE2 3.85Å; F556-Y579 AromaticContact CE2-CG 3.51Å; F556-Y579 HydrophobicContact CE2-CG 3.51Å; F556-Y579 AromaticContact CE2-CZ 3.96Å; F556-Y579 AromaticContact CZ-CD2 3.96Å; F556-Y579 HydrophobicContact CZ-CD2 3.96Å; F556-Y579 HydrophobicContact CZ-CE2 4.1Å; F556-Y579 HydrophobicContact CZ-CG 4.29Å; F556-L581 HydrophobicContact CB-CD1 4.04Å; F556-L581 HydrophobicContact CD2-CD1 4.26Å; F556-L581 HydrophobicContact CD2-CD2 3.96Å; F556-L581 HydrophobicContact CG-CD1 4.11Å; F556-I603 HydrophobicContact CD1-CD1 3.99Å; F556-I603 HydrophobicContact CD2-CD1 4.14Å; F556-I603 HydrophobicContact CE1-CD1 3.73Å; F556-I603 HydrophobicContact CE1-CG2 4.36Å; F556-I603 HydrophobicContact CE2-CD1 3.9Å; F556-I603 HydrophobicContact CG-CD1 4.19Å; F556-I603 HydrophobicContact CZ-CB 4.45Å; F556-I603 HydrophobicContact CZ-CD1 3.68Å; F556-I603 HydrophobicContact CZ-CG2 3.91Å
557	V	92.5	Very high	90.4	Very high	71 Å²	71	54.3 Å²	54.3	43%	0.43	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.6	174.1	-178.9	0	0	0	0	108.5	V565 S566 A568	V557-V565 CarbonylContact O-C 3.57Å; V557-V565 WeakPolarHBondContact O-CA 2.99Å; V557-S566 PolarHBondContact N-O 3.14Å; V557-S566 PolarHBondContact O-N 3.48Å; V557-A568 HydrophobicContact CG2-CB 3.75Å
558	I	94.4	Very high	90.2	Very high	21 Å²	21	49.5 Å²	49.5	11%	0.108	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137	173	-167.3	162.5	0	0	0	110.8	L531 Y546 I548 K560 L564 V565 V583	L531-I558 HydrophobicContact CD1-CD1 4.16Å; Y546-I558 HydrophobicContact CG-CD1 4.39Å; I548-I558 HydrophobicContact CB-CG2 4.47Å; I548-I558 HydrophobicContact CD1-CB 3.82Å; I548-I558 HydrophobicContact CD1-CG2 3.96Å; I548-I558 HydrophobicContact CG1-CB 3.89Å; I548-I558 HydrophobicContact CG1-CG2 3.69Å; I558-K560 PolarHBondContact O-N 2.82Å; I558-L564 CarbonylContact C-O 3.57Å; I558-L564 WeakPolarHBondContact CA-O 3.44Å; I558-V565 HydrophobicContact CB-CG2 4.37Å; I558-V565 HydrophobicContact CD1-CG2 3.92Å; I558-V565 HydrophobicContact CG1-CG2 4.08Å; I558-V583 HydrophobicContact CD1-CG1 3.52Å
559	N	94.1	Very high	89.9	Confident	71 Å²	71	53.4 Å²	53.4	38%	0.38	31%	0.312	S	S	.	.			trans	-76.1	120.9	168.7	-175	-40.6	0	0	0	109.8	T561 T562 G563 L564	N559-T561 PolarHBondContact O-N 2.83Å; N559-T561 PolarHBondContact OD1-N 3Å; N559-T561 PolarHBondContact OD1-OG1 2.95Å; N559-T561 VanDerWaalsContact OD1-OG1 3.11Å; N559-T562 VanDerWaalsContact CB-OG1 3.24Å; N559-T562 WeakPolarHBondContact CB-OG1 3.46Å; N559-T562 PolarHBondContact ND2-OG1 3.29Å; N559-T562 PolarHBondContact OD1-N 3.02Å; N559-G563 PolarHBondContact O-N 3.34Å; N559-L564 HydrophobicContact CB-CB 4.27Å; N559-L564 PolarHBondContact N-O 3.11Å
560	K	93.8	Very high	89.4	Confident	144 Å²	144	53.4 Å²	53.4	63%	0.626	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.1	-174.9	-68.1	-167.8	173.3	-163.6	0	114.8	S545 Y546 I558	S545-K560 WeakPolarHBondContact CA-O 2.95Å; Y546-K560 WeakPolarHBondContact CD2-O 3.47Å; Y546-K560 PolarHBondContact N-O 2.85Å; I558-K560 PolarHBondContact O-N 2.82Å
561	T	91.9	Very high	89.1	Confident	108 Å²	108	49.9 Å²	49.9	66%	0.663	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-34.8	-176.8	56	0	0	0	0	112.7	N559	N559-T561 PolarHBondContact O-N 2.83Å; N559-T561 PolarHBondContact OD1-N 3Å; N559-T561 PolarHBondContact OD1-OG1 2.95Å; N559-T561 VanDerWaalsContact OD1-OG1 3.11Å
562	T	91.8	Very high	89	Confident	57 Å²	57	57.1 Å²	57.1	35%	0.35	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.2	-175.6	72.3	0	0	0	0	114.2	Q530 N559 L564	Q530-T562 PolarHBondContact NE2-O 2.69Å; Q530-T562 VanDerWaalsContact NE2-O 3.12Å; N559-T562 VanDerWaalsContact CB-OG1 3.24Å; N559-T562 WeakPolarHBondContact CB-OG1 3.46Å; N559-T562 PolarHBondContact ND2-OG1 3.29Å; N559-T562 PolarHBondContact OD1-N 3.02Å; T562-L564 PolarHBondContact O-N 3.23Å; T562-L564 WeakPolarHBondContact OG1-CB 3.46Å; T562-L564 PolarHBondContact OG1-N 3.28Å
563	G	92.4	Very high	89.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.338	C	S	.	.			trans	66.5	11.1	-175.7	0	0	0	0	0	114.3	L531 Y546 N559 V565	L531-G563 PolarHBondContact N-O 2.79Å; L531-G563 WeakPolarHBondContact O-CA 3.2Å; Y546-G563 VanDerWaalsContact CD2-CA 3.5Å; N559-G563 PolarHBondContact O-N 3.34Å; G563-V565 PolarHBondContact O-N 2.93Å
564	L	94.5	Very high	89.6	Confident	47 Å²	47	55.7 Å²	55.7	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	117	-178.3	-176.6	68.3	0	0	0	110.5	Q530 I558 N559 T562	Q530-L564 HydrophobicContact CB-CD1 4.07Å; I558-L564 CarbonylContact C-O 3.57Å; I558-L564 WeakPolarHBondContact CA-O 3.44Å; N559-L564 HydrophobicContact CB-CB 4.27Å; N559-L564 PolarHBondContact N-O 3.11Å; T562-L564 PolarHBondContact O-N 3.23Å; T562-L564 WeakPolarHBondContact OG1-CB 3.46Å; T562-L564 PolarHBondContact OG1-N 3.28Å
565	V	93.5	Very high	89.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.8	170.6	-176.7	0	0	0	0	108.6	V528 I529 L531 F556 V557 I558 G563 L581	V528-V565 HydrophobicContact CB-CB 4.48Å; V528-V565 HydrophobicContact CB-CG1 4.29Å; V528-V565 WeakPolarHBondContact CB-O 3.25Å; V528-V565 PolarHBondContact N-O 2.85Å; I529-V565 HydrophobicContact CG2-CB 3.91Å; I529-V565 HydrophobicContact CG2-CG2 4Å; I529-V565 PolarHBondContact N-O 2.89Å; I529-V565 PolarHBondContact O-N 2.82Å; L531-V565 HydrophobicContact CD1-CG2 4.07Å; L531-V565 HydrophobicContact CG-CG2 4.46Å; F556-V565 HydrophobicContact CB-CG1 4.05Å; F556-V565 HydrophobicContact CD1-CG1 4.31Å; F556-V565 HydrophobicContact CG-CG1 4.5Å; V557-V565 CarbonylContact O-C 3.57Å; V557-V565 WeakPolarHBondContact O-CA 2.99Å; I558-V565 HydrophobicContact CB-CG2 4.37Å; I558-V565 HydrophobicContact CD1-CG2 3.92Å; I558-V565 HydrophobicContact CG1-CG2 4.08Å; G563-V565 PolarHBondContact O-N 2.93Å; V565-L581 HydrophobicContact CG1-CD1 3.98Å
566	S	92.9	Very high	88.9	Confident	27 Å²	27	58 Å²	58	19%	0.189	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	161.2	178.9	61.3	0	0	0	0	112.1	D526 F556 V557 A568	D526-S566 VanDerWaalsContact O-CA 3.26Å; D526-S566 WeakPolarHBondContact O-CA 3.19Å; D526-S566 VanDerWaalsContact O-CB 3.31Å; D526-S566 WeakPolarHBondContact O-CB 3.07Å; F556-S566 WeakPolarHBondContact CA-O 3.2Å; V557-S566 PolarHBondContact N-O 3.14Å; V557-S566 PolarHBondContact O-N 3.48Å; S566-A568 PolarHBondContact O-N 2.83Å
567	I	91.4	Very high	88.6	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.5	176.3	-58.7	171.1	0	0	0	109.2	M522 G525 D526 V528 V571 L573	M522-I567 HydrophobicContact CB-CD1 3.45Å; M522-I567 VanDerWaalsContact CB-CD1 3.45Å; M522-I567 HydrophobicContact CE-CD1 4.11Å; M522-I567 HydrophobicContact CG-CD1 4.48Å; M522-I567 HydrophobicContact SD-CD1 4.38Å; G525-I567 PolarHBondContact N-O 3.36Å; D526-I567 HydrophobicContact CB-CD1 4.37Å; D526-I567 PolarHBondContact O-N 3.41Å; D526-I567 VanDerWaalsContact O-N 3.1Å; V528-I567 HydrophobicContact CG2-CG1 3.97Å; I567-V571 HydrophobicContact CG2-CB 4.33Å; I567-L573 HydrophobicContact CD1-CD1 3.61Å; I567-L573 HydrophobicContact CD1-CG 4.39Å; I567-L573 HydrophobicContact CG1-CD1 4.31Å
568	A	90.7	Very high	88.4	Confident	6 Å²	6	61.6 Å²	61.6	5%	0.05	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-64.4	147	-176.9	0	0	0	0	0	112.2	G554 D555 V557 S566 G570 V571	G554-A568 WeakPolarHBondContact O-CB 3.37Å; D555-A568 WeakPolarHBondContact O-CB 3.42Å; D555-A568 PolarHBondContact O-N 2.79Å; V557-A568 HydrophobicContact CG2-CB 3.75Å; S566-A568 PolarHBondContact O-N 2.83Å; A568-G570 PolarHBondContact O-N 2.55Å; A568-V571 HydrophobicContact CB-CG2 3.87Å; A568-V571 WeakPolarHBondContact O-CB 3.44Å; A568-V571 PolarHBondContact O-N 2.9Å
569	P	86.1	Confident	88.3	Confident	116 Å²	116	61.1 Å²	61.1	75%	0.753	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	127.5	177	-24.4	33.8	0	0	0	112.6
570	G	82	Confident	88.2	Confident	77 Å²	77	59.8 Å²	59.8	79%	0.794	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	13.7	175.3	0	0	0	0	0	115.4	A568	A568-G570 PolarHBondContact O-N 2.55Å
571	V	83.9	Confident	88.2	Confident	27 Å²	27	53 Å²	53	16%	0.164	33%	0.334	C	S	.	.			trans	-99.4	137.3	179.3	174.1	0	0	0	0	110.7	D555 I567 A568	D555-V571 HydrophobicContact CB-CG1 3.84Å; D555-V571 WeakPolarHBondContact OD1-CG1 3.29Å; I567-V571 HydrophobicContact CG2-CB 4.33Å; A568-V571 HydrophobicContact CB-CG2 3.87Å; A568-V571 WeakPolarHBondContact O-CB 3.44Å; A568-V571 PolarHBondContact O-N 2.9Å
572	E	81.5	Confident	88.4	Confident	177 Å²	177	49.7 Å²	49.7	83%	0.827	31%	0.314	S	S	*	.			trans	-111.6	120.2	172.4	-71.1	-178.5	178.8	0	0	108.8
573	L	84	Confident	88.5	Confident	17 Å²	17	47 Å²	47	9%	0.089	30%	0.297	C	S	.	.			trans	-75.2	136.8	179.6	-64.1	178.3	0	0	0	110.8	V518 T520 F556 I567 V605	V518-L573 HydrophobicContact CB-CD1 4.12Å; V518-L573 HydrophobicContact CG2-CD1 3.88Å; T520-L573 HydrophobicContact CG2-CB 4.42Å; T520-L573 WeakPolarHBondContact CG2-O 3.37Å; F556-L573 HydrophobicContact CZ-CD2 4.31Å; I567-L573 HydrophobicContact CD1-CD1 3.61Å; I567-L573 HydrophobicContact CD1-CG 4.39Å; I567-L573 HydrophobicContact CG1-CD1 4.31Å; L573-V605 HydrophobicContact CB-CG1 3.85Å; L573-V605 HydrophobicContact CD2-CG2 4.39Å
574	I	83.3	Confident	88.6	Confident	104 Å²	104	48.5 Å²	48.5	53%	0.533	31%	0.305	S	S	.	.			trans	-111.8	124.8	-178.5	-57.1	171.3	0	0	0	109.3	G576 Q577 V605	I574-G576 PolarHBondContact O-N 2.87Å; I574-Q577 HydrophobicContact CB-CG 4.23Å; I574-Q577 WeakPolarHBondContact O-CB 3.18Å; I574-Q577 PolarHBondContact O-N 2.82Å; I574-Q577 VanDerWaalsContact O-N 3.14Å; I574-V605 WeakPolarHBondContact O-CB 3.39Å; I574-V605 WeakPolarHBondContact O-CG1 3.42Å
575	V	81.9	Confident	88.7	Confident	78 Å²	78	46.3 Å²	46.3	47%	0.473	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	132.5	177.5	-176.1	0	0	0	0	111.1	T520 Q577 P607	T520-V575 HydrophobicContact CG2-CB 4.41Å; T520-V575 HydrophobicContact CG2-CG2 3.44Å; T520-V575 VanDerWaalsContact CG2-CG2 3.44Å; V575-Q577 VanDerWaalsContact C-N 3.35Å; V575-P607 HydrophobicContact CG1-CB 4.23Å; V575-P607 HydrophobicContact CG1-CG 4.32Å; V575-P607 HydrophobicContact CG2-CB 3.88Å
576	G	77.7	Confident	88.7	Confident	59 Å²	59	46.7 Å²	46.7	61%	0.608	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	2.4	178.3	0	0	0	0	0	114.7	I574 V605	I574-G576 PolarHBondContact O-N 2.87Å; G576-V605 PolarHBondContact N-O 3.44Å
577	Q	85.9	Confident	88.8	Confident	60 Å²	60	45.4 Å²	45.4	28%	0.28	29%	0.287	S	S	.	.			trans	-76.6	140.1	163.8	-74.4	-137.7	34.2	0	0	111.2	I574 V575 Y579 V605	I574-Q577 HydrophobicContact CB-CG 4.23Å; I574-Q577 WeakPolarHBondContact O-CB 3.18Å; I574-Q577 PolarHBondContact O-N 2.82Å; I574-Q577 VanDerWaalsContact O-N 3.14Å; V575-Q577 VanDerWaalsContact C-N 3.35Å; Q577-Y579 HydrophobicContact CB-CE2 3.91Å; Q577-V605 HydrophobicContact CB-CG2 4.17Å; Q577-V605 WeakPolarHBondContact O-CG2 3.5Å; Q577-V605 PolarHBondContact O-N 3.46Å
578	T	89.7	Confident	88.9	Confident	96 Å²	96	48 Å²	48	59%	0.589	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.1	173.3	57.2	0	0	0	0	109.7	I603 E604	T578-I603 CarbonylContact C-O 3.52Å; T578-I603 VanDerWaalsContact CA-O 3.26Å; T578-I603 WeakPolarHBondContact CA-O 3.15Å; T578-E604 HydrophobicContact CG2-CG 4.41Å
579	Y	91.1	Very high	88.9	Confident	10 Å²	10	47.8 Å²	47.8	4%	0.039	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.7	176	-54.5	-101.3	0	0	0	109.8	K553 D555 F556 Q577 Y602 I603 V605	K553-Y579 HydrophobicContact CB-CE1 4.3Å; K553-Y579 HydrophobicContact CD-CD1 4.25Å; K553-Y579 HydrophobicContact CD-CE1 3.9Å; K553-Y579 HydrophobicContact CG-CD1 4.45Å; K553-Y579 HydrophobicContact CG-CE1 4.33Å; D555-Y579 HydrophobicContact CB-CE1 3.96Å; D555-Y579 WeakPolarHBondContact OD2-CE1 2.87Å; D555-Y579 PolarHBondContact OD2-OH 3.16Å; F556-Y579 HydrophobicContact CD2-CD1 4.27Å; F556-Y579 HydrophobicContact CD2-CG 4.4Å; F556-Y579 AromaticContact CE2-CD1 3.65Å; F556-Y579 HydrophobicContact CE2-CD1 3.65Å; F556-Y579 AromaticContact CE2-CD2 3.61Å; F556-Y579 HydrophobicContact CE2-CD2 3.61Å; F556-Y579 AromaticContact CE2-CE1 3.85Å; F556-Y579 HydrophobicContact CE2-CE1 3.85Å; F556-Y579 AromaticContact CE2-CE2 3.85Å; F556-Y579 HydrophobicContact CE2-CE2 3.85Å; F556-Y579 AromaticContact CE2-CG 3.51Å; F556-Y579 HydrophobicContact CE2-CG 3.51Å; F556-Y579 AromaticContact CE2-CZ 3.96Å; F556-Y579 AromaticContact CZ-CD2 3.96Å; F556-Y579 HydrophobicContact CZ-CD2 3.96Å; F556-Y579 HydrophobicContact CZ-CE2 4.1Å; F556-Y579 HydrophobicContact CZ-CG 4.29Å; Q577-Y579 HydrophobicContact CB-CE2 3.91Å; Y579-Y602 CarbonylContact O-C 3.51Å; Y579-Y602 WeakPolarHBondContact O-CA 3.36Å; Y579-I603 HydrophobicContact CD2-CB 4.4Å; Y579-I603 HydrophobicContact CD2-CG2 4.48Å; Y579-I603 PolarHBondContact N-O 2.92Å; Y579-I603 PolarHBondContact O-N 3.13Å; Y579-V605 HydrophobicContact CD2-CG2 4.38Å; Y579-V605 HydrophobicContact CE2-CG2 3.79Å
580	A	93.1	Very high	89	Confident	44 Å²	44	45.6 Å²	45.6	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	90.4	173	0	0	0	0	0	107.1	G551 T600 V601 Y602	G551-A580 VanDerWaalsContact CA-O 3.31Å; G551-A580 WeakPolarHBondContact CA-O 3.28Å; A580-T600 HydrophobicContact CB-CG2 4.35Å; A580-V601 CarbonylContact C-O 3.49Å; A580-V601 WeakPolarHBondContact CA-O 3.33Å; A580-Y602 HydrophobicContact CB-CD1 3.93Å; A580-Y602 HydrophobicContact CB-CE1 3.92Å
581	L	93.8	Very high	89.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	123.2	-178.5	-47.7	-172.4	0	0	0	109.2	G551 F556 V565 V583 T600 V601 I603	G551-L581 VanDerWaalsContact C-CD2 3.43Å; G551-L581 WeakPolarHBondContact O-CD2 3.34Å; F556-L581 HydrophobicContact CB-CD1 4.04Å; F556-L581 HydrophobicContact CD2-CD1 4.26Å; F556-L581 HydrophobicContact CD2-CD2 3.96Å; F556-L581 HydrophobicContact CG-CD1 4.11Å; V565-L581 HydrophobicContact CG1-CD1 3.98Å; L581-V583 HydrophobicContact CB-CG2 4.18Å; L581-T600 CarbonylContact O-C 3.58Å; L581-T600 VanDerWaalsContact O-CA 3.27Å; L581-T600 WeakPolarHBondContact O-CA 3.28Å; L581-V601 HydrophobicContact CB-CB 4.11Å; L581-V601 HydrophobicContact CG-CB 4.41Å; L581-V601 PolarHBondContact N-O 2.93Å; L581-V601 PolarHBondContact O-N 3.44Å; L581-I603 HydrophobicContact CD1-CD1 3.49Å; L581-I603 VanDerWaalsContact CD1-CD1 3.49Å; L581-I603 HydrophobicContact CD2-CD1 4.47Å; L581-I603 HydrophobicContact CG-CD1 3.82Å
582	T	94.4	Very high	89.4	Confident	39 Å²	39	50.8 Å²	50.8	24%	0.239	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.7	166.7	-52.7	0	0	0	0	108.2	L549 V550 I598	L549-T582 HydrophobicContact CD1-CG2 4.36Å; L549-T582 PolarHBondContact N-O 2.94Å; V550-T582 PolarHBondContact O-N 3.45Å; T582-I598 HydrophobicContact CG2-CB 4.37Å; T582-I598 HydrophobicContact CG2-CD1 4.48Å
583	V	94.5	Very high	89.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.1	-178	-175.3	0	0	0	0	109.6	F509 L531 E547 I548 I558 L581 I598 C599 V601	F509-V583 HydrophobicContact CZ-CG1 4.44Å; L531-V583 HydrophobicContact CD1-CB 3.86Å; L531-V583 HydrophobicContact CD1-CG1 3.69Å; L531-V583 HydrophobicContact CD1-CG2 3.76Å; E547-V583 CarbonylContact O-C 3.51Å; E547-V583 WeakPolarHBondContact O-CA 3.25Å; I548-V583 HydrophobicContact CG1-CG2 4.17Å; I558-V583 HydrophobicContact CD1-CG1 3.52Å; L581-V583 HydrophobicContact CB-CG2 4.18Å; V583-I598 CarbonylContact O-C 3.5Å; V583-I598 VanDerWaalsContact O-CA 3.22Å; V583-I598 WeakPolarHBondContact O-CA 3.27Å; V583-C599 PolarHBondContact N-O 2.74Å; V583-C599 PolarHBondContact O-N 3.35Å; V583-V601 HydrophobicContact CG2-CG2 4.24Å
584	Q	95.2	Very high	90.1	Very high	33 Å²	33	52.5 Å²	52.5	15%	0.154	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.5	175.5	-174	177.1	-72.2	0	0	110.2	Y546 E547 L549 S586 H596 S597 I598	Y546-Q584 WeakPolarHBondContact CA-O 3.26Å; E547-Q584 PolarHBondContact N-O 3.46Å; E547-Q584 PolarHBondContact O-N 3.34Å; L549-Q584 HydrophobicContact CD1-CB 3.91Å; L549-Q584 HydrophobicContact CD2-CB 4.18Å; L549-Q584 HydrophobicContact CG-CB 3.88Å; Q584-S586 PolarHBondContact NE2-OG 2.96Å; Q584-H596 HydrophobicContact CG-CB 3.94Å; Q584-S597 VanDerWaalsContact CA-O 3.31Å; Q584-S597 WeakPolarHBondContact CA-O 3.3Å; Q584-I598 HydrophobicContact CB-CG2 4.09Å; Q584-I598 HydrophobicContact CG-CG2 4.19Å
585	A	95.6	Very high	90.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.5	162.2	0	0	0	0	0	108.1	P507 F509 A533 I544 S545 Y546 H596 S597	P507-A585 HydrophobicContact CB-CB 4.03Å; F509-A585 HydrophobicContact CD2-CB 4.5Å; F509-A585 HydrophobicContact CE1-CB 4.11Å; F509-A585 HydrophobicContact CE2-CB 3.59Å; F509-A585 HydrophobicContact CZ-CB 3.36Å; A533-A585 HydrophobicContact CB-CB 3.62Å; I544-A585 HydrophobicContact CG2-CB 3.81Å; S545-A585 WeakPolarHBondContact O-CA 3.45Å; Y546-A585 HydrophobicContact CD1-CB 4.1Å; Y546-A585 HydrophobicContact CE1-CB 4.06Å; A585-H596 CarbonylContact O-C 3.57Å; A585-H596 WeakPolarHBondContact O-CA 3.4Å; A585-H596 WeakPolarHBondContact O-CB 3.47Å; A585-S597 PolarHBondContact N-O 3.03Å; A585-S597 PolarHBondContact O-N 2.7Å
586	S	95.1	Very high	91.1	Very high	8 Å²	8	53 Å²	53	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.5	179.3	-59.3	0	0	0	0	110.7	I544 S545 Q584 R595 H596	I544-S586 CarbonylContact C-O 3.57Å; S545-S586 PolarHBondContact N-O 3.11Å; S545-S586 PolarHBondContact O-N 3.16Å; S545-S586 PolarHBondContact OG-O 3.49Å; S545-S586 VanDerWaalsContact OG-O 3.06Å; Q584-S586 PolarHBondContact NE2-OG 2.96Å; S586-R595 WeakPolarHBondContact CA-O 3.17Å; S586-H596 VanDerWaalsContact OG-CB 3.23Å; S586-H596 WeakPolarHBondContact OG-CB 3.22Å
587	D	95	Very high	92	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	170	168.8	67.1	45.8	0	0	0	111.7	N503 P507 N541 E543 A589 R594 R595	N503-D587 PolarHBondContact ND2-OD2 2.86Å; P507-D587 HydrophobicContact CG-CB 4.1Å; N541-D587 WeakPolarHBondContact O-CB 3.09Å; E543-D587 CarbonylContact O-C 3.58Å; E543-D587 WeakPolarHBondContact O-CA 3.36Å; D587-A589 WeakPolarHBondContact OD1-CB 3.44Å; D587-A589 PolarHBondContact OD1-N 3.03Å; D587-R594 PolarHBondContact O-NE 2.82Å; D587-R594 VanDerWaalsContact OD1-CA 3.31Å; D587-R594 WeakPolarHBondContact OD1-CA 3.29Å; D587-R594 WeakPolarHBondContact OD1-CG 3.45Å; D587-R595 PolarHBondContact N-O 2.92Å; D587-R595 VanDerWaalsContact N-O 3.13Å; D587-R595 WeakPolarHBondContact OD2-CA 3.38Å; D587-R595 WeakPolarHBondContact OD2-CB 3.15Å; D587-R595 PolarHBondContact OD2-N 2.95Å
588	N	92.7	Very high	92.4	Very high	58 Å²	58	53.2 Å²	53.2	31%	0.31	30%	0.297	S	S	.	.			trans	-98.8	19.2	177.1	-75.2	-22.3	0	0	0	113.1	S540 E543	S540-N588 CarbonylContact O-C 3.55Å; S540-N588 VanDerWaalsContact O-CA 3.3Å; S540-N588 WeakPolarHBondContact O-CA 3.41Å; S540-N588 WeakPolarHBondContact O-CB 3.35Å; S540-N588 PolarHBondContact O-N 2.91Å; E543-N588 HydrophobicContact CB-CB 4.28Å; E543-N588 WeakPolarHBondContact CG-ND2 3.39Å; E543-N588 VanDerWaalsContact O-CG 3.31Å; E543-N588 PolarHBondContact O-N 2.93Å; E543-N588 PolarHBondContact O-ND2 3.32Å; E543-N588 PolarHBondContact OE2-ND2 3.17Å
589	A	89.6	Confident	92.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-65.3	165.8	178.1	0	0	0	0	0	111.8	N503 S540 N541 D587 R594	N503-A589 WeakPolarHBondContact ND2-CB 3.36Å; S540-A589 PolarHBondContact O-N 2.79Å; N541-A589 WeakPolarHBondContact OD1-CB 3.17Å; D587-A589 WeakPolarHBondContact OD1-CB 3.44Å; D587-A589 PolarHBondContact OD1-N 3.03Å; A589-R594 PolarHBondContact O-NE 3.34Å; A589-R594 PolarHBondContact O-NH2 2.82Å
590	P	89	Confident	92.8	Very high	71 Å²	71	50 Å²	50	46%	0.461	28%	0.278	S	S	.	.			trans	-52.3	145	174.5	-26.3	35.6	0	0	0	111.3	A592 E593 R594	P590-A592 PolarHBondContact O-N 3.02Å; P590-E593 PolarHBondContact O-N 2.74Å; P590-R594 PolarHBondContact O-N 3.16Å
591	P	87.4	Confident	92.9	Very high	112 Å²	112	47.9 Å²	47.9	73%	0.727	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-19.4	-173.1	-28.3	34.7	0	0	0	116.2
592	A	87.7	Confident	92.8	Very high	100 Å²	100	53 Å²	53	83%	0.826	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-23.7	177.3	0	0	0	0	0	113.7	P590	P590-A592 PolarHBondContact O-N 3.02Å
593	E	87.7	Confident	92.7	Very high	117 Å²	117	51.3 Å²	51.3	55%	0.547	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-11.4	-174.3	-69.1	169.2	-164.3	0	0	112.4	N503 P590 R595	N503-E593 PolarHBondContact ND2-O 2.89Å; P590-E593 PolarHBondContact O-N 2.74Å; E593-R595 WeakPolarHBondContact O-CG 3.25Å; E593-R595 PolarHBondContact O-N 3.25Å
594	R	91.7	Very high	92.5	Very high	113 Å²	113	55.3 Å²	55.3	43%	0.426	29%	0.289	S	S	.	.			trans	-53.7	129	-178.5	179.1	169.5	-57.6	151.5	8.2	113.5	D587 A589 P590	D587-R594 PolarHBondContact O-NE 2.82Å; D587-R594 VanDerWaalsContact OD1-CA 3.31Å; D587-R594 WeakPolarHBondContact OD1-CA 3.29Å; D587-R594 WeakPolarHBondContact OD1-CG 3.45Å; A589-R594 PolarHBondContact O-NE 3.34Å; A589-R594 PolarHBondContact O-NH2 2.82Å; P590-R594 PolarHBondContact O-N 3.16Å
595	R	93	Very high	92.2	Very high	88 Å²	88	53.8 Å²	53.8	33%	0.332	28%	0.282	S	S	.	.			trans	-112	155.2	176.5	-54	-171.7	-178.9	-157	-0.7	110.9	N503 D504 N505 T506 S586 D587 E593	N503-R595 PolarHBondContact O-NE 3.28Å; N503-R595 VanDerWaalsContact O-NE 3.08Å; N503-R595 PolarHBondContact O-NH2 3.1Å; N503-R595 WeakPolarHBondContact OD1-CD 3.48Å; N503-R595 WeakPolarHBondContact OD1-CG 3.23Å; N503-R595 PolarHBondContact OD1-NE 3.02Å; N503-R595 VanDerWaalsContact OD1-NE 3.11Å; D504-R595 VanDerWaalsContact CA-CZ 3.44Å; D504-R595 PolarHBondContact O-NH1 3.26Å; N505-R595 WeakPolarHBondContact O-CD 3.41Å; T506-R595 HydrophobicContact CG2-CB 4.08Å; T506-R595 WeakPolarHBondContact OG1-CD 3.39Å; S586-R595 WeakPolarHBondContact CA-O 3.17Å; D587-R595 PolarHBondContact N-O 2.92Å; D587-R595 VanDerWaalsContact N-O 3.13Å; D587-R595 WeakPolarHBondContact OD2-CA 3.38Å; D587-R595 WeakPolarHBondContact OD2-CB 3.15Å; D587-R595 PolarHBondContact OD2-N 2.95Å; E593-R595 WeakPolarHBondContact O-CG 3.25Å; E593-R595 PolarHBondContact O-N 3.25Å
596	H	94.4	Very high	91.6	Very high	104 Å²	104	56 Å²	56	48%	0.481	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	152.1	-177.2	62.9	78.9	0	0	0	113	Q584 A585 S586	Q584-H596 HydrophobicContact CG-CB 3.94Å; A585-H596 CarbonylContact O-C 3.57Å; A585-H596 WeakPolarHBondContact O-CA 3.4Å; A585-H596 WeakPolarHBondContact O-CB 3.47Å; S586-H596 VanDerWaalsContact OG-CB 3.23Å; S586-H596 WeakPolarHBondContact OG-CB 3.22Å
597	S	95.3	Very high	90.7	Very high	25 Å²	25	57.8 Å²	57.8	18%	0.175	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	167.6	167.7	74.4	0	0	0	0	111.3	P507 F509 Q584 A585	P507-S597 WeakPolarHBondContact O-CB 3.49Å; P507-S597 PolarHBondContact O-OG 2.7Å; F509-S597 WeakPolarHBondContact CD2-OG 3.44Å; Q584-S597 VanDerWaalsContact CA-O 3.31Å; Q584-S597 WeakPolarHBondContact CA-O 3.3Å; A585-S597 PolarHBondContact N-O 3.03Å; A585-S597 PolarHBondContact O-N 2.7Å
598	I	94.9	Very high	89.4	Confident	100 Å²	100	60.2 Å²	60.2	51%	0.513	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.5	-180	59.1	173.1	0	0	0	110.8	L549 T582 V583 Q584	L549-I598 HydrophobicContact CD1-CG2 4.08Å; T582-I598 HydrophobicContact CG2-CB 4.37Å; T582-I598 HydrophobicContact CG2-CD1 4.48Å; V583-I598 CarbonylContact O-C 3.5Å; V583-I598 VanDerWaalsContact O-CA 3.22Å; V583-I598 WeakPolarHBondContact O-CA 3.27Å; Q584-I598 HydrophobicContact CB-CG2 4.09Å; Q584-I598 HydrophobicContact CG-CG2 4.19Å
599	C	94.6	Very high	87.7	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	162.5	167.4	67.9	0	0	0	0	110.6	F509 I512 Y514 V583	F509-C599 HydrophobicContact CB-CB 4.2Å; F509-C599 HydrophobicContact CD1-CB 4.34Å; F509-C599 HydrophobicContact CD2-CB 3.71Å; F509-C599 HydrophobicContact CE2-CB 4.1Å; F509-C599 HydrophobicContact CG-CB 3.83Å; I512-C599 WeakPolarHBondContact O-CA 3.46Å; Y514-C599 HydrophobicContact CE2-CB 4.16Å; V583-C599 PolarHBondContact N-O 2.74Å; V583-C599 PolarHBondContact O-N 3.35Å
600	T	94.1	Very high	86.2	Confident	37 Å²	37	62.4 Å²	62.4	23%	0.227	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124	177.6	-53.3	0	0	0	0	111.3	I512 S513 Y514 A580 L581 Y602	I512-T600 PolarHBondContact O-N 3.34Å; S513-T600 CarbonylContact C-O 3.54Å; S513-T600 WeakPolarHBondContact CA-O 3.48Å; S513-T600 WeakPolarHBondContact CB-O 3.35Å; Y514-T600 PolarHBondContact N-O 2.97Å; A580-T600 HydrophobicContact CB-CG2 4.35Å; L581-T600 CarbonylContact O-C 3.58Å; L581-T600 VanDerWaalsContact O-CA 3.27Å; L581-T600 WeakPolarHBondContact O-CA 3.28Å; T600-Y602 HydrophobicContact CG2-CD1 4.41Å; T600-Y602 HydrophobicContact CG2-CD2 4.44Å; T600-Y602 HydrophobicContact CG2-CE1 3.92Å; T600-Y602 HydrophobicContact CG2-CE2 3.95Å
601	V	94.3	Very high	84.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.5	174	-172.1	0	0	0	0	109.3	Y514 V516 I529 L531 A580 L581 V583 I603	Y514-V601 HydrophobicContact CD2-CG2 4.41Å; Y514-V601 CarbonylContact O-C 3.58Å; Y514-V601 WeakPolarHBondContact O-CA 3.37Å; V516-V601 HydrophobicContact CG2-CG1 3.88Å; I529-V601 HydrophobicContact CG2-CG1 4.07Å; L531-V601 HydrophobicContact CD1-CG2 3.94Å; L531-V601 HydrophobicContact CD2-CG2 3.97Å; L531-V601 HydrophobicContact CG-CG2 4.48Å; A580-V601 CarbonylContact C-O 3.49Å; A580-V601 WeakPolarHBondContact CA-O 3.33Å; L581-V601 HydrophobicContact CB-CB 4.11Å; L581-V601 HydrophobicContact CG-CB 4.41Å; L581-V601 PolarHBondContact N-O 2.93Å; L581-V601 PolarHBondContact O-N 3.44Å; V583-V601 HydrophobicContact CG2-CG2 4.24Å; V601-I603 HydrophobicContact CG1-CD1 4.31Å; V601-I603 HydrophobicContact CG1-CG1 3.88Å
602	Y	93.7	Very high	83.5	Confident	107 Å²	107	59.2 Å²	59.2	42%	0.42	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	121.6	172.3	-63.6	-72.1	0	0	0	109.4	Y514 D515 V516 Y579 A580 T600	Y514-Y602 PolarHBondContact O-N 2.85Å; D515-Y602 WeakPolarHBondContact OD1-CB 3.26Å; V516-Y602 PolarHBondContact N-O 2.74Å; Y579-Y602 CarbonylContact O-C 3.51Å; Y579-Y602 WeakPolarHBondContact O-CA 3.36Å; A580-Y602 HydrophobicContact CB-CD1 3.93Å; A580-Y602 HydrophobicContact CB-CE1 3.92Å; T600-Y602 HydrophobicContact CG2-CD1 4.41Å; T600-Y602 HydrophobicContact CG2-CD2 4.44Å; T600-Y602 HydrophobicContact CG2-CE1 3.92Å; T600-Y602 HydrophobicContact CG2-CE2 3.95Å
603	I	92.1	Very high	82.6	Confident	3 Å²	3	57 Å²	57	2%	0.015	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	122.4	-178.8	-54.5	172.4	0	0	0	109	V516 V518 V528 F556 T578 Y579 L581 V601	V516-I603 VanDerWaalsContact O-CA 3.3Å; V516-I603 WeakPolarHBondContact O-CA 3.45Å; V518-I603 HydrophobicContact CB-CG2 4.25Å; V518-I603 HydrophobicContact CG1-CG2 3.77Å; V518-I603 HydrophobicContact CG2-CG2 3.48Å; V518-I603 VanDerWaalsContact CG2-CG2 3.48Å; V528-I603 HydrophobicContact CG1-CD1 4.05Å; V528-I603 HydrophobicContact CG1-CG1 4.47Å; F556-I603 HydrophobicContact CD1-CD1 3.99Å; F556-I603 HydrophobicContact CD2-CD1 4.14Å; F556-I603 HydrophobicContact CE1-CD1 3.73Å; F556-I603 HydrophobicContact CE1-CG2 4.36Å; F556-I603 HydrophobicContact CE2-CD1 3.9Å; F556-I603 HydrophobicContact CG-CD1 4.19Å; F556-I603 HydrophobicContact CZ-CB 4.45Å; F556-I603 HydrophobicContact CZ-CD1 3.68Å; F556-I603 HydrophobicContact CZ-CG2 3.91Å; T578-I603 CarbonylContact C-O 3.52Å; T578-I603 VanDerWaalsContact CA-O 3.26Å; T578-I603 WeakPolarHBondContact CA-O 3.15Å; Y579-I603 HydrophobicContact CD2-CB 4.4Å; Y579-I603 HydrophobicContact CD2-CG2 4.48Å; Y579-I603 PolarHBondContact N-O 2.92Å; Y579-I603 PolarHBondContact O-N 3.13Å; L581-I603 HydrophobicContact CD1-CD1 3.49Å; L581-I603 VanDerWaalsContact CD1-CD1 3.49Å; L581-I603 HydrophobicContact CD2-CD1 4.47Å; L581-I603 HydrophobicContact CG-CD1 3.82Å; V601-I603 HydrophobicContact CG1-CD1 4.31Å; V601-I603 HydrophobicContact CG1-CG1 3.88Å
604	E	90.5	Very high	82.2	Confident	84 Å²	84	51.7 Å²	51.7	39%	0.393	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.3	172.9	-176.5	177.6	-179.5	0	0	110.6	V516 Y517 V518 T578 L606	V516-E604 PolarHBondContact O-N 3.39Å; Y517-E604 HydrophobicContact CD1-CB 4Å; Y517-E604 HydrophobicContact CE1-CB 4.26Å; Y517-E604 WeakPolarHBondContact CE1-OE2 3.45Å; V518-E604 PolarHBondContact N-O 2.87Å; T578-E604 HydrophobicContact CG2-CG 4.41Å; E604-L606 HydrophobicContact CG-CD2 4.04Å; E604-L606 PolarHBondContact O-N 3.18Å
605	V	88.5	Confident	81.7	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	107.3	178	-174.1	0	0	0	0	110.5	V518 T520 L573 I574 G576 Q577 Y579	V518-V605 HydrophobicContact CG2-CB 4.24Å; V518-V605 HydrophobicContact CG2-CG1 4.48Å; V518-V605 HydrophobicContact CG2-CG2 3.73Å; V518-V605 CarbonylContact O-C 3.54Å; V518-V605 WeakPolarHBondContact O-CA 3.49Å; T520-V605 HydrophobicContact CG2-CG1 3.6Å; L573-V605 HydrophobicContact CB-CG1 3.85Å; L573-V605 HydrophobicContact CD2-CG2 4.39Å; I574-V605 WeakPolarHBondContact O-CB 3.39Å; I574-V605 WeakPolarHBondContact O-CG1 3.42Å; G576-V605 PolarHBondContact N-O 3.44Å; Q577-V605 HydrophobicContact CB-CG2 4.17Å; Q577-V605 WeakPolarHBondContact O-CG2 3.5Å; Q577-V605 PolarHBondContact O-N 3.46Å; Y579-V605 HydrophobicContact CD2-CG2 4.38Å; Y579-V605 HydrophobicContact CE2-CG2 3.79Å
606	L	81.4	Confident	81.3	Confident	46 Å²	46	52.1 Å²	52.1	24%	0.241	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	153.2	176.4	-61	-175.7	0	0	0	111.5	Y517 V518 Y519 T520 E604	Y517-L606 HydrophobicContact CD1-CD1 3.7Å; Y517-L606 HydrophobicContact CD1-CG 4.11Å; Y517-L606 HydrophobicContact CG-CD1 3.9Å; V518-L606 PolarHBondContact O-N 3.32Å; Y519-L606 WeakPolarHBondContact CA-O 3.27Å; Y519-L606 HydrophobicContact CD1-CB 3.84Å; Y519-L606 HydrophobicContact CE1-CB 3.97Å; Y519-L606 HydrophobicContact CE1-CD1 4.08Å; T520-L606 PolarHBondContact N-O 3.3Å; T520-L606 VanDerWaalsContact N-O 3.11Å; E604-L606 HydrophobicContact CG-CD2 4.04Å; E604-L606 PolarHBondContact O-N 3.18Å
607	P	76.3	Confident	80.8	Confident	46 Å²	46	51.9 Å²	51.9	30%	0.299	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-70.3	161.2	170.6	33.2	-35.9	0	0	0	110.9	Y519 V575 Q611	Y519-P607 WeakPolarHBondContact CD1-O 3.39Å; V575-P607 HydrophobicContact CG1-CB 4.23Å; V575-P607 HydrophobicContact CG1-CG 4.32Å; V575-P607 HydrophobicContact CG2-CB 3.88Å; P607-Q611 VanDerWaalsContact CG-NE2 3.26Å
608	P	68.9	Low	80.2	Confident	51 Å²	51	55.7 Å²	55.7	33%	0.331	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-55.1	142.7	-169.5	-26	37.2	0	0	0	113.5	T520 D521 N610 Q611	T520-P608 VanDerWaalsContact OG1-CD 3.23Å; T520-P608 WeakPolarHBondContact OG1-CD 3.28Å; T520-P608 WeakPolarHBondContact OG1-CG 3.25Å; D521-P608 HydrophobicContact CB-CB 4.07Å; D521-P608 HydrophobicContact CB-CG 4.05Å; P608-N610 PolarHBondContact O-N 3.45Å; P608-N610 VanDerWaalsContact O-N 3.08Å; P608-Q611 WeakPolarHBondContact O-CG 3.44Å; P608-Q611 PolarHBondContact O-NE2 3.21Å
609	N	57.5	Low	79.6	Confident	87 Å²	87	54.9 Å²	54.9	47%	0.465	28%	0.279	S	S	.	.	S	Bend	trans	-81.8	77.1	-176.2	-170.3	18.6	0	0	0	112.2	Y519	Y519-N609 HydrophobicContact CD1-CB 4.16Å; Y519-N609 HydrophobicContact CE1-CB 3.88Å
610	N	57	Low	79	Confident	18 Å²	18	60.3 Å²	60.3	10%	0.096	31%	0.305	C	S	.	.			trans	178.4	77.2	160.3	-177.2	19.1	0	0	0	110.4	P608 R694	P608-N610 PolarHBondContact O-N 3.45Å; P608-N610 VanDerWaalsContact O-N 3.08Å; N610-R694 VanDerWaalsContact ND2-CB 3.31Å; N610-R694 WeakPolarHBondContact ND2-CB 3.44Å
611	Q	57.3	Low	78.7	Confident	90 Å²	90	59.4 Å²	59.4	42%	0.421	30%	0.298	S	S	.	.			trans	-104.7	-3	-167.5	-62.3	-163.5	0.1	0	0	115	P607 P608 E644	P607-Q611 VanDerWaalsContact CG-NE2 3.26Å; P608-Q611 WeakPolarHBondContact O-CG 3.44Å; P608-Q611 PolarHBondContact O-NE2 3.21Å; Q611-E644 PolarHBondContact N-OE1 3.4Å
612	S	62	Low	78.3	Confident	25 Å²	25	63.7 Å²	63.7	18%	0.175	33%	0.328	C	S	.	.			trans	-136.6	112.8	-169.6	-39.1	0	0	0	0	111.1	D642 R643 E644	S612-D642 VanDerWaalsContact O-OD1 3.11Å; S612-R643 WeakPolarHBondContact OG-CD 3.36Å; S612-E644 WeakPolarHBondContact CB-OE2 3.4Å; S612-E644 PolarHBondContact N-OE1 3.17Å; S612-E644 PolarHBondContact OG-OE1 3.33Å
613	P	68.6	Low	78	Confident	54 Å²	54	59.9 Å²	59.9	35%	0.351	31%	0.314	S	S	.	.			trans	-66.5	151.7	173.8	26.4	-33.5	0	0	0	111.5	R615 V703	P613-R615 PolarHBondContact O-N 3.16Å; P613-V703 HydrophobicContact CB-CG2 4.11Å; P613-V703 HydrophobicContact CG-CG2 3.66Å
614	P	79.6	Confident	77.7	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.039	35%	0.345	C	S	.	.			trans	-53	128.6	178.6	-29	34.1	0	0	0	112.7	A640 I648 A690 D692	P614-A640 HydrophobicContact CB-CB 4.34Å; P614-I648 HydrophobicContact CB-CD1 4.25Å; P614-I648 HydrophobicContact CB-CG1 4.32Å; P614-I648 HydrophobicContact CB-CG2 4.13Å; P614-I648 HydrophobicContact CG-CG1 4.33Å; P614-I648 HydrophobicContact CG-CG2 4.41Å; P614-A690 HydrophobicContact CB-CB 3.89Å; P614-D692 HydrophobicContact CG-CB 3.86Å
615	R	82	Confident	77.4	Confident	191 Å²	191	62.8 Å²	62.8	72%	0.721	33%	0.329	S	S	*	.	B	Isolated β-bridge	trans	-113.9	129.6	-173.4	-170.3	177.4	177.8	-174.4	-0.7	111.8	P613 A640 T641	P613-R615 PolarHBondContact O-N 3.16Å; R615-A640 CarbonylContact O-C 3.52Å; R615-A640 WeakPolarHBondContact O-CA 3.25Å; R615-T641 PolarHBondContact N-O 3.33Å; R615-T641 PolarHBondContact O-N 3.26Å; R615-T641 PolarHBondContact O-OG1 3.2Å
616	F	85.2	Confident	77.1	Confident	19 Å²	19	65.2 Å²	65.2	8%	0.083	35%	0.346	C	S	.	.			trans	-79.8	141.5	169.1	-66.8	-86.5	0	0	0	111.4	Q618 L638 A640 Y650 V688 A690 P706	F616-Q618 VanDerWaalsContact C-N 3.29Å; F616-Q618 PolarHBondContact O-N 2.92Å; F616-L638 HydrophobicContact CE1-CB 4.21Å; F616-A640 HydrophobicContact CD1-CB 3.93Å; F616-A640 HydrophobicContact CD2-CB 4.43Å; F616-A640 HydrophobicContact CE1-CB 3.94Å; F616-A640 HydrophobicContact CE2-CB 4.47Å; F616-A640 HydrophobicContact CG-CB 4.21Å; F616-A640 HydrophobicContact CZ-CB 4.24Å; F616-Y650 HydrophobicContact CE1-CD1 4.02Å; F616-Y650 AromaticContact CE1-CE1 3.84Å; F616-Y650 HydrophobicContact CE1-CE1 3.84Å; F616-Y650 HydrophobicContact CZ-CD1 4.05Å; F616-Y650 HydrophobicContact CZ-CE1 4.19Å; F616-V688 HydrophobicContact CZ-CG1 4.22Å; F616-A690 HydrophobicContact CD2-CB 4.39Å; F616-A690 HydrophobicContact CE1-CB 4.32Å; F616-A690 HydrophobicContact CE2-CB 3.47Å; F616-A690 VanDerWaalsContact CE2-CB 3.47Å; F616-A690 HydrophobicContact CZ-CB 3.44Å; F616-A690 VanDerWaalsContact CZ-CB 3.44Å; F616-P706 HydrophobicContact CB-CB 4.4Å; F616-P706 HydrophobicContact CB-CG 4.26Å; F616-P706 HydrophobicContact CD1-CG 4Å; F616-P706 HydrophobicContact CD2-CB 4.33Å; F616-P706 HydrophobicContact CD2-CG 3.35Å; F616-P706 HydrophobicContact CE1-CG 4.11Å; F616-P706 HydrophobicContact CE2-CG 3.46Å; F616-P706 VanDerWaalsContact CE2-CG 3.46Å; F616-P706 HydrophobicContact CG-CB 4.23Å; F616-P706 HydrophobicContact CG-CG 3.61Å; F616-P706 HydrophobicContact CZ-CG 3.83Å
617	P	83.5	Confident	77.2	Confident	98 Å²	98	67.5 Å²	67.5	64%	0.636	36%	0.355	S	S	*	.	S	Bend	trans	-68.2	-27.8	178.1	25.2	-32.8	0	0	0	112.7	Q639	P617-Q639 WeakPolarHBondContact CD-O 3.39Å
618	Q	82.6	Confident	77.6	Confident	106 Å²	106	69.3 Å²	69.3	50%	0.495	37%	0.374	S	S	.	.			trans	-126.4	145.3	178.3	-61.2	-178.3	-20.6	0	0	111.2	F616 Y621	F616-Q618 VanDerWaalsContact C-N 3.29Å; F616-Q618 PolarHBondContact O-N 2.92Å; Q618-Y621 HydrophobicContact CB-CE1 3.97Å; Q618-Y621 HydrophobicContact CB-CE2 4.18Å; Q618-Y621 HydrophobicContact CG-CE1 4.43Å; Q618-Y621 VanDerWaalsContact OE1-CE1 3.25Å
619	L	81.2	Confident	78.4	Confident	82 Å²	82	70.4 Å²	70.4	43%	0.429	38%	0.376	S	S	.	.	S	Bend	trans	-94.6	-16	178.9	-67.7	173.5	0	0	0	113.5	K704 P706 K707	L619-K704 HydrophobicContact CD1-CB 4.44Å; L619-K704 HydrophobicContact CD1-CD 3.68Å; L619-K704 HydrophobicContact CD2-CB 3.46Å; L619-K704 VanDerWaalsContact CD2-CB 3.46Å; L619-K704 HydrophobicContact CD2-CD 4.25Å; L619-P706 WeakPolarHBondContact O-CA 3.42Å; L619-K707 PolarHBondContact O-N 2.88Å
620	M	83.7	Confident	79.9	Confident	115 Å²	115	76.3 Å²	76.3	57%	0.567	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	132.2	173.2	-65.9	-161.7	87.8	0	0	109.7	K707	M620-K707 CarbonylContact C-O 3.45Å; M620-K707 VanDerWaalsContact CA-O 3.26Å; M620-K707 WeakPolarHBondContact CA-O 3.43Å; M620-K707 HydrophobicContact CE-CB 4.06Å; M620-K707 HydrophobicContact CE-CD 4.25Å; M620-K707 HydrophobicContact CG-CB 4.43Å
621	Y	85.8	Confident	81.5	Confident	19 Å²	19	80.9 Å²	80.9	8%	0.075	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	121.2	171.3	-61.9	-90.4	0	0	0	107.1	Q618 L636 L638 P706 K707 V708 E709	Q618-Y621 HydrophobicContact CB-CE1 3.97Å; Q618-Y621 HydrophobicContact CB-CE2 4.18Å; Q618-Y621 HydrophobicContact CG-CE1 4.43Å; Q618-Y621 VanDerWaalsContact OE1-CE1 3.25Å; Y621-L636 HydrophobicContact CD1-CD1 3.95Å; Y621-L636 HydrophobicContact CD1-CD2 3.71Å; Y621-L636 HydrophobicContact CD1-CG 4.38Å; Y621-L636 HydrophobicContact CD2-CD2 4.2Å; Y621-L636 HydrophobicContact CE1-CD2 4.38Å; Y621-L636 HydrophobicContact CG-CD2 3.6Å; Y621-L638 HydrophobicContact CD1-CD2 4.46Å; Y621-L638 HydrophobicContact CD2-CD2 3.73Å; Y621-L638 HydrophobicContact CE1-CD2 4.19Å; Y621-L638 HydrophobicContact CE2-CD2 3.42Å; Y621-L638 VanDerWaalsContact CE2-CD2 3.42Å; Y621-L638 HydrophobicContact CG-CD2 4.25Å; Y621-P706 HydrophobicContact CD2-CB 4.23Å; Y621-P706 HydrophobicContact CE2-CB 3.85Å; Y621-K707 PolarHBondContact N-O 3.38Å; Y621-V708 HydrophobicContact CD2-CG2 4.15Å; Y621-V708 CarbonylContact O-C 3.41Å; Y621-V708 WeakPolarHBondContact O-CA 3.29Å; Y621-E709 PolarHBondContact O-N 3.38Å
622	S	87.3	Confident	82.8	Confident	90 Å²	90	79 Å²	79	63%	0.629	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	122	177.6	-169.6	0	0	0	0	108.9	E709	S622-E709 CarbonylContact C-O 3.53Å; S622-E709 WeakPolarHBondContact CA-O 3.09Å
623	L	86.8	Confident	84.1	Confident	26 Å²	26	78.9 Å²	78.9	14%	0.136	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134	-179.6	-63.8	102.3	0	0	0	110.1	V625 L635 L636 V708 E709 I710 R711	L623-V625 HydrophobicContact CB-CG2 4.1Å; L623-L635 HydrophobicContact CD2-CB 4.25Å; L623-L635 WeakPolarHBondContact CD2-O 3.17Å; L623-L636 HydrophobicContact CD1-CB 4.47Å; L623-L636 HydrophobicContact CD1-CD2 4.16Å; L623-L636 HydrophobicContact CD2-CB 4.04Å; L623-L636 HydrophobicContact CD2-CD1 4.34Å; L623-V708 HydrophobicContact CD1-CG1 3.34Å; L623-E709 PolarHBondContact N-O 3.22Å; L623-I710 HydrophobicContact CB-CG1 4.37Å; L623-I710 HydrophobicContact CD1-CG1 4.35Å; L623-I710 WeakPolarHBondContact O-CA 3.37Å; L623-R711 PolarHBondContact O-N 3.38Å
624	E	85.9	Confident	85.1	Confident	141 Å²	141	81.8 Å²	81.8	66%	0.659	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	110	170.7	-72.4	-175.7	168.8	0	0	109	R711 P713	E624-R711 CarbonylContact C-O 3.51Å; E624-R711 WeakPolarHBondContact CA-O 3.43Å; E624-P713 HydrophobicContact CB-CB 4.24Å; E624-P713 HydrophobicContact CB-CG 4.28Å; E624-P713 HydrophobicContact CG-CB 4.41Å
625	V	84.1	Confident	85.6	Confident	8 Å²	8	82.4 Å²	82.4	5%	0.048	43%	0.434	C	S	.	.			trans	-125.3	123	-174.3	-174.9	0	0	0	0	108.8	L623 M629 L635 L676 I710 R711 E712	L623-V625 HydrophobicContact CB-CG2 4.1Å; V625-M629 HydrophobicContact CG1-CB 3.74Å; V625-M629 HydrophobicContact CG1-CE 4.13Å; V625-M629 HydrophobicContact CG1-CG 3.93Å; V625-L635 HydrophobicContact CG1-CD2 4.01Å; V625-L635 HydrophobicContact CG2-CD2 4.01Å; V625-L676 HydrophobicContact CB-CD1 4.25Å; V625-L676 HydrophobicContact CG1-CD1 3.59Å; V625-I710 HydrophobicContact CB-CG2 3.83Å; V625-I710 HydrophobicContact CG2-CG2 3.65Å; V625-R711 PolarHBondContact N-O 3Å; V625-E712 WeakPolarHBondContact O-CA 3.11Å
626	S	83.1	Confident	86	Confident	52 Å²	52	74.9 Å²	74.9	36%	0.364	41%	0.408	S	S	.	.			trans	-71.7	147.6	176.4	176.3	0	0	0	0	111.9	A628 M629 E712	S626-A628 PolarHBondContact O-N 2.72Å; S626-A628 VanDerWaalsContact O-N 3.11Å; S626-A628 PolarHBondContact OG-N 2.81Å; S626-M629 WeakPolarHBondContact O-CB 3.34Å; S626-M629 PolarHBondContact O-N 3.35Å; S626-E712 WeakPolarHBondContact CA-OE1 3.28Å; S626-E712 PolarHBondContact OG-OE1 3.38Å
627	E	83.7	Confident	86.2	Confident	93 Å²	93	77.9 Å²	77.9	44%	0.435	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.5	170.5	71.4	174.2	-170.2	0	0	113	M629 E712	E627-M629 PolarHBondContact O-N 3Å; E627-E712 PolarHBondContact N-OE1 3.33Å
628	A	82.9	Confident	86.5	Confident	85 Å²	85	73.2 Å²	73.2	70%	0.702	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	1.5	177.1	0	0	0	0	0	114.2	S626 R630	S626-A628 PolarHBondContact O-N 2.72Å; S626-A628 VanDerWaalsContact O-N 3.11Å; S626-A628 PolarHBondContact OG-N 2.81Å; A628-R630 PolarHBondContact O-N 2.75Å
629	M	86.8	Confident	86.8	Confident	73 Å²	73	74 Å²	74	36%	0.36	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-63.6	132.7	179.4	-171.8	64.9	100.3	0	0	111	V625 S626 E627 A633 L635 L672	V625-M629 HydrophobicContact CG1-CB 3.74Å; V625-M629 HydrophobicContact CG1-CE 4.13Å; V625-M629 HydrophobicContact CG1-CG 3.93Å; S626-M629 WeakPolarHBondContact O-CB 3.34Å; S626-M629 PolarHBondContact O-N 3.35Å; E627-M629 PolarHBondContact O-N 3Å; M629-A633 HydrophobicContact CE-CB 4.41Å; M629-A633 HydrophobicContact CG-CB 3.58Å; M629-A633 HydrophobicContact SD-CB 3.54Å; M629-A633 VanDerWaalsContact SD-CB 3.54Å; M629-L635 HydrophobicContact CE-CD2 4.31Å; M629-L635 HydrophobicContact CG-CD2 4.41Å; M629-L672 HydrophobicContact CB-CD2 3.94Å; M629-L672 HydrophobicContact CG-CD2 3.94Å; M629-L672 WeakPolarHBondContact O-CD2 3.34Å
630	R	88.6	Confident	87	Confident	212 Å²	212	70.5 Å²	70.5	80%	0.8	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-68.9	140.8	-178.3	-64.5	-174.7	-151.1	176.7	8.1	111	A628 G632 A633	A628-R630 PolarHBondContact O-N 2.75Å; R630-G632 PolarHBondContact O-N 3.14Å; R630-A633 WeakPolarHBondContact O-CB 3.48Å; R630-A633 PolarHBondContact O-N 2.71Å
631	I	89.8	Confident	87	Confident	113 Å²	113	69.6 Å²	69.6	58%	0.579	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	131.5	165.6	-57.2	174.2	0	0	0	108.5	A675	I631-A675 HydrophobicContact CD1-CB 4.49Å
632	G	86.2	Confident	86.8	Confident	52 Å²	52	69.7 Å²	69.7	54%	0.536	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-4.3	-174.1	0	0	0	0	0	114.8	R630 I634 L672	R630-G632 PolarHBondContact O-N 3.14Å; G632-I634 PolarHBondContact O-N 2.8Å; G632-L672 PolarHBondContact N-O 2.83Å
633	A	88	Confident	86.3	Confident	21 Å²	21	75 Å²	75	17%	0.174	39%	0.39	C	S	.	.			trans	-63.2	132.5	174.5	0	0	0	0	0	111	M629 R630 S671 L672	M629-A633 HydrophobicContact CE-CB 4.41Å; M629-A633 HydrophobicContact CG-CB 3.58Å; M629-A633 HydrophobicContact SD-CB 3.54Å; M629-A633 VanDerWaalsContact SD-CB 3.54Å; R630-A633 WeakPolarHBondContact O-CB 3.48Å; R630-A633 PolarHBondContact O-N 2.71Å; A633-S671 CarbonylContact O-C 3.55Å; A633-S671 VanDerWaalsContact O-CA 3.24Å; A633-S671 WeakPolarHBondContact O-CA 3.4Å; A633-L672 PolarHBondContact O-N 2.81Å
634	I	90.1	Very high	85.6	Confident	115 Å²	115	76.2 Å²	76.2	59%	0.59	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.1	172.8	-62.5	170.9	0	0	0	107.9	G632 I669	G632-I634 PolarHBondContact O-N 2.8Å; I634-I669 HydrophobicContact CB-CG2 4.44Å; I634-I669 HydrophobicContact CD1-CG2 4.26Å; I634-I669 HydrophobicContact CG1-CG2 3.97Å; I634-I669 HydrophobicContact CG2-CG2 3.77Å
635	L	89.6	Confident	84.9	Confident	20 Å²	20	72.5 Å²	72.5	11%	0.105	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-47.9	-179.1	-56.1	-178.1	0	0	0	110.8	L623 V625 M629 F661 L670 L672 I710	L623-L635 HydrophobicContact CD2-CB 4.25Å; L623-L635 WeakPolarHBondContact CD2-O 3.17Å; V625-L635 HydrophobicContact CG1-CD2 4.01Å; V625-L635 HydrophobicContact CG2-CD2 4.01Å; M629-L635 HydrophobicContact CE-CD2 4.31Å; M629-L635 HydrophobicContact CG-CD2 4.41Å; L635-F661 HydrophobicContact CD1-CD1 3.49Å; L635-F661 VanDerWaalsContact CD1-CD1 3.49Å; L635-F661 HydrophobicContact CD1-CE1 3.5Å; L635-L670 HydrophobicContact CB-CD2 4.45Å; L635-L670 PolarHBondContact N-O 3.38Å; L635-L672 HydrophobicContact CD1-CB 4.44Å; L635-L672 HydrophobicContact CD2-CB 4.47Å; L635-I710 HydrophobicContact CD1-CD1 4.02Å
636	L	90.2	Very high	84.5	Confident	32 Å²	32	73.1 Å²	73.1	17%	0.168	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	148.9	-173.1	-171.8	67.2	0	0	0	110.9	Y621 L623 L638 L670 V708	Y621-L636 HydrophobicContact CD1-CD1 3.95Å; Y621-L636 HydrophobicContact CD1-CD2 3.71Å; Y621-L636 HydrophobicContact CD1-CG 4.38Å; Y621-L636 HydrophobicContact CD2-CD2 4.2Å; Y621-L636 HydrophobicContact CE1-CD2 4.38Å; Y621-L636 HydrophobicContact CG-CD2 3.6Å; L623-L636 HydrophobicContact CD1-CB 4.47Å; L623-L636 HydrophobicContact CD1-CD2 4.16Å; L623-L636 HydrophobicContact CD2-CB 4.04Å; L623-L636 HydrophobicContact CD2-CD1 4.34Å; L636-L638 HydrophobicContact CD2-CD1 4.45Å; L636-L638 HydrophobicContact CD2-CD2 3.42Å; L636-L638 VanDerWaalsContact CD2-CD2 3.42Å; L636-L638 HydrophobicContact CD2-CG 3.77Å; L636-L638 HydrophobicContact CG-CD2 4.23Å; L636-L638 HydrophobicContact CG-CG 4.23Å; L636-L670 HydrophobicContact CB-CB 4.15Å; L636-L670 HydrophobicContact CB-CD2 4.27Å; L636-L670 PolarHBondContact N-O 2.64Å; L636-L670 PolarHBondContact O-N 3.5Å; L636-V708 HydrophobicContact CD2-CG1 4.02Å; L636-V708 HydrophobicContact CD2-CG2 4.06Å
637	N	90.7	Very high	84.4	Confident	82 Å²	82	75.8 Å²	75.8	44%	0.439	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	106.5	167.2	-176.8	10.7	0	0	0	109	T667	N637-T667 PolarHBondContact OD1-O 3.42Å
638	L	89.5	Confident	84.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	40%	0.401	C	S	.	.			trans	-87.7	115.4	179.3	-69.3	166.8	0	0	0	109.3	F616 Y621 L636 Y650 L663 G668 V688 V708	F616-L638 HydrophobicContact CE1-CB 4.21Å; Y621-L638 HydrophobicContact CD1-CD2 4.46Å; Y621-L638 HydrophobicContact CD2-CD2 3.73Å; Y621-L638 HydrophobicContact CE1-CD2 4.19Å; Y621-L638 HydrophobicContact CE2-CD2 3.42Å; Y621-L638 VanDerWaalsContact CE2-CD2 3.42Å; Y621-L638 HydrophobicContact CG-CD2 4.25Å; L636-L638 HydrophobicContact CD2-CD1 4.45Å; L636-L638 HydrophobicContact CD2-CD2 3.42Å; L636-L638 VanDerWaalsContact CD2-CD2 3.42Å; L636-L638 HydrophobicContact CD2-CG 3.77Å; L636-L638 HydrophobicContact CG-CD2 4.23Å; L636-L638 HydrophobicContact CG-CG 4.23Å; L638-Y650 WeakPolarHBondContact O-CE1 3.34Å; L638-L663 HydrophobicContact CD1-CD1 4Å; L638-G668 WeakPolarHBondContact CB-O 3.37Å; L638-G668 PolarHBondContact N-O 3.1Å; L638-G668 WeakPolarHBondContact O-CA 3.29Å; L638-V688 HydrophobicContact CD1-CB 4.13Å; L638-V688 HydrophobicContact CD1-CG1 3.8Å; L638-V688 HydrophobicContact CD1-CG2 3.83Å; L638-V708 HydrophobicContact CD1-CG2 4.29Å; L638-V708 HydrophobicContact CD2-CG2 4.27Å
639	Q	88.2	Confident	84.8	Confident	123 Å²	123	72.2 Å²	72.2	58%	0.575	39%	0.389	S	S	*	.			trans	-116.3	112.5	176.6	-64.8	-171.7	-37.5	0	0	109.3	P617	P617-Q639 WeakPolarHBondContact CD-O 3.39Å
640	A	86	Confident	84.9	Confident	9 Å²	9	69.7 Å²	69.7	7%	0.074	38%	0.375	C	S	.	.			trans	-91.6	152.4	165.3	0	0	0	0	0	109.2	P614 R615 F616 I648 Y650 A690	P614-A640 HydrophobicContact CB-CB 4.34Å; R615-A640 CarbonylContact O-C 3.52Å; R615-A640 WeakPolarHBondContact O-CA 3.25Å; F616-A640 HydrophobicContact CD1-CB 3.93Å; F616-A640 HydrophobicContact CD2-CB 4.43Å; F616-A640 HydrophobicContact CE1-CB 3.94Å; F616-A640 HydrophobicContact CE2-CB 4.47Å; F616-A640 HydrophobicContact CG-CB 4.21Å; F616-A640 HydrophobicContact CZ-CB 4.24Å; A640-I648 HydrophobicContact CB-CD1 4.12Å; A640-I648 HydrophobicContact CB-CG2 4.26Å; A640-I648 WeakPolarHBondContact O-CD1 3.24Å; A640-Y650 HydrophobicContact CB-CE1 3.88Å; A640-Y650 PolarHBondContact N-OH 3.42Å; A640-A690 HydrophobicContact CB-CB 3.62Å
641	T	83.9	Confident	85	Confident	96 Å²	96	61.9 Å²	61.9	59%	0.589	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-116.5	130.6	175.3	53.8	0	0	0	0	108.9	R615	R615-T641 PolarHBondContact N-O 3.33Å; R615-T641 PolarHBondContact O-N 3.26Å; R615-T641 PolarHBondContact O-OG1 3.2Å
642	D	80.6	Confident	85	Confident	21 Å²	21	58.9 Å²	58.9	11%	0.112	34%	0.341	C	S	.	.			trans	-101.6	141.3	170.5	-172.3	68.9	0	0	0	108.9	S612 E644 G645 D646 I648	S612-D642 VanDerWaalsContact O-OD1 3.11Å; D642-E644 PolarHBondContact OD2-N 3.43Å; D642-E644 VanDerWaalsContact OD2-N 3.13Å; D642-G645 PolarHBondContact OD2-N 2.91Å; D642-D646 PolarHBondContact OD2-N 3.36Å; D642-I648 HydrophobicContact CB-CD1 3.94Å; D642-I648 HydrophobicContact CB-CG1 4.13Å
643	R	76.7	Confident	85	Confident	200 Å²	200	61.2 Å²	61.2	76%	0.755	34%	0.338	S	S	*	.	S	Bend	trans	-78.2	-32.1	-174.7	177.2	-171.5	177.7	-165.5	-5.1	110.9	S612 G645	S612-R643 WeakPolarHBondContact OG-CD 3.36Å; R643-G645 VanDerWaalsContact C-N 3.31Å
644	E	73	Confident	85	Confident	52 Å²	52	65.1 Å²	65.1	24%	0.243	36%	0.356	C	S	.	.	S	Bend	trans	-86.5	-8.8	-178.3	-64.2	75.1	-169.2	0	0	111.5	Q611 S612 D642	Q611-E644 PolarHBondContact N-OE1 3.4Å; S612-E644 WeakPolarHBondContact CB-OE2 3.4Å; S612-E644 PolarHBondContact N-OE1 3.17Å; S612-E644 PolarHBondContact OG-OE1 3.33Å; D642-E644 PolarHBondContact OD2-N 3.43Å; D642-E644 VanDerWaalsContact OD2-N 3.13Å
645	G	71.4	Confident	84.7	Confident	63 Å²	63	60.6 Å²	60.6	65%	0.649	34%	0.337	S	S	*	.			trans	81	18.6	176.6	0	0	0	0	0	113	D642 R643	D642-G645 PolarHBondContact OD2-N 2.91Å; R643-G645 VanDerWaalsContact C-N 3.31Å
646	D	75.6	Confident	84.6	Confident	21 Å²	21	60.5 Å²	60.5	11%	0.112	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-67.9	148	-177.3	-76.2	-32.1	0	0	0	111.8	D642 I648 D692 R694	D642-D646 PolarHBondContact OD2-N 3.36Å; D646-I648 WeakPolarHBondContact O-CG1 3.46Å; D646-I648 PolarHBondContact O-N 3.42Å; D646-D692 HydrophobicContact CB-CB 4.05Å; D646-R694 IonicContact OD1-CZ 3.32Å; D646-R694 IonicContact OD1-NH1 3.33Å; D646-R694 IonicContact OD1-NH2 3.17Å; D646-R694 PolarHBondContact OD1-NH2 3.31Å; D646-R694 IonicContact OD2-CZ 2.91Å; D646-R694 IonicContact OD2-NE 3.7Å; D646-R694 IonicContact OD2-NH1 2.77Å; D646-R694 PolarHBondContact OD2-NH1 3.09Å; D646-R694 IonicContact OD2-NH2 2.83Å; D646-R694 PolarHBondContact OD2-NH2 3.33Å
647	P	81.6	Confident	84.3	Confident	108 Å²	108	64.7 Å²	64.7	70%	0.701	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-61.7	121.8	178	-22.3	32.8	0	0	0	112.8
648	I	85.1	Confident	83.9	Confident	31 Å²	31	66.4 Å²	66.4	16%	0.159	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-96.3	132.5	-174.7	-52.7	171.9	0	0	0	111.5	P614 A640 D642 D646 Y650 A690	P614-I648 HydrophobicContact CB-CD1 4.25Å; P614-I648 HydrophobicContact CB-CG1 4.32Å; P614-I648 HydrophobicContact CB-CG2 4.13Å; P614-I648 HydrophobicContact CG-CG1 4.33Å; P614-I648 HydrophobicContact CG-CG2 4.41Å; A640-I648 HydrophobicContact CB-CD1 4.12Å; A640-I648 HydrophobicContact CB-CG2 4.26Å; A640-I648 WeakPolarHBondContact O-CD1 3.24Å; D642-I648 HydrophobicContact CB-CD1 3.94Å; D642-I648 HydrophobicContact CB-CG1 4.13Å; D646-I648 WeakPolarHBondContact O-CG1 3.46Å; D646-I648 PolarHBondContact O-N 3.42Å; I648-Y650 HydrophobicContact CG2-CE1 4.17Å; I648-Y650 HydrophobicContact CG2-CE2 4.22Å; I648-A690 HydrophobicContact CG2-CB 3.68Å
649	T	88.2	Confident	83.8	Confident	72 Å²	72	75.8 Å²	75.8	44%	0.442	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.3	173.2	58.6	0	0	0	0	111.5	E665 A690 S691	T649-E665 CarbonylContact C-O 3.53Å; T649-E665 WeakPolarHBondContact CA-O 3.27Å; T649-A690 CarbonylContact O-C 3.54Å; T649-A690 VanDerWaalsContact O-CA 3.28Å; T649-A690 WeakPolarHBondContact O-CA 3.48Å; T649-S691 PolarHBondContact N-O 3.04Å; T649-S691 PolarHBondContact O-N 2.7Å; T649-S691 PolarHBondContact OG1-O 3.41Å
650	Y	90.4	Very high	83.9	Confident	20 Å²	20	70 Å²	70	8%	0.078	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.1	-176.6	-58.9	-86.9	0	0	0	112.3	F616 L638 A640 I648 E665 T689 A690	F616-Y650 HydrophobicContact CE1-CD1 4.02Å; F616-Y650 AromaticContact CE1-CE1 3.84Å; F616-Y650 HydrophobicContact CE1-CE1 3.84Å; F616-Y650 HydrophobicContact CZ-CD1 4.05Å; F616-Y650 HydrophobicContact CZ-CE1 4.19Å; L638-Y650 WeakPolarHBondContact O-CE1 3.34Å; A640-Y650 HydrophobicContact CB-CE1 3.88Å; A640-Y650 PolarHBondContact N-OH 3.42Å; I648-Y650 HydrophobicContact CG2-CE1 4.17Å; I648-Y650 HydrophobicContact CG2-CE2 4.22Å; Y650-E665 WeakPolarHBondContact CD2-O 3.36Å; Y650-E665 PolarHBondContact N-O 3.01Å; Y650-T689 WeakPolarHBondContact CA-O 3.24Å; Y650-A690 HydrophobicContact CD1-CB 4.24Å; Y650-A690 HydrophobicContact CE1-CB 4.25Å
651	A	90.3	Very high	84.2	Confident	49 Å²	49	69.9 Å²	69.9	41%	0.405	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	146.5	177	0	0	0	0	0	113	E653 V688 T689	A651-E653 PolarHBondContact O-N 2.92Å; A651-V688 CarbonylContact O-C 3.59Å; A651-V688 WeakPolarHBondContact O-CA 3.25Å; A651-V688 WeakPolarHBondContact O-CG1 3.36Å; A651-T689 PolarHBondContact N-O 2.7Å; A651-T689 PolarHBondContact O-N 2.82Å; A651-T689 PolarHBondContact O-OG1 3.38Å
652	I	89.4	Confident	84.6	Confident	49 Å²	49	69.9 Å²	69.9	25%	0.251	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109	169.4	-55.8	175.5	0	0	0	107.6	N654 D656 F661 L663 L670	I652-N654 WeakPolarHBondContact CG2-O 3.37Å; I652-D656 HydrophobicContact CG2-CB 4.37Å; I652-F661 HydrophobicContact CD1-CB 4.23Å; I652-L663 HydrophobicContact CD1-CB 3.89Å; I652-L663 HydrophobicContact CG1-CB 3.79Å; I652-L663 HydrophobicContact CG1-CD2 3.73Å; I652-L663 HydrophobicContact CG1-CG 4.43Å; I652-L670 HydrophobicContact CD1-CD1 4.05Å
653	E	87.1	Confident	85.1	Confident	102 Å²	102	70.2 Å²	70.2	48%	0.477	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-41.5	178.4	-179.1	-176.1	-160.9	0	0	111.8	A651 I687 T689 K705	A651-E653 PolarHBondContact O-N 2.92Å; E653-I687 HydrophobicContact CB-CG2 4.35Å; E653-I687 PolarHBondContact N-O 3.28Å; E653-I687 WeakPolarHBondContact OE2-CG2 3.32Å; E653-T689 HydrophobicContact CB-CG2 4.03Å; E653-K705 IonicContact OE1-NZ 2.83Å; E653-K705 PolarHBondContact OE1-NZ 2.73Å; E653-K705 WeakPolarHBondContact OE2-CD 3.33Å; E653-K705 WeakPolarHBondContact OE2-CE 3.49Å; E653-K705 IonicContact OE2-NZ 2.69Å; E653-K705 PolarHBondContact OE2-NZ 2.88Å
654	N	86.9	Confident	85.9	Confident	103 Å²	103	62.7 Å²	62.7	55%	0.551	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.3	168.3	-175.3	-155.7	-5.7	0	0	0	111.6	I652 L686 I687	I652-N654 WeakPolarHBondContact CG2-O 3.37Å; N654-L686 CarbonylContact O-C 3.22Å; N654-L686 WeakPolarHBondContact O-CA 3.49Å; N654-I687 HydrophobicContact CB-CB 4.15Å; N654-I687 HydrophobicContact CB-CD1 4.07Å; N654-I687 HydrophobicContact CB-CG1 4.24Å; N654-I687 PolarHBondContact N-O 3.12Å; N654-I687 PolarHBondContact O-N 3.35Å
655	G	84.1	Confident	86.7	Confident	19 Å²	19	67 Å²	67	20%	0.196	37%	0.374	C	S	.	.	S	Bend	trans	97.2	-7.7	173.9	0	0	0	0	0	116.2	I685	G655-I685 WeakPolarHBondContact CA-O 3.21Å
656	D	88.6	Confident	87.4	Confident	19 Å²	19	69.2 Å²	69.2	10%	0.102	38%	0.375	C	S	.	.			trans	-129.2	66.4	175.2	-173.1	15.5	0	0	0	112.7	I652 Q658 R659 V660 F661 L686	I652-D656 HydrophobicContact CG2-CB 4.37Å; D656-Q658 PolarHBondContact O-N 3.38Å; D656-R659 PolarHBondContact O-N 3.07Å; D656-R659 WeakPolarHBondContact OD1-CA 3.4Å; D656-R659 PolarHBondContact OD1-N 2.9Å; D656-R659 VanDerWaalsContact OD2-CA 3.22Å; D656-R659 WeakPolarHBondContact OD2-CA 3.46Å; D656-V660 WeakPolarHBondContact OD1-CB 3.45Å; D656-V660 PolarHBondContact OD1-N 2.77Å; D656-V660 PolarHBondContact OD2-N 2.86Å; D656-F661 HydrophobicContact CB-CD2 4.14Å; D656-F661 PolarHBondContact OD2-N 3.11Å; D656-L686 HydrophobicContact CB-CD2 3.72Å
657	P	82	Confident	88	Confident	120 Å²	120	71.3 Å²	71.3	78%	0.779	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.6	-177.8	27	-34.9	0	0	0	113.2
658	Q	83.6	Confident	88.3	Confident	117 Å²	117	66.2 Å²	66.2	55%	0.547	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	0.8	-178.9	-66.9	-175.1	9.2	0	0	113.2	D656 V660 K674	D656-Q658 PolarHBondContact O-N 3.38Å; Q658-V660 VanDerWaalsContact C-N 3.33Å; Q658-V660 HydrophobicContact CB-CG2 3.78Å; Q658-V660 PolarHBondContact O-N 3.01Å; Q658-K674 PolarHBondContact O-NZ 2.83Å
659	R	87.7	Confident	88.6	Confident	197 Å²	197	67.3 Å²	67.3	74%	0.743	36%	0.361	S	S	*	.			trans	52	51.7	-174.8	-58.6	-174.8	-177.9	179.2	-1.6	111.5	D656 K674	D656-R659 PolarHBondContact O-N 3.07Å; D656-R659 WeakPolarHBondContact OD1-CA 3.4Å; D656-R659 PolarHBondContact OD1-N 2.9Å; D656-R659 VanDerWaalsContact OD2-CA 3.22Å; D656-R659 WeakPolarHBondContact OD2-CA 3.46Å; R659-K674 WeakPolarHBondContact O-CE 3.34Å
660	V	90.3	Very high	88.8	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	34%	0.34	C	S	.	.			trans	-77.1	-28.4	176.5	-177.9	0	0	0	0	110.7	D656 Q658 L672 G673 K674 L676 Y684	D656-V660 WeakPolarHBondContact OD1-CB 3.45Å; D656-V660 PolarHBondContact OD1-N 2.77Å; D656-V660 PolarHBondContact OD2-N 2.86Å; Q658-V660 VanDerWaalsContact C-N 3.33Å; Q658-V660 HydrophobicContact CB-CG2 3.78Å; Q658-V660 PolarHBondContact O-N 3.01Å; V660-L672 HydrophobicContact CG1-CD1 4.16Å; V660-G673 CarbonylContact O-C 3.52Å; V660-G673 VanDerWaalsContact O-CA 3.27Å; V660-G673 WeakPolarHBondContact O-CA 3.25Å; V660-G673 PolarHBondContact O-N 2.8Å; V660-K674 HydrophobicContact CG1-CB 4.36Å; V660-K674 PolarHBondContact O-N 2.98Å; V660-K674 VanDerWaalsContact O-N 3.08Å; V660-L676 HydrophobicContact CG1-CD2 3.75Å; V660-Y684 HydrophobicContact CB-CE1 4.36Å; V660-Y684 HydrophobicContact CG2-CE1 4.03Å
661	F	92	Very high	88.8	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.026	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.5	-179.2	-52.9	-78.4	0	0	0	111.5	L635 I652 D656 L670 S671 L672 L676 Y684 L686 I710	L635-F661 HydrophobicContact CD1-CD1 3.49Å; L635-F661 VanDerWaalsContact CD1-CD1 3.49Å; L635-F661 HydrophobicContact CD1-CE1 3.5Å; I652-F661 HydrophobicContact CD1-CB 4.23Å; D656-F661 HydrophobicContact CB-CD2 4.14Å; D656-F661 PolarHBondContact OD2-N 3.11Å; F661-L670 HydrophobicContact CB-CD1 3.87Å; F661-S671 CarbonylContact C-O 3.56Å; F661-S671 WeakPolarHBondContact CA-O 3.33Å; F661-L672 HydrophobicContact CD1-CD1 4.15Å; F661-L672 HydrophobicContact CE1-CD1 3.9Å; F661-L676 HydrophobicContact CE1-CD2 4.41Å; F661-L676 HydrophobicContact CZ-CD2 4.22Å; F661-Y684 AromaticContact CE2-CD1 3.55Å; F661-Y684 HydrophobicContact CE2-CD1 3.55Å; F661-Y684 HydrophobicContact CE2-CD2 4.01Å; F661-Y684 HydrophobicContact CE2-CE1 4.1Å; F661-Y684 AromaticContact CE2-CG 3.48Å; F661-Y684 HydrophobicContact CE2-CG 3.48Å; F661-Y684 VanDerWaalsContact CE2-CG 3.48Å; F661-Y684 HydrophobicContact CZ-CD1 4.16Å; F661-Y684 AromaticContact CZ-CD2 3.75Å; F661-Y684 HydrophobicContact CZ-CD2 3.75Å; F661-Y684 HydrophobicContact CZ-CE2 4.27Å; F661-Y684 AromaticContact CZ-CG 3.68Å; F661-Y684 HydrophobicContact CZ-CG 3.68Å; F661-L686 HydrophobicContact CB-CD1 4.34Å; F661-L686 HydrophobicContact CD2-CD1 3.82Å; F661-L686 HydrophobicContact CD2-CD2 3.66Å; F661-L686 HydrophobicContact CD2-CG 4.31Å; F661-L686 HydrophobicContact CE2-CD1 4.29Å; F661-L686 HydrophobicContact CE2-CD2 3.9Å; F661-L686 HydrophobicContact CE2-CG 4.5Å; F661-L686 HydrophobicContact CG-CD1 3.98Å; F661-I710 HydrophobicContact CD1-CD1 3.91Å; F661-I710 HydrophobicContact CE1-CD1 3.3Å; F661-I710 HydrophobicContact CE2-CD1 4.09Å; F661-I710 HydrophobicContact CZ-CD1 3.41Å; F661-I710 VanDerWaalsContact CZ-CD1 3.41Å
662	N	91.7	Very high	88.9	Confident	95 Å²	95	61.8 Å²	61.8	51%	0.508	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121	172.1	-76.4	-19.9	0	0	0	108.7	L670 S671	N662-L670 CarbonylContact O-C 3.58Å; N662-L670 WeakPolarHBondContact O-CA 2.95Å; N662-S671 WeakPolarHBondContact CB-OG 3.5Å; N662-S671 PolarHBondContact N-O 3.05Å; N662-S671 PolarHBondContact O-N 3.07Å; N662-S671 PolarHBondContact O-OG 2.91Å; N662-S671 VanDerWaalsContact O-OG 3.09Å
663	L	92.3	Very high	88.8	Confident	29 Å²	29	60.5 Å²	60.5	15%	0.152	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.8	172.7	-179.7	64.9	0	0	0	109.4	L638 I652 E665 G668 I669 L670 V688	L638-L663 HydrophobicContact CD1-CD1 4Å; I652-L663 HydrophobicContact CD1-CB 3.89Å; I652-L663 HydrophobicContact CG1-CB 3.79Å; I652-L663 HydrophobicContact CG1-CD2 3.73Å; I652-L663 HydrophobicContact CG1-CG 4.43Å; L663-E665 PolarHBondContact O-N 3.28Å; L663-G668 WeakPolarHBondContact CD1-O 3.34Å; L663-I669 WeakPolarHBondContact CA-O 3.46Å; L663-L670 HydrophobicContact CB-CD1 4.22Å; L663-L670 HydrophobicContact CD1-CB 4.2Å; L663-L670 HydrophobicContact CD1-CD1 4.36Å; L663-V688 HydrophobicContact CD2-CG1 3.6Å
664	S	92.2	Very high	88.9	Confident	41 Å²	41	60.6 Å²	60.6	29%	0.287	32%	0.323	S	S	.	.			trans	-75.3	123	174.6	175.1	0	0	0	0	110.9	T666 T667 G668 I669	S664-T666 VanDerWaalsContact C-N 3.29Å; S664-T666 PolarHBondContact O-N 2.76Å; S664-T667 WeakPolarHBondContact CB-OG1 3.47Å; S664-T667 PolarHBondContact OG-N 2.63Å; S664-T667 PolarHBondContact OG-OG1 2.85Å; S664-G668 PolarHBondContact O-N 2.74Å; S664-I669 PolarHBondContact N-O 3.32Å
665	E	90.3	Very high	88.9	Confident	142 Å²	142	59 Å²	59	66%	0.664	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.2	-175.7	-66.7	-179.8	-178.9	0	0	113.8	T649 Y650 L663	T649-E665 CarbonylContact C-O 3.53Å; T649-E665 WeakPolarHBondContact CA-O 3.27Å; Y650-E665 WeakPolarHBondContact CD2-O 3.36Å; Y650-E665 PolarHBondContact N-O 3.01Å; L663-E665 PolarHBondContact O-N 3.28Å
666	T	87	Confident	88.9	Confident	111 Å²	111	59.2 Å²	59.2	68%	0.681	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-29.6	-176.3	52.5	0	0	0	0	113.5	S664	S664-T666 VanDerWaalsContact C-N 3.29Å; S664-T666 PolarHBondContact O-N 2.76Å
667	T	86.9	Confident	88.7	Confident	65 Å²	65	62 Å²	62	40%	0.399	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-14.6	-175	67.1	0	0	0	0	113.8	N637 S664 I669	N637-T667 PolarHBondContact OD1-O 3.42Å; S664-T667 WeakPolarHBondContact CB-OG1 3.47Å; S664-T667 PolarHBondContact OG-N 2.63Å; S664-T667 PolarHBondContact OG-OG1 2.85Å; T667-I669 PolarHBondContact O-N 2.89Å; T667-I669 WeakPolarHBondContact OG1-CD1 3.24Å; T667-I669 WeakPolarHBondContact OG1-CG1 3.48Å
668	G	87.6	Confident	88.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.			trans	71.2	10.1	-177.1	0	0	0	0	0	114.6	L638 L663 S664 L670	L638-G668 WeakPolarHBondContact CB-O 3.37Å; L638-G668 PolarHBondContact N-O 3.1Å; L638-G668 WeakPolarHBondContact O-CA 3.29Å; L663-G668 WeakPolarHBondContact CD1-O 3.34Å; S664-G668 PolarHBondContact O-N 2.74Å; G668-L670 PolarHBondContact O-N 2.85Å
669	I	92.1	Very high	88.5	Confident	55 Å²	55	64.7 Å²	64.7	28%	0.282	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	117.8	-179.9	-63.1	173	0	0	0	110.3	I634 L663 S664 T667	I634-I669 HydrophobicContact CB-CG2 4.44Å; I634-I669 HydrophobicContact CD1-CG2 4.26Å; I634-I669 HydrophobicContact CG1-CG2 3.97Å; I634-I669 HydrophobicContact CG2-CG2 3.77Å; L663-I669 WeakPolarHBondContact CA-O 3.46Å; S664-I669 PolarHBondContact N-O 3.32Å; T667-I669 PolarHBondContact O-N 2.89Å; T667-I669 WeakPolarHBondContact OG1-CD1 3.24Å; T667-I669 WeakPolarHBondContact OG1-CG1 3.48Å
670	L	91.5	Very high	88.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.6	171.9	-174.6	71.8	0	0	0	109.7	L635 L636 I652 F661 N662 L663 G668 L686 V708 I710	L635-L670 HydrophobicContact CB-CD2 4.45Å; L635-L670 PolarHBondContact N-O 3.38Å; L636-L670 HydrophobicContact CB-CB 4.15Å; L636-L670 HydrophobicContact CB-CD2 4.27Å; L636-L670 PolarHBondContact N-O 2.64Å; L636-L670 PolarHBondContact O-N 3.5Å; I652-L670 HydrophobicContact CD1-CD1 4.05Å; F661-L670 HydrophobicContact CB-CD1 3.87Å; N662-L670 CarbonylContact O-C 3.58Å; N662-L670 WeakPolarHBondContact O-CA 2.95Å; L663-L670 HydrophobicContact CB-CD1 4.22Å; L663-L670 HydrophobicContact CD1-CB 4.2Å; L663-L670 HydrophobicContact CD1-CD1 4.36Å; G668-L670 PolarHBondContact O-N 2.85Å; L670-L686 HydrophobicContact CD1-CD1 3.91Å; L670-L686 HydrophobicContact CD2-CD1 3.77Å; L670-L686 HydrophobicContact CG-CD1 4.46Å; L670-V708 HydrophobicContact CD2-CG1 3.96Å; L670-I710 HydrophobicContact CD2-CD1 4.32Å
671	S	92.2	Very high	87.8	Confident	24 Å²	24	60.3 Å²	60.3	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.8	-177.1	60.9	0	0	0	0	112	A633 F661 N662 G673	A633-S671 CarbonylContact O-C 3.55Å; A633-S671 VanDerWaalsContact O-CA 3.24Å; A633-S671 WeakPolarHBondContact O-CA 3.4Å; F661-S671 CarbonylContact C-O 3.56Å; F661-S671 WeakPolarHBondContact CA-O 3.33Å; N662-S671 WeakPolarHBondContact CB-OG 3.5Å; N662-S671 PolarHBondContact N-O 3.05Å; N662-S671 PolarHBondContact O-N 3.07Å; N662-S671 PolarHBondContact O-OG 2.91Å; N662-S671 VanDerWaalsContact O-OG 3.09Å; S671-G673 PolarHBondContact O-N 2.86Å
672	L	91.5	Very high	87.4	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113.4	179.9	-171.5	65.2	0	0	0	111.1	M629 G632 A633 L635 V660 F661 K674 L676	M629-L672 HydrophobicContact CB-CD2 3.94Å; M629-L672 HydrophobicContact CG-CD2 3.94Å; M629-L672 WeakPolarHBondContact O-CD2 3.34Å; G632-L672 PolarHBondContact N-O 2.83Å; A633-L672 PolarHBondContact O-N 2.81Å; L635-L672 HydrophobicContact CD1-CB 4.44Å; L635-L672 HydrophobicContact CD2-CB 4.47Å; V660-L672 HydrophobicContact CG1-CD1 4.16Å; F661-L672 HydrophobicContact CD1-CD1 4.15Å; F661-L672 HydrophobicContact CE1-CD1 3.9Å; L672-K674 VanDerWaalsContact CD1-O 3.23Å; L672-K674 WeakPolarHBondContact CD1-O 2.99Å; L672-K674 WeakPolarHBondContact CG-O 3.38Å; L672-L676 HydrophobicContact CD1-CD1 4.16Å; L672-L676 HydrophobicContact CD1-CD2 3.7Å; L672-L676 HydrophobicContact CD1-CG 3.73Å; L672-L676 HydrophobicContact CD2-CD1 4.38Å; L672-L676 HydrophobicContact CD2-CG 4.2Å
673	G	87.8	Confident	87.2	Confident	22 Å²	22	67.3 Å²	67.3	23%	0.227	36%	0.357	C	S	.	.			trans	-90.8	-24.6	-179.1	0	0	0	0	0	114.9	V660 S671	V660-G673 CarbonylContact O-C 3.52Å; V660-G673 VanDerWaalsContact O-CA 3.27Å; V660-G673 WeakPolarHBondContact O-CA 3.25Å; V660-G673 PolarHBondContact O-N 2.8Å; S671-G673 PolarHBondContact O-N 2.86Å
674	K	88.5	Confident	87	Confident	104 Å²	104	66.9 Å²	66.9	45%	0.452	35%	0.354	S	S	.	.	S	Bend	trans	-137.4	157	177.5	-63.8	179.6	-177.5	173.2	0	110.7	Q658 R659 V660 L672	Q658-K674 PolarHBondContact O-NZ 2.83Å; R659-K674 WeakPolarHBondContact O-CE 3.34Å; V660-K674 HydrophobicContact CG1-CB 4.36Å; V660-K674 PolarHBondContact O-N 2.98Å; V660-K674 VanDerWaalsContact O-N 3.08Å; L672-K674 VanDerWaalsContact CD1-O 3.23Å; L672-K674 WeakPolarHBondContact CD1-O 2.99Å; L672-K674 WeakPolarHBondContact CG-O 3.38Å
675	A	86.7	Confident	86.8	Confident	70 Å²	70	68.1 Å²	68.1	58%	0.579	36%	0.356	S	S	*	.			trans	-59.8	139.5	174.2	0	0	0	0	0	110.4	I631	I631-A675 HydrophobicContact CD1-CB 4.49Å
676	L	85.5	Confident	86.8	Confident	22 Å²	22	61.3 Å²	61.3	12%	0.115	33%	0.325	C	S	.	.			trans	-81.6	144.3	173.9	-63.1	174.3	0	0	0	108.9	V625 V660 F661 L672 Y684	V625-L676 HydrophobicContact CB-CD1 4.25Å; V625-L676 HydrophobicContact CG1-CD1 3.59Å; V660-L676 HydrophobicContact CG1-CD2 3.75Å; F661-L676 HydrophobicContact CE1-CD2 4.41Å; F661-L676 HydrophobicContact CZ-CD2 4.22Å; L672-L676 HydrophobicContact CD1-CD1 4.16Å; L672-L676 HydrophobicContact CD1-CD2 3.7Å; L672-L676 HydrophobicContact CD1-CG 3.73Å; L672-L676 HydrophobicContact CD2-CD1 4.38Å; L672-L676 HydrophobicContact CD2-CG 4.2Å; L676-Y684 HydrophobicContact CD2-CD2 4.41Å; L676-Y684 HydrophobicContact CD2-CE2 3.75Å
677	D	84.4	Confident	86.9	Confident	77 Å²	77	58 Å²	58	41%	0.412	30%	0.302	S	S	.	.			trans	-135.5	104.9	178.3	172.6	-0.2	0	0	0	107.3	E679 S680 T681	D677-E679 PolarHBondContact O-N 2.74Å; D677-E679 WeakPolarHBondContact OD1-CB 3.32Å; D677-E679 PolarHBondContact OD1-N 3.06Å; D677-E679 VanDerWaalsContact OD1-N 3.08Å; D677-S680 WeakPolarHBondContact O-CB 3.05Å; D677-S680 PolarHBondContact O-N 3.06Å; D677-S680 PolarHBondContact O-OG 3.35Å; D677-S680 PolarHBondContact OD1-N 2.85Å; D677-T681 PolarHBondContact O-N 2.96Å; D677-T681 VanDerWaalsContact O-N 3.15Å
678	R	79.7	Confident	87	Confident	144 Å²	144	54.9 Å²	54.9	54%	0.543	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-32.9	-175.3	-168.3	-168.4	112	103.5	1.2	111.8	S680 E712	R678-S680 PolarHBondContact O-N 2.83Å; R678-E712 WeakPolarHBondContact CD-OE2 3.34Å; R678-E712 VanDerWaalsContact CG-OE2 3.3Å; R678-E712 WeakPolarHBondContact CG-OE2 3.24Å
679	E	80.2	Confident	87.1	Confident	151 Å²	151	56.7 Å²	56.7	71%	0.706	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.4	176.7	-72.9	65.1	-141.3	0	0	112.2	D677	D677-E679 PolarHBondContact O-N 2.74Å; D677-E679 WeakPolarHBondContact OD1-CB 3.32Å; D677-E679 PolarHBondContact OD1-N 3.06Å; D677-E679 VanDerWaalsContact OD1-N 3.08Å
680	S	81.8	Confident	86.8	Confident	63 Å²	63	55 Å²	55	44%	0.441	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-41.9	179	80.2	0	0	0	0	113.4	D677 R678	D677-S680 WeakPolarHBondContact O-CB 3.05Å; D677-S680 PolarHBondContact O-N 3.06Å; D677-S680 PolarHBondContact O-OG 3.35Å; D677-S680 PolarHBondContact OD1-N 2.85Å; R678-S680 PolarHBondContact O-N 2.83Å
681	T	82.5	Confident	86.4	Confident	45 Å²	45	57.6 Å²	57.6	28%	0.276	31%	0.307	S	S	.	.			trans	-153	112.5	-176.2	-59	0	0	0	0	108.9	D677 R683 Y684	D677-T681 PolarHBondContact O-N 2.96Å; D677-T681 VanDerWaalsContact O-N 3.15Å; T681-R683 VanDerWaalsContact C-N 3.34Å; T681-R683 WeakPolarHBondContact CG2-O 3.5Å; T681-Y684 HydrophobicContact CG2-CD1 4.2Å; T681-Y684 HydrophobicContact CG2-CD2 4.19Å; T681-Y684 HydrophobicContact CG2-CE1 3.93Å; T681-Y684 HydrophobicContact CG2-CE2 3.89Å; T681-Y684 HydrophobicContact CG2-CG 4.34Å
682	D	82.9	Confident	85.8	Confident	116 Å²	116	57.4 Å²	57.4	62%	0.62	30%	0.304	S	S	*	.	S	Bend	trans	-79.2	-15.7	-177.4	63.6	-19	0	0	0	113.8
683	R	87.3	Confident	84.8	Confident	132 Å²	132	60.2 Å²	60.2	50%	0.498	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	144.6	176.1	65.8	-175.4	177.6	176.2	-2.1	112.6	T681 I710 R711	T681-R683 VanDerWaalsContact C-N 3.34Å; T681-R683 WeakPolarHBondContact CG2-O 3.5Å; R683-I710 CarbonylContact C-O 3.43Å; R683-I710 WeakPolarHBondContact CA-O 3.3Å; R683-R711 HydrophobicContact CB-CG 3.96Å
684	Y	88.2	Confident	83.7	Confident	20 Å²	20	64.3 Å²	64.3	8%	0.078	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	138.1	168.2	-64.6	-93.5	0	0	0	110.1	V660 F661 L676 T681 E709 I710	V660-Y684 HydrophobicContact CB-CE1 4.36Å; V660-Y684 HydrophobicContact CG2-CE1 4.03Å; F661-Y684 AromaticContact CE2-CD1 3.55Å; F661-Y684 HydrophobicContact CE2-CD1 3.55Å; F661-Y684 HydrophobicContact CE2-CD2 4.01Å; F661-Y684 HydrophobicContact CE2-CE1 4.1Å; F661-Y684 AromaticContact CE2-CG 3.48Å; F661-Y684 HydrophobicContact CE2-CG 3.48Å; F661-Y684 VanDerWaalsContact CE2-CG 3.48Å; F661-Y684 HydrophobicContact CZ-CD1 4.16Å; F661-Y684 AromaticContact CZ-CD2 3.75Å; F661-Y684 HydrophobicContact CZ-CD2 3.75Å; F661-Y684 HydrophobicContact CZ-CE2 4.27Å; F661-Y684 AromaticContact CZ-CG 3.68Å; F661-Y684 HydrophobicContact CZ-CG 3.68Å; L676-Y684 HydrophobicContact CD2-CD2 4.41Å; L676-Y684 HydrophobicContact CD2-CE2 3.75Å; T681-Y684 HydrophobicContact CG2-CD1 4.2Å; T681-Y684 HydrophobicContact CG2-CD2 4.19Å; T681-Y684 HydrophobicContact CG2-CE1 3.93Å; T681-Y684 HydrophobicContact CG2-CE2 3.89Å; T681-Y684 HydrophobicContact CG2-CG 4.34Å; Y684-E709 CarbonylContact O-C 3.58Å; Y684-E709 WeakPolarHBondContact O-CA 3.15Å; Y684-I710 PolarHBondContact N-O 2.82Å; Y684-I710 PolarHBondContact O-N 3.22Å
685	I	89.1	Confident	82.3	Confident	66 Å²	66	64.9 Å²	64.9	34%	0.338	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	91.8	175.9	-57.3	174.6	0	0	0	107.5	G655 K707 V708	G655-I685 WeakPolarHBondContact CA-O 3.21Å; I685-K707 HydrophobicContact CG2-CB 4.47Å; I685-K707 HydrophobicContact CG2-CD 4.48Å; I685-V708 CarbonylContact C-O 3.59Å; I685-V708 WeakPolarHBondContact CA-O 3.47Å
686	L	90.2	Very high	80.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	135.5	179.9	-44.2	178.7	0	0	0	110.2	N654 D656 F661 L670 V688 K707 V708 I710	N654-L686 CarbonylContact O-C 3.22Å; N654-L686 WeakPolarHBondContact O-CA 3.49Å; D656-L686 HydrophobicContact CB-CD2 3.72Å; F661-L686 HydrophobicContact CB-CD1 4.34Å; F661-L686 HydrophobicContact CD2-CD1 3.82Å; F661-L686 HydrophobicContact CD2-CD2 3.66Å; F661-L686 HydrophobicContact CD2-CG 4.31Å; F661-L686 HydrophobicContact CE2-CD1 4.29Å; F661-L686 HydrophobicContact CE2-CD2 3.9Å; F661-L686 HydrophobicContact CE2-CG 4.5Å; F661-L686 HydrophobicContact CG-CD1 3.98Å; L670-L686 HydrophobicContact CD1-CD1 3.91Å; L670-L686 HydrophobicContact CD2-CD1 3.77Å; L670-L686 HydrophobicContact CG-CD1 4.46Å; L686-V688 HydrophobicContact CB-CG2 4.42Å; L686-K707 CarbonylContact O-C 3.39Å; L686-K707 VanDerWaalsContact O-CA 3.28Å; L686-K707 WeakPolarHBondContact O-CA 3.31Å; L686-V708 HydrophobicContact CB-CB 4.04Å; L686-V708 HydrophobicContact CD1-CB 4.34Å; L686-V708 HydrophobicContact CG-CB 4.38Å; L686-V708 PolarHBondContact N-O 2.64Å; L686-V708 PolarHBondContact O-N 2.76Å; L686-I710 HydrophobicContact CD1-CD1 3.95Å
687	I	89.6	Confident	79.3	Confident	41 Å²	41	68.1 Å²	68.1	21%	0.21	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.4	168.9	-56.3	-176.3	0	0	0	106.6	E653 N654 K705	E653-I687 HydrophobicContact CB-CG2 4.35Å; E653-I687 PolarHBondContact N-O 3.28Å; E653-I687 WeakPolarHBondContact OE2-CG2 3.32Å; N654-I687 HydrophobicContact CB-CB 4.15Å; N654-I687 HydrophobicContact CB-CD1 4.07Å; N654-I687 HydrophobicContact CB-CG1 4.24Å; N654-I687 PolarHBondContact N-O 3.12Å; N654-I687 PolarHBondContact O-N 3.35Å; I687-K705 HydrophobicContact CG2-CB 3.82Å; I687-K705 HydrophobicContact CG2-CD 3.96Å
688	V	88.9	Confident	77.7	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	141.7	-177.6	-174.9	0	0	0	0	110	F616 L638 A651 L663 L686 P706 V708	F616-V688 HydrophobicContact CZ-CG1 4.22Å; L638-V688 HydrophobicContact CD1-CB 4.13Å; L638-V688 HydrophobicContact CD1-CG1 3.8Å; L638-V688 HydrophobicContact CD1-CG2 3.83Å; A651-V688 CarbonylContact O-C 3.59Å; A651-V688 WeakPolarHBondContact O-CA 3.25Å; A651-V688 WeakPolarHBondContact O-CG1 3.36Å; L663-V688 HydrophobicContact CD2-CG1 3.6Å; L686-V688 HydrophobicContact CB-CG2 4.42Å; V688-P706 HydrophobicContact CB-CG 4.26Å; V688-P706 PolarHBondContact N-O 3.23Å; V688-P706 VanDerWaalsContact O-CD 3.23Å; V688-P706 WeakPolarHBondContact O-CD 3.39Å; V688-P706 WeakPolarHBondContact O-CG 3.36Å; V688-V708 HydrophobicContact CG2-CG2 4.03Å
689	T	88.3	Confident	76.3	Confident	38 Å²	38	68.8 Å²	68.8	23%	0.233	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.4	176	51.4	0	0	0	0	110.7	Y650 A651 E653 K705	Y650-T689 WeakPolarHBondContact CA-O 3.24Å; A651-T689 PolarHBondContact N-O 2.7Å; A651-T689 PolarHBondContact O-N 2.82Å; A651-T689 PolarHBondContact O-OG1 3.38Å; E653-T689 HydrophobicContact CB-CG2 4.03Å; T689-K705 HydrophobicContact CG2-CD 3.85Å; T689-K705 HydrophobicContact CG2-CG 4.41Å
690	A	85.6	Confident	74.9	Confident	20 Å²	20	67.4 Å²	67.4	17%	0.165	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.4	168.2	0	0	0	0	0	108.3	P614 F616 A640 I648 T649 Y650	P614-A690 HydrophobicContact CB-CB 3.89Å; F616-A690 HydrophobicContact CD2-CB 4.39Å; F616-A690 HydrophobicContact CE1-CB 4.32Å; F616-A690 HydrophobicContact CE2-CB 3.47Å; F616-A690 VanDerWaalsContact CE2-CB 3.47Å; F616-A690 HydrophobicContact CZ-CB 3.44Å; F616-A690 VanDerWaalsContact CZ-CB 3.44Å; A640-A690 HydrophobicContact CB-CB 3.62Å; I648-A690 HydrophobicContact CG2-CB 3.68Å; T649-A690 CarbonylContact O-C 3.54Å; T649-A690 VanDerWaalsContact O-CA 3.28Å; T649-A690 WeakPolarHBondContact O-CA 3.48Å; Y650-A690 HydrophobicContact CD1-CB 4.24Å; Y650-A690 HydrophobicContact CE1-CB 4.25Å
691	S	84.1	Confident	73.4	Confident	54 Å²	54	72.7 Å²	72.7	38%	0.378	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.2	179.9	177.9	0	0	0	0	111	T649 G693	T649-S691 PolarHBondContact N-O 3.04Å; T649-S691 PolarHBondContact O-N 2.7Å; T649-S691 PolarHBondContact OG1-O 3.41Å; S691-G693 VanDerWaalsContact C-N 3.31Å; S691-G693 PolarHBondContact OG-N 2.96Å
692	D	79.9	Confident	71.9	Confident	20 Å²	20	78.9 Å²	78.9	11%	0.107	43%	0.428	C	S	.	.			trans	-83.9	-0.2	174.8	54.9	11.1	0	0	0	113.2	P614 D646 R694	P614-D692 HydrophobicContact CG-CB 3.86Å; D646-D692 HydrophobicContact CB-CB 4.05Å; D692-R694 VanDerWaalsContact C-N 3.26Å; D692-R694 PolarHBondContact O-N 2.88Å; D692-R694 PolarHBondContact OD1-N 2.8Å
693	G	69	Low	70.6	Confident	60 Å²	60	76.5 Å²	76.5	62%	0.619	42%	0.417	S	S	*	.	S	Bend	trans	74.4	3.3	-177.3	0	0	0	0	0	115.6	S691	S691-G693 VanDerWaalsContact C-N 3.31Å; S691-G693 PolarHBondContact OG-N 2.96Å
694	R	66	Low	69.3	Low	107 Å²	107	77.6 Å²	77.6	40%	0.404	43%	0.425	S	S	.	.			trans	-105.5	117	-179.4	-66.3	-173.4	-173.1	163.2	19.3	111	N610 D646 D692 D696	N610-R694 VanDerWaalsContact ND2-CB 3.31Å; N610-R694 WeakPolarHBondContact ND2-CB 3.44Å; D646-R694 IonicContact OD1-CZ 3.32Å; D646-R694 IonicContact OD1-NH1 3.33Å; D646-R694 IonicContact OD1-NH2 3.17Å; D646-R694 PolarHBondContact OD1-NH2 3.31Å; D646-R694 IonicContact OD2-CZ 2.91Å; D646-R694 IonicContact OD2-NE 3.7Å; D646-R694 IonicContact OD2-NH1 2.77Å; D646-R694 PolarHBondContact OD2-NH1 3.09Å; D646-R694 IonicContact OD2-NH2 2.83Å; D646-R694 PolarHBondContact OD2-NH2 3.33Å; D692-R694 VanDerWaalsContact C-N 3.26Å; D692-R694 PolarHBondContact O-N 2.88Å; D692-R694 PolarHBondContact OD1-N 2.8Å; R694-D696 PolarHBondContact O-N 2.88Å
695	P	59.5	Low	68.4	Low	117 Å²	117	80.9 Å²	80.9	76%	0.76	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.8	-177.4	28.1	-33	0	0	0	114.1
696	D	56.5	Low	67.9	Low	140 Å²	140	77.8 Å²	77.8	75%	0.749	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	5.1	-167.8	-53.9	-43	0	0	0	114.1	R694 V698	R694-D696 PolarHBondContact O-N 2.88Å; D696-V698 PolarHBondContact O-N 2.94Å
697	G	51.7	Low	67.4	Low	19 Å²	19	82.4 Å²	82.4	20%	0.196	44%	0.444	C	S	.	.	S	Bend	trans	-68.2	125.1	172.3	0	0	0	0	0	112	E699	G697-E699 PolarHBondContact O-N 2.77Å; G697-E699 VanDerWaalsContact O-N 3.14Å
698	V	50.5	Low	67	Low	111 Å²	111	80.5 Å²	80.5	67%	0.673	43%	0.434	S	S	*	.	S	Bend	trans	-45.6	112.7	-174.8	-165.2	0	0	0	0	113	D696	D696-V698 PolarHBondContact O-N 2.94Å
699	E	50.3	Low	66.8	Low	125 Å²	125	81.6 Å²	81.6	58%	0.584	44%	0.44	S	S	*	.			trans	39.1	107.6	173.7	-77	-175	166.6	0	0	118.3	G697 E701	G697-E699 PolarHBondContact O-N 2.77Å; G697-E699 VanDerWaalsContact O-N 3.14Å; E699-E701 PolarHBondContact O-N 3.22Å
700	P	51.7	Low	66.4	Low	122 Å²	122	80 Å²	80	79%	0.792	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-66.3	-0.3	175.8	26.4	-34	0	0	0	115	K702	P700-K702 PolarHBondContact O-N 2.86Å
701	E	49.7	Very low	66.1	Low	174 Å²	174	84.2 Å²	84.2	81%	0.813	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-80.2	-11.6	-170.7	-125.3	-175.1	179.5	0	0	114.7	E699	E699-E701 PolarHBondContact O-N 3.22Å
702	K	50.7	Low	65.4	Low	175 Å²	175	84.3 Å²	84.3	76%	0.761	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-112.8	-0.4	-178.5	-70.1	178.2	-174.5	158.1	0	115.3	P700 K704	P700-K702 PolarHBondContact O-N 2.86Å; K702-K704 PolarHBondContact O-N 2.8Å
703	V	56	Low	64.5	Low	65 Å²	65	86.3 Å²	86.3	39%	0.394	45%	0.45	S	S	.	.			trans	-80.4	107.2	180	-173.1	0	0	0	0	109.8	P613 K705	P613-V703 HydrophobicContact CB-CG2 4.11Å; P613-V703 HydrophobicContact CG-CG2 3.66Å; V703-K705 PolarHBondContact O-N 2.89Å
704	K	59.1	Low	63.9	Low	156 Å²	156	88.4 Å²	88.4	68%	0.678	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-69.3	117.3	174.2	-66.7	-177.5	-178.5	177.5	0	109.4	L619 K702	L619-K704 HydrophobicContact CD1-CB 4.44Å; L619-K704 HydrophobicContact CD1-CD 3.68Å; L619-K704 HydrophobicContact CD2-CB 3.46Å; L619-K704 VanDerWaalsContact CD2-CB 3.46Å; L619-K704 HydrophobicContact CD2-CD 4.25Å; K702-K704 PolarHBondContact O-N 2.8Å
705	K	70.8	Confident	62.9	Low	89 Å²	89	92.6 Å²	92.6	39%	0.387	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-78.3	130.6	178.9	-56.9	-179.7	178.8	173.1	0	110.7	E653 I687 T689 V703	E653-K705 IonicContact OE1-NZ 2.83Å; E653-K705 PolarHBondContact OE1-NZ 2.73Å; E653-K705 WeakPolarHBondContact OE2-CD 3.33Å; E653-K705 WeakPolarHBondContact OE2-CE 3.49Å; E653-K705 IonicContact OE2-NZ 2.69Å; E653-K705 PolarHBondContact OE2-NZ 2.88Å; I687-K705 HydrophobicContact CG2-CB 3.82Å; I687-K705 HydrophobicContact CG2-CD 3.96Å; T689-K705 HydrophobicContact CG2-CD 3.85Å; T689-K705 HydrophobicContact CG2-CG 4.41Å; V703-K705 PolarHBondContact O-N 2.89Å
706	P	78.6	Confident	62.1	Low	1 Å²	1	95.5 Å²	95.5	1%	0.006	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-62.5	141.6	176.3	29.1	-39.4	0	0	0	111.1	F616 L619 Y621 V688	F616-P706 HydrophobicContact CB-CB 4.4Å; F616-P706 HydrophobicContact CB-CG 4.26Å; F616-P706 HydrophobicContact CD1-CG 4Å; F616-P706 HydrophobicContact CD2-CB 4.33Å; F616-P706 HydrophobicContact CD2-CG 3.35Å; F616-P706 HydrophobicContact CE1-CG 4.11Å; F616-P706 HydrophobicContact CE2-CG 3.46Å; F616-P706 VanDerWaalsContact CE2-CG 3.46Å; F616-P706 HydrophobicContact CG-CB 4.23Å; F616-P706 HydrophobicContact CG-CG 3.61Å; F616-P706 HydrophobicContact CZ-CG 3.83Å; L619-P706 WeakPolarHBondContact O-CA 3.42Å; Y621-P706 HydrophobicContact CD2-CB 4.23Å; Y621-P706 HydrophobicContact CE2-CB 3.85Å; V688-P706 HydrophobicContact CB-CG 4.26Å; V688-P706 PolarHBondContact N-O 3.23Å; V688-P706 VanDerWaalsContact O-CD 3.23Å; V688-P706 WeakPolarHBondContact O-CD 3.39Å; V688-P706 WeakPolarHBondContact O-CG 3.36Å
707	K	79.5	Confident	61.1	Low	97 Å²	97	97.4 Å²	97.4	42%	0.422	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.1	172	-65.6	-178.9	-179.8	179.4	0	109.8	L619 M620 Y621 I685 L686	L619-K707 PolarHBondContact O-N 2.88Å; M620-K707 CarbonylContact C-O 3.45Å; M620-K707 VanDerWaalsContact CA-O 3.26Å; M620-K707 WeakPolarHBondContact CA-O 3.43Å; M620-K707 HydrophobicContact CE-CB 4.06Å; M620-K707 HydrophobicContact CE-CD 4.25Å; M620-K707 HydrophobicContact CG-CB 4.43Å; Y621-K707 PolarHBondContact N-O 3.38Å; I685-K707 HydrophobicContact CG2-CB 4.47Å; I685-K707 HydrophobicContact CG2-CD 4.48Å; L686-K707 CarbonylContact O-C 3.39Å; L686-K707 VanDerWaalsContact O-CA 3.28Å; L686-K707 WeakPolarHBondContact O-CA 3.31Å
708	V	80.1	Confident	60.3	Low	0 Å²	0	102.6 Å²	102.6	0%	0	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	108.4	172.2	-171.4	0	0	0	0	108	Y621 L623 L636 L638 L670 I685 L686 V688 I710	Y621-V708 HydrophobicContact CD2-CG2 4.15Å; Y621-V708 CarbonylContact O-C 3.41Å; Y621-V708 WeakPolarHBondContact O-CA 3.29Å; L623-V708 HydrophobicContact CD1-CG1 3.34Å; L636-V708 HydrophobicContact CD2-CG1 4.02Å; L636-V708 HydrophobicContact CD2-CG2 4.06Å; L638-V708 HydrophobicContact CD1-CG2 4.29Å; L638-V708 HydrophobicContact CD2-CG2 4.27Å; L670-V708 HydrophobicContact CD2-CG1 3.96Å; I685-V708 CarbonylContact C-O 3.59Å; I685-V708 WeakPolarHBondContact CA-O 3.47Å; L686-V708 HydrophobicContact CB-CB 4.04Å; L686-V708 HydrophobicContact CD1-CB 4.34Å; L686-V708 HydrophobicContact CG-CB 4.38Å; L686-V708 PolarHBondContact N-O 2.64Å; L686-V708 PolarHBondContact O-N 2.76Å; V688-V708 HydrophobicContact CG2-CG2 4.03Å; V708-I710 HydrophobicContact CG1-CD1 4.39Å; V708-I710 HydrophobicContact CG1-CG1 4.13Å
709	E	84.3	Confident	59.5	Low	24 Å²	24	103.2 Å²	103.2	11%	0.112	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.6	176.9	177.2	155.7	-134.2	0	0	110.1	Y621 S622 L623 Y684 R711	Y621-E709 PolarHBondContact O-N 3.38Å; S622-E709 CarbonylContact C-O 3.53Å; S622-E709 WeakPolarHBondContact CA-O 3.09Å; L623-E709 PolarHBondContact N-O 3.22Å; Y684-E709 CarbonylContact O-C 3.58Å; Y684-E709 WeakPolarHBondContact O-CA 3.15Å; E709-R711 HydrophobicContact CG-CG 3.98Å; E709-R711 IonicContact OE1-CZ 3.04Å; E709-R711 IonicContact OE1-NE 2.79Å; E709-R711 PolarHBondContact OE1-NE 2.85Å; E709-R711 IonicContact OE1-NH2 2.63Å; E709-R711 PolarHBondContact OE1-NH2 2.97Å; E709-R711 IonicContact OE2-CZ 3.49Å; E709-R711 IonicContact OE2-NE 3.69Å; E709-R711 IonicContact OE2-NH2 3.1Å; E709-R711 PolarHBondContact OE2-NH2 2.8Å; E709-R711 VanDerWaalsContact OE2-NH2 3.1Å
710	I	81.7	Confident	58.8	Low	3 Å²	3	102.9 Å²	102.9	2%	0.015	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.5	179.4	-57.7	168.4	0	0	0	107.4	L623 V625 L635 F661 L670 R683 Y684 L686 V708	L623-I710 HydrophobicContact CB-CG1 4.37Å; L623-I710 HydrophobicContact CD1-CG1 4.35Å; L623-I710 WeakPolarHBondContact O-CA 3.37Å; V625-I710 HydrophobicContact CB-CG2 3.83Å; V625-I710 HydrophobicContact CG2-CG2 3.65Å; L635-I710 HydrophobicContact CD1-CD1 4.02Å; F661-I710 HydrophobicContact CD1-CD1 3.91Å; F661-I710 HydrophobicContact CE1-CD1 3.3Å; F661-I710 HydrophobicContact CE2-CD1 4.09Å; F661-I710 HydrophobicContact CZ-CD1 3.41Å; F661-I710 VanDerWaalsContact CZ-CD1 3.41Å; L670-I710 HydrophobicContact CD2-CD1 4.32Å; R683-I710 CarbonylContact C-O 3.43Å; R683-I710 WeakPolarHBondContact CA-O 3.3Å; Y684-I710 PolarHBondContact N-O 2.82Å; Y684-I710 PolarHBondContact O-N 3.22Å; L686-I710 HydrophobicContact CD1-CD1 3.95Å; V708-I710 HydrophobicContact CG1-CD1 4.39Å; V708-I710 HydrophobicContact CG1-CG1 4.13Å
711	R	79.4	Confident	58	Low	109 Å²	109	103 Å²	103	41%	0.411	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.6	179.7	-65.5	-178.8	180	171.6	2.4	109.6	L623 E624 V625 R683 E709	L623-R711 PolarHBondContact O-N 3.38Å; E624-R711 CarbonylContact C-O 3.51Å; E624-R711 WeakPolarHBondContact CA-O 3.43Å; V625-R711 PolarHBondContact N-O 3Å; R683-R711 HydrophobicContact CB-CG 3.96Å; E709-R711 HydrophobicContact CG-CG 3.98Å; E709-R711 IonicContact OE1-CZ 3.04Å; E709-R711 IonicContact OE1-NE 2.79Å; E709-R711 PolarHBondContact OE1-NE 2.85Å; E709-R711 IonicContact OE1-NH2 2.63Å; E709-R711 PolarHBondContact OE1-NH2 2.97Å; E709-R711 IonicContact OE2-CZ 3.49Å; E709-R711 IonicContact OE2-NE 3.69Å; E709-R711 IonicContact OE2-NH2 3.1Å; E709-R711 PolarHBondContact OE2-NH2 2.8Å; E709-R711 VanDerWaalsContact OE2-NH2 3.1Å
712	E	67.8	Low	57.6	Low	56 Å²	56	101.6 Å²	101.6	26%	0.262	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-89.4	136	167.9	-169.4	164.4	-147.7	0	0	109.9	V625 S626 E627 R678 S714	V625-E712 WeakPolarHBondContact O-CA 3.11Å; S626-E712 WeakPolarHBondContact CA-OE1 3.28Å; S626-E712 PolarHBondContact OG-OE1 3.38Å; E627-E712 PolarHBondContact N-OE1 3.33Å; R678-E712 WeakPolarHBondContact CD-OE2 3.34Å; R678-E712 VanDerWaalsContact CG-OE2 3.3Å; R678-E712 WeakPolarHBondContact CG-OE2 3.24Å; E712-S714 PolarHBondContact O-N 3.43Å
713	P	61.1	Low	56.8	Low	62 Å²	62	102 Å²	102	40%	0.403	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-62.8	129.4	-179.4	20.4	-28.9	0	0	0	111.7	E624	E624-P713 HydrophobicContact CB-CB 4.24Å; E624-P713 HydrophobicContact CB-CG 4.28Å; E624-P713 HydrophobicContact CG-CB 4.41Å
714	S	56.6	Low	55.7	Low	104 Å²	104	108.5 Å²	108.5	73%	0.727	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-78.5	131.8	167.1	55.5	0	0	0	0	109.6	E712 E716	E712-S714 PolarHBondContact O-N 3.43Å; S714-E716 PolarHBondContact O-N 2.94Å
715	E	45.8	Very low	55.3	Low	195 Å²	195	106.3 Å²	106.3	91%	0.911	56%	0.556	S	S	*	*	S	Bend	trans	-59.4	92.1	174.4	-67.6	-173.1	154.5	0	0	110.8
716	E	43.2	Very low	53.9	Low	179 Å²	179	108.1 Å²	108.1	84%	0.836	58%	0.576	S	S	*	*			trans	176.4	128.4	153.4	-99.8	164.8	-168	0	0	112.4	S714	S714-E716 PolarHBondContact O-N 2.94Å
717	E	35.5	Very low	51.9	Low	179 Å²	179	113.2 Å²	113.2	84%	0.836	62%	0.619	S	S	*	*			trans	70.9	106.7	161.1	-54.6	-165	153.3	0	0	121.7
718	V	33.1	Very low	50.1	Low	128 Å²	128	113.2 Å²	113.2	78%	0.776	64%	0.636	S	S	*	*				70.5	128.9	83.3	-141	0	0	0	0	117.6
719	V	33.9	Very low	48.2	Very low	124 Å²	124	122.4 Å²	122.4	75%	0.752	68%	0.679	S	S	*	*			trans	97.7	134.1	139.7	-129.7	0	0	0	0	121.8
720	V	37.4	Very low	46	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	71%	0.709	S	S	*	*			trans	107.5	113.9	133.7	-141.8	0	0	0	0	119.7
721	T	33.1	Very low	43.6	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	75%	0.747	S	S	*	*			trans	-63.3	143	160.4	45.4	0	0	0	0	114.9
722	V	42	Very low	41.2	Very low	145 Å²	145	138.4 Å²	138.4	88%	0.879	77%	0.77	S	S	*	*			trans	-140.3	130.8	158.4	-175.2	0	0	0	0	111.7
723	E	33.4	Very low	39.6	Very low	184 Å²	184	140.9 Å²	140.9	86%	0.86	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77.5	161.2	-174.7	-62.2	173.6	138.3	0	0	114.5
724	K	33.7	Very low	38	Very low	201 Å²	201	144.6 Å²	144.6	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.1	134.5	-177.6	-179.2	179.8	-179.4	-179.8	0	112.6
725	P	50.2	Low	36.9	Very low	110 Å²	110	149.5 Å²	149.5	71%	0.714	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-89.5	156.4	168.7	0.7	18.8	0	0	0	113.3
726	P	42.4	Very low	36.3	Very low	126 Å²	126	150.2 Å²	150.2	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-90.5	164.4	-170.8	36.8	-33.8	0	0	0	114.3
727	A	36.2	Very low	35.6	Very low	109 Å²	109	153.9 Å²	153.9	90%	0.901	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.7	139.8	177.8	0	0	0	0	0	112.2
728	A	40.9	Very low	35.5	Very low	96 Å²	96	150 Å²	150	79%	0.793	82%	0.82	S	S	*	*			trans	-112.9	119.8	176.7	0	0	0	0	0	110.2
729	E	41.3	Very low	35.6	Very low	193 Å²	193	155.4 Å²	155.4	90%	0.902	83%	0.826	S	S	*	*			trans	-75.9	152.4	164.6	-67.3	175.2	173.6	0	0	110.7
730	P	36.8	Very low	35.8	Very low	115 Å²	115	156.6 Å²	156.6	75%	0.747	83%	0.827	S	S	*	*			trans	-144.6	128.8	145	28.5	-7.9	0	0	0	116.6
731	T	32.7	Very low	35.8	Very low	131 Å²	131	159.8 Å²	159.8	80%	0.804	83%	0.831	S	S	*	*				61.3	113.9	121.4	-20.7	0	0	0	0	121.7
732	Y	27.6	Very low	36.2	Very low	227 Å²	227	158.1 Å²	158.1	89%	0.89	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.4	138.8	172.1	-51.1	-87.1	0	0	0	113.7
733	P	34.8	Very low	36.1	Very low	107 Å²	107	159.3 Å²	159.3	70%	0.695	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-103	140.7	161.9	31.4	-19.7	0	0	0	112.7
734	T	28.6	Very low	36.9	Very low	140 Å²	140	157 Å²	157	86%	0.859	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81	122.4	-177.8	51	0	0	0	0	113.3
735	W	31.6	Very low	37.5	Very low	207 Å²	207	153.8 Å²	153.8	78%	0.784	80%	0.799	S	S	*	*			trans	-111.4	148.5	173	-72.8	6.9	0	0	0	113.6	E787	W735-E787 WeakPolarHBondContact CZ3-OE2 3.39Å
736	K	33.3	Very low	37.9	Very low	210 Å²	210	156.5 Å²	156.5	91%	0.913	80%	0.8	S	S	*	*			trans	-97.9	144.6	-170.6	-75.5	176.6	176.2	173.5	0	111.7
737	R	30.1	Very low	38.3	Very low	256 Å²	256	158.4 Å²	158.4	97%	0.966	80%	0.795	S	S	*	*			trans	-34.6	125.4	178.7	-63.4	174.1	-168	169.4	2.1	116.6
738	A	32.4	Very low	39.4	Very low	98 Å²	98	156.7 Å²	156.7	81%	0.81	77%	0.774	S	S	*	*			trans	-130.3	157.3	159	0	0	0	0	0	111.2
739	R	35.8	Very low	40.4	Very low	241 Å²	241	159 Å²	159	91%	0.909	76%	0.762	S	S	*	*			trans	-99	100	-148.2	-67	164.2	170.5	165.8	-4.3	112.3
740	I	37	Very low	41.4	Very low	149 Å²	149	151.5 Å²	151.5	76%	0.764	74%	0.736	S	S	*	*			trans	-126.6	5.4	170.6	-57.5	177.4	0	0	0	111.8	P742	I740-P742 VanDerWaalsContact C-CD 3.41Å
741	F	38.7	Very low	42.5	Very low	186 Å²	186	150.8 Å²	150.8	82%	0.816	73%	0.726	S	S	*	*			trans	-87.7	13.5	-176.3	-99.6	-91.2	0	0	0	120.4
742	P	40.7	Very low	43.8	Very low	90 Å²	90	145.1 Å²	145.1	58%	0.584	69%	0.692	S	S	*	*	S	Bend	trans	-99	-16.9	177.1	-7.3	27.1	0	0	0	118.8	I740	I740-P742 VanDerWaalsContact C-CD 3.41Å
743	M	40	Very low	45.5	Very low	170 Å²	170	140.8 Å²	140.8	84%	0.837	68%	0.68	S	S	*	*	S	Bend	trans	-91.3	-40.7	-173.9	-73.3	-168.6	-144.8	0	0	114	K746 K747	M743-K746 PolarHBondContact O-N 3.32Å; M743-K747 PolarHBondContact O-N 3Å
744	I	50.5	Low	46.8	Very low	136 Å²	136	144.6 Å²	144.6	70%	0.697	69%	0.685	S	S	*	*	H	α-helix	trans	-69.9	-40.4	177.5	-71	163.3	0	0	0	110.8	K746 K747 V748	I744-K746 VanDerWaalsContact C-N 3.26Å; I744-K746 PolarHBondContact O-N 2.83Å; I744-K747 PolarHBondContact O-N 3.34Å; I744-V748 HydrophobicContact CG2-CG2 4.32Å; I744-V748 VanDerWaalsContact O-CG2 3.31Å; I744-V748 WeakPolarHBondContact O-CG2 3.41Å; I744-V748 PolarHBondContact O-N 3.11Å
745	F	47	Very low	48.4	Very low	132 Å²	132	145.7 Å²	145.7	58%	0.579	67%	0.674	S	S	*	*	H	α-helix	trans	-65.8	-25.9	178	-147.1	-91	0	0	0	113.2	R749	F745-R749 WeakPolarHBondContact O-CB 3.01Å; F745-R749 PolarHBondContact O-N 2.91Å
746	K	56.9	Low	49.7	Very low	168 Å²	168	139.4 Å²	139.4	73%	0.73	67%	0.673	S	S	*	*	H	α-helix	trans	-78.6	-32.7	178.8	-150.7	179.6	-175	-173	0	112.3	M743 I744 G750	M743-K746 PolarHBondContact O-N 3.32Å; I744-K746 VanDerWaalsContact C-N 3.26Å; I744-K746 PolarHBondContact O-N 2.83Å; K746-G750 PolarHBondContact O-N 3.21Å; K746-G750 VanDerWaalsContact O-N 3.1Å
747	K	50.6	Low	51	Low	165 Å²	165	132.5 Å²	132.5	72%	0.717	65%	0.646	S	S	*	*	H	α-helix	trans	-78.9	-39.8	177.6	-150.9	166.1	-177.2	-177	0	111.5	M743 I744 G750 L751	M743-K747 PolarHBondContact O-N 3Å; I744-K747 PolarHBondContact O-N 3.34Å; K747-G750 PolarHBondContact O-N 2.87Å; K747-L751 PolarHBondContact O-N 2.87Å
748	V	59.2	Low	52.4	Low	74 Å²	74	126.3 Å²	126.3	45%	0.448	63%	0.632	S	S	.	*	H	α-helix	trans	-68.7	-38.9	174.2	178.7	0	0	0	0	111.8	I744 L751 A752	I744-V748 HydrophobicContact CG2-CG2 4.32Å; I744-V748 VanDerWaalsContact O-CG2 3.31Å; I744-V748 WeakPolarHBondContact O-CG2 3.41Å; I744-V748 PolarHBondContact O-N 3.11Å; V748-L751 PolarHBondContact O-N 3.13Å; V748-A752 WeakPolarHBondContact O-CB 3.22Å; V748-A752 PolarHBondContact O-N 2.82Å
749	R	62	Low	53.5	Low	144 Å²	144	125.6 Å²	125.6	54%	0.543	61%	0.614	S	S	.	*	H	α-helix	trans	-67.3	-37.2	173.1	-171.2	-178.5	-175.4	160.3	13.3	112.7	F745 L751 A752 E753	F745-R749 WeakPolarHBondContact O-CB 3.01Å; F745-R749 PolarHBondContact O-N 2.91Å; R749-L751 VanDerWaalsContact C-N 3.33Å; R749-L751 PolarHBondContact O-N 2.93Å; R749-A752 PolarHBondContact O-N 3.37Å; R749-E753 HydrophobicContact CG-CG 4.46Å; R749-E753 IonicContact CZ-OE1 2.73Å; R749-E753 IonicContact NE-OE1 3.8Å; R749-E753 PolarHBondContact NE-OE1 2.03Å; R749-E753 VanDerWaalsContact NE-OE1 3.08Å; R749-E753 WeakPolarHBondContact O-CB 3.21Å; R749-E753 WeakPolarHBondContact O-CG 2.94Å; R749-E753 PolarHBondContact O-N 3.04Å
750	G	64.3	Low	54.5	Low	35 Å²	35	123 Å²	123	36%	0.361	61%	0.612	S	S	.	*	H	α-helix	trans	-65.1	-34.1	174.1	0	0	0	0	0	113.3	K746 K747 K754	K746-G750 PolarHBondContact O-N 3.21Å; K746-G750 VanDerWaalsContact O-N 3.1Å; K747-G750 PolarHBondContact O-N 2.87Å; G750-K754 VanDerWaalsContact O-CB 3.31Å; G750-K754 WeakPolarHBondContact O-CB 3.28Å; G750-K754 PolarHBondContact O-N 3.43Å
751	L	57.9	Low	55.5	Low	101 Å²	101	117.7 Å²	117.7	53%	0.529	59%	0.594	S	S	.	*	H	α-helix	trans	-72.1	-39.9	172.9	-84.7	155.6	0	0	0	112.3	K747 V748 R749 K754 R755	K747-L751 PolarHBondContact O-N 2.87Å; V748-L751 PolarHBondContact O-N 3.13Å; R749-L751 VanDerWaalsContact C-N 3.33Å; R749-L751 PolarHBondContact O-N 2.93Å; L751-K754 PolarHBondContact O-N 2.76Å; L751-R755 PolarHBondContact O-N 3.19Å; L751-R755 VanDerWaalsContact O-N 3.14Å
752	A	60	Low	56.4	Low	12 Å²	12	117 Å²	117	10%	0.099	59%	0.594	C	S	.	*	H	α-helix	trans	-70.1	-36.6	177.4	0	0	0	0	0	113.3	V748 R749 K754 R755 G756 I757 L759	V748-A752 WeakPolarHBondContact O-CB 3.22Å; V748-A752 PolarHBondContact O-N 2.82Å; R749-A752 PolarHBondContact O-N 3.37Å; A752-K754 VanDerWaalsContact C-N 3.35Å; A752-R755 PolarHBondContact O-N 2.96Å; A752-G756 PolarHBondContact O-N 3.4Å; A752-I757 PolarHBondContact O-N 2.84Å; A752-I757 VanDerWaalsContact O-N 3.16Å; A752-L759 HydrophobicContact CB-CD1 3.48Å; A752-L759 VanDerWaalsContact CB-CD1 3.48Å; A752-L759 HydrophobicContact CB-CG 4.05Å
753	E	63.4	Low	57.2	Low	136 Å²	136	119.6 Å²	119.6	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-69.1	-31.2	173.3	-76.7	172.9	-172.1	0	0	112.1	R749	R749-E753 HydrophobicContact CG-CG 4.46Å; R749-E753 IonicContact CZ-OE1 2.73Å; R749-E753 IonicContact NE-OE1 3.8Å; R749-E753 PolarHBondContact NE-OE1 2.03Å; R749-E753 VanDerWaalsContact NE-OE1 3.08Å; R749-E753 WeakPolarHBondContact O-CB 3.21Å; R749-E753 WeakPolarHBondContact O-CG 2.94Å; R749-E753 PolarHBondContact O-N 3.04Å
754	K	62.6	Low	58.1	Low	186 Å²	186	116 Å²	116	81%	0.809	58%	0.575	S	S	*	*	H	α-helix	trans	-77.8	-22.8	177.2	-158.4	176.6	-175.5	-173.5	0	113.4	G750 L751 A752	G750-K754 VanDerWaalsContact O-CB 3.31Å; G750-K754 WeakPolarHBondContact O-CB 3.28Å; G750-K754 PolarHBondContact O-N 3.43Å; L751-K754 PolarHBondContact O-N 2.76Å; A752-K754 VanDerWaalsContact C-N 3.35Å
755	R	62.6	Low	58.5	Low	164 Å²	164	117.8 Å²	117.8	62%	0.619	57%	0.573	S	S	*	*	H	α-helix	trans	-108.2	1.7	179.5	-75.6	-172.6	174.4	174.4	-0.8	114.8	L751 A752 I757 D772	L751-R755 PolarHBondContact O-N 3.19Å; L751-R755 VanDerWaalsContact O-N 3.14Å; A752-R755 PolarHBondContact O-N 2.96Å; R755-I757 HydrophobicContact CB-CD1 3.92Å; R755-I757 HydrophobicContact CB-CG1 4.07Å; R755-I757 PolarHBondContact O-N 3.37Å; R755-D772 IonicContact NH1-OD2 3.23Å
756	G	58.4	Low	59.1	Low	74 Å²	74	121.6 Å²	121.6	76%	0.763	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.7	33.5	176.5	0	0	0	0	0	114.5	A752	A752-G756 PolarHBondContact O-N 3.4Å
757	I	60.5	Low	59.1	Low	66 Å²	66	123.4 Å²	123.4	34%	0.338	59%	0.586	S	S	.	*			trans	-99.2	119.4	-176.3	-58	173.3	0	0	0	109.5	A752 R755 W764	A752-I757 PolarHBondContact O-N 2.84Å; A752-I757 VanDerWaalsContact O-N 3.16Å; R755-I757 HydrophobicContact CB-CD1 3.92Å; R755-I757 HydrophobicContact CB-CG1 4.07Å; R755-I757 PolarHBondContact O-N 3.37Å; I757-W764 HydrophobicContact CG2-CB 4.13Å
758	D	60.1	Low	59.4	Low	126 Å²	126	117.6 Å²	117.6	67%	0.674	56%	0.562	S	S	*	*			trans	-76.1	122.2	174	-169.6	3.1	0	0	0	110.6	E760	D758-E760 PolarHBondContact OD1-N 3.29Å
759	L	54.9	Low	59.5	Low	82 Å²	82	119.4 Å²	119.4	43%	0.429	57%	0.57	S	S	.	*			trans	-96.8	11.7	-171.2	-74.9	169.5	0	0	0	113.6	A752 W764	A752-L759 HydrophobicContact CB-CD1 3.48Å; A752-L759 VanDerWaalsContact CB-CD1 3.48Å; A752-L759 HydrophobicContact CB-CG 4.05Å; L759-W764 HydrophobicContact CD2-CG 4.47Å
760	E	56.5	Low	59.3	Low	186 Å²	186	119.4 Å²	119.4	87%	0.869	58%	0.576	S	S	*	*	S	Bend	trans	-96.7	8.3	-179.9	-74.1	-167.1	155.7	0	0	115.5	D758	D758-E760 PolarHBondContact OD1-N 3.29Å
761	G	58.2	Low	58.7	Low	39 Å²	39	126 Å²	126	40%	0.402	60%	0.597	S	S	.	*	S	Bend	trans	-136.8	156.3	-178.6	0	0	0	0	0	115.2	E763	G761-E763 PolarHBondContact O-N 2.87Å
762	E	58.9	Low	58.7	Low	172 Å²	172	123.9 Å²	123.9	80%	0.804	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	1.1	178.7	-65.6	-170.6	155.3	0	0	114.6
763	E	56.7	Low	58.4	Low	143 Å²	143	127 Å²	127	67%	0.668	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-22.6	-168.8	-153.6	168.8	-154.3	0	0	114	G761 R765 R766	G761-E763 PolarHBondContact O-N 2.87Å; E763-R765 PolarHBondContact O-N 3.39Å; E763-R766 PolarHBondContact O-N 3.43Å; E763-R766 VanDerWaalsContact O-N 3.09Å
764	W	58.3	Low	57.9	Low	94 Å²	94	125.3 Å²	125.3	36%	0.356	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-64.9	-24.5	179	66	-98.7	0	0	0	113.1	I757 L759 R766 R767 L768	I757-W764 HydrophobicContact CG2-CB 4.13Å; L759-W764 HydrophobicContact CD2-CG 4.47Å; W764-R766 PolarHBondContact O-N 2.89Å; W764-R767 PolarHBondContact O-N 3.41Å; W764-L768 HydrophobicContact CE3-CD1 3.5Å; W764-L768 HydrophobicContact CZ3-CD1 3.64Å
765	R	59.1	Low	57.1	Low	175 Å²	175	125.3 Å²	125.3	66%	0.66	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-63.8	-18	174.1	-72.8	-178.5	172.9	171.6	-4	113.8	E763	E763-R765 PolarHBondContact O-N 3.39Å
766	R	59.4	Low	56	Low	211 Å²	211	120.9 Å²	120.9	80%	0.796	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-94.8	-9.8	179.3	-70	-164.6	-174.8	101.2	2.6	114.5	E763 W764	E763-R766 PolarHBondContact O-N 3.43Å; E763-R766 VanDerWaalsContact O-N 3.09Å; W764-R766 PolarHBondContact O-N 2.89Å
767	R	58.5	Low	55.2	Low	206 Å²	206	123.9 Å²	123.9	78%	0.777	57%	0.572	S	S	*	*	S	Bend	trans	-109	7.7	-174.8	-68.1	-175.5	70.8	145.9	1.1	113.8	W764	W764-R767 PolarHBondContact O-N 3.41Å
768	L	56.5	Low	54.2	Low	43 Å²	43	127.9 Å²	127.9	23%	0.225	59%	0.593	C	S	.	*	S	Bend	trans	-94.9	126.9	175.8	-79.9	149.3	0	0	0	108.8	W764 D772 K773 L776	W764-L768 HydrophobicContact CE3-CD1 3.5Å; W764-L768 HydrophobicContact CZ3-CD1 3.64Å; L768-D772 HydrophobicContact CB-CB 4.32Å; L768-D772 HydrophobicContact CD2-CB 3.45Å; L768-D772 VanDerWaalsContact CD2-CB 3.45Å; L768-K773 HydrophobicContact CB-CG 4.44Å; L768-K773 WeakPolarHBondContact O-CE 3.44Å; L768-L776 HydrophobicContact CD1-CD1 4.31Å
769	D	60.3	Low	53.4	Low	113 Å²	113	127 Å²	127	60%	0.604	59%	0.592	S	S	*	*			trans	-65.3	155.4	174.9	-57.7	-39.2	0	0	0	109.8	E771 D772 K773	D769-E771 PolarHBondContact O-N 3.19Å; D769-E771 VanDerWaalsContact O-N 3.12Å; D769-D772 PolarHBondContact O-N 3.36Å; D769-K773 PolarHBondContact O-N 2.93Å
770	E	57.7	Low	52.4	Low	144 Å²	144	128.6 Å²	128.6	67%	0.673	60%	0.601	S	S	*	*	H	α-helix	trans	-56.2	-31.3	-172.7	-123.8	70.5	-161.5	0	0	112.8	K773	E770-K773 PolarHBondContact O-N 2.83Å; E770-K773 IonicContact OE1-NZ 2.67Å; E770-K773 PolarHBondContact OE1-NZ 2.87Å; E770-K773 IonicContact OE2-NZ 3.97Å; E770-K773 PolarHBondContact OE2-NZ 3.48Å
771	E	53.2	Low	51.5	Low	174 Å²	174	127.5 Å²	127.5	81%	0.813	60%	0.601	S	S	*	*	H	α-helix	trans	-71	-33.7	176.7	-69.1	174.8	170.4	0	0	113.3	D769 K773	D769-E771 PolarHBondContact O-N 3.19Å; D769-E771 VanDerWaalsContact O-N 3.12Å; E771-K773 VanDerWaalsContact C-N 3.3Å; E771-K773 PolarHBondContact O-N 3.37Å
772	D	57.5	Low	50.3	Low	55 Å²	55	133.7 Å²	133.7	29%	0.294	62%	0.619	S	S	.	*	H	α-helix	trans	-76.1	-20.1	176.3	-77.7	-28.7	0	0	0	111.8	R755 L768 D769	R755-D772 IonicContact NH1-OD2 3.23Å; L768-D772 HydrophobicContact CB-CB 4.32Å; L768-D772 HydrophobicContact CD2-CB 3.45Å; L768-D772 VanDerWaalsContact CD2-CB 3.45Å; D769-D772 PolarHBondContact O-N 3.36Å
773	K	53.4	Low	49.6	Very low	77 Å²	77	134.7 Å²	134.7	34%	0.335	62%	0.624	S	S	.	*	H	α-helix	trans	-73.3	-38.9	175.2	-67	174.7	-170.2	149.1	0	111.7	L768 D769 E770 E771 L776 Q777	L768-K773 HydrophobicContact CB-CG 4.44Å; L768-K773 WeakPolarHBondContact O-CE 3.44Å; D769-K773 PolarHBondContact O-N 2.93Å; E770-K773 PolarHBondContact O-N 2.83Å; E770-K773 IonicContact OE1-NZ 2.67Å; E770-K773 PolarHBondContact OE1-NZ 2.87Å; E770-K773 IonicContact OE2-NZ 3.97Å; E770-K773 PolarHBondContact OE2-NZ 3.48Å; E771-K773 VanDerWaalsContact C-N 3.3Å; E771-K773 PolarHBondContact O-N 3.37Å; K773-L776 PolarHBondContact O-N 2.87Å; K773-Q777 WeakPolarHBondContact O-CB 3.43Å; K773-Q777 PolarHBondContact O-N 2.83Å
774	D	52.8	Low	48.6	Very low	102 Å²	102	137.4 Å²	137.4	55%	0.545	64%	0.636	S	S	.	*	H	α-helix	trans	-69.5	-38	179.5	-102.5	2.9	0	0	0	112.3	L776 Q777 L778	D774-L776 VanDerWaalsContact C-N 3.26Å; D774-L776 PolarHBondContact O-N 3.42Å; D774-Q777 PolarHBondContact O-N 3.05Å; D774-L778 PolarHBondContact O-N 2.71Å; D774-L778 VanDerWaalsContact O-N 3.13Å
775	Y	44.8	Very low	47.3	Very low	185 Å²	185	137.7 Å²	137.7	73%	0.725	66%	0.659	S	S	*	*	H	α-helix	trans	-63	-31.4	175.7	-169.7	-98.6	0	0	0	113.1	T779	Y775-T779 PolarHBondContact O-OG1 3.08Å
776	L	40	Very low	46.1	Very low	72 Å²	72	135.7 Å²	135.7	38%	0.377	67%	0.666	S	S	.	*	H	α-helix	trans	-86.7	-20.1	176.9	-74.2	166.5	0	0	0	113.2	L768 K773 D774 T779	L768-L776 HydrophobicContact CD1-CD1 4.31Å; K773-L776 PolarHBondContact O-N 2.87Å; D774-L776 VanDerWaalsContact C-N 3.26Å; D774-L776 PolarHBondContact O-N 3.42Å; L776-T779 PolarHBondContact O-OG1 2.73Å
777	Q	42.5	Very low	45	Very low	136 Å²	136	132.4 Å²	132.4	64%	0.636	66%	0.66	S	S	*	*	H	α-helix	trans	-84.7	-29.6	179.9	-162.9	164.3	-21.2	0	0	112.2	K773 D774 T779	K773-Q777 WeakPolarHBondContact O-CB 3.43Å; K773-Q777 PolarHBondContact O-N 2.83Å; D774-Q777 PolarHBondContact O-N 3.05Å; Q777-T779 VanDerWaalsContact C-N 3.26Å; Q777-T779 PolarHBondContact O-N 3.48Å
778	L	38.4	Very low	43.8	Very low	150 Å²	150	128.2 Å²	128.2	79%	0.785	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-9.1	174.7	-91.8	147.2	0	0	0	115	D774	D774-L778 PolarHBondContact O-N 2.71Å; D774-L778 VanDerWaalsContact O-N 3.13Å
779	T	44.1	Very low	42.7	Very low	108 Å²	108	131.6 Å²	131.6	66%	0.663	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	10.5	-177.7	40.4	0	0	0	0	114.3	Y775 L776 Q777	Y775-T779 PolarHBondContact O-OG1 3.08Å; L776-T779 PolarHBondContact O-OG1 2.73Å; Q777-T779 VanDerWaalsContact C-N 3.26Å; Q777-T779 PolarHBondContact O-N 3.48Å
780	L	34.6	Very low	41.4	Very low	116 Å²	116	131.5 Å²	131.5	61%	0.607	69%	0.688	S	S	*	*			trans	-125	10.4	-169.8	-98.6	162.8	0	0	0	116.7	Q782	L780-Q782 PolarHBondContact O-N 3.47Å
781	D	36.4	Very low	40.2	Very low	163 Å²	163	133.1 Å²	133.1	87%	0.872	70%	0.696	S	S	*	*			trans	-85	101.4	170.5	-76.4	-26.8	0	0	0	111.1
782	Q	32.3	Very low	39.5	Very low	169 Å²	169	130.5 Å²	130.5	79%	0.79	70%	0.697	S	S	*	*			trans	-89.8	85.8	-176.8	-69.1	-177.9	-25.3	0	0	111.1	L780	L780-Q782 PolarHBondContact O-N 3.47Å
783	E	44.5	Very low	38.3	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	72%	0.724	S	S	*	*			trans	-159.7	31.4	171.5	-119.5	167.1	-141.7	0	0	117.6
784	E	37.1	Very low	37.4	Very low	200 Å²	200	142 Å²	142	94%	0.935	75%	0.75	S	S	*	*			trans	-157.6	83.4	168.8	-120.7	164.1	-168.1	0	0	113.9
785	A	30.3	Very low	36.3	Very low	100 Å²	100	146.1 Å²	146.1	83%	0.826	77%	0.766	S	S	*	*			trans	-154.2	108.2	164.2	0	0	0	0	0	112
786	T	33.8	Very low	35.6	Very low	133 Å²	133	143 Å²	143	82%	0.816	77%	0.771	S	S	*	*			trans	-143.8	100.9	159.3	55	0	0	0	0	106.9
787	E	36.2	Very low	35.1	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.664	79%	0.787	S	S	*	*				64.2	104.2	80.7	-162.6	171.9	-158.4	0	0	114.9	W735	W735-E787 WeakPolarHBondContact CZ3-OE2 3.39Å
788	S	33.2	Very low	34.8	Very low	119 Å²	119	144.2 Å²	144.2	83%	0.832	79%	0.79	S	S	*	*			trans	-163.4	111.4	131.9	62.5	0	0	0	0	112.8
789	T	33.2	Very low	34.5	Very low	113 Å²	113	146 Å²	146	69%	0.693	79%	0.788	S	S	*	*			trans	-55.3	162	163.5	41.4	0	0	0	0	116.1
790	V	34	Very low	34	Very low	111 Å²	111	145.6 Å²	145.6	67%	0.673	79%	0.785	S	S	*	*				163.3	117.3	106	166	0	0	0	0	111.6
791	E	32.2	Very low	33.8	Very low	179 Å²	179	147.9 Å²	147.9	84%	0.836	79%	0.793	S	S	*	*			trans	40.8	124.8	135.4	-50.9	174.4	170.3	0	0	121.5
792	S	37.9	Very low	33.7	Very low	119 Å²	119	151.2 Å²	151.2	83%	0.832	80%	0.795	S	S	*	*				-166.7	133.3	112	57.6	0	0	0	0	111.7
793	E	31.9	Very low	33.7	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	79%	0.788	S	S	*	*			trans	-55.7	149.9	174.4	-57.4	162.5	145.7	0	0	113
794	E	35.2	Very low	33	Very low	188 Å²	188	147.9 Å²	147.9	88%	0.879	79%	0.787	S	S	*	*				178.7	147.9	110.5	-95.8	-172.2	179.7	0	0	113
795	E	29.4	Very low	32.8	Very low	190 Å²	190	144.8 Å²	144.8	89%	0.888	78%	0.782	S	S	*	*			trans	-55.5	148.9	-174.4	-64.7	168.5	127.9	0	0	116.4
796	S	31	Very low	32.8	Very low	119 Å²	119	149.4 Å²	149.4	83%	0.832	79%	0.786	S	S	*	*				-165.9	119.5	129.8	176.4	0	0	0	0	110.9
797	S	29.8	Very low	32.7	Very low	101 Å²	101	148.3 Å²	148.3	71%	0.706	78%	0.784	S	S	*	*			trans	-60.5	145.2	173.7	52.9	0	0	0	0	114.5
798	D	34.4	Very low	32.4	Very low	133 Å²	133	150.8 Å²	150.8	71%	0.711	80%	0.795	S	S	*	*				-166	132.6	124.3	-116.2	-1.3	0	0	0	115.5
799	Y	34.1	Very low	32.2	Very low	187 Å²	187	154.9 Å²	154.9	73%	0.733	80%	0.799	S	S	*	*			trans	66.2	97.9	152.7	-70.9	-75.8	0	0	0	124.7
800	T	33.1	Very low	32	Very low	99 Å²	99	153 Å²	153	61%	0.607	79%	0.791	S	S	*	*				66.9	105.8	122.3	57.1	0	0	0	0	122.9
801	E	30.1	Very low	31.7	Very low	165 Å²	165	156.2 Å²	156.2	77%	0.771	80%	0.798	S	S	*	*				22.3	123.3	113.4	-136.9	171.7	-157.1	0	0	119.2	T803	E801-T803 HydrophobicContact CG-CG2 4.38Å
802	Y	33.7	Very low	31.8	Very low	233 Å²	233	153.4 Å²	153.4	91%	0.914	80%	0.798	S	S	*	*			trans	-129.5	104.2	152.8	-78.4	-80.5	0	0	0	109.5
803	T	31.9	Very low	31.3	Very low	105 Å²	105	156 Å²	156	64%	0.644	80%	0.797	S	S	*	*			trans	-90.6	152.4	165.4	44.5	0	0	0	0	111.2	E801	E801-T803 HydrophobicContact CG-CG2 4.38Å
804	E	29.9	Very low	31.2	Very low	185 Å²	185	154 Å²	154	86%	0.864	80%	0.798	S	S	*	*			trans	22.9	127.2	149.5	-59.2	179.8	176.3	0	0	120.3
805	T	33.5	Very low	30.7	Very low	136 Å²	136	150 Å²	150	83%	0.834	79%	0.786	S	S	*	*			trans	-153	115.9	139.3	47.1	0	0	0	0	112
806	E	30.8	Very low	30.9	Very low	197 Å²	197	150.2 Å²	150.2	92%	0.921	79%	0.787	S	S	*	*			trans	-55.6	139.2	143.5	-62.3	175.6	142.5	0	0	109.2
807	S	30.9	Very low	30.9	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	79%	0.786	S	S	*	*			trans	-152.5	107.4	155.1	74.9	0	0	0	0	110.5
808	E	29.6	Very low	30.9	Very low	193 Å²	193	152.4 Å²	152.4	90%	0.902	78%	0.784	S	S	*	*			trans	-55.5	139.9	153.4	-62.5	174.9	136.4	0	0	109.7
809	F	29.2	Very low	30.9	Very low	205 Å²	205	154.2 Å²	154.2	90%	0.899	79%	0.788	S	S	*	*			trans	-137.7	126.8	150.2	-159.3	-100	0	0	0	109.8
810	S	28.7	Very low	30.6	Very low	75 Å²	75	149.9 Å²	149.9	52%	0.524	79%	0.785	S	S	.	*			trans	-100.5	167.6	-157.2	46.9	0	0	0	0	113.3
811	E	28.7	Very low	30.7	Very low	177 Å²	177	154 Å²	154	83%	0.827	80%	0.797	S	S	*	*			trans	67.8	116.3	148.9	-75.9	172.9	173.9	0	0	120.2
812	S	33.4	Very low	30.8	Very low	121 Å²	121	152.3 Å²	152.3	85%	0.846	80%	0.798	S	S	*	*				-161.8	116.3	99.6	30.1	0	0	0	0	111.3
813	E	28.5	Very low	31.1	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	79%	0.79	S	S	*	*			trans	-68.4	142.1	157	-74	175.5	132.7	0	0	109.8
814	T	28.4	Very low	31	Very low	144 Å²	144	146.3 Å²	146.3	88%	0.883	79%	0.792	S	S	*	*			trans	-132.5	97.6	140.8	30.7	0	0	0	0	107.5
815	T	26.7	Very low	31.1	Very low	103 Å²	103	145.7 Å²	145.7	63%	0.632	79%	0.789	S	S	*	*			trans	-48.3	130	152.5	28.8	0	0	0	0	111.3
816	E	32.9	Very low	31.1	Very low	195 Å²	195	147.2 Å²	147.2	91%	0.911	79%	0.787	S	S	*	*				-131.1	114.1	128.8	-79.4	-162.5	160.2	0	0	108
817	E	30.8	Very low	31.1	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	78%	0.777	S	S	*	*			trans	-51.8	156.3	160.6	-57.7	168.4	147.8	0	0	108.9
818	S	30.5	Very low	31.2	Very low	94 Å²	94	144.3 Å²	144.3	66%	0.657	78%	0.776	S	S	*	*				178.4	141.2	59.7	51.4	0	0	0	0	110.5
819	E	33.1	Very low	31.3	Very low	171 Å²	171	143 Å²	143	80%	0.799	77%	0.77	S	S	*	*			trans	73.1	105.9	132.5	-68.9	176.7	177.9	0	0	118.3
820	S	28.8	Very low	31.4	Very low	97 Å²	97	138 Å²	138	68%	0.678	76%	0.76	S	S	*	*				73	133.1	87.6	76.1	0	0	0	0	111.7
821	E	34.6	Very low	31.8	Very low	184 Å²	184	139 Å²	139	86%	0.86	77%	0.767	S	S	*	*			cis	-162.2	155.5	41.7	-67.9	-178.6	141.9	0	0	110.6
822	T	32.1	Very low	32.4	Very low	130 Å²	130	137 Å²	137	80%	0.798	77%	0.767	S	S	*	*			trans	-80	-174.5	161.6	43.1	0	0	0	0	112
823	P	40.1	Very low	32.5	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	76%	0.763	S	S	*	*			cis	-133.3	-157.6	-47.8	37.3	-17.2	0	0	0	111.2
824	S	30.3	Very low	32.9	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	77%	0.769	S	S	*	*			trans	108.9	116.5	166.7	73.7	0	0	0	0	115
825	E	32	Very low	33.3	Very low	173 Å²	173	136.3 Å²	136.3	81%	0.808	76%	0.762	S	S	*	*				73.9	124.2	108	-76.4	-177	165.3	0	0	110.8
826	E	32.2	Very low	33.6	Very low	167 Å²	167	140.4 Å²	140.4	78%	0.78	77%	0.774	S	S	*	*				179	152.5	53.3	-117.1	166.3	-163.5	0	0	106.6
827	A	31.3	Very low	33.5	Very low	85 Å²	85	140.6 Å²	140.6	70%	0.702	78%	0.775	S	S	*	*			trans	50.8	136.8	134	0	0	0	0	0	119.9
828	E	32.8	Very low	33.6	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	78%	0.778	S	S	*	*			cis	-166.4	153.5	28.1	-81.9	-159.3	154.8	0	0	110
829	E	32	Very low	33.6	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	79%	0.79	S	S	*	*			trans	45.2	123.8	135.5	-58.8	-171.1	165.1	0	0	121.4
830	S	31.9	Very low	33.7	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	79%	0.791	S	S	*	*				163.4	129.9	91.7	178.3	0	0	0	0	112.7
831	S	37.8	Very low	33.9	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	79%	0.794	S	S	*	*			trans	61.7	129.2	147	58	0	0	0	0	118.8
832	T	39.8	Very low	33.7	Very low	137 Å²	137	140.9 Å²	140.9	84%	0.84	79%	0.79	S	S	*	*			cis	-170.2	156.5	27.3	-3.2	0	0	0	0	108.7
833	P	36	Very low	33.9	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	79%	0.793	S	S	*	*			trans	-106.5	154.3	-166.4	38.1	-27.8	0	0	0	114.3
834	E	36.7	Very low	33.4	Very low	199 Å²	199	143.7 Å²	143.7	93%	0.93	80%	0.798	S	S	*	*			trans	-133.6	126.7	151	-78.9	-171.6	157.4	0	0	109.5
835	S	37.2	Very low	33.4	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	80%	0.8	S	S	*	*			trans	-52.9	130.4	-177.4	41.8	0	0	0	0	114.6
836	E	32.6	Very low	33.5	Very low	188 Å²	188	143.7 Å²	143.7	88%	0.879	81%	0.807	S	S	*	*				75.7	95.1	84.4	-69.8	-174.8	-180	0	0	114
837	E	32.2	Very low	33.4	Very low	200 Å²	200	145.7 Å²	145.7	94%	0.935	81%	0.813	S	S	*	*			trans	-121.9	128.2	133.9	-89	-173.8	164.9	0	0	107.8
838	S	31.6	Very low	33.5	Very low	123 Å²	123	145.9 Å²	145.9	86%	0.86	81%	0.814	S	S	*	*			trans	-86.9	129.2	-171.7	47.8	0	0	0	0	111.7
839	E	30.2	Very low	33.7	Very low	194 Å²	194	150.2 Å²	150.2	91%	0.907	82%	0.824	S	S	*	*			trans	-128.4	133.7	151.6	-160	172.7	-166.8	0	0	108.5
840	S	36.4	Very low	33.6	Very low	116 Å²	116	151.8 Å²	151.8	81%	0.811	83%	0.828	S	S	*	*			trans	-67.4	145.1	-164.4	40.6	0	0	0	0	115
841	T	31.8	Very low	33.6	Very low	121 Å²	121	154.3 Å²	154.3	74%	0.742	83%	0.834	S	S	*	*			trans	-73.6	135.7	176.4	44.5	0	0	0	0	114.7
842	E	31.7	Very low	33.5	Very low	168 Å²	168	157.9 Å²	157.9	79%	0.785	84%	0.844	S	S	*	*				61.1	127.8	129.3	-62.6	-178.1	161	0	0	121.2
843	S	35.5	Very low	33	Very low	122 Å²	122	157.6 Å²	157.6	85%	0.853	84%	0.841	S	S	*	*				-143.9	133.4	111.9	67.6	0	0	0	0	112.7
844	E	29.9	Very low	32.9	Very low	180 Å²	180	159.8 Å²	159.8	84%	0.841	85%	0.846	S	S	*	*			trans	-52.5	132.2	179.1	-63.7	-146.8	125.2	0	0	115.9
845	G	30.6	Very low	32.5	Very low	72 Å²	72	154.6 Å²	154.6	74%	0.742	84%	0.837	S	S	*	*			trans	-166.6	107.5	163.7	0	0	0	0	0	110.1
846	E	33.1	Very low	32.3	Very low	201 Å²	201	161.2 Å²	161.2	94%	0.939	85%	0.845	S	S	*	*			trans	92	74.3	152.9	-130.9	149.6	-179.1	0	0	119.3
847	K	29.9	Very low	32.3	Very low	209 Å²	209	164 Å²	164	91%	0.909	85%	0.848	S	S	*	*			trans	-86.9	116.4	150.5	-83.4	174.6	179.4	160.5	0	110
848	A	33.5	Very low	32.2	Very low	89 Å²	89	165.9 Å²	165.9	74%	0.736	85%	0.846	S	S	*	*			trans	-177.3	104.7	137.4	0	0	0	0	0	112.3
849	R	37.1	Very low	32.5	Very low	251 Å²	251	165.9 Å²	165.9	95%	0.947	84%	0.843	S	S	*	*			trans	162.7	97	134.8	-89	167.5	179.3	-159.1	0.6	110.8
850	K	31.4	Very low	32.7	Very low	201 Å²	201	163 Å²	163	87%	0.874	84%	0.839	S	S	*	*			trans	-133.7	118	152.5	-91.3	-174.7	179	174.6	0	108.1
851	N	30.3	Very low	32.5	Very low	152 Å²	152	164 Å²	164	81%	0.813	84%	0.84	S	S	*	*			trans	179.6	109.1	133.1	-90.7	-9.1	0	0	0	108.9
852	I	36.3	Very low	32.7	Very low	170 Å²	170	166.4 Å²	166.4	87%	0.872	84%	0.843	S	S	*	*			trans	-163.1	114.8	131.2	-91.3	148.4	0	0	0	105.9
853	V	30	Very low	32.6	Very low	131 Å²	131	166.6 Å²	166.6	79%	0.794	84%	0.843	S	S	*	*			trans	-97.4	125.1	172.7	170.6	0	0	0	0	106.7
854	L	33.1	Very low	32.5	Very low	163 Å²	163	168.1 Å²	168.1	85%	0.853	84%	0.841	S	S	*	*			trans	-118.8	112.1	161.5	-157.3	77.7	0	0	0	109
855	A	28.4	Very low	32.5	Very low	89 Å²	89	166.8 Å²	166.8	74%	0.736	83%	0.834	S	S	*	*			trans	-69.1	131	179	0	0	0	0	0	111.7
856	R	32.7	Very low	32.4	Very low	246 Å²	246	171.6 Å²	171.6	93%	0.928	84%	0.837	S	S	*	*			trans	-139.5	141.3	155.3	-99.3	-176.3	-180	179.5	0.5	111.9
857	R	33.2	Very low	32.5	Very low	245 Å²	245	168.4 Å²	168.4	93%	0.925	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-68.3	144	-159.3	-69.8	167.5	168.3	177.4	-4.8	114.1
858	R	29.6	Very low	32.5	Very low	240 Å²	240	168.8 Å²	168.8	91%	0.906	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-64.1	136.8	161.6	-70.2	178.4	174.8	-174.3	-3.3	110.5
859	P	38.6	Very low	32.5	Very low	123 Å²	123	168.1 Å²	168.1	80%	0.799	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.7	157.9	14.1	2.5	0	0	0	110.4
860	V	34.5	Very low	32.1	Very low	135 Å²	135	166 Å²	166	82%	0.818	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-72.1	135	174.5	171.1	0	0	0	0	109	E862	V860-E862 PolarHBondContact O-N 2.82Å
861	V	32	Very low	32	Very low	136 Å²	136	167 Å²	167	82%	0.824	83%	0.831	S	S	*	*			trans	-75.5	114.8	168.8	175.4	0	0	0	0	107.7
862	E	36.1	Very low	32.2	Very low	172 Å²	172	167.1 Å²	167.1	80%	0.804	83%	0.827	S	S	*	*			trans	-83.3	122.3	163.5	-91.5	-171.6	158.6	0	0	109.4	V860	V860-E862 PolarHBondContact O-N 2.82Å
863	E	28.2	Very low	31.9	Very low	171 Å²	171	168.2 Å²	168.2	80%	0.799	83%	0.828	S	S	*	*			trans	-77.9	117.4	173	-164.1	176.8	-161.8	0	0	108.6
864	I	34.3	Very low	32.5	Very low	155 Å²	155	167.5 Å²	167.5	80%	0.795	83%	0.826	S	S	*	*			trans	-117	112.3	167.2	-61	178.1	0	0	0	108.1
865	Q	30.5	Very low	32.6	Very low	152 Å²	152	165.1 Å²	165.1	71%	0.71	82%	0.82	S	S	*	*			trans	-81.2	147.8	173.6	-95.7	-174.6	-13.2	0	0	112.7
866	E	27.2	Very low	32.8	Very low	172 Å²	172	167.4 Å²	167.4	80%	0.804	83%	0.825	S	S	*	*			trans	70.7	126.3	153.8	-68.8	-171.6	161.2	0	0	119.7
867	V	36.7	Very low	32.9	Very low	135 Å²	135	164.2 Å²	164.2	82%	0.818	82%	0.821	S	S	*	*				-161.8	126.6	91.4	169.5	0	0	0	0	110.2
868	K	28.4	Very low	32.9	Very low	216 Å²	216	161.1 Å²	161.1	94%	0.939	82%	0.817	S	S	*	*			trans	-67.9	122.6	165.3	-84.6	174.6	172.4	170.4	0	110.2
869	G	33.9	Very low	33.2	Very low	76 Å²	76	159.1 Å²	159.1	78%	0.784	82%	0.818	S	S	*	*			trans	-155.7	128.6	172.3	0	0	0	0	0	112
870	K	29.7	Very low	33.2	Very low	206 Å²	206	162 Å²	162	90%	0.896	82%	0.82	S	S	*	*			trans	-70.7	161.1	-174.4	-85.4	173.8	165.2	177.1	0	114.8
871	R	28.8	Very low	33.2	Very low	221 Å²	221	164.4 Å²	164.4	83%	0.834	82%	0.823	S	S	*	*			trans	76.7	139.7	160.5	-88.3	179.8	159.5	165.2	-6.9	114.3
872	E	33.4	Very low	33.8	Very low	155 Å²	155	163.7 Å²	163.7	72%	0.724	82%	0.821	S	S	*	*			cis	-160.4	140.9	30	-119.8	147.9	-162.8	0	0	107.8
873	E	29.8	Very low	33.8	Very low	194 Å²	194	161 Å²	161	91%	0.907	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.7	133	169.6	-79.3	170	152.3	0	0	110.4
874	P	43.3	Very low	34.1	Very low	115 Å²	115	161.1 Å²	161.1	75%	0.747	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.2	155.2	158.2	14.9	3.8	0	0	0	110.9
875	P	36.2	Very low	34.2	Very low	113 Å²	113	162.8 Å²	162.8	73%	0.734	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-82	156.3	-159.3	34.3	-34.5	0	0	0	113.6	E877	P875-E877 PolarHBondContact O-N 2.89Å
876	V	32.3	Very low	34.1	Very low	138 Å²	138	164.6 Å²	164.6	84%	0.836	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-61.2	119.2	164	177.3	0	0	0	0	108.5
877	E	35.1	Very low	34.4	Very low	178 Å²	178	165 Å²	165	83%	0.832	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-101.1	121.2	163.4	-79.4	-175.2	162.8	0	0	108.3	P875	P875-E877 PolarHBondContact O-N 2.89Å
878	E	33.3	Very low	34.1	Very low	181 Å²	181	167.6 Å²	167.6	85%	0.846	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-73.2	120.9	169.3	-67.8	173.1	152.8	0	0	108.1	E880	E878-E880 PolarHBondContact O-N 2.91Å
879	E	35.7	Very low	34.3	Very low	197 Å²	197	168.4 Å²	168.4	92%	0.921	84%	0.839	S	S	*	*			trans	-85.1	107.3	166.2	-78.4	-173.2	156.6	0	0	108.9
880	E	37.3	Very low	34.2	Very low	183 Å²	183	169.3 Å²	169.3	86%	0.855	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-64.4	128.1	167.4	-75.8	-177.3	139.5	0	0	110.6	E878	E878-E880 PolarHBondContact O-N 2.91Å
881	E	34.8	Very low	34.2	Very low	187 Å²	187	168.7 Å²	168.7	87%	0.874	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-62.7	129.5	164	-69	-177.1	157.3	0	0	110.4
882	P	45.2	Very low	34.5	Very low	120 Å²	120	167.5 Å²	167.5	78%	0.779	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-78	143.1	167.6	29.9	-29.3	0	0	0	110.7
883	P	36.6	Very low	34.4	Very low	115 Å²	115	163.5 Å²	163.5	75%	0.747	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-78.8	151.5	-170.1	32.2	-34	0	0	0	113	E885	P883-E885 PolarHBondContact O-N 3.36Å
884	L	33.1	Very low	34.6	Very low	175 Å²	175	163.4 Å²	163.4	92%	0.916	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-51	117.9	166.6	-68.2	161.9	0	0	0	111
885	E	35.8	Very low	34.2	Very low	189 Å²	189	167.1 Å²	167.1	88%	0.883	85%	0.85	S	S	*	*			trans	-98.8	106.4	162.2	-74.5	-171.1	162.6	0	0	108.9	P883	P883-E885 PolarHBondContact O-N 3.36Å
886	E	29.8	Very low	34.3	Very low	190 Å²	190	166.9 Å²	166.9	89%	0.888	85%	0.851	S	S	*	*			trans	-66.8	124	159.1	-68.4	177.1	147.8	0	0	108.6
887	E	33.4	Very low	34.5	Very low	181 Å²	181	169.5 Å²	169.5	85%	0.846	85%	0.854	S	S	*	*			trans	-117.8	107	161	-124	-168.9	-178.8	0	0	109.4
888	E	30	Very low	34.6	Very low	190 Å²	190	165.1 Å²	165.1	89%	0.888	85%	0.848	S	S	*	*			trans	-52.7	133.8	166.1	-71.7	177.6	127.5	0	0	111
889	R	32.2	Very low	34.8	Very low	233 Å²	233	161.2 Å²	161.2	88%	0.879	85%	0.847	S	S	*	*			trans	-129.8	106.4	155	-127.6	-177.5	-170.6	93.8	-1.4	110.9
890	A	33.3	Very low	35.1	Very low	95 Å²	95	157.4 Å²	157.4	79%	0.785	84%	0.839	S	S	*	*			trans	-11.8	130.5	166.7	0	0	0	0	0	119.4
891	E	29.2	Very low	34.9	Very low	193 Å²	193	155.8 Å²	155.8	90%	0.902	83%	0.834	S	S	*	*			trans	-74.3	125	152.6	-67.9	-177	150.8	0	0	111.3
892	E	34.9	Very low	35.1	Very low	196 Å²	196	154.1 Å²	154.1	92%	0.916	83%	0.831	S	S	*	*			trans	-148	125.1	144.8	-69.5	-169.8	160.1	0	0	103.4
893	G	30.6	Very low	34.7	Very low	70 Å²	70	156.1 Å²	156.1	72%	0.722	83%	0.83	S	S	*	*			cis	118.6	132.6	43.2	0	0	0	0	0	107.4
894	E	35	Very low	34.8	Very low	192 Å²	192	155.6 Å²	155.6	90%	0.897	83%	0.828	S	S	*	*			trans	89.5	95.5	176.6	-56.1	-172.5	151	0	0	116.1
895	E	33.8	Very low	35	Very low	193 Å²	193	152.5 Å²	152.5	90%	0.902	82%	0.817	S	S	*	*				59.4	103.1	74.7	-76.1	-167.3	152.2	0	0	115.7
896	S	38.1	Very low	34.9	Very low	108 Å²	108	150.2 Å²	150.2	76%	0.755	81%	0.811	S	S	*	*			trans	-168.2	110.5	132.8	38	0	0	0	0	107.3
897	E	36.3	Very low	35.5	Very low	194 Å²	194	149.9 Å²	149.9	91%	0.907	81%	0.814	S	S	*	*				56.1	138.1	103.7	-81.7	-168.1	144	0	0	114.1
898	A	37.1	Very low	35.6	Very low	86 Å²	86	150.1 Å²	150.1	71%	0.711	82%	0.816	S	S	*	*			cis	-178.9	143.1	-15.5	0	0	0	0	0	105.2
899	A	38.8	Very low	35.9	Very low	99 Å²	99	145.3 Å²	145.3	82%	0.818	81%	0.808	S	S	*	*			trans	72.8	156	146.3	0	0	0	0	0	121.8
900	P	40.7	Very low	36.2	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	81%	0.808	S	S	*	*			trans	-127.5	-167.2	-141.3	37.8	-17.5	0	0	0	115.2
901	M	34.9	Very low	36.5	Very low	150 Å²	150	145.8 Å²	145.8	74%	0.739	81%	0.809	S	S	*	*			trans	94.7	128.1	162.9	-63.6	-179.3	63.6	0	0	119.1
902	D	38.5	Very low	36.9	Very low	152 Å²	152	143.4 Å²	143.4	81%	0.813	81%	0.807	S	S	*	*			trans	159.4	103.4	139.2	-84	-15	0	0	0	106.4
903	E	35.6	Very low	37	Very low	162 Å²	162	139 Å²	139	76%	0.757	80%	0.796	S	S	*	*				59.4	105.6	56	-154.3	177.7	-158.7	0	0	114.6
904	S	39.9	Very low	37.3	Very low	103 Å²	103	144.7 Å²	144.7	72%	0.72	80%	0.804	S	S	*	*			trans	178.5	104.8	140.3	26.6	0	0	0	0	110.4
905	T	36.2	Very low	37.3	Very low	111 Å²	111	145.1 Å²	145.1	68%	0.681	81%	0.806	S	S	*	*				80.8	105.7	95.4	58.5	0	0	0	0	113
906	D	34.4	Very low	37.4	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	80%	0.796	S	S	*	*				90.6	119.7	85.5	-77.7	-29.4	0	0	0	112.8
907	L	42.1	Very low	37.2	Very low	183 Å²	183	139.6 Å²	139.6	96%	0.958	80%	0.799	S	S	*	*			trans	-146.8	111.6	136.5	-80.6	-173.2	0	0	0	110
908	E	36.8	Very low	37.1	Very low	186 Å²	186	135 Å²	135	87%	0.869	79%	0.794	S	S	*	*			trans	-86.3	159.4	177.3	-133.9	178	174.2	0	0	111.6
909	A	35.9	Very low	37	Very low	89 Å²	89	139.8 Å²	139.8	74%	0.736	80%	0.802	S	S	*	*				130.9	143	129.8	0	0	0	0	0	118.2
910	Q	39.1	Very low	36.7	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	80%	0.799	S	S	*	*			trans	91.3	97.8	165.1	-56.3	-176.2	-7.7	0	0	115.3
911	D	37.8	Very low	36.4	Very low	151 Å²	151	141 Å²	141	81%	0.807	80%	0.801	S	S	*	*			cis	76.8	96.9	37.1	-144.3	20.8	0	0	0	113.6
912	V	39.2	Very low	36.4	Very low	142 Å²	142	138.2 Å²	138.2	86%	0.861	80%	0.796	S	S	*	*			trans	-152.7	123.2	156	-174.8	0	0	0	0	109.8
913	P	36.3	Very low	36.2	Very low	105 Å²	105	140.4 Å²	140.4	68%	0.682	80%	0.804	S	S	*	*			trans	-112.6	151.6	167.5	37.2	-26.5	0	0	0	112.7
914	E	37.5	Very low	36.2	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	81%	0.808	S	S	*	*			trans	-177.5	109.8	154.9	-109.3	179.3	174.5	0	0	108.4
915	E	34.6	Very low	35.9	Very low	201 Å²	201	148.5 Å²	148.5	94%	0.939	82%	0.82	S	S	*	*				48.3	123.8	94.6	-73.8	-142.1	164.3	0	0	116.6
916	G	35.2	Very low	35.7	Very low	67 Å²	67	147 Å²	147	69%	0.691	83%	0.826	S	S	*	*			trans	148.5	77.2	170	0	0	0	0	0	112.2
917	S	33.9	Very low	35.7	Very low	117 Å²	117	146.5 Å²	146.5	82%	0.818	83%	0.827	S	S	*	*				79.5	108.6	103.3	72	0	0	0	0	115.1
918	A	35.5	Very low	35.3	Very low	98 Å²	98	146.6 Å²	146.6	81%	0.81	82%	0.823	S	S	*	*			trans	18.5	118.2	144.1	0	0	0	0	0	118.7
919	E	33.3	Very low	35.2	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	81%	0.812	S	S	*	*			trans	-151.2	111.5	134.8	-115.4	174.9	-174	0	0	110.2
920	S	33.4	Very low	35.1	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	82%	0.817	S	S	*	*			trans	-66.3	125.5	159.9	46.5	0	0	0	0	109.3
921	V	34.4	Very low	34.8	Very low	132 Å²	132	146.1 Å²	146.1	80%	0.8	82%	0.816	S	S	*	*			trans	-112.6	87.7	162.4	-178	0	0	0	0	107.8
922	S	35.3	Very low	34.6	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	81%	0.811	S	S	*	*			trans	-66.9	124.3	154.9	42.5	0	0	0	0	108.8	E924	S922-E924 PolarHBondContact O-N 3.05Å; S922-E924 VanDerWaalsContact O-N 3.15Å
923	M	34.8	Very low	34.2	Very low	198 Å²	198	146 Å²	146	98%	0.975	81%	0.812	S	S	*	*			trans	-81.5	85.3	172.6	-151.4	167.3	-176.8	0	0	108.3
924	E	35.5	Very low	34.1	Very low	180 Å²	180	145.8 Å²	145.8	84%	0.841	81%	0.813	S	S	*	*			trans	-103.4	109.4	162.7	-80.1	-162.7	146.7	0	0	109.2	S922	S922-E924 PolarHBondContact O-N 3.05Å; S922-E924 VanDerWaalsContact O-N 3.15Å
925	R	32.6	Very low	33.9	Very low	255 Å²	255	145 Å²	145	96%	0.962	81%	0.809	S	S	*	*			trans	-171.2	113.1	140.3	-119.3	177.5	-179.8	145.6	1.1	110.4
926	G	31.4	Very low	33.8	Very low	78 Å²	78	142.5 Å²	142.5	80%	0.804	80%	0.802	S	S	*	*			trans	166.6	47.9	174.4	0	0	0	0	0	111.1	E928	G926-E928 PolarHBondContact O-N 3.11Å
927	V	35.4	Very low	33.6	Very low	131 Å²	131	144 Å²	144	79%	0.794	80%	0.801	S	S	*	*			trans	-86.2	99.7	164.4	177.6	0	0	0	0	106.2
928	E	33.2	Very low	33.4	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	80%	0.803	S	S	*	*			trans	-115.7	88.2	147.9	-82.2	-173.7	161.8	0	0	106.5	G926	G926-E928 PolarHBondContact O-N 3.11Å
929	S	34.2	Very low	33.3	Very low	91 Å²	91	144.2 Å²	144.2	64%	0.636	80%	0.797	S	S	*	*			trans	-78.1	103.2	154.4	49.8	0	0	0	0	106.9	E931	S929-E931 VanDerWaalsContact C-N 3.35Å; S929-E931 PolarHBondContact O-N 3.48Å; S929-E931 VanDerWaalsContact O-N 3.12Å
930	E	34.4	Very low	33.1	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	79%	0.791	S	S	*	*			trans	-73.5	94.8	161.4	-75	-165.3	143.8	0	0	108.5	S932	E930-S932 PolarHBondContact O-N 3.11Å
931	E	32.5	Very low	33.1	Very low	182 Å²	182	140.4 Å²	140.4	85%	0.85	79%	0.791	S	S	*	*			trans	-64.7	105.1	150.5	-72.5	-179.1	149.8	0	0	107.6	S929	S929-E931 VanDerWaalsContact C-N 3.35Å; S929-E931 PolarHBondContact O-N 3.48Å; S929-E931 VanDerWaalsContact O-N 3.12Å
932	S	33.5	Very low	32.8	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	79%	0.79	S	S	*	*			trans	-112.1	89.5	155	49.5	0	0	0	0	108.4	E930 S934	E930-S932 PolarHBondContact O-N 3.11Å; S932-S934 PolarHBondContact O-N 2.76Å
933	E	32	Very low	32.9	Very low	189 Å²	189	140.9 Å²	140.9	88%	0.883	80%	0.795	S	S	*	*			trans	-62.3	112	155.3	-68.6	-172.2	139.3	0	0	108.3
934	S	34.4	Very low	32.8	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	79%	0.792	S	S	*	*			trans	-146.7	97.9	148	53.1	0	0	0	0	106.1	S932	S932-S934 PolarHBondContact O-N 2.76Å
935	E	33.3	Very low	32.8	Very low	172 Å²	172	137.5 Å²	137.5	80%	0.804	79%	0.789	S	S	*	*				49	93.1	94	-68.6	-151.7	148.8	0	0	111.8
936	L	31.8	Very low	32.8	Very low	150 Å²	150	133 Å²	133	79%	0.785	78%	0.783	S	S	*	*				154.7	129.4	107.7	-85.6	144.2	0	0	0	113.1
937	S	31.8	Very low	32.8	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	78%	0.782	S	S	*	*			trans	65.9	87.1	153.2	60.4	0	0	0	0	118.2	S939	S937-S939 PolarHBondContact O-N 3.43Å
938	S	28.6	Very low	32.7	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	78%	0.784	S	S	*	*				-48.5	115.3	125.7	54	0	0	0	0	110.3
939	S	33.3	Very low	32.7	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	78%	0.775	S	S	*	*			trans	-121	89.2	156.5	64.2	0	0	0	0	108.7	S937 S941	S937-S939 PolarHBondContact O-N 3.43Å; S939-S941 PolarHBondContact O-N 3.5Å
940	S	29.6	Very low	32.7	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	78%	0.783	S	S	*	*			trans	-60.6	103.5	149.3	51.6	0	0	0	0	107.9	T942	S940-T942 PolarHBondContact O-N 3.22Å
941	S	32.1	Very low	32.8	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	79%	0.785	S	S	*	*			trans	-87.5	82.5	165.4	44.5	0	0	0	0	109	S939 S943	S939-S941 PolarHBondContact O-N 3.5Å; S941-S943 PolarHBondContact O-N 3.41Å
942	T	30.1	Very low	32.7	Very low	128 Å²	128	125.2 Å²	125.2	79%	0.785	78%	0.78	S	S	*	*			trans	-68.4	106.6	150.1	47.4	0	0	0	0	107.5	S940	S940-T942 PolarHBondContact O-N 3.22Å
943	S	37.1	Very low	32.7	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	78%	0.784	S	S	*	*			trans	-111.3	102.1	158.5	59.7	0	0	0	0	108.3	S941 S945	S941-S943 PolarHBondContact O-N 3.41Å; S943-S945 PolarHBondContact O-N 3.39Å
944	E	32.5	Very low	32.7	Very low	197 Å²	197	129 Å²	129	92%	0.921	78%	0.784	S	S	*	*			trans	-60	116.5	159.7	-65.5	176.7	126.2	0	0	108.9
945	S	34.3	Very low	32.9	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	79%	0.789	S	S	*	*			trans	-130.8	88.8	154.5	51.8	0	0	0	0	109.2	S943	S943-S945 PolarHBondContact O-N 3.39Å
946	L	33.4	Very low	33.2	Very low	160 Å²	160	127.8 Å²	127.8	84%	0.838	79%	0.785	S	S	*	*			trans	5.4	113.6	147.2	-71.3	156	0	0	0	118.2
947	S	32.1	Very low	33.2	Very low	113 Å²	113	130 Å²	130	79%	0.79	79%	0.792	S	S	*	*				63.4	114.7	126.3	69.6	0	0	0	0	119.8
948	G	32	Very low	33.3	Very low	81 Å²	81	136.3 Å²	136.3	84%	0.835	80%	0.802	S	S	*	*			trans	177.8	53.4	162.7	0	0	0	0	0	117.2
949	G	33.1	Very low	33.6	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	79%	0.794	S	S	*	*			trans	54.7	128	144	0	0	0	0	0	121.6
950	P	35.5	Very low	33.6	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	81%	0.805	S	S	*	*			trans	-82.5	132.7	-178.8	34.1	-31	0	0	0	112
951	W	35.2	Very low	33.9	Very low	228 Å²	228	148.6 Å²	148.6	86%	0.864	81%	0.808	S	S	*	*			trans	-120.5	91.6	157.6	-79.1	78.7	0	0	0	108.6	F953	W951-F953 HydrophobicContact CE3-CE2 4.47Å
952	G	30.6	Very low	34	Very low	72 Å²	72	152.5 Å²	152.5	74%	0.742	81%	0.811	S	S	*	*			trans	-71.4	125.4	163.1	0	0	0	0	0	109.2
953	F	34.7	Very low	34.4	Very low	184 Å²	184	154.7 Å²	154.7	81%	0.807	82%	0.818	S	S	*	*			trans	-99.4	112.5	159.6	-96.9	-90.5	0	0	0	108.1	W951 V955	W951-F953 HydrophobicContact CE3-CE2 4.47Å; F953-V955 PolarHBondContact O-N 2.71Å
954	Q	30.8	Very low	34.4	Very low	186 Å²	186	158.4 Å²	158.4	87%	0.869	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-62.5	120.4	166	-80	162.1	-80.2	0	0	109
955	V	39.9	Very low	34.4	Very low	135 Å²	135	157 Å²	157	82%	0.818	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.1	126.9	164	-176	0	0	0	0	107.6	F953	F953-V955 PolarHBondContact O-N 2.71Å
956	P	39.1	Very low	34.6	Very low	111 Å²	111	158 Å²	158	72%	0.721	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-70.1	136.7	176.4	-12.7	27.3	0	0	0	111.1	Y958	P956-Y958 PolarHBondContact O-N 3.2Å
957	E	30.8	Very low	34.8	Very low	197 Å²	197	158.8 Å²	158.8	92%	0.921	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-50.4	121.1	167.4	-83	176.6	137.6	0	0	110.8	D959	E957-D959 PolarHBondContact O-N 3.38Å
958	Y	34.2	Very low	34.9	Very low	229 Å²	229	162.6 Å²	162.6	90%	0.898	82%	0.82	S	S	*	*			trans	-90.6	102.7	169.6	-136.7	-91.8	0	0	0	109.4	P956 R960	P956-Y958 PolarHBondContact O-N 3.2Å; Y958-R960 PolarHBondContact O-N 3.07Å
959	D	35.1	Very low	35.2	Very low	128 Å²	128	164.4 Å²	164.4	68%	0.684	82%	0.82	S	S	*	*			trans	-64.4	105.7	178.1	-161.2	-3.6	0	0	0	110.6	E957 R961	E957-D959 PolarHBondContact O-N 3.38Å; D959-R961 PolarHBondContact O-N 3.22Å
960	R	33.9	Very low	35.4	Very low	246 Å²	246	167.2 Å²	167.2	93%	0.928	83%	0.827	S	S	*	*			trans	-74.8	85.9	172.7	-92.6	-175.9	168.3	169.8	-1.5	110	Y958	Y958-R960 PolarHBondContact O-N 3.07Å
961	R	36.1	Very low	35.5	Very low	210 Å²	210	165 Å²	165	79%	0.792	83%	0.827	S	S	*	*			trans	-145.1	103.8	159.2	-66.9	-170.3	-157.8	-167.3	4.3	112.4	D959	D959-R961 PolarHBondContact O-N 3.22Å
962	K	34.1	Very low	35.8	Very low	192 Å²	192	158.6 Å²	158.6	84%	0.835	82%	0.822	S	S	*	*			trans	142.2	94.6	139.5	-82	179.1	175.6	-176.7	0	110.8
963	D	37.7	Very low	36.2	Very low	173 Å²	173	162.3 Å²	162.3	93%	0.925	83%	0.825	S	S	*	*			trans	-108.8	108.4	152.8	-72.8	-42.2	0	0	0	107.8
964	E	37.6	Very low	36.2	Very low	184 Å²	184	158.3 Å²	158.3	86%	0.86	82%	0.82	S	S	*	*			trans	-90.2	125.9	161.5	-80.6	-178.4	157.4	0	0	107.9
965	E	33.1	Very low	36.6	Very low	167 Å²	167	158.1 Å²	158.1	78%	0.78	82%	0.819	S	S	*	*			trans	-53.1	156.1	172.5	-68	-177.5	139.8	0	0	112.9
966	P	38.6	Very low	36.4	Very low	133 Å²	133	155 Å²	155	86%	0.864	81%	0.813	S	S	*	*				-134.3	140.5	117.6	31.6	-17.7	0	0	0	115.3
967	K	37.2	Very low	36.4	Very low	176 Å²	176	160.5 Å²	160.5	77%	0.765	82%	0.821	S	S	*	*			trans	-51.1	135.6	179.3	-75.4	167.9	176.3	168.2	0	117.5
968	K	34.2	Very low	36.7	Very low	193 Å²	193	158.4 Å²	158.4	84%	0.839	82%	0.817	S	S	*	*				48.1	130	127.8	-93	178.4	175.9	175.6	0	120.9
969	S	37.9	Very low	36.6	Very low	118 Å²	118	154.2 Å²	154.2	83%	0.825	82%	0.815	S	S	*	*				-148.9	142.6	118.9	47.4	0	0	0	0	111.6
970	P	38.2	Very low	36.9	Very low	125 Å²	125	152.7 Å²	152.7	81%	0.812	82%	0.82	S	S	*	*			trans	-109.5	161.3	-165.7	39.4	-29.4	0	0	0	114.8
971	G	37.6	Very low	36.9	Very low	79 Å²	79	153.2 Å²	153.2	81%	0.814	84%	0.84	S	S	*	*			trans	130	106.8	147.5	0	0	0	0	0	116.4
972	A	39.6	Very low	37	Very low	92 Å²	92	150.4 Å²	150.4	76%	0.76	84%	0.843	S	S	*	*				154.7	120.3	103.2	0	0	0	0	0	113.2
973	N	39.3	Very low	37.1	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	84%	0.843	S	S	*	*			trans	58.8	106.6	144.4	-65.2	5.2	0	0	0	120
974	S	34.6	Very low	37.1	Very low	99 Å²	99	146.8 Å²	146.8	69%	0.692	84%	0.839	S	S	*	*				67.1	105.3	85.8	74.8	0	0	0	0	112.4
975	E	40.3	Very low	37.1	Very low	183 Å²	183	144.6 Å²	144.6	86%	0.855	84%	0.837	S	S	*	*				-168.4	137.5	92.9	-81.4	160.9	179.1	0	0	105.7
976	G	34.6	Very low	37.3	Very low	68 Å²	68	143.3 Å²	143.3	70%	0.701	84%	0.841	S	S	*	*			cis	102.3	66.3	34.7	0	0	0	0	0	110.3
977	Y	39.9	Very low	37.3	Very low	227 Å²	227	143.9 Å²	143.9	89%	0.89	84%	0.839	S	S	*	*			trans	-135.8	114.7	164.5	-87.8	-81	0	0	0	110.9
978	N	37.2	Very low	37.3	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	85%	0.845	S	S	*	*			trans	-70.8	146.8	177.3	-69.9	-29.1	0	0	0	111.6
979	T	32	Very low	37.5	Very low	141 Å²	141	137.7 Å²	137.7	87%	0.865	85%	0.845	S	S	*	*			trans	-25.3	133.2	149.2	33.9	0	0	0	0	115.8
980	A	41.6	Very low	37.5	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	85%	0.847	S	S	*	*			trans	-147.7	127.2	153.3	0	0	0	0	0	109.5
981	L	34.6	Very low	37.4	Very low	257 Å²	257	140.6 Å²	140.6	100%	1.346	85%	0.85	S	S	*	*			trans	78.2	0	-175.1	-69.6	160.2	0	0	0	116.2

Retrieved 981 of 981 residues in 475 ms (Link to these results)

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