A0A087Y8U9_POEFO Loading...

MET proto-oncogene, receptor tyrosine kinase

AlphaFold DB , UniProt , Accession A0A087Y8U9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,102 aa.

						>A0A087Y8U9_POEFO|A0A087Y8U9
MNLLLLHATMLLWALSPSMQNYCDKSSETSKLNLSVTYELPTFTADFPIQNMVTLDGIIYVGAVNRIYALAPNLTKLSEYHTGPLLAHQACGLTQTTTGGASGVDNHNIALVVENIYDKGLYSCGSADNGVCRRHVLDDGNSLKAIDEDVYCFADKVQPGQGHPIDADVVVSPSGSQVLNVESNVITFFVGNSEIPKAGNISGSIMRLHTISQRKMKTSQNGFTFFSSLSHMDLIPSLQGNYYLRYVYSFHSGPFTYFLTVQQVNKDTQAYHTRIVRMCSSDLVIRRYVEMPLECISTNKRRRRATEEVKVFNILQAAHVTKVGNDAELQRQLKAEEDEDVLFAAFAQGQPGSPEPTPNSAVCVMSLKHINNMFKMYMQRCNTIDPYHFTGSERKSCYNMTSSDDCDPHEGIHEGKEGMYRLQVTQFVQRLEFWHKDLKNTLVTSITVVPVNGRTVAYLGTADGRHIQVLFSRFTSPHVNIGLDSSPVSASVVLPDTPHSEGAVLMATGSKITKIPLIGPGCGQLTTCTSCLLSSKVTQCGWCDGRCTRRPQCPSTSSWSQDNCTPVITKVFPSSGPIRGSTAVTICGRNFGFDKTENFKTSMVNVEVAGAQCKLARQDNVNRWTEMQCSPSFSGNFTPSGHLVKVTSGHAVAKLEGFKFVDPVINNIFPTFGPKSGNTMLTIRGAFLDTGNKQVVTVGKASCKIQSLSFSMLICKTPPHTHAVPSEQPVKLTVDSVERQAPVPFTYNEDPVISSIQPLRSFVSGGCTVSAQGSYLQSGLQPQMVLRTAQDTAVFHVSCVYGENRTSIQCTTPSLAKLPLQPPVVTKVAFVLDGYLTDQKDLIYVEDPLFQDPKLTSKDNKSIVELKGDRMDREAMKCQVLTVSNHSCESLTVVGNTLECTVPTQLQAATAKELQVEWRQADSIRHLGKVTLAQEQDYTGLIVGCVCVSLLLLFLASLLMWRRNKHIDDLSEVWYDGRGHIQHLDRLANARSVSPTNEMVSHESVDYRTTLLEDQGVDRPETCRAAPPMYRANGELLSPRLGTLGGGLGLGMEGDLVSPLLMAPVHIDPSCLHPDLLTEVQHVVIAREQLLLHVNQIIGRGQ
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	36.2	Very low	211 Å²	211	126.3 Å²	126.3	100%	1.039	67%	0.666	S	S	*	*				0	-49.7	0	-151.2	133.2	71.9	0	0	113.1
2	N	39.3	Very low	35.7	Very low	125 Å²	125	126.5 Å²	126.5	67%	0.668	67%	0.667	S	S	*	*	H	α-helix	trans	-78.1	-23	-166.2	-64.3	5.4	0	0	0	117.3	L4 L5	N2-L4 PolarHBondContact O-N 3.15Å; N2-L5 PolarHBondContact O-N 3.47Å
3	L	33.8	Very low	35	Very low	143 Å²	143	133.5 Å²	133.5	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-64.1	-38	179.3	-100	71.5	0	0	0	113.4	L5 L6 H7	L3-L5 PolarHBondContact O-N 3.35Å; L3-L6 PolarHBondContact O-N 2.95Å; L3-L6 VanDerWaalsContact O-N 3.17Å; L3-H7 PolarHBondContact O-N 2.68Å; L3-H7 VanDerWaalsContact O-N 3.1Å
4	L	34.6	Very low	34.5	Very low	140 Å²	140	130.1 Å²	130.1	73%	0.733	68%	0.681	S	S	*	*	H	α-helix	trans	-60.9	-33.1	179	-83.2	153.9	0	0	0	112.2	N2 A8	N2-L4 PolarHBondContact O-N 3.15Å; L4-A8 WeakPolarHBondContact O-CB 3.17Å; L4-A8 PolarHBondContact O-N 3.45Å
5	L	34.2	Very low	34	Very low	128 Å²	128	129.5 Å²	129.5	67%	0.67	68%	0.677	S	S	*	*	H	α-helix	trans	-71.1	-33.8	177.8	-129.5	74.3	0	0	0	112.6	N2 L3 T9	N2-L5 PolarHBondContact O-N 3.47Å; L3-L5 PolarHBondContact O-N 3.35Å; L5-T9 WeakPolarHBondContact O-CG2 3.3Å; L5-T9 PolarHBondContact O-N 3.12Å; L5-T9 VanDerWaalsContact O-N 3.14Å; L5-T9 PolarHBondContact O-OG1 2.89Å
6	L	37.5	Very low	33.3	Very low	115 Å²	115	125.6 Å²	125.6	60%	0.602	66%	0.664	S	S	*	*	H	α-helix	trans	-72.6	-40.7	174.1	-89.6	81.8	0	0	0	112	L3 T9 M10	L3-L6 PolarHBondContact O-N 2.95Å; L3-L6 VanDerWaalsContact O-N 3.17Å; L6-T9 WeakPolarHBondContact CA-OG1 3.45Å; L6-T9 PolarHBondContact O-N 3.46Å; L6-T9 PolarHBondContact O-OG1 2.84Å; L6-T9 VanDerWaalsContact O-OG1 3.12Å; L6-M10 PolarHBondContact O-N 3.26Å
7	H	35.1	Very low	33.1	Very low	130 Å²	130	125.7 Å²	125.7	60%	0.602	67%	0.674	S	S	*	*	H	α-helix	trans	-65.3	-41	175.7	-84.9	49.6	0	0	0	111.9	L3 T9 M10 L11	L3-H7 PolarHBondContact O-N 2.68Å; L3-H7 VanDerWaalsContact O-N 3.1Å; H7-T9 PolarHBondContact O-N 2.88Å; H7-M10 PolarHBondContact O-N 3.19Å; H7-L11 WeakPolarHBondContact O-CD1 3.38Å; H7-L11 PolarHBondContact O-N 2.79Å
8	A	36.4	Very low	32.9	Very low	51 Å²	51	123.8 Å²	123.8	42%	0.421	67%	0.672	S	S	.	*	H	α-helix	trans	-61.5	-42.8	174.9	0	0	0	0	0	112.6	L4 L12	L4-A8 WeakPolarHBondContact O-CB 3.17Å; L4-A8 PolarHBondContact O-N 3.45Å; A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 PolarHBondContact O-N 2.76Å; A8-L12 VanDerWaalsContact O-N 3.14Å
9	T	38.4	Very low	32.8	Very low	80 Å²	80	124.7 Å²	124.7	49%	0.491	67%	0.673	S	S	.	*	H	α-helix	trans	-72.2	-33.4	-179.8	45.3	0	0	0	0	113.2	L5 L6 H7 W13	L5-T9 WeakPolarHBondContact O-CG2 3.3Å; L5-T9 PolarHBondContact O-N 3.12Å; L5-T9 VanDerWaalsContact O-N 3.14Å; L5-T9 PolarHBondContact O-OG1 2.89Å; L6-T9 WeakPolarHBondContact CA-OG1 3.45Å; L6-T9 PolarHBondContact O-N 3.46Å; L6-T9 PolarHBondContact O-OG1 2.84Å; L6-T9 VanDerWaalsContact O-OG1 3.12Å; H7-T9 PolarHBondContact O-N 2.88Å; T9-W13 PolarHBondContact O-N 2.95Å
10	M	35.5	Very low	33.2	Very low	146 Å²	146	125.3 Å²	125.3	72%	0.719	67%	0.672	S	S	*	*	H	α-helix	trans	-66.5	-46.5	171.8	-79.5	-65.6	-164.8	0	0	112.7	L6 H7 L12 W13	L6-M10 PolarHBondContact O-N 3.26Å; H7-M10 PolarHBondContact O-N 3.19Å; M10-L12 VanDerWaalsContact C-N 3.27Å; M10-L12 PolarHBondContact O-N 2.92Å; M10-W13 PolarHBondContact O-N 3.45Å
11	L	33.8	Very low	34	Very low	120 Å²	120	123.2 Å²	123.2	63%	0.628	66%	0.66	S	S	*	*	H	α-helix	trans	-63.6	-32	177.4	-94.3	78.9	0	0	0	112.7	H7 W13 A14	H7-L11 WeakPolarHBondContact O-CD1 3.38Å; H7-L11 PolarHBondContact O-N 2.79Å; L11-W13 VanDerWaalsContact C-N 3.32Å; L11-W13 PolarHBondContact O-N 2.76Å; L11-A14 PolarHBondContact O-N 3.38Å
12	L	30	Very low	35	Very low	129 Å²	129	116.9 Å²	116.9	68%	0.675	63%	0.626	S	S	*	*	H	α-helix	trans	-68	-25.5	177.6	-90.8	161.6	0	0	0	113.9	A8 M10	A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 PolarHBondContact O-N 2.76Å; A8-L12 VanDerWaalsContact O-N 3.14Å; M10-L12 VanDerWaalsContact C-N 3.27Å; M10-L12 PolarHBondContact O-N 2.92Å
13	W	27.3	Very low	36.3	Very low	218 Å²	218	111.3 Å²	111.3	83%	0.826	60%	0.596	S	S	*	*	H	α-helix	trans	-76.6	-33.3	173.9	-89.7	64.7	0	0	0	112.8	T9 M10 L11 L15 S16	T9-W13 PolarHBondContact O-N 2.95Å; M10-W13 PolarHBondContact O-N 3.45Å; L11-W13 VanDerWaalsContact C-N 3.32Å; L11-W13 PolarHBondContact O-N 2.76Å; W13-L15 PolarHBondContact O-N 2.86Å; W13-L15 VanDerWaalsContact O-N 3.13Å; W13-S16 PolarHBondContact O-OG 3.35Å
14	A	27.6	Very low	37.4	Very low	85 Å²	85	110.9 Å²	110.9	70%	0.702	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-3.5	-177.3	0	0	0	0	0	115.2	L11	L11-A14 PolarHBondContact O-N 3.38Å
15	L	26.5	Very low	38.2	Very low	121 Å²	121	110.6 Å²	110.6	63%	0.634	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	19.4	-177.3	-67.5	174.7	0	0	0	114.1	W13 P17	W13-L15 PolarHBondContact O-N 2.86Å; W13-L15 VanDerWaalsContact O-N 3.13Å; L15-P17 WeakPolarHBondContact O-CD 3.44Å
16	S	23.3	Very low	38.6	Very low	67 Å²	67	106.7 Å²	106.7	47%	0.469	57%	0.571	S	S	.	*			trans	-108.6	103.6	170.7	67.1	0	0	0	0	111.9	W13 S18	W13-S16 PolarHBondContact O-OG 3.35Å; S16-S18 PolarHBondContact O-N 3.16Å
17	P	29.1	Very low	38.8	Very low	128 Å²	128	104 Å²	104	83%	0.831	56%	0.561	S	S	*	*			trans	-76.1	71.8	172.8	31.8	-34.3	0	0	0	109.8	L15	L15-P17 WeakPolarHBondContact O-CD 3.44Å
18	S	29.9	Very low	39.4	Very low	92 Å²	92	101.1 Å²	101.1	64%	0.643	55%	0.549	S	S	*	.			trans	-95.8	111.4	-178.8	68.9	0	0	0	0	111.8	S16	S16-S18 PolarHBondContact O-N 3.16Å
19	M	31.1	Very low	39.9	Very low	140 Å²	140	103.9 Å²	103.9	69%	0.69	56%	0.56	S	S	*	*			trans	58.7	67.7	168.4	-57.3	-74.2	91.8	0	0	115.8	N21	M19-N21 PolarHBondContact O-N 2.79Å; M19-N21 PolarHBondContact O-ND2 2.93Å
20	Q	41.4	Very low	40.6	Very low	137 Å²	137	101.3 Å²	101.3	64%	0.64	55%	0.546	S	S	*	.			trans	-49.4	130.3	142.5	-127.2	79.5	1.4	0	0	107.9	Y22	Q20-Y22 HydrophobicContact CB-CE1 4.07Å; Q20-Y22 HydrophobicContact CB-CE2 4.07Å; Q20-Y22 WeakPolarHBondContact O-CD2 3.41Å; Q20-Y22 PolarHBondContact O-N 3.02Å
21	N	49.4	Very low	41.8	Very low	81 Å²	81	101.1 Å²	101.1	43%	0.433	54%	0.541	S	S	.	.			trans	-87.9	102.9	175.1	-56.2	-89.7	0	0	0	106.4	M19 C23 K25	M19-N21 PolarHBondContact O-N 2.79Å; M19-N21 PolarHBondContact O-ND2 2.93Å; N21-C23 CarbonylContact C-O 3.51Å; N21-K25 HydrophobicContact CB-CD 4.16Å; N21-K25 HydrophobicContact CB-CG 4.36Å; N21-K25 VanDerWaalsContact CG-NZ 3.32Å; N21-K25 WeakPolarHBondContact OD1-CE 3.44Å; N21-K25 PolarHBondContact OD1-NZ 2.82Å
22	Y	60	Low	43.6	Very low	79 Å²	79	96.4 Å²	96.4	31%	0.31	52%	0.516	S	S	.	.			trans	-77.5	-29	-169.4	-70.3	-75.4	0	0	0	113.4	Q20 K570 F572	Q20-Y22 HydrophobicContact CB-CE1 4.07Å; Q20-Y22 HydrophobicContact CB-CE2 4.07Å; Q20-Y22 WeakPolarHBondContact O-CD2 3.41Å; Q20-Y22 PolarHBondContact O-N 3.02Å; Y22-K570 PolarHBondContact O-NZ 2.85Å; Y22-F572 AromaticContact CD1-CD1 3.53Å; Y22-F572 HydrophobicContact CD1-CD1 3.53Å; Y22-F572 HydrophobicContact CD1-CD2 4.02Å; Y22-F572 AromaticContact CD1-CE1 3.51Å; Y22-F572 HydrophobicContact CD1-CE1 3.51Å; Y22-F572 AromaticContact CD1-CE2 4Å; Y22-F572 HydrophobicContact CD1-CE2 4Å; Y22-F572 AromaticContact CD1-CG 3.8Å; Y22-F572 HydrophobicContact CD1-CG 3.8Å; Y22-F572 AromaticContact CD1-CZ 3.76Å; Y22-F572 HydrophobicContact CD1-CZ 3.76Å; Y22-F572 AromaticContact CD2-CD1 3.91Å; Y22-F572 HydrophobicContact CD2-CD1 3.91Å; Y22-F572 HydrophobicContact CD2-CE1 4.03Å; Y22-F572 AromaticContact CE1-CD1 3.84Å; Y22-F572 HydrophobicContact CE1-CD1 3.84Å; Y22-F572 HydrophobicContact CE1-CD2 4.4Å; Y22-F572 AromaticContact CE1-CE1 3.28Å; Y22-F572 HydrophobicContact CE1-CE1 3.28Å; Y22-F572 AromaticContact CE1-CE2 3.92Å; Y22-F572 HydrophobicContact CE1-CE2 3.92Å; Y22-F572 HydrophobicContact CE1-CG 4.38Å; Y22-F572 AromaticContact CE1-CZ 3.34Å; Y22-F572 HydrophobicContact CE1-CZ 3.34Å; Y22-F572 HydrophobicContact CE2-CD1 4.18Å; Y22-F572 AromaticContact CE2-CE1 3.82Å; Y22-F572 HydrophobicContact CE2-CE1 3.82Å; Y22-F572 AromaticContact CG-CD1 3.56Å; Y22-F572 HydrophobicContact CG-CD1 3.56Å; Y22-F572 AromaticContact CG-CE1 3.88Å; Y22-F572 HydrophobicContact CG-CE1 3.88Å; Y22-F572 HydrophobicContact CG-CG 4.02Å; Y22-F572 AromaticContact CZ-CE1 3.43Å; Y22-F572 VanDerWaalsContact CZ-CE1 3.43Å; Y22-F572 AromaticContact CZ-CZ 3.82Å
23	C	66.8	Low	45.9	Very low	7 Å²	7	93.3 Å²	93.3	5%	0.047	50%	0.5	C	S	.	.	S	Bend	trans	-80.4	140.1	161.9	-55.3	0	0	0	0	109.3	N21 K25 C587 E626	N21-C23 CarbonylContact C-O 3.51Å; C23-K25 PolarHBondContact O-N 3.34Å; C23-C587 WeakPolarHBondContact CA-SG 3.5Å; C23-C587 HydrophobicContact CB-CB 3.73Å; C23-C587 WeakPolarHBondContact CB-SG 3.38Å; C23-C587 WeakPolarHBondContact SG-CA 3.1Å; C23-C587 WeakPolarHBondContact SG-CB 3.31Å; C23-C587 CovalentContact SG-SG 2.03Å; C23-C587 PolarHBondContact SG-SG 2.69Å; C23-E626 HydrophobicContact CB-CB 4.33Å; C23-E626 HydrophobicContact CB-CG 4.34Å
24	D	58.4	Low	48.4	Very low	135 Å²	135	88 Å²	88	72%	0.722	49%	0.487	S	S	*	.			trans	-55.4	125.6	168.3	-63.8	-64.7	0	0	0	108.8	S26	D24-S26 PolarHBondContact O-N 2.83Å
25	K	50	Low	50.8	Low	133 Å²	133	88.2 Å²	88.2	58%	0.578	48%	0.484	S	S	*	.			trans	-73.7	67.7	168.4	-87.4	177.5	164.6	165.5	0	109	N21 C23 S27	N21-K25 HydrophobicContact CB-CD 4.16Å; N21-K25 HydrophobicContact CB-CG 4.36Å; N21-K25 VanDerWaalsContact CG-NZ 3.32Å; N21-K25 WeakPolarHBondContact OD1-CE 3.44Å; N21-K25 PolarHBondContact OD1-NZ 2.82Å; C23-K25 PolarHBondContact O-N 3.34Å; K25-S27 PolarHBondContact O-N 3.19Å; K25-S27 VanDerWaalsContact O-N 3.12Å
26	S	43.9	Very low	53.5	Low	47 Å²	47	84.1 Å²	84.1	33%	0.329	46%	0.464	S	S	.	.			trans	-46.6	120.2	158.4	55.5	0	0	0	0	107.2	D24 E28	D24-S26 PolarHBondContact O-N 2.83Å; S26-E28 PolarHBondContact O-N 2.96Å
27	S	41.8	Very low	56.4	Low	57 Å²	57	87.2 Å²	87.2	40%	0.399	48%	0.48	S	S	.	.			trans	-75.3	49.3	173.8	72.6	0	0	0	0	109.8	K25 T29 K31	K25-S27 PolarHBondContact O-N 3.19Å; K25-S27 VanDerWaalsContact O-N 3.12Å; S27-T29 PolarHBondContact O-N 3.1Å; S27-K31 WeakPolarHBondContact OG-CD 3.36Å; S27-K31 WeakPolarHBondContact OG-CE 3.24Å; S27-K31 PolarHBondContact OG-NZ 3.22Å
28	E	47.5	Very low	59.2	Low	71 Å²	71	83.9 Å²	83.9	33%	0.332	45%	0.451	S	S	.	.			trans	-89.2	36	-176.2	-81.5	174.5	-143.3	0	0	111.4	S26 S30 R589	S26-E28 PolarHBondContact O-N 2.96Å; E28-S30 PolarHBondContact O-N 2.8Å; E28-R589 IonicContact OE1-CZ 2.79Å; E28-R589 IonicContact OE1-NE 3.2Å; E28-R589 IonicContact OE1-NH2 3.78Å; E28-R589 PolarHBondContact OE1-NH2 3.35Å; E28-R589 IonicContact OE2-CZ 3.95Å; E28-R589 IonicContact OE2-NE 3.12Å; E28-R589 PolarHBondContact OE2-NE 2.85Å; E28-R589 IonicContact OE2-NH2 2.65Å; E28-R589 PolarHBondContact OE2-NH2 3.14Å
29	T	46.4	Very low	62	Low	109 Å²	109	88.9 Å²	88.9	67%	0.669	46%	0.464	S	S	*	.	S	Bend	trans	-64.8	73	140.1	50.6	0	0	0	0	108	S27 K31	S27-T29 PolarHBondContact O-N 3.1Å; T29-K31 PolarHBondContact O-N 2.96Å
30	S	52.8	Low	64.9	Low	26 Å²	26	83.9 Å²	83.9	18%	0.182	44%	0.44	C	S	.	.			trans	37.1	68.9	172	64.5	0	0	0	0	115.1	E28 L32 S476	E28-S30 PolarHBondContact O-N 2.8Å; S30-L32 PolarHBondContact O-N 3.24Å; S30-S476 WeakPolarHBondContact OG-CB 3.46Å; S30-S476 PolarHBondContact OG-OG 2.96Å
31	K	60	Low	67.3	Low	142 Å²	142	80.9 Å²	80.9	62%	0.617	43%	0.433	S	S	*	.			trans	-67.6	97.4	168.3	-87.8	-178.9	161.2	169.8	0	109.8	S27 T29 N33	S27-K31 WeakPolarHBondContact OG-CD 3.36Å; S27-K31 WeakPolarHBondContact OG-CE 3.24Å; S27-K31 PolarHBondContact OG-NZ 3.22Å; T29-K31 PolarHBondContact O-N 2.96Å; K31-N33 PolarHBondContact O-N 3.22Å
32	L	73.2	Confident	69.5	Low	21 Å²	21	80.4 Å²	80.4	11%	0.11	43%	0.433	C	S	.	.			trans	-53.6	135.2	166.1	-66.6	174.9	0	0	0	109.4	S30 L34 P477 H478 N480 Q524 L525	S30-L32 PolarHBondContact O-N 3.24Å; L32-L34 HydrophobicContact CB-CD2 4.35Å; L32-L34 PolarHBondContact O-N 2.95Å; L32-P477 HydrophobicContact CD1-CB 4.06Å; L32-P477 WeakPolarHBondContact CD1-O 3.26Å; L32-H478 WeakPolarHBondContact CD2-O 3.39Å; L32-N480 HydrophobicContact CD1-CB 3.64Å; L32-Q524 WeakPolarHBondContact CA-O 3.32Å; L32-Q524 HydrophobicContact CB-CB 4.35Å; L32-Q524 HydrophobicContact CD2-CB 4.01Å; L32-L525 HydrophobicContact CD2-CD2 3.69Å; L32-L525 HydrophobicContact CD2-CG 4.42Å
33	N	78.6	Confident	71.2	Confident	63 Å²	63	77.8 Å²	77.8	34%	0.337	42%	0.423	S	S	.	.			trans	-76.9	96	176.1	-174.8	12.6	0	0	0	110.9	K31 S35 V36 Q524 T526	K31-N33 PolarHBondContact O-N 3.22Å; N33-S35 VanDerWaalsContact CG-OG 3.22Å; N33-S35 PolarHBondContact ND2-OG 3.32Å; N33-S35 VanDerWaalsContact ND2-OG 3.09Å; N33-S35 PolarHBondContact O-N 2.99Å; N33-S35 VanDerWaalsContact O-N 3.14Å; N33-S35 PolarHBondContact OD1-N 2.81Å; N33-S35 PolarHBondContact OD1-OG 2.87Å; N33-V36 HydrophobicContact CB-CG2 3.99Å; N33-V36 PolarHBondContact O-N 2.97Å; N33-V36 VanDerWaalsContact O-N 3.12Å; N33-Q524 PolarHBondContact N-O 3.04Å; N33-Q524 PolarHBondContact O-NE2 3.27Å; N33-T526 HydrophobicContact CB-CG2 3.71Å
34	L	78.4	Confident	72.6	Confident	106 Å²	106	81.5 Å²	81.5	56%	0.555	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.8	-179	-53.9	-177.2	0	0	0	113.9	L32 V36 N480	L32-L34 HydrophobicContact CB-CD2 4.35Å; L32-L34 PolarHBondContact O-N 2.95Å; L34-V36 VanDerWaalsContact C-N 3.3Å; L34-N480 HydrophobicContact CD2-CB 3.78Å; L34-N480 WeakPolarHBondContact CD2-O 3.3Å
35	S	79.3	Confident	74.3	Confident	91 Å²	91	75.3 Å²	75.3	64%	0.636	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.7	173.3	65.5	0	0	0	0	114.1	N33 T37	N33-S35 VanDerWaalsContact CG-OG 3.22Å; N33-S35 PolarHBondContact ND2-OG 3.32Å; N33-S35 VanDerWaalsContact ND2-OG 3.09Å; N33-S35 PolarHBondContact O-N 2.99Å; N33-S35 VanDerWaalsContact O-N 3.14Å; N33-S35 PolarHBondContact OD1-N 2.81Å; N33-S35 PolarHBondContact OD1-OG 2.87Å; S35-T37 PolarHBondContact O-N 2.84Å
36	V	83.1	Confident	76.5	Confident	35 Å²	35	73.8 Å²	73.8	21%	0.212	41%	0.411	C	S	.	.			trans	-78.5	107.5	176.8	-179.8	0	0	0	0	109.6	N33 L34 Y38 Q524	N33-V36 HydrophobicContact CB-CG2 3.99Å; N33-V36 PolarHBondContact O-N 2.97Å; N33-V36 VanDerWaalsContact O-N 3.12Å; L34-V36 VanDerWaalsContact C-N 3.3Å; V36-Y38 HydrophobicContact CG1-CD2 4.46Å; V36-Y38 HydrophobicContact CG1-CE1 4.19Å; V36-Y38 HydrophobicContact CG1-CE2 3.98Å; V36-Q524 HydrophobicContact CB-CG 3.88Å; V36-Q524 HydrophobicContact CG1-CG 4.28Å; V36-Q524 HydrophobicContact CG2-CG 4.44Å
37	T	83.1	Confident	78.9	Confident	131 Å²	131	74.9 Å²	74.9	80%	0.804	41%	0.41	S	S	*	.			trans	-79.1	158.9	165.2	51.1	0	0	0	0	110.9	S35	S35-T37 PolarHBondContact O-N 2.84Å
38	Y	87.8	Confident	81.4	Confident	58 Å²	58	75.5 Å²	75.5	23%	0.227	41%	0.413	C	S	.	.			trans	-135.7	137.2	172.1	-64.3	-85.6	0	0	0	109.4	V36 L40 I481 P520 G521 G523 Q524	V36-Y38 HydrophobicContact CG1-CD2 4.46Å; V36-Y38 HydrophobicContact CG1-CE1 4.19Å; V36-Y38 HydrophobicContact CG1-CE2 3.98Å; Y38-L40 PolarHBondContact O-N 3.2Å; Y38-I481 HydrophobicContact CD2-CG2 3.7Å; Y38-I481 HydrophobicContact CE2-CG2 3.73Å; Y38-P520 HydrophobicContact CD1-CB 4.03Å; Y38-P520 HydrophobicContact CD2-CB 3.74Å; Y38-P520 HydrophobicContact CD2-CG 3.66Å; Y38-P520 HydrophobicContact CE1-CB 4.4Å; Y38-P520 HydrophobicContact CE1-CG 4.49Å; Y38-P520 HydrophobicContact CE2-CB 4.1Å; Y38-P520 HydrophobicContact CE2-CG 3.59Å; Y38-P520 HydrophobicContact CG-CB 3.67Å; Y38-P520 HydrophobicContact CG-CG 4.11Å; Y38-G521 PolarHBondContact OH-O 2.92Å; Y38-G523 PolarHBondContact OH-N 3.41Å; Y38-G523 VanDerWaalsContact OH-N 3.12Å; Y38-Q524 HydrophobicContact CE2-CG 3.95Å; Y38-Q524 PolarHBondContact OH-N 3.35Å
39	E	88.5	Confident	83.7	Confident	198 Å²	198	72.8 Å²	72.8	93%	0.925	40%	0.4	S	S	*	.			trans	-77.4	120.3	169	-66.1	176.7	-178.8	0	0	108.6
40	L	91.8	Very high	85.9	Confident	34 Å²	34	70.3 Å²	70.3	18%	0.178	38%	0.381	C	S	.	.			trans	-128.5	147.9	-177.5	-67.3	176.3	0	0	0	109.3	Y38 T42 I481 T513 I515 P520	Y38-L40 PolarHBondContact O-N 3.2Å; L40-T42 PolarHBondContact O-N 2.82Å; L40-I481 HydrophobicContact CD1-CD1 3.94Å; L40-T513 HydrophobicContact CB-CG2 3.72Å; L40-T513 HydrophobicContact CD1-CG2 3.83Å; L40-T513 HydrophobicContact CG-CG2 4.45Å; L40-I515 HydrophobicContact CD1-CG1 4.31Å; L40-I515 HydrophobicContact CD1-CG2 4.32Å; L40-P520 HydrophobicContact CD1-CB 4.37Å; L40-P520 HydrophobicContact CD2-CB 3.97Å
41	P	93.1	Very high	87.9	Confident	74 Å²	74	70.9 Å²	70.9	48%	0.481	38%	0.382	S	S	.	.			trans	-63.5	131.6	176.4	-19.2	31.5	0	0	0	111.2	K514	P41-K514 HydrophobicContact CB-CB 4.27Å; P41-K514 PolarHBondContact O-N 3.17Å
42	T	94.8	Very high	89.6	Confident	71 Å²	71	64.5 Å²	64.5	44%	0.436	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.2	-176.7	53.3	0	0	0	0	112.6	L40 I512 T513	L40-T42 PolarHBondContact O-N 2.82Å; T42-I512 CarbonylContact C-O 3.58Å; T42-I512 WeakPolarHBondContact CA-O 3.13Å; T42-I512 WeakPolarHBondContact CB-O 3.45Å; T42-T513 HydrophobicContact CG2-CG2 3.98Å
43	F	95.8	Very high	90.5	Very high	25 Å²	25	64.8 Å²	64.8	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	148.1	164.6	168.2	-98.2	0	0	0	109.4	A45 Y68 L70 L74 K76 K511 I512	F43-A45 HydrophobicContact CE1-CB 4.02Å; F43-Y68 HydrophobicContact CE1-CD2 4.4Å; F43-Y68 HydrophobicContact CE1-CG 4.32Å; F43-Y68 AromaticContact CZ-CD1 3.96Å; F43-Y68 HydrophobicContact CZ-CD1 3.96Å; F43-Y68 HydrophobicContact CZ-CE1 4.22Å; F43-Y68 HydrophobicContact CZ-CG 4.11Å; F43-L70 HydrophobicContact CB-CD1 4.13Å; F43-L70 HydrophobicContact CD1-CD1 3.65Å; F43-L70 HydrophobicContact CD1-CD2 4.18Å; F43-L70 HydrophobicContact CD2-CD1 4.43Å; F43-L70 HydrophobicContact CD2-CD2 3.98Å; F43-L70 HydrophobicContact CE1-CD1 4.15Å; F43-L70 HydrophobicContact CE1-CD2 4.03Å; F43-L70 HydrophobicContact CE2-CD2 3.84Å; F43-L70 HydrophobicContact CG-CD1 3.8Å; F43-L70 HydrophobicContact CG-CD2 4.16Å; F43-L70 HydrophobicContact CZ-CD2 3.86Å; F43-L74 HydrophobicContact CB-CB 4.01Å; F43-L74 HydrophobicContact CB-CD1 4.38Å; F43-K76 HydrophobicContact CE2-CB 4.12Å; F43-K76 HydrophobicContact CE2-CD 4.49Å; F43-K511 CarbonylContact O-C 3.49Å; F43-K511 WeakPolarHBondContact O-CA 3.37Å; F43-I512 HydrophobicContact CD1-CD1 4.07Å; F43-I512 HydrophobicContact CD1-CG1 4.41Å; F43-I512 PolarHBondContact N-O 2.03Å; F43-I512 PolarHBondContact O-N 3.49Å
44	T	96.1	Very high	91	Very high	85 Å²	85	63.7 Å²	63.7	52%	0.521	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.2	176.7	-56.4	0	0	0	0	109.2
45	A	95.1	Very high	91.4	Very high	5 Å²	5	59.3 Å²	59.3	4%	0.041	33%	0.33	C	S	.	.			trans	-86.3	158	172.7	0	0	0	0	0	111.2	F43 F47 I49 Y68 S510	F43-A45 HydrophobicContact CE1-CB 4.02Å; A45-F47 WeakPolarHBondContact CB-O 3.49Å; A45-F47 PolarHBondContact O-N 2.62Å; A45-I49 HydrophobicContact CB-CD1 4.21Å; A45-I49 HydrophobicContact CB-CG1 4.14Å; A45-Y68 HydrophobicContact CB-CD2 4.35Å; A45-Y68 HydrophobicContact CB-CE2 3.48Å; A45-Y68 VanDerWaalsContact CB-CE2 3.48Å; A45-Y68 WeakPolarHBondContact CB-OH 3.44Å; A45-S510 WeakPolarHBondContact CB-O 3.48Å; A45-S510 PolarHBondContact N-O 3.37Å; A45-S510 VanDerWaalsContact O-CB 3.3Å; A45-S510 WeakPolarHBondContact O-CB 3.17Å; A45-S510 PolarHBondContact O-OG 2.87Å
46	D	94.6	Very high	91.6	Very high	101 Å²	101	60.1 Å²	60.1	54%	0.54	33%	0.327	S	S	.	.	S	Bend	trans	-63	-25.2	171.8	-58.5	-10.4	0	0	0	112.6	R66 Y68	D46-R66 IonicContact OD2-CZ 2.65Å; D46-R66 IonicContact OD2-NE 3.22Å; D46-R66 PolarHBondContact OD2-NE 2.83Å; D46-R66 IonicContact OD2-NH2 2.94Å; D46-R66 PolarHBondContact OD2-NH2 3.41Å; D46-Y68 PolarHBondContact N-OH 3.46Å
47	F	94.8	Very high	91.6	Very high	69 Å²	69	59.5 Å²	59.5	30%	0.303	33%	0.328	S	S	.	.	S	Bend	trans	-134.4	157.7	-168.6	-67.3	-74.3	0	0	0	111.7	A45 I49 A63 V64 N65 R66 S510	A45-F47 WeakPolarHBondContact CB-O 3.49Å; A45-F47 PolarHBondContact O-N 2.62Å; F47-I49 PolarHBondContact O-N 2.86Å; F47-A63 HydrophobicContact CB-CB 4.29Å; F47-V64 HydrophobicContact CB-CB 4.18Å; F47-V64 WeakPolarHBondContact CB-O 3.44Å; F47-V64 WeakPolarHBondContact CD2-O 3.46Å; F47-V64 VanDerWaalsContact CG-O 3.24Å; F47-V64 WeakPolarHBondContact CG-O 3.38Å; F47-N65 HydrophobicContact CD2-CB 4.25Å; F47-N65 HydrophobicContact CE2-CB 4.03Å; F47-N65 HydrophobicContact CZ-CB 4.2Å; F47-R66 HydrophobicContact CD2-CG 4.15Å; F47-R66 HydrophobicContact CE2-CG 4.27Å; F47-S510 WeakPolarHBondContact O-CB 3.09Å
48	P	94.8	Very high	91.8	Very high	70 Å²	70	55.1 Å²	55.1	46%	0.455	30%	0.3	S	S	.	.			trans	-57.3	136.1	176.5	-24.5	34.7	0	0	0	112.9	A63 V64	P48-A63 CarbonylContact O-C 3.57Å; P48-A63 VanDerWaalsContact O-CA 3.25Å; P48-A63 WeakPolarHBondContact O-CA 3.34Å; P48-A63 WeakPolarHBondContact O-CB 3.48Å; P48-V64 HydrophobicContact CB-CG2 4.32Å; P48-V64 PolarHBondContact O-N 2.87Å
49	I	95.7	Very high	92	Very high	14 Å²	14	52.4 Å²	52.4	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	138.1	-178.8	-64.3	169.7	0	0	0	109.5	A45 F47 M52 V61 A63 A507 G509 S510 I512	A45-I49 HydrophobicContact CB-CD1 4.21Å; A45-I49 HydrophobicContact CB-CG1 4.14Å; F47-I49 PolarHBondContact O-N 2.86Å; I49-M52 HydrophobicContact CG2-CG 4.06Å; I49-M52 HydrophobicContact CG2-SD 4.43Å; I49-V61 HydrophobicContact CB-CG1 4.44Å; I49-V61 HydrophobicContact CD1-CG1 3.9Å; I49-V61 HydrophobicContact CG1-CG1 3.9Å; I49-V61 HydrophobicContact CG2-CG1 3.72Å; I49-A63 HydrophobicContact CG1-CB 4.4Å; I49-A507 HydrophobicContact CB-CB 4.19Å; I49-A507 HydrophobicContact CG2-CB 3.86Å; I49-G509 PolarHBondContact N-O 2.82Å; I49-S510 WeakPolarHBondContact CD1-O 3.41Å; I49-I512 HydrophobicContact CD1-CD1 3.97Å; I49-I512 HydrophobicContact CD1-CG1 3.45Å; I49-I512 VanDerWaalsContact CD1-CG1 3.45Å
50	Q	93.2	Very high	92.3	Very high	57 Å²	57	43.3 Å²	43.3	27%	0.266	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-52.5	-174.4	-57.3	-170.9	-84.6	0	0	111.4	G62 H107 N108	Q50-G62 PolarHBondContact N-O 2.98Å; Q50-H107 PolarHBondContact NE2-ND1 2.85Å; Q50-H107 VanDerWaalsContact OE1-CB 3.32Å; Q50-N108 WeakPolarHBondContact CB-O 3.37Å
51	N	94.6	Very high	92.5	Very high	38 Å²	38	41.7 Å²	41.7	20%	0.203	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	152.5	177.4	-64.8	-66.9	0	0	0	112	G62 N108 I109 L111	N51-G62 PolarHBondContact N-O 2.68Å; N51-G62 VanDerWaalsContact N-O 3.16Å; N51-G62 PolarHBondContact O-N 2.73Å; N51-N108 WeakPolarHBondContact CB-OD1 3.48Å; N51-N108 PolarHBondContact ND2-O 2.79Å; N51-N108 VanDerWaalsContact ND2-O 3.16Å; N51-N108 PolarHBondContact ND2-OD1 3.23Å; N51-I109 PolarHBondContact ND2-O 2.92Å; N51-L111 HydrophobicContact CB-CB 3.83Å
52	M	94.7	Very high	92.6	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.039	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.2	171.5	-60.5	-178.3	-66.9	0	0	109.7	I49 Y60 V61 S491 V493 A507 I512	I49-M52 HydrophobicContact CG2-CG 4.06Å; I49-M52 HydrophobicContact CG2-SD 4.43Å; M52-Y60 CarbonylContact C-O 3.51Å; M52-Y60 VanDerWaalsContact CA-O 3.3Å; M52-Y60 WeakPolarHBondContact CA-O 3.02Å; M52-V61 HydrophobicContact CG-CG1 4.26Å; M52-V61 HydrophobicContact CG-CG2 4.32Å; M52-S491 VanDerWaalsContact CE-O 3.25Å; M52-S491 WeakPolarHBondContact CE-O 3.11Å; M52-S491 PolarHBondContact N-OG 2.86Å; M52-S491 PolarHBondContact O-OG 2.87Å; M52-V493 HydrophobicContact CB-CG2 3.59Å; M52-V493 WeakPolarHBondContact O-CG2 3.48Å; M52-A507 HydrophobicContact CE-CB 3.83Å; M52-A507 HydrophobicContact SD-CB 4.16Å; M52-I512 HydrophobicContact SD-CD1 3.69Å; M52-I512 HydrophobicContact SD-CG1 4Å; M52-I512 HydrophobicContact SD-CG2 4.37Å
53	V	92.5	Very high	92.6	Very high	28 Å²	28	34.8 Å²	34.8	17%	0.17	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.6	176	-61.7	0	0	0	0	110.4	Y60 L111 V113 L121	V53-Y60 PolarHBondContact N-O 3.25Å; V53-Y60 PolarHBondContact O-N 3.12Å; V53-L111 HydrophobicContact CG1-CB 4.46Å; V53-L111 HydrophobicContact CG1-CG 4.44Å; V53-L111 WeakPolarHBondContact CG1-O 3.19Å; V53-L111 HydrophobicContact CG2-CD2 3.81Å; V53-L111 HydrophobicContact CG2-CG 3.91Å; V53-V113 HydrophobicContact CB-CG2 4.15Å; V53-V113 HydrophobicContact CG2-CG2 3.65Å; V53-L121 HydrophobicContact CG2-CD1 3.92Å
54	T	89.9	Confident	92.5	Very high	40 Å²	40	34 Å²	34	25%	0.245	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.6	176.3	35.9	0	0	0	0	112.1	I58 I59 V493	T54-I58 VanDerWaalsContact CA-O 3.31Å; T54-I58 WeakPolarHBondContact CA-O 3.43Å; T54-I59 HydrophobicContact CG2-CB 4.26Å; T54-I59 HydrophobicContact CG2-CG1 3.71Å; T54-V493 HydrophobicContact CG2-CG1 3.59Å
55	L	86.9	Confident	92.4	Very high	13 Å²	13	30 Å²	30	7%	0.068	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	133	168.7	175.8	66	0	0	0	107.9	G57 I58 Y60 V113 N115 K119 L137	L55-G57 PolarHBondContact O-N 2.82Å; L55-I58 PolarHBondContact N-O 3.31Å; L55-I58 WeakPolarHBondContact O-CB 3.43Å; L55-I58 PolarHBondContact O-N 2.87Å; L55-Y60 HydrophobicContact CB-CE2 4.05Å; L55-V113 HydrophobicContact CB-CG1 4.06Å; L55-V113 HydrophobicContact CB-CG2 4.49Å; L55-V113 HydrophobicContact CD1-CG1 4Å; L55-V113 HydrophobicContact CD2-CG1 3.85Å; L55-V113 HydrophobicContact CG-CG1 4.17Å; L55-N115 HydrophobicContact CD1-CB 4.15Å; L55-K119 HydrophobicContact CD2-CB 4.42Å; L55-K119 HydrophobicContact CD2-CD 4.44Å; L55-L137 HydrophobicContact CD2-CD1 3.65Å
56	D	83.6	Confident	92.3	Very high	108 Å²	108	31.2 Å²	31.2	58%	0.578	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	34.6	176.1	-57.3	-15.1	0	0	0	114.2	I58 K119	D56-I58 VanDerWaalsContact C-N 3.25Å; D56-I58 PolarHBondContact O-N 2.81Å; D56-K119 WeakPolarHBondContact OD2-CE 3.17Å; D56-K119 IonicContact OD2-NZ 3.62Å; D56-K119 PolarHBondContact OD2-NZ 3.44Å
57	G	82.3	Confident	92.3	Very high	22 Å²	22	26.4 Å²	26.4	23%	0.227	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-8.7	-176.6	0	0	0	0	0	115.6	L55 P72	L55-G57 PolarHBondContact O-N 2.82Å; G57-P72 WeakPolarHBondContact O-CD 3.44Å; G57-P72 WeakPolarHBondContact O-CG 3.35Å
58	I	87.8	Confident	92.3	Very high	40 Å²	40	23.1 Å²	23.1	21%	0.205	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.6	173.2	-58.8	173	0	0	0	109.2	T54 L55 D56 Y60 A69 L77 A145	T54-I58 VanDerWaalsContact CA-O 3.31Å; T54-I58 WeakPolarHBondContact CA-O 3.43Å; L55-I58 PolarHBondContact N-O 3.31Å; L55-I58 WeakPolarHBondContact O-CB 3.43Å; L55-I58 PolarHBondContact O-N 2.87Å; D56-I58 VanDerWaalsContact C-N 3.25Å; D56-I58 PolarHBondContact O-N 2.81Å; I58-Y60 HydrophobicContact CB-CE2 3.74Å; I58-Y60 HydrophobicContact CG2-CD2 4.1Å; I58-Y60 HydrophobicContact CG2-CE1 4.09Å; I58-Y60 HydrophobicContact CG2-CE2 3.54Å; I58-A69 HydrophobicContact CG2-CB 3.91Å; I58-L77 HydrophobicContact CG1-CD1 4.35Å; I58-L77 HydrophobicContact CG2-CD1 4.35Å; I58-A145 HydrophobicContact CD1-CB 4.1Å; I58-A145 HydrophobicContact CG2-CB 4.45Å
59	I	91.9	Very high	92.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.9	179.5	-56.9	144.9	0	0	0	108.1	T54 V61 L70 L74 L505	T54-I59 HydrophobicContact CG2-CB 4.26Å; T54-I59 HydrophobicContact CG2-CG1 3.71Å; I59-V61 HydrophobicContact CG2-CG2 4.08Å; I59-L70 HydrophobicContact CB-CB 4.33Å; I59-L70 PolarHBondContact N-O 3.14Å; I59-L70 PolarHBondContact O-N 3.22Å; I59-L74 HydrophobicContact CD1-CD2 4.06Å; I59-L505 HydrophobicContact CD1-CD1 3.51Å; I59-L505 HydrophobicContact CG1-CD1 3.86Å; I59-L505 HydrophobicContact CG2-CD1 3.9Å
60	Y	93.6	Very high	92	Very high	8 Å²	8	19.1 Å²	19.1	3%	0.031	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.7	177.5	-61.4	-92.7	0	0	0	109.8	M52 V53 L55 I58 Y68 A69 L121 L137 A145 I146	M52-Y60 CarbonylContact C-O 3.51Å; M52-Y60 VanDerWaalsContact CA-O 3.3Å; M52-Y60 WeakPolarHBondContact CA-O 3.02Å; V53-Y60 PolarHBondContact N-O 3.25Å; V53-Y60 PolarHBondContact O-N 3.12Å; L55-Y60 HydrophobicContact CB-CE2 4.05Å; I58-Y60 HydrophobicContact CB-CE2 3.74Å; I58-Y60 HydrophobicContact CG2-CD2 4.1Å; I58-Y60 HydrophobicContact CG2-CE1 4.09Å; I58-Y60 HydrophobicContact CG2-CE2 3.54Å; Y60-Y68 CarbonylContact C-O 3.55Å; Y60-Y68 WeakPolarHBondContact CA-O 3.29Å; Y60-A69 HydrophobicContact CD1-CB 4.11Å; Y60-A69 HydrophobicContact CE1-CB 4.03Å; Y60-L121 HydrophobicContact CD1-CD2 3.67Å; Y60-L121 HydrophobicContact CE1-CD2 4.33Å; Y60-L121 HydrophobicContact CG-CD1 4.35Å; Y60-L121 HydrophobicContact CG-CD2 4.11Å; Y60-L137 HydrophobicContact CE1-CD2 4.23Å; Y60-A145 WeakPolarHBondContact CE1-O 3.44Å; Y60-A145 PolarHBondContact OH-O 3.4Å; Y60-I146 HydrophobicContact CD1-CD1 4.25Å; Y60-I146 HydrophobicContact CD1-CG1 4.05Å; Y60-I146 HydrophobicContact CE1-CG1 3.86Å
61	V	95.9	Very high	91.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	108.5	-170.1	-178.4	0	0	0	0	109.2	I49 M52 I59 I67 Y68 L70 I512	I49-V61 HydrophobicContact CB-CG1 4.44Å; I49-V61 HydrophobicContact CD1-CG1 3.9Å; I49-V61 HydrophobicContact CG1-CG1 3.9Å; I49-V61 HydrophobicContact CG2-CG1 3.72Å; M52-V61 HydrophobicContact CG-CG1 4.26Å; M52-V61 HydrophobicContact CG-CG2 4.32Å; I59-V61 HydrophobicContact CG2-CG2 4.08Å; V61-I67 CarbonylContact O-C 3.58Å; V61-I67 VanDerWaalsContact O-CA 3.3Å; V61-I67 WeakPolarHBondContact O-CA 3.41Å; V61-Y68 HydrophobicContact CB-CD2 4.37Å; V61-Y68 HydrophobicContact CG1-CD2 4.36Å; V61-Y68 PolarHBondContact N-O 3.05Å; V61-Y68 PolarHBondContact O-N 2.83Å; V61-L70 HydrophobicContact CG2-CD1 3.84Å; V61-L70 HydrophobicContact CG2-CG 4.11Å; V61-I512 HydrophobicContact CB-CD1 4.46Å; V61-I512 HydrophobicContact CG1-CD1 3.98Å; V61-I512 HydrophobicContact CG2-CD1 3.59Å
62	G	95.4	Very high	91.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.2	172.7	0	0	0	0	0	110.9	Q50 N51	Q50-G62 PolarHBondContact N-O 2.98Å; N51-G62 PolarHBondContact N-O 2.68Å; N51-G62 VanDerWaalsContact N-O 3.16Å; N51-G62 PolarHBondContact O-N 2.73Å
63	A	95.6	Very high	91.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	176.2	172	0	0	0	0	0	110.4	F47 P48 I49 N65 R66 Y68	F47-A63 HydrophobicContact CB-CB 4.29Å; P48-A63 CarbonylContact O-C 3.57Å; P48-A63 VanDerWaalsContact O-CA 3.25Å; P48-A63 WeakPolarHBondContact O-CA 3.34Å; P48-A63 WeakPolarHBondContact O-CB 3.48Å; I49-A63 HydrophobicContact CG1-CB 4.4Å; A63-N65 PolarHBondContact O-N 3.44Å; A63-R66 CarbonylContact C-O 3.59Å; A63-R66 PolarHBondContact N-O 2.99Å; A63-R66 VanDerWaalsContact O-O 3.13Å; A63-Y68 HydrophobicContact CB-CE2 3.96Å
64	V	94.2	Very high	91.1	Very high	8 Å²	8	21.2 Å²	21.2	5%	0.048	12%	0.123	C	C	.	.	S	Bend	trans	-61.4	134.4	164.5	-166.3	0	0	0	0	108.6	F47 P48 R66 D105 H107	F47-V64 HydrophobicContact CB-CB 4.18Å; F47-V64 WeakPolarHBondContact CB-O 3.44Å; F47-V64 WeakPolarHBondContact CD2-O 3.46Å; F47-V64 VanDerWaalsContact CG-O 3.24Å; F47-V64 WeakPolarHBondContact CG-O 3.38Å; P48-V64 HydrophobicContact CB-CG2 4.32Å; P48-V64 PolarHBondContact O-N 2.87Å; V64-R66 PolarHBondContact O-N 3.36Å; V64-D105 HydrophobicContact CG1-CB 3.92Å; V64-H107 WeakPolarHBondContact CG2-ND1 3.49Å
65	N	93.3	Very high	91.2	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.011	13%	0.133	C	C	.	.	S	Bend	trans	60.1	-6.8	176.9	-64.8	-29.5	0	0	0	118.1	F47 A63 T82 G83 P84 D105 N106	F47-N65 HydrophobicContact CD2-CB 4.25Å; F47-N65 HydrophobicContact CE2-CB 4.03Å; F47-N65 HydrophobicContact CZ-CB 4.2Å; A63-N65 PolarHBondContact O-N 3.44Å; N65-T82 WeakPolarHBondContact CA-OG1 3.41Å; N65-T82 PolarHBondContact O-N 3.14Å; N65-T82 PolarHBondContact O-OG1 2.99Å; N65-G83 VanDerWaalsContact CG-C 3.49Å; N65-G83 PolarHBondContact O-N 2.93Å; N65-G83 VanDerWaalsContact OD1-C 3.32Å; N65-G83 WeakPolarHBondContact OD1-CA 3.43Å; N65-P84 WeakPolarHBondContact OD1-CA 3.46Å; N65-D105 PolarHBondContact ND2-OD1 3.34Å; N65-D105 WeakPolarHBondContact OD1-CA 3.4Å; N65-N106 PolarHBondContact N-O 3.48Å; N65-N106 PolarHBondContact OD1-N 3.18Å
66	R	93.9	Very high	91.5	Very high	29 Å²	29	27.2 Å²	27.2	11%	0.109	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152	179.9	-70.6	-178.5	178.9	-98.2	39	113.2	D46 F47 A63 V64 Y68 E79 Y80 H81 T82	D46-R66 IonicContact OD2-CZ 2.65Å; D46-R66 IonicContact OD2-NE 3.22Å; D46-R66 PolarHBondContact OD2-NE 2.83Å; D46-R66 IonicContact OD2-NH2 2.94Å; D46-R66 PolarHBondContact OD2-NH2 3.41Å; F47-R66 HydrophobicContact CD2-CG 4.15Å; F47-R66 HydrophobicContact CE2-CG 4.27Å; A63-R66 CarbonylContact C-O 3.59Å; A63-R66 PolarHBondContact N-O 2.99Å; A63-R66 VanDerWaalsContact O-O 3.13Å; V64-R66 PolarHBondContact O-N 3.36Å; R66-Y68 HydrophobicContact CB-CE2 3.99Å; R66-Y68 WeakPolarHBondContact CD-OH 3.08Å; R66-E79 IonicContact CZ-OE1 3.36Å; R66-E79 VanDerWaalsContact CZ-OE1 3.28Å; R66-E79 IonicContact NH1-OE1 2.7Å; R66-E79 PolarHBondContact NH1-OE1 2.73Å; R66-E79 IonicContact NH1-OE2 3.89Å; R66-E79 IonicContact NH2-OE1 3.19Å; R66-E79 PolarHBondContact NH2-OE1 3.39Å; R66-E79 VanDerWaalsContact NH2-OE1 3.1Å; R66-Y80 CarbonylContact C-O 3.57Å; R66-Y80 VanDerWaalsContact CA-O 3.28Å; R66-Y80 WeakPolarHBondContact CA-O 3.37Å; R66-H81 PolarHBondContact NH1-CE1 3.32Å; R66-H81 PolarHBondContact NH1-NE2 3.04Å; R66-H81 VanDerWaalsContact NH1-NE2 3.11Å; R66-T82 PolarHBondContact N-OG1 3.47Å
67	I	94.7	Very high	91.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.9	161.5	-59.6	166.9	0	0	0	107.9	V61 E79 Y80 T82 L111 L121 I146	V61-I67 CarbonylContact O-C 3.58Å; V61-I67 VanDerWaalsContact O-CA 3.3Å; V61-I67 WeakPolarHBondContact O-CA 3.41Å; I67-E79 CarbonylContact O-C 3.59Å; I67-E79 VanDerWaalsContact O-CA 3.29Å; I67-E79 WeakPolarHBondContact O-CA 3.39Å; I67-Y80 PolarHBondContact N-O 2.96Å; I67-Y80 PolarHBondContact O-N 3.27Å; I67-T82 HydrophobicContact CD1-CG2 3.65Å; I67-T82 HydrophobicContact CG1-CG2 3.75Å; I67-L111 HydrophobicContact CD1-CD1 4.43Å; I67-L121 HydrophobicContact CG2-CD2 4.27Å; I67-I146 HydrophobicContact CB-CD1 4.42Å; I67-I146 HydrophobicContact CG2-CD1 3.78Å
68	Y	94.2	Very high	92.2	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.6	174.6	-48.6	-94.5	0	0	0	110.3	F43 A45 D46 Y60 V61 A63 R66 K76 E79	F43-Y68 HydrophobicContact CE1-CD2 4.4Å; F43-Y68 HydrophobicContact CE1-CG 4.32Å; F43-Y68 AromaticContact CZ-CD1 3.96Å; F43-Y68 HydrophobicContact CZ-CD1 3.96Å; F43-Y68 HydrophobicContact CZ-CE1 4.22Å; F43-Y68 HydrophobicContact CZ-CG 4.11Å; A45-Y68 HydrophobicContact CB-CD2 4.35Å; A45-Y68 HydrophobicContact CB-CE2 3.48Å; A45-Y68 VanDerWaalsContact CB-CE2 3.48Å; A45-Y68 WeakPolarHBondContact CB-OH 3.44Å; D46-Y68 PolarHBondContact N-OH 3.46Å; Y60-Y68 CarbonylContact C-O 3.55Å; Y60-Y68 WeakPolarHBondContact CA-O 3.29Å; V61-Y68 HydrophobicContact CB-CD2 4.37Å; V61-Y68 HydrophobicContact CG1-CD2 4.36Å; V61-Y68 PolarHBondContact N-O 3.05Å; V61-Y68 PolarHBondContact O-N 2.83Å; A63-Y68 HydrophobicContact CB-CE2 3.96Å; R66-Y68 HydrophobicContact CB-CE2 3.99Å; R66-Y68 WeakPolarHBondContact CD-OH 3.08Å; Y68-K76 HydrophobicContact CD1-CD 3.9Å; Y68-K76 HydrophobicContact CE1-CD 4.49Å; Y68-E79 HydrophobicContact CD1-CB 3.82Å; Y68-E79 HydrophobicContact CE1-CB 4.3Å
69	A	92.5	Very high	92.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.9	162.6	0	0	0	0	0	109.3	I58 Y60 L77 S78 A145 I146	I58-A69 HydrophobicContact CG2-CB 3.91Å; Y60-A69 HydrophobicContact CD1-CB 4.11Å; Y60-A69 HydrophobicContact CE1-CB 4.03Å; A69-L77 HydrophobicContact CB-CB 4.5Å; A69-L77 PolarHBondContact O-N 3.12Å; A69-S78 PolarHBondContact N-O 3.08Å; A69-S78 PolarHBondContact O-N 2.95Å; A69-A145 HydrophobicContact CB-CB 3.65Å; A69-I146 HydrophobicContact CB-CD1 3.87Å; A69-I146 HydrophobicContact CB-CG1 3.9Å
70	L	92.1	Very high	92.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.6	179.6	-45.3	-179.7	0	0	0	110.3	F43 I59 V61 L74 T75 K76 I512	F43-L70 HydrophobicContact CB-CD1 4.13Å; F43-L70 HydrophobicContact CD1-CD1 3.65Å; F43-L70 HydrophobicContact CD1-CD2 4.18Å; F43-L70 HydrophobicContact CD2-CD1 4.43Å; F43-L70 HydrophobicContact CD2-CD2 3.98Å; F43-L70 HydrophobicContact CE1-CD1 4.15Å; F43-L70 HydrophobicContact CE1-CD2 4.03Å; F43-L70 HydrophobicContact CE2-CD2 3.84Å; F43-L70 HydrophobicContact CG-CD1 3.8Å; F43-L70 HydrophobicContact CG-CD2 4.16Å; F43-L70 HydrophobicContact CZ-CD2 3.86Å; I59-L70 HydrophobicContact CB-CB 4.33Å; I59-L70 PolarHBondContact N-O 3.14Å; I59-L70 PolarHBondContact O-N 3.22Å; V61-L70 HydrophobicContact CG2-CD1 3.84Å; V61-L70 HydrophobicContact CG2-CG 4.11Å; L70-L74 HydrophobicContact CD1-CD2 4.14Å; L70-T75 WeakPolarHBondContact CA-O 3.49Å; L70-K76 HydrophobicContact CD2-CB 3.98Å; L70-K76 HydrophobicContact CD2-CG 4.31Å; L70-I512 HydrophobicContact CD1-CD1 3.83Å
71	A	89.1	Confident	92.3	Very high	15 Å²	15	34.7 Å²	34.7	12%	0.124	18%	0.177	C	C	.	.			trans	-73.9	164.9	168.9	0	0	0	0	0	111.6	N73 L74 T75 L77	A71-N73 VanDerWaalsContact CB-OD1 3.27Å; A71-N73 WeakPolarHBondContact CB-OD1 3.4Å; A71-N73 PolarHBondContact O-N 3.03Å; A71-N73 PolarHBondContact O-OD1 3.19Å; A71-L74 WeakPolarHBondContact O-CA 3.05Å; A71-L74 PolarHBondContact O-N 2.94Å; A71-T75 PolarHBondContact N-O 3.06Å; A71-L77 HydrophobicContact CB-CD1 4.11Å; A71-L77 HydrophobicContact CB-CD2 4.11Å; A71-L77 HydrophobicContact CB-CG 4.12Å
72	P	86.8	Confident	92	Very high	59 Å²	59	35 Å²	35	38%	0.383	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-17.5	-178.8	-28.9	33.3	0	0	0	116.8	G57 K514	G57-P72 WeakPolarHBondContact O-CD 3.44Å; G57-P72 WeakPolarHBondContact O-CG 3.35Å; P72-K514 PolarHBondContact O-NZ 2.96Å
73	N	87.8	Confident	91.6	Very high	92 Å²	92	35.7 Å²	35.7	49%	0.492	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	2.2	176	64.4	-8.6	0	0	0	113.7	A71 T75	A71-N73 VanDerWaalsContact CB-OD1 3.27Å; A71-N73 WeakPolarHBondContact CB-OD1 3.4Å; A71-N73 PolarHBondContact O-N 3.03Å; A71-N73 PolarHBondContact O-OD1 3.19Å; N73-T75 WeakPolarHBondContact ND2-CG2 3.02Å; N73-T75 PolarHBondContact ND2-OG1 3.41Å; N73-T75 PolarHBondContact OD1-N 3.01Å; N73-T75 PolarHBondContact OD1-OG1 3.21Å
74	L	91.9	Very high	91.3	Very high	9 Å²	9	38.9 Å²	38.9	5%	0.047	21%	0.207	C	C	.	.	S	Bend	trans	69	15.6	-171.3	-54.3	-175.3	0	0	0	116.6	F43 I59 L70 A71 L505 I512 K514	F43-L74 HydrophobicContact CB-CB 4.01Å; F43-L74 HydrophobicContact CB-CD1 4.38Å; I59-L74 HydrophobicContact CD1-CD2 4.06Å; L70-L74 HydrophobicContact CD1-CD2 4.14Å; A71-L74 WeakPolarHBondContact O-CA 3.05Å; A71-L74 PolarHBondContact O-N 2.94Å; L74-L505 HydrophobicContact CD2-CD1 4.14Å; L74-L505 HydrophobicContact CD2-CD2 4.08Å; L74-I512 HydrophobicContact CD1-CG2 4.13Å; L74-I512 HydrophobicContact CD2-CG2 4.31Å; L74-K514 HydrophobicContact CD1-CB 3.9Å; L74-K514 HydrophobicContact CG-CB 4.43Å
75	T	92.3	Very high	90.8	Very high	75 Å²	75	39.4 Å²	39.4	46%	0.46	21%	0.21	S	C	.	.			trans	-76.5	130.9	169	57.8	0	0	0	0	111	L70 A71 N73 L77	L70-T75 WeakPolarHBondContact CA-O 3.49Å; A71-T75 PolarHBondContact N-O 3.06Å; N73-T75 WeakPolarHBondContact ND2-CG2 3.02Å; N73-T75 PolarHBondContact ND2-OG1 3.41Å; N73-T75 PolarHBondContact OD1-N 3.01Å; N73-T75 PolarHBondContact OD1-OG1 3.21Å; T75-L77 PolarHBondContact O-N 3.44Å
76	K	92.9	Very high	90.2	Very high	103 Å²	103	42.4 Å²	42.4	45%	0.448	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	125.8	176.4	-174.8	174.6	68.1	178.8	0	111.2	F43 Y68 L70 E79	F43-K76 HydrophobicContact CE2-CB 4.12Å; F43-K76 HydrophobicContact CE2-CD 4.49Å; Y68-K76 HydrophobicContact CD1-CD 3.9Å; Y68-K76 HydrophobicContact CE1-CD 4.49Å; L70-K76 HydrophobicContact CD2-CB 3.98Å; L70-K76 HydrophobicContact CD2-CG 4.31Å; K76-E79 HydrophobicContact CD-CB 4.42Å; K76-E79 WeakPolarHBondContact CD-OE2 3.09Å; K76-E79 WeakPolarHBondContact CE-OE2 3.5Å; K76-E79 IonicContact NZ-OE2 2.84Å; K76-E79 PolarHBondContact NZ-OE2 3.19Å
77	L	90.5	Very high	89.1	Confident	85 Å²	85	44.6 Å²	44.6	45%	0.445	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-52.3	174.8	-63.5	174	0	0	0	110.6	I58 A69 A71 T75 A145	I58-L77 HydrophobicContact CG1-CD1 4.35Å; I58-L77 HydrophobicContact CG2-CD1 4.35Å; A69-L77 HydrophobicContact CB-CB 4.5Å; A69-L77 PolarHBondContact O-N 3.12Å; A71-L77 HydrophobicContact CB-CD1 4.11Å; A71-L77 HydrophobicContact CB-CD2 4.11Å; A71-L77 HydrophobicContact CB-CG 4.12Å; T75-L77 PolarHBondContact O-N 3.44Å; L77-A145 HydrophobicContact CB-CB 4.11Å; L77-A145 HydrophobicContact CD1-CB 4.13Å
78	S	90.6	Very high	87.9	Confident	14 Å²	14	51.2 Å²	51.2	10%	0.098	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	166.9	177.8	59.6	0	0	0	0	111.4	A69 A145 I146	A69-S78 PolarHBondContact N-O 3.08Å; A69-S78 PolarHBondContact O-N 2.95Å; S78-A145 PolarHBondContact OG-N 3.31Å; S78-I146 PolarHBondContact OG-N 2.73Å; S78-I146 VanDerWaalsContact OG-N 3.16Å
79	E	91.8	Very high	87	Confident	64 Å²	64	55.3 Å²	55.3	30%	0.299	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.5	171.4	64.1	-172.4	-147.4	0	0	110.6	R66 I67 Y68 K76	R66-E79 IonicContact CZ-OE1 3.36Å; R66-E79 VanDerWaalsContact CZ-OE1 3.28Å; R66-E79 IonicContact NH1-OE1 2.7Å; R66-E79 PolarHBondContact NH1-OE1 2.73Å; R66-E79 IonicContact NH1-OE2 3.89Å; R66-E79 IonicContact NH2-OE1 3.19Å; R66-E79 PolarHBondContact NH2-OE1 3.39Å; R66-E79 VanDerWaalsContact NH2-OE1 3.1Å; I67-E79 CarbonylContact O-C 3.59Å; I67-E79 VanDerWaalsContact O-CA 3.29Å; I67-E79 WeakPolarHBondContact O-CA 3.39Å; Y68-E79 HydrophobicContact CD1-CB 3.82Å; Y68-E79 HydrophobicContact CE1-CB 4.3Å; K76-E79 HydrophobicContact CD-CB 4.42Å; K76-E79 WeakPolarHBondContact CD-OE2 3.09Å; K76-E79 WeakPolarHBondContact CE-OE2 3.5Å; K76-E79 IonicContact NZ-OE2 2.84Å; K76-E79 PolarHBondContact NZ-OE2 3.19Å
80	Y	91.1	Very high	86.4	Confident	56 Å²	56	56 Å²	56	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.9	177.3	-178.7	-85.4	0	0	0	109.8	R66 I67 T82 H135 I146 V150	R66-Y80 CarbonylContact C-O 3.57Å; R66-Y80 VanDerWaalsContact CA-O 3.28Å; R66-Y80 WeakPolarHBondContact CA-O 3.37Å; I67-Y80 PolarHBondContact N-O 2.96Å; I67-Y80 PolarHBondContact O-N 3.27Å; Y80-T82 HydrophobicContact CD1-CG2 3.91Å; Y80-T82 HydrophobicContact CE1-CG2 4.15Å; Y80-H135 AromaticContact CD1-CE1 3.66Å; Y80-H135 AromaticContact CE1-CE1 3.85Å; Y80-I146 HydrophobicContact CG-CG2 4.43Å; Y80-V150 HydrophobicContact CD2-CG2 4Å; Y80-V150 HydrophobicContact CE1-CG1 4.26Å; Y80-V150 HydrophobicContact CE2-CB 3.92Å; Y80-V150 HydrophobicContact CE2-CG1 4.29Å; Y80-V150 HydrophobicContact CE2-CG2 3.49Å; Y80-V150 VanDerWaalsContact CE2-CG2 3.49Å
81	H	91.5	Very high	85.6	Confident	116 Å²	116	56.9 Å²	56.9	54%	0.537	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113.4	-178.9	-68.8	-104.8	0	0	0	111.2	R66	R66-H81 PolarHBondContact NH1-CE1 3.32Å; R66-H81 PolarHBondContact NH1-NE2 3.04Å; R66-H81 VanDerWaalsContact NH1-NE2 3.11Å
82	T	89.6	Confident	84.3	Confident	8 Å²	8	56.6 Å²	56.6	5%	0.049	31%	0.309	C	S	.	.			trans	-96.6	-6.9	176.3	58.8	0	0	0	0	113.8	N65 R66 I67 Y80 L85 N106	N65-T82 WeakPolarHBondContact CA-OG1 3.41Å; N65-T82 PolarHBondContact O-N 3.14Å; N65-T82 PolarHBondContact O-OG1 2.99Å; R66-T82 PolarHBondContact N-OG1 3.47Å; I67-T82 HydrophobicContact CD1-CG2 3.65Å; I67-T82 HydrophobicContact CG1-CG2 3.75Å; Y80-T82 HydrophobicContact CD1-CG2 3.91Å; Y80-T82 HydrophobicContact CE1-CG2 4.15Å; T82-L85 WeakPolarHBondContact O-CD2 3.2Å; T82-L85 WeakPolarHBondContact O-CG 3.37Å; T82-N106 VanDerWaalsContact O-CB 3.28Å; T82-N106 WeakPolarHBondContact O-CB 3.49Å; T82-N106 PolarHBondContact O-ND2 2.89Å
83	G	87.3	Confident	83.2	Confident	14 Å²	14	57.6 Å²	57.6	14%	0.144	31%	0.311	C	S	.	.			trans	-179.6	-168	178	0	0	0	0	0	113.2	N65	N65-G83 VanDerWaalsContact CG-C 3.49Å; N65-G83 PolarHBondContact O-N 2.93Å; N65-G83 VanDerWaalsContact OD1-C 3.32Å; N65-G83 WeakPolarHBondContact OD1-CA 3.43Å
84	P	89.1	Confident	81.4	Confident	67 Å²	67	56.4 Å²	56.4	44%	0.435	31%	0.307	S	S	.	.	S	Bend	cis	-66.4	139.1	-4.8	28.1	-34.6	0	0	0	111.1	N65 V104	N65-P84 WeakPolarHBondContact OD1-CA 3.46Å; P84-V104 CarbonylContact C-O 3.5Å; P84-V104 VanDerWaalsContact CA-O 3.3Å; P84-V104 WeakPolarHBondContact CA-O 3.49Å
85	L	83.7	Confident	79.2	Confident	18 Å²	18	64.1 Å²	64.1	9%	0.094	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-92.1	136.4	-173.4	-65	-179.2	0	0	0	111.8	T82 Q89 G103 V104 N106 A127 D128	T82-L85 WeakPolarHBondContact O-CD2 3.2Å; T82-L85 WeakPolarHBondContact O-CG 3.37Å; L85-Q89 HydrophobicContact CD2-CB 4.11Å; L85-G103 CarbonylContact O-C 3.6Å; L85-G103 WeakPolarHBondContact O-CA 3.39Å; L85-V104 PolarHBondContact N-O 3.24Å; L85-V104 PolarHBondContact O-N 3.09Å; L85-N106 HydrophobicContact CD1-CB 4.43Å; L85-N106 WeakPolarHBondContact CD1-ND2 3.4Å; L85-N106 HydrophobicContact CG-CB 4.4Å; L85-A127 HydrophobicContact CB-CB 4.31Å; L85-A127 HydrophobicContact CD1-CB 4.07Å; L85-A127 HydrophobicContact CG-CB 4.49Å; L85-D128 WeakPolarHBondContact CD1-OD1 3.42Å
86	L	81.5	Confident	76.9	Confident	65 Å²	65	66.2 Å²	66.2	34%	0.34	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-79.7	152.3	161.2	-62.4	171.9	0	0	0	109.3	H88 Q89	L86-H88 PolarHBondContact O-N 2.92Å; L86-Q89 HydrophobicContact CB-CG 4.32Å; L86-Q89 WeakPolarHBondContact O-CB 3.49Å; L86-Q89 PolarHBondContact O-N 2.8Å
87	A	70.4	Confident	74.4	Confident	75 Å²	75	68.1 Å²	68.1	62%	0.62	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-51.1	-39.2	-176.4	0	0	0	0	0	113.5	Q89 A90 L93	A87-Q89 PolarHBondContact O-N 2.85Å; A87-Q89 VanDerWaalsContact O-N 3.14Å; A87-A90 PolarHBondContact O-N 2.78Å; A87-L93 VanDerWaalsContact O-CD2 3.28Å; A87-L93 WeakPolarHBondContact O-CD2 3.31Å; A87-L93 WeakPolarHBondContact O-CG 3.37Å
88	H	70.4	Confident	72.4	Confident	139 Å²	139	71.5 Å²	71.5	64%	0.644	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-70	-4.8	179.3	73.6	-98.4	0	0	0	115	L86	L86-H88 PolarHBondContact O-N 2.92Å
89	Q	75.3	Confident	70.1	Confident	88 Å²	88	74 Å²	74	41%	0.411	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-110	-10.3	-178.8	-55	173.2	-45.9	0	0	112.7	L85 L86 A87 R133	L85-Q89 HydrophobicContact CD2-CB 4.11Å; L86-Q89 HydrophobicContact CB-CG 4.32Å; L86-Q89 WeakPolarHBondContact O-CB 3.49Å; L86-Q89 PolarHBondContact O-N 2.8Å; A87-Q89 PolarHBondContact O-N 2.85Å; A87-Q89 VanDerWaalsContact O-N 3.14Å; Q89-R133 PolarHBondContact O-NH2 3Å
90	A	78.5	Confident	68	Low	15 Å²	15	74.2 Å²	74.2	12%	0.124	45%	0.449	C	S	.	.			trans	-74.6	138.2	178.7	0	0	0	0	0	111.4	A87 G92 A127	A87-A90 PolarHBondContact O-N 2.78Å; A90-G92 VanDerWaalsContact C-N 3.31Å; A90-G92 PolarHBondContact O-N 2.9Å; A90-A127 VanDerWaalsContact CB-O 3.24Å; A90-A127 WeakPolarHBondContact CB-O 3.15Å
91	C	76.1	Confident	66.4	Low	17 Å²	17	76.5 Å²	76.5	12%	0.115	48%	0.479	C	S	.	.	S	Bend	trans	-70.5	-19.9	-175.6	-68.9	0	0	0	0	115.2	D128 V131 C152	C91-D128 HydrophobicContact CB-CB 4.23Å; C91-D128 PolarHBondContact N-OD1 2.97Å; C91-D128 VanDerWaalsContact N-OD1 3.08Å; C91-V131 HydrophobicContact CB-CB 3.88Å; C91-V131 HydrophobicContact CB-CG1 3.77Å; C91-C152 WeakPolarHBondContact CA-SG 3.19Å; C91-C152 HydrophobicContact CB-CB 3.62Å; C91-C152 WeakPolarHBondContact CB-SG 3.37Å; C91-C152 VanDerWaalsContact SG-CA 3.54Å; C91-C152 WeakPolarHBondContact SG-CB 3.26Å; C91-C152 CovalentContact SG-SG 2.04Å; C91-C152 PolarHBondContact SG-SG 2.89Å
92	G	61.8	Low	65.2	Low	9 Å²	9	75.6 Å²	75.6	9%	0.093	49%	0.485	C	S	.	.	S	Bend	trans	-113.3	53.2	-175.2	0	0	0	0	0	114.2	A90 D128 N129	A90-G92 VanDerWaalsContact C-N 3.31Å; A90-G92 PolarHBondContact O-N 2.9Å; G92-D128 PolarHBondContact N-O 2.86Å; G92-N129 PolarHBondContact O-ND2 2.88Å
93	L	62.7	Low	64.6	Low	80 Å²	80	76.9 Å²	76.9	42%	0.419	50%	0.5	S	S	.	.			trans	-68.7	129.2	-171	-102.7	163.8	0	0	0	115.5	A87	A87-L93 VanDerWaalsContact O-CD2 3.28Å; A87-L93 WeakPolarHBondContact O-CD2 3.31Å; A87-L93 WeakPolarHBondContact O-CG 3.37Å
94	T	50.6	Low	64.5	Low	67 Å²	67	80.5 Å²	80.5	41%	0.411	52%	0.519	S	S	.	.			trans	-118.2	129.5	158.5	48	0	0	0	0	109.7	T96	T94-T96 PolarHBondContact O-N 3.3Å; T94-T96 VanDerWaalsContact O-N 3.09Å
95	Q	45.2	Very low	64.6	Low	171 Å²	171	81.2 Å²	81.2	80%	0.799	52%	0.52	S	S	*	.			trans	-84.4	77.7	-173.1	-71.7	-168.1	1.7	0	0	113.8
96	T	44	Very low	64.9	Low	119 Å²	119	80.5 Å²	80.5	73%	0.73	52%	0.516	S	S	*	.			trans	-152.3	93.1	162.7	41.8	0	0	0	0	113.1	T94	T94-T96 PolarHBondContact O-N 3.3Å; T94-T96 VanDerWaalsContact O-N 3.09Å
97	T	41.7	Very low	65.4	Low	144 Å²	144	81.1 Å²	81.1	88%	0.883	52%	0.517	S	S	*	.			trans	-177.6	124.9	133.2	16.5	0	0	0	0	111	G99	T97-G99 PolarHBondContact O-N 2.92Å
98	T	46.8	Very low	66.5	Low	155 Å²	155	77.9 Å²	77.9	95%	0.951	49%	0.489	S	S	*	.			trans	-93.3	88.4	169.1	48.8	0	0	0	0	109.7
99	G	43.3	Very low	67.6	Low	66 Å²	66	72.5 Å²	72.5	68%	0.68	47%	0.465	S	S	*	.			trans	-175.6	141.1	174.7	0	0	0	0	0	114.2	T97	T97-G99 PolarHBondContact O-N 2.92Å
100	G	47.3	Very low	68.4	Low	70 Å²	70	68.7 Å²	68.7	72%	0.722	45%	0.448	S	S	*	.			trans	54.1	84.7	162.5	0	0	0	0	0	117.1	S102	G100-S102 VanDerWaalsContact C-N 3.33Å; G100-S102 PolarHBondContact O-N 2.82Å
101	A	57.8	Low	69.2	Low	104 Å²	104	68.6 Å²	68.6	86%	0.86	45%	0.446	S	S	*	.			trans	-76.1	76	176.5	0	0	0	0	0	113.3
102	S	65.8	Low	69.9	Low	96 Å²	96	68.3 Å²	68.3	67%	0.671	44%	0.444	S	S	*	.			trans	-104.9	128.4	160.2	53.9	0	0	0	0	109.5	G100	G100-S102 VanDerWaalsContact C-N 3.33Å; G100-S102 PolarHBondContact O-N 2.82Å
103	G	77.6	Confident	71.2	Confident	35 Å²	35	69 Å²	69	36%	0.361	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-65.8	148.3	174.8	0	0	0	0	0	112	L85	L85-G103 CarbonylContact O-C 3.6Å; L85-G103 WeakPolarHBondContact O-CA 3.39Å
104	V	85.7	Confident	72.3	Confident	90 Å²	90	65.1 Å²	65.1	55%	0.545	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-99.6	131.7	178.5	-179	0	0	0	0	109.5	P84 L85 N106 A127	P84-V104 CarbonylContact C-O 3.5Å; P84-V104 VanDerWaalsContact CA-O 3.3Å; P84-V104 WeakPolarHBondContact CA-O 3.49Å; L85-V104 PolarHBondContact N-O 3.24Å; L85-V104 PolarHBondContact O-N 3.09Å; V104-N106 PolarHBondContact O-N 3.29Å; V104-A127 HydrophobicContact CB-CB 4.45Å; V104-A127 HydrophobicContact CG1-CB 4.28Å
105	D	90.3	Very high	73.8	Confident	82 Å²	82	66.3 Å²	66.3	44%	0.439	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-61.6	128	176.6	-75.7	-28.5	0	0	0	111.2	V64 N65 H107 S126	V64-D105 HydrophobicContact CG1-CB 3.92Å; N65-D105 PolarHBondContact ND2-OD1 3.34Å; N65-D105 WeakPolarHBondContact OD1-CA 3.4Å; D105-H107 PolarHBondContact O-N 2.83Å; D105-S126 PolarHBondContact O-OG 2.85Å
106	N	90.7	Very high	75.2	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	41%	0.409	C	S	.	.			trans	-95.4	99.4	179.9	-160.5	7.2	0	0	0	110.2	N65 T82 L85 V104 G125 S126 A127 D128	N65-N106 PolarHBondContact N-O 3.48Å; N65-N106 PolarHBondContact OD1-N 3.18Å; T82-N106 VanDerWaalsContact O-CB 3.28Å; T82-N106 WeakPolarHBondContact O-CB 3.49Å; T82-N106 PolarHBondContact O-ND2 2.89Å; L85-N106 HydrophobicContact CD1-CB 4.43Å; L85-N106 WeakPolarHBondContact CD1-ND2 3.4Å; L85-N106 HydrophobicContact CG-CB 4.4Å; V104-N106 PolarHBondContact O-N 3.29Å; N106-G125 VanDerWaalsContact OD1-C 3.31Å; N106-G125 WeakPolarHBondContact OD1-CA 3.31Å; N106-S126 PolarHBondContact OD1-N 2.87Å; N106-A127 HydrophobicContact CB-CB 3.9Å; N106-A127 PolarHBondContact OD1-N 2.93Å; N106-D128 PolarHBondContact ND2-OD2 3.45Å
107	H	92.3	Very high	76.6	Confident	77 Å²	77	61.8 Å²	61.8	36%	0.356	40%	0.397	S	S	.	.			trans	-75.5	128.5	173	-64.4	-82.4	0	0	0	109.9	Q50 V64 D105 I109 G125 S126	Q50-H107 PolarHBondContact NE2-ND1 2.85Å; Q50-H107 VanDerWaalsContact OE1-CB 3.32Å; V64-H107 WeakPolarHBondContact CG2-ND1 3.49Å; D105-H107 PolarHBondContact O-N 2.83Å; H107-I109 PolarHBondContact O-N 2.9Å; H107-I109 VanDerWaalsContact O-N 3.15Å; H107-G125 CarbonylContact O-C 3.58Å; H107-G125 WeakPolarHBondContact O-CA 3.47Å; H107-S126 WeakPolarHBondContact CB-OG 3.39Å; H107-S126 PolarHBondContact N-OG 3.08Å; H107-S126 PolarHBondContact O-N 3.41Å
108	N	93.4	Very high	78.3	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.043	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	103.6	171.1	177.9	-101.2	0	0	0	109.4	Q50 N51 A110	Q50-N108 WeakPolarHBondContact CB-O 3.37Å; N51-N108 WeakPolarHBondContact CB-OD1 3.48Å; N51-N108 PolarHBondContact ND2-O 2.79Å; N51-N108 VanDerWaalsContact ND2-O 3.16Å; N51-N108 PolarHBondContact ND2-OD1 3.23Å; N108-A110 PolarHBondContact ND2-O 2.72Å
109	I	92.2	Very high	80	Confident	25 Å²	25	52.3 Å²	52.3	13%	0.128	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-43.6	179.9	-62.7	161.1	0	0	0	110.3	N51 H107 C124 V171	N51-I109 PolarHBondContact ND2-O 2.92Å; H107-I109 PolarHBondContact O-N 2.9Å; H107-I109 VanDerWaalsContact O-N 3.15Å; I109-C124 PolarHBondContact N-O 2.95Å; I109-V171 HydrophobicContact CB-CB 4.36Å; I109-V171 HydrophobicContact CB-CG2 4.08Å; I109-V171 HydrophobicContact CD1-CB 4.5Å; I109-V171 HydrophobicContact CD1-CG2 3.78Å; I109-V171 HydrophobicContact CG2-CB 3.93Å; I109-V171 HydrophobicContact CG2-CG1 4.36Å; I109-V171 HydrophobicContact CG2-CG2 4.2Å
110	A	93.3	Very high	82	Confident	8 Å²	8	49.1 Å²	49.1	7%	0.066	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.8	175.5	0	0	0	0	0	111.3	N108 C124 V171 V178	N108-A110 PolarHBondContact ND2-O 2.72Å; A110-C124 HydrophobicContact CB-CB 4.2Å; A110-C124 PolarHBondContact N-O 2.99Å; A110-C124 PolarHBondContact O-N 2.87Å; A110-V171 HydrophobicContact CB-CG1 3.99Å; A110-V178 HydrophobicContact CB-CG2 4.1Å
111	L	93.9	Very high	84.1	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.068	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	118.5	172.5	-168.2	65.6	0	0	0	106.9	N51 V53 I67 L121 Y122	N51-L111 HydrophobicContact CB-CB 3.83Å; V53-L111 HydrophobicContact CG1-CB 4.46Å; V53-L111 HydrophobicContact CG1-CG 4.44Å; V53-L111 WeakPolarHBondContact CG1-O 3.19Å; V53-L111 HydrophobicContact CG2-CD2 3.81Å; V53-L111 HydrophobicContact CG2-CG 3.91Å; I67-L111 HydrophobicContact CD1-CD1 4.43Å; L111-L121 HydrophobicContact CD1-CD1 3.79Å; L111-L121 HydrophobicContact CD1-CD2 4.12Å; L111-L121 HydrophobicContact CD1-CG 3.91Å; L111-L121 HydrophobicContact CG-CD1 3.98Å; L111-Y122 WeakPolarHBondContact CA-O 3.33Å
112	V	91.9	Very high	85.7	Confident	12 Å²	12	41 Å²	41	7%	0.073	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.8	-172	-175.6	0	0	0	0	109.3	Y122 V178	V112-Y122 PolarHBondContact N-O 3.31Å; V112-Y122 PolarHBondContact O-N 2.83Å; V112-V178 HydrophobicContact CG2-CB 3.93Å; V112-V178 HydrophobicContact CG2-CG1 3.85Å
113	V	89.6	Confident	87	Confident	22 Å²	22	36.7 Å²	36.7	13%	0.133	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.2	176.8	175.6	0	0	0	0	109.6	V53 L55 L121 N180	V53-V113 HydrophobicContact CB-CG2 4.15Å; V53-V113 HydrophobicContact CG2-CG2 3.65Å; L55-V113 HydrophobicContact CB-CG1 4.06Å; L55-V113 HydrophobicContact CB-CG2 4.49Å; L55-V113 HydrophobicContact CD1-CG1 4Å; L55-V113 HydrophobicContact CD2-CG1 3.85Å; L55-V113 HydrophobicContact CG-CG1 4.17Å; V113-L121 HydrophobicContact CG2-CD1 3.89Å; V113-N180 PolarHBondContact O-ND2 2.94Å
114	E	85.4	Confident	87.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.6	167.5	-160.3	-92.7	112.7	0	0	109	I116 Y117 K119 G120 Y122 I186 F188 M216	E114-I116 WeakPolarHBondContact OE1-CA 3.42Å; E114-I116 PolarHBondContact OE1-N 2.79Å; E114-Y117 PolarHBondContact OE1-N 2.86Å; E114-K119 WeakPolarHBondContact O-CA 3.45Å; E114-G120 PolarHBondContact N-O 3.26Å; E114-G120 PolarHBondContact O-N 2.89Å; E114-Y122 HydrophobicContact CB-CD2 4.39Å; E114-Y122 HydrophobicContact CB-CE2 3.7Å; E114-I186 HydrophobicContact CG-CD1 3.83Å; E114-I186 VanDerWaalsContact OE1-CD1 3.28Å; E114-I186 WeakPolarHBondContact OE1-CD1 3.32Å; E114-F188 HydrophobicContact CG-CZ 4.42Å; E114-M216 WeakPolarHBondContact OE2-CE 3.37Å
115	N	81.4	Confident	87.8	Confident	91 Å²	91	31.1 Å²	31.1	49%	0.487	16%	0.155	S	C	.	.			trans	-151.9	15.2	-167.2	67.8	-29	0	0	0	114	L55	L55-N115 HydrophobicContact CD1-CB 4.15Å
116	I	74.4	Confident	87.6	Confident	72 Å²	72	28.4 Å²	28.4	37%	0.369	14%	0.143	S	C	.	.	S	Bend	trans	-104.1	-37.8	-176.9	-65.8	155.7	0	0	0	110.5	E114 E182 I186	E114-I116 WeakPolarHBondContact OE1-CA 3.42Å; E114-I116 PolarHBondContact OE1-N 2.79Å; I116-E182 HydrophobicContact CD1-CB 4.02Å; I116-E182 HydrophobicContact CD1-CG 4.04Å; I116-I186 HydrophobicContact CB-CD1 3.74Å; I116-I186 HydrophobicContact CD1-CD1 3.97Å; I116-I186 HydrophobicContact CD1-CG1 4.2Å; I116-I186 HydrophobicContact CG1-CD1 4.46Å; I116-I186 HydrophobicContact CG2-CD1 4.04Å; I116-I186 HydrophobicContact CG2-CG1 4.44Å
117	Y	73.8	Confident	87.2	Confident	123 Å²	123	28.9 Å²	28.9	48%	0.482	15%	0.147	S	C	.	.	S	Bend	trans	-88.3	-61.5	171.1	-63.8	-52.9	0	0	0	111.6	E114 I186 M216	E114-Y117 PolarHBondContact OE1-N 2.86Å; Y117-I186 HydrophobicContact CD2-CD1 3.44Å; Y117-I186 VanDerWaalsContact CD2-CD1 3.44Å; Y117-I186 HydrophobicContact CD2-CG1 4.35Å; Y117-I186 HydrophobicContact CE2-CB 4.16Å; Y117-I186 HydrophobicContact CE2-CD1 3.3Å; Y117-I186 HydrophobicContact CE2-CG1 3.71Å; Y117-I186 HydrophobicContact CG-CD1 4.2Å; Y117-M216 HydrophobicContact CD2-CE 3.97Å; Y117-M216 HydrophobicContact CD2-SD 4.46Å; Y117-M216 HydrophobicContact CE2-CE 4.43Å
118	D	77.1	Confident	86.7	Confident	46 Å²	46	25.2 Å²	25.2	25%	0.246	13%	0.13	C	C	.	.	S	Bend	trans	-157.7	147.2	175.8	60	-71.9	0	0	0	108.8	G120 R134 Q220	D118-G120 PolarHBondContact O-N 3.44Å; D118-R134 IonicContact OD1-CZ 2.69Å; D118-R134 IonicContact OD1-NH1 3.04Å; D118-R134 IonicContact OD1-NH2 2.7Å; D118-R134 PolarHBondContact OD1-NH2 2.88Å; D118-R134 IonicContact OD2-CZ 3.24Å; D118-R134 IonicContact OD2-NH1 3.59Å; D118-R134 PolarHBondContact OD2-NH1 3.47Å; D118-R134 IonicContact OD2-NH2 2.92Å; D118-R134 PolarHBondContact OD2-NH2 2.91Å; D118-Q220 PolarHBondContact OD1-NE2 3.22Å; D118-Q220 PolarHBondContact OD1-OE1 3.18Å
119	K	82.9	Confident	85.9	Confident	54 Å²	54	28.8 Å²	28.8	24%	0.235	15%	0.149	C	C	.	.			trans	-66.9	108.2	-170.3	-67.2	-178.3	-176.8	176.9	0	110.7	L55 D56 E114 L137 D139	L55-K119 HydrophobicContact CD2-CB 4.42Å; L55-K119 HydrophobicContact CD2-CD 4.44Å; D56-K119 WeakPolarHBondContact OD2-CE 3.17Å; D56-K119 IonicContact OD2-NZ 3.62Å; D56-K119 PolarHBondContact OD2-NZ 3.44Å; E114-K119 WeakPolarHBondContact O-CA 3.45Å; K119-L137 HydrophobicContact CB-CB 3.98Å; K119-L137 HydrophobicContact CB-CD1 4.47Å; K119-L137 WeakPolarHBondContact O-CB 3.3Å; K119-L137 PolarHBondContact O-N 3.46Å; K119-D139 WeakPolarHBondContact CD-OD1 3.47Å; K119-D139 WeakPolarHBondContact CE-OD1 3.41Å; K119-D139 IonicContact NZ-OD1 3.57Å; K119-D139 PolarHBondContact NZ-OD1 2.85Å
120	G	86.2	Confident	85.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.6	-173.8	0	0	0	0	0	112.4	E114 D118 Y122	E114-G120 PolarHBondContact N-O 3.26Å; E114-G120 PolarHBondContact O-N 2.89Å; D118-G120 PolarHBondContact O-N 3.44Å; G120-Y122 WeakPolarHBondContact O-CD2 3.36Å
121	L	90.9	Very high	85	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.1	167.8	-174.6	70.8	0	0	0	108.8	V53 Y60 I67 L111 V113 H135 L137	V53-L121 HydrophobicContact CG2-CD1 3.92Å; Y60-L121 HydrophobicContact CD1-CD2 3.67Å; Y60-L121 HydrophobicContact CE1-CD2 4.33Å; Y60-L121 HydrophobicContact CG-CD1 4.35Å; Y60-L121 HydrophobicContact CG-CD2 4.11Å; I67-L121 HydrophobicContact CG2-CD2 4.27Å; L111-L121 HydrophobicContact CD1-CD1 3.79Å; L111-L121 HydrophobicContact CD1-CD2 4.12Å; L111-L121 HydrophobicContact CD1-CG 3.91Å; L111-L121 HydrophobicContact CG-CD1 3.98Å; V113-L121 HydrophobicContact CG2-CD1 3.89Å; L121-H135 HydrophobicContact CB-CB 4.27Å; L121-H135 PolarHBondContact N-O 3.45Å; L121-H135 PolarHBondContact O-CD2 3.48Å; L121-H135 PolarHBondContact O-N 2.94Å; L121-L137 HydrophobicContact CB-CD1 4.27Å; L121-L137 HydrophobicContact CB-CD2 4.35Å
122	Y	91.7	Very high	84.8	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.016	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.9	179.5	-62.8	-98.7	0	0	0	109.1	L111 V112 E114 G120 R133 R134 F153 M216	L111-Y122 WeakPolarHBondContact CA-O 3.33Å; V112-Y122 PolarHBondContact N-O 3.31Å; V112-Y122 PolarHBondContact O-N 2.83Å; E114-Y122 HydrophobicContact CB-CD2 4.39Å; E114-Y122 HydrophobicContact CB-CE2 3.7Å; G120-Y122 WeakPolarHBondContact O-CD2 3.36Å; Y122-R133 WeakPolarHBondContact CA-O 3.39Å; Y122-R134 HydrophobicContact CD1-CB 4.25Å; Y122-R134 HydrophobicContact CD1-CG 4.27Å; Y122-R134 HydrophobicContact CE1-CB 4.06Å; Y122-R134 HydrophobicContact CE1-CG 3.76Å; Y122-R134 PolarHBondContact OH-NE 3.18Å; Y122-R134 PolarHBondContact OH-NH2 2.97Å; Y122-F153 HydrophobicContact CE1-CD1 4.27Å; Y122-F153 HydrophobicContact CE1-CD2 4.07Å; Y122-F153 HydrophobicContact CE1-CE1 4.1Å; Y122-F153 AromaticContact CE1-CE2 3.89Å; Y122-F153 HydrophobicContact CE1-CE2 3.89Å; Y122-F153 HydrophobicContact CE1-CG 4.25Å; Y122-F153 AromaticContact CE1-CZ 3.91Å; Y122-F153 HydrophobicContact CE1-CZ 3.91Å; Y122-M216 WeakPolarHBondContact OH-CE 3Å
123	S	93	Very high	84.7	Confident	5 Å²	5	27 Å²	27	4%	0.035	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117	177.9	69.4	0	0	0	0	110.2	C132 R133 H135	S123-C132 WeakPolarHBondContact O-CA 3.3Å; S123-R133 PolarHBondContact N-O 3.33Å; S123-R133 PolarHBondContact O-N 3.32Å; S123-H135 PolarHBondContact OG-NE2 3.37Å
124	C	91.4	Very high	84.7	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.02	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.9	-178.2	-44.9	0	0	0	0	109.6	I109 A110 C132 V171	I109-C124 PolarHBondContact N-O 2.95Å; A110-C124 HydrophobicContact CB-CB 4.2Å; A110-C124 PolarHBondContact N-O 2.99Å; A110-C124 PolarHBondContact O-N 2.87Å; C124-C132 HydrophobicContact CB-CB 3.99Å; C124-C132 WeakPolarHBondContact CB-SG 3.48Å; C124-C132 WeakPolarHBondContact SG-CB 3.45Å; C124-C132 CovalentContact SG-SG 2.04Å; C124-C132 PolarHBondContact SG-SG 3.38Å; C124-V171 HydrophobicContact CB-CB 4.24Å; C124-V171 HydrophobicContact CB-CG1 3.57Å; C124-V171 HydrophobicContact CB-CG2 3.57Å
125	G	87.6	Confident	84.9	Confident	4 Å²	4	26.1 Å²	26.1	4%	0.041	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	152.5	-166.4	0	0	0	0	0	114.5	N106 H107 D128	N106-G125 VanDerWaalsContact OD1-C 3.31Å; N106-G125 WeakPolarHBondContact OD1-CA 3.31Å; H107-G125 CarbonylContact O-C 3.58Å; H107-G125 WeakPolarHBondContact O-CA 3.47Å; G125-D128 PolarHBondContact O-N 3.45Å
126	S	85.6	Confident	85	Confident	26 Å²	26	23.9 Å²	23.9	18%	0.182	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-68	-37.4	175	62.8	0	0	0	0	113.2	D105 N106 H107 D128	D105-S126 PolarHBondContact O-OG 2.85Å; N106-S126 PolarHBondContact OD1-N 2.87Å; H107-S126 WeakPolarHBondContact CB-OG 3.39Å; H107-S126 PolarHBondContact N-OG 3.08Å; H107-S126 PolarHBondContact O-N 3.41Å; S126-D128 PolarHBondContact O-N 3.45Å
127	A	84.3	Confident	85.4	Confident	13 Å²	13	21.2 Å²	21.2	11%	0.107	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-80.4	-4.1	-179	0	0	0	0	0	112.8	L85 A90 V104 N106	L85-A127 HydrophobicContact CB-CB 4.31Å; L85-A127 HydrophobicContact CD1-CB 4.07Å; L85-A127 HydrophobicContact CG-CB 4.49Å; A90-A127 VanDerWaalsContact CB-O 3.24Å; A90-A127 WeakPolarHBondContact CB-O 3.15Å; V104-A127 HydrophobicContact CB-CB 4.45Å; V104-A127 HydrophobicContact CG1-CB 4.28Å; N106-A127 HydrophobicContact CB-CB 3.9Å; N106-A127 PolarHBondContact OD1-N 2.93Å
128	D	81	Confident	85.3	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-97.7	12.2	179.6	-67.5	-64.2	0	0	0	113.6	L85 C91 G92 N106 G125 S126 G130 V131 R133	L85-D128 WeakPolarHBondContact CD1-OD1 3.42Å; C91-D128 HydrophobicContact CB-CB 4.23Å; C91-D128 PolarHBondContact N-OD1 2.97Å; C91-D128 VanDerWaalsContact N-OD1 3.08Å; G92-D128 PolarHBondContact N-O 2.86Å; N106-D128 PolarHBondContact ND2-OD2 3.45Å; G125-D128 PolarHBondContact O-N 3.45Å; S126-D128 PolarHBondContact O-N 3.45Å; D128-G130 PolarHBondContact O-N 2.87Å; D128-V131 WeakPolarHBondContact CB-O 3.05Å; D128-V131 PolarHBondContact O-N 3.16Å; D128-V131 VanDerWaalsContact O-N 3.15Å; D128-R133 IonicContact OD1-CZ 4Å; D128-R133 IonicContact OD1-NH1 3.19Å; D128-R133 PolarHBondContact OD1-NH1 2.94Å; D128-R133 IonicContact OD1-NH2 2.75Å; D128-R133 PolarHBondContact OD1-NH2 3.48Å; D128-R133 IonicContact OD2-CZ 2.74Å; D128-R133 IonicContact OD2-NH1 2.92Å; D128-R133 PolarHBondContact OD2-NH1 3.05Å; D128-R133 IonicContact OD2-NH2 2.76Å
129	N	75.9	Confident	84.6	Confident	83 Å²	83	23 Å²	23	44%	0.444	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.6	-178.4	-61.8	-25.2	0	0	0	113.1	G92	G92-N129 PolarHBondContact O-ND2 2.88Å
130	G	79.2	Confident	83.4	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.01	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	88	-8.4	177.3	0	0	0	0	0	115.8	D128 V170 V171	D128-G130 PolarHBondContact O-N 2.87Å; G130-V170 PolarHBondContact O-N 3.33Å; G130-V171 WeakPolarHBondContact CA-O 3.41Å; G130-V171 PolarHBondContact O-N 2.92Å; G130-V171 VanDerWaalsContact O-N 3.11Å
131	V	87.3	Confident	81.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-76.5	139.2	175.3	-177.5	0	0	0	0	110.1	C91 D128 A154 P164 V169	C91-V131 HydrophobicContact CB-CB 3.88Å; C91-V131 HydrophobicContact CB-CG1 3.77Å; D128-V131 WeakPolarHBondContact CB-O 3.05Å; D128-V131 PolarHBondContact O-N 3.16Å; D128-V131 VanDerWaalsContact O-N 3.15Å; V131-A154 HydrophobicContact CG1-CB 4.02Å; V131-P164 HydrophobicContact CG2-CB 4.44Å; V131-P164 HydrophobicContact CG2-CG 4.34Å; V131-V169 HydrophobicContact CG2-CG2 4.3Å
132	C	90.6	Very high	80.1	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	151	177.8	-51.6	0	0	0	0	112	S123 C124 F153 V170	S123-C132 WeakPolarHBondContact O-CA 3.3Å; C124-C132 HydrophobicContact CB-CB 3.99Å; C124-C132 WeakPolarHBondContact CB-SG 3.48Å; C124-C132 WeakPolarHBondContact SG-CB 3.45Å; C124-C132 CovalentContact SG-SG 2.04Å; C124-C132 PolarHBondContact SG-SG 3.38Å; C132-F153 VanDerWaalsContact O-CB 3.32Å; C132-F153 WeakPolarHBondContact O-CB 3.39Å; C132-F153 PolarHBondContact O-N 2.86Å; C132-V170 VanDerWaalsContact SG-CG2 3.59Å
133	R	89.8	Confident	78.5	Confident	18 Å²	18	42.3 Å²	42.3	7%	0.068	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.4	158.1	-70.7	-172.9	-172.7	70.4	11.5	109.8	Q89 Y122 S123 D128 V150 Y151	Q89-R133 PolarHBondContact O-NH2 3Å; Y122-R133 WeakPolarHBondContact CA-O 3.39Å; S123-R133 PolarHBondContact N-O 3.33Å; S123-R133 PolarHBondContact O-N 3.32Å; D128-R133 IonicContact OD1-CZ 4Å; D128-R133 IonicContact OD1-NH1 3.19Å; D128-R133 PolarHBondContact OD1-NH1 2.94Å; D128-R133 IonicContact OD1-NH2 2.75Å; D128-R133 PolarHBondContact OD1-NH2 3.48Å; D128-R133 IonicContact OD2-CZ 2.74Å; D128-R133 IonicContact OD2-NH1 2.92Å; D128-R133 PolarHBondContact OD2-NH1 3.05Å; D128-R133 IonicContact OD2-NH2 2.76Å; R133-V150 HydrophobicContact CB-CG1 4.02Å; R133-V150 HydrophobicContact CG-CG1 4.48Å; R133-Y151 CarbonylContact C-O 3.59Å; R133-Y151 VanDerWaalsContact CA-O 3.29Å; R133-Y151 WeakPolarHBondContact CA-O 3.46Å
134	R	89.4	Confident	77	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.011	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134	164.8	-170.7	-168.6	-147.5	-157.1	-1	108.2	D118 Y122 V150 Y151 F153	D118-R134 IonicContact OD1-CZ 2.69Å; D118-R134 IonicContact OD1-NH1 3.04Å; D118-R134 IonicContact OD1-NH2 2.7Å; D118-R134 PolarHBondContact OD1-NH2 2.88Å; D118-R134 IonicContact OD2-CZ 3.24Å; D118-R134 IonicContact OD2-NH1 3.59Å; D118-R134 PolarHBondContact OD2-NH1 3.47Å; D118-R134 IonicContact OD2-NH2 2.92Å; D118-R134 PolarHBondContact OD2-NH2 2.91Å; Y122-R134 HydrophobicContact CD1-CB 4.25Å; Y122-R134 HydrophobicContact CD1-CG 4.27Å; Y122-R134 HydrophobicContact CE1-CB 4.06Å; Y122-R134 HydrophobicContact CE1-CG 3.76Å; Y122-R134 PolarHBondContact OH-NE 3.18Å; Y122-R134 PolarHBondContact OH-NH2 2.97Å; R134-V150 WeakPolarHBondContact O-CA 3.35Å; R134-Y151 HydrophobicContact CB-CE1 4.34Å; R134-Y151 WeakPolarHBondContact CD-OH 3.47Å; R134-Y151 PolarHBondContact N-O 2.03Å; R134-Y151 PolarHBondContact NH1-OH 3.41Å; R134-Y151 VanDerWaalsContact NH1-OH 3.15Å; R134-Y151 PolarHBondContact O-N 2.89Å; R134-F153 HydrophobicContact CB-CD2 3.73Å; R134-F153 HydrophobicContact CB-CE2 4.36Å; R134-F153 HydrophobicContact CB-CG 4.45Å; R134-F153 HydrophobicContact CG-CD2 4.35Å
135	H	88.9	Confident	75.9	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.4	166.4	-48.4	-117.2	0	0	0	106	Y80 L121 S123 V150	Y80-H135 AromaticContact CD1-CE1 3.66Å; Y80-H135 AromaticContact CE1-CE1 3.85Å; L121-H135 HydrophobicContact CB-CB 4.27Å; L121-H135 PolarHBondContact N-O 3.45Å; L121-H135 PolarHBondContact O-CD2 3.48Å; L121-H135 PolarHBondContact O-N 2.94Å; S123-H135 PolarHBondContact OG-NE2 3.37Å; H135-V150 HydrophobicContact CB-CG2 4.06Å; H135-V150 VanDerWaalsContact ND1-CG2 3.3Å; H135-V150 WeakPolarHBondContact ND1-CG2 3.05Å
136	V	84.3	Confident	75.2	Confident	43 Å²	43	47.1 Å²	47.1	26%	0.261	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	141.3	172.8	-175.4	0	0	0	0	108.3	D149 Y151	V136-D149 PolarHBondContact N-O 3.1Å; V136-Y151 HydrophobicContact CG2-CE1 4.21Å
137	L	83.4	Confident	74.2	Confident	16 Å²	16	48.1 Å²	48.1	8%	0.084	28%	0.278	C	S	.	.			trans	-114.9	123.4	179.2	-53.5	177	0	0	0	109.4	L55 Y60 K119 L121	L55-L137 HydrophobicContact CD2-CD1 3.65Å; Y60-L137 HydrophobicContact CE1-CD2 4.23Å; K119-L137 HydrophobicContact CB-CB 3.98Å; K119-L137 HydrophobicContact CB-CD1 4.47Å; K119-L137 WeakPolarHBondContact O-CB 3.3Å; K119-L137 PolarHBondContact O-N 3.46Å; L121-L137 HydrophobicContact CB-CD1 4.27Å; L121-L137 HydrophobicContact CB-CD2 4.35Å
138	D	70.7	Confident	73.2	Confident	81 Å²	81	54.4 Å²	54.4	43%	0.433	31%	0.305	S	S	.	.			trans	-71.2	146.2	177.3	173.7	51.8	0	0	0	112.2	G140 N141 S142	D138-G140 VanDerWaalsContact C-N 3.28Å; D138-G140 PolarHBondContact O-N 3.47Å; D138-G140 PolarHBondContact OD2-N 2.03Å; D138-N141 WeakPolarHBondContact OD2-CA 3.41Å; D138-N141 PolarHBondContact OD2-N 2.87Å; D138-S142 WeakPolarHBondContact OD2-CB 3.31Å; D138-S142 PolarHBondContact OD2-N 3.13Å
139	D	62.5	Low	73	Confident	125 Å²	125	59.8 Å²	59.8	67%	0.668	33%	0.334	S	S	*	.	S	Bend	trans	-86.8	13.2	-172	-114.2	-32.7	0	0	0	114.3	K119	K119-D139 WeakPolarHBondContact CD-OD1 3.47Å; K119-D139 WeakPolarHBondContact CE-OD1 3.41Å; K119-D139 IonicContact NZ-OD1 3.57Å; K119-D139 PolarHBondContact NZ-OD1 2.85Å
140	G	57	Low	73.4	Confident	70 Å²	70	57.1 Å²	57.1	72%	0.722	32%	0.32	S	S	*	.	S	Bend	trans	134	26.8	159	0	0	0	0	0	117.8	D138	D138-G140 VanDerWaalsContact C-N 3.28Å; D138-G140 PolarHBondContact O-N 3.47Å; D138-G140 PolarHBondContact OD2-N 2.03Å
141	N	51.3	Low	73.6	Confident	159 Å²	159	59.9 Å²	59.9	85%	0.85	33%	0.331	S	S	*	.			trans	-118.9	-15.6	178.8	-149	29.7	0	0	0	113.7	D138	D138-N141 WeakPolarHBondContact OD2-CA 3.41Å; D138-N141 PolarHBondContact OD2-N 2.87Å
142	S	58.1	Low	73.6	Confident	54 Å²	54	61.8 Å²	61.8	38%	0.378	34%	0.344	S	S	.	.			trans	-79.8	143.2	174.7	-172.9	0	0	0	0	113	D138 K144	D138-S142 WeakPolarHBondContact OD2-CB 3.31Å; D138-S142 PolarHBondContact OD2-N 3.13Å; S142-K144 PolarHBondContact O-N 2.83Å; S142-K144 PolarHBondContact OG-N 2.86Å; S142-K144 VanDerWaalsContact OG-N 3.17Å; S142-K144 PolarHBondContact OG-O 2.83Å
143	L	56.5	Low	73.4	Confident	181 Å²	181	61.7 Å²	61.7	95%	0.948	34%	0.343	S	S	*	.	S	Bend	trans	-75.4	-7.3	169.6	-76.6	165.5	0	0	0	113.1
144	K	61.6	Low	73.1	Confident	87 Å²	87	61.3 Å²	61.3	38%	0.378	34%	0.344	S	S	.	.			trans	-108.9	125.3	177.9	-61.9	177.7	179.6	170.6	0	110.3	S142 I146 E148	S142-K144 PolarHBondContact O-N 2.83Å; S142-K144 PolarHBondContact OG-N 2.86Å; S142-K144 VanDerWaalsContact OG-N 3.17Å; S142-K144 PolarHBondContact OG-O 2.83Å; K144-I146 WeakPolarHBondContact CB-O 3.49Å; K144-I146 PolarHBondContact O-N 3.01Å; K144-E148 VanDerWaalsContact NZ-CD 3.26Å; K144-E148 IonicContact NZ-OE1 2.86Å; K144-E148 PolarHBondContact NZ-OE1 3.43Å
145	A	68.4	Low	72.2	Confident	20 Å²	20	64.7 Å²	64.7	17%	0.165	36%	0.362	C	S	.	.	S	Bend	trans	-77.9	-2.6	173.6	0	0	0	0	0	114	I58 Y60 A69 L77 S78	I58-A145 HydrophobicContact CD1-CB 4.1Å; I58-A145 HydrophobicContact CG2-CB 4.45Å; Y60-A145 WeakPolarHBondContact CE1-O 3.44Å; Y60-A145 PolarHBondContact OH-O 3.4Å; A69-A145 HydrophobicContact CB-CB 3.65Å; L77-A145 HydrophobicContact CB-CB 4.11Å; L77-A145 HydrophobicContact CD1-CB 4.13Å; S78-A145 PolarHBondContact OG-N 3.31Å
146	I	73	Confident	70.7	Confident	6 Å²	6	73 Å²	73	3%	0.031	40%	0.398	C	S	.	.	S	Bend	trans	-139.4	122.1	170	-58.6	167.1	0	0	0	104.9	Y60 I67 A69 S78 Y80 K144	Y60-I146 HydrophobicContact CD1-CD1 4.25Å; Y60-I146 HydrophobicContact CD1-CG1 4.05Å; Y60-I146 HydrophobicContact CE1-CG1 3.86Å; I67-I146 HydrophobicContact CB-CD1 4.42Å; I67-I146 HydrophobicContact CG2-CD1 3.78Å; A69-I146 HydrophobicContact CB-CD1 3.87Å; A69-I146 HydrophobicContact CB-CG1 3.9Å; S78-I146 PolarHBondContact OG-N 2.73Å; S78-I146 VanDerWaalsContact OG-N 3.16Å; Y80-I146 HydrophobicContact CG-CG2 4.43Å; K144-I146 WeakPolarHBondContact CB-O 3.49Å; K144-I146 PolarHBondContact O-N 3.01Å
147	D	65.9	Low	69.1	Low	48 Å²	48	75 Å²	75	26%	0.257	41%	0.41	S	S	.	.			trans	-85.4	174.1	-173	-149.8	-7.6	0	0	0	113.1	V150	D147-V150 WeakPolarHBondContact O-CG2 3.29Å
148	E	62.5	Low	67	Low	144 Å²	144	81.7 Å²	81.7	67%	0.673	44%	0.441	S	S	*	.	S	Bend	trans	-83.3	-14.2	171	-73.6	-179.9	-164	0	0	113.1	K144 V150	K144-E148 VanDerWaalsContact NZ-CD 3.26Å; K144-E148 IonicContact NZ-OE1 2.86Å; K144-E148 PolarHBondContact NZ-OE1 3.43Å; E148-V150 PolarHBondContact O-N 2.86Å
149	D	76.2	Confident	65.5	Low	114 Å²	114	84.6 Å²	84.6	61%	0.61	46%	0.464	S	S	*	.			trans	-73.8	70.1	174.9	-92.5	-5.6	0	0	0	111.8	V136	V136-D149 PolarHBondContact N-O 3.1Å
150	V	84.6	Confident	64.5	Low	27 Å²	27	81.3 Å²	81.3	16%	0.164	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.7	-178.6	-174.1	0	0	0	0	110.1	Y80 R133 R134 H135 D147 E148	Y80-V150 HydrophobicContact CD2-CG2 4Å; Y80-V150 HydrophobicContact CE1-CG1 4.26Å; Y80-V150 HydrophobicContact CE2-CB 3.92Å; Y80-V150 HydrophobicContact CE2-CG1 4.29Å; Y80-V150 HydrophobicContact CE2-CG2 3.49Å; Y80-V150 VanDerWaalsContact CE2-CG2 3.49Å; R133-V150 HydrophobicContact CB-CG1 4.02Å; R133-V150 HydrophobicContact CG-CG1 4.48Å; R134-V150 WeakPolarHBondContact O-CA 3.35Å; H135-V150 HydrophobicContact CB-CG2 4.06Å; H135-V150 VanDerWaalsContact ND1-CG2 3.3Å; H135-V150 WeakPolarHBondContact ND1-CG2 3.05Å; D147-V150 WeakPolarHBondContact O-CG2 3.29Å; E148-V150 PolarHBondContact O-N 2.86Å
151	Y	84.4	Confident	63.8	Low	59 Å²	59	86.5 Å²	86.5	23%	0.231	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151.4	-177.5	63.6	-84.8	0	0	0	113.7	R133 R134 V136 F153 Q220	R133-Y151 CarbonylContact C-O 3.59Å; R133-Y151 VanDerWaalsContact CA-O 3.29Å; R133-Y151 WeakPolarHBondContact CA-O 3.46Å; R134-Y151 HydrophobicContact CB-CE1 4.34Å; R134-Y151 WeakPolarHBondContact CD-OH 3.47Å; R134-Y151 PolarHBondContact N-O 2.03Å; R134-Y151 PolarHBondContact NH1-OH 3.41Å; R134-Y151 VanDerWaalsContact NH1-OH 3.15Å; R134-Y151 PolarHBondContact O-N 2.89Å; V136-Y151 HydrophobicContact CG2-CE1 4.21Å; Y151-F153 HydrophobicContact CE2-CD2 4.01Å; Y151-F153 HydrophobicContact CE2-CE2 4.49Å; Y151-F153 PolarHBondContact O-N 2.85Å; Y151-Q220 WeakPolarHBondContact CE2-O 3.49Å; Y151-Q220 PolarHBondContact OH-O 3.08Å
152	C	86.7	Confident	63.6	Low	41 Å²	41	80.6 Å²	80.6	28%	0.277	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	125	170.8	-62	0	0	0	0	109.9	C91 A154	C91-C152 WeakPolarHBondContact CA-SG 3.19Å; C91-C152 HydrophobicContact CB-CB 3.62Å; C91-C152 WeakPolarHBondContact CB-SG 3.37Å; C91-C152 VanDerWaalsContact SG-CA 3.54Å; C91-C152 WeakPolarHBondContact SG-CB 3.26Å; C91-C152 CovalentContact SG-SG 2.04Å; C91-C152 PolarHBondContact SG-SG 2.89Å; C152-A154 PolarHBondContact O-N 3.3Å
153	F	87.1	Confident	63.5	Low	0 Å²	0	84.1 Å²	84.1	0%	0	45%	0.453	C	S	.	.	S	Bend	trans	-87.2	62.3	-175.7	-156.3	-105.5	0	0	0	111.1	Y122 C132 R134 Y151 M216 Q220 G222 F223	Y122-F153 HydrophobicContact CE1-CD1 4.27Å; Y122-F153 HydrophobicContact CE1-CD2 4.07Å; Y122-F153 HydrophobicContact CE1-CE1 4.1Å; Y122-F153 AromaticContact CE1-CE2 3.89Å; Y122-F153 HydrophobicContact CE1-CE2 3.89Å; Y122-F153 HydrophobicContact CE1-CG 4.25Å; Y122-F153 AromaticContact CE1-CZ 3.91Å; Y122-F153 HydrophobicContact CE1-CZ 3.91Å; C132-F153 VanDerWaalsContact O-CB 3.32Å; C132-F153 WeakPolarHBondContact O-CB 3.39Å; C132-F153 PolarHBondContact O-N 2.86Å; R134-F153 HydrophobicContact CB-CD2 3.73Å; R134-F153 HydrophobicContact CB-CE2 4.36Å; R134-F153 HydrophobicContact CB-CG 4.45Å; R134-F153 HydrophobicContact CG-CD2 4.35Å; Y151-F153 HydrophobicContact CE2-CD2 4.01Å; Y151-F153 HydrophobicContact CE2-CE2 4.49Å; Y151-F153 PolarHBondContact O-N 2.85Å; F153-M216 HydrophobicContact CE1-CG 4.1Å; F153-M216 HydrophobicContact CZ-CG 3.61Å; F153-M216 HydrophobicContact CZ-SD 3.95Å; F153-Q220 WeakPolarHBondContact CE2-O 3.41Å; F153-G222 VanDerWaalsContact CD1-CA 3.42Å; F153-G222 VanDerWaalsContact CE1-C 3.42Å; F153-G222 VanDerWaalsContact CE1-CA 3.47Å; F153-G222 VanDerWaalsContact CE1-O 3.28Å; F153-G222 WeakPolarHBondContact CE1-O 3.46Å; F153-G222 WeakPolarHBondContact O-CA 3.38Å; F153-F223 AromaticContact CD1-CD2 3.82Å; F153-F223 HydrophobicContact CD1-CD2 3.82Å; F153-F223 AromaticContact CD1-CE2 3.47Å; F153-F223 HydrophobicContact CD1-CE2 3.47Å; F153-F223 VanDerWaalsContact CD1-CE2 3.47Å; F153-F223 HydrophobicContact CD1-CG 4.49Å; F153-F223 AromaticContact CD1-CZ 3.85Å; F153-F223 HydrophobicContact CD1-CZ 3.85Å; F153-F223 HydrophobicContact CE1-CD1 4.28Å; F153-F223 HydrophobicContact CE1-CD2 4.07Å; F153-F223 HydrophobicContact CE1-CE1 4.04Å; F153-F223 AromaticContact CE1-CE2 3.82Å; F153-F223 HydrophobicContact CE1-CE2 3.82Å; F153-F223 HydrophobicContact CE1-CG 4.3Å; F153-F223 AromaticContact CE1-CZ 3.79Å; F153-F223 HydrophobicContact CE1-CZ 3.79Å
154	A	81.9	Confident	63.9	Low	10 Å²	10	76.5 Å²	76.5	8%	0.083	41%	0.414	C	S	.	.	S	Bend	trans	-148.6	161.8	176.6	0	0	0	0	0	109.5	V131 C152 K156 D168 N221	V131-A154 HydrophobicContact CG1-CB 4.02Å; C152-A154 PolarHBondContact O-N 3.3Å; A154-K156 PolarHBondContact O-N 2.84Å; A154-D168 WeakPolarHBondContact CA-OD2 3.45Å; A154-D168 HydrophobicContact CB-CB 3.86Å; A154-N221 CarbonylContact C-O 2.97Å; A154-N221 VanDerWaalsContact CA-O 3.3Å; A154-N221 WeakPolarHBondContact CA-O 3.4Å; A154-N221 PolarHBondContact N-O 2.03Å
155	D	71.6	Confident	64.5	Low	73 Å²	73	76 Å²	76	39%	0.39	42%	0.415	S	S	.	.			trans	-63.3	122.2	-178.4	-90.5	-59.2	0	0	0	111.7	V157 K217 N221	D155-V157 HydrophobicContact CB-CG2 4.5Å; D155-V157 PolarHBondContact O-N 2.91Å; D155-K217 WeakPolarHBondContact OD2-CE 3.24Å; D155-K217 IonicContact OD2-NZ 3.18Å; D155-K217 PolarHBondContact OD2-NZ 3.07Å; D155-N221 PolarHBondContact N-O 3.35Å; D155-N221 PolarHBondContact OD1-ND2 2.6Å
156	K	57.1	Low	65	Low	176 Å²	176	77.9 Å²	77.9	77%	0.765	42%	0.422	S	S	*	.			trans	-73.9	70.9	174.1	-70.2	-175.5	-179.2	175.1	0	111.2	A154	A154-K156 PolarHBondContact O-N 2.84Å
157	V	50.8	Low	65.5	Low	83 Å²	83	77.8 Å²	77.8	50%	0.503	42%	0.422	S	S	.	.			trans	-66.8	149.1	162.5	-170	0	0	0	0	108.9	D155	D155-V157 HydrophobicContact CB-CG2 4.5Å; D155-V157 PolarHBondContact O-N 2.91Å
158	Q	39.2	Very low	66.5	Low	157 Å²	157	75.5 Å²	75.5	73%	0.734	41%	0.41	S	S	*	.			trans	-56.1	146.4	-174.6	-65.6	-177.2	7.8	0	0	112.7	G160 Q161	Q158-G160 PolarHBondContact O-N 3.27Å; Q158-Q161 PolarHBondContact O-N 3.01Å
159	P	38.8	Very low	67.7	Low	142 Å²	142	68.9 Å²	68.9	92%	0.922	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	105.6	-174.8	23.8	-34.6	0	0	0	111.7
160	G	42.1	Very low	68.3	Low	57 Å²	57	63.6 Å²	63.6	59%	0.588	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.2	-5.3	173.4	0	0	0	0	0	117.1	Q158	Q158-G160 PolarHBondContact O-N 3.27Å
161	Q	41.7	Very low	68.6	Low	178 Å²	178	62.3 Å²	62.3	83%	0.832	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	-5.5	-175.3	-75.1	-169	-19.9	0	0	117.9	Q158	Q158-Q161 PolarHBondContact O-N 3.01Å
162	G	47.1	Very low	68.8	Low	36 Å²	36	59.9 Å²	59.9	37%	0.371	34%	0.335	S	S	.	.			trans	-121.5	138.5	172.7	0	0	0	0	0	112.7
163	H	57	Low	68.6	Low	127 Å²	127	62 Å²	62	59%	0.588	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-94.7	157.7	168.7	-57.8	85.1	0	0	0	108.8	M206	H163-M206 HydrophobicContact CB-SD 4.32Å
164	P	64.6	Low	68.4	Low	21 Å²	21	63.4 Å²	63.4	14%	0.136	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-53.1	156	163.3	-21.4	32.9	0	0	0	110.7	V131 D168 V169 M206	V131-P164 HydrophobicContact CG2-CB 4.44Å; V131-P164 HydrophobicContact CG2-CG 4.34Å; P164-D168 HydrophobicContact CB-CB 4.46Å; P164-V169 HydrophobicContact CB-CG2 4.37Å; P164-M206 HydrophobicContact CB-SD 4.38Å; P164-M206 WeakPolarHBondContact O-CE 3.36Å
165	I	73.8	Confident	68.8	Low	77 Å²	77	64.1 Å²	64.1	40%	0.395	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-88	154.9	167.3	56.3	169.7	0	0	0	110	A167 D168	I165-A167 HydrophobicContact CD1-CB 3.95Å; I165-A167 HydrophobicContact CG1-CB 4.18Å; I165-A167 PolarHBondContact O-N 2.79Å; I165-D168 HydrophobicContact CG1-CB 4.29Å; I165-D168 WeakPolarHBondContact CG1-OD2 3.46Å; I165-D168 PolarHBondContact O-N 2.93Å
166	D	78.4	Confident	69.8	Low	60 Å²	60	61 Å²	61	32%	0.321	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.2	179.6	-63	-46	0	0	0	112.7	M206 R207	D166-M206 WeakPolarHBondContact OD1-CE 3.09Å; D166-R207 PolarHBondContact OD1-N 2.86Å; D166-R207 VanDerWaalsContact OD1-N 3.09Å
167	A	84.6	Confident	71.6	Confident	3 Å²	3	55.1 Å²	55.1	3%	0.025	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.5	174.3	0	0	0	0	0	114.4	I165 V169 R214 F223 F225	I165-A167 HydrophobicContact CD1-CB 3.95Å; I165-A167 HydrophobicContact CG1-CB 4.18Å; I165-A167 PolarHBondContact O-N 2.79Å; A167-V169 VanDerWaalsContact C-N 3.35Å; A167-R214 PolarHBondContact O-NH1 3.43Å; A167-F223 WeakPolarHBondContact CB-O 3.47Å; A167-F223 VanDerWaalsContact O-CB 3.3Å; A167-F223 WeakPolarHBondContact O-CB 3.41Å; A167-F225 HydrophobicContact CB-CD2 3.9Å; A167-F225 HydrophobicContact CB-CE1 4.38Å; A167-F225 HydrophobicContact CB-CE2 3.61Å; A167-F225 HydrophobicContact CB-CG 4.4Å; A167-F225 HydrophobicContact CB-CZ 3.85Å
168	D	86.8	Confident	73.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-16.1	178.8	-67.7	-25.5	0	0	0	112.2	A154 P164 I165 V170 K217 G222 F223	A154-D168 WeakPolarHBondContact CA-OD2 3.45Å; A154-D168 HydrophobicContact CB-CB 3.86Å; P164-D168 HydrophobicContact CB-CB 4.46Å; I165-D168 HydrophobicContact CG1-CB 4.29Å; I165-D168 WeakPolarHBondContact CG1-OD2 3.46Å; I165-D168 PolarHBondContact O-N 2.93Å; D168-V170 PolarHBondContact O-N 2.64Å; D168-K217 VanDerWaalsContact CG-NZ 3.34Å; D168-K217 WeakPolarHBondContact OD1-CE 3.28Å; D168-K217 IonicContact OD1-NZ 3.57Å; D168-K217 PolarHBondContact OD1-NZ 3.31Å; D168-K217 IonicContact OD2-NZ 2.75Å; D168-K217 PolarHBondContact OD2-NZ 2.62Å; D168-G222 VanDerWaalsContact OD1-CA 3.25Å; D168-G222 WeakPolarHBondContact OD1-CA 3.49Å; D168-F223 PolarHBondContact OD1-N 2.92Å
169	V	87.2	Confident	76.2	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.03	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-87.7	93.6	179.1	-177	0	0	0	0	110	V131 P164 A167 M206 L208 R214	V131-V169 HydrophobicContact CG2-CG2 4.3Å; P164-V169 HydrophobicContact CB-CG2 4.37Å; A167-V169 VanDerWaalsContact C-N 3.35Å; V169-M206 HydrophobicContact CG2-CB 4.31Å; V169-L208 HydrophobicContact CG1-CD1 3.57Å; V169-L208 HydrophobicContact CG1-CG 4.3Å; V169-R214 VanDerWaalsContact C-NH1 3.27Å; V169-R214 PolarHBondContact O-NH1 3.46Å; V169-R214 PolarHBondContact O-NH2 2.89Å
170	V	89.4	Confident	78.7	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.024	25%	0.251	C	S	.	.			trans	-83.9	-58	-168.7	-174.7	0	0	0	0	112.4	G130 C132 D168 V178 V190 N192 F223	G130-V170 PolarHBondContact O-N 3.33Å; C132-V170 VanDerWaalsContact SG-CG2 3.59Å; D168-V170 PolarHBondContact O-N 2.64Å; V170-V178 HydrophobicContact CG1-CG2 4.19Å; V170-V190 HydrophobicContact CG1-CG1 4.06Å; V170-V190 HydrophobicContact CG1-CG2 3.94Å; V170-V190 WeakPolarHBondContact O-CG1 3.3Å; V170-N192 PolarHBondContact O-ND2 3.25Å; V170-N192 PolarHBondContact O-OD1 2.74Å; V170-N192 VanDerWaalsContact O-OD1 3.13Å; V170-F223 HydrophobicContact CG2-CD2 3.72Å; V170-F223 HydrophobicContact CG2-CE2 3.53Å; V170-F223 HydrophobicContact CG2-CZ 4.44Å
171	V	90.6	Very high	80.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.226	C	C	.	.			trans	-107.1	149.8	-163.4	-60.3	0	0	0	0	114.9	I109 A110 C124 G130 S176 V178	I109-V171 HydrophobicContact CB-CB 4.36Å; I109-V171 HydrophobicContact CB-CG2 4.08Å; I109-V171 HydrophobicContact CD1-CB 4.5Å; I109-V171 HydrophobicContact CD1-CG2 3.78Å; I109-V171 HydrophobicContact CG2-CB 3.93Å; I109-V171 HydrophobicContact CG2-CG1 4.36Å; I109-V171 HydrophobicContact CG2-CG2 4.2Å; A110-V171 HydrophobicContact CB-CG1 3.99Å; C124-V171 HydrophobicContact CB-CB 4.24Å; C124-V171 HydrophobicContact CB-CG1 3.57Å; C124-V171 HydrophobicContact CB-CG2 3.57Å; G130-V171 WeakPolarHBondContact CA-O 3.41Å; G130-V171 PolarHBondContact O-N 2.92Å; G130-V171 VanDerWaalsContact O-N 3.11Å; V171-S176 WeakPolarHBondContact CA-OG 3.46Å; V171-S176 WeakPolarHBondContact CB-OG 3.16Å; V171-V178 HydrophobicContact CG1-CG2 4.24Å
172	S	87.6	Confident	82.9	Confident	7 Å²	7	37.4 Å²	37.4	5%	0.049	21%	0.214	C	C	.	.			trans	-90.1	135.4	174.5	175.9	0	0	0	0	110.5	S174 G175 S176 N192 S193	S172-S174 PolarHBondContact O-N 3.17Å; S172-S174 VanDerWaalsContact O-N 3.1Å; S172-S174 PolarHBondContact OG-N 2.8Å; S172-S174 VanDerWaalsContact OG-N 3.12Å; S172-G175 PolarHBondContact O-N 2.95Å; S172-S176 PolarHBondContact N-OG 2.76Å; S172-N192 PolarHBondContact N-OD1 3.16Å; S172-S193 PolarHBondContact OG-O 3.42Å
173	P	82.8	Confident	84	Confident	85 Å²	85	38.1 Å²	38.1	55%	0.552	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.6	167.6	-26.7	36	0	0	0	114.3	G175	P173-G175 PolarHBondContact O-N 2.04Å
174	S	83.9	Confident	84.6	Confident	31 Å²	31	39 Å²	39	22%	0.217	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	1.9	173.6	-59.3	0	0	0	0	114	S172 S193	S172-S174 PolarHBondContact O-N 3.17Å; S172-S174 VanDerWaalsContact O-N 3.1Å; S172-S174 PolarHBondContact OG-N 2.8Å; S172-S174 VanDerWaalsContact OG-N 3.12Å; S174-S193 WeakPolarHBondContact CB-O 3.36Å
175	G	89.9	Confident	85.4	Confident	24 Å²	24	40.6 Å²	40.6	25%	0.247	23%	0.232	C	C	.	.			trans	102.4	142.3	178.4	0	0	0	0	0	113.8	S172 P173 S193	S172-G175 PolarHBondContact O-N 2.95Å; P173-G175 PolarHBondContact O-N 2.04Å; G175-S193 WeakPolarHBondContact O-CA 3.41Å; G175-S193 WeakPolarHBondContact O-CB 3.41Å; G175-S193 PolarHBondContact O-N 2.92Å; G175-S193 PolarHBondContact O-OG 2.87Å
176	S	93.3	Very high	85.9	Confident	8 Å²	8	37.1 Å²	37.1	6%	0.056	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.1	-177.5	-61.4	0	0	0	0	112	V171 S172 G191 N192	V171-S176 WeakPolarHBondContact CA-OG 3.46Å; V171-S176 WeakPolarHBondContact CB-OG 3.16Å; S172-S176 PolarHBondContact N-OG 2.76Å; S176-G191 CarbonylContact C-O 3.58Å; S176-G191 WeakPolarHBondContact CA-O 3.03Å; S176-N192 WeakPolarHBondContact CB-OD1 3.02Å; S176-N192 PolarHBondContact OG-OD1 2.99Å
177	Q	94.5	Very high	86.5	Confident	52 Å²	52	34.5 Å²	34.5	24%	0.243	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.1	165.6	-68	-65.4	-80.9	0	0	108	V190 G191 Y248 F258	Q177-V190 WeakPolarHBondContact O-CA 3.39Å; Q177-G191 PolarHBondContact N-O 3.01Å; Q177-G191 PolarHBondContact O-N 2.83Å; Q177-Y248 VanDerWaalsContact OE1-CA 3.3Å; Q177-F258 HydrophobicContact CB-CD1 4.25Å; Q177-F258 HydrophobicContact CB-CE1 4Å
178	V	93.9	Very high	86.8	Confident	27 Å²	27	34.6 Å²	34.6	16%	0.164	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.4	-179.5	-177.1	0	0	0	0	108	A110 V112 V170 V171 F188 F189 V190	A110-V178 HydrophobicContact CB-CG2 4.1Å; V112-V178 HydrophobicContact CG2-CB 3.93Å; V112-V178 HydrophobicContact CG2-CG1 3.85Å; V170-V178 HydrophobicContact CG1-CG2 4.19Å; V171-V178 HydrophobicContact CG1-CG2 4.24Å; V178-F188 HydrophobicContact CG1-CD1 4.41Å; V178-F189 WeakPolarHBondContact CA-O 3.1Å; V178-V190 HydrophobicContact CG1-CG2 4.25Å; V178-V190 HydrophobicContact CG2-CG1 4.3Å; V178-V190 HydrophobicContact CG2-CG2 4.37Å
179	L	93	Very high	87.2	Confident	28 Å²	28	34.7 Å²	34.7	15%	0.147	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119	178.1	-179.3	73.7	0	0	0	108.8	V181 F189 H251 T256	L179-V181 HydrophobicContact CD2-CG2 3.72Å; L179-V181 HydrophobicContact CG-CG2 3.85Å; L179-F189 HydrophobicContact CB-CB 4.47Å; L179-F189 PolarHBondContact N-O 2.85Å; L179-F189 PolarHBondContact O-N 3.46Å; L179-H251 HydrophobicContact CD2-CB 4.43Å; L179-T256 HydrophobicContact CD2-CG2 3.8Å
180	N	90.8	Very high	87.6	Confident	55 Å²	55	34.5 Å²	34.5	29%	0.294	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.5	164.1	51.2	-34.7	0	0	0	109.8	V113 I186 F188	V113-N180 PolarHBondContact O-ND2 2.94Å; N180-I186 HydrophobicContact CB-CG2 4.35Å; N180-F188 HydrophobicContact CB-CD1 4.32Å; N180-F188 HydrophobicContact CB-CE1 4.19Å
181	V	88.1	Confident	87.8	Confident	8 Å²	8	34.3 Å²	34.3	5%	0.048	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.5	175.5	-177.3	0	0	0	0	108.6	L179 T187 F189 H251	L179-V181 HydrophobicContact CD2-CG2 3.72Å; L179-V181 HydrophobicContact CG-CG2 3.85Å; V181-T187 PolarHBondContact N-O 3.27Å; V181-T187 PolarHBondContact O-N 3.23Å; V181-F189 HydrophobicContact CB-CD2 4.16Å; V181-F189 HydrophobicContact CB-CE2 3.96Å; V181-F189 HydrophobicContact CG2-CD2 3.78Å; V181-F189 HydrophobicContact CG2-CE2 3.94Å; V181-H251 VanDerWaalsContact CG1-CD2 3.5Å; V181-H251 WeakPolarHBondContact CG1-CD2 3.47Å; V181-H251 HydrophobicContact CG2-CB 4.42Å
182	E	83.2	Confident	87.9	Confident	127 Å²	127	34.5 Å²	34.5	59%	0.593	20%	0.199	S	C	*	.			trans	-83.8	139.7	171.1	-170.9	174.8	-156.4	0	0	110.5	I116	I116-E182 HydrophobicContact CD1-CB 4.02Å; I116-E182 HydrophobicContact CD1-CG 4.04Å
183	S	70.9	Confident	88.2	Confident	51 Å²	51	34.3 Å²	34.3	36%	0.357	20%	0.198	S	C	.	.	S	Bend	trans	-156.1	-133.1	173.2	-175	0	0	0	0	105.5	V185	S183-V185 PolarHBondContact O-N 2.53Å
184	N	70.4	Confident	88.4	Confident	147 Å²	147	32.7 Å²	32.7	79%	0.786	18%	0.183	S	C	*	.	S	Bend	trans	-68.1	-20.1	170.2	-64.3	-29.8	0	0	0	113.4
185	V	79.8	Confident	88.4	Confident	53 Å²	53	33.8 Å²	33.8	32%	0.321	19%	0.186	S	C	.	.	S	Bend	trans	-150.5	140.6	176	-174.1	0	0	0	0	108	S183 T187 K215	S183-V185 PolarHBondContact O-N 2.53Å; V185-T187 PolarHBondContact O-N 2.75Å; V185-T187 VanDerWaalsContact O-N 3.12Å; V185-T187 PolarHBondContact O-OG1 2.97Å; V185-K215 HydrophobicContact CG1-CB 4.33Å
186	I	85.5	Confident	87.6	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.021	19%	0.187	C	C	.	.			trans	-58.7	118.2	172.6	-48.3	-179.8	0	0	0	109.8	E114 I116 Y117 N180 F188	E114-I186 HydrophobicContact CG-CD1 3.83Å; E114-I186 VanDerWaalsContact OE1-CD1 3.28Å; E114-I186 WeakPolarHBondContact OE1-CD1 3.32Å; I116-I186 HydrophobicContact CB-CD1 3.74Å; I116-I186 HydrophobicContact CD1-CD1 3.97Å; I116-I186 HydrophobicContact CD1-CG1 4.2Å; I116-I186 HydrophobicContact CG1-CD1 4.46Å; I116-I186 HydrophobicContact CG2-CD1 4.04Å; I116-I186 HydrophobicContact CG2-CG1 4.44Å; Y117-I186 HydrophobicContact CD2-CD1 3.44Å; Y117-I186 VanDerWaalsContact CD2-CD1 3.44Å; Y117-I186 HydrophobicContact CD2-CG1 4.35Å; Y117-I186 HydrophobicContact CE2-CB 4.16Å; Y117-I186 HydrophobicContact CE2-CD1 3.3Å; Y117-I186 HydrophobicContact CE2-CG1 3.71Å; Y117-I186 HydrophobicContact CG-CD1 4.2Å; N180-I186 HydrophobicContact CB-CG2 4.35Å; I186-F188 HydrophobicContact CG2-CD2 4.4Å; I186-F188 HydrophobicContact CG2-CE2 3.85Å; I186-F188 HydrophobicContact CG2-CZ 4.25Å
187	T	89.7	Confident	86	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124	-179.7	-59.3	0	0	0	0	109.9	V181 V185 F189 Q213 F226	V181-T187 PolarHBondContact N-O 3.27Å; V181-T187 PolarHBondContact O-N 3.23Å; V185-T187 PolarHBondContact O-N 2.75Å; V185-T187 VanDerWaalsContact O-N 3.12Å; V185-T187 PolarHBondContact O-OG1 2.97Å; T187-F189 HydrophobicContact CG2-CD2 3.89Å; T187-F189 HydrophobicContact CG2-CE2 3.55Å; T187-F189 HydrophobicContact CG2-CZ 4.12Å; T187-Q213 HydrophobicContact CG2-CB 4.15Å; T187-F226 HydrophobicContact CG2-CE2 4.23Å
188	F	92	Very high	84	Confident	5 Å²	5	44.6 Å²	44.6	2%	0.022	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	106.6	175.5	-66.6	-99.5	0	0	0	108.4	E114 V178 N180 I186 R214 F223	E114-F188 HydrophobicContact CG-CZ 4.42Å; V178-F188 HydrophobicContact CG1-CD1 4.41Å; N180-F188 HydrophobicContact CB-CD1 4.32Å; N180-F188 HydrophobicContact CB-CE1 4.19Å; I186-F188 HydrophobicContact CG2-CD2 4.4Å; I186-F188 HydrophobicContact CG2-CE2 3.85Å; I186-F188 HydrophobicContact CG2-CZ 4.25Å; F188-R214 HydrophobicContact CB-CB 4.42Å; F188-R214 PolarHBondContact N-O 2.82Å; F188-R214 PolarHBondContact O-N 3.17Å; F188-F223 HydrophobicContact CD1-CE1 4.16Å; F188-F223 HydrophobicContact CD2-CD1 4.34Å; F188-F223 AromaticContact CD2-CE1 3.78Å; F188-F223 HydrophobicContact CD2-CE1 3.78Å; F188-F223 HydrophobicContact CE1-CE1 4.3Å; F188-F223 AromaticContact CE2-CE1 3.94Å; F188-F223 HydrophobicContact CE2-CE1 3.94Å; F188-F223 AromaticContact CG-CE1 3.91Å; F188-F223 HydrophobicContact CG-CE1 3.91Å; F188-F223 HydrophobicContact CZ-CE1 4.19Å
189	F	94.4	Very high	81.6	Confident	1 Å²	1	46 Å²	46	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.1	171.3	-70.2	-103.8	0	0	0	108.6	V178 L179 V181 T187 Q213 T256 F258 M278	V178-F189 WeakPolarHBondContact CA-O 3.1Å; L179-F189 HydrophobicContact CB-CB 4.47Å; L179-F189 PolarHBondContact N-O 2.85Å; L179-F189 PolarHBondContact O-N 3.46Å; V181-F189 HydrophobicContact CB-CD2 4.16Å; V181-F189 HydrophobicContact CB-CE2 3.96Å; V181-F189 HydrophobicContact CG2-CD2 3.78Å; V181-F189 HydrophobicContact CG2-CE2 3.94Å; T187-F189 HydrophobicContact CG2-CD2 3.89Å; T187-F189 HydrophobicContact CG2-CE2 3.55Å; T187-F189 HydrophobicContact CG2-CZ 4.12Å; F189-Q213 HydrophobicContact CD1-CG 3.87Å; F189-Q213 HydrophobicContact CE1-CG 3.77Å; F189-Q213 HydrophobicContact CZ-CG 4.37Å; F189-T256 HydrophobicContact CB-CG2 4.25Å; F189-T256 HydrophobicContact CD1-CG2 3.7Å; F189-T256 HydrophobicContact CD2-CG2 4.31Å; F189-T256 HydrophobicContact CE1-CG2 4.02Å; F189-T256 HydrophobicContact CG-CG2 3.85Å; F189-T256 HydrophobicContact CZ-CG2 4.49Å; F189-F258 HydrophobicContact CB-CE2 3.99Å; F189-F258 HydrophobicContact CB-CZ 3.84Å; F189-M278 HydrophobicContact CD1-CE 3.76Å; F189-M278 HydrophobicContact CE1-CE 4.12Å
190	V	95	Very high	79	Confident	1 Å²	1	53 Å²	53	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.5	-173.6	-178.3	0	0	0	0	109.5	V170 Q177 V178 I211 S212	V170-V190 HydrophobicContact CG1-CG1 4.06Å; V170-V190 HydrophobicContact CG1-CG2 3.94Å; V170-V190 WeakPolarHBondContact O-CG1 3.3Å; Q177-V190 WeakPolarHBondContact O-CA 3.39Å; V178-V190 HydrophobicContact CG1-CG2 4.25Å; V178-V190 HydrophobicContact CG2-CG1 4.3Å; V178-V190 HydrophobicContact CG2-CG2 4.37Å; V190-I211 CarbonylContact O-C 3.55Å; V190-I211 WeakPolarHBondContact O-CA 3.02Å; V190-S212 PolarHBondContact N-O 2.89Å; V190-S212 PolarHBondContact O-N 3.08Å
191	G	95	Very high	76.8	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.1	169.8	0	0	0	0	0	110.5	S176 Q177	S176-G191 CarbonylContact C-O 3.58Å; S176-G191 WeakPolarHBondContact CA-O 3.03Å; Q177-G191 PolarHBondContact N-O 3.01Å; Q177-G191 PolarHBondContact O-N 2.83Å
192	N	93.1	Very high	74.5	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.1	-175.5	-77.7	-37.3	0	0	0	110.6	V170 S172 S176 L208 H209 T210 Y246	V170-N192 PolarHBondContact O-ND2 3.25Å; V170-N192 PolarHBondContact O-OD1 2.74Å; V170-N192 VanDerWaalsContact O-OD1 3.13Å; S172-N192 PolarHBondContact N-OD1 3.16Å; S176-N192 WeakPolarHBondContact CB-OD1 3.02Å; S176-N192 PolarHBondContact OG-OD1 2.99Å; N192-L208 HydrophobicContact CB-CD2 3.86Å; N192-H209 WeakPolarHBondContact CB-O 2.8Å; N192-H209 PolarHBondContact ND2-O 3.14Å; N192-T210 PolarHBondContact N-O 3.41Å; N192-Y246 WeakPolarHBondContact O-CD2 3.28Å; N192-Y246 VanDerWaalsContact O-CE2 3.26Å; N192-Y246 WeakPolarHBondContact O-CE2 3.34Å
193	S	92.1	Very high	72.3	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.028	35%	0.347	C	S	.	.			trans	-77.9	144.8	-178.4	-51.9	0	0	0	0	111.8	S172 S174 G175 L244 Y246	S172-S193 PolarHBondContact OG-O 3.42Å; S174-S193 WeakPolarHBondContact CB-O 3.36Å; G175-S193 WeakPolarHBondContact O-CA 3.41Å; G175-S193 WeakPolarHBondContact O-CB 3.41Å; G175-S193 PolarHBondContact O-N 2.92Å; G175-S193 PolarHBondContact O-OG 2.87Å; S193-L244 CarbonylContact C-O 3.56Å; S193-L244 WeakPolarHBondContact CA-O 3.43Å; S193-L244 WeakPolarHBondContact CB-O 2.98Å; S193-Y246 PolarHBondContact OG-N 3.08Å
194	E	87.6	Confident	71	Confident	51 Å²	51	60.8 Å²	60.8	24%	0.238	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-117	117	173.7	-169.4	81.9	138.7	0	0	107.8	L234 G240 Y242 L244	E194-L234 HydrophobicContact CB-CD1 4.02Å; E194-L234 HydrophobicContact CG-CD1 3.91Å; E194-G240 PolarHBondContact OE1-N 3.02Å; E194-Y242 VanDerWaalsContact CG-O 3.28Å; E194-Y242 WeakPolarHBondContact CG-O 3.49Å; E194-L244 HydrophobicContact CB-CB 4.46Å; E194-L244 PolarHBondContact N-O 3.04Å; E194-L244 PolarHBondContact O-N 2.68Å
195	I	83.8	Confident	70	Confident	53 Å²	53	58.9 Å²	58.9	27%	0.272	36%	0.356	S	S	.	.			trans	-129.3	105.9	-177.8	-59.6	-179.2	0	0	0	109.1	K197 A198 Y243	I195-K197 PolarHBondContact O-N 3.49Å; I195-A198 WeakPolarHBondContact O-CB 3.44Å; I195-A198 PolarHBondContact O-N 2.98Å; I195-Y243 HydrophobicContact CG1-CE2 4.24Å; I195-Y243 HydrophobicContact CG2-CD2 4.25Å; I195-Y243 HydrophobicContact CG2-CE2 4.07Å
196	P	74.5	Confident	68.9	Low	42 Å²	42	59 Å²	59	27%	0.273	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	137	178.3	-27.3	36.4	0	0	0	111.9	N241 Y242	P196-N241 VanDerWaalsContact CG-C 3.45Å; P196-N241 WeakPolarHBondContact CG-O 3.43Å; P196-Y242 WeakPolarHBondContact CD-O 3.42Å
197	K	59.1	Low	67.9	Low	209 Å²	209	65 Å²	65	91%	0.909	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	8.9	-174.5	-48.8	174.2	-178.2	174.5	0	117.1	I195 G199	I195-K197 PolarHBondContact O-N 3.49Å; K197-G199 PolarHBondContact O-N 3.5Å
198	A	52.5	Low	67.4	Low	61 Å²	61	67 Å²	67	50%	0.504	39%	0.387	S	S	.	.	S	Bend	trans	-72.4	49.2	170.7	0	0	0	0	0	114.3	I195	I195-A198 WeakPolarHBondContact O-CB 3.44Å; I195-A198 PolarHBondContact O-N 2.98Å
199	G	44.2	Very low	67.2	Low	56 Å²	56	67 Å²	67	58%	0.577	39%	0.387	S	S	*	.			trans	84.4	136.2	177.3	0	0	0	0	0	115	K197 I201	K197-G199 PolarHBondContact O-N 3.5Å; G199-I201 VanDerWaalsContact C-N 3.3Å; G199-I201 PolarHBondContact O-N 3.27Å
200	N	36.7	Very low	67	Low	174 Å²	174	67.5 Å²	67.5	93%	0.93	39%	0.39	S	S	*	.			trans	-82.6	69.9	175.5	-115	12.8	0	0	0	110.6	S202	N200-S202 PolarHBondContact O-N 3.09Å
201	I	46.4	Very low	66.9	Low	119 Å²	119	67.6 Å²	67.6	61%	0.61	39%	0.39	S	S	*	.			trans	-81.3	72.3	174.4	-50.3	-178	0	0	0	109.4	G199 G203 I205	G199-I201 VanDerWaalsContact C-N 3.3Å; G199-I201 PolarHBondContact O-N 3.27Å; I201-G203 VanDerWaalsContact C-N 3.33Å; I201-G203 PolarHBondContact O-N 3.5Å; I201-I205 HydrophobicContact CB-CD1 4.19Å; I201-I205 HydrophobicContact CG2-CD1 3.95Å
202	S	38.1	Very low	66.9	Low	125 Å²	125	67.6 Å²	67.6	87%	0.874	39%	0.391	S	S	*	.			trans	-76	83.3	173.6	-169.6	0	0	0	0	109.9	N200	N200-S202 PolarHBondContact O-N 3.09Å
203	G	38.3	Very low	66.8	Low	48 Å²	48	67.5 Å²	67.5	50%	0.495	39%	0.39	S	S	.	.	S	Bend	trans	-167.5	68.1	-172.5	0	0	0	0	0	114.7	I201 I205	I201-G203 VanDerWaalsContact C-N 3.33Å; I201-G203 PolarHBondContact O-N 3.5Å; G203-I205 VanDerWaalsContact C-N 3.3Å; G203-I205 PolarHBondContact O-N 3.01Å
204	S	42.4	Very low	66.8	Low	114 Å²	114	67.4 Å²	67.4	80%	0.797	39%	0.389	S	S	*	.			trans	42.3	44.9	163.2	-167.1	0	0	0	0	116.4
205	I	51	Low	66.9	Low	106 Å²	106	68.4 Å²	68.4	54%	0.544	39%	0.393	S	S	.	.			trans	-67.4	137	177.1	-51.7	179.1	0	0	0	109	I201 G203	I201-I205 HydrophobicContact CB-CD1 4.19Å; I201-I205 HydrophobicContact CG2-CD1 3.95Å; G203-I205 VanDerWaalsContact C-N 3.3Å; G203-I205 PolarHBondContact O-N 3.01Å
206	M	56.1	Low	67.1	Low	57 Å²	57	66.8 Å²	66.8	28%	0.281	38%	0.384	S	S	.	.			trans	-63	160.1	175.8	-64.9	-158.8	63	0	0	111.9	H163 P164 D166 V169 L208	H163-M206 HydrophobicContact CB-SD 4.32Å; P164-M206 HydrophobicContact CB-SD 4.38Å; P164-M206 WeakPolarHBondContact O-CE 3.36Å; D166-M206 WeakPolarHBondContact OD1-CE 3.09Å; V169-M206 HydrophobicContact CG2-CB 4.31Å; M206-L208 PolarHBondContact O-N 3.3Å
207	R	64.1	Low	67.6	Low	129 Å²	129	65.9 Å²	65.9	49%	0.487	38%	0.376	S	S	.	.			trans	-75.2	93.9	-163.7	-173.4	176.6	177.9	138.5	-3.1	111.5	D166 H209 D233	D166-R207 PolarHBondContact OD1-N 2.86Å; D166-R207 VanDerWaalsContact OD1-N 3.09Å; R207-H209 PolarHBondContact O-N 2.89Å; R207-D233 IonicContact CZ-OD2 3.17Å; R207-D233 IonicContact NE-OD2 2.8Å; R207-D233 PolarHBondContact NE-OD2 2.69Å; R207-D233 IonicContact NH2-OD2 2.7Å; R207-D233 PolarHBondContact NH2-OD2 2.85Å
208	L	79.4	Confident	68.8	Low	47 Å²	47	63.2 Å²	63.2	25%	0.246	38%	0.377	C	S	.	.			trans	-72	111.9	177.6	-132.9	117.4	0	0	0	110.4	V169 N192 M206	V169-L208 HydrophobicContact CG1-CD1 3.57Å; V169-L208 HydrophobicContact CG1-CG 4.3Å; N192-L208 HydrophobicContact CB-CD2 3.86Å; M206-L208 PolarHBondContact O-N 3.3Å
209	H	88.2	Confident	70.1	Confident	5 Å²	5	63.8 Å²	63.8	2%	0.023	38%	0.378	C	S	.	.			trans	-74.4	134.1	179	-67.8	-65.8	0	0	0	112	N192 R207 F225 H231 D233	N192-H209 WeakPolarHBondContact CB-O 2.8Å; N192-H209 PolarHBondContact ND2-O 3.14Å; R207-H209 PolarHBondContact O-N 2.89Å; H209-F225 AromaticContact CD2-CZ 3.48Å; H209-F225 VanDerWaalsContact CD2-CZ 3.48Å; H209-F225 WeakPolarHBondContact CD2-CZ 3.4Å; H209-F225 AromaticContact NE2-CE2 3.93Å; H209-F225 AromaticContact NE2-CZ 3.8Å; H209-H231 HydrophobicContact CB-CB 4.05Å; H209-H231 AromaticContact CE1-CD2 3.41Å; H209-H231 PolarHBondContact CE1-CD2 2.95Å; H209-H231 VanDerWaalsContact CE1-CD2 3.41Å; H209-H231 AromaticContact CE1-CE1 3.34Å; H209-H231 PolarHBondContact CE1-CE1 3.28Å; H209-H231 AromaticContact CE1-CG 3.53Å; H209-H231 AromaticContact CE1-ND1 3.48Å; H209-H231 PolarHBondContact CE1-ND1 3.19Å; H209-H231 AromaticContact CE1-NE2 3.31Å; H209-H231 PolarHBondContact CE1-NE2 2.91Å; H209-H231 VanDerWaalsContact CE1-NE2 3.31Å; H209-H231 AromaticContact CG-CG 3.84Å; H209-H231 AromaticContact ND1-CD2 3.39Å; H209-H231 PolarHBondContact ND1-CD2 2.03Å; H209-H231 AromaticContact ND1-CG 3.46Å; H209-H231 AromaticContact ND1-ND1 3.88Å; H209-H231 AromaticContact ND1-NE2 3.8Å; H209-H231 AromaticContact NE2-CE1 3.63Å; H209-H231 AromaticContact NE2-CG 3.93Å; H209-H231 AromaticContact NE2-ND1 3.55Å; H209-D233 VanDerWaalsContact CA-OD1 3.29Å; H209-D233 WeakPolarHBondContact CA-OD1 3.02Å; H209-D233 IonicContact CE1-OD1 3.3Å; H209-D233 IonicContact CE1-OD2 3.77Å; H209-D233 IonicContact CG-OD1 3.89Å; H209-D233 IonicContact ND1-OD1 3.49Å; H209-D233 PolarHBondContact ND1-OD1 2.81Å; H209-D233 IonicContact ND1-OD2 2.65Å; H209-D233 PolarHBondContact ND1-OD2 2.72Å
210	T	90.6	Very high	71.8	Confident	13 Å²	13	63.9 Å²	63.9	8%	0.08	36%	0.363	C	S	.	.	S	Bend	trans	-66.7	-44.3	-176.3	-51.1	0	0	0	0	111.8	N192 M232 L234 L244 Y246 F389	N192-T210 PolarHBondContact N-O 3.41Å; T210-M232 WeakPolarHBondContact CB-O 3.44Å; T210-L234 HydrophobicContact CG2-CG 4.09Å; T210-L234 PolarHBondContact OG1-N 2.97Å; T210-L234 VanDerWaalsContact OG1-N 3.11Å; T210-L244 HydrophobicContact CG2-CD2 3.47Å; T210-L244 VanDerWaalsContact CG2-CD2 3.47Å; T210-Y246 HydrophobicContact CG2-CE2 4.39Å; T210-F389 HydrophobicContact CG2-CE1 3.98Å; T210-F389 HydrophobicContact CG2-CZ 4.23Å
211	I	92.8	Very high	73.9	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	136.1	167.8	-168.2	170.1	0	0	0	110	V190 H231 M232 Y246 F258 M278 I285 Y288 F389	V190-I211 CarbonylContact O-C 3.55Å; V190-I211 WeakPolarHBondContact O-CA 3.02Å; I211-H231 CarbonylContact O-C 3.52Å; I211-H231 VanDerWaalsContact O-CA 3.3Å; I211-H231 WeakPolarHBondContact O-CA 3.28Å; I211-M232 HydrophobicContact CG2-CB 3.78Å; I211-M232 PolarHBondContact N-O 3.21Å; I211-M232 PolarHBondContact O-N 3.03Å; I211-Y246 HydrophobicContact CD1-CE1 4.49Å; I211-F258 HydrophobicContact CD1-CD2 4.34Å; I211-F258 HydrophobicContact CD1-CE2 4.49Å; I211-M278 HydrophobicContact CD1-CE 3.73Å; I211-M278 HydrophobicContact CD1-SD 3.95Å; I211-I285 HydrophobicContact CG1-CD1 4.46Å; I211-I285 HydrophobicContact CG2-CD1 4.11Å; I211-Y288 HydrophobicContact CD1-CE2 4.25Å; I211-F389 HydrophobicContact CG2-CE1 4Å; I211-F389 HydrophobicContact CG2-CZ 4.13Å
212	S	93.4	Very high	75.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.007	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	149.3	-175.6	57.1	0	0	0	0	113.6	V190 R214 S230	V190-S212 PolarHBondContact N-O 2.89Å; V190-S212 PolarHBondContact O-N 3.08Å; S212-R214 PolarHBondContact OG-NE 3.46Å; S212-R214 PolarHBondContact OG-NH2 3.33Å; S212-S230 CarbonylContact C-O 3.5Å; S212-S230 WeakPolarHBondContact CA-O 3.37Å
213	Q	92.6	Very high	78.3	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.2	169.1	-64.7	172.3	-49.1	0	0	108.4	T187 F189 S230 D282 V284 I285	T187-Q213 HydrophobicContact CG2-CB 4.15Å; F189-Q213 HydrophobicContact CD1-CG 3.87Å; F189-Q213 HydrophobicContact CE1-CG 3.77Å; F189-Q213 HydrophobicContact CZ-CG 4.37Å; Q213-S230 PolarHBondContact N-O 2.84Å; Q213-D282 PolarHBondContact NE2-O 3.02Å; Q213-V284 VanDerWaalsContact OE1-N 3.17Å; Q213-I285 HydrophobicContact CG-CD1 4.34Å; Q213-I285 HydrophobicContact CG-CG1 3.95Å
214	R	91.2	Very high	80.8	Confident	1 Å²	1	46.2 Å²	46.2	0%	0.004	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.3	-175.5	-45.2	-173.9	-169.4	-159.9	6.1	110	A167 V169 F188 S212 F223 F225	A167-R214 PolarHBondContact O-NH1 3.43Å; V169-R214 VanDerWaalsContact C-NH1 3.27Å; V169-R214 PolarHBondContact O-NH1 3.46Å; V169-R214 PolarHBondContact O-NH2 2.89Å; F188-R214 HydrophobicContact CB-CB 4.42Å; F188-R214 PolarHBondContact N-O 2.82Å; F188-R214 PolarHBondContact O-N 3.17Å; S212-R214 PolarHBondContact OG-NE 3.46Å; S212-R214 PolarHBondContact OG-NH2 3.33Å; R214-F223 HydrophobicContact CB-CB 4.37Å; R214-F223 HydrophobicContact CB-CD1 4.39Å; R214-F225 HydrophobicContact CG-CD1 4.12Å; R214-F225 HydrophobicContact CG-CE1 3.88Å
215	K	89.6	Confident	83.1	Confident	73 Å²	73	42.5 Å²	42.5	32%	0.317	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	161.5	165.5	59.1	166.2	173.9	-178.8	0	110.5	V185 F223 T224 F226	V185-K215 HydrophobicContact CG1-CB 4.33Å; K215-F223 CarbonylContact O-C 3.56Å; K215-F223 VanDerWaalsContact O-CA 3.31Å; K215-F223 WeakPolarHBondContact O-CA 3.43Å; K215-T224 HydrophobicContact CD-CG2 4.22Å; K215-T224 HydrophobicContact CG-CG2 3.73Å; K215-T224 PolarHBondContact N-O 3.14Å; K215-T224 PolarHBondContact O-N 2.87Å; K215-F226 HydrophobicContact CB-CE1 4.18Å; K215-F226 HydrophobicContact CB-CE2 4.09Å; K215-F226 HydrophobicContact CB-CZ 3.67Å; K215-F226 HydrophobicContact CD-CD1 4.03Å; K215-F226 HydrophobicContact CD-CE1 3.62Å; K215-F226 HydrophobicContact CD-CZ 4.02Å; K215-F226 HydrophobicContact CG-CD1 4.42Å; K215-F226 HydrophobicContact CG-CE1 4.01Å; K215-F226 HydrophobicContact CG-CE2 4.23Å; K215-F226 HydrophobicContact CG-CZ 3.91Å
216	M	87.7	Confident	84.8	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.089	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	146.6	169.9	-151.5	-177.4	-66.2	0	0	110.9	E114 Y117 Y122 F153 Q220	E114-M216 WeakPolarHBondContact OE2-CE 3.37Å; Y117-M216 HydrophobicContact CD2-CE 3.97Å; Y117-M216 HydrophobicContact CD2-SD 4.46Å; Y117-M216 HydrophobicContact CE2-CE 4.43Å; Y122-M216 WeakPolarHBondContact OH-CE 3Å; F153-M216 HydrophobicContact CE1-CG 4.1Å; F153-M216 HydrophobicContact CZ-CG 3.61Å; F153-M216 HydrophobicContact CZ-SD 3.95Å; M216-Q220 HydrophobicContact SD-CB 4.33Å; M216-Q220 HydrophobicContact SD-CG 3.92Å
217	K	86.4	Confident	86.4	Confident	23 Å²	23	39.3 Å²	39.3	10%	0.1	21%	0.206	C	C	.	.			trans	-69.1	144	162.7	-63.6	170	-164.1	166.3	0	108.7	D155 D168 S219 Q220 N221 G222 F223	D155-K217 WeakPolarHBondContact OD2-CE 3.24Å; D155-K217 IonicContact OD2-NZ 3.18Å; D155-K217 PolarHBondContact OD2-NZ 3.07Å; D168-K217 VanDerWaalsContact CG-NZ 3.34Å; D168-K217 WeakPolarHBondContact OD1-CE 3.28Å; D168-K217 IonicContact OD1-NZ 3.57Å; D168-K217 PolarHBondContact OD1-NZ 3.31Å; D168-K217 IonicContact OD2-NZ 2.75Å; D168-K217 PolarHBondContact OD2-NZ 2.62Å; K217-S219 PolarHBondContact O-N 3.08Å; K217-S219 VanDerWaalsContact O-N 3.15Å; K217-Q220 PolarHBondContact O-N 3.16Å; K217-N221 WeakPolarHBondContact CD-OD1 3.5Å; K217-N221 PolarHBondContact NZ-O 3.11Å; K217-G222 WeakPolarHBondContact CG-O 3.48Å; K217-G222 PolarHBondContact N-O 3.24Å; K217-F223 WeakPolarHBondContact CE-O 3.43Å
218	T	82.3	Confident	87.3	Confident	153 Å²	153	37.7 Å²	37.7	94%	0.939	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20	176	45.7	0	0	0	0	113.2	Q220	T218-Q220 VanDerWaalsContact C-N 3.31Å
219	S	80.3	Confident	87.6	Confident	73 Å²	73	39 Å²	39	51%	0.51	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	4.6	172.5	42.3	0	0	0	0	114.6	K217 N221	K217-S219 PolarHBondContact O-N 3.08Å; K217-S219 VanDerWaalsContact O-N 3.15Å; S219-N221 WeakPolarHBondContact CB-OD1 3.4Å; S219-N221 PolarHBondContact O-N 2.89Å; S219-N221 PolarHBondContact OG-OD1 2.88Å
220	Q	80.2	Confident	87.7	Confident	59 Å²	59	38.8 Å²	38.8	28%	0.276	22%	0.221	S	C	.	.	S	Bend	trans	48.1	36.9	176.9	-58	-165.4	-23.1	0	0	115	D118 Y151 F153 M216 K217 T218	D118-Q220 PolarHBondContact OD1-NE2 3.22Å; D118-Q220 PolarHBondContact OD1-OE1 3.18Å; Y151-Q220 WeakPolarHBondContact CE2-O 3.49Å; Y151-Q220 PolarHBondContact OH-O 3.08Å; F153-Q220 WeakPolarHBondContact CE2-O 3.41Å; M216-Q220 HydrophobicContact SD-CB 4.33Å; M216-Q220 HydrophobicContact SD-CG 3.92Å; K217-Q220 PolarHBondContact O-N 3.16Å; T218-Q220 VanDerWaalsContact C-N 3.31Å
221	N	80.8	Confident	87.7	Confident	38 Å²	38	40.1 Å²	40.1	20%	0.203	23%	0.226	C	C	.	.	S	Bend	trans	-132.5	35.7	-174	69.8	-20.1	0	0	0	111.7	A154 D155 K217 S219	A154-N221 CarbonylContact C-O 2.97Å; A154-N221 VanDerWaalsContact CA-O 3.3Å; A154-N221 WeakPolarHBondContact CA-O 3.4Å; A154-N221 PolarHBondContact N-O 2.03Å; D155-N221 PolarHBondContact N-O 3.35Å; D155-N221 PolarHBondContact OD1-ND2 2.6Å; K217-N221 WeakPolarHBondContact CD-OD1 3.5Å; K217-N221 PolarHBondContact NZ-O 3.11Å; S219-N221 WeakPolarHBondContact CB-OD1 3.4Å; S219-N221 PolarHBondContact O-N 2.89Å; S219-N221 PolarHBondContact OG-OD1 2.88Å
222	G	87.6	Confident	87.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	137.8	-172	-179.6	0	0	0	0	0	114	F153 D168 K217	F153-G222 VanDerWaalsContact CD1-CA 3.42Å; F153-G222 VanDerWaalsContact CE1-C 3.42Å; F153-G222 VanDerWaalsContact CE1-CA 3.47Å; F153-G222 VanDerWaalsContact CE1-O 3.28Å; F153-G222 WeakPolarHBondContact CE1-O 3.46Å; F153-G222 WeakPolarHBondContact O-CA 3.38Å; D168-G222 VanDerWaalsContact OD1-CA 3.25Å; D168-G222 WeakPolarHBondContact OD1-CA 3.49Å; K217-G222 WeakPolarHBondContact CG-O 3.48Å; K217-G222 PolarHBondContact N-O 3.24Å
223	F	89.3	Confident	87.4	Confident	7 Å²	7	40.2 Å²	40.2	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159.1	-175	-65.5	-75.5	0	0	0	111.8	F153 A167 D168 V170 F188 R214 K215 K217	F153-F223 AromaticContact CD1-CD2 3.82Å; F153-F223 HydrophobicContact CD1-CD2 3.82Å; F153-F223 AromaticContact CD1-CE2 3.47Å; F153-F223 HydrophobicContact CD1-CE2 3.47Å; F153-F223 VanDerWaalsContact CD1-CE2 3.47Å; F153-F223 HydrophobicContact CD1-CG 4.49Å; F153-F223 AromaticContact CD1-CZ 3.85Å; F153-F223 HydrophobicContact CD1-CZ 3.85Å; F153-F223 HydrophobicContact CE1-CD1 4.28Å; F153-F223 HydrophobicContact CE1-CD2 4.07Å; F153-F223 HydrophobicContact CE1-CE1 4.04Å; F153-F223 AromaticContact CE1-CE2 3.82Å; F153-F223 HydrophobicContact CE1-CE2 3.82Å; F153-F223 HydrophobicContact CE1-CG 4.3Å; F153-F223 AromaticContact CE1-CZ 3.79Å; F153-F223 HydrophobicContact CE1-CZ 3.79Å; A167-F223 WeakPolarHBondContact CB-O 3.47Å; A167-F223 VanDerWaalsContact O-CB 3.3Å; A167-F223 WeakPolarHBondContact O-CB 3.41Å; D168-F223 PolarHBondContact OD1-N 2.92Å; V170-F223 HydrophobicContact CG2-CD2 3.72Å; V170-F223 HydrophobicContact CG2-CE2 3.53Å; V170-F223 HydrophobicContact CG2-CZ 4.44Å; F188-F223 HydrophobicContact CD1-CE1 4.16Å; F188-F223 HydrophobicContact CD2-CD1 4.34Å; F188-F223 AromaticContact CD2-CE1 3.78Å; F188-F223 HydrophobicContact CD2-CE1 3.78Å; F188-F223 HydrophobicContact CE1-CE1 4.3Å; F188-F223 AromaticContact CE2-CE1 3.94Å; F188-F223 HydrophobicContact CE2-CE1 3.94Å; F188-F223 AromaticContact CG-CE1 3.91Å; F188-F223 HydrophobicContact CG-CE1 3.91Å; F188-F223 HydrophobicContact CZ-CE1 4.19Å; R214-F223 HydrophobicContact CB-CB 4.37Å; R214-F223 HydrophobicContact CB-CD1 4.39Å; K215-F223 CarbonylContact O-C 3.56Å; K215-F223 VanDerWaalsContact O-CA 3.31Å; K215-F223 WeakPolarHBondContact O-CA 3.43Å; K217-F223 WeakPolarHBondContact CE-O 3.43Å
224	T	90.6	Very high	87.2	Confident	50 Å²	50	40.1 Å²	40.1	31%	0.307	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.9	169.5	-176.6	0	0	0	0	110.9	K215	K215-T224 HydrophobicContact CD-CG2 4.22Å; K215-T224 HydrophobicContact CG-CG2 3.73Å; K215-T224 PolarHBondContact N-O 3.14Å; K215-T224 PolarHBondContact O-N 2.87Å
225	F	90.6	Very high	87	Confident	35 Å²	35	42.2 Å²	42.2	15%	0.154	24%	0.237	C	C	.	.			trans	-72.1	160.7	165.8	-55.4	-57.7	0	0	0	110.3	A167 H209 R214	A167-F225 HydrophobicContact CB-CD2 3.9Å; A167-F225 HydrophobicContact CB-CE1 4.38Å; A167-F225 HydrophobicContact CB-CE2 3.61Å; A167-F225 HydrophobicContact CB-CG 4.4Å; A167-F225 HydrophobicContact CB-CZ 3.85Å; H209-F225 AromaticContact CD2-CZ 3.48Å; H209-F225 VanDerWaalsContact CD2-CZ 3.48Å; H209-F225 WeakPolarHBondContact CD2-CZ 3.4Å; H209-F225 AromaticContact NE2-CE2 3.93Å; H209-F225 AromaticContact NE2-CZ 3.8Å; R214-F225 HydrophobicContact CG-CD1 4.12Å; R214-F225 HydrophobicContact CG-CE1 3.88Å
226	F	87.4	Confident	86.8	Confident	50 Å²	50	43.6 Å²	43.6	22%	0.219	25%	0.253	C	S	.	.	S	Bend	trans	-84.5	-34.1	169.3	-57.6	-99.1	0	0	0	111.2	T187 K215 S230 L283	T187-F226 HydrophobicContact CG2-CE2 4.23Å; K215-F226 HydrophobicContact CB-CE1 4.18Å; K215-F226 HydrophobicContact CB-CE2 4.09Å; K215-F226 HydrophobicContact CB-CZ 3.67Å; K215-F226 HydrophobicContact CD-CD1 4.03Å; K215-F226 HydrophobicContact CD-CE1 3.62Å; K215-F226 HydrophobicContact CD-CZ 4.02Å; K215-F226 HydrophobicContact CG-CD1 4.42Å; K215-F226 HydrophobicContact CG-CE1 4.01Å; K215-F226 HydrophobicContact CG-CE2 4.23Å; K215-F226 HydrophobicContact CG-CZ 3.91Å; F226-S230 WeakPolarHBondContact CB-OG 3.06Å; F226-S230 PolarHBondContact N-OG 3.05Å; F226-L283 HydrophobicContact CB-CB 4.15Å; F226-L283 WeakPolarHBondContact CB-O 3.43Å; F226-L283 HydrophobicContact CD1-CB 3.93Å; F226-L283 HydrophobicContact CD1-CD1 3.91Å; F226-L283 HydrophobicContact CD1-CD2 4.23Å; F226-L283 HydrophobicContact CD1-CG 4.24Å; F226-L283 HydrophobicContact CD2-CB 4.22Å; F226-L283 WeakPolarHBondContact CD2-O 3.32Å; F226-L283 HydrophobicContact CE1-CB 4.31Å; F226-L283 HydrophobicContact CE1-CD1 4.09Å; F226-L283 HydrophobicContact CE1-CD2 3.76Å; F226-L283 HydrophobicContact CE1-CG 4.27Å; F226-L283 HydrophobicContact CE2-CD2 4.5Å; F226-L283 HydrophobicContact CG-CB 3.87Å; F226-L283 HydrophobicContact CZ-CD2 3.91Å
227	S	88.3	Confident	86.5	Confident	46 Å²	46	46.8 Å²	46.8	32%	0.322	28%	0.277	S	S	.	.	S	Bend	trans	-158.8	-179.8	169.8	72.1	0	0	0	0	111.2	L229 S230 V284	S227-L229 PolarHBondContact O-N 2.91Å; S227-L229 PolarHBondContact OG-N 2.92Å; S227-S230 PolarHBondContact N-OG 3.44Å; S227-S230 VanDerWaalsContact N-OG 3.08Å; S227-S230 WeakPolarHBondContact O-CB 3.3Å; S227-S230 PolarHBondContact O-N 2.92Å; S227-S230 VanDerWaalsContact O-N 3.09Å; S227-S230 PolarHBondContact O-OG 3.15Å; S227-V284 WeakPolarHBondContact OG-CG1 3.04Å
228	S	84.3	Confident	86.3	Confident	96 Å²	96	46.5 Å²	46.5	67%	0.671	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-11.1	168.3	51.2	0	0	0	0	114.5
229	L	86.3	Confident	86.3	Confident	74 Å²	74	42.9 Å²	42.9	39%	0.387	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-2	173.5	-61.1	179.2	0	0	0	113.2	S227 H231 V284 I285 M419	S227-L229 PolarHBondContact O-N 2.91Å; S227-L229 PolarHBondContact OG-N 2.92Å; L229-H231 PolarHBondContact O-N 3.43Å; L229-V284 HydrophobicContact CB-CB 3.93Å; L229-V284 HydrophobicContact CB-CG1 3.96Å; L229-I285 PolarHBondContact O-N 3.24Å; L229-M419 HydrophobicContact CD1-CE 4.42Å; L229-M419 HydrophobicContact CD2-CE 4.41Å
230	S	90.1	Very high	86.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-78.9	6	175.7	-52.7	0	0	0	0	113.7	S212 Q213 F226 S227 L283	S212-S230 CarbonylContact C-O 3.5Å; S212-S230 WeakPolarHBondContact CA-O 3.37Å; Q213-S230 PolarHBondContact N-O 2.84Å; F226-S230 WeakPolarHBondContact CB-OG 3.06Å; F226-S230 PolarHBondContact N-OG 3.05Å; S227-S230 PolarHBondContact N-OG 3.44Å; S227-S230 VanDerWaalsContact N-OG 3.08Å; S227-S230 WeakPolarHBondContact O-CB 3.3Å; S227-S230 PolarHBondContact O-N 2.92Å; S227-S230 VanDerWaalsContact O-N 3.09Å; S227-S230 PolarHBondContact O-OG 3.15Å; S230-L283 PolarHBondContact OG-O 3.36Å
231	H	90.8	Very high	86.1	Confident	42 Å²	42	44.6 Å²	44.6	19%	0.194	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	160.9	173.1	60.8	-115.5	0	0	0	112.4	H209 I211 L229	H209-H231 HydrophobicContact CB-CB 4.05Å; H209-H231 AromaticContact CE1-CD2 3.41Å; H209-H231 PolarHBondContact CE1-CD2 2.95Å; H209-H231 VanDerWaalsContact CE1-CD2 3.41Å; H209-H231 AromaticContact CE1-CE1 3.34Å; H209-H231 PolarHBondContact CE1-CE1 3.28Å; H209-H231 AromaticContact CE1-CG 3.53Å; H209-H231 AromaticContact CE1-ND1 3.48Å; H209-H231 PolarHBondContact CE1-ND1 3.19Å; H209-H231 AromaticContact CE1-NE2 3.31Å; H209-H231 PolarHBondContact CE1-NE2 2.91Å; H209-H231 VanDerWaalsContact CE1-NE2 3.31Å; H209-H231 AromaticContact CG-CG 3.84Å; H209-H231 AromaticContact ND1-CD2 3.39Å; H209-H231 PolarHBondContact ND1-CD2 2.03Å; H209-H231 AromaticContact ND1-CG 3.46Å; H209-H231 AromaticContact ND1-ND1 3.88Å; H209-H231 AromaticContact ND1-NE2 3.8Å; H209-H231 AromaticContact NE2-CE1 3.63Å; H209-H231 AromaticContact NE2-CG 3.93Å; H209-H231 AromaticContact NE2-ND1 3.55Å; I211-H231 CarbonylContact O-C 3.52Å; I211-H231 VanDerWaalsContact O-CA 3.3Å; I211-H231 WeakPolarHBondContact O-CA 3.28Å; L229-H231 PolarHBondContact O-N 3.43Å
232	M	90.2	Very high	86.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	136.8	170	-70.7	172.2	51.5	0	0	109.8	T210 I211 I285 Y288 F389 R421	T210-M232 WeakPolarHBondContact CB-O 3.44Å; I211-M232 HydrophobicContact CG2-CB 3.78Å; I211-M232 PolarHBondContact N-O 3.21Å; I211-M232 PolarHBondContact O-N 3.03Å; M232-I285 HydrophobicContact CG-CB 4.35Å; M232-I285 HydrophobicContact CG-CG2 4.27Å; M232-I285 HydrophobicContact SD-CB 4.07Å; M232-I285 HydrophobicContact SD-CG2 3.43Å; M232-I285 WeakPolarHBondContact SD-CG2 3.44Å; M232-Y288 HydrophobicContact CE-CD1 4.47Å; M232-Y288 HydrophobicContact CE-CD2 4.41Å; M232-Y288 HydrophobicContact CE-CG 4.28Å; M232-Y288 HydrophobicContact SD-CD2 4.31Å; M232-Y288 HydrophobicContact SD-CG 4.36Å; M232-F389 HydrophobicContact CB-CD1 3.75Å; M232-F389 HydrophobicContact CB-CE1 4.04Å; M232-F389 HydrophobicContact CE-CB 3.62Å; M232-F389 HydrophobicContact CE-CD1 3.9Å; M232-F389 HydrophobicContact CE-CD2 3.89Å; M232-F389 HydrophobicContact CE-CG 3.54Å; M232-R421 HydrophobicContact CE-CG 4.38Å; M232-R421 HydrophobicContact SD-CG 4.29Å; M232-R421 VanDerWaalsContact SD-CZ 3.54Å; M232-R421 PolarHBondContact SD-NE 3.39Å; M232-R421 VanDerWaalsContact SD-NE 3.39Å
233	D	89.3	Confident	86.3	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	26%	0.261	C	S	.	.			trans	-117	153.4	-177.5	-61.7	-17.1	0	0	0	111.5	R207 H209 F389 T390	R207-D233 IonicContact CZ-OD2 3.17Å; R207-D233 IonicContact NE-OD2 2.8Å; R207-D233 PolarHBondContact NE-OD2 2.69Å; R207-D233 IonicContact NH2-OD2 2.7Å; R207-D233 PolarHBondContact NH2-OD2 2.85Å; H209-D233 VanDerWaalsContact CA-OD1 3.29Å; H209-D233 WeakPolarHBondContact CA-OD1 3.02Å; H209-D233 IonicContact CE1-OD1 3.3Å; H209-D233 IonicContact CE1-OD2 3.77Å; H209-D233 IonicContact CG-OD1 3.89Å; H209-D233 IonicContact ND1-OD1 3.49Å; H209-D233 PolarHBondContact ND1-OD1 2.81Å; H209-D233 IonicContact ND1-OD2 2.65Å; H209-D233 PolarHBondContact ND1-OD2 2.72Å; D233-F389 WeakPolarHBondContact O-CA 3.14Å; D233-F389 WeakPolarHBondContact O-CD1 3.41Å; D233-T390 PolarHBondContact O-N 2.91Å; D233-T390 PolarHBondContact O-OG1 2.86Å
234	L	88.2	Confident	86.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-54.4	141.7	162.8	-70.1	175.5	0	0	0	110.6	E194 T210 Q239 Y242 L244 H388	E194-L234 HydrophobicContact CB-CD1 4.02Å; E194-L234 HydrophobicContact CG-CD1 3.91Å; T210-L234 HydrophobicContact CG2-CG 4.09Å; T210-L234 PolarHBondContact OG1-N 2.97Å; T210-L234 VanDerWaalsContact OG1-N 3.11Å; L234-Q239 HydrophobicContact CB-CG 4.02Å; L234-Q239 PolarHBondContact O-NE2 3.08Å; L234-Y242 HydrophobicContact CD1-CD1 4.23Å; L234-Y242 HydrophobicContact CD2-CD1 3.84Å; L234-Y242 HydrophobicContact CD2-CE1 4.3Å; L234-L244 HydrophobicContact CD2-CD2 4.25Å; L234-H388 CarbonylContact C-O 3.5Å; L234-H388 VanDerWaalsContact CA-O 3.27Å; L234-H388 WeakPolarHBondContact CA-O 3.48Å; L234-H388 HydrophobicContact CD2-CB 4.08Å
235	I	86.9	Confident	86.6	Confident	46 Å²	46	46 Å²	46	24%	0.236	26%	0.262	C	S	.	.			trans	-58.6	145.4	174	59.4	173.6	0	0	0	110.6	S237 L238 Q239 H388 T390	I235-S237 PolarHBondContact O-N 2.91Å; I235-L238 HydrophobicContact CD1-CD1 3.97Å; I235-L238 HydrophobicContact CD1-CG 4.02Å; I235-L238 HydrophobicContact CG1-CB 3.98Å; I235-L238 HydrophobicContact CG1-CD1 3.76Å; I235-L238 HydrophobicContact CG1-CG 3.69Å; I235-L238 PolarHBondContact O-N 3.09Å; I235-Q239 PolarHBondContact O-N 2.94Å; I235-H388 PolarHBondContact N-O 2.81Å; I235-T390 HydrophobicContact CG2-CG2 4.13Å
236	P	84.5	Confident	86.9	Confident	102 Å²	102	44.8 Å²	44.8	66%	0.662	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.8	-171	-29.7	36.6	0	0	0	116.1	L238	P236-L238 VanDerWaalsContact C-N 3.33Å
237	S	81.3	Confident	87.2	Confident	84 Å²	84	43.3 Å²	43.3	59%	0.587	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-5.4	175.9	58.1	0	0	0	0	114.9	I235	I235-S237 PolarHBondContact O-N 2.91Å
238	L	83.3	Confident	87.6	Confident	17 Å²	17	43.5 Å²	43.5	9%	0.089	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-18.7	178.4	-72.3	-172.5	0	0	0	113	I235 P236 N241 Y242 H388	I235-L238 HydrophobicContact CD1-CD1 3.97Å; I235-L238 HydrophobicContact CD1-CG 4.02Å; I235-L238 HydrophobicContact CG1-CB 3.98Å; I235-L238 HydrophobicContact CG1-CD1 3.76Å; I235-L238 HydrophobicContact CG1-CG 3.69Å; I235-L238 PolarHBondContact O-N 3.09Å; P236-L238 VanDerWaalsContact C-N 3.33Å; L238-N241 PolarHBondContact O-N 2.79Å; L238-N241 VanDerWaalsContact O-N 3.08Å; L238-Y242 HydrophobicContact CB-CG 4.45Å; L238-Y242 HydrophobicContact CD1-CD2 4.04Å; L238-Y242 HydrophobicContact CD1-CE2 4.42Å; L238-Y242 HydrophobicContact CD1-CG 4.33Å; L238-Y242 HydrophobicContact CD2-CD2 4.13Å; L238-Y242 VanDerWaalsContact O-CB 3.27Å; L238-Y242 WeakPolarHBondContact O-CB 3.26Å; L238-Y242 PolarHBondContact O-N 2.89Å; L238-H388 HydrophobicContact CD1-CB 3.61Å
239	Q	82.1	Confident	88.1	Confident	77 Å²	77	39.5 Å²	39.5	36%	0.36	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	137.8	173.5	-65	174	1.5	0	0	110.7	L234 I235 N241	L234-Q239 HydrophobicContact CB-CG 4.02Å; L234-Q239 PolarHBondContact O-NE2 3.08Å; I235-Q239 PolarHBondContact O-N 2.94Å; Q239-N241 PolarHBondContact O-N 2.69Å; Q239-N241 PolarHBondContact O-ND2 3.16Å
240	G	75.4	Confident	88.5	Confident	44 Å²	44	36.4 Å²	36.4	45%	0.454	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	68	-13.6	-173	0	0	0	0	0	116.4	E194	E194-G240 PolarHBondContact OE1-N 3.02Å
241	N	79.9	Confident	88.7	Confident	124 Å²	124	40.2 Å²	40.2	66%	0.663	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.6	-15.1	-166.8	-68.1	-80.6	0	0	0	114.2	P196 L238 Q239	P196-N241 VanDerWaalsContact CG-C 3.45Å; P196-N241 WeakPolarHBondContact CG-O 3.43Å; L238-N241 PolarHBondContact O-N 2.79Å; L238-N241 VanDerWaalsContact O-N 3.08Å; Q239-N241 PolarHBondContact O-N 2.69Å; Q239-N241 PolarHBondContact O-ND2 3.16Å
242	Y	85.2	Confident	88.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-98.4	136.3	178.6	-169.8	-105.3	0	0	0	111.1	E194 P196 L234 L238 L244 Q262 Q263 Y387 H388	E194-Y242 VanDerWaalsContact CG-O 3.28Å; E194-Y242 WeakPolarHBondContact CG-O 3.49Å; P196-Y242 WeakPolarHBondContact CD-O 3.42Å; L234-Y242 HydrophobicContact CD1-CD1 4.23Å; L234-Y242 HydrophobicContact CD2-CD1 3.84Å; L234-Y242 HydrophobicContact CD2-CE1 4.3Å; L238-Y242 HydrophobicContact CB-CG 4.45Å; L238-Y242 HydrophobicContact CD1-CD2 4.04Å; L238-Y242 HydrophobicContact CD1-CE2 4.42Å; L238-Y242 HydrophobicContact CD1-CG 4.33Å; L238-Y242 HydrophobicContact CD2-CD2 4.13Å; L238-Y242 VanDerWaalsContact O-CB 3.27Å; L238-Y242 WeakPolarHBondContact O-CB 3.26Å; L238-Y242 PolarHBondContact O-N 2.89Å; Y242-L244 HydrophobicContact CD1-CB 3.92Å; Y242-L244 HydrophobicContact CE1-CB 4.03Å; Y242-Q262 HydrophobicContact CE1-CB 4.17Å; Y242-Q262 PolarHBondContact OH-OE1 3.31Å; Y242-Q263 HydrophobicContact CE2-CB 3.8Å; Y242-Q263 HydrophobicContact CE2-CG 4.12Å; Y242-Q263 VanDerWaalsContact CE2-OE1 3.28Å; Y242-Q263 PolarHBondContact OH-O 3.31Å; Y242-Y387 HydrophobicContact CE2-CE2 4.01Å; Y242-Y387 PolarHBondContact OH-OH 3.4Å; Y242-H388 HydrophobicContact CE1-CB 4.41Å
243	Y	89.4	Confident	88.7	Confident	29 Å²	29	41.2 Å²	41.2	11%	0.114	24%	0.239	C	C	.	.			trans	-89	114.9	173.5	-174.7	-80.7	0	0	0	109.5	I195 R245 V261 Q262 Y271 P354	I195-Y243 HydrophobicContact CG1-CE2 4.24Å; I195-Y243 HydrophobicContact CG2-CD2 4.25Å; I195-Y243 HydrophobicContact CG2-CE2 4.07Å; Y243-R245 HydrophobicContact CE1-CB 3.82Å; Y243-R245 WeakPolarHBondContact OH-CD 3.43Å; Y243-V261 HydrophobicContact CE1-CB 4.37Å; Y243-V261 HydrophobicContact CE1-CG1 4Å; Y243-Q262 WeakPolarHBondContact O-CA 3.05Å; Y243-Y271 HydrophobicContact CD1-CD1 4.26Å; Y243-Y271 HydrophobicContact CD1-CE1 4.31Å; Y243-Y271 HydrophobicContact CG-CE1 4.24Å; Y243-P354 HydrophobicContact CD1-CB 3.99Å; Y243-P354 HydrophobicContact CD2-CB 4.11Å; Y243-P354 HydrophobicContact CD2-CG 3.89Å; Y243-P354 HydrophobicContact CE1-CB 3.73Å; Y243-P354 HydrophobicContact CE2-CB 3.84Å; Y243-P354 HydrophobicContact CE2-CG 3.75Å; Y243-P354 HydrophobicContact CG-CB 4.19Å; Y243-P354 HydrophobicContact CG-CG 4.33Å
244	L	91.8	Very high	88.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	104.2	173.8	172.5	59.7	0	0	0	108.4	S193 E194 T210 L234 Y242 Y246 T260 Q262	S193-L244 CarbonylContact C-O 3.56Å; S193-L244 WeakPolarHBondContact CA-O 3.43Å; S193-L244 WeakPolarHBondContact CB-O 2.98Å; E194-L244 HydrophobicContact CB-CB 4.46Å; E194-L244 PolarHBondContact N-O 3.04Å; E194-L244 PolarHBondContact O-N 2.68Å; T210-L244 HydrophobicContact CG2-CD2 3.47Å; T210-L244 VanDerWaalsContact CG2-CD2 3.47Å; L234-L244 HydrophobicContact CD2-CD2 4.25Å; Y242-L244 HydrophobicContact CD1-CB 3.92Å; Y242-L244 HydrophobicContact CE1-CB 4.03Å; L244-Y246 HydrophobicContact CD1-CE2 4.42Å; L244-Y246 HydrophobicContact CD2-CE2 3.97Å; L244-Y246 HydrophobicContact CG-CD2 4.5Å; L244-Y246 HydrophobicContact CG-CE2 3.94Å; L244-T260 HydrophobicContact CD1-CG2 3.99Å; L244-Q262 HydrophobicContact CD1-CB 3.9Å; L244-Q262 HydrophobicContact CD1-CG 4.25Å
245	R	93.9	Very high	88.8	Confident	96 Å²	96	44.3 Å²	44.3	36%	0.362	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.9	178.5	-176.1	178.3	175.8	-165.9	-2.3	110.7	Y243 V247 T260 V261	Y243-R245 HydrophobicContact CE1-CB 3.82Å; Y243-R245 WeakPolarHBondContact OH-CD 3.43Å; R245-V247 HydrophobicContact CG-CG2 4.12Å; R245-T260 CarbonylContact O-C 3.56Å; R245-T260 VanDerWaalsContact O-CA 3.25Å; R245-T260 WeakPolarHBondContact O-CA 3.22Å; R245-V261 PolarHBondContact N-O 3.2Å; R245-V261 PolarHBondContact O-N 3.23Å
246	Y	95.6	Very high	89.2	Confident	8 Å²	8	42.1 Å²	42.1	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.5	168	-69.9	-93.6	0	0	0	108.8	N192 S193 T210 I211 L244 F258 T260	N192-Y246 WeakPolarHBondContact O-CD2 3.28Å; N192-Y246 VanDerWaalsContact O-CE2 3.26Å; N192-Y246 WeakPolarHBondContact O-CE2 3.34Å; S193-Y246 PolarHBondContact OG-N 3.08Å; T210-Y246 HydrophobicContact CG2-CE2 4.39Å; I211-Y246 HydrophobicContact CD1-CE1 4.49Å; L244-Y246 HydrophobicContact CD1-CE2 4.42Å; L244-Y246 HydrophobicContact CD2-CE2 3.97Å; L244-Y246 HydrophobicContact CG-CD2 4.5Å; L244-Y246 HydrophobicContact CG-CE2 3.94Å; Y246-F258 HydrophobicContact CD1-CB 4.04Å; Y246-F258 AromaticContact CD1-CD1 3.62Å; Y246-F258 HydrophobicContact CD1-CD1 3.62Å; Y246-F258 HydrophobicContact CD1-CE1 4.44Å; Y246-F258 HydrophobicContact CD1-CG 4.11Å; Y246-F258 HydrophobicContact CE1-CB 4.14Å; Y246-F258 HydrophobicContact CE1-CD1 4.06Å; Y246-F258 HydrophobicContact CE1-CG 4.21Å; Y246-T260 HydrophobicContact CD1-CG2 3.48Å; Y246-T260 VanDerWaalsContact CD1-CG2 3.48Å; Y246-T260 HydrophobicContact CE1-CG2 3.48Å; Y246-T260 VanDerWaalsContact CE1-CG2 3.48Å; Y246-T260 HydrophobicContact CG-CG2 4.05Å
247	V	94.8	Very high	89.8	Confident	19 Å²	19	37.3 Å²	37.3	12%	0.115	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-34.2	-171.4	177.6	0	0	0	0	112.5	R245 L259 V261 L315 Q316	R245-V247 HydrophobicContact CG-CG2 4.12Å; V247-L259 PolarHBondContact N-O 3.43Å; V247-V261 HydrophobicContact CG2-CG2 4.01Å; V247-L315 HydrophobicContact CB-CD2 4.05Å; V247-L315 HydrophobicContact CG1-CD2 3.88Å; V247-L315 HydrophobicContact CG1-CG 4.02Å; V247-Q316 WeakPolarHBondContact CG1-O 3.16Å
248	Y	95.8	Very high	90.6	Very high	50 Å²	50	33.3 Å²	33.3	20%	0.196	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	149.4	-179.6	-175.7	-119.5	0	0	0	110.3	Q177 F250 L259 A318 V320	Q177-Y248 VanDerWaalsContact OE1-CA 3.3Å; Y248-F250 AromaticContact CD1-CD1 3.6Å; Y248-F250 HydrophobicContact CD1-CD1 3.6Å; Y248-F250 HydrophobicContact CD1-CE1 4.2Å; Y248-F250 HydrophobicContact CE1-CB 3.95Å; Y248-F250 AromaticContact CE1-CD1 3.37Å; Y248-F250 HydrophobicContact CE1-CD1 3.37Å; Y248-F250 HydrophobicContact CE1-CE1 4.17Å; Y248-F250 AromaticContact CE1-CG 3.98Å; Y248-F250 HydrophobicContact CE1-CG 3.98Å; Y248-L259 HydrophobicContact CD1-CD1 4.08Å; Y248-L259 PolarHBondContact O-N 3.33Å; Y248-A318 HydrophobicContact CD1-CB 3.63Å; Y248-A318 HydrophobicContact CE1-CB 4.25Å; Y248-A318 WeakPolarHBondContact CE2-O 3.43Å; Y248-A318 HydrophobicContact CG-CB 3.99Å; Y248-V320 HydrophobicContact CE1-CG2 4.25Å; Y248-V320 PolarHBondContact OH-N 2.85Å
249	S	95.6	Very high	91.2	Very high	13 Å²	13	32.6 Å²	32.6	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	146.3	172.5	57.3	0	0	0	0	111.5	Y257 F258	S249-Y257 VanDerWaalsContact CA-O 3.3Å; S249-Y257 WeakPolarHBondContact CA-O 3.42Å; S249-F258 VanDerWaalsContact CB-CD1 3.47Å; S249-F258 VanDerWaalsContact CB-CE1 3.43Å
250	F	95.3	Very high	91.9	Very high	9 Å²	9	28.9 Å²	28.9	4%	0.039	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	160.1	-179.3	63.4	-87.7	0	0	0	112.6	Y248 Y257 L259 I275 V320 L342 L367	Y248-F250 AromaticContact CD1-CD1 3.6Å; Y248-F250 HydrophobicContact CD1-CD1 3.6Å; Y248-F250 HydrophobicContact CD1-CE1 4.2Å; Y248-F250 HydrophobicContact CE1-CB 3.95Å; Y248-F250 AromaticContact CE1-CD1 3.37Å; Y248-F250 HydrophobicContact CE1-CD1 3.37Å; Y248-F250 HydrophobicContact CE1-CE1 4.17Å; Y248-F250 AromaticContact CE1-CG 3.98Å; Y248-F250 HydrophobicContact CE1-CG 3.98Å; F250-Y257 AromaticContact CD2-CD2 3.79Å; F250-Y257 HydrophobicContact CD2-CD2 3.79Å; F250-Y257 HydrophobicContact CD2-CG 4.26Å; F250-Y257 HydrophobicContact CE1-CG 4.31Å; F250-Y257 HydrophobicContact CE2-CD1 4.43Å; F250-Y257 AromaticContact CE2-CD2 3.23Å; F250-Y257 HydrophobicContact CE2-CD2 3.23Å; F250-Y257 AromaticContact CE2-CE2 3.94Å; F250-Y257 HydrophobicContact CE2-CE2 3.94Å; F250-Y257 AromaticContact CE2-CG 3.53Å; F250-Y257 HydrophobicContact CE2-CG 3.53Å; F250-Y257 HydrophobicContact CZ-CD1 4.24Å; F250-Y257 AromaticContact CZ-CD2 3.82Å; F250-Y257 HydrophobicContact CZ-CD2 3.82Å; F250-Y257 AromaticContact CZ-CG 3.57Å; F250-Y257 HydrophobicContact CZ-CG 3.57Å; F250-Y257 PolarHBondContact N-O 3.18Å; F250-Y257 PolarHBondContact O-N 3.31Å; F250-L259 HydrophobicContact CE1-CG 4.49Å; F250-I275 HydrophobicContact CZ-CD1 4.35Å; F250-V320 HydrophobicContact CD1-CG2 3.97Å; F250-V320 HydrophobicContact CD2-CB 4.39Å; F250-V320 HydrophobicContact CD2-CG2 3.77Å; F250-V320 HydrophobicContact CE1-CG2 3.98Å; F250-V320 HydrophobicContact CE2-CG2 3.8Å; F250-V320 HydrophobicContact CG-CG2 3.85Å; F250-V320 HydrophobicContact CZ-CG2 3.89Å; F250-L342 HydrophobicContact CE1-CD1 4.28Å; F250-L367 HydrophobicContact CD2-CD1 4.44Å; F250-L367 HydrophobicContact CE2-CD1 3.57Å; F250-L367 HydrophobicContact CE2-CD2 4.18Å; F250-L367 HydrophobicContact CZ-CD1 4.25Å; F250-L367 HydrophobicContact CZ-CD2 4.07Å
251	H	93.6	Very high	92.8	Very high	79 Å²	79	26.9 Å²	26.9	37%	0.366	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.6	171.2	-170.3	-108.6	0	0	0	110.2	L179 V181 G253 F255 S280	L179-H251 HydrophobicContact CD2-CB 4.43Å; V181-H251 VanDerWaalsContact CG1-CD2 3.5Å; V181-H251 WeakPolarHBondContact CG1-CD2 3.47Å; V181-H251 HydrophobicContact CG2-CB 4.42Å; H251-G253 PolarHBondContact CE1-O 3.29Å; H251-G253 PolarHBondContact NE2-O 3Å; H251-F255 PolarHBondContact CD2-O 2.99Å; H251-S280 PolarHBondContact CD2-OG 2.77Å; H251-S280 VanDerWaalsContact NE2-CB 3.33Å; H251-S280 WeakPolarHBondContact NE2-CB 3.21Å; H251-S280 PolarHBondContact NE2-OG 3.43Å
252	S	93.1	Very high	93.3	Very high	11 Å²	11	21 Å²	21	8%	0.077	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	130	171.7	169.9	0	0	0	0	111.2	F255 D340 L367	S252-F255 PolarHBondContact N-O 3.07Å; S252-F255 PolarHBondContact O-N 2.91Å; S252-F255 VanDerWaalsContact O-N 3.13Å; S252-F255 VanDerWaalsContact O-O 3.12Å; S252-D340 WeakPolarHBondContact CB-OD2 3.18Å; S252-D340 PolarHBondContact OG-OD2 3.22Å; S252-L367 VanDerWaalsContact OG-CD1 3.29Å; S252-L367 WeakPolarHBondContact OG-CD1 3.32Å
253	G	88.4	Confident	93.5	Very high	54 Å²	54	22.3 Å²	22.3	56%	0.557	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	-135.1	-171.3	0	0	0	0	0	111.3	H251 F255	H251-G253 PolarHBondContact CE1-O 3.29Å; H251-G253 PolarHBondContact NE2-O 3Å; G253-F255 VanDerWaalsContact C-N 3.28Å
254	P	87.9	Confident	93.2	Very high	56 Å²	56	22.5 Å²	22.5	36%	0.364	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	13.3	175.6	38.8	-37	0	0	0	113.3	S280 C406	P254-S280 PolarHBondContact O-N 3.16Å; P254-S280 PolarHBondContact O-OG 3.02Å; P254-C406 HydrophobicContact CB-CB 4.08Å; P254-C406 HydrophobicContact CG-CB 4.48Å
255	F	92	Very high	92.5	Very high	12 Å²	12	26.1 Å²	26.1	5%	0.053	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	145.3	-171.2	-61.1	-74.1	0	0	0	113.2	H251 S252 G253 Y257 R277 M278 C406	H251-F255 PolarHBondContact CD2-O 2.99Å; S252-F255 PolarHBondContact N-O 3.07Å; S252-F255 PolarHBondContact O-N 2.91Å; S252-F255 VanDerWaalsContact O-N 3.13Å; S252-F255 VanDerWaalsContact O-O 3.12Å; G253-F255 VanDerWaalsContact C-N 3.28Å; F255-Y257 HydrophobicContact CB-CD2 4.26Å; F255-Y257 HydrophobicContact CB-CE1 4.45Å; F255-Y257 HydrophobicContact CB-CE2 3.46Å; F255-Y257 VanDerWaalsContact CB-CE2 3.46Å; F255-Y257 WeakPolarHBondContact CB-OH 3.41Å; F255-Y257 WeakPolarHBondContact CD2-OH 3.4Å; F255-R277 HydrophobicContact CB-CG 4.02Å; F255-R277 HydrophobicContact CD1-CG 3.65Å; F255-R277 HydrophobicContact CE1-CG 4.31Å; F255-R277 HydrophobicContact CG-CG 3.95Å; F255-M278 CarbonylContact C-O 3.6Å; F255-M278 VanDerWaalsContact CA-O 3.32Å; F255-M278 WeakPolarHBondContact CA-O 3.45Å; F255-C406 WeakPolarHBondContact CE1-SG 3.45Å
256	T	94.3	Very high	91.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.1	169.2	-67.2	0	0	0	0	109.8	L179 F189 F258 M278 S280	L179-T256 HydrophobicContact CD2-CG2 3.8Å; F189-T256 HydrophobicContact CB-CG2 4.25Å; F189-T256 HydrophobicContact CD1-CG2 3.7Å; F189-T256 HydrophobicContact CD2-CG2 4.31Å; F189-T256 HydrophobicContact CE1-CG2 4.02Å; F189-T256 HydrophobicContact CG-CG2 3.85Å; F189-T256 HydrophobicContact CZ-CG2 4.49Å; T256-F258 HydrophobicContact CG2-CD2 4.46Å; T256-F258 HydrophobicContact CG2-CE2 3.95Å; T256-M278 HydrophobicContact CG2-CE 4.39Å; T256-M278 PolarHBondContact N-O 3.49Å; T256-M278 PolarHBondContact O-N 3.24Å; T256-S280 PolarHBondContact N-OG 3.3Å; T256-S280 PolarHBondContact OG1-OG 3.37Å
257	Y	96.8	Very high	90.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.3	-174.7	-59.9	-93	0	0	0	112.5	S249 F250 F255 I275 V276 R277 N371	S249-Y257 VanDerWaalsContact CA-O 3.3Å; S249-Y257 WeakPolarHBondContact CA-O 3.42Å; F250-Y257 AromaticContact CD2-CD2 3.79Å; F250-Y257 HydrophobicContact CD2-CD2 3.79Å; F250-Y257 HydrophobicContact CD2-CG 4.26Å; F250-Y257 HydrophobicContact CE1-CG 4.31Å; F250-Y257 HydrophobicContact CE2-CD1 4.43Å; F250-Y257 AromaticContact CE2-CD2 3.23Å; F250-Y257 HydrophobicContact CE2-CD2 3.23Å; F250-Y257 AromaticContact CE2-CE2 3.94Å; F250-Y257 HydrophobicContact CE2-CE2 3.94Å; F250-Y257 AromaticContact CE2-CG 3.53Å; F250-Y257 HydrophobicContact CE2-CG 3.53Å; F250-Y257 HydrophobicContact CZ-CD1 4.24Å; F250-Y257 AromaticContact CZ-CD2 3.82Å; F250-Y257 HydrophobicContact CZ-CD2 3.82Å; F250-Y257 AromaticContact CZ-CG 3.57Å; F250-Y257 HydrophobicContact CZ-CG 3.57Å; F250-Y257 PolarHBondContact N-O 3.18Å; F250-Y257 PolarHBondContact O-N 3.31Å; F255-Y257 HydrophobicContact CB-CD2 4.26Å; F255-Y257 HydrophobicContact CB-CE1 4.45Å; F255-Y257 HydrophobicContact CB-CE2 3.46Å; F255-Y257 VanDerWaalsContact CB-CE2 3.46Å; F255-Y257 WeakPolarHBondContact CB-OH 3.41Å; F255-Y257 WeakPolarHBondContact CD2-OH 3.4Å; Y257-I275 HydrophobicContact CD1-CD1 3.84Å; Y257-I275 HydrophobicContact CD1-CG1 4.04Å; Y257-I275 HydrophobicContact CE1-CD1 4.43Å; Y257-V276 VanDerWaalsContact CA-O 3.27Å; Y257-V276 WeakPolarHBondContact CA-O 3.26Å; Y257-V276 WeakPolarHBondContact CD1-O 3.35Å; Y257-R277 HydrophobicContact CD1-CB 3.94Å; Y257-R277 HydrophobicContact CD1-CG 4.05Å; Y257-R277 HydrophobicContact CE1-CB 3.82Å; Y257-R277 HydrophobicContact CE1-CG 3.54Å; Y257-N371 PolarHBondContact OH-ND2 3.42Å; Y257-N371 PolarHBondContact OH-OD1 3.08Å
258	F	97.6	Very high	89.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.6	168	-72.3	-98	0	0	0	109.7	Q177 F189 I211 Y246 S249 T256 V276 M278	Q177-F258 HydrophobicContact CB-CD1 4.25Å; Q177-F258 HydrophobicContact CB-CE1 4Å; F189-F258 HydrophobicContact CB-CE2 3.99Å; F189-F258 HydrophobicContact CB-CZ 3.84Å; I211-F258 HydrophobicContact CD1-CD2 4.34Å; I211-F258 HydrophobicContact CD1-CE2 4.49Å; Y246-F258 HydrophobicContact CD1-CB 4.04Å; Y246-F258 AromaticContact CD1-CD1 3.62Å; Y246-F258 HydrophobicContact CD1-CD1 3.62Å; Y246-F258 HydrophobicContact CD1-CE1 4.44Å; Y246-F258 HydrophobicContact CD1-CG 4.11Å; Y246-F258 HydrophobicContact CE1-CB 4.14Å; Y246-F258 HydrophobicContact CE1-CD1 4.06Å; Y246-F258 HydrophobicContact CE1-CG 4.21Å; S249-F258 VanDerWaalsContact CB-CD1 3.47Å; S249-F258 VanDerWaalsContact CB-CE1 3.43Å; T256-F258 HydrophobicContact CG2-CD2 4.46Å; T256-F258 HydrophobicContact CG2-CE2 3.95Å; F258-V276 HydrophobicContact CB-CB 4.16Å; F258-V276 HydrophobicContact CB-CG2 4.49Å; F258-V276 PolarHBondContact N-O 2.91Å; F258-V276 PolarHBondContact O-N 2.99Å; F258-M278 HydrophobicContact CD2-CE 3.83Å; F258-M278 HydrophobicContact CE2-CE 3.7Å
259	L	97	Very high	88.2	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.3	170.9	-61.8	178.4	0	0	0	109.5	V247 Y248 F250 I275 L293 L315 A318 L342	V247-L259 PolarHBondContact N-O 3.43Å; Y248-L259 HydrophobicContact CD1-CD1 4.08Å; Y248-L259 PolarHBondContact O-N 3.33Å; F250-L259 HydrophobicContact CE1-CG 4.49Å; L259-I275 HydrophobicContact CD2-CB 3.59Å; L259-I275 HydrophobicContact CD2-CD1 3.89Å; L259-I275 HydrophobicContact CD2-CG1 3.67Å; L259-L293 HydrophobicContact CD2-CD1 4.46Å; L259-L315 HydrophobicContact CB-CD2 3.47Å; L259-L315 VanDerWaalsContact CB-CD2 3.47Å; L259-L315 HydrophobicContact CD1-CD2 3.6Å; L259-L315 HydrophobicContact CG-CD2 4.12Å; L259-A318 HydrophobicContact CD1-CB 3.46Å; L259-A318 VanDerWaalsContact CD1-CB 3.46Å; L259-L342 HydrophobicContact CD1-CD1 4.06Å; L259-L342 HydrophobicContact CD1-CD2 4.28Å; L259-L342 HydrophobicContact CD2-CD2 4.33Å
260	T	95.9	Very high	87.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.9	-175	58.9	0	0	0	0	112	L244 R245 Y246 Q262 T273 R274 V276	L244-T260 HydrophobicContact CD1-CG2 3.99Å; R245-T260 CarbonylContact O-C 3.56Å; R245-T260 VanDerWaalsContact O-CA 3.25Å; R245-T260 WeakPolarHBondContact O-CA 3.22Å; Y246-T260 HydrophobicContact CD1-CG2 3.48Å; Y246-T260 VanDerWaalsContact CD1-CG2 3.48Å; Y246-T260 HydrophobicContact CE1-CG2 3.48Å; Y246-T260 VanDerWaalsContact CE1-CG2 3.48Å; Y246-T260 HydrophobicContact CG-CG2 4.05Å; T260-Q262 PolarHBondContact OG1-NE2 3.26Å; T260-T273 CarbonylContact O-C 3.53Å; T260-T273 VanDerWaalsContact O-CA 3.25Å; T260-T273 WeakPolarHBondContact O-CA 3.23Å; T260-R274 PolarHBondContact N-O 2.63Å; T260-R274 PolarHBondContact O-N 2.84Å; T260-V276 HydrophobicContact CG2-CG2 4.32Å
261	V	94.5	Very high	87.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.3	166	177.4	0	0	0	0	108	Y243 R245 V247 H272 I314 L315	Y243-V261 HydrophobicContact CE1-CB 4.37Å; Y243-V261 HydrophobicContact CE1-CG1 4Å; R245-V261 PolarHBondContact N-O 3.2Å; R245-V261 PolarHBondContact O-N 3.23Å; V247-V261 HydrophobicContact CG2-CG2 4.01Å; V261-H272 WeakPolarHBondContact CA-O 3.4Å; V261-I314 HydrophobicContact CG1-CD1 4.21Å; V261-I314 HydrophobicContact CG1-CG2 4.12Å; V261-I314 HydrophobicContact CG2-CG2 4.37Å; V261-L315 HydrophobicContact CG2-CB 4.06Å
262	Q	91.8	Very high	87.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	176	-173.1	48.7	172.1	-42	0	0	111.6	Y242 Y243 L244 T260 Y271 H272 R274 E290	Y242-Q262 HydrophobicContact CE1-CB 4.17Å; Y242-Q262 PolarHBondContact OH-OE1 3.31Å; Y243-Q262 WeakPolarHBondContact O-CA 3.05Å; L244-Q262 HydrophobicContact CD1-CB 3.9Å; L244-Q262 HydrophobicContact CD1-CG 4.25Å; T260-Q262 PolarHBondContact OG1-NE2 3.26Å; Q262-Y271 WeakPolarHBondContact O-CA 3.32Å; Q262-H272 PolarHBondContact N-O 3.01Å; Q262-H272 VanDerWaalsContact N-O 3.08Å; Q262-H272 PolarHBondContact O-CE1 3.36Å; Q262-H272 PolarHBondContact O-N 2.93Å; Q262-H272 PolarHBondContact O-ND1 3.04Å; Q262-R274 HydrophobicContact CG-CG 4.41Å; Q262-E290 PolarHBondContact NE2-OE2 3.25Å
263	Q	88.3	Confident	87.4	Confident	29 Å²	29	39.7 Å²	39.7	14%	0.136	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	142.2	179.8	-68	174.3	-13.6	0	0	111.9	Y242 A270 Y271 H272 R274 Y387	Y242-Q263 HydrophobicContact CE2-CB 3.8Å; Y242-Q263 HydrophobicContact CE2-CG 4.12Å; Y242-Q263 VanDerWaalsContact CE2-OE1 3.28Å; Y242-Q263 PolarHBondContact OH-O 3.31Å; Q263-A270 WeakPolarHBondContact CA-O 3.47Å; Q263-Y271 HydrophobicContact CG-CD1 3.83Å; Q263-Y271 HydrophobicContact CG-CE1 3.33Å; Q263-Y271 PolarHBondContact NE2-OH 3.03Å; Q263-H272 PolarHBondContact O-CE1 2.92Å; Q263-R274 PolarHBondContact O-NH2 2.93Å; Q263-Y387 PolarHBondContact O-OH 3.14Å
264	V	83.5	Confident	87.6	Confident	33 Å²	33	37.2 Å²	37.2	20%	0.2	20%	0.197	C	C	.	.	S	Bend	trans	-56.5	-64.5	176.8	174.3	0	0	0	0	109.8	A270 H272 R274 F427	V264-A270 HydrophobicContact CB-CB 4.29Å; V264-A270 HydrophobicContact CG2-CB 3.82Å; V264-A270 PolarHBondContact N-O 2.79Å; V264-H272 WeakPolarHBondContact CA-CE1 3.43Å; V264-H272 WeakPolarHBondContact CA-ND1 3.29Å; V264-H272 HydrophobicContact CG2-CB 4.19Å; V264-H272 VanDerWaalsContact CG2-ND1 3.34Å; V264-H272 WeakPolarHBondContact CG2-ND1 3.49Å; V264-H272 PolarHBondContact N-CE1 2.91Å; V264-H272 VanDerWaalsContact N-CE1 3.32Å; V264-H272 PolarHBondContact N-ND1 3.07Å; V264-R274 PolarHBondContact O-NH2 2.78Å; V264-F427 HydrophobicContact CG1-CZ 4.4Å
265	N	77.1	Confident	88	Confident	76 Å²	76	34.6 Å²	34.6	41%	0.406	18%	0.179	S	C	.	.	S	Bend	trans	-135	161.1	173.8	-72.5	-23.5	0	0	0	109.8	D267 T268	N265-D267 PolarHBondContact O-N 3.15Å; N265-D267 VanDerWaalsContact O-N 3.12Å; N265-T268 PolarHBondContact N-OG1 3.12Å; N265-T268 VanDerWaalsContact N-OG1 3.13Å; N265-T268 PolarHBondContact O-N 3.38Å; N265-T268 VanDerWaalsContact O-N 3.12Å; N265-T268 PolarHBondContact O-OG1 3.44Å
266	K	70.3	Confident	88.2	Confident	138 Å²	138	34 Å²	34	60%	0.6	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-37.1	176.8	-174.2	-172.6	176	-170	0	113.9	Y387	K266-Y387 HydrophobicContact CB-CD2 4.15Å; K266-Y387 HydrophobicContact CB-CE2 4.01Å
267	D	69.9	Low	88.1	Confident	147 Å²	147	34.2 Å²	34.2	79%	0.786	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	7.7	-172.1	-42.7	-69.8	0	0	0	113.2	N265	N265-D267 PolarHBondContact O-N 3.15Å; N265-D267 VanDerWaalsContact O-N 3.12Å
268	T	75.3	Confident	87.9	Confident	54 Å²	54	34.4 Å²	34.4	33%	0.331	18%	0.179	S	C	.	.			trans	-127.2	130.2	-174.9	58	0	0	0	0	112.4	N265 A270	N265-T268 PolarHBondContact N-OG1 3.12Å; N265-T268 VanDerWaalsContact N-OG1 3.13Å; N265-T268 PolarHBondContact O-N 3.38Å; N265-T268 VanDerWaalsContact O-N 3.12Å; N265-T268 PolarHBondContact O-OG1 3.44Å; T268-A270 PolarHBondContact O-N 3.49Å
269	Q	74.6	Confident	87.5	Confident	150 Å²	150	34.5 Å²	34.5	70%	0.701	18%	0.179	S	C	*	.			trans	-77.1	24.3	170.1	-63.5	179.7	-14.8	0	0	112.8	Y271 G352	Q269-Y271 WeakPolarHBondContact O-CD2 3.42Å; Q269-Y271 VanDerWaalsContact O-CE2 3.27Å; Q269-Y271 WeakPolarHBondContact O-CE2 3.23Å; Q269-G352 CarbonylContact O-C 3.53Å; Q269-G352 VanDerWaalsContact O-C 3.31Å; Q269-G352 VanDerWaalsContact O-CA 3.26Å; Q269-G352 WeakPolarHBondContact O-CA 3.37Å
270	A	84.7	Confident	87.1	Confident	47 Å²	47	34.9 Å²	34.9	39%	0.388	18%	0.182	S	C	.	.			trans	-95.5	135.9	178.9	0	0	0	0	0	109.9	Q263 V264 T268	Q263-A270 WeakPolarHBondContact CA-O 3.47Å; V264-A270 HydrophobicContact CB-CB 4.29Å; V264-A270 HydrophobicContact CG2-CB 3.82Å; V264-A270 PolarHBondContact N-O 2.79Å; T268-A270 PolarHBondContact O-N 3.49Å
271	Y	90.1	Very high	86.5	Confident	31 Å²	31	36.4 Å²	36.4	12%	0.122	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145	-178.6	-60.4	-88.9	0	0	0	110.5	Y243 Q262 Q263 Q269 N313 S353 P354	Y243-Y271 HydrophobicContact CD1-CD1 4.26Å; Y243-Y271 HydrophobicContact CD1-CE1 4.31Å; Y243-Y271 HydrophobicContact CG-CE1 4.24Å; Q262-Y271 WeakPolarHBondContact O-CA 3.32Å; Q263-Y271 HydrophobicContact CG-CD1 3.83Å; Q263-Y271 HydrophobicContact CG-CE1 3.33Å; Q263-Y271 PolarHBondContact NE2-OH 3.03Å; Q269-Y271 WeakPolarHBondContact O-CD2 3.42Å; Q269-Y271 VanDerWaalsContact O-CE2 3.27Å; Q269-Y271 WeakPolarHBondContact O-CE2 3.23Å; Y271-N313 PolarHBondContact O-ND2 2.85Å; Y271-S353 WeakPolarHBondContact CD2-O 3.13Å; Y271-P354 HydrophobicContact CD1-CB 3.87Å; Y271-P354 HydrophobicContact CD2-CB 4.18Å; Y271-P354 HydrophobicContact CE1-CB 4.07Å; Y271-P354 HydrophobicContact CE1-CG 4.43Å; Y271-P354 HydrophobicContact CE2-CB 4.38Å; Y271-P354 HydrophobicContact CE2-CG 4.5Å; Y271-P354 HydrophobicContact CG-CB 3.92Å
272	H	90.7	Very high	86.1	Confident	3 Å²	3	36.5 Å²	36.5	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	173.9	179.9	70.5	-56.4	0	0	0	110.1	V261 Q262 Q263 V264 R274 N313 F427	V261-H272 WeakPolarHBondContact CA-O 3.4Å; Q262-H272 PolarHBondContact N-O 3.01Å; Q262-H272 VanDerWaalsContact N-O 3.08Å; Q262-H272 PolarHBondContact O-CE1 3.36Å; Q262-H272 PolarHBondContact O-N 2.93Å; Q262-H272 PolarHBondContact O-ND1 3.04Å; Q263-H272 PolarHBondContact O-CE1 2.92Å; V264-H272 WeakPolarHBondContact CA-CE1 3.43Å; V264-H272 WeakPolarHBondContact CA-ND1 3.29Å; V264-H272 HydrophobicContact CG2-CB 4.19Å; V264-H272 VanDerWaalsContact CG2-ND1 3.34Å; V264-H272 WeakPolarHBondContact CG2-ND1 3.49Å; V264-H272 PolarHBondContact N-CE1 2.91Å; V264-H272 VanDerWaalsContact N-CE1 3.32Å; V264-H272 PolarHBondContact N-ND1 3.07Å; H272-R274 PolarHBondContact CE1-NE 3.2Å; H272-R274 PolarHBondContact CE1-NH2 3.24Å; H272-R274 WeakPolarHBondContact NE2-CD 3.02Å; H272-R274 WeakPolarHBondContact NE2-CG 2.97Å; H272-R274 PolarHBondContact NE2-NE 2.9Å; H272-R274 PolarHBondContact NE2-NH2 2.68Å; H272-R274 VanDerWaalsContact NE2-NH2 3.19Å; H272-N313 CarbonylContact C-O 3.54Å; H272-N313 WeakPolarHBondContact CA-O 3.14Å; H272-F427 HydrophobicContact CB-CE1 4.25Å; H272-F427 AromaticContact CD2-CE1 3.86Å
273	T	93.9	Very high	85.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.9	177.8	-55.4	0	0	0	0	110.4	T260 P292 L293 N313 L315 F346	T260-T273 CarbonylContact O-C 3.53Å; T260-T273 VanDerWaalsContact O-CA 3.25Å; T260-T273 WeakPolarHBondContact O-CA 3.23Å; T273-P292 WeakPolarHBondContact O-CA 3.19Å; T273-L293 PolarHBondContact O-N 3.42Å; T273-N313 PolarHBondContact N-O 3.13Å; T273-N313 PolarHBondContact OG1-O 2.87Å; T273-L315 HydrophobicContact CG2-CB 3.76Å; T273-L315 HydrophobicContact CG2-CD2 4.11Å; T273-L315 HydrophobicContact CG2-CG 4.47Å; T273-L315 WeakPolarHBondContact OG1-CB 3.25Å; T273-L315 PolarHBondContact OG1-N 3.17Å; T273-F346 HydrophobicContact CG2-CE1 4.03Å
274	R	93.8	Very high	85.7	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.9	162.9	-59.6	-161.3	-178.7	106.8	15.4	111	T260 Q262 Q263 V264 H272 E290 M291 P292	T260-R274 PolarHBondContact N-O 2.63Å; T260-R274 PolarHBondContact O-N 2.84Å; Q262-R274 HydrophobicContact CG-CG 4.41Å; Q263-R274 PolarHBondContact O-NH2 2.93Å; V264-R274 PolarHBondContact O-NH2 2.78Å; H272-R274 PolarHBondContact CE1-NE 3.2Å; H272-R274 PolarHBondContact CE1-NH2 3.24Å; H272-R274 WeakPolarHBondContact NE2-CD 3.02Å; H272-R274 WeakPolarHBondContact NE2-CG 2.97Å; H272-R274 PolarHBondContact NE2-NE 2.9Å; H272-R274 PolarHBondContact NE2-NH2 2.68Å; H272-R274 VanDerWaalsContact NE2-NH2 3.19Å; R274-E290 HydrophobicContact CB-CB 4.48Å; R274-E290 WeakPolarHBondContact CD-OE1 3.25Å; R274-E290 IonicContact CZ-OE1 3.41Å; R274-E290 IonicContact NE-OE1 3.22Å; R274-E290 PolarHBondContact NE-OE1 3.15Å; R274-E290 IonicContact NH1-OE1 2.61Å; R274-E290 PolarHBondContact NH1-OE1 3.02Å; R274-E290 IonicContact NH1-OE2 3.5Å; R274-M291 CarbonylContact C-O 3.58Å; R274-M291 VanDerWaalsContact CA-O 3.27Å; R274-M291 WeakPolarHBondContact CA-O 3.29Å; R274-P292 HydrophobicContact CG-CB 4.32Å
275	I	95.7	Very high	85.9	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.3	160.3	-176.6	163.4	0	0	0	109.2	F250 Y257 L259 E290 M291 L293 L342 I370 F374	F250-I275 HydrophobicContact CZ-CD1 4.35Å; Y257-I275 HydrophobicContact CD1-CD1 3.84Å; Y257-I275 HydrophobicContact CD1-CG1 4.04Å; Y257-I275 HydrophobicContact CE1-CD1 4.43Å; L259-I275 HydrophobicContact CD2-CB 3.59Å; L259-I275 HydrophobicContact CD2-CD1 3.89Å; L259-I275 HydrophobicContact CD2-CG1 3.67Å; I275-E290 CarbonylContact O-C 3.59Å; I275-E290 VanDerWaalsContact O-CA 3.31Å; I275-E290 WeakPolarHBondContact O-CA 3.13Å; I275-M291 HydrophobicContact CG2-CB 4.22Å; I275-M291 HydrophobicContact CG2-CE 4.15Å; I275-M291 PolarHBondContact N-O 2.8Å; I275-M291 PolarHBondContact O-N 2.03Å; I275-L293 HydrophobicContact CB-CD1 3.83Å; I275-L293 HydrophobicContact CB-CG 4.32Å; I275-L293 HydrophobicContact CG2-CD1 3.77Å; I275-L293 HydrophobicContact CG2-CD2 3.88Å; I275-L293 HydrophobicContact CG2-CG 3.85Å; I275-L342 HydrophobicContact CD1-CD2 4.17Å; I275-I370 HydrophobicContact CD1-CD1 4.5Å; I275-I370 HydrophobicContact CD1-CG2 4.21Å; I275-F374 HydrophobicContact CG2-CE2 4.35Å; I275-F374 HydrophobicContact CG2-CZ 4.02Å
276	V	95.6	Very high	86.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.7	172.4	-178.3	0	0	0	0	108.3	Y257 F258 T260 Y288 V289 E290	Y257-V276 VanDerWaalsContact CA-O 3.27Å; Y257-V276 WeakPolarHBondContact CA-O 3.26Å; Y257-V276 WeakPolarHBondContact CD1-O 3.35Å; F258-V276 HydrophobicContact CB-CB 4.16Å; F258-V276 HydrophobicContact CB-CG2 4.49Å; F258-V276 PolarHBondContact N-O 2.91Å; F258-V276 PolarHBondContact O-N 2.99Å; T260-V276 HydrophobicContact CG2-CG2 4.32Å; V276-Y288 HydrophobicContact CG1-CD2 3.94Å; V276-Y288 HydrophobicContact CG1-CE2 3.34Å; V276-Y288 WeakPolarHBondContact CG2-OH 3.3Å; V276-V289 CarbonylContact C-O 3.52Å; V276-V289 WeakPolarHBondContact CA-O 3.47Å; V276-E290 HydrophobicContact CG2-CB 4.15Å
277	R	93.8	Very high	86.9	Confident	4 Å²	4	32 Å²	32	2%	0.015	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.7	172.4	-176.1	-174.2	70.6	163.5	6.2	110.3	F255 Y257 V289 N371 F374	F255-R277 HydrophobicContact CB-CG 4.02Å; F255-R277 HydrophobicContact CD1-CG 3.65Å; F255-R277 HydrophobicContact CE1-CG 4.31Å; F255-R277 HydrophobicContact CG-CG 3.95Å; Y257-R277 HydrophobicContact CD1-CB 3.94Å; Y257-R277 HydrophobicContact CD1-CG 4.05Å; Y257-R277 HydrophobicContact CE1-CB 3.82Å; Y257-R277 HydrophobicContact CE1-CG 3.54Å; R277-V289 HydrophobicContact CB-CG1 4.08Å; R277-V289 PolarHBondContact N-O 3.4Å; R277-V289 PolarHBondContact O-N 3.22Å; R277-V289 VanDerWaalsContact O-N 3.1Å; R277-N371 WeakPolarHBondContact CD-OD1 3.5Å; R277-N371 PolarHBondContact NH1-OD1 2.94Å; R277-F374 HydrophobicContact CB-CE2 3.89Å; R277-F374 HydrophobicContact CB-CZ 3.88Å
278	M	91.6	Very high	87.9	Confident	5 Å²	5	25 Å²	25	3%	0.025	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.8	172	-61.1	175.7	-67.8	0	0	109.5	F189 I211 F255 T256 F258 I285 Y288	F189-M278 HydrophobicContact CD1-CE 3.76Å; F189-M278 HydrophobicContact CE1-CE 4.12Å; I211-M278 HydrophobicContact CD1-CE 3.73Å; I211-M278 HydrophobicContact CD1-SD 3.95Å; F255-M278 CarbonylContact C-O 3.6Å; F255-M278 VanDerWaalsContact CA-O 3.32Å; F255-M278 WeakPolarHBondContact CA-O 3.45Å; T256-M278 HydrophobicContact CG2-CE 4.39Å; T256-M278 PolarHBondContact N-O 3.49Å; T256-M278 PolarHBondContact O-N 3.24Å; F258-M278 HydrophobicContact CD2-CE 3.83Å; F258-M278 HydrophobicContact CE2-CE 3.7Å; M278-I285 HydrophobicContact SD-CG2 3.89Å; M278-Y288 HydrophobicContact CG-CD2 4.23Å; M278-Y288 HydrophobicContact SD-CD2 4.2Å
279	C	88.8	Confident	88.6	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.014	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	140.6	167.1	-68.4	0	0	0	0	110.3	D282 R287 C406	C279-D282 HydrophobicContact CB-CB 3.92Å; C279-D282 VanDerWaalsContact CB-CG 3.41Å; C279-R287 VanDerWaalsContact SG-CD 3.55Å; C279-C406 WeakPolarHBondContact CA-SG 3.46Å; C279-C406 HydrophobicContact CB-CB 3.65Å; C279-C406 WeakPolarHBondContact CB-SG 3.47Å; C279-C406 WeakPolarHBondContact SG-CB 3.2Å; C279-C406 CovalentContact SG-SG 2.03Å; C279-C406 PolarHBondContact SG-SG 2.96Å
280	S	88.8	Confident	89.4	Confident	9 Å²	9	15.3 Å²	15.3	6%	0.063	8%	0.084	C	C	.	.	S	Bend	trans	-79.9	-26.7	176.4	-59.2	0	0	0	0	113.3	H251 P254 T256	H251-S280 PolarHBondContact CD2-OG 2.77Å; H251-S280 VanDerWaalsContact NE2-CB 3.33Å; H251-S280 WeakPolarHBondContact NE2-CB 3.21Å; H251-S280 PolarHBondContact NE2-OG 3.43Å; P254-S280 PolarHBondContact O-N 3.16Å; P254-S280 PolarHBondContact O-OG 3.02Å; T256-S280 PolarHBondContact N-OG 3.3Å; T256-S280 PolarHBondContact OG1-OG 3.37Å
281	S	84.6	Confident	89.8	Confident	32 Å²	32	13 Å²	13	22%	0.224	7%	0.066	C	C	.	.	S	Bend	trans	-79.7	-13.4	177.3	42.2	0	0	0	0	113.9	L283 C406	S281-L283 PolarHBondContact O-N 3.18Å; S281-C406 PolarHBondContact OG-O 3.15Å
282	D	85	Confident	89.9	Confident	4 Å²	4	11.8 Å²	11.8	2%	0.021	6%	0.061	C	C	.	.			trans	-78.6	119.2	-178.3	-80.3	7.7	0	0	0	111.4	Q213 C279 V284 R286	Q213-D282 PolarHBondContact NE2-O 3.02Å; C279-D282 HydrophobicContact CB-CB 3.92Å; C279-D282 VanDerWaalsContact CB-CG 3.41Å; D282-V284 PolarHBondContact O-N 3.27Å; D282-R286 HydrophobicContact CB-CG 4.47Å; D282-R286 IonicContact OD1-CZ 3.05Å; D282-R286 VanDerWaalsContact OD1-CZ 3.24Å; D282-R286 IonicContact OD1-NE 2.63Å; D282-R286 PolarHBondContact OD1-NE 3.18Å; D282-R286 IonicContact OD1-NH2 3.81Å; D282-R286 PolarHBondContact OD1-NH2 3.06Å; D282-R286 WeakPolarHBondContact OD2-CG 3.49Å; D282-R286 IonicContact OD2-CZ 3.66Å; D282-R286 IonicContact OD2-NE 2.69Å; D282-R286 PolarHBondContact OD2-NE 3.1Å
283	L	84.7	Confident	89.9	Confident	80 Å²	80	11.8 Å²	11.8	42%	0.419	6%	0.061	S	C	.	.	S	Bend	trans	-76.6	-1.9	176.2	-50.5	-175.2	0	0	0	113.9	F226 S230 S281	F226-L283 HydrophobicContact CB-CB 4.15Å; F226-L283 WeakPolarHBondContact CB-O 3.43Å; F226-L283 HydrophobicContact CD1-CB 3.93Å; F226-L283 HydrophobicContact CD1-CD1 3.91Å; F226-L283 HydrophobicContact CD1-CD2 4.23Å; F226-L283 HydrophobicContact CD1-CG 4.24Å; F226-L283 HydrophobicContact CD2-CB 4.22Å; F226-L283 WeakPolarHBondContact CD2-O 3.32Å; F226-L283 HydrophobicContact CE1-CB 4.31Å; F226-L283 HydrophobicContact CE1-CD1 4.09Å; F226-L283 HydrophobicContact CE1-CD2 3.76Å; F226-L283 HydrophobicContact CE1-CG 4.27Å; F226-L283 HydrophobicContact CE2-CD2 4.5Å; F226-L283 HydrophobicContact CG-CB 3.87Å; F226-L283 HydrophobicContact CZ-CD2 3.91Å; S230-L283 PolarHBondContact OG-O 3.36Å; S281-L283 PolarHBondContact O-N 3.18Å
284	V	86.7	Confident	89.3	Confident	30 Å²	30	13.5 Å²	13.5	18%	0.182	7%	0.069	C	C	.	.	S	Bend	trans	-141.3	150	-178.6	-68	0	0	0	0	110.3	Q213 S227 L229 D282 R286	Q213-V284 VanDerWaalsContact OE1-N 3.17Å; S227-V284 WeakPolarHBondContact OG-CG1 3.04Å; L229-V284 HydrophobicContact CB-CB 3.93Å; L229-V284 HydrophobicContact CB-CG1 3.96Å; D282-V284 PolarHBondContact O-N 3.27Å; V284-R286 HydrophobicContact CG2-CB 4.03Å; V284-R286 HydrophobicContact CG2-CG 3.98Å; V284-R286 PolarHBondContact O-N 3.35Å
285	I	87.8	Confident	88.8	Confident	4 Å²	4	13.5 Å²	13.5	2%	0.021	7%	0.07	C	C	.	.	S	Bend	trans	-81.4	70.1	-178.9	-47.6	-178.2	0	0	0	109.4	I211 Q213 L229 M232 M278 Y288 R421	I211-I285 HydrophobicContact CG1-CD1 4.46Å; I211-I285 HydrophobicContact CG2-CD1 4.11Å; Q213-I285 HydrophobicContact CG-CD1 4.34Å; Q213-I285 HydrophobicContact CG-CG1 3.95Å; L229-I285 PolarHBondContact O-N 3.24Å; M232-I285 HydrophobicContact CG-CB 4.35Å; M232-I285 HydrophobicContact CG-CG2 4.27Å; M232-I285 HydrophobicContact SD-CB 4.07Å; M232-I285 HydrophobicContact SD-CG2 3.43Å; M232-I285 WeakPolarHBondContact SD-CG2 3.44Å; M278-I285 HydrophobicContact SD-CG2 3.89Å; I285-Y288 HydrophobicContact CG2-CD2 4.12Å; I285-R421 PolarHBondContact O-NE 2.8Å; I285-R421 PolarHBondContact O-NH2 3.01Å
286	R	82.6	Confident	88.1	Confident	53 Å²	53	14.3 Å²	14.3	20%	0.2	7%	0.074	C	C	.	.			trans	-98.1	-25.5	-178.1	63.1	175.7	-179.4	-170.9	5.4	114.1	D282 V284 E417 M419 Y420	D282-R286 HydrophobicContact CB-CG 4.47Å; D282-R286 IonicContact OD1-CZ 3.05Å; D282-R286 VanDerWaalsContact OD1-CZ 3.24Å; D282-R286 IonicContact OD1-NE 2.63Å; D282-R286 PolarHBondContact OD1-NE 3.18Å; D282-R286 IonicContact OD1-NH2 3.81Å; D282-R286 PolarHBondContact OD1-NH2 3.06Å; D282-R286 WeakPolarHBondContact OD2-CG 3.49Å; D282-R286 IonicContact OD2-CZ 3.66Å; D282-R286 IonicContact OD2-NE 2.69Å; D282-R286 PolarHBondContact OD2-NE 3.1Å; V284-R286 HydrophobicContact CG2-CB 4.03Å; V284-R286 HydrophobicContact CG2-CG 3.98Å; V284-R286 PolarHBondContact O-N 3.35Å; R286-E417 IonicContact CZ-OE2 2.68Å; R286-E417 IonicContact NH1-OE2 2.7Å; R286-E417 PolarHBondContact NH1-OE2 2.8Å; R286-E417 IonicContact NH2-OE2 2.86Å; R286-M419 HydrophobicContact CB-CB 4.38Å; R286-M419 HydrophobicContact CB-CG 4.01Å; R286-M419 HydrophobicContact CB-SD 4.36Å; R286-M419 CarbonylContact O-C 3.52Å; R286-M419 WeakPolarHBondContact O-CA 3.43Å; R286-Y420 CarbonylContact O-C 3.57Å; R286-Y420 PolarHBondContact O-N 2.85Å
287	R	85.9	Confident	87	Confident	13 Å²	13	15 Å²	15	5%	0.049	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	63.7	-178.2	-75.8	171.5	166.2	174	-11.4	110.7	C279 S403 D404 G418 Y420	C279-R287 VanDerWaalsContact SG-CD 3.55Å; R287-S403 PolarHBondContact NH1-O 3.13Å; R287-S403 PolarHBondContact NH2-O 3.35Å; R287-S403 PolarHBondContact NH2-OG 2.79Å; R287-D404 IonicContact CZ-OD1 3.94Å; R287-D404 IonicContact NE-OD1 2.73Å; R287-D404 PolarHBondContact NE-OD1 3.48Å; R287-D404 IonicContact NH2-OD1 3.96Å; R287-D404 PolarHBondContact NH2-OD1 2.81Å; R287-G418 VanDerWaalsContact CG-O 3.24Å; R287-G418 WeakPolarHBondContact CG-O 3.46Å; R287-G418 PolarHBondContact NE-O 2.71Å; R287-Y420 HydrophobicContact CB-CE2 4.12Å; R287-Y420 HydrophobicContact CG-CD1 4.49Å; R287-Y420 HydrophobicContact CG-CE1 3.9Å; R287-Y420 HydrophobicContact CG-CE2 4.3Å
288	Y	90.3	Very high	85.6	Confident	1 Å²	1	16.7 Å²	16.7	0%	0.004	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.3	178.7	-178	-82.6	0	0	0	109.8	I211 M232 V276 M278 I285 E290 F389 Y420 R421 L422	I211-Y288 HydrophobicContact CD1-CE2 4.25Å; M232-Y288 HydrophobicContact CE-CD1 4.47Å; M232-Y288 HydrophobicContact CE-CD2 4.41Å; M232-Y288 HydrophobicContact CE-CG 4.28Å; M232-Y288 HydrophobicContact SD-CD2 4.31Å; M232-Y288 HydrophobicContact SD-CG 4.36Å; V276-Y288 HydrophobicContact CG1-CD2 3.94Å; V276-Y288 HydrophobicContact CG1-CE2 3.34Å; V276-Y288 WeakPolarHBondContact CG2-OH 3.3Å; M278-Y288 HydrophobicContact CG-CD2 4.23Å; M278-Y288 HydrophobicContact SD-CD2 4.2Å; I285-Y288 HydrophobicContact CG2-CD2 4.12Å; Y288-E290 HydrophobicContact CE1-CB 4.04Å; Y288-E290 HydrophobicContact CE1-CG 3.96Å; Y288-E290 PolarHBondContact OH-OE2 2.62Å; Y288-F389 HydrophobicContact CE1-CE2 4.41Å; Y288-F389 HydrophobicContact CE2-CE2 4.44Å; Y288-F389 AromaticContact CZ-CE2 3.86Å; Y288-F389 WeakPolarHBondContact OH-CE2 3.33Å; Y288-Y420 PolarHBondContact N-O 3.5Å; Y288-R421 CarbonylContact O-C 3.5Å; Y288-R421 WeakPolarHBondContact O-CA 3.46Å; Y288-L422 PolarHBondContact O-N 2.84Å
289	V	90.2	Very high	83.9	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	133.6	168.2	63.7	0	0	0	0	111.5	V276 R277 F374 M378 L422 V424	V276-V289 CarbonylContact C-O 3.52Å; V276-V289 WeakPolarHBondContact CA-O 3.47Å; R277-V289 HydrophobicContact CB-CG1 4.08Å; R277-V289 PolarHBondContact N-O 3.4Å; R277-V289 PolarHBondContact O-N 3.22Å; R277-V289 VanDerWaalsContact O-N 3.1Å; V289-F374 HydrophobicContact CB-CD1 4.32Å; V289-F374 HydrophobicContact CB-CE1 4.24Å; V289-F374 HydrophobicContact CG1-CD1 3.66Å; V289-F374 HydrophobicContact CG1-CE1 3.67Å; V289-F374 HydrophobicContact CG1-CG 4.35Å; V289-F374 HydrophobicContact CG1-CZ 4.35Å; V289-F374 HydrophobicContact CG2-CD1 3.7Å; V289-F374 HydrophobicContact CG2-CE1 3.8Å; V289-M378 HydrophobicContact CG2-SD 4.44Å; V289-L422 CarbonylContact C-O 3.31Å; V289-L422 VanDerWaalsContact CA-O 3.3Å; V289-L422 WeakPolarHBondContact CA-O 3.37Å; V289-L422 HydrophobicContact CG2-CB 4.1Å; V289-V424 HydrophobicContact CG2-CG2 4.3Å
290	E	93.1	Very high	82	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.4	174.4	63.1	163.3	-143.4	0	0	112.5	Q262 R274 I275 V276 Y288 H388 L422 Q423 V424	Q262-E290 PolarHBondContact NE2-OE2 3.25Å; R274-E290 HydrophobicContact CB-CB 4.48Å; R274-E290 WeakPolarHBondContact CD-OE1 3.25Å; R274-E290 IonicContact CZ-OE1 3.41Å; R274-E290 IonicContact NE-OE1 3.22Å; R274-E290 PolarHBondContact NE-OE1 3.15Å; R274-E290 IonicContact NH1-OE1 2.61Å; R274-E290 PolarHBondContact NH1-OE1 3.02Å; R274-E290 IonicContact NH1-OE2 3.5Å; I275-E290 CarbonylContact O-C 3.59Å; I275-E290 VanDerWaalsContact O-CA 3.31Å; I275-E290 WeakPolarHBondContact O-CA 3.13Å; V276-E290 HydrophobicContact CG2-CB 4.15Å; Y288-E290 HydrophobicContact CE1-CB 4.04Å; Y288-E290 HydrophobicContact CE1-CG 3.96Å; Y288-E290 PolarHBondContact OH-OE2 2.62Å; E290-H388 IonicContact OE1-CE1 3.79Å; E290-H388 PolarHBondContact OE1-CE1 3.24Å; E290-H388 IonicContact OE2-CE1 2.6Å; E290-H388 IonicContact OE2-NE2 3.03Å; E290-L422 PolarHBondContact N-O 2.89Å; E290-Q423 HydrophobicContact CG-CB 4.02Å; E290-Q423 HydrophobicContact CG-CG 4.19Å; E290-Q423 WeakPolarHBondContact OE1-CG 3.48Å; E290-V424 PolarHBondContact O-N 3.12Å
291	M	92.8	Very high	80.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.2	-175	-179.8	169.3	65.6	0	0	111.7	R274 I275 I370 M373 F374 Y377 V424 V428	R274-M291 CarbonylContact C-O 3.58Å; R274-M291 VanDerWaalsContact CA-O 3.27Å; R274-M291 WeakPolarHBondContact CA-O 3.29Å; I275-M291 HydrophobicContact CG2-CB 4.22Å; I275-M291 HydrophobicContact CG2-CE 4.15Å; I275-M291 PolarHBondContact N-O 2.8Å; I275-M291 PolarHBondContact O-N 2.03Å; M291-I370 HydrophobicContact CE-CG2 4.01Å; M291-M373 HydrophobicContact CE-CB 4.14Å; M291-M373 HydrophobicContact SD-CB 4.04Å; M291-F374 HydrophobicContact CB-CD1 4.06Å; M291-F374 HydrophobicContact CB-CE1 3.4Å; M291-F374 HydrophobicContact CB-CZ 3.83Å; M291-F374 HydrophobicContact CE-CD1 4.2Å; M291-F374 HydrophobicContact CE-CD2 3.89Å; M291-F374 HydrophobicContact CE-CE1 4.14Å; M291-F374 HydrophobicContact CE-CE2 3.82Å; M291-F374 HydrophobicContact CE-CG 4.09Å; M291-F374 HydrophobicContact CE-CZ 3.96Å; M291-F374 HydrophobicContact CG-CE1 4.45Å; M291-F374 HydrophobicContact SD-CD1 4.15Å; M291-F374 HydrophobicContact SD-CE1 4.33Å; M291-F374 HydrophobicContact SD-CG 4.39Å; M291-Y377 HydrophobicContact SD-CD2 3.87Å; M291-Y377 HydrophobicContact SD-CE2 4.08Å; M291-V424 HydrophobicContact CB-CB 4.07Å; M291-V424 HydrophobicContact CB-CG2 4.06Å; M291-V424 HydrophobicContact CG-CB 4.02Å; M291-V424 HydrophobicContact CG-CG1 4.06Å; M291-V424 HydrophobicContact CG-CG2 4.21Å; M291-V424 HydrophobicContact SD-CG2 4.49Å; M291-V428 HydrophobicContact CE-CG2 3.95Å; M291-V428 HydrophobicContact CG-CG2 3.85Å; M291-V428 HydrophobicContact SD-CG2 3.46Å; M291-V428 WeakPolarHBondContact SD-CG2 3.37Å
292	P	92.2	Very high	78.2	Confident	4 Å²	4	42.8 Å²	42.8	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	136.2	-178.2	29.3	-32.5	0	0	0	112.7	T273 R274 V424 F427 V428	T273-P292 WeakPolarHBondContact O-CA 3.19Å; R274-P292 HydrophobicContact CG-CB 4.32Å; P292-V424 VanDerWaalsContact CD-O 3.26Å; P292-V424 WeakPolarHBondContact CD-O 3.22Å; P292-F427 HydrophobicContact CB-CD1 3.64Å; P292-F427 HydrophobicContact CB-CE1 3.73Å; P292-F427 HydrophobicContact CB-CG 4.32Å; P292-F427 HydrophobicContact CB-CZ 4.44Å; P292-F427 HydrophobicContact CG-CD1 4.13Å; P292-F427 HydrophobicContact CG-CE1 4.41Å; P292-F427 HydrophobicContact CG-CG 4.32Å; P292-V428 PolarHBondContact O-N 3.27Å
293	L	89.3	Confident	76.2	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134	-178.1	-60.1	-175.5	0	0	0	110.8	L259 T273 I275 F346 M365 V428	L259-L293 HydrophobicContact CD2-CD1 4.46Å; T273-L293 PolarHBondContact O-N 3.42Å; I275-L293 HydrophobicContact CB-CD1 3.83Å; I275-L293 HydrophobicContact CB-CG 4.32Å; I275-L293 HydrophobicContact CG2-CD1 3.77Å; I275-L293 HydrophobicContact CG2-CD2 3.88Å; I275-L293 HydrophobicContact CG2-CG 3.85Å; L293-F346 HydrophobicContact CB-CZ 4.46Å; L293-M365 HydrophobicContact CD1-CE 4.19Å; L293-V428 HydrophobicContact CD2-CB 3.98Å; L293-V428 HydrophobicContact CD2-CG1 4.45Å
294	E	81.3	Confident	74	Confident	36 Å²	36	63 Å²	63	17%	0.168	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.5	173.3	-83.5	178.5	152.4	0	0	110.7	I296 V311 F427 V428 Q429	E294-I296 HydrophobicContact CB-CD1 4.29Å; E294-I296 HydrophobicContact CB-CG1 4.12Å; E294-V311 HydrophobicContact CG-CG1 4.17Å; E294-F427 HydrophobicContact CG-CD1 3.63Å; E294-F427 HydrophobicContact CG-CE1 4.2Å; E294-F427 HydrophobicContact CG-CG 4.38Å; E294-V428 PolarHBondContact N-O 3.44Å; E294-Q429 HydrophobicContact CB-CG 4.3Å; E294-Q429 WeakPolarHBondContact OE2-CG 3.39Å; E294-Q429 PolarHBondContact OE2-NE2 3.4Å
295	C	84.8	Confident	71.9	Confident	4 Å²	4	63.4 Å²	63.4	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.5	169.7	-172	0	0	0	0	108.4	F312 F346 C363	C295-F312 HydrophobicContact CB-CB 4.18Å; C295-F312 PolarHBondContact N-O 3.44Å; C295-F312 VanDerWaalsContact N-O 3.15Å; C295-F312 WeakPolarHBondContact O-CD2 3.32Å; C295-F312 PolarHBondContact O-N 2.78Å; C295-F346 HydrophobicContact CB-CB 4.19Å; C295-F346 HydrophobicContact CB-CD1 4.41Å; C295-F346 HydrophobicContact CB-CD2 3.5Å; C295-F346 HydrophobicContact CB-CE2 3.89Å; C295-F346 HydrophobicContact CB-CG 3.8Å; C295-F346 HydrophobicContact CB-CZ 4.49Å; C295-C363 WeakPolarHBondContact CA-SG 3.29Å; C295-C363 HydrophobicContact CB-CB 3.77Å; C295-C363 WeakPolarHBondContact CB-SG 3.29Å; C295-C363 WeakPolarHBondContact SG-CB 3.12Å; C295-C363 CovalentContact SG-SG 2.04Å; C295-C363 PolarHBondContact SG-SG 2.91Å
296	I	79.6	Confident	69.7	Low	16 Å²	16	70.8 Å²	70.8	8%	0.082	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.4	-174	-57.4	-173.6	0	0	0	109.6	E294 T298 V309 K310 V311 Q429 L431	E294-I296 HydrophobicContact CB-CD1 4.29Å; E294-I296 HydrophobicContact CB-CG1 4.12Å; I296-T298 HydrophobicContact CG2-CG2 4.3Å; I296-V309 HydrophobicContact CG2-CG1 3.56Å; I296-K310 WeakPolarHBondContact CA-O 3.39Å; I296-V311 HydrophobicContact CD1-CG2 4.35Å; I296-V311 HydrophobicContact CG1-CG1 4.4Å; I296-V311 HydrophobicContact CG1-CG2 4.28Å; I296-Q429 HydrophobicContact CD1-CB 4.02Å; I296-Q429 VanDerWaalsContact CD1-CD 3.4Å; I296-Q429 HydrophobicContact CD1-CG 3.62Å; I296-L431 WeakPolarHBondContact O-CD2 3.31Å
297	S	73.4	Confident	68.3	Low	14 Å²	14	72.7 Å²	72.7	10%	0.098	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.7	171	-176.3	0	0	0	0	112	K310 E432	S297-K310 PolarHBondContact N-O 2.97Å; S297-K310 PolarHBondContact O-N 3.28Å; S297-E432 WeakPolarHBondContact CA-OE1 3.46Å; S297-E432 WeakPolarHBondContact CB-OE1 3.28Å; S297-E432 PolarHBondContact OG-OE1 3.49Å
298	T	63.2	Low	66.9	Low	41 Å²	41	80.2 Å²	80.2	25%	0.252	36%	0.363	S	S	.	.			trans	-137.4	123.1	-179.4	54.6	0	0	0	0	111.1	I296 K300 V309 L431 E432	I296-T298 HydrophobicContact CG2-CG2 4.3Å; T298-K300 PolarHBondContact O-N 3.18Å; T298-K300 VanDerWaalsContact OG1-CE 3.28Å; T298-K300 WeakPolarHBondContact OG1-CE 3.35Å; T298-V309 HydrophobicContact CG2-CG1 4.33Å; T298-L431 HydrophobicContact CG2-CD2 4.2Å; T298-L431 VanDerWaalsContact OG1-CD2 3.28Å; T298-L431 WeakPolarHBondContact OG1-CD2 3.36Å; T298-E432 PolarHBondContact N-OE1 3.25Å
299	N	57.3	Low	66	Low	114 Å²	114	84.5 Å²	84.5	61%	0.61	39%	0.389	S	S	*	.			trans	-75.5	71.4	179.3	-101.7	-23.1	0	0	0	112.2	R301 R302 E307	N299-R301 PolarHBondContact O-N 2.83Å; N299-R302 PolarHBondContact O-N 3.01Å; N299-E307 PolarHBondContact ND2-OE2 2.03Å
300	K	48.7	Very low	65.5	Low	134 Å²	134	88 Å²	88	58%	0.583	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-3.8	-174.4	-71.4	161.1	-176.2	143.5	0	116.4	T298 E432	T298-K300 PolarHBondContact O-N 3.18Å; T298-K300 VanDerWaalsContact OG1-CE 3.28Å; T298-K300 WeakPolarHBondContact OG1-CE 3.35Å; K300-E432 IonicContact NZ-OE2 3.91Å; K300-E432 PolarHBondContact NZ-OE2 3.21Å
301	R	48.8	Very low	65.1	Low	179 Å²	179	90.3 Å²	90.3	68%	0.675	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	3.2	-179.1	-70.7	-168	179.6	172.7	4.7	115.8	N299	N299-R301 PolarHBondContact O-N 2.83Å
302	R	44	Very low	64.9	Low	169 Å²	169	90.3 Å²	90.3	64%	0.638	42%	0.418	S	S	*	.			trans	-133.4	82.1	173.7	-80.7	-176.5	163.2	-179.1	-7.6	114	N299 R304 A305 E307	N299-R302 PolarHBondContact O-N 3.01Å; R302-R304 PolarHBondContact O-N 3.33Å; R302-A305 HydrophobicContact CB-CB 3.98Å; R302-A305 PolarHBondContact O-N 2.97Å; R302-E307 IonicContact NH1-OE1 2.68Å
303	R	43	Very low	64.7	Low	258 Å²	258	91.6 Å²	91.6	97%	0.974	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	20.8	166.8	-81	-175.1	168.2	177.5	-4.3	115
304	R	40.1	Very low	64.9	Low	250 Å²	250	91.7 Å²	91.7	94%	0.943	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.5	13	-177.7	-74.2	-168	175.9	176	-1.6	113.7	R302	R302-R304 PolarHBondContact O-N 3.33Å
305	A	42.2	Very low	65.5	Low	38 Å²	38	90 Å²	90	31%	0.314	42%	0.417	S	S	.	.			trans	-122	132.8	173.5	0	0	0	0	0	109.3	R302 E307	R302-A305 HydrophobicContact CB-CB 3.98Å; R302-A305 PolarHBondContact O-N 2.97Å; A305-E307 HydrophobicContact CB-CG 4.13Å; A305-E307 PolarHBondContact O-N 2.81Å
306	T	41.7	Very low	66	Low	160 Å²	160	90.9 Å²	90.9	98%	0.982	42%	0.421	S	S	*	.			trans	-78.6	49.9	176	-34.6	0	0	0	0	110.4
307	E	51.9	Low	66.7	Low	92 Å²	92	90.5 Å²	90.5	43%	0.43	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-77.8	125.3	175.7	-74.9	175.7	-161.7	0	0	109.3	N299 R302 A305	N299-E307 PolarHBondContact ND2-OE2 2.03Å; R302-E307 IonicContact NH1-OE1 2.68Å; A305-E307 HydrophobicContact CB-CG 4.13Å; A305-E307 PolarHBondContact O-N 2.81Å
308	E	57.7	Low	67.7	Low	171 Å²	171	90.2 Å²	90.2	80%	0.799	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-63.4	136.5	-173.9	-170	173.8	-140.8	0	0	112.6	K310	E308-K310 PolarHBondContact O-N 3.46Å
309	V	71.5	Confident	69.2	Low	91 Å²	91	89.9 Å²	89.9	55%	0.552	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-71.5	125	176.3	176.2	0	0	0	0	108.9	I296 T298	I296-V309 HydrophobicContact CG2-CG1 3.56Å; T298-V309 HydrophobicContact CG2-CG1 4.33Å
310	K	79.1	Confident	70.9	Confident	75 Å²	75	85.6 Å²	85.6	33%	0.326	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125.1	-177.1	-64	-162.1	170.3	-146.8	0	111.5	I296 S297 E308 F312	I296-K310 WeakPolarHBondContact CA-O 3.39Å; S297-K310 PolarHBondContact N-O 2.97Å; S297-K310 PolarHBondContact O-N 3.28Å; E308-K310 PolarHBondContact O-N 3.46Å; K310-F312 HydrophobicContact CB-CE2 3.64Å; K310-F312 HydrophobicContact CB-CZ 3.87Å; K310-F312 HydrophobicContact CD-CZ 4.27Å
311	V	84.3	Confident	73	Confident	47 Å²	47	80.4 Å²	80.4	29%	0.285	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.2	177.8	-175.1	0	0	0	0	109.2	E294 I296	E294-V311 HydrophobicContact CG-CG1 4.17Å; I296-V311 HydrophobicContact CD1-CG2 4.35Å; I296-V311 HydrophobicContact CG1-CG1 4.4Å; I296-V311 HydrophobicContact CG1-CG2 4.28Å
312	F	88.6	Confident	74.9	Confident	1 Å²	1	76.6 Å²	76.6	0%	0.004	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	109.2	177.7	-55.2	-91.9	0	0	0	107.4	C295 K310 F346 Q348 N359 A361 W434	C295-F312 HydrophobicContact CB-CB 4.18Å; C295-F312 PolarHBondContact N-O 3.44Å; C295-F312 VanDerWaalsContact N-O 3.15Å; C295-F312 WeakPolarHBondContact O-CD2 3.32Å; C295-F312 PolarHBondContact O-N 2.78Å; K310-F312 HydrophobicContact CB-CE2 3.64Å; K310-F312 HydrophobicContact CB-CZ 3.87Å; K310-F312 HydrophobicContact CD-CZ 4.27Å; F312-F346 HydrophobicContact CB-CB 3.71Å; F312-Q348 HydrophobicContact CD1-CB 3.8Å; F312-Q348 HydrophobicContact CE1-CB 4Å; F312-N359 WeakPolarHBondContact CD1-O 3.47Å; F312-N359 HydrophobicContact CE1-CB 4.16Å; F312-A361 HydrophobicContact CB-CB 3.99Å; F312-A361 HydrophobicContact CD1-CB 3.91Å; F312-A361 HydrophobicContact CD2-CB 3.63Å; F312-A361 HydrophobicContact CE1-CB 4.35Å; F312-A361 HydrophobicContact CE2-CB 4.08Å; F312-A361 HydrophobicContact CG-CB 3.55Å; F312-A361 HydrophobicContact CZ-CB 4.43Å; F312-W434 HydrophobicContact CD1-CZ3 4.23Å; F312-W434 AromaticContact CE1-CE3 3.97Å; F312-W434 HydrophobicContact CE1-CE3 3.97Å; F312-W434 AromaticContact CE1-CH2 3.9Å; F312-W434 HydrophobicContact CE1-CH2 3.9Å; F312-W434 AromaticContact CE1-CZ3 3.29Å; F312-W434 HydrophobicContact CE1-CZ3 3.29Å; F312-W434 AromaticContact CE2-CE3 3.84Å; F312-W434 HydrophobicContact CE2-CE3 3.84Å; F312-W434 HydrophobicContact CE2-CZ3 4Å; F312-W434 HydrophobicContact CZ-CD2 4.21Å; F312-W434 AromaticContact CZ-CE3 3.44Å; F312-W434 HydrophobicContact CZ-CE3 3.44Å; F312-W434 VanDerWaalsContact CZ-CE3 3.44Å; F312-W434 AromaticContact CZ-CH2 3.72Å; F312-W434 HydrophobicContact CZ-CH2 3.72Å; F312-W434 HydrophobicContact CZ-CZ2 4.42Å; F312-W434 AromaticContact CZ-CZ3 3.14Å; F312-W434 HydrophobicContact CZ-CZ3 3.14Å
313	N	88.4	Confident	76.9	Confident	31 Å²	31	68.6 Å²	68.6	17%	0.166	33%	0.33	C	S	.	.			trans	-115.6	-21.4	-161.4	56.3	-45	0	0	0	113.5	Y271 H272 T273 A347 G349	Y271-N313 PolarHBondContact O-ND2 2.85Å; H272-N313 CarbonylContact C-O 3.54Å; H272-N313 WeakPolarHBondContact CA-O 3.14Å; T273-N313 PolarHBondContact N-O 3.13Å; T273-N313 PolarHBondContact OG1-O 2.87Å; N313-A347 PolarHBondContact N-O 3.4Å; N313-A347 VanDerWaalsContact N-O 3.14Å; N313-G349 PolarHBondContact OD1-N 2.9Å
314	I	92.9	Very high	78.9	Confident	4 Å²	4	57 Å²	57	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	102.2	-175.3	-48.1	-57.3	0	0	0	110	V261 Q316 F346 A347	V261-I314 HydrophobicContact CG1-CD1 4.21Å; V261-I314 HydrophobicContact CG1-CG2 4.12Å; V261-I314 HydrophobicContact CG2-CG2 4.37Å; I314-Q316 PolarHBondContact O-N 3.19Å; I314-Q316 PolarHBondContact O-NE2 3.47Å; I314-F346 CarbonylContact O-C 3.6Å; I314-A347 PolarHBondContact N-O 3.07Å; I314-A347 PolarHBondContact O-N 3.09Å
315	L	94.2	Very high	80.9	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	134.9	174.1	-172.2	72.5	0	0	0	111.5	V247 L259 V261 T273 A317 A318 A344 F346	V247-L315 HydrophobicContact CB-CD2 4.05Å; V247-L315 HydrophobicContact CG1-CD2 3.88Å; V247-L315 HydrophobicContact CG1-CG 4.02Å; L259-L315 HydrophobicContact CB-CD2 3.47Å; L259-L315 VanDerWaalsContact CB-CD2 3.47Å; L259-L315 HydrophobicContact CD1-CD2 3.6Å; L259-L315 HydrophobicContact CG-CD2 4.12Å; V261-L315 HydrophobicContact CG2-CB 4.06Å; T273-L315 HydrophobicContact CG2-CB 3.76Å; T273-L315 HydrophobicContact CG2-CD2 4.11Å; T273-L315 HydrophobicContact CG2-CG 4.47Å; T273-L315 WeakPolarHBondContact OG1-CB 3.25Å; T273-L315 PolarHBondContact OG1-N 3.17Å; L315-A317 WeakPolarHBondContact CD1-O 3.22Å; L315-A318 HydrophobicContact CD1-CB 4.48Å; L315-A318 HydrophobicContact CD2-CB 4.48Å; L315-A344 HydrophobicContact CD1-CB 3.73Å; L315-F346 HydrophobicContact CB-CD1 4.33Å; L315-F346 HydrophobicContact CB-CE1 4.35Å; L315-F346 HydrophobicContact CD1-CD1 4.32Å; L315-F346 HydrophobicContact CD1-CD2 4.41Å; L315-F346 HydrophobicContact CD1-CE1 4.18Å; L315-F346 HydrophobicContact CD1-CE2 4.27Å; L315-F346 HydrophobicContact CD1-CG 4.44Å; L315-F346 HydrophobicContact CD1-CZ 4.15Å
316	Q	94.8	Very high	82.9	Confident	22 Å²	22	48.6 Å²	48.6	10%	0.103	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-45.1	174.8	-57.1	-54.2	-64.9	0	0	111.7	V247 I314 A345 A347 L442 V443	V247-Q316 WeakPolarHBondContact CG1-O 3.16Å; I314-Q316 PolarHBondContact O-N 3.19Å; I314-Q316 PolarHBondContact O-NE2 3.47Å; Q316-A345 PolarHBondContact N-O 3.28Å; Q316-A347 HydrophobicContact CG-CB 3.9Å; Q316-L442 HydrophobicContact CG-CD1 3.95Å; Q316-V443 WeakPolarHBondContact CB-O 3.4Å; Q316-V443 WeakPolarHBondContact CG-O 3.41Å
317	A	95.3	Very high	84.8	Confident	8 Å²	8	44.1 Å²	44.1	7%	0.066	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	160.8	178.5	0	0	0	0	0	111	L315 A345 I446	L315-A317 WeakPolarHBondContact CD1-O 3.22Å; A317-A345 PolarHBondContact N-O 2.9Å; A317-A345 PolarHBondContact O-N 3.39Å; A317-I446 HydrophobicContact CB-CG2 3.89Å
318	A	94.8	Very high	86.1	Confident	8 Å²	8	41.6 Å²	41.6	7%	0.066	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	162.3	176.2	0	0	0	0	0	111.8	Y248 L259 L315 L342 F343 A344 I446	Y248-A318 HydrophobicContact CD1-CB 3.63Å; Y248-A318 HydrophobicContact CE1-CB 4.25Å; Y248-A318 WeakPolarHBondContact CE2-O 3.43Å; Y248-A318 HydrophobicContact CG-CB 3.99Å; L259-A318 HydrophobicContact CD1-CB 3.46Å; L259-A318 VanDerWaalsContact CD1-CB 3.46Å; L315-A318 HydrophobicContact CD1-CB 4.48Å; L315-A318 HydrophobicContact CD2-CB 4.48Å; A318-L342 HydrophobicContact CB-CD1 4Å; A318-F343 CarbonylContact C-O 3.54Å; A318-F343 VanDerWaalsContact CA-O 3.28Å; A318-F343 WeakPolarHBondContact CA-O 3.37Å; A318-A344 HydrophobicContact CB-CB 4.31Å; A318-I446 VanDerWaalsContact CA-CG2 3.5Å
319	H	94.5	Very high	87.3	Confident	34 Å²	34	33.4 Å²	33.4	16%	0.157	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.2	177.4	-167.8	81.5	0	0	0	109.6	F343 I446 V448	H319-F343 PolarHBondContact N-O 2.92Å; H319-F343 PolarHBondContact O-N 3.11Å; H319-I446 HydrophobicContact CB-CG2 4.38Å; H319-V448 PolarHBondContact CD2-N 3.36Å; H319-V448 VanDerWaalsContact CD2-N 3.26Å; H319-V448 PolarHBondContact NE2-O 3.44Å
320	V	93.5	Very high	87.9	Confident	25 Å²	25	31.8 Å²	31.8	15%	0.152	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.9	175.8	172.7	0	0	0	0	109	Y248 F250 D340 V341 L342 L367	Y248-V320 HydrophobicContact CE1-CG2 4.25Å; Y248-V320 PolarHBondContact OH-N 2.85Å; F250-V320 HydrophobicContact CD1-CG2 3.97Å; F250-V320 HydrophobicContact CD2-CB 4.39Å; F250-V320 HydrophobicContact CD2-CG2 3.77Å; F250-V320 HydrophobicContact CE1-CG2 3.98Å; F250-V320 HydrophobicContact CE2-CG2 3.8Å; F250-V320 HydrophobicContact CG-CG2 3.85Å; F250-V320 HydrophobicContact CZ-CG2 3.89Å; V320-D340 HydrophobicContact CG1-CB 4.02Å; V320-V341 WeakPolarHBondContact CA-O 3.5Å; V320-L342 HydrophobicContact CG2-CB 4.21Å; V320-L342 HydrophobicContact CG2-CD1 3.72Å; V320-L367 HydrophobicContact CG1-CD1 4.15Å
321	T	91.1	Very high	88.1	Confident	24 Å²	24	36 Å²	36	15%	0.147	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.7	174.2	173.6	0	0	0	0	109.1	V341 F343 V448	T321-V341 PolarHBondContact N-O 3.25Å; T321-V341 PolarHBondContact O-N 3.31Å; T321-F343 HydrophobicContact CG2-CD2 3.95Å; T321-F343 HydrophobicContact CG2-CE2 3.63Å; T321-V448 HydrophobicContact CG2-CB 3.95Å; T321-V448 HydrophobicContact CG2-CG1 3.92Å
322	K	89.9	Confident	87.9	Confident	99 Å²	99	35.9 Å²	35.9	43%	0.43	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	155.2	165.2	-72.3	-175.6	168.2	-173.2	0	111.6	D338 E339	K322-D338 WeakPolarHBondContact CE-OD1 3.45Å; K322-D338 IonicContact NZ-OD1 2.84Å; K322-D338 PolarHBondContact NZ-OD1 2.78Å; K322-E339 CarbonylContact C-O 3.59Å; K322-E339 VanDerWaalsContact CA-O 3.31Å; K322-E339 WeakPolarHBondContact CA-O 3.27Å
323	V	85.1	Confident	87.4	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.19	C	C	.	.			trans	-60.7	-45.7	172.6	176.9	0	0	0	0	111.4	L329 Q330 A335 E336 E339 V341	V323-L329 HydrophobicContact CB-CD2 4.36Å; V323-L329 HydrophobicContact CG1-CB 4.32Å; V323-L329 HydrophobicContact CG1-CD2 3.97Å; V323-L329 HydrophobicContact CG1-CG 4.02Å; V323-Q330 HydrophobicContact CG1-CB 4.32Å; V323-Q330 HydrophobicContact CG1-CG 3.4Å; V323-Q330 VanDerWaalsContact CG1-CG 3.4Å; V323-A335 HydrophobicContact CG2-CB 3.76Å; V323-E336 WeakPolarHBondContact CB-O 3.34Å; V323-E336 WeakPolarHBondContact CG2-O 3.14Å; V323-E339 HydrophobicContact CG2-CB 4.2Å; V323-E339 WeakPolarHBondContact CG2-O 3.35Å; V323-E339 PolarHBondContact N-O 2.78Å; V323-V341 HydrophobicContact CG2-CG2 3.48Å; V323-V341 VanDerWaalsContact CG2-CG2 3.48Å
324	G	84.9	Confident	87.2	Confident	15 Å²	15	44.6 Å²	44.6	16%	0.155	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	-157.6	-174.8	0	0	0	0	0	113.1	D326 Q330 E337	G324-D326 VanDerWaalsContact C-N 3.31Å; G324-D326 PolarHBondContact O-N 2.91Å; G324-Q330 PolarHBondContact O-NE2 2.85Å; G324-E337 PolarHBondContact N-O 3.12Å
325	N	82.9	Confident	86.8	Confident	108 Å²	108	44.9 Å²	44.9	58%	0.578	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	12.2	-174	-84.8	-75.7	0	0	0	115.7	A327 E337	N325-A327 PolarHBondContact O-N 2.85Å; N325-E337 PolarHBondContact ND2-OE1 2.7Å
326	D	83.8	Confident	86.4	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	25%	0.253	C	S	.	.			trans	-76.2	95.1	174	-168.6	-31.6	0	0	0	110.4	G324 E328 L329 Q330 R454 T455	G324-D326 VanDerWaalsContact C-N 3.31Å; G324-D326 PolarHBondContact O-N 2.91Å; D326-E328 PolarHBondContact O-N 2.77Å; D326-E328 VanDerWaalsContact O-N 3.12Å; D326-E328 WeakPolarHBondContact OD1-CA 3.22Å; D326-E328 VanDerWaalsContact OD1-CB 3.26Å; D326-E328 WeakPolarHBondContact OD1-CB 3.23Å; D326-E328 PolarHBondContact OD1-N 3.49Å; D326-L329 HydrophobicContact CB-CB 3.95Å; D326-L329 WeakPolarHBondContact O-CB 3.14Å; D326-L329 PolarHBondContact O-N 2.87Å; D326-L329 PolarHBondContact OD1-N 3.1Å; D326-Q330 WeakPolarHBondContact O-CG 3.46Å; D326-Q330 PolarHBondContact O-N 2.89Å; D326-R454 IonicContact OD1-NE 2.81Å; D326-R454 VanDerWaalsContact OD2-CA 3.25Å; D326-R454 WeakPolarHBondContact OD2-CA 3.35Å; D326-R454 WeakPolarHBondContact OD2-CD 3.46Å; D326-R454 IonicContact OD2-CZ 3.93Å; D326-R454 IonicContact OD2-NE 3.39Å; D326-R454 PolarHBondContact OD2-NE 2.89Å; D326-T455 WeakPolarHBondContact CB-OG1 3.25Å; D326-T455 PolarHBondContact OD2-N 2.97Å
327	A	82	Confident	86	Confident	65 Å²	65	54 Å²	54	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-57.8	-22.1	177.8	0	0	0	0	0	114	N325 R331	N325-A327 PolarHBondContact O-N 2.85Å; A327-R331 WeakPolarHBondContact O-CB 3.35Å; A327-R331 PolarHBondContact O-N 2.69Å; A327-R331 VanDerWaalsContact O-N 3.17Å
328	E	78.9	Confident	85.6	Confident	39 Å²	39	58.9 Å²	58.9	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-77.3	-40.8	173	-173.4	57.5	-145.7	0	0	111	D326 R331 Q332	D326-E328 PolarHBondContact O-N 2.77Å; D326-E328 VanDerWaalsContact O-N 3.12Å; D326-E328 WeakPolarHBondContact OD1-CA 3.22Å; D326-E328 VanDerWaalsContact OD1-CB 3.26Å; D326-E328 WeakPolarHBondContact OD1-CB 3.23Å; D326-E328 PolarHBondContact OD1-N 3.49Å; E328-R331 PolarHBondContact O-N 3.36Å; E328-R331 IonicContact OE1-CZ 2.71Å; E328-R331 IonicContact OE1-NE 3.1Å; E328-R331 IonicContact OE1-NH2 3.28Å; E328-R331 PolarHBondContact OE1-NH2 3.06Å; E328-R331 IonicContact OE2-CZ 3.56Å; E328-R331 IonicContact OE2-NE 2.65Å; E328-R331 PolarHBondContact OE2-NE 2.85Å; E328-R331 IonicContact OE2-NH2 3.82Å; E328-R331 PolarHBondContact OE2-NH2 3.46Å; E328-Q332 WeakPolarHBondContact O-CB 3.47Å; E328-Q332 VanDerWaalsContact O-CG 3.26Å; E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 2.95Å; E328-Q332 WeakPolarHBondContact OE1-CG 3.41Å; E328-Q332 PolarHBondContact OE1-NE2 2.68Å
329	L	81.9	Confident	85.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-49.6	174.4	-175.9	63.6	0	0	0	111.3	V323 D326 R331 Q332 L333 F343 T455 F471	V323-L329 HydrophobicContact CB-CD2 4.36Å; V323-L329 HydrophobicContact CG1-CB 4.32Å; V323-L329 HydrophobicContact CG1-CD2 3.97Å; V323-L329 HydrophobicContact CG1-CG 4.02Å; D326-L329 HydrophobicContact CB-CB 3.95Å; D326-L329 WeakPolarHBondContact O-CB 3.14Å; D326-L329 PolarHBondContact O-N 2.87Å; D326-L329 PolarHBondContact OD1-N 3.1Å; L329-R331 VanDerWaalsContact C-N 3.35Å; L329-R331 PolarHBondContact O-N 2.85Å; L329-Q332 PolarHBondContact O-N 2.87Å; L329-L333 HydrophobicContact CD1-CD1 3.57Å; L329-L333 HydrophobicContact CD1-CG 4Å; L329-L333 HydrophobicContact CG-CD1 4.09Å; L329-L333 PolarHBondContact O-N 3.18Å; L329-F343 HydrophobicContact CD1-CZ 4.28Å; L329-F343 HydrophobicContact CD2-CZ 4.18Å; L329-T455 HydrophobicContact CD2-CG2 4.11Å; L329-T455 WeakPolarHBondContact CD2-OG1 3.02Å; L329-F471 HydrophobicContact CB-CD1 4.12Å; L329-F471 HydrophobicContact CB-CE1 4.29Å; L329-F471 HydrophobicContact CD1-CD1 3.7Å; L329-F471 HydrophobicContact CD1-CD2 4.5Å; L329-F471 HydrophobicContact CD1-CE1 3.44Å; L329-F471 VanDerWaalsContact CD1-CE1 3.44Å; L329-F471 HydrophobicContact CD1-CE2 4.28Å; L329-F471 HydrophobicContact CD1-CG 4.24Å; L329-F471 HydrophobicContact CD1-CZ 3.75Å; L329-F471 HydrophobicContact CG-CE1 4.48Å
330	Q	86.1	Confident	85.2	Confident	57 Å²	57	59.7 Å²	59.7	27%	0.266	30%	0.297	S	S	.	.	H	α-helix	trans	-51.2	-52.9	174	-68.9	176.9	4	0	0	110.9	V323 G324 D326 Q332 K334 A335	V323-Q330 HydrophobicContact CG1-CB 4.32Å; V323-Q330 HydrophobicContact CG1-CG 3.4Å; V323-Q330 VanDerWaalsContact CG1-CG 3.4Å; G324-Q330 PolarHBondContact O-NE2 2.85Å; D326-Q330 WeakPolarHBondContact O-CG 3.46Å; D326-Q330 PolarHBondContact O-N 2.89Å; Q330-Q332 VanDerWaalsContact C-N 3.35Å; Q330-Q332 PolarHBondContact O-N 3.01Å; Q330-K334 VanDerWaalsContact O-CA 3.28Å; Q330-K334 WeakPolarHBondContact O-CA 3.19Å; Q330-K334 PolarHBondContact O-N 2.7Å; Q330-A335 PolarHBondContact O-N 2.85Å
331	R	82.5	Confident	85.1	Confident	162 Å²	162	58.5 Å²	58.5	61%	0.611	29%	0.29	S	S	*	.	H	α-helix	trans	-63.3	-35.1	-179	-174.9	-178.2	77	153.4	5.3	113.4	A327 E328 L329	A327-R331 WeakPolarHBondContact O-CB 3.35Å; A327-R331 PolarHBondContact O-N 2.69Å; A327-R331 VanDerWaalsContact O-N 3.17Å; E328-R331 PolarHBondContact O-N 3.36Å; E328-R331 IonicContact OE1-CZ 2.71Å; E328-R331 IonicContact OE1-NE 3.1Å; E328-R331 IonicContact OE1-NH2 3.28Å; E328-R331 PolarHBondContact OE1-NH2 3.06Å; E328-R331 IonicContact OE2-CZ 3.56Å; E328-R331 IonicContact OE2-NE 2.65Å; E328-R331 PolarHBondContact OE2-NE 2.85Å; E328-R331 IonicContact OE2-NH2 3.82Å; E328-R331 PolarHBondContact OE2-NH2 3.46Å; L329-R331 VanDerWaalsContact C-N 3.35Å; L329-R331 PolarHBondContact O-N 2.85Å
332	Q	78.9	Confident	85.2	Confident	45 Å²	45	57.4 Å²	57.4	21%	0.21	28%	0.283	C	S	.	.	H	α-helix	trans	-79.6	-40.5	-178.8	-75.1	-164.1	63.3	0	0	113.4	E328 L329 Q330 F471 R473	E328-Q332 WeakPolarHBondContact O-CB 3.47Å; E328-Q332 VanDerWaalsContact O-CG 3.26Å; E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 2.95Å; E328-Q332 WeakPolarHBondContact OE1-CG 3.41Å; E328-Q332 PolarHBondContact OE1-NE2 2.68Å; L329-Q332 PolarHBondContact O-N 2.87Å; Q330-Q332 VanDerWaalsContact C-N 3.35Å; Q330-Q332 PolarHBondContact O-N 3.01Å; Q332-F471 HydrophobicContact CB-CE1 4.34Å; Q332-R473 VanDerWaalsContact CD-NE 3.35Å; Q332-R473 VanDerWaalsContact OE1-CG 3.28Å
333	L	80.1	Confident	85.2	Confident	22 Å²	22	52.9 Å²	52.9	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-83.3	-23.9	179.8	-66.3	-178.6	0	0	0	113.1	L329 A335 V341 V364	L329-L333 HydrophobicContact CD1-CD1 3.57Å; L329-L333 HydrophobicContact CD1-CG 4Å; L329-L333 HydrophobicContact CG-CD1 4.09Å; L329-L333 PolarHBondContact O-N 3.18Å; L333-A335 HydrophobicContact CB-CB 3.93Å; L333-V341 HydrophobicContact CD1-CB 4.35Å; L333-V341 HydrophobicContact CD1-CG1 3.7Å; L333-V341 HydrophobicContact CD1-CG2 3.61Å; L333-V364 HydrophobicContact CD1-CG1 4.13Å; L333-V364 HydrophobicContact CD2-CG1 4.32Å
334	K	83.6	Confident	85.6	Confident	194 Å²	194	52.9 Å²	52.9	84%	0.843	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	51.4	-163.1	-55.6	-176.7	178.2	-174.3	0	111.3	Q330	Q330-K334 VanDerWaalsContact O-CA 3.28Å; Q330-K334 WeakPolarHBondContact O-CA 3.19Å; Q330-K334 PolarHBondContact O-N 2.7Å
335	A	83.6	Confident	85.9	Confident	9 Å²	9	52.2 Å²	52.2	7%	0.074	26%	0.256	C	S	.	.			trans	-121.7	144.8	-176.9	0	0	0	0	0	110.3	V323 Q330 L333 E339	V323-A335 HydrophobicContact CG2-CB 3.76Å; Q330-A335 PolarHBondContact O-N 2.85Å; L333-A335 HydrophobicContact CB-CB 3.93Å; A335-E339 WeakPolarHBondContact CA-OE1 3.03Å; A335-E339 HydrophobicContact CB-CB 4.14Å; A335-E339 HydrophobicContact CB-CG 4.42Å; A335-E339 WeakPolarHBondContact CB-OE2 3.34Å
336	E	87.3	Confident	86.4	Confident	125 Å²	125	47.1 Å²	47.1	58%	0.584	23%	0.229	S	C	*	.			trans	-76.3	164.8	175.8	-68.6	139.8	-138.5	0	0	111.7	V323 D338 E339 K368	V323-E336 WeakPolarHBondContact CB-O 3.34Å; V323-E336 WeakPolarHBondContact CG2-O 3.14Å; E336-D338 VanDerWaalsContact C-N 3.34Å; E336-D338 PolarHBondContact O-N 3.17Å; E336-E339 HydrophobicContact CB-CG 4.33Å; E336-E339 PolarHBondContact N-OE1 3Å; E336-E339 WeakPolarHBondContact O-CB 3.43Å; E336-E339 PolarHBondContact O-N 3.29Å; E336-E339 VanDerWaalsContact O-N 3.15Å; E336-K368 IonicContact OE1-NZ 2.62Å; E336-K368 PolarHBondContact OE1-NZ 3.2Å; E336-K368 IonicContact OE2-NZ 2.8Å; E336-K368 PolarHBondContact OE2-NZ 3.21Å
337	E	85.6	Confident	86.8	Confident	89 Å²	89	47 Å²	47	42%	0.416	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-42.2	-174.7	177.9	169.4	-179.7	0	0	113.7	G324 N325	G324-E337 PolarHBondContact N-O 3.12Å; N325-E337 PolarHBondContact ND2-OE1 2.7Å
338	D	86.9	Confident	87.1	Confident	111 Å²	111	47 Å²	47	59%	0.594	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	0.3	-179.3	-84.4	-59.5	0	0	0	114.6	K322 E336	K322-D338 WeakPolarHBondContact CE-OD1 3.45Å; K322-D338 IonicContact NZ-OD1 2.84Å; K322-D338 PolarHBondContact NZ-OD1 2.78Å; E336-D338 VanDerWaalsContact C-N 3.34Å; E336-D338 PolarHBondContact O-N 3.17Å
339	E	89.1	Confident	87.6	Confident	18 Å²	18	45.7 Å²	45.7	8%	0.084	21%	0.214	C	C	.	.			trans	-71	134.1	176.8	-82.2	-174.7	-133.4	0	0	112.5	K322 V323 A335 E336 S366 K368	K322-E339 CarbonylContact C-O 3.59Å; K322-E339 VanDerWaalsContact CA-O 3.31Å; K322-E339 WeakPolarHBondContact CA-O 3.27Å; V323-E339 HydrophobicContact CG2-CB 4.2Å; V323-E339 WeakPolarHBondContact CG2-O 3.35Å; V323-E339 PolarHBondContact N-O 2.78Å; A335-E339 WeakPolarHBondContact CA-OE1 3.03Å; A335-E339 HydrophobicContact CB-CB 4.14Å; A335-E339 HydrophobicContact CB-CG 4.42Å; A335-E339 WeakPolarHBondContact CB-OE2 3.34Å; E336-E339 HydrophobicContact CB-CG 4.33Å; E336-E339 PolarHBondContact N-OE1 3Å; E336-E339 WeakPolarHBondContact O-CB 3.43Å; E336-E339 PolarHBondContact O-N 3.29Å; E336-E339 VanDerWaalsContact O-N 3.15Å; E339-S366 PolarHBondContact OE2-OG 3.09Å; E339-K368 HydrophobicContact CG-CD 3.94Å; E339-K368 WeakPolarHBondContact OE1-CD 3.05Å; E339-K368 WeakPolarHBondContact OE1-CE 3.44Å; E339-K368 IonicContact OE1-NZ 3.89Å; E339-K368 PolarHBondContact OE1-NZ 3.14Å; E339-K368 WeakPolarHBondContact OE2-CB 3.37Å; E339-K368 WeakPolarHBondContact OE2-CD 3.47Å
340	D	92	Very high	87.8	Confident	42 Å²	42	49.2 Å²	49.2	23%	0.225	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	135.6	170.1	-69.3	-35.4	0	0	0	112.1	S252 V320 L367	S252-D340 WeakPolarHBondContact CB-OD2 3.18Å; S252-D340 PolarHBondContact OG-OD2 3.22Å; V320-D340 HydrophobicContact CG1-CB 4.02Å; D340-L367 HydrophobicContact CB-CB 4.46Å; D340-L367 HydrophobicContact CB-CD1 3.72Å; D340-L367 HydrophobicContact CB-CG 4.3Å; D340-L367 PolarHBondContact O-N 3.41Å
341	V	91	Very high	87.7	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.8	179.2	179	0	0	0	0	110.3	V320 T321 V323 L333 F343 V364	V320-V341 WeakPolarHBondContact CA-O 3.5Å; T321-V341 PolarHBondContact N-O 3.25Å; T321-V341 PolarHBondContact O-N 3.31Å; V323-V341 HydrophobicContact CG2-CG2 3.48Å; V323-V341 VanDerWaalsContact CG2-CG2 3.48Å; L333-V341 HydrophobicContact CD1-CB 4.35Å; L333-V341 HydrophobicContact CD1-CG1 3.7Å; L333-V341 HydrophobicContact CD1-CG2 3.61Å; V341-F343 HydrophobicContact CB-CD2 4.41Å; V341-F343 HydrophobicContact CB-CE2 3.85Å; V341-F343 HydrophobicContact CG1-CD2 3.92Å; V341-F343 HydrophobicContact CG1-CE2 3.46Å; V341-F343 VanDerWaalsContact CG1-CE2 3.46Å; V341-F343 HydrophobicContact CG1-CZ 3.95Å; V341-V364 HydrophobicContact CG1-CG1 3.4Å
342	L	92.2	Very high	87.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.7	171.8	175.6	59.9	0	0	0	110.3	F250 L259 I275 A318 V320 A344 V364 M365 L367 I370	F250-L342 HydrophobicContact CE1-CD1 4.28Å; L259-L342 HydrophobicContact CD1-CD1 4.06Å; L259-L342 HydrophobicContact CD1-CD2 4.28Å; L259-L342 HydrophobicContact CD2-CD2 4.33Å; I275-L342 HydrophobicContact CD1-CD2 4.17Å; A318-L342 HydrophobicContact CB-CD1 4Å; V320-L342 HydrophobicContact CG2-CB 4.21Å; V320-L342 HydrophobicContact CG2-CD1 3.72Å; L342-A344 HydrophobicContact CG-CB 4.49Å; L342-V364 WeakPolarHBondContact O-CA 3.11Å; L342-M365 HydrophobicContact CD2-CE 4.01Å; L342-M365 HydrophobicContact CG-CE 4.32Å; L342-M365 PolarHBondContact N-O 2.65Å; L342-M365 PolarHBondContact O-N 3.15Å; L342-L367 HydrophobicContact CB-CD2 4.03Å; L342-I370 HydrophobicContact CD2-CD1 4.23Å
343	F	91.6	Very high	87.8	Confident	5 Å²	5	46.2 Å²	46.2	2%	0.022	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.1	167.6	-66.4	-103.2	0	0	0	108.4	A318 H319 T321 L329 V341 V364 I446 V448 T455 F471	A318-F343 CarbonylContact C-O 3.54Å; A318-F343 VanDerWaalsContact CA-O 3.28Å; A318-F343 WeakPolarHBondContact CA-O 3.37Å; H319-F343 PolarHBondContact N-O 2.92Å; H319-F343 PolarHBondContact O-N 3.11Å; T321-F343 HydrophobicContact CG2-CD2 3.95Å; T321-F343 HydrophobicContact CG2-CE2 3.63Å; L329-F343 HydrophobicContact CD1-CZ 4.28Å; L329-F343 HydrophobicContact CD2-CZ 4.18Å; V341-F343 HydrophobicContact CB-CD2 4.41Å; V341-F343 HydrophobicContact CB-CE2 3.85Å; V341-F343 HydrophobicContact CG1-CD2 3.92Å; V341-F343 HydrophobicContact CG1-CE2 3.46Å; V341-F343 VanDerWaalsContact CG1-CE2 3.46Å; V341-F343 HydrophobicContact CG1-CZ 3.95Å; F343-V364 HydrophobicContact CD1-CB 4.28Å; F343-V364 HydrophobicContact CD1-CG1 3.85Å; F343-V364 HydrophobicContact CD1-CG2 3.5Å; F343-V364 VanDerWaalsContact CD1-CG2 3.5Å; F343-V364 HydrophobicContact CE1-CB 4.31Å; F343-V364 HydrophobicContact CE1-CG1 3.55Å; F343-V364 HydrophobicContact CE1-CG2 3.71Å; F343-V364 HydrophobicContact CE2-CG1 4.26Å; F343-V364 HydrophobicContact CG-CG1 4.31Å; F343-V364 HydrophobicContact CG-CG2 4.36Å; F343-V364 HydrophobicContact CZ-CG1 3.76Å; F343-I446 HydrophobicContact CB-CD1 4Å; F343-V448 HydrophobicContact CB-CG2 3.78Å; F343-V448 HydrophobicContact CD1-CG1 4.25Å; F343-V448 HydrophobicContact CD1-CG2 4.01Å; F343-V448 HydrophobicContact CD2-CB 4.27Å; F343-V448 HydrophobicContact CD2-CG1 4.17Å; F343-V448 HydrophobicContact CD2-CG2 4.12Å; F343-V448 HydrophobicContact CE1-CG1 4.1Å; F343-V448 HydrophobicContact CE2-CG1 4.02Å; F343-V448 HydrophobicContact CG-CB 4.35Å; F343-V448 HydrophobicContact CG-CG1 4.3Å; F343-V448 HydrophobicContact CG-CG2 3.72Å; F343-V448 HydrophobicContact CZ-CG1 4Å; F343-T455 HydrophobicContact CE1-CG2 4.42Å; F343-T455 HydrophobicContact CZ-CG2 3.93Å; F343-F471 HydrophobicContact CE1-CD2 4.37Å
344	A	91.9	Very high	88	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.7	-171.6	0	0	0	0	0	111.1	L315 A318 L342 F346 V362 C363 M365	L315-A344 HydrophobicContact CD1-CB 3.73Å; A318-A344 HydrophobicContact CB-CB 4.31Å; L342-A344 HydrophobicContact CG-CB 4.49Å; A344-F346 HydrophobicContact CB-CD2 4.18Å; A344-F346 HydrophobicContact CB-CE2 3.49Å; A344-F346 VanDerWaalsContact CB-CE2 3.49Å; A344-F346 HydrophobicContact CB-CZ 4.11Å; A344-F346 WeakPolarHBondContact O-CD2 3Å; A344-V362 CarbonylContact O-C 3.57Å; A344-V362 WeakPolarHBondContact O-CA 3.24Å; A344-C363 PolarHBondContact N-O 3.43Å; A344-C363 PolarHBondContact O-N 3.08Å; A344-M365 HydrophobicContact CB-CE 4.44Å
345	A	92.6	Very high	88.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.5	177.3	0	0	0	0	0	110	Q316 A317 A361 V443 I446	Q316-A345 PolarHBondContact N-O 3.28Å; A317-A345 PolarHBondContact N-O 2.9Å; A317-A345 PolarHBondContact O-N 3.39Å; A345-A361 CarbonylContact C-O 3.46Å; A345-A361 WeakPolarHBondContact CA-O 3.48Å; A345-V443 HydrophobicContact CB-CB 4.32Å; A345-V443 HydrophobicContact CB-CG1 3.69Å; A345-I446 HydrophobicContact CB-CB 4.44Å; A345-I446 HydrophobicContact CB-CG2 4.29Å
346	F	91.8	Very high	88.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	156.3	177.7	-65.1	-97.1	0	0	0	110.8	T273 L293 C295 F312 I314 L315 A344 S360 A361 C363	T273-F346 HydrophobicContact CG2-CE1 4.03Å; L293-F346 HydrophobicContact CB-CZ 4.46Å; C295-F346 HydrophobicContact CB-CB 4.19Å; C295-F346 HydrophobicContact CB-CD1 4.41Å; C295-F346 HydrophobicContact CB-CD2 3.5Å; C295-F346 HydrophobicContact CB-CE2 3.89Å; C295-F346 HydrophobicContact CB-CG 3.8Å; C295-F346 HydrophobicContact CB-CZ 4.49Å; F312-F346 HydrophobicContact CB-CB 3.71Å; I314-F346 CarbonylContact O-C 3.6Å; L315-F346 HydrophobicContact CB-CD1 4.33Å; L315-F346 HydrophobicContact CB-CE1 4.35Å; L315-F346 HydrophobicContact CD1-CD1 4.32Å; L315-F346 HydrophobicContact CD1-CD2 4.41Å; L315-F346 HydrophobicContact CD1-CE1 4.18Å; L315-F346 HydrophobicContact CD1-CE2 4.27Å; L315-F346 HydrophobicContact CD1-CG 4.44Å; L315-F346 HydrophobicContact CD1-CZ 4.15Å; A344-F346 HydrophobicContact CB-CD2 4.18Å; A344-F346 HydrophobicContact CB-CE2 3.49Å; A344-F346 VanDerWaalsContact CB-CE2 3.49Å; A344-F346 HydrophobicContact CB-CZ 4.11Å; A344-F346 WeakPolarHBondContact O-CD2 3Å; F346-S360 CarbonylContact O-C 3.58Å; F346-S360 WeakPolarHBondContact O-CA 3.17Å; F346-S360 WeakPolarHBondContact O-CB 3.47Å; F346-A361 PolarHBondContact N-O 3.43Å; F346-A361 PolarHBondContact O-N 3.03Å; F346-C363 HydrophobicContact CD2-CB 4.22Å; F346-C363 HydrophobicContact CE2-CB 3.96Å
347	A	92.3	Very high	88.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	155.4	164.9	0	0	0	0	0	110.4	N313 I314 Q316 G349 P356 N359 L442	N313-A347 PolarHBondContact N-O 3.4Å; N313-A347 VanDerWaalsContact N-O 3.14Å; I314-A347 PolarHBondContact N-O 3.07Å; I314-A347 PolarHBondContact O-N 3.09Å; Q316-A347 HydrophobicContact CG-CB 3.9Å; A347-G349 PolarHBondContact O-N 2.83Å; A347-P356 HydrophobicContact CB-CB 3.5Å; A347-N359 WeakPolarHBondContact CA-O 3.3Å; A347-L442 HydrophobicContact CB-CD1 3.84Å
348	Q	89.9	Confident	89.1	Confident	66 Å²	66	38.3 Å²	38.3	31%	0.308	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.8	168.4	176.5	177.4	10.2	0	0	107.9	F312 T357 N359	F312-Q348 HydrophobicContact CD1-CB 3.8Å; F312-Q348 HydrophobicContact CE1-CB 4Å; Q348-T357 WeakPolarHBondContact O-CB 3.32Å; Q348-T357 WeakPolarHBondContact O-CG2 3.4Å; Q348-T357 PolarHBondContact O-N 3.28Å; Q348-T357 PolarHBondContact O-OG1 3.24Å; Q348-N359 HydrophobicContact CB-CB 4.47Å; Q348-N359 PolarHBondContact N-O 3Å; Q348-N359 VanDerWaalsContact N-O 3.09Å
349	G	88.5	Confident	89.2	Confident	11 Å²	11	34.1 Å²	34.1	11%	0.113	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	154.2	179.3	0	0	0	0	0	113.3	N313 A347 E355	N313-G349 PolarHBondContact OD1-N 2.9Å; A347-G349 PolarHBondContact O-N 2.83Å; G349-E355 WeakPolarHBondContact CA-O 3.49Å
350	Q	87.4	Confident	89.2	Confident	75 Å²	75	33.3 Å²	33.3	35%	0.35	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-69.2	143.5	168.3	-67.7	-179.6	42.8	0	0	110.5	G352 S353 E355 T357	Q350-G352 PolarHBondContact O-N 3.37Å; Q350-S353 PolarHBondContact O-N 2.78Å; Q350-S353 VanDerWaalsContact O-O 3.13Å; Q350-E355 HydrophobicContact CG-CB 4.39Å; Q350-E355 PolarHBondContact N-O 2.84Å; Q350-E355 VanDerWaalsContact NE2-CB 3.26Å; Q350-E355 PolarHBondContact NE2-OE2 3.32Å; Q350-T357 HydrophobicContact CG-CG2 3.83Å
351	P	82.2	Confident	89	Confident	135 Å²	135	31.3 Å²	31.3	88%	0.877	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	125.5	177.4	-24.5	34.7	0	0	0	112.3	S353	P351-S353 VanDerWaalsContact C-N 3.28Å; P351-S353 PolarHBondContact O-N 2.86Å
352	G	80.5	Confident	88.8	Confident	40 Å²	40	31.6 Å²	31.6	41%	0.412	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	2.8	179	0	0	0	0	0	115.8	Q269 Q350	Q269-G352 CarbonylContact O-C 3.53Å; Q269-G352 VanDerWaalsContact O-C 3.31Å; Q269-G352 VanDerWaalsContact O-CA 3.26Å; Q269-G352 WeakPolarHBondContact O-CA 3.37Å; Q350-G352 PolarHBondContact O-N 3.37Å
353	S	84.4	Confident	88.6	Confident	26 Å²	26	31.9 Å²	31.9	18%	0.182	19%	0.193	C	C	.	.	S	Bend	trans	-132.4	147.8	-170.3	172	0	0	0	0	112	Y271 Q350 P351 E355	Y271-S353 WeakPolarHBondContact CD2-O 3.13Å; Q350-S353 PolarHBondContact O-N 2.78Å; Q350-S353 VanDerWaalsContact O-O 3.13Å; P351-S353 VanDerWaalsContact C-N 3.28Å; P351-S353 PolarHBondContact O-N 2.86Å; S353-E355 PolarHBondContact O-N 3.31Å; S353-E355 WeakPolarHBondContact OG-CB 3.06Å; S353-E355 PolarHBondContact OG-N 3.24Å; S353-E355 VanDerWaalsContact OG-N 3.16Å
354	P	83.3	Confident	88.4	Confident	25 Å²	25	32.3 Å²	32.3	16%	0.162	20%	0.196	C	C	.	.	S	Bend	trans	-75.2	-8.2	172.8	32.6	-35.6	0	0	0	112.7	Y243 Y271	Y243-P354 HydrophobicContact CD1-CB 3.99Å; Y243-P354 HydrophobicContact CD2-CB 4.11Å; Y243-P354 HydrophobicContact CD2-CG 3.89Å; Y243-P354 HydrophobicContact CE1-CB 3.73Å; Y243-P354 HydrophobicContact CE2-CB 3.84Å; Y243-P354 HydrophobicContact CE2-CG 3.75Å; Y243-P354 HydrophobicContact CG-CB 4.19Å; Y243-P354 HydrophobicContact CG-CG 4.33Å; Y271-P354 HydrophobicContact CD1-CB 3.87Å; Y271-P354 HydrophobicContact CD2-CB 4.18Å; Y271-P354 HydrophobicContact CE1-CB 4.07Å; Y271-P354 HydrophobicContact CE1-CG 4.43Å; Y271-P354 HydrophobicContact CE2-CB 4.38Å; Y271-P354 HydrophobicContact CE2-CG 4.5Å; Y271-P354 HydrophobicContact CG-CB 3.92Å
355	E	89	Confident	88.1	Confident	109 Å²	109	32.6 Å²	32.6	51%	0.509	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-71.6	139.1	-177	-67.9	-179.9	-170.8	0	0	112.7	G349 Q350 S353	G349-E355 WeakPolarHBondContact CA-O 3.49Å; Q350-E355 HydrophobicContact CG-CB 4.39Å; Q350-E355 PolarHBondContact N-O 2.84Å; Q350-E355 VanDerWaalsContact NE2-CB 3.26Å; Q350-E355 PolarHBondContact NE2-OE2 3.32Å; S353-E355 PolarHBondContact O-N 3.31Å; S353-E355 WeakPolarHBondContact OG-CB 3.06Å; S353-E355 PolarHBondContact OG-N 3.24Å; S353-E355 VanDerWaalsContact OG-N 3.16Å
356	P	92.4	Very high	87.9	Confident	36 Å²	36	32.9 Å²	32.9	23%	0.234	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	153.3	174.7	33.5	-36.4	0	0	0	112.4	A347 L442	A347-P356 HydrophobicContact CB-CB 3.5Å; P356-L442 HydrophobicContact CB-CD1 3.89Å; P356-L442 HydrophobicContact CB-CD2 4.48Å; P356-L442 HydrophobicContact CG-CD1 4.14Å; P356-L442 HydrophobicContact CG-CD2 3.93Å
357	T	91.7	Very high	87.9	Confident	30 Å²	30	33 Å²	33	18%	0.184	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	161.2	160.6	69.4	0	0	0	0	109.6	Q348 Q350 N359	Q348-T357 WeakPolarHBondContact O-CB 3.32Å; Q348-T357 WeakPolarHBondContact O-CG2 3.4Å; Q348-T357 PolarHBondContact O-N 3.28Å; Q348-T357 PolarHBondContact O-OG1 3.24Å; Q350-T357 HydrophobicContact CG-CG2 3.83Å; T357-N359 PolarHBondContact O-N 2.89Å
358	P	89.4	Confident	87.7	Confident	72 Å²	72	37.2 Å²	37.2	47%	0.468	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	53.4	176	32.9	-37.4	0	0	0	112.8	N440 T441 L442	P358-N440 CarbonylContact O-C 3.58Å; P358-N440 VanDerWaalsContact O-C 3.22Å; P358-N440 WeakPolarHBondContact O-CA 3.29Å; P358-N440 PolarHBondContact O-N 2.95Å; P358-T441 CarbonylContact C-O 3.44Å; P358-T441 PolarHBondContact O-N 3.07Å; P358-L442 HydrophobicContact CB-CB 4.46Å
359	N	89	Confident	87.7	Confident	24 Å²	24	37 Å²	37	13%	0.128	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	104.8	170.3	-65.3	-74.6	0	0	0	108.3	F312 A347 Q348 T357 W434 N440	F312-N359 WeakPolarHBondContact CD1-O 3.47Å; F312-N359 HydrophobicContact CE1-CB 4.16Å; A347-N359 WeakPolarHBondContact CA-O 3.3Å; Q348-N359 HydrophobicContact CB-CB 4.47Å; Q348-N359 PolarHBondContact N-O 3Å; Q348-N359 VanDerWaalsContact N-O 3.09Å; T357-N359 PolarHBondContact O-N 2.89Å; N359-W434 HydrophobicContact CB-CH2 4.36Å; N359-N440 PolarHBondContact OD1-N 2.91Å
360	S	89.6	Confident	87.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	139.2	-175.1	-73.1	0	0	0	0	113.7	F346 W434 L438 T441 V443	F346-S360 CarbonylContact O-C 3.58Å; F346-S360 WeakPolarHBondContact O-CA 3.17Å; F346-S360 WeakPolarHBondContact O-CB 3.47Å; S360-W434 WeakPolarHBondContact O-CZ3 3.41Å; S360-L438 PolarHBondContact N-O 2.04Å; S360-L438 WeakPolarHBondContact O-CB 3.48Å; S360-L438 WeakPolarHBondContact O-CD1 3.47Å; S360-T441 PolarHBondContact N-O 3.11Å; S360-V443 PolarHBondContact OG-N 3.25Å
361	A	87.8	Confident	87.9	Confident	1 Å²	1	34 Å²	34	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	149	175.6	0	0	0	0	0	109.8	F312 A345 F346 W434	F312-A361 HydrophobicContact CB-CB 3.99Å; F312-A361 HydrophobicContact CD1-CB 3.91Å; F312-A361 HydrophobicContact CD2-CB 3.63Å; F312-A361 HydrophobicContact CE1-CB 4.35Å; F312-A361 HydrophobicContact CE2-CB 4.08Å; F312-A361 HydrophobicContact CG-CB 3.55Å; F312-A361 HydrophobicContact CZ-CB 4.43Å; A345-A361 CarbonylContact C-O 3.46Å; A345-A361 WeakPolarHBondContact CA-O 3.48Å; F346-A361 PolarHBondContact N-O 3.43Å; F346-A361 PolarHBondContact O-N 3.03Å; A361-W434 HydrophobicContact CB-CE3 3.74Å; A361-W434 HydrophobicContact CB-CZ3 4.19Å
362	V	87.9	Confident	88.3	Confident	6 Å²	6	32 Å²	32	4%	0.036	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.9	164.9	-175.7	0	0	0	0	108.2	A344 V364 F433 L438 I446 L459	A344-V362 CarbonylContact O-C 3.57Å; A344-V362 WeakPolarHBondContact O-CA 3.24Å; V362-V364 HydrophobicContact CG1-CG2 4.4Å; V362-F433 HydrophobicContact CB-CB 4.45Å; V362-F433 HydrophobicContact CB-CD1 4.15Å; V362-F433 PolarHBondContact N-O 2.85Å; V362-F433 CarbonylContact O-C 3.56Å; V362-F433 VanDerWaalsContact O-C 3.28Å; V362-F433 VanDerWaalsContact O-CA 3.29Å; V362-F433 WeakPolarHBondContact O-CA 3.31Å; V362-F433 VanDerWaalsContact O-CB 3.3Å; V362-F433 WeakPolarHBondContact O-CB 3.46Å; V362-F433 PolarHBondContact O-N 2.96Å; V362-F433 VanDerWaalsContact O-N 3.1Å; V362-L438 HydrophobicContact CG2-CD1 4.32Å; V362-I446 HydrophobicContact CG1-CD1 3.85Å; V362-I446 HydrophobicContact CG2-CD1 4.41Å; V362-L459 HydrophobicContact CG2-CD1 4.38Å; V362-L459 HydrophobicContact CG2-CD2 4.33Å
363	C	86.6	Confident	88.7	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.034	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.9	170.8	-91.4	0	0	0	0	110.5	C295 A344 F346	C295-C363 WeakPolarHBondContact CA-SG 3.29Å; C295-C363 HydrophobicContact CB-CB 3.77Å; C295-C363 WeakPolarHBondContact CB-SG 3.29Å; C295-C363 WeakPolarHBondContact SG-CB 3.12Å; C295-C363 CovalentContact SG-SG 2.04Å; C295-C363 PolarHBondContact SG-SG 2.91Å; A344-C363 PolarHBondContact N-O 3.43Å; A344-C363 PolarHBondContact O-N 3.08Å; F346-C363 HydrophobicContact CD2-CB 4.22Å; F346-C363 HydrophobicContact CE2-CB 3.96Å
364	V	87.2	Confident	88.9	Confident	14 Å²	14	30.3 Å²	30.3	9%	0.085	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	124.4	-169	-172.8	0	0	0	0	109.8	L333 V341 L342 F343 V362 F471	L333-V364 HydrophobicContact CD1-CG1 4.13Å; L333-V364 HydrophobicContact CD2-CG1 4.32Å; V341-V364 HydrophobicContact CG1-CG1 3.4Å; L342-V364 WeakPolarHBondContact O-CA 3.11Å; F343-V364 HydrophobicContact CD1-CB 4.28Å; F343-V364 HydrophobicContact CD1-CG1 3.85Å; F343-V364 HydrophobicContact CD1-CG2 3.5Å; F343-V364 VanDerWaalsContact CD1-CG2 3.5Å; F343-V364 HydrophobicContact CE1-CB 4.31Å; F343-V364 HydrophobicContact CE1-CG1 3.55Å; F343-V364 HydrophobicContact CE1-CG2 3.71Å; F343-V364 HydrophobicContact CE2-CG1 4.26Å; F343-V364 HydrophobicContact CG-CG1 4.31Å; F343-V364 HydrophobicContact CG-CG2 4.36Å; F343-V364 HydrophobicContact CZ-CG1 3.76Å; V362-V364 HydrophobicContact CG1-CG2 4.4Å; V364-F471 HydrophobicContact CB-CE2 4.5Å; V364-F471 HydrophobicContact CG2-CE2 4.03Å
365	M	86.7	Confident	89.1	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.039	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	122.1	-168.3	-62.5	171.7	-76.7	0	0	110.9	L293 L342 A344 I370	L293-M365 HydrophobicContact CD1-CE 4.19Å; L342-M365 HydrophobicContact CD2-CE 4.01Å; L342-M365 HydrophobicContact CG-CE 4.32Å; L342-M365 PolarHBondContact N-O 2.65Å; L342-M365 PolarHBondContact O-N 3.15Å; A344-M365 HydrophobicContact CB-CE 4.44Å; M365-I370 HydrophobicContact CB-CD1 3.65Å; M365-I370 HydrophobicContact CB-CG1 4.34Å; M365-I370 HydrophobicContact CG-CD1 4.47Å; M365-I370 HydrophobicContact SD-CD1 4.16Å
366	S	88.9	Confident	89	Confident	6 Å²	6	28.8 Å²	28.8	4%	0.042	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.4	168.9	148	0	0	0	0	109.9	E339 K368 H369 I370	E339-S366 PolarHBondContact OE2-OG 3.09Å; S366-K368 VanDerWaalsContact C-N 3.3Å; S366-K368 PolarHBondContact O-N 3.24Å; S366-K368 WeakPolarHBondContact OG-CB 3.03Å; S366-K368 PolarHBondContact OG-N 3.35Å; S366-H369 WeakPolarHBondContact O-CB 3.48Å; S366-H369 PolarHBondContact O-N 3.12Å; S366-H369 VanDerWaalsContact O-N 3.14Å; S366-H369 PolarHBondContact OG-N 3.48Å; S366-I370 PolarHBondContact O-N 2.67Å; S366-I370 VanDerWaalsContact O-N 3.11Å
367	L	90.5	Very high	88.8	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-69.5	-28.3	178.8	-68.2	-178.9	0	0	0	112.2	F250 S252 V320 D340 L342 H369 I370 N371	F250-L367 HydrophobicContact CD2-CD1 4.44Å; F250-L367 HydrophobicContact CE2-CD1 3.57Å; F250-L367 HydrophobicContact CE2-CD2 4.18Å; F250-L367 HydrophobicContact CZ-CD1 4.25Å; F250-L367 HydrophobicContact CZ-CD2 4.07Å; S252-L367 VanDerWaalsContact OG-CD1 3.29Å; S252-L367 WeakPolarHBondContact OG-CD1 3.32Å; V320-L367 HydrophobicContact CG1-CD1 4.15Å; D340-L367 HydrophobicContact CB-CB 4.46Å; D340-L367 HydrophobicContact CB-CD1 3.72Å; D340-L367 HydrophobicContact CB-CG 4.3Å; D340-L367 PolarHBondContact O-N 3.41Å; L342-L367 HydrophobicContact CB-CD2 4.03Å; L367-H369 VanDerWaalsContact C-N 3.27Å; L367-H369 PolarHBondContact O-N 3.5Å; L367-I370 HydrophobicContact CD2-CD1 3.93Å; L367-I370 PolarHBondContact O-N 2.76Å; L367-N371 WeakPolarHBondContact O-CB 3.11Å; L367-N371 PolarHBondContact O-N 3.31Å; L367-N371 PolarHBondContact O-ND2 2.9Å
368	K	89.4	Confident	88.5	Confident	89 Å²	89	26.4 Å²	26.4	39%	0.387	14%	0.135	S	C	.	.	H	α-helix	trans	-56.9	-41.3	168.6	-166.9	176.4	-178	172.1	0	110.7	E336 E339 S366 N372	E336-K368 IonicContact OE1-NZ 2.62Å; E336-K368 PolarHBondContact OE1-NZ 3.2Å; E336-K368 IonicContact OE2-NZ 2.8Å; E336-K368 PolarHBondContact OE2-NZ 3.21Å; E339-K368 HydrophobicContact CG-CD 3.94Å; E339-K368 WeakPolarHBondContact OE1-CD 3.05Å; E339-K368 WeakPolarHBondContact OE1-CE 3.44Å; E339-K368 IonicContact OE1-NZ 3.89Å; E339-K368 PolarHBondContact OE1-NZ 3.14Å; E339-K368 WeakPolarHBondContact OE2-CB 3.37Å; E339-K368 WeakPolarHBondContact OE2-CD 3.47Å; S366-K368 VanDerWaalsContact C-N 3.3Å; S366-K368 PolarHBondContact O-N 3.24Å; S366-K368 WeakPolarHBondContact OG-CB 3.03Å; S366-K368 PolarHBondContact OG-N 3.35Å; K368-N372 WeakPolarHBondContact O-CB 3.49Å; K368-N372 PolarHBondContact O-N 3.47Å; K368-N372 VanDerWaalsContact O-N 3.12Å; K368-N372 PolarHBondContact O-ND2 3.27Å
369	H	88.5	Confident	88.2	Confident	61 Å²	61	28.3 Å²	28.3	28%	0.282	14%	0.138	S	C	.	.	H	α-helix	trans	-69.3	-44.7	174.2	179.3	63.6	0	0	0	112.8	S366 L367 N371 N372 M373 R430	S366-H369 WeakPolarHBondContact O-CB 3.48Å; S366-H369 PolarHBondContact O-N 3.12Å; S366-H369 VanDerWaalsContact O-N 3.14Å; S366-H369 PolarHBondContact OG-N 3.48Å; L367-H369 VanDerWaalsContact C-N 3.27Å; L367-H369 PolarHBondContact O-N 3.5Å; H369-N371 PolarHBondContact O-N 2.99Å; H369-N372 PolarHBondContact O-N 3.05Å; H369-M373 WeakPolarHBondContact O-CG 3.49Å; H369-M373 PolarHBondContact O-N 3.5Å; H369-R430 PolarHBondContact CD2-NH1 2.83Å; H369-R430 PolarHBondContact NE2-NH1 2.92Å
370	I	90.2	Very high	88	Confident	1 Å²	1	35 Å²	35	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-44.8	177	-78.9	163.2	0	0	0	111.5	I275 M291 L342 M365 S366 L367 N372 M373 F374	I275-I370 HydrophobicContact CD1-CD1 4.5Å; I275-I370 HydrophobicContact CD1-CG2 4.21Å; M291-I370 HydrophobicContact CE-CG2 4.01Å; L342-I370 HydrophobicContact CD2-CD1 4.23Å; M365-I370 HydrophobicContact CB-CD1 3.65Å; M365-I370 HydrophobicContact CB-CG1 4.34Å; M365-I370 HydrophobicContact CG-CD1 4.47Å; M365-I370 HydrophobicContact SD-CD1 4.16Å; S366-I370 PolarHBondContact O-N 2.67Å; S366-I370 VanDerWaalsContact O-N 3.11Å; L367-I370 HydrophobicContact CD2-CD1 3.93Å; L367-I370 PolarHBondContact O-N 2.76Å; I370-N372 VanDerWaalsContact C-N 3.35Å; I370-N372 PolarHBondContact O-N 2.81Å; I370-M373 WeakPolarHBondContact O-CB 3.46Å; I370-M373 PolarHBondContact O-N 2.83Å; I370-M373 VanDerWaalsContact O-N 3.14Å; I370-F374 HydrophobicContact CG2-CD2 3.92Å; I370-F374 HydrophobicContact CG2-CE2 3.67Å; I370-F374 WeakPolarHBondContact O-CD2 3.36Å; I370-F374 PolarHBondContact O-N 3.42Å
371	N	90.8	Very high	87.7	Confident	24 Å²	24	37.5 Å²	37.5	13%	0.128	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-39.2	176	-78	-42.7	0	0	0	112.3	Y257 R277 L367 H369 M373 F374 K375	Y257-N371 PolarHBondContact OH-ND2 3.42Å; Y257-N371 PolarHBondContact OH-OD1 3.08Å; R277-N371 WeakPolarHBondContact CD-OD1 3.5Å; R277-N371 PolarHBondContact NH1-OD1 2.94Å; L367-N371 WeakPolarHBondContact O-CB 3.11Å; L367-N371 PolarHBondContact O-N 3.31Å; L367-N371 PolarHBondContact O-ND2 2.9Å; H369-N371 PolarHBondContact O-N 2.99Å; N371-M373 VanDerWaalsContact C-N 3.32Å; N371-M373 PolarHBondContact O-N 3.08Å; N371-F374 PolarHBondContact O-N 2.8Å; N371-K375 WeakPolarHBondContact O-CG 3.35Å; N371-K375 PolarHBondContact O-N 3.48Å
372	N	89.8	Confident	87.6	Confident	93 Å²	93	39.1 Å²	39.1	50%	0.497	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-33.5	173.2	-72.8	-21.1	0	0	0	112.8	K368 H369 I370 M376	K368-N372 WeakPolarHBondContact O-CB 3.49Å; K368-N372 PolarHBondContact O-N 3.47Å; K368-N372 VanDerWaalsContact O-N 3.12Å; K368-N372 PolarHBondContact O-ND2 3.27Å; H369-N372 PolarHBondContact O-N 3.05Å; I370-N372 VanDerWaalsContact C-N 3.35Å; I370-N372 PolarHBondContact O-N 2.81Å; N372-M376 VanDerWaalsContact O-CB 3.28Å; N372-M376 WeakPolarHBondContact O-CB 3.48Å; N372-M376 PolarHBondContact O-N 3.33Å
373	M	89.9	Confident	87.5	Confident	30 Å²	30	39 Å²	39	15%	0.148	19%	0.186	C	C	.	.	H	α-helix	trans	-68.1	-43.3	173.5	-64.8	-60.6	-70.3	0	0	111.8	M291 H369 I370 N371 M376 Y377 V428	M291-M373 HydrophobicContact CE-CB 4.14Å; M291-M373 HydrophobicContact SD-CB 4.04Å; H369-M373 WeakPolarHBondContact O-CG 3.49Å; H369-M373 PolarHBondContact O-N 3.5Å; I370-M373 WeakPolarHBondContact O-CB 3.46Å; I370-M373 PolarHBondContact O-N 2.83Å; I370-M373 VanDerWaalsContact O-N 3.14Å; N371-M373 VanDerWaalsContact C-N 3.32Å; N371-M373 PolarHBondContact O-N 3.08Å; M373-M376 HydrophobicContact CE-CE 3.58Å; M373-M376 PolarHBondContact O-N 2.86Å; M373-M376 HydrophobicContact SD-CE 3.78Å; M373-Y377 HydrophobicContact CB-CD2 4.48Å; M373-Y377 HydrophobicContact CB-CE2 4.4Å; M373-Y377 HydrophobicContact CE-CE2 3.66Å; M373-Y377 WeakPolarHBondContact CE-OH 3.43Å; M373-Y377 WeakPolarHBondContact O-CB 3.1Å; M373-Y377 WeakPolarHBondContact O-CD2 3.49Å; M373-Y377 PolarHBondContact O-N 2.85Å; M373-V428 HydrophobicContact CB-CG2 4.34Å; M373-V428 HydrophobicContact CE-CG2 4.1Å
374	F	88.6	Confident	87.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.1	-52.5	171.7	-79.2	-66.3	0	0	0	111.5	I275 R277 V289 M291 I370 N371 M376 Y377 M378 V424	I275-F374 HydrophobicContact CG2-CE2 4.35Å; I275-F374 HydrophobicContact CG2-CZ 4.02Å; R277-F374 HydrophobicContact CB-CE2 3.89Å; R277-F374 HydrophobicContact CB-CZ 3.88Å; V289-F374 HydrophobicContact CB-CD1 4.32Å; V289-F374 HydrophobicContact CB-CE1 4.24Å; V289-F374 HydrophobicContact CG1-CD1 3.66Å; V289-F374 HydrophobicContact CG1-CE1 3.67Å; V289-F374 HydrophobicContact CG1-CG 4.35Å; V289-F374 HydrophobicContact CG1-CZ 4.35Å; V289-F374 HydrophobicContact CG2-CD1 3.7Å; V289-F374 HydrophobicContact CG2-CE1 3.8Å; M291-F374 HydrophobicContact CB-CD1 4.06Å; M291-F374 HydrophobicContact CB-CE1 3.4Å; M291-F374 HydrophobicContact CB-CZ 3.83Å; M291-F374 HydrophobicContact CE-CD1 4.2Å; M291-F374 HydrophobicContact CE-CD2 3.89Å; M291-F374 HydrophobicContact CE-CE1 4.14Å; M291-F374 HydrophobicContact CE-CE2 3.82Å; M291-F374 HydrophobicContact CE-CG 4.09Å; M291-F374 HydrophobicContact CE-CZ 3.96Å; M291-F374 HydrophobicContact CG-CE1 4.45Å; M291-F374 HydrophobicContact SD-CD1 4.15Å; M291-F374 HydrophobicContact SD-CE1 4.33Å; M291-F374 HydrophobicContact SD-CG 4.39Å; I370-F374 HydrophobicContact CG2-CD2 3.92Å; I370-F374 HydrophobicContact CG2-CE2 3.67Å; I370-F374 WeakPolarHBondContact O-CD2 3.36Å; I370-F374 PolarHBondContact O-N 3.42Å; N371-F374 PolarHBondContact O-N 2.8Å; F374-M376 PolarHBondContact O-N 2.87Å; F374-Y377 PolarHBondContact O-N 2.85Å; F374-M378 WeakPolarHBondContact O-CG 3.4Å; F374-M378 PolarHBondContact O-N 3.25Å; F374-V424 HydrophobicContact CD1-CG2 4.47Å
375	K	86.8	Confident	87.3	Confident	53 Å²	53	44 Å²	44	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-55.4	-49.2	178	-69.8	-168.5	173.5	-171.3	0	111.6	N371 Y377 Q379 M400 D405	N371-K375 WeakPolarHBondContact O-CG 3.35Å; N371-K375 PolarHBondContact O-N 3.48Å; K375-Y377 PolarHBondContact O-N 3.47Å; K375-Q379 WeakPolarHBondContact O-CB 3.47Å; K375-Q379 VanDerWaalsContact O-CG 3.28Å; K375-Q379 WeakPolarHBondContact O-CG 3.39Å; K375-Q379 PolarHBondContact O-N 2.93Å; K375-Q379 VanDerWaalsContact O-N 3.09Å; K375-M400 HydrophobicContact CB-SD 4.35Å; K375-M400 HydrophobicContact CD-SD 4.48Å; K375-M400 HydrophobicContact CG-CE 4.25Å; K375-M400 HydrophobicContact CG-SD 3.74Å; K375-D405 WeakPolarHBondContact CE-OD1 3.08Å; K375-D405 IonicContact NZ-OD1 3.76Å; K375-D405 PolarHBondContact NZ-OD1 2.97Å; K375-D405 IonicContact NZ-OD2 3.83Å; K375-D405 PolarHBondContact NZ-OD2 3.5Å
376	M	87.9	Confident	87.2	Confident	49 Å²	49	43.8 Å²	43.8	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-41.6	179.4	-177.8	-171.2	65.5	0	0	112.7	N372 M373 F374 R380	N372-M376 VanDerWaalsContact O-CB 3.28Å; N372-M376 WeakPolarHBondContact O-CB 3.48Å; N372-M376 PolarHBondContact O-N 3.33Å; M373-M376 HydrophobicContact CE-CE 3.58Å; M373-M376 PolarHBondContact O-N 2.86Å; M373-M376 HydrophobicContact SD-CE 3.78Å; F374-M376 PolarHBondContact O-N 2.87Å; M376-R380 WeakPolarHBondContact O-CB 3.49Å; M376-R380 VanDerWaalsContact O-CG 3.27Å; M376-R380 WeakPolarHBondContact O-CG 3.07Å; M376-R380 PolarHBondContact O-N 2.84Å; M376-R380 VanDerWaalsContact O-N 3.09Å
377	Y	88.3	Confident	87	Confident	15 Å²	15	46.2 Å²	46.2	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-75.2	-36.9	-177	-72.6	-43.6	0	0	0	113.5	M291 M373 F374 K375 R380 C381 N382 V424 Q426 V428	M291-Y377 HydrophobicContact SD-CD2 3.87Å; M291-Y377 HydrophobicContact SD-CE2 4.08Å; M373-Y377 HydrophobicContact CB-CD2 4.48Å; M373-Y377 HydrophobicContact CB-CE2 4.4Å; M373-Y377 HydrophobicContact CE-CE2 3.66Å; M373-Y377 WeakPolarHBondContact CE-OH 3.43Å; M373-Y377 WeakPolarHBondContact O-CB 3.1Å; M373-Y377 WeakPolarHBondContact O-CD2 3.49Å; M373-Y377 PolarHBondContact O-N 2.85Å; F374-Y377 PolarHBondContact O-N 2.85Å; K375-Y377 PolarHBondContact O-N 3.47Å; Y377-R380 PolarHBondContact O-N 2.6Å; Y377-C381 PolarHBondContact O-N 3.03Å; Y377-N382 HydrophobicContact CD1-CB 3.8Å; Y377-N382 WeakPolarHBondContact CD1-ND2 3.11Å; Y377-N382 HydrophobicContact CG-CB 4.29Å; Y377-N382 PolarHBondContact O-N 2.98Å; Y377-V424 HydrophobicContact CD2-CG1 3.48Å; Y377-V424 VanDerWaalsContact CD2-CG1 3.48Å; Y377-V424 HydrophobicContact CD2-CG2 4.49Å; Y377-V424 HydrophobicContact CE2-CG1 4Å; Y377-V424 HydrophobicContact CG-CG1 3.82Å; Y377-Q426 HydrophobicContact CE1-CB 3.92Å; Y377-Q426 HydrophobicContact CE1-CG 4.32Å; Y377-Q426 HydrophobicContact CE2-CB 4.45Å; Y377-V428 HydrophobicContact CE2-CG2 3.88Å
378	M	84.4	Confident	86.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-47.6	172.4	-68	165.9	62.4	0	0	110.9	V289 F374 R380 C381 T383 Y398 M400 Y420 L422	V289-M378 HydrophobicContact CG2-SD 4.44Å; F374-M378 WeakPolarHBondContact O-CG 3.4Å; F374-M378 PolarHBondContact O-N 3.25Å; M378-R380 VanDerWaalsContact C-N 3.27Å; M378-R380 PolarHBondContact O-N 2.98Å; M378-C381 PolarHBondContact O-N 2.93Å; M378-C381 VanDerWaalsContact O-N 3.14Å; M378-T383 HydrophobicContact CG-CG2 4.26Å; M378-Y398 HydrophobicContact CE-CD1 3.84Å; M378-M400 HydrophobicContact CE-SD 3.94Å; M378-M400 HydrophobicContact SD-SD 4.23Å; M378-Y420 HydrophobicContact CE-CD2 4.21Å; M378-Y420 HydrophobicContact CE-CE1 4.06Å; M378-Y420 HydrophobicContact CE-CE2 3.67Å; M378-L422 HydrophobicContact CE-CD1 4.38Å; M378-L422 HydrophobicContact CG-CD1 4.26Å
379	Q	83.6	Confident	86.6	Confident	113 Å²	113	42.3 Å²	42.3	53%	0.528	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-28.2	176.9	-73.6	174.9	-16.3	0	0	113.9	K375	K375-Q379 WeakPolarHBondContact O-CB 3.47Å; K375-Q379 VanDerWaalsContact O-CG 3.28Å; K375-Q379 WeakPolarHBondContact O-CG 3.39Å; K375-Q379 PolarHBondContact O-N 2.93Å; K375-Q379 VanDerWaalsContact O-N 3.09Å
380	R	85.8	Confident	85.8	Confident	164 Å²	164	41.6 Å²	41.6	62%	0.619	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4.1	177.5	-71.4	-179.8	-179.9	-175.3	1.2	114.1	M376 Y377 M378 N382	M376-R380 WeakPolarHBondContact O-CB 3.49Å; M376-R380 VanDerWaalsContact O-CG 3.27Å; M376-R380 WeakPolarHBondContact O-CG 3.07Å; M376-R380 PolarHBondContact O-N 2.84Å; M376-R380 VanDerWaalsContact O-N 3.09Å; Y377-R380 PolarHBondContact O-N 2.6Å; M378-R380 VanDerWaalsContact C-N 3.27Å; M378-R380 PolarHBondContact O-N 2.98Å; R380-N382 PolarHBondContact O-N 2.8Å
381	C	83	Confident	84.5	Confident	52 Å²	52	44.2 Å²	44.2	35%	0.351	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	30.5	-173.6	-43	0	0	0	0	114.3	Y377 M378 T383 C397	Y377-C381 PolarHBondContact O-N 3.03Å; M378-C381 PolarHBondContact O-N 2.93Å; M378-C381 VanDerWaalsContact O-N 3.14Å; C381-T383 PolarHBondContact O-N 3.18Å; C381-C397 HydrophobicContact CB-CB 4.03Å; C381-C397 WeakPolarHBondContact CB-SG 3.37Å; C381-C397 VanDerWaalsContact SG-CA 3.58Å; C381-C397 WeakPolarHBondContact SG-CB 3.41Å; C381-C397 CovalentContact SG-SG 2.03Å; C381-C397 PolarHBondContact SG-SG 3.22Å
382	N	85.9	Confident	83	Confident	36 Å²	36	44.9 Å²	44.9	19%	0.193	24%	0.235	C	C	.	.			trans	-81.5	40.6	173.7	-75.4	-10.1	0	0	0	111	Y377 R380 V424 T425 Q426	Y377-N382 HydrophobicContact CD1-CB 3.8Å; Y377-N382 WeakPolarHBondContact CD1-ND2 3.11Å; Y377-N382 HydrophobicContact CG-CB 4.29Å; Y377-N382 PolarHBondContact O-N 2.98Å; R380-N382 PolarHBondContact O-N 2.8Å; N382-V424 WeakPolarHBondContact O-CA 3.26Å; N382-T425 PolarHBondContact O-N 2.74Å; N382-T425 PolarHBondContact O-OG1 2.94Å; N382-Q426 VanDerWaalsContact ND2-CD 3.26Å; N382-Q426 PolarHBondContact ND2-NE2 2.93Å; N382-Q426 PolarHBondContact ND2-OE1 2.73Å
383	T	85.7	Confident	81.4	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.5	-167.6	36.3	0	0	0	0	111.4	M378 C381 S396 L422 Q423 V424	M378-T383 HydrophobicContact CG-CG2 4.26Å; C381-T383 PolarHBondContact O-N 3.18Å; T383-S396 PolarHBondContact OG1-O 3.45Å; T383-L422 HydrophobicContact CG2-CB 4.22Å; T383-L422 HydrophobicContact CG2-CD1 4.33Å; T383-Q423 CarbonylContact C-O 3.59Å; T383-Q423 WeakPolarHBondContact CA-O 3.36Å; T383-V424 HydrophobicContact CG2-CG2 3.96Å
384	I	85.8	Confident	79.7	Confident	72 Å²	72	55.2 Å²	55.2	37%	0.369	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	166.8	177.2	60.1	173.4	0	0	0	110.5	Q423 T425	I384-Q423 HydrophobicContact CG1-CB 4.11Å; I384-Q423 HydrophobicContact CG1-CG 4.38Å; I384-Q423 PolarHBondContact N-O 2.67Å; I384-Q423 PolarHBondContact O-N 2.89Å; I384-T425 HydrophobicContact CB-CG2 4.37Å; I384-T425 HydrophobicContact CD1-CG2 3.99Å; I384-T425 HydrophobicContact CG1-CG2 3.87Å; I384-T425 HydrophobicContact CG2-CG2 3.75Å
385	D	82	Confident	78.3	Confident	52 Å²	52	59.7 Å²	59.7	28%	0.278	29%	0.29	S	S	.	.			trans	-59.7	130.3	167.4	-65.9	-62.8	0	0	0	110.6	Y387 S392	D385-Y387 PolarHBondContact O-N 2.8Å; D385-S392 VanDerWaalsContact OD1-CB 3.26Å; D385-S392 WeakPolarHBondContact OD1-CB 3.33Å; D385-S392 PolarHBondContact OD1-OG 2.74Å
386	P	85.8	Confident	77	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.032	30%	0.303	C	S	.	.			trans	-61.1	108.4	173.2	-23	32.8	0	0	0	111.1	H388 F389 R421 Q423	P386-H388 PolarHBondContact O-N 3.25Å; P386-F389 HydrophobicContact CB-CD2 4.38Å; P386-F389 PolarHBondContact O-N 2.91Å; P386-R421 WeakPolarHBondContact CD-O 3.48Å; P386-Q423 HydrophobicContact CB-CB 4.36Å; P386-Q423 HydrophobicContact CG-CB 4.14Å
387	Y	83.8	Confident	75.9	Confident	56 Å²	56	61.6 Å²	61.6	22%	0.22	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.7	-168.5	70.8	-94.5	0	0	0	115.5	Y242 Q263 K266 D385	Y242-Y387 HydrophobicContact CE2-CE2 4.01Å; Y242-Y387 PolarHBondContact OH-OH 3.4Å; Q263-Y387 PolarHBondContact O-OH 3.14Å; K266-Y387 HydrophobicContact CB-CD2 4.15Å; K266-Y387 HydrophobicContact CB-CE2 4.01Å; D385-Y387 PolarHBondContact O-N 2.8Å
388	H	85.1	Confident	75	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-14.7	-170.6	52.3	-85.7	0	0	0	114	L234 I235 L238 Y242 E290 P386	L234-H388 CarbonylContact C-O 3.5Å; L234-H388 VanDerWaalsContact CA-O 3.27Å; L234-H388 WeakPolarHBondContact CA-O 3.48Å; L234-H388 HydrophobicContact CD2-CB 4.08Å; I235-H388 PolarHBondContact N-O 2.81Å; L238-H388 HydrophobicContact CD1-CB 3.61Å; Y242-H388 HydrophobicContact CE1-CB 4.41Å; E290-H388 IonicContact OE1-CE1 3.79Å; E290-H388 PolarHBondContact OE1-CE1 3.24Å; E290-H388 IonicContact OE2-CE1 2.6Å; E290-H388 IonicContact OE2-NE2 3.03Å; P386-H388 PolarHBondContact O-N 3.25Å
389	F	87	Confident	74.1	Confident	11 Å²	11	69.1 Å²	69.1	5%	0.048	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-100.8	150.1	-178.8	-82.3	-68.9	0	0	0	113.6	T210 I211 M232 D233 Y288 P386	T210-F389 HydrophobicContact CG2-CE1 3.98Å; T210-F389 HydrophobicContact CG2-CZ 4.23Å; I211-F389 HydrophobicContact CG2-CE1 4Å; I211-F389 HydrophobicContact CG2-CZ 4.13Å; M232-F389 HydrophobicContact CB-CD1 3.75Å; M232-F389 HydrophobicContact CB-CE1 4.04Å; M232-F389 HydrophobicContact CE-CB 3.62Å; M232-F389 HydrophobicContact CE-CD1 3.9Å; M232-F389 HydrophobicContact CE-CD2 3.89Å; M232-F389 HydrophobicContact CE-CG 3.54Å; D233-F389 WeakPolarHBondContact O-CA 3.14Å; D233-F389 WeakPolarHBondContact O-CD1 3.41Å; Y288-F389 HydrophobicContact CE1-CE2 4.41Å; Y288-F389 HydrophobicContact CE2-CE2 4.44Å; Y288-F389 AromaticContact CZ-CE2 3.86Å; Y288-F389 WeakPolarHBondContact OH-CE2 3.33Å; P386-F389 HydrophobicContact CB-CD2 4.38Å; P386-F389 PolarHBondContact O-N 2.91Å
390	T	72.6	Confident	73.2	Confident	46 Å²	46	64.8 Å²	64.8	28%	0.282	33%	0.333	S	S	.	.	S	Bend	trans	-73.8	131.8	174.3	56.1	0	0	0	0	113	D233 I235 R421	D233-T390 PolarHBondContact O-N 2.91Å; D233-T390 PolarHBondContact O-OG1 2.86Å; I235-T390 HydrophobicContact CG2-CG2 4.13Å; T390-R421 PolarHBondContact O-NH1 2.8Å
391	G	62.6	Low	72.2	Confident	56 Å²	56	60.3 Å²	60.3	58%	0.577	32%	0.323	S	S	*	.			trans	77	65.2	168	0	0	0	0	0	114	R421	G391-R421 VanDerWaalsContact O-CD 3.31Å; G391-R421 WeakPolarHBondContact O-CD 3.47Å; G391-R421 PolarHBondContact O-NH1 2.85Å
392	S	59.4	Low	70.9	Confident	37 Å²	37	62.2 Å²	62.2	26%	0.259	34%	0.338	S	S	.	.			trans	-98.5	133.8	164.7	-160.4	0	0	0	0	110	D385 R421	D385-S392 VanDerWaalsContact OD1-CB 3.26Å; D385-S392 WeakPolarHBondContact OD1-CB 3.33Å; D385-S392 PolarHBondContact OD1-OG 2.74Å; S392-R421 PolarHBondContact OG-O 3.42Å
393	E	56.1	Low	69.5	Low	106 Å²	106	61 Å²	61	50%	0.495	33%	0.331	S	S	.	.			trans	-83.2	124.3	170.2	-69.9	-168	169.9	0	0	109.8	K395	E393-K395 VanDerWaalsContact C-N 3.34Å; E393-K395 HydrophobicContact CB-CD 4.48Å; E393-K395 PolarHBondContact O-N 3.02Å; E393-K395 WeakPolarHBondContact OE2-CE 3.4Å; E393-K395 IonicContact OE2-NZ 3.69Å; E393-K395 PolarHBondContact OE2-NZ 2.85Å
394	R	53.1	Low	68.3	Low	234 Å²	234	60.9 Å²	60.9	88%	0.883	33%	0.331	S	S	*	.			trans	-59.3	85.5	-178	-70.3	-179.1	174.5	175.2	-1.7	113.2
395	K	59.4	Low	67.4	Low	94 Å²	94	60.7 Å²	60.7	41%	0.409	33%	0.331	S	S	.	.			trans	-139.5	95.7	179.3	-71.8	171.2	177	163.7	0	109.8	E393 L422	E393-K395 VanDerWaalsContact C-N 3.34Å; E393-K395 HydrophobicContact CB-CD 4.48Å; E393-K395 PolarHBondContact O-N 3.02Å; E393-K395 WeakPolarHBondContact OE2-CE 3.4Å; E393-K395 IonicContact OE2-NZ 3.69Å; E393-K395 PolarHBondContact OE2-NZ 2.85Å; K395-L422 WeakPolarHBondContact O-CD2 3.26Å
396	S	59.1	Low	67	Low	72 Å²	72	58.3 Å²	58.3	50%	0.503	32%	0.318	S	S	.	.	S	Bend	trans	-74.4	-24	178.1	51.2	0	0	0	0	114.1	T383	T383-S396 PolarHBondContact OG1-O 3.45Å
397	C	65.4	Low	66	Low	70 Å²	70	61.9 Å²	61.9	47%	0.473	34%	0.337	S	S	.	.			trans	-113.6	136.7	176.5	-67.6	0	0	0	0	110.3	C381	C381-C397 HydrophobicContact CB-CB 4.03Å; C381-C397 WeakPolarHBondContact CB-SG 3.37Å; C381-C397 VanDerWaalsContact SG-CA 3.58Å; C381-C397 WeakPolarHBondContact SG-CB 3.41Å; C381-C397 CovalentContact SG-SG 2.03Å; C381-C397 PolarHBondContact SG-SG 3.22Å
398	Y	69.1	Low	64.7	Low	40 Å²	40	63.1 Å²	63.1	16%	0.157	35%	0.352	C	S	.	.			trans	-136.8	118.7	168.8	-173.8	-95.4	0	0	0	110.3	M378 M400 D404 G418 Y420	M378-Y398 HydrophobicContact CE-CD1 3.84Å; Y398-M400 HydrophobicContact CD1-CB 4.47Å; Y398-M400 HydrophobicContact CE1-CB 4.49Å; Y398-M400 PolarHBondContact O-N 3.14Å; Y398-D404 WeakPolarHBondContact CE1-OD2 3.46Å; Y398-D404 PolarHBondContact OH-OD1 2.86Å; Y398-D404 PolarHBondContact OH-OD2 3.29Å; Y398-G418 VanDerWaalsContact OH-CA 3.3Å; Y398-G418 WeakPolarHBondContact OH-CA 3.3Å; Y398-Y420 AromaticContact CD1-CD1 3.9Å; Y398-Y420 HydrophobicContact CD1-CD1 3.9Å; Y398-Y420 AromaticContact CD1-CE1 3.96Å; Y398-Y420 HydrophobicContact CD1-CE1 3.96Å; Y398-Y420 HydrophobicContact CD2-CD1 4Å; Y398-Y420 AromaticContact CE1-CD1 3.75Å; Y398-Y420 HydrophobicContact CE1-CD1 3.75Å; Y398-Y420 AromaticContact CE1-CE1 3.58Å; Y398-Y420 HydrophobicContact CE1-CE1 3.58Å; Y398-Y420 AromaticContact CE2-CD1 3.88Å; Y398-Y420 HydrophobicContact CE2-CD1 3.88Å; Y398-Y420 HydrophobicContact CE2-CE1 4.47Å; Y398-Y420 HydrophobicContact CG-CD1 4.03Å; Y398-Y420 AromaticContact CZ-CD1 3.77Å; Y398-Y420 AromaticContact CZ-CE1 3.9Å
399	N	66.9	Low	63.3	Low	134 Å²	134	71.5 Å²	71.5	72%	0.717	39%	0.391	S	S	*	.			trans	-86.4	103.7	179.6	-171.4	29.9	0	0	0	109.7
400	M	63.9	Low	61.7	Low	22 Å²	22	75.3 Å²	75.3	11%	0.108	41%	0.409	C	S	.	.			trans	-73.9	128.5	-168.8	-158.4	167.1	-179.7	0	0	112.2	K375 M378 Y398 D404	K375-M400 HydrophobicContact CB-SD 4.35Å; K375-M400 HydrophobicContact CD-SD 4.48Å; K375-M400 HydrophobicContact CG-CE 4.25Å; K375-M400 HydrophobicContact CG-SD 3.74Å; M378-M400 HydrophobicContact CE-SD 3.94Å; M378-M400 HydrophobicContact SD-SD 4.23Å; Y398-M400 HydrophobicContact CD1-CB 4.47Å; Y398-M400 HydrophobicContact CE1-CB 4.49Å; Y398-M400 PolarHBondContact O-N 3.14Å; M400-D404 HydrophobicContact CE-CB 3.53Å; M400-D404 VanDerWaalsContact CE-O 3.24Å; M400-D404 WeakPolarHBondContact CE-O 3.48Å; M400-D404 HydrophobicContact CG-CB 3.51Å; M400-D404 HydrophobicContact SD-CB 4.38Å
401	T	63.7	Low	60.4	Low	69 Å²	69	74.9 Å²	74.9	42%	0.423	41%	0.413	S	S	.	.			trans	-105.1	178.2	-175.5	65.1	0	0	0	0	111.8	S403 D404	T401-S403 PolarHBondContact O-N 2.66Å; T401-S403 PolarHBondContact OG1-N 3.39Å; T401-S403 PolarHBondContact OG1-OG 2.68Å; T401-D404 PolarHBondContact N-OD2 2.95Å; T401-D404 PolarHBondContact O-N 3.28Å; T401-D404 PolarHBondContact OG1-OD2 3Å
402	S	56.1	Low	59.9	Low	93 Å²	93	78.8 Å²	78.8	65%	0.65	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-58.7	-36.6	172.1	50	0	0	0	0	112.6	D404 D405	S402-D404 PolarHBondContact O-N 3.09Å; S402-D405 PolarHBondContact O-N 3.12Å
403	S	57.1	Low	59.2	Low	9 Å²	9	84.7 Å²	84.7	6%	0.063	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-56.3	-25.8	179.6	76.3	0	0	0	0	113.7	R287 T401 D405 C406 E410	R287-S403 PolarHBondContact NH1-O 3.13Å; R287-S403 PolarHBondContact NH2-O 3.35Å; R287-S403 PolarHBondContact NH2-OG 2.79Å; T401-S403 PolarHBondContact O-N 2.66Å; T401-S403 PolarHBondContact OG1-N 3.39Å; T401-S403 PolarHBondContact OG1-OG 2.68Å; S403-D405 VanDerWaalsContact C-N 3.31Å; S403-D405 PolarHBondContact O-N 3.19Å; S403-C406 PolarHBondContact O-N 2.84Å; S403-E410 WeakPolarHBondContact CA-OE2 3.46Å; S403-E410 WeakPolarHBondContact CB-OE2 3.14Å
404	D	60.5	Low	58.7	Low	0 Å²	0	86.9 Å²	86.9	0%	0	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-87.2	2.6	-170	-57.3	-62.7	0	0	0	113.9	R287 Y398 M400 T401 S402 C406	R287-D404 IonicContact CZ-OD1 3.94Å; R287-D404 IonicContact NE-OD1 2.73Å; R287-D404 PolarHBondContact NE-OD1 3.48Å; R287-D404 IonicContact NH2-OD1 3.96Å; R287-D404 PolarHBondContact NH2-OD1 2.81Å; Y398-D404 WeakPolarHBondContact CE1-OD2 3.46Å; Y398-D404 PolarHBondContact OH-OD1 2.86Å; Y398-D404 PolarHBondContact OH-OD2 3.29Å; M400-D404 HydrophobicContact CE-CB 3.53Å; M400-D404 VanDerWaalsContact CE-O 3.24Å; M400-D404 WeakPolarHBondContact CE-O 3.48Å; M400-D404 HydrophobicContact CG-CB 3.51Å; M400-D404 HydrophobicContact SD-CB 4.38Å; T401-D404 PolarHBondContact N-OD2 2.95Å; T401-D404 PolarHBondContact O-N 3.28Å; T401-D404 PolarHBondContact OG1-OD2 3Å; S402-D404 PolarHBondContact O-N 3.09Å; D404-C406 VanDerWaalsContact C-N 3.26Å
405	D	65.9	Low	58.3	Low	69 Å²	69	79.3 Å²	79.3	37%	0.369	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-89.7	16.7	164.7	-80.1	-38.2	0	0	0	113.2	K375 S402 S403	K375-D405 WeakPolarHBondContact CE-OD1 3.08Å; K375-D405 IonicContact NZ-OD1 3.76Å; K375-D405 PolarHBondContact NZ-OD1 2.97Å; K375-D405 IonicContact NZ-OD2 3.83Å; K375-D405 PolarHBondContact NZ-OD2 3.5Å; S402-D405 PolarHBondContact O-N 3.12Å; S403-D405 VanDerWaalsContact C-N 3.31Å; S403-D405 PolarHBondContact O-N 3.19Å
406	C	73.4	Confident	57.8	Low	2 Å²	2	82.4 Å²	82.4	1%	0.014	46%	0.461	C	S	.	.			trans	66.5	31.2	169.7	-46.7	0	0	0	0	115.8	P254 F255 C279 S281 S403 D404 P408	P254-C406 HydrophobicContact CB-CB 4.08Å; P254-C406 HydrophobicContact CG-CB 4.48Å; F255-C406 WeakPolarHBondContact CE1-SG 3.45Å; C279-C406 WeakPolarHBondContact CA-SG 3.46Å; C279-C406 HydrophobicContact CB-CB 3.65Å; C279-C406 WeakPolarHBondContact CB-SG 3.47Å; C279-C406 WeakPolarHBondContact SG-CB 3.2Å; C279-C406 CovalentContact SG-SG 2.03Å; C279-C406 PolarHBondContact SG-SG 2.96Å; S281-C406 PolarHBondContact OG-O 3.15Å; S403-C406 PolarHBondContact O-N 2.84Å; D404-C406 VanDerWaalsContact C-N 3.26Å; C406-P408 WeakPolarHBondContact O-CD 3.46Å
407	D	65.9	Low	57.8	Low	79 Å²	79	81.6 Å²	81.6	42%	0.422	45%	0.449	S	S	.	.			trans	-54.3	120.2	-178.8	-166.5	-30.8	0	0	0	112.4	H409 E410	D407-H409 PolarHBondContact O-N 3.44Å; D407-H409 WeakPolarHBondContact OD1-CB 3.48Å; D407-H409 IonicContact OD1-CD2 2.74Å; D407-H409 IonicContact OD1-CG 3.53Å; D407-H409 PolarHBondContact OD1-N 2.84Å; D407-E410 HydrophobicContact CB-CG 4.43Å; D407-E410 PolarHBondContact O-N 3.23Å
408	P	56.6	Low	57.6	Low	83 Å²	83	78.5 Å²	78.5	54%	0.539	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.5	177.1	-22	34.3	0	0	0	115.1	C406	C406-P408 WeakPolarHBondContact O-CD 3.46Å
409	H	55	Low	57.9	Low	175 Å²	175	79.3 Å²	79.3	81%	0.81	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-13	-176.4	-62.1	-66.7	0	0	0	114	D407 G411	D407-H409 PolarHBondContact O-N 3.44Å; D407-H409 WeakPolarHBondContact OD1-CB 3.48Å; D407-H409 IonicContact OD1-CD2 2.74Å; D407-H409 IonicContact OD1-CG 3.53Å; D407-H409 PolarHBondContact OD1-N 2.84Å; H409-G411 PolarHBondContact O-N 3.39Å
410	E	54.5	Low	58.5	Low	91 Å²	91	73.5 Å²	73.5	43%	0.425	40%	0.403	S	S	.	.	S	Bend	trans	-77.5	67.9	168.3	-71.4	-166.4	179.7	0	0	110.8	S403 D407 I412	S403-E410 WeakPolarHBondContact CA-OE2 3.46Å; S403-E410 WeakPolarHBondContact CB-OE2 3.14Å; D407-E410 HydrophobicContact CB-CG 4.43Å; D407-E410 PolarHBondContact O-N 3.23Å; E410-I412 PolarHBondContact O-N 3.49Å
411	G	45.2	Very low	59.6	Low	37 Å²	37	73.4 Å²	73.4	38%	0.381	40%	0.402	S	S	.	.			trans	-79.4	103.6	-173.4	0	0	0	0	0	115	H409 H413	H409-G411 PolarHBondContact O-N 3.39Å; G411-H413 WeakPolarHBondContact O-CB 3.25Å; G411-H413 PolarHBondContact O-CD2 2.88Å; G411-H413 VanDerWaalsContact O-CD2 3.28Å; G411-H413 PolarHBondContact O-N 3.2Å
412	I	50.6	Low	60.8	Low	139 Å²	139	70.3 Å²	70.3	71%	0.713	38%	0.382	S	S	*	.	S	Bend	trans	48.9	30.2	150.4	-28.3	-178.3	0	0	0	116.3	E410 E417	E410-I412 PolarHBondContact O-N 3.49Å; I412-E417 WeakPolarHBondContact CA-OE1 3.44Å
413	H	45.5	Very low	62.3	Low	161 Å²	161	66.2 Å²	66.2	75%	0.745	35%	0.353	S	S	*	.			trans	-133.8	143.2	-172.6	-68.3	-22.4	0	0	0	111.8	G411 G415	G411-H413 WeakPolarHBondContact O-CB 3.25Å; G411-H413 PolarHBondContact O-CD2 2.88Å; G411-H413 VanDerWaalsContact O-CD2 3.28Å; G411-H413 PolarHBondContact O-N 3.2Å; H413-G415 PolarHBondContact O-N 3.4Å
414	E	44.7	Very low	63.8	Low	152 Å²	152	65.9 Å²	65.9	71%	0.71	35%	0.35	S	S	*	.	S	Bend	trans	69.9	-0.6	-178.7	-53.3	-158.5	136.7	0	0	119.3	K416	E414-K416 HydrophobicContact CB-CD 4.29Å; E414-K416 PolarHBondContact O-N 3.28Å; E414-K416 VanDerWaalsContact O-N 3.08Å; E414-K416 IonicContact OE2-NZ 2.99Å; E414-K416 PolarHBondContact OE2-NZ 3.37Å
415	G	46.3	Very low	65	Low	74 Å²	74	69.1 Å²	69.1	76%	0.763	37%	0.37	S	S	*	.	S	Bend	trans	63.8	21.9	163.9	0	0	0	0	0	115.9	H413 E417	H413-G415 PolarHBondContact O-N 3.4Å; G415-E417 VanDerWaalsContact C-N 3.34Å
416	K	47.8	Very low	65.8	Low	159 Å²	159	70 Å²	70	69%	0.691	37%	0.372	S	S	*	.			trans	-89.1	-2.2	175.9	-67.1	160.2	-175.5	169	0	112.9	E414	E414-K416 HydrophobicContact CB-CD 4.29Å; E414-K416 PolarHBondContact O-N 3.28Å; E414-K416 VanDerWaalsContact O-N 3.08Å; E414-K416 IonicContact OE2-NZ 2.99Å; E414-K416 PolarHBondContact OE2-NZ 3.37Å
417	E	60.1	Low	65.9	Low	56 Å²	56	73.2 Å²	73.2	26%	0.262	39%	0.386	S	S	.	.			trans	-66.5	130.1	-171.3	-64.6	169.7	-128.7	0	0	112.3	R286 I412 G415 M419	R286-E417 IonicContact CZ-OE2 2.68Å; R286-E417 IonicContact NH1-OE2 2.7Å; R286-E417 PolarHBondContact NH1-OE2 2.8Å; R286-E417 IonicContact NH2-OE2 2.86Å; I412-E417 WeakPolarHBondContact CA-OE1 3.44Å; G415-E417 VanDerWaalsContact C-N 3.34Å; E417-M419 PolarHBondContact O-N 2.91Å; E417-M419 VanDerWaalsContact O-N 3.16Å
418	G	60.8	Low	66.3	Low	5 Å²	5	69.8 Å²	69.8	5%	0.052	37%	0.368	C	S	.	.			trans	-71.4	104.6	-178.4	0	0	0	0	0	113.8	R287 Y398	R287-G418 VanDerWaalsContact CG-O 3.24Å; R287-G418 WeakPolarHBondContact CG-O 3.46Å; R287-G418 PolarHBondContact NE-O 2.71Å; Y398-G418 VanDerWaalsContact OH-CA 3.3Å; Y398-G418 WeakPolarHBondContact OH-CA 3.3Å
419	M	75.5	Confident	66.7	Low	57 Å²	57	71.8 Å²	71.8	28%	0.281	37%	0.37	S	S	.	.			trans	-91.8	120.3	161.9	-174.9	163.9	177.8	0	0	110.4	L229 R286 E417	L229-M419 HydrophobicContact CD1-CE 4.42Å; L229-M419 HydrophobicContact CD2-CE 4.41Å; R286-M419 HydrophobicContact CB-CB 4.38Å; R286-M419 HydrophobicContact CB-CG 4.01Å; R286-M419 HydrophobicContact CB-SD 4.36Å; R286-M419 CarbonylContact O-C 3.52Å; R286-M419 WeakPolarHBondContact O-CA 3.43Å; E417-M419 PolarHBondContact O-N 2.91Å; E417-M419 VanDerWaalsContact O-N 3.16Å
420	Y	80.3	Confident	67.1	Low	12 Å²	12	66.3 Å²	66.3	5%	0.047	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	142.8	176.7	56.5	-102.8	0	0	0	111.8	R286 R287 Y288 M378 Y398 L422	R286-Y420 CarbonylContact O-C 3.57Å; R286-Y420 PolarHBondContact O-N 2.85Å; R287-Y420 HydrophobicContact CB-CE2 4.12Å; R287-Y420 HydrophobicContact CG-CD1 4.49Å; R287-Y420 HydrophobicContact CG-CE1 3.9Å; R287-Y420 HydrophobicContact CG-CE2 4.3Å; Y288-Y420 PolarHBondContact N-O 3.5Å; M378-Y420 HydrophobicContact CE-CD2 4.21Å; M378-Y420 HydrophobicContact CE-CE1 4.06Å; M378-Y420 HydrophobicContact CE-CE2 3.67Å; Y398-Y420 AromaticContact CD1-CD1 3.9Å; Y398-Y420 HydrophobicContact CD1-CD1 3.9Å; Y398-Y420 AromaticContact CD1-CE1 3.96Å; Y398-Y420 HydrophobicContact CD1-CE1 3.96Å; Y398-Y420 HydrophobicContact CD2-CD1 4Å; Y398-Y420 AromaticContact CE1-CD1 3.75Å; Y398-Y420 HydrophobicContact CE1-CD1 3.75Å; Y398-Y420 AromaticContact CE1-CE1 3.58Å; Y398-Y420 HydrophobicContact CE1-CE1 3.58Å; Y398-Y420 AromaticContact CE2-CD1 3.88Å; Y398-Y420 HydrophobicContact CE2-CD1 3.88Å; Y398-Y420 HydrophobicContact CE2-CE1 4.47Å; Y398-Y420 HydrophobicContact CG-CD1 4.03Å; Y398-Y420 AromaticContact CZ-CD1 3.77Å; Y398-Y420 AromaticContact CZ-CE1 3.9Å; Y420-L422 HydrophobicContact CD2-CD1 3.96Å; Y420-L422 HydrophobicContact CD2-CG 4.25Å; Y420-L422 HydrophobicContact CG-CD1 4.21Å
421	R	86.8	Confident	66.8	Low	20 Å²	20	65.8 Å²	65.8	8%	0.075	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	107.3	175.2	-67.6	172.9	170.9	-175.1	-10.4	106.4	M232 I285 Y288 P386 T390 G391 S392	M232-R421 HydrophobicContact CE-CG 4.38Å; M232-R421 HydrophobicContact SD-CG 4.29Å; M232-R421 VanDerWaalsContact SD-CZ 3.54Å; M232-R421 PolarHBondContact SD-NE 3.39Å; M232-R421 VanDerWaalsContact SD-NE 3.39Å; I285-R421 PolarHBondContact O-NE 2.8Å; I285-R421 PolarHBondContact O-NH2 3.01Å; Y288-R421 CarbonylContact O-C 3.5Å; Y288-R421 WeakPolarHBondContact O-CA 3.46Å; P386-R421 WeakPolarHBondContact CD-O 3.48Å; T390-R421 PolarHBondContact O-NH1 2.8Å; G391-R421 VanDerWaalsContact O-CD 3.31Å; G391-R421 WeakPolarHBondContact O-CD 3.47Å; G391-R421 PolarHBondContact O-NH1 2.85Å; S392-R421 PolarHBondContact OG-O 3.42Å
422	L	87.3	Confident	67.3	Low	3 Å²	3	67.3 Å²	67.3	2%	0.016	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.3	-163.9	-62.7	175.5	0	0	0	113.2	Y288 V289 E290 M378 T383 K395 Y420	Y288-L422 PolarHBondContact O-N 2.84Å; V289-L422 CarbonylContact C-O 3.31Å; V289-L422 VanDerWaalsContact CA-O 3.3Å; V289-L422 WeakPolarHBondContact CA-O 3.37Å; V289-L422 HydrophobicContact CG2-CB 4.1Å; E290-L422 PolarHBondContact N-O 2.89Å; M378-L422 HydrophobicContact CE-CD1 4.38Å; M378-L422 HydrophobicContact CG-CD1 4.26Å; T383-L422 HydrophobicContact CG2-CB 4.22Å; T383-L422 HydrophobicContact CG2-CD1 4.33Å; K395-L422 WeakPolarHBondContact O-CD2 3.26Å; Y420-L422 HydrophobicContact CD2-CD1 3.96Å; Y420-L422 HydrophobicContact CD2-CG 4.25Å; Y420-L422 HydrophobicContact CG-CD1 4.21Å
423	Q	88.9	Confident	67.4	Low	8 Å²	8	62 Å²	62	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.6	169.2	173.5	-174.1	-20.7	0	0	108.9	E290 T383 I384 P386	E290-Q423 HydrophobicContact CG-CB 4.02Å; E290-Q423 HydrophobicContact CG-CG 4.19Å; E290-Q423 WeakPolarHBondContact OE1-CG 3.48Å; T383-Q423 CarbonylContact C-O 3.59Å; T383-Q423 WeakPolarHBondContact CA-O 3.36Å; I384-Q423 HydrophobicContact CG1-CB 4.11Å; I384-Q423 HydrophobicContact CG1-CG 4.38Å; I384-Q423 PolarHBondContact N-O 2.67Å; I384-Q423 PolarHBondContact O-N 2.89Å; P386-Q423 HydrophobicContact CB-CB 4.36Å; P386-Q423 HydrophobicContact CG-CB 4.14Å
424	V	89	Confident	67.4	Low	1 Å²	1	57 Å²	57	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.9	172.8	175.1	0	0	0	0	110	V289 E290 M291 P292 F374 Y377 N382 T383	V289-V424 HydrophobicContact CG2-CG2 4.3Å; E290-V424 PolarHBondContact O-N 3.12Å; M291-V424 HydrophobicContact CB-CB 4.07Å; M291-V424 HydrophobicContact CB-CG2 4.06Å; M291-V424 HydrophobicContact CG-CB 4.02Å; M291-V424 HydrophobicContact CG-CG1 4.06Å; M291-V424 HydrophobicContact CG-CG2 4.21Å; M291-V424 HydrophobicContact SD-CG2 4.49Å; P292-V424 VanDerWaalsContact CD-O 3.26Å; P292-V424 WeakPolarHBondContact CD-O 3.22Å; F374-V424 HydrophobicContact CD1-CG2 4.47Å; Y377-V424 HydrophobicContact CD2-CG1 3.48Å; Y377-V424 VanDerWaalsContact CD2-CG1 3.48Å; Y377-V424 HydrophobicContact CD2-CG2 4.49Å; Y377-V424 HydrophobicContact CE2-CG1 4Å; Y377-V424 HydrophobicContact CG-CG1 3.82Å; N382-V424 WeakPolarHBondContact O-CA 3.26Å; T383-V424 HydrophobicContact CG2-CG2 3.96Å
425	T	84.3	Confident	68	Low	68 Å²	68	51.4 Å²	51.4	42%	0.417	26%	0.259	S	S	.	.			trans	-89.6	-16.9	-176.4	58.4	0	0	0	0	114.6	N382 I384	N382-T425 PolarHBondContact O-N 2.74Å; N382-T425 PolarHBondContact O-OG1 2.94Å; I384-T425 HydrophobicContact CB-CG2 4.37Å; I384-T425 HydrophobicContact CD1-CG2 3.99Å; I384-T425 HydrophobicContact CG1-CG2 3.87Å; I384-T425 HydrophobicContact CG2-CG2 3.75Å
426	Q	82.7	Confident	68.4	Low	88 Å²	88	55.3 Å²	55.3	41%	0.411	26%	0.256	S	S	.	.	S	Bend	trans	-100.4	132.8	-178.7	-63.4	-164.8	-6.3	0	0	111.9	Y377 N382	Y377-Q426 HydrophobicContact CE1-CB 3.92Å; Y377-Q426 HydrophobicContact CE1-CG 4.32Å; Y377-Q426 HydrophobicContact CE2-CB 4.45Å; N382-Q426 VanDerWaalsContact ND2-CD 3.26Å; N382-Q426 PolarHBondContact ND2-NE2 2.93Å; N382-Q426 PolarHBondContact ND2-OE1 2.73Å
427	F	76	Confident	68.9	Low	69 Å²	69	51.1 Å²	51.1	30%	0.303	24%	0.24	S	C	.	.			trans	-69.5	125.8	174.3	-71.3	-90.3	0	0	0	111.3	V264 H272 P292 E294 Q429	V264-F427 HydrophobicContact CG1-CZ 4.4Å; H272-F427 HydrophobicContact CB-CE1 4.25Å; H272-F427 AromaticContact CD2-CE1 3.86Å; P292-F427 HydrophobicContact CB-CD1 3.64Å; P292-F427 HydrophobicContact CB-CE1 3.73Å; P292-F427 HydrophobicContact CB-CG 4.32Å; P292-F427 HydrophobicContact CB-CZ 4.44Å; P292-F427 HydrophobicContact CG-CD1 4.13Å; P292-F427 HydrophobicContact CG-CE1 4.41Å; P292-F427 HydrophobicContact CG-CG 4.32Å; E294-F427 HydrophobicContact CG-CD1 3.63Å; E294-F427 HydrophobicContact CG-CE1 4.2Å; E294-F427 HydrophobicContact CG-CG 4.38Å; F427-Q429 HydrophobicContact CB-CG 4.22Å; F427-Q429 PolarHBondContact O-N 2.89Å; F427-Q429 VanDerWaalsContact O-N 3.11Å
428	V	74.4	Confident	69.6	Low	7 Å²	7	48.6 Å²	48.6	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	95.8	168.7	178.6	0	0	0	0	108.4	M291 P292 L293 E294 M373 Y377	M291-V428 HydrophobicContact CE-CG2 3.95Å; M291-V428 HydrophobicContact CG-CG2 3.85Å; M291-V428 HydrophobicContact SD-CG2 3.46Å; M291-V428 WeakPolarHBondContact SD-CG2 3.37Å; P292-V428 PolarHBondContact O-N 3.27Å; L293-V428 HydrophobicContact CD2-CB 3.98Å; L293-V428 HydrophobicContact CD2-CG1 4.45Å; E294-V428 PolarHBondContact N-O 3.44Å; M373-V428 HydrophobicContact CB-CG2 4.34Å; M373-V428 HydrophobicContact CE-CG2 4.1Å; Y377-V428 HydrophobicContact CE2-CG2 3.88Å
429	Q	65.9	Low	70.4	Confident	126 Å²	126	54.4 Å²	54.4	59%	0.589	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.7	175.7	-63.3	-175.7	-17.2	0	0	109.6	E294 I296 F427	E294-Q429 HydrophobicContact CB-CG 4.3Å; E294-Q429 WeakPolarHBondContact OE2-CG 3.39Å; E294-Q429 PolarHBondContact OE2-NE2 3.4Å; I296-Q429 HydrophobicContact CD1-CB 4.02Å; I296-Q429 VanDerWaalsContact CD1-CD 3.4Å; I296-Q429 HydrophobicContact CD1-CG 3.62Å; F427-Q429 HydrophobicContact CB-CG 4.22Å; F427-Q429 PolarHBondContact O-N 2.89Å; F427-Q429 VanDerWaalsContact O-N 3.11Å
430	R	62	Low	70.9	Confident	60 Å²	60	57.3 Å²	57.3	23%	0.226	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.7	176.4	-169	160.6	169	132.8	-2.6	112.2	H369	H369-R430 PolarHBondContact CD2-NH1 2.83Å; H369-R430 PolarHBondContact NE2-NH1 2.92Å
431	L	48.9	Very low	71.3	Confident	80 Å²	80	57.1 Å²	57.1	42%	0.419	27%	0.27	S	S	.	.			trans	-102.7	142.9	-179.9	-74.6	148.7	0	0	0	108.6	I296 T298	I296-L431 WeakPolarHBondContact O-CD2 3.31Å; T298-L431 HydrophobicContact CG2-CD2 4.2Å; T298-L431 VanDerWaalsContact OG1-CD2 3.28Å; T298-L431 WeakPolarHBondContact OG1-CD2 3.36Å
432	E	56.4	Low	71.6	Confident	69 Å²	69	57.7 Å²	57.7	32%	0.322	27%	0.274	S	S	.	.			cis	-174.7	133.4	-1.8	-178.9	166.2	-150.2	0	0	109	S297 T298 K300 W434	S297-E432 WeakPolarHBondContact CA-OE1 3.46Å; S297-E432 WeakPolarHBondContact CB-OE1 3.28Å; S297-E432 PolarHBondContact OG-OE1 3.49Å; T298-E432 PolarHBondContact N-OE1 3.25Å; K300-E432 IonicContact NZ-OE2 3.91Å; K300-E432 PolarHBondContact NZ-OE2 3.21Å; E432-W434 HydrophobicContact CG-CB 4.41Å
433	F	51.6	Low	71.9	Confident	27 Å²	27	57.6 Å²	57.6	12%	0.118	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-133.9	74.2	155.2	-168.2	-89	0	0	0	110.5	V362 H435 V469 S472	V362-F433 HydrophobicContact CB-CB 4.45Å; V362-F433 HydrophobicContact CB-CD1 4.15Å; V362-F433 PolarHBondContact N-O 2.85Å; V362-F433 CarbonylContact O-C 3.56Å; V362-F433 VanDerWaalsContact O-C 3.28Å; V362-F433 VanDerWaalsContact O-CA 3.29Å; V362-F433 WeakPolarHBondContact O-CA 3.31Å; V362-F433 VanDerWaalsContact O-CB 3.3Å; V362-F433 WeakPolarHBondContact O-CB 3.46Å; V362-F433 PolarHBondContact O-N 2.96Å; V362-F433 VanDerWaalsContact O-N 3.1Å; F433-H435 HydrophobicContact CE1-CB 4.05Å; F433-H435 HydrophobicContact CZ-CB 4.31Å; F433-V469 HydrophobicContact CE1-CG1 3.75Å; F433-V469 HydrophobicContact CZ-CG1 3.49Å; F433-V469 VanDerWaalsContact CZ-CG1 3.49Å; F433-S472 WeakPolarHBondContact CE2-O 3.3Å
434	W	46.9	Very low	72.3	Confident	57 Å²	57	58.4 Å²	58.4	22%	0.216	28%	0.279	C	S	.	.			trans	-95.9	99.7	169.4	175.7	-99.4	0	0	0	109.7	F312 N359 S360 A361 E432 K439	F312-W434 HydrophobicContact CD1-CZ3 4.23Å; F312-W434 AromaticContact CE1-CE3 3.97Å; F312-W434 HydrophobicContact CE1-CE3 3.97Å; F312-W434 AromaticContact CE1-CH2 3.9Å; F312-W434 HydrophobicContact CE1-CH2 3.9Å; F312-W434 AromaticContact CE1-CZ3 3.29Å; F312-W434 HydrophobicContact CE1-CZ3 3.29Å; F312-W434 AromaticContact CE2-CE3 3.84Å; F312-W434 HydrophobicContact CE2-CE3 3.84Å; F312-W434 HydrophobicContact CE2-CZ3 4Å; F312-W434 HydrophobicContact CZ-CD2 4.21Å; F312-W434 AromaticContact CZ-CE3 3.44Å; F312-W434 HydrophobicContact CZ-CE3 3.44Å; F312-W434 VanDerWaalsContact CZ-CE3 3.44Å; F312-W434 AromaticContact CZ-CH2 3.72Å; F312-W434 HydrophobicContact CZ-CH2 3.72Å; F312-W434 HydrophobicContact CZ-CZ2 4.42Å; F312-W434 AromaticContact CZ-CZ3 3.14Å; F312-W434 HydrophobicContact CZ-CZ3 3.14Å; N359-W434 HydrophobicContact CB-CH2 4.36Å; S360-W434 WeakPolarHBondContact O-CZ3 3.41Å; A361-W434 HydrophobicContact CB-CE3 3.74Å; A361-W434 HydrophobicContact CB-CZ3 4.19Å; E432-W434 HydrophobicContact CG-CB 4.41Å; W434-K439 HydrophobicContact CZ2-CB 4.23Å
435	H	56.2	Low	72.6	Confident	33 Å²	33	58.4 Å²	58.4	15%	0.153	28%	0.279	C	S	.	.			trans	-84.8	139.2	165.4	-155.7	-94.7	0	0	0	110.5	F433 D437 L438 T475	F433-H435 HydrophobicContact CE1-CB 4.05Å; F433-H435 HydrophobicContact CZ-CB 4.31Å; H435-D437 IonicContact CE1-OD1 2.86Å; H435-D437 IonicContact CE1-OD2 3.17Å; H435-D437 PolarHBondContact CE1-OD2 3.15Å; H435-D437 VanDerWaalsContact ND1-CG 3.34Å; H435-D437 IonicContact ND1-OD1 2.57Å; H435-D437 IonicContact ND1-OD2 2.71Å; H435-D437 PolarHBondContact ND1-OD2 2.91Å; H435-D437 PolarHBondContact O-N 3.2Å; H435-D437 VanDerWaalsContact O-N 3.09Å; H435-L438 PolarHBondContact O-N 2.92Å; H435-T475 PolarHBondContact CD2-O 3.04Å; H435-T475 VanDerWaalsContact CD2-O 3.25Å
436	K	55.1	Low	73	Confident	157 Å²	157	55.4 Å²	55.4	68%	0.683	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.6	-174.7	-67.5	179.9	-179	174.7	0	113.6	L438 K439	K436-L438 VanDerWaalsContact C-N 3.26Å; K436-L438 PolarHBondContact O-N 2.74Å; K436-K439 VanDerWaalsContact O-CB 3.28Å; K436-K439 WeakPolarHBondContact O-CB 3.37Å; K436-K439 PolarHBondContact O-N 2.81Å
437	D	57.1	Low	73.5	Confident	70 Å²	70	51.6 Å²	51.6	37%	0.374	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-80.4	-5.2	-175.1	-48.4	-31.1	0	0	0	113.3	H435 K439 P477	H435-D437 IonicContact CE1-OD1 2.86Å; H435-D437 IonicContact CE1-OD2 3.17Å; H435-D437 PolarHBondContact CE1-OD2 3.15Å; H435-D437 VanDerWaalsContact ND1-CG 3.34Å; H435-D437 IonicContact ND1-OD1 2.57Å; H435-D437 IonicContact ND1-OD2 2.71Å; H435-D437 PolarHBondContact ND1-OD2 2.91Å; H435-D437 PolarHBondContact O-N 3.2Å; H435-D437 VanDerWaalsContact O-N 3.09Å; D437-K439 VanDerWaalsContact C-N 3.31Å; D437-P477 HydrophobicContact CB-CG 4.44Å; D437-P477 WeakPolarHBondContact OD2-CD 3.38Å
438	L	75.1	Confident	74.3	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-89.4	3.3	169.1	-56.8	-179.6	0	0	0	112.8	S360 V362 H435 K436 T441 V443 L459 I467	S360-L438 PolarHBondContact N-O 2.04Å; S360-L438 WeakPolarHBondContact O-CB 3.48Å; S360-L438 WeakPolarHBondContact O-CD1 3.47Å; V362-L438 HydrophobicContact CG2-CD1 4.32Å; H435-L438 PolarHBondContact O-N 2.92Å; K436-L438 VanDerWaalsContact C-N 3.26Å; K436-L438 PolarHBondContact O-N 2.74Å; L438-T441 PolarHBondContact O-N 2.02Å; L438-V443 HydrophobicContact CD2-CG2 4.03Å; L438-L459 HydrophobicContact CD2-CD1 4.36Å; L438-I467 HydrophobicContact CD2-CD1 4.32Å
439	K	78.4	Confident	74.9	Confident	127 Å²	127	48.7 Å²	48.7	55%	0.552	23%	0.231	S	C	*	.	B	Isolated β-bridge	trans	-69.6	137	163.9	-171.5	-166.9	170.3	-170.4	0	109.1	W434 K436 D437 T441	W434-K439 HydrophobicContact CZ2-CB 4.23Å; K436-K439 VanDerWaalsContact O-CB 3.28Å; K436-K439 WeakPolarHBondContact O-CB 3.37Å; K436-K439 PolarHBondContact O-N 2.81Å; D437-K439 VanDerWaalsContact C-N 3.31Å; K439-T441 PolarHBondContact O-N 3.04Å
440	N	85.7	Confident	75.9	Confident	118 Å²	118	44.9 Å²	44.9	63%	0.631	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	25.4	-174.1	-62.5	26.8	0	0	0	113.4	P358 N359	P358-N440 CarbonylContact O-C 3.58Å; P358-N440 VanDerWaalsContact O-C 3.22Å; P358-N440 WeakPolarHBondContact O-CA 3.29Å; P358-N440 PolarHBondContact O-N 2.95Å; N359-N440 PolarHBondContact OD1-N 2.91Å
441	T	88.8	Confident	77	Confident	9 Å²	9	42.1 Å²	42.1	6%	0.055	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-132	130.6	172.4	-65.1	0	0	0	0	108.9	P358 S360 L438 K439 T461 R465 I467	P358-T441 CarbonylContact C-O 3.44Å; P358-T441 PolarHBondContact O-N 3.07Å; S360-T441 PolarHBondContact N-O 3.11Å; L438-T441 PolarHBondContact O-N 2.02Å; K439-T441 PolarHBondContact O-N 3.04Å; T441-T461 HydrophobicContact CG2-CG2 3.53Å; T441-R465 PolarHBondContact OG1-NH2 3.14Å; T441-I467 HydrophobicContact CG2-CD1 4.47Å
442	L	93.6	Very high	78.5	Confident	32 Å²	32	42.3 Å²	42.3	17%	0.168	21%	0.208	C	C	.	.			trans	-96.9	117.3	169.1	179.1	57.6	0	0	0	109	Q316 A347 P356 P358 T461 A462	Q316-L442 HydrophobicContact CG-CD1 3.95Å; A347-L442 HydrophobicContact CB-CD1 3.84Å; P356-L442 HydrophobicContact CB-CD1 3.89Å; P356-L442 HydrophobicContact CB-CD2 4.48Å; P356-L442 HydrophobicContact CG-CD1 4.14Å; P356-L442 HydrophobicContact CG-CD2 3.93Å; P358-L442 HydrophobicContact CB-CB 4.46Å; L442-T461 CarbonylContact O-C 3.55Å; L442-T461 VanDerWaalsContact O-CA 3.26Å; L442-T461 WeakPolarHBondContact O-CA 3.39Å; L442-T461 WeakPolarHBondContact O-CB 3.22Å; L442-A462 HydrophobicContact CB-CB 3.9Å; L442-A462 HydrophobicContact CD2-CB 3.97Å; L442-A462 HydrophobicContact CG-CB 4.08Å; L442-A462 PolarHBondContact O-N 2.87Å
443	V	94	Very high	79.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	128.8	172.4	174.9	0	0	0	0	109	Q316 A345 S360 L438 S445 L459 G460	Q316-V443 WeakPolarHBondContact CB-O 3.4Å; Q316-V443 WeakPolarHBondContact CG-O 3.41Å; A345-V443 HydrophobicContact CB-CB 4.32Å; A345-V443 HydrophobicContact CB-CG1 3.69Å; S360-V443 PolarHBondContact OG-N 3.25Å; L438-V443 HydrophobicContact CD2-CG2 4.03Å; V443-S445 WeakPolarHBondContact CG1-O 3.36Å; V443-L459 HydrophobicContact CG1-CB 4.32Å; V443-L459 HydrophobicContact CG1-CD2 4.32Å; V443-G460 CarbonylContact C-O 3.58Å; V443-G460 WeakPolarHBondContact CA-O 3.19Å
444	T	95.4	Very high	81.2	Confident	26 Å²	26	41 Å²	41	16%	0.16	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-19.8	-178.8	52	0	0	0	0	113.5	G460 T461 A462 V488	T444-G460 PolarHBondContact N-O 2.86Å; T444-G460 PolarHBondContact OG1-O 2.97Å; T444-T461 PolarHBondContact OG1-O 2.84Å; T444-A462 HydrophobicContact CG2-CB 3.77Å; T444-V488 WeakPolarHBondContact CB-O 3.42Å; T444-V488 PolarHBondContact OG1-O 3.5Å
445	S	95.3	Very high	83.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	153.7	175.2	68.9	0	0	0	0	112.4	V443 L459 G460 S489	V443-S445 WeakPolarHBondContact CG1-O 3.36Å; S445-L459 WeakPolarHBondContact O-CA 3Å; S445-G460 PolarHBondContact N-O 3.13Å; S445-G460 PolarHBondContact O-N 2.93Å; S445-G460 WeakPolarHBondContact OG-CA 3.28Å; S445-G460 PolarHBondContact OG-N 2.94Å; S445-S489 WeakPolarHBondContact CB-O 3.4Å; S445-S489 PolarHBondContact OG-O 3.19Å
446	I	94.1	Very high	84.6	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.7	174.9	-178.3	164.6	0	0	0	109.7	A317 A318 H319 F343 A345 V362 V448 Y458 L459	A317-I446 HydrophobicContact CB-CG2 3.89Å; A318-I446 VanDerWaalsContact CA-CG2 3.5Å; H319-I446 HydrophobicContact CB-CG2 4.38Å; F343-I446 HydrophobicContact CB-CD1 4Å; A345-I446 HydrophobicContact CB-CB 4.44Å; A345-I446 HydrophobicContact CB-CG2 4.29Å; V362-I446 HydrophobicContact CG1-CD1 3.85Å; V362-I446 HydrophobicContact CG2-CD1 4.41Å; I446-V448 HydrophobicContact CD1-CG2 4.17Å; I446-V448 HydrophobicContact CG1-CG2 3.93Å; I446-Y458 WeakPolarHBondContact CA-O 3.32Å; I446-L459 HydrophobicContact CB-CD2 3.88Å; I446-L459 HydrophobicContact CD1-CD2 3.69Å; I446-L459 HydrophobicContact CG1-CD2 3.6Å
447	T	93.3	Very high	86.3	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.043	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	146.3	168.9	-75	0	0	0	0	108.1	V449 Y458 V492 L494 V504	T447-V449 HydrophobicContact CG2-CG2 4.22Å; T447-Y458 PolarHBondContact N-O 2.78Å; T447-Y458 PolarHBondContact O-N 2.95Å; T447-V492 HydrophobicContact CG2-CG1 4.31Å; T447-V492 WeakPolarHBondContact OG1-CG1 3.36Å; T447-L494 HydrophobicContact CG2-CD1 3.73Å; T447-L494 HydrophobicContact CG2-CD2 3.95Å; T447-L494 HydrophobicContact CG2-CG 3.87Å; T447-V504 HydrophobicContact CG2-CG2 4.19Å
448	V	91.3	Very high	88	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	123.5	-169.1	-173	0	0	0	0	109.9	H319 T321 F343 I446 T455 V456 A457	H319-V448 PolarHBondContact CD2-N 3.36Å; H319-V448 VanDerWaalsContact CD2-N 3.26Å; H319-V448 PolarHBondContact NE2-O 3.44Å; T321-V448 HydrophobicContact CG2-CB 3.95Å; T321-V448 HydrophobicContact CG2-CG1 3.92Å; F343-V448 HydrophobicContact CB-CG2 3.78Å; F343-V448 HydrophobicContact CD1-CG1 4.25Å; F343-V448 HydrophobicContact CD1-CG2 4.01Å; F343-V448 HydrophobicContact CD2-CB 4.27Å; F343-V448 HydrophobicContact CD2-CG1 4.17Å; F343-V448 HydrophobicContact CD2-CG2 4.12Å; F343-V448 HydrophobicContact CE1-CG1 4.1Å; F343-V448 HydrophobicContact CE2-CG1 4.02Å; F343-V448 HydrophobicContact CG-CB 4.35Å; F343-V448 HydrophobicContact CG-CG1 4.3Å; F343-V448 HydrophobicContact CG-CG2 3.72Å; F343-V448 HydrophobicContact CZ-CG1 4Å; I446-V448 HydrophobicContact CD1-CG2 4.17Å; I446-V448 HydrophobicContact CG1-CG2 3.93Å; V448-T455 HydrophobicContact CG1-CG2 3.37Å; V448-V456 WeakPolarHBondContact CA-O 3.38Å; V448-A457 HydrophobicContact CG2-CB 4.13Å
449	V	88.5	Confident	88.9	Confident	13 Å²	13	26.7 Å²	26.7	8%	0.079	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.6	-171.5	-169.9	0	0	0	0	110.2	T447 V451 V456 Y458 L494 L517	T447-V449 HydrophobicContact CG2-CG2 4.22Å; V449-V451 HydrophobicContact CB-CG2 4.46Å; V449-V451 HydrophobicContact CG1-CG2 4.32Å; V449-V451 PolarHBondContact O-N 2.88Å; V449-V456 PolarHBondContact N-O 2.65Å; V449-V456 PolarHBondContact O-N 2.98Å; V449-Y458 HydrophobicContact CB-CE2 3.9Å; V449-Y458 HydrophobicContact CG2-CD2 4.27Å; V449-Y458 HydrophobicContact CG2-CE2 3.9Å; V449-L494 HydrophobicContact CG2-CD1 3.7Å; V449-L494 HydrophobicContact CG2-CD2 3.68Å; V449-L494 HydrophobicContact CG2-CG 4.36Å; V449-L517 HydrophobicContact CB-CD2 4.27Å; V449-L517 HydrophobicContact CG1-CD1 4.18Å; V449-L517 HydrophobicContact CG1-CD2 4.27Å; V449-L517 HydrophobicContact CG2-CD2 4.03Å
450	P	86.2	Confident	89.8	Confident	46 Å²	46	20.7 Å²	20.7	30%	0.299	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	117.5	167.9	29.9	-32.7	0	0	0	110.7	R454	P450-R454 CarbonylContact C-O 3.59Å; P450-R454 WeakPolarHBondContact CA-O 3.45Å
451	V	84.9	Confident	90.2	Very high	2 Å²	2	15 Å²	15	1%	0.012	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.2	177.9	-176.6	0	0	0	0	109	V449 G453 R454 V456 Y458 L517 I518 V537	V449-V451 HydrophobicContact CB-CG2 4.46Å; V449-V451 HydrophobicContact CG1-CG2 4.32Å; V449-V451 PolarHBondContact O-N 2.88Å; V451-G453 PolarHBondContact O-N 2.92Å; V451-R454 PolarHBondContact N-O 3.26Å; V451-R454 PolarHBondContact O-N 3.47Å; V451-V456 HydrophobicContact CB-CG2 4.23Å; V451-V456 HydrophobicContact CG2-CG2 4.38Å; V451-Y458 WeakPolarHBondContact CG2-OH 3.18Å; V451-L517 HydrophobicContact CG2-CB 4.06Å; V451-I518 HydrophobicContact CG1-CG2 4.27Å; V451-V537 HydrophobicContact CB-CG1 4.44Å; V451-V537 HydrophobicContact CG1-CG1 4.13Å
452	N	81.4	Confident	90.5	Very high	84 Å²	84	16.2 Å²	16.2	45%	0.449	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	40	179.6	-52.9	-25.2	0	0	0	113.9	R454 K536 V537	N452-R454 VanDerWaalsContact C-N 3.35Å; N452-K536 VanDerWaalsContact CB-O 3.29Å; N452-K536 WeakPolarHBondContact CB-O 3.43Å; N452-K536 PolarHBondContact ND2-O 3.19Å; N452-V537 PolarHBondContact ND2-O 2.67Å
453	G	79.8	Confident	90.5	Very high	40 Å²	40	18.3 Å²	18.3	41%	0.412	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	19.9	-177.8	0	0	0	0	0	114.8	V451	V451-G453 PolarHBondContact O-N 2.92Å
454	R	83.3	Confident	90.4	Very high	28 Å²	28	18.3 Å²	18.3	11%	0.106	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	141	174.3	-67.5	-60.2	-58.1	-83.5	7.1	112.6	D326 P450 V451 N452 L470 F471	D326-R454 IonicContact OD1-NE 2.81Å; D326-R454 VanDerWaalsContact OD2-CA 3.25Å; D326-R454 WeakPolarHBondContact OD2-CA 3.35Å; D326-R454 WeakPolarHBondContact OD2-CD 3.46Å; D326-R454 IonicContact OD2-CZ 3.93Å; D326-R454 IonicContact OD2-NE 3.39Å; D326-R454 PolarHBondContact OD2-NE 2.89Å; P450-R454 CarbonylContact C-O 3.59Å; P450-R454 WeakPolarHBondContact CA-O 3.45Å; V451-R454 PolarHBondContact N-O 3.26Å; V451-R454 PolarHBondContact O-N 3.47Å; N452-R454 VanDerWaalsContact C-N 3.35Å; R454-L470 HydrophobicContact CB-CD1 3.7Å; R454-L470 HydrophobicContact CG-CD1 4.23Å; R454-F471 PolarHBondContact NH2-O 3.34Å
455	T	87.3	Confident	90.3	Very high	3 Å²	3	19 Å²	19	2%	0.018	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122.5	178.3	-49.1	0	0	0	0	110.7	D326 L329 F343 V448 F471	D326-T455 WeakPolarHBondContact CB-OG1 3.25Å; D326-T455 PolarHBondContact OD2-N 2.97Å; L329-T455 HydrophobicContact CD2-CG2 4.11Å; L329-T455 WeakPolarHBondContact CD2-OG1 3.02Å; F343-T455 HydrophobicContact CE1-CG2 4.42Å; F343-T455 HydrophobicContact CZ-CG2 3.93Å; V448-T455 HydrophobicContact CG1-CG2 3.37Å; T455-F471 WeakPolarHBondContact O-CB 3.44Å; T455-F471 PolarHBondContact O-N 2.96Å
456	V	88.4	Confident	90.1	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.5	-178.5	-177.6	0	0	0	0	109.8	V448 V449 V451 Y458 Q468 L470 V537	V448-V456 WeakPolarHBondContact CA-O 3.38Å; V449-V456 PolarHBondContact N-O 2.65Å; V449-V456 PolarHBondContact O-N 2.98Å; V451-V456 HydrophobicContact CB-CG2 4.23Å; V451-V456 HydrophobicContact CG2-CG2 4.38Å; V456-Y458 HydrophobicContact CB-CE2 3.81Å; V456-Y458 HydrophobicContact CG1-CD2 4.26Å; V456-Y458 HydrophobicContact CG1-CE2 3.64Å; V456-Y458 WeakPolarHBondContact O-CD2 2.98Å; V456-Y458 VanDerWaalsContact O-CE2 3.3Å; V456-Y458 WeakPolarHBondContact O-CE2 3.44Å; V456-Q468 HydrophobicContact CG1-CB 4.44Å; V456-L470 HydrophobicContact CG2-CD1 4.35Å; V456-V537 HydrophobicContact CG2-CB 4.48Å; V456-V537 HydrophobicContact CG2-CG1 3.92Å; V456-V537 HydrophobicContact CG2-CG2 3.67Å
457	A	90.8	Very high	90	Very high	16 Å²	16	18.9 Å²	18.9	13%	0.132	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	134.6	171.4	0	0	0	0	0	110.8	V448 L459 Q468 V469	V448-A457 HydrophobicContact CG2-CB 4.13Å; A457-L459 HydrophobicContact CB-CD2 4.39Å; A457-Q468 WeakPolarHBondContact O-CA 3.43Å; A457-V469 PolarHBondContact N-O 3.33Å; A457-V469 PolarHBondContact O-N 2.75Å
458	Y	93.4	Very high	89.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.1	178.5	-58.7	-108.4	0	0	0	106.1	I446 T447 V449 V451 V456 H466 Q468 V504 L517	I446-Y458 WeakPolarHBondContact CA-O 3.32Å; T447-Y458 PolarHBondContact N-O 2.78Å; T447-Y458 PolarHBondContact O-N 2.95Å; V449-Y458 HydrophobicContact CB-CE2 3.9Å; V449-Y458 HydrophobicContact CG2-CD2 4.27Å; V449-Y458 HydrophobicContact CG2-CE2 3.9Å; V451-Y458 WeakPolarHBondContact CG2-OH 3.18Å; V456-Y458 HydrophobicContact CB-CE2 3.81Å; V456-Y458 HydrophobicContact CG1-CD2 4.26Å; V456-Y458 HydrophobicContact CG1-CE2 3.64Å; V456-Y458 WeakPolarHBondContact O-CD2 2.98Å; V456-Y458 VanDerWaalsContact O-CE2 3.3Å; V456-Y458 WeakPolarHBondContact O-CE2 3.44Å; Y458-H466 AromaticContact CD1-CE1 3.76Å; Y458-Q468 HydrophobicContact CD1-CG 4.07Å; Y458-Q468 HydrophobicContact CE1-CG 4.26Å; Y458-V504 HydrophobicContact CD1-CG1 3.81Å; Y458-V504 HydrophobicContact CD1-CG2 4.04Å; Y458-V504 HydrophobicContact CE1-CG1 4.42Å; Y458-V504 HydrophobicContact CG-CG2 4.12Å; Y458-L517 HydrophobicContact CE1-CD2 3.79Å; Y458-L517 HydrophobicContact CE2-CD2 4.15Å; Y458-L517 WeakPolarHBondContact OH-CA 3.45Å; Y458-L517 WeakPolarHBondContact OH-CB 3.45Å; Y458-L517 VanDerWaalsContact OH-CD2 3.31Å; Y458-L517 WeakPolarHBondContact OH-CD2 3.33Å; Y458-L517 PolarHBondContact OH-O 2.89Å
459	L	94.1	Very high	89.6	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.2	-172	-52.4	176	0	0	0	110.3	V362 L438 V443 S445 I446 A457 H466 I467 V469	V362-L459 HydrophobicContact CG2-CD1 4.38Å; V362-L459 HydrophobicContact CG2-CD2 4.33Å; L438-L459 HydrophobicContact CD2-CD1 4.36Å; V443-L459 HydrophobicContact CG1-CB 4.32Å; V443-L459 HydrophobicContact CG1-CD2 4.32Å; S445-L459 WeakPolarHBondContact O-CA 3Å; I446-L459 HydrophobicContact CB-CD2 3.88Å; I446-L459 HydrophobicContact CD1-CD2 3.69Å; I446-L459 HydrophobicContact CG1-CD2 3.6Å; A457-L459 HydrophobicContact CB-CD2 4.39Å; L459-H466 WeakPolarHBondContact O-CA 3.36Å; L459-I467 HydrophobicContact CB-CB 4.28Å; L459-I467 PolarHBondContact N-O 3.15Å; L459-I467 PolarHBondContact O-N 3.48Å; L459-V469 HydrophobicContact CD1-CG2 3.94Å
460	G	95.3	Very high	89.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	150.1	167.2	0	0	0	0	0	111.7	V443 T444 S445	V443-G460 CarbonylContact C-O 3.58Å; V443-G460 WeakPolarHBondContact CA-O 3.19Å; T444-G460 PolarHBondContact N-O 2.86Å; T444-G460 PolarHBondContact OG1-O 2.97Å; S445-G460 PolarHBondContact N-O 3.13Å; S445-G460 PolarHBondContact O-N 2.93Å; S445-G460 WeakPolarHBondContact OG-CA 3.28Å; S445-G460 PolarHBondContact OG-N 2.94Å
461	T	95.2	Very high	88.9	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160.9	-178.4	74.1	0	0	0	0	113.9	T441 L442 T444 D463 G464 R465 I467 V488	T441-T461 HydrophobicContact CG2-CG2 3.53Å; L442-T461 CarbonylContact O-C 3.55Å; L442-T461 VanDerWaalsContact O-CA 3.26Å; L442-T461 WeakPolarHBondContact O-CA 3.39Å; L442-T461 WeakPolarHBondContact O-CB 3.22Å; T444-T461 PolarHBondContact OG1-O 2.84Å; T461-D463 WeakPolarHBondContact CB-OD1 3.34Å; T461-D463 PolarHBondContact O-N 2.81Å; T461-D463 PolarHBondContact OG1-OD1 2.96Å; T461-G464 PolarHBondContact O-N 2.92Å; T461-G464 VanDerWaalsContact O-N 3.17Å; T461-R465 HydrophobicContact CG2-CB 4.37Å; T461-R465 PolarHBondContact N-O 2.78Å; T461-R465 WeakPolarHBondContact OG1-CB 3.43Å; T461-R465 PolarHBondContact OG1-N 2.96Å; T461-R465 PolarHBondContact OG1-O 3.27Å; T461-I467 HydrophobicContact CG2-CD1 3.82Å; T461-I467 HydrophobicContact CG2-CG1 4.25Å; T461-V488 PolarHBondContact O-N 2.95Å
462	A	95.2	Very high	88.1	Confident	33 Å²	33	17.6 Å²	17.6	27%	0.273	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.3	176.3	0	0	0	0	0	113.5	L442 T444 G464 P487	L442-A462 HydrophobicContact CB-CB 3.9Å; L442-A462 HydrophobicContact CD2-CB 3.97Å; L442-A462 HydrophobicContact CG-CB 4.08Å; L442-A462 PolarHBondContact O-N 2.87Å; T444-A462 HydrophobicContact CG2-CB 3.77Å; A462-G464 VanDerWaalsContact C-N 3.32Å; A462-P487 WeakPolarHBondContact O-CA 3.35Å; A462-P487 WeakPolarHBondContact O-CG 3.33Å
463	D	92.9	Very high	87	Confident	76 Å²	76	20.8 Å²	20.8	41%	0.406	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	26.3	173.8	64.2	-35.2	0	0	0	113	T461 R465	T461-D463 WeakPolarHBondContact CB-OD1 3.34Å; T461-D463 PolarHBondContact O-N 2.81Å; T461-D463 PolarHBondContact OG1-OD1 2.96Å; D463-R465 VanDerWaalsContact C-N 3.31Å; D463-R465 PolarHBondContact O-N 2.9Å; D463-R465 IonicContact OD1-CZ 2.68Å; D463-R465 IonicContact OD1-NE 3.09Å; D463-R465 IonicContact OD1-NH2 2.65Å; D463-R465 PolarHBondContact OD1-NH2 3.07Å; D463-R465 IonicContact OD2-CZ 3.09Å; D463-R465 IonicContact OD2-NE 3.79Å; D463-R465 PolarHBondContact OD2-NE 3.33Å; D463-R465 IonicContact OD2-NH2 3.18Å; D463-R465 PolarHBondContact OD2-NH2 3Å
464	G	92.9	Very high	85.8	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	70	19.6	167.9	0	0	0	0	0	115.8	T461 A462 L483 D484 S486	T461-G464 PolarHBondContact O-N 2.92Å; T461-G464 VanDerWaalsContact O-N 3.17Å; A462-G464 VanDerWaalsContact C-N 3.32Å; G464-L483 WeakPolarHBondContact O-CB 3.3Å; G464-L483 PolarHBondContact O-N 2.87Å; G464-D484 WeakPolarHBondContact CA-O 3.42Å; G464-D484 PolarHBondContact O-N 2.96Å; G464-S486 WeakPolarHBondContact CA-O 3.35Å
465	R	92.1	Very high	84.8	Confident	42 Å²	42	25.4 Å²	25.4	16%	0.158	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	151.7	177.9	-64.9	-176.4	-72.7	114.4	2	112.6	T441 T461 D463 N480 I481 V488	T441-R465 PolarHBondContact OG1-NH2 3.14Å; T461-R465 HydrophobicContact CG2-CB 4.37Å; T461-R465 PolarHBondContact N-O 2.78Å; T461-R465 WeakPolarHBondContact OG1-CB 3.43Å; T461-R465 PolarHBondContact OG1-N 2.96Å; T461-R465 PolarHBondContact OG1-O 3.27Å; D463-R465 VanDerWaalsContact C-N 3.31Å; D463-R465 PolarHBondContact O-N 2.9Å; D463-R465 IonicContact OD1-CZ 2.68Å; D463-R465 IonicContact OD1-NE 3.09Å; D463-R465 IonicContact OD1-NH2 2.65Å; D463-R465 PolarHBondContact OD1-NH2 3.07Å; D463-R465 IonicContact OD2-CZ 3.09Å; D463-R465 IonicContact OD2-NE 3.79Å; D463-R465 PolarHBondContact OD2-NE 3.33Å; D463-R465 IonicContact OD2-NH2 3.18Å; D463-R465 PolarHBondContact OD2-NH2 3Å; R465-N480 PolarHBondContact NH1-ND2 3.19Å; R465-N480 PolarHBondContact NH1-OD1 2.92Å; R465-I481 CarbonylContact C-O 3.51Å; R465-I481 WeakPolarHBondContact CA-O 3.18Å; R465-I481 WeakPolarHBondContact CB-O 3.4Å; R465-V488 WeakPolarHBondContact O-CG2 3.47Å
466	H	92.7	Very high	83.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.9	167.8	164.7	53.6	0	0	0	110.1	Y458 L459 Q468 N480 I481 L483 M506 I515	Y458-H466 AromaticContact CD1-CE1 3.76Å; L459-H466 WeakPolarHBondContact O-CA 3.36Å; H466-Q468 WeakPolarHBondContact CE1-CG 3.28Å; H466-Q468 WeakPolarHBondContact NE2-CG 3.43Å; H466-Q468 PolarHBondContact NE2-NE2 3.47Å; H466-N480 CarbonylContact O-C 3.56Å; H466-N480 WeakPolarHBondContact O-CA 3.33Å; H466-I481 HydrophobicContact CB-CG1 4.04Å; H466-I481 PolarHBondContact N-O 3.18Å; H466-I481 PolarHBondContact O-N 2.81Å; H466-L483 HydrophobicContact CB-CD1 3.91Å; H466-L483 HydrophobicContact CB-CD2 4.01Å; H466-L483 HydrophobicContact CB-CG 3.92Å; H466-M506 HydrophobicContact CB-SD 4.02Å; H466-M506 WeakPolarHBondContact ND1-CE 3.42Å; H466-I515 HydrophobicContact CB-CD1 4Å; H466-I515 VanDerWaalsContact CD2-CD1 3.45Å; H466-I515 WeakPolarHBondContact CD2-CD1 3.29Å
467	I	91.6	Very high	83.5	Confident	2 Å²	2	27 Å²	27	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.2	-176.2	-49.7	-179.2	0	0	0	109.2	L438 T441 L459 T461 V469 P477 V479	L438-I467 HydrophobicContact CD2-CD1 4.32Å; T441-I467 HydrophobicContact CG2-CD1 4.47Å; L459-I467 HydrophobicContact CB-CB 4.28Å; L459-I467 PolarHBondContact N-O 3.15Å; L459-I467 PolarHBondContact O-N 3.48Å; T461-I467 HydrophobicContact CG2-CD1 3.82Å; T461-I467 HydrophobicContact CG2-CG1 4.25Å; I467-V469 HydrophobicContact CG2-CG2 3.84Å; I467-P477 HydrophobicContact CG2-CB 3.56Å; I467-P477 HydrophobicContact CG2-CG 3.7Å; I467-V479 CarbonylContact C-O 3.56Å; I467-V479 WeakPolarHBondContact CA-O 3.43Å
468	Q	89.9	Confident	83	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.3	171.6	-61.3	178.9	-31.5	0	0	110.6	V456 A457 Y458 H466 P477 H478 V479 P516	V456-Q468 HydrophobicContact CG1-CB 4.44Å; A457-Q468 WeakPolarHBondContact O-CA 3.43Å; Y458-Q468 HydrophobicContact CD1-CG 4.07Å; Y458-Q468 HydrophobicContact CE1-CG 4.26Å; H466-Q468 WeakPolarHBondContact CE1-CG 3.28Å; H466-Q468 WeakPolarHBondContact NE2-CG 3.43Å; H466-Q468 PolarHBondContact NE2-NE2 3.47Å; Q468-P477 CarbonylContact O-C 3.53Å; Q468-P477 VanDerWaalsContact O-CA 3.3Å; Q468-P477 WeakPolarHBondContact O-CA 3.37Å; Q468-H478 PolarHBondContact O-N 3.31Å; Q468-H478 PolarHBondContact O-ND1 2.95Å; Q468-V479 HydrophobicContact CB-CB 3.91Å; Q468-V479 HydrophobicContact CB-CG2 4.28Å; Q468-V479 HydrophobicContact CG-CB 4.05Å; Q468-V479 HydrophobicContact CG-CG2 4.44Å; Q468-V479 PolarHBondContact N-O 2.78Å; Q468-P516 PolarHBondContact NE2-O 3.33Å
469	V	85.8	Confident	82.8	Confident	7 Å²	7	26.9 Å²	26.9	4%	0.042	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.1	-176.2	-167.1	0	0	0	0	109.5	F433 A457 L459 I467 P477	F433-V469 HydrophobicContact CE1-CG1 3.75Å; F433-V469 HydrophobicContact CZ-CG1 3.49Å; F433-V469 VanDerWaalsContact CZ-CG1 3.49Å; A457-V469 PolarHBondContact N-O 3.33Å; A457-V469 PolarHBondContact O-N 2.75Å; L459-V469 HydrophobicContact CD1-CG2 3.94Å; I467-V469 HydrophobicContact CG2-CG2 3.84Å; V469-P477 HydrophobicContact CG2-CB 4.35Å; V469-P477 HydrophobicContact CG2-CG 4.19Å
470	L	82.4	Confident	82.6	Confident	7 Å²	7	27.7 Å²	27.7	4%	0.037	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.3	177.1	175.8	60.8	0	0	0	109	R454 V456 S472 T475 V537	R454-L470 HydrophobicContact CB-CD1 3.7Å; R454-L470 HydrophobicContact CG-CD1 4.23Å; V456-L470 HydrophobicContact CG2-CD1 4.35Å; L470-S472 PolarHBondContact O-N 2.83Å; L470-S472 VanDerWaalsContact O-N 3.09Å; L470-T475 HydrophobicContact CB-CG2 4.45Å; L470-T475 HydrophobicContact CD2-CG2 4.27Å; L470-T475 HydrophobicContact CG-CG2 4.45Å; L470-T475 WeakPolarHBondContact O-CB 3.37Å; L470-T475 PolarHBondContact O-OG1 2.69Å; L470-V537 HydrophobicContact CD1-CG2 3.99Å
471	F	76.8	Confident	82.3	Confident	20 Å²	20	28.1 Å²	28.1	9%	0.088	14%	0.136	C	C	.	.			trans	-72.5	103	179.6	-170.7	-94.1	0	0	0	112.2	L329 Q332 F343 V364 R454 T455	L329-F471 HydrophobicContact CB-CD1 4.12Å; L329-F471 HydrophobicContact CB-CE1 4.29Å; L329-F471 HydrophobicContact CD1-CD1 3.7Å; L329-F471 HydrophobicContact CD1-CD2 4.5Å; L329-F471 HydrophobicContact CD1-CE1 3.44Å; L329-F471 VanDerWaalsContact CD1-CE1 3.44Å; L329-F471 HydrophobicContact CD1-CE2 4.28Å; L329-F471 HydrophobicContact CD1-CG 4.24Å; L329-F471 HydrophobicContact CD1-CZ 3.75Å; L329-F471 HydrophobicContact CG-CE1 4.48Å; Q332-F471 HydrophobicContact CB-CE1 4.34Å; F343-F471 HydrophobicContact CE1-CD2 4.37Å; V364-F471 HydrophobicContact CB-CE2 4.5Å; V364-F471 HydrophobicContact CG2-CE2 4.03Å; R454-F471 PolarHBondContact NH2-O 3.34Å; T455-F471 WeakPolarHBondContact O-CB 3.44Å; T455-F471 PolarHBondContact O-N 2.96Å
472	S	69.7	Low	82.1	Confident	9 Å²	9	31 Å²	31	6%	0.063	17%	0.166	C	C	.	.	S	Bend	trans	-154.5	166.6	167.7	172.5	0	0	0	0	108.7	F433 L470 F474 T475 E597	F433-S472 WeakPolarHBondContact CE2-O 3.3Å; L470-S472 PolarHBondContact O-N 2.83Å; L470-S472 VanDerWaalsContact O-N 3.09Å; S472-F474 VanDerWaalsContact C-N 3.25Å; S472-F474 PolarHBondContact O-N 3.14Å; S472-T475 WeakPolarHBondContact CA-OG1 3.31Å; S472-T475 VanDerWaalsContact CB-OG1 3.3Å; S472-T475 WeakPolarHBondContact CB-OG1 3.49Å; S472-T475 PolarHBondContact N-OG1 2.73Å; S472-T475 VanDerWaalsContact N-OG1 3.14Å; S472-T475 PolarHBondContact O-OG1 3.01Å; S472-E597 PolarHBondContact OG-OE2 2.91Å
473	R	57.2	Low	82	Confident	151 Å²	151	30.2 Å²	30.2	57%	0.57	16%	0.157	S	C	*	.	S	Bend	trans	-70.8	-16.4	-174.3	-76.5	174.8	176.7	177.1	-0.5	115	Q332	Q332-R473 VanDerWaalsContact CD-NE 3.35Å; Q332-R473 VanDerWaalsContact OE1-CG 3.28Å
474	F	55.2	Low	81.8	Confident	151 Å²	151	29.5 Å²	29.5	66%	0.662	15%	0.153	S	C	*	.	S	Bend	trans	-138.7	12.8	-172.7	-53.9	-66.5	0	0	0	113	S472	S472-F474 VanDerWaalsContact C-N 3.25Å; S472-F474 PolarHBondContact O-N 3.14Å
475	T	61.5	Low	81.7	Confident	15 Å²	15	34.3 Å²	34.3	9%	0.092	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-82.9	125.4	178.6	35.6	0	0	0	0	111.9	H435 L470 S472	H435-T475 PolarHBondContact CD2-O 3.04Å; H435-T475 VanDerWaalsContact CD2-O 3.25Å; L470-T475 HydrophobicContact CB-CG2 4.45Å; L470-T475 HydrophobicContact CD2-CG2 4.27Å; L470-T475 HydrophobicContact CG-CG2 4.45Å; L470-T475 WeakPolarHBondContact O-CB 3.37Å; L470-T475 PolarHBondContact O-OG1 2.69Å; S472-T475 WeakPolarHBondContact CA-OG1 3.31Å; S472-T475 VanDerWaalsContact CB-OG1 3.3Å; S472-T475 WeakPolarHBondContact CB-OG1 3.49Å; S472-T475 PolarHBondContact N-OG1 2.73Å; S472-T475 VanDerWaalsContact N-OG1 3.14Å; S472-T475 PolarHBondContact O-OG1 3.01Å
476	S	68.2	Low	81.8	Confident	30 Å²	30	34.2 Å²	34.2	21%	0.21	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-70.8	168	162.3	41.3	0	0	0	0	112.3	S30	S30-S476 WeakPolarHBondContact OG-CB 3.46Å; S30-S476 PolarHBondContact OG-OG 2.96Å
477	P	80.1	Confident	81.9	Confident	6 Å²	6	37.9 Å²	37.9	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	141.1	160.9	-23.7	34.7	0	0	0	111.5	L32 D437 I467 Q468 V469	L32-P477 HydrophobicContact CD1-CB 4.06Å; L32-P477 WeakPolarHBondContact CD1-O 3.26Å; D437-P477 HydrophobicContact CB-CG 4.44Å; D437-P477 WeakPolarHBondContact OD2-CD 3.38Å; I467-P477 HydrophobicContact CG2-CB 3.56Å; I467-P477 HydrophobicContact CG2-CG 3.7Å; Q468-P477 CarbonylContact O-C 3.53Å; Q468-P477 VanDerWaalsContact O-CA 3.3Å; Q468-P477 WeakPolarHBondContact O-CA 3.37Å; V469-P477 HydrophobicContact CG2-CB 4.35Å; V469-P477 HydrophobicContact CG2-CG 4.19Å
478	H	81.9	Confident	82.1	Confident	13 Å²	13	37.9 Å²	37.9	6%	0.06	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-9.7	172.3	58.7	-84.8	0	0	0	113	L32 Q468	L32-H478 WeakPolarHBondContact CD2-O 3.39Å; Q468-H478 PolarHBondContact O-N 3.31Å; Q468-H478 PolarHBondContact O-ND1 2.95Å
479	V	87.3	Confident	82.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.4	166.6	-179.9	0	0	0	0	108.1	I467 Q468 I481 P520	I467-V479 CarbonylContact C-O 3.56Å; I467-V479 WeakPolarHBondContact CA-O 3.43Å; Q468-V479 HydrophobicContact CB-CB 3.91Å; Q468-V479 HydrophobicContact CB-CG2 4.28Å; Q468-V479 HydrophobicContact CG-CB 4.05Å; Q468-V479 HydrophobicContact CG-CG2 4.44Å; Q468-V479 PolarHBondContact N-O 2.78Å; V479-I481 HydrophobicContact CG1-CG1 4.27Å; V479-I481 HydrophobicContact CG1-CG2 3.86Å; V479-P520 HydrophobicContact CG1-CG 3.84Å
480	N	90.1	Very high	82.5	Confident	19 Å²	19	42.2 Å²	42.2	10%	0.102	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	91.3	174	-177.6	-0.4	0	0	0	107.2	L32 L34 R465 H466 Q524	L32-N480 HydrophobicContact CD1-CB 3.64Å; L34-N480 HydrophobicContact CD2-CB 3.78Å; L34-N480 WeakPolarHBondContact CD2-O 3.3Å; R465-N480 PolarHBondContact NH1-ND2 3.19Å; R465-N480 PolarHBondContact NH1-OD1 2.92Å; H466-N480 CarbonylContact O-C 3.56Å; H466-N480 WeakPolarHBondContact O-CA 3.33Å; N480-Q524 PolarHBondContact O-NE2 3.25Å; N480-Q524 PolarHBondContact O-OE1 2.85Å
481	I	90.4	Very high	82.8	Confident	8 Å²	8	43 Å²	43	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.6	-173.5	57.9	166.8	0	0	0	110.7	Y38 L40 R465 H466 V479 L483 P520	Y38-I481 HydrophobicContact CD2-CG2 3.7Å; Y38-I481 HydrophobicContact CE2-CG2 3.73Å; L40-I481 HydrophobicContact CD1-CD1 3.94Å; R465-I481 CarbonylContact C-O 3.51Å; R465-I481 WeakPolarHBondContact CA-O 3.18Å; R465-I481 WeakPolarHBondContact CB-O 3.4Å; H466-I481 HydrophobicContact CB-CG1 4.04Å; H466-I481 PolarHBondContact N-O 3.18Å; H466-I481 PolarHBondContact O-N 2.81Å; V479-I481 HydrophobicContact CG1-CG1 4.27Å; V479-I481 HydrophobicContact CG1-CG2 3.86Å; I481-L483 HydrophobicContact CD1-CD2 3.68Å; I481-L483 HydrophobicContact CG1-CD2 4.12Å; I481-P520 HydrophobicContact CD1-CG 4.31Å; I481-P520 HydrophobicContact CG2-CG 4.35Å
482	G	91	Very high	83.5	Confident	61 Å²	61	43.1 Å²	43.1	63%	0.629	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.9	161.5	0	0	0	0	0	110.3
483	L	91.4	Very high	84.4	Confident	16 Å²	16	43.2 Å²	43.2	8%	0.084	26%	0.26	C	S	.	.			trans	-97.6	-43.9	169.1	-57.6	-176	0	0	0	110.5	G464 H466 I481 V488 M506 T508 K511 T513 I515	G464-L483 WeakPolarHBondContact O-CB 3.3Å; G464-L483 PolarHBondContact O-N 2.87Å; H466-L483 HydrophobicContact CB-CD1 3.91Å; H466-L483 HydrophobicContact CB-CD2 4.01Å; H466-L483 HydrophobicContact CB-CG 3.92Å; I481-L483 HydrophobicContact CD1-CD2 3.68Å; I481-L483 HydrophobicContact CG1-CD2 4.12Å; L483-V488 HydrophobicContact CD1-CG2 4.39Å; L483-M506 HydrophobicContact CD1-CB 3.96Å; L483-M506 HydrophobicContact CD1-SD 4.19Å; L483-T508 HydrophobicContact CB-CG2 4.1Å; L483-T508 HydrophobicContact CD1-CG2 4.25Å; L483-K511 PolarHBondContact O-NZ 2.85Å; L483-T513 HydrophobicContact CD2-CG2 4.22Å; L483-I515 HydrophobicContact CD1-CD1 4.01Å; L483-I515 HydrophobicContact CD2-CD1 3.75Å; L483-I515 HydrophobicContact CD2-CG1 4.49Å
484	D	90.3	Very high	85.8	Confident	61 Å²	61	38.9 Å²	38.9	33%	0.326	25%	0.248	S	C	.	.			trans	-159.9	-174.4	178.5	-144.3	-76.3	0	0	0	110.6	G464 T508 K511	G464-D484 WeakPolarHBondContact CA-O 3.42Å; G464-D484 PolarHBondContact O-N 2.96Å; D484-T508 HydrophobicContact CB-CG2 4.32Å; D484-K511 WeakPolarHBondContact OD2-CD 3.14Å; D484-K511 IonicContact OD2-NZ 2.85Å; D484-K511 PolarHBondContact OD2-NZ 2.97Å
485	S	90.4	Very high	87	Confident	102 Å²	102	32.2 Å²	32.2	71%	0.713	22%	0.22	S	C	*	.	S	Bend	trans	-83.3	-20.3	170.2	59.8	0	0	0	0	113.8
486	S	94	Very high	87.3	Confident	40 Å²	40	37.6 Å²	37.6	28%	0.28	25%	0.248	S	C	.	.	S	Bend	trans	-87.1	147.7	-177.4	-66.2	0	0	0	0	112.2	G464	G464-S486 WeakPolarHBondContact CA-O 3.35Å
487	P	95.2	Very high	87	Confident	76 Å²	76	38.6 Å²	38.6	49%	0.494	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-50.1	141.7	173.8	-26.6	32.6	0	0	0	113.3	A462	A462-P487 WeakPolarHBondContact O-CA 3.35Å; A462-P487 WeakPolarHBondContact O-CG 3.33Å
488	V	95.8	Very high	85.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.8	169.7	-168.8	0	0	0	0	109.2	T444 T461 R465 L483 M506 A507 T508	T444-V488 WeakPolarHBondContact CB-O 3.42Å; T444-V488 PolarHBondContact OG1-O 3.5Å; T461-V488 PolarHBondContact O-N 2.95Å; R465-V488 WeakPolarHBondContact O-CG2 3.47Å; L483-V488 HydrophobicContact CD1-CG2 4.39Å; V488-M506 HydrophobicContact CG1-CB 4.03Å; V488-M506 HydrophobicContact CG1-CG 4.29Å; V488-M506 HydrophobicContact CG1-SD 4.13Å; V488-A507 CarbonylContact C-O 3.45Å; V488-A507 WeakPolarHBondContact CA-O 3.13Å; V488-T508 HydrophobicContact CB-CG2 4.33Å; V488-T508 HydrophobicContact CG2-CG2 3.84Å
489	S	93.9	Very high	84.6	Confident	29 Å²	29	47.7 Å²	47.7	20%	0.203	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	149	177.6	-174	0	0	0	0	112	S445 S491 V492 A507	S445-S489 WeakPolarHBondContact CB-O 3.4Å; S445-S489 PolarHBondContact OG-O 3.19Å; S489-S491 PolarHBondContact O-N 3.12Å; S489-S491 PolarHBondContact OG-N 3.4Å; S489-V492 WeakPolarHBondContact O-CG2 3.44Å; S489-A507 PolarHBondContact N-O 2.92Å
490	A	90.6	Very high	82.8	Confident	69 Å²	69	51.5 Å²	51.5	57%	0.57	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	-28	170.9	0	0	0	0	0	112.4	V492	A490-V492 PolarHBondContact O-N 3.28Å
491	S	88.6	Confident	81.6	Confident	24 Å²	24	58 Å²	58	17%	0.168	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	112.3	172.2	-173.4	0	0	0	0	109.3	M52 S489	M52-S491 VanDerWaalsContact CE-O 3.25Å; M52-S491 WeakPolarHBondContact CE-O 3.11Å; M52-S491 PolarHBondContact N-OG 2.86Å; M52-S491 PolarHBondContact O-OG 2.87Å; S489-S491 PolarHBondContact O-N 3.12Å; S489-S491 PolarHBondContact OG-N 3.4Å
492	V	90.2	Very high	81.2	Confident	23 Å²	23	57.9 Å²	57.9	14%	0.139	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.2	170.7	92.8	0	0	0	0	109.4	T447 S489 A490 L505 M506	T447-V492 HydrophobicContact CG2-CG1 4.31Å; T447-V492 WeakPolarHBondContact OG1-CG1 3.36Å; S489-V492 WeakPolarHBondContact O-CG2 3.44Å; A490-V492 PolarHBondContact O-N 3.28Å; V492-L505 WeakPolarHBondContact CA-O 3.33Å; V492-L505 WeakPolarHBondContact CB-O 3.49Å; V492-M506 HydrophobicContact CB-CG 4.29Å; V492-M506 HydrophobicContact CG2-CG 4.15Å
493	V	88.8	Confident	81.1	Confident	10 Å²	10	55.1 Å²	55.1	6%	0.061	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.5	-169.1	159.6	0	0	0	0	111	M52 T54 P495 V504 L505	M52-V493 HydrophobicContact CB-CG2 3.59Å; M52-V493 WeakPolarHBondContact O-CG2 3.48Å; T54-V493 HydrophobicContact CG2-CG1 3.59Å; V493-P495 HydrophobicContact CG1-CG 4.24Å; V493-V504 WeakPolarHBondContact O-CA 3.34Å; V493-L505 HydrophobicContact CB-CB 4.22Å; V493-L505 HydrophobicContact CB-CD1 4.47Å; V493-L505 HydrophobicContact CG1-CD1 4.07Å; V493-L505 HydrophobicContact CG1-CG 4.49Å; V493-L505 PolarHBondContact N-O 2.74Å; V493-L505 VanDerWaalsContact N-O 3.11Å; V493-L505 PolarHBondContact O-N 2.8Å
494	L	87.1	Confident	81.2	Confident	61 Å²	61	54.4 Å²	54.4	32%	0.319	33%	0.326	S	S	.	.			trans	-111.5	103.2	168.8	-66.3	171.5	0	0	0	107.7	T447 V449 V504 L517	T447-L494 HydrophobicContact CG2-CD1 3.73Å; T447-L494 HydrophobicContact CG2-CD2 3.95Å; T447-L494 HydrophobicContact CG2-CG 3.87Å; V449-L494 HydrophobicContact CG2-CD1 3.7Å; V449-L494 HydrophobicContact CG2-CD2 3.68Å; V449-L494 HydrophobicContact CG2-CG 4.36Å; L494-V504 HydrophobicContact CD2-CG2 3.55Å; L494-L517 HydrophobicContact CD2-CD2 4.18Å
495	P	80.8	Confident	81.4	Confident	11 Å²	11	51.5 Å²	51.5	7%	0.071	31%	0.311	C	S	.	.			trans	-69.3	138.5	178.1	-19.1	33.5	0	0	0	111.3	V493 T497 A503 L505	V493-P495 HydrophobicContact CG1-CG 4.24Å; P495-T497 VanDerWaalsContact C-N 3.33Å; P495-T497 PolarHBondContact O-N 2.93Å; P495-T497 PolarHBondContact O-OG1 2.67Å; P495-A503 VanDerWaalsContact CD-O 3.23Å; P495-A503 WeakPolarHBondContact CD-O 3.44Å; P495-L505 HydrophobicContact CG-CD1 3.7Å; P495-L505 HydrophobicContact CG-CD2 4.38Å; P495-L505 HydrophobicContact CG-CG 3.79Å
496	D	66.8	Low	81.6	Confident	128 Å²	128	46.6 Å²	46.6	68%	0.684	28%	0.277	S	S	*	.	S	Bend	trans	-62.5	87.5	-179.6	-60.4	-72.4	0	0	0	112.1
497	T	62.6	Low	81.7	Confident	51 Å²	51	44.8 Å²	44.8	31%	0.313	26%	0.264	S	S	.	.			trans	-142.9	145	-173.6	43.7	0	0	0	0	109.5	P495 H499 G502	P495-T497 VanDerWaalsContact C-N 3.33Å; P495-T497 PolarHBondContact O-N 2.93Å; P495-T497 PolarHBondContact O-OG1 2.67Å; T497-H499 PolarHBondContact O-N 3.45Å; T497-G502 WeakPolarHBondContact OG1-CA 3.46Å
498	P	57.1	Low	81.7	Confident	84 Å²	84	41.2 Å²	41.2	55%	0.545	24%	0.241	S	C	.	.			trans	-60	140	-174.5	23.5	-33.4	0	0	0	111.5	S500 E501 G502	P498-S500 PolarHBondContact O-N 3.26Å; P498-E501 PolarHBondContact O-N 2.97Å; P498-G502 PolarHBondContact O-N 2.96Å
499	H	55.3	Low	81.6	Confident	126 Å²	126	42.4 Å²	42.4	58%	0.583	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-21.7	-166.8	-70.8	75.3	0	0	0	116	T497	T497-H499 PolarHBondContact O-N 3.45Å
500	S	49.7	Very low	81.6	Confident	80 Å²	80	42.9 Å²	42.9	56%	0.559	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-25.9	175.9	50.3	0	0	0	0	114.8	P498	P498-S500 PolarHBondContact O-N 3.26Å
501	E	63.6	Low	81.9	Confident	157 Å²	157	41.9 Å²	41.9	73%	0.734	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-4.9	-179.4	-60.8	-167.6	160.5	0	0	113.1	P498	P498-E501 PolarHBondContact O-N 2.97Å
502	G	81.5	Confident	82.2	Confident	4 Å²	4	40.8 Å²	40.8	4%	0.041	23%	0.232	C	C	.	.			trans	-61.4	160	-179.4	0	0	0	0	0	114.9	T497 P498 L517	T497-G502 WeakPolarHBondContact OG1-CA 3.46Å; P498-G502 PolarHBondContact O-N 2.96Å; G502-L517 WeakPolarHBondContact O-CG 3.37Å; G502-L517 PolarHBondContact O-N 2.85Å
503	A	90.3	Very high	82.4	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	159.2	-178.8	0	0	0	0	0	111.9	P495 K514 I515	P495-A503 VanDerWaalsContact CD-O 3.23Å; P495-A503 WeakPolarHBondContact CD-O 3.44Å; A503-K514 HydrophobicContact CB-CD 4.26Å; A503-K514 HydrophobicContact CB-CG 3.61Å; A503-I515 CarbonylContact C-O 3.47Å; A503-I515 WeakPolarHBondContact CA-O 3.46Å; A503-I515 VanDerWaalsContact CB-O 3.28Å; A503-I515 WeakPolarHBondContact CB-O 3.28Å
504	V	92.6	Very high	82.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.7	154.4	43.1	0	0	0	0	109.7	T447 Y458 V493 L494 M506 I515	T447-V504 HydrophobicContact CG2-CG2 4.19Å; Y458-V504 HydrophobicContact CD1-CG1 3.81Å; Y458-V504 HydrophobicContact CD1-CG2 4.04Å; Y458-V504 HydrophobicContact CE1-CG1 4.42Å; Y458-V504 HydrophobicContact CG-CG2 4.12Å; V493-V504 WeakPolarHBondContact O-CA 3.34Å; L494-V504 HydrophobicContact CD2-CG2 3.55Å; V504-M506 HydrophobicContact CG1-CE 4.25Å; V504-M506 HydrophobicContact CG1-CG 4.44Å; V504-I515 HydrophobicContact CG1-CB 3.83Å; V504-I515 HydrophobicContact CG1-CD1 4.27Å; V504-I515 HydrophobicContact CG1-CG1 4.32Å; V504-I515 PolarHBondContact N-O 2.81Å; V504-I515 PolarHBondContact O-N 3.45Å
505	L	94.1	Very high	82.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.9	164.4	-55.6	-175.3	0	0	0	109.1	I59 L74 V492 V493 P495 I512 K514	I59-L505 HydrophobicContact CD1-CD1 3.51Å; I59-L505 HydrophobicContact CG1-CD1 3.86Å; I59-L505 HydrophobicContact CG2-CD1 3.9Å; L74-L505 HydrophobicContact CD2-CD1 4.14Å; L74-L505 HydrophobicContact CD2-CD2 4.08Å; V492-L505 WeakPolarHBondContact CA-O 3.33Å; V492-L505 WeakPolarHBondContact CB-O 3.49Å; V493-L505 HydrophobicContact CB-CB 4.22Å; V493-L505 HydrophobicContact CB-CD1 4.47Å; V493-L505 HydrophobicContact CG1-CD1 4.07Å; V493-L505 HydrophobicContact CG1-CG 4.49Å; V493-L505 PolarHBondContact N-O 2.74Å; V493-L505 VanDerWaalsContact N-O 3.11Å; V493-L505 PolarHBondContact O-N 2.8Å; P495-L505 HydrophobicContact CG-CD1 3.7Å; P495-L505 HydrophobicContact CG-CD2 4.38Å; P495-L505 HydrophobicContact CG-CG 3.79Å; L505-I512 HydrophobicContact CB-CG2 4.14Å; L505-K514 HydrophobicContact CD2-CB 3.64Å; L505-K514 HydrophobicContact CD2-CD 4.18Å; L505-K514 HydrophobicContact CD2-CG 3.66Å
506	M	95.2	Very high	83.4	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.4	177.6	-71	-172.5	171.2	0	0	110.4	H466 L483 V488 V492 V504 I512 T513 I515	H466-M506 HydrophobicContact CB-SD 4.02Å; H466-M506 WeakPolarHBondContact ND1-CE 3.42Å; L483-M506 HydrophobicContact CD1-CB 3.96Å; L483-M506 HydrophobicContact CD1-SD 4.19Å; V488-M506 HydrophobicContact CG1-CB 4.03Å; V488-M506 HydrophobicContact CG1-CG 4.29Å; V488-M506 HydrophobicContact CG1-SD 4.13Å; V492-M506 HydrophobicContact CB-CG 4.29Å; V492-M506 HydrophobicContact CG2-CG 4.15Å; V504-M506 HydrophobicContact CG1-CE 4.25Å; V504-M506 HydrophobicContact CG1-CG 4.44Å; M506-I512 WeakPolarHBondContact O-CA 3.33Å; M506-T513 PolarHBondContact N-O 3.43Å; M506-T513 VanDerWaalsContact N-O 3.11Å; M506-T513 PolarHBondContact O-N 2.93Å; M506-I515 HydrophobicContact CB-CD1 4.41Å; M506-I515 HydrophobicContact CG-CD1 4.29Å; M506-I515 HydrophobicContact SD-CD1 3.91Å
507	A	95.6	Very high	84.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.6	175.4	0	0	0	0	0	111.6	I49 M52 V488 S489 K511	I49-A507 HydrophobicContact CB-CB 4.19Å; I49-A507 HydrophobicContact CG2-CB 3.86Å; M52-A507 HydrophobicContact CE-CB 3.83Å; M52-A507 HydrophobicContact SD-CB 4.16Å; V488-A507 CarbonylContact C-O 3.45Å; V488-A507 WeakPolarHBondContact CA-O 3.13Å; S489-A507 PolarHBondContact N-O 2.92Å; A507-K511 CarbonylContact C-O 3.58Å; A507-K511 VanDerWaalsContact CA-O 3.31Å; A507-K511 WeakPolarHBondContact CA-O 3.27Å
508	T	95.3	Very high	85.8	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	111.4	175.2	46.9	0	0	0	0	108.5	L483 D484 V488 S510 K511	L483-T508 HydrophobicContact CB-CG2 4.1Å; L483-T508 HydrophobicContact CD1-CG2 4.25Å; D484-T508 HydrophobicContact CB-CG2 4.32Å; V488-T508 HydrophobicContact CB-CG2 4.33Å; V488-T508 HydrophobicContact CG2-CG2 3.84Å; T508-S510 PolarHBondContact O-N 2.91Å; T508-K511 PolarHBondContact N-O 2.87Å; T508-K511 PolarHBondContact O-N 3.11Å; T508-K511 PolarHBondContact OG1-O 2.85Å
509	G	94.1	Very high	87.3	Confident	27 Å²	27	29.2 Å²	29.2	28%	0.278	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	-118	-172.8	0	0	0	0	0	111.5	I49	I49-G509 PolarHBondContact N-O 2.82Å
510	S	94.8	Very high	88.9	Confident	38 Å²	38	24 Å²	24	27%	0.266	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	6.1	175.2	65	0	0	0	0	114.6	A45 F47 I49 T508	A45-S510 WeakPolarHBondContact CB-O 3.48Å; A45-S510 PolarHBondContact N-O 3.37Å; A45-S510 VanDerWaalsContact O-CB 3.3Å; A45-S510 WeakPolarHBondContact O-CB 3.17Å; A45-S510 PolarHBondContact O-OG 2.87Å; F47-S510 WeakPolarHBondContact O-CB 3.09Å; I49-S510 WeakPolarHBondContact CD1-O 3.41Å; T508-S510 PolarHBondContact O-N 2.91Å
511	K	95.5	Very high	90.8	Very high	49 Å²	49	20.5 Å²	20.5	21%	0.213	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.1	-171.2	175.7	-177.5	161.5	-160.6	0	111.8	F43 L483 D484 A507 T508	F43-K511 CarbonylContact O-C 3.49Å; F43-K511 WeakPolarHBondContact O-CA 3.37Å; L483-K511 PolarHBondContact O-NZ 2.85Å; D484-K511 WeakPolarHBondContact OD2-CD 3.14Å; D484-K511 IonicContact OD2-NZ 2.85Å; D484-K511 PolarHBondContact OD2-NZ 2.97Å; A507-K511 CarbonylContact C-O 3.58Å; A507-K511 VanDerWaalsContact CA-O 3.31Å; A507-K511 WeakPolarHBondContact CA-O 3.27Å; T508-K511 PolarHBondContact N-O 2.87Å; T508-K511 PolarHBondContact O-N 3.11Å; T508-K511 PolarHBondContact OG1-O 2.85Å
512	I	95.6	Very high	92	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.5	169.8	-53.9	177.7	0	0	0	108.6	T42 F43 I49 M52 V61 L70 L74 L505 M506	T42-I512 CarbonylContact C-O 3.58Å; T42-I512 WeakPolarHBondContact CA-O 3.13Å; T42-I512 WeakPolarHBondContact CB-O 3.45Å; F43-I512 HydrophobicContact CD1-CD1 4.07Å; F43-I512 HydrophobicContact CD1-CG1 4.41Å; F43-I512 PolarHBondContact N-O 2.03Å; F43-I512 PolarHBondContact O-N 3.49Å; I49-I512 HydrophobicContact CD1-CD1 3.97Å; I49-I512 HydrophobicContact CD1-CG1 3.45Å; I49-I512 VanDerWaalsContact CD1-CG1 3.45Å; M52-I512 HydrophobicContact SD-CD1 3.69Å; M52-I512 HydrophobicContact SD-CG1 4Å; M52-I512 HydrophobicContact SD-CG2 4.37Å; V61-I512 HydrophobicContact CB-CD1 4.46Å; V61-I512 HydrophobicContact CG1-CD1 3.98Å; V61-I512 HydrophobicContact CG2-CD1 3.59Å; L70-I512 HydrophobicContact CD1-CD1 3.83Å; L74-I512 HydrophobicContact CD1-CG2 4.13Å; L74-I512 HydrophobicContact CD2-CG2 4.31Å; L505-I512 HydrophobicContact CB-CG2 4.14Å; M506-I512 WeakPolarHBondContact O-CA 3.33Å
513	T	94.9	Very high	92.3	Very high	5 Å²	5	15 Å²	15	3%	0.031	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.1	170.1	-49.6	0	0	0	0	110.4	L40 T42 L483 M506 I515	L40-T513 HydrophobicContact CB-CG2 3.72Å; L40-T513 HydrophobicContact CD1-CG2 3.83Å; L40-T513 HydrophobicContact CG-CG2 4.45Å; T42-T513 HydrophobicContact CG2-CG2 3.98Å; L483-T513 HydrophobicContact CD2-CG2 4.22Å; M506-T513 PolarHBondContact N-O 3.43Å; M506-T513 VanDerWaalsContact N-O 3.11Å; M506-T513 PolarHBondContact O-N 2.93Å; T513-I515 HydrophobicContact CG2-CG1 4.1Å
514	K	93.6	Very high	92.1	Very high	43 Å²	43	14.9 Å²	14.9	19%	0.187	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.2	172.9	-176.9	171.2	-174.7	178.8	0	109.9	P41 P72 L74 A503 L505	P41-K514 HydrophobicContact CB-CB 4.27Å; P41-K514 PolarHBondContact O-N 3.17Å; P72-K514 PolarHBondContact O-NZ 2.96Å; L74-K514 HydrophobicContact CD1-CB 3.9Å; L74-K514 HydrophobicContact CG-CB 4.43Å; A503-K514 HydrophobicContact CB-CD 4.26Å; A503-K514 HydrophobicContact CB-CG 3.61Å; L505-K514 HydrophobicContact CD2-CB 3.64Å; L505-K514 HydrophobicContact CD2-CD 4.18Å; L505-K514 HydrophobicContact CD2-CG 3.66Å
515	I	92.6	Very high	91.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.2	-174	-39.5	174.7	0	0	0	109.2	L40 H466 L483 A503 V504 M506 T513	L40-I515 HydrophobicContact CD1-CG1 4.31Å; L40-I515 HydrophobicContact CD1-CG2 4.32Å; H466-I515 HydrophobicContact CB-CD1 4Å; H466-I515 VanDerWaalsContact CD2-CD1 3.45Å; H466-I515 WeakPolarHBondContact CD2-CD1 3.29Å; L483-I515 HydrophobicContact CD1-CD1 4.01Å; L483-I515 HydrophobicContact CD2-CD1 3.75Å; L483-I515 HydrophobicContact CD2-CG1 4.49Å; A503-I515 CarbonylContact C-O 3.47Å; A503-I515 WeakPolarHBondContact CA-O 3.46Å; A503-I515 VanDerWaalsContact CB-O 3.28Å; A503-I515 WeakPolarHBondContact CB-O 3.28Å; V504-I515 HydrophobicContact CG1-CB 3.83Å; V504-I515 HydrophobicContact CG1-CD1 4.27Å; V504-I515 HydrophobicContact CG1-CG1 4.32Å; V504-I515 PolarHBondContact N-O 2.81Å; V504-I515 PolarHBondContact O-N 3.45Å; M506-I515 HydrophobicContact CB-CD1 4.41Å; M506-I515 HydrophobicContact CG-CD1 4.29Å; M506-I515 HydrophobicContact SD-CD1 3.91Å; T513-I515 HydrophobicContact CG2-CG1 4.1Å
516	P	91.7	Very high	91.3	Very high	42 Å²	42	18.7 Å²	18.7	27%	0.273	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	144.6	-179.6	-23.3	32.8	0	0	0	112.9	Q468 I518 G519	Q468-P516 PolarHBondContact NE2-O 3.33Å; P516-I518 VanDerWaalsContact C-N 3.26Å; P516-I518 HydrophobicContact CB-CG1 4.17Å; P516-I518 PolarHBondContact O-N 2.84Å; P516-G519 WeakPolarHBondContact O-CA 3.47Å; P516-G519 PolarHBondContact O-N 2.94Å
517	L	89.8	Confident	90.7	Very high	11 Å²	11	19.7 Å²	19.7	6%	0.058	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-36.8	175.5	-68.4	173.8	0	0	0	111.5	V449 V451 Y458 L494 G502 G519	V449-L517 HydrophobicContact CB-CD2 4.27Å; V449-L517 HydrophobicContact CG1-CD1 4.18Å; V449-L517 HydrophobicContact CG1-CD2 4.27Å; V449-L517 HydrophobicContact CG2-CD2 4.03Å; V451-L517 HydrophobicContact CG2-CB 4.06Å; Y458-L517 HydrophobicContact CE1-CD2 3.79Å; Y458-L517 HydrophobicContact CE2-CD2 4.15Å; Y458-L517 WeakPolarHBondContact OH-CA 3.45Å; Y458-L517 WeakPolarHBondContact OH-CB 3.45Å; Y458-L517 VanDerWaalsContact OH-CD2 3.31Å; Y458-L517 WeakPolarHBondContact OH-CD2 3.33Å; Y458-L517 PolarHBondContact OH-O 2.89Å; L494-L517 HydrophobicContact CD2-CD2 4.18Å; G502-L517 WeakPolarHBondContact O-CG 3.37Å; G502-L517 PolarHBondContact O-N 2.85Å; L517-G519 PolarHBondContact O-N 2.75Å; L517-G519 VanDerWaalsContact O-N 3.08Å
518	I	88.7	Confident	90.1	Very high	24 Å²	24	19.7 Å²	19.7	12%	0.123	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	16.8	172.1	64.7	163.3	0	0	0	114.2	V451 P516 V537 T538 R549	V451-I518 HydrophobicContact CG1-CG2 4.27Å; P516-I518 VanDerWaalsContact C-N 3.26Å; P516-I518 HydrophobicContact CB-CG1 4.17Å; P516-I518 PolarHBondContact O-N 2.84Å; I518-V537 WeakPolarHBondContact CB-O 3.42Å; I518-V537 WeakPolarHBondContact CG2-O 3.42Å; I518-T538 WeakPolarHBondContact O-CA 3.23Å; I518-R549 PolarHBondContact O-NH2 3.02Å
519	G	88.9	Confident	89.3	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.134	C	C	.	.			trans	75.1	165.1	-179.2	0	0	0	0	0	114.9	P516 L517 G521 R549	P516-G519 WeakPolarHBondContact O-CA 3.47Å; P516-G519 PolarHBondContact O-N 2.94Å; L517-G519 PolarHBondContact O-N 2.75Å; L517-G519 VanDerWaalsContact O-N 3.08Å; G519-G521 VanDerWaalsContact C-N 3.34Å; G519-G521 PolarHBondContact O-N 3.18Å; G519-R549 PolarHBondContact O-NH2 3.02Å
520	P	89.1	Confident	88.6	Confident	17 Å²	17	19.9 Å²	19.9	11%	0.11	12%	0.124	C	C	.	.	S	Bend	trans	-67.9	-33.6	-178.6	31.2	-37.3	0	0	0	112.1	Y38 L40 V479 I481	Y38-P520 HydrophobicContact CD1-CB 4.03Å; Y38-P520 HydrophobicContact CD2-CB 3.74Å; Y38-P520 HydrophobicContact CD2-CG 3.66Å; Y38-P520 HydrophobicContact CE1-CB 4.4Å; Y38-P520 HydrophobicContact CE1-CG 4.49Å; Y38-P520 HydrophobicContact CE2-CB 4.1Å; Y38-P520 HydrophobicContact CE2-CG 3.59Å; Y38-P520 HydrophobicContact CG-CB 3.67Å; Y38-P520 HydrophobicContact CG-CG 4.11Å; L40-P520 HydrophobicContact CD1-CB 4.37Å; L40-P520 HydrophobicContact CD2-CB 3.97Å; V479-P520 HydrophobicContact CG1-CG 3.84Å; I481-P520 HydrophobicContact CD1-CG 4.31Å; I481-P520 HydrophobicContact CG2-CG 4.35Å
521	G	88.6	Confident	88.1	Confident	7 Å²	7	18 Å²	18	7%	0.072	11%	0.112	C	C	.	.			trans	170.4	-169.6	177.6	0	0	0	0	0	112.7	Y38 G519	Y38-G521 PolarHBondContact OH-O 2.92Å; G519-G521 VanDerWaalsContact C-N 3.34Å; G519-G521 PolarHBondContact O-N 3.18Å
522	C	90.2	Very high	87.6	Confident	4 Å²	4	16 Å²	16	3%	0.027	10%	0.103	C	C	.	.	S	Bend	trans	-99.5	-10.7	-172	-56.3	0	0	0	0	114.7	Q524 L525 C540 C547 T548 R549	C522-Q524 VanDerWaalsContact C-N 3.26Å; C522-Q524 PolarHBondContact O-N 2.96Å; C522-Q524 VanDerWaalsContact O-N 3.15Å; C522-L525 WeakPolarHBondContact O-CB 3.45Å; C522-L525 PolarHBondContact O-N 2.75Å; C522-C540 VanDerWaalsContact CA-SG 3.52Å; C522-C540 HydrophobicContact CB-CB 3.96Å; C522-C540 WeakPolarHBondContact CB-SG 3.49Å; C522-C540 VanDerWaalsContact SG-CA 3.57Å; C522-C540 WeakPolarHBondContact SG-CB 3.19Å; C522-C540 CovalentContact SG-SG 2.03Å; C522-C540 PolarHBondContact SG-SG 3.12Å; C522-C547 HydrophobicContact CB-CB 4.17Å; C522-C547 VanDerWaalsContact CB-O 3.23Å; C522-C547 WeakPolarHBondContact CB-O 3.02Å; C522-T548 VanDerWaalsContact SG-C 3.51Å; C522-R549 PolarHBondContact SG-N 3.31Å; C522-R549 VanDerWaalsContact SG-N 3.43Å
523	G	86.7	Confident	86.7	Confident	40 Å²	40	18.2 Å²	18.2	41%	0.412	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25	-166.3	0	0	0	0	0	115.3	Y38 L525	Y38-G523 PolarHBondContact OH-N 3.41Å; Y38-G523 VanDerWaalsContact OH-N 3.12Å; G523-L525 VanDerWaalsContact C-N 3.26Å; G523-L525 PolarHBondContact O-N 3.38Å
524	Q	87	Confident	86	Confident	2 Å²	2	18.2 Å²	18.2	1%	0.009	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.4	175.5	-71.4	-164.7	-34.6	0	0	113.8	L32 N33 V36 Y38 N480 C522 T526	L32-Q524 WeakPolarHBondContact CA-O 3.32Å; L32-Q524 HydrophobicContact CB-CB 4.35Å; L32-Q524 HydrophobicContact CD2-CB 4.01Å; N33-Q524 PolarHBondContact N-O 3.04Å; N33-Q524 PolarHBondContact O-NE2 3.27Å; V36-Q524 HydrophobicContact CB-CG 3.88Å; V36-Q524 HydrophobicContact CG1-CG 4.28Å; V36-Q524 HydrophobicContact CG2-CG 4.44Å; Y38-Q524 HydrophobicContact CE2-CG 3.95Å; Y38-Q524 PolarHBondContact OH-N 3.35Å; N480-Q524 PolarHBondContact O-NE2 3.25Å; N480-Q524 PolarHBondContact O-OE1 2.85Å; C522-Q524 VanDerWaalsContact C-N 3.26Å; C522-Q524 PolarHBondContact O-N 2.96Å; C522-Q524 VanDerWaalsContact O-N 3.15Å; Q524-T526 PolarHBondContact O-N 2.71Å
525	L	86.7	Confident	85.1	Confident	6 Å²	6	16.7 Å²	16.7	3%	0.031	11%	0.11	C	C	.	.			trans	-89.8	80.3	-174	-61.4	163.4	0	0	0	110	L32 C522 G523 T527 C531 C547	L32-L525 HydrophobicContact CD2-CD2 3.69Å; L32-L525 HydrophobicContact CD2-CG 4.42Å; C522-L525 WeakPolarHBondContact O-CB 3.45Å; C522-L525 PolarHBondContact O-N 2.75Å; G523-L525 VanDerWaalsContact C-N 3.26Å; G523-L525 PolarHBondContact O-N 3.38Å; L525-T527 VanDerWaalsContact C-N 3.27Å; L525-T527 PolarHBondContact O-N 3.17Å; L525-C531 HydrophobicContact CB-CB 4.33Å; L525-C547 HydrophobicContact CB-CB 3.94Å; L525-C547 WeakPolarHBondContact O-CB 3.3Å
526	T	83.6	Confident	84.5	Confident	75 Å²	75	21.4 Å²	21.4	46%	0.46	13%	0.13	S	C	.	.			trans	-72.9	-8.9	-171.7	52.7	0	0	0	0	115.4	N33 Q524	N33-T526 HydrophobicContact CB-CG2 3.71Å; Q524-T526 PolarHBondContact O-N 2.71Å
527	T	81.4	Confident	84.1	Confident	21 Å²	21	19.5 Å²	19.5	13%	0.129	12%	0.118	C	C	.	.	S	Bend	trans	-124.7	146.6	-179.3	70	0	0	0	0	111.5	L525 T529 S530 C531 W542	L525-T527 VanDerWaalsContact C-N 3.27Å; L525-T527 PolarHBondContact O-N 3.17Å; T527-T529 VanDerWaalsContact C-N 3.26Å; T527-T529 PolarHBondContact O-N 2.92Å; T527-T529 PolarHBondContact OG1-OG1 2.86Å; T527-S530 PolarHBondContact N-OG 3.42Å; T527-S530 PolarHBondContact O-N 2.88Å; T527-S530 PolarHBondContact O-OG 2.98Å; T527-S530 WeakPolarHBondContact OG1-CB 3.43Å; T527-S530 PolarHBondContact OG1-N 2.99Å; T527-S530 PolarHBondContact OG1-OG 3.26Å; T527-C531 WeakPolarHBondContact O-CB 3.47Å; T527-C531 PolarHBondContact O-N 2.89Å; T527-W542 VanDerWaalsContact C-CZ3 3.42Å
528	C	82.8	Confident	83.9	Confident	1 Å²	1	19 Å²	19	1%	0.007	12%	0.115	C	C	.	.	H	α-helix	trans	-56.6	-41.6	177.6	-177.3	0	0	0	0	112.2	C531 L532 W542 C564	C528-C531 WeakPolarHBondContact O-CB 3.37Å; C528-C531 PolarHBondContact O-N 3.29Å; C528-L532 WeakPolarHBondContact O-CB 3.4Å; C528-L532 WeakPolarHBondContact O-CG 3.46Å; C528-L532 PolarHBondContact O-N 3.18Å; C528-W542 VanDerWaalsContact CA-CE3 3.49Å; C528-W542 HydrophobicContact CB-CD2 3.57Å; C528-W542 HydrophobicContact CB-CE3 3.97Å; C528-W542 HydrophobicContact CB-CG 3.83Å; C528-W542 HydrophobicContact CB-CH2 4.45Å; C528-W542 HydrophobicContact CB-CZ2 4.09Å; C528-W542 HydrophobicContact CB-CZ3 4.4Å; C528-W542 VanDerWaalsContact SG-CG 3.58Å; C528-C564 HydrophobicContact CB-CB 3.78Å; C528-C564 WeakPolarHBondContact CB-SG 3.15Å; C528-C564 WeakPolarHBondContact SG-CA 3.17Å; C528-C564 WeakPolarHBondContact SG-CB 3.39Å; C528-C564 CovalentContact SG-SG 2.03Å; C528-C564 PolarHBondContact SG-SG 2.89Å
529	T	78.8	Confident	83.8	Confident	21 Å²	21	22 Å²	22	13%	0.129	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-45.9	176.9	46.3	0	0	0	0	112.8	T527 L533 N590 F593 W624	T527-T529 VanDerWaalsContact C-N 3.26Å; T527-T529 PolarHBondContact O-N 2.92Å; T527-T529 PolarHBondContact OG1-OG1 2.86Å; T529-L533 WeakPolarHBondContact O-CB 3.26Å; T529-L533 VanDerWaalsContact O-CG 3.25Å; T529-L533 WeakPolarHBondContact O-CG 3.24Å; T529-L533 PolarHBondContact O-N 3.26Å; T529-L533 VanDerWaalsContact O-N 3.16Å; T529-N590 WeakPolarHBondContact CG2-OD1 3.16Å; T529-F593 HydrophobicContact CG2-CB 4.49Å; T529-F593 HydrophobicContact CG2-CD2 3.8Å; T529-F593 HydrophobicContact CG2-CE2 4.46Å; T529-F593 HydrophobicContact CG2-CG 4.32Å; T529-W624 HydrophobicContact CG2-CD2 4.34Å; T529-W624 HydrophobicContact CG2-CE3 3.67Å; T529-W624 HydrophobicContact CG2-CZ3 3.92Å
530	S	79.1	Confident	83.9	Confident	11 Å²	11	22 Å²	22	8%	0.077	13%	0.129	C	C	.	.	H	α-helix	trans	-67.1	-40.9	176.4	58.3	0	0	0	0	112	T527 S534	T527-S530 PolarHBondContact N-OG 3.42Å; T527-S530 PolarHBondContact O-N 2.88Å; T527-S530 PolarHBondContact O-OG 2.98Å; T527-S530 WeakPolarHBondContact OG1-CB 3.43Å; T527-S530 PolarHBondContact OG1-N 2.99Å; T527-S530 PolarHBondContact OG1-OG 3.26Å; S530-S534 WeakPolarHBondContact O-CB 3.34Å; S530-S534 PolarHBondContact O-N 3.09Å; S530-S534 VanDerWaalsContact O-N 3.11Å
531	C	85.2	Confident	84	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.4	-52	175.8	-171.8	0	0	0	0	112.7	L525 T527 C528 S534 S535 G541 W542 C547	L525-C531 HydrophobicContact CB-CB 4.33Å; T527-C531 WeakPolarHBondContact O-CB 3.47Å; T527-C531 PolarHBondContact O-N 2.89Å; C528-C531 WeakPolarHBondContact O-CB 3.37Å; C528-C531 PolarHBondContact O-N 3.29Å; C531-S534 PolarHBondContact O-N 2.8Å; C531-S535 PolarHBondContact O-N 3.41Å; C531-G541 PolarHBondContact SG-O 3Å; C531-W542 HydrophobicContact CB-CE3 3.89Å; C531-W542 HydrophobicContact CB-CZ3 4.37Å; C531-C547 VanDerWaalsContact CA-SG 3.54Å; C531-C547 HydrophobicContact CB-CB 3.66Å; C531-C547 WeakPolarHBondContact CB-SG 3.28Å; C531-C547 VanDerWaalsContact SG-CA 3.54Å; C531-C547 WeakPolarHBondContact SG-CB 3.49Å; C531-C547 CovalentContact SG-SG 2.03Å; C531-C547 PolarHBondContact SG-SG 2.94Å
532	L	83.8	Confident	84.1	Confident	5 Å²	5	22.7 Å²	22.7	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-77.6	-22.6	-174.6	-62.6	-163.6	0	0	0	113.8	C528 S535 W542 N563 C564 F593	C528-L532 WeakPolarHBondContact O-CB 3.4Å; C528-L532 WeakPolarHBondContact O-CG 3.46Å; C528-L532 PolarHBondContact O-N 3.18Å; L532-S535 WeakPolarHBondContact O-CB 3.46Å; L532-W542 HydrophobicContact CD2-CB 4.27Å; L532-N563 WeakPolarHBondContact CD1-O 3.36Å; L532-C564 VanDerWaalsContact CD1-SG 3.59Å; L532-F593 HydrophobicContact CB-CE1 3.91Å; L532-F593 HydrophobicContact CB-CE2 4.49Å; L532-F593 HydrophobicContact CB-CZ 3.55Å; L532-F593 HydrophobicContact CD1-CE1 3.76Å; L532-F593 HydrophobicContact CD1-CZ 4.29Å; L532-F593 HydrophobicContact CG-CE1 4.46Å
533	L	77.9	Confident	84.1	Confident	48 Å²	48	22.5 Å²	22.5	25%	0.251	13%	0.126	S	C	.	.	H	α-helix	trans	-71	-43.9	168.3	-72.3	178.3	0	0	0	111.9	T529 S535 F593 E597 W624	T529-L533 WeakPolarHBondContact O-CB 3.26Å; T529-L533 VanDerWaalsContact O-CG 3.25Å; T529-L533 WeakPolarHBondContact O-CG 3.24Å; T529-L533 PolarHBondContact O-N 3.26Å; T529-L533 VanDerWaalsContact O-N 3.16Å; L533-S535 VanDerWaalsContact C-N 3.31Å; L533-S535 PolarHBondContact O-N 3.18Å; L533-F593 HydrophobicContact CD2-CE2 4.25Å; L533-F593 HydrophobicContact CG-CE2 4.27Å; L533-E597 HydrophobicContact CD2-CG 3.68Å; L533-W624 HydrophobicContact CD1-CH2 3.97Å; L533-W624 HydrophobicContact CD1-CZ3 3.97Å; L533-W624 HydrophobicContact CD2-CH2 4.41Å; L533-W624 HydrophobicContact CG-CH2 4.44Å
534	S	79.4	Confident	84	Confident	5 Å²	5	26.4 Å²	26.4	4%	0.035	14%	0.137	C	C	.	.	H	α-helix	trans	-68.5	-29.8	178.8	-179	0	0	0	0	113.3	S530 C531 K536 V537 T538	S530-S534 WeakPolarHBondContact O-CB 3.34Å; S530-S534 PolarHBondContact O-N 3.09Å; S530-S534 VanDerWaalsContact O-N 3.11Å; C531-S534 PolarHBondContact O-N 2.8Å; S534-K536 PolarHBondContact O-N 2.65Å; S534-V537 PolarHBondContact O-N 2.7Å; S534-T538 PolarHBondContact O-N 2.85Å; S534-T538 PolarHBondContact O-OG1 2.93Å; S534-T538 WeakPolarHBondContact OG-CG2 3.45Å; S534-T538 PolarHBondContact OG-OG1 2.71Å
535	S	76.3	Confident	83.8	Confident	11 Å²	11	28.9 Å²	28.9	8%	0.077	16%	0.164	C	C	.	.	H	α-helix	trans	-37.1	-40.7	-175.8	-174.6	0	0	0	0	116.2	C531 L532 L533 V537 Q539 C540 Q561	C531-S535 PolarHBondContact O-N 3.41Å; L532-S535 WeakPolarHBondContact O-CB 3.46Å; L533-S535 VanDerWaalsContact C-N 3.31Å; L533-S535 PolarHBondContact O-N 3.18Å; S535-V537 VanDerWaalsContact C-N 3.27Å; S535-V537 PolarHBondContact O-N 3.1Å; S535-Q539 WeakPolarHBondContact O-CA 3.39Å; S535-Q539 PolarHBondContact O-N 2.89Å; S535-C540 VanDerWaalsContact CB-O 3.3Å; S535-C540 WeakPolarHBondContact CB-O 3.46Å; S535-C540 PolarHBondContact OG-O 2.92Å; S535-Q561 PolarHBondContact OG-NE2 3.45Å; S535-Q561 VanDerWaalsContact OG-NE2 3.08Å
536	K	79.4	Confident	83.9	Confident	99 Å²	99	34.8 Å²	34.8	43%	0.43	19%	0.185	S	C	.	.	H	α-helix	trans	-59.3	-33.3	179.7	-66.2	179	-177.2	170.1	0	113.4	N452 S534 K595	N452-K536 VanDerWaalsContact CB-O 3.29Å; N452-K536 WeakPolarHBondContact CB-O 3.43Å; N452-K536 PolarHBondContact ND2-O 3.19Å; S534-K536 PolarHBondContact O-N 2.65Å; K536-K595 PolarHBondContact NZ-O 2.72Å
537	V	81.9	Confident	84.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-95.1	-50.7	177.4	176.8	0	0	0	0	110.4	V451 N452 V456 L470 I518 S534 S535 Q539	V451-V537 HydrophobicContact CB-CG1 4.44Å; V451-V537 HydrophobicContact CG1-CG1 4.13Å; N452-V537 PolarHBondContact ND2-O 2.67Å; V456-V537 HydrophobicContact CG2-CB 4.48Å; V456-V537 HydrophobicContact CG2-CG1 3.92Å; V456-V537 HydrophobicContact CG2-CG2 3.67Å; L470-V537 HydrophobicContact CD1-CG2 3.99Å; I518-V537 WeakPolarHBondContact CB-O 3.42Å; I518-V537 WeakPolarHBondContact CG2-O 3.42Å; S534-V537 PolarHBondContact O-N 2.7Å; S535-V537 VanDerWaalsContact C-N 3.27Å; S535-V537 PolarHBondContact O-N 3.1Å; V537-Q539 PolarHBondContact O-N 2.67Å
538	T	86.3	Confident	84.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-86	-7.3	-166.7	52.8	0	0	0	0	115.1	I518 S534 C540 R549	I518-T538 WeakPolarHBondContact O-CA 3.23Å; S534-T538 PolarHBondContact O-N 2.85Å; S534-T538 PolarHBondContact O-OG1 2.93Å; S534-T538 WeakPolarHBondContact OG-CG2 3.45Å; S534-T538 PolarHBondContact OG-OG1 2.71Å; T538-C540 VanDerWaalsContact CB-SG 3.54Å; T538-C540 PolarHBondContact O-N 2.79Å; T538-C540 VanDerWaalsContact O-N 3.15Å; T538-C540 PolarHBondContact OG1-SG 3.4Å; T538-R549 PolarHBondContact O-NE 3.33Å
539	Q	87.3	Confident	85.1	Confident	89 Å²	89	33.5 Å²	33.5	42%	0.416	17%	0.172	S	C	.	.			trans	57.7	19.4	-173.6	-55.3	-178.1	-0.4	0	0	113.9	S535 V537	S535-Q539 WeakPolarHBondContact O-CA 3.39Å; S535-Q539 PolarHBondContact O-N 2.89Å; V537-Q539 PolarHBondContact O-N 2.67Å
540	C	90.4	Very high	85.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	158.7	175.4	-60.9	0	0	0	0	112.1	C522 S535 T538 C547 Q561	C522-C540 VanDerWaalsContact CA-SG 3.52Å; C522-C540 HydrophobicContact CB-CB 3.96Å; C522-C540 WeakPolarHBondContact CB-SG 3.49Å; C522-C540 VanDerWaalsContact SG-CA 3.57Å; C522-C540 WeakPolarHBondContact SG-CB 3.19Å; C522-C540 CovalentContact SG-SG 2.03Å; C522-C540 PolarHBondContact SG-SG 3.12Å; S535-C540 VanDerWaalsContact CB-O 3.3Å; S535-C540 WeakPolarHBondContact CB-O 3.46Å; S535-C540 PolarHBondContact OG-O 2.92Å; T538-C540 VanDerWaalsContact CB-SG 3.54Å; T538-C540 PolarHBondContact O-N 2.79Å; T538-C540 VanDerWaalsContact O-N 3.15Å; T538-C540 PolarHBondContact OG1-SG 3.4Å; C540-C547 VanDerWaalsContact CB-SG 3.56Å; C540-Q561 PolarHBondContact O-NE2 3.02Å
541	G	91.2	Very high	86.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	163.1	168.6	0	0	0	0	0	110.3	C531 T548 S560	C531-G541 PolarHBondContact SG-O 3Å; G541-T548 PolarHBondContact N-O 3.17Å; G541-T548 PolarHBondContact O-N 2.81Å; G541-T548 VanDerWaalsContact O-O 3.05Å; G541-S560 CarbonylContact C-O 3.58Å
542	W	90.3	Very high	86.4	Confident	37 Å²	37	48.7 Å²	48.7	14%	0.14	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.8	-179.4	-164.9	-112.2	0	0	0	110.2	T527 C528 C531 L532 G545 C547 W559 S560	T527-W542 VanDerWaalsContact C-CZ3 3.42Å; C528-W542 VanDerWaalsContact CA-CE3 3.49Å; C528-W542 HydrophobicContact CB-CD2 3.57Å; C528-W542 HydrophobicContact CB-CE3 3.97Å; C528-W542 HydrophobicContact CB-CG 3.83Å; C528-W542 HydrophobicContact CB-CH2 4.45Å; C528-W542 HydrophobicContact CB-CZ2 4.09Å; C528-W542 HydrophobicContact CB-CZ3 4.4Å; C528-W542 VanDerWaalsContact SG-CG 3.58Å; C531-W542 HydrophobicContact CB-CE3 3.89Å; C531-W542 HydrophobicContact CB-CZ3 4.37Å; L532-W542 HydrophobicContact CD2-CB 4.27Å; W542-G545 WeakPolarHBondContact CH2-O 3.39Å; W542-G545 VanDerWaalsContact CZ2-O 3.29Å; W542-G545 WeakPolarHBondContact CZ2-O 3.27Å; W542-C547 HydrophobicContact CE3-CB 4.12Å; W542-C547 HydrophobicContact CZ3-CB 4.14Å; W542-W559 CarbonylContact O-C 3.58Å; W542-W559 WeakPolarHBondContact O-CA 3.31Å; W542-S560 PolarHBondContact N-O 2.83Å; W542-S560 PolarHBondContact O-N 2.85Å
543	C	90.6	Very high	86.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	105	-179.9	178.8	0	0	0	0	107.5	G545 R546 T548 C553	C543-G545 PolarHBondContact O-N 3.44Å; C543-G545 VanDerWaalsContact O-N 3.13Å; C543-R546 CarbonylContact C-O 3.57Å; C543-R546 HydrophobicContact CB-CG 4.47Å; C543-R546 PolarHBondContact N-O 3.1Å; C543-R546 WeakPolarHBondContact O-CG 3.4Å; C543-R546 PolarHBondContact O-N 3.28Å; C543-T548 WeakPolarHBondContact CB-OG1 3.23Å; C543-C553 HydrophobicContact CB-CB 3.7Å; C543-C553 WeakPolarHBondContact CB-SG 3.49Å; C543-C553 WeakPolarHBondContact SG-CA 3.3Å; C543-C553 WeakPolarHBondContact SG-CB 3.29Å; C543-C553 CovalentContact SG-SG 2.03Å; C543-C553 PolarHBondContact SG-SG 3.01Å
544	D	83.8	Confident	87.4	Confident	121 Å²	121	49 Å²	49	65%	0.647	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	55.5	165.6	-156.1	10	0	0	0	114.8	R546 S557	D544-R546 PolarHBondContact O-N 2.75Å; D544-S557 PolarHBondContact OD2-OG 3.02Å
545	G	83.5	Confident	87.6	Confident	55 Å²	55	55.1 Å²	55.1	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	-6.2	179.5	0	0	0	0	0	116.4	W542 C543	W542-G545 WeakPolarHBondContact CH2-O 3.39Å; W542-G545 VanDerWaalsContact CZ2-O 3.29Å; W542-G545 WeakPolarHBondContact CZ2-O 3.27Å; C543-G545 PolarHBondContact O-N 3.44Å; C543-G545 VanDerWaalsContact O-N 3.13Å
546	R	89.1	Confident	88.1	Confident	129 Å²	129	61 Å²	61	49%	0.487	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.3	178.6	60.5	175.1	-160.5	-149	16	113.6	C543 D544 T548 Q552	C543-R546 CarbonylContact C-O 3.57Å; C543-R546 HydrophobicContact CB-CG 4.47Å; C543-R546 PolarHBondContact N-O 3.1Å; C543-R546 WeakPolarHBondContact O-CG 3.4Å; C543-R546 PolarHBondContact O-N 3.28Å; D544-R546 PolarHBondContact O-N 2.75Å; R546-T548 HydrophobicContact CG-CG2 4.01Å; R546-Q552 PolarHBondContact NH2-O 3.02Å
547	C	90.7	Very high	88.3	Confident	11 Å²	11	57.4 Å²	57.4	7%	0.074	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.8	173.2	-167.6	0	0	0	0	110.9	C522 L525 C531 C540 W542	C522-C547 HydrophobicContact CB-CB 4.17Å; C522-C547 VanDerWaalsContact CB-O 3.23Å; C522-C547 WeakPolarHBondContact CB-O 3.02Å; L525-C547 HydrophobicContact CB-CB 3.94Å; L525-C547 WeakPolarHBondContact O-CB 3.3Å; C531-C547 VanDerWaalsContact CA-SG 3.54Å; C531-C547 HydrophobicContact CB-CB 3.66Å; C531-C547 WeakPolarHBondContact CB-SG 3.28Å; C531-C547 VanDerWaalsContact SG-CA 3.54Å; C531-C547 WeakPolarHBondContact SG-CB 3.49Å; C531-C547 CovalentContact SG-SG 2.03Å; C531-C547 PolarHBondContact SG-SG 2.94Å; C540-C547 VanDerWaalsContact CB-SG 3.56Å; W542-C547 HydrophobicContact CE3-CB 4.12Å; W542-C547 HydrophobicContact CZ3-CB 4.14Å
548	T	92	Very high	88.5	Confident	10 Å²	10	62 Å²	62	6%	0.061	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	153.2	-173	51.1	0	0	0	0	112.8	C522 G541 C543 R546 Q552 W559	C522-T548 VanDerWaalsContact SG-C 3.51Å; G541-T548 PolarHBondContact N-O 3.17Å; G541-T548 PolarHBondContact O-N 2.81Å; G541-T548 VanDerWaalsContact O-O 3.05Å; C543-T548 WeakPolarHBondContact CB-OG1 3.23Å; R546-T548 HydrophobicContact CG-CG2 4.01Å; T548-Q552 HydrophobicContact CG2-CB 4.25Å; T548-W559 PolarHBondContact O-NE1 2.81Å
549	R	91.2	Very high	88.7	Confident	49 Å²	49	64.7 Å²	64.7	19%	0.185	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	152.9	165.7	-65.1	-172.4	174.3	135.4	2.8	109.3	I518 G519 C522 T538 P551 Q552	I518-R549 PolarHBondContact O-NH2 3.02Å; G519-R549 PolarHBondContact O-NH2 3.02Å; C522-R549 PolarHBondContact SG-N 3.31Å; C522-R549 VanDerWaalsContact SG-N 3.43Å; T538-R549 PolarHBondContact O-NE 3.33Å; R549-P551 VanDerWaalsContact C-N 3.33Å; R549-P551 VanDerWaalsContact O-N 3.11Å; R549-Q552 WeakPolarHBondContact O-CB 3.37Å; R549-Q552 PolarHBondContact O-N 3.1Å
550	R	88.7	Confident	88.6	Confident	125 Å²	125	61.5 Å²	61.5	47%	0.472	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-47.8	-42.2	-174	-175.8	67	-174.6	108.9	-13.9	115.1	Q552 C553 W559	R550-Q552 VanDerWaalsContact C-N 3.27Å; R550-Q552 PolarHBondContact O-N 2.83Å; R550-C553 PolarHBondContact O-N 3.41Å; R550-W559 HydrophobicContact CB-CD2 4.36Å; R550-W559 HydrophobicContact CB-CH2 3.95Å; R550-W559 HydrophobicContact CB-CZ2 3.73Å; R550-W559 HydrophobicContact CB-CZ3 4.43Å; R550-W559 HydrophobicContact CG-CD2 4.47Å
551	P	90.3	Very high	88.4	Confident	125 Å²	125	64 Å²	64	81%	0.812	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-71.6	-15.5	-179.9	-18.9	33.8	0	0	0	114.8	R549	R549-P551 VanDerWaalsContact C-N 3.33Å; R549-P551 VanDerWaalsContact O-N 3.11Å
552	Q	90.4	Very high	87.7	Confident	102 Å²	102	69.1 Å²	69.1	48%	0.477	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-93	-0.8	-178.3	-61.8	167.9	-28.3	0	0	112.7	R546 T548 R549 R550	R546-Q552 PolarHBondContact NH2-O 3.02Å; T548-Q552 HydrophobicContact CG2-CB 4.25Å; R549-Q552 WeakPolarHBondContact O-CB 3.37Å; R549-Q552 PolarHBondContact O-N 3.1Å; R550-Q552 VanDerWaalsContact C-N 3.27Å; R550-Q552 PolarHBondContact O-N 2.83Å
553	C	91.1	Very high	87.1	Confident	8 Å²	8	71.5 Å²	71.5	5%	0.054	40%	0.401	C	S	.	.	S	Bend	trans	-97.7	124.3	174.6	-171.9	0	0	0	0	109.7	C543 R550 W559	C543-C553 HydrophobicContact CB-CB 3.7Å; C543-C553 WeakPolarHBondContact CB-SG 3.49Å; C543-C553 WeakPolarHBondContact SG-CA 3.3Å; C543-C553 WeakPolarHBondContact SG-CB 3.29Å; C543-C553 CovalentContact SG-SG 2.03Å; C543-C553 PolarHBondContact SG-SG 3.01Å; R550-C553 PolarHBondContact O-N 3.41Å; C553-W559 HydrophobicContact CB-CB 4.09Å; C553-W559 HydrophobicContact CB-CG 4.2Å
554	P	90.7	Very high	86.7	Confident	52 Å²	52	71.7 Å²	71.7	34%	0.338	40%	0.403	S	S	.	.			trans	-56.7	147.1	179.9	-24.9	34.9	0	0	0	112.2	T556 S557	P554-T556 PolarHBondContact O-N 3.43Å; P554-S557 PolarHBondContact O-N 2.82Å
555	S	84.6	Confident	86.7	Confident	132 Å²	132	69.7 Å²	69.7	92%	0.923	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.5	179.1	-50.9	0	0	0	0	113.9
556	T	85.6	Confident	86.8	Confident	136 Å²	136	67.5 Å²	67.5	83%	0.834	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-18	175.1	51.2	0	0	0	0	114	P554	P554-T556 PolarHBondContact O-N 3.43Å
557	S	85.5	Confident	86.7	Confident	22 Å²	22	64.6 Å²	64.6	15%	0.154	37%	0.368	C	S	.	.	S	Bend	trans	-103.5	139.7	-173.6	-64.5	0	0	0	0	111.1	D544 P554 W559	D544-S557 PolarHBondContact OD2-OG 3.02Å; P554-S557 PolarHBondContact O-N 2.82Å; S557-W559 PolarHBondContact O-N 2.94Å
558	S	85.8	Confident	86.6	Confident	99 Å²	99	64.9 Å²	64.9	69%	0.692	37%	0.368	S	S	*	.			trans	-73.2	111	176.4	57	0	0	0	0	111
559	W	89.9	Confident	86.4	Confident	56 Å²	56	68.5 Å²	68.5	21%	0.212	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	120.1	167.1	-170.2	88.3	0	0	0	109.7	W542 T548 R550 C553 S557 Q561	W542-W559 CarbonylContact O-C 3.58Å; W542-W559 WeakPolarHBondContact O-CA 3.31Å; T548-W559 PolarHBondContact O-NE1 2.81Å; R550-W559 HydrophobicContact CB-CD2 4.36Å; R550-W559 HydrophobicContact CB-CH2 3.95Å; R550-W559 HydrophobicContact CB-CZ2 3.73Å; R550-W559 HydrophobicContact CB-CZ3 4.43Å; R550-W559 HydrophobicContact CG-CD2 4.47Å; C553-W559 HydrophobicContact CB-CB 4.09Å; C553-W559 HydrophobicContact CB-CG 4.2Å; S557-W559 PolarHBondContact O-N 2.94Å; W559-Q561 HydrophobicContact CE3-CG 4.32Å; W559-Q561 HydrophobicContact CH2-CG 3.47Å; W559-Q561 VanDerWaalsContact CH2-CG 3.47Å; W559-Q561 HydrophobicContact CZ2-CG 3.88Å; W559-Q561 HydrophobicContact CZ3-CB 4.36Å; W559-Q561 HydrophobicContact CZ3-CG 3.67Å
560	S	85.6	Confident	86.3	Confident	22 Å²	22	70.5 Å²	70.5	15%	0.154	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.1	178	-176.7	0	0	0	0	110.3	G541 W542 D562 N563	G541-S560 CarbonylContact C-O 3.58Å; W542-S560 PolarHBondContact N-O 2.83Å; W542-S560 PolarHBondContact O-N 2.85Å; S560-D562 PolarHBondContact OG-N 2.84Å; S560-N563 PolarHBondContact OG-N 2.94Å; S560-N563 PolarHBondContact OG-O 2.94Å; S560-N563 PolarHBondContact OG-OD1 3.27Å
561	Q	85.5	Confident	86.4	Confident	51 Å²	51	65.4 Å²	65.4	24%	0.238	38%	0.383	C	S	.	.	S	Bend	trans	-107.5	-8.1	164.3	-88.3	-174.4	-19.7	0	0	113	S535 C540 W559 K595	S535-Q561 PolarHBondContact OG-NE2 3.45Å; S535-Q561 VanDerWaalsContact OG-NE2 3.08Å; C540-Q561 PolarHBondContact O-NE2 3.02Å; W559-Q561 HydrophobicContact CE3-CG 4.32Å; W559-Q561 HydrophobicContact CH2-CG 3.47Å; W559-Q561 VanDerWaalsContact CH2-CG 3.47Å; W559-Q561 HydrophobicContact CZ2-CG 3.88Å; W559-Q561 HydrophobicContact CZ3-CB 4.36Å; W559-Q561 HydrophobicContact CZ3-CG 3.67Å; Q561-K595 WeakPolarHBondContact O-CE 3.41Å; Q561-K595 PolarHBondContact O-NZ 3.3Å; Q561-K595 VanDerWaalsContact O-NZ 3.1Å
562	D	77.4	Confident	86.3	Confident	109 Å²	109	62 Å²	62	58%	0.583	36%	0.356	S	S	*	.	S	Bend	trans	-109.1	-24.7	-164.2	-65.5	-69.9	0	0	0	114.4	S560 K595	S560-D562 PolarHBondContact OG-N 2.84Å; D562-K595 IonicContact OD1-NZ 3.68Å; D562-K595 PolarHBondContact OD1-NZ 2.9Å
563	N	76.9	Confident	86.4	Confident	86 Å²	86	57.4 Å²	57.4	46%	0.46	33%	0.334	S	S	.	.			trans	-139.6	151.1	-173.8	56.4	41.9	0	0	0	112.6	L532 S560	L532-N563 WeakPolarHBondContact CD1-O 3.36Å; S560-N563 PolarHBondContact OG-N 2.94Å; S560-N563 PolarHBondContact OG-O 2.94Å; S560-N563 PolarHBondContact OG-OD1 3.27Å
564	C	82.2	Confident	86.3	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.041	36%	0.359	C	S	.	.			trans	-117.3	133.3	168.5	-68.4	0	0	0	0	109	C528 L532 N590 F593	C528-C564 HydrophobicContact CB-CB 3.78Å; C528-C564 WeakPolarHBondContact CB-SG 3.15Å; C528-C564 WeakPolarHBondContact SG-CA 3.17Å; C528-C564 WeakPolarHBondContact SG-CB 3.39Å; C528-C564 CovalentContact SG-SG 2.03Å; C528-C564 PolarHBondContact SG-SG 2.89Å; L532-C564 VanDerWaalsContact CD1-SG 3.59Å; C564-N590 HydrophobicContact CB-CB 3.71Å; C564-F593 HydrophobicContact CB-CD1 4.28Å; C564-F593 HydrophobicContact CB-CG 4.49Å
565	T	83.1	Confident	86.3	Confident	78 Å²	78	58.8 Å²	58.8	48%	0.479	35%	0.345	S	S	.	.			trans	-68	125	173.1	46.3	0	0	0	0	109.7	N590 A651	T565-N590 WeakPolarHBondContact O-CB 3.37Å; T565-N590 PolarHBondContact O-ND2 2.85Å; T565-A651 HydrophobicContact CG2-CB 4.42Å
566	P	87.1	Confident	86.6	Confident	9 Å²	9	52.5 Å²	52.5	6%	0.058	30%	0.301	C	S	.	.			trans	-64.9	150.1	173.1	29.1	-33.7	0	0	0	110.1	R589 F591 A651 A653	P566-R589 WeakPolarHBondContact CA-O 3.28Å; P566-F591 HydrophobicContact CB-CD1 4.02Å; P566-F591 HydrophobicContact CB-CE1 4.35Å; P566-A651 VanDerWaalsContact CD-CB 3.46Å; P566-A651 HydrophobicContact CG-CB 4.36Å; P566-A653 HydrophobicContact CB-CB 4.05Å; P566-A653 HydrophobicContact CG-CB 3.97Å; P566-A653 WeakPolarHBondContact O-CB 3.43Å
567	V	86.8	Confident	86.8	Confident	69 Å²	69	46.1 Å²	46.1	42%	0.418	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.4	173.6	-178.9	0	0	0	0	107.5	G588 R589 F591	V567-G588 CarbonylContact O-C 3.5Å; V567-G588 WeakPolarHBondContact O-CA 3.42Å; V567-R589 PolarHBondContact N-O 2.87Å; V567-R589 PolarHBondContact O-N 3.05Å; V567-F591 WeakPolarHBondContact O-CE1 3.37Å; V567-F591 WeakPolarHBondContact O-CZ 3.41Å
568	I	89	Confident	86.8	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.6	172	-55.5	161.6	0	0	0	107.2	V571 I586 C587 F591 V644 V646 A653 L655	I568-V571 HydrophobicContact CG2-CG2 4.19Å; I568-I586 HydrophobicContact CG1-CG2 4.24Å; I568-I586 HydrophobicContact CG2-CG2 3.73Å; I568-C587 WeakPolarHBondContact CG2-O 3.32Å; I568-F591 HydrophobicContact CG1-CE1 4.18Å; I568-F591 HydrophobicContact CG1-CZ 4.31Å; I568-V644 HydrophobicContact CD1-CG1 4.41Å; I568-V646 HydrophobicContact CD1-CB 4.11Å; I568-V646 HydrophobicContact CD1-CG2 3.79Å; I568-V646 HydrophobicContact CG1-CB 4.38Å; I568-V646 HydrophobicContact CG1-CG2 4.08Å; I568-A653 HydrophobicContact CD1-CB 3.85Å; I568-A653 HydrophobicContact CG1-CB 3.77Å; I568-L655 HydrophobicContact CB-CB 4.03Å; I568-L655 HydrophobicContact CB-CD2 4.26Å; I568-L655 HydrophobicContact CD1-CB 4.32Å; I568-L655 HydrophobicContact CG2-CB 3.96Å; I568-L655 HydrophobicContact CG2-CD2 3.62Å; I568-L655 HydrophobicContact CG2-CG 4.44Å
569	T	87.7	Confident	86.6	Confident	87 Å²	87	51.5 Å²	51.5	53%	0.534	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-30.6	179.9	53.9	0	0	0	0	113.3	C587 G588	T569-C587 PolarHBondContact N-O 2.81Å; T569-C587 PolarHBondContact OG1-O 3.48Å; T569-G588 PolarHBondContact OG1-N 3.34Å
570	K	88.6	Confident	85.7	Confident	90 Å²	90	48.9 Å²	48.9	39%	0.391	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	150.6	-175.9	-174.4	-177.5	-178.7	-173.1	0	110.3	Y22 C587	Y22-K570 PolarHBondContact O-NZ 2.85Å; K570-C587 HydrophobicContact CB-CB 3.93Å; K570-C587 PolarHBondContact N-O 3.27Å; K570-C587 PolarHBondContact O-N 2.65Å
571	V	90.3	Very high	85.6	Confident	18 Å²	18	51.8 Å²	51.8	11%	0.109	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.6	172.3	-179.5	0	0	0	0	108.4	I568 V584 T585 V644 L655 F658	I568-V571 HydrophobicContact CG2-CG2 4.19Å; V571-V584 HydrophobicContact CG1-CG1 3.54Å; V571-T585 WeakPolarHBondContact CA-O 3.44Å; V571-V644 HydrophobicContact CG1-CG2 4.27Å; V571-V644 HydrophobicContact CG2-CB 4.25Å; V571-V644 HydrophobicContact CG2-CG1 4.26Å; V571-V644 HydrophobicContact CG2-CG2 4.09Å; V571-L655 HydrophobicContact CG2-CD2 4.49Å; V571-F658 HydrophobicContact CG1-CB 4.27Å
572	F	89.3	Confident	85.7	Confident	55 Å²	55	49.6 Å²	49.6	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	139.3	176.7	-179.4	-89.2	0	0	0	111.4	Y22 T585	Y22-F572 AromaticContact CD1-CD1 3.53Å; Y22-F572 HydrophobicContact CD1-CD1 3.53Å; Y22-F572 HydrophobicContact CD1-CD2 4.02Å; Y22-F572 AromaticContact CD1-CE1 3.51Å; Y22-F572 HydrophobicContact CD1-CE1 3.51Å; Y22-F572 AromaticContact CD1-CE2 4Å; Y22-F572 HydrophobicContact CD1-CE2 4Å; Y22-F572 AromaticContact CD1-CG 3.8Å; Y22-F572 HydrophobicContact CD1-CG 3.8Å; Y22-F572 AromaticContact CD1-CZ 3.76Å; Y22-F572 HydrophobicContact CD1-CZ 3.76Å; Y22-F572 AromaticContact CD2-CD1 3.91Å; Y22-F572 HydrophobicContact CD2-CD1 3.91Å; Y22-F572 HydrophobicContact CD2-CE1 4.03Å; Y22-F572 AromaticContact CE1-CD1 3.84Å; Y22-F572 HydrophobicContact CE1-CD1 3.84Å; Y22-F572 HydrophobicContact CE1-CD2 4.4Å; Y22-F572 AromaticContact CE1-CE1 3.28Å; Y22-F572 HydrophobicContact CE1-CE1 3.28Å; Y22-F572 AromaticContact CE1-CE2 3.92Å; Y22-F572 HydrophobicContact CE1-CE2 3.92Å; Y22-F572 HydrophobicContact CE1-CG 4.38Å; Y22-F572 AromaticContact CE1-CZ 3.34Å; Y22-F572 HydrophobicContact CE1-CZ 3.34Å; Y22-F572 HydrophobicContact CE2-CD1 4.18Å; Y22-F572 AromaticContact CE2-CE1 3.82Å; Y22-F572 HydrophobicContact CE2-CE1 3.82Å; Y22-F572 AromaticContact CG-CD1 3.56Å; Y22-F572 HydrophobicContact CG-CD1 3.56Å; Y22-F572 AromaticContact CG-CE1 3.88Å; Y22-F572 HydrophobicContact CG-CE1 3.88Å; Y22-F572 HydrophobicContact CG-CG 4.02Å; Y22-F572 AromaticContact CZ-CE1 3.43Å; Y22-F572 VanDerWaalsContact CZ-CE1 3.43Å; Y22-F572 AromaticContact CZ-CZ 3.82Å; F572-T585 PolarHBondContact N-O 3.34Å; F572-T585 PolarHBondContact O-N 2.69Å
573	P	91.1	Very high	86.3	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.026	25%	0.25	C	S	.	.	S	Bend	cis	-66.6	166.6	-9.7	31.2	-36.9	0	0	0	111.3	S575 T582 F658 G691	P573-S575 WeakPolarHBondContact CB-O 3.46Å; P573-S575 VanDerWaalsContact CG-O 3.31Å; P573-S575 WeakPolarHBondContact CG-O 3.44Å; P573-S575 PolarHBondContact O-N 3.06Å; P573-T582 HydrophobicContact CG-CG2 3.63Å; P573-F658 HydrophobicContact CG-CE2 4.43Å; P573-F658 WeakPolarHBondContact O-CD2 3.32Å; P573-G691 WeakPolarHBondContact CB-O 3.42Å
574	S	89.3	Confident	86.9	Confident	82 Å²	82	41.4 Å²	41.4	57%	0.573	23%	0.228	S	C	*	.	S	Bend	trans	-74.6	-14.6	175.4	52.2	0	0	0	0	113.1	F658 K659	S574-F658 WeakPolarHBondContact O-CA 3.43Å; S574-K659 PolarHBondContact O-N 3.39Å; S574-K659 VanDerWaalsContact O-N 3.1Å
575	S	90.9	Very high	87.3	Confident	7 Å²	7	41.4 Å²	41.4	5%	0.049	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	161	172.5	63.1	0	0	0	0	113	P573 K659 T690 G691	P573-S575 WeakPolarHBondContact CB-O 3.46Å; P573-S575 VanDerWaalsContact CG-O 3.31Å; P573-S575 WeakPolarHBondContact CG-O 3.44Å; P573-S575 PolarHBondContact O-N 3.06Å; S575-K659 WeakPolarHBondContact CA-O 3.47Å; S575-K659 WeakPolarHBondContact CB-O 3.4Å; S575-T690 WeakPolarHBondContact CB-OG1 3.05Å; S575-T690 PolarHBondContact O-OG1 2.71Å; S575-T690 WeakPolarHBondContact OG-CB 3.44Å; S575-T690 PolarHBondContact OG-OG1 3.04Å; S575-G691 PolarHBondContact O-N 2.84Å
576	G	91.3	Very high	87.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	154.9	175.5	0	0	0	0	0	112.5	K659 F660 V661 T690	G576-K659 PolarHBondContact N-O 3.47Å; G576-K659 VanDerWaalsContact N-O 3.14Å; G576-F660 WeakPolarHBondContact O-CA 3.21Å; G576-F660 WeakPolarHBondContact O-CD1 3.49Å; G576-V661 PolarHBondContact O-N 2.77Å; G576-T690 WeakPolarHBondContact CA-OG1 3.42Å; G576-T690 PolarHBondContact N-OG1 3.11Å
577	P	89.6	Confident	87.6	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.019	20%	0.204	C	C	.	.			trans	-77.1	144.5	-179.9	27.2	-29.2	0	0	0	114	R579 G580 T582 V661 V734 V737	P577-R579 PolarHBondContact O-N 3.01Å; P577-G580 WeakPolarHBondContact O-CA 3.34Å; P577-G580 PolarHBondContact O-N 2.99Å; P577-T582 WeakPolarHBondContact CD-OG1 3.36Å; P577-V661 VanDerWaalsContact CA-O 3.24Å; P577-V661 WeakPolarHBondContact CA-O 3.46Å; P577-V734 HydrophobicContact CG-CB 4.4Å; P577-V734 HydrophobicContact CG-CG1 3.98Å; P577-V737 HydrophobicContact CB-CB 4.4Å; P577-V737 HydrophobicContact CB-CG2 4.05Å; P577-V737 HydrophobicContact CG-CB 4.34Å; P577-V737 HydrophobicContact CG-CG2 4.16Å
578	I	85.6	Confident	87.5	Confident	69 Å²	69	34.5 Å²	34.5	35%	0.354	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	131	176.5	-59.3	178.2	0	0	0	108.7	G580 F633 P639 F660	I578-G580 PolarHBondContact O-N 3.37Å; I578-G580 VanDerWaalsContact O-N 3.16Å; I578-F633 HydrophobicContact CG2-CD1 4.46Å; I578-F633 HydrophobicContact CG2-CE1 4.29Å; I578-P639 HydrophobicContact CD1-CG 3.89Å; I578-F660 HydrophobicContact CD1-CB 4.22Å; I578-F660 HydrophobicContact CG1-CB 3.7Å; I578-F660 HydrophobicContact CG1-CD1 4.09Å; I578-F660 HydrophobicContact CG1-CG 4.03Å
579	R	81.4	Confident	87.2	Confident	165 Å²	165	39 Å²	39	62%	0.623	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	10.6	-172.1	-59.4	165.9	-175.7	172.5	1.3	115.1	P577 S581 F633	P577-R579 PolarHBondContact O-N 3.01Å; R579-S581 PolarHBondContact O-N 2.56Å; R579-F633 HydrophobicContact CG-CD2 4.15Å; R579-F633 VanDerWaalsContact N-CE2 3.3Å
580	G	71.4	Confident	86.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-71.2	-7.1	177.3	0	0	0	0	0	115.9	P577 I578 T582 D735 S736	P577-G580 WeakPolarHBondContact O-CA 3.34Å; P577-G580 PolarHBondContact O-N 2.99Å; I578-G580 PolarHBondContact O-N 3.37Å; I578-G580 VanDerWaalsContact O-N 3.16Å; G580-T582 PolarHBondContact O-N 2.98Å; G580-D735 WeakPolarHBondContact O-CB 3.5Å; G580-S736 WeakPolarHBondContact O-CB 3.4Å; G580-S736 PolarHBondContact O-N 3.17Å; G580-S736 PolarHBondContact O-OG 2.92Å
581	S	83.3	Confident	86.4	Confident	83 Å²	83	31.3 Å²	31.3	58%	0.58	16%	0.163	S	C	*	.			trans	62.1	18.8	-172.4	-43.6	0	0	0	0	115	R579 A583 S736	R579-S581 PolarHBondContact O-N 2.56Å; S581-A583 PolarHBondContact O-N 3.37Å; S581-S736 WeakPolarHBondContact CB-OG 3.46Å; S581-S736 PolarHBondContact OG-OG 3.48Å; S581-S736 VanDerWaalsContact OG-OG 3.12Å
582	T	88.2	Confident	85.6	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.037	16%	0.158	C	C	.	.			trans	-51.4	122	176	-49.1	0	0	0	0	111.1	P573 P577 G580 P631 N692 D735	P573-T582 HydrophobicContact CG-CG2 3.63Å; P577-T582 WeakPolarHBondContact CD-OG1 3.36Å; G580-T582 PolarHBondContact O-N 2.98Å; T582-P631 WeakPolarHBondContact O-CD 3.07Å; T582-N692 WeakPolarHBondContact CA-OD1 3.2Å; T582-N692 WeakPolarHBondContact CG2-OD1 3.31Å; T582-D735 WeakPolarHBondContact CA-OD2 3.44Å; T582-D735 VanDerWaalsContact CB-OD2 3.31Å; T582-D735 WeakPolarHBondContact CB-OD2 3.43Å; T582-D735 WeakPolarHBondContact CG2-OD2 3.49Å; T582-D735 PolarHBondContact OG1-OD2 3.34Å
583	A	89.3	Confident	84.9	Confident	22 Å²	22	28.7 Å²	28.7	18%	0.182	15%	0.15	C	C	.	.			trans	-88	111	175.1	0	0	0	0	0	109.8	S581 Q628 C629 N692	S581-A583 PolarHBondContact O-N 3.37Å; A583-Q628 HydrophobicContact CB-CG 3.94Å; A583-C629 CarbonylContact C-O 3.59Å; A583-C629 WeakPolarHBondContact CA-O 3.48Å; A583-N692 PolarHBondContact N-OD1 2.95Å; A583-N692 PolarHBondContact O-ND2 2.96Å; A583-N692 PolarHBondContact O-OD1 3.36Å
584	V	90.1	Very high	83.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.8	179.9	-175.3	0	0	0	0	109.1	V571 I586 V608 Q628 C629 P631 F658	V571-V584 HydrophobicContact CG1-CG1 3.54Å; V584-I586 HydrophobicContact CG1-CG1 4.18Å; V584-V608 HydrophobicContact CG2-CG1 4.42Å; V584-Q628 WeakPolarHBondContact O-CA 3.46Å; V584-C629 PolarHBondContact N-O 3.02Å; V584-C629 PolarHBondContact O-N 2.83Å; V584-P631 HydrophobicContact CG2-CG 3.97Å; V584-F658 HydrophobicContact CG1-CD2 4.18Å; V584-F658 HydrophobicContact CG2-CD2 3.81Å; V584-F658 HydrophobicContact CG2-CE2 3.52Å; V584-F658 HydrophobicContact CG2-CZ 4.06Å
585	T	89.8	Confident	82.8	Confident	6 Å²	6	29.1 Å²	29.1	4%	0.037	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125	170.8	-63.5	0	0	0	0	109.1	V571 F572 E626 M627	V571-T585 WeakPolarHBondContact CA-O 3.44Å; F572-T585 PolarHBondContact N-O 3.34Å; F572-T585 PolarHBondContact O-N 2.69Å; T585-E626 HydrophobicContact CG2-CG 4.02Å; T585-M627 WeakPolarHBondContact CA-O 3.38Å
586	I	88.7	Confident	81.5	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	119.5	178.9	-56.3	175.6	0	0	0	107.9	I568 V584 F591 V606 M627 V644 V646	I568-I586 HydrophobicContact CG1-CG2 4.24Å; I568-I586 HydrophobicContact CG2-CG2 3.73Å; V584-I586 HydrophobicContact CG1-CG1 4.18Å; I586-F591 HydrophobicContact CG2-CZ 4.06Å; I586-V606 HydrophobicContact CD1-CG1 3.41Å; I586-V606 VanDerWaalsContact CD1-CG1 3.41Å; I586-M627 PolarHBondContact N-O 3.45Å; I586-M627 PolarHBondContact O-N 2.95Å; I586-V644 HydrophobicContact CD1-CG1 3.67Å; I586-V644 HydrophobicContact CG1-CG1 4.29Å; I586-V646 HydrophobicContact CD1-CG2 4.14Å; I586-V646 HydrophobicContact CG2-CG2 4.23Å
587	C	87.4	Confident	79.9	Confident	4 Å²	4	34.9 Å²	34.9	3%	0.027	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	147.7	177	-46.4	0	0	0	0	110.1	C23 I568 T569 K570 T625	C23-C587 WeakPolarHBondContact CA-SG 3.5Å; C23-C587 HydrophobicContact CB-CB 3.73Å; C23-C587 WeakPolarHBondContact CB-SG 3.38Å; C23-C587 WeakPolarHBondContact SG-CA 3.1Å; C23-C587 WeakPolarHBondContact SG-CB 3.31Å; C23-C587 CovalentContact SG-SG 2.03Å; C23-C587 PolarHBondContact SG-SG 2.69Å; I568-C587 WeakPolarHBondContact CG2-O 3.32Å; T569-C587 PolarHBondContact N-O 2.81Å; T569-C587 PolarHBondContact OG1-O 3.48Å; K570-C587 HydrophobicContact CB-CB 3.93Å; K570-C587 PolarHBondContact N-O 3.27Å; K570-C587 PolarHBondContact O-N 2.65Å; C587-T625 CarbonylContact C-O 3.22Å; C587-T625 WeakPolarHBondContact CA-O 3.22Å
588	G	85.1	Confident	78.6	Confident	6 Å²	6	39.6 Å²	39.6	6%	0.062	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-147.8	-179.1	0	0	0	0	0	113.8	V567 T569 T625	V567-G588 CarbonylContact O-C 3.5Å; V567-G588 WeakPolarHBondContact O-CA 3.42Å; T569-G588 PolarHBondContact OG1-N 3.34Å; G588-T625 PolarHBondContact N-O 3.32Å; G588-T625 VanDerWaalsContact O-CA 3.22Å; G588-T625 WeakPolarHBondContact O-CA 3.42Å; G588-T625 WeakPolarHBondContact O-CB 3.44Å
589	R	82.1	Confident	77.8	Confident	111 Å²	111	38.2 Å²	38.2	42%	0.419	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.8	178.2	-68.4	-174	175.2	128.8	-1.4	111.4	E28 P566 V567 F591 W624	E28-R589 IonicContact OE1-CZ 2.79Å; E28-R589 IonicContact OE1-NE 3.2Å; E28-R589 IonicContact OE1-NH2 3.78Å; E28-R589 PolarHBondContact OE1-NH2 3.35Å; E28-R589 IonicContact OE2-CZ 3.95Å; E28-R589 IonicContact OE2-NE 3.12Å; E28-R589 PolarHBondContact OE2-NE 2.85Å; E28-R589 IonicContact OE2-NH2 2.65Å; E28-R589 PolarHBondContact OE2-NH2 3.14Å; P566-R589 WeakPolarHBondContact CA-O 3.28Å; V567-R589 PolarHBondContact N-O 2.87Å; V567-R589 PolarHBondContact O-N 3.05Å; R589-F591 VanDerWaalsContact C-N 3.28Å; R589-F591 PolarHBondContact O-N 3.35Å; R589-W624 CarbonylContact C-O 3.58Å; R589-W624 VanDerWaalsContact C-O 3.31Å; R589-W624 WeakPolarHBondContact CA-O 3.43Å
590	N	78.8	Confident	77.3	Confident	16 Å²	16	33.6 Å²	33.6	9%	0.086	18%	0.175	C	C	.	.			trans	63.2	19.1	172.6	-49.6	-27.5	0	0	0	115.9	T529 C564 T565 G592 W624	T529-N590 WeakPolarHBondContact CG2-OD1 3.16Å; C564-N590 HydrophobicContact CB-CB 3.71Å; T565-N590 WeakPolarHBondContact O-CB 3.37Å; T565-N590 PolarHBondContact O-ND2 2.85Å; N590-G592 PolarHBondContact O-N 3.31Å; N590-W624 PolarHBondContact N-O 3.42Å; N590-W624 VanDerWaalsContact N-O 3.08Å
591	F	81.4	Confident	77.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	126.5	-179	-56.1	-45.3	0	0	0	112.5	P566 V567 I568 I586 R589 F593 F599 W624 M627 V646	P566-F591 HydrophobicContact CB-CD1 4.02Å; P566-F591 HydrophobicContact CB-CE1 4.35Å; V567-F591 WeakPolarHBondContact O-CE1 3.37Å; V567-F591 WeakPolarHBondContact O-CZ 3.41Å; I568-F591 HydrophobicContact CG1-CE1 4.18Å; I568-F591 HydrophobicContact CG1-CZ 4.31Å; I586-F591 HydrophobicContact CG2-CZ 4.06Å; R589-F591 VanDerWaalsContact C-N 3.28Å; R589-F591 PolarHBondContact O-N 3.35Å; F591-F593 PolarHBondContact O-N 2.99Å; F591-F599 WeakPolarHBondContact O-CD2 3.26Å; F591-F599 WeakPolarHBondContact O-CE2 3.27Å; F591-W624 PolarHBondContact N-O 2.99Å; F591-M627 HydrophobicContact CB-CE 3.97Å; F591-M627 HydrophobicContact CB-CG 4.3Å; F591-M627 HydrophobicContact CB-SD 3.71Å; F591-M627 HydrophobicContact CD1-CE 3.86Å; F591-M627 HydrophobicContact CD2-CE 3.77Å; F591-M627 HydrophobicContact CD2-CG 3.81Å; F591-M627 HydrophobicContact CD2-SD 4.08Å; F591-M627 HydrophobicContact CE1-CE 4.21Å; F591-M627 HydrophobicContact CE2-CE 4.12Å; F591-M627 HydrophobicContact CE2-CG 4.45Å; F591-M627 HydrophobicContact CG-CE 3.61Å; F591-M627 HydrophobicContact CG-CG 4.3Å; F591-M627 HydrophobicContact CG-SD 3.97Å; F591-M627 HydrophobicContact CZ-CE 4.32Å; F591-V646 HydrophobicContact CD1-CG1 3.89Å; F591-V646 HydrophobicContact CE1-CB 4.47Å; F591-V646 HydrophobicContact CE1-CG1 4.06Å; F591-V646 HydrophobicContact CE1-CG2 4.48Å
592	G	73.7	Confident	76.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	28.9	173.1	0	0	0	0	0	114.7	N590 S648	N590-G592 PolarHBondContact O-N 3.31Å; G592-S648 PolarHBondContact N-OG 2.89Å
593	F	74.4	Confident	76.3	Confident	17 Å²	17	41.5 Å²	41.5	8%	0.075	22%	0.22	C	C	.	.			trans	-64.1	141	177	173.7	-99.8	0	0	0	112.1	T529 L532 L533 C564 F591 W624	T529-F593 HydrophobicContact CG2-CB 4.49Å; T529-F593 HydrophobicContact CG2-CD2 3.8Å; T529-F593 HydrophobicContact CG2-CE2 4.46Å; T529-F593 HydrophobicContact CG2-CG 4.32Å; L532-F593 HydrophobicContact CB-CE1 3.91Å; L532-F593 HydrophobicContact CB-CE2 4.49Å; L532-F593 HydrophobicContact CB-CZ 3.55Å; L532-F593 HydrophobicContact CD1-CE1 3.76Å; L532-F593 HydrophobicContact CD1-CZ 4.29Å; L532-F593 HydrophobicContact CG-CE1 4.46Å; L533-F593 HydrophobicContact CD2-CE2 4.25Å; L533-F593 HydrophobicContact CG-CE2 4.27Å; C564-F593 HydrophobicContact CB-CD1 4.28Å; C564-F593 HydrophobicContact CB-CG 4.49Å; F591-F593 PolarHBondContact O-N 2.99Å; F593-W624 AromaticContact CD2-CH2 3.76Å; F593-W624 HydrophobicContact CD2-CH2 3.76Å; F593-W624 AromaticContact CD2-CZ2 3.92Å; F593-W624 HydrophobicContact CD2-CZ2 3.92Å; F593-W624 HydrophobicContact CD2-CZ3 4.18Å; F593-W624 AromaticContact CE2-CH2 3.99Å; F593-W624 HydrophobicContact CE2-CH2 3.99Å; F593-W624 HydrophobicContact CE2-CZ2 4.47Å; F593-W624 HydrophobicContact CE2-CZ3 4.48Å
594	D	70.6	Confident	76.1	Confident	25 Å²	25	41.1 Å²	41.1	13%	0.134	22%	0.215	C	C	.	.			trans	-155.2	151.4	176.1	172.5	66.4	0	0	0	110.6	T596 E597 K600 M603	D594-T596 PolarHBondContact O-N 3.27Å; D594-T596 VanDerWaalsContact OD2-CB 3.26Å; D594-T596 WeakPolarHBondContact OD2-CB 3.49Å; D594-T596 VanDerWaalsContact OD2-CG2 3.22Å; D594-T596 WeakPolarHBondContact OD2-CG2 2.94Å; D594-T596 PolarHBondContact OD2-N 2.97Å; D594-T596 PolarHBondContact OD2-OG1 3.39Å; D594-E597 PolarHBondContact O-N 2.86Å; D594-K600 HydrophobicContact CB-CD 4Å; D594-K600 HydrophobicContact CB-CG 4.44Å; D594-K600 IonicContact OD1-NZ 2.65Å; D594-K600 PolarHBondContact OD1-NZ 3.48Å; D594-K600 WeakPolarHBondContact OD2-CE 3.35Å; D594-K600 IonicContact OD2-NZ 2.69Å; D594-K600 PolarHBondContact OD2-NZ 2.86Å; D594-M603 HydrophobicContact CB-SD 4.41Å
595	K	65.5	Low	76.1	Confident	70 Å²	70	44.7 Å²	44.7	30%	0.304	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-0.6	-177.1	-77.5	-176.9	165.7	171.6	0	115.5	K536 Q561 D562	K536-K595 PolarHBondContact NZ-O 2.72Å; Q561-K595 WeakPolarHBondContact O-CE 3.41Å; Q561-K595 PolarHBondContact O-NZ 3.3Å; Q561-K595 VanDerWaalsContact O-NZ 3.1Å; D562-K595 IonicContact OD1-NZ 3.68Å; D562-K595 PolarHBondContact OD1-NZ 2.9Å
596	T	63.1	Low	76.1	Confident	70 Å²	70	44.5 Å²	44.5	43%	0.429	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	13.5	179.9	68.8	0	0	0	0	114.1	D594 N598	D594-T596 PolarHBondContact O-N 3.27Å; D594-T596 VanDerWaalsContact OD2-CB 3.26Å; D594-T596 WeakPolarHBondContact OD2-CB 3.49Å; D594-T596 VanDerWaalsContact OD2-CG2 3.22Å; D594-T596 WeakPolarHBondContact OD2-CG2 2.94Å; D594-T596 PolarHBondContact OD2-N 2.97Å; D594-T596 PolarHBondContact OD2-OG1 3.39Å; T596-N598 PolarHBondContact O-N 3.47Å; T596-N598 PolarHBondContact O-ND2 2.87Å
597	E	58.9	Low	76.2	Confident	59 Å²	59	46.8 Å²	46.8	28%	0.276	24%	0.244	S	C	.	.	S	Bend	trans	61	7.5	-175.8	-69	165	-140.2	0	0	114	S472 L533 D594	S472-E597 PolarHBondContact OG-OE2 2.91Å; L533-E597 HydrophobicContact CD2-CG 3.68Å; D594-E597 PolarHBondContact O-N 2.86Å
598	N	62.3	Low	76.3	Confident	102 Å²	102	46.6 Å²	46.6	55%	0.545	24%	0.243	S	C	.	.	S	Bend	trans	-117.9	134.9	-176.6	-74	-85.7	0	0	0	111.9	T596 K600	T596-N598 PolarHBondContact O-N 3.47Å; T596-N598 PolarHBondContact O-ND2 2.87Å; N598-K600 PolarHBondContact O-N 2.87Å
599	F	68.6	Low	76.5	Confident	39 Å²	39	46.3 Å²	46.3	17%	0.171	24%	0.24	C	C	.	.			trans	-68.3	115.8	171.4	175.4	-90.9	0	0	0	111.1	F591 T601 V604 R623 W624 M627	F591-F599 WeakPolarHBondContact O-CD2 3.26Å; F591-F599 WeakPolarHBondContact O-CE2 3.27Å; F599-T601 HydrophobicContact CE1-CG2 4.19Å; F599-T601 PolarHBondContact O-N 2.83Å; F599-V604 HydrophobicContact CE2-CG2 3.98Å; F599-V604 HydrophobicContact CZ-CB 4.48Å; F599-V604 HydrophobicContact CZ-CG2 3.88Å; F599-R623 HydrophobicContact CB-CB 4.32Å; F599-R623 HydrophobicContact CD1-CB 4.23Å; F599-R623 VanDerWaalsContact CD1-NH1 3.32Å; F599-R623 HydrophobicContact CD2-CB 3.69Å; F599-R623 HydrophobicContact CE1-CB 4.45Å; F599-R623 HydrophobicContact CE2-CB 3.92Å; F599-R623 HydrophobicContact CG-CB 3.82Å; F599-R623 HydrophobicContact CZ-CB 4.3Å; F599-W624 AromaticContact CD2-CD1 3.83Å; F599-M627 HydrophobicContact CE2-SD 4.26Å; F599-M627 HydrophobicContact CZ-SD 4.15Å
600	K	70.1	Confident	76.7	Confident	69 Å²	69	42.2 Å²	42.2	30%	0.3	23%	0.232	S	C	.	.			trans	-92.4	95.6	176.4	-76.5	176	176.2	161.1	0	110.7	D594 N598 S602 M603	D594-K600 HydrophobicContact CB-CD 4Å; D594-K600 HydrophobicContact CB-CG 4.44Å; D594-K600 IonicContact OD1-NZ 2.65Å; D594-K600 PolarHBondContact OD1-NZ 3.48Å; D594-K600 WeakPolarHBondContact OD2-CE 3.35Å; D594-K600 IonicContact OD2-NZ 2.69Å; D594-K600 PolarHBondContact OD2-NZ 2.86Å; N598-K600 PolarHBondContact O-N 2.87Å; K600-S602 PolarHBondContact O-N 2.81Å; K600-S602 VanDerWaalsContact O-N 3.08Å; K600-M603 HydrophobicContact CB-CB 4.35Å; K600-M603 HydrophobicContact CB-CG 3.97Å; K600-M603 HydrophobicContact CB-SD 3.75Å; K600-M603 HydrophobicContact CD-CE 3.71Å; K600-M603 HydrophobicContact CD-SD 3.64Å; K600-M603 HydrophobicContact CG-SD 4.32Å; K600-M603 WeakPolarHBondContact O-CB 3.36Å; K600-M603 PolarHBondContact O-N 2.84Å
601	T	71.8	Confident	77.1	Confident	63 Å²	63	41.6 Å²	41.6	39%	0.387	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-52.3	-32.6	176.7	-38.7	0	0	0	0	112.9	F599 M603 V604 L615 R623	F599-T601 HydrophobicContact CE1-CG2 4.19Å; F599-T601 PolarHBondContact O-N 2.83Å; T601-M603 PolarHBondContact O-N 2.04Å; T601-V604 PolarHBondContact O-N 2.8Å; T601-L615 HydrophobicContact CG2-CB 4.39Å; T601-L615 HydrophobicContact CG2-CD1 3.9Å; T601-R623 PolarHBondContact OG1-NH1 2.82Å; T601-R623 VanDerWaalsContact OG1-NH1 3.14Å
602	S	74.4	Confident	77.5	Confident	117 Å²	117	45.6 Å²	45.6	82%	0.818	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-67.5	-15.7	177.8	49.5	0	0	0	0	114.8	K600	K600-S602 PolarHBondContact O-N 2.81Å; K600-S602 VanDerWaalsContact O-N 3.08Å
603	M	77	Confident	78.2	Confident	75 Å²	75	45.9 Å²	45.9	37%	0.369	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-90.3	-6.9	175.2	-68.3	175.1	161.6	0	0	112.8	D594 K600 T601 S648 G649	D594-M603 HydrophobicContact CB-SD 4.41Å; K600-M603 HydrophobicContact CB-CB 4.35Å; K600-M603 HydrophobicContact CB-CG 3.97Å; K600-M603 HydrophobicContact CB-SD 3.75Å; K600-M603 HydrophobicContact CD-CE 3.71Å; K600-M603 HydrophobicContact CD-SD 3.64Å; K600-M603 HydrophobicContact CG-SD 4.32Å; K600-M603 WeakPolarHBondContact O-CB 3.36Å; K600-M603 PolarHBondContact O-N 2.84Å; T601-M603 PolarHBondContact O-N 2.04Å; M603-S648 CarbonylContact O-C 3.54Å; M603-S648 WeakPolarHBondContact O-CA 3.44Å; M603-G649 PolarHBondContact O-N 3.31Å
604	V	84.9	Confident	78.8	Confident	13 Å²	13	51.6 Å²	51.6	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.6	-175.1	-172.6	0	0	0	0	110.8	F599 T601 V606 L615 M627 V646 T647	F599-V604 HydrophobicContact CE2-CG2 3.98Å; F599-V604 HydrophobicContact CZ-CB 4.48Å; F599-V604 HydrophobicContact CZ-CG2 3.88Å; T601-V604 PolarHBondContact O-N 2.8Å; V604-V606 HydrophobicContact CG1-CG2 4.01Å; V604-L615 HydrophobicContact CB-CD1 3.99Å; V604-L615 HydrophobicContact CG1-CD1 3.97Å; V604-M627 HydrophobicContact CG1-CE 4.07Å; V604-M627 HydrophobicContact CG1-SD 3.89Å; V604-V646 HydrophobicContact CG1-CG1 4.26Å; V604-T647 VanDerWaalsContact CA-O 3.29Å; V604-T647 WeakPolarHBondContact CA-O 3.41Å
605	N	88.7	Confident	79.5	Confident	76 Å²	76	52.5 Å²	52.5	41%	0.406	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.7	165.6	-167.5	26.5	0	0	0	110.7	Q612 T647	N605-Q612 PolarHBondContact ND2-OE1 3.48Å; N605-Q612 PolarHBondContact OD1-OE1 3.44Å; N605-T647 PolarHBondContact N-O 3.19Å; N605-T647 PolarHBondContact O-N 2.83Å
606	V	90.5	Very high	80	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132	-174.7	-175.7	0	0	0	0	110.2	I586 V604 V608 C613 L615 M627 V646	I586-V606 HydrophobicContact CD1-CG1 3.41Å; I586-V606 VanDerWaalsContact CD1-CG1 3.41Å; V604-V606 HydrophobicContact CG1-CG2 4.01Å; V606-V608 HydrophobicContact CG1-CG2 4.24Å; V606-C613 HydrophobicContact CB-CB 4.09Å; V606-C613 HydrophobicContact CG1-CB 3.9Å; V606-C613 WeakPolarHBondContact O-CB 3.05Å; V606-C613 PolarHBondContact O-N 3.26Å; V606-L615 HydrophobicContact CG2-CD2 4Å; V606-L615 HydrophobicContact CG2-CG 4.3Å; V606-M627 HydrophobicContact CG2-CE 4.17Å; V606-V646 HydrophobicContact CG1-CG2 4.34Å; V606-V646 HydrophobicContact CG2-CG2 4.32Å
607	E	91	Very high	80.1	Confident	49 Å²	49	60 Å²	60	23%	0.229	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.5	-176.5	-176.6	-177.6	152.6	0	0	108.9	A611 V644 K645	E607-A611 WeakPolarHBondContact CA-O 3.42Å; E607-V644 WeakPolarHBondContact O-CA 3.38Å; E607-K645 HydrophobicContact CB-CB 4.28Å; E607-K645 PolarHBondContact N-O 3.16Å; E607-K645 PolarHBondContact O-N 3.37Å; E607-K645 IonicContact OE1-NZ 3.94Å; E607-K645 WeakPolarHBondContact OE2-CE 3.29Å; E607-K645 IonicContact OE2-NZ 2.68Å; E607-K645 PolarHBondContact OE2-NZ 2.84Å
608	V	90.4	Very high	80	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	110.4	-170.3	175	0	0	0	0	109.1	V584 V606 G610 A611 C613 V644 F658	V584-V608 HydrophobicContact CG2-CG1 4.42Å; V606-V608 HydrophobicContact CG1-CG2 4.24Å; V608-G610 PolarHBondContact O-N 2.91Å; V608-G610 VanDerWaalsContact O-N 3.12Å; V608-A611 PolarHBondContact N-O 3.44Å; V608-A611 WeakPolarHBondContact O-CB 3.15Å; V608-A611 PolarHBondContact O-N 3.44Å; V608-C613 HydrophobicContact CG2-CB 3.97Å; V608-V644 HydrophobicContact CG1-CG2 4.28Å; V608-V644 HydrophobicContact CG2-CG1 4.29Å; V608-V644 HydrophobicContact CG2-CG2 4.37Å; V608-F658 HydrophobicContact CG1-CB 3.9Å; V608-F658 HydrophobicContact CG1-CD1 3.32Å; V608-F658 HydrophobicContact CG1-CD2 4.35Å; V608-F658 HydrophobicContact CG1-CE1 3.94Å; V608-F658 HydrophobicContact CG1-CG 3.57Å
609	A	88.2	Confident	79.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	37.7	-177.9	0	0	0	0	0	113.5	S640 G641 L643 F658 F660	A609-S640 CarbonylContact C-O 3.54Å; A609-S640 PolarHBondContact O-N 3.49Å; A609-S640 PolarHBondContact O-OG 2.78Å; A609-G641 WeakPolarHBondContact CB-O 3.4Å; A609-L643 PolarHBondContact N-O 3.42Å; A609-F658 HydrophobicContact CB-CD1 4.41Å; A609-F660 HydrophobicContact CB-CD2 3.98Å; A609-F660 HydrophobicContact CB-CE2 3.91Å
610	G	85.9	Confident	78.8	Confident	26 Å²	26	66.4 Å²	66.4	27%	0.268	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	-14.1	-177	0	0	0	0	0	115.9	V608 S640	V608-G610 PolarHBondContact O-N 2.91Å; V608-G610 VanDerWaalsContact O-N 3.12Å; G610-S640 WeakPolarHBondContact CA-OG 3.45Å; G610-S640 PolarHBondContact N-OG 3.38Å
611	A	88.1	Confident	77.9	Confident	2 Å²	2	68.2 Å²	68.2	2%	0.017	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.4	178.1	0	0	0	0	0	111.6	E607 V608 C613 P631 F633 F637 F660	E607-A611 WeakPolarHBondContact CA-O 3.42Å; V608-A611 PolarHBondContact N-O 3.44Å; V608-A611 WeakPolarHBondContact O-CB 3.15Å; V608-A611 PolarHBondContact O-N 3.44Å; A611-C613 PolarHBondContact O-N 2.58Å; A611-P631 HydrophobicContact CB-CB 4.03Å; A611-F633 HydrophobicContact CB-CE1 4.43Å; A611-F637 HydrophobicContact CB-CE1 4.4Å; A611-F637 HydrophobicContact CB-CE2 4.03Å; A611-F637 HydrophobicContact CB-CZ 3.77Å; A611-F660 HydrophobicContact CB-CE2 4.19Å; A611-F660 HydrophobicContact CB-CZ 4.22Å
612	Q	89.3	Confident	77.1	Confident	85 Å²	85	68.1 Å²	68.1	40%	0.397	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	125.4	171.8	-66.3	-63.8	-63.2	0	0	109.7	N605 S632	N605-Q612 PolarHBondContact ND2-OE1 3.48Å; N605-Q612 PolarHBondContact OD1-OE1 3.44Å; Q612-S632 PolarHBondContact O-N 3.11Å; Q612-S632 PolarHBondContact O-OG 3.14Å
613	C	88.9	Confident	76.6	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.041	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.5	-168.6	-154.3	0	0	0	0	111.6	V606 V608 A611 L615 C629 S630 P631	V606-C613 HydrophobicContact CB-CB 4.09Å; V606-C613 HydrophobicContact CG1-CB 3.9Å; V606-C613 WeakPolarHBondContact O-CB 3.05Å; V606-C613 PolarHBondContact O-N 3.26Å; V608-C613 HydrophobicContact CG2-CB 3.97Å; A611-C613 PolarHBondContact O-N 2.58Å; C613-L615 PolarHBondContact O-N 2.85Å; C613-C629 HydrophobicContact CB-CB 3.82Å; C613-C629 WeakPolarHBondContact CB-SG 3.43Å; C613-C629 WeakPolarHBondContact SG-CB 3.14Å; C613-C629 CovalentContact SG-SG 2.03Å; C613-C629 PolarHBondContact SG-SG 3.47Å; C613-S630 CarbonylContact C-O 3.59Å; C613-S630 WeakPolarHBondContact CA-O 2.98Å; C613-S630 PolarHBondContact SG-N 3.39Å; C613-P631 VanDerWaalsContact SG-N 3.44Å
614	K	87.4	Confident	76.1	Confident	137 Å²	137	63.6 Å²	63.6	60%	0.596	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.4	-176.4	-66.8	-179.2	-179.6	177.4	0	110.4	C629 S630 S632	K614-C629 CarbonylContact O-C 3.52Å; K614-C629 VanDerWaalsContact O-CA 3.3Å; K614-C629 WeakPolarHBondContact O-CA 3.44Å; K614-S630 PolarHBondContact N-O 3.22Å; K614-S630 PolarHBondContact O-N 3.38Å; K614-S630 PolarHBondContact O-OG 3.12Å; K614-S632 WeakPolarHBondContact CE-OG 3.02Å
615	L	85.1	Confident	75.6	Confident	44 Å²	44	64.5 Å²	64.5	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136	177.7	-73.1	167	0	0	0	112	T601 V604 V606 C613 M627 C629	T601-L615 HydrophobicContact CG2-CB 4.39Å; T601-L615 HydrophobicContact CG2-CD1 3.9Å; V604-L615 HydrophobicContact CB-CD1 3.99Å; V604-L615 HydrophobicContact CG1-CD1 3.97Å; V606-L615 HydrophobicContact CG2-CD2 4Å; V606-L615 HydrophobicContact CG2-CG 4.3Å; C613-L615 PolarHBondContact O-N 2.85Å; L615-M627 HydrophobicContact CD2-CB 4.14Å; L615-M627 HydrophobicContact CD2-SD 4.06Å; L615-C629 HydrophobicContact CD2-CB 4.16Å
616	A	74.5	Confident	75.3	Confident	38 Å²	38	62.3 Å²	62.3	31%	0.314	31%	0.309	S	S	.	.			trans	-73.2	147.8	178.7	0	0	0	0	0	112.4	Q618 Q628	A616-Q618 VanDerWaalsContact C-N 3.28Å; A616-Q618 PolarHBondContact O-N 3.22Å; A616-Q628 HydrophobicContact CB-CB 4.35Å; A616-Q628 WeakPolarHBondContact CB-O 3.43Å; A616-Q628 PolarHBondContact N-O 2.83Å
617	R	65.1	Low	74.9	Confident	258 Å²	258	62.5 Å²	62.5	97%	0.974	31%	0.31	S	S	*	.			trans	-79.5	76	170.8	-70.1	-173.4	177.5	-171.3	-0.1	110.3
618	Q	57.8	Low	74.7	Confident	70 Å²	70	63 Å²	63	33%	0.327	31%	0.312	S	S	.	.			trans	-102	148.4	-174.2	-157.1	174.4	16	0	0	112	A616 R623	A616-Q618 VanDerWaalsContact C-N 3.28Å; A616-Q618 PolarHBondContact O-N 3.22Å; Q618-R623 PolarHBondContact O-NE 3.21Å; Q618-R623 VanDerWaalsContact O-NE 3.16Å; Q618-R623 PolarHBondContact O-NH2 3.44Å
619	D	52.1	Low	74.6	Confident	146 Å²	146	63 Å²	63	78%	0.781	31%	0.313	S	S	*	.			trans	-62.3	146.8	-176.3	-93.8	-46.9	0	0	0	114	V621	D619-V621 PolarHBondContact O-N 2.97Å
620	N	52.7	Low	74.7	Confident	119 Å²	119	65.5 Å²	65.5	64%	0.636	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	13.9	-156.4	-73.1	-8.7	0	0	0	118.1
621	V	51.8	Low	74.8	Confident	108 Å²	108	64.9 Å²	64.9	66%	0.655	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-41.9	-163.7	-168.9	0	0	0	0	114.5	D619	D619-V621 PolarHBondContact O-N 2.97Å
622	N	55.6	Low	74.6	Confident	60 Å²	60	66.5 Å²	66.5	32%	0.321	33%	0.333	S	S	.	.	S	Bend	trans	-125.9	13.3	-167.2	-82.5	17.7	0	0	0	115.8	W624 T625 E626	N622-W624 PolarHBondContact O-N 2.65Å; N622-T625 PolarHBondContact O-N 2.79Å; N622-T625 PolarHBondContact O-OG1 3.17Å; N622-E626 PolarHBondContact O-N 3.42Å; N622-E626 VanDerWaalsContact O-N 3.07Å
623	R	62.5	Low	74.3	Confident	41 Å²	41	65 Å²	65	16%	0.155	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.5	-168.5	-67	-165	-172.2	-178.2	6.9	116.6	F599 T601 Q618 E626	F599-R623 HydrophobicContact CB-CB 4.32Å; F599-R623 HydrophobicContact CD1-CB 4.23Å; F599-R623 VanDerWaalsContact CD1-NH1 3.32Å; F599-R623 HydrophobicContact CD2-CB 3.69Å; F599-R623 HydrophobicContact CE1-CB 4.45Å; F599-R623 HydrophobicContact CE2-CB 3.92Å; F599-R623 HydrophobicContact CG-CB 3.82Å; F599-R623 HydrophobicContact CZ-CB 4.3Å; T601-R623 PolarHBondContact OG1-NH1 2.82Å; T601-R623 VanDerWaalsContact OG1-NH1 3.14Å; Q618-R623 PolarHBondContact O-NE 3.21Å; Q618-R623 VanDerWaalsContact O-NE 3.16Å; Q618-R623 PolarHBondContact O-NH2 3.44Å; R623-E626 WeakPolarHBondContact CA-O 3.28Å
624	W	67.7	Low	73.4	Confident	56 Å²	56	69.6 Å²	69.6	21%	0.212	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.7	176.5	-67.8	-1.8	0	0	0	113.8	T529 L533 R589 N590 F591 F593 F599 N622	T529-W624 HydrophobicContact CG2-CD2 4.34Å; T529-W624 HydrophobicContact CG2-CE3 3.67Å; T529-W624 HydrophobicContact CG2-CZ3 3.92Å; L533-W624 HydrophobicContact CD1-CH2 3.97Å; L533-W624 HydrophobicContact CD1-CZ3 3.97Å; L533-W624 HydrophobicContact CD2-CH2 4.41Å; L533-W624 HydrophobicContact CG-CH2 4.44Å; R589-W624 CarbonylContact C-O 3.58Å; R589-W624 VanDerWaalsContact C-O 3.31Å; R589-W624 WeakPolarHBondContact CA-O 3.43Å; N590-W624 PolarHBondContact N-O 3.42Å; N590-W624 VanDerWaalsContact N-O 3.08Å; F591-W624 PolarHBondContact N-O 2.99Å; F593-W624 AromaticContact CD2-CH2 3.76Å; F593-W624 HydrophobicContact CD2-CH2 3.76Å; F593-W624 AromaticContact CD2-CZ2 3.92Å; F593-W624 HydrophobicContact CD2-CZ2 3.92Å; F593-W624 HydrophobicContact CD2-CZ3 4.18Å; F593-W624 AromaticContact CE2-CH2 3.99Å; F593-W624 HydrophobicContact CE2-CH2 3.99Å; F593-W624 HydrophobicContact CE2-CZ2 4.47Å; F593-W624 HydrophobicContact CE2-CZ3 4.48Å; F599-W624 AromaticContact CD2-CD1 3.83Å; N622-W624 PolarHBondContact O-N 2.65Å
625	T	74.4	Confident	72.8	Confident	32 Å²	32	65.9 Å²	65.9	20%	0.196	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127	-20.8	-177.1	56.9	0	0	0	0	114	C587 G588 N622	C587-T625 CarbonylContact C-O 3.22Å; C587-T625 WeakPolarHBondContact CA-O 3.22Å; G588-T625 PolarHBondContact N-O 3.32Å; G588-T625 VanDerWaalsContact O-CA 3.22Å; G588-T625 WeakPolarHBondContact O-CA 3.42Å; G588-T625 WeakPolarHBondContact O-CB 3.44Å; N622-T625 PolarHBondContact O-N 2.79Å; N622-T625 PolarHBondContact O-OG1 3.17Å
626	E	81.9	Confident	72.3	Confident	30 Å²	30	71.4 Å²	71.4	14%	0.14	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	128.2	176.8	176.9	169	-155.7	0	0	110.1	C23 T585 N622 R623	C23-E626 HydrophobicContact CB-CB 4.33Å; C23-E626 HydrophobicContact CB-CG 4.34Å; T585-E626 HydrophobicContact CG2-CG 4.02Å; N622-E626 PolarHBondContact O-N 3.42Å; N622-E626 VanDerWaalsContact O-N 3.07Å; R623-E626 WeakPolarHBondContact CA-O 3.28Å
627	M	82.7	Confident	72.4	Confident	6 Å²	6	71.9 Å²	71.9	3%	0.03	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132.6	175	-64	-167.6	-59.8	0	0	110.8	T585 I586 F591 F599 V604 V606 L615 V646	T585-M627 WeakPolarHBondContact CA-O 3.38Å; I586-M627 PolarHBondContact N-O 3.45Å; I586-M627 PolarHBondContact O-N 2.95Å; F591-M627 HydrophobicContact CB-CE 3.97Å; F591-M627 HydrophobicContact CB-CG 4.3Å; F591-M627 HydrophobicContact CB-SD 3.71Å; F591-M627 HydrophobicContact CD1-CE 3.86Å; F591-M627 HydrophobicContact CD2-CE 3.77Å; F591-M627 HydrophobicContact CD2-CG 3.81Å; F591-M627 HydrophobicContact CD2-SD 4.08Å; F591-M627 HydrophobicContact CE1-CE 4.21Å; F591-M627 HydrophobicContact CE2-CE 4.12Å; F591-M627 HydrophobicContact CE2-CG 4.45Å; F591-M627 HydrophobicContact CG-CE 3.61Å; F591-M627 HydrophobicContact CG-CG 4.3Å; F591-M627 HydrophobicContact CG-SD 3.97Å; F591-M627 HydrophobicContact CZ-CE 4.32Å; F599-M627 HydrophobicContact CE2-SD 4.26Å; F599-M627 HydrophobicContact CZ-SD 4.15Å; V604-M627 HydrophobicContact CG1-CE 4.07Å; V604-M627 HydrophobicContact CG1-SD 3.89Å; V606-M627 HydrophobicContact CG2-CE 4.17Å; L615-M627 HydrophobicContact CD2-CB 4.14Å; L615-M627 HydrophobicContact CD2-SD 4.06Å; M627-V646 HydrophobicContact CE-CG1 3.8Å; M627-V646 HydrophobicContact CE-CG2 4.11Å
628	Q	86.9	Confident	73	Confident	58 Å²	58	65.1 Å²	65.1	27%	0.271	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.7	170.9	-165.5	174.8	44.9	0	0	110.7	A583 V584 A616	A583-Q628 HydrophobicContact CB-CG 3.94Å; V584-Q628 WeakPolarHBondContact O-CA 3.46Å; A616-Q628 HydrophobicContact CB-CB 4.35Å; A616-Q628 WeakPolarHBondContact CB-O 3.43Å; A616-Q628 PolarHBondContact N-O 2.83Å
629	C	88	Confident	74	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	156.6	176.6	77.6	0	0	0	0	111.9	A583 V584 C613 K614 L615	A583-C629 CarbonylContact C-O 3.59Å; A583-C629 WeakPolarHBondContact CA-O 3.48Å; V584-C629 PolarHBondContact N-O 3.02Å; V584-C629 PolarHBondContact O-N 2.83Å; C613-C629 HydrophobicContact CB-CB 3.82Å; C613-C629 WeakPolarHBondContact CB-SG 3.43Å; C613-C629 WeakPolarHBondContact SG-CB 3.14Å; C613-C629 CovalentContact SG-SG 2.03Å; C613-C629 PolarHBondContact SG-SG 3.47Å; K614-C629 CarbonylContact O-C 3.52Å; K614-C629 VanDerWaalsContact O-CA 3.3Å; K614-C629 WeakPolarHBondContact O-CA 3.44Å; L615-C629 HydrophobicContact CD2-CB 4.16Å
630	S	89.2	Confident	74.9	Confident	52 Å²	52	61.1 Å²	61.1	36%	0.364	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.2	176.3	49.1	0	0	0	0	110.1	C613 K614 S632	C613-S630 CarbonylContact C-O 3.59Å; C613-S630 WeakPolarHBondContact CA-O 2.98Å; C613-S630 PolarHBondContact SG-N 3.39Å; K614-S630 PolarHBondContact N-O 3.22Å; K614-S630 PolarHBondContact O-N 3.38Å; K614-S630 PolarHBondContact O-OG 3.12Å; S630-S632 PolarHBondContact O-N 2.65Å
631	P	89.1	Confident	76.2	Confident	13 Å²	13	57.8 Å²	57.8	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	129.7	177.1	-24.8	35.5	0	0	0	110.8	T582 V584 A611 C613 F633 F660	T582-P631 WeakPolarHBondContact O-CD 3.07Å; V584-P631 HydrophobicContact CG2-CG 3.97Å; A611-P631 HydrophobicContact CB-CB 4.03Å; C613-P631 VanDerWaalsContact SG-N 3.44Å; P631-F633 HydrophobicContact CB-CE2 4.5Å; P631-F633 HydrophobicContact CB-CZ 4.06Å; P631-F660 HydrophobicContact CB-CE1 4.35Å; P631-F660 HydrophobicContact CB-CZ 3.83Å; P631-F660 HydrophobicContact CG-CE1 4.45Å; P631-F660 HydrophobicContact CG-CZ 4.12Å
632	S	84.3	Confident	78	Confident	36 Å²	36	57 Å²	57	25%	0.252	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.5	179.4	64.8	0	0	0	0	111	Q612 K614 S630	Q612-S632 PolarHBondContact O-N 3.11Å; Q612-S632 PolarHBondContact O-OG 3.14Å; K614-S632 WeakPolarHBondContact CE-OG 3.02Å; S630-S632 PolarHBondContact O-N 2.65Å
633	F	82.2	Confident	79.6	Confident	53 Å²	53	57.3 Å²	57.3	23%	0.232	34%	0.344	C	S	.	.			trans	-103.5	145	-175.3	-48.6	-81.1	0	0	0	110.1	I578 R579 A611 P631 F637 F660	I578-F633 HydrophobicContact CG2-CD1 4.46Å; I578-F633 HydrophobicContact CG2-CE1 4.29Å; R579-F633 HydrophobicContact CG-CD2 4.15Å; R579-F633 VanDerWaalsContact N-CE2 3.3Å; A611-F633 HydrophobicContact CB-CE1 4.43Å; P631-F633 HydrophobicContact CB-CE2 4.5Å; P631-F633 HydrophobicContact CB-CZ 4.06Å; F633-F637 HydrophobicContact CB-CB 4.46Å; F633-F637 HydrophobicContact CD1-CB 4.31Å; F633-F637 AromaticContact CD1-CD1 3.58Å; F633-F637 HydrophobicContact CD1-CD1 3.58Å; F633-F637 HydrophobicContact CD1-CE1 4.03Å; F633-F637 AromaticContact CD1-CG 3.94Å; F633-F637 HydrophobicContact CD1-CG 3.94Å; F633-F637 AromaticContact CE1-CD1 3.97Å; F633-F637 HydrophobicContact CE1-CD1 3.97Å; F633-F637 HydrophobicContact CE1-CE1 4.03Å; F633-F660 HydrophobicContact CE1-CD1 4.34Å; F633-F660 AromaticContact CE1-CE1 3.73Å; F633-F660 HydrophobicContact CE1-CE1 3.73Å; F633-F660 HydrophobicContact CE1-CE2 4.18Å; F633-F660 AromaticContact CE1-CZ 3.63Å; F633-F660 HydrophobicContact CE1-CZ 3.63Å; F633-F660 HydrophobicContact CZ-CD1 4.27Å; F633-F660 AromaticContact CZ-CE1 3.52Å; F633-F660 HydrophobicContact CZ-CE1 3.52Å; F633-F660 AromaticContact CZ-CZ 3.79Å; F633-F660 HydrophobicContact CZ-CZ 3.79Å
634	S	71.1	Confident	81	Confident	103 Å²	103	55.3 Å²	55.3	72%	0.72	34%	0.336	S	S	*	.			trans	-138.3	141.1	170.6	63.8	0	0	0	0	109.8
635	G	73.9	Confident	82.2	Confident	59 Å²	59	55.6 Å²	55.6	61%	0.608	34%	0.339	S	S	*	.	S	Bend	trans	55.9	-147.1	-176	0	0	0	0	0	114.6	F637	G635-F637 VanDerWaalsContact C-N 3.31Å; G635-F637 PolarHBondContact O-N 3.4Å; G635-F637 VanDerWaalsContact O-N 3.15Å
636	N	73.7	Confident	82.9	Confident	159 Å²	159	54 Å²	54	85%	0.85	33%	0.329	S	S	*	.	S	Bend	trans	-84.7	72.6	173.5	-72.4	-8.4	0	0	0	110.1	T638	N636-T638 PolarHBondContact O-N 2.78Å
637	F	76.9	Confident	83.2	Confident	48 Å²	48	54.2 Å²	54.2	21%	0.211	33%	0.332	C	S	.	.			trans	-64.1	128.4	176	176.5	-98.3	0	0	0	111.8	A611 F633 G635 P639 F660	A611-F637 HydrophobicContact CB-CE1 4.4Å; A611-F637 HydrophobicContact CB-CE2 4.03Å; A611-F637 HydrophobicContact CB-CZ 3.77Å; F633-F637 HydrophobicContact CB-CB 4.46Å; F633-F637 HydrophobicContact CD1-CB 4.31Å; F633-F637 AromaticContact CD1-CD1 3.58Å; F633-F637 HydrophobicContact CD1-CD1 3.58Å; F633-F637 HydrophobicContact CD1-CE1 4.03Å; F633-F637 AromaticContact CD1-CG 3.94Å; F633-F637 HydrophobicContact CD1-CG 3.94Å; F633-F637 AromaticContact CE1-CD1 3.97Å; F633-F637 HydrophobicContact CE1-CD1 3.97Å; F633-F637 HydrophobicContact CE1-CE1 4.03Å; G635-F637 VanDerWaalsContact C-N 3.31Å; G635-F637 PolarHBondContact O-N 3.4Å; G635-F637 VanDerWaalsContact O-N 3.15Å; F637-P639 HydrophobicContact CE1-CB 4.39Å; F637-P639 HydrophobicContact CE1-CG 4.1Å; F637-F660 HydrophobicContact CE1-CD2 4.04Å; F637-F660 AromaticContact CE1-CE2 3.95Å; F637-F660 HydrophobicContact CE1-CE2 3.95Å; F637-F660 HydrophobicContact CZ-CE2 4.24Å
638	T	78.1	Confident	83.3	Confident	117 Å²	117	54.5 Å²	54.5	72%	0.718	34%	0.335	S	S	*	.			trans	-109	129	168.8	38.8	0	0	0	0	109.5	N636	N636-T638 PolarHBondContact O-N 2.78Å
639	P	78.1	Confident	83	Confident	59 Å²	59	53.7 Å²	53.7	38%	0.383	34%	0.343	S	S	.	.			trans	-59.8	136.1	176.7	-27	36.3	0	0	0	113.2	I578 F637 F660	I578-P639 HydrophobicContact CD1-CG 3.89Å; F637-P639 HydrophobicContact CE1-CB 4.39Å; F637-P639 HydrophobicContact CE1-CG 4.1Å; P639-F660 HydrophobicContact CB-CB 4.24Å; P639-F660 HydrophobicContact CB-CD2 4.03Å; P639-F660 HydrophobicContact CG-CB 3.77Å; P639-F660 HydrophobicContact CG-CD2 4.05Å; P639-F660 HydrophobicContact CG-CG 4.27Å
640	S	71.9	Confident	82.5	Confident	73 Å²	73	62.7 Å²	62.7	51%	0.51	38%	0.384	S	S	.	.			trans	-112.6	90.7	175.3	70.9	0	0	0	0	111.6	A609 G610	A609-S640 CarbonylContact C-O 3.54Å; A609-S640 PolarHBondContact O-N 3.49Å; A609-S640 PolarHBondContact O-OG 2.78Å; G610-S640 WeakPolarHBondContact CA-OG 3.45Å; G610-S640 PolarHBondContact N-OG 3.38Å
641	G	80.9	Confident	82.2	Confident	48 Å²	48	61.2 Å²	61.2	50%	0.495	38%	0.375	S	S	.	.			trans	68.3	-155.4	173.3	0	0	0	0	0	115	A609	A609-G641 WeakPolarHBondContact CB-O 3.4Å
642	H	88.9	Confident	82.1	Confident	93 Å²	93	64.1 Å²	64.1	43%	0.431	39%	0.393	S	S	.	.	S	Bend	trans	-110.6	3.9	-172.1	-64.8	94.5	0	0	0	114.1	E656 G657 F658	H642-E656 HydrophobicContact CB-CB 4.19Å; H642-E656 HydrophobicContact CB-CG 4.46Å; H642-E656 WeakPolarHBondContact O-CA 3.48Å; H642-G657 PolarHBondContact O-N 3.44Å; H642-F658 CarbonylContact C-O 3.54Å; H642-F658 VanDerWaalsContact CA-O 3.3Å; H642-F658 WeakPolarHBondContact CA-O 3.16Å; H642-F658 PolarHBondContact O-N 3.35Å
643	L	89.6	Confident	82.4	Confident	65 Å²	65	62.8 Å²	62.8	34%	0.34	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.6	-162	-169.4	68.2	0	0	0	112.8	A609 K654 E656	A609-L643 PolarHBondContact N-O 3.42Å; L643-K654 HydrophobicContact CD1-CB 4.19Å; L643-E656 HydrophobicContact CD1-CG 4.08Å
644	V	91.8	Very high	82.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130	166	179.1	0	0	0	0	108.9	I568 V571 I586 E607 V608 K654 L655 F658	I568-V644 HydrophobicContact CD1-CG1 4.41Å; V571-V644 HydrophobicContact CG1-CG2 4.27Å; V571-V644 HydrophobicContact CG2-CB 4.25Å; V571-V644 HydrophobicContact CG2-CG1 4.26Å; V571-V644 HydrophobicContact CG2-CG2 4.09Å; I586-V644 HydrophobicContact CD1-CG1 3.67Å; I586-V644 HydrophobicContact CG1-CG1 4.29Å; E607-V644 WeakPolarHBondContact O-CA 3.38Å; V608-V644 HydrophobicContact CG1-CG2 4.28Å; V608-V644 HydrophobicContact CG2-CG1 4.29Å; V608-V644 HydrophobicContact CG2-CG2 4.37Å; V644-K654 CarbonylContact O-C 3.28Å; V644-K654 WeakPolarHBondContact O-CA 3.42Å; V644-L655 WeakPolarHBondContact CA-O 3.4Å; V644-L655 PolarHBondContact N-O 2.92Å; V644-L655 PolarHBondContact O-N 2.72Å; V644-F658 HydrophobicContact CG2-CB 3.81Å
645	K	91.6	Very high	83.9	Confident	61 Å²	61	65 Å²	65	27%	0.265	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.5	-174.8	167.9	-174.6	158.3	-153.3	0	109.3	E607 V652 A653	E607-K645 HydrophobicContact CB-CB 4.28Å; E607-K645 PolarHBondContact N-O 3.16Å; E607-K645 PolarHBondContact O-N 3.37Å; E607-K645 IonicContact OE1-NZ 3.94Å; E607-K645 WeakPolarHBondContact OE2-CE 3.29Å; E607-K645 IonicContact OE2-NZ 2.68Å; E607-K645 PolarHBondContact OE2-NZ 2.84Å; K645-V652 HydrophobicContact CG-CG1 3.92Å; K645-A653 WeakPolarHBondContact CA-O 3.39Å
646	V	90.5	Very high	84.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.7	176.2	174.6	0	0	0	0	108.3	I568 I586 F591 V604 V606 M627 V652 A653	I568-V646 HydrophobicContact CD1-CB 4.11Å; I568-V646 HydrophobicContact CD1-CG2 3.79Å; I568-V646 HydrophobicContact CG1-CB 4.38Å; I568-V646 HydrophobicContact CG1-CG2 4.08Å; I586-V646 HydrophobicContact CD1-CG2 4.14Å; I586-V646 HydrophobicContact CG2-CG2 4.23Å; F591-V646 HydrophobicContact CD1-CG1 3.89Å; F591-V646 HydrophobicContact CE1-CB 4.47Å; F591-V646 HydrophobicContact CE1-CG1 4.06Å; F591-V646 HydrophobicContact CE1-CG2 4.48Å; V604-V646 HydrophobicContact CG1-CG1 4.26Å; V606-V646 HydrophobicContact CG1-CG2 4.34Å; V606-V646 HydrophobicContact CG2-CG2 4.32Å; M627-V646 HydrophobicContact CE-CG1 3.8Å; M627-V646 HydrophobicContact CE-CG2 4.11Å; V646-V652 WeakPolarHBondContact O-CA 3.47Å; V646-A653 PolarHBondContact N-O 2.84Å; V646-A653 PolarHBondContact O-N 3.26Å
647	T	88.4	Confident	85.2	Confident	33 Å²	33	62.4 Å²	62.4	20%	0.202	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.1	173	-52.6	0	0	0	0	108.2	V604 N605 V652	V604-T647 VanDerWaalsContact CA-O 3.29Å; V604-T647 WeakPolarHBondContact CA-O 3.41Å; N605-T647 PolarHBondContact N-O 3.19Å; N605-T647 PolarHBondContact O-N 2.83Å; T647-V652 HydrophobicContact CG2-CG2 4.07Å
648	S	84.4	Confident	85.9	Confident	12 Å²	12	60.2 Å²	60.2	8%	0.084	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	98.8	-179.9	-172.6	0	0	0	0	108.9	G592 M603 H650 A651	G592-S648 PolarHBondContact N-OG 2.89Å; M603-S648 CarbonylContact O-C 3.54Å; M603-S648 WeakPolarHBondContact O-CA 3.44Å; S648-H650 PolarHBondContact O-N 2.94Å; S648-A651 PolarHBondContact N-O 2.92Å; S648-A651 PolarHBondContact O-N 2.83Å
649	G	80	Confident	86.5	Confident	42 Å²	42	58.6 Å²	58.6	43%	0.433	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	-122.8	-167	0	0	0	0	0	110.9	M603	M603-G649 PolarHBondContact O-N 3.31Å
650	H	78.6	Confident	87.1	Confident	190 Å²	190	56.9 Å²	56.9	88%	0.88	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.1	178.3	-59.2	-75.1	0	0	0	114.4	S648	S648-H650 PolarHBondContact O-N 2.94Å
651	A	82.4	Confident	87.9	Confident	22 Å²	22	54.3 Å²	54.3	18%	0.182	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145	-173.5	0	0	0	0	0	112	T565 P566 S648	T565-A651 HydrophobicContact CG2-CB 4.42Å; P566-A651 VanDerWaalsContact CD-CB 3.46Å; P566-A651 HydrophobicContact CG-CB 4.36Å; S648-A651 PolarHBondContact N-O 2.92Å; S648-A651 PolarHBondContact O-N 2.83Å
652	V	87.6	Confident	88.3	Confident	74 Å²	74	55.7 Å²	55.7	45%	0.448	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.5	-173.8	-177.6	0	0	0	0	110.6	K645 V646 T647 K654	K645-V652 HydrophobicContact CG-CG1 3.92Å; V646-V652 WeakPolarHBondContact O-CA 3.47Å; T647-V652 HydrophobicContact CG2-CG2 4.07Å; V652-K654 HydrophobicContact CG1-CG 4.35Å
653	A	89.4	Confident	88.4	Confident	8 Å²	8	51.3 Å²	51.3	7%	0.066	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	149.7	167	0	0	0	0	0	110.7	P566 I568 K645 V646	P566-A653 HydrophobicContact CB-CB 4.05Å; P566-A653 HydrophobicContact CG-CB 3.97Å; P566-A653 WeakPolarHBondContact O-CB 3.43Å; I568-A653 HydrophobicContact CD1-CB 3.85Å; I568-A653 HydrophobicContact CG1-CB 3.77Å; K645-A653 WeakPolarHBondContact CA-O 3.39Å; V646-A653 PolarHBondContact N-O 2.84Å; V646-A653 PolarHBondContact O-N 3.26Å
654	K	92.4	Very high	88.6	Confident	144 Å²	144	51.2 Å²	51.2	63%	0.626	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.2	178.5	-67	-179.1	-174.8	176.9	0	109.6	L643 V644 V652	L643-K654 HydrophobicContact CD1-CB 4.19Å; V644-K654 CarbonylContact O-C 3.28Å; V644-K654 WeakPolarHBondContact O-CA 3.42Å; V652-K654 HydrophobicContact CG1-CG 4.35Å
655	L	92.1	Very high	88.8	Confident	59 Å²	59	52 Å²	52	31%	0.309	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	140.4	170.6	-177.6	63.2	0	0	0	109.1	I568 V571 V644	I568-L655 HydrophobicContact CB-CB 4.03Å; I568-L655 HydrophobicContact CB-CD2 4.26Å; I568-L655 HydrophobicContact CD1-CB 4.32Å; I568-L655 HydrophobicContact CG2-CB 3.96Å; I568-L655 HydrophobicContact CG2-CD2 3.62Å; I568-L655 HydrophobicContact CG2-CG 4.44Å; V571-L655 HydrophobicContact CG2-CD2 4.49Å; V644-L655 WeakPolarHBondContact CA-O 3.4Å; V644-L655 PolarHBondContact N-O 2.92Å; V644-L655 PolarHBondContact O-N 2.72Å
656	E	90.2	Very high	88.9	Confident	133 Å²	133	54 Å²	54	62%	0.621	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	133.9	167.6	-61.3	-153.8	141.5	0	0	110.1	H642 L643	H642-E656 HydrophobicContact CB-CB 4.19Å; H642-E656 HydrophobicContact CB-CG 4.46Å; H642-E656 WeakPolarHBondContact O-CA 3.48Å; L643-E656 HydrophobicContact CD1-CG 4.08Å
657	G	85.1	Confident	89.1	Confident	29 Å²	29	57.6 Å²	57.6	30%	0.299	31%	0.313	S	S	.	.			trans	174.2	6.3	-174.6	0	0	0	0	0	117.4	H642	H642-G657 PolarHBondContact O-N 3.44Å
658	F	91.1	Very high	89.5	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.009	31%	0.306	C	S	.	.			trans	-139.8	136.3	174.9	-173.9	-84.3	0	0	0	111.6	V571 P573 S574 V584 V608 A609 H642 V644 F660	V571-F658 HydrophobicContact CG1-CB 4.27Å; P573-F658 HydrophobicContact CG-CE2 4.43Å; P573-F658 WeakPolarHBondContact O-CD2 3.32Å; S574-F658 WeakPolarHBondContact O-CA 3.43Å; V584-F658 HydrophobicContact CG1-CD2 4.18Å; V584-F658 HydrophobicContact CG2-CD2 3.81Å; V584-F658 HydrophobicContact CG2-CE2 3.52Å; V584-F658 HydrophobicContact CG2-CZ 4.06Å; V608-F658 HydrophobicContact CG1-CB 3.9Å; V608-F658 HydrophobicContact CG1-CD1 3.32Å; V608-F658 HydrophobicContact CG1-CD2 4.35Å; V608-F658 HydrophobicContact CG1-CE1 3.94Å; V608-F658 HydrophobicContact CG1-CG 3.57Å; A609-F658 HydrophobicContact CB-CD1 4.41Å; H642-F658 CarbonylContact C-O 3.54Å; H642-F658 VanDerWaalsContact CA-O 3.3Å; H642-F658 WeakPolarHBondContact CA-O 3.16Å; H642-F658 PolarHBondContact O-N 3.35Å; V644-F658 HydrophobicContact CG2-CB 3.81Å; F658-F660 AromaticContact CE1-CD1 3.76Å; F658-F660 HydrophobicContact CE1-CD1 3.76Å; F658-F660 HydrophobicContact CE1-CD2 4.21Å; F658-F660 AromaticContact CE1-CE1 3.53Å; F658-F660 HydrophobicContact CE1-CE1 3.53Å; F658-F660 HydrophobicContact CE1-CE2 4.04Å; F658-F660 HydrophobicContact CE1-CG 4.09Å; F658-F660 AromaticContact CE1-CZ 3.69Å; F658-F660 HydrophobicContact CE1-CZ 3.69Å; F658-F660 HydrophobicContact CZ-CD1 4.26Å; F658-F660 AromaticContact CZ-CE1 3.97Å; F658-F660 HydrophobicContact CZ-CE1 3.97Å; F658-F660 HydrophobicContact CZ-CZ 4.44Å
659	K	90.9	Very high	89.9	Confident	83 Å²	83	61.4 Å²	61.4	36%	0.361	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.3	170	53.4	-178.3	-179.9	-172.2	0	113.5	S574 S575 G576 V661	S574-K659 PolarHBondContact O-N 3.39Å; S574-K659 VanDerWaalsContact O-N 3.1Å; S575-K659 WeakPolarHBondContact CA-O 3.47Å; S575-K659 WeakPolarHBondContact CB-O 3.4Å; G576-K659 PolarHBondContact N-O 3.47Å; G576-K659 VanDerWaalsContact N-O 3.14Å; K659-V661 HydrophobicContact CB-CG1 4.48Å; K659-V661 HydrophobicContact CD-CG1 3.91Å; K659-V661 HydrophobicContact CG-CG1 3.88Å
660	F	90.4	Very high	90.6	Very high	24 Å²	24	59.9 Å²	59.9	11%	0.105	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.7	166.7	-69.5	-67.4	0	0	0	110.4	G576 I578 A609 A611 P631 F633 F637 P639 F658	G576-F660 WeakPolarHBondContact O-CA 3.21Å; G576-F660 WeakPolarHBondContact O-CD1 3.49Å; I578-F660 HydrophobicContact CD1-CB 4.22Å; I578-F660 HydrophobicContact CG1-CB 3.7Å; I578-F660 HydrophobicContact CG1-CD1 4.09Å; I578-F660 HydrophobicContact CG1-CG 4.03Å; A609-F660 HydrophobicContact CB-CD2 3.98Å; A609-F660 HydrophobicContact CB-CE2 3.91Å; A611-F660 HydrophobicContact CB-CE2 4.19Å; A611-F660 HydrophobicContact CB-CZ 4.22Å; P631-F660 HydrophobicContact CB-CE1 4.35Å; P631-F660 HydrophobicContact CB-CZ 3.83Å; P631-F660 HydrophobicContact CG-CE1 4.45Å; P631-F660 HydrophobicContact CG-CZ 4.12Å; F633-F660 HydrophobicContact CE1-CD1 4.34Å; F633-F660 AromaticContact CE1-CE1 3.73Å; F633-F660 HydrophobicContact CE1-CE1 3.73Å; F633-F660 HydrophobicContact CE1-CE2 4.18Å; F633-F660 AromaticContact CE1-CZ 3.63Å; F633-F660 HydrophobicContact CE1-CZ 3.63Å; F633-F660 HydrophobicContact CZ-CD1 4.27Å; F633-F660 AromaticContact CZ-CE1 3.52Å; F633-F660 HydrophobicContact CZ-CE1 3.52Å; F633-F660 AromaticContact CZ-CZ 3.79Å; F633-F660 HydrophobicContact CZ-CZ 3.79Å; F637-F660 HydrophobicContact CE1-CD2 4.04Å; F637-F660 AromaticContact CE1-CE2 3.95Å; F637-F660 HydrophobicContact CE1-CE2 3.95Å; F637-F660 HydrophobicContact CZ-CE2 4.24Å; P639-F660 HydrophobicContact CB-CB 4.24Å; P639-F660 HydrophobicContact CB-CD2 4.03Å; P639-F660 HydrophobicContact CG-CB 3.77Å; P639-F660 HydrophobicContact CG-CD2 4.05Å; P639-F660 HydrophobicContact CG-CG 4.27Å; F658-F660 AromaticContact CE1-CD1 3.76Å; F658-F660 HydrophobicContact CE1-CD1 3.76Å; F658-F660 HydrophobicContact CE1-CD2 4.21Å; F658-F660 AromaticContact CE1-CE1 3.53Å; F658-F660 HydrophobicContact CE1-CE1 3.53Å; F658-F660 HydrophobicContact CE1-CE2 4.04Å; F658-F660 HydrophobicContact CE1-CG 4.09Å; F658-F660 AromaticContact CE1-CZ 3.69Å; F658-F660 HydrophobicContact CE1-CZ 3.69Å; F658-F660 HydrophobicContact CZ-CD1 4.26Å; F658-F660 AromaticContact CZ-CE1 3.97Å; F658-F660 HydrophobicContact CZ-CE1 3.97Å; F658-F660 HydrophobicContact CZ-CZ 4.44Å
661	V	90.4	Very high	91.3	Very high	18 Å²	18	53.9 Å²	53.9	11%	0.109	29%	0.285	C	S	.	.			trans	-143.2	158.5	-177.8	-59.5	0	0	0	0	110.1	G576 P577 K659 F687 T690	G576-V661 PolarHBondContact O-N 2.77Å; P577-V661 VanDerWaalsContact CA-O 3.24Å; P577-V661 WeakPolarHBondContact CA-O 3.46Å; K659-V661 HydrophobicContact CB-CG1 4.48Å; K659-V661 HydrophobicContact CD-CG1 3.91Å; K659-V661 HydrophobicContact CG-CG1 3.88Å; V661-F687 HydrophobicContact CB-CB 4.31Å; V661-F687 HydrophobicContact CB-CD1 3.51Å; V661-F687 HydrophobicContact CB-CD2 4.42Å; V661-F687 HydrophobicContact CB-CE1 3.88Å; V661-F687 HydrophobicContact CB-CG 3.83Å; V661-F687 HydrophobicContact CB-CZ 4.48Å; V661-F687 HydrophobicContact CG1-CD1 3.61Å; V661-F687 HydrophobicContact CG1-CE1 3.59Å; V661-F687 HydrophobicContact CG1-CG 4.42Å; V661-F687 HydrophobicContact CG1-CZ 4.39Å; V661-F687 HydrophobicContact CG2-CB 3.87Å; V661-F687 HydrophobicContact CG2-CD1 3.7Å; V661-F687 HydrophobicContact CG2-CG 3.92Å; V661-T690 HydrophobicContact CG2-CG2 4.05Å; V661-T690 WeakPolarHBondContact CG2-OG1 3.36Å
662	D	88.3	Confident	91.8	Very high	78 Å²	78	55.5 Å²	55.5	42%	0.417	29%	0.288	S	S	.	.			trans	-111.4	119.8	176.1	-164.6	4.5	0	0	0	110.6	F687 R739	D662-F687 WeakPolarHBondContact O-CD2 3.32Å; D662-R739 IonicContact OD1-CZ 2.85Å; D662-R739 IonicContact OD1-NE 2.69Å; D662-R739 PolarHBondContact OD1-NE 3.45Å; D662-R739 IonicContact OD1-NH2 3.66Å; D662-R739 PolarHBondContact OD1-NH2 2.82Å; D662-R739 IonicContact OD2-CZ 2.7Å; D662-R739 IonicContact OD2-NE 2.71Å; D662-R739 IonicContact OD2-NH2 2.67Å; D662-R739 PolarHBondContact OD2-NH2 3.48Å
663	P	92.1	Very high	92	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.			trans	-65.3	137.6	173.7	25.8	-33.4	0	0	0	111.6	A686 T690 V734 R739	P663-A686 WeakPolarHBondContact CA-O 3.33Å; P663-T690 HydrophobicContact CB-CG2 4.22Å; P663-T690 HydrophobicContact CG-CG2 4.21Å; P663-V734 HydrophobicContact CB-CG2 4.14Å; P663-V734 HydrophobicContact CG-CB 4.17Å; P663-V734 HydrophobicContact CG-CG2 3.88Å; P663-R739 HydrophobicContact CG-CG 4.18Å; P663-R739 WeakPolarHBondContact O-CD 3.3Å; P663-R739 VanDerWaalsContact O-CG 3.26Å; P663-R739 WeakPolarHBondContact O-CG 3.41Å; P663-R739 PolarHBondContact O-NE 3.09Å
664	V	92.8	Very high	92.2	Very high	64 Å²	64	51.6 Å²	51.6	39%	0.388	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.4	-179.4	-177	0	0	0	0	109.9	G685 A686 L688	V664-G685 CarbonylContact O-C 3.59Å; V664-G685 WeakPolarHBondContact O-CA 3.5Å; V664-A686 PolarHBondContact N-O 3.11Å; V664-A686 PolarHBondContact O-N 3.46Å; V664-L688 WeakPolarHBondContact O-CD2 3.49Å
665	I	95.5	Very high	92.1	Very high	16 Å²	16	47.5 Å²	47.5	8%	0.082	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.2	169.6	-59.7	170.7	0	0	0	108.5	I668 I683 L732 R739 A741	I665-I668 HydrophobicContact CG2-CG2 4.4Å; I665-I683 HydrophobicContact CB-CG2 4.42Å; I665-I683 HydrophobicContact CD1-CG2 4.35Å; I665-I683 HydrophobicContact CG1-CG2 4.01Å; I665-I683 HydrophobicContact CG2-CG2 3.72Å; I665-L732 HydrophobicContact CD1-CB 3.9Å; I665-R739 HydrophobicContact CD1-CB 4.46Å; I665-A741 HydrophobicContact CD1-CB 4.3Å; I665-A741 HydrophobicContact CG2-CB 3.99Å
666	N	94.3	Very high	92	Very high	102 Å²	102	46.8 Å²	46.8	55%	0.545	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-44.4	178.4	-64.8	-5.4	0	0	0	111.4	R684 P742	N666-R684 PolarHBondContact N-O 3.02Å; N666-P742 WeakPolarHBondContact O-CG 3.25Å
667	N	95.6	Very high	92	Very high	77 Å²	77	40.5 Å²	40.5	41%	0.412	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	174.6	172.7	64.3	17.2	0	0	0	112.4	R684	N667-R684 PolarHBondContact N-O 3.14Å; N667-R684 PolarHBondContact O-N 2.81Å; N667-R684 WeakPolarHBondContact OD1-CB 3.42Å
668	I	96.2	Very high	92.2	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.041	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.8	173.3	67.6	176.7	0	0	0	110.3	I665 T671 L681 T682 I683 V730 A741 V743 F745	I665-I668 HydrophobicContact CG2-CG2 4.4Å; I668-T671 HydrophobicContact CG1-CG2 4.33Å; I668-L681 HydrophobicContact CB-CD1 4.04Å; I668-L681 HydrophobicContact CD1-CD1 4.35Å; I668-L681 HydrophobicContact CG1-CD1 4.48Å; I668-T682 CarbonylContact C-O 3.53Å; I668-T682 WeakPolarHBondContact CA-O 3.45Å; I668-I683 HydrophobicContact CG2-CB 4.41Å; I668-I683 HydrophobicContact CG2-CG1 3.97Å; I668-I683 HydrophobicContact CG2-CG2 4.24Å; I668-V730 HydrophobicContact CD1-CB 4.32Å; I668-V730 HydrophobicContact CD1-CG2 3.69Å; I668-A741 HydrophobicContact CG2-CB 3.86Å; I668-V743 HydrophobicContact CD1-CG2 4.06Å; I668-V743 WeakPolarHBondContact CD1-O 3.41Å; I668-V743 HydrophobicContact CG1-CG2 3.72Å; I668-F745 HydrophobicContact CD1-CB 4.4Å
669	F	93.5	Very high	92.2	Very high	116 Å²	116	42.6 Å²	42.6	51%	0.509	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	136	178.6	-177.4	-92.7	0	0	0	111.8	T682 L780	F669-T682 PolarHBondContact N-O 2.82Å; F669-T682 WeakPolarHBondContact O-CA 3.45Å; F669-T682 WeakPolarHBondContact O-CB 3.33Å; F669-T682 PolarHBondContact O-N 2.88Å; F669-L780 HydrophobicContact CE1-CD2 3.96Å; F669-L780 HydrophobicContact CE2-CD2 4.32Å; F669-L780 HydrophobicContact CZ-CD2 3.5Å; F669-L780 VanDerWaalsContact CZ-CD2 3.5Å
670	P	93.5	Very high	92.2	Very high	11 Å²	11	43 Å²	43	7%	0.071	23%	0.225	C	C	.	.			cis	-66	164.7	-11.9	31.3	-36.3	0	0	0	111.4	T679 L681	P670-T679 HydrophobicContact CG-CG2 3.57Å; P670-L681 VanDerWaalsContact O-CD1 3.3Å; P670-L681 WeakPolarHBondContact O-CD1 3.41Å
671	T	93.5	Very high	92.4	Very high	63 Å²	63	41.9 Å²	41.9	39%	0.387	22%	0.22	S	C	.	.	S	Bend	trans	-88.5	-1.5	175.7	48.5	0	0	0	0	113.3	I668 V743 F745 T746	I668-T671 HydrophobicContact CG1-CG2 4.33Å; T671-V743 HydrophobicContact CG2-CG2 4.02Å; T671-F745 CarbonylContact O-C 3.57Å; T671-F745 WeakPolarHBondContact O-CA 3.33Å; T671-T746 PolarHBondContact O-N 2.72Å
672	F	92.5	Very high	92.6	Very high	56 Å²	56	42 Å²	42	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	168	-179.6	64.5	-91.4	0	0	0	112	F745 T746 L780	F672-F745 VanDerWaalsContact C-CE2 3.42Å; F672-F745 VanDerWaalsContact O-CE2 3.3Å; F672-F745 WeakPolarHBondContact O-CE2 3.39Å; F672-F745 WeakPolarHBondContact O-CZ 3.14Å; F672-T746 CarbonylContact C-O 3.45Å; F672-T746 WeakPolarHBondContact CA-O 3.4Å; F672-T746 WeakPolarHBondContact CB-O 3.45Å; F672-L780 HydrophobicContact CZ-CD1 4.4Å
673	G	92.3	Very high	93	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	175.8	173	0	0	0	0	0	113.8	T746 Y747 N748 S778	G673-T746 PolarHBondContact N-O 3.14Å; G673-T746 VanDerWaalsContact N-O 3.08Å; G673-Y747 CarbonylContact O-C 3.51Å; G673-Y747 WeakPolarHBondContact O-CA 3.3Å; G673-N748 PolarHBondContact O-N 2.96Å; G673-S778 CarbonylContact C-O 3.59Å; G673-S778 WeakPolarHBondContact CA-O 3.45Å
674	P	92.7	Very high	93.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	144	178	24.1	-33.7	0	0	0	113.3	S676 G677 D750 S778 Y835	P674-S676 PolarHBondContact O-N 3.05Å; P674-G677 PolarHBondContact O-N 3.34Å; P674-D750 VanDerWaalsContact CB-OD1 3.27Å; P674-D750 WeakPolarHBondContact CB-OD1 3.47Å; P674-S778 WeakPolarHBondContact CD-O 3.4Å; P674-Y835 HydrophobicContact CB-CG 4.49Å
675	K	91.4	Very high	93.3	Very high	58 Å²	58	41.9 Å²	41.9	25%	0.252	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.1	179.9	70.3	-178.2	-173.2	-164.1	0	113.4	G677 P719 H720 V724 N748 E749 D750	K675-G677 PolarHBondContact O-N 2.98Å; K675-P719 CarbonylContact O-C 3.59Å; K675-P719 WeakPolarHBondContact O-CA 3.3Å; K675-H720 PolarHBondContact O-N 2.86Å; K675-V724 HydrophobicContact CB-CG1 3.97Å; K675-V724 HydrophobicContact CB-CG2 4.43Å; K675-V724 HydrophobicContact CD-CG2 3.85Å; K675-N748 WeakPolarHBondContact CB-O 3.39Å; K675-N748 PolarHBondContact N-O 2.84Å; K675-E749 VanDerWaalsContact CE-OE2 3.22Å; K675-E749 WeakPolarHBondContact CE-OE2 3.33Å; K675-E749 IonicContact NZ-OE1 2.92Å; K675-E749 PolarHBondContact NZ-OE1 3.46Å; K675-E749 IonicContact NZ-OE2 2.76Å; K675-E749 PolarHBondContact NZ-OE2 2.79Å; K675-D750 WeakPolarHBondContact CE-OD2 3.35Å; K675-D750 WeakPolarHBondContact CG-OD1 3.31Å; K675-D750 VanDerWaalsContact CG-OD2 3.23Å; K675-D750 WeakPolarHBondContact CG-OD2 3.38Å; K675-D750 PolarHBondContact N-OD1 2.76Å; K675-D750 VanDerWaalsContact N-OD1 3.13Å
676	S	90	Very high	93.3	Very high	45 Å²	45	42.2 Å²	42.2	32%	0.315	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-6.6	172.3	-76.5	0	0	0	0	114.1	P674 D750 Y835	P674-S676 PolarHBondContact O-N 3.05Å; S676-D750 WeakPolarHBondContact CB-OD1 3.03Å; S676-D750 PolarHBondContact N-OD1 2.87Å; S676-D750 PolarHBondContact OG-OD1 3.04Å; S676-D750 PolarHBondContact OG-OD2 3.01Å; S676-Y835 VanDerWaalsContact CB-CD2 3.49Å
677	G	90.1	Very high	93.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.			trans	75.9	-148.2	173.6	0	0	0	0	0	113.9	P674 K675 T679 T717	P674-G677 PolarHBondContact O-N 3.34Å; K675-G677 PolarHBondContact O-N 2.98Å; G677-T679 PolarHBondContact O-N 2.89Å; G677-T717 WeakPolarHBondContact CA-OG1 3.15Å
678	N	89.3	Confident	93	Very high	74 Å²	74	36.5 Å²	36.5	40%	0.396	18%	0.183	S	C	.	.			trans	67.5	1.4	-173.1	-64.2	-77.8	0	0	0	116.6	M680 T717 D833	N678-M680 PolarHBondContact O-N 3.08Å; N678-T717 PolarHBondContact N-O 2.9Å; N678-T717 PolarHBondContact N-OG1 3.16Å; N678-D833 CarbonylContact C-O 3.59Å
679	T	91.1	Very high	92.8	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.198	C	C	.	.			trans	-55.4	131.2	171.3	-44.1	0	0	0	0	111	P670 G677 L681 K716 T717 F745 D833	P670-T679 HydrophobicContact CG-CG2 3.57Å; G677-T679 PolarHBondContact O-N 2.89Å; T679-L681 VanDerWaalsContact C-N 3.33Å; T679-L681 PolarHBondContact O-N 2.76Å; T679-K716 WeakPolarHBondContact O-CA 3.18Å; T679-T717 VanDerWaalsContact CB-OG1 3.25Å; T679-T717 WeakPolarHBondContact CB-OG1 3.15Å; T679-T717 PolarHBondContact N-OG1 3.04Å; T679-T717 PolarHBondContact O-N 3.13Å; T679-T717 PolarHBondContact OG1-OG1 3.46Å; T679-F745 HydrophobicContact CG2-CE2 4.08Å; T679-F745 HydrophobicContact CG2-CZ 4.01Å; T679-D833 WeakPolarHBondContact CA-O 3.07Å; T679-D833 HydrophobicContact CG2-CB 4.23Å; T679-D833 PolarHBondContact N-O 3.15Å
680	M	91.7	Very high	92.7	Very high	92 Å²	92	33.8 Å²	33.8	45%	0.453	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	81.1	176.3	-69.2	-65.9	-149.7	0	0	110.2	N678 T682 Q706 I714 K716	N678-M680 PolarHBondContact O-N 3.08Å; M680-T682 PolarHBondContact O-N 3.34Å; M680-Q706 HydrophobicContact SD-CG 4.12Å; M680-I714 HydrophobicContact CB-CG2 4.41Å; M680-I714 HydrophobicContact SD-CG2 4.44Å; M680-K716 VanDerWaalsContact CE-CE 3.43Å; M680-K716 HydrophobicContact CE-CG 4.49Å; M680-K716 HydrophobicContact SD-CD 4.32Å; M680-K716 HydrophobicContact SD-CG 3.62Å
681	L	93.8	Very high	92.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	113.7	178.6	-175.7	62.9	0	0	0	110.2	I668 P670 T679 I683 V698 I714 C715 T717 V730 F745	I668-L681 HydrophobicContact CB-CD1 4.04Å; I668-L681 HydrophobicContact CD1-CD1 4.35Å; I668-L681 HydrophobicContact CG1-CD1 4.48Å; P670-L681 VanDerWaalsContact O-CD1 3.3Å; P670-L681 WeakPolarHBondContact O-CD1 3.41Å; T679-L681 VanDerWaalsContact C-N 3.33Å; T679-L681 PolarHBondContact O-N 2.76Å; L681-I683 HydrophobicContact CG-CG1 4.37Å; L681-V698 HydrophobicContact CD2-CG2 4.12Å; L681-I714 WeakPolarHBondContact O-CA 3.4Å; L681-C715 PolarHBondContact N-O 2.97Å; L681-C715 PolarHBondContact O-N 2.93Å; L681-T717 HydrophobicContact CB-CG2 3.9Å; L681-T717 HydrophobicContact CD2-CG2 4.3Å; L681-V730 HydrophobicContact CD2-CG1 4.07Å; L681-V730 HydrophobicContact CD2-CG2 4.06Å; L681-F745 HydrophobicContact CD1-CD2 3.85Å; L681-F745 HydrophobicContact CD1-CE2 4.23Å
682	T	95.2	Very high	92.2	Very high	22 Å²	22	32.8 Å²	32.8	14%	0.135	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116.2	173.8	-57.9	0	0	0	0	109.5	I668 F669 M680 R684 M712 I714	I668-T682 CarbonylContact C-O 3.53Å; I668-T682 WeakPolarHBondContact CA-O 3.45Å; F669-T682 PolarHBondContact N-O 2.82Å; F669-T682 WeakPolarHBondContact O-CA 3.45Å; F669-T682 WeakPolarHBondContact O-CB 3.33Å; F669-T682 PolarHBondContact O-N 2.88Å; M680-T682 PolarHBondContact O-N 3.34Å; T682-R684 HydrophobicContact CG2-CG 4.21Å; T682-M712 HydrophobicContact CG2-CG 3.68Å; T682-M712 HydrophobicContact CG2-SD 3.68Å; T682-I714 HydrophobicContact CG2-CG1 4.26Å
683	I	96.4	Very high	92.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.3	172.7	-53.5	-174.9	0	0	0	107.6	I665 I668 L681 V696 M712 L713 V730	I665-I683 HydrophobicContact CB-CG2 4.42Å; I665-I683 HydrophobicContact CD1-CG2 4.35Å; I665-I683 HydrophobicContact CG1-CG2 4.01Å; I665-I683 HydrophobicContact CG2-CG2 3.72Å; I668-I683 HydrophobicContact CG2-CB 4.41Å; I668-I683 HydrophobicContact CG2-CG1 3.97Å; I668-I683 HydrophobicContact CG2-CG2 4.24Å; L681-I683 HydrophobicContact CG-CG1 4.37Å; I683-V696 HydrophobicContact CD1-CG1 3.71Å; I683-V696 HydrophobicContact CD1-CG2 3.98Å; I683-M712 WeakPolarHBondContact O-CA 3.28Å; I683-L713 HydrophobicContact CB-CB 4.46Å; I683-L713 PolarHBondContact N-O 3Å; I683-L713 PolarHBondContact O-N 2.95Å; I683-V730 HydrophobicContact CD1-CG1 3.77Å
684	R	96.6	Very high	92	Very high	129 Å²	129	38.4 Å²	38.4	49%	0.487	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	146.5	175.3	-54.2	-176.9	177	-164.5	-0.1	110.4	N666 N667 T682 S711	N666-R684 PolarHBondContact N-O 3.02Å; N667-R684 PolarHBondContact N-O 3.14Å; N667-R684 PolarHBondContact O-N 2.81Å; N667-R684 WeakPolarHBondContact OD1-CB 3.42Å; T682-R684 HydrophobicContact CG2-CG 4.21Å; R684-S711 WeakPolarHBondContact CA-O 3.37Å
685	G	95.1	Very high	92	Very high	9 Å²	9	40.4 Å²	40.4	9%	0.093	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	-151.1	-169.7	0	0	0	0	0	113.5	V664 S711	V664-G685 CarbonylContact O-C 3.59Å; V664-G685 WeakPolarHBondContact O-CA 3.5Å; G685-S711 PolarHBondContact N-O 2.83Å; G685-S711 VanDerWaalsContact O-CA 3.31Å; G685-S711 WeakPolarHBondContact O-CA 3.49Å; G685-S711 WeakPolarHBondContact O-CB 3.21Å
686	A	93.6	Very high	92.2	Very high	24 Å²	24	37.6 Å²	37.6	20%	0.198	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.9	173.4	0	0	0	0	0	111	P663 V664 L688 F710	P663-A686 WeakPolarHBondContact CA-O 3.33Å; V664-A686 PolarHBondContact N-O 3.11Å; V664-A686 PolarHBondContact O-N 3.46Å; A686-L688 PolarHBondContact O-N 3.3Å; A686-F710 CarbonylContact C-O 3.45Å; A686-F710 HydrophobicContact CB-CZ 4.45Å
687	F	92.7	Very high	92.5	Very high	58 Å²	58	37 Å²	37	25%	0.254	19%	0.185	S	C	.	.	S	Bend	trans	53.6	29.2	-176.3	-46.7	-84.8	0	0	0	114.1	V661 D662 D689 T690 F710	V661-F687 HydrophobicContact CB-CB 4.31Å; V661-F687 HydrophobicContact CB-CD1 3.51Å; V661-F687 HydrophobicContact CB-CD2 4.42Å; V661-F687 HydrophobicContact CB-CE1 3.88Å; V661-F687 HydrophobicContact CB-CG 3.83Å; V661-F687 HydrophobicContact CB-CZ 4.48Å; V661-F687 HydrophobicContact CG1-CD1 3.61Å; V661-F687 HydrophobicContact CG1-CE1 3.59Å; V661-F687 HydrophobicContact CG1-CG 4.42Å; V661-F687 HydrophobicContact CG1-CZ 4.39Å; V661-F687 HydrophobicContact CG2-CB 3.87Å; V661-F687 HydrophobicContact CG2-CD1 3.7Å; V661-F687 HydrophobicContact CG2-CG 3.92Å; D662-F687 WeakPolarHBondContact O-CD2 3.32Å; F687-D689 PolarHBondContact O-N 2.83Å; F687-T690 HydrophobicContact CB-CG2 4.37Å; F687-T690 WeakPolarHBondContact O-CB 3.5Å; F687-T690 WeakPolarHBondContact O-CG2 3.47Å; F687-T690 PolarHBondContact O-N 3.44Å; F687-F710 HydrophobicContact CB-CE2 4.46Å; F687-F710 HydrophobicContact CD1-CD2 4.32Å; F687-F710 AromaticContact CD1-CE2 3.43Å; F687-F710 HydrophobicContact CD1-CE2 3.43Å; F687-F710 VanDerWaalsContact CD1-CE2 3.43Å; F687-F710 HydrophobicContact CD1-CZ 4.15Å; F687-F710 AromaticContact CE1-CE2 3.67Å; F687-F710 HydrophobicContact CE1-CE2 3.67Å; F687-F710 HydrophobicContact CE1-CZ 4.08Å; F687-F710 AromaticContact CG-CE2 3.92Å; F687-F710 HydrophobicContact CG-CE2 3.92Å; F687-F710 HydrophobicContact CG-CZ 4.44Å; F687-F710 HydrophobicContact CZ-CE2 4.33Å; F687-F710 HydrophobicContact CZ-CZ 4.31Å; F687-F710 PolarHBondContact N-O 2.71Å
688	L	92.8	Very high	92.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.1	-174.6	-57.6	-176	0	0	0	113	V664 A686 Q694 L708 F710 L713 L732	V664-L688 WeakPolarHBondContact O-CD2 3.49Å; A686-L688 PolarHBondContact O-N 3.3Å; L688-Q694 WeakPolarHBondContact O-CG 3.49Å; L688-L708 HydrophobicContact CB-CD1 4.46Å; L688-F710 PolarHBondContact N-O 2.86Å; L688-L713 HydrophobicContact CD1-CB 4.06Å; L688-L732 HydrophobicContact CD2-CD2 3.78Å
689	D	90.8	Very high	92.8	Very high	67 Å²	67	34.5 Å²	34.5	36%	0.358	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3	178.9	59.6	-10	0	0	0	114.7	F687 Q694 L708 F710	F687-D689 PolarHBondContact O-N 2.83Å; D689-Q694 PolarHBondContact O-NE2 2.65Å; D689-L708 HydrophobicContact CB-CG 4.23Å; D689-F710 VanDerWaalsContact CG-CA 3.45Å; D689-F710 WeakPolarHBondContact OD1-CA 3.4Å; D689-F710 WeakPolarHBondContact OD2-CA 3.28Å; D689-F710 PolarHBondContact OD2-N 2.71Å
690	T	91.1	Very high	92.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.22	C	C	.	.			trans	-67.5	158.7	-178.3	-163.4	0	0	0	0	112.9	S575 G576 V661 P663 F687 Q694 V734	S575-T690 WeakPolarHBondContact CB-OG1 3.05Å; S575-T690 PolarHBondContact O-OG1 2.71Å; S575-T690 WeakPolarHBondContact OG-CB 3.44Å; S575-T690 PolarHBondContact OG-OG1 3.04Å; G576-T690 WeakPolarHBondContact CA-OG1 3.42Å; G576-T690 PolarHBondContact N-OG1 3.11Å; V661-T690 HydrophobicContact CG2-CG2 4.05Å; V661-T690 WeakPolarHBondContact CG2-OG1 3.36Å; P663-T690 HydrophobicContact CB-CG2 4.22Å; P663-T690 HydrophobicContact CG-CG2 4.21Å; F687-T690 HydrophobicContact CB-CG2 4.37Å; F687-T690 WeakPolarHBondContact O-CB 3.5Å; F687-T690 WeakPolarHBondContact O-CG2 3.47Å; F687-T690 PolarHBondContact O-N 3.44Å; T690-Q694 PolarHBondContact O-NE2 3.25Å; T690-V734 HydrophobicContact CG2-CG1 3.89Å; T690-V734 WeakPolarHBondContact O-CG1 3.5Å
691	G	89.1	Confident	92.7	Very high	3 Å²	3	42 Å²	42	3%	0.031	21%	0.213	C	C	.	.	S	Bend	trans	85.7	-174.4	177.1	0	0	0	0	0	114.6	P573 S575 D735	P573-G691 WeakPolarHBondContact CB-O 3.42Å; S575-G691 PolarHBondContact O-N 2.84Å; G691-D735 WeakPolarHBondContact CA-OD2 3.28Å
692	N	88.1	Confident	92.6	Very high	49 Å²	49	45.9 Å²	45.9	26%	0.262	24%	0.24	S	C	.	.	S	Bend	trans	-88.4	-31.1	175.6	-61	111.4	0	0	0	113.1	T582 A583 D735	T582-N692 WeakPolarHBondContact CA-OD1 3.2Å; T582-N692 WeakPolarHBondContact CG2-OD1 3.31Å; A583-N692 PolarHBondContact N-OD1 2.95Å; A583-N692 PolarHBondContact O-ND2 2.96Å; A583-N692 PolarHBondContact O-OD1 3.36Å; N692-D735 WeakPolarHBondContact CA-OD1 3.37Å; N692-D735 WeakPolarHBondContact CB-OD1 3.5Å; N692-D735 PolarHBondContact N-OD1 2.97Å; N692-D735 PolarHBondContact N-OD2 3.32Å; N692-D735 VanDerWaalsContact N-OD2 3.09Å
693	K	89.5	Confident	92.6	Very high	138 Å²	138	45 Å²	45	60%	0.6	24%	0.235	S	C	*	.			trans	-148.7	123.5	-172.8	-172.5	-173.5	179.1	-169.7	0	112.1	V695 D735	K693-V695 HydrophobicContact CD-CG2 4.22Å; K693-V695 HydrophobicContact CG-CG2 4.2Å; K693-D735 PolarHBondContact N-OD1 2.86Å; K693-D735 PolarHBondContact O-N 2.89Å
694	Q	91.1	Very high	92.3	Very high	37 Å²	37	51 Å²	51	17%	0.173	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.5	172.8	-53.2	73.8	20.1	0	0	109.1	L688 D689 T690 I705 L708 L732 V734	L688-Q694 WeakPolarHBondContact O-CG 3.49Å; D689-Q694 PolarHBondContact O-NE2 2.65Å; T690-Q694 PolarHBondContact O-NE2 3.25Å; Q694-I705 HydrophobicContact CB-CD1 4.16Å; Q694-L708 HydrophobicContact CB-CD2 4.44Å; Q694-L708 HydrophobicContact CG-CD1 4.4Å; Q694-L708 HydrophobicContact CG-CD2 3.89Å; Q694-L732 HydrophobicContact CB-CD1 4.2Å; Q694-V734 HydrophobicContact CG-CG2 4.49Å
695	V	93.6	Very high	92.2	Very high	41 Å²	41	47.4 Å²	47.4	25%	0.248	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.3	174.5	-178.2	0	0	0	0	108.2	K693 T697 T733	K693-V695 HydrophobicContact CD-CG2 4.22Å; K693-V695 HydrophobicContact CG-CG2 4.2Å; V695-T697 HydrophobicContact CG1-CG2 4.42Å; V695-T733 PolarHBondContact N-O 2.82Å; V695-T733 PolarHBondContact O-N 3.04Å
696	V	95.4	Very high	92.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.6	172.1	175.8	0	0	0	0	109.2	I683 C703 I705 L713 V730 K731 L732	I683-V696 HydrophobicContact CD1-CG1 3.71Å; I683-V696 HydrophobicContact CD1-CG2 3.98Å; V696-C703 HydrophobicContact CB-CB 3.95Å; V696-C703 HydrophobicContact CG1-CB 3.67Å; V696-C703 PolarHBondContact O-N 3.44Å; V696-I705 HydrophobicContact CG2-CD1 4.49Å; V696-L713 HydrophobicContact CG2-CD1 3.68Å; V696-L713 HydrophobicContact CG2-CD2 3.76Å; V696-L713 HydrophobicContact CG2-CG 4.42Å; V696-V730 HydrophobicContact CG1-CG1 4.15Å; V696-K731 CarbonylContact C-O 3.58Å; V696-K731 VanDerWaalsContact CA-O 3.29Å; V696-K731 WeakPolarHBondContact CA-O 3.44Å; V696-L732 HydrophobicContact CG2-CD1 3.85Å
697	T	95.4	Very high	92.1	Very high	31 Å²	31	52.8 Å²	52.8	19%	0.19	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.3	171.7	57.5	0	0	0	0	111.1	V695 A701 V730 K731	V695-T697 HydrophobicContact CG1-CG2 4.42Å; T697-A701 CarbonylContact C-O 3.59Å; T697-A701 WeakPolarHBondContact CA-O 3.46Å; T697-A701 WeakPolarHBondContact CB-O 3.42Å; T697-V730 WeakPolarHBondContact O-CA 3.43Å; T697-K731 PolarHBondContact N-O 2.91Å; T697-K731 PolarHBondContact O-N 2.89Å
698	V	95.1	Very high	92.1	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	113.3	169	-174.3	0	0	0	0	106.9	L681 K700 A701 C703 P718 Q728 V730 F745 Y747	L681-V698 HydrophobicContact CD2-CG2 4.12Å; V698-K700 PolarHBondContact O-N 3.39Å; V698-A701 PolarHBondContact N-O 3.41Å; V698-A701 PolarHBondContact O-N 2.95Å; V698-A701 VanDerWaalsContact O-N 3.08Å; V698-C703 HydrophobicContact CG2-CB 4.23Å; V698-P718 HydrophobicContact CB-CG 4.31Å; V698-Q728 HydrophobicContact CG1-CB 3.79Å; V698-V730 HydrophobicContact CG1-CG2 4.46Å; V698-V730 HydrophobicContact CG2-CG2 4.33Å; V698-F745 HydrophobicContact CG1-CB 4.2Å; V698-F745 HydrophobicContact CG1-CD1 4.27Å; V698-Y747 HydrophobicContact CG1-CE2 3.77Å
699	G	90.6	Very high	92.1	Very high	18 Å²	18	55.6 Å²	55.6	19%	0.186	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	-103.8	-170.3	0	0	0	0	0	111.6	P729	G699-P729 PolarHBondContact N-O 2.96Å
700	K	87.9	Confident	92.1	Very high	214 Å²	214	57.1 Å²	57.1	93%	0.93	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-3.7	176.6	-64.2	-178.5	-178.3	175.5	0	114	V698	V698-K700 PolarHBondContact O-N 3.39Å
701	A	92.3	Very high	92.3	Very high	37 Å²	37	60 Å²	60	31%	0.306	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148	-173.1	0	0	0	0	0	111.7	T697 V698 P718	T697-A701 CarbonylContact C-O 3.59Å; T697-A701 WeakPolarHBondContact CA-O 3.46Å; T697-A701 WeakPolarHBondContact CB-O 3.42Å; V698-A701 PolarHBondContact N-O 3.41Å; V698-A701 PolarHBondContact O-N 2.95Å; V698-A701 VanDerWaalsContact O-N 3.08Å; A701-P718 HydrophobicContact CB-CB 3.64Å; A701-P718 HydrophobicContact CB-CG 3.44Å; A701-P718 VanDerWaalsContact CB-CG 3.44Å
702	S	93.2	Very high	92.5	Very high	81 Å²	81	62.8 Å²	62.8	57%	0.566	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.3	-176	-170.5	0	0	0	0	111.9
703	C	93.8	Very high	92.9	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	122.4	175.2	-163.1	0	0	0	0	109.2	V696 V698 I705 C715 K716	V696-C703 HydrophobicContact CB-CB 3.95Å; V696-C703 HydrophobicContact CG1-CB 3.67Å; V696-C703 PolarHBondContact O-N 3.44Å; V698-C703 HydrophobicContact CG2-CB 4.23Å; C703-I705 PolarHBondContact O-N 3.29Å; C703-I705 VanDerWaalsContact O-N 3.08Å; C703-C715 HydrophobicContact CB-CB 3.85Å; C703-C715 WeakPolarHBondContact CB-SG 3.29Å; C703-C715 VanDerWaalsContact SG-C 3.54Å; C703-C715 WeakPolarHBondContact SG-CB 3.4Å; C703-C715 CovalentContact SG-SG 2.04Å; C703-C715 PolarHBondContact SG-SG 3.02Å; C703-K716 WeakPolarHBondContact CA-O 3.4Å; C703-K716 PolarHBondContact SG-O 3.42Å
704	K	91.6	Very high	93.2	Very high	127 Å²	127	55.9 Å²	55.9	55%	0.552	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	102.1	-174.2	-171.3	178.7	179.5	179.3	0	110.3	Q706 C715 K716	K704-Q706 PolarHBondContact O-N 3.39Å; K704-Q706 PolarHBondContact O-NE2 3.04Å; K704-C715 CarbonylContact O-C 3.57Å; K704-C715 VanDerWaalsContact O-CA 3.32Å; K704-C715 WeakPolarHBondContact O-CA 3.27Å; K704-K716 PolarHBondContact N-O 3Å; K704-K716 VanDerWaalsContact N-O 3.07Å; K704-K716 PolarHBondContact O-N 2.95Å
705	I	92.9	Very high	93.3	Very high	53 Å²	53	54.1 Å²	54.1	27%	0.272	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	133.9	176.3	-52.3	-176.8	0	0	0	109.9	Q694 V696 C703 S707 L708 L713 C715	Q694-I705 HydrophobicContact CB-CD1 4.16Å; V696-I705 HydrophobicContact CG2-CD1 4.49Å; C703-I705 PolarHBondContact O-N 3.29Å; C703-I705 VanDerWaalsContact O-N 3.08Å; I705-S707 WeakPolarHBondContact CG2-O 3.04Å; I705-L708 HydrophobicContact CG2-CB 4.48Å; I705-L713 HydrophobicContact CD1-CD1 4.23Å; I705-L713 HydrophobicContact CD1-CD2 4.35Å; I705-L713 HydrophobicContact CD1-CG 4.49Å; I705-L713 HydrophobicContact CG1-CD2 4.1Å; I705-L713 HydrophobicContact CG2-CD2 4.13Å; I705-L713 HydrophobicContact CG2-CG 4.33Å; I705-C715 HydrophobicContact CG1-CB 4.33Å
706	Q	93.8	Very high	93.3	Very high	91 Å²	91	55.6 Å²	55.6	43%	0.425	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-40.9	177.6	-55.8	-60.7	-91.4	0	0	110.5	M680 K704 I714 K716	M680-Q706 HydrophobicContact SD-CG 4.12Å; K704-Q706 PolarHBondContact O-N 3.39Å; K704-Q706 PolarHBondContact O-NE2 3.04Å; Q706-I714 PolarHBondContact N-O 2.91Å; Q706-K716 HydrophobicContact CG-CG 4.02Å
707	S	93	Very high	93.2	Very high	56 Å²	56	55.8 Å²	55.8	39%	0.392	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.6	173.4	65.7	0	0	0	0	111.3	I705 I714	I705-S707 WeakPolarHBondContact CG2-O 3.04Å; S707-I714 PolarHBondContact N-O 3.09Å; S707-I714 PolarHBondContact O-N 3.09Å; S707-I714 WeakPolarHBondContact OG-CB 3.35Å
708	L	93.1	Very high	93.1	Very high	68 Å²	68	55 Å²	55	36%	0.356	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.3	-177.7	-179.1	65.1	0	0	0	109.5	L688 D689 Q694 I705 L713	L688-L708 HydrophobicContact CB-CD1 4.46Å; D689-L708 HydrophobicContact CB-CG 4.23Å; Q694-L708 HydrophobicContact CB-CD2 4.44Å; Q694-L708 HydrophobicContact CG-CD1 4.4Å; Q694-L708 HydrophobicContact CG-CD2 3.89Å; I705-L708 HydrophobicContact CG2-CB 4.48Å; L708-L713 HydrophobicContact CD1-CB 4.03Å; L708-L713 HydrophobicContact CD1-CD1 3.75Å; L708-L713 HydrophobicContact CD1-CG 3.76Å
709	S	92.4	Very high	92.9	Very high	49 Å²	49	59 Å²	59	34%	0.343	32%	0.32	S	S	.	.			trans	-156.4	166.6	176.2	66.9	0	0	0	0	109.6	S711 M712	S709-S711 PolarHBondContact O-N 2.57Å; S709-S711 VanDerWaalsContact O-N 3.08Å; S709-M712 PolarHBondContact N-O 3.29Å; S709-M712 PolarHBondContact O-N 3.03Å; S709-M712 PolarHBondContact OG-N 3.48Å; S709-M712 VanDerWaalsContact OG-N 3.12Å; S709-M712 PolarHBondContact OG-O 3.1Å
710	F	91.3	Very high	93	Very high	99 Å²	99	59.3 Å²	59.3	43%	0.434	32%	0.317	S	S	.	.	S	Bend	trans	-42.1	-43.8	176.8	176.6	-98.7	0	0	0	115.5	A686 F687 L688 D689	A686-F710 CarbonylContact C-O 3.45Å; A686-F710 HydrophobicContact CB-CZ 4.45Å; F687-F710 HydrophobicContact CB-CE2 4.46Å; F687-F710 HydrophobicContact CD1-CD2 4.32Å; F687-F710 AromaticContact CD1-CE2 3.43Å; F687-F710 HydrophobicContact CD1-CE2 3.43Å; F687-F710 VanDerWaalsContact CD1-CE2 3.43Å; F687-F710 HydrophobicContact CD1-CZ 4.15Å; F687-F710 AromaticContact CE1-CE2 3.67Å; F687-F710 HydrophobicContact CE1-CE2 3.67Å; F687-F710 HydrophobicContact CE1-CZ 4.08Å; F687-F710 AromaticContact CG-CE2 3.92Å; F687-F710 HydrophobicContact CG-CE2 3.92Å; F687-F710 HydrophobicContact CG-CZ 4.44Å; F687-F710 HydrophobicContact CZ-CE2 4.33Å; F687-F710 HydrophobicContact CZ-CZ 4.31Å; F687-F710 PolarHBondContact N-O 2.71Å; L688-F710 PolarHBondContact N-O 2.86Å; D689-F710 VanDerWaalsContact CG-CA 3.45Å; D689-F710 WeakPolarHBondContact OD1-CA 3.4Å; D689-F710 WeakPolarHBondContact OD2-CA 3.28Å; D689-F710 PolarHBondContact OD2-N 2.71Å
711	S	94.4	Very high	92.8	Very high	61 Å²	61	55 Å²	55	43%	0.427	31%	0.309	S	S	.	.	S	Bend	trans	-116.9	-7.2	-172.9	56.9	0	0	0	0	115.1	R684 G685 S709	R684-S711 WeakPolarHBondContact CA-O 3.37Å; G685-S711 PolarHBondContact N-O 2.83Å; G685-S711 VanDerWaalsContact O-CA 3.31Å; G685-S711 WeakPolarHBondContact O-CA 3.49Å; G685-S711 WeakPolarHBondContact O-CB 3.21Å; S709-S711 PolarHBondContact O-N 2.57Å; S709-S711 VanDerWaalsContact O-N 3.08Å
712	M	94.7	Very high	92.5	Very high	62 Å²	62	59.6 Å²	59.6	31%	0.305	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	134.2	-177.4	-165.7	-178.6	-58	0	0	112.5	T682 I683 S709 I714	T682-M712 HydrophobicContact CG2-CG 3.68Å; T682-M712 HydrophobicContact CG2-SD 3.68Å; I683-M712 WeakPolarHBondContact O-CA 3.28Å; S709-M712 PolarHBondContact N-O 3.29Å; S709-M712 PolarHBondContact O-N 3.03Å; S709-M712 PolarHBondContact OG-N 3.48Å; S709-M712 VanDerWaalsContact OG-N 3.12Å; S709-M712 PolarHBondContact OG-O 3.1Å; M712-I714 HydrophobicContact CG-CG1 4.4Å; M712-I714 HydrophobicContact SD-CD1 4.3Å; M712-I714 HydrophobicContact SD-CG1 4.39Å
713	L	95.4	Very high	92.1	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.8	175.7	-175.3	172.6	0	0	0	107.9	I683 L688 V696 I705 L708 C715 L732	I683-L713 HydrophobicContact CB-CB 4.46Å; I683-L713 PolarHBondContact N-O 3Å; I683-L713 PolarHBondContact O-N 2.95Å; L688-L713 HydrophobicContact CD1-CB 4.06Å; V696-L713 HydrophobicContact CG2-CD1 3.68Å; V696-L713 HydrophobicContact CG2-CD2 3.76Å; V696-L713 HydrophobicContact CG2-CG 4.42Å; I705-L713 HydrophobicContact CD1-CD1 4.23Å; I705-L713 HydrophobicContact CD1-CD2 4.35Å; I705-L713 HydrophobicContact CD1-CG 4.49Å; I705-L713 HydrophobicContact CG1-CD2 4.1Å; I705-L713 HydrophobicContact CG2-CD2 4.13Å; I705-L713 HydrophobicContact CG2-CG 4.33Å; L708-L713 HydrophobicContact CD1-CB 4.03Å; L708-L713 HydrophobicContact CD1-CD1 3.75Å; L708-L713 HydrophobicContact CD1-CG 3.76Å; L713-C715 HydrophobicContact CD2-CB 4.1Å; L713-L732 HydrophobicContact CD1-CD1 3.96Å
714	I	95.4	Very high	91.8	Very high	42 Å²	42	61.1 Å²	61.1	22%	0.215	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.8	177	-53.1	179.9	0	0	0	109.1	M680 L681 T682 Q706 S707 M712	M680-I714 HydrophobicContact CB-CG2 4.41Å; M680-I714 HydrophobicContact SD-CG2 4.44Å; L681-I714 WeakPolarHBondContact O-CA 3.4Å; T682-I714 HydrophobicContact CG2-CG1 4.26Å; Q706-I714 PolarHBondContact N-O 2.91Å; S707-I714 PolarHBondContact N-O 3.09Å; S707-I714 PolarHBondContact O-N 3.09Å; S707-I714 WeakPolarHBondContact OG-CB 3.35Å; M712-I714 HydrophobicContact CG-CG1 4.4Å; M712-I714 HydrophobicContact SD-CD1 4.3Å; M712-I714 HydrophobicContact SD-CG1 4.39Å
715	C	95.1	Very high	91.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.6	177.1	72.7	0	0	0	0	112.4	L681 C703 K704 I705 L713	L681-C715 PolarHBondContact N-O 2.97Å; L681-C715 PolarHBondContact O-N 2.93Å; C703-C715 HydrophobicContact CB-CB 3.85Å; C703-C715 WeakPolarHBondContact CB-SG 3.29Å; C703-C715 VanDerWaalsContact SG-C 3.54Å; C703-C715 WeakPolarHBondContact SG-CB 3.4Å; C703-C715 CovalentContact SG-SG 2.04Å; C703-C715 PolarHBondContact SG-SG 3.02Å; K704-C715 CarbonylContact O-C 3.57Å; K704-C715 VanDerWaalsContact O-CA 3.32Å; K704-C715 WeakPolarHBondContact O-CA 3.27Å; I705-C715 HydrophobicContact CG1-CB 4.33Å; L713-C715 HydrophobicContact CD2-CB 4.1Å
716	K	93.2	Very high	91.7	Very high	71 Å²	71	58.6 Å²	58.6	31%	0.309	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125	173.2	-74.3	-171.4	175.5	-166.4	0	111.1	T679 M680 C703 K704 Q706	T679-K716 WeakPolarHBondContact O-CA 3.18Å; M680-K716 VanDerWaalsContact CE-CE 3.43Å; M680-K716 HydrophobicContact CE-CG 4.49Å; M680-K716 HydrophobicContact SD-CD 4.32Å; M680-K716 HydrophobicContact SD-CG 3.62Å; C703-K716 WeakPolarHBondContact CA-O 3.4Å; C703-K716 PolarHBondContact SG-O 3.42Å; K704-K716 PolarHBondContact N-O 3Å; K704-K716 VanDerWaalsContact N-O 3.07Å; K704-K716 PolarHBondContact O-N 2.95Å; Q706-K716 HydrophobicContact CG-CG 4.02Å
717	T	92.8	Very high	91.7	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.025	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-62.2	139.6	178	57.3	0	0	0	0	111.3	G677 N678 T679 L681 F745	G677-T717 WeakPolarHBondContact CA-OG1 3.15Å; N678-T717 PolarHBondContact N-O 2.9Å; N678-T717 PolarHBondContact N-OG1 3.16Å; T679-T717 VanDerWaalsContact CB-OG1 3.25Å; T679-T717 WeakPolarHBondContact CB-OG1 3.15Å; T679-T717 PolarHBondContact N-OG1 3.04Å; T679-T717 PolarHBondContact O-N 3.13Å; T679-T717 PolarHBondContact OG1-OG1 3.46Å; L681-T717 HydrophobicContact CB-CG2 3.9Å; L681-T717 HydrophobicContact CD2-CG2 4.3Å; T717-F745 HydrophobicContact CG2-CD1 4.47Å; T717-F745 HydrophobicContact CG2-CE1 4.01Å; T717-F745 HydrophobicContact CG2-CE2 4.12Å; T717-F745 HydrophobicContact CG2-CZ 3.81Å
718	P	93.3	Very high	91.7	Very high	14 Å²	14	59.9 Å²	59.9	9%	0.091	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-72.2	160.6	173.3	29.9	-33	0	0	0	111.1	V698 A701 Y747	V698-P718 HydrophobicContact CB-CG 4.31Å; A701-P718 HydrophobicContact CB-CB 3.64Å; A701-P718 HydrophobicContact CB-CG 3.44Å; A701-P718 VanDerWaalsContact CB-CG 3.44Å; P718-Y747 WeakPolarHBondContact CD-OH 3.3Å; P718-Y747 VanDerWaalsContact O-CE1 3.28Å; P718-Y747 WeakPolarHBondContact O-CE1 3.45Å; P718-Y747 PolarHBondContact O-OH 3.21Å
719	P	91.6	Very high	91.9	Very high	88 Å²	88	59.1 Å²	59.1	57%	0.571	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-67.4	150.7	169.8	29.6	-35.3	0	0	0	111.7	K675	K675-P719 CarbonylContact O-C 3.59Å; K675-P719 WeakPolarHBondContact O-CA 3.3Å
720	H	91.4	Very high	92.1	Very high	26 Å²	26	56.8 Å²	56.8	12%	0.12	32%	0.322	C	S	.	.			trans	-115.2	130.3	-179.1	-166.7	72.7	0	0	0	111.2	K675 H722 S726 Q728 Y747	K675-H720 PolarHBondContact O-N 2.86Å; H720-H722 AromaticContact CE1-CD2 3.93Å; H720-H722 AromaticContact NE2-CD2 3.99Å; H720-S726 PolarHBondContact CE1-OG 3.01Å; H720-S726 WeakPolarHBondContact NE2-CB 3.4Å; H720-S726 PolarHBondContact NE2-OG 2.94Å; H720-Q728 PolarHBondContact CE1-NE2 2.95Å; H720-Y747 HydrophobicContact CB-CD1 3.81Å; H720-Y747 HydrophobicContact CB-CD2 3.88Å; H720-Y747 HydrophobicContact CB-CE1 3.97Å; H720-Y747 HydrophobicContact CB-CE2 4.07Å; H720-Y747 HydrophobicContact CB-CG 3.72Å; H720-Y747 AromaticContact CG-CD2 3.82Å; H720-Y747 AromaticContact ND1-CD2 3.92Å
721	T	84.6	Confident	92.2	Very high	124 Å²	124	54.8 Å²	54.8	76%	0.761	31%	0.313	S	S	*	.			trans	-106.3	3.7	-169.2	55.2	0	0	0	0	114.9
722	H	84.8	Confident	92.3	Very high	132 Å²	132	51.9 Å²	51.9	61%	0.611	29%	0.293	S	S	*	.	S	Bend	trans	-105.4	171.1	177.3	-56.5	-78.1	0	0	0	111.1	H720	H720-H722 AromaticContact CE1-CD2 3.93Å; H720-H722 AromaticContact NE2-CD2 3.99Å
723	A	85.8	Confident	92.2	Very high	91 Å²	91	50.3 Å²	50.3	75%	0.752	29%	0.287	S	S	*	.			trans	-58.8	147.5	174.7	0	0	0	0	0	111.4
724	V	88.1	Confident	92	Very high	26 Å²	26	50.3 Å²	50.3	16%	0.158	29%	0.287	C	S	.	.	S	Bend	trans	-125.2	155.8	-177.4	-74.8	0	0	0	0	110.7	K675 Y747 E749	K675-V724 HydrophobicContact CB-CG1 3.97Å; K675-V724 HydrophobicContact CB-CG2 4.43Å; K675-V724 HydrophobicContact CD-CG2 3.85Å; V724-Y747 WeakPolarHBondContact CB-O 3.27Å; V724-Y747 WeakPolarHBondContact CG1-O 3.27Å; V724-E749 HydrophobicContact CG2-CB 4.43Å; V724-E749 HydrophobicContact CG2-CG 3.75Å; V724-E749 VanDerWaalsContact CG2-OE1 3.26Å; V724-E749 WeakPolarHBondContact CG2-OE1 3.33Å
725	P	88.4	Confident	91.6	Very high	109 Å²	109	50.2 Å²	50.2	71%	0.708	29%	0.286	S	S	*	.	S	Bend	cis	-65	140	4.6	27.1	-35.3	0	0	0	113.8	T746 Y747	P725-T746 HydrophobicContact CB-CG2 4.29Å; P725-Y747 CarbonylContact C-O 3.48Å; P725-Y747 VanDerWaalsContact CA-O 3.26Å; P725-Y747 WeakPolarHBondContact CA-O 3.25Å
726	S	92.3	Very high	91.2	Very high	17 Å²	17	53.6 Å²	53.6	12%	0.119	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	112.9	-173.9	179.3	0	0	0	0	111.3	H720 Q728 T746 Y747	H720-S726 PolarHBondContact CE1-OG 3.01Å; H720-S726 WeakPolarHBondContact NE2-CB 3.4Å; H720-S726 PolarHBondContact NE2-OG 2.94Å; S726-Q728 PolarHBondContact OG-NE2 2.8Å; S726-T746 WeakPolarHBondContact O-CA 3.48Å; S726-Y747 PolarHBondContact N-O 2.81Å; S726-Y747 PolarHBondContact O-N 2.82Å
727	E	93.9	Very high	91	Very high	134 Å²	134	51.3 Å²	51.3	63%	0.626	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.7	176	-58	-162.5	152.4	0	0	110.9	P744 T746	E727-P744 HydrophobicContact CB-CB 4.12Å; E727-P744 HydrophobicContact CB-CG 4.16Å; E727-P744 HydrophobicContact CG-CG 4.47Å; E727-T746 HydrophobicContact CG-CG2 4.22Å
728	Q	94.8	Very high	90.9	Very high	40 Å²	40	56 Å²	56	19%	0.187	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.1	-178.4	-64.2	-60.4	-47.9	0	0	110.5	V698 H720 S726 V730 F745 Y747	V698-Q728 HydrophobicContact CG1-CB 3.79Å; H720-Q728 PolarHBondContact CE1-NE2 2.95Å; S726-Q728 PolarHBondContact OG-NE2 2.8Å; Q728-V730 PolarHBondContact O-N 3.04Å; Q728-F745 PolarHBondContact N-O 2.88Å; Q728-F745 PolarHBondContact O-N 2.92Å; Q728-Y747 HydrophobicContact CB-CD2 4.36Å; Q728-Y747 HydrophobicContact CB-CE2 4.16Å; Q728-Y747 HydrophobicContact CG-CD2 3.78Å; Q728-Y747 HydrophobicContact CG-CE2 3.85Å
729	P	95.4	Very high	90.9	Very high	52 Å²	52	59.3 Å²	59.3	34%	0.338	34%	0.335	S	S	.	.			trans	-67.4	132.7	179.9	27.3	-34.7	0	0	0	110.7	G699	G699-P729 PolarHBondContact N-O 2.96Å
730	V	96.5	Very high	91.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.9	172.4	-176.1	0	0	0	0	108.9	I668 L681 I683 V696 T697 V698 Q728 A741 F745	I668-V730 HydrophobicContact CD1-CB 4.32Å; I668-V730 HydrophobicContact CD1-CG2 3.69Å; L681-V730 HydrophobicContact CD2-CG1 4.07Å; L681-V730 HydrophobicContact CD2-CG2 4.06Å; I683-V730 HydrophobicContact CD1-CG1 3.77Å; V696-V730 HydrophobicContact CG1-CG1 4.15Å; T697-V730 WeakPolarHBondContact O-CA 3.43Å; V698-V730 HydrophobicContact CG1-CG2 4.46Å; V698-V730 HydrophobicContact CG2-CG2 4.33Å; Q728-V730 PolarHBondContact O-N 3.04Å; V730-A741 HydrophobicContact CB-CB 3.92Å; V730-A741 HydrophobicContact CG1-CB 4.48Å; V730-A741 PolarHBondContact O-N 3.12Å; V730-F745 HydrophobicContact CG2-CB 3.74Å
731	K	95.4	Very high	91.2	Very high	57 Å²	57	60 Å²	60	25%	0.248	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.9	176.3	-68.8	-177	167	-164	0	111.2	V696 T697 E738 R739 Q740	V696-K731 CarbonylContact C-O 3.58Å; V696-K731 VanDerWaalsContact CA-O 3.29Å; V696-K731 WeakPolarHBondContact CA-O 3.44Å; T697-K731 PolarHBondContact N-O 2.91Å; T697-K731 PolarHBondContact O-N 2.89Å; K731-E738 WeakPolarHBondContact CD-OE2 3.28Å; K731-E738 IonicContact NZ-OE2 2.65Å; K731-E738 PolarHBondContact NZ-OE2 2.87Å; K731-R739 CarbonylContact C-O 3.39Å; K731-R739 WeakPolarHBondContact CA-O 3.45Å; K731-Q740 HydrophobicContact CG-CB 4.24Å; K731-Q740 HydrophobicContact CG-CG 4.1Å
732	L	94.6	Very high	91.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.7	165.2	172.5	60.9	0	0	0	108.4	I665 L688 Q694 V696 L713 V734 E738 R739	I665-L732 HydrophobicContact CD1-CB 3.9Å; L688-L732 HydrophobicContact CD2-CD2 3.78Å; Q694-L732 HydrophobicContact CB-CD1 4.2Å; V696-L732 HydrophobicContact CG2-CD1 3.85Å; L713-L732 HydrophobicContact CD1-CD1 3.96Å; L732-V734 HydrophobicContact CD1-CG2 4.08Å; L732-V734 HydrophobicContact CD2-CG2 4.01Å; L732-V734 HydrophobicContact CG-CG2 3.84Å; L732-E738 CarbonylContact O-C 3.55Å; L732-R739 PolarHBondContact N-O 3.2Å; L732-R739 PolarHBondContact O-N 2.78Å
733	T	93.1	Very high	92.2	Very high	30 Å²	30	55.2 Å²	55.2	18%	0.184	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.8	167.2	-47.5	0	0	0	0	108.3	V695 V737 E738	V695-T733 PolarHBondContact N-O 2.82Å; V695-T733 PolarHBondContact O-N 3.04Å; T733-V737 CarbonylContact C-O 3.6Å; T733-V737 WeakPolarHBondContact CA-O 3.41Å; T733-E738 HydrophobicContact CG2-CG 4.18Å
734	V	90.8	Very high	92.6	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.2	172	-178	0	0	0	0	108.7	P577 P663 T690 Q694 L732 S736 V737	P577-V734 HydrophobicContact CG-CB 4.4Å; P577-V734 HydrophobicContact CG-CG1 3.98Å; P663-V734 HydrophobicContact CB-CG2 4.14Å; P663-V734 HydrophobicContact CG-CB 4.17Å; P663-V734 HydrophobicContact CG-CG2 3.88Å; T690-V734 HydrophobicContact CG2-CG1 3.89Å; T690-V734 WeakPolarHBondContact O-CG1 3.5Å; Q694-V734 HydrophobicContact CG-CG2 4.49Å; L732-V734 HydrophobicContact CD1-CG2 4.08Å; L732-V734 HydrophobicContact CD2-CG2 4.01Å; L732-V734 HydrophobicContact CG-CG2 3.84Å; V734-S736 PolarHBondContact O-N 2.87Å; V734-V737 PolarHBondContact N-O 3.06Å; V734-V737 PolarHBondContact O-N 2.82Å
735	D	88.1	Confident	93	Very high	39 Å²	39	51.7 Å²	51.7	21%	0.209	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	-92.1	-169.9	-56.8	-31.4	0	0	0	112.6	G580 T582 G691 N692 K693	G580-D735 WeakPolarHBondContact O-CB 3.5Å; T582-D735 WeakPolarHBondContact CA-OD2 3.44Å; T582-D735 VanDerWaalsContact CB-OD2 3.31Å; T582-D735 WeakPolarHBondContact CB-OD2 3.43Å; T582-D735 WeakPolarHBondContact CG2-OD2 3.49Å; T582-D735 PolarHBondContact OG1-OD2 3.34Å; G691-D735 WeakPolarHBondContact CA-OD2 3.28Å; N692-D735 WeakPolarHBondContact CA-OD1 3.37Å; N692-D735 WeakPolarHBondContact CB-OD1 3.5Å; N692-D735 PolarHBondContact N-OD1 2.97Å; N692-D735 PolarHBondContact N-OD2 3.32Å; N692-D735 VanDerWaalsContact N-OD2 3.09Å; K693-D735 PolarHBondContact N-OD1 2.86Å; K693-D735 PolarHBondContact O-N 2.89Å
736	S	86.2	Confident	93.3	Very high	72 Å²	72	47.9 Å²	47.9	50%	0.503	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	4	176.4	-43.5	0	0	0	0	114.7	G580 S581 V734	G580-S736 WeakPolarHBondContact O-CB 3.4Å; G580-S736 PolarHBondContact O-N 3.17Å; G580-S736 PolarHBondContact O-OG 2.92Å; S581-S736 WeakPolarHBondContact CB-OG 3.46Å; S581-S736 PolarHBondContact OG-OG 3.48Å; S581-S736 VanDerWaalsContact OG-OG 3.12Å; V734-S736 PolarHBondContact O-N 2.87Å
737	V	88.9	Confident	93.3	Very high	22 Å²	22	47.2 Å²	47.2	13%	0.133	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.5	-175	173.5	0	0	0	0	110.2	P577 T733 V734	P577-V737 HydrophobicContact CB-CB 4.4Å; P577-V737 HydrophobicContact CB-CG2 4.05Å; P577-V737 HydrophobicContact CG-CB 4.34Å; P577-V737 HydrophobicContact CG-CG2 4.16Å; T733-V737 CarbonylContact C-O 3.6Å; T733-V737 WeakPolarHBondContact CA-O 3.41Å; V734-V737 PolarHBondContact N-O 3.06Å; V734-V737 PolarHBondContact O-N 2.82Å
738	E	91.9	Very high	93.2	Very high	104 Å²	104	42.6 Å²	42.6	49%	0.486	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	142.9	172.9	-69.1	-170.1	-168.1	0	0	112.6	K731 L732 T733	K731-E738 WeakPolarHBondContact CD-OE2 3.28Å; K731-E738 IonicContact NZ-OE2 2.65Å; K731-E738 PolarHBondContact NZ-OE2 2.87Å; L732-E738 CarbonylContact O-C 3.55Å; T733-E738 HydrophobicContact CG2-CG 4.18Å
739	R	93.1	Very high	93.1	Very high	83 Å²	83	43.6 Å²	43.6	31%	0.313	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.6	172	-64.6	-73.5	169.3	-109.2	19.8	108.3	D662 P663 I665 K731 L732	D662-R739 IonicContact OD1-CZ 2.85Å; D662-R739 IonicContact OD1-NE 2.69Å; D662-R739 PolarHBondContact OD1-NE 3.45Å; D662-R739 IonicContact OD1-NH2 3.66Å; D662-R739 PolarHBondContact OD1-NH2 2.82Å; D662-R739 IonicContact OD2-CZ 2.7Å; D662-R739 IonicContact OD2-NE 2.71Å; D662-R739 IonicContact OD2-NH2 2.67Å; D662-R739 PolarHBondContact OD2-NH2 3.48Å; P663-R739 HydrophobicContact CG-CG 4.18Å; P663-R739 WeakPolarHBondContact O-CD 3.3Å; P663-R739 VanDerWaalsContact O-CG 3.26Å; P663-R739 WeakPolarHBondContact O-CG 3.41Å; P663-R739 PolarHBondContact O-NE 3.09Å; I665-R739 HydrophobicContact CD1-CB 4.46Å; K731-R739 CarbonylContact C-O 3.39Å; K731-R739 WeakPolarHBondContact CA-O 3.45Å; L732-R739 PolarHBondContact N-O 3.2Å; L732-R739 PolarHBondContact O-N 2.78Å
740	Q	94.4	Very high	92.9	Very high	121 Å²	121	41.9 Å²	41.9	57%	0.565	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102	142.2	179.9	-170.4	168.6	-54.6	0	0	110.1	K731	K731-Q740 HydrophobicContact CG-CB 4.24Å; K731-Q740 HydrophobicContact CG-CG 4.1Å
741	A	94.8	Very high	92.6	Very high	8 Å²	8	41.9 Å²	41.9	7%	0.066	23%	0.225	C	C	.	.			trans	-68.2	149.5	174.2	0	0	0	0	0	111.1	I665 I668 V730 V743	I665-A741 HydrophobicContact CD1-CB 4.3Å; I665-A741 HydrophobicContact CG2-CB 3.99Å; I668-A741 HydrophobicContact CG2-CB 3.86Å; V730-A741 HydrophobicContact CB-CB 3.92Å; V730-A741 HydrophobicContact CG1-CB 4.48Å; V730-A741 PolarHBondContact O-N 3.12Å; A741-V743 PolarHBondContact O-N 2.92Å
742	P	94.2	Very high	92.4	Very high	90 Å²	90	42.7 Å²	42.7	58%	0.584	23%	0.234	S	C	*	.	S	Bend	trans	-71.9	-14.3	-179	28.3	-34.8	0	0	0	114.1	N666	N666-P742 WeakPolarHBondContact O-CG 3.25Å
743	V	94.6	Very high	92.2	Very high	64 Å²	64	43 Å²	43	39%	0.388	24%	0.236	S	C	.	.	S	Bend	trans	-133	148.3	175	-61.8	0	0	0	0	110.3	I668 T671 A741	I668-V743 HydrophobicContact CD1-CG2 4.06Å; I668-V743 WeakPolarHBondContact CD1-O 3.41Å; I668-V743 HydrophobicContact CG1-CG2 3.72Å; T671-V743 HydrophobicContact CG2-CG2 4.02Å; A741-V743 PolarHBondContact O-N 2.92Å
744	P	95.3	Very high	92	Very high	44 Å²	44	45.1 Å²	45.1	29%	0.286	25%	0.252	S	S	.	.			trans	-74.9	170.9	174.3	33.4	-35.9	0	0	0	111.9	E727	E727-P744 HydrophobicContact CB-CB 4.12Å; E727-P744 HydrophobicContact CB-CG 4.16Å; E727-P744 HydrophobicContact CG-CG 4.47Å
745	F	95.4	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129	166.8	-179.3	-90	0	0	0	109.8	I668 T671 F672 T679 L681 V698 T717 Q728 V730 Y747	I668-F745 HydrophobicContact CD1-CB 4.4Å; T671-F745 CarbonylContact O-C 3.57Å; T671-F745 WeakPolarHBondContact O-CA 3.33Å; F672-F745 VanDerWaalsContact C-CE2 3.42Å; F672-F745 VanDerWaalsContact O-CE2 3.3Å; F672-F745 WeakPolarHBondContact O-CE2 3.39Å; F672-F745 WeakPolarHBondContact O-CZ 3.14Å; T679-F745 HydrophobicContact CG2-CE2 4.08Å; T679-F745 HydrophobicContact CG2-CZ 4.01Å; L681-F745 HydrophobicContact CD1-CD2 3.85Å; L681-F745 HydrophobicContact CD1-CE2 4.23Å; V698-F745 HydrophobicContact CG1-CB 4.2Å; V698-F745 HydrophobicContact CG1-CD1 4.27Å; T717-F745 HydrophobicContact CG2-CD1 4.47Å; T717-F745 HydrophobicContact CG2-CE1 4.01Å; T717-F745 HydrophobicContact CG2-CE2 4.12Å; T717-F745 HydrophobicContact CG2-CZ 3.81Å; Q728-F745 PolarHBondContact N-O 2.88Å; Q728-F745 PolarHBondContact O-N 2.92Å; V730-F745 HydrophobicContact CG2-CB 3.74Å; F745-Y747 HydrophobicContact CD1-CD1 4.45Å; F745-Y747 HydrophobicContact CD1-CD2 4.08Å; F745-Y747 HydrophobicContact CD1-CE1 4.37Å; F745-Y747 AromaticContact CD1-CE2 3.94Å; F745-Y747 HydrophobicContact CD1-CE2 3.94Å; F745-Y747 HydrophobicContact CD1-CG 4.36Å; F745-Y747 AromaticContact CE1-CD1 3.87Å; F745-Y747 HydrophobicContact CE1-CD1 3.87Å; F745-Y747 HydrophobicContact CE1-CD2 4.31Å; F745-Y747 AromaticContact CE1-CE1 3.84Å; F745-Y747 HydrophobicContact CE1-CE1 3.84Å; F745-Y747 HydrophobicContact CE1-CE2 4.24Å; F745-Y747 HydrophobicContact CE1-CG 4.16Å
746	T	94.8	Very high	92.2	Very high	29 Å²	29	45.5 Å²	45.5	18%	0.178	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	112	-174.5	-50.9	0	0	0	0	111.5	T671 F672 G673 P725 S726 E727	T671-T746 PolarHBondContact O-N 2.72Å; F672-T746 CarbonylContact C-O 3.45Å; F672-T746 WeakPolarHBondContact CA-O 3.4Å; F672-T746 WeakPolarHBondContact CB-O 3.45Å; G673-T746 PolarHBondContact N-O 3.14Å; G673-T746 VanDerWaalsContact N-O 3.08Å; P725-T746 HydrophobicContact CB-CG2 4.29Å; S726-T746 WeakPolarHBondContact O-CA 3.48Å; E727-T746 HydrophobicContact CG-CG2 4.22Å
747	Y	93.6	Very high	92.4	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.3	170.9	-70.9	-82.3	0	0	0	110.4	G673 V698 P718 H720 V724 P725 S726 Q728 F745	G673-Y747 CarbonylContact O-C 3.51Å; G673-Y747 WeakPolarHBondContact O-CA 3.3Å; V698-Y747 HydrophobicContact CG1-CE2 3.77Å; P718-Y747 WeakPolarHBondContact CD-OH 3.3Å; P718-Y747 VanDerWaalsContact O-CE1 3.28Å; P718-Y747 WeakPolarHBondContact O-CE1 3.45Å; P718-Y747 PolarHBondContact O-OH 3.21Å; H720-Y747 HydrophobicContact CB-CD1 3.81Å; H720-Y747 HydrophobicContact CB-CD2 3.88Å; H720-Y747 HydrophobicContact CB-CE1 3.97Å; H720-Y747 HydrophobicContact CB-CE2 4.07Å; H720-Y747 HydrophobicContact CB-CG 3.72Å; H720-Y747 AromaticContact CG-CD2 3.82Å; H720-Y747 AromaticContact ND1-CD2 3.92Å; V724-Y747 WeakPolarHBondContact CB-O 3.27Å; V724-Y747 WeakPolarHBondContact CG1-O 3.27Å; P725-Y747 CarbonylContact C-O 3.48Å; P725-Y747 VanDerWaalsContact CA-O 3.26Å; P725-Y747 WeakPolarHBondContact CA-O 3.25Å; S726-Y747 PolarHBondContact N-O 2.81Å; S726-Y747 PolarHBondContact O-N 2.82Å; Q728-Y747 HydrophobicContact CB-CD2 4.36Å; Q728-Y747 HydrophobicContact CB-CE2 4.16Å; Q728-Y747 HydrophobicContact CG-CD2 3.78Å; Q728-Y747 HydrophobicContact CG-CE2 3.85Å; F745-Y747 HydrophobicContact CD1-CD1 4.45Å; F745-Y747 HydrophobicContact CD1-CD2 4.08Å; F745-Y747 HydrophobicContact CD1-CE1 4.37Å; F745-Y747 AromaticContact CD1-CE2 3.94Å; F745-Y747 HydrophobicContact CD1-CE2 3.94Å; F745-Y747 HydrophobicContact CD1-CG 4.36Å; F745-Y747 AromaticContact CE1-CD1 3.87Å; F745-Y747 HydrophobicContact CE1-CD1 3.87Å; F745-Y747 HydrophobicContact CE1-CD2 4.31Å; F745-Y747 AromaticContact CE1-CE1 3.84Å; F745-Y747 HydrophobicContact CE1-CE1 3.84Å; F745-Y747 HydrophobicContact CE1-CE2 4.24Å; F745-Y747 HydrophobicContact CE1-CG 4.16Å
748	N	92.5	Very high	92.4	Very high	37 Å²	37	46.5 Å²	46.5	20%	0.198	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	170.9	178.1	-66.7	-30.5	0	0	0	111.1	G673 K675 S778	G673-N748 PolarHBondContact O-N 2.96Å; K675-N748 WeakPolarHBondContact CB-O 3.39Å; K675-N748 PolarHBondContact N-O 2.84Å; N748-S778 WeakPolarHBondContact CB-OG 3.25Å
749	E	91.7	Very high	92.4	Very high	61 Å²	61	45.9 Å²	45.9	29%	0.285	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-62.1	149	173.5	-90.1	-57.2	154.8	0	0	112.7	K675 V724 Y775 S778	K675-E749 VanDerWaalsContact CE-OE2 3.22Å; K675-E749 WeakPolarHBondContact CE-OE2 3.33Å; K675-E749 IonicContact NZ-OE1 2.92Å; K675-E749 PolarHBondContact NZ-OE1 3.46Å; K675-E749 IonicContact NZ-OE2 2.76Å; K675-E749 PolarHBondContact NZ-OE2 2.79Å; V724-E749 HydrophobicContact CG2-CB 4.43Å; V724-E749 HydrophobicContact CG2-CG 3.75Å; V724-E749 VanDerWaalsContact CG2-OE1 3.26Å; V724-E749 WeakPolarHBondContact CG2-OE1 3.33Å; E749-Y775 HydrophobicContact CB-CD1 3.92Å; E749-Y775 HydrophobicContact CB-CD2 3.8Å; E749-Y775 HydrophobicContact CB-CE1 4.21Å; E749-Y775 HydrophobicContact CB-CE2 4.08Å; E749-Y775 HydrophobicContact CB-CG 3.71Å; E749-Y775 HydrophobicContact CG-CE2 4.38Å; E749-S778 WeakPolarHBondContact O-CB 3.28Å; E749-S778 PolarHBondContact O-OG 2.77Å
750	D	90.6	Very high	92.3	Very high	16 Å²	16	46.5 Å²	46.5	9%	0.086	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-71.6	138.7	-177.6	-68.3	-39.6	0	0	0	110.9	P674 K675 S676 Y835	P674-D750 VanDerWaalsContact CB-OD1 3.27Å; P674-D750 WeakPolarHBondContact CB-OD1 3.47Å; K675-D750 WeakPolarHBondContact CE-OD2 3.35Å; K675-D750 WeakPolarHBondContact CG-OD1 3.31Å; K675-D750 VanDerWaalsContact CG-OD2 3.23Å; K675-D750 WeakPolarHBondContact CG-OD2 3.38Å; K675-D750 PolarHBondContact N-OD1 2.76Å; K675-D750 VanDerWaalsContact N-OD1 3.13Å; S676-D750 WeakPolarHBondContact CB-OD1 3.03Å; S676-D750 PolarHBondContact N-OD1 2.87Å; S676-D750 PolarHBondContact OG-OD1 3.04Å; S676-D750 PolarHBondContact OG-OD2 3.01Å; D750-Y835 HydrophobicContact CB-CE1 4.31Å; D750-Y835 HydrophobicContact CB-CE2 4.06Å
751	P	91.2	Very high	92.2	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-71.8	131.5	-176.9	27.8	-33.8	0	0	0	112.1	L776 L832 Y835	P751-L776 HydrophobicContact CB-CD2 4.07Å; P751-L832 HydrophobicContact CB-CD1 4.26Å; P751-L832 HydrophobicContact CB-CD2 3.89Å; P751-L832 HydrophobicContact CG-CB 3.95Å; P751-L832 HydrophobicContact CG-CD1 4.02Å; P751-L832 HydrophobicContact CG-CD2 4.01Å; P751-L832 HydrophobicContact CG-CG 4.22Å; P751-Y835 HydrophobicContact CG-CD1 3.62Å; P751-Y835 HydrophobicContact CG-CE1 4.02Å; P751-Y835 WeakPolarHBondContact O-CE1 3.43Å
752	V	89.9	Confident	92	Very high	73 Å²	73	40.5 Å²	40.5	44%	0.442	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.2	-175.8	-179.7	0	0	0	0	110.5	G773 S774	V752-G773 CarbonylContact O-C 3.57Å; V752-G773 WeakPolarHBondContact O-CA 3.3Å; V752-S774 PolarHBondContact N-O 2.74Å; V752-S774 PolarHBondContact O-N 3.04Å
753	I	91.4	Very high	91.7	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.2	176.2	-58	-73.4	0	0	0	109.1	I756 A771 Q772 L776 I808 F830 T837 K840	I753-I756 HydrophobicContact CG2-CG2 4.09Å; I753-A771 HydrophobicContact CD1-CB 4.09Å; I753-A771 HydrophobicContact CG2-CB 4.21Å; I753-Q772 CarbonylContact C-O 3.59Å; I753-L776 HydrophobicContact CD1-CD1 4.29Å; I753-L776 HydrophobicContact CD1-CD2 3.63Å; I753-L776 HydrophobicContact CG1-CD2 4.48Å; I753-I808 HydrophobicContact CD1-CD1 4.24Å; I753-F830 HydrophobicContact CD1-CD2 4.05Å; I753-F830 HydrophobicContact CD1-CG 4.2Å; I753-F830 HydrophobicContact CG1-CB 4.43Å; I753-F830 HydrophobicContact CG1-CD2 3.76Å; I753-F830 HydrophobicContact CG1-CE2 4.42Å; I753-F830 HydrophobicContact CG1-CG 4.25Å; I753-F830 HydrophobicContact CG2-CD2 4.35Å; I753-F830 HydrophobicContact CG2-CE2 4.2Å; I753-T837 HydrophobicContact CG1-CG2 3.83Å; I753-K840 WeakPolarHBondContact O-CE 3.49Å; I753-K840 PolarHBondContact O-NZ 3.34Å
754	S	89.4	Confident	91.4	Very high	76 Å²	76	34.3 Å²	34.3	53%	0.531	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-55.5	178.7	61.8	0	0	0	0	110.6	Q772 K840	S754-Q772 PolarHBondContact N-O 3.41Å; S754-Q772 PolarHBondContact OG-O 2.94Å; S754-Q772 VanDerWaalsContact OG-O 3.1Å; S754-K840 PolarHBondContact O-NZ 3.38Å
755	S	90.5	Very high	91	Very high	41 Å²	41	32.2 Å²	32.2	29%	0.287	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	160.4	-178.2	65	0	0	0	0	112.6	A771 Q772	S755-A771 WeakPolarHBondContact O-CA 3.15Å; S755-Q772 PolarHBondContact N-O 2.79Å; S755-Q772 PolarHBondContact O-N 3.49Å
756	I	92.2	Very high	90.5	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.6	167.4	64.6	173	0	0	0	108.3	I753 L759 V769 A771 F830 K840 L842	I753-I756 HydrophobicContact CG2-CG2 4.09Å; I756-L759 HydrophobicContact CG1-CD2 3.98Å; I756-V769 HydrophobicContact CB-CG1 3.96Å; I756-A771 HydrophobicContact CG2-CB 3.79Å; I756-F830 HydrophobicContact CG2-CE2 3.83Å; I756-F830 HydrophobicContact CG2-CZ 3.94Å; I756-K840 HydrophobicContact CD1-CB 3.82Å; I756-K840 HydrophobicContact CG1-CB 4.21Å; I756-K840 HydrophobicContact CG2-CG 4.34Å; I756-L842 HydrophobicContact CD1-CB 4.35Å
757	Q	89.2	Confident	90.2	Very high	108 Å²	108	31.5 Å²	31.5	51%	0.505	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.5	174.3	-62.8	-171.4	24.5	0	0	110.9	S770	Q757-S770 PolarHBondContact N-O 3.29Å; Q757-S770 PolarHBondContact O-N 3.23Å
758	P	90.6	Very high	90	Very high	8 Å²	8	34.5 Å²	34.5	5%	0.052	19%	0.19	C	C	.	.			cis	-72.3	166.2	-8.3	30.3	-33.2	0	0	0	112.8	R760 C767 E874 K877 C878	P758-R760 VanDerWaalsContact C-N 3.32Å; P758-C767 VanDerWaalsContact CG-SG 3.6Å; P758-E874 WeakPolarHBondContact CA-OE1 3.08Å; P758-E874 HydrophobicContact CB-CG 4.36Å; P758-E874 WeakPolarHBondContact CB-O 3.26Å; P758-E874 WeakPolarHBondContact CB-OE1 3.24Å; P758-K877 HydrophobicContact CB-CB 4.05Å; P758-K877 HydrophobicContact CB-CD 4.34Å; P758-K877 HydrophobicContact CG-CB 4.4Å; P758-C878 WeakPolarHBondContact CG-SG 3.3Å
759	L	90.9	Very high	89.9	Confident	91 Å²	91	32.7 Å²	32.7	48%	0.476	18%	0.18	S	C	.	.	S	Bend	trans	-85.7	-1.2	178.7	-69.5	170.5	0	0	0	113.9	I756 I843 E874	I756-L759 HydrophobicContact CG1-CD2 3.98Å; L759-I843 PolarHBondContact O-N 3.32Å; L759-E874 HydrophobicContact CB-CG 4.23Å; L759-E874 PolarHBondContact N-OE1 3.19Å
760	R	91.1	Very high	89.9	Confident	96 Å²	96	31.3 Å²	31.3	36%	0.362	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.6	176.7	-59	-167.7	176.9	175.7	-1.7	111.7	P758 I843 D872 E874 A875	P758-R760 VanDerWaalsContact C-N 3.32Å; R760-I843 CarbonylContact C-O 3.52Å; R760-I843 WeakPolarHBondContact CA-O 3.42Å; R760-I843 HydrophobicContact CG-CB 4.25Å; R760-D872 WeakPolarHBondContact CD-OD1 3.28Å; R760-D872 VanDerWaalsContact CD-OD2 3.27Å; R760-D872 WeakPolarHBondContact CD-OD2 3.44Å; R760-D872 IonicContact CZ-OD2 2.79Å; R760-D872 IonicContact NE-OD2 3.76Å; R760-D872 IonicContact NH1-OD2 3.18Å; R760-D872 PolarHBondContact NH1-OD2 2.6Å; R760-E874 HydrophobicContact CB-CB 4.09Å; R760-E874 HydrophobicContact CB-CG 3.95Å; R760-E874 HydrophobicContact CG-CB 3.96Å; R760-E874 HydrophobicContact CG-CG 3.8Å; R760-A875 HydrophobicContact CB-CB 3.91Å
761	S	91.6	Very high	90	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	162.9	175.5	177.7	0	0	0	0	109.4	T812 I843 Y844 V845	S761-T812 PolarHBondContact OG-OG1 3.35Å; S761-I843 PolarHBondContact N-O 2.91Å; S761-Y844 CarbonylContact O-C 3.58Å; S761-Y844 VanDerWaalsContact O-CA 3.24Å; S761-Y844 WeakPolarHBondContact O-CA 3.36Å; S761-V845 WeakPolarHBondContact O-CG2 2.82Å; S761-V845 PolarHBondContact O-N 2.88Å
762	F	90.6	Very high	90	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	151	171.6	-61.4	-73.4	0	0	0	111.3	S764 G765 Y844 V845 D847 P848 A875 M876 V880 W918	F762-S764 PolarHBondContact O-N 2.83Å; F762-G765 PolarHBondContact O-N 2.87Å; F762-Y844 VanDerWaalsContact O-CD1 3.26Å; F762-Y844 WeakPolarHBondContact O-CD1 3.02Å; F762-V845 HydrophobicContact CD1-CG2 3.75Å; F762-V845 HydrophobicContact CE1-CG2 3.91Å; F762-D847 WeakPolarHBondContact CB-OD1 3.35Å; F762-P848 HydrophobicContact CE1-CG 4.2Å; F762-A875 HydrophobicContact CD1-CB 4.21Å; F762-A875 HydrophobicContact CD2-CB 4.1Å; F762-A875 HydrophobicContact CE1-CB 3.72Å; F762-A875 HydrophobicContact CE2-CB 3.59Å; F762-A875 WeakPolarHBondContact CE2-O 3.17Å; F762-A875 HydrophobicContact CG-CB 4.39Å; F762-A875 HydrophobicContact CZ-CB 3.39Å; F762-M876 HydrophobicContact CE2-SD 4.39Å; F762-M876 HydrophobicContact CZ-CE 3.95Å; F762-M876 HydrophobicContact CZ-CG 4.23Å; F762-M876 HydrophobicContact CZ-SD 3.98Å; F762-V880 HydrophobicContact CD2-CG2 4.16Å; F762-V880 HydrophobicContact CE2-CG2 3.87Å; F762-W918 HydrophobicContact CD1-CZ2 4.4Å; F762-W918 AromaticContact CD2-CH2 3.92Å; F762-W918 HydrophobicContact CD2-CH2 3.92Å; F762-W918 AromaticContact CD2-CZ2 3.56Å; F762-W918 HydrophobicContact CD2-CZ2 3.56Å; F762-W918 HydrophobicContact CE1-CH2 4.49Å; F762-W918 HydrophobicContact CE1-CZ2 4.48Å; F762-W918 AromaticContact CE2-CH2 3.48Å; F762-W918 HydrophobicContact CE2-CH2 3.48Å; F762-W918 VanDerWaalsContact CE2-CH2 3.48Å; F762-W918 AromaticContact CE2-CZ2 3.65Å; F762-W918 HydrophobicContact CE2-CZ2 3.65Å; F762-W918 AromaticContact CG-CZ2 3.96Å; F762-W918 HydrophobicContact CG-CZ2 3.96Å; F762-W918 AromaticContact CZ-CH2 3.81Å; F762-W918 HydrophobicContact CZ-CH2 3.81Å; F762-W918 HydrophobicContact CZ-CZ2 4.13Å
763	V	89.3	Confident	90	Very high	21 Å²	21	32.4 Å²	32.4	13%	0.127	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.9	179.8	-77.1	0	0	0	0	114.1	G765 L815 A816 P822 V845 D847	V763-G765 PolarHBondContact O-N 2.88Å; V763-L815 PolarHBondContact O-N 2.77Å; V763-A816 PolarHBondContact O-N 3.3Å; V763-A816 VanDerWaalsContact O-N 3.12Å; V763-P822 HydrophobicContact CG1-CB 4.26Å; V763-P822 HydrophobicContact CG1-CG 3.66Å; V763-V845 PolarHBondContact N-O 2.93Å; V763-D847 HydrophobicContact CG2-CB 4.43Å; V763-D847 WeakPolarHBondContact CG2-OD1 3.28Å; V763-D847 PolarHBondContact N-OD1 3.05Å
764	S	87.4	Confident	89.9	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-10	171.7	52.3	0	0	0	0	114.9	F762 S814 D847 Q920 A921	F762-S764 PolarHBondContact O-N 2.83Å; S764-S814 WeakPolarHBondContact O-CB 3.44Å; S764-S814 PolarHBondContact O-OG 3.1Å; S764-D847 VanDerWaalsContact CB-OD1 3.29Å; S764-D847 WeakPolarHBondContact CB-OD1 3.44Å; S764-D847 VanDerWaalsContact CB-OD2 3.32Å; S764-D847 WeakPolarHBondContact CB-OD2 3.29Å; S764-D847 PolarHBondContact N-OD1 3.45Å; S764-D847 VanDerWaalsContact OG-CG 3.28Å; S764-D847 PolarHBondContact OG-OD1 2.9Å; S764-D847 PolarHBondContact OG-OD2 3.49Å; S764-Q920 PolarHBondContact OG-NE2 2.8Å; S764-A921 PolarHBondContact O-N 2.9Å
765	G	87.7	Confident	89.9	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.01	20%	0.199	C	C	.	.			trans	71.7	-165	-176.3	0	0	0	0	0	112.7	F762 V763 P813	F762-G765 PolarHBondContact O-N 2.87Å; V763-G765 PolarHBondContact O-N 2.88Å; G765-P813 WeakPolarHBondContact CA-O 3.33Å
766	G	84.9	Confident	89.8	Confident	13 Å²	13	35.2 Å²	35.2	13%	0.134	19%	0.185	C	C	.	.			trans	91.8	1.2	177.4	0	0	0	0	0	115.2	T812	G766-T812 PolarHBondContact N-O 2.98Å; G766-T812 PolarHBondContact N-OG1 3.01Å
767	C	88.4	Confident	89.4	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.007	21%	0.206	C	C	.	.			trans	-76.2	127.6	173.7	-180	0	0	0	0	110.8	P758 V769 T811 T812 C878	P758-C767 VanDerWaalsContact CG-SG 3.6Å; C767-V769 PolarHBondContact O-N 2.03Å; C767-T811 CarbonylContact O-C 3.6Å; C767-T811 WeakPolarHBondContact O-CA 3.41Å; C767-T812 HydrophobicContact CB-CG2 4.07Å; C767-T812 WeakPolarHBondContact CB-OG1 3.48Å; C767-T812 PolarHBondContact N-OG1 2.71Å; C767-T812 PolarHBondContact O-N 2.84Å; C767-T812 PolarHBondContact O-OG1 2.93Å; C767-C878 HydrophobicContact CB-CB 3.58Å; C767-C878 WeakPolarHBondContact CB-SG 3.24Å; C767-C878 WeakPolarHBondContact SG-CB 3.42Å; C767-C878 CovalentContact SG-SG 2.02Å; C767-C878 PolarHBondContact SG-SG 2.74Å
768	T	89.3	Confident	89.3	Confident	64 Å²	64	34.7 Å²	34.7	39%	0.393	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	104.5	170.1	-58	0	0	0	0	109.7	Q809	T768-Q809 HydrophobicContact CG2-CB 4.17Å
769	V	91.1	Very high	89.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.6	174	175.6	0	0	0	0	109	I756 C767 Q809 C810 T812 L842	I756-V769 HydrophobicContact CB-CG1 3.96Å; C767-V769 PolarHBondContact O-N 2.03Å; V769-Q809 WeakPolarHBondContact O-CA 3.42Å; V769-C810 PolarHBondContact N-O 3.34Å; V769-C810 PolarHBondContact O-N 2.96Å; V769-T812 HydrophobicContact CG2-CG2 3.76Å; V769-L842 HydrophobicContact CG2-CD1 4.29Å; V769-L842 HydrophobicContact CG2-CD2 4.22Å
770	S	90.8	Very high	88.7	Confident	32 Å²	32	33.3 Å²	33.3	22%	0.224	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114.4	174.6	177	0	0	0	0	109.8	Q757	Q757-S770 PolarHBondContact N-O 3.29Å; Q757-S770 PolarHBondContact O-N 3.23Å
771	A	92.1	Very high	88.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.7	173.8	0	0	0	0	0	110.4	I753 S755 I756 S807 I808 F830	I753-A771 HydrophobicContact CD1-CB 4.09Å; I753-A771 HydrophobicContact CG2-CB 4.21Å; S755-A771 WeakPolarHBondContact O-CA 3.15Å; I756-A771 HydrophobicContact CG2-CB 3.79Å; A771-S807 CarbonylContact O-C 3.54Å; A771-S807 WeakPolarHBondContact O-CA 3.45Å; A771-S807 VanDerWaalsContact O-CB 3.29Å; A771-S807 WeakPolarHBondContact O-CB 3.41Å; A771-I808 HydrophobicContact CB-CB 4.48Å; A771-I808 PolarHBondContact N-O 2.04Å; A771-I808 PolarHBondContact O-N 2.91Å; A771-F830 HydrophobicContact CB-CE1 3.77Å; A771-F830 HydrophobicContact CB-CE2 3.95Å; A771-F830 HydrophobicContact CB-CZ 3.46Å; A771-F830 VanDerWaalsContact CB-CZ 3.46Å
772	Q	91.4	Very high	88.3	Confident	96 Å²	96	35.3 Å²	35.3	45%	0.449	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	151.6	178.4	-64.3	-174.8	3.2	0	0	110.6	I753 S754 S755	I753-Q772 CarbonylContact C-O 3.59Å; S754-Q772 PolarHBondContact N-O 3.41Å; S754-Q772 PolarHBondContact OG-O 2.94Å; S754-Q772 VanDerWaalsContact OG-O 3.1Å; S755-Q772 PolarHBondContact N-O 2.79Å; S755-Q772 PolarHBondContact O-N 3.49Å
773	G	90	Very high	88.4	Confident	16 Å²	16	38.1 Å²	38.1	17%	0.165	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-171.7	-174.5	0	0	0	0	0	115.8	V752 T806	V752-G773 CarbonylContact O-C 3.57Å; V752-G773 WeakPolarHBondContact O-CA 3.3Å; G773-T806 PolarHBondContact N-O 2.79Å
774	S	89.1	Confident	88.6	Confident	68 Å²	68	37.1 Å²	37.1	48%	0.476	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.6	178.5	-61.8	0	0	0	0	110.6	V752 L776	V752-S774 PolarHBondContact N-O 2.74Å; V752-S774 PolarHBondContact O-N 3.04Å; S774-L776 PolarHBondContact O-N 3.2Å; S774-L776 VanDerWaalsContact O-N 3.12Å
775	Y	89.4	Confident	88.8	Confident	115 Å²	115	37.3 Å²	37.3	45%	0.451	20%	0.198	S	C	.	.	S	Bend	trans	56.8	22.9	177.8	-44.5	-64	0	0	0	115	E749 Q777 S778	E749-Y775 HydrophobicContact CB-CD1 3.92Å; E749-Y775 HydrophobicContact CB-CD2 3.8Å; E749-Y775 HydrophobicContact CB-CE1 4.21Å; E749-Y775 HydrophobicContact CB-CE2 4.08Å; E749-Y775 HydrophobicContact CB-CG 3.71Å; E749-Y775 HydrophobicContact CG-CE2 4.38Å; Y775-Q777 VanDerWaalsContact C-OE1 3.27Å; Y775-Q777 PolarHBondContact O-N 3.25Å; Y775-Q777 VanDerWaalsContact O-N 3.14Å; Y775-S778 WeakPolarHBondContact O-CB 3.38Å; Y775-S778 PolarHBondContact O-N 3.47Å; Y775-S778 PolarHBondContact O-OG 3.04Å
776	L	88.3	Confident	89	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-62.3	-24.1	-179.5	-53.2	-172.2	0	0	0	112.4	P751 I753 S774 S778 Y801 I808 L832	P751-L776 HydrophobicContact CB-CD2 4.07Å; I753-L776 HydrophobicContact CD1-CD1 4.29Å; I753-L776 HydrophobicContact CD1-CD2 3.63Å; I753-L776 HydrophobicContact CG1-CD2 4.48Å; S774-L776 PolarHBondContact O-N 3.2Å; S774-L776 VanDerWaalsContact O-N 3.12Å; L776-S778 PolarHBondContact O-N 2.71Å; L776-Y801 HydrophobicContact CB-CE1 4.12Å; L776-Y801 VanDerWaalsContact O-CE1 3.31Å; L776-Y801 WeakPolarHBondContact O-CE1 3.46Å; L776-Y801 PolarHBondContact O-OH 2.87Å; L776-I808 HydrophobicContact CB-CD1 4.23Å; L776-I808 HydrophobicContact CD1-CD1 3.99Å; L776-I808 HydrophobicContact CD1-CG1 4.04Å; L776-I808 HydrophobicContact CD2-CD1 4.33Å; L776-I808 HydrophobicContact CG-CD1 4.41Å; L776-L832 WeakPolarHBondContact O-CD2 2.29Å
777	Q	85.2	Confident	89.2	Confident	98 Å²	98	40.6 Å²	40.6	46%	0.458	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-71.5	-3.3	172.4	76	-77.4	4.9	0	0	114.9	Y775 G779	Y775-Q777 VanDerWaalsContact C-OE1 3.27Å; Y775-Q777 PolarHBondContact O-N 3.25Å; Y775-Q777 VanDerWaalsContact O-N 3.14Å; Q777-G779 VanDerWaalsContact C-N 3.26Å; Q777-G779 PolarHBondContact O-N 2.73Å
778	S	87.1	Confident	89	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.021	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-73.7	-14.8	177.4	-67.8	0	0	0	0	113.9	G673 P674 N748 E749 Y775 L776	G673-S778 CarbonylContact C-O 3.59Å; G673-S778 WeakPolarHBondContact CA-O 3.45Å; P674-S778 WeakPolarHBondContact CD-O 3.4Å; N748-S778 WeakPolarHBondContact CB-OG 3.25Å; E749-S778 WeakPolarHBondContact O-CB 3.28Å; E749-S778 PolarHBondContact O-OG 2.77Å; Y775-S778 WeakPolarHBondContact O-CB 3.38Å; Y775-S778 PolarHBondContact O-N 3.47Å; Y775-S778 PolarHBondContact O-OG 3.04Å; L776-S778 PolarHBondContact O-N 2.71Å
779	G	85.3	Confident	88.1	Confident	3 Å²	3	41.6 Å²	41.6	3%	0.031	22%	0.221	C	C	.	.	S	Bend	trans	-110.6	161.2	166.2	0	0	0	0	0	111.6	Q777 Y801	Q777-G779 VanDerWaalsContact C-N 3.26Å; Q777-G779 PolarHBondContact O-N 2.73Å; G779-Y801 PolarHBondContact O-OH 3.19Å
780	L	83.4	Confident	86.8	Confident	67 Å²	67	48.5 Å²	48.5	35%	0.351	25%	0.253	S	S	.	.	S	Bend	trans	-92.8	-38.2	177.4	-175.8	68	0	0	0	112.5	F669 F672 D833	F669-L780 HydrophobicContact CE1-CD2 3.96Å; F669-L780 HydrophobicContact CE2-CD2 4.32Å; F669-L780 HydrophobicContact CZ-CD2 3.5Å; F669-L780 VanDerWaalsContact CZ-CD2 3.5Å; F672-L780 HydrophobicContact CZ-CD1 4.4Å; L780-D833 WeakPolarHBondContact CB-OD2 3.3Å; L780-D833 PolarHBondContact N-OD1 3.14Å; L780-D833 PolarHBondContact N-OD2 2.92Å
781	Q	83.7	Confident	85.6	Confident	131 Å²	131	51.9 Å²	51.9	61%	0.612	27%	0.269	S	S	*	.	S	Bend	trans	-127.2	100.6	-175.4	-67.8	-171.9	-6.7	0	0	111.5	D833	Q781-D833 PolarHBondContact N-OD1 3.26Å
782	P	90.6	Very high	84.4	Confident	7 Å²	7	56.6 Å²	56.6	5%	0.045	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	132.2	175.6	31.1	-32.1	0	0	0	110.7	C799 Y801 I808 V831 L832	P782-C799 HydrophobicContact CB-CB 4.29Å; P782-C799 HydrophobicContact CG-CB 4.17Å; P782-C799 WeakPolarHBondContact O-CB 3.33Å; P782-C799 PolarHBondContact O-N 3.37Å; P782-Y801 HydrophobicContact CG-CD2 4.23Å; P782-Y801 HydrophobicContact CG-CE1 4.2Å; P782-Y801 HydrophobicContact CG-CE2 3.8Å; P782-I808 HydrophobicContact CB-CD1 3.83Å; P782-I808 HydrophobicContact CB-CG1 4.1Å; P782-I808 HydrophobicContact CB-CG2 3.85Å; P782-I808 HydrophobicContact CG-CG1 4.35Å; P782-I808 HydrophobicContact CG-CG2 4.1Å; P782-V831 WeakPolarHBondContact CA-O 2.73Å; P782-L832 HydrophobicContact CB-CG 4.3Å
783	Q	92.3	Very high	83.7	Confident	62 Å²	62	52.8 Å²	52.8	29%	0.29	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143	169	-63.7	-174.8	-0.4	0	0	110	V797 F830 V831	Q783-V797 CarbonylContact C-O 3.56Å; Q783-V797 WeakPolarHBondContact CA-O 3.36Å; Q783-V797 WeakPolarHBondContact CB-O 3.47Å; Q783-F830 CarbonylContact O-C 3.57Å; Q783-F830 VanDerWaalsContact O-CA 3.31Å; Q783-F830 WeakPolarHBondContact O-CA 3.18Å; Q783-V831 HydrophobicContact CB-CB 4.45Å; Q783-V831 PolarHBondContact N-O 3.18Å; Q783-V831 PolarHBondContact O-N 3.3Å
784	M	92.9	Very high	83.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.6	169.4	174.8	178.9	71.2	0	0	108.8	V797 C799 C810 V828 F830	M784-V797 HydrophobicContact CB-CB 4.23Å; M784-V797 HydrophobicContact CE-CB 3.99Å; M784-V797 HydrophobicContact CE-CG1 4.11Å; M784-V797 HydrophobicContact CE-CG2 3.93Å; M784-V797 PolarHBondContact N-O 3.46Å; M784-V797 PolarHBondContact O-N 2.93Å; M784-C799 VanDerWaalsContact CB-SG 3.56Å; M784-C799 PolarHBondContact N-SG 3.31Å; M784-C810 HydrophobicContact CB-CB 3.98Å; M784-C810 HydrophobicContact CE-CB 3.77Å; M784-C810 HydrophobicContact SD-CB 3.8Å; M784-V828 HydrophobicContact CG-CG1 3.5Å; M784-V828 HydrophobicContact SD-CG1 3.66Å; M784-F830 HydrophobicContact CB-CD1 4.19Å; M784-F830 HydrophobicContact CB-CE1 4.03Å; M784-F830 HydrophobicContact CG-CE1 4.17Å; M784-F830 HydrophobicContact CG-CZ 4.5Å; M784-F830 HydrophobicContact SD-CE1 4.48Å
785	V	93.1	Very high	83.6	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.8	173.1	178.2	0	0	0	0	108.3	R787 V794 F795 A829 V831	V785-R787 HydrophobicContact CG1-CG 4.5Å; V785-V794 HydrophobicContact CG1-CG1 3.85Å; V785-F795 WeakPolarHBondContact CA-O 3.4Å; V785-A829 PolarHBondContact N-O 2.9Å; V785-A829 PolarHBondContact O-N 3.35Å; V785-V831 HydrophobicContact CG2-CB 4.46Å; V785-V831 HydrophobicContact CG2-CG2 3.6Å
786	L	90.9	Very high	83.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.9	179.9	-179.9	152.5	0	0	0	110.2	V794 F795 P813 L815 T826 V828 L842 Y844	L786-V794 WeakPolarHBondContact O-CA 3.21Å; L786-F795 HydrophobicContact CB-CB 4.41Å; L786-F795 HydrophobicContact CD2-CD2 3.86Å; L786-F795 PolarHBondContact N-O 3.46Å; L786-F795 PolarHBondContact O-N 2.88Å; L786-P813 HydrophobicContact CD1-CG 4.38Å; L786-L815 HydrophobicContact CD2-CD2 4.37Å; L786-T826 HydrophobicContact CD2-CG2 4.12Å; L786-V828 HydrophobicContact CB-CG2 4.36Å; L786-V828 HydrophobicContact CD1-CG2 3.94Å; L786-V828 HydrophobicContact CG-CG2 4.08Å; L786-L842 HydrophobicContact CD1-CD2 4.33Å; L786-Y844 HydrophobicContact CD1-CE2 3.72Å; L786-Y844 WeakPolarHBondContact CD1-OH 3.4Å
787	R	90	Very high	83.8	Confident	82 Å²	82	56.2 Å²	56.2	31%	0.309	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137	176.9	-52.9	-166.4	-171.3	173.6	1.7	111.6	V785 D791 V794 T826 K827	V785-R787 HydrophobicContact CG1-CG 4.5Å; R787-D791 VanDerWaalsContact CD-OD1 3.27Å; R787-D791 WeakPolarHBondContact CD-OD1 3.11Å; R787-V794 HydrophobicContact CG-CG1 4.26Å; R787-V794 HydrophobicContact CG-CG2 4.13Å; R787-T826 CarbonylContact O-C 3.58Å; R787-T826 VanDerWaalsContact O-CA 3.3Å; R787-T826 WeakPolarHBondContact O-CA 3.44Å; R787-T826 WeakPolarHBondContact O-CB 3.46Å; R787-K827 PolarHBondContact N-O 3.14Å; R787-K827 PolarHBondContact O-N 2.94Å
788	T	83.3	Confident	84.1	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.025	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	149.3	170.1	51.8	0	0	0	0	110.9	Q790 D791 T792 A793 L818 L820	T788-Q790 PolarHBondContact O-N 3.23Å; T788-D791 PolarHBondContact O-N 3.27Å; T788-T792 PolarHBondContact OG1-N 3.11Å; T788-T792 PolarHBondContact OG1-OG1 3.19Å; T788-A793 HydrophobicContact CG2-CB 4.28Å; T788-A793 PolarHBondContact N-O 2.81Å; T788-A793 PolarHBondContact OG1-N 3.3Å; T788-A793 PolarHBondContact OG1-O 3.2Å; T788-L818 HydrophobicContact CG2-CD1 4.38Å; T788-L820 HydrophobicContact CG2-CD1 3.81Å
789	A	69.5	Low	84.3	Confident	83 Å²	83	57 Å²	57	69%	0.686	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-6.7	-178.9	0	0	0	0	0	116.5
790	Q	65.3	Low	84.6	Confident	145 Å²	145	61.8 Å²	61.8	68%	0.678	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	5.2	174	-64.9	174.3	-19.4	0	0	113	T788 T792	T788-Q790 PolarHBondContact O-N 3.23Å; Q790-T792 HydrophobicContact CB-CG2 3.94Å; Q790-T792 PolarHBondContact O-N 3.07Å
791	D	65.1	Low	84.9	Confident	103 Å²	103	60.7 Å²	60.7	55%	0.551	33%	0.332	S	S	*	.	S	Bend	trans	50.8	15.7	-171.2	-93.8	-19.7	0	0	0	115.3	R787 T788 A793	R787-D791 VanDerWaalsContact CD-OD1 3.27Å; R787-D791 WeakPolarHBondContact CD-OD1 3.11Å; T788-D791 PolarHBondContact O-N 3.27Å; D791-A793 VanDerWaalsContact C-N 3.29Å; D791-A793 PolarHBondContact O-N 2.84Å
792	T	66.4	Low	84.9	Confident	98 Å²	98	54.7 Å²	54.7	60%	0.601	31%	0.305	S	S	*	.	S	Bend	trans	-69.1	-21.1	179.8	46.1	0	0	0	0	114.2	T788 Q790	T788-T792 PolarHBondContact OG1-N 3.11Å; T788-T792 PolarHBondContact OG1-OG1 3.19Å; Q790-T792 HydrophobicContact CB-CG2 3.94Å; Q790-T792 PolarHBondContact O-N 3.07Å
793	A	77.3	Confident	84.4	Confident	16 Å²	16	63.7 Å²	63.7	13%	0.132	35%	0.346	C	S	.	.			trans	-142.9	138.9	171.9	0	0	0	0	0	112.1	T788 D791 F795 L818	T788-A793 HydrophobicContact CG2-CB 4.28Å; T788-A793 PolarHBondContact N-O 2.81Å; T788-A793 PolarHBondContact OG1-N 3.3Å; T788-A793 PolarHBondContact OG1-O 3.2Å; D791-A793 VanDerWaalsContact C-N 3.29Å; D791-A793 PolarHBondContact O-N 2.84Å; A793-F795 HydrophobicContact CB-CD2 4.36Å; A793-F795 HydrophobicContact CB-CE2 3.62Å; A793-F795 HydrophobicContact CB-CZ 4.15Å; A793-L818 HydrophobicContact CB-CD1 3.81Å
794	V	87.8	Confident	83.8	Confident	70 Å²	70	67.1 Å²	67.1	42%	0.424	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.2	173.5	-177.4	0	0	0	0	108.7	V785 L786 R787	V785-V794 HydrophobicContact CG1-CG1 3.85Å; L786-V794 WeakPolarHBondContact O-CA 3.21Å; R787-V794 HydrophobicContact CG-CG1 4.26Å; R787-V794 HydrophobicContact CG-CG2 4.13Å
795	F	88.6	Confident	83.1	Confident	55 Å²	55	74.9 Å²	74.9	24%	0.241	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132.8	-179.9	-64.2	-92	0	0	0	110.5	V785 L786 A793 P813 L815 L818	V785-F795 WeakPolarHBondContact CA-O 3.4Å; L786-F795 HydrophobicContact CB-CB 4.41Å; L786-F795 HydrophobicContact CD2-CD2 3.86Å; L786-F795 PolarHBondContact N-O 3.46Å; L786-F795 PolarHBondContact O-N 2.88Å; A793-F795 HydrophobicContact CB-CD2 4.36Å; A793-F795 HydrophobicContact CB-CE2 3.62Å; A793-F795 HydrophobicContact CB-CZ 4.15Å; F795-P813 HydrophobicContact CB-CB 4.43Å; F795-P813 HydrophobicContact CB-CG 3.97Å; F795-P813 HydrophobicContact CD1-CB 3.94Å; F795-P813 HydrophobicContact CD1-CG 4.2Å; F795-P813 HydrophobicContact CD2-CG 4.43Å; F795-P813 HydrophobicContact CE1-CB 4.45Å; F795-P813 HydrophobicContact CG-CB 4.22Å; F795-P813 HydrophobicContact CG-CG 3.96Å; F795-L815 HydrophobicContact CD2-CD2 4.13Å; F795-L815 HydrophobicContact CE2-CD2 3.47Å; F795-L815 VanDerWaalsContact CE2-CD2 3.47Å; F795-L815 HydrophobicContact CZ-CD2 3.84Å; F795-L818 HydrophobicContact CE2-CD1 4.08Å; F795-L818 HydrophobicContact CZ-CD1 4.02Å
796	H	90.9	Very high	82.6	Confident	125 Å²	125	78.6 Å²	78.6	58%	0.579	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.9	171	-74.9	-107.5	0	0	0	109.2
797	V	91.1	Very high	82.6	Confident	22 Å²	22	79.5 Å²	79.5	13%	0.133	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.1	178.5	173.9	0	0	0	0	108.9	Q783 M784 C810 T811 P813	Q783-V797 CarbonylContact C-O 3.56Å; Q783-V797 WeakPolarHBondContact CA-O 3.36Å; Q783-V797 WeakPolarHBondContact CB-O 3.47Å; M784-V797 HydrophobicContact CB-CB 4.23Å; M784-V797 HydrophobicContact CE-CB 3.99Å; M784-V797 HydrophobicContact CE-CG1 4.11Å; M784-V797 HydrophobicContact CE-CG2 3.93Å; M784-V797 PolarHBondContact N-O 3.46Å; M784-V797 PolarHBondContact O-N 2.93Å; V797-C810 HydrophobicContact CG1-CB 4.34Å; V797-T811 WeakPolarHBondContact CG1-O 3.34Å; V797-P813 HydrophobicContact CG2-CG 4.35Å
798	S	90.9	Very high	82.7	Confident	101 Å²	101	75.6 Å²	75.6	71%	0.706	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.8	170.6	-63.4	0	0	0	0	110.1
799	C	91.4	Very high	83.1	Confident	16 Å²	16	79.6 Å²	79.6	11%	0.108	43%	0.429	C	S	.	.			trans	-119.6	163.4	-176.9	-55.8	0	0	0	0	112	P782 M784 I808 Q809 C810	P782-C799 HydrophobicContact CB-CB 4.29Å; P782-C799 HydrophobicContact CG-CB 4.17Å; P782-C799 WeakPolarHBondContact O-CB 3.33Å; P782-C799 PolarHBondContact O-N 3.37Å; M784-C799 VanDerWaalsContact CB-SG 3.56Å; M784-C799 PolarHBondContact N-SG 3.31Å; C799-I808 HydrophobicContact CB-CG2 3.45Å; C799-I808 VanDerWaalsContact CB-CG2 3.45Å; C799-Q809 WeakPolarHBondContact CA-O 3.38Å; C799-Q809 VanDerWaalsContact CB-O 3.3Å; C799-Q809 WeakPolarHBondContact CB-O 3.26Å; C799-C810 HydrophobicContact CB-CB 4.11Å; C799-C810 WeakPolarHBondContact CB-SG 3.34Å; C799-C810 WeakPolarHBondContact SG-CB 3.45Å; C799-C810 CovalentContact SG-SG 2.03Å; C799-C810 PolarHBondContact SG-SG 2.92Å
800	V	91.1	Very high	84.1	Confident	104 Å²	104	75.7 Å²	75.7	63%	0.63	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	144.9	178.3	-160.8	0	0	0	0	109	I808 Q809	V800-I808 CarbonylContact O-C 3.58Å; V800-I808 WeakPolarHBondContact O-CA 3.47Å; V800-Q809 PolarHBondContact N-O 2.83Å; V800-Q809 PolarHBondContact O-N 3.03Å
801	Y	89.9	Confident	85.4	Confident	44 Å²	44	72.1 Å²	72.1	17%	0.173	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	137.2	167.2	-71	-72.9	0	0	0	110.2	L776 G779 P782 R805 S807 I808	L776-Y801 HydrophobicContact CB-CE1 4.12Å; L776-Y801 VanDerWaalsContact O-CE1 3.31Å; L776-Y801 WeakPolarHBondContact O-CE1 3.46Å; L776-Y801 PolarHBondContact O-OH 2.87Å; G779-Y801 PolarHBondContact O-OH 3.19Å; P782-Y801 HydrophobicContact CG-CD2 4.23Å; P782-Y801 HydrophobicContact CG-CE1 4.2Å; P782-Y801 HydrophobicContact CG-CE2 3.8Å; Y801-R805 HydrophobicContact CG-CG 4.43Å; Y801-S807 WeakPolarHBondContact CA-O 3.48Å; Y801-I808 HydrophobicContact CD1-CG1 3.89Å; Y801-I808 HydrophobicContact CE1-CD1 4.25Å; Y801-I808 HydrophobicContact CE1-CG1 3.81Å
802	G	84.6	Confident	86.6	Confident	5 Å²	5	67.2 Å²	67.2	5%	0.052	36%	0.359	C	S	.	.			trans	-64.8	163.7	165.7	0	0	0	0	0	111.3	N804 R805 S807	G802-N804 VanDerWaalsContact C-N 3.28Å; G802-N804 PolarHBondContact O-N 2.9Å; G802-N804 VanDerWaalsContact O-N 3.09Å; G802-R805 WeakPolarHBondContact O-CA 3.25Å; G802-R805 PolarHBondContact O-N 3.16Å; G802-S807 PolarHBondContact N-O 3.37Å
803	E	79.8	Confident	87.9	Confident	196 Å²	196	63.5 Å²	63.5	92%	0.916	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-45.9	-170.6	-60	174.9	156.7	0	0	114	R805	E803-R805 VanDerWaalsContact C-N 3.34Å; E803-R805 PolarHBondContact O-N 3.15Å
804	N	79.4	Confident	88.4	Confident	134 Å²	134	63.8 Å²	63.8	72%	0.717	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	4.6	-179.1	-68.6	-38.5	0	0	0	114.7	G802 T806	G802-N804 VanDerWaalsContact C-N 3.28Å; G802-N804 PolarHBondContact O-N 2.9Å; G802-N804 VanDerWaalsContact O-N 3.09Å; N804-T806 PolarHBondContact O-N 3.23Å
805	R	78.4	Confident	88.5	Confident	162 Å²	162	60.7 Å²	60.7	61%	0.611	32%	0.318	S	S	*	.	S	Bend	trans	55.4	1.8	-174.5	-63.3	-175.4	171.4	-169.3	-4	117.1	Y801 G802 E803 S807	Y801-R805 HydrophobicContact CG-CG 4.43Å; G802-R805 WeakPolarHBondContact O-CA 3.25Å; G802-R805 PolarHBondContact O-N 3.16Å; E803-R805 VanDerWaalsContact C-N 3.34Å; E803-R805 PolarHBondContact O-N 3.15Å; R805-S807 PolarHBondContact O-N 2.97Å
806	T	83.3	Confident	88.2	Confident	86 Å²	86	61 Å²	61	53%	0.528	33%	0.331	S	S	.	.	S	Bend	trans	-79.3	-1	172.2	51.2	0	0	0	0	113.9	G773 N804	G773-T806 PolarHBondContact N-O 2.79Å; N804-T806 PolarHBondContact O-N 3.23Å
807	S	89.8	Confident	87.7	Confident	18 Å²	18	63 Å²	63	13%	0.126	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	157.4	175.6	56.8	0	0	0	0	112.3	A771 Y801 G802 R805	A771-S807 CarbonylContact O-C 3.54Å; A771-S807 WeakPolarHBondContact O-CA 3.45Å; A771-S807 VanDerWaalsContact O-CB 3.29Å; A771-S807 WeakPolarHBondContact O-CB 3.41Å; Y801-S807 WeakPolarHBondContact CA-O 3.48Å; G802-S807 PolarHBondContact N-O 3.37Å; R805-S807 PolarHBondContact O-N 2.97Å
808	I	92.3	Very high	87.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.1	174.9	-64.8	162.3	0	0	0	107.4	I753 A771 L776 P782 C799 V800 Y801 F830 L832	I753-I808 HydrophobicContact CD1-CD1 4.24Å; A771-I808 HydrophobicContact CB-CB 4.48Å; A771-I808 PolarHBondContact N-O 2.04Å; A771-I808 PolarHBondContact O-N 2.91Å; L776-I808 HydrophobicContact CB-CD1 4.23Å; L776-I808 HydrophobicContact CD1-CD1 3.99Å; L776-I808 HydrophobicContact CD1-CG1 4.04Å; L776-I808 HydrophobicContact CD2-CD1 4.33Å; L776-I808 HydrophobicContact CG-CD1 4.41Å; P782-I808 HydrophobicContact CB-CD1 3.83Å; P782-I808 HydrophobicContact CB-CG1 4.1Å; P782-I808 HydrophobicContact CB-CG2 3.85Å; P782-I808 HydrophobicContact CG-CG1 4.35Å; P782-I808 HydrophobicContact CG-CG2 4.1Å; C799-I808 HydrophobicContact CB-CG2 3.45Å; C799-I808 VanDerWaalsContact CB-CG2 3.45Å; V800-I808 CarbonylContact O-C 3.58Å; V800-I808 WeakPolarHBondContact O-CA 3.47Å; Y801-I808 HydrophobicContact CD1-CG1 3.89Å; Y801-I808 HydrophobicContact CE1-CD1 4.25Å; Y801-I808 HydrophobicContact CE1-CG1 3.81Å; I808-F830 HydrophobicContact CG2-CD1 4.34Å; I808-F830 HydrophobicContact CG2-CE1 4.49Å; I808-L832 HydrophobicContact CD1-CD1 4.34Å; I808-L832 HydrophobicContact CD1-CD2 4.1Å
809	Q	91.5	Very high	86.7	Confident	88 Å²	88	66.2 Å²	66.2	41%	0.411	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.8	179.1	-61.9	-178.1	5.7	0	0	110	T768 V769 C799 V800	T768-Q809 HydrophobicContact CG2-CB 4.17Å; V769-Q809 WeakPolarHBondContact O-CA 3.42Å; C799-Q809 WeakPolarHBondContact CA-O 3.38Å; C799-Q809 VanDerWaalsContact CB-O 3.3Å; C799-Q809 WeakPolarHBondContact CB-O 3.26Å; V800-Q809 PolarHBondContact N-O 2.83Å; V800-Q809 PolarHBondContact O-N 3.03Å
810	C	92.2	Very high	86.2	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.014	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	134	-176.7	-50.3	0	0	0	0	110.5	V769 M784 V797 C799	V769-C810 PolarHBondContact N-O 3.34Å; V769-C810 PolarHBondContact O-N 2.96Å; M784-C810 HydrophobicContact CB-CB 3.98Å; M784-C810 HydrophobicContact CE-CB 3.77Å; M784-C810 HydrophobicContact SD-CB 3.8Å; V797-C810 HydrophobicContact CG1-CB 4.34Å; C799-C810 HydrophobicContact CB-CB 4.11Å; C799-C810 WeakPolarHBondContact CB-SG 3.34Å; C799-C810 WeakPolarHBondContact SG-CB 3.45Å; C799-C810 CovalentContact SG-SG 2.03Å; C799-C810 PolarHBondContact SG-SG 2.92Å
811	T	91.1	Very high	85.7	Confident	69 Å²	69	71 Å²	71	42%	0.423	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.1	175.7	-49.8	0	0	0	0	111	C767 V797	C767-T811 CarbonylContact O-C 3.6Å; C767-T811 WeakPolarHBondContact O-CA 3.41Å; V797-T811 WeakPolarHBondContact CG1-O 3.34Å
812	T	91.4	Very high	85.4	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.006	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-69.3	137.4	-178.3	53.7	0	0	0	0	112.7	S761 G766 C767 V769 L842 Y844 A921	S761-T812 PolarHBondContact OG-OG1 3.35Å; G766-T812 PolarHBondContact N-O 2.98Å; G766-T812 PolarHBondContact N-OG1 3.01Å; C767-T812 HydrophobicContact CB-CG2 4.07Å; C767-T812 WeakPolarHBondContact CB-OG1 3.48Å; C767-T812 PolarHBondContact N-OG1 2.71Å; C767-T812 PolarHBondContact O-N 2.84Å; C767-T812 PolarHBondContact O-OG1 2.93Å; V769-T812 HydrophobicContact CG2-CG2 3.76Å; T812-L842 HydrophobicContact CG2-CD2 3.86Å; T812-Y844 VanDerWaalsContact CB-OH 3.25Å; T812-Y844 WeakPolarHBondContact CB-OH 3.3Å; T812-Y844 WeakPolarHBondContact CG2-OH 3.33Å; T812-A921 WeakPolarHBondContact O-CB 3.37Å
813	P	92.2	Very high	85.6	Confident	19 Å²	19	74.8 Å²	74.8	12%	0.123	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-72	160.7	175.3	32.3	-35.7	0	0	0	111.3	G765 L786 F795 V797	G765-P813 WeakPolarHBondContact CA-O 3.33Å; L786-P813 HydrophobicContact CD1-CG 4.38Å; F795-P813 HydrophobicContact CB-CB 4.43Å; F795-P813 HydrophobicContact CB-CG 3.97Å; F795-P813 HydrophobicContact CD1-CB 3.94Å; F795-P813 HydrophobicContact CD1-CG 4.2Å; F795-P813 HydrophobicContact CD2-CG 4.43Å; F795-P813 HydrophobicContact CE1-CB 4.45Å; F795-P813 HydrophobicContact CG-CB 4.22Å; F795-P813 HydrophobicContact CG-CG 3.96Å; V797-P813 HydrophobicContact CG2-CG 4.35Å
814	S	89.8	Confident	85.9	Confident	23 Å²	23	66.1 Å²	66.1	16%	0.161	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-76.8	127.5	173.1	-152.2	0	0	0	0	111	S764	S764-S814 WeakPolarHBondContact O-CB 3.44Å; S764-S814 PolarHBondContact O-OG 3.1Å
815	L	88.8	Confident	86.4	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	34%	0.342	C	S	.	.			trans	-100.1	-9.2	171.7	-57.4	-173.2	0	0	0	112.5	V763 L786 F795 K817 L818 T826 Y844	V763-L815 PolarHBondContact O-N 2.77Å; L786-L815 HydrophobicContact CD2-CD2 4.37Å; F795-L815 HydrophobicContact CD2-CD2 4.13Å; F795-L815 HydrophobicContact CE2-CD2 3.47Å; F795-L815 VanDerWaalsContact CE2-CD2 3.47Å; F795-L815 HydrophobicContact CZ-CD2 3.84Å; L815-K817 PolarHBondContact O-N 2.86Å; L815-L818 HydrophobicContact CD2-CD1 4.27Å; L815-L818 WeakPolarHBondContact O-CB 3.41Å; L815-L818 PolarHBondContact O-N 3.03Å; L815-T826 HydrophobicContact CD1-CG2 3.99Å; L815-Y844 HydrophobicContact CD1-CD1 3.58Å; L815-Y844 HydrophobicContact CD1-CD2 3.78Å; L815-Y844 HydrophobicContact CD1-CE1 3.82Å; L815-Y844 HydrophobicContact CD1-CE2 4.04Å; L815-Y844 HydrophobicContact CD1-CG 3.55Å; L815-Y844 HydrophobicContact CG-CD1 3.93Å; L815-Y844 HydrophobicContact CG-CE1 3.88Å; L815-Y844 HydrophobicContact CG-CG 4.41Å
816	A	82.4	Confident	87	Confident	63 Å²	63	55 Å²	55	52%	0.521	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-8.7	-173.7	0	0	0	0	0	116.1	V763	V763-A816 PolarHBondContact O-N 3.3Å; V763-A816 VanDerWaalsContact O-N 3.12Å
817	K	79.7	Confident	87.4	Confident	165 Å²	165	54.4 Å²	54.4	72%	0.717	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-6.9	174.7	-66	166.4	-177.2	160	0	113.3	L815 D922	L815-K817 PolarHBondContact O-N 2.86Å; K817-D922 IonicContact NZ-OD2 2.71Å; K817-D922 PolarHBondContact NZ-OD2 3.4Å
818	L	82.3	Confident	87.5	Confident	56 Å²	56	53.6 Å²	53.6	29%	0.293	30%	0.297	S	S	.	.	S	Bend	trans	-95.4	149.3	179.3	-60.7	177.3	0	0	0	110.9	T788 A793 F795 L815 L820	T788-L818 HydrophobicContact CG2-CD1 4.38Å; A793-L818 HydrophobicContact CB-CD1 3.81Å; F795-L818 HydrophobicContact CE2-CD1 4.08Å; F795-L818 HydrophobicContact CZ-CD1 4.02Å; L815-L818 HydrophobicContact CD2-CD1 4.27Å; L815-L818 WeakPolarHBondContact O-CB 3.41Å; L815-L818 PolarHBondContact O-N 3.03Å; L818-L820 HydrophobicContact CB-CD1 3.77Å; L818-L820 HydrophobicContact CB-CG 3.83Å; L818-L820 HydrophobicContact CD1-CD1 3.72Å; L818-L820 HydrophobicContact CG-CD1 4.42Å; L818-L820 PolarHBondContact O-N 2.9Å
819	P	79	Confident	87.5	Confident	135 Å²	135	53.8 Å²	53.8	88%	0.877	30%	0.299	S	S	*	.			trans	-77.7	61.1	177.3	34.3	-36.7	0	0	0	111.4
820	L	80.6	Confident	87.6	Confident	40 Å²	40	49.6 Å²	49.6	21%	0.209	28%	0.279	C	S	.	.			trans	-116	129.2	-176.5	-61.3	173.7	0	0	0	110.4	T788 L818 V824	T788-L820 HydrophobicContact CG2-CD1 3.81Å; L818-L820 HydrophobicContact CB-CD1 3.77Å; L818-L820 HydrophobicContact CB-CG 3.83Å; L818-L820 HydrophobicContact CD1-CD1 3.72Å; L818-L820 HydrophobicContact CG-CD1 4.42Å; L818-L820 PolarHBondContact O-N 2.9Å; L820-V824 HydrophobicContact CB-CG2 3.88Å; L820-V824 HydrophobicContact CD1-CG1 4.25Å
821	Q	82.2	Confident	87.5	Confident	180 Å²	180	51 Å²	51	84%	0.841	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-90.5	122	177.4	-166.5	168.7	13.5	0	0	110.1
822	P	83.3	Confident	87.4	Confident	33 Å²	33	47.8 Å²	47.8	21%	0.214	27%	0.268	C	S	.	.	S	Bend	trans	-75.9	158.8	-178.7	-18.9	36.1	0	0	0	112.7	V763 E846	V763-P822 HydrophobicContact CG1-CB 4.26Å; V763-P822 HydrophobicContact CG1-CG 3.66Å; P822-E846 HydrophobicContact CB-CG 3.72Å; P822-E846 HydrophobicContact CG-CG 3.94Å
823	P	87.5	Confident	86.8	Confident	96 Å²	96	48.9 Å²	48.9	62%	0.623	27%	0.274	S	S	*	.	S	Bend	cis	-76.6	128.3	0.5	30.2	-34.3	0	0	0	113.3	I843 Y844	P823-I843 HydrophobicContact CB-CG2 3.85Å; P823-Y844 CarbonylContact C-O 3.54Å; P823-Y844 VanDerWaalsContact CA-O 3.22Å; P823-Y844 WeakPolarHBondContact CA-O 3.3Å
824	V	87.3	Confident	86	Confident	14 Å²	14	49.8 Å²	49.8	9%	0.085	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.2	-178.3	-171.9	0	0	0	0	109.9	L820 T826 I843 Y844	L820-V824 HydrophobicContact CB-CG2 3.88Å; L820-V824 HydrophobicContact CD1-CG1 4.25Å; V824-T826 HydrophobicContact CG1-CG2 4.13Å; V824-I843 WeakPolarHBondContact O-CA 3.37Å; V824-Y844 PolarHBondContact N-O 3.08Å; V824-Y844 PolarHBondContact O-N 3.42Å
825	V	89.4	Confident	85.9	Confident	62 Å²	62	51.2 Å²	51.2	38%	0.376	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125	169.6	-174.7	0	0	0	0	109	I843	V825-I843 HydrophobicContact CG2-CG1 4.4Å
826	T	90.3	Very high	85.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.3	175.3	68.7	0	0	0	0	110.5	L786 R787 L815 V824 L842 Y844	L786-T826 HydrophobicContact CD2-CG2 4.12Å; R787-T826 CarbonylContact O-C 3.58Å; R787-T826 VanDerWaalsContact O-CA 3.3Å; R787-T826 WeakPolarHBondContact O-CA 3.44Å; R787-T826 WeakPolarHBondContact O-CB 3.46Å; L815-T826 HydrophobicContact CD1-CG2 3.99Å; V824-T826 HydrophobicContact CG1-CG2 4.13Å; T826-L842 PolarHBondContact N-O 3.42Å; T826-L842 PolarHBondContact O-N 3.16Å; T826-L842 PolarHBondContact OG1-O 2.79Å; T826-Y844 HydrophobicContact CG2-CD2 3.67Å; T826-Y844 HydrophobicContact CG2-CE2 3.86Å; T826-Y844 WeakPolarHBondContact OG1-CE2 3.01Å
827	K	91.6	Very high	86.2	Confident	75 Å²	75	52 Å²	52	33%	0.326	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123	173	-63.2	-55.5	-165.8	-174.9	0	108.7	R787 Q839 D841	R787-K827 PolarHBondContact N-O 3.14Å; R787-K827 PolarHBondContact O-N 2.94Å; K827-Q839 HydrophobicContact CB-CG 4.46Å; K827-D841 WeakPolarHBondContact CD-OD1 3.24Å; K827-D841 IonicContact NZ-OD1 3.23Å; K827-D841 PolarHBondContact NZ-OD1 2.54Å; K827-D841 IonicContact NZ-OD2 3.87Å; K827-D841 PolarHBondContact NZ-OD2 2.88Å
828	V	92.7	Very high	86.7	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.1	-178.3	179.6	0	0	0	0	109	M784 L786 F830 Q839 K840 L842	M784-V828 HydrophobicContact CG-CG1 3.5Å; M784-V828 HydrophobicContact SD-CG1 3.66Å; L786-V828 HydrophobicContact CB-CG2 4.36Å; L786-V828 HydrophobicContact CD1-CG2 3.94Å; L786-V828 HydrophobicContact CG-CG2 4.08Å; V828-F830 HydrophobicContact CG1-CE2 4.12Å; V828-F830 HydrophobicContact CG1-CZ 4.07Å; V828-Q839 CarbonylContact O-C 3.58Å; V828-Q839 WeakPolarHBondContact O-CA 3.43Å; V828-K840 PolarHBondContact N-O 2.55Å; V828-K840 PolarHBondContact O-N 2.86Å; V828-L842 HydrophobicContact CG2-CB 3.64Å; V828-L842 HydrophobicContact CG2-CD2 3.9Å; V828-L842 HydrophobicContact CG2-CG 4.43Å
829	A	92.6	Very high	87.1	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.8	171.6	0	0	0	0	0	109.7	V785 L836 T837 Q839	V785-A829 PolarHBondContact N-O 2.9Å; V785-A829 PolarHBondContact O-N 3.35Å; A829-L836 HydrophobicContact CB-CD1 3.67Å; A829-L836 HydrophobicContact CB-CG 4.27Å; A829-T837 WeakPolarHBondContact CB-O 3.38Å; A829-Q839 HydrophobicContact CB-CG 4.08Å
830	F	92.4	Very high	87.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.6	-178.5	-60	-95.7	0	0	0	109	I753 I756 A771 Q783 M784 I808 V828 L832 L836 T837	I753-F830 HydrophobicContact CD1-CD2 4.05Å; I753-F830 HydrophobicContact CD1-CG 4.2Å; I753-F830 HydrophobicContact CG1-CB 4.43Å; I753-F830 HydrophobicContact CG1-CD2 3.76Å; I753-F830 HydrophobicContact CG1-CE2 4.42Å; I753-F830 HydrophobicContact CG1-CG 4.25Å; I753-F830 HydrophobicContact CG2-CD2 4.35Å; I753-F830 HydrophobicContact CG2-CE2 4.2Å; I756-F830 HydrophobicContact CG2-CE2 3.83Å; I756-F830 HydrophobicContact CG2-CZ 3.94Å; A771-F830 HydrophobicContact CB-CE1 3.77Å; A771-F830 HydrophobicContact CB-CE2 3.95Å; A771-F830 HydrophobicContact CB-CZ 3.46Å; A771-F830 VanDerWaalsContact CB-CZ 3.46Å; Q783-F830 CarbonylContact O-C 3.57Å; Q783-F830 VanDerWaalsContact O-CA 3.31Å; Q783-F830 WeakPolarHBondContact O-CA 3.18Å; M784-F830 HydrophobicContact CB-CD1 4.19Å; M784-F830 HydrophobicContact CB-CE1 4.03Å; M784-F830 HydrophobicContact CG-CE1 4.17Å; M784-F830 HydrophobicContact CG-CZ 4.5Å; M784-F830 HydrophobicContact SD-CE1 4.48Å; I808-F830 HydrophobicContact CG2-CD1 4.34Å; I808-F830 HydrophobicContact CG2-CE1 4.49Å; V828-F830 HydrophobicContact CG1-CE2 4.12Å; V828-F830 HydrophobicContact CG1-CZ 4.07Å; F830-L832 HydrophobicContact CB-CD1 3.84Å; F830-L836 WeakPolarHBondContact O-CA 3.32Å; F830-T837 HydrophobicContact CB-CG2 4.04Å; F830-T837 PolarHBondContact N-OG1 2.92Å; F830-T837 WeakPolarHBondContact O-CG2 3.4Å; F830-T837 PolarHBondContact O-N 3.48Å
831	V	91.4	Very high	88.1	Confident	33 Å²	33	49.4 Å²	49.4	20%	0.2	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.7	170.2	175.2	0	0	0	0	107.9	P782 Q783 V785 Y835 L836	P782-V831 WeakPolarHBondContact CA-O 2.73Å; Q783-V831 HydrophobicContact CB-CB 4.45Å; Q783-V831 PolarHBondContact N-O 3.18Å; Q783-V831 PolarHBondContact O-N 3.3Å; V785-V831 HydrophobicContact CG2-CB 4.46Å; V785-V831 HydrophobicContact CG2-CG2 3.6Å; V831-Y835 CarbonylContact C-O 3.59Å; V831-Y835 VanDerWaalsContact CA-O 3.24Å; V831-Y835 WeakPolarHBondContact CA-O 3.06Å; V831-L836 HydrophobicContact CG2-CD1 3.56Å
832	L	89.1	Confident	88.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	109.6	173.3	-70.6	93	0	0	0	107.5	P751 L776 P782 I808 F830 G834 Y835 T837	P751-L832 HydrophobicContact CB-CD1 4.26Å; P751-L832 HydrophobicContact CB-CD2 3.89Å; P751-L832 HydrophobicContact CG-CB 3.95Å; P751-L832 HydrophobicContact CG-CD1 4.02Å; P751-L832 HydrophobicContact CG-CD2 4.01Å; P751-L832 HydrophobicContact CG-CG 4.22Å; L776-L832 WeakPolarHBondContact O-CD2 2.29Å; P782-L832 HydrophobicContact CB-CG 4.3Å; I808-L832 HydrophobicContact CD1-CD1 4.34Å; I808-L832 HydrophobicContact CD1-CD2 4.1Å; F830-L832 HydrophobicContact CB-CD1 3.84Å; L832-G834 PolarHBondContact O-N 3.03Å; L832-Y835 PolarHBondContact N-O 3.39Å; L832-Y835 WeakPolarHBondContact O-CB 3.34Å; L832-Y835 PolarHBondContact O-N 2.97Å; L832-T837 HydrophobicContact CD1-CG2 3.96Å
833	D	78.5	Confident	88.9	Confident	24 Å²	24	41.5 Å²	41.5	13%	0.128	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	40.9	178.1	-67.7	18.6	0	0	0	113.9	N678 T679 L780 Q781	N678-D833 CarbonylContact C-O 3.59Å; T679-D833 WeakPolarHBondContact CA-O 3.07Å; T679-D833 HydrophobicContact CG2-CB 4.23Å; T679-D833 PolarHBondContact N-O 3.15Å; L780-D833 WeakPolarHBondContact CB-OD2 3.3Å; L780-D833 PolarHBondContact N-OD1 3.14Å; L780-D833 PolarHBondContact N-OD2 2.92Å; Q781-D833 PolarHBondContact N-OD1 3.26Å
834	G	75.8	Confident	89.1	Confident	38 Å²	38	36.9 Å²	36.9	39%	0.392	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-11.1	177.9	0	0	0	0	0	115.9	L832	L832-G834 PolarHBondContact O-N 3.03Å
835	Y	86.6	Confident	89.3	Confident	53 Å²	53	36.9 Å²	36.9	21%	0.208	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	138.8	166.3	179.8	-97.2	0	0	0	110.4	P674 S676 D750 P751 V831 L832 T837	P674-Y835 HydrophobicContact CB-CG 4.49Å; S676-Y835 VanDerWaalsContact CB-CD2 3.49Å; D750-Y835 HydrophobicContact CB-CE1 4.31Å; D750-Y835 HydrophobicContact CB-CE2 4.06Å; P751-Y835 HydrophobicContact CG-CD1 3.62Å; P751-Y835 HydrophobicContact CG-CE1 4.02Å; P751-Y835 WeakPolarHBondContact O-CE1 3.43Å; V831-Y835 CarbonylContact C-O 3.59Å; V831-Y835 VanDerWaalsContact CA-O 3.24Å; V831-Y835 WeakPolarHBondContact CA-O 3.06Å; L832-Y835 PolarHBondContact N-O 3.39Å; L832-Y835 WeakPolarHBondContact O-CB 3.34Å; L832-Y835 PolarHBondContact O-N 2.97Å; Y835-T837 HydrophobicContact CD1-CG2 4.38Å; Y835-T837 HydrophobicContact CE1-CG2 4.2Å
836	L	89.1	Confident	89.2	Confident	78 Å²	78	37.4 Å²	37.4	41%	0.408	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.5	178.2	-178.8	71.2	0	0	0	109.4	A829 F830 V831	A829-L836 HydrophobicContact CB-CD1 3.67Å; A829-L836 HydrophobicContact CB-CG 4.27Å; F830-L836 WeakPolarHBondContact O-CA 3.32Å; V831-L836 HydrophobicContact CG2-CD1 3.56Å
837	T	89.9	Confident	89.1	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.043	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-74.4	166.1	178.3	71.2	0	0	0	0	112.3	I753 A829 F830 L832 Y835	I753-T837 HydrophobicContact CG1-CG2 3.83Å; A829-T837 WeakPolarHBondContact CB-O 3.38Å; F830-T837 HydrophobicContact CB-CG2 4.04Å; F830-T837 PolarHBondContact N-OG1 2.92Å; F830-T837 WeakPolarHBondContact O-CG2 3.4Å; F830-T837 PolarHBondContact O-N 3.48Å; L832-T837 HydrophobicContact CD1-CG2 3.96Å; Y835-T837 HydrophobicContact CD1-CG2 4.38Å; Y835-T837 HydrophobicContact CE1-CG2 4.2Å
838	D	88.7	Confident	88.8	Confident	121 Å²	121	35.6 Å²	35.6	65%	0.647	19%	0.189	S	C	*	.	P	Polyproline II helix	trans	-50.8	145.6	166.8	-66.9	-40.7	0	0	0	112.2
839	Q	90.4	Very high	88.3	Confident	96 Å²	96	39.8 Å²	39.8	45%	0.449	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-75.2	142.7	176.3	-67.9	179.7	2.6	0	0	111.5	K827 V828 A829	K827-Q839 HydrophobicContact CB-CG 4.46Å; V828-Q839 CarbonylContact O-C 3.58Å; V828-Q839 WeakPolarHBondContact O-CA 3.43Å; A829-Q839 HydrophobicContact CB-CG 4.08Å
840	K	90.1	Very high	88	Confident	54 Å²	54	40.8 Å²	40.8	24%	0.235	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	157.4	170.6	-53	-68.5	176.7	166	0	108.8	I753 S754 I756 V828	I753-K840 WeakPolarHBondContact O-CE 3.49Å; I753-K840 PolarHBondContact O-NZ 3.34Å; S754-K840 PolarHBondContact O-NZ 3.38Å; I756-K840 HydrophobicContact CD1-CB 3.82Å; I756-K840 HydrophobicContact CG1-CB 4.21Å; I756-K840 HydrophobicContact CG2-CG 4.34Å; V828-K840 PolarHBondContact N-O 2.55Å; V828-K840 PolarHBondContact O-N 2.86Å
841	D	91.2	Very high	87.6	Confident	70 Å²	70	46.8 Å²	46.8	37%	0.374	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.5	-176.6	-72.9	38	0	0	0	110.3	K827	K827-D841 WeakPolarHBondContact CD-OD1 3.24Å; K827-D841 IonicContact NZ-OD1 3.23Å; K827-D841 PolarHBondContact NZ-OD1 2.54Å; K827-D841 IonicContact NZ-OD2 3.87Å; K827-D841 PolarHBondContact NZ-OD2 2.88Å
842	L	91.9	Very high	87.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.7	175	178.5	66.1	0	0	0	108.3	I756 V769 L786 T812 T826 V828 Y844	I756-L842 HydrophobicContact CD1-CB 4.35Å; V769-L842 HydrophobicContact CG2-CD1 4.29Å; V769-L842 HydrophobicContact CG2-CD2 4.22Å; L786-L842 HydrophobicContact CD1-CD2 4.33Å; T812-L842 HydrophobicContact CG2-CD2 3.86Å; T826-L842 PolarHBondContact N-O 3.42Å; T826-L842 PolarHBondContact O-N 3.16Å; T826-L842 PolarHBondContact OG1-O 2.79Å; V828-L842 HydrophobicContact CG2-CB 3.64Å; V828-L842 HydrophobicContact CG2-CD2 3.9Å; V828-L842 HydrophobicContact CG2-CG 4.43Å; L842-Y844 HydrophobicContact CD2-CE2 3.75Å; L842-Y844 HydrophobicContact CG-CD2 4.48Å; L842-Y844 HydrophobicContact CG-CE2 3.93Å
843	I	91.6	Very high	86.9	Confident	46 Å²	46	52.6 Å²	52.6	24%	0.236	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.8	-174	-52.6	175.1	0	0	0	110	L759 R760 S761 P823 V824 V825	L759-I843 PolarHBondContact O-N 3.32Å; R760-I843 CarbonylContact C-O 3.52Å; R760-I843 WeakPolarHBondContact CA-O 3.42Å; R760-I843 HydrophobicContact CG-CB 4.25Å; S761-I843 PolarHBondContact N-O 2.91Å; P823-I843 HydrophobicContact CB-CG2 3.85Å; V824-I843 WeakPolarHBondContact O-CA 3.37Å; V825-I843 HydrophobicContact CG2-CG1 4.4Å
844	Y	91.6	Very high	87	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.2	175.2	-74.6	-112.4	0	0	0	110.1	S761 F762 L786 T812 L815 P823 V824 T826 L842	S761-Y844 CarbonylContact O-C 3.58Å; S761-Y844 VanDerWaalsContact O-CA 3.24Å; S761-Y844 WeakPolarHBondContact O-CA 3.36Å; F762-Y844 VanDerWaalsContact O-CD1 3.26Å; F762-Y844 WeakPolarHBondContact O-CD1 3.02Å; L786-Y844 HydrophobicContact CD1-CE2 3.72Å; L786-Y844 WeakPolarHBondContact CD1-OH 3.4Å; T812-Y844 VanDerWaalsContact CB-OH 3.25Å; T812-Y844 WeakPolarHBondContact CB-OH 3.3Å; T812-Y844 WeakPolarHBondContact CG2-OH 3.33Å; L815-Y844 HydrophobicContact CD1-CD1 3.58Å; L815-Y844 HydrophobicContact CD1-CD2 3.78Å; L815-Y844 HydrophobicContact CD1-CE1 3.82Å; L815-Y844 HydrophobicContact CD1-CE2 4.04Å; L815-Y844 HydrophobicContact CD1-CG 3.55Å; L815-Y844 HydrophobicContact CG-CD1 3.93Å; L815-Y844 HydrophobicContact CG-CE1 3.88Å; L815-Y844 HydrophobicContact CG-CG 4.41Å; P823-Y844 CarbonylContact C-O 3.54Å; P823-Y844 VanDerWaalsContact CA-O 3.22Å; P823-Y844 WeakPolarHBondContact CA-O 3.3Å; V824-Y844 PolarHBondContact N-O 3.08Å; V824-Y844 PolarHBondContact O-N 3.42Å; T826-Y844 HydrophobicContact CG2-CD2 3.67Å; T826-Y844 HydrophobicContact CG2-CE2 3.86Å; T826-Y844 WeakPolarHBondContact OG1-CE2 3.01Å; L842-Y844 HydrophobicContact CD2-CE2 3.75Å; L842-Y844 HydrophobicContact CG-CD2 4.48Å; L842-Y844 HydrophobicContact CG-CE2 3.93Å
845	V	90.4	Very high	87.3	Confident	14 Å²	14	57.4 Å²	57.4	9%	0.085	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	163.8	178.6	-60.8	0	0	0	0	111.2	S761 F762 V763 D872 A875	S761-V845 WeakPolarHBondContact O-CG2 2.82Å; S761-V845 PolarHBondContact O-N 2.88Å; F762-V845 HydrophobicContact CD1-CG2 3.75Å; F762-V845 HydrophobicContact CE1-CG2 3.91Å; V763-V845 PolarHBondContact N-O 2.93Å; V845-D872 HydrophobicContact CG1-CB 4.49Å; V845-D872 HydrophobicContact CG2-CB 3.85Å; V845-A875 HydrophobicContact CG2-CB 3.87Å
846	E	88.2	Confident	86.9	Confident	73 Å²	73	56.2 Å²	56.2	34%	0.341	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-60	146.1	178.4	-58.2	-162.9	150.3	0	0	112.4	P822 R870	P822-E846 HydrophobicContact CB-CG 3.72Å; P822-E846 HydrophobicContact CG-CG 3.94Å; E846-R870 WeakPolarHBondContact OE2-CD 3.4Å; E846-R870 IonicContact OE2-CZ 2.77Å; E846-R870 IonicContact OE2-NE 3.78Å; E846-R870 PolarHBondContact OE2-NE 3.29Å; E846-R870 IonicContact OE2-NH1 2.8Å; E846-R870 PolarHBondContact OE2-NH1 2.82Å; E846-R870 IonicContact OE2-NH2 3.58Å
847	D	86.4	Confident	86.2	Confident	35 Å²	35	57.1 Å²	57.1	19%	0.187	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-65.2	135.9	175.6	-66.7	-29.9	0	0	0	110.6	F762 V763 S764 R870	F762-D847 WeakPolarHBondContact CB-OD1 3.35Å; V763-D847 HydrophobicContact CG2-CB 4.43Å; V763-D847 WeakPolarHBondContact CG2-OD1 3.28Å; V763-D847 PolarHBondContact N-OD1 3.05Å; S764-D847 VanDerWaalsContact CB-OD1 3.29Å; S764-D847 WeakPolarHBondContact CB-OD1 3.44Å; S764-D847 VanDerWaalsContact CB-OD2 3.32Å; S764-D847 WeakPolarHBondContact CB-OD2 3.29Å; S764-D847 PolarHBondContact N-OD1 3.45Å; S764-D847 VanDerWaalsContact OG-CG 3.28Å; S764-D847 PolarHBondContact OG-OD1 2.9Å; S764-D847 PolarHBondContact OG-OD2 3.49Å; D847-R870 PolarHBondContact O-NH2 2.94Å
848	P	86.3	Confident	85.3	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.013	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-69.2	148.8	179.2	28.9	-35	0	0	0	111.7	F762 F850 D869 M871 M876 W918	F762-P848 HydrophobicContact CE1-CG 4.2Å; P848-F850 HydrophobicContact CB-CE1 4.4Å; P848-F850 HydrophobicContact CB-CE2 4.08Å; P848-F850 HydrophobicContact CB-CZ 3.94Å; P848-F850 HydrophobicContact CG-CD2 4.48Å; P848-F850 HydrophobicContact CG-CE2 3.6Å; P848-F850 HydrophobicContact CG-CZ 3.68Å; P848-D869 WeakPolarHBondContact CA-O 3.36Å; P848-M871 HydrophobicContact CB-CG 4.01Å; P848-M876 HydrophobicContact CB-CE 4.07Å; P848-M876 HydrophobicContact CG-CE 3.92Å; P848-W918 HydrophobicContact CG-CH2 3.53Å; P848-W918 HydrophobicContact CG-CZ2 3.51Å; P848-W918 HydrophobicContact CG-CZ3 4.24Å
849	L	82.9	Confident	84.2	Confident	88 Å²	88	62.1 Å²	62.1	46%	0.461	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	101.2	178.1	-65.1	179	0	0	0	109.6	G868 D869	L849-G868 CarbonylContact O-C 3.4Å; L849-G868 WeakPolarHBondContact O-CA 3.49Å; L849-D869 PolarHBondContact N-O 2.77Å; L849-D869 VanDerWaalsContact N-O 3.1Å; L849-D869 PolarHBondContact O-N 3.05Å
850	F	84.9	Confident	83.1	Confident	24 Å²	24	65 Å²	65	11%	0.105	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	148.3	178.8	-58.6	-70	0	0	0	113.2	P848 L866 K867 M871 M876 L898 W918 L927	P848-F850 HydrophobicContact CB-CE1 4.4Å; P848-F850 HydrophobicContact CB-CE2 4.08Å; P848-F850 HydrophobicContact CB-CZ 3.94Å; P848-F850 HydrophobicContact CG-CD2 4.48Å; P848-F850 HydrophobicContact CG-CE2 3.6Å; P848-F850 HydrophobicContact CG-CZ 3.68Å; F850-L866 HydrophobicContact CB-CD2 4.23Å; F850-L866 HydrophobicContact CD1-CB 3.92Å; F850-L866 HydrophobicContact CD1-CD1 4.47Å; F850-L866 HydrophobicContact CD1-CD2 4.42Å; F850-L866 HydrophobicContact CE1-CB 4.26Å; F850-L866 HydrophobicContact CG-CD2 4.43Å; F850-K867 CarbonylContact C-O 3.5Å; F850-K867 WeakPolarHBondContact CA-O 3.17Å; F850-M871 HydrophobicContact CD1-SD 4.42Å; F850-M871 HydrophobicContact CE1-CG 4.5Å; F850-M871 HydrophobicContact CE1-SD 3.76Å; F850-M876 HydrophobicContact CE1-CE 4.36Å; F850-M876 HydrophobicContact CZ-CE 3.94Å; F850-L898 HydrophobicContact CE1-CD2 3.77Å; F850-L898 HydrophobicContact CZ-CD2 3.98Å; F850-W918 AromaticContact CE2-CD2 3.89Å; F850-W918 HydrophobicContact CE2-CD2 3.89Å; F850-W918 AromaticContact CE2-CE3 3.49Å; F850-W918 HydrophobicContact CE2-CE3 3.49Å; F850-W918 VanDerWaalsContact CE2-CE3 3.49Å; F850-W918 HydrophobicContact CE2-CH2 4.26Å; F850-W918 AromaticContact CE2-CZ3 3.69Å; F850-W918 HydrophobicContact CE2-CZ3 3.69Å; F850-W918 AromaticContact CZ-CE3 3.8Å; F850-W918 HydrophobicContact CZ-CE3 3.8Å; F850-W918 HydrophobicContact CZ-CH2 4.15Å; F850-W918 AromaticContact CZ-CZ3 3.55Å; F850-W918 HydrophobicContact CZ-CZ3 3.55Å; F850-L927 HydrophobicContact CB-CD1 4.36Å; F850-L927 HydrophobicContact CB-CD2 4.37Å; F850-L927 HydrophobicContact CD2-CD1 3.53Å; F850-L927 HydrophobicContact CD2-CD2 3.81Å; F850-L927 HydrophobicContact CD2-CG 4.34Å; F850-L927 HydrophobicContact CE2-CD1 3.91Å; F850-L927 HydrophobicContact CG-CD1 3.98Å; F850-L927 HydrophobicContact CG-CD2 4.48Å
851	Q	84.6	Confident	82.4	Confident	127 Å²	127	66.4 Å²	66.4	59%	0.593	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-89.2	172.7	160.6	-61.2	175.6	-3.8	0	0	109.7	K867	Q851-K867 HydrophobicContact CB-CB 4.44Å; Q851-K867 PolarHBondContact N-O 3.26Å
852	D	80.9	Confident	82	Confident	140 Å²	140	64.1 Å²	64.1	75%	0.749	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-57	138.9	179.4	-56.5	-64.8	0	0	0	112.1
853	P	85	Confident	81.6	Confident	15 Å²	15	64.6 Å²	64.6	10%	0.097	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-67.6	133.9	-178.7	27	-34.8	0	0	0	111.4	V864 L866 V916 L927 V930	P853-V864 HydrophobicContact CB-CG1 3.78Å; P853-L866 HydrophobicContact CB-CD2 3.76Å; P853-L866 HydrophobicContact CB-CG 4.28Å; P853-V916 HydrophobicContact CB-CB 4.34Å; P853-V916 HydrophobicContact CB-CG1 4.41Å; P853-V916 HydrophobicContact CB-CG2 4Å; P853-V916 HydrophobicContact CG-CB 4.15Å; P853-V916 HydrophobicContact CG-CG2 4.01Å; P853-L927 WeakPolarHBondContact CD-O 3.46Å; P853-V930 HydrophobicContact CB-CG1 3.8Å; P853-V930 HydrophobicContact CG-CG1 3.97Å; P853-V930 WeakPolarHBondContact O-CG1 3.47Å
854	K	81.5	Confident	81.3	Confident	123 Å²	123	62.4 Å²	62.4	54%	0.535	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.9	171.3	-174.3	-170.5	171.1	-153.4	0	109.6	T856 E865	K854-T856 HydrophobicContact CD-CG2 4.29Å; K854-E865 HydrophobicContact CB-CB 4.4Å; K854-E865 PolarHBondContact N-O 3.03Å; K854-E865 IonicContact NZ-OE2 3.84Å; K854-E865 PolarHBondContact O-N 2.7Å
855	L	80.6	Confident	81	Confident	40 Å²	40	64.3 Å²	64.3	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	136.7	167.9	-161	76.3	0	0	0	110.5	I863 V864 V902 V930 T931 L932	L855-I863 WeakPolarHBondContact CA-O 3.44Å; L855-I863 WeakPolarHBondContact CD1-O 3.32Å; L855-V864 HydrophobicContact CD1-CG2 4.02Å; L855-V902 HydrophobicContact CD1-CG2 4.48Å; L855-V930 HydrophobicContact CB-CB 4.18Å; L855-V930 HydrophobicContact CB-CG1 4.43Å; L855-V930 HydrophobicContact CD1-CB 4.46Å; L855-V930 HydrophobicContact CD1-CG2 4.08Å; L855-T931 WeakPolarHBondContact CD2-O 3.03Å; L855-L932 HydrophobicContact CD2-CD2 4.12Å
856	T	78.8	Confident	80.8	Confident	28 Å²	28	63.6 Å²	63.6	17%	0.172	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.5	166.2	54.2	0	0	0	0	110.6	K854 I863 E865	K854-T856 HydrophobicContact CD-CG2 4.29Å; T856-I863 PolarHBondContact N-O 2.26Å; T856-I863 PolarHBondContact O-N 2.84Å; T856-E865 WeakPolarHBondContact CB-OE1 3.41Å; T856-E865 VanDerWaalsContact CG2-CD 3.49Å; T856-E865 HydrophobicContact CG2-CG 4.47Å; T856-E865 WeakPolarHBondContact CG2-OE1 3.1Å; T856-E865 PolarHBondContact OG1-OE1 3.34Å
857	S	74.1	Confident	80.5	Confident	97 Å²	97	65.5 Å²	65.5	68%	0.678	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	171.3	-172.9	0	0	0	0	108.2
858	K	70.6	Confident	80.3	Confident	82 Å²	82	64.2 Å²	64.2	36%	0.357	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	123.5	-174.1	-171.7	-179.7	178.7	-176.6	0	106.6	N860 K861 I863 E899	K858-N860 VanDerWaalsContact C-N 3.3Å; K858-N860 PolarHBondContact O-N 3.36Å; K858-K861 PolarHBondContact N-O 3.19Å; K858-K861 VanDerWaalsContact N-O 3.08Å; K858-K861 PolarHBondContact O-N 2.7Å; K858-I863 HydrophobicContact CB-CD1 3.85Å; K858-I863 HydrophobicContact CD-CD1 3.74Å; K858-I863 HydrophobicContact CG-CD1 4.32Å; K858-E899 IonicContact NZ-OE1 2.74Å; K858-E899 PolarHBondContact NZ-OE1 3.1Å; K858-E899 IonicContact NZ-OE2 3.39Å; K858-E899 PolarHBondContact NZ-OE2 3.12Å
859	D	65.1	Low	79.9	Confident	150 Å²	150	68.6 Å²	68.6	80%	0.802	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	44.2	179.6	-48.5	-42.9	0	0	0	114	K861	D859-K861 PolarHBondContact O-N 3.22Å; D859-K861 VanDerWaalsContact O-N 3.15Å
860	N	68.3	Low	79.5	Confident	156 Å²	156	69.1 Å²	69.1	83%	0.834	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	15.8	-173.4	-74.2	11.5	0	0	0	116	K858	K858-N860 VanDerWaalsContact C-N 3.3Å; K858-N860 PolarHBondContact O-N 3.36Å
861	K	75.3	Confident	79.3	Confident	84 Å²	84	69.2 Å²	69.2	37%	0.365	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.3	170.6	-65.2	-163.4	177.1	-172	0	111.9	K858 D859 E889 T901	K858-K861 PolarHBondContact N-O 3.19Å; K858-K861 VanDerWaalsContact N-O 3.08Å; K858-K861 PolarHBondContact O-N 2.7Å; D859-K861 PolarHBondContact O-N 3.22Å; D859-K861 VanDerWaalsContact O-N 3.15Å; K861-E889 IonicContact NZ-OE1 3.4Å; K861-E889 PolarHBondContact NZ-OE1 3.15Å; K861-T901 HydrophobicContact CB-CG2 4.47Å; K861-T901 HydrophobicContact CD-CG2 3.8Å
862	S	82	Confident	79.3	Confident	22 Å²	22	64.6 Å²	64.6	15%	0.154	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	119.2	170.8	-46.9	0	0	0	0	110	V902 L932	S862-V902 WeakPolarHBondContact O-CG2 3.37Å; S862-V902 PolarHBondContact O-N 3.13Å; S862-L932 WeakPolarHBondContact OG-CD2 3.32Å
863	I	83.9	Confident	79.4	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.056	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.3	-179.2	-59.9	-177.5	0	0	0	109.3	L855 T856 K858 E899 C900	L855-I863 WeakPolarHBondContact CA-O 3.44Å; L855-I863 WeakPolarHBondContact CD1-O 3.32Å; T856-I863 PolarHBondContact N-O 2.26Å; T856-I863 PolarHBondContact O-N 2.84Å; K858-I863 HydrophobicContact CB-CD1 3.85Å; K858-I863 HydrophobicContact CD-CD1 3.74Å; K858-I863 HydrophobicContact CG-CD1 4.32Å; I863-E899 HydrophobicContact CG2-CB 3.83Å; I863-E899 HydrophobicContact CG2-CG 4.18Å; I863-C900 WeakPolarHBondContact CA-O 3.48Å
864	V	85.8	Confident	79.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113	168.1	-177.1	0	0	0	0	108.2	P853 L855 L866 V883 C900 V902 V916 V930	P853-V864 HydrophobicContact CB-CG1 3.78Å; L855-V864 HydrophobicContact CD1-CG2 4.02Å; V864-L866 HydrophobicContact CG1-CG 4.32Å; V864-V883 HydrophobicContact CG2-CG2 4.42Å; V864-C900 HydrophobicContact CB-CB 4.26Å; V864-C900 PolarHBondContact N-O 2.92Å; V864-C900 PolarHBondContact O-N 2.95Å; V864-V902 HydrophobicContact CG2-CG2 3.75Å; V864-V916 HydrophobicContact CG1-CG1 4.3Å; V864-V916 HydrophobicContact CG1-CG2 4.06Å; V864-V930 HydrophobicContact CG2-CG2 4.16Å
865	E	84.9	Confident	79.4	Confident	39 Å²	39	62.3 Å²	62.3	18%	0.182	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	110.9	169.8	-74.4	171.9	-161.4	0	0	109.4	K854 T856 T897	K854-E865 HydrophobicContact CB-CB 4.4Å; K854-E865 PolarHBondContact N-O 3.03Å; K854-E865 IonicContact NZ-OE2 3.84Å; K854-E865 PolarHBondContact O-N 2.7Å; T856-E865 WeakPolarHBondContact CB-OE1 3.41Å; T856-E865 VanDerWaalsContact CG2-CD 3.49Å; T856-E865 HydrophobicContact CG2-CG 4.47Å; T856-E865 WeakPolarHBondContact CG2-OE1 3.1Å; T856-E865 PolarHBondContact OG1-OE1 3.34Å; E865-T897 HydrophobicContact CB-CG2 3.93Å; E865-T897 HydrophobicContact CG-CG2 4.13Å
866	L	86.6	Confident	79.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	109.3	168.8	-82.1	164.6	0	0	0	109.1	F850 P853 V864 L881 L898 V916 L927	F850-L866 HydrophobicContact CB-CD2 4.23Å; F850-L866 HydrophobicContact CD1-CB 3.92Å; F850-L866 HydrophobicContact CD1-CD1 4.47Å; F850-L866 HydrophobicContact CD1-CD2 4.42Å; F850-L866 HydrophobicContact CE1-CB 4.26Å; F850-L866 HydrophobicContact CG-CD2 4.43Å; P853-L866 HydrophobicContact CB-CD2 3.76Å; P853-L866 HydrophobicContact CB-CG 4.28Å; V864-L866 HydrophobicContact CG1-CG 4.32Å; L866-L881 HydrophobicContact CD1-CD1 3.55Å; L866-L881 HydrophobicContact CD1-CD2 3.76Å; L866-L881 HydrophobicContact CD1-CG 4.34Å; L866-L898 HydrophobicContact CB-CB 4.16Å; L866-L898 HydrophobicContact CD1-CD2 4.36Å; L866-L898 PolarHBondContact N-O 3.11Å; L866-L898 PolarHBondContact O-N 2.86Å; L866-V916 HydrophobicContact CD1-CG1 3.96Å; L866-L927 HydrophobicContact CD1-CD1 3.68Å; L866-L927 HydrophobicContact CD2-CB 4.25Å; L866-L927 HydrophobicContact CD2-CD1 3.94Å; L866-L927 HydrophobicContact CG-CD1 4.5Å
867	K	82.8	Confident	79.6	Confident	112 Å²	112	65.1 Å²	65.1	49%	0.487	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	136.2	170.1	-72.3	-175.6	179.2	-179.1	0	109.6	F850 Q851 N896 T897	F850-K867 CarbonylContact C-O 3.5Å; F850-K867 WeakPolarHBondContact CA-O 3.17Å; Q851-K867 HydrophobicContact CB-CB 4.44Å; Q851-K867 PolarHBondContact N-O 3.26Å; K867-N896 WeakPolarHBondContact CA-O 3.3Å; K867-T897 HydrophobicContact CG-CG2 4.13Å
868	G	81.4	Confident	79.5	Confident	9 Å²	9	60.9 Å²	60.9	9%	0.093	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	167.1	-180	0	0	0	0	0	114.3	L849 N896	L849-G868 CarbonylContact O-C 3.4Å; L849-G868 WeakPolarHBondContact O-CA 3.49Å; G868-N896 PolarHBondContact N-O 2.78Å
869	D	77.4	Confident	79.5	Confident	93 Å²	93	63.5 Å²	63.5	50%	0.497	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	158.4	175.2	-166.2	18	0	0	0	111.3	P848 L849 M871	P848-D869 WeakPolarHBondContact CA-O 3.36Å; L849-D869 PolarHBondContact N-O 2.77Å; L849-D869 VanDerWaalsContact N-O 3.1Å; L849-D869 PolarHBondContact O-N 3.05Å; D869-M871 PolarHBondContact O-N 2.87Å
870	R	74.1	Confident	80.1	Confident	100 Å²	100	56.5 Å²	56.5	38%	0.377	26%	0.262	S	S	.	.	S	Bend	trans	62.9	32.4	177.2	-44	-173.8	-57.8	-175.1	10.5	114.9	E846 D847 D872	E846-R870 WeakPolarHBondContact OE2-CD 3.4Å; E846-R870 IonicContact OE2-CZ 2.77Å; E846-R870 IonicContact OE2-NE 3.78Å; E846-R870 PolarHBondContact OE2-NE 3.29Å; E846-R870 IonicContact OE2-NH1 2.8Å; E846-R870 PolarHBondContact OE2-NH1 2.82Å; E846-R870 IonicContact OE2-NH2 3.58Å; D847-R870 PolarHBondContact O-NH2 2.94Å; R870-D872 PolarHBondContact O-N 2.93Å
871	M	81.3	Confident	80.7	Confident	26 Å²	26	49.1 Å²	49.1	13%	0.128	22%	0.223	C	C	.	.			trans	-82.2	99.9	-179.6	-61.6	-168.7	-65.8	0	0	112.6	P848 F850 D869 M876 V893 N896 L898	P848-M871 HydrophobicContact CB-CG 4.01Å; F850-M871 HydrophobicContact CD1-SD 4.42Å; F850-M871 HydrophobicContact CE1-CG 4.5Å; F850-M871 HydrophobicContact CE1-SD 3.76Å; D869-M871 PolarHBondContact O-N 2.87Å; M871-M876 HydrophobicContact CB-CE 3.77Å; M871-M876 HydrophobicContact CG-CE 3.68Å; M871-M876 HydrophobicContact SD-CE 4.04Å; M871-V893 HydrophobicContact CB-CG1 4.47Å; M871-V893 HydrophobicContact CE-CG1 4.26Å; M871-N896 WeakPolarHBondContact CE-O 3.39Å; M871-L898 HydrophobicContact CE-CB 4.45Å; M871-L898 HydrophobicContact SD-CB 3.87Å
872	D	85.1	Confident	81.1	Confident	29 Å²	29	45.3 Å²	45.3	16%	0.155	21%	0.207	C	C	.	.			trans	-76	125.1	175.4	-176.4	-71.8	0	0	0	112.3	R760 V845 R870 E874 A875 M876	R760-D872 WeakPolarHBondContact CD-OD1 3.28Å; R760-D872 VanDerWaalsContact CD-OD2 3.27Å; R760-D872 WeakPolarHBondContact CD-OD2 3.44Å; R760-D872 IonicContact CZ-OD2 2.79Å; R760-D872 IonicContact NE-OD2 3.76Å; R760-D872 IonicContact NH1-OD2 3.18Å; R760-D872 PolarHBondContact NH1-OD2 2.6Å; V845-D872 HydrophobicContact CG1-CB 4.49Å; V845-D872 HydrophobicContact CG2-CB 3.85Å; R870-D872 PolarHBondContact O-N 2.93Å; D872-E874 VanDerWaalsContact C-N 3.31Å; D872-E874 PolarHBondContact O-N 2.98Å; D872-E874 WeakPolarHBondContact OD1-CA 3.42Å; D872-E874 WeakPolarHBondContact OD1-CB 3.13Å; D872-E874 PolarHBondContact OD1-N 2.91Å; D872-A875 HydrophobicContact CB-CB 4.09Å; D872-A875 PolarHBondContact O-N 3.41Å; D872-A875 PolarHBondContact OD1-N 3.23Å; D872-M876 WeakPolarHBondContact O-CB 3.33Å; D872-M876 VanDerWaalsContact O-CG 3.23Å; D872-M876 WeakPolarHBondContact O-CG 3.42Å; D872-M876 PolarHBondContact O-N 2.99Å
873	R	82.6	Confident	81.2	Confident	187 Å²	187	44.3 Å²	44.3	71%	0.706	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.8	-175.5	-65.2	-176.9	-179.9	175	0.7	114.9	V893	R873-V893 HydrophobicContact CG-CB 4.38Å
874	E	83.1	Confident	80.9	Confident	44 Å²	44	45.5 Å²	45.5	21%	0.206	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-43.7	177.2	-176.8	62.1	-155	0	0	110	P758 L759 R760 D872 M876 K877	P758-E874 WeakPolarHBondContact CA-OE1 3.08Å; P758-E874 HydrophobicContact CB-CG 4.36Å; P758-E874 WeakPolarHBondContact CB-O 3.26Å; P758-E874 WeakPolarHBondContact CB-OE1 3.24Å; L759-E874 HydrophobicContact CB-CG 4.23Å; L759-E874 PolarHBondContact N-OE1 3.19Å; R760-E874 HydrophobicContact CB-CB 4.09Å; R760-E874 HydrophobicContact CB-CG 3.95Å; R760-E874 HydrophobicContact CG-CB 3.96Å; R760-E874 HydrophobicContact CG-CG 3.8Å; D872-E874 VanDerWaalsContact C-N 3.31Å; D872-E874 PolarHBondContact O-N 2.98Å; D872-E874 WeakPolarHBondContact OD1-CA 3.42Å; D872-E874 WeakPolarHBondContact OD1-CB 3.13Å; D872-E874 PolarHBondContact OD1-N 2.91Å; E874-M876 VanDerWaalsContact C-N 3.33Å; E874-M876 PolarHBondContact O-N 3.28Å; E874-K877 VanDerWaalsContact O-CB 3.3Å; E874-K877 WeakPolarHBondContact O-CB 3.06Å; E874-K877 WeakPolarHBondContact O-CG 3.49Å; E874-K877 PolarHBondContact O-N 2.91Å; E874-K877 IonicContact OE1-NZ 2.69Å; E874-K877 VanDerWaalsContact OE2-CE 3.28Å; E874-K877 WeakPolarHBondContact OE2-CE 3.43Å; E874-K877 IonicContact OE2-NZ 3.66Å; E874-K877 PolarHBondContact OE2-NZ 3.35Å
875	A	83.6	Confident	80.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-67.9	-29.7	176.4	0	0	0	0	0	112.6	R760 F762 V845 D872 K877 C878	R760-A875 HydrophobicContact CB-CB 3.91Å; F762-A875 HydrophobicContact CD1-CB 4.21Å; F762-A875 HydrophobicContact CD2-CB 4.1Å; F762-A875 HydrophobicContact CE1-CB 3.72Å; F762-A875 HydrophobicContact CE2-CB 3.59Å; F762-A875 WeakPolarHBondContact CE2-O 3.17Å; F762-A875 HydrophobicContact CG-CB 4.39Å; F762-A875 HydrophobicContact CZ-CB 3.39Å; V845-A875 HydrophobicContact CG2-CB 3.87Å; D872-A875 HydrophobicContact CB-CB 4.09Å; D872-A875 PolarHBondContact O-N 3.41Å; D872-A875 PolarHBondContact OD1-N 3.23Å; A875-K877 PolarHBondContact O-N 2.8Å; A875-K877 VanDerWaalsContact O-N 3.13Å; A875-C878 WeakPolarHBondContact O-CB 3.21Å; A875-C878 PolarHBondContact O-N 2.61Å; A875-C878 VanDerWaalsContact O-N 3.11Å; A875-C878 PolarHBondContact O-SG 2.88Å
876	M	82.3	Confident	80.2	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.044	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-63.3	-15.6	173.4	-74.4	-63.6	177.1	0	0	113.9	F762 P848 F850 M871 D872 E874 C878 L891 V893 L898 W918	F762-M876 HydrophobicContact CE2-SD 4.39Å; F762-M876 HydrophobicContact CZ-CE 3.95Å; F762-M876 HydrophobicContact CZ-CG 4.23Å; F762-M876 HydrophobicContact CZ-SD 3.98Å; P848-M876 HydrophobicContact CB-CE 4.07Å; P848-M876 HydrophobicContact CG-CE 3.92Å; F850-M876 HydrophobicContact CE1-CE 4.36Å; F850-M876 HydrophobicContact CZ-CE 3.94Å; M871-M876 HydrophobicContact CB-CE 3.77Å; M871-M876 HydrophobicContact CG-CE 3.68Å; M871-M876 HydrophobicContact SD-CE 4.04Å; D872-M876 WeakPolarHBondContact O-CB 3.33Å; D872-M876 VanDerWaalsContact O-CG 3.23Å; D872-M876 WeakPolarHBondContact O-CG 3.42Å; D872-M876 PolarHBondContact O-N 2.99Å; E874-M876 VanDerWaalsContact C-N 3.33Å; E874-M876 PolarHBondContact O-N 3.28Å; M876-C878 PolarHBondContact O-N 2.03Å; M876-L891 WeakPolarHBondContact O-CD2 3.43Å; M876-V893 HydrophobicContact CB-CG2 4.2Å; M876-V893 HydrophobicContact CG-CG2 3.96Å; M876-L898 HydrophobicContact CE-CD2 4.31Å; M876-L898 HydrophobicContact CG-CD1 4.45Å; M876-L898 HydrophobicContact SD-CD1 4.15Å; M876-L898 HydrophobicContact SD-CD2 4.1Å; M876-W918 HydrophobicContact CE-CH2 3.87Å; M876-W918 HydrophobicContact CE-CZ3 4.15Å; M876-W918 HydrophobicContact SD-CH2 3.83Å; M876-W918 HydrophobicContact SD-CZ3 3.95Å
877	K	81.1	Confident	79.9	Confident	118 Å²	118	55.4 Å²	55.4	51%	0.513	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-67.5	-14.8	173	-62.7	174.5	176.5	174.9	0	113.6	P758 E874 A875 Q879	P758-K877 HydrophobicContact CB-CB 4.05Å; P758-K877 HydrophobicContact CB-CD 4.34Å; P758-K877 HydrophobicContact CG-CB 4.4Å; E874-K877 VanDerWaalsContact O-CB 3.3Å; E874-K877 WeakPolarHBondContact O-CB 3.06Å; E874-K877 WeakPolarHBondContact O-CG 3.49Å; E874-K877 PolarHBondContact O-N 2.91Å; E874-K877 IonicContact OE1-NZ 2.69Å; E874-K877 VanDerWaalsContact OE2-CE 3.28Å; E874-K877 WeakPolarHBondContact OE2-CE 3.43Å; E874-K877 IonicContact OE2-NZ 3.66Å; E874-K877 PolarHBondContact OE2-NZ 3.35Å; A875-K877 PolarHBondContact O-N 2.8Å; A875-K877 VanDerWaalsContact O-N 3.13Å; K877-Q879 PolarHBondContact O-N 2.86Å
878	C	73	Confident	79.8	Confident	7 Å²	7	51 Å²	51	5%	0.047	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-64.3	-0.1	-174.8	-70.6	0	0	0	0	116.6	P758 C767 A875 M876 V880	P758-C878 WeakPolarHBondContact CG-SG 3.3Å; C767-C878 HydrophobicContact CB-CB 3.58Å; C767-C878 WeakPolarHBondContact CB-SG 3.24Å; C767-C878 WeakPolarHBondContact SG-CB 3.42Å; C767-C878 CovalentContact SG-SG 2.02Å; C767-C878 PolarHBondContact SG-SG 2.74Å; A875-C878 WeakPolarHBondContact O-CB 3.21Å; A875-C878 PolarHBondContact O-N 2.61Å; A875-C878 VanDerWaalsContact O-N 3.11Å; A875-C878 PolarHBondContact O-SG 2.88Å; M876-C878 PolarHBondContact O-N 2.03Å; C878-V880 HydrophobicContact CB-CG1 3.78Å; C878-V880 HydrophobicContact CB-CG2 4.18Å; C878-V880 PolarHBondContact O-N 3.42Å; C878-V880 VanDerWaalsContact O-N 3.15Å
879	Q	70.4	Confident	79.8	Confident	137 Å²	137	55 Å²	55	64%	0.64	26%	0.264	S	S	*	.			trans	53.3	28.7	-173.7	-58.2	-172.7	1.8	0	0	114.6	K877 L881	K877-Q879 PolarHBondContact O-N 2.86Å; Q879-L881 VanDerWaalsContact C-N 3.27Å; Q879-L881 PolarHBondContact O-N 3.37Å
880	V	76.6	Confident	80	Confident	3 Å²	3	53 Å²	53	2%	0.018	26%	0.258	C	S	.	.			trans	-73.9	-11.2	-177.4	-76.4	0	0	0	0	114.6	F762 C878 W918 R919	F762-V880 HydrophobicContact CD2-CG2 4.16Å; F762-V880 HydrophobicContact CE2-CG2 3.87Å; C878-V880 HydrophobicContact CB-CG1 3.78Å; C878-V880 HydrophobicContact CB-CG2 4.18Å; C878-V880 PolarHBondContact O-N 3.42Å; C878-V880 VanDerWaalsContact O-N 3.15Å; V880-W918 HydrophobicContact CB-CH2 4.34Å; V880-W918 HydrophobicContact CB-CZ2 4.38Å; V880-W918 HydrophobicContact CB-CZ3 4.38Å; V880-W918 HydrophobicContact CG2-CE3 4.15Å; V880-W918 HydrophobicContact CG2-CH2 3.35Å; V880-W918 HydrophobicContact CG2-CZ2 3.76Å; V880-W918 HydrophobicContact CG2-CZ3 3.56Å; V880-R919 PolarHBondContact O-N 3.28Å
881	L	82.4	Confident	80.3	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.1	172.6	-172.3	75.8	0	0	0	110.2	L866 Q879 L891 L898 C900 V916 W918 L927	L866-L881 HydrophobicContact CD1-CD1 3.55Å; L866-L881 HydrophobicContact CD1-CD2 3.76Å; L866-L881 HydrophobicContact CD1-CG 4.34Å; Q879-L881 VanDerWaalsContact C-N 3.27Å; Q879-L881 PolarHBondContact O-N 3.37Å; L881-L891 HydrophobicContact CD2-CD1 3.83Å; L881-L898 HydrophobicContact CD2-CD2 3.96Å; L881-C900 HydrophobicContact CD2-CB 3.74Å; L881-V916 HydrophobicContact CD1-CG1 4.03Å; L881-W918 HydrophobicContact CB-CE3 4.45Å; L881-W918 HydrophobicContact CD1-CE3 4.31Å; L881-L927 HydrophobicContact CD1-CD1 3.81Å
882	T	82.3	Confident	80.3	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.1	174.4	48.6	0	0	0	0	111.6	H886 E917	T882-H886 CarbonylContact C-O 3.53Å; T882-H886 WeakPolarHBondContact CA-O 3.26Å; T882-H886 WeakPolarHBondContact CB-O 3.49Å; T882-E917 PolarHBondContact N-O 3.49Å; T882-E917 PolarHBondContact O-N 3.35Å
883	V	83.7	Confident	80.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	113.4	172	-179.3	0	0	0	0	107.4	V864 N885 H886 L906 L914 Q915	V864-V883 HydrophobicContact CG2-CG2 4.42Å; V883-N885 PolarHBondContact O-N 2.81Å; V883-H886 PolarHBondContact N-O 2.93Å; V883-H886 PolarHBondContact O-N 2.91Å; V883-L906 HydrophobicContact CG1-CD1 4.21Å; V883-L906 WeakPolarHBondContact O-CD1 3.31Å; V883-L914 HydrophobicContact CG1-CB 3.88Å; V883-L914 HydrophobicContact CG1-CD1 4.23Å; V883-L914 HydrophobicContact CG1-CG 4.47Å; V883-Q915 CarbonylContact C-O 3.58Å; V883-Q915 WeakPolarHBondContact CA-O 3.33Å
884	S	78.9	Confident	80.1	Confident	37 Å²	37	47.7 Å²	47.7	26%	0.259	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	52.5	-179.5	-52.1	0	0	0	0	112.6	H886 L914 Q915	S884-H886 VanDerWaalsContact C-N 3.25Å; S884-H886 PolarHBondContact O-CD2 3.06Å; S884-H886 PolarHBondContact O-N 2.69Å; S884-L914 WeakPolarHBondContact OG-CA 3.34Å; S884-Q915 PolarHBondContact N-O 2.84Å; S884-Q915 PolarHBondContact OG-N 3.05Å; S884-Q915 VanDerWaalsContact OG-N 3.1Å
885	N	73.5	Confident	80	Confident	107 Å²	107	48 Å²	48	57%	0.572	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	-2.3	-175.9	-154.7	31.7	0	0	0	117.5	V883 R919	V883-N885 PolarHBondContact O-N 2.81Å; N885-R919 PolarHBondContact OD1-NH2 2.93Å
886	H	81.3	Confident	79.9	Confident	81 Å²	81	53.2 Å²	53.2	38%	0.375	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	145.5	174.2	-67.2	-101.6	0	0	0	112.2	T882 V883 S884 P903 L906	T882-H886 CarbonylContact C-O 3.53Å; T882-H886 WeakPolarHBondContact CA-O 3.26Å; T882-H886 WeakPolarHBondContact CB-O 3.49Å; V883-H886 PolarHBondContact N-O 2.93Å; V883-H886 PolarHBondContact O-N 2.91Å; S884-H886 VanDerWaalsContact C-N 3.25Å; S884-H886 PolarHBondContact O-CD2 3.06Å; S884-H886 PolarHBondContact O-N 2.69Å; H886-P903 HydrophobicContact CB-CG 4.37Å; H886-L906 HydrophobicContact CB-CD1 4.23Å
887	S	81.5	Confident	79.9	Confident	58 Å²	58	54.1 Å²	54.1	41%	0.406	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	146.7	171.4	51.1	0	0	0	0	111.8	P903	S887-P903 WeakPolarHBondContact O-CG 3.31Å
888	C	81.1	Confident	80.1	Confident	21 Å²	21	48.5 Å²	48.5	14%	0.142	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-58.3	143.5	175.5	-52.4	0	0	0	0	112.1	S890 C900	C888-S890 VanDerWaalsContact C-N 3.3Å; C888-S890 WeakPolarHBondContact CB-O 3.27Å; C888-S890 PolarHBondContact O-N 2.92Å; C888-C900 HydrophobicContact CB-CB 4.05Å; C888-C900 WeakPolarHBondContact CB-SG 3.4Å; C888-C900 WeakPolarHBondContact SG-CB 3.4Å; C888-C900 CovalentContact SG-SG 2.04Å; C888-C900 PolarHBondContact SG-SG 3.06Å
889	E	81.3	Confident	80.7	Confident	91 Å²	91	49.6 Å²	49.6	43%	0.425	29%	0.286	S	S	.	.	S	Bend	trans	-65	-37.2	175.4	-176	-171.4	122.3	0	0	111.5	K861 T901	K861-E889 IonicContact NZ-OE1 3.4Å; K861-E889 PolarHBondContact NZ-OE1 3.15Å; E889-T901 HydrophobicContact CB-CG2 4.03Å; E889-T901 PolarHBondContact N-O 2.57Å
890	S	80.1	Confident	81.5	Confident	53 Å²	53	43 Å²	43	37%	0.371	26%	0.256	S	S	.	.			trans	-144.5	149.8	167.9	67.7	0	0	0	0	109.6	C888 T901	C888-S890 VanDerWaalsContact C-N 3.3Å; C888-S890 WeakPolarHBondContact CB-O 3.27Å; C888-S890 PolarHBondContact O-N 2.92Å; S890-T901 PolarHBondContact O-N 2.91Å; S890-T901 WeakPolarHBondContact OG-CB 3.43Å; S890-T901 PolarHBondContact OG-OG1 3.38Å
891	L	81.4	Confident	81.9	Confident	54 Å²	54	43.4 Å²	43.4	28%	0.283	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	119.8	179.5	-170.6	70	0	0	0	109.6	M876 L881 L898 E899 C900	M876-L891 WeakPolarHBondContact O-CD2 3.43Å; L881-L891 HydrophobicContact CD2-CD1 3.83Å; L891-L898 HydrophobicContact CD1-CD1 3.67Å; L891-L898 HydrophobicContact CD1-CD2 4.16Å; L891-L898 HydrophobicContact CD1-CG 3.79Å; L891-L898 HydrophobicContact CD2-CD1 4.3Å; L891-L898 HydrophobicContact CG-CD1 3.8Å; L891-L898 HydrophobicContact CG-CG 4.47Å; L891-E899 WeakPolarHBondContact CA-O 3.44Å; L891-C900 HydrophobicContact CD1-CB 3.78Å
892	T	81.6	Confident	81.9	Confident	66 Å²	66	43.3 Å²	43.3	41%	0.405	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.3	-172.8	38.5	0	0	0	0	112.4	E899	T892-E899 PolarHBondContact N-O 2.89Å; T892-E899 PolarHBondContact O-N 3.44Å
893	V	82.4	Confident	81.9	Confident	31 Å²	31	43.6 Å²	43.6	19%	0.188	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	107	178.3	-176.1	0	0	0	0	110	M871 R873 M876 L898	M871-V893 HydrophobicContact CB-CG1 4.47Å; M871-V893 HydrophobicContact CE-CG1 4.26Å; R873-V893 HydrophobicContact CG-CB 4.38Å; M876-V893 HydrophobicContact CB-CG2 4.2Å; M876-V893 HydrophobicContact CG-CG2 3.96Å; V893-L898 HydrophobicContact CG2-CD1 3.74Å
894	V	81.1	Confident	81.4	Confident	79 Å²	79	47.6 Å²	47.6	48%	0.479	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	97.1	-179	-174.1	0	0	0	0	109	N896 T897 E899	V894-N896 PolarHBondContact O-N 3.05Å; V894-T897 PolarHBondContact N-O 2.87Å; V894-T897 PolarHBondContact O-N 2.82Å; V894-E899 HydrophobicContact CG2-CG 4.43Å
895	G	80.4	Confident	81	Confident	51 Å²	51	52.6 Å²	52.6	53%	0.526	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	-122.9	-170.7	0	0	0	0	0	110.9
896	N	80.9	Confident	81	Confident	109 Å²	109	48.6 Å²	48.6	58%	0.583	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	23.2	175.8	-68.9	39.7	0	0	0	112.7	K867 G868 M871 V894	K867-N896 WeakPolarHBondContact CA-O 3.3Å; G868-N896 PolarHBondContact N-O 2.78Å; M871-N896 WeakPolarHBondContact CE-O 3.39Å; V894-N896 PolarHBondContact O-N 3.05Å
897	T	82.1	Confident	80.3	Confident	28 Å²	28	47.7 Å²	47.7	17%	0.172	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.8	174.1	-41.5	0	0	0	0	110.3	E865 K867 V894	E865-T897 HydrophobicContact CB-CG2 3.93Å; E865-T897 HydrophobicContact CG-CG2 4.13Å; K867-T897 HydrophobicContact CG-CG2 4.13Å; V894-T897 PolarHBondContact N-O 2.87Å; V894-T897 PolarHBondContact O-N 2.82Å
898	L	85.2	Confident	79.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	111.4	171.4	-177.9	69.3	0	0	0	107.8	F850 L866 M871 M876 L881 L891 V893	F850-L898 HydrophobicContact CE1-CD2 3.77Å; F850-L898 HydrophobicContact CZ-CD2 3.98Å; L866-L898 HydrophobicContact CB-CB 4.16Å; L866-L898 HydrophobicContact CD1-CD2 4.36Å; L866-L898 PolarHBondContact N-O 3.11Å; L866-L898 PolarHBondContact O-N 2.86Å; M871-L898 HydrophobicContact CE-CB 4.45Å; M871-L898 HydrophobicContact SD-CB 3.87Å; M876-L898 HydrophobicContact CE-CD2 4.31Å; M876-L898 HydrophobicContact CG-CD1 4.45Å; M876-L898 HydrophobicContact SD-CD1 4.15Å; M876-L898 HydrophobicContact SD-CD2 4.1Å; L881-L898 HydrophobicContact CD2-CD2 3.96Å; L891-L898 HydrophobicContact CD1-CD1 3.67Å; L891-L898 HydrophobicContact CD1-CD2 4.16Å; L891-L898 HydrophobicContact CD1-CG 3.79Å; L891-L898 HydrophobicContact CD2-CD1 4.3Å; L891-L898 HydrophobicContact CG-CD1 3.8Å; L891-L898 HydrophobicContact CG-CG 4.47Å; V893-L898 HydrophobicContact CG2-CD1 3.74Å
899	E	86.7	Confident	78.1	Confident	29 Å²	29	49.8 Å²	49.8	14%	0.136	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	117.1	174.1	-67.9	-174.5	-166.7	0	0	108.9	K858 I863 L891 T892 V894	K858-E899 IonicContact NZ-OE1 2.74Å; K858-E899 PolarHBondContact NZ-OE1 3.1Å; K858-E899 IonicContact NZ-OE2 3.39Å; K858-E899 PolarHBondContact NZ-OE2 3.12Å; I863-E899 HydrophobicContact CG2-CB 3.83Å; I863-E899 HydrophobicContact CG2-CG 4.18Å; L891-E899 WeakPolarHBondContact CA-O 3.44Å; T892-E899 PolarHBondContact N-O 2.89Å; T892-E899 PolarHBondContact O-N 3.44Å; V894-E899 HydrophobicContact CG2-CG 4.43Å
900	C	86.3	Confident	76.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.4	173.5	162.5	0	0	0	0	109.9	I863 V864 L881 C888 L891 V902	I863-C900 WeakPolarHBondContact CA-O 3.48Å; V864-C900 HydrophobicContact CB-CB 4.26Å; V864-C900 PolarHBondContact N-O 2.92Å; V864-C900 PolarHBondContact O-N 2.95Å; L881-C900 HydrophobicContact CD2-CB 3.74Å; C888-C900 HydrophobicContact CB-CB 4.05Å; C888-C900 WeakPolarHBondContact CB-SG 3.4Å; C888-C900 WeakPolarHBondContact SG-CB 3.4Å; C888-C900 CovalentContact SG-SG 2.04Å; C888-C900 PolarHBondContact SG-SG 3.06Å; L891-C900 HydrophobicContact CD1-CB 3.78Å; C900-V902 PolarHBondContact O-N 2.88Å
901	T	85.8	Confident	75.6	Confident	10 Å²	10	54.7 Å²	54.7	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	119.8	173.1	-59.4	0	0	0	0	109.6	K861 E889 S890	K861-T901 HydrophobicContact CB-CG2 4.47Å; K861-T901 HydrophobicContact CD-CG2 3.8Å; E889-T901 HydrophobicContact CB-CG2 4.03Å; E889-T901 PolarHBondContact N-O 2.57Å; S890-T901 PolarHBondContact O-N 2.91Å; S890-T901 WeakPolarHBondContact OG-CB 3.43Å; S890-T901 PolarHBondContact OG-OG1 3.38Å
902	V	83.1	Confident	74.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-66	126.4	176.3	178.8	0	0	0	0	109.1	L855 S862 V864 C900 T904 L906 Q907 L914	L855-V902 HydrophobicContact CD1-CG2 4.48Å; S862-V902 WeakPolarHBondContact O-CG2 3.37Å; S862-V902 PolarHBondContact O-N 3.13Å; V864-V902 HydrophobicContact CG2-CG2 3.75Å; C900-V902 PolarHBondContact O-N 2.88Å; V902-T904 PolarHBondContact O-N 2.92Å; V902-L906 HydrophobicContact CG1-CB 3.92Å; V902-L906 HydrophobicContact CG1-CD1 4.44Å; V902-Q907 HydrophobicContact CG1-CG 4.31Å; V902-Q907 PolarHBondContact O-NE2 2.97Å; V902-L914 HydrophobicContact CG1-CD1 3.81Å; V902-L914 HydrophobicContact CG2-CD1 4.37Å
903	P	80.9	Confident	74.4	Confident	11 Å²	11	60.9 Å²	60.9	7%	0.071	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-54.3	138.6	177.7	-28.3	35.8	0	0	0	113.2	H886 S887 Q905 L906 Q907	H886-P903 HydrophobicContact CB-CG 4.37Å; S887-P903 WeakPolarHBondContact O-CG 3.31Å; P903-Q905 PolarHBondContact O-N 2.93Å; P903-L906 PolarHBondContact O-N 3.15Å; P903-Q907 PolarHBondContact O-N 3.18Å
904	T	73	Confident	74.4	Confident	84 Å²	84	59.5 Å²	59.5	52%	0.515	36%	0.356	S	S	.	.	H	α-helix	trans	-50.9	-32.1	177.1	52.8	0	0	0	0	113.8	V902 L906 Q907	V902-T904 PolarHBondContact O-N 2.92Å; T904-L906 PolarHBondContact O-N 2.86Å; T904-Q907 PolarHBondContact O-N 2.9Å; T904-Q907 VanDerWaalsContact O-N 3.14Å
905	Q	71.6	Confident	74.6	Confident	141 Å²	141	59 Å²	59	66%	0.659	35%	0.349	S	S	*	.	H	α-helix	trans	-55.5	-32.2	174	-64.4	166.7	-6.1	0	0	113.7	P903	P903-Q905 PolarHBondContact O-N 2.93Å
906	L	72.7	Confident	74.8	Confident	24 Å²	24	56.6 Å²	56.6	13%	0.126	32%	0.324	C	S	.	.	H	α-helix	trans	-94.4	-16.4	179.7	-65.6	175.6	0	0	0	113	V883 H886 V902 P903 T904 A908 L914	V883-L906 HydrophobicContact CG1-CD1 4.21Å; V883-L906 WeakPolarHBondContact O-CD1 3.31Å; H886-L906 HydrophobicContact CB-CD1 4.23Å; V902-L906 HydrophobicContact CG1-CB 3.92Å; V902-L906 HydrophobicContact CG1-CD1 4.44Å; P903-L906 PolarHBondContact O-N 3.15Å; T904-L906 PolarHBondContact O-N 2.86Å; L906-A908 VanDerWaalsContact C-N 3.35Å; L906-L914 HydrophobicContact CB-CD2 4.24Å; L906-L914 HydrophobicContact CD1-CD2 4.42Å
907	Q	66.5	Low	75.1	Confident	61 Å²	61	52.4 Å²	52.4	29%	0.285	30%	0.3	S	S	.	.	H	α-helix	trans	-75.8	-22.2	179.5	-62.9	174.5	0.9	0	0	112.7	V902 P903 T904 A909	V902-Q907 HydrophobicContact CG1-CG 4.31Å; V902-Q907 PolarHBondContact O-NE2 2.97Å; P903-Q907 PolarHBondContact O-N 3.18Å; T904-Q907 PolarHBondContact O-N 2.9Å; T904-Q907 VanDerWaalsContact O-N 3.14Å; Q907-A909 VanDerWaalsContact C-N 3.3Å; Q907-A909 PolarHBondContact O-N 2.9Å
908	A	60.3	Low	75.3	Confident	90 Å²	90	51.3 Å²	51.3	74%	0.744	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	2.5	-175.5	0	0	0	0	0	115.4	L906	L906-A908 VanDerWaalsContact C-N 3.35Å
909	A	56.3	Low	75.2	Confident	33 Å²	33	55.9 Å²	55.9	27%	0.273	31%	0.311	S	S	.	.			trans	-101.2	112.8	-178.1	0	0	0	0	0	111.4	Q907 A911 K912	Q907-A909 VanDerWaalsContact C-N 3.3Å; Q907-A909 PolarHBondContact O-N 2.9Å; A909-A911 PolarHBondContact O-N 2.91Å; A909-K912 HydrophobicContact CB-CD 4.07Å; A909-K912 HydrophobicContact CB-CG 4.18Å
910	T	53.3	Low	75.1	Confident	154 Å²	154	56.5 Å²	56.5	95%	0.945	31%	0.314	S	S	*	.	S	Bend	trans	-63.6	-15	-167.7	38	0	0	0	0	116.7
911	A	55.6	Low	74.9	Confident	93 Å²	93	57.8 Å²	57.8	77%	0.769	32%	0.324	S	S	*	.	S	Bend	trans	-157.2	103.6	164.8	0	0	0	0	0	110.9	A909	A909-A911 PolarHBondContact O-N 2.91Å
912	K	65.4	Low	74.6	Confident	136 Å²	136	60.2 Å²	60.2	59%	0.591	34%	0.337	S	S	*	.			trans	-140.7	137.2	165.8	-75	-169.7	175.5	-177.7	0	110.9	A909	A909-K912 HydrophobicContact CB-CD 4.07Å; A909-K912 HydrophobicContact CB-CG 4.18Å
913	E	73.7	Confident	74.5	Confident	115 Å²	115	62.8 Å²	62.8	54%	0.537	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.8	158.6	-61.3	-177.4	131.1	0	0	108.2	K929 T931	E913-K929 HydrophobicContact CB-CD 4.33Å; E913-K929 IonicContact OE1-NZ 2.64Å; E913-K929 WeakPolarHBondContact OE2-CD 3.13Å; E913-K929 WeakPolarHBondContact OE2-CE 3.03Å; E913-K929 IonicContact OE2-NZ 2.68Å; E913-K929 PolarHBondContact OE2-NZ 3.33Å; E913-T931 HydrophobicContact CG-CG2 4.14Å
914	L	81.8	Confident	74.5	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	117.4	173.9	-61	177.9	0	0	0	109	V883 S884 V902 L906 K929 V930 L932	V883-L914 HydrophobicContact CG1-CB 3.88Å; V883-L914 HydrophobicContact CG1-CD1 4.23Å; V883-L914 HydrophobicContact CG1-CG 4.47Å; S884-L914 WeakPolarHBondContact OG-CA 3.34Å; V902-L914 HydrophobicContact CG1-CD1 3.81Å; V902-L914 HydrophobicContact CG2-CD1 4.37Å; L906-L914 HydrophobicContact CB-CD2 4.24Å; L906-L914 HydrophobicContact CD1-CD2 4.42Å; L914-K929 WeakPolarHBondContact O-CA 3.38Å; L914-V930 HydrophobicContact CB-CG2 3.92Å; L914-V930 PolarHBondContact N-O 3.39Å; L914-V930 PolarHBondContact O-N 2.86Å; L914-L932 HydrophobicContact CD1-CD1 4.24Å; L914-L932 HydrophobicContact CD1-CG 4.23Å
915	Q	84.4	Confident	75	Confident	68 Å²	68	67.2 Å²	67.2	32%	0.318	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.4	177.1	-170.1	156.6	-21.8	0	0	109.7	V883 S884 E917 H926	V883-Q915 CarbonylContact C-O 3.58Å; V883-Q915 WeakPolarHBondContact CA-O 3.33Å; S884-Q915 PolarHBondContact N-O 2.84Å; S884-Q915 PolarHBondContact OG-N 3.05Å; S884-Q915 VanDerWaalsContact OG-N 3.1Å; Q915-E917 HydrophobicContact CG-CG 4.04Å; Q915-H926 PolarHBondContact NE2-CE1 2.85Å; Q915-H926 PolarHBondContact NE2-ND1 2.9Å
916	V	86.3	Confident	75.6	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.9	-177.4	-175.7	0	0	0	0	108.7	P853 V864 L866 L881 L927 G928 V930	P853-V916 HydrophobicContact CB-CB 4.34Å; P853-V916 HydrophobicContact CB-CG1 4.41Å; P853-V916 HydrophobicContact CB-CG2 4Å; P853-V916 HydrophobicContact CG-CB 4.15Å; P853-V916 HydrophobicContact CG-CG2 4.01Å; V864-V916 HydrophobicContact CG1-CG1 4.3Å; V864-V916 HydrophobicContact CG1-CG2 4.06Å; L866-V916 HydrophobicContact CD1-CG1 3.96Å; L881-V916 HydrophobicContact CD1-CG1 4.03Å; V916-L927 HydrophobicContact CG1-CB 4.32Å; V916-L927 HydrophobicContact CG1-CD1 4.43Å; V916-L927 PolarHBondContact O-N 2.84Å; V916-G928 PolarHBondContact N-O 3.08Å; V916-V930 HydrophobicContact CG2-CG1 4.44Å; V916-V930 HydrophobicContact CG2-CG2 4.17Å
917	E	87	Confident	76.1	Confident	21 Å²	21	65.3 Å²	65.3	10%	0.098	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.9	-163.4	-55.2	-168.5	122.7	0	0	112.8	T882 Q915 I924 H926	T882-E917 PolarHBondContact N-O 3.49Å; T882-E917 PolarHBondContact O-N 3.35Å; Q915-E917 HydrophobicContact CG-CG 4.04Å; E917-I924 HydrophobicContact CB-CG2 3.89Å; E917-I924 HydrophobicContact CG-CG2 4.38Å; E917-H926 IonicContact OE1-CE1 2.75Å; E917-H926 PolarHBondContact OE1-CE1 3.3Å; E917-H926 IonicContact OE1-ND1 3.58Å; E917-H926 PolarHBondContact OE1-ND1 3.03Å
918	W	86.6	Confident	76.9	Confident	6 Å²	6	63.5 Å²	63.5	2%	0.023	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	114.5	173.9	-176.9	-95.2	0	0	0	110.2	F762 P848 F850 M876 V880 L881 R925 L927	F762-W918 HydrophobicContact CD1-CZ2 4.4Å; F762-W918 AromaticContact CD2-CH2 3.92Å; F762-W918 HydrophobicContact CD2-CH2 3.92Å; F762-W918 AromaticContact CD2-CZ2 3.56Å; F762-W918 HydrophobicContact CD2-CZ2 3.56Å; F762-W918 HydrophobicContact CE1-CH2 4.49Å; F762-W918 HydrophobicContact CE1-CZ2 4.48Å; F762-W918 AromaticContact CE2-CH2 3.48Å; F762-W918 HydrophobicContact CE2-CH2 3.48Å; F762-W918 VanDerWaalsContact CE2-CH2 3.48Å; F762-W918 AromaticContact CE2-CZ2 3.65Å; F762-W918 HydrophobicContact CE2-CZ2 3.65Å; F762-W918 AromaticContact CG-CZ2 3.96Å; F762-W918 HydrophobicContact CG-CZ2 3.96Å; F762-W918 AromaticContact CZ-CH2 3.81Å; F762-W918 HydrophobicContact CZ-CH2 3.81Å; F762-W918 HydrophobicContact CZ-CZ2 4.13Å; P848-W918 HydrophobicContact CG-CH2 3.53Å; P848-W918 HydrophobicContact CG-CZ2 3.51Å; P848-W918 HydrophobicContact CG-CZ3 4.24Å; F850-W918 AromaticContact CE2-CD2 3.89Å; F850-W918 HydrophobicContact CE2-CD2 3.89Å; F850-W918 AromaticContact CE2-CE3 3.49Å; F850-W918 HydrophobicContact CE2-CE3 3.49Å; F850-W918 VanDerWaalsContact CE2-CE3 3.49Å; F850-W918 HydrophobicContact CE2-CH2 4.26Å; F850-W918 AromaticContact CE2-CZ3 3.69Å; F850-W918 HydrophobicContact CE2-CZ3 3.69Å; F850-W918 AromaticContact CZ-CE3 3.8Å; F850-W918 HydrophobicContact CZ-CE3 3.8Å; F850-W918 HydrophobicContact CZ-CH2 4.15Å; F850-W918 AromaticContact CZ-CZ3 3.55Å; F850-W918 HydrophobicContact CZ-CZ3 3.55Å; M876-W918 HydrophobicContact CE-CH2 3.87Å; M876-W918 HydrophobicContact CE-CZ3 4.15Å; M876-W918 HydrophobicContact SD-CH2 3.83Å; M876-W918 HydrophobicContact SD-CZ3 3.95Å; V880-W918 HydrophobicContact CB-CH2 4.34Å; V880-W918 HydrophobicContact CB-CZ2 4.38Å; V880-W918 HydrophobicContact CB-CZ3 4.38Å; V880-W918 HydrophobicContact CG2-CE3 4.15Å; V880-W918 HydrophobicContact CG2-CH2 3.35Å; V880-W918 HydrophobicContact CG2-CZ2 3.76Å; V880-W918 HydrophobicContact CG2-CZ3 3.56Å; L881-W918 HydrophobicContact CB-CE3 4.45Å; L881-W918 HydrophobicContact CD1-CE3 4.31Å; W918-R925 HydrophobicContact CB-CB 4.33Å; W918-R925 PolarHBondContact N-O 2.83Å; W918-R925 PolarHBondContact O-N 3.24Å; W918-L927 HydrophobicContact CB-CD1 4.16Å; W918-L927 HydrophobicContact CB-CD2 4.11Å; W918-L927 HydrophobicContact CB-CG 4.13Å
919	R	81.9	Confident	77.9	Confident	96 Å²	96	64.9 Å²	64.9	36%	0.362	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.6	179.3	-70.1	-179.5	164.1	-155.5	-3.3	111	V880 N885	V880-R919 PolarHBondContact O-N 3.28Å; N885-R919 PolarHBondContact OD1-NH2 2.93Å
920	Q	84.3	Confident	79.1	Confident	42 Å²	42	63.7 Å²	63.7	20%	0.196	33%	0.333	C	S	.	.			trans	-122.6	171.6	174.1	-52.2	178.6	-59.7	0	0	108.5	S764 D922 S923	S764-Q920 PolarHBondContact OG-NE2 2.8Å; Q920-D922 PolarHBondContact O-N 3.04Å; Q920-S923 CarbonylContact C-O 3.31Å; Q920-S923 WeakPolarHBondContact CA-O 3.38Å; Q920-S923 VanDerWaalsContact CB-O 3.29Å; Q920-S923 WeakPolarHBondContact CB-O 3.43Å; Q920-S923 PolarHBondContact N-O 2.9Å; Q920-S923 PolarHBondContact OE1-OG 3.22Å
921	A	82	Confident	80	Confident	27 Å²	27	60.8 Å²	60.8	22%	0.223	32%	0.315	C	S	.	.	S	Bend	trans	-64.6	-39.7	-179	0	0	0	0	0	113.1	S764 T812 R1024	S764-A921 PolarHBondContact O-N 2.9Å; T812-A921 WeakPolarHBondContact O-CB 3.37Å; A921-R1024 PolarHBondContact O-NH1 2.9Å
922	D	79.3	Confident	80.7	Confident	61 Å²	61	58.5 Å²	58.5	33%	0.326	29%	0.29	S	S	.	.	S	Bend	trans	-106.6	-5.6	-174	-85.2	-24.5	0	0	0	114.5	K817 Q920 R1024	K817-D922 IonicContact NZ-OD2 2.71Å; K817-D922 PolarHBondContact NZ-OD2 3.4Å; Q920-D922 PolarHBondContact O-N 3.04Å; D922-R1024 VanDerWaalsContact C-NH1 3.31Å; D922-R1024 PolarHBondContact O-NE 2.74Å; D922-R1024 PolarHBondContact O-NH1 3.34Å; D922-R1024 IonicContact OD1-CZ 2.97Å; D922-R1024 IonicContact OD1-NH2 3.5Å; D922-R1024 PolarHBondContact OD1-NH2 3.14Å
923	S	80.8	Confident	80.3	Confident	53 Å²	53	56.5 Å²	56.5	37%	0.371	30%	0.299	S	S	.	.			trans	-159.3	159.6	-166.6	39.3	0	0	0	0	112.6	Q920	Q920-S923 CarbonylContact C-O 3.31Å; Q920-S923 WeakPolarHBondContact CA-O 3.38Å; Q920-S923 VanDerWaalsContact CB-O 3.29Å; Q920-S923 WeakPolarHBondContact CB-O 3.43Å; Q920-S923 PolarHBondContact N-O 2.9Å; Q920-S923 PolarHBondContact OE1-OG 3.22Å
924	I	81.6	Confident	79.5	Confident	84 Å²	84	59.4 Å²	59.4	43%	0.431	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.5	164.8	-59.6	177.6	0	0	0	106.7	E917	E917-I924 HydrophobicContact CB-CG2 3.89Å; E917-I924 HydrophobicContact CG-CG2 4.38Å
925	R	82.9	Confident	77.9	Confident	105 Å²	105	68 Å²	68	40%	0.396	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	107.2	174.5	179.3	-176.2	176.9	-172.3	-1.9	108.4	W918 L927	W918-R925 HydrophobicContact CB-CB 4.33Å; W918-R925 PolarHBondContact N-O 2.83Å; W918-R925 PolarHBondContact O-N 3.24Å; R925-L927 HydrophobicContact CG-CD2 4.18Å; R925-L927 PolarHBondContact O-N 3.35Å
926	H	84.4	Confident	76.1	Confident	108 Å²	108	72.1 Å²	72.1	50%	0.5	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130.2	170.8	-43.2	-61.9	0	0	0	109	Q915 E917	Q915-H926 PolarHBondContact NE2-CE1 2.85Å; Q915-H926 PolarHBondContact NE2-ND1 2.9Å; E917-H926 IonicContact OE1-CE1 2.75Å; E917-H926 PolarHBondContact OE1-CE1 3.3Å; E917-H926 IonicContact OE1-ND1 3.58Å; E917-H926 PolarHBondContact OE1-ND1 3.03Å
927	L	84.1	Confident	74.5	Confident	16 Å²	16	78 Å²	78	8%	0.084	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-22.4	-179.7	-58.2	-176.1	0	0	0	112.1	F850 P853 L866 L881 V916 W918 R925	F850-L927 HydrophobicContact CB-CD1 4.36Å; F850-L927 HydrophobicContact CB-CD2 4.37Å; F850-L927 HydrophobicContact CD2-CD1 3.53Å; F850-L927 HydrophobicContact CD2-CD2 3.81Å; F850-L927 HydrophobicContact CD2-CG 4.34Å; F850-L927 HydrophobicContact CE2-CD1 3.91Å; F850-L927 HydrophobicContact CG-CD1 3.98Å; F850-L927 HydrophobicContact CG-CD2 4.48Å; P853-L927 WeakPolarHBondContact CD-O 3.46Å; L866-L927 HydrophobicContact CD1-CD1 3.68Å; L866-L927 HydrophobicContact CD2-CB 4.25Å; L866-L927 HydrophobicContact CD2-CD1 3.94Å; L866-L927 HydrophobicContact CG-CD1 4.5Å; L881-L927 HydrophobicContact CD1-CD1 3.81Å; V916-L927 HydrophobicContact CG1-CB 4.32Å; V916-L927 HydrophobicContact CG1-CD1 4.43Å; V916-L927 PolarHBondContact O-N 2.84Å; W918-L927 HydrophobicContact CB-CD1 4.16Å; W918-L927 HydrophobicContact CB-CD2 4.11Å; W918-L927 HydrophobicContact CB-CG 4.13Å; R925-L927 HydrophobicContact CG-CD2 4.18Å; R925-L927 PolarHBondContact O-N 3.35Å
928	G	83	Confident	73.1	Confident	24 Å²	24	83.9 Å²	83.9	25%	0.247	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.8	-168.2	174.8	0	0	0	0	0	112.3	V916	V916-G928 PolarHBondContact N-O 3.08Å
929	K	82.1	Confident	71.8	Confident	118 Å²	118	87.4 Å²	87.4	51%	0.513	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145.4	173.1	-67.6	-176.3	174.4	-172.7	0	109.8	E913 L914	E913-K929 HydrophobicContact CB-CD 4.33Å; E913-K929 IonicContact OE1-NZ 2.64Å; E913-K929 WeakPolarHBondContact OE2-CD 3.13Å; E913-K929 WeakPolarHBondContact OE2-CE 3.03Å; E913-K929 IonicContact OE2-NZ 2.68Å; E913-K929 PolarHBondContact OE2-NZ 3.33Å; L914-K929 WeakPolarHBondContact O-CA 3.38Å
930	V	80.2	Confident	70.8	Confident	8 Å²	8	85.5 Å²	85.5	5%	0.048	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.8	170.3	-63.7	0	0	0	0	110.8	P853 L855 V864 L914 V916	P853-V930 HydrophobicContact CB-CG1 3.8Å; P853-V930 HydrophobicContact CG-CG1 3.97Å; P853-V930 WeakPolarHBondContact O-CG1 3.47Å; L855-V930 HydrophobicContact CB-CB 4.18Å; L855-V930 HydrophobicContact CB-CG1 4.43Å; L855-V930 HydrophobicContact CD1-CB 4.46Å; L855-V930 HydrophobicContact CD1-CG2 4.08Å; V864-V930 HydrophobicContact CG2-CG2 4.16Å; L914-V930 HydrophobicContact CB-CG2 3.92Å; L914-V930 PolarHBondContact N-O 3.39Å; L914-V930 PolarHBondContact O-N 2.86Å; V916-V930 HydrophobicContact CG2-CG1 4.44Å; V916-V930 HydrophobicContact CG2-CG2 4.17Å
931	T	73.2	Confident	69.8	Low	93 Å²	93	89.1 Å²	89.1	57%	0.571	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.2	175.1	47.5	0	0	0	0	110	L855 E913 A933	L855-T931 WeakPolarHBondContact CD2-O 3.03Å; E913-T931 HydrophobicContact CG-CG2 4.14Å; T931-A933 PolarHBondContact O-N 3.12Å
932	L	70.3	Confident	69	Low	45 Å²	45	93 Å²	93	24%	0.236	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-62	126.5	168.2	-71.8	161.3	0	0	0	108.9	L855 S862 L914 Q934	L855-L932 HydrophobicContact CD2-CD2 4.12Å; S862-L932 WeakPolarHBondContact OG-CD2 3.32Å; L914-L932 HydrophobicContact CD1-CD1 4.24Å; L914-L932 HydrophobicContact CD1-CG 4.23Å; L932-Q934 PolarHBondContact O-N 2.92Å
933	A	57.3	Low	68.6	Low	95 Å²	95	94.1 Å²	94.1	79%	0.785	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-73	124.1	180	0	0	0	0	0	110.2	T931	T931-A933 PolarHBondContact O-N 3.12Å
934	Q	55.2	Low	68	Low	175 Å²	175	93.1 Å²	93.1	82%	0.818	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-74.7	128.4	178.7	-173.6	177.7	3.4	0	0	110.5	L932 Q936	L932-Q934 PolarHBondContact O-N 2.92Å; Q934-Q936 PolarHBondContact O-N 3.12Å
935	E	49.8	Very low	67.5	Low	182 Å²	182	92.7 Å²	92.7	85%	0.85	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-63.2	128.3	167	-68.8	-169.6	125	0	0	109.4	D937	E935-D937 PolarHBondContact O-N 3.13Å; E935-D937 VanDerWaalsContact O-N 3.15Å
936	Q	47	Very low	67.1	Low	155 Å²	155	91.4 Å²	91.4	72%	0.724	51%	0.508	S	S	*	.			trans	-75.8	106.2	178.1	-74.7	-170.9	-24.8	0	0	109.7	Q934 Y938	Q934-Q936 PolarHBondContact O-N 3.12Å; Q936-Y938 HydrophobicContact CB-CE2 4.21Å; Q936-Y938 WeakPolarHBondContact O-CD2 3.24Å; Q936-Y938 WeakPolarHBondContact O-CE2 3.2Å; Q936-Y938 PolarHBondContact O-N 2.81Å
937	D	51.5	Low	66.6	Low	123 Å²	123	89.4 Å²	89.4	66%	0.658	51%	0.506	S	S	*	.			trans	-76.7	101.7	-177.4	-167.2	-20.5	0	0	0	111.4	E935 T939	E935-D937 PolarHBondContact O-N 3.13Å; E935-D937 VanDerWaalsContact O-N 3.15Å; D937-T939 VanDerWaalsContact CG-OG1 3.22Å; D937-T939 PolarHBondContact O-N 3.04Å; D937-T939 VanDerWaalsContact OD1-CB 3.23Å; D937-T939 WeakPolarHBondContact OD1-CB 3.42Å; D937-T939 WeakPolarHBondContact OD1-CG2 3.33Å; D937-T939 PolarHBondContact OD1-N 2.88Å; D937-T939 PolarHBondContact OD1-OG1 3.2Å
938	Y	57.7	Low	66.2	Low	145 Å²	145	92.6 Å²	92.6	57%	0.569	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-0.5	-179.8	-73.1	-86.7	0	0	0	114.3	Q936 G940 L941 I942	Q936-Y938 HydrophobicContact CB-CE2 4.21Å; Q936-Y938 WeakPolarHBondContact O-CD2 3.24Å; Q936-Y938 WeakPolarHBondContact O-CE2 3.2Å; Q936-Y938 PolarHBondContact O-N 2.81Å; Y938-G940 VanDerWaalsContact C-N 3.27Å; Y938-G940 PolarHBondContact O-N 3.05Å; Y938-L941 PolarHBondContact O-N 2.79Å; Y938-I942 PolarHBondContact O-N 2.63Å
939	T	60.4	Low	65.9	Low	80 Å²	80	94.6 Å²	94.6	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-53.3	-40.3	-178.6	47.4	0	0	0	0	113.4	D937 L941 I942 V943	D937-T939 VanDerWaalsContact CG-OG1 3.22Å; D937-T939 PolarHBondContact O-N 3.04Å; D937-T939 VanDerWaalsContact OD1-CB 3.23Å; D937-T939 WeakPolarHBondContact OD1-CB 3.42Å; D937-T939 WeakPolarHBondContact OD1-CG2 3.33Å; D937-T939 PolarHBondContact OD1-N 2.88Å; D937-T939 PolarHBondContact OD1-OG1 3.2Å; T939-L941 VanDerWaalsContact C-N 3.27Å; T939-L941 PolarHBondContact O-N 3.16Å; T939-I942 PolarHBondContact O-N 2.88Å; T939-V943 WeakPolarHBondContact O-CB 3.43Å; T939-V943 WeakPolarHBondContact O-CG2 3.25Å; T939-V943 PolarHBondContact O-N 3Å
940	G	59.9	Low	65.6	Low	56 Å²	56	94.1 Å²	94.1	58%	0.577	54%	0.538	S	S	*	.	H	α-helix	trans	-59.9	-34.9	178	0	0	0	0	0	113.8	Y938 G944	Y938-G940 VanDerWaalsContact C-N 3.27Å; Y938-G940 PolarHBondContact O-N 3.05Å; G940-G944 PolarHBondContact O-N 2.7Å
941	L	63.1	Low	65.5	Low	118 Å²	118	98.8 Å²	98.8	62%	0.618	56%	0.562	S	S	*	*	H	α-helix	trans	-75.7	-38.6	179.5	-147.2	162.2	0	0	0	110.8	Y938 T939 G944 C945	Y938-L941 PolarHBondContact O-N 2.79Å; T939-L941 VanDerWaalsContact C-N 3.27Å; T939-L941 PolarHBondContact O-N 3.16Å; L941-G944 PolarHBondContact O-N 3.08Å; L941-C945 PolarHBondContact O-N 2.6Å; L941-C945 VanDerWaalsContact O-N 3.16Å; L941-C945 PolarHBondContact O-SG 3.08Å
942	I	65.8	Low	65.7	Low	109 Å²	109	99.5 Å²	99.5	56%	0.559	56%	0.562	S	S	*	*	H	α-helix	trans	-64.9	-47.9	174.5	-62.2	169.3	0	0	0	110.7	Y938 T939 G944 C945 V946	Y938-I942 PolarHBondContact O-N 2.63Å; T939-I942 PolarHBondContact O-N 2.88Å; I942-G944 VanDerWaalsContact C-N 3.32Å; I942-G944 PolarHBondContact O-N 3.39Å; I942-C945 PolarHBondContact O-N 2.86Å; I942-V946 WeakPolarHBondContact O-CG2 3.3Å; I942-V946 PolarHBondContact O-N 3Å; I942-V946 VanDerWaalsContact O-N 3.07Å
943	V	69.8	Low	66	Low	84 Å²	84	103 Å²	103	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-61.2	-40.8	177.3	171.2	0	0	0	0	111.1	T939 V946 C947	T939-V943 WeakPolarHBondContact O-CB 3.43Å; T939-V943 WeakPolarHBondContact O-CG2 3.25Å; T939-V943 PolarHBondContact O-N 3Å; V943-V946 PolarHBondContact O-N 2.04Å; V943-C947 WeakPolarHBondContact O-CB 3.47Å; V943-C947 PolarHBondContact O-N 3.49Å; V943-C947 PolarHBondContact O-SG 3.2Å
944	G	68.3	Low	66.8	Low	33 Å²	33	104.9 Å²	104.9	34%	0.34	57%	0.571	S	S	.	*	H	α-helix	trans	-56.4	-51.4	174.5	0	0	0	0	0	112.9	G940 L941 I942 V946 C947 V948	G940-G944 PolarHBondContact O-N 2.7Å; L941-G944 PolarHBondContact O-N 3.08Å; I942-G944 VanDerWaalsContact C-N 3.32Å; I942-G944 PolarHBondContact O-N 3.39Å; G944-V946 VanDerWaalsContact C-N 3.35Å; G944-V946 PolarHBondContact O-N 3.48Å; G944-C947 PolarHBondContact O-N 3.15Å; G944-V948 WeakPolarHBondContact O-CG2 3.37Å; G944-V948 PolarHBondContact O-N 2.83Å
945	C	72.2	Confident	67.6	Low	75 Å²	75	100.9 Å²	100.9	51%	0.507	56%	0.555	S	S	.	*	H	α-helix	trans	-61.2	-39.7	178.2	-71.4	0	0	0	0	112.9	L941 I942 S949	L941-C945 PolarHBondContact O-N 2.6Å; L941-C945 VanDerWaalsContact O-N 3.16Å; L941-C945 PolarHBondContact O-SG 3.08Å; I942-C945 PolarHBondContact O-N 2.86Å; C945-S949 WeakPolarHBondContact O-CB 3.35Å; C945-S949 PolarHBondContact O-N 2.63Å; C945-S949 VanDerWaalsContact O-N 3.09Å; C945-S949 PolarHBondContact O-OG 3.23Å
946	V	74.1	Confident	68.5	Low	78 Å²	78	94.6 Å²	94.6	47%	0.473	53%	0.534	S	S	.	.	H	α-helix	trans	-67.1	-44.5	176.6	172.8	0	0	0	0	111.3	I942 V943 G944 V948 S949 L950	I942-V946 WeakPolarHBondContact O-CG2 3.3Å; I942-V946 PolarHBondContact O-N 3Å; I942-V946 VanDerWaalsContact O-N 3.07Å; V943-V946 PolarHBondContact O-N 2.04Å; G944-V946 VanDerWaalsContact C-N 3.35Å; G944-V946 PolarHBondContact O-N 3.48Å; V946-V948 PolarHBondContact O-N 3.28Å; V946-S949 PolarHBondContact O-N 2.72Å; V946-L950 HydrophobicContact CG1-CD1 3.96Å; V946-L950 WeakPolarHBondContact O-CG 3.38Å; V946-L950 PolarHBondContact O-N 3.47Å
947	C	73	Confident	69.4	Low	65 Å²	65	90.4 Å²	90.4	44%	0.439	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-41.8	179.5	-68.2	0	0	0	0	112.5	V943 G944 L950 L951	V943-C947 WeakPolarHBondContact O-CB 3.47Å; V943-C947 PolarHBondContact O-N 3.49Å; V943-C947 PolarHBondContact O-SG 3.2Å; G944-C947 PolarHBondContact O-N 3.15Å; C947-L950 PolarHBondContact O-N 3.23Å; C947-L951 WeakPolarHBondContact O-CB 3.48Å; C947-L951 PolarHBondContact O-N 2.86Å
948	V	77.3	Confident	70	Confident	84 Å²	84	87.7 Å²	87.7	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-41.3	174.9	172.8	0	0	0	0	111.1	G944 V946 L950 L951 L952	G944-V948 WeakPolarHBondContact O-CG2 3.37Å; G944-V948 PolarHBondContact O-N 2.83Å; V946-V948 PolarHBondContact O-N 3.28Å; V948-L950 PolarHBondContact O-N 2.68Å; V948-L951 PolarHBondContact O-N 2.99Å; V948-L952 HydrophobicContact CG1-CD1 4.05Å; V948-L952 HydrophobicContact CG1-CG 4.5Å; V948-L952 WeakPolarHBondContact O-CG 3.41Å; V948-L952 PolarHBondContact O-N 2.77Å
949	S	75.1	Confident	70.1	Confident	66 Å²	66	86.5 Å²	86.5	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-42.5	177.1	-58.3	0	0	0	0	112.2	C945 V946 L952 L953	C945-S949 WeakPolarHBondContact O-CB 3.35Å; C945-S949 PolarHBondContact O-N 2.63Å; C945-S949 VanDerWaalsContact O-N 3.09Å; C945-S949 PolarHBondContact O-OG 3.23Å; V946-S949 PolarHBondContact O-N 2.72Å; S949-L952 PolarHBondContact O-N 2.84Å; S949-L953 WeakPolarHBondContact O-CG 3.04Å; S949-L953 PolarHBondContact O-N 2.74Å; S949-L953 VanDerWaalsContact O-N 3.16Å
950	L	76.6	Confident	70.1	Confident	107 Å²	107	89.9 Å²	89.9	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-68.2	-39.8	176.2	-70.8	169.9	0	0	0	112.3	V946 C947 V948 L952 L953 F954	V946-L950 HydrophobicContact CG1-CD1 3.96Å; V946-L950 WeakPolarHBondContact O-CG 3.38Å; V946-L950 PolarHBondContact O-N 3.47Å; C947-L950 PolarHBondContact O-N 3.23Å; V948-L950 PolarHBondContact O-N 2.68Å; L950-L952 PolarHBondContact O-N 3.32Å; L950-L953 PolarHBondContact O-N 3.06Å; L950-F954 WeakPolarHBondContact O-CB 3.42Å; L950-F954 PolarHBondContact O-N 3.44Å
951	L	78.4	Confident	69.8	Low	106 Å²	106	97.1 Å²	97.1	56%	0.555	53%	0.532	S	S	*	.	H	α-helix	trans	-61.4	-42.1	174.5	-95.4	163.9	0	0	0	112.2	C947 V948 F954 L955	C947-L951 WeakPolarHBondContact O-CB 3.48Å; C947-L951 PolarHBondContact O-N 2.86Å; V948-L951 PolarHBondContact O-N 2.99Å; L951-F954 PolarHBondContact O-N 2.72Å; L951-L955 WeakPolarHBondContact O-CB 3.29Å; L951-L955 WeakPolarHBondContact O-CG 3.28Å; L951-L955 PolarHBondContact O-N 3.23Å
952	L	77.7	Confident	69.3	Low	108 Å²	108	101.5 Å²	101.5	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-64.6	-39.2	176.6	-71.7	169.7	0	0	0	112.1	V948 S949 L950 A956	V948-L952 HydrophobicContact CG1-CD1 4.05Å; V948-L952 HydrophobicContact CG1-CG 4.5Å; V948-L952 WeakPolarHBondContact O-CG 3.41Å; V948-L952 PolarHBondContact O-N 2.77Å; S949-L952 PolarHBondContact O-N 2.84Å; L950-L952 PolarHBondContact O-N 3.32Å; L952-A956 VanDerWaalsContact O-CB 3.3Å; L952-A956 WeakPolarHBondContact O-CB 3.27Å; L952-A956 PolarHBondContact O-N 2.87Å
953	L	75.1	Confident	68.4	Low	119 Å²	119	107.2 Å²	107.2	62%	0.623	56%	0.555	S	S	*	*	H	α-helix	trans	-67.9	-37.7	174.4	-71.4	168	0	0	0	112.6	S949 L950 A956 S957	S949-L953 WeakPolarHBondContact O-CG 3.04Å; S949-L953 PolarHBondContact O-N 2.74Å; S949-L953 VanDerWaalsContact O-N 3.16Å; L950-L953 PolarHBondContact O-N 3.06Å; L953-A956 PolarHBondContact O-N 3.08Å; L953-S957 PolarHBondContact O-N 3.48Å; L953-S957 PolarHBondContact O-OG 3.39Å
954	F	73.9	Confident	67.5	Low	134 Å²	134	110.4 Å²	110.4	59%	0.588	57%	0.569	S	S	*	*	H	α-helix	trans	-69.2	-39.5	176.1	-160.3	-104	0	0	0	111.9	L950 L951 S957 L958	L950-F954 WeakPolarHBondContact O-CB 3.42Å; L950-F954 PolarHBondContact O-N 3.44Å; L951-F954 PolarHBondContact O-N 2.72Å; F954-S957 WeakPolarHBondContact CA-OG 3.27Å; F954-S957 PolarHBondContact O-OG 3.41Å; F954-S957 VanDerWaalsContact O-OG 3.05Å; F954-L958 HydrophobicContact CD1-CD1 3.72Å; F954-L958 HydrophobicContact CE1-CD1 3.6Å; F954-L958 HydrophobicContact CE1-CG 4.46Å; F954-L958 HydrophobicContact CZ-CD1 4.49Å; F954-L958 WeakPolarHBondContact O-CB 3.14Å; F954-L958 PolarHBondContact O-N 3.3Å
955	L	73.4	Confident	66.3	Low	91 Å²	91	117.5 Å²	117.5	48%	0.476	59%	0.591	S	S	.	*	H	α-helix	trans	-65.8	-42.8	172.3	-76.7	164.8	0	0	0	112	L951 S957 L958 L959	L951-L955 WeakPolarHBondContact O-CB 3.29Å; L951-L955 WeakPolarHBondContact O-CG 3.28Å; L951-L955 PolarHBondContact O-N 3.23Å; L955-S957 PolarHBondContact O-N 2.74Å; L955-L958 PolarHBondContact O-N 3.11Å; L955-L959 WeakPolarHBondContact O-CB 3.44Å; L955-L959 VanDerWaalsContact O-CG 3.24Å; L955-L959 WeakPolarHBondContact O-CG 3.26Å; L955-L959 PolarHBondContact O-N 3.09Å
956	A	68.4	Low	64.4	Low	50 Å²	50	121.6 Å²	121.6	41%	0.413	60%	0.602	S	S	.	*	H	α-helix	trans	-61.4	-41.8	177.3	0	0	0	0	0	112.3	L952 L953 L959 M960	L952-A956 VanDerWaalsContact O-CB 3.3Å; L952-A956 WeakPolarHBondContact O-CB 3.27Å; L952-A956 PolarHBondContact O-N 2.87Å; L953-A956 PolarHBondContact O-N 3.08Å; A956-L959 PolarHBondContact O-N 3.18Å; A956-M960 VanDerWaalsContact O-CG 3.28Å; A956-M960 WeakPolarHBondContact O-CG 3.48Å; A956-M960 PolarHBondContact O-N 3.34Å
957	S	64.7	Low	62.6	Low	67 Å²	67	124.3 Å²	124.3	47%	0.469	61%	0.613	S	S	.	*	H	α-helix	trans	-71	-38.4	176.7	47.1	0	0	0	0	112.9	L953 F954 L955 M960 W961	L953-S957 PolarHBondContact O-N 3.48Å; L953-S957 PolarHBondContact O-OG 3.39Å; F954-S957 WeakPolarHBondContact CA-OG 3.27Å; F954-S957 PolarHBondContact O-OG 3.41Å; F954-S957 VanDerWaalsContact O-OG 3.05Å; L955-S957 PolarHBondContact O-N 2.74Å; S957-M960 PolarHBondContact O-N 2.76Å; S957-W961 WeakPolarHBondContact O-CB 3.48Å; S957-W961 PolarHBondContact O-N 3.31Å
958	L	64.9	Low	60.6	Low	67 Å²	67	128 Å²	128	35%	0.351	63%	0.628	S	S	.	*	H	α-helix	trans	-61.9	-40.1	170.4	-90.5	164.4	0	0	0	113	F954 L955 W961 R962	F954-L958 HydrophobicContact CD1-CD1 3.72Å; F954-L958 HydrophobicContact CE1-CD1 3.6Å; F954-L958 HydrophobicContact CE1-CG 4.46Å; F954-L958 HydrophobicContact CZ-CD1 4.49Å; F954-L958 WeakPolarHBondContact O-CB 3.14Å; F954-L958 PolarHBondContact O-N 3.3Å; L955-L958 PolarHBondContact O-N 3.11Å; L958-W961 HydrophobicContact CD2-CE3 4.18Å; L958-W961 PolarHBondContact O-N 3.05Å; L958-R962 PolarHBondContact O-N 3.42Å
959	L	60.2	Low	58.5	Low	120 Å²	120	130.6 Å²	130.6	63%	0.628	64%	0.639	S	S	*	*	H	α-helix	trans	-67.6	-41.9	176.7	-74.5	166.8	0	0	0	111.6	L955 A956 W961 R963	L955-L959 WeakPolarHBondContact O-CB 3.44Å; L955-L959 VanDerWaalsContact O-CG 3.24Å; L955-L959 WeakPolarHBondContact O-CG 3.26Å; L955-L959 PolarHBondContact O-N 3.09Å; A956-L959 PolarHBondContact O-N 3.18Å; L959-W961 VanDerWaalsContact C-N 3.3Å; L959-W961 PolarHBondContact O-N 3.42Å; L959-R963 WeakPolarHBondContact O-CB 3.28Å; L959-R963 PolarHBondContact O-N 2.97Å
960	M	60.1	Low	56.4	Low	151 Å²	151	134.4 Å²	134.4	74%	0.744	65%	0.653	S	S	*	*	H	α-helix	trans	-61.2	-38.5	172.2	-72.9	-73.8	-78.4	0	0	112	A956 S957	A956-M960 VanDerWaalsContact O-CG 3.28Å; A956-M960 WeakPolarHBondContact O-CG 3.48Å; A956-M960 PolarHBondContact O-N 3.34Å; S957-M960 PolarHBondContact O-N 2.76Å
961	W	54.5	Low	54.1	Low	207 Å²	207	133.8 Å²	133.8	78%	0.784	66%	0.658	S	S	*	*	H	α-helix	trans	-72.4	-41.6	179.5	-170.5	40.4	0	0	0	113.1	S957 L958 L959	S957-W961 WeakPolarHBondContact O-CB 3.48Å; S957-W961 PolarHBondContact O-N 3.31Å; L958-W961 HydrophobicContact CD2-CE3 4.18Å; L958-W961 PolarHBondContact O-N 3.05Å; L959-W961 VanDerWaalsContact C-N 3.3Å; L959-W961 PolarHBondContact O-N 3.42Å
962	R	51.3	Low	51.9	Low	210 Å²	210	137.1 Å²	137.1	79%	0.792	67%	0.671	S	S	*	*	H	α-helix	trans	-71.7	-29.6	175.4	-87.5	-171.2	169.2	-168.9	-3	113.8	L958 N964 K965	L958-R962 PolarHBondContact O-N 3.42Å; R962-N964 PolarHBondContact O-N 3.36Å; R962-N964 VanDerWaalsContact O-N 3.14Å; R962-K965 PolarHBondContact O-N 2.93Å
963	R	47.9	Very low	49.6	Very low	229 Å²	229	136.8 Å²	136.8	86%	0.864	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-6.9	-176.1	-168.1	166.5	-178.6	174.2	1	114.4	L959 K965	L959-R963 WeakPolarHBondContact O-CB 3.28Å; L959-R963 PolarHBondContact O-N 2.97Å; R963-K965 VanDerWaalsContact C-N 3.34Å; R963-K965 PolarHBondContact O-N 2.93Å
964	N	51.1	Low	47.3	Very low	151 Å²	151	140.9 Å²	140.9	81%	0.807	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	22.2	176	-157.3	29.5	0	0	0	114.2	R962	R962-N964 PolarHBondContact O-N 3.36Å; R962-N964 VanDerWaalsContact O-N 3.14Å
965	K	43.2	Very low	45.2	Very low	182 Å²	182	142.7 Å²	142.7	79%	0.791	68%	0.684	S	S	*	*	S	Bend	trans	-151.5	82.3	174.5	-141.3	179.7	-171.6	-173.9	0	113.9	R962 R963	R962-K965 PolarHBondContact O-N 2.93Å; R963-K965 VanDerWaalsContact C-N 3.34Å; R963-K965 PolarHBondContact O-N 2.93Å
966	H	30.9	Very low	43	Very low	162 Å²	162	144.1 Å²	144.1	75%	0.75	69%	0.692	S	S	*	*			trans	59.8	123.8	168.9	-86.9	-99.6	0	0	0	116.2
967	I	36.5	Very low	41.3	Very low	135 Å²	135	145.2 Å²	145.2	69%	0.692	71%	0.709	S	S	*	*				53.2	84.2	56.7	-53.9	177.1	0	0	0	110.6
968	D	32.3	Very low	39.6	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	73%	0.727	S	S	*	*				-171.6	171	108.6	-88.4	-40.6	0	0	0	112.5
969	D	31.8	Very low	38.2	Very low	139 Å²	139	152.6 Å²	152.6	74%	0.743	74%	0.743	S	S	*	*			trans	63.5	98.9	163.3	-68.5	-5.8	0	0	0	124.4
970	L	31.3	Very low	36.8	Very low	146 Å²	146	154.9 Å²	154.9	76%	0.764	75%	0.75	S	S	*	*				60.5	106	117.1	-87.3	103.9	0	0	0	124.1
971	S	29.3	Very low	35.7	Very low	94 Å²	94	153.1 Å²	153.1	66%	0.657	74%	0.742	S	S	*	*				80.8	155.6	114.4	75.1	0	0	0	0	123.7
972	E	31.1	Very low	35	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	74%	0.736	S	S	*	*			trans	72.6	146.3	157.5	-68.2	-142.7	130.6	0	0	120
973	V	29.3	Very low	34.3	Very low	102 Å²	102	146.8 Å²	146.8	62%	0.618	73%	0.73	S	S	*	*			cis	-166.1	142.4	-21.8	115.5	0	0	0	0	111.7
974	W	26.9	Very low	33.7	Very low	204 Å²	204	142.4 Å²	142.4	77%	0.773	72%	0.723	S	S	*	*			trans	72.4	126.6	147.8	-80.1	43.4	0	0	0	128
975	Y	29.5	Very low	32.9	Very low	172 Å²	172	140.9 Å²	140.9	68%	0.675	71%	0.714	S	S	*	*				68.4	127	123.5	-85.7	-111.3	0	0	0	127.4
976	D	28.8	Very low	32.4	Very low	121 Å²	121	141.7 Å²	141.7	65%	0.647	71%	0.713	S	S	*	*			trans	63	168.4	133.1	-137.6	-29.4	0	0	0	121.3
977	G	31	Very low	32.5	Very low	74 Å²	74	141.1 Å²	141.1	76%	0.763	71%	0.714	S	S	*	*			trans	162.1	43.6	178	0	0	0	0	0	118.6
978	R	30.2	Very low	32.3	Very low	223 Å²	223	138.5 Å²	138.5	84%	0.842	71%	0.713	S	S	*	*			trans	-59.1	150.3	176.9	-80.7	-178.8	-108.9	-172.1	-8.1	116
979	G	34.4	Very low	32.3	Very low	66 Å²	66	139.2 Å²	139.2	68%	0.68	72%	0.717	S	S	*	*			trans	160.7	120.3	144.6	0	0	0	0	0	113
980	H	32	Very low	32.3	Very low	168 Å²	168	136.6 Å²	136.6	78%	0.778	71%	0.714	S	S	*	*				77	141.6	53.4	-85.7	41.7	0	0	0	116.3
981	I	37.5	Very low	32.5	Very low	114 Å²	114	141.1 Å²	141.1	59%	0.585	72%	0.721	S	S	*	*			cis	-169.6	148.4	-33.1	-125.6	-175.7	0	0	0	111.3
982	Q	39.4	Very low	32.7	Very low	139 Å²	139	141.6 Å²	141.6	65%	0.65	73%	0.725	S	S	*	*			trans	56.8	124.1	147.4	-70.3	-178.3	-30.6	0	0	125.9
983	H	35.5	Very low	32.8	Very low	145 Å²	145	140.1 Å²	140.1	67%	0.671	73%	0.727	S	S	*	*				90.9	139.6	110.7	-77.6	-30.9	0	0	0	127.7
984	L	36	Very low	33	Very low	137 Å²	137	140 Å²	140	72%	0.717	73%	0.731	S	S	*	*				89.8	106.2	127.8	-77.1	166	0	0	0	124
985	D	34.4	Very low	34.2	Very low	118 Å²	118	135 Å²	135	63%	0.631	73%	0.725	S	S	*	*				86.6	145.6	110.7	-126.9	12.7	0	0	0	125.1
986	R	33.2	Very low	34.7	Very low	199 Å²	199	132.5 Å²	132.5	75%	0.751	73%	0.728	S	S	*	*			trans	77.8	114.8	145.4	-80	165.3	-169.4	-128.4	-6.7	125.8
987	L	32.6	Very low	34.9	Very low	150 Å²	150	132.4 Å²	132.4	79%	0.785	73%	0.727	S	S	*	*				76.6	120.2	119	-72.7	171.1	0	0	0	124.4
988	A	31.2	Very low	35	Very low	81 Å²	81	135.6 Å²	135.6	67%	0.669	72%	0.722	S	S	*	*				90.4	123.3	121.7	0	0	0	0	0	124.3
989	N	32.2	Very low	34.9	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	72%	0.718	S	S	*	*			trans	70.1	101.1	135	-70.6	-10	0	0	0	124.5
990	A	33	Very low	34.8	Very low	83 Å²	83	135 Å²	135	69%	0.686	72%	0.721	S	S	*	*				83.8	126.6	106.1	0	0	0	0	0	124
991	R	35.8	Very low	34.9	Very low	241 Å²	241	131.6 Å²	131.6	91%	0.909	72%	0.716	S	S	*	*			trans	72.3	156.3	151.6	-68.1	176	175.1	159.7	-1.3	117
992	S	33.8	Very low	34.6	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	72%	0.724	S	S	*	*			cis	-161.1	157.1	9.2	5.5	0	0	0	0	114.9
993	V	31.5	Very low	34.4	Very low	144 Å²	144	135.3 Å²	135.3	87%	0.873	73%	0.731	S	S	*	*			trans	81.5	160.7	145.9	170.8	0	0	0	0	119.8
994	S	35.4	Very low	34.4	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	74%	0.736	S	S	*	*			trans	-129.6	-157.4	-159.2	57.2	0	0	0	0	110.4
995	P	52.1	Low	34.3	Very low	99 Å²	99	133.4 Å²	133.4	64%	0.643	74%	0.739	S	S	*	*			cis	-147.5	-169.4	8.8	45.6	-24.2	0	0	0	119.1
996	T	39.6	Very low	34.1	Very low	120 Å²	120	133.5 Å²	133.5	74%	0.736	74%	0.74	S	S	*	*			trans	70.9	149.5	157.2	54.8	0	0	0	0	120
997	N	32.4	Very low	34	Very low	118 Å²	118	132.8 Å²	132.8	63%	0.631	74%	0.739	S	S	*	*			cis	-154.6	158.8	0.7	-126.7	21.2	0	0	0	115.8
998	E	32.9	Very low	34	Very low	142 Å²	142	135.9 Å²	135.9	66%	0.664	74%	0.74	S	S	*	*			trans	66.7	124.7	141.1	-75.4	172.8	142	0	0	127.9
999	M	28.9	Very low	34	Very low	154 Å²	154	137.4 Å²	137.4	76%	0.759	74%	0.741	S	S	*	*				87.9	107.3	125.7	-71.9	-166.2	-173.5	0	0	127.1
1000	V	30.7	Very low	34	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	74%	0.735	S	S	*	*				87.7	112.5	113.9	172.8	0	0	0	0	124
1001	S	34.1	Very low	33.9	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	74%	0.74	S	S	*	*			trans	63.9	105.8	139.8	77.4	0	0	0	0	126.1
1002	H	32.5	Very low	33.7	Very low	162 Å²	162	133.6 Å²	133.6	75%	0.75	73%	0.73	S	S	*	*				62.5	122.7	110.6	-86.8	-97.9	0	0	0	125.4
1003	E	35.1	Very low	33.5	Very low	170 Å²	170	137 Å²	137	79%	0.794	74%	0.735	S	S	*	*				85.3	154.9	128.6	-103.3	158.3	-126.3	0	0	125
1004	S	34.9	Very low	33.4	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	73%	0.725	S	S	*	*			trans	-167.1	174.1	-168.1	59.2	0	0	0	0	110.2
1005	V	33.1	Very low	33.1	Very low	130 Å²	130	139.7 Å²	139.7	79%	0.788	73%	0.73	S	S	*	*			trans	-142.8	144.8	-174.1	-153.3	0	0	0	0	113.1
1006	D	31.6	Very low	31.9	Very low	121 Å²	121	138.3 Å²	138.3	65%	0.647	73%	0.734	S	S	*	*			trans	72	157.9	152.8	-119.9	-25.4	0	0	0	117.7
1007	Y	31.4	Very low	31.3	Very low	184 Å²	184	139.4 Å²	139.4	72%	0.722	74%	0.74	S	S	*	*			cis	-153.6	169.4	12.6	-39.9	-107.9	0	0	0	114.4
1008	R	31.9	Very low	31.1	Very low	214 Å²	214	141.2 Å²	141.2	81%	0.808	75%	0.75	S	S	*	*			trans	89.6	119.4	136.6	-92.5	-163.1	166.8	107.2	-0.9	126.7
1009	T	32.2	Very low	30.8	Very low	114 Å²	114	145.3 Å²	145.3	70%	0.699	76%	0.759	S	S	*	*			trans	69.1	159.3	130.6	54.2	0	0	0	0	122.7
1010	T	31.9	Very low	31.7	Very low	115 Å²	115	143 Å²	143	71%	0.706	76%	0.755	S	S	*	*			cis	-170.2	156.8	-4.9	22.7	0	0	0	0	115.7
1011	L	30	Very low	31.7	Very low	153 Å²	153	144.9 Å²	144.9	80%	0.801	76%	0.756	S	S	*	*			trans	83.2	140.1	138.7	-82.6	166.4	0	0	0	126.8
1012	L	32	Very low	31.5	Very low	132 Å²	132	146.6 Å²	146.6	69%	0.691	76%	0.763	S	S	*	*			trans	91.2	120	150.8	-72.2	166.4	0	0	0	124.7
1013	E	29.8	Very low	31.2	Very low	177 Å²	177	144.5 Å²	144.5	83%	0.827	77%	0.765	S	S	*	*				32.5	146.6	129.7	-75.3	172.8	177.3	0	0	122.6
1014	D	28.4	Very low	30.9	Very low	124 Å²	124	144.2 Å²	144.2	66%	0.663	76%	0.757	S	S	*	*			cis	-159.1	171.6	3.2	-173.5	22	0	0	0	111.2
1015	Q	29	Very low	30.6	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	76%	0.758	S	S	*	*			trans	37.1	132.2	163.3	-76.1	170.5	74.9	0	0	120.9
1016	G	26.8	Very low	30.4	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	76%	0.755	S	S	*	*			cis	161.7	165.7	-2.6	0	0	0	0	0	112.9
1017	V	27.8	Very low	31.4	Very low	143 Å²	143	141.3 Å²	141.3	87%	0.867	76%	0.76	S	S	*	*			trans	82.9	132.6	168.1	-172.9	0	0	0	0	119.7
1018	D	28	Very low	32.2	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	76%	0.756	S	S	*	*			trans	82.4	157.9	159.8	-89.5	-38.5	0	0	0	125.1
1019	R	26	Very low	32.1	Very low	228 Å²	228	134.2 Å²	134.2	86%	0.86	75%	0.753	S	S	*	*			trans	-102.9	179.7	-166.6	-90.4	171.9	161.9	-177.5	-4.9	112.2
1020	P	49.6	Very low	32.1	Very low	105 Å²	105	138 Å²	138	68%	0.682	76%	0.756	S	S	*	*			cis	-134.7	-151.7	-16.9	27	-0.7	0	0	0	112.6
1021	E	30.5	Very low	31.9	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	76%	0.763	S	S	*	*			trans	93.9	102.5	144.1	-80.5	-178.6	-167.6	0	0	124.3
1022	T	28.9	Very low	31.9	Very low	133 Å²	133	139.8 Å²	139.8	82%	0.816	76%	0.755	S	S	*	*				74.7	155.3	128.5	61.4	0	0	0	0	123.5
1023	C	25.9	Very low	31.8	Very low	117 Å²	117	141.7 Å²	141.7	79%	0.791	77%	0.766	S	S	*	*			trans	-103.3	150.7	-176.3	-30.9	0	0	0	0	112.6
1024	R	29.3	Very low	31.7	Very low	164 Å²	164	136.5 Å²	136.5	62%	0.619	76%	0.76	S	S	*	*			trans	169.3	120.6	132.1	-93.6	158.2	178.1	-170.9	-9.7	109.8	A921 D922	A921-R1024 PolarHBondContact O-NH1 2.9Å; D922-R1024 VanDerWaalsContact C-NH1 3.31Å; D922-R1024 PolarHBondContact O-NE 2.74Å; D922-R1024 PolarHBondContact O-NH1 3.34Å; D922-R1024 IonicContact OD1-CZ 2.97Å; D922-R1024 IonicContact OD1-NH2 3.5Å; D922-R1024 PolarHBondContact OD1-NH2 3.14Å
1025	A	28.9	Very low	31.9	Very low	97 Å²	97	139.2 Å²	139.2	80%	0.802	77%	0.769	S	S	*	*				78.3	141.8	90.8	0	0	0	0	0	114
1026	A	29.5	Very low	31.9	Very low	88 Å²	88	137.3 Å²	137.3	73%	0.727	76%	0.764	S	S	*	*			cis	-168.3	-104.9	-8.1	0	0	0	0	0	111.3
1027	P	51.9	Low	32	Very low	116 Å²	116	141.9 Å²	141.9	75%	0.753	77%	0.771	S	S	*	*				-109.9	-148.6	-125	33.2	-11.9	0	0	0	111.7
1028	P	47.4	Very low	32.1	Very low	98 Å²	98	140.1 Å²	140.1	64%	0.636	77%	0.765	S	S	*	*			cis	-153.1	178.5	1.7	47.4	-26.7	0	0	0	120.4
1029	M	30.4	Very low	32.9	Very low	151 Å²	151	139.2 Å²	139.2	74%	0.744	77%	0.767	S	S	*	*			trans	75.6	153.6	151.6	-51.7	-149.4	150.6	0	0	120.7
1030	Y	32.7	Very low	33.1	Very low	195 Å²	195	139.5 Å²	139.5	77%	0.765	77%	0.769	S	S	*	*			cis	-165.6	167.9	-8.1	-126.1	-32.5	0	0	0	115
1031	R	26.8	Very low	32	Very low	229 Å²	229	143.3 Å²	143.3	86%	0.864	78%	0.782	S	S	*	*			trans	113	114.1	134.4	-95.6	-176	-179.6	173	1.7	124
1032	A	29.7	Very low	31.8	Very low	76 Å²	76	138.7 Å²	138.7	63%	0.628	78%	0.778	S	S	*	*				87.7	113.8	114.5	0	0	0	0	0	126.7
1033	N	31	Very low	31.7	Very low	172 Å²	172	139.7 Å²	139.7	92%	0.92	78%	0.784	S	S	*	*				84.2	142.7	120.4	-63.7	16.6	0	0	0	126
1034	G	27.8	Very low	31.9	Very low	68 Å²	68	143 Å²	143	70%	0.701	79%	0.793	S	S	*	*			trans	119.3	113	165	0	0	0	0	0	113.7
1035	E	31.1	Very low	31.7	Very low	180 Å²	180	139 Å²	139	84%	0.841	80%	0.803	S	S	*	*				72.3	138.9	52.6	-65.5	-157.7	142	0	0	115.1
1036	L	30.5	Very low	31.6	Very low	137 Å²	137	138.5 Å²	138.5	72%	0.717	81%	0.807	S	S	*	*			cis	-167	170.3	-8.2	-120.7	174.1	0	0	0	111
1037	L	27.8	Very low	31.3	Very low	164 Å²	164	137.9 Å²	137.9	86%	0.859	81%	0.81	S	S	*	*			trans	133.6	159.4	145.2	-71.1	177.6	0	0	0	118.5
1038	S	31	Very low	30.1	Very low	107 Å²	107	141.2 Å²	141.2	75%	0.748	82%	0.82	S	S	*	*			trans	-132.4	-176.4	-172.9	-42.3	0	0	0	0	111.7
1039	P	45	Very low	29.1	Very low	136 Å²	136	140.1 Å²	140.1	88%	0.883	83%	0.826	S	S	*	*				-144.3	-170.6	109.7	37.5	-21.3	0	0	0	115.6
1040	R	28.7	Very low	29	Very low	235 Å²	235	142 Å²	142	89%	0.887	84%	0.838	S	S	*	*			trans	-107.6	160.8	-163.7	-53	167.7	170.2	177.2	-5.2	114.6
1041	L	26.8	Very low	28.6	Very low	184 Å²	184	136.3 Å²	136.3	96%	0.963	84%	0.839	S	S	*	*				-163.3	171.7	119.9	-133.1	70.2	0	0	0	111.9
1042	G	26.4	Very low	28.7	Very low	66 Å²	66	133.6 Å²	133.6	68%	0.68	84%	0.839	S	S	*	*			trans	175.2	171.2	175.9	0	0	0	0	0	113.9
1043	T	27.7	Very low	28.5	Very low	154 Å²	154	138.7 Å²	138.7	95%	0.945	85%	0.85	S	S	*	*			trans	-156.9	167.6	177.8	17	0	0	0	0	112.7
1044	L	28.5	Very low	28.4	Very low	185 Å²	185	134 Å²	134	97%	0.969	84%	0.842	S	S	*	*			trans	-95.1	152.5	-174.8	-68.2	139.4	0	0	0	113.5
1045	G	26.6	Very low	28.4	Very low	81 Å²	81	138 Å²	138	84%	0.835	85%	0.847	S	S	*	*			trans	173.3	134.1	166.6	0	0	0	0	0	110.4
1046	G	25.6	Very low	28.3	Very low	86 Å²	86	137.5 Å²	137.5	89%	0.887	85%	0.849	S	S	*	*			trans	-129.6	155.1	-172.7	0	0	0	0	0	114.1
1047	G	24.5	Very low	28.3	Very low	76 Å²	76	137.8 Å²	137.8	78%	0.784	86%	0.856	S	S	*	*			trans	173.3	107.3	176.4	0	0	0	0	0	114.2
1048	L	26.5	Very low	28.4	Very low	186 Å²	186	135 Å²	135	97%	0.974	85%	0.851	S	S	*	*			trans	11.9	124.1	153.7	-69.4	156.9	0	0	0	120
1049	G	24.9	Very low	28.7	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	85%	0.852	S	S	*	*			trans	137.8	112.5	138	0	0	0	0	0	118
1050	L	29.3	Very low	27.9	Very low	190 Å²	190	137 Å²	137	100%	0.995	85%	0.851	S	S	*	*			trans	47.1	119.1	153.7	-66.2	169.3	0	0	0	119.8
1051	G	25.2	Very low	28	Very low	76 Å²	76	134 Å²	134	78%	0.784	85%	0.851	S	S	*	*			trans	161.6	100.2	158.6	0	0	0	0	0	114.2
1052	M	27.1	Very low	28.3	Very low	173 Å²	173	134.1 Å²	134.1	85%	0.852	85%	0.849	S	S	*	*			trans	-119.3	107.5	151.3	-82.3	-159.2	75.5	0	0	108.7
1053	E	27.2	Very low	28.8	Very low	183 Å²	183	134.9 Å²	134.9	86%	0.855	85%	0.85	S	S	*	*			trans	10.8	126.6	144.5	-63.6	162.1	136	0	0	118.1
1054	G	27.3	Very low	29.3	Very low	73 Å²	73	133.2 Å²	133.2	75%	0.753	84%	0.842	S	S	*	*			trans	-139.5	132.3	156.3	0	0	0	0	0	108.2
1055	D	28.7	Very low	29.6	Very low	153 Å²	153	130.4 Å²	130.4	82%	0.818	83%	0.831	S	S	*	*			trans	-65.3	160.7	-167.9	-54.4	-85.1	0	0	0	114.7
1056	L	28.1	Very low	30	Very low	168 Å²	168	135.1 Å²	135.1	88%	0.88	83%	0.832	S	S	*	*				174.4	117.8	109.4	-90.6	160.1	0	0	0	111.9
1057	V	30.4	Very low	30.6	Very low	143 Å²	143	137.5 Å²	137.5	87%	0.867	82%	0.822	S	S	*	*			trans	-114.4	148	158.6	176.4	0	0	0	0	108.4
1058	S	31.5	Very low	31.2	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	81%	0.808	S	S	*	*			trans	-59.8	146.2	-165.8	-51.4	0	0	0	0	114.9
1059	P	35.9	Very low	32.1	Very low	118 Å²	118	133.6 Å²	133.6	77%	0.766	79%	0.789	S	S	*	*			trans	-74.3	139.6	163.5	32.8	-33.3	0	0	0	110.1
1060	L	29.6	Very low	33	Very low	167 Å²	167	134.6 Å²	134.6	87%	0.874	79%	0.785	S	S	*	*			trans	-179.6	107.7	145.4	-104.5	167.5	0	0	0	110.9
1061	L	29.6	Very low	33.5	Very low	170 Å²	170	130.8 Å²	130.8	89%	0.89	77%	0.773	S	S	*	*			trans	169.4	133.7	133.6	-92.1	163.5	0	0	0	108.6
1062	M	33.6	Very low	34.6	Very low	187 Å²	187	131.6 Å²	131.6	92%	0.921	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-81.8	147	172.1	-77.6	-179.1	162.1	0	0	110.3
1063	A	37.1	Very low	35.5	Very low	83 Å²	83	129.6 Å²	129.6	69%	0.686	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.1	149	167.7	0	0	0	0	0	110.6	V1065	A1063-V1065 PolarHBondContact O-N 2.85Å
1064	P	37.8	Very low	36.6	Very low	119 Å²	119	125.2 Å²	125.2	77%	0.773	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-65.6	121.1	179.4	27	-34.2	0	0	0	110.8	H1066	P1064-H1066 PolarHBondContact O-N 3.06Å
1065	V	36.1	Very low	37.7	Very low	125 Å²	125	127.5 Å²	127.5	76%	0.758	73%	0.729	S	S	*	*			trans	-74.3	113.1	169.8	178.3	0	0	0	0	108	A1063 I1067	A1063-V1065 PolarHBondContact O-N 2.85Å; V1065-I1067 HydrophobicContact CG1-CG1 4.42Å; V1065-I1067 PolarHBondContact O-N 3.33Å
1066	H	34.1	Very low	38.6	Very low	181 Å²	181	125.1 Å²	125.1	84%	0.838	72%	0.716	S	S	*	*			trans	-66.6	111.7	165.8	-91.9	-94.3	0	0	0	109	P1064	P1064-H1066 PolarHBondContact O-N 3.06Å
1067	I	37.8	Very low	39.5	Very low	135 Å²	135	121.7 Å²	121.7	69%	0.692	70%	0.698	S	S	*	*			trans	-90	121	165.8	-59.5	175.7	0	0	0	106.7	V1065 P1069	V1065-I1067 HydrophobicContact CG1-CG1 4.42Å; V1065-I1067 PolarHBondContact O-N 3.33Å; I1067-P1069 WeakPolarHBondContact O-CD 3.37Å
1068	D	38.5	Very low	40.3	Very low	91 Å²	91	119.4 Å²	119.4	49%	0.487	68%	0.684	S	S	.	*			trans	-81.9	119.9	172.8	-167.5	-41.3	0	0	0	109.4	S1070 C1071	D1068-S1070 PolarHBondContact O-N 2.85Å; D1068-S1070 VanDerWaalsContact O-N 3.16Å; D1068-S1070 VanDerWaalsContact OD1-CB 3.29Å; D1068-S1070 WeakPolarHBondContact OD1-CB 3.5Å; D1068-S1070 PolarHBondContact OD1-N 3.05Å; D1068-S1070 PolarHBondContact OD1-OG 2.97Å; D1068-C1071 WeakPolarHBondContact O-CB 3.08Å; D1068-C1071 PolarHBondContact O-N 2.87Å; D1068-C1071 VanDerWaalsContact O-N 3.11Å
1069	P	43.8	Very low	41.3	Very low	89 Å²	89	121.8 Å²	121.8	58%	0.578	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-60.4	-23.1	179.3	-23.7	34.9	0	0	0	113.9	I1067 C1071 L1072	I1067-P1069 WeakPolarHBondContact O-CD 3.37Å; P1069-C1071 PolarHBondContact O-N 3.48Å; P1069-L1072 PolarHBondContact O-N 2.82Å
1070	S	44.9	Very low	41.8	Very low	95 Å²	95	119.7 Å²	119.7	66%	0.664	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-68.7	-11	177.1	68	0	0	0	0	114	D1068	D1068-S1070 PolarHBondContact O-N 2.85Å; D1068-S1070 VanDerWaalsContact O-N 3.16Å; D1068-S1070 VanDerWaalsContact OD1-CB 3.29Å; D1068-S1070 WeakPolarHBondContact OD1-CB 3.5Å; D1068-S1070 PolarHBondContact OD1-N 3.05Å; D1068-S1070 PolarHBondContact OD1-OG 2.97Å
1071	C	40.5	Very low	42.3	Very low	110 Å²	110	118.6 Å²	118.6	74%	0.743	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-87.9	1.1	173.5	-67.1	0	0	0	0	114	D1068 P1069	D1068-C1071 WeakPolarHBondContact O-CB 3.08Å; D1068-C1071 PolarHBondContact O-N 2.87Å; D1068-C1071 VanDerWaalsContact O-N 3.11Å; P1069-C1071 PolarHBondContact O-N 3.48Å
1072	L	46.7	Very low	43.2	Very low	93 Å²	93	118.8 Å²	118.8	49%	0.487	66%	0.655	S	S	.	*	S	Bend	trans	-90.3	141.9	174.7	-71.8	166.1	0	0	0	111.4	P1069 L1077	P1069-L1072 PolarHBondContact O-N 2.82Å; L1072-L1077 HydrophobicContact CB-CD1 3.93Å; L1072-L1077 HydrophobicContact CD1-CD1 3.81Å
1073	H	47.1	Very low	43.9	Very low	132 Å²	132	115.2 Å²	115.2	61%	0.611	64%	0.643	S	S	*	*			trans	-65.8	132.6	177.4	-137.3	-47.3	0	0	0	109.5	D1075 L1076	H1073-D1075 VanDerWaalsContact C-N 3.26Å; H1073-D1075 IonicContact ND1-OD2 3.88Å; H1073-D1075 PolarHBondContact O-N 3.02Å; H1073-D1075 VanDerWaalsContact O-N 3.14Å; H1073-L1076 PolarHBondContact O-N 2.8Å
1074	P	50.3	Low	44.1	Very low	91 Å²	91	117 Å²	117	59%	0.591	65%	0.646	S	S	*	*	H	α-helix	trans	-56.3	-36.8	-171.9	-30.1	37.1	0	0	0	114.7	L1076 L1077	P1074-L1076 PolarHBondContact O-N 3.09Å; P1074-L1077 PolarHBondContact O-N 2.93Å
1075	D	50.1	Low	44.5	Very low	120 Å²	120	117 Å²	117	64%	0.642	64%	0.638	S	S	*	*	H	α-helix	trans	-65.7	-19.2	-178.6	-46.5	-43.1	0	0	0	113.1	H1073 T1078	H1073-D1075 VanDerWaalsContact C-N 3.26Å; H1073-D1075 IonicContact ND1-OD2 3.88Å; H1073-D1075 PolarHBondContact O-N 3.02Å; H1073-D1075 VanDerWaalsContact O-N 3.14Å; D1075-T1078 PolarHBondContact O-OG1 2.81Å
1076	L	47	Very low	45	Very low	104 Å²	104	112.9 Å²	112.9	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-91.9	-12.8	174.6	-91	162.1	0	0	0	113.6	H1073 P1074	H1073-L1076 PolarHBondContact O-N 2.8Å; P1074-L1076 PolarHBondContact O-N 3.09Å
1077	L	48.3	Very low	45.2	Very low	95 Å²	95	114.7 Å²	114.7	50%	0.497	62%	0.617	S	S	.	*	H	α-helix	trans	-81.2	-30.5	178.2	-136.1	79.6	0	0	0	112	L1072 P1074 V1080 Q1081	L1072-L1077 HydrophobicContact CB-CD1 3.93Å; L1072-L1077 HydrophobicContact CD1-CD1 3.81Å; P1074-L1077 PolarHBondContact O-N 2.93Å; L1077-V1080 PolarHBondContact O-N 3.39Å; L1077-Q1081 PolarHBondContact O-N 2.95Å
1078	T	46.5	Very low	45.4	Very low	95 Å²	95	116.2 Å²	116.2	58%	0.583	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-32.4	-178.1	50.1	0	0	0	0	113.3	D1075 V1080	D1075-T1078 PolarHBondContact O-OG1 2.81Å; T1078-V1080 VanDerWaalsContact C-N 3.33Å; T1078-V1080 PolarHBondContact O-N 2.7Å
1079	E	51.9	Low	45.6	Very low	158 Å²	158	118.7 Å²	118.7	74%	0.738	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-21.9	176.4	-68.5	-161.7	138	0	0	113.9
1080	V	46.5	Very low	45.5	Very low	73 Å²	73	120.1 Å²	120.1	44%	0.442	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.4	-1.2	-169.6	-162.3	0	0	0	0	113.1	L1077 T1078 H1082 V1083	L1077-V1080 PolarHBondContact O-N 3.39Å; T1078-V1080 VanDerWaalsContact C-N 3.33Å; T1078-V1080 PolarHBondContact O-N 2.7Å; V1080-H1082 PolarHBondContact O-N 2.85Å; V1080-V1083 HydrophobicContact CG1-CB 4.26Å; V1080-V1083 HydrophobicContact CG1-CG2 4.5Å; V1080-V1083 PolarHBondContact O-N 2.85Å; V1080-V1083 VanDerWaalsContact O-N 3.08Å
1081	Q	41.1	Very low	45.4	Very low	145 Å²	145	123.3 Å²	123.3	68%	0.678	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-24.3	-176	-175.7	173	-9.4	0	0	114.6	L1077	L1077-Q1081 PolarHBondContact O-N 2.95Å
1082	H	47.1	Very low	45.6	Very low	174 Å²	174	124.8 Å²	124.8	81%	0.806	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	2.7	-177.3	-59.9	-59.6	0	0	0	115.5	V1080	V1080-H1082 PolarHBondContact O-N 2.85Å
1083	V	48.7	Very low	45.3	Very low	111 Å²	111	126.8 Å²	126.8	67%	0.673	65%	0.647	S	S	*	*	S	Bend	trans	-114.1	-10.2	-170.5	-168.6	0	0	0	0	113.6	V1080	V1080-V1083 HydrophobicContact CG1-CB 4.26Å; V1080-V1083 HydrophobicContact CG1-CG2 4.5Å; V1080-V1083 PolarHBondContact O-N 2.85Å; V1080-V1083 VanDerWaalsContact O-N 3.08Å
1084	V	41.7	Very low	45.3	Very low	122 Å²	122	125.9 Å²	125.9	74%	0.739	65%	0.65	S	S	*	*			trans	-93	108.2	-175.6	-172.9	0	0	0	0	111.4
1085	I	47	Very low	44.7	Very low	117 Å²	117	129 Å²	129	60%	0.6	66%	0.662	S	S	*	*			trans	-77.7	130.8	171.9	-59.4	175.6	0	0	0	109.2	Q1089	I1085-Q1089 HydrophobicContact CG2-CB 3.9Å
1086	A	44.7	Very low	44	Very low	40 Å²	40	129.7 Å²	129.7	33%	0.331	66%	0.661	S	S	.	*			trans	-68.2	151.2	-179.8	0	0	0	0	0	112	E1088 Q1089	A1086-E1088 VanDerWaalsContact C-N 3.27Å; A1086-E1088 HydrophobicContact CB-CG 4.31Å; A1086-E1088 PolarHBondContact O-N 2.93Å; A1086-Q1089 HydrophobicContact CB-CG 4.4Å; A1086-Q1089 WeakPolarHBondContact O-CB 3.37Å; A1086-Q1089 PolarHBondContact O-N 3.09Å
1087	R	39.7	Very low	44	Very low	219 Å²	219	133.1 Å²	133.1	83%	0.826	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-65.4	-33.6	-175.1	-174.1	177.6	178.5	-177.6	-0.8	111.9	Q1089 L1090	R1087-Q1089 PolarHBondContact O-N 3.33Å; R1087-L1090 PolarHBondContact O-N 3Å
1088	E	42.5	Very low	43.2	Very low	167 Å²	167	135 Å²	135	78%	0.78	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-69.9	-8.3	174.8	35	-78.3	102.6	0	0	113.9	A1086	A1086-E1088 VanDerWaalsContact C-N 3.27Å; A1086-E1088 HydrophobicContact CB-CG 4.31Å; A1086-E1088 PolarHBondContact O-N 2.93Å
1089	Q	41.7	Very low	42.6	Very low	142 Å²	142	133.9 Å²	133.9	66%	0.664	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-96.1	-3.5	172.1	-65	-177	-15.3	0	0	113.4	I1085 A1086 R1087 L1091	I1085-Q1089 HydrophobicContact CG2-CB 3.9Å; A1086-Q1089 HydrophobicContact CB-CG 4.4Å; A1086-Q1089 WeakPolarHBondContact O-CB 3.37Å; A1086-Q1089 PolarHBondContact O-N 3.09Å; R1087-Q1089 PolarHBondContact O-N 3.33Å; Q1089-L1091 PolarHBondContact O-N 3Å
1090	L	41	Very low	41.9	Very low	120 Å²	120	138.9 Å²	138.9	63%	0.628	71%	0.707	S	S	*	*			trans	-92.5	91.1	177.9	-78.1	165.3	0	0	0	111.9	R1087 L1092	R1087-L1090 PolarHBondContact O-N 3Å; L1090-L1092 PolarHBondContact O-N 2.97Å
1091	L	43.8	Very low	41.2	Very low	162 Å²	162	139 Å²	139	85%	0.848	72%	0.723	S	S	*	*			trans	-68	114.4	168.9	-80	167.3	0	0	0	110.8	Q1089	Q1089-L1091 PolarHBondContact O-N 3Å
1092	L	44.6	Very low	40.7	Very low	140 Å²	140	145.2 Å²	145.2	73%	0.733	75%	0.752	S	S	*	*			trans	-118.8	99.2	-174.3	-146.1	165	0	0	0	110.1	L1090 V1094	L1090-L1092 PolarHBondContact O-N 2.97Å; L1092-V1094 HydrophobicContact CD2-CG2 3.95Å; L1092-V1094 PolarHBondContact O-N 3.49Å
1093	H	40.9	Very low	40.4	Very low	135 Å²	135	143.8 Å²	143.8	63%	0.625	75%	0.749	S	S	*	*			trans	-80.5	104.2	179.4	-70.4	-20.8	0	0	0	111.3
1094	V	45.8	Very low	40	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.685	75%	0.753	S	S	*	*	S	Bend	trans	-85.2	-25.5	-175.6	-177.4	0	0	0	0	113.3	L1092	L1092-V1094 HydrophobicContact CD2-CG2 3.95Å; L1092-V1094 PolarHBondContact O-N 3.49Å
1095	N	39	Very low	39.9	Very low	156 Å²	156	146.8 Å²	146.8	83%	0.834	75%	0.754	S	S	*	*	S	Bend	trans	-133.8	40.2	-168.3	-72.2	-41	0	0	0	114.5
1096	Q	33.9	Very low	39.4	Very low	136 Å²	136	148.5 Å²	148.5	64%	0.636	76%	0.763	S	S	*	*			trans	-130.6	127.4	168.6	-83.4	-169.3	-14.9	0	0	112.2
1097	I	47.1	Very low	39.1	Very low	176 Å²	176	155.3 Å²	155.3	90%	0.903	79%	0.79	S	S	*	*			trans	-89	108.6	165.3	-60.2	174.4	0	0	0	107.1
1098	I	32.4	Very low	39.1	Very low	134 Å²	134	151.1 Å²	151.1	69%	0.687	79%	0.788	S	S	*	*			trans	-95.9	142.3	170.2	-60.1	178.6	0	0	0	108.3
1099	G	33.1	Very low	38.8	Very low	72 Å²	72	149.9 Å²	149.9	74%	0.742	79%	0.788	S	S	*	*			trans	-79.6	-176.7	-162.1	0	0	0	0	0	117.4
1100	R	38.7	Very low	38.6	Very low	263 Å²	263	150.5 Å²	150.5	99%	0.992	80%	0.798	S	S	*	*			trans	-66.5	151.3	-178.8	-67.2	174.7	169.8	174	-5.3	113.8
1101	G	30.5	Very low	38.4	Very low	75 Å²	75	153.1 Å²	153.1	77%	0.773	81%	0.812	S	S	*	*			trans	139.3	127.2	160.6	0	0	0	0	0	111.6
1102	Q	31.3	Very low	37.9	Very low	275 Å²	275	152.3 Å²	152.3	100%	1.285	81%	0.809	S	S	*	*			cis	-118.3	0	-1.3	-70.6	-180	-25.7	0	0	110.8

Retrieved 1,102 of 1,102 residues in 839 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).