A0A087XS11_POEFO Loading...

Neuropilin

AlphaFold DB , UniProt , Accession A0A087XS11, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 919 aa.

						>A0A087XS11_POEFO|A0A087XS11
MHCGLVFVLFMGILVVLEAFKNDKCGGNIRISSASYLTSPGYPMSYPPSQRCMWVISAPGPHQRILINFNPHFDLEDRECKYDYVEVRDGVDENGQLVGKYCGKIAPSAVVSSGNQLFIKFVSDYETHGAGFSIRYEIFKTGPECSKNFTSNSGVIKSPGFPEKYPNNLDCTFMIFAPKMSEIILEFESFELEPDTTPPTGVFCRYDRLEIWDGFPGVGPYIGRYCGQNTPGRIISYTGILALTINTDSAIAKEGFSANFTVLDRTVPEDFDCSDPLGMESGEITSDQIMASSHYNPSWSPERSRLNYYENAWTPAEDSNKEWIQVDLGFLRFISAIGTQGAISQETHKIYFVKSYKVDVSSNGEDWITLKEGSKQKIFQGNTNPTDVTKTKLPKPTLTRFLRIRPVTWETGIALRFEVYGCKISEYPCSGMLGMVSGLITDNQITASSHTDRSWVPENARLLTSRTGWTLLPQPQPFTNEWLQVDLGEEKLVKGFIIQGGKYRENKVFMKKFRLGYSNNGSDWRVVSDTSGNKPKIFEGNSNYDTPELRTVEPLLTRFIRIYPERATPAGMGLRLELLGCEIEAPTFPPTTPAPSTTPSDECDDDQASCHSGTGGTTMPETTTLKVDPIPAFLWFACDFGWPNDPSFCRWTSEDTGSRWQIQSSGTPTLNTGPNMDHTGGSGNFIYTLATGLQESEVARLVSPMVSSEDSDLCVSFWYHMHGSHIGTLHIKQREQTEEGTADILLWTVSGHQGNRWREGRVLVPRISKPYQVVIEGLVQRKSWGDIAVDDIKVLDGLGKSDCEDPDVPTEPMLPEDNNNEIFEVEDITDYPDLVETNQISGAGNMLKTLNPILITIIAMSALGVFLGAICGVVLYCACSHGGMSERNLSALENYNFELVDGVKLKKDKLNVQNSYSEA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	46.2	Very low	230 Å²	230	135.5 Å²	135.5	100%	1.133	73%	0.725	S	S	*	*				0	138.1	0	-74.8	160.6	74.2	0	0	107.7
2	H	45.1	Very low	45.9	Very low	183 Å²	183	127.2 Å²	127.2	85%	0.847	70%	0.696	S	S	*	*			trans	105.7	15.5	-179.6	-58.9	-22	0	0	0	120.4
3	C	43.9	Very low	45.8	Very low	122 Å²	122	124.5 Å²	124.5	82%	0.824	68%	0.679	S	S	*	*	S	Bend	trans	-118.4	-10.5	165.3	-133.3	0	0	0	0	115
4	G	41.8	Very low	45.3	Very low	60 Å²	60	123.7 Å²	123.7	62%	0.619	67%	0.673	S	S	*	*	S	Bend	trans	-89.5	-14.2	-177.1	0	0	0	0	0	116
5	L	44.7	Very low	45	Very low	137 Å²	137	122.2 Å²	122.2	72%	0.717	67%	0.669	S	S	*	*	H	α-helix	trans	-91	-20.2	-172.6	-135.5	89.1	0	0	0	113.8
6	V	48.8	Very low	44.6	Very low	102 Å²	102	119.9 Å²	119.9	62%	0.618	66%	0.659	S	S	*	*	H	α-helix	trans	-86.8	-28.2	-174.9	-178.8	0	0	0	0	111.9	F10	V6-F10 PolarHBondContact O-N 2.61Å
7	F	45.5	Very low	44.1	Very low	165 Å²	165	119.9 Å²	119.9	72%	0.724	66%	0.657	S	S	*	*	H	α-helix	trans	-75.8	-30.1	179.4	-138.2	-94.1	0	0	0	112.9	M11	F7-M11 PolarHBondContact O-N 3.13Å
8	V	49.5	Very low	43.7	Very low	110 Å²	110	122.7 Å²	122.7	67%	0.667	67%	0.665	S	S	*	*	H	α-helix	trans	-73.6	-31.3	176.1	-177.5	0	0	0	0	111.3	G12	V8-G12 PolarHBondContact O-N 3.02Å; V8-G12 VanDerWaalsContact O-N 3.13Å
9	L	47.6	Very low	43.5	Very low	108 Å²	108	120.6 Å²	120.6	57%	0.565	67%	0.666	S	S	*	*	H	α-helix	trans	-74.8	-32.8	177.9	-106.9	131.8	0	0	0	113.3	I13	L9-I13 WeakPolarHBondContact O-CD1 3.39Å; L9-I13 VanDerWaalsContact O-CG1 3.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.35Å; L9-I13 PolarHBondContact O-N 2.95Å
10	F	46.2	Very low	43.3	Very low	146 Å²	146	122.8 Å²	122.8	64%	0.64	67%	0.669	S	S	*	*	H	α-helix	trans	-81.2	-34	178.9	-112.8	-90.2	0	0	0	113.7	V6 I13 L14	V6-F10 PolarHBondContact O-N 2.61Å; F10-I13 PolarHBondContact O-N 3.23Å; F10-L14 PolarHBondContact O-N 2.93Å
11	M	45.8	Very low	42.9	Very low	127 Å²	127	125.9 Å²	125.9	63%	0.626	68%	0.676	S	S	*	*	H	α-helix	trans	-71.2	-31.8	170.9	-98.4	-96.4	171.4	0	0	112	F7 V15	F7-M11 PolarHBondContact O-N 3.13Å; M11-V15 VanDerWaalsContact O-CG2 3.26Å; M11-V15 WeakPolarHBondContact O-CG2 3.26Å; M11-V15 PolarHBondContact O-N 3.07Å; M11-V15 VanDerWaalsContact O-N 3.15Å
12	G	42.8	Very low	42.4	Very low	36 Å²	36	121.8 Å²	121.8	37%	0.371	66%	0.659	S	S	.	*	H	α-helix	trans	-66.3	-34.9	172.4	0	0	0	0	0	113.4	V8 V16	V8-G12 PolarHBondContact O-N 3.02Å; V8-G12 VanDerWaalsContact O-N 3.13Å; G12-V16 WeakPolarHBondContact O-CB 3.18Å; G12-V16 WeakPolarHBondContact O-CG2 3.44Å; G12-V16 PolarHBondContact O-N 3.44Å; G12-V16 VanDerWaalsContact O-N 3.14Å
13	I	44.8	Very low	42.5	Very low	92 Å²	92	118.9 Å²	118.9	47%	0.472	65%	0.65	S	S	.	*	H	α-helix	trans	-78.1	-31.9	-178.8	-69.3	167.6	0	0	0	112.1	L9 F10 L17	L9-I13 WeakPolarHBondContact O-CD1 3.39Å; L9-I13 VanDerWaalsContact O-CG1 3.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.35Å; L9-I13 PolarHBondContact O-N 2.95Å; F10-I13 PolarHBondContact O-N 3.23Å; I13-L17 HydrophobicContact CG2-CD1 4.01Å; I13-L17 WeakPolarHBondContact O-CB 3.21Å; I13-L17 PolarHBondContact O-N 2.8Å; I13-L17 VanDerWaalsContact O-N 3.14Å
14	L	38.3	Very low	43.1	Very low	114 Å²	114	121.7 Å²	121.7	60%	0.597	65%	0.648	S	S	*	*	H	α-helix	trans	-76.5	-32.4	174.2	-105.6	128.4	0	0	0	113.4	F10 V16 L17 E18	F10-L14 PolarHBondContact O-N 2.93Å; L14-V16 VanDerWaalsContact C-N 3.32Å; L14-L17 PolarHBondContact O-N 2.82Å; L14-E18 PolarHBondContact O-N 3.41Å
15	V	41.1	Very low	45	Very low	101 Å²	101	120.3 Å²	120.3	61%	0.612	63%	0.628	S	S	*	*	H	α-helix	trans	-71.8	-28.9	172.7	175.2	0	0	0	0	111.6	M11	M11-V15 VanDerWaalsContact O-CG2 3.26Å; M11-V15 WeakPolarHBondContact O-CG2 3.26Å; M11-V15 PolarHBondContact O-N 3.07Å; M11-V15 VanDerWaalsContact O-N 3.15Å
16	V	38.8	Very low	46.8	Very low	85 Å²	85	114.8 Å²	114.8	52%	0.515	60%	0.604	S	S	.	*	H	α-helix	trans	-76.6	-23.4	172.6	174.8	0	0	0	0	111.9	G12 L14 F20	G12-V16 WeakPolarHBondContact O-CB 3.18Å; G12-V16 WeakPolarHBondContact O-CG2 3.44Å; G12-V16 PolarHBondContact O-N 3.44Å; G12-V16 VanDerWaalsContact O-N 3.14Å; L14-V16 VanDerWaalsContact C-N 3.32Å; V16-F20 HydrophobicContact CG1-CD2 4.27Å; V16-F20 HydrophobicContact CG1-CE2 3.86Å; V16-F20 VanDerWaalsContact O-CD2 3.24Å; V16-F20 WeakPolarHBondContact O-CD2 3.42Å
17	L	36.1	Very low	48.7	Very low	120 Å²	120	111.5 Å²	111.5	63%	0.628	59%	0.591	S	S	*	*	H	α-helix	trans	-85.2	-13	179	-94.7	151.4	0	0	0	115.2	I13 L14	I13-L17 HydrophobicContact CG2-CD1 4.01Å; I13-L17 WeakPolarHBondContact O-CB 3.21Å; I13-L17 PolarHBondContact O-N 2.8Å; I13-L17 VanDerWaalsContact O-N 3.14Å; L14-L17 PolarHBondContact O-N 2.82Å
18	E	37	Very low	50.9	Low	171 Å²	171	110.2 Å²	110.2	80%	0.799	59%	0.592	S	S	*	*	H	α-helix	trans	-92.7	-11	168.8	-77.3	-168.6	159.9	0	0	114	L14	L14-E18 PolarHBondContact O-N 3.41Å
19	A	39.9	Very low	52.9	Low	83 Å²	83	106.5 Å²	106.5	69%	0.686	57%	0.568	S	S	*	*	S	Bend	trans	-94.2	1.9	172.6	0	0	0	0	0	114	K21	A19-K21 VanDerWaalsContact C-N 3.3Å
20	F	38.6	Very low	55	Low	163 Å²	163	111.9 Å²	111.9	72%	0.715	58%	0.581	S	S	*	*			trans	-99.3	54.4	163.5	-76.5	-75.2	0	0	0	110.2	V16 N22	V16-F20 HydrophobicContact CG1-CD2 4.27Å; V16-F20 HydrophobicContact CG1-CE2 3.86Å; V16-F20 VanDerWaalsContact O-CD2 3.24Å; V16-F20 WeakPolarHBondContact O-CD2 3.42Å; F20-N22 PolarHBondContact O-N 2.67Å
21	K	36.4	Very low	56.9	Low	188 Å²	188	105.3 Å²	105.3	82%	0.817	55%	0.552	S	S	*	*			trans	-75.5	77.5	162.1	-154.4	178.1	-167	177.2	0	107.3	A19 D23	A19-K21 VanDerWaalsContact C-N 3.3Å; K21-D23 PolarHBondContact O-N 2.75Å; K21-D23 VanDerWaalsContact O-N 3.08Å
22	N	37.6	Very low	58.7	Low	145 Å²	145	104.8 Å²	104.8	78%	0.775	56%	0.561	S	S	*	*			trans	13.5	87.3	161.7	-141.1	12.1	0	0	0	112.3	F20 K24	F20-N22 PolarHBondContact O-N 2.67Å; N22-K24 PolarHBondContact O-N 3.38Å
23	D	47.3	Very low	60.5	Low	122 Å²	122	106.9 Å²	106.9	65%	0.652	57%	0.57	S	S	*	*			trans	-69	80.2	-165.7	-143.9	12	0	0	0	109.3	K21 C25	K21-D23 PolarHBondContact O-N 2.75Å; K21-D23 VanDerWaalsContact O-N 3.08Å; D23-C25 VanDerWaalsContact C-N 3.3Å; D23-C25 PolarHBondContact O-N 3.21Å
24	K	56.4	Low	62.3	Low	180 Å²	180	104.4 Å²	104.4	78%	0.783	56%	0.563	S	S	*	*			trans	-68.4	99.5	166.7	-79.1	-169.6	176.8	-174.6	0	105.3	N22 G26	N22-K24 PolarHBondContact O-N 3.38Å; K24-G26 PolarHBondContact O-N 3.23Å
25	C	81	Confident	64.8	Low	32 Å²	32	101.3 Å²	101.3	22%	0.216	55%	0.551	C	S	.	*			trans	-66.7	116.6	174	-153.3	0	0	0	0	109.6	D23 P40 C52	D23-C25 VanDerWaalsContact C-N 3.3Å; D23-C25 PolarHBondContact O-N 3.21Å; C25-P40 HydrophobicContact CB-CG 3.99Å; C25-P40 VanDerWaalsContact SG-CD 3.51Å; C25-P40 WeakPolarHBondContact SG-CG 3.42Å; C25-C52 HydrophobicContact CB-CB 3.74Å; C25-C52 WeakPolarHBondContact CB-SG 3.24Å; C25-C52 WeakPolarHBondContact SG-CB 3.44Å; C25-C52 CovalentContact SG-SG 1.97Å; C25-C52 PolarHBondContact SG-SG 3.08Å
26	G	83.3	Confident	67.2	Low	20 Å²	20	103 Å²	103	21%	0.206	55%	0.547	C	S	.	.			trans	103.3	162.8	-174.6	0	0	0	0	0	114.9	K24 M53	K24-G26 PolarHBondContact O-N 3.23Å; G26-M53 CarbonylContact C-O 3.3Å; G26-M53 WeakPolarHBondContact CA-O 3.35Å
27	G	88.9	Confident	69.7	Low	33 Å²	33	99.3 Å²	99.3	34%	0.34	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	154	172.5	177.5	0	0	0	0	0	114.3	M53 W54 V55	G27-M53 PolarHBondContact N-O 3.14Å; G27-W54 WeakPolarHBondContact O-CA 3.42Å; G27-V55 PolarHBondContact O-N 2.84Å
28	N	90.9	Very high	72.5	Confident	139 Å²	139	96.3 Å²	96.3	74%	0.743	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.6	177.9	-63.4	-24.1	0	0	0	110	V55	N28-V55 CarbonylContact C-O 3.53Å; N28-V55 WeakPolarHBondContact CA-O 3.28Å; N28-V55 WeakPolarHBondContact OD1-CB 3.22Å
29	I	92.3	Very high	75.2	Confident	32 Å²	32	88.1 Å²	88.1	16%	0.164	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.5	-179	-61.5	173	0	0	0	108	L37 V55 I56 S57 Y136	I29-L37 HydrophobicContact CD1-CD1 3.88Å; I29-V55 PolarHBondContact N-O 3Å; I29-I56 HydrophobicContact CB-CG1 4.44Å; I29-I56 HydrophobicContact CD1-CG1 4.38Å; I29-I56 HydrophobicContact CG2-CG2 4.35Å; I29-I56 CarbonylContact O-C 3.52Å; I29-I56 WeakPolarHBondContact O-CA 3.23Å; I29-S57 PolarHBondContact O-N 2.73Å; I29-Y136 HydrophobicContact CD1-CE1 4.18Å; I29-Y136 HydrophobicContact CG2-CE1 4.29Å; I29-Y136 HydrophobicContact CG2-CE2 3.67Å; I29-Y136 WeakPolarHBondContact CG2-OH 3.45Å
30	R	90.9	Very high	77.6	Confident	221 Å²	221	84.7 Å²	84.7	83%	0.834	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.6	169.2	-69.8	-175.6	176.6	-176.5	-1.8	109.1	S32 S57	R30-S32 PolarHBondContact O-N 2.89Å; R30-S57 WeakPolarHBondContact CA-O 3.4Å
31	I	87.6	Confident	79.8	Confident	7 Å²	7	79 Å²	79	4%	0.036	43%	0.43	C	S	.	.			trans	-74.2	116.6	-176.5	-52.5	178.3	0	0	0	109.4	I56 S57 P59 I65 Y136 I138	I31-I56 HydrophobicContact CD1-CG2 3.63Å; I31-I56 HydrophobicContact CG1-CG2 3.61Å; I31-S57 PolarHBondContact N-O 2.86Å; I31-P59 WeakPolarHBondContact O-CD 3.19Å; I31-I65 HydrophobicContact CD1-CB 4.4Å; I31-I65 HydrophobicContact CD1-CD1 4.12Å; I31-I65 HydrophobicContact CD1-CG1 3.93Å; I31-I65 HydrophobicContact CD1-CG2 3.74Å; I31-Y136 HydrophobicContact CD1-CD2 4.19Å; I31-Y136 HydrophobicContact CG1-CD2 3.93Å; I31-Y136 HydrophobicContact CG1-CE2 4.26Å; I31-I138 HydrophobicContact CB-CG1 4.49Å; I31-I138 HydrophobicContact CG2-CD1 4.47Å; I31-I138 HydrophobicContact CG2-CG1 4.01Å
32	S	82.3	Confident	82.3	Confident	117 Å²	117	72 Å²	72	82%	0.818	40%	0.4	S	S	*	.	S	Bend	trans	-105.6	-35.2	166.3	52.5	0	0	0	0	111.8	R30	R30-S32 PolarHBondContact O-N 2.89Å
33	S	80.3	Confident	84.8	Confident	79 Å²	79	68.9 Å²	68.9	55%	0.552	39%	0.387	S	S	*	.	S	Bend	trans	-149.1	164.7	175.3	59.5	0	0	0	0	109	S35	S33-S35 PolarHBondContact O-N 2.84Å
34	A	84.5	Confident	86.7	Confident	40 Å²	40	69.8 Å²	69.8	33%	0.331	39%	0.389	S	S	.	.			trans	-57.8	134.5	173.4	0	0	0	0	0	110.9	Y136 E137	A34-Y136 WeakPolarHBondContact CA-O 2.94Å; A34-E137 HydrophobicContact CB-CB 3.76Å
35	S	89.9	Confident	88.1	Confident	49 Å²	49	64.9 Å²	64.9	34%	0.343	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-178.7	-176.5	-173.8	0	0	0	0	110.9	S33 R135 Y136	S33-S35 PolarHBondContact O-N 2.84Å; S35-R135 WeakPolarHBondContact O-CA 3.37Å; S35-Y136 WeakPolarHBondContact CB-OH 3.32Å; S35-Y136 PolarHBondContact N-O 2.6Å; S35-Y136 VanDerWaalsContact N-O 3.16Å; S35-Y136 WeakPolarHBondContact O-CD1 3.45Å; S35-Y136 PolarHBondContact O-N 2.93Å; S35-Y136 PolarHBondContact OG-OH 2.83Å
36	Y	90.8	Very high	88.5	Confident	137 Å²	137	63.5 Å²	63.5	54%	0.537	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.2	-171.3	-66.2	-92.6	0	0	0	112.9	I134 R135	Y36-I134 CarbonylContact C-O 3.49Å; Y36-I134 VanDerWaalsContact CA-O 3.27Å; Y36-I134 WeakPolarHBondContact CA-O 3.35Å; Y36-R135 HydrophobicContact CD1-CB 3.94Å; Y36-R135 HydrophobicContact CD1-CG 4.41Å; Y36-R135 HydrophobicContact CE1-CB 3.67Å; Y36-R135 HydrophobicContact CE1-CG 3.99Å
37	L	92.9	Very high	88.8	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.037	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.1	170.3	178.4	160.4	0	0	0	107.6	I29 W54 I56 I119 F132 S133 I134 Y136	I29-L37 HydrophobicContact CD1-CD1 3.88Å; L37-W54 HydrophobicContact CD1-CB 3.72Å; L37-W54 HydrophobicContact CD1-CD2 3.68Å; L37-W54 HydrophobicContact CD1-CE3 4.17Å; L37-W54 HydrophobicContact CD1-CG 3.48Å; L37-W54 VanDerWaalsContact CD1-CG 3.48Å; L37-W54 HydrophobicContact CD2-CD2 4.21Å; L37-W54 HydrophobicContact CD2-CE3 4.15Å; L37-W54 HydrophobicContact CD2-CH2 4.32Å; L37-W54 HydrophobicContact CD2-CZ2 4.39Å; L37-W54 HydrophobicContact CD2-CZ3 4.21Å; L37-W54 HydrophobicContact CG-CD2 4.13Å; L37-W54 HydrophobicContact CG-CG 4.32Å; L37-I56 HydrophobicContact CD1-CD1 4.37Å; L37-I119 HydrophobicContact CD1-CD1 4.31Å; L37-F132 HydrophobicContact CD2-CE2 3.56Å; L37-F132 HydrophobicContact CD2-CZ 4.06Å; L37-S133 CarbonylContact O-C 3.56Å; L37-S133 WeakPolarHBondContact O-CA 3.4Å; L37-I134 HydrophobicContact CB-CB 4.49Å; L37-I134 HydrophobicContact CD2-CD1 4.34Å; L37-I134 PolarHBondContact N-O 2.88Å; L37-I134 PolarHBondContact O-N 2.85Å; L37-Y136 HydrophobicContact CB-CD1 4.17Å; L37-Y136 HydrophobicContact CB-CE1 4.07Å
38	T	93.6	Very high	88.7	Confident	57 Å²	57	65.9 Å²	65.9	35%	0.35	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	157.9	-179.3	61.6	0	0	0	0	111.7	Y42 F132	T38-Y42 HydrophobicContact CG2-CD1 3.96Å; T38-Y42 HydrophobicContact CG2-CG 4.38Å; T38-F132 VanDerWaalsContact CA-O 3.3Å; T38-F132 WeakPolarHBondContact CA-O 3.26Å
39	S	92.9	Very high	88.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.367	C	S	.	.			trans	-62.4	150.2	161.5	53.4	0	0	0	0	110.3	G41 Y42 G131 F132	S39-G41 PolarHBondContact O-N 2.8Å; S39-Y42 WeakPolarHBondContact O-CB 3.18Å; S39-Y42 PolarHBondContact O-N 2.75Å; S39-G131 VanDerWaalsContact OG-CA 3.31Å; S39-G131 WeakPolarHBondContact OG-CA 3.31Å; S39-F132 PolarHBondContact N-O 3.16Å; S39-F132 VanDerWaalsContact N-O 3.07Å; S39-F132 PolarHBondContact OG-N 2.8Å; S39-F132 VanDerWaalsContact OG-N 3.08Å
40	P	91	Very high	88.3	Confident	11 Å²	11	64.5 Å²	64.5	7%	0.071	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	133.9	176.4	-25.9	35.4	0	0	0	111.1	C25 Y42 Y46 P47	C25-P40 HydrophobicContact CB-CG 3.99Å; C25-P40 VanDerWaalsContact SG-CD 3.51Å; C25-P40 WeakPolarHBondContact SG-CG 3.42Å; P40-Y42 VanDerWaalsContact C-N 3.3Å; P40-Y42 PolarHBondContact O-N 3.21Å; P40-Y46 WeakPolarHBondContact O-CA 3.43Å; P40-P47 HydrophobicContact CB-CG 4.21Å; P40-P47 WeakPolarHBondContact O-CD 3.46Å
41	G	84.8	Confident	88.3	Confident	42 Å²	42	60.9 Å²	60.9	43%	0.433	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	-7.1	178.8	0	0	0	0	0	116.3	S39 M44	S39-G41 PolarHBondContact O-N 2.8Å; G41-M44 CarbonylContact C-O 3.44Å; G41-M44 CarbonylContact O-C 3.55Å; G41-M44 VanDerWaalsContact O-CA 3.31Å; G41-M44 WeakPolarHBondContact O-CA 3.36Å; G41-M44 WeakPolarHBondContact O-CB 3.33Å; G41-M44 PolarHBondContact O-N 3.13Å
42	Y	89.8	Confident	88.6	Confident	43 Å²	43	60.5 Å²	60.5	17%	0.169	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	136.1	178.1	-177.6	-88.1	0	0	0	111.9	T38 S39 P40 H72 A130 F132	T38-Y42 HydrophobicContact CG2-CD1 3.96Å; T38-Y42 HydrophobicContact CG2-CG 4.38Å; S39-Y42 WeakPolarHBondContact O-CB 3.18Å; S39-Y42 PolarHBondContact O-N 2.75Å; P40-Y42 VanDerWaalsContact C-N 3.3Å; P40-Y42 PolarHBondContact O-N 3.21Å; Y42-H72 WeakPolarHBondContact CE2-O 3.48Å; Y42-H72 AromaticContact CZ-CD2 3.89Å; Y42-H72 WeakPolarHBondContact OH-CB 3.47Å; Y42-H72 PolarHBondContact OH-CD2 2.91Å; Y42-H72 PolarHBondContact OH-O 3Å; Y42-H72 VanDerWaalsContact OH-O 3.07Å; Y42-A130 WeakPolarHBondContact CD2-O 3.29Å; Y42-F132 WeakPolarHBondContact CD2-O 3.05Å
43	P	89.7	Confident	89.2	Confident	78 Å²	78	58.7 Å²	58.7	51%	0.506	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	10.7	7.3	36.9	-37.3	0	0	0	114.6	A130	P43-A130 WeakPolarHBondContact O-CB 3.35Å
44	M	87.3	Confident	89.9	Confident	142 Å²	142	56 Å²	56	70%	0.7	31%	0.313	S	S	*	.	S	Bend	trans	-80.1	171.5	170.5	-54.9	-62.3	-62.7	0	0	110.2	G41 Y46 A130	G41-M44 CarbonylContact C-O 3.44Å; G41-M44 CarbonylContact O-C 3.55Å; G41-M44 VanDerWaalsContact O-CA 3.31Å; G41-M44 WeakPolarHBondContact O-CA 3.36Å; G41-M44 WeakPolarHBondContact O-CB 3.33Å; G41-M44 PolarHBondContact O-N 3.13Å; M44-Y46 PolarHBondContact O-N 2.77Å; M44-A130 VanDerWaalsContact O-O 3.05Å
45	S	85.3	Confident	90.4	Very high	76 Å²	76	55 Å²	55	53%	0.531	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-58.8	132.3	-177.5	-58.6	0	0	0	0	113.1	G129	S45-G129 WeakPolarHBondContact CA-O 3.39Å
46	Y	90.6	Very high	90.6	Very high	3 Å²	3	52.7 Å²	52.7	1%	0.012	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-67.5	148.9	174.8	55	-94.9	0	0	0	111	P40 M44 L75 E76 D83 F121 H128 G129	P40-Y46 WeakPolarHBondContact O-CA 3.43Å; M44-Y46 PolarHBondContact O-N 2.77Å; Y46-L75 HydrophobicContact CD1-CD2 3.87Å; Y46-L75 HydrophobicContact CE1-CD2 3.38Å; Y46-E76 PolarHBondContact OH-N 3.21Å; Y46-D83 WeakPolarHBondContact CE2-OD2 3.15Å; Y46-D83 PolarHBondContact OH-OD2 2.91Å; Y46-F121 HydrophobicContact CD1-CZ 4.27Å; Y46-F121 HydrophobicContact CD2-CE1 4.39Å; Y46-F121 AromaticContact CD2-CZ 3.71Å; Y46-F121 HydrophobicContact CD2-CZ 3.71Å; Y46-F121 HydrophobicContact CE2-CZ 4.21Å; Y46-F121 HydrophobicContact CG-CE1 4.37Å; Y46-F121 AromaticContact CG-CZ 3.75Å; Y46-F121 HydrophobicContact CG-CZ 3.75Å; Y46-H128 AromaticContact CD2-CD2 4Å; Y46-H128 HydrophobicContact CE2-CB 4.22Å; Y46-H128 AromaticContact CE2-CD2 3.93Å; Y46-H128 PolarHBondContact O-CD2 3.35Å; Y46-G129 WeakPolarHBondContact CD1-O 3.34Å; Y46-G129 VanDerWaalsContact CE1-O 3.26Å; Y46-G129 WeakPolarHBondContact CE1-O 3.31Å; Y46-G129 PolarHBondContact N-O 3.18Å; Y46-G129 PolarHBondContact OH-N 3.41Å
47	P	88.8	Confident	90.8	Very high	46 Å²	46	47 Å²	47	30%	0.299	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-69.1	156.5	178.3	-17.9	30.5	0	0	0	113.1	P40 Q50 S123	P40-P47 HydrophobicContact CB-CG 4.21Å; P40-P47 WeakPolarHBondContact O-CD 3.46Å; P47-Q50 HydrophobicContact CB-CG 3.9Å; P47-Q50 HydrophobicContact CG-CG 4.35Å; P47-Q50 VanDerWaalsContact O-CG 3.26Å; P47-Q50 WeakPolarHBondContact O-CG 3.31Å; P47-S123 PolarHBondContact O-OG 3.34Å
48	P	87	Confident	90.6	Very high	58 Å²	58	47.1 Å²	47.1	38%	0.377	27%	0.268	S	S	.	.	S	Bend	trans	-70.5	160.7	171	23.5	-27.5	0	0	0	111.9	Q50 D124 H128	P48-Q50 PolarHBondContact O-N 2.96Å; P48-Q50 PolarHBondContact O-NE2 3.19Å; P48-Q50 VanDerWaalsContact O-NE2 3.08Å; P48-D124 CarbonylContact C-O 3.53Å; P48-D124 VanDerWaalsContact CA-O 3.24Å; P48-D124 WeakPolarHBondContact CA-O 3.23Å; P48-D124 WeakPolarHBondContact CB-O 3.3Å; P48-H128 WeakPolarHBondContact CA-NE2 3.09Å; P48-H128 WeakPolarHBondContact CB-NE2 3.31Å; P48-H128 VanDerWaalsContact CD-NE2 3.27Å; P48-H128 WeakPolarHBondContact CD-NE2 3.08Å
49	S	86.8	Confident	90.2	Very high	86 Å²	86	48.9 Å²	48.9	60%	0.601	28%	0.281	S	S	*	.	S	Bend	trans	56.4	36	169.8	-57	0	0	0	0	113.4	S123 D124	S49-S123 VanDerWaalsContact CA-O 3.23Å; S49-S123 WeakPolarHBondContact CA-O 3.24Å; S49-S123 PolarHBondContact N-O 2.82Å; S49-S123 PolarHBondContact N-OG 2.79Å; S49-D124 PolarHBondContact N-O 2.87Å
50	Q	88	Confident	89.4	Confident	56 Å²	56	49.6 Å²	49.6	26%	0.262	29%	0.289	S	S	.	.			trans	-87.3	142.9	178.4	-61.8	-58.4	-52.9	0	0	110.5	P47 P48 F121 V122 S123	P47-Q50 HydrophobicContact CB-CG 3.9Å; P47-Q50 HydrophobicContact CG-CG 4.35Å; P47-Q50 VanDerWaalsContact O-CG 3.26Å; P47-Q50 WeakPolarHBondContact O-CG 3.31Å; P48-Q50 PolarHBondContact O-N 2.96Å; P48-Q50 PolarHBondContact O-NE2 3.19Å; P48-Q50 VanDerWaalsContact O-NE2 3.08Å; Q50-F121 HydrophobicContact CB-CD1 4.48Å; Q50-F121 HydrophobicContact CB-CE1 4.24Å; Q50-V122 VanDerWaalsContact O-CA 3.31Å; Q50-V122 WeakPolarHBondContact O-CA 3.24Å; Q50-S123 WeakPolarHBondContact CB-OG 3.21Å; Q50-S123 PolarHBondContact N-O 3.22Å; Q50-S123 PolarHBondContact N-OG 3.21Å; Q50-S123 PolarHBondContact O-N 2.82Å
51	R	91.8	Very high	88.5	Confident	144 Å²	144	53.7 Å²	53.7	54%	0.543	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	105.3	166.1	-173.5	-180	-177.1	-170	4.5	108.7	E93 F121	R51-E93 IonicContact CZ-OE1 3.74Å; R51-E93 IonicContact NH2-OE1 3.94Å; R51-E93 PolarHBondContact NH2-OE1 3.42Å; R51-E93 IonicContact NH2-OE2 2.73Å; R51-E93 PolarHBondContact NH2-OE2 3.02Å; R51-F121 CarbonylContact C-O 3.37Å; R51-F121 WeakPolarHBondContact CA-O 3.43Å
52	C	93.1	Very high	87.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.1	-175.2	-47	0	0	0	0	109.8	C25 W54 K120 F121	C25-C52 HydrophobicContact CB-CB 3.74Å; C25-C52 WeakPolarHBondContact CB-SG 3.24Å; C25-C52 WeakPolarHBondContact SG-CB 3.44Å; C25-C52 CovalentContact SG-SG 1.97Å; C25-C52 PolarHBondContact SG-SG 3.08Å; C52-W54 HydrophobicContact CB-CE3 4.17Å; C52-W54 HydrophobicContact CB-CH2 3.24Å; C52-W54 HydrophobicContact CB-CZ2 3.86Å; C52-W54 HydrophobicContact CB-CZ3 3.42Å; C52-W54 VanDerWaalsContact CB-CZ3 3.42Å; C52-K120 CarbonylContact O-C 3.51Å; C52-K120 WeakPolarHBondContact O-CA 3.47Å; C52-F121 HydrophobicContact CB-CB 4.14Å; C52-F121 PolarHBondContact N-O 3.32Å; C52-F121 PolarHBondContact O-N 3.03Å
53	M	94.4	Very high	87.3	Confident	79 Å²	79	60.5 Å²	60.5	39%	0.389	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.8	-178.1	-62.7	179.3	-61.3	0	0	109.5	G26 G27 F118 I119 K120	G26-M53 CarbonylContact C-O 3.3Å; G26-M53 WeakPolarHBondContact CA-O 3.35Å; G27-M53 PolarHBondContact N-O 3.14Å; M53-F118 HydrophobicContact CB-CE2 3.89Å; M53-F118 HydrophobicContact CB-CZ 3.92Å; M53-F118 HydrophobicContact CG-CE2 4.29Å; M53-F118 HydrophobicContact CG-CZ 3.82Å; M53-F118 HydrophobicContact SD-CE2 4.43Å; M53-F118 HydrophobicContact SD-CZ 3.92Å; M53-I119 CarbonylContact C-O 3.55Å; M53-I119 WeakPolarHBondContact CA-O 3.44Å; M53-K120 HydrophobicContact CG-CB 4.36Å; M53-K120 HydrophobicContact CG-CG 4.19Å
54	W	95.1	Very high	87.1	Confident	23 Å²	23	62.6 Å²	62.6	9%	0.087	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.4	178	-60.8	-92.9	0	0	0	110.9	G27 L37 C52 F118 I119 F121 F132	G27-W54 WeakPolarHBondContact O-CA 3.42Å; L37-W54 HydrophobicContact CD1-CB 3.72Å; L37-W54 HydrophobicContact CD1-CD2 3.68Å; L37-W54 HydrophobicContact CD1-CE3 4.17Å; L37-W54 HydrophobicContact CD1-CG 3.48Å; L37-W54 VanDerWaalsContact CD1-CG 3.48Å; L37-W54 HydrophobicContact CD2-CD2 4.21Å; L37-W54 HydrophobicContact CD2-CE3 4.15Å; L37-W54 HydrophobicContact CD2-CH2 4.32Å; L37-W54 HydrophobicContact CD2-CZ2 4.39Å; L37-W54 HydrophobicContact CD2-CZ3 4.21Å; L37-W54 HydrophobicContact CG-CD2 4.13Å; L37-W54 HydrophobicContact CG-CG 4.32Å; C52-W54 HydrophobicContact CB-CE3 4.17Å; C52-W54 HydrophobicContact CB-CH2 3.24Å; C52-W54 HydrophobicContact CB-CZ2 3.86Å; C52-W54 HydrophobicContact CB-CZ3 3.42Å; C52-W54 VanDerWaalsContact CB-CZ3 3.42Å; W54-F118 CarbonylContact O-C 3.52Å; W54-F118 WeakPolarHBondContact O-CA 2.98Å; W54-I119 HydrophobicContact CE3-CB 4.42Å; W54-I119 HydrophobicContact CE3-CG2 4.15Å; W54-I119 PolarHBondContact N-O 2.79Å; W54-I119 PolarHBondContact O-N 2.93Å; W54-F121 HydrophobicContact CH2-CB 4.28Å; W54-F121 HydrophobicContact CZ3-CB 3.85Å; W54-F132 HydrophobicContact CZ3-CZ 4.31Å
55	V	95.5	Very high	87.3	Confident	19 Å²	19	55.8 Å²	55.8	12%	0.115	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113.2	168.7	-174.3	0	0	0	0	107.7	G27 N28 I29 V91 L117 F118	G27-V55 PolarHBondContact O-N 2.84Å; N28-V55 CarbonylContact C-O 3.53Å; N28-V55 WeakPolarHBondContact CA-O 3.28Å; N28-V55 WeakPolarHBondContact OD1-CB 3.22Å; I29-V55 PolarHBondContact N-O 3Å; V55-V91 VanDerWaalsContact CG2-O 3.22Å; V55-V91 WeakPolarHBondContact CG2-O 3.37Å; V55-L117 CarbonylContact C-O 3.55Å; V55-L117 WeakPolarHBondContact CA-O 3.17Å; V55-F118 HydrophobicContact CG2-CD2 4.02Å
56	I	94.8	Very high	87.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.1	174.1	-49	-179.1	0	0	0	107.4	I29 I31 L37 I65 I67 Q116 L117 I119 Y136	I29-I56 HydrophobicContact CB-CG1 4.44Å; I29-I56 HydrophobicContact CD1-CG1 4.38Å; I29-I56 HydrophobicContact CG2-CG2 4.35Å; I29-I56 CarbonylContact O-C 3.52Å; I29-I56 WeakPolarHBondContact O-CA 3.23Å; I31-I56 HydrophobicContact CD1-CG2 3.63Å; I31-I56 HydrophobicContact CG1-CG2 3.61Å; L37-I56 HydrophobicContact CD1-CD1 4.37Å; I56-I65 HydrophobicContact CB-CD1 4.26Å; I56-I65 HydrophobicContact CG2-CD1 4.04Å; I56-I65 HydrophobicContact CG2-CG2 4.29Å; I56-I65 WeakPolarHBondContact O-CD1 3.19Å; I56-I67 HydrophobicContact CD1-CG2 4.3Å; I56-Q116 CarbonylContact O-C 3.49Å; I56-Q116 VanDerWaalsContact O-CA 3.22Å; I56-Q116 WeakPolarHBondContact O-CA 3.5Å; I56-L117 HydrophobicContact CB-CB 4.47Å; I56-L117 PolarHBondContact N-O 3.46Å; I56-L117 PolarHBondContact O-N 2.82Å; I56-I119 HydrophobicContact CD1-CD1 3.7Å; I56-Y136 HydrophobicContact CD1-CD1 3.99Å; I56-Y136 HydrophobicContact CD1-CG 3.99Å; I56-Y136 HydrophobicContact CG2-CD2 4.14Å; I56-Y136 HydrophobicContact CG2-CG 4.31Å
57	S	93.4	Very high	87.7	Confident	17 Å²	17	53.5 Å²	53.5	12%	0.119	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.2	-179.9	-60.7	0	0	0	0	111.2	I29 R30 I31 N115 Q116	I29-S57 PolarHBondContact O-N 2.73Å; R30-S57 WeakPolarHBondContact CA-O 3.4Å; I31-S57 PolarHBondContact N-O 2.86Å; S57-N115 CarbonylContact C-O 3.57Å; S57-N115 WeakPolarHBondContact CA-O 3.45Å; S57-Q116 PolarHBondContact OG-NE2 2.87Å; S57-Q116 VanDerWaalsContact OG-NE2 3.15Å
58	A	89.4	Confident	87.6	Confident	9 Å²	9	53.7 Å²	53.7	7%	0.074	28%	0.282	C	S	.	.			trans	-76.1	152.5	170.7	0	0	0	0	0	110.9	Q63 I65 N115	A58-Q63 HydrophobicContact CB-CB 3.82Å; A58-I65 HydrophobicContact CB-CD1 4.44Å; A58-I65 HydrophobicContact CB-CG1 4.06Å; A58-N115 HydrophobicContact CB-CB 4.18Å; A58-N115 PolarHBondContact N-O 2.86Å
59	P	84.8	Confident	87.7	Confident	94 Å²	94	51.8 Å²	51.8	61%	0.61	27%	0.268	S	S	*	.	S	Bend	trans	-72.2	-30.7	-177.2	23.8	-28.4	0	0	0	113.4	I31 Q63 I138	I31-P59 WeakPolarHBondContact O-CD 3.19Å; P59-Q63 VanDerWaalsContact CD-OE1 3.26Å; P59-Q63 VanDerWaalsContact CG-OE1 3.29Å; P59-I138 HydrophobicContact CG-CD1 3.94Å
60	G	76.9	Confident	87.6	Confident	16 Å²	16	50.8 Å²	50.8	17%	0.165	26%	0.255	C	S	.	.	S	Bend	trans	-97.6	148.9	175.6	0	0	0	0	0	113.4	H62 Q63 N115	G60-H62 VanDerWaalsContact C-N 3.3Å; G60-H62 PolarHBondContact O-N 2.88Å; G60-Q63 PolarHBondContact O-N 2.82Å; G60-N115 WeakPolarHBondContact O-CB 3.29Å
61	P	71.1	Confident	87.3	Confident	96 Å²	96	53.4 Å²	53.4	62%	0.623	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-19.5	-178.9	29.3	-35.3	0	0	0	114.1
62	H	70.9	Confident	87	Confident	159 Å²	159	51 Å²	51	74%	0.736	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	0.5	178.9	-55.9	-46	0	0	0	113.2	G60	G60-H62 VanDerWaalsContact C-N 3.3Å; G60-H62 PolarHBondContact O-N 2.88Å
63	Q	78.3	Confident	87	Confident	70 Å²	70	51.3 Å²	51.3	33%	0.327	27%	0.273	S	S	.	.			trans	-82.2	136.8	178.7	-71.7	179.8	-27.6	0	0	109.8	A58 P59 G60 N115 I138	A58-Q63 HydrophobicContact CB-CB 3.82Å; P59-Q63 VanDerWaalsContact CD-OE1 3.26Å; P59-Q63 VanDerWaalsContact CG-OE1 3.29Å; G60-Q63 PolarHBondContact O-N 2.82Å; Q63-N115 WeakPolarHBondContact O-CA 3.36Å; Q63-N115 WeakPolarHBondContact O-CB 3.48Å; Q63-I138 HydrophobicContact CB-CG2 4.06Å; Q63-I138 HydrophobicContact CG-CG2 4.23Å
64	R	86.9	Confident	86.8	Confident	121 Å²	121	49.5 Å²	49.5	46%	0.457	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	166.5	173.7	-68.6	175.4	178.8	173.1	6	110.4	V111 S112 S113 I138 F139	R64-V111 HydrophobicContact CB-CG1 4.49Å; R64-S112 WeakPolarHBondContact CB-O 3.42Å; R64-S112 VanDerWaalsContact CD-O 3.24Å; R64-S112 WeakPolarHBondContact CD-O 3.42Å; R64-S112 VanDerWaalsContact CG-O 3.3Å; R64-S112 WeakPolarHBondContact CG-O 3.38Å; R64-S113 PolarHBondContact NE-O 2.97Å; R64-I138 CarbonylContact O-C 3.6Å; R64-I138 WeakPolarHBondContact O-CA 3.45Å; R64-F139 HydrophobicContact CB-CB 3.93Å; R64-F139 HydrophobicContact CB-CD1 4.14Å; R64-F139 PolarHBondContact O-N 2.81Å
65	I	91	Very high	86.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130	-176.4	-54.6	175.7	0	0	0	108.3	I31 I56 A58 I67 V111 S112 N115 L117 E137	I31-I65 HydrophobicContact CD1-CB 4.4Å; I31-I65 HydrophobicContact CD1-CD1 4.12Å; I31-I65 HydrophobicContact CD1-CG1 3.93Å; I31-I65 HydrophobicContact CD1-CG2 3.74Å; I56-I65 HydrophobicContact CB-CD1 4.26Å; I56-I65 HydrophobicContact CG2-CD1 4.04Å; I56-I65 HydrophobicContact CG2-CG2 4.29Å; I56-I65 WeakPolarHBondContact O-CD1 3.19Å; A58-I65 HydrophobicContact CB-CD1 4.44Å; A58-I65 HydrophobicContact CB-CG1 4.06Å; I65-I67 HydrophobicContact CG2-CG2 4.11Å; I65-V111 CarbonylContact O-C 3.55Å; I65-V111 WeakPolarHBondContact O-CA 3.49Å; I65-S112 PolarHBondContact N-OG 2.85Å; I65-S112 PolarHBondContact O-N 2.86Å; I65-N115 WeakPolarHBondContact CD1-O 3.37Å; I65-L117 HydrophobicContact CB-CD1 3.79Å; I65-L117 HydrophobicContact CD1-CB 4.45Å; I65-L117 HydrophobicContact CG2-CD1 3.77Å; I65-E137 WeakPolarHBondContact CA-O 3.38Å
66	L	90.7	Very high	86.3	Confident	30 Å²	30	48.7 Å²	48.7	16%	0.157	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.8	169.4	174.6	65.2	0	0	0	108.8	A109 V110 V111 Y136 E137 F139	L66-A109 HydrophobicContact CD1-CB 4.19Å; L66-V110 WeakPolarHBondContact CA-O 3.27Å; L66-V111 HydrophobicContact CD1-CG2 3.7Å; L66-Y136 CarbonylContact O-C 3.45Å; L66-Y136 WeakPolarHBondContact O-CA 3.36Å; L66-E137 HydrophobicContact CB-CG 4.28Å; L66-E137 HydrophobicContact CD2-CG 4.4Å; L66-E137 PolarHBondContact N-O 2.89Å; L66-E137 PolarHBondContact O-N 2.82Å; L66-F139 HydrophobicContact CB-CB 4.02Å; L66-F139 HydrophobicContact CB-CD2 3.99Å; L66-F139 HydrophobicContact CB-CG 4.47Å; L66-F139 HydrophobicContact CD1-CD2 4.43Å; L66-F139 HydrophobicContact CD2-CD2 4.36Å; L66-F139 HydrophobicContact CG-CD2 4.5Å
67	I	93.3	Very high	85.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.8	169.3	67.5	172.3	0	0	0	111.6	I56 I65 F69 V87 A109 V110 L117 I119 I134 R135	I56-I67 HydrophobicContact CD1-CG2 4.3Å; I65-I67 HydrophobicContact CG2-CG2 4.11Å; I67-F69 HydrophobicContact CD1-CE2 4.42Å; I67-V87 HydrophobicContact CD1-CG1 3.87Å; I67-V87 HydrophobicContact CD1-CG2 4.14Å; I67-A109 WeakPolarHBondContact O-CA 3.38Å; I67-V110 HydrophobicContact CD1-CB 4.07Å; I67-V110 HydrophobicContact CD1-CG1 4.33Å; I67-V110 HydrophobicContact CG1-CB 3.64Å; I67-V110 HydrophobicContact CG1-CG1 4.18Å; I67-V110 PolarHBondContact N-O 2.99Å; I67-V110 PolarHBondContact O-N 2.73Å; I67-L117 HydrophobicContact CD1-CD1 4.49Å; I67-L117 HydrophobicContact CG2-CD1 3.96Å; I67-I119 HydrophobicContact CD1-CD1 4.06Å; I67-I134 HydrophobicContact CB-CG2 3.66Å; I67-I134 HydrophobicContact CD1-CG2 4.42Å; I67-I134 HydrophobicContact CG1-CG2 4.49Å; I67-I134 HydrophobicContact CG2-CG2 4.1Å; I67-R135 CarbonylContact C-O 3.56Å; I67-R135 WeakPolarHBondContact CA-O 3.43Å
68	N	86.6	Confident	85.1	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.273	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.5	-179.5	-71.6	-51.4	0	0	0	110.2	A109 I134 R135	N68-A109 WeakPolarHBondContact OD1-CB 3.49Å; N68-I134 CarbonylContact O-C 3.41Å; N68-I134 WeakPolarHBondContact O-CA 3.23Å; N68-R135 PolarHBondContact N-O 3.06Å; N68-R135 PolarHBondContact O-N 2.86Å
69	F	88.8	Confident	84.6	Confident	18 Å²	18	68.2 Å²	68.2	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	140	175.2	-71.1	-96.5	0	0	0	111	I67 F73 V85 V87 Y101 A106 P107 F132 I134	I67-F69 HydrophobicContact CD1-CE2 4.42Å; F69-F73 HydrophobicContact CD1-CD2 4.15Å; F69-F73 HydrophobicContact CD1-CE2 4.13Å; F69-F73 HydrophobicContact CE1-CE2 4.27Å; F69-V85 HydrophobicContact CE1-CG1 4.03Å; F69-V87 HydrophobicContact CZ-CG2 4.03Å; F69-Y101 HydrophobicContact CZ-CD2 4.33Å; F69-A106 HydrophobicContact CB-CB 4.08Å; F69-P107 HydrophobicContact CD1-CG 4.22Å; F69-P107 HydrophobicContact CD2-CB 3.73Å; F69-P107 HydrophobicContact CD2-CG 3.97Å; F69-P107 HydrophobicContact CE1-CG 4.21Å; F69-P107 HydrophobicContact CE2-CB 3.83Å; F69-P107 HydrophobicContact CE2-CG 3.97Å; F69-P107 HydrophobicContact CG-CB 4.28Å; F69-P107 HydrophobicContact CG-CG 4.11Å; F69-P107 HydrophobicContact CZ-CB 4.43Å; F69-P107 HydrophobicContact CZ-CG 4.09Å; F69-F132 HydrophobicContact CE1-CD2 4.42Å; F69-I134 HydrophobicContact CD1-CD1 4.05Å; F69-I134 HydrophobicContact CD1-CG1 3.54Å; F69-I134 HydrophobicContact CE1-CD1 3.38Å; F69-I134 HydrophobicContact CE1-CG1 3.44Å; F69-I134 VanDerWaalsContact CE1-CG1 3.44Å; F69-I134 HydrophobicContact CE2-CD1 4.44Å; F69-I134 HydrophobicContact CE2-CG1 4.49Å; F69-I134 HydrophobicContact CG-CG1 4.13Å; F69-I134 HydrophobicContact CZ-CD1 3.61Å; F69-I134 HydrophobicContact CZ-CG1 3.95Å
70	N	85.3	Confident	84.8	Confident	64 Å²	64	64.9 Å²	64.9	34%	0.342	33%	0.326	S	S	.	.			trans	-67.6	134	169.4	-168.6	-49.8	0	0	0	109.2	H72 A106 S133	N70-H72 CarbonylContact O-C 3.36Å; N70-H72 PolarHBondContact O-N 2.83Å; N70-H72 VanDerWaalsContact O-N 3.07Å; N70-H72 PolarHBondContact OD1-N 2.86Å; N70-A106 WeakPolarHBondContact O-CB 3.27Å; N70-S133 WeakPolarHBondContact CB-O 3.24Å; N70-S133 PolarHBondContact N-O 2.94Å
71	P	80.9	Confident	85.3	Confident	111 Å²	111	71.1 Å²	71.1	72%	0.721	35%	0.349	S	S	*	.	S	Bend	trans	-55.3	-23.9	175.5	-27.8	35.5	0	0	0	114.6	F73	P71-F73 VanDerWaalsContact C-N 3.31Å; P71-F73 PolarHBondContact O-N 2.77Å
72	H	86.8	Confident	86	Confident	94 Å²	94	70.6 Å²	70.6	44%	0.435	34%	0.335	S	S	.	.			trans	-77.4	84.4	168.7	-171.8	43.1	0	0	0	110	Y42 N70	Y42-H72 WeakPolarHBondContact CE2-O 3.48Å; Y42-H72 AromaticContact CZ-CD2 3.89Å; Y42-H72 WeakPolarHBondContact OH-CB 3.47Å; Y42-H72 PolarHBondContact OH-CD2 2.91Å; Y42-H72 PolarHBondContact OH-O 3Å; Y42-H72 VanDerWaalsContact OH-O 3.07Å; N70-H72 CarbonylContact O-C 3.36Å; N70-H72 PolarHBondContact O-N 2.83Å; N70-H72 VanDerWaalsContact O-N 3.07Å; N70-H72 PolarHBondContact OD1-N 2.86Å
73	F	91.7	Very high	87	Confident	6 Å²	6	63 Å²	63	3%	0.026	30%	0.3	C	S	.	.			trans	-125.5	126.4	-178.5	-178.5	-87.6	0	0	0	109.1	F69 P71 L75 V85 G103 K104 I105 A106 F132	F69-F73 HydrophobicContact CD1-CD2 4.15Å; F69-F73 HydrophobicContact CD1-CE2 4.13Å; F69-F73 HydrophobicContact CE1-CE2 4.27Å; P71-F73 VanDerWaalsContact C-N 3.31Å; P71-F73 PolarHBondContact O-N 2.77Å; F73-L75 HydrophobicContact CE1-CB 4.47Å; F73-L75 HydrophobicContact CE1-CD1 4.33Å; F73-L75 HydrophobicContact CE1-CG 4.24Å; F73-L75 HydrophobicContact CE2-CD1 4.15Å; F73-L75 HydrophobicContact CE2-CG 4.45Å; F73-L75 HydrophobicContact CZ-CD1 3.63Å; F73-L75 HydrophobicContact CZ-CG 3.96Å; F73-V85 HydrophobicContact CE2-CG1 3.86Å; F73-V85 HydrophobicContact CZ-CG1 4Å; F73-G103 WeakPolarHBondContact CD1-O 3.15Å; F73-G103 VanDerWaalsContact CE1-O 3.26Å; F73-G103 WeakPolarHBondContact CE1-O 3.47Å; F73-K104 CarbonylContact O-C 3.6Å; F73-K104 WeakPolarHBondContact O-CA 3.37Å; F73-I105 WeakPolarHBondContact CD1-O 3.22Å; F73-A106 HydrophobicContact CB-CB 3.8Å; F73-A106 HydrophobicContact CG-CB 4.37Å; F73-F132 HydrophobicContact CD2-CB 3.49Å; F73-F132 VanDerWaalsContact CD2-CB 3.49Å; F73-F132 HydrophobicContact CE2-CB 3.62Å; F73-F132 HydrophobicContact CE2-CG 4.38Å
74	D	90.3	Very high	87.8	Confident	41 Å²	41	61.3 Å²	61.3	22%	0.219	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-153.6	97.7	-175.7	-174.8	41.3	0	0	0	110.9	G103 G129 A130 G131	D74-G103 WeakPolarHBondContact CA-O 3.14Å; D74-G129 CarbonylContact O-C 3.55Å; D74-G129 WeakPolarHBondContact O-CA 3.18Å; D74-G129 WeakPolarHBondContact OD2-CA 3.48Å; D74-A130 HydrophobicContact CB-CB 3.99Å; D74-A130 PolarHBondContact O-N 3.31Å; D74-A130 PolarHBondContact OD2-N 2.74Å; D74-G131 PolarHBondContact N-O 2.61Å; D74-G131 WeakPolarHBondContact O-CA 3.01Å; D74-G131 PolarHBondContact O-N 2.85Å
75	L	90.5	Very high	88.3	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	27%	0.269	C	S	.	.			trans	-122.1	161.8	173.2	-61.8	-175.9	0	0	0	109.7	Y46 F73 D77 V85 C102 G103 F121 F132	Y46-L75 HydrophobicContact CD1-CD2 3.87Å; Y46-L75 HydrophobicContact CE1-CD2 3.38Å; F73-L75 HydrophobicContact CE1-CB 4.47Å; F73-L75 HydrophobicContact CE1-CD1 4.33Å; F73-L75 HydrophobicContact CE1-CG 4.24Å; F73-L75 HydrophobicContact CE2-CD1 4.15Å; F73-L75 HydrophobicContact CE2-CG 4.45Å; F73-L75 HydrophobicContact CZ-CD1 3.63Å; F73-L75 HydrophobicContact CZ-CG 3.96Å; L75-D77 PolarHBondContact O-N 2.64Å; L75-V85 HydrophobicContact CD1-CB 4.3Å; L75-V85 HydrophobicContact CD1-CG1 4.07Å; L75-C102 HydrophobicContact CB-CB 4.27Å; L75-G103 PolarHBondContact N-O 2.87Å; L75-G103 CarbonylContact O-C 3.53Å; L75-G103 WeakPolarHBondContact O-CA 3.12Å; L75-G103 PolarHBondContact O-N 2.91Å; L75-G103 VanDerWaalsContact O-N 3.15Å; L75-F121 HydrophobicContact CD1-CE2 4.25Å; L75-F121 HydrophobicContact CD2-CE2 3.71Å; L75-F121 HydrophobicContact CD2-CZ 4.26Å; L75-F132 HydrophobicContact CD1-CD1 4.45Å
76	E	89.8	Confident	88.5	Confident	22 Å²	22	56.1 Å²	56.1	10%	0.103	27%	0.271	C	S	.	.			trans	-57.2	127.6	-179.9	-162.6	-165.1	-178.1	0	0	112.6	Y46 R78 Y82 D83 C102 T127	Y46-E76 PolarHBondContact OH-N 3.21Å; E76-R78 HydrophobicContact CG-CG 4.32Å; E76-R78 PolarHBondContact O-N 3.22Å; E76-R78 WeakPolarHBondContact OE1-CD 3.21Å; E76-R78 IonicContact OE1-CZ 2.93Å; E76-R78 IonicContact OE1-NE 3.19Å; E76-R78 PolarHBondContact OE1-NE 2.82Å; E76-R78 IonicContact OE1-NH2 3.97Å; E76-Y82 WeakPolarHBondContact OE2-CB 3.45Å; E76-D83 HydrophobicContact CB-CB 3.84Å; E76-C102 WeakPolarHBondContact O-CB 3.38Å; E76-T127 WeakPolarHBondContact CG-OG1 3.28Å; E76-T127 PolarHBondContact OE1-OG1 2.68Å
77	D	81.3	Confident	88.7	Confident	121 Å²	121	54.7 Å²	54.7	65%	0.647	26%	0.264	S	S	*	.			trans	-96	76.5	-176.5	-164.3	2.9	0	0	0	111.6	L75	L75-D77 PolarHBondContact O-N 2.64Å
78	R	82.6	Confident	88.8	Confident	130 Å²	130	57 Å²	57	49%	0.491	27%	0.273	S	S	.	.	S	Bend	trans	-136.8	63.5	174.9	-67.6	-165.6	-165.1	-159.7	2.6	111.4	E76 C80 K81 Y82	E76-R78 HydrophobicContact CG-CG 4.32Å; E76-R78 PolarHBondContact O-N 3.22Å; E76-R78 WeakPolarHBondContact OE1-CD 3.21Å; E76-R78 IonicContact OE1-CZ 2.93Å; E76-R78 IonicContact OE1-NE 3.19Å; E76-R78 PolarHBondContact OE1-NE 2.82Å; E76-R78 IonicContact OE1-NH2 3.97Å; R78-C80 PolarHBondContact O-N 2.83Å; R78-K81 WeakPolarHBondContact O-CB 3.5Å; R78-K81 PolarHBondContact O-N 2.61Å; R78-K81 VanDerWaalsContact O-N 3.12Å; R78-Y82 HydrophobicContact CB-CD2 3.77Å; R78-Y82 HydrophobicContact CB-CE2 3.93Å; R78-Y82 HydrophobicContact CG-CD2 4.41Å; R78-Y82 HydrophobicContact CG-CE2 4.46Å
79	E	78.6	Confident	88.9	Confident	186 Å²	186	55.7 Å²	55.7	87%	0.869	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	27.5	-178.8	-58.1	177.6	178.2	0	0	113.1	K81	E79-K81 PolarHBondContact O-N 3.14Å; E79-K81 VanDerWaalsContact O-N 3.09Å
80	C	87.9	Confident	88.9	Confident	23 Å²	23	55.8 Å²	55.8	16%	0.155	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	31.3	-178.6	-47.7	0	0	0	0	113.3	R78 Y84 K100 C102	R78-C80 PolarHBondContact O-N 2.83Å; C80-Y84 WeakPolarHBondContact O-CD1 3.18Å; C80-K100 HydrophobicContact CB-CD 4.41Å; C80-K100 HydrophobicContact CB-CG 4.39Å; C80-K100 WeakPolarHBondContact O-CE 2.93Å; C80-K100 PolarHBondContact O-NZ 2.99Å; C80-C102 WeakPolarHBondContact CA-SG 3.42Å; C80-C102 HydrophobicContact CB-CB 3.67Å; C80-C102 WeakPolarHBondContact CB-SG 3.33Å; C80-C102 PolarHBondContact N-SG 3.27Å; C80-C102 WeakPolarHBondContact SG-CB 3.34Å; C80-C102 PolarHBondContact SG-N 2.94Å; C80-C102 CovalentContact SG-SG 2.04Å; C80-C102 PolarHBondContact SG-SG 2.83Å
81	K	87.5	Confident	89.1	Confident	148 Å²	148	55.9 Å²	55.9	64%	0.643	28%	0.275	S	S	*	.	S	Bend	trans	-79.9	-36.8	-177.9	-171.9	175	-178.9	177.5	0	112.6	R78 E79	R78-K81 WeakPolarHBondContact O-CB 3.5Å; R78-K81 PolarHBondContact O-N 2.61Å; R78-K81 VanDerWaalsContact O-N 3.12Å; E79-K81 PolarHBondContact O-N 3.14Å; E79-K81 VanDerWaalsContact O-N 3.09Å
82	Y	86.6	Confident	89.5	Confident	84 Å²	84	53.7 Å²	53.7	33%	0.329	26%	0.257	S	S	.	.	S	Bend	trans	-100.8	-73.4	-173.5	-56.3	-79.6	0	0	0	109.9	E76 R78 Y84 D124	E76-Y82 WeakPolarHBondContact OE2-CB 3.45Å; R78-Y82 HydrophobicContact CB-CD2 3.77Å; R78-Y82 HydrophobicContact CB-CE2 3.93Å; R78-Y82 HydrophobicContact CG-CD2 4.41Å; R78-Y82 HydrophobicContact CG-CE2 4.46Å; Y82-Y84 WeakPolarHBondContact O-CD1 3.44Å; Y82-D124 VanDerWaalsContact CD1-OD2 3.28Å; Y82-D124 WeakPolarHBondContact CD1-OD2 3.46Å
83	D	92.4	Very high	89.6	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.251	C	S	.	.	S	Bend	trans	-98.9	131	178.2	-61.5	-11.3	0	0	0	111.9	Y46 E76 C102 V122 S123 D124	Y46-D83 WeakPolarHBondContact CE2-OD2 3.15Å; Y46-D83 PolarHBondContact OH-OD2 2.91Å; E76-D83 HydrophobicContact CB-CB 3.84Å; D83-C102 VanDerWaalsContact O-CB 3.28Å; D83-C102 WeakPolarHBondContact O-CB 3.29Å; D83-V122 WeakPolarHBondContact CA-O 3.48Å; D83-S123 WeakPolarHBondContact OD1-CA 3.24Å; D83-D124 PolarHBondContact OD1-N 3.4Å
84	Y	94.8	Very high	89.5	Confident	33 Å²	33	58.8 Å²	58.8	13%	0.129	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	153.9	179.7	57.3	-92.2	0	0	0	113.2	C80 Y82 E86 K100 Y101 F121 V122	C80-Y84 WeakPolarHBondContact O-CD1 3.18Å; Y82-Y84 WeakPolarHBondContact O-CD1 3.44Å; Y84-E86 HydrophobicContact CD2-CB 4.09Å; Y84-E86 HydrophobicContact CE2-CB 4.24Å; Y84-E86 WeakPolarHBondContact CE2-OE2 3.42Å; Y84-K100 HydrophobicContact CD2-CD 4.12Å; Y84-K100 HydrophobicContact CD2-CG 3.84Å; Y84-K100 VanDerWaalsContact CE1-CE 3.43Å; Y84-K100 VanDerWaalsContact CE1-NZ 3.34Å; Y84-K100 HydrophobicContact CE2-CD 4.46Å; Y84-K100 HydrophobicContact CG-CD 4.19Å; Y84-K100 HydrophobicContact CG-CG 4.03Å; Y84-K100 VanDerWaalsContact CZ-CE 3.49Å; Y84-Y101 VanDerWaalsContact CA-O 3.32Å; Y84-Y101 WeakPolarHBondContact CA-O 3.25Å; Y84-F121 WeakPolarHBondContact O-CA 3.46Å; Y84-F121 VanDerWaalsContact O-CD2 3.28Å; Y84-F121 WeakPolarHBondContact O-CD2 3.34Å; Y84-V122 HydrophobicContact CD1-CB 4.23Å; Y84-V122 HydrophobicContact CD2-CB 4.35Å; Y84-V122 HydrophobicContact CD2-CG2 4.46Å; Y84-V122 HydrophobicContact CE1-CB 3.79Å; Y84-V122 HydrophobicContact CE1-CG1 3.99Å; Y84-V122 HydrophobicContact CE1-CG2 4.27Å; Y84-V122 HydrophobicContact CE2-CB 3.93Å; Y84-V122 HydrophobicContact CE2-CG2 3.7Å; Y84-V122 HydrophobicContact CG-CB 4.5Å; Y84-V122 PolarHBondContact N-O 2.89Å; Y84-V122 PolarHBondContact O-N 2.92Å
85	V	95.9	Very high	89.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.6	161.2	63.6	0	0	0	0	109.5	F69 F73 L75 Y101 I119 K120 F121 F132	F69-V85 HydrophobicContact CE1-CG1 4.03Å; F73-V85 HydrophobicContact CE2-CG1 3.86Å; F73-V85 HydrophobicContact CZ-CG1 4Å; L75-V85 HydrophobicContact CD1-CB 4.3Å; L75-V85 HydrophobicContact CD1-CG1 4.07Å; V85-Y101 HydrophobicContact CG1-CD2 4.44Å; V85-Y101 PolarHBondContact N-O 3.45Å; V85-Y101 PolarHBondContact O-N 3.03Å; V85-I119 HydrophobicContact CG2-CG2 3.85Å; V85-K120 CarbonylContact C-O 3.41Å; V85-K120 WeakPolarHBondContact CA-O 3.1Å; V85-F121 HydrophobicContact CB-CD2 4.46Å; V85-F132 HydrophobicContact CB-CD1 4.15Å; V85-F132 HydrophobicContact CB-CE1 3.9Å; V85-F132 HydrophobicContact CB-CZ 4.22Å; V85-F132 HydrophobicContact CG1-CD1 4.43Å; V85-F132 HydrophobicContact CG2-CD1 4.42Å; V85-F132 HydrophobicContact CG2-CE1 3.87Å; V85-F132 HydrophobicContact CG2-CE2 4.04Å; V85-F132 HydrophobicContact CG2-CZ 3.65Å
86	E	95.3	Very high	89.1	Confident	12 Å²	12	64 Å²	64	6%	0.056	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129	-174	-175.1	-178.8	166	0	0	108.3	Y84 R88 L97 G99 I119 K120	Y84-E86 HydrophobicContact CD2-CB 4.09Å; Y84-E86 HydrophobicContact CE2-CB 4.24Å; Y84-E86 WeakPolarHBondContact CE2-OE2 3.42Å; E86-R88 HydrophobicContact CG-CG 4.44Å; E86-R88 IonicContact OE1-CZ 3.81Å; E86-R88 IonicContact OE1-NE 2.92Å; E86-R88 PolarHBondContact OE1-NE 3.06Å; E86-R88 IonicContact OE1-NH2 2.68Å; E86-R88 PolarHBondContact OE1-NH2 3.34Å; E86-L97 HydrophobicContact CG-CD1 3.49Å; E86-L97 VanDerWaalsContact CG-CD1 3.49Å; E86-G99 WeakPolarHBondContact CA-O 3.29Å; E86-I119 CarbonylContact O-C 3.52Å; E86-I119 WeakPolarHBondContact O-CA 3.46Å; E86-K120 HydrophobicContact CB-CB 4.26Å; E86-K120 PolarHBondContact N-O 3.23Å; E86-K120 PolarHBondContact O-N 3.33Å
87	V	95.8	Very high	89.1	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.5	177.9	-177.1	0	0	0	0	108.4	I67 F69 V98 G99 Y101 V110 L117 I119	I67-V87 HydrophobicContact CD1-CG1 3.87Å; I67-V87 HydrophobicContact CD1-CG2 4.14Å; F69-V87 HydrophobicContact CZ-CG2 4.03Å; V87-V98 HydrophobicContact CB-CB 4.38Å; V87-V98 HydrophobicContact CG1-CB 4.24Å; V87-V98 HydrophobicContact CG1-CG2 4.4Å; V87-V98 WeakPolarHBondContact O-CB 3.45Å; V87-V98 PolarHBondContact O-N 2.91Å; V87-G99 PolarHBondContact N-O 3.46Å; V87-G99 PolarHBondContact O-N 2.76Å; V87-Y101 HydrophobicContact CB-CE2 4.3Å; V87-Y101 HydrophobicContact CG2-CD2 4.37Å; V87-Y101 HydrophobicContact CG2-CE2 3.97Å; V87-V110 HydrophobicContact CG1-CG1 4.19Å; V87-L117 HydrophobicContact CG1-CD2 4.02Å; V87-I119 HydrophobicContact CG2-CG1 4.48Å
88	R	94.6	Very high	89.5	Confident	50 Å²	50	64 Å²	64	19%	0.189	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.5	177.3	-62.6	-175	169.7	-94.3	-5.6	111	E86 E93 G95 Q96 L97 L117 F118	E86-R88 HydrophobicContact CG-CG 4.44Å; E86-R88 IonicContact OE1-CZ 3.81Å; E86-R88 IonicContact OE1-NE 2.92Å; E86-R88 PolarHBondContact OE1-NE 3.06Å; E86-R88 IonicContact OE1-NH2 2.68Å; E86-R88 PolarHBondContact OE1-NH2 3.34Å; R88-E93 WeakPolarHBondContact CD-O 3.48Å; R88-E93 PolarHBondContact NE-O 3.19Å; R88-E93 PolarHBondContact NH1-O 3.06Å; R88-G95 WeakPolarHBondContact CD-O 3.32Å; R88-G95 PolarHBondContact NH1-O 2.93Å; R88-Q96 CarbonylContact C-O 3.56Å; R88-Q96 WeakPolarHBondContact CA-O 3.29Å; R88-L97 HydrophobicContact CG-CD1 4.07Å; R88-L117 WeakPolarHBondContact O-CD2 3.37Å; R88-F118 HydrophobicContact CB-CB 4.22Å; R88-F118 HydrophobicContact CB-CD1 4.14Å; R88-F118 HydrophobicContact CG-CD1 4.3Å; R88-F118 PolarHBondContact N-O 3.44Å; R88-F118 PolarHBondContact O-N 3.19Å
89	D	90.3	Very high	89.7	Confident	22 Å²	22	58.4 Å²	58.4	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	110	174.9	-154.5	-14	0	0	0	109.5	G95 Q96 V98 S113	D89-G95 CarbonylContact O-C 3.56Å; D89-G95 WeakPolarHBondContact O-CA 3.48Å; D89-Q96 HydrophobicContact CB-CB 4.35Å; D89-Q96 PolarHBondContact N-O 3.21Å; D89-Q96 PolarHBondContact O-N 3.08Å; D89-V98 HydrophobicContact CB-CG2 3.95Å; D89-S113 PolarHBondContact OD1-N 3.03Å; D89-S113 PolarHBondContact OD1-OG 2.99Å; D89-S113 WeakPolarHBondContact OD2-CA 3.12Å; D89-S113 WeakPolarHBondContact OD2-CB 3.29Å; D89-S113 PolarHBondContact OD2-N 3.26Å; D89-S113 PolarHBondContact OD2-OG 3.08Å
90	G	88.7	Confident	90.4	Very high	21 Å²	21	53.5 Å²	53.5	22%	0.216	27%	0.272	C	S	.	.	S	Bend	trans	137.6	-165.2	-170.1	0	0	0	0	0	114	Q116 L117 F118	G90-Q116 PolarHBondContact N-O 2.81Å; G90-Q116 CarbonylContact O-C 3.59Å; G90-L117 CarbonylContact O-C 3.51Å; G90-L117 VanDerWaalsContact O-C 3.29Å; G90-L117 WeakPolarHBondContact O-CA 3.49Å; G90-L117 PolarHBondContact O-N 2.82Å; G90-F118 PolarHBondContact O-N 3.07Å; G90-F118 VanDerWaalsContact O-N 3.17Å
91	V	88.8	Confident	90.7	Very high	66 Å²	66	54.9 Å²	54.9	40%	0.4	27%	0.274	S	S	.	.	S	Bend	trans	-102.5	-17.3	-173.5	-70.1	0	0	0	0	114.8	V55 Q116	V55-V91 VanDerWaalsContact CG2-O 3.22Å; V55-V91 WeakPolarHBondContact CG2-O 3.37Å; V91-Q116 HydrophobicContact CG1-CB 3.96Å; V91-Q116 HydrophobicContact CG1-CG 4.19Å
92	D	89.7	Confident	90.9	Very high	64 Å²	64	48.8 Å²	48.8	34%	0.342	25%	0.25	S	C	.	.	S	Bend	trans	-148.3	-173.6	-171.2	66.6	8.2	0	0	0	111.8	N94 G95	D92-N94 PolarHBondContact O-N 3.37Å; D92-N94 WeakPolarHBondContact OD1-CA 3.36Å; D92-N94 VanDerWaalsContact OD1-CB 3.25Å; D92-N94 WeakPolarHBondContact OD1-CB 3.2Å; D92-N94 PolarHBondContact OD1-N 2.85Å; D92-N94 PolarHBondContact OD2-ND2 2.79Å; D92-G95 PolarHBondContact O-N 3.42Å; D92-G95 VanDerWaalsContact O-N 3.13Å; D92-G95 PolarHBondContact OD1-N 2.98Å
93	E	87.9	Confident	91.1	Very high	66 Å²	66	44.9 Å²	44.9	31%	0.308	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.1	178.7	-63	-170.5	152.5	0	0	113.5	R51 R88 G95 F118 K120	R51-E93 IonicContact CZ-OE1 3.74Å; R51-E93 IonicContact NH2-OE1 3.94Å; R51-E93 PolarHBondContact NH2-OE1 3.42Å; R51-E93 IonicContact NH2-OE2 2.73Å; R51-E93 PolarHBondContact NH2-OE2 3.02Å; R88-E93 WeakPolarHBondContact CD-O 3.48Å; R88-E93 PolarHBondContact NE-O 3.19Å; R88-E93 PolarHBondContact NH1-O 3.06Å; E93-G95 VanDerWaalsContact C-N 3.34Å; E93-F118 HydrophobicContact CG-CE1 3.72Å; E93-F118 HydrophobicContact CG-CZ 3.61Å; E93-K120 VanDerWaalsContact OE1-CD 3.25Å; E93-K120 WeakPolarHBondContact OE1-CD 3.06Å; E93-K120 VanDerWaalsContact OE1-CE 3.25Å; E93-K120 WeakPolarHBondContact OE1-CE 3.41Å; E93-K120 IonicContact OE1-NZ 2.85Å; E93-K120 PolarHBondContact OE1-NZ 2.78Å
94	N	89.4	Confident	90.7	Very high	142 Å²	142	52.3 Å²	52.3	76%	0.759	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10.7	175.7	-53.5	-46.7	0	0	0	112.4	D92	D92-N94 PolarHBondContact O-N 3.37Å; D92-N94 WeakPolarHBondContact OD1-CA 3.36Å; D92-N94 VanDerWaalsContact OD1-CB 3.25Å; D92-N94 WeakPolarHBondContact OD1-CB 3.2Å; D92-N94 PolarHBondContact OD1-N 2.85Å; D92-N94 PolarHBondContact OD2-ND2 2.79Å
95	G	83.6	Confident	90	Very high	10 Å²	10	57.7 Å²	57.7	10%	0.103	30%	0.297	C	S	.	.	S	Bend	trans	-60	155.1	174.7	0	0	0	0	0	112.8	R88 D89 D92 E93 L97	R88-G95 WeakPolarHBondContact CD-O 3.32Å; R88-G95 PolarHBondContact NH1-O 2.93Å; D89-G95 CarbonylContact O-C 3.56Å; D89-G95 WeakPolarHBondContact O-CA 3.48Å; D92-G95 PolarHBondContact O-N 3.42Å; D92-G95 VanDerWaalsContact O-N 3.13Å; D92-G95 PolarHBondContact OD1-N 2.98Å; E93-G95 VanDerWaalsContact C-N 3.34Å; G95-L97 PolarHBondContact O-N 2.95Å
96	Q	90.3	Very high	89.2	Confident	144 Å²	144	59 Å²	59	67%	0.673	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	126.3	-179.7	-177.9	178.8	9.3	0	0	109.7	R88 D89 V98	R88-Q96 CarbonylContact C-O 3.56Å; R88-Q96 WeakPolarHBondContact CA-O 3.29Å; D89-Q96 HydrophobicContact CB-CB 4.35Å; D89-Q96 PolarHBondContact N-O 3.21Å; D89-Q96 PolarHBondContact O-N 3.08Å; Q96-V98 PolarHBondContact O-N 3.16Å; Q96-V98 VanDerWaalsContact O-N 3.13Å
97	L	89.6	Confident	88.8	Confident	83 Å²	83	59.3 Å²	59.3	44%	0.435	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	112.5	177.4	-178.4	64.6	0	0	0	109.9	E86 R88 G95	E86-L97 HydrophobicContact CG-CD1 3.49Å; E86-L97 VanDerWaalsContact CG-CD1 3.49Å; R88-L97 HydrophobicContact CG-CD1 4.07Å; G95-L97 PolarHBondContact O-N 2.95Å
98	V	88.9	Confident	87.6	Confident	59 Å²	59	64.2 Å²	64.2	36%	0.358	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-42.5	173.7	-178	0	0	0	0	109.6	V87 D89 Q96 V110	V87-V98 HydrophobicContact CB-CB 4.38Å; V87-V98 HydrophobicContact CG1-CB 4.24Å; V87-V98 HydrophobicContact CG1-CG2 4.4Å; V87-V98 WeakPolarHBondContact O-CB 3.45Å; V87-V98 PolarHBondContact O-N 2.91Å; D89-V98 HydrophobicContact CB-CG2 3.95Å; Q96-V98 PolarHBondContact O-N 3.16Å; Q96-V98 VanDerWaalsContact O-N 3.13Å; V98-V110 HydrophobicContact CG1-CB 4.48Å; V98-V110 HydrophobicContact CG1-CG1 3.73Å; V98-V110 HydrophobicContact CG1-CG2 3.89Å
99	G	87.2	Confident	86.8	Confident	12 Å²	12	64.6 Å²	64.6	12%	0.124	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.4	160.2	174.1	0	0	0	0	0	113.6	E86 V87	E86-G99 WeakPolarHBondContact CA-O 3.29Å; V87-G99 PolarHBondContact N-O 3.46Å; V87-G99 PolarHBondContact O-N 2.76Å
100	K	93.5	Very high	86.7	Confident	83 Å²	83	64 Å²	64	36%	0.361	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.2	175.7	-170.3	-173.9	-170.7	-165.6	0	107.8	C80 Y84	C80-K100 HydrophobicContact CB-CD 4.41Å; C80-K100 HydrophobicContact CB-CG 4.39Å; C80-K100 WeakPolarHBondContact O-CE 2.93Å; C80-K100 PolarHBondContact O-NZ 2.99Å; Y84-K100 HydrophobicContact CD2-CD 4.12Å; Y84-K100 HydrophobicContact CD2-CG 3.84Å; Y84-K100 VanDerWaalsContact CE1-CE 3.43Å; Y84-K100 VanDerWaalsContact CE1-NZ 3.34Å; Y84-K100 HydrophobicContact CE2-CD 4.46Å; Y84-K100 HydrophobicContact CG-CD 4.19Å; Y84-K100 HydrophobicContact CG-CG 4.03Å; Y84-K100 VanDerWaalsContact CZ-CE 3.49Å
101	Y	93	Very high	86.6	Confident	53 Å²	53	65.8 Å²	65.8	21%	0.208	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.9	-165.3	-48.8	-73.8	0	0	0	111.7	F69 Y84 V85 V87 P107	F69-Y101 HydrophobicContact CZ-CD2 4.33Å; Y84-Y101 VanDerWaalsContact CA-O 3.32Å; Y84-Y101 WeakPolarHBondContact CA-O 3.25Å; V85-Y101 HydrophobicContact CG1-CD2 4.44Å; V85-Y101 PolarHBondContact N-O 3.45Å; V85-Y101 PolarHBondContact O-N 3.03Å; V87-Y101 HydrophobicContact CB-CE2 4.3Å; V87-Y101 HydrophobicContact CG2-CD2 4.37Å; V87-Y101 HydrophobicContact CG2-CE2 3.97Å; Y101-P107 HydrophobicContact CD1-CB 3.7Å; Y101-P107 HydrophobicContact CD1-CG 3.47Å; Y101-P107 VanDerWaalsContact CD1-CG 3.47Å; Y101-P107 HydrophobicContact CD2-CB 4.18Å; Y101-P107 HydrophobicContact CD2-CG 3.72Å; Y101-P107 HydrophobicContact CE1-CB 3.74Å; Y101-P107 HydrophobicContact CE1-CG 4.03Å; Y101-P107 HydrophobicContact CE2-CB 4.2Å; Y101-P107 HydrophobicContact CE2-CG 4.25Å; Y101-P107 HydrophobicContact CG-CB 3.92Å; Y101-P107 HydrophobicContact CG-CG 3.27Å
102	C	93.1	Very high	86.6	Confident	19 Å²	19	62.7 Å²	62.7	13%	0.128	34%	0.344	C	S	.	.			trans	-157	-177.4	176.8	68.9	0	0	0	0	109.7	L75 E76 C80 D83	L75-C102 HydrophobicContact CB-CB 4.27Å; E76-C102 WeakPolarHBondContact O-CB 3.38Å; C80-C102 WeakPolarHBondContact CA-SG 3.42Å; C80-C102 HydrophobicContact CB-CB 3.67Å; C80-C102 WeakPolarHBondContact CB-SG 3.33Å; C80-C102 PolarHBondContact N-SG 3.27Å; C80-C102 WeakPolarHBondContact SG-CB 3.34Å; C80-C102 PolarHBondContact SG-N 2.94Å; C80-C102 CovalentContact SG-SG 2.04Å; C80-C102 PolarHBondContact SG-SG 2.83Å; D83-C102 VanDerWaalsContact O-CB 3.28Å; D83-C102 WeakPolarHBondContact O-CB 3.29Å
103	G	90.2	Very high	86.4	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.021	35%	0.353	C	S	.	.	S	Bend	trans	81.3	-155	-177.9	0	0	0	0	0	113.4	F73 D74 L75	F73-G103 WeakPolarHBondContact CD1-O 3.15Å; F73-G103 VanDerWaalsContact CE1-O 3.26Å; F73-G103 WeakPolarHBondContact CE1-O 3.47Å; D74-G103 WeakPolarHBondContact CA-O 3.14Å; L75-G103 PolarHBondContact N-O 2.87Å; L75-G103 CarbonylContact O-C 3.53Å; L75-G103 WeakPolarHBondContact O-CA 3.12Å; L75-G103 PolarHBondContact O-N 2.91Å; L75-G103 VanDerWaalsContact O-N 3.15Å
104	K	85.1	Confident	86.3	Confident	157 Å²	157	61.5 Å²	61.5	68%	0.683	35%	0.353	S	S	*	.	S	Bend	trans	-107.7	0.3	-169.7	-58.8	-170	177.3	-172.5	0	115.2	F73	F73-K104 CarbonylContact O-C 3.6Å; F73-K104 WeakPolarHBondContact O-CA 3.37Å
105	I	78.8	Confident	86.4	Confident	146 Å²	146	57 Å²	57	75%	0.749	33%	0.328	S	S	*	.	S	Bend	trans	-106.3	117.8	-176.9	-58.7	176.1	0	0	0	107.5	F73	F73-I105 WeakPolarHBondContact CD1-O 3.22Å
106	A	80.3	Confident	86.8	Confident	27 Å²	27	59.5 Å²	59.5	22%	0.223	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-62.4	134.9	175.5	0	0	0	0	0	110.5	F69 N70 F73	F69-A106 HydrophobicContact CB-CB 4.08Å; N70-A106 WeakPolarHBondContact O-CB 3.27Å; F73-A106 HydrophobicContact CB-CB 3.8Å; F73-A106 HydrophobicContact CG-CB 4.37Å
107	P	85.4	Confident	87	Confident	19 Å²	19	52.6 Å²	52.6	12%	0.123	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-62.4	157	175.8	-24	34.1	0	0	0	113.4	F69 Y101	F69-P107 HydrophobicContact CD1-CG 4.22Å; F69-P107 HydrophobicContact CD2-CB 3.73Å; F69-P107 HydrophobicContact CD2-CG 3.97Å; F69-P107 HydrophobicContact CE1-CG 4.21Å; F69-P107 HydrophobicContact CE2-CB 3.83Å; F69-P107 HydrophobicContact CE2-CG 3.97Å; F69-P107 HydrophobicContact CG-CB 4.28Å; F69-P107 HydrophobicContact CG-CG 4.11Å; F69-P107 HydrophobicContact CZ-CB 4.43Å; F69-P107 HydrophobicContact CZ-CG 4.09Å; Y101-P107 HydrophobicContact CD1-CB 3.7Å; Y101-P107 HydrophobicContact CD1-CG 3.47Å; Y101-P107 VanDerWaalsContact CD1-CG 3.47Å; Y101-P107 HydrophobicContact CD2-CB 4.18Å; Y101-P107 HydrophobicContact CD2-CG 3.72Å; Y101-P107 HydrophobicContact CE1-CB 3.74Å; Y101-P107 HydrophobicContact CE1-CG 4.03Å; Y101-P107 HydrophobicContact CE2-CB 4.2Å; Y101-P107 HydrophobicContact CE2-CG 4.25Å; Y101-P107 HydrophobicContact CG-CB 3.92Å; Y101-P107 HydrophobicContact CG-CG 3.27Å
108	S	72.1	Confident	87.3	Confident	103 Å²	103	49.1 Å²	49.1	72%	0.72	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-61.3	156.6	169.1	-57.9	0	0	0	0	111.7
109	A	78.1	Confident	87.7	Confident	59 Å²	59	46.3 Å²	46.3	49%	0.488	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-54.5	140.2	174.4	0	0	0	0	0	111.4	L66 I67 N68	L66-A109 HydrophobicContact CD1-CB 4.19Å; I67-A109 WeakPolarHBondContact O-CA 3.38Å; N68-A109 WeakPolarHBondContact OD1-CB 3.49Å
110	V	86.8	Confident	88.1	Confident	9 Å²	9	46.7 Å²	46.7	6%	0.055	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.2	-179.9	166.8	0	0	0	0	109.6	L66 I67 V87 V98	L66-V110 WeakPolarHBondContact CA-O 3.27Å; I67-V110 HydrophobicContact CD1-CB 4.07Å; I67-V110 HydrophobicContact CD1-CG1 4.33Å; I67-V110 HydrophobicContact CG1-CB 3.64Å; I67-V110 HydrophobicContact CG1-CG1 4.18Å; I67-V110 PolarHBondContact N-O 2.99Å; I67-V110 PolarHBondContact O-N 2.73Å; V87-V110 HydrophobicContact CG1-CG1 4.19Å; V98-V110 HydrophobicContact CG1-CB 4.48Å; V98-V110 HydrophobicContact CG1-CG1 3.73Å; V98-V110 HydrophobicContact CG1-CG2 3.89Å
111	V	87	Confident	88.2	Confident	58 Å²	58	42.7 Å²	42.7	35%	0.352	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.1	173.1	179	0	0	0	0	108.8	R64 I65 L66 F139	R64-V111 HydrophobicContact CB-CG1 4.49Å; I65-V111 CarbonylContact O-C 3.55Å; I65-V111 WeakPolarHBondContact O-CA 3.49Å; L66-V111 HydrophobicContact CD1-CG2 3.7Å; V111-F139 HydrophobicContact CG1-CB 4.19Å; V111-F139 HydrophobicContact CG1-CD1 3.4Å; V111-F139 VanDerWaalsContact CG1-CD1 3.4Å; V111-F139 HydrophobicContact CG1-CD2 4.07Å; V111-F139 HydrophobicContact CG1-CE1 3.63Å; V111-F139 HydrophobicContact CG1-CE2 4.28Å; V111-F139 HydrophobicContact CG1-CG 3.63Å; V111-F139 HydrophobicContact CG1-CZ 4.07Å; V111-F139 HydrophobicContact CG2-CD1 4.48Å; V111-F139 HydrophobicContact CG2-CD2 3.74Å; V111-F139 HydrophobicContact CG2-CE1 4.36Å; V111-F139 HydrophobicContact CG2-CE2 3.62Å; V111-F139 HydrophobicContact CG2-CG 4.17Å; V111-F139 HydrophobicContact CG2-CZ 3.94Å
112	S	89.5	Confident	88.3	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.014	25%	0.248	C	C	.	.			trans	-74.9	149	175.5	68.7	0	0	0	0	112.4	R64 I65 G114	R64-S112 WeakPolarHBondContact CB-O 3.42Å; R64-S112 VanDerWaalsContact CD-O 3.24Å; R64-S112 WeakPolarHBondContact CD-O 3.42Å; R64-S112 VanDerWaalsContact CG-O 3.3Å; R64-S112 WeakPolarHBondContact CG-O 3.38Å; I65-S112 PolarHBondContact N-OG 2.85Å; I65-S112 PolarHBondContact O-N 2.86Å; S112-G114 WeakPolarHBondContact CB-O 3.13Å; S112-G114 PolarHBondContact OG-O 2.85Å
113	S	85.1	Confident	88.2	Confident	75 Å²	75	40.8 Å²	40.8	52%	0.524	24%	0.244	S	C	.	.	S	Bend	trans	-75.4	-35	170.6	63.1	0	0	0	0	111.9	R64 D89	R64-S113 PolarHBondContact NE-O 2.97Å; D89-S113 PolarHBondContact OD1-N 3.03Å; D89-S113 PolarHBondContact OD1-OG 2.99Å; D89-S113 WeakPolarHBondContact OD2-CA 3.12Å; D89-S113 WeakPolarHBondContact OD2-CB 3.29Å; D89-S113 PolarHBondContact OD2-N 3.26Å; D89-S113 PolarHBondContact OD2-OG 3.08Å
114	G	86.3	Confident	88.1	Confident	30 Å²	30	42 Å²	42	31%	0.309	25%	0.25	S	C	.	.	S	Bend	trans	-112.8	-163.6	179	0	0	0	0	0	113.9	S112 Q116	S112-G114 WeakPolarHBondContact CB-O 3.13Å; S112-G114 PolarHBondContact OG-O 2.85Å; G114-Q116 VanDerWaalsContact C-N 3.33Å
115	N	90	Very high	88	Confident	46 Å²	46	42.3 Å²	42.3	25%	0.246	25%	0.248	C	C	.	.	S	Bend	trans	-90.8	10.6	-179.3	72.2	-43.8	0	0	0	114.2	S57 A58 G60 Q63 I65	S57-N115 CarbonylContact C-O 3.57Å; S57-N115 WeakPolarHBondContact CA-O 3.45Å; A58-N115 HydrophobicContact CB-CB 4.18Å; A58-N115 PolarHBondContact N-O 2.86Å; G60-N115 WeakPolarHBondContact O-CB 3.29Å; Q63-N115 WeakPolarHBondContact O-CA 3.36Å; Q63-N115 WeakPolarHBondContact O-CB 3.48Å; I65-N115 WeakPolarHBondContact CD1-O 3.37Å
116	Q	92.8	Very high	87.8	Confident	63 Å²	63	40.1 Å²	40.1	29%	0.294	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	140.1	-175.7	-58.3	-178.2	-64	0	0	111.7	I56 S57 G90 V91 G114	I56-Q116 CarbonylContact O-C 3.49Å; I56-Q116 VanDerWaalsContact O-CA 3.22Å; I56-Q116 WeakPolarHBondContact O-CA 3.5Å; S57-Q116 PolarHBondContact OG-NE2 2.87Å; S57-Q116 VanDerWaalsContact OG-NE2 3.15Å; G90-Q116 PolarHBondContact N-O 2.81Å; G90-Q116 CarbonylContact O-C 3.59Å; V91-Q116 HydrophobicContact CG1-CB 3.96Å; V91-Q116 HydrophobicContact CG1-CG 4.19Å; G114-Q116 VanDerWaalsContact C-N 3.33Å
117	L	94.9	Very high	87	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.2	175.3	-90	167.5	0	0	0	110	V55 I56 I65 I67 V87 R88 G90	V55-L117 CarbonylContact C-O 3.55Å; V55-L117 WeakPolarHBondContact CA-O 3.17Å; I56-L117 HydrophobicContact CB-CB 4.47Å; I56-L117 PolarHBondContact N-O 3.46Å; I56-L117 PolarHBondContact O-N 2.82Å; I65-L117 HydrophobicContact CB-CD1 3.79Å; I65-L117 HydrophobicContact CD1-CB 4.45Å; I65-L117 HydrophobicContact CG2-CD1 3.77Å; I67-L117 HydrophobicContact CD1-CD1 4.49Å; I67-L117 HydrophobicContact CG2-CD1 3.96Å; V87-L117 HydrophobicContact CG1-CD2 4.02Å; R88-L117 WeakPolarHBondContact O-CD2 3.37Å; G90-L117 CarbonylContact O-C 3.51Å; G90-L117 VanDerWaalsContact O-C 3.29Å; G90-L117 WeakPolarHBondContact O-CA 3.49Å; G90-L117 PolarHBondContact O-N 2.82Å
118	F	96.4	Very high	86.4	Confident	9 Å²	9	44.9 Å²	44.9	4%	0.039	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.8	174.6	177.3	-93.3	0	0	0	110	M53 W54 V55 R88 G90 E93 K120	M53-F118 HydrophobicContact CB-CE2 3.89Å; M53-F118 HydrophobicContact CB-CZ 3.92Å; M53-F118 HydrophobicContact CG-CE2 4.29Å; M53-F118 HydrophobicContact CG-CZ 3.82Å; M53-F118 HydrophobicContact SD-CE2 4.43Å; M53-F118 HydrophobicContact SD-CZ 3.92Å; W54-F118 CarbonylContact O-C 3.52Å; W54-F118 WeakPolarHBondContact O-CA 2.98Å; V55-F118 HydrophobicContact CG2-CD2 4.02Å; R88-F118 HydrophobicContact CB-CB 4.22Å; R88-F118 HydrophobicContact CB-CD1 4.14Å; R88-F118 HydrophobicContact CG-CD1 4.3Å; R88-F118 PolarHBondContact N-O 3.44Å; R88-F118 PolarHBondContact O-N 3.19Å; G90-F118 PolarHBondContact O-N 3.07Å; G90-F118 VanDerWaalsContact O-N 3.17Å; E93-F118 HydrophobicContact CG-CE1 3.72Å; E93-F118 HydrophobicContact CG-CZ 3.61Å; F118-K120 HydrophobicContact CD1-CB 4.48Å; F118-K120 HydrophobicContact CE1-CB 3.64Å; F118-K120 HydrophobicContact CE1-CD 4.31Å; F118-K120 HydrophobicContact CZ-CB 4.09Å
119	I	96.3	Very high	87.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.2	178.5	-59	179.9	0	0	0	108.5	L37 M53 W54 I56 I67 V85 E86 V87 I134	L37-I119 HydrophobicContact CD1-CD1 4.31Å; M53-I119 CarbonylContact C-O 3.55Å; M53-I119 WeakPolarHBondContact CA-O 3.44Å; W54-I119 HydrophobicContact CE3-CB 4.42Å; W54-I119 HydrophobicContact CE3-CG2 4.15Å; W54-I119 PolarHBondContact N-O 2.79Å; W54-I119 PolarHBondContact O-N 2.93Å; I56-I119 HydrophobicContact CD1-CD1 3.7Å; I67-I119 HydrophobicContact CD1-CD1 4.06Å; V85-I119 HydrophobicContact CG2-CG2 3.85Å; E86-I119 CarbonylContact O-C 3.52Å; E86-I119 WeakPolarHBondContact O-CA 3.46Å; V87-I119 HydrophobicContact CG2-CG1 4.48Å; I119-I134 HydrophobicContact CD1-CD1 3.91Å; I119-I134 HydrophobicContact CG2-CD1 4.34Å
120	K	95.8	Very high	87.6	Confident	20 Å²	20	38 Å²	38	9%	0.087	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.9	179	170.3	179.9	172.2	-174.3	0	111.1	C52 M53 V85 E86 E93 F118 V122	C52-K120 CarbonylContact O-C 3.51Å; C52-K120 WeakPolarHBondContact O-CA 3.47Å; M53-K120 HydrophobicContact CG-CB 4.36Å; M53-K120 HydrophobicContact CG-CG 4.19Å; V85-K120 CarbonylContact C-O 3.41Å; V85-K120 WeakPolarHBondContact CA-O 3.1Å; E86-K120 HydrophobicContact CB-CB 4.26Å; E86-K120 PolarHBondContact N-O 3.23Å; E86-K120 PolarHBondContact O-N 3.33Å; E93-K120 VanDerWaalsContact OE1-CD 3.25Å; E93-K120 WeakPolarHBondContact OE1-CD 3.06Å; E93-K120 VanDerWaalsContact OE1-CE 3.25Å; E93-K120 WeakPolarHBondContact OE1-CE 3.41Å; E93-K120 IonicContact OE1-NZ 2.85Å; E93-K120 PolarHBondContact OE1-NZ 2.78Å; F118-K120 HydrophobicContact CD1-CB 4.48Å; F118-K120 HydrophobicContact CE1-CB 3.64Å; F118-K120 HydrophobicContact CE1-CD 4.31Å; F118-K120 HydrophobicContact CZ-CB 4.09Å; K120-V122 HydrophobicContact CD-CG2 4.44Å; K120-V122 HydrophobicContact CG-CG2 4.1Å
121	F	95.8	Very high	87.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.2	173.4	172.8	-119.5	0	0	0	110.1	Y46 Q50 R51 C52 W54 L75 Y84 V85 F132	Y46-F121 HydrophobicContact CD1-CZ 4.27Å; Y46-F121 HydrophobicContact CD2-CE1 4.39Å; Y46-F121 AromaticContact CD2-CZ 3.71Å; Y46-F121 HydrophobicContact CD2-CZ 3.71Å; Y46-F121 HydrophobicContact CE2-CZ 4.21Å; Y46-F121 HydrophobicContact CG-CE1 4.37Å; Y46-F121 AromaticContact CG-CZ 3.75Å; Y46-F121 HydrophobicContact CG-CZ 3.75Å; Q50-F121 HydrophobicContact CB-CD1 4.48Å; Q50-F121 HydrophobicContact CB-CE1 4.24Å; R51-F121 CarbonylContact C-O 3.37Å; R51-F121 WeakPolarHBondContact CA-O 3.43Å; C52-F121 HydrophobicContact CB-CB 4.14Å; C52-F121 PolarHBondContact N-O 3.32Å; C52-F121 PolarHBondContact O-N 3.03Å; W54-F121 HydrophobicContact CH2-CB 4.28Å; W54-F121 HydrophobicContact CZ3-CB 3.85Å; L75-F121 HydrophobicContact CD1-CE2 4.25Å; L75-F121 HydrophobicContact CD2-CE2 3.71Å; L75-F121 HydrophobicContact CD2-CZ 4.26Å; Y84-F121 WeakPolarHBondContact O-CA 3.46Å; Y84-F121 VanDerWaalsContact O-CD2 3.28Å; Y84-F121 WeakPolarHBondContact O-CD2 3.34Å; V85-F121 HydrophobicContact CB-CD2 4.46Å; F121-F132 HydrophobicContact CB-CE1 3.87Å; F121-F132 HydrophobicContact CB-CZ 4.11Å; F121-F132 HydrophobicContact CD1-CE1 4.39Å; F121-F132 HydrophobicContact CD2-CD1 4.25Å; F121-F132 AromaticContact CD2-CE1 3.58Å; F121-F132 HydrophobicContact CD2-CE1 3.58Å; F121-F132 HydrophobicContact CE2-CE1 4.22Å; F121-F132 AromaticContact CG-CE1 3.69Å; F121-F132 HydrophobicContact CG-CE1 3.69Å; F121-F132 HydrophobicContact CG-CZ 4.39Å
122	V	94.3	Very high	88.2	Confident	26 Å²	26	34.8 Å²	34.8	16%	0.158	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.2	178.2	179.9	0	0	0	0	109.1	Q50 D83 Y84 K120	Q50-V122 VanDerWaalsContact O-CA 3.31Å; Q50-V122 WeakPolarHBondContact O-CA 3.24Å; D83-V122 WeakPolarHBondContact CA-O 3.48Å; Y84-V122 HydrophobicContact CD1-CB 4.23Å; Y84-V122 HydrophobicContact CD2-CB 4.35Å; Y84-V122 HydrophobicContact CD2-CG2 4.46Å; Y84-V122 HydrophobicContact CE1-CB 3.79Å; Y84-V122 HydrophobicContact CE1-CG1 3.99Å; Y84-V122 HydrophobicContact CE1-CG2 4.27Å; Y84-V122 HydrophobicContact CE2-CB 3.93Å; Y84-V122 HydrophobicContact CE2-CG2 3.7Å; Y84-V122 HydrophobicContact CG-CB 4.5Å; Y84-V122 PolarHBondContact N-O 2.89Å; Y84-V122 PolarHBondContact O-N 2.92Å; K120-V122 HydrophobicContact CD-CG2 4.44Å; K120-V122 HydrophobicContact CG-CG2 4.1Å
123	S	92.3	Very high	88.5	Confident	6 Å²	6	35.1 Å²	35.1	4%	0.042	19%	0.188	C	C	.	.			trans	-127.9	151.8	166.1	65.7	0	0	0	0	112.4	P47 S49 Q50 D83	P47-S123 PolarHBondContact O-OG 3.34Å; S49-S123 VanDerWaalsContact CA-O 3.23Å; S49-S123 WeakPolarHBondContact CA-O 3.24Å; S49-S123 PolarHBondContact N-O 2.82Å; S49-S123 PolarHBondContact N-OG 2.79Å; Q50-S123 WeakPolarHBondContact CB-OG 3.21Å; Q50-S123 PolarHBondContact N-O 3.22Å; Q50-S123 PolarHBondContact N-OG 3.21Å; Q50-S123 PolarHBondContact O-N 2.82Å; D83-S123 WeakPolarHBondContact OD1-CA 3.24Å
124	D	87.1	Confident	88.9	Confident	26 Å²	26	31.5 Å²	31.5	14%	0.139	16%	0.163	C	C	.	.			trans	-97	-158	178.9	90	-13.8	0	0	0	112.4	P48 S49 Y82 D83 E126	P48-D124 CarbonylContact C-O 3.53Å; P48-D124 VanDerWaalsContact CA-O 3.24Å; P48-D124 WeakPolarHBondContact CA-O 3.23Å; P48-D124 WeakPolarHBondContact CB-O 3.3Å; S49-D124 PolarHBondContact N-O 2.87Å; Y82-D124 VanDerWaalsContact CD1-OD2 3.28Å; Y82-D124 WeakPolarHBondContact CD1-OD2 3.46Å; D83-D124 PolarHBondContact OD1-N 3.4Å; D124-E126 PolarHBondContact OD1-N 2.82Å
125	Y	83.8	Confident	89.2	Confident	165 Å²	165	33.8 Å²	33.8	65%	0.647	16%	0.162	S	C	*	.	S	Bend	trans	-98.5	-2.2	-177.3	69	-88.2	0	0	0	114.5
126	E	73.3	Confident	89.3	Confident	99 Å²	99	32.6 Å²	32.6	46%	0.463	15%	0.154	S	C	.	.	S	Bend	trans	-134.1	136	-173.1	-93.1	179.2	-161.5	0	0	112.7	D124	D124-E126 PolarHBondContact OD1-N 2.82Å
127	T	64.6	Low	89.2	Confident	70 Å²	70	32 Å²	32	43%	0.429	15%	0.151	S	C	.	.			trans	62.5	141	179.2	68.9	0	0	0	0	115.7	E76	E76-T127 WeakPolarHBondContact CG-OG1 3.28Å; E76-T127 PolarHBondContact OE1-OG1 2.68Å
128	H	73.2	Confident	88.9	Confident	76 Å²	76	34 Å²	34	35%	0.352	16%	0.162	S	C	.	.			trans	-146.2	137.7	-176.7	-49.4	84.8	0	0	0	110.1	Y46 P48	Y46-H128 AromaticContact CD2-CD2 4Å; Y46-H128 HydrophobicContact CE2-CB 4.22Å; Y46-H128 AromaticContact CE2-CD2 3.93Å; Y46-H128 PolarHBondContact O-CD2 3.35Å; P48-H128 WeakPolarHBondContact CA-NE2 3.09Å; P48-H128 WeakPolarHBondContact CB-NE2 3.31Å; P48-H128 VanDerWaalsContact CD-NE2 3.27Å; P48-H128 WeakPolarHBondContact CD-NE2 3.08Å
129	G	85.7	Confident	88.1	Confident	5 Å²	5	36 Å²	36	5%	0.052	17%	0.171	C	C	.	.			trans	-105.3	-176.1	170.5	0	0	0	0	0	112.5	S45 Y46 D74 G131	S45-G129 WeakPolarHBondContact CA-O 3.39Å; Y46-G129 WeakPolarHBondContact CD1-O 3.34Å; Y46-G129 VanDerWaalsContact CE1-O 3.26Å; Y46-G129 WeakPolarHBondContact CE1-O 3.31Å; Y46-G129 PolarHBondContact N-O 3.18Å; Y46-G129 PolarHBondContact OH-N 3.41Å; D74-G129 CarbonylContact O-C 3.55Å; D74-G129 WeakPolarHBondContact O-CA 3.18Å; D74-G129 WeakPolarHBondContact OD2-CA 3.48Å; G129-G131 PolarHBondContact O-N 3.33Å
130	A	88.8	Confident	86.6	Confident	13 Å²	13	42.9 Å²	42.9	11%	0.107	20%	0.2	C	C	.	.			trans	-65.9	-17.6	178.8	0	0	0	0	0	114.4	Y42 P43 M44 D74	Y42-A130 WeakPolarHBondContact CD2-O 3.29Å; P43-A130 WeakPolarHBondContact O-CB 3.35Å; M44-A130 VanDerWaalsContact O-O 3.05Å; D74-A130 HydrophobicContact CB-CB 3.99Å; D74-A130 PolarHBondContact O-N 3.31Å; D74-A130 PolarHBondContact OD2-N 2.74Å
131	G	92.9	Very high	84.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	92.9	-150.3	179.2	0	0	0	0	0	113.5	S39 D74 G129	S39-G131 VanDerWaalsContact OG-CA 3.31Å; S39-G131 WeakPolarHBondContact OG-CA 3.31Å; D74-G131 PolarHBondContact N-O 2.61Å; D74-G131 WeakPolarHBondContact O-CA 3.01Å; D74-G131 PolarHBondContact O-N 2.85Å; G129-G131 PolarHBondContact O-N 3.33Å
132	F	94.4	Very high	82.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.234	C	C	.	.			trans	-142.4	157.7	-178.8	71.3	-90.4	0	0	0	113	L37 T38 S39 Y42 W54 F69 F73 L75 V85 F121 I134	L37-F132 HydrophobicContact CD2-CE2 3.56Å; L37-F132 HydrophobicContact CD2-CZ 4.06Å; T38-F132 VanDerWaalsContact CA-O 3.3Å; T38-F132 WeakPolarHBondContact CA-O 3.26Å; S39-F132 PolarHBondContact N-O 3.16Å; S39-F132 VanDerWaalsContact N-O 3.07Å; S39-F132 PolarHBondContact OG-N 2.8Å; S39-F132 VanDerWaalsContact OG-N 3.08Å; Y42-F132 WeakPolarHBondContact CD2-O 3.05Å; W54-F132 HydrophobicContact CZ3-CZ 4.31Å; F69-F132 HydrophobicContact CE1-CD2 4.42Å; F73-F132 HydrophobicContact CD2-CB 3.49Å; F73-F132 VanDerWaalsContact CD2-CB 3.49Å; F73-F132 HydrophobicContact CE2-CB 3.62Å; F73-F132 HydrophobicContact CE2-CG 4.38Å; L75-F132 HydrophobicContact CD1-CD1 4.45Å; V85-F132 HydrophobicContact CB-CD1 4.15Å; V85-F132 HydrophobicContact CB-CE1 3.9Å; V85-F132 HydrophobicContact CB-CZ 4.22Å; V85-F132 HydrophobicContact CG1-CD1 4.43Å; V85-F132 HydrophobicContact CG2-CD1 4.42Å; V85-F132 HydrophobicContact CG2-CE1 3.87Å; V85-F132 HydrophobicContact CG2-CE2 4.04Å; V85-F132 HydrophobicContact CG2-CZ 3.65Å; F121-F132 HydrophobicContact CB-CE1 3.87Å; F121-F132 HydrophobicContact CB-CZ 4.11Å; F121-F132 HydrophobicContact CD1-CE1 4.39Å; F121-F132 HydrophobicContact CD2-CD1 4.25Å; F121-F132 AromaticContact CD2-CE1 3.58Å; F121-F132 HydrophobicContact CD2-CE1 3.58Å; F121-F132 HydrophobicContact CE2-CE1 4.22Å; F121-F132 AromaticContact CG-CE1 3.69Å; F121-F132 HydrophobicContact CG-CE1 3.69Å; F121-F132 HydrophobicContact CG-CZ 4.39Å; F132-I134 HydrophobicContact CD2-CD1 3.82Å; F132-I134 HydrophobicContact CD2-CG1 3.81Å; F132-I134 HydrophobicContact CE2-CD1 3.57Å; F132-I134 HydrophobicContact CE2-CG1 4Å
133	S	94.1	Very high	80.1	Confident	8 Å²	8	51.1 Å²	51.1	6%	0.056	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.4	169.5	178.5	0	0	0	0	110.1	L37 N70	L37-S133 CarbonylContact O-C 3.56Å; L37-S133 WeakPolarHBondContact O-CA 3.4Å; N70-S133 WeakPolarHBondContact CB-O 3.24Å; N70-S133 PolarHBondContact N-O 2.94Å
134	I	94.9	Very high	78.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.2	179.6	-66.9	169.6	0	0	0	108.5	Y36 L37 I67 N68 F69 I119 F132	Y36-I134 CarbonylContact C-O 3.49Å; Y36-I134 VanDerWaalsContact CA-O 3.27Å; Y36-I134 WeakPolarHBondContact CA-O 3.35Å; L37-I134 HydrophobicContact CB-CB 4.49Å; L37-I134 HydrophobicContact CD2-CD1 4.34Å; L37-I134 PolarHBondContact N-O 2.88Å; L37-I134 PolarHBondContact O-N 2.85Å; I67-I134 HydrophobicContact CB-CG2 3.66Å; I67-I134 HydrophobicContact CD1-CG2 4.42Å; I67-I134 HydrophobicContact CG1-CG2 4.49Å; I67-I134 HydrophobicContact CG2-CG2 4.1Å; N68-I134 CarbonylContact O-C 3.41Å; N68-I134 WeakPolarHBondContact O-CA 3.23Å; F69-I134 HydrophobicContact CD1-CD1 4.05Å; F69-I134 HydrophobicContact CD1-CG1 3.54Å; F69-I134 HydrophobicContact CE1-CD1 3.38Å; F69-I134 HydrophobicContact CE1-CG1 3.44Å; F69-I134 VanDerWaalsContact CE1-CG1 3.44Å; F69-I134 HydrophobicContact CE2-CD1 4.44Å; F69-I134 HydrophobicContact CE2-CG1 4.49Å; F69-I134 HydrophobicContact CG-CG1 4.13Å; F69-I134 HydrophobicContact CZ-CD1 3.61Å; F69-I134 HydrophobicContact CZ-CG1 3.95Å; I119-I134 HydrophobicContact CD1-CD1 3.91Å; I119-I134 HydrophobicContact CG2-CD1 4.34Å; F132-I134 HydrophobicContact CD2-CD1 3.82Å; F132-I134 HydrophobicContact CD2-CG1 3.81Å; F132-I134 HydrophobicContact CE2-CD1 3.57Å; F132-I134 HydrophobicContact CE2-CG1 4Å
135	R	91.7	Very high	78.3	Confident	78 Å²	78	59 Å²	59	29%	0.294	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.9	166.1	-173.4	174.7	175.9	-86.3	-7.6	108.9	S35 Y36 I67 N68 E137	S35-R135 WeakPolarHBondContact O-CA 3.37Å; Y36-R135 HydrophobicContact CD1-CB 3.94Å; Y36-R135 HydrophobicContact CD1-CG 4.41Å; Y36-R135 HydrophobicContact CE1-CB 3.67Å; Y36-R135 HydrophobicContact CE1-CG 3.99Å; I67-R135 CarbonylContact C-O 3.56Å; I67-R135 WeakPolarHBondContact CA-O 3.43Å; N68-R135 PolarHBondContact N-O 3.06Å; N68-R135 PolarHBondContact O-N 2.86Å; R135-E137 IonicContact CZ-OE1 3.74Å; R135-E137 IonicContact CZ-OE2 3.25Å; R135-E137 IonicContact NH1-OE1 3.46Å; R135-E137 PolarHBondContact NH1-OE1 3.48Å; R135-E137 IonicContact NH1-OE2 2.72Å; R135-E137 PolarHBondContact NH1-OE2 3.21Å; R135-E137 IonicContact NH2-OE2 2.71Å; R135-E137 PolarHBondContact NH2-OE2 2.7Å
136	Y	93.6	Very high	78.4	Confident	20 Å²	20	53.8 Å²	53.8	8%	0.078	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.3	177.4	58.4	-97.9	0	0	0	111.7	I29 I31 A34 S35 L37 I56 L66	I29-Y136 HydrophobicContact CD1-CE1 4.18Å; I29-Y136 HydrophobicContact CG2-CE1 4.29Å; I29-Y136 HydrophobicContact CG2-CE2 3.67Å; I29-Y136 WeakPolarHBondContact CG2-OH 3.45Å; I31-Y136 HydrophobicContact CD1-CD2 4.19Å; I31-Y136 HydrophobicContact CG1-CD2 3.93Å; I31-Y136 HydrophobicContact CG1-CE2 4.26Å; A34-Y136 WeakPolarHBondContact CA-O 2.94Å; S35-Y136 WeakPolarHBondContact CB-OH 3.32Å; S35-Y136 PolarHBondContact N-O 2.6Å; S35-Y136 VanDerWaalsContact N-O 3.16Å; S35-Y136 WeakPolarHBondContact O-CD1 3.45Å; S35-Y136 PolarHBondContact O-N 2.93Å; S35-Y136 PolarHBondContact OG-OH 2.83Å; L37-Y136 HydrophobicContact CB-CD1 4.17Å; L37-Y136 HydrophobicContact CB-CE1 4.07Å; I56-Y136 HydrophobicContact CD1-CD1 3.99Å; I56-Y136 HydrophobicContact CD1-CG 3.99Å; I56-Y136 HydrophobicContact CG2-CD2 4.14Å; I56-Y136 HydrophobicContact CG2-CG 4.31Å; L66-Y136 CarbonylContact O-C 3.45Å; L66-Y136 WeakPolarHBondContact O-CA 3.36Å
137	E	90.3	Very high	79	Confident	50 Å²	50	54.9 Å²	54.9	23%	0.234	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	172.9	175.2	70.1	-165	145.5	0	0	112.3	A34 I65 L66 R135	A34-E137 HydrophobicContact CB-CB 3.76Å; I65-E137 WeakPolarHBondContact CA-O 3.38Å; L66-E137 HydrophobicContact CB-CG 4.28Å; L66-E137 HydrophobicContact CD2-CG 4.4Å; L66-E137 PolarHBondContact N-O 2.89Å; L66-E137 PolarHBondContact O-N 2.82Å; R135-E137 IonicContact CZ-OE1 3.74Å; R135-E137 IonicContact CZ-OE2 3.25Å; R135-E137 IonicContact NH1-OE1 3.46Å; R135-E137 PolarHBondContact NH1-OE1 3.48Å; R135-E137 IonicContact NH1-OE2 2.72Å; R135-E137 PolarHBondContact NH1-OE2 3.21Å; R135-E137 IonicContact NH2-OE2 2.71Å; R135-E137 PolarHBondContact NH2-OE2 2.7Å
138	I	87.4	Confident	80.1	Confident	44 Å²	44	56.7 Å²	56.7	23%	0.226	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127	175.6	-61.8	169.4	0	0	0	109	I31 P59 Q63 R64	I31-I138 HydrophobicContact CB-CG1 4.49Å; I31-I138 HydrophobicContact CG2-CD1 4.47Å; I31-I138 HydrophobicContact CG2-CG1 4.01Å; P59-I138 HydrophobicContact CG-CD1 3.94Å; Q63-I138 HydrophobicContact CB-CG2 4.06Å; Q63-I138 HydrophobicContact CG-CG2 4.23Å; R64-I138 CarbonylContact O-C 3.6Å; R64-I138 WeakPolarHBondContact O-CA 3.45Å
139	F	79.9	Confident	81.1	Confident	51 Å²	51	54 Å²	54	22%	0.224	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	127.4	175.1	-174.5	-112.7	0	0	0	110.5	R64 L66 V111 T141	R64-F139 HydrophobicContact CB-CB 3.93Å; R64-F139 HydrophobicContact CB-CD1 4.14Å; R64-F139 PolarHBondContact O-N 2.81Å; L66-F139 HydrophobicContact CB-CB 4.02Å; L66-F139 HydrophobicContact CB-CD2 3.99Å; L66-F139 HydrophobicContact CB-CG 4.47Å; L66-F139 HydrophobicContact CD1-CD2 4.43Å; L66-F139 HydrophobicContact CD2-CD2 4.36Å; L66-F139 HydrophobicContact CG-CD2 4.5Å; V111-F139 HydrophobicContact CG1-CB 4.19Å; V111-F139 HydrophobicContact CG1-CD1 3.4Å; V111-F139 VanDerWaalsContact CG1-CD1 3.4Å; V111-F139 HydrophobicContact CG1-CD2 4.07Å; V111-F139 HydrophobicContact CG1-CE1 3.63Å; V111-F139 HydrophobicContact CG1-CE2 4.28Å; V111-F139 HydrophobicContact CG1-CG 3.63Å; V111-F139 HydrophobicContact CG1-CZ 4.07Å; V111-F139 HydrophobicContact CG2-CD1 4.48Å; V111-F139 HydrophobicContact CG2-CD2 3.74Å; V111-F139 HydrophobicContact CG2-CE1 4.36Å; V111-F139 HydrophobicContact CG2-CE2 3.62Å; V111-F139 HydrophobicContact CG2-CG 4.17Å; V111-F139 HydrophobicContact CG2-CZ 3.94Å; F139-T141 HydrophobicContact CE1-CG2 4.01Å; F139-T141 WeakPolarHBondContact CE1-OG1 3.49Å; F139-T141 HydrophobicContact CE2-CG2 4.19Å; F139-T141 HydrophobicContact CZ-CG2 3.63Å; F139-T141 WeakPolarHBondContact CZ-OG1 3.39Å
140	K	64.1	Low	81.3	Confident	143 Å²	143	58.7 Å²	58.7	62%	0.622	31%	0.313	S	S	*	.			trans	-120.5	102.3	-178.2	-62.1	-179.7	-178.8	-179.3	0	109.4
141	T	51.7	Low	81.5	Confident	67 Å²	67	60.8 Å²	60.8	41%	0.411	33%	0.327	S	S	.	.			trans	-145.1	137.5	163.7	53.6	0	0	0	0	109.6	F139 N168	F139-T141 HydrophobicContact CE1-CG2 4.01Å; F139-T141 WeakPolarHBondContact CE1-OG1 3.49Å; F139-T141 HydrophobicContact CE2-CG2 4.19Å; F139-T141 HydrophobicContact CZ-CG2 3.63Å; F139-T141 WeakPolarHBondContact CZ-OG1 3.39Å; T141-N168 HydrophobicContact CG2-CB 3.98Å
142	G	47.1	Very low	81.4	Confident	37 Å²	37	64.1 Å²	64.1	38%	0.381	35%	0.345	S	S	.	.	S	Bend	trans	-76	140.4	-163	0	0	0	0	0	115.5
143	P	51.5	Low	81.4	Confident	115 Å²	115	67.6 Å²	67.6	75%	0.747	37%	0.369	S	S	*	.	S	Bend		-112	1.4	99.8	31.2	-34.8	0	0	0	115.3	C145	P143-C145 VanDerWaalsContact C-N 3.27Å; P143-C145 PolarHBondContact O-N 3.3Å
144	E	62.8	Low	81.5	Confident	175 Å²	175	68.2 Å²	68.2	82%	0.818	38%	0.376	S	S	*	.	S	Bend	trans	-76.8	-4	-175.9	-64.8	-169.2	163	0	0	115.1
145	C	78.1	Confident	81.5	Confident	24 Å²	24	71.7 Å²	71.7	16%	0.162	40%	0.398	C	S	.	.	S	Bend	trans	-107.8	-20.4	-179.4	56.7	0	0	0	0	115.1	P143 P159 C171 F173	P143-C145 VanDerWaalsContact C-N 3.27Å; P143-C145 PolarHBondContact O-N 3.3Å; C145-P159 HydrophobicContact CB-CG 3.78Å; C145-C171 HydrophobicContact CB-CB 3.81Å; C145-C171 WeakPolarHBondContact CB-SG 3.37Å; C145-C171 WeakPolarHBondContact SG-CB 3.43Å; C145-C171 CovalentContact SG-SG 2.01Å; C145-C171 PolarHBondContact SG-SG 3.08Å; C145-F173 WeakPolarHBondContact O-CE1 3.22Å
146	S	86.1	Confident	81.7	Confident	55 Å²	55	68 Å²	68	39%	0.385	38%	0.384	S	S	.	.			trans	-70.9	137.8	178.4	-62.6	0	0	0	0	110.6	T172	S146-T172 CarbonylContact C-O 3.57Å; S146-T172 WeakPolarHBondContact CA-O 3.39Å; S146-T172 WeakPolarHBondContact CB-O 3.48Å; S146-T172 PolarHBondContact OG-N 3.4Å
147	K	85.8	Confident	81.7	Confident	121 Å²	121	72 Å²	72	53%	0.526	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	138	-174.5	-173.4	173.1	176.1	-178	0	112.5	F149 T172 F173 M174	K147-F149 HydrophobicContact CB-CE2 4.06Å; K147-F149 HydrophobicContact CB-CZ 4.39Å; K147-F149 HydrophobicContact CD-CE1 4.08Å; K147-F149 HydrophobicContact CD-CE2 4.15Å; K147-F149 HydrophobicContact CD-CZ 3.67Å; K147-F149 HydrophobicContact CG-CD2 4.48Å; K147-F149 HydrophobicContact CG-CE2 3.96Å; K147-F149 HydrophobicContact CG-CZ 4.01Å; K147-T172 PolarHBondContact N-O 2.77Å; K147-F173 HydrophobicContact CB-CD1 4.22Å; K147-F173 WeakPolarHBondContact O-CA 3.49Å; K147-M174 PolarHBondContact O-N 3.04Å
148	N	88.4	Confident	81.8	Confident	108 Å²	108	69.8 Å²	69.8	58%	0.578	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	141.2	173.3	-62.9	-9.1	0	0	0	110.6	M174 F176	N148-M174 CarbonylContact C-O 3.49Å; N148-M174 WeakPolarHBondContact CA-O 3.44Å; N148-M174 WeakPolarHBondContact OD1-CB 2.96Å; N148-F176 HydrophobicContact CB-CD2 4.47Å; N148-F176 HydrophobicContact CB-CE2 4.06Å
149	F	93	Very high	81.8	Confident	19 Å²	19	69.2 Å²	69.2	8%	0.083	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.7	179.6	-63.2	-93.8	0	0	0	109.7	K147 I156 F173 M174 I175 F176 F260	K147-F149 HydrophobicContact CB-CE2 4.06Å; K147-F149 HydrophobicContact CB-CZ 4.39Å; K147-F149 HydrophobicContact CD-CE1 4.08Å; K147-F149 HydrophobicContact CD-CE2 4.15Å; K147-F149 HydrophobicContact CD-CZ 3.67Å; K147-F149 HydrophobicContact CG-CD2 4.48Å; K147-F149 HydrophobicContact CG-CE2 3.96Å; K147-F149 HydrophobicContact CG-CZ 4.01Å; F149-I156 HydrophobicContact CD2-CD1 4.34Å; F149-I156 HydrophobicContact CD2-CG1 4.41Å; F149-I156 HydrophobicContact CE1-CG1 4.42Å; F149-I156 HydrophobicContact CE2-CD1 4.11Å; F149-I156 HydrophobicContact CE2-CG1 3.85Å; F149-I156 HydrophobicContact CZ-CG1 3.84Å; F149-F173 HydrophobicContact CE2-CB 4.27Å; F149-F173 HydrophobicContact CE2-CD1 4.23Å; F149-M174 PolarHBondContact N-O 2.71Å; F149-I175 HydrophobicContact CB-CG1 4.42Å; F149-F176 PolarHBondContact O-N 3.16Å; F149-F260 HydrophobicContact CB-CE1 4Å; F149-F260 HydrophobicContact CB-CZ 3.68Å; F149-F260 AromaticContact CD1-CE1 3.72Å; F149-F260 HydrophobicContact CD1-CE1 3.72Å; F149-F260 HydrophobicContact CD1-CZ 4.01Å; F149-F260 HydrophobicContact CE1-CE1 4.33Å; F149-F260 AromaticContact CG-CE1 3.88Å; F149-F260 HydrophobicContact CG-CE1 3.88Å; F149-F260 HydrophobicContact CG-CZ 4.06Å
150	T	91.3	Very high	81.9	Confident	105 Å²	105	69.3 Å²	69.3	64%	0.644	41%	0.406	S	S	*	.			trans	-122.2	-3.5	177.5	53.4	0	0	0	0	112.7	F176	T150-F176 HydrophobicContact CG2-CB 4.37Å
151	S	91.8	Very high	83	Confident	57 Å²	57	64.6 Å²	64.6	40%	0.399	39%	0.385	S	S	.	.	S	Bend	trans	-73	152.8	176.4	53	0	0	0	0	111.4	S153 F260	S151-S153 WeakPolarHBondContact CB-O 3.19Å; S151-S153 PolarHBondContact O-N 2.99Å; S151-S153 PolarHBondContact OG-O 3.03Å; S151-F260 WeakPolarHBondContact O-CE2 3.4Å
152	N	91.4	Very high	84.9	Confident	70 Å²	70	65.3 Å²	65.3	37%	0.374	39%	0.391	S	S	.	.	S	Bend	trans	-69	-12.1	178.5	-67.2	27.6	0	0	0	113.5	P178 T261 V262 D264	N152-P178 WeakPolarHBondContact OD1-CG 3.36Å; N152-T261 CarbonylContact O-C 3.38Å; N152-V262 HydrophobicContact CB-CB 4.32Å; N152-V262 WeakPolarHBondContact O-CB 3.43Å; N152-V262 PolarHBondContact O-N 3.24Å; N152-D264 PolarHBondContact ND2-OD1 3.09Å
153	S	95.3	Very high	86.8	Confident	72 Å²	72	70.4 Å²	70.4	50%	0.503	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.2	170.4	61.9	0	0	0	0	110.1	S151 F260	S151-S153 WeakPolarHBondContact CB-O 3.19Å; S151-S153 PolarHBondContact O-N 2.99Å; S151-S153 PolarHBondContact OG-O 3.03Å; S153-F260 WeakPolarHBondContact CA-O 3.47Å; S153-F260 WeakPolarHBondContact CB-O 3.4Å
154	G	94.8	Very high	88.2	Confident	21 Å²	21	71.6 Å²	71.6	22%	0.216	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	177.7	177	0	0	0	0	0	112.5	N259 F260	G154-N259 WeakPolarHBondContact O-CA 3.48Å; G154-F260 PolarHBondContact N-O 3.17Å; G154-F260 WeakPolarHBondContact O-CD1 3.21Å; G154-F260 PolarHBondContact O-N 2.73Å
155	V	95.9	Very high	89.3	Confident	74 Å²	74	63.4 Å²	63.4	45%	0.448	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.2	177.9	-174	0	0	0	0	108.4	K157 A258 N259	V155-K157 HydrophobicContact CG1-CD 4.44Å; V155-K157 HydrophobicContact CG1-CG 4.03Å; V155-A258 CarbonylContact C-O 3.54Å; V155-A258 WeakPolarHBondContact CA-O 3.4Å; V155-A258 WeakPolarHBondContact CG1-O 3.36Å; V155-N259 HydrophobicContact CG2-CB 4.44Å
156	I	95.3	Very high	89.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129	177.9	-54.7	178.8	0	0	0	107.4	F149 F173 I175 L185 L243 F256 S257 A258 F260	F149-I156 HydrophobicContact CD2-CD1 4.34Å; F149-I156 HydrophobicContact CD2-CG1 4.41Å; F149-I156 HydrophobicContact CE1-CG1 4.42Å; F149-I156 HydrophobicContact CE2-CD1 4.11Å; F149-I156 HydrophobicContact CE2-CG1 3.85Å; F149-I156 HydrophobicContact CZ-CG1 3.84Å; I156-F173 HydrophobicContact CD1-CB 4.34Å; I156-F173 HydrophobicContact CG2-CB 3.98Å; I156-F173 HydrophobicContact CG2-CD1 3.87Å; I156-F173 HydrophobicContact CG2-CD2 3.81Å; I156-F173 HydrophobicContact CG2-CE1 4.29Å; I156-F173 HydrophobicContact CG2-CE2 4.23Å; I156-F173 HydrophobicContact CG2-CG 3.59Å; I156-F173 HydrophobicContact CG2-CZ 4.45Å; I156-I175 HydrophobicContact CD1-CD1 3.64Å; I156-I175 HydrophobicContact CD1-CG1 3.86Å; I156-L185 HydrophobicContact CD1-CD1 4.47Å; I156-L243 HydrophobicContact CD1-CD1 4.46Å; I156-F256 HydrophobicContact CG2-CE2 3.9Å; I156-F256 HydrophobicContact CG2-CZ 4.33Å; I156-S257 WeakPolarHBondContact O-CA 3.39Å; I156-A258 PolarHBondContact N-O 2.8Å; I156-A258 PolarHBondContact O-N 2.84Å; I156-F260 HydrophobicContact CD1-CD1 3.99Å; I156-F260 HydrophobicContact CD1-CE1 4.42Å; I156-F260 HydrophobicContact CG1-CD1 4.01Å; I156-F260 HydrophobicContact CG1-CE1 4.28Å
157	K	93.5	Very high	89.3	Confident	104 Å²	104	64.2 Å²	64.2	45%	0.452	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.8	-179.8	-61	-175.1	177	-174.7	0	109.9	V155 F161 F256 S257	V155-K157 HydrophobicContact CG1-CD 4.44Å; V155-K157 HydrophobicContact CG1-CG 4.03Å; K157-F161 HydrophobicContact CB-CB 4.01Å; K157-F161 HydrophobicContact CB-CG 4.46Å; K157-F161 HydrophobicContact CD-CB 4.46Å; K157-F161 HydrophobicContact CD-CD1 3.95Å; K157-F161 HydrophobicContact CD-CG 4.49Å; K157-F161 HydrophobicContact CG-CD1 4.49Å; K157-F256 VanDerWaalsContact CA-O 3.3Å; K157-F256 WeakPolarHBondContact CA-O 3.32Å; K157-S257 WeakPolarHBondContact CE-OG 3.37Å
158	S	92.1	Very high	88.9	Confident	2 Å²	2	62 Å²	62	1%	0.014	35%	0.354	C	S	.	.			trans	-59.5	147.3	166.6	50	0	0	0	0	110.7	G160 F161 E254 G255 F256	S158-G160 PolarHBondContact O-N 2.93Å; S158-F161 WeakPolarHBondContact O-CB 3.42Å; S158-F161 PolarHBondContact O-N 2.95Å; S158-F161 VanDerWaalsContact O-N 3.1Å; S158-E254 PolarHBondContact OG-O 2.68Å; S158-G255 WeakPolarHBondContact OG-CA 3.21Å; S158-F256 PolarHBondContact N-O 2.94Å; S158-F256 PolarHBondContact OG-N 3.04Å; S158-F256 PolarHBondContact OG-O 2.94Å
159	P	88	Confident	88.5	Confident	33 Å²	33	57.6 Å²	57.6	21%	0.214	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	123.8	178.8	-25.2	34.8	0	0	0	111.6	C145 Y165 P166 L169	C145-P159 HydrophobicContact CB-CG 3.78Å; P159-Y165 WeakPolarHBondContact O-CA 3.1Å; P159-P166 WeakPolarHBondContact O-CD 3.49Å; P159-L169 HydrophobicContact CG-CD1 4.14Å; P159-L169 HydrophobicContact CG-CD2 4.42Å
160	G	81	Confident	88.1	Confident	52 Å²	52	61.1 Å²	61.1	54%	0.536	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-6	-179.9	0	0	0	0	0	115.8	S158 E163	S158-G160 PolarHBondContact O-N 2.93Å; G160-E163 CarbonylContact C-O 3.5Å; G160-E163 WeakPolarHBondContact O-CA 3.38Å; G160-E163 VanDerWaalsContact O-CB 3.25Å; G160-E163 WeakPolarHBondContact O-CB 3.47Å; G160-E163 PolarHBondContact O-N 3.26Å
161	F	88.2	Confident	87.8	Confident	45 Å²	45	56.1 Å²	56.1	20%	0.197	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	133.8	-177.7	-172.9	-84.9	0	0	0	112.9	K157 S158 E254	K157-F161 HydrophobicContact CB-CB 4.01Å; K157-F161 HydrophobicContact CB-CG 4.46Å; K157-F161 HydrophobicContact CD-CB 4.46Å; K157-F161 HydrophobicContact CD-CD1 3.95Å; K157-F161 HydrophobicContact CD-CG 4.49Å; K157-F161 HydrophobicContact CG-CD1 4.49Å; S158-F161 WeakPolarHBondContact O-CB 3.42Å; S158-F161 PolarHBondContact O-N 2.95Å; S158-F161 VanDerWaalsContact O-N 3.1Å; F161-E254 WeakPolarHBondContact CD2-O 3.29Å
162	P	92.4	Very high	87.6	Confident	82 Å²	82	55.1 Å²	55.1	53%	0.532	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.7	3	9.2	36.1	-37.1	0	0	0	114.9
163	E	86.6	Confident	87.7	Confident	144 Å²	144	52.2 Å²	52.2	67%	0.673	30%	0.296	S	S	*	.	S	Bend	trans	-70.1	164.3	173.1	-60.5	-65.4	157.7	0	0	110.9	G160 Y165	G160-E163 CarbonylContact C-O 3.5Å; G160-E163 WeakPolarHBondContact O-CA 3.38Å; G160-E163 VanDerWaalsContact O-CB 3.25Å; G160-E163 WeakPolarHBondContact O-CB 3.47Å; G160-E163 PolarHBondContact O-N 3.26Å; E163-Y165 PolarHBondContact O-N 3.12Å
164	K	80.9	Confident	87.4	Confident	139 Å²	139	49.3 Å²	49.3	60%	0.604	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-58.2	133.8	-178.4	-67.7	-176.5	172.1	-144	0	112.3	A252 K253	K164-A252 HydrophobicContact CB-CB 3.96Å; K164-A252 HydrophobicContact CD-CB 4.42Å; K164-A252 WeakPolarHBondContact CD-O 2.98Å; K164-A252 WeakPolarHBondContact CE-O 3.25Å; K164-A252 PolarHBondContact NZ-O 3.09Å; K164-K253 WeakPolarHBondContact CA-O 3.28Å
165	Y	85.6	Confident	87.5	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.016	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-65.4	150.9	175.5	51.6	-102.6	0	0	0	111.6	P159 E163 L192 E193 D207 T247 A252 K253 G255	P159-Y165 WeakPolarHBondContact O-CA 3.1Å; E163-Y165 PolarHBondContact O-N 3.12Å; Y165-L192 HydrophobicContact CD1-CD2 4.18Å; Y165-L192 HydrophobicContact CE1-CD2 3.51Å; Y165-E193 PolarHBondContact OH-N 2.02Å; Y165-D207 WeakPolarHBondContact CE2-OD2 3.23Å; Y165-D207 PolarHBondContact OH-OD2 2.79Å; Y165-T247 HydrophobicContact CD2-CG2 3.54Å; Y165-T247 HydrophobicContact CE2-CG2 3.5Å; Y165-T247 HydrophobicContact CG-CG2 4.4Å; Y165-A252 HydrophobicContact CD2-CB 3.82Å; Y165-A252 HydrophobicContact CE2-CB 3.79Å; Y165-A252 HydrophobicContact CG-CB 4.45Å; Y165-A252 WeakPolarHBondContact O-CB 3.25Å; Y165-K253 WeakPolarHBondContact CD1-O 3.32Å; Y165-K253 VanDerWaalsContact CE1-C 3.49Å; Y165-K253 HydrophobicContact CE1-CB 3.75Å; Y165-K253 WeakPolarHBondContact CE1-O 3.41Å; Y165-K253 VanDerWaalsContact CZ-N 3.26Å; Y165-K253 PolarHBondContact N-O 3.44Å; Y165-K253 VanDerWaalsContact N-O 3.08Å; Y165-K253 PolarHBondContact OH-N 3.3Å; Y165-G255 VanDerWaalsContact CD1-CA 3.45Å
166	P	83.4	Confident	87.2	Confident	40 Å²	40	47.3 Å²	47.3	26%	0.26	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-60.9	153.6	171.2	-24	30.4	0	0	0	113.7	P159 L169 T247	P159-P166 WeakPolarHBondContact O-CD 3.49Å; P166-L169 HydrophobicContact CB-CD1 4.41Å; P166-L169 HydrophobicContact CB-CD2 3.86Å; P166-L169 HydrophobicContact CB-CG 4.08Å; P166-L169 HydrophobicContact CG-CD2 4.14Å; P166-L169 WeakPolarHBondContact O-CD1 3.36Å; P166-L169 VanDerWaalsContact O-CG 3.25Å; P166-L169 WeakPolarHBondContact O-CG 3.47Å; P166-T247 PolarHBondContact O-OG1 3.04Å
167	N	80.9	Confident	87	Confident	56 Å²	56	47.4 Å²	47.4	30%	0.299	26%	0.255	S	S	.	.	S	Bend	trans	-77.9	159.2	169.4	-61.6	-3	0	0	0	110.3	L169 D248 S249 A250	N167-L169 VanDerWaalsContact C-N 3.26Å; N167-L169 PolarHBondContact O-N 3.48Å; N167-D248 CarbonylContact C-O 3.58Å; N167-D248 WeakPolarHBondContact CA-O 3.27Å; N167-D248 VanDerWaalsContact CB-O 3.26Å; N167-D248 WeakPolarHBondContact CB-O 3.3Å; N167-S249 PolarHBondContact ND2-O 2.84Å; N167-A250 WeakPolarHBondContact ND2-CA 3.46Å
168	N	76.9	Confident	86.4	Confident	73 Å²	73	44.9 Å²	44.9	39%	0.39	25%	0.249	S	C	.	.	S	Bend	trans	55.9	37.1	-179.5	-51.7	-62.4	0	0	0	113.4	T141 T247 D248 S249	T141-N168 HydrophobicContact CG2-CB 3.98Å; N168-T247 VanDerWaalsContact CA-O 3.23Å; N168-T247 WeakPolarHBondContact CA-O 3.39Å; N168-T247 PolarHBondContact N-O 3.09Å; N168-T247 PolarHBondContact N-OG1 3.07Å; N168-D248 PolarHBondContact N-O 2.89Å; N168-S249 VanDerWaalsContact OD1-CA 3.26Å; N168-S249 WeakPolarHBondContact OD1-CA 3.09Å; N168-S249 PolarHBondContact OD1-N 3.22Å
169	L	80.7	Confident	85.8	Confident	16 Å²	16	50 Å²	50	8%	0.084	27%	0.271	C	S	.	.			trans	-75	141.3	172.4	-69.1	175	0	0	0	110.2	P159 P166 N167 N246 T247	P159-L169 HydrophobicContact CG-CD1 4.14Å; P159-L169 HydrophobicContact CG-CD2 4.42Å; P166-L169 HydrophobicContact CB-CD1 4.41Å; P166-L169 HydrophobicContact CB-CD2 3.86Å; P166-L169 HydrophobicContact CB-CG 4.08Å; P166-L169 HydrophobicContact CG-CD2 4.14Å; P166-L169 WeakPolarHBondContact O-CD1 3.36Å; P166-L169 VanDerWaalsContact O-CG 3.25Å; P166-L169 WeakPolarHBondContact O-CG 3.47Å; N167-L169 VanDerWaalsContact C-N 3.26Å; N167-L169 PolarHBondContact O-N 3.48Å; L169-N246 VanDerWaalsContact O-CA 3.28Å; L169-N246 WeakPolarHBondContact O-CA 3.39Å; L169-T247 HydrophobicContact CB-CG2 4.09Å; L169-T247 WeakPolarHBondContact CB-OG1 3.3Å; L169-T247 HydrophobicContact CD1-CG2 4.13Å; L169-T247 HydrophobicContact CG-CG2 4.47Å; L169-T247 PolarHBondContact N-OG1 3.44Å; L169-T247 PolarHBondContact O-N 3.36Å
170	D	83.8	Confident	85.5	Confident	94 Å²	94	49.7 Å²	49.7	50%	0.503	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	96.7	161.5	-170.6	11.2	0	0	0	106.7	N246	D170-N246 PolarHBondContact OD1-ND2 3.33Å
171	C	85.9	Confident	85.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.2	-173.4	-49.1	0	0	0	0	110.3	C145 F173 T244 I245	C145-C171 HydrophobicContact CB-CB 3.81Å; C145-C171 WeakPolarHBondContact CB-SG 3.37Å; C145-C171 WeakPolarHBondContact SG-CB 3.43Å; C145-C171 CovalentContact SG-SG 2.01Å; C145-C171 PolarHBondContact SG-SG 3.08Å; C171-F173 HydrophobicContact CB-CE2 4.41Å; C171-F173 HydrophobicContact CB-CZ 4.34Å; C171-T244 CarbonylContact O-C 3.6Å; C171-T244 WeakPolarHBondContact O-CA 3.36Å; C171-I245 HydrophobicContact CB-CG2 3.65Å; C171-I245 PolarHBondContact N-O 3.12Å; C171-I245 PolarHBondContact O-N 2.99Å
172	T	86.3	Confident	85.5	Confident	35 Å²	35	46 Å²	46	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.8	177	-51.1	0	0	0	0	110.4	S146 K147 M174 P216 L243	S146-T172 CarbonylContact C-O 3.57Å; S146-T172 WeakPolarHBondContact CA-O 3.39Å; S146-T172 WeakPolarHBondContact CB-O 3.48Å; S146-T172 PolarHBondContact OG-N 3.4Å; K147-T172 PolarHBondContact N-O 2.77Å; T172-M174 HydrophobicContact CG2-CG 4.11Å; T172-M174 HydrophobicContact CG2-SD 3.75Å; T172-P216 HydrophobicContact CG2-CG 4.06Å; T172-L243 CarbonylContact C-O 3.6Å; T172-L243 WeakPolarHBondContact CA-O 3.26Å
173	F	93.9	Very high	85.6	Confident	10 Å²	10	42.1 Å²	42.1	4%	0.044	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.9	172.3	-51.8	-77.1	0	0	0	109.1	C145 K147 F149 I156 C171 A242 L243 I245 F256	C145-F173 WeakPolarHBondContact O-CE1 3.22Å; K147-F173 HydrophobicContact CB-CD1 4.22Å; K147-F173 WeakPolarHBondContact O-CA 3.49Å; F149-F173 HydrophobicContact CE2-CB 4.27Å; F149-F173 HydrophobicContact CE2-CD1 4.23Å; I156-F173 HydrophobicContact CD1-CB 4.34Å; I156-F173 HydrophobicContact CG2-CB 3.98Å; I156-F173 HydrophobicContact CG2-CD1 3.87Å; I156-F173 HydrophobicContact CG2-CD2 3.81Å; I156-F173 HydrophobicContact CG2-CE1 4.29Å; I156-F173 HydrophobicContact CG2-CE2 4.23Å; I156-F173 HydrophobicContact CG2-CG 3.59Å; I156-F173 HydrophobicContact CG2-CZ 4.45Å; C171-F173 HydrophobicContact CB-CE2 4.41Å; C171-F173 HydrophobicContact CB-CZ 4.34Å; F173-A242 CarbonylContact O-C 3.56Å; F173-A242 WeakPolarHBondContact O-CA 3.4Å; F173-L243 HydrophobicContact CB-CB 4.33Å; F173-L243 HydrophobicContact CD2-CB 4.28Å; F173-L243 PolarHBondContact N-O 3.03Å; F173-L243 PolarHBondContact O-N 3.41Å; F173-I245 HydrophobicContact CE2-CG2 3.96Å; F173-F256 HydrophobicContact CD2-CZ 4.15Å; F173-F256 HydrophobicContact CE2-CE1 4.49Å; F173-F256 AromaticContact CE2-CZ 3.81Å; F173-F256 HydrophobicContact CE2-CZ 3.81Å
174	M	89.7	Confident	85.9	Confident	11 Å²	11	35.8 Å²	35.8	5%	0.054	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.1	-179.3	-60.9	-66	-63.4	0	0	110.1	K147 N148 F149 T172 F176 F215 P216 I240 A242	K147-M174 PolarHBondContact O-N 3.04Å; N148-M174 CarbonylContact C-O 3.49Å; N148-M174 WeakPolarHBondContact CA-O 3.44Å; N148-M174 WeakPolarHBondContact OD1-CB 2.96Å; F149-M174 PolarHBondContact N-O 2.71Å; T172-M174 HydrophobicContact CG2-CG 4.11Å; T172-M174 HydrophobicContact CG2-SD 3.75Å; M174-F176 HydrophobicContact CB-CD2 4.3Å; M174-F176 HydrophobicContact CB-CE2 3.5Å; M174-F176 HydrophobicContact CB-CZ 3.89Å; M174-F176 HydrophobicContact CE-CE1 4.47Å; M174-F176 HydrophobicContact CE-CZ 4.05Å; M174-F176 HydrophobicContact CG-CE2 4.44Å; M174-F176 HydrophobicContact CG-CZ 4.46Å; M174-F215 HydrophobicContact CE-CD1 3.56Å; M174-F215 HydrophobicContact CE-CE1 3.67Å; M174-F215 HydrophobicContact CE-CG 4.16Å; M174-F215 HydrophobicContact CE-CZ 4.34Å; M174-P216 HydrophobicContact SD-CG 4.43Å; M174-I240 HydrophobicContact CE-CG2 3.71Å; M174-A242 HydrophobicContact CE-CB 4.01Å; M174-A242 HydrophobicContact SD-CB 3.33Å; M174-A242 WeakPolarHBondContact SD-CB 3.47Å
175	I	95.8	Very high	86.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.6	173.4	-50.8	166	0	0	0	108.1	F149 I156 I183 L185 I240 L241 L243 F260	F149-I175 HydrophobicContact CB-CG1 4.42Å; I156-I175 HydrophobicContact CD1-CD1 3.64Å; I156-I175 HydrophobicContact CD1-CG1 3.86Å; I175-I183 HydrophobicContact CB-CD1 4.11Å; I175-I183 HydrophobicContact CD1-CG2 4.19Å; I175-I183 HydrophobicContact CG2-CD1 3.8Å; I175-I183 HydrophobicContact CG2-CG1 4.36Å; I175-I183 HydrophobicContact CG2-CG2 4.1Å; I175-L185 HydrophobicContact CD1-CD1 4.45Å; I175-I240 WeakPolarHBondContact O-CA 3.28Å; I175-L241 HydrophobicContact CB-CB 4.37Å; I175-L241 HydrophobicContact CD1-CB 4.35Å; I175-L241 HydrophobicContact CD1-CD2 4.17Å; I175-L241 HydrophobicContact CD1-CG 4.42Å; I175-L241 PolarHBondContact N-O 3.32Å; I175-L241 PolarHBondContact O-N 3.41Å; I175-L243 HydrophobicContact CD1-CD1 4.41Å; I175-F260 HydrophobicContact CD1-CB 3.91Å; I175-F260 HydrophobicContact CD1-CD1 3.94Å; I175-F260 HydrophobicContact CD1-CD2 4.23Å; I175-F260 HydrophobicContact CD1-CG 3.76Å; I175-F260 HydrophobicContact CG1-CD1 4.34Å; I175-F260 HydrophobicContact CG1-CE1 4.48Å; I175-F260 HydrophobicContact CG1-CG 4.42Å; I175-F260 HydrophobicContact CG2-CD2 3.73Å; I175-F260 HydrophobicContact CG2-CE2 3.65Å; I175-F260 HydrophobicContact CG2-CG 4.33Å; I175-F260 HydrophobicContact CG2-CZ 4.19Å
176	F	91.1	Very high	87.1	Confident	52 Å²	52	32.8 Å²	32.8	23%	0.228	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.3	176.7	-61.1	-86.1	0	0	0	109.2	N148 F149 T150 M174 F215 I240	N148-F176 HydrophobicContact CB-CD2 4.47Å; N148-F176 HydrophobicContact CB-CE2 4.06Å; F149-F176 PolarHBondContact O-N 3.16Å; T150-F176 HydrophobicContact CG2-CB 4.37Å; M174-F176 HydrophobicContact CB-CD2 4.3Å; M174-F176 HydrophobicContact CB-CE2 3.5Å; M174-F176 HydrophobicContact CB-CZ 3.89Å; M174-F176 HydrophobicContact CE-CE1 4.47Å; M174-F176 HydrophobicContact CE-CZ 4.05Å; M174-F176 HydrophobicContact CG-CE2 4.44Å; M174-F176 HydrophobicContact CG-CZ 4.46Å; F176-F215 AromaticContact CE1-CZ 3.93Å; F176-F215 HydrophobicContact CE1-CZ 3.93Å; F176-F215 HydrophobicContact CZ-CE1 4.47Å; F176-F215 HydrophobicContact CZ-CZ 4.27Å; F176-I240 HydrophobicContact CD1-CD1 4.04Å; F176-I240 HydrophobicContact CD1-CG1 3.99Å; F176-I240 HydrophobicContact CD1-CG2 4.39Å; F176-I240 HydrophobicContact CE1-CD1 4.03Å; F176-I240 HydrophobicContact CE1-CG1 4.35Å; F176-I240 HydrophobicContact CE1-CG2 4.21Å
177	A	89.4	Confident	87.7	Confident	4 Å²	4	32 Å²	32	3%	0.033	16%	0.163	C	C	.	.			trans	-77.3	129.5	178.5	0	0	0	0	0	111.2	K179 M180 S181 I183 G239 V262	A177-K179 PolarHBondContact O-N 3.09Å; A177-M180 PolarHBondContact O-N 2.64Å; A177-S181 VanDerWaalsContact CB-O 3.23Å; A177-S181 WeakPolarHBondContact CB-O 3.32Å; A177-I183 HydrophobicContact CB-CD1 3.97Å; A177-I183 HydrophobicContact CB-CG1 3.7Å; A177-G239 WeakPolarHBondContact CB-O 3.38Å; A177-G239 PolarHBondContact N-O 2.04Å; A177-V262 HydrophobicContact CB-CG1 3.74Å; A177-V262 HydrophobicContact CB-CG2 4.34Å
178	P	82.5	Confident	88.3	Confident	51 Å²	51	35.2 Å²	35.2	33%	0.331	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-54.1	139.8	170	-28.2	37	0	0	0	112	N152 M180 S181	N152-P178 WeakPolarHBondContact OD1-CG 3.36Å; P178-M180 PolarHBondContact O-N 3.27Å; P178-S181 PolarHBondContact O-N 2.79Å; P178-S181 PolarHBondContact O-OG 3.39Å
179	K	78.4	Confident	89.1	Confident	108 Å²	108	33.8 Å²	33.8	47%	0.47	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	57.8	12.1	-176.5	-49	-174.8	-177.4	-171.2	0	114.2	A177 R265 E584	A177-K179 PolarHBondContact O-N 3.09Å; K179-R265 PolarHBondContact O-NH1 3.05Å; K179-R265 PolarHBondContact O-NH2 3.2Å; K179-E584 IonicContact NZ-OE1 3.16Å; K179-E584 PolarHBondContact NZ-OE1 3.39Å
180	M	81.4	Confident	89.8	Confident	28 Å²	28	33.6 Å²	33.6	14%	0.138	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	60.1	40.3	-172.7	-42.6	-41.3	-60.9	0	0	113.1	A177 P178 G239 I240 R265 L439	A177-M180 PolarHBondContact O-N 2.64Å; P178-M180 PolarHBondContact O-N 3.27Å; M180-G239 WeakPolarHBondContact CE-O 3.46Å; M180-I240 HydrophobicContact CE-CD1 4.15Å; M180-I240 HydrophobicContact CE-CG1 3.61Å; M180-R265 PolarHBondContact O-NH2 3.05Å; M180-L439 HydrophobicContact CE-CD2 4.44Å
181	S	83	Confident	90.4	Very high	5 Å²	5	31.2 Å²	31.2	4%	0.035	16%	0.156	C	C	.	.			trans	-77.5	176.5	176.1	63.6	0	0	0	0	112.9	A177 P178 G239 V262 L263	A177-S181 VanDerWaalsContact CB-O 3.23Å; A177-S181 WeakPolarHBondContact CB-O 3.32Å; P178-S181 PolarHBondContact O-N 2.79Å; P178-S181 PolarHBondContact O-OG 3.39Å; S181-G239 WeakPolarHBondContact O-CA 3.21Å; S181-V262 WeakPolarHBondContact OG-CG1 3.48Å; S181-L263 WeakPolarHBondContact CB-O 3.46Å; S181-L263 PolarHBondContact OG-O 3.32Å; S181-L263 VanDerWaalsContact OG-O 3.07Å
182	E	87.9	Confident	90.9	Very high	14 Å²	14	31.2 Å²	31.2	7%	0.065	16%	0.156	C	C	.	.			trans	-74.3	137.2	-175.4	-62.8	-177.4	176.6	0	0	111.3	S236 Y237 V262 L263 K423 S425	E182-S236 WeakPolarHBondContact CA-O 3.5Å; E182-Y237 HydrophobicContact CG-CD1 4.13Å; E182-V262 WeakPolarHBondContact O-CA 3.23Å; E182-L263 HydrophobicContact CB-CD1 4.46Å; E182-L263 PolarHBondContact O-N 2.82Å; E182-K423 WeakPolarHBondContact OE1-CD 3.27Å; E182-K423 IonicContact OE1-NZ 2.66Å; E182-K423 IonicContact OE2-NZ 3.63Å; E182-K423 PolarHBondContact OE2-NZ 3.25Å; E182-S425 PolarHBondContact OE1-OG 3.39Å
183	I	93.2	Very high	91.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.1	176.1	-53.5	163.8	0	0	0	107.7	I175 A177 I235 S236 L241 F260 V262	I175-I183 HydrophobicContact CB-CD1 4.11Å; I175-I183 HydrophobicContact CD1-CG2 4.19Å; I175-I183 HydrophobicContact CG2-CD1 3.8Å; I175-I183 HydrophobicContact CG2-CG1 4.36Å; I175-I183 HydrophobicContact CG2-CG2 4.1Å; A177-I183 HydrophobicContact CB-CD1 3.97Å; A177-I183 HydrophobicContact CB-CG1 3.7Å; I183-I235 CarbonylContact O-C 3.57Å; I183-I235 WeakPolarHBondContact O-CA 3.42Å; I183-S236 PolarHBondContact N-O 2.82Å; I183-S236 VanDerWaalsContact N-O 3.12Å; I183-S236 PolarHBondContact O-N 3.22Å; I183-L241 HydrophobicContact CB-CD2 4.49Å; I183-L241 HydrophobicContact CD1-CB 3.83Å; I183-L241 HydrophobicContact CG2-CD2 4Å; I183-F260 HydrophobicContact CG2-CB 4.3Å; I183-F260 HydrophobicContact CG2-CD2 4.41Å; I183-V262 HydrophobicContact CG1-CG2 4.37Å
184	I	93.9	Very high	91.3	Very high	11 Å²	11	32.5 Å²	32.5	6%	0.056	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.6	168.6	-63.1	159	0	0	0	107.6	E186 R233 I234 F260 T261 L263	I184-E186 HydrophobicContact CG2-CG 4.05Å; I184-R233 HydrophobicContact CG2-CG 4.23Å; I184-I234 WeakPolarHBondContact CA-O 3.22Å; I184-F260 CarbonylContact O-C 3.53Å; I184-F260 WeakPolarHBondContact O-CA 3.43Å; I184-T261 PolarHBondContact N-O 2.95Å; I184-T261 PolarHBondContact O-N 3.2Å; I184-L263 HydrophobicContact CD1-CD1 3.66Å; I184-L263 HydrophobicContact CD1-CD2 3.77Å; I184-L263 HydrophobicContact CD1-CG 3.71Å; I184-L263 HydrophobicContact CG1-CD1 4.4Å; I184-L263 HydrophobicContact CG1-CG 4.46Å
185	L	95.9	Very high	91.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.3	175.1	177.2	81.6	0	0	0	109	I156 I175 F187 I234 L241 L243 A258 N259 F260	I156-L185 HydrophobicContact CD1-CD1 4.47Å; I175-L185 HydrophobicContact CD1-CD1 4.45Å; L185-F187 HydrophobicContact CD2-CE2 3.58Å; L185-F187 HydrophobicContact CD2-CZ 3.96Å; L185-F187 HydrophobicContact CG-CE2 4.12Å; L185-I234 HydrophobicContact CB-CB 4.29Å; L185-I234 HydrophobicContact CD2-CB 4.45Å; L185-I234 PolarHBondContact N-O 2.79Å; L185-I234 PolarHBondContact O-N 2.86Å; L185-L241 HydrophobicContact CB-CD2 3.84Å; L185-L241 HydrophobicContact CD2-CD2 4.09Å; L185-L241 HydrophobicContact CG-CD2 4.49Å; L185-L243 HydrophobicContact CD2-CD1 4.09Å; L185-L243 HydrophobicContact CD2-CD2 3.92Å; L185-L243 HydrophobicContact CD2-CG 4.3Å; L185-A258 HydrophobicContact CD1-CB 3.82Å; L185-A258 HydrophobicContact CG-CB 4.37Å; L185-N259 WeakPolarHBondContact CA-O 3.26Å; L185-F260 HydrophobicContact CD1-CB 3.94Å
186	E	94.9	Very high	90.9	Very high	80 Å²	80	38.4 Å²	38.4	37%	0.374	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.5	179.3	-67.1	176.1	177.1	0	0	110.2	I184 R233 A258 N259	I184-E186 HydrophobicContact CG2-CG 4.05Å; E186-R233 HydrophobicContact CG-CB 4.21Å; E186-R233 HydrophobicContact CG-CG 3.87Å; E186-R233 WeakPolarHBondContact OE1-CD 3.33Å; E186-R233 IonicContact OE1-NE 2.83Å; E186-R233 PolarHBondContact OE1-NE 3.34Å; E186-A258 CarbonylContact O-C 3.52Å; E186-A258 WeakPolarHBondContact O-CA 3.37Å; E186-A258 WeakPolarHBondContact O-CB 3.2Å; E186-N259 PolarHBondContact N-O 3.4Å; E186-N259 PolarHBondContact O-N 3.15Å
187	F	95.3	Very high	90.6	Very high	24 Å²	24	41 Å²	41	11%	0.105	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	121.4	178.4	-74.5	-98.2	0	0	0	110.7	L185 F190 L209 I211 P231 L243 F256 A258	L185-F187 HydrophobicContact CD2-CE2 3.58Å; L185-F187 HydrophobicContact CD2-CZ 3.96Å; L185-F187 HydrophobicContact CG-CE2 4.12Å; F187-F190 HydrophobicContact CD1-CB 4.46Å; F187-F190 AromaticContact CD1-CD2 3.96Å; F187-F190 HydrophobicContact CD1-CD2 3.96Å; F187-F190 HydrophobicContact CE1-CD2 4.04Å; F187-L209 HydrophobicContact CE1-CD2 3.56Å; F187-L209 HydrophobicContact CZ-CD2 3.6Å; F187-I211 HydrophobicContact CE2-CD1 3.96Å; F187-I211 HydrophobicContact CZ-CD1 3.87Å; F187-P231 HydrophobicContact CD1-CG 4.37Å; F187-P231 HydrophobicContact CD2-CB 3.82Å; F187-P231 HydrophobicContact CD2-CG 3.82Å; F187-P231 HydrophobicContact CE1-CG 4.13Å; F187-P231 HydrophobicContact CE2-CB 3.64Å; F187-P231 HydrophobicContact CE2-CG 3.55Å; F187-P231 HydrophobicContact CG-CG 4.24Å; F187-P231 HydrophobicContact CZ-CB 4.3Å; F187-P231 HydrophobicContact CZ-CG 3.72Å; F187-L243 HydrophobicContact CZ-CD2 4.17Å; F187-F256 HydrophobicContact CD1-CB 4.31Å; F187-F256 HydrophobicContact CD1-CD2 4.33Å; F187-F256 HydrophobicContact CE1-CB 4.3Å; F187-F256 AromaticContact CE1-CD2 3.8Å; F187-F256 HydrophobicContact CE1-CD2 3.8Å; F187-F256 HydrophobicContact CE1-CE2 4.42Å; F187-F256 HydrophobicContact CE1-CG 4.19Å; F187-A258 HydrophobicContact CD1-CB 3.87Å; F187-A258 HydrophobicContact CD2-CB 4.43Å; F187-A258 HydrophobicContact CE1-CB 3.99Å; F187-A258 HydrophobicContact CG-CB 4.1Å; F187-A258 HydrophobicContact CZ-CB 4.31Å
188	E	93.6	Very high	90.4	Very high	123 Å²	123	43.7 Å²	43.7	58%	0.575	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	-39.9	174.7	-64	174.2	172	0	0	111.2	S257 N259	E188-S257 PolarHBondContact N-O 2.78Å; E188-S257 PolarHBondContact OE2-OG 2.76Å; E188-N259 PolarHBondContact OE1-ND2 2.76Å; E188-N259 VanDerWaalsContact OE1-ND2 3.09Å
189	S	94.4	Very high	90.5	Very high	43 Å²	43	44.5 Å²	44.5	30%	0.301	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	143.7	176.3	-179.5	0	0	0	0	109.9	F256 S257	S189-F256 VanDerWaalsContact O-CA 3.27Å; S189-F256 WeakPolarHBondContact O-CA 3.4Å; S189-F256 WeakPolarHBondContact O-CB 3.31Å; S189-S257 PolarHBondContact N-O 3.41Å; S189-S257 PolarHBondContact O-N 3.13Å
190	F	96.5	Very high	90.7	Very high	13 Å²	13	46.7 Å²	46.7	6%	0.057	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	110.7	179.3	-174.4	-91.8	0	0	0	110.6	F187 L192 L209 G227 N229 P231 F256	F187-F190 HydrophobicContact CD1-CB 4.46Å; F187-F190 AromaticContact CD1-CD2 3.96Å; F187-F190 HydrophobicContact CD1-CD2 3.96Å; F187-F190 HydrophobicContact CE1-CD2 4.04Å; F190-L192 HydrophobicContact CE1-CG 4.44Å; F190-L192 HydrophobicContact CE2-CD1 3.99Å; F190-L192 HydrophobicContact CE2-CG 4.14Å; F190-L192 HydrophobicContact CZ-CD1 3.7Å; F190-L192 HydrophobicContact CZ-CG 3.88Å; F190-L209 HydrophobicContact CD2-CD2 4.41Å; F190-L209 HydrophobicContact CE2-CB 4.03Å; F190-L209 HydrophobicContact CE2-CD2 3.74Å; F190-L209 HydrophobicContact CZ-CB 4.36Å; F190-G227 WeakPolarHBondContact CE1-O 3.09Å; F190-N229 WeakPolarHBondContact CE1-O 3.33Å; F190-P231 HydrophobicContact CE2-CG 4.48Å; F190-F256 HydrophobicContact CD2-CB 3.75Å; F190-F256 HydrophobicContact CE2-CB 4.44Å
191	E	96.1	Very high	90.5	Very high	43 Å²	43	49 Å²	49	20%	0.201	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	107	169.3	-170.1	176	156.1	0	0	110.5	G227 Q228 K253 G255	E191-G227 WeakPolarHBondContact CA-O 3.25Å; E191-Q228 HydrophobicContact CG-CG 4.05Å; E191-Q228 PolarHBondContact OE2-NE2 2.89Å; E191-K253 HydrophobicContact CG-CB 4.06Å; E191-K253 HydrophobicContact CG-CG 4.25Å; E191-K253 VanDerWaalsContact O-CB 3.25Å; E191-K253 WeakPolarHBondContact O-CB 3.48Å; E191-K253 IonicContact OE1-NZ 3.78Å; E191-K253 PolarHBondContact OE1-NZ 3.28Å; E191-G255 PolarHBondContact N-O 2.86Å; E191-G255 VanDerWaalsContact O-CA 3.28Å; E191-G255 WeakPolarHBondContact O-CA 3.33Å; E191-G255 PolarHBondContact O-N 2.89Å
192	L	96.1	Very high	90.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	32%	0.315	C	S	.	.			trans	-109.7	171.1	168.2	-62	-176	0	0	0	110.4	Y165 F190 P194 D207 L209 G227 I245	Y165-L192 HydrophobicContact CD1-CD2 4.18Å; Y165-L192 HydrophobicContact CE1-CD2 3.51Å; F190-L192 HydrophobicContact CE1-CG 4.44Å; F190-L192 HydrophobicContact CE2-CD1 3.99Å; F190-L192 HydrophobicContact CE2-CG 4.14Å; F190-L192 HydrophobicContact CZ-CD1 3.7Å; F190-L192 HydrophobicContact CZ-CG 3.88Å; L192-P194 WeakPolarHBondContact O-CD 3.1Å; L192-D207 HydrophobicContact CB-CB 4.28Å; L192-L209 HydrophobicContact CD1-CB 3.97Å; L192-G227 PolarHBondContact N-O 2.91Å; L192-G227 WeakPolarHBondContact O-CA 3.13Å; L192-G227 PolarHBondContact O-N 2.89Å; L192-I245 HydrophobicContact CD2-CD1 3.97Å
193	E	95.3	Very high	90.4	Very high	16 Å²	16	56.4 Å²	56.4	8%	0.075	33%	0.334	C	S	.	.			trans	-56.7	126.4	170.9	-172.3	-179.5	-171.4	0	0	110.7	Y165 Y206 D207 G227 I251	Y165-E193 PolarHBondContact OH-N 2.02Å; E193-Y206 HydrophobicContact CG-CD2 4.47Å; E193-Y206 WeakPolarHBondContact OE2-CB 3.37Å; E193-D207 HydrophobicContact CB-CB 3.86Å; E193-D207 VanDerWaalsContact CB-OD2 3.23Å; E193-D207 WeakPolarHBondContact CB-OD2 3.47Å; E193-G227 PolarHBondContact O-N 2.79Å; E193-I251 HydrophobicContact CG-CB 4.33Å; E193-I251 HydrophobicContact CG-CG2 3.9Å; E193-I251 WeakPolarHBondContact OE1-CB 3.36Å; E193-I251 WeakPolarHBondContact OE1-CD1 3.35Å
194	P	93.6	Very high	90.3	Very high	56 Å²	56	56.8 Å²	56.8	36%	0.364	34%	0.337	S	S	.	.			trans	-82.4	142.9	178.5	31.9	-33.4	0	0	0	112	L192 T196	L192-P194 WeakPolarHBondContact O-CD 3.1Å; P194-T196 HydrophobicContact CB-CG2 4.4Å; P194-T196 HydrophobicContact CG-CG2 4.36Å; P194-T196 PolarHBondContact O-N 3.48Å
195	D	90.6	Very high	90.2	Very high	21 Å²	21	60.6 Å²	60.6	11%	0.112	35%	0.35	C	S	.	.			trans	-92.3	96.3	167	-165.8	-8	0	0	0	109.8	C204 R205 Y206	D195-C204 PolarHBondContact OD2-N 3.31Å; D195-R205 IonicContact OD1-CZ 3.63Å; D195-R205 IonicContact OD1-NE 3.65Å; D195-R205 IonicContact OD1-NH2 2.81Å; D195-R205 PolarHBondContact OD1-NH2 2.8Å; D195-R205 WeakPolarHBondContact OD2-CG 3.34Å; D195-R205 IonicContact OD2-CZ 2.8Å; D195-R205 PolarHBondContact OD2-N 3.37Å; D195-R205 IonicContact OD2-NE 2.76Å; D195-R205 PolarHBondContact OD2-NE 2.84Å; D195-R205 IonicContact OD2-NH2 3.42Å; D195-Y206 HydrophobicContact CB-CD2 4.49Å
196	T	85.8	Confident	89.9	Confident	114 Å²	114	64.3 Å²	64.3	70%	0.699	37%	0.365	S	S	*	.	S	Bend	trans	-83.2	-20.8	-172.8	54.2	0	0	0	0	114.3	P194 P198	P194-T196 HydrophobicContact CB-CG2 4.4Å; P194-T196 HydrophobicContact CG-CG2 4.36Å; P194-T196 PolarHBondContact O-N 3.48Å; T196-P198 VanDerWaalsContact C-CD 3.4Å
197	T	85.7	Confident	89.9	Confident	106 Å²	106	60.5 Å²	60.5	65%	0.65	35%	0.347	S	S	*	.	S	Bend	trans	-134.1	60.3	-178.2	48.4	0	0	0	0	111.9	R205	T197-R205 PolarHBondContact O-NH2 2.91Å; T197-R205 VanDerWaalsContact O-NH2 3.08Å
198	P	84.8	Confident	89.9	Confident	62 Å²	62	62.3 Å²	62.3	40%	0.403	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.9	137.5	179.3	23.1	-29.5	0	0	0	112.4	T196 V202	T196-P198 VanDerWaalsContact C-CD 3.4Å; P198-V202 WeakPolarHBondContact CB-O 3.26Å
199	P	84.7	Confident	90	Very high	68 Å²	68	56.5 Å²	56.5	44%	0.442	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-59.4	152.6	161.2	-19.5	31.2	0	0	0	111.3	G201 V202 R205	P199-G201 PolarHBondContact O-N 3.36Å; P199-G201 VanDerWaalsContact O-N 3.15Å; P199-V202 PolarHBondContact O-N 2.68Å; P199-V202 VanDerWaalsContact O-N 3.09Å; P199-V202 VanDerWaalsContact O-O 3.12Å; P199-R205 VanDerWaalsContact CD-CZ 3.49Å
200	T	81.4	Confident	90	Very high	153 Å²	153	55.6 Å²	55.6	94%	0.939	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	121.8	179.5	-45.9	0	0	0	0	111.3
201	G	78	Confident	90	Very high	76 Å²	76	55 Å²	55	78%	0.784	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-1.5	177.5	0	0	0	0	0	115.7	P199	P199-G201 PolarHBondContact O-N 3.36Å; P199-G201 VanDerWaalsContact O-N 3.15Å
202	V	82.4	Confident	89.8	Confident	67 Å²	67	54.9 Å²	54.9	41%	0.406	31%	0.312	S	S	.	.			trans	-124.7	129.7	176.3	-172	0	0	0	0	109.1	P198 P199 R205	P198-V202 WeakPolarHBondContact CB-O 3.26Å; P199-V202 PolarHBondContact O-N 2.68Å; P199-V202 VanDerWaalsContact O-N 3.09Å; P199-V202 VanDerWaalsContact O-O 3.12Å; V202-R205 HydrophobicContact CG1-CG 3.48Å; V202-R205 VanDerWaalsContact CG1-CG 3.48Å
203	F	87.4	Confident	89.7	Confident	108 Å²	108	55.1 Å²	55.1	47%	0.474	31%	0.314	S	S	.	.			trans	-142.7	156.6	178.2	61.6	-80.4	0	0	0	110.8	R224	F203-R224 HydrophobicContact CD2-CB 4.5Å; F203-R224 HydrophobicContact CE2-CB 3.71Å; F203-R224 HydrophobicContact CE2-CG 4.43Å; F203-R224 HydrophobicContact CZ-CB 4.19Å; F203-R224 WeakPolarHBondContact O-CD 3.08Å; F203-R224 PolarHBondContact O-NH1 2.89Å
204	C	90.9	Very high	89.4	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.054	31%	0.31	C	S	.	.			trans	55	55.2	-176.7	-56.8	0	0	0	0	112.4	D195 R208 R224 C226	D195-C204 PolarHBondContact OD2-N 3.31Å; C204-R208 HydrophobicContact CB-CB 4.03Å; C204-R224 HydrophobicContact CB-CG 3.87Å; C204-C226 WeakPolarHBondContact CA-SG 3.43Å; C204-C226 HydrophobicContact CB-CB 3.5Å; C204-C226 WeakPolarHBondContact CB-SG 3.36Å; C204-C226 WeakPolarHBondContact SG-CB 3.25Å; C204-C226 PolarHBondContact SG-N 3.4Å; C204-C226 VanDerWaalsContact SG-N 3.4Å; C204-C226 CovalentContact SG-SG 2.03Å; C204-C226 PolarHBondContact SG-SG 2.88Å
205	R	90.3	Very high	88.9	Confident	91 Å²	91	54.8 Å²	54.8	34%	0.343	31%	0.306	S	S	.	.			trans	-74.7	-31.3	-176.6	-69.8	175.8	-65.6	156.7	0.7	114.6	D195 T197 P199 V202	D195-R205 IonicContact OD1-CZ 3.63Å; D195-R205 IonicContact OD1-NE 3.65Å; D195-R205 IonicContact OD1-NH2 2.81Å; D195-R205 PolarHBondContact OD1-NH2 2.8Å; D195-R205 WeakPolarHBondContact OD2-CG 3.34Å; D195-R205 IonicContact OD2-CZ 2.8Å; D195-R205 PolarHBondContact OD2-N 3.37Å; D195-R205 IonicContact OD2-NE 2.76Å; D195-R205 PolarHBondContact OD2-NE 2.84Å; D195-R205 IonicContact OD2-NH2 3.42Å; T197-R205 PolarHBondContact O-NH2 2.91Å; T197-R205 VanDerWaalsContact O-NH2 3.08Å; P199-R205 VanDerWaalsContact CD-CZ 3.49Å; V202-R205 HydrophobicContact CG1-CG 3.48Å; V202-R205 VanDerWaalsContact CG1-CG 3.48Å
206	Y	90.6	Very high	88.5	Confident	78 Å²	78	56 Å²	56	31%	0.306	32%	0.315	S	S	.	.	S	Bend	trans	-84.3	-95.6	-178.1	-45.9	-64.9	0	0	0	109	E193 D195	E193-Y206 HydrophobicContact CG-CD2 4.47Å; E193-Y206 WeakPolarHBondContact OE2-CB 3.37Å; D195-Y206 HydrophobicContact CB-CD2 4.49Å
207	D	94.5	Very high	88.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	31%	0.313	C	S	.	.	S	Bend	trans	-92	137.5	175.2	-58.7	-21.1	0	0	0	111.8	Y165 L192 E193 C226 N246 T247 D248	Y165-D207 WeakPolarHBondContact CE2-OD2 3.23Å; Y165-D207 PolarHBondContact OH-OD2 2.79Å; L192-D207 HydrophobicContact CB-CB 4.28Å; E193-D207 HydrophobicContact CB-CB 3.86Å; E193-D207 VanDerWaalsContact CB-OD2 3.23Å; E193-D207 WeakPolarHBondContact CB-OD2 3.47Å; D207-C226 WeakPolarHBondContact O-CB 3.44Å; D207-N246 WeakPolarHBondContact CA-O 3.36Å; D207-T247 HydrophobicContact CB-CG2 4.39Å; D207-T247 WeakPolarHBondContact OD1-CA 3.42Å; D207-T247 VanDerWaalsContact OD1-CB 3.24Å; D207-T247 WeakPolarHBondContact OD1-CB 3.18Å; D207-D248 PolarHBondContact OD1-N 3.03Å
208	R	95	Very high	87.8	Confident	62 Å²	62	51.1 Å²	51.1	23%	0.234	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148.4	-179.5	63	-175.3	-179.1	-75.5	-5.9	112.5	C204 E210 R224 Y225 I245 N246	C204-R208 HydrophobicContact CB-CB 4.03Å; R208-E210 IonicContact NE-OE1 2.72Å; R208-R224 HydrophobicContact CB-CG 3.84Å; R208-Y225 WeakPolarHBondContact CA-O 3Å; R208-I245 WeakPolarHBondContact O-CA 3.46Å; R208-N246 HydrophobicContact CG-CB 4.1Å; R208-N246 PolarHBondContact N-O 3.2Å; R208-N246 PolarHBondContact NH2-OD1 2.94Å; R208-N246 PolarHBondContact O-N 3.22Å
209	L	96.2	Very high	87.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.6	163.9	-174.1	68.1	0	0	0	108.8	F187 F190 L192 I211 R224 Y225 L243 T244 I245 F256	F187-L209 HydrophobicContact CE1-CD2 3.56Å; F187-L209 HydrophobicContact CZ-CD2 3.6Å; F190-L209 HydrophobicContact CD2-CD2 4.41Å; F190-L209 HydrophobicContact CE2-CB 4.03Å; F190-L209 HydrophobicContact CE2-CD2 3.74Å; F190-L209 HydrophobicContact CZ-CB 4.36Å; L192-L209 HydrophobicContact CD1-CB 3.97Å; L209-I211 HydrophobicContact CD2-CD1 4.36Å; L209-I211 HydrophobicContact CD2-CG1 4.48Å; L209-I211 HydrophobicContact CG-CG1 4.32Å; L209-R224 CarbonylContact O-C 3.53Å; L209-R224 WeakPolarHBondContact O-CA 2.93Å; L209-Y225 PolarHBondContact N-O 3.32Å; L209-Y225 PolarHBondContact O-N 2.98Å; L209-L243 HydrophobicContact CD1-CB 4.15Å; L209-T244 CarbonylContact C-O 3.41Å; L209-T244 WeakPolarHBondContact CA-O 3.43Å; L209-I245 HydrophobicContact CD1-CB 4.03Å; L209-F256 HydrophobicContact CD1-CD1 4.41Å; L209-F256 HydrophobicContact CD1-CE1 3.7Å; L209-F256 HydrophobicContact CD1-CZ 3.89Å; L209-F256 HydrophobicContact CD2-CD1 4.3Å; L209-F256 HydrophobicContact CD2-CE1 4.28Å; L209-F256 HydrophobicContact CD2-CG 4.47Å; L209-F256 HydrophobicContact CD2-CZ 4.43Å
210	E	94.8	Very high	87.8	Confident	25 Å²	25	46.3 Å²	46.3	12%	0.117	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.5	174	-65	-170.7	153.9	0	0	110.1	R208 Y221 G223 R224 L243 T244	R208-E210 IonicContact NE-OE1 2.72Å; E210-Y221 HydrophobicContact CB-CE2 4.33Å; E210-G223 WeakPolarHBondContact CA-O 3.42Å; E210-R224 HydrophobicContact CG-CG 4.16Å; E210-R224 IonicContact OE1-CZ 3.07Å; E210-R224 IonicContact OE1-NE 2.65Å; E210-R224 PolarHBondContact OE1-NE 2.91Å; E210-R224 IonicContact OE1-NH2 2.68Å; E210-R224 PolarHBondContact OE1-NH2 3.3Å; E210-L243 CarbonylContact O-C 3.58Å; E210-L243 WeakPolarHBondContact O-CA 3.44Å; E210-T244 PolarHBondContact N-O 3.16Å; E210-T244 PolarHBondContact O-N 3.02Å
211	I	95.8	Very high	88.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.8	-178	-50	-177.8	0	0	0	109.6	F187 L209 I222 G223 Y225 P231 I234 L241 A242 L243	F187-I211 HydrophobicContact CE2-CD1 3.96Å; F187-I211 HydrophobicContact CZ-CD1 3.87Å; L209-I211 HydrophobicContact CD2-CD1 4.36Å; L209-I211 HydrophobicContact CD2-CG1 4.48Å; L209-I211 HydrophobicContact CG-CG1 4.32Å; I211-I222 HydrophobicContact CB-CB 4.23Å; I211-I222 HydrophobicContact CG2-CB 4.3Å; I211-I222 HydrophobicContact CG2-CD1 3.78Å; I211-I222 WeakPolarHBondContact O-CB 3.21Å; I211-I222 PolarHBondContact O-N 3.28Å; I211-G223 PolarHBondContact N-O 3.37Å; I211-G223 PolarHBondContact O-N 2.86Å; I211-Y225 HydrophobicContact CD1-CD2 4.09Å; I211-Y225 HydrophobicContact CD1-CE2 3.83Å; I211-Y225 HydrophobicContact CG1-CD2 4.26Å; I211-Y225 HydrophobicContact CG1-CE2 4.09Å; I211-P231 HydrophobicContact CD1-CB 4.11Å; I211-P231 HydrophobicContact CD1-CG 4.11Å; I211-I234 HydrophobicContact CD1-CG1 4.42Å; I211-I234 HydrophobicContact CG2-CG2 4.49Å; I211-L241 HydrophobicContact CG2-CD1 3.61Å; I211-A242 WeakPolarHBondContact CA-O 3.36Å; I211-L243 HydrophobicContact CG1-CG 4.35Å
212	W	92.1	Very high	88.7	Confident	40 Å²	40	42.8 Å²	42.8	15%	0.152	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.3	-177.6	-56.2	82.5	0	0	0	110.5	G214 P216 Y221 L241 A242	W212-G214 PolarHBondContact O-N 2.74Å; W212-P216 HydrophobicContact CG-CB 4.44Å; W212-Y221 AromaticContact CD2-CD2 3.68Å; W212-Y221 HydrophobicContact CD2-CD2 3.68Å; W212-Y221 HydrophobicContact CD2-CE2 4.39Å; W212-Y221 AromaticContact CE2-CD2 3.54Å; W212-Y221 AromaticContact CE2-CE2 3.83Å; W212-Y221 AromaticContact CE3-CD2 3.7Å; W212-Y221 HydrophobicContact CE3-CD2 3.7Å; W212-Y221 HydrophobicContact CE3-CG 4.33Å; W212-Y221 AromaticContact CH2-CD2 3.46Å; W212-Y221 HydrophobicContact CH2-CD2 3.46Å; W212-Y221 VanDerWaalsContact CH2-CD2 3.46Å; W212-Y221 HydrophobicContact CH2-CE2 4.07Å; W212-Y221 HydrophobicContact CH2-CG 4.15Å; W212-Y221 AromaticContact CZ2-CD2 3.43Å; W212-Y221 HydrophobicContact CZ2-CD2 3.43Å; W212-Y221 VanDerWaalsContact CZ2-CD2 3.43Å; W212-Y221 AromaticContact CZ2-CE2 3.66Å; W212-Y221 HydrophobicContact CZ2-CE2 3.66Å; W212-Y221 AromaticContact CZ3-CD2 3.6Å; W212-Y221 HydrophobicContact CZ3-CD2 3.6Å; W212-Y221 HydrophobicContact CZ3-CG 4.06Å; W212-L241 VanDerWaalsContact O-CD1 3.29Å; W212-L241 WeakPolarHBondContact O-CD1 3.35Å; W212-A242 HydrophobicContact CB-CB 4.29Å; W212-A242 PolarHBondContact N-O 2.93Å; W212-A242 PolarHBondContact O-N 3.15Å
213	D	93.3	Very high	89	Confident	6 Å²	6	40 Å²	40	3%	0.032	20%	0.203	C	C	.	.	S	Bend	trans	-80.8	61	171.1	-168.8	-0.5	0	0	0	109.9	P220 I222 S236 Y237 T238 I240	D213-P220 HydrophobicContact CB-CB 4.39Å; D213-P220 PolarHBondContact N-O 2.86Å; D213-P220 WeakPolarHBondContact O-CD 3.28Å; D213-I222 HydrophobicContact CB-CD1 3.9Å; D213-I222 HydrophobicContact CB-CG1 4.27Å; D213-S236 VanDerWaalsContact OD1-CB 3.23Å; D213-S236 WeakPolarHBondContact OD1-CB 3.38Å; D213-S236 PolarHBondContact OD1-OG 3.08Å; D213-Y237 PolarHBondContact OD1-N 2.81Å; D213-Y237 PolarHBondContact OD2-N 3.15Å; D213-T238 WeakPolarHBondContact O-CG2 3.46Å; D213-T238 PolarHBondContact O-OG1 2.7Å; D213-T238 VanDerWaalsContact O-OG1 3.09Å; D213-T238 WeakPolarHBondContact OD1-CB 3.1Å; D213-T238 WeakPolarHBondContact OD1-CG2 3.5Å; D213-T238 PolarHBondContact OD1-N 2.94Å; D213-T238 PolarHBondContact OD1-OG1 2.89Å; D213-I240 CarbonylContact C-O 3.49Å; D213-I240 VanDerWaalsContact C-O 3.3Å
214	G	89.2	Confident	89.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	153.7	-160.7	-175	0	0	0	0	0	110.9	W212 I240 A242 S437	W212-G214 PolarHBondContact O-N 2.74Å; G214-I240 PolarHBondContact N-O 2.78Å; G214-A242 VanDerWaalsContact O-CB 3.24Å; G214-A242 WeakPolarHBondContact O-CB 3.18Å; G214-S437 CarbonylContact C-O 3.59Å; G214-S437 WeakPolarHBondContact CA-O 3.21Å
215	F	84.1	Confident	89.4	Confident	64 Å²	64	40.3 Å²	40.3	28%	0.281	20%	0.2	S	C	.	.	S	Bend	trans	-68.3	140.4	171.4	-76.9	-86	0	0	0	110.9	M174 F176 G217 V218 G219 I240 S437 L439	M174-F215 HydrophobicContact CE-CD1 3.56Å; M174-F215 HydrophobicContact CE-CE1 3.67Å; M174-F215 HydrophobicContact CE-CG 4.16Å; M174-F215 HydrophobicContact CE-CZ 4.34Å; F176-F215 AromaticContact CE1-CZ 3.93Å; F176-F215 HydrophobicContact CE1-CZ 3.93Å; F176-F215 HydrophobicContact CZ-CE1 4.47Å; F176-F215 HydrophobicContact CZ-CZ 4.27Å; F215-G217 PolarHBondContact O-N 3.07Å; F215-V218 HydrophobicContact CB-CB 4.4Å; F215-V218 PolarHBondContact O-N 2.97Å; F215-V218 VanDerWaalsContact O-N 3.1Å; F215-G219 PolarHBondContact O-N 2.9Å; F215-I240 HydrophobicContact CD2-CD1 4.2Å; F215-I240 HydrophobicContact CE2-CD1 3.62Å; F215-I240 HydrophobicContact CZ-CD1 4.37Å; F215-S437 WeakPolarHBondContact CD2-O 3.35Å; F215-S437 PolarHBondContact N-O 3.42Å; F215-L439 HydrophobicContact CE2-CB 4.2Å; F215-L439 HydrophobicContact CE2-CD1 4.17Å
216	P	81.8	Confident	89.6	Confident	47 Å²	47	36.5 Å²	36.5	31%	0.305	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	135.6	176.1	-24.9	34	0	0	0	112	T172 M174 W212 V218 A242	T172-P216 HydrophobicContact CG2-CG 4.06Å; M174-P216 HydrophobicContact SD-CG 4.43Å; W212-P216 HydrophobicContact CG-CB 4.44Å; P216-V218 PolarHBondContact O-N 3.04Å; P216-A242 HydrophobicContact CG-CB 3.73Å
217	G	76.8	Confident	89.8	Confident	62 Å²	62	33.1 Å²	33.1	64%	0.639	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	-10.4	-178.9	0	0	0	0	0	115.6	F215	F215-G217 PolarHBondContact O-N 3.07Å
218	V	80	Confident	89.7	Confident	55 Å²	55	39.6 Å²	39.6	33%	0.333	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-51.3	-179.4	-175.1	0	0	0	0	112	F215 P216 G438 T464	F215-V218 HydrophobicContact CB-CB 4.4Å; F215-V218 PolarHBondContact O-N 2.97Å; F215-V218 VanDerWaalsContact O-N 3.1Å; P216-V218 PolarHBondContact O-N 3.04Å; V218-G438 VanDerWaalsContact CG1-CA 3.49Å; V218-T464 VanDerWaalsContact O-CG2 3.29Å; V218-T464 WeakPolarHBondContact O-CG2 3.36Å
219	G	80.7	Confident	89.2	Confident	4 Å²	4	42.6 Å²	42.6	4%	0.041	23%	0.227	C	C	.	.	S	Bend	trans	-69.9	168.1	-178.1	0	0	0	0	0	113.4	F215 Y221 V436	F215-G219 PolarHBondContact O-N 2.9Å; G219-Y221 PolarHBondContact O-N 2.99Å; G219-V436 WeakPolarHBondContact CA-O 3.25Å
220	P	88.5	Confident	88.8	Confident	25 Å²	25	46.3 Å²	46.3	16%	0.162	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-53.4	125	171.5	-27.7	34.5	0	0	0	112.6	D213 I222 V436 T464	D213-P220 HydrophobicContact CB-CB 4.39Å; D213-P220 PolarHBondContact N-O 2.86Å; D213-P220 WeakPolarHBondContact O-CD 3.28Å; P220-I222 PolarHBondContact O-N 3Å; P220-V436 HydrophobicContact CG-CG1 3.64Å; P220-T464 HydrophobicContact CG-CG2 3.93Å
221	Y	88.2	Confident	88.3	Confident	99 Å²	99	45.8 Å²	45.8	39%	0.388	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.8	175.9	-173.9	-115.9	0	0	0	111	E210 W212 G219 G223 R224	E210-Y221 HydrophobicContact CB-CE2 4.33Å; W212-Y221 AromaticContact CD2-CD2 3.68Å; W212-Y221 HydrophobicContact CD2-CD2 3.68Å; W212-Y221 HydrophobicContact CD2-CE2 4.39Å; W212-Y221 AromaticContact CE2-CD2 3.54Å; W212-Y221 AromaticContact CE2-CE2 3.83Å; W212-Y221 AromaticContact CE3-CD2 3.7Å; W212-Y221 HydrophobicContact CE3-CD2 3.7Å; W212-Y221 HydrophobicContact CE3-CG 4.33Å; W212-Y221 AromaticContact CH2-CD2 3.46Å; W212-Y221 HydrophobicContact CH2-CD2 3.46Å; W212-Y221 VanDerWaalsContact CH2-CD2 3.46Å; W212-Y221 HydrophobicContact CH2-CE2 4.07Å; W212-Y221 HydrophobicContact CH2-CG 4.15Å; W212-Y221 AromaticContact CZ2-CD2 3.43Å; W212-Y221 HydrophobicContact CZ2-CD2 3.43Å; W212-Y221 VanDerWaalsContact CZ2-CD2 3.43Å; W212-Y221 AromaticContact CZ2-CE2 3.66Å; W212-Y221 HydrophobicContact CZ2-CE2 3.66Å; W212-Y221 AromaticContact CZ3-CD2 3.6Å; W212-Y221 HydrophobicContact CZ3-CD2 3.6Å; W212-Y221 HydrophobicContact CZ3-CG 4.06Å; G219-Y221 PolarHBondContact O-N 2.99Å; Y221-G223 VanDerWaalsContact CZ-C 3.46Å; Y221-R224 WeakPolarHBondContact OH-CB 3.48Å; Y221-R224 PolarHBondContact OH-N 2.97Å
222	I	89.7	Confident	87.9	Confident	56 Å²	56	47.3 Å²	47.3	29%	0.287	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-49.7	178.4	-67.7	164.3	0	0	0	110.1	I211 D213 P220 I234 L241	I211-I222 HydrophobicContact CB-CB 4.23Å; I211-I222 HydrophobicContact CG2-CB 4.3Å; I211-I222 HydrophobicContact CG2-CD1 3.78Å; I211-I222 WeakPolarHBondContact O-CB 3.21Å; I211-I222 PolarHBondContact O-N 3.28Å; D213-I222 HydrophobicContact CB-CD1 3.9Å; D213-I222 HydrophobicContact CB-CG1 4.27Å; P220-I222 PolarHBondContact O-N 3Å; I222-I234 HydrophobicContact CD1-CG2 3.76Å; I222-I234 HydrophobicContact CG2-CD1 4Å; I222-I234 HydrophobicContact CG2-CG2 4.42Å; I222-L241 HydrophobicContact CD1-CD1 3.85Å
223	G	88.9	Confident	87.8	Confident	10 Å²	10	51.1 Å²	51.1	10%	0.103	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.2	168.6	179.8	0	0	0	0	0	115.3	E210 I211 Y221	E210-G223 WeakPolarHBondContact CA-O 3.42Å; I211-G223 PolarHBondContact N-O 3.37Å; I211-G223 PolarHBondContact O-N 2.86Å; Y221-G223 VanDerWaalsContact CZ-C 3.46Å
224	R	92.6	Very high	87.7	Confident	76 Å²	76	51.6 Å²	51.6	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.5	169.8	-166	175	-75	177.3	-7.2	108.9	F203 C204 R208 L209 E210 Y221	F203-R224 HydrophobicContact CD2-CB 4.5Å; F203-R224 HydrophobicContact CE2-CB 3.71Å; F203-R224 HydrophobicContact CE2-CG 4.43Å; F203-R224 HydrophobicContact CZ-CB 4.19Å; F203-R224 WeakPolarHBondContact O-CD 3.08Å; F203-R224 PolarHBondContact O-NH1 2.89Å; C204-R224 HydrophobicContact CB-CG 3.87Å; R208-R224 HydrophobicContact CB-CG 3.84Å; L209-R224 CarbonylContact O-C 3.53Å; L209-R224 WeakPolarHBondContact O-CA 2.93Å; E210-R224 HydrophobicContact CG-CG 4.16Å; E210-R224 IonicContact OE1-CZ 3.07Å; E210-R224 IonicContact OE1-NE 2.65Å; E210-R224 PolarHBondContact OE1-NE 2.91Å; E210-R224 IonicContact OE1-NH2 2.68Å; E210-R224 PolarHBondContact OE1-NH2 3.3Å; Y221-R224 WeakPolarHBondContact OH-CB 3.48Å; Y221-R224 PolarHBondContact OH-N 2.97Å
225	Y	94.6	Very high	87.7	Confident	46 Å²	46	53.2 Å²	53.2	18%	0.18	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142.6	-177.6	-52.7	-90.5	0	0	0	111.1	R208 L209 I211 P231	R208-Y225 WeakPolarHBondContact CA-O 3Å; L209-Y225 PolarHBondContact N-O 3.32Å; L209-Y225 PolarHBondContact O-N 2.98Å; I211-Y225 HydrophobicContact CD1-CD2 4.09Å; I211-Y225 HydrophobicContact CD1-CE2 3.83Å; I211-Y225 HydrophobicContact CG1-CD2 4.26Å; I211-Y225 HydrophobicContact CG1-CE2 4.09Å; Y225-P231 HydrophobicContact CD1-CB 3.96Å; Y225-P231 HydrophobicContact CD1-CG 3.78Å; Y225-P231 HydrophobicContact CD2-CB 4.16Å; Y225-P231 HydrophobicContact CD2-CG 3.77Å; Y225-P231 HydrophobicContact CE1-CB 3.78Å; Y225-P231 HydrophobicContact CE1-CG 4.13Å; Y225-P231 HydrophobicContact CE2-CB 3.98Å; Y225-P231 HydrophobicContact CE2-CG 4.12Å; Y225-P231 HydrophobicContact CG-CB 4.15Å; Y225-P231 HydrophobicContact CG-CG 3.6Å
226	C	94.6	Very high	88.1	Confident	11 Å²	11	50.2 Å²	50.2	7%	0.074	28%	0.275	C	S	.	.			trans	-157.1	177.1	175	64.9	0	0	0	0	110.5	C204 D207 N229	C204-C226 WeakPolarHBondContact CA-SG 3.43Å; C204-C226 HydrophobicContact CB-CB 3.5Å; C204-C226 WeakPolarHBondContact CB-SG 3.36Å; C204-C226 WeakPolarHBondContact SG-CB 3.25Å; C204-C226 PolarHBondContact SG-N 3.4Å; C204-C226 VanDerWaalsContact SG-N 3.4Å; C204-C226 CovalentContact SG-SG 2.03Å; C204-C226 PolarHBondContact SG-SG 2.88Å; D207-C226 WeakPolarHBondContact O-CB 3.44Å; C226-N229 PolarHBondContact O-N 3.44Å
227	G	93.8	Very high	88.4	Confident	6 Å²	6	49.3 Å²	49.3	6%	0.062	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	-139	-174.5	0	0	0	0	0	111.8	F190 E191 L192 E193	F190-G227 WeakPolarHBondContact CE1-O 3.09Å; E191-G227 WeakPolarHBondContact CA-O 3.25Å; L192-G227 PolarHBondContact N-O 2.91Å; L192-G227 WeakPolarHBondContact O-CA 3.13Å; L192-G227 PolarHBondContact O-N 2.89Å; E193-G227 PolarHBondContact O-N 2.79Å
228	Q	92.3	Very high	88.9	Confident	137 Å²	137	46.4 Å²	46.4	64%	0.64	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	11.8	176.7	-67.8	-178.2	-25.4	0	0	112.9	E191 T230	E191-Q228 HydrophobicContact CG-CG 4.05Å; E191-Q228 PolarHBondContact OE2-NE2 2.89Å; Q228-T230 VanDerWaalsContact C-N 3.33Å; Q228-T230 PolarHBondContact O-N 2.82Å
229	N	85.5	Confident	89.3	Confident	126 Å²	126	43.8 Å²	43.8	67%	0.674	22%	0.22	S	C	*	.			trans	-78.2	86.6	178.1	-67.9	-12	0	0	0	108.9	F190 C226	F190-N229 WeakPolarHBondContact CE1-O 3.33Å; C226-N229 PolarHBondContact O-N 3.44Å
230	T	87.3	Confident	89.8	Confident	77 Å²	77	43.6 Å²	43.6	47%	0.472	22%	0.218	S	C	.	.			trans	-59.7	136.4	178.8	179.7	0	0	0	0	111.1	Q228 G232	Q228-T230 VanDerWaalsContact C-N 3.33Å; Q228-T230 PolarHBondContact O-N 2.82Å; T230-G232 PolarHBondContact O-N 3.22Å; T230-G232 VanDerWaalsContact O-N 3.15Å; T230-G232 PolarHBondContact OG1-N 3.07Å
231	P	85.2	Confident	90.2	Very high	15 Å²	15	42.4 Å²	42.4	10%	0.097	21%	0.21	C	C	.	.			trans	-61.5	-16.7	172.6	-21.2	31.9	0	0	0	113.7	F187 F190 I211 Y225 I234	F187-P231 HydrophobicContact CD1-CG 4.37Å; F187-P231 HydrophobicContact CD2-CB 3.82Å; F187-P231 HydrophobicContact CD2-CG 3.82Å; F187-P231 HydrophobicContact CE1-CG 4.13Å; F187-P231 HydrophobicContact CE2-CB 3.64Å; F187-P231 HydrophobicContact CE2-CG 3.55Å; F187-P231 HydrophobicContact CG-CG 4.24Å; F187-P231 HydrophobicContact CZ-CB 4.3Å; F187-P231 HydrophobicContact CZ-CG 3.72Å; F190-P231 HydrophobicContact CE2-CG 4.48Å; I211-P231 HydrophobicContact CD1-CB 4.11Å; I211-P231 HydrophobicContact CD1-CG 4.11Å; Y225-P231 HydrophobicContact CD1-CB 3.96Å; Y225-P231 HydrophobicContact CD1-CG 3.78Å; Y225-P231 HydrophobicContact CD2-CB 4.16Å; Y225-P231 HydrophobicContact CD2-CG 3.77Å; Y225-P231 HydrophobicContact CE1-CB 3.78Å; Y225-P231 HydrophobicContact CE1-CG 4.13Å; Y225-P231 HydrophobicContact CE2-CB 3.98Å; Y225-P231 HydrophobicContact CE2-CG 4.12Å; Y225-P231 HydrophobicContact CG-CB 4.15Å; Y225-P231 HydrophobicContact CG-CG 3.6Å; P231-I234 HydrophobicContact CB-CD1 4.3Å; P231-I234 HydrophobicContact CB-CG1 4.25Å
232	G	87	Confident	90.4	Very high	31 Å²	31	37.7 Å²	37.7	32%	0.32	19%	0.192	S	C	.	.			trans	70.1	-141.4	-175.8	0	0	0	0	0	112.1	T230	T230-G232 PolarHBondContact O-N 3.22Å; T230-G232 VanDerWaalsContact O-N 3.15Å; T230-G232 PolarHBondContact OG1-N 3.07Å
233	R	89.5	Confident	90.7	Very high	121 Å²	121	35 Å²	35	46%	0.457	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121	178.4	-177	176	-163.2	-106.9	3.2	110.1	I184 E186	I184-R233 HydrophobicContact CG2-CG 4.23Å; E186-R233 HydrophobicContact CG-CB 4.21Å; E186-R233 HydrophobicContact CG-CG 3.87Å; E186-R233 WeakPolarHBondContact OE1-CD 3.33Å; E186-R233 IonicContact OE1-NE 2.83Å; E186-R233 PolarHBondContact OE1-NE 3.34Å
234	I	91.4	Very high	90.9	Very high	16 Å²	16	35.1 Å²	35.1	8%	0.082	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.2	177.5	-58.2	-56.9	0	0	0	109.2	I184 L185 I211 I222 P231 L241	I184-I234 WeakPolarHBondContact CA-O 3.22Å; L185-I234 HydrophobicContact CB-CB 4.29Å; L185-I234 HydrophobicContact CD2-CB 4.45Å; L185-I234 PolarHBondContact N-O 2.79Å; L185-I234 PolarHBondContact O-N 2.86Å; I211-I234 HydrophobicContact CD1-CG1 4.42Å; I211-I234 HydrophobicContact CG2-CG2 4.49Å; I222-I234 HydrophobicContact CD1-CG2 3.76Å; I222-I234 HydrophobicContact CG2-CD1 4Å; I222-I234 HydrophobicContact CG2-CG2 4.42Å; P231-I234 HydrophobicContact CB-CD1 4.3Å; P231-I234 HydrophobicContact CB-CG1 4.25Å; I234-L241 HydrophobicContact CG2-CD1 4.47Å
235	I	90.1	Very high	90.9	Very high	34 Å²	34	31.5 Å²	31.5	17%	0.174	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.4	175.3	-49.2	172.4	0	0	0	107.9	I183 Y237	I183-I235 CarbonylContact O-C 3.57Å; I183-I235 WeakPolarHBondContact O-CA 3.42Å; I235-Y237 HydrophobicContact CB-CE1 4.28Å; I235-Y237 HydrophobicContact CB-CE2 4.14Å; I235-Y237 HydrophobicContact CG2-CD1 4.22Å; I235-Y237 HydrophobicContact CG2-CE1 3.44Å; I235-Y237 VanDerWaalsContact CG2-CE1 3.44Å; I235-Y237 HydrophobicContact CG2-CE2 4.11Å; I235-Y237 VanDerWaalsContact CG2-CZ 3.42Å; I235-Y237 WeakPolarHBondContact O-CE2 3.29Å
236	S	91.6	Very high	90.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.6	171.5	155.4	0	0	0	0	110.3	E182 I183 D213 I240	E182-S236 WeakPolarHBondContact CA-O 3.5Å; I183-S236 PolarHBondContact N-O 2.82Å; I183-S236 VanDerWaalsContact N-O 3.12Å; I183-S236 PolarHBondContact O-N 3.22Å; D213-S236 VanDerWaalsContact OD1-CB 3.23Å; D213-S236 WeakPolarHBondContact OD1-CB 3.38Å; D213-S236 PolarHBondContact OD1-OG 3.08Å; S236-I240 PolarHBondContact OG-O 2.85Å
237	Y	87.6	Confident	90.4	Very high	29 Å²	29	30.3 Å²	30.3	11%	0.114	16%	0.159	C	C	.	.	S	Bend	trans	-112.1	-12	-175.3	-59.5	-73	0	0	0	113.3	E182 D213 I235 G239 F330 R332	E182-Y237 HydrophobicContact CG-CD1 4.13Å; D213-Y237 PolarHBondContact OD1-N 2.81Å; D213-Y237 PolarHBondContact OD2-N 3.15Å; I235-Y237 HydrophobicContact CB-CE1 4.28Å; I235-Y237 HydrophobicContact CB-CE2 4.14Å; I235-Y237 HydrophobicContact CG2-CD1 4.22Å; I235-Y237 HydrophobicContact CG2-CE1 3.44Å; I235-Y237 VanDerWaalsContact CG2-CE1 3.44Å; I235-Y237 HydrophobicContact CG2-CE2 4.11Å; I235-Y237 VanDerWaalsContact CG2-CZ 3.42Å; I235-Y237 WeakPolarHBondContact O-CE2 3.29Å; Y237-G239 VanDerWaalsContact C-N 3.34Å; Y237-F330 VanDerWaalsContact CB-CE1 3.42Å; Y237-F330 HydrophobicContact CD1-CD1 4.43Å; Y237-F330 HydrophobicContact CD2-CB 3.17Å; Y237-F330 AromaticContact CD2-CD1 3.76Å; Y237-F330 HydrophobicContact CD2-CD1 3.76Å; Y237-F330 AromaticContact CD2-CD2 3.74Å; Y237-F330 HydrophobicContact CD2-CD2 3.74Å; Y237-F330 AromaticContact CD2-CG 3.29Å; Y237-F330 HydrophobicContact CD2-CG 3.29Å; Y237-F330 HydrophobicContact CE2-CB 3.35Å; Y237-F330 HydrophobicContact CE2-CG 4.03Å; Y237-F330 HydrophobicContact CG-CB 3.82Å; Y237-F330 AromaticContact CG-CD1 3.57Å; Y237-F330 HydrophobicContact CG-CD1 3.57Å; Y237-F330 HydrophobicContact CG-CD2 4.3Å; Y237-F330 HydrophobicContact CG-CE1 4.16Å; Y237-F330 AromaticContact CG-CG 3.65Å; Y237-F330 HydrophobicContact CG-CG 3.65Å; Y237-R332 PolarHBondContact OH-NH2 2.93Å
238	T	88.8	Confident	90	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.167	C	C	.	.	S	Bend	trans	-86.7	-11	-179.8	71	0	0	0	0	113.1	D213 I240 F330 V436	D213-T238 WeakPolarHBondContact O-CG2 3.46Å; D213-T238 PolarHBondContact O-OG1 2.7Å; D213-T238 VanDerWaalsContact O-OG1 3.09Å; D213-T238 WeakPolarHBondContact OD1-CB 3.1Å; D213-T238 WeakPolarHBondContact OD1-CG2 3.5Å; D213-T238 PolarHBondContact OD1-N 2.94Å; D213-T238 PolarHBondContact OD1-OG1 2.89Å; T238-I240 PolarHBondContact O-N 2.91Å; T238-I240 PolarHBondContact OG1-N 2.88Å; T238-I240 PolarHBondContact OG1-O 3.12Å; T238-I240 VanDerWaalsContact OG1-O 3.1Å; T238-F330 HydrophobicContact CG2-CE2 4.39Å; T238-F330 HydrophobicContact CG2-CZ 4.16Å; T238-V436 HydrophobicContact CG2-CB 4.28Å; T238-V436 HydrophobicContact CG2-CG1 3.67Å
239	G	87.5	Confident	89.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	77.7	6.8	-175.4	0	0	0	0	0	114.1	A177 M180 S181 Y237	A177-G239 WeakPolarHBondContact CB-O 3.38Å; A177-G239 PolarHBondContact N-O 2.04Å; M180-G239 WeakPolarHBondContact CE-O 3.46Å; S181-G239 WeakPolarHBondContact O-CA 3.21Å; Y237-G239 VanDerWaalsContact C-N 3.34Å
240	I	91.9	Very high	89.3	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.5	168.6	-57.2	-178.5	0	0	0	107.8	M174 I175 F176 M180 D213 G214 F215 S236 T238 L439	M174-I240 HydrophobicContact CE-CG2 3.71Å; I175-I240 WeakPolarHBondContact O-CA 3.28Å; F176-I240 HydrophobicContact CD1-CD1 4.04Å; F176-I240 HydrophobicContact CD1-CG1 3.99Å; F176-I240 HydrophobicContact CD1-CG2 4.39Å; F176-I240 HydrophobicContact CE1-CD1 4.03Å; F176-I240 HydrophobicContact CE1-CG1 4.35Å; F176-I240 HydrophobicContact CE1-CG2 4.21Å; M180-I240 HydrophobicContact CE-CD1 4.15Å; M180-I240 HydrophobicContact CE-CG1 3.61Å; D213-I240 CarbonylContact C-O 3.49Å; D213-I240 VanDerWaalsContact C-O 3.3Å; G214-I240 PolarHBondContact N-O 2.78Å; F215-I240 HydrophobicContact CD2-CD1 4.2Å; F215-I240 HydrophobicContact CE2-CD1 3.62Å; F215-I240 HydrophobicContact CZ-CD1 4.37Å; S236-I240 PolarHBondContact OG-O 2.85Å; T238-I240 PolarHBondContact O-N 2.91Å; T238-I240 PolarHBondContact OG1-N 2.88Å; T238-I240 PolarHBondContact OG1-O 3.12Å; T238-I240 VanDerWaalsContact OG1-O 3.1Å; I240-L439 HydrophobicContact CD1-CB 3.85Å; I240-L439 HydrophobicContact CD1-CD1 4.16Å; I240-L439 HydrophobicContact CD1-CD2 4.4Å; I240-L439 HydrophobicContact CD1-CG 4.37Å
241	L	95.8	Very high	89.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.5	176.3	-178.1	58.3	0	0	0	109	I175 I183 L185 I211 W212 I222 I234 L243	I175-L241 HydrophobicContact CB-CB 4.37Å; I175-L241 HydrophobicContact CD1-CB 4.35Å; I175-L241 HydrophobicContact CD1-CD2 4.17Å; I175-L241 HydrophobicContact CD1-CG 4.42Å; I175-L241 PolarHBondContact N-O 3.32Å; I175-L241 PolarHBondContact O-N 3.41Å; I183-L241 HydrophobicContact CB-CD2 4.49Å; I183-L241 HydrophobicContact CD1-CB 3.83Å; I183-L241 HydrophobicContact CG2-CD2 4Å; L185-L241 HydrophobicContact CB-CD2 3.84Å; L185-L241 HydrophobicContact CD2-CD2 4.09Å; L185-L241 HydrophobicContact CG-CD2 4.49Å; I211-L241 HydrophobicContact CG2-CD1 3.61Å; W212-L241 VanDerWaalsContact O-CD1 3.29Å; W212-L241 WeakPolarHBondContact O-CD1 3.35Å; I222-L241 HydrophobicContact CD1-CD1 3.85Å; I234-L241 HydrophobicContact CG2-CD1 4.47Å; L241-L243 HydrophobicContact CG-CD1 4.11Å
242	A	92.9	Very high	89.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.6	-179.7	0	0	0	0	0	111.3	F173 M174 I211 W212 G214 P216	F173-A242 CarbonylContact O-C 3.56Å; F173-A242 WeakPolarHBondContact O-CA 3.4Å; M174-A242 HydrophobicContact CE-CB 4.01Å; M174-A242 HydrophobicContact SD-CB 3.33Å; M174-A242 WeakPolarHBondContact SD-CB 3.47Å; I211-A242 WeakPolarHBondContact CA-O 3.36Å; W212-A242 HydrophobicContact CB-CB 4.29Å; W212-A242 PolarHBondContact N-O 2.93Å; W212-A242 PolarHBondContact O-N 3.15Å; G214-A242 VanDerWaalsContact O-CB 3.24Å; G214-A242 WeakPolarHBondContact O-CB 3.18Å; P216-A242 HydrophobicContact CG-CB 3.73Å
243	L	96.3	Very high	89.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.4	172.5	-67.1	72.2	0	0	0	108.4	I156 T172 F173 I175 L185 F187 L209 E210 I211 L241 F256	I156-L243 HydrophobicContact CD1-CD1 4.46Å; T172-L243 CarbonylContact C-O 3.6Å; T172-L243 WeakPolarHBondContact CA-O 3.26Å; F173-L243 HydrophobicContact CB-CB 4.33Å; F173-L243 HydrophobicContact CD2-CB 4.28Å; F173-L243 PolarHBondContact N-O 3.03Å; F173-L243 PolarHBondContact O-N 3.41Å; I175-L243 HydrophobicContact CD1-CD1 4.41Å; L185-L243 HydrophobicContact CD2-CD1 4.09Å; L185-L243 HydrophobicContact CD2-CD2 3.92Å; L185-L243 HydrophobicContact CD2-CG 4.3Å; F187-L243 HydrophobicContact CZ-CD2 4.17Å; L209-L243 HydrophobicContact CD1-CB 4.15Å; E210-L243 CarbonylContact O-C 3.58Å; E210-L243 WeakPolarHBondContact O-CA 3.44Å; I211-L243 HydrophobicContact CG1-CG 4.35Å; L241-L243 HydrophobicContact CG-CD1 4.11Å; L243-F256 HydrophobicContact CD2-CE2 4.2Å
244	T	92.5	Very high	89.7	Confident	11 Å²	11	26.6 Å²	26.6	7%	0.067	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117.4	177.1	-54.4	0	0	0	0	109.6	C171 L209 E210	C171-T244 CarbonylContact O-C 3.6Å; C171-T244 WeakPolarHBondContact O-CA 3.36Å; L209-T244 CarbonylContact C-O 3.41Å; L209-T244 WeakPolarHBondContact CA-O 3.43Å; E210-T244 PolarHBondContact N-O 3.16Å; E210-T244 PolarHBondContact O-N 3.02Å
245	I	92.4	Very high	89.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124	172.7	-178.9	169.5	0	0	0	109.2	C171 F173 L192 R208 L209 T247 F256	C171-I245 HydrophobicContact CB-CG2 3.65Å; C171-I245 PolarHBondContact N-O 3.12Å; C171-I245 PolarHBondContact O-N 2.99Å; F173-I245 HydrophobicContact CE2-CG2 3.96Å; L192-I245 HydrophobicContact CD2-CD1 3.97Å; R208-I245 WeakPolarHBondContact O-CA 3.46Å; L209-I245 HydrophobicContact CD1-CB 4.03Å; I245-T247 HydrophobicContact CD1-CG2 4.12Å; I245-T247 HydrophobicContact CG1-CG2 4.01Å; I245-F256 HydrophobicContact CB-CE1 4.24Å; I245-F256 HydrophobicContact CD1-CD1 4.25Å; I245-F256 HydrophobicContact CD1-CE1 3.92Å
246	N	90.5	Very high	90.2	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.118	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.3	171.8	-60.3	110	0	0	0	108.8	L169 D170 D207 R208	L169-N246 VanDerWaalsContact O-CA 3.28Å; L169-N246 WeakPolarHBondContact O-CA 3.39Å; D170-N246 PolarHBondContact OD1-ND2 3.33Å; D207-N246 WeakPolarHBondContact CA-O 3.36Å; R208-N246 HydrophobicContact CG-CB 4.1Å; R208-N246 PolarHBondContact N-O 3.2Å; R208-N246 PolarHBondContact NH2-OD1 2.94Å; R208-N246 PolarHBondContact O-N 3.22Å
247	T	89.6	Confident	90.4	Very high	10 Å²	10	24.3 Å²	24.3	6%	0.061	14%	0.136	C	C	.	.			trans	-121.3	147.4	175.2	68.9	0	0	0	0	111.1	Y165 P166 N168 L169 D207 I245	Y165-T247 HydrophobicContact CD2-CG2 3.54Å; Y165-T247 HydrophobicContact CE2-CG2 3.5Å; Y165-T247 HydrophobicContact CG-CG2 4.4Å; P166-T247 PolarHBondContact O-OG1 3.04Å; N168-T247 VanDerWaalsContact CA-O 3.23Å; N168-T247 WeakPolarHBondContact CA-O 3.39Å; N168-T247 PolarHBondContact N-O 3.09Å; N168-T247 PolarHBondContact N-OG1 3.07Å; L169-T247 HydrophobicContact CB-CG2 4.09Å; L169-T247 WeakPolarHBondContact CB-OG1 3.3Å; L169-T247 HydrophobicContact CD1-CG2 4.13Å; L169-T247 HydrophobicContact CG-CG2 4.47Å; L169-T247 PolarHBondContact N-OG1 3.44Å; L169-T247 PolarHBondContact O-N 3.36Å; D207-T247 HydrophobicContact CB-CG2 4.39Å; D207-T247 WeakPolarHBondContact OD1-CA 3.42Å; D207-T247 VanDerWaalsContact OD1-CB 3.24Å; D207-T247 WeakPolarHBondContact OD1-CB 3.18Å; I245-T247 HydrophobicContact CD1-CG2 4.12Å; I245-T247 HydrophobicContact CG1-CG2 4.01Å
248	D	85.3	Confident	90.8	Very high	43 Å²	43	23 Å²	23	23%	0.23	13%	0.13	C	C	.	.			trans	-85.2	-171.9	-178.9	89	0.8	0	0	0	111.9	N167 N168 D207 A250	N167-D248 CarbonylContact C-O 3.58Å; N167-D248 WeakPolarHBondContact CA-O 3.27Å; N167-D248 VanDerWaalsContact CB-O 3.26Å; N167-D248 WeakPolarHBondContact CB-O 3.3Å; N168-D248 PolarHBondContact N-O 2.89Å; D207-D248 PolarHBondContact OD1-N 3.03Å; D248-A250 PolarHBondContact O-N 2.64Å; D248-A250 PolarHBondContact OD1-N 2.73Å
249	S	83.4	Confident	91.2	Very high	85 Å²	85	25 Å²	25	59%	0.594	14%	0.141	S	C	*	.	S	Bend	trans	-71.9	-7.4	-176.2	68.3	0	0	0	0	115.3	N167 N168	N167-S249 PolarHBondContact ND2-O 2.84Å; N168-S249 VanDerWaalsContact OD1-CA 3.26Å; N168-S249 WeakPolarHBondContact OD1-CA 3.09Å; N168-S249 PolarHBondContact OD1-N 3.22Å
250	A	78.3	Confident	91.6	Very high	39 Å²	39	25 Å²	25	32%	0.322	14%	0.141	S	C	.	.	S	Bend	trans	-143.3	-178.8	-170.6	0	0	0	0	0	113.1	N167 D248 A252	N167-A250 WeakPolarHBondContact ND2-CA 3.46Å; D248-A250 PolarHBondContact O-N 2.64Å; D248-A250 PolarHBondContact OD1-N 2.73Å; A250-A252 PolarHBondContact O-N 2.93Å
251	I	85.9	Confident	91.8	Very high	103 Å²	103	27.9 Å²	27.9	53%	0.528	16%	0.159	S	C	.	.			trans	44.9	70.3	167.1	-48.3	179.7	0	0	0	115.8	E193	E193-I251 HydrophobicContact CG-CB 4.33Å; E193-I251 HydrophobicContact CG-CG2 3.9Å; E193-I251 WeakPolarHBondContact OE1-CB 3.36Å; E193-I251 WeakPolarHBondContact OE1-CD1 3.35Å
252	A	86.8	Confident	91.6	Very high	10 Å²	10	28.4 Å²	28.4	8%	0.083	16%	0.162	C	C	.	.			trans	-81.5	146	170.9	0	0	0	0	0	115	K164 Y165 A250	K164-A252 HydrophobicContact CB-CB 3.96Å; K164-A252 HydrophobicContact CD-CB 4.42Å; K164-A252 WeakPolarHBondContact CD-O 2.98Å; K164-A252 WeakPolarHBondContact CE-O 3.25Å; K164-A252 PolarHBondContact NZ-O 3.09Å; Y165-A252 HydrophobicContact CD2-CB 3.82Å; Y165-A252 HydrophobicContact CE2-CB 3.79Å; Y165-A252 HydrophobicContact CG-CB 4.45Å; Y165-A252 WeakPolarHBondContact O-CB 3.25Å; A250-A252 PolarHBondContact O-N 2.93Å
253	K	93.3	Very high	91.2	Very high	61 Å²	61	31.9 Å²	31.9	27%	0.265	18%	0.18	S	C	.	.			trans	-114.5	-175.7	171	-61.5	-55.1	-157	126.5	0	111.4	K164 Y165 E191 G255	K164-K253 WeakPolarHBondContact CA-O 3.28Å; Y165-K253 WeakPolarHBondContact CD1-O 3.32Å; Y165-K253 VanDerWaalsContact CE1-C 3.49Å; Y165-K253 HydrophobicContact CE1-CB 3.75Å; Y165-K253 WeakPolarHBondContact CE1-O 3.41Å; Y165-K253 VanDerWaalsContact CZ-N 3.26Å; Y165-K253 PolarHBondContact N-O 3.44Å; Y165-K253 VanDerWaalsContact N-O 3.08Å; Y165-K253 PolarHBondContact OH-N 3.3Å; E191-K253 HydrophobicContact CG-CB 4.06Å; E191-K253 HydrophobicContact CG-CG 4.25Å; E191-K253 VanDerWaalsContact O-CB 3.25Å; E191-K253 WeakPolarHBondContact O-CB 3.48Å; E191-K253 IonicContact OE1-NZ 3.78Å; E191-K253 PolarHBondContact OE1-NZ 3.28Å; K253-G255 VanDerWaalsContact C-N 3.27Å; K253-G255 PolarHBondContact O-N 2.81Å
254	E	92.7	Very high	90	Very high	94 Å²	94	37.6 Å²	37.6	44%	0.439	21%	0.211	S	C	.	.			trans	-65.9	-27.9	-178.2	-61.8	-174.3	174.8	0	0	112.9	S158 F161	S158-E254 PolarHBondContact OG-O 2.68Å; F161-E254 WeakPolarHBondContact CD2-O 3.29Å
255	G	94.3	Very high	88.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.9	-139.2	179.6	0	0	0	0	0	112.5	S158 Y165 E191 K253	S158-G255 WeakPolarHBondContact OG-CA 3.21Å; Y165-G255 VanDerWaalsContact CD1-CA 3.45Å; E191-G255 PolarHBondContact N-O 2.86Å; E191-G255 VanDerWaalsContact O-CA 3.28Å; E191-G255 WeakPolarHBondContact O-CA 3.33Å; E191-G255 PolarHBondContact O-N 2.89Å; K253-G255 VanDerWaalsContact C-N 3.27Å; K253-G255 PolarHBondContact O-N 2.81Å
256	F	96.3	Very high	87.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.7	-175.1	71.7	-91.3	0	0	0	113.1	I156 K157 S158 F173 F187 S189 F190 L209 L243 I245	I156-F256 HydrophobicContact CG2-CE2 3.9Å; I156-F256 HydrophobicContact CG2-CZ 4.33Å; K157-F256 VanDerWaalsContact CA-O 3.3Å; K157-F256 WeakPolarHBondContact CA-O 3.32Å; S158-F256 PolarHBondContact N-O 2.94Å; S158-F256 PolarHBondContact OG-N 3.04Å; S158-F256 PolarHBondContact OG-O 2.94Å; F173-F256 HydrophobicContact CD2-CZ 4.15Å; F173-F256 HydrophobicContact CE2-CE1 4.49Å; F173-F256 AromaticContact CE2-CZ 3.81Å; F173-F256 HydrophobicContact CE2-CZ 3.81Å; F187-F256 HydrophobicContact CD1-CB 4.31Å; F187-F256 HydrophobicContact CD1-CD2 4.33Å; F187-F256 HydrophobicContact CE1-CB 4.3Å; F187-F256 AromaticContact CE1-CD2 3.8Å; F187-F256 HydrophobicContact CE1-CD2 3.8Å; F187-F256 HydrophobicContact CE1-CE2 4.42Å; F187-F256 HydrophobicContact CE1-CG 4.19Å; S189-F256 VanDerWaalsContact O-CA 3.27Å; S189-F256 WeakPolarHBondContact O-CA 3.4Å; S189-F256 WeakPolarHBondContact O-CB 3.31Å; F190-F256 HydrophobicContact CD2-CB 3.75Å; F190-F256 HydrophobicContact CE2-CB 4.44Å; L209-F256 HydrophobicContact CD1-CD1 4.41Å; L209-F256 HydrophobicContact CD1-CE1 3.7Å; L209-F256 HydrophobicContact CD1-CZ 3.89Å; L209-F256 HydrophobicContact CD2-CD1 4.3Å; L209-F256 HydrophobicContact CD2-CE1 4.28Å; L209-F256 HydrophobicContact CD2-CG 4.47Å; L209-F256 HydrophobicContact CD2-CZ 4.43Å; L243-F256 HydrophobicContact CD2-CE2 4.2Å; I245-F256 HydrophobicContact CB-CE1 4.24Å; I245-F256 HydrophobicContact CD1-CD1 4.25Å; I245-F256 HydrophobicContact CD1-CE1 3.92Å
257	S	95.9	Very high	86.2	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.6	167.8	-177.2	0	0	0	0	107.9	I156 K157 E188 S189	I156-S257 WeakPolarHBondContact O-CA 3.39Å; K157-S257 WeakPolarHBondContact CE-OG 3.37Å; E188-S257 PolarHBondContact N-O 2.78Å; E188-S257 PolarHBondContact OE2-OG 2.76Å; S189-S257 PolarHBondContact N-O 3.41Å; S189-S257 PolarHBondContact O-N 3.13Å
258	A	96.8	Very high	85.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.8	178.6	0	0	0	0	0	110.1	V155 I156 L185 E186 F187	V155-A258 CarbonylContact C-O 3.54Å; V155-A258 WeakPolarHBondContact CA-O 3.4Å; V155-A258 WeakPolarHBondContact CG1-O 3.36Å; I156-A258 PolarHBondContact N-O 2.8Å; I156-A258 PolarHBondContact O-N 2.84Å; L185-A258 HydrophobicContact CD1-CB 3.82Å; L185-A258 HydrophobicContact CG-CB 4.37Å; E186-A258 CarbonylContact O-C 3.52Å; E186-A258 WeakPolarHBondContact O-CA 3.37Å; E186-A258 WeakPolarHBondContact O-CB 3.2Å; F187-A258 HydrophobicContact CD1-CB 3.87Å; F187-A258 HydrophobicContact CD2-CB 4.43Å; F187-A258 HydrophobicContact CE1-CB 3.99Å; F187-A258 HydrophobicContact CG-CB 4.1Å; F187-A258 HydrophobicContact CZ-CB 4.31Å
259	N	97	Very high	84.2	Confident	44 Å²	44	59.1 Å²	59.1	24%	0.235	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	147.5	170.4	65.2	40.7	0	0	0	109.2	G154 V155 L185 E186 E188	G154-N259 WeakPolarHBondContact O-CA 3.48Å; V155-N259 HydrophobicContact CG2-CB 4.44Å; L185-N259 WeakPolarHBondContact CA-O 3.26Å; E186-N259 PolarHBondContact N-O 3.4Å; E186-N259 PolarHBondContact O-N 3.15Å; E188-N259 PolarHBondContact OE1-ND2 2.76Å; E188-N259 VanDerWaalsContact OE1-ND2 3.09Å
260	F	96.8	Very high	83.5	Confident	1 Å²	1	62.6 Å²	62.6	0%	0.004	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148	172	76.7	-91.6	0	0	0	110.7	F149 S151 S153 G154 I156 I175 I183 I184 L185 V262	F149-F260 HydrophobicContact CB-CE1 4Å; F149-F260 HydrophobicContact CB-CZ 3.68Å; F149-F260 AromaticContact CD1-CE1 3.72Å; F149-F260 HydrophobicContact CD1-CE1 3.72Å; F149-F260 HydrophobicContact CD1-CZ 4.01Å; F149-F260 HydrophobicContact CE1-CE1 4.33Å; F149-F260 AromaticContact CG-CE1 3.88Å; F149-F260 HydrophobicContact CG-CE1 3.88Å; F149-F260 HydrophobicContact CG-CZ 4.06Å; S151-F260 WeakPolarHBondContact O-CE2 3.4Å; S153-F260 WeakPolarHBondContact CA-O 3.47Å; S153-F260 WeakPolarHBondContact CB-O 3.4Å; G154-F260 PolarHBondContact N-O 3.17Å; G154-F260 WeakPolarHBondContact O-CD1 3.21Å; G154-F260 PolarHBondContact O-N 2.73Å; I156-F260 HydrophobicContact CD1-CD1 3.99Å; I156-F260 HydrophobicContact CD1-CE1 4.42Å; I156-F260 HydrophobicContact CG1-CD1 4.01Å; I156-F260 HydrophobicContact CG1-CE1 4.28Å; I175-F260 HydrophobicContact CD1-CB 3.91Å; I175-F260 HydrophobicContact CD1-CD1 3.94Å; I175-F260 HydrophobicContact CD1-CD2 4.23Å; I175-F260 HydrophobicContact CD1-CG 3.76Å; I175-F260 HydrophobicContact CG1-CD1 4.34Å; I175-F260 HydrophobicContact CG1-CE1 4.48Å; I175-F260 HydrophobicContact CG1-CG 4.42Å; I175-F260 HydrophobicContact CG2-CD2 3.73Å; I175-F260 HydrophobicContact CG2-CE2 3.65Å; I175-F260 HydrophobicContact CG2-CG 4.33Å; I175-F260 HydrophobicContact CG2-CZ 4.19Å; I183-F260 HydrophobicContact CG2-CB 4.3Å; I183-F260 HydrophobicContact CG2-CD2 4.41Å; I184-F260 CarbonylContact O-C 3.53Å; I184-F260 WeakPolarHBondContact O-CA 3.43Å; L185-F260 HydrophobicContact CD1-CB 3.94Å; F260-V262 HydrophobicContact CD2-CG2 4.33Å; F260-V262 HydrophobicContact CE2-CG2 4.32Å
261	T	95.4	Very high	83.5	Confident	59 Å²	59	63 Å²	63	36%	0.362	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	137.9	174.5	54.4	0	0	0	0	109.3	N152 I184	N152-T261 CarbonylContact O-C 3.38Å; I184-T261 PolarHBondContact N-O 2.95Å; I184-T261 PolarHBondContact O-N 3.2Å
262	V	91.1	Very high	83.2	Confident	12 Å²	12	63.4 Å²	63.4	7%	0.073	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.8	176.4	-178.1	0	0	0	0	107.1	N152 A177 S181 E182 I183 F260	N152-V262 HydrophobicContact CB-CB 4.32Å; N152-V262 WeakPolarHBondContact O-CB 3.43Å; N152-V262 PolarHBondContact O-N 3.24Å; A177-V262 HydrophobicContact CB-CG1 3.74Å; A177-V262 HydrophobicContact CB-CG2 4.34Å; S181-V262 WeakPolarHBondContact OG-CG1 3.48Å; E182-V262 WeakPolarHBondContact O-CA 3.23Å; I183-V262 HydrophobicContact CG1-CG2 4.37Å; F260-V262 HydrophobicContact CD2-CG2 4.33Å; F260-V262 HydrophobicContact CE2-CG2 4.32Å
263	L	84.4	Confident	83.3	Confident	73 Å²	73	63.3 Å²	63.3	38%	0.382	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-78.3	126.7	179.7	-66	-178.1	0	0	0	110.4	S181 E182 I184	S181-L263 WeakPolarHBondContact CB-O 3.46Å; S181-L263 PolarHBondContact OG-O 3.32Å; S181-L263 VanDerWaalsContact OG-O 3.07Å; E182-L263 HydrophobicContact CB-CD1 4.46Å; E182-L263 PolarHBondContact O-N 2.82Å; I184-L263 HydrophobicContact CD1-CD1 3.66Å; I184-L263 HydrophobicContact CD1-CD2 3.77Å; I184-L263 HydrophobicContact CD1-CG 3.71Å; I184-L263 HydrophobicContact CG1-CD1 4.4Å; I184-L263 HydrophobicContact CG1-CG 4.46Å
264	D	72.1	Confident	83.1	Confident	119 Å²	119	61.9 Å²	61.9	64%	0.636	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-72.1	135	170.1	-82.9	-24.9	0	0	0	110.2	N152 T266	N152-D264 PolarHBondContact ND2-OD1 3.09Å; D264-T266 PolarHBondContact O-N 3.38Å
265	R	67.2	Low	83.1	Confident	74 Å²	74	61.3 Å²	61.3	28%	0.279	33%	0.33	S	S	.	.			trans	-75.3	108.9	-178.8	-66.7	-179.3	173.4	161.9	0.2	110.2	K179 M180 G431	K179-R265 PolarHBondContact O-NH1 3.05Å; K179-R265 PolarHBondContact O-NH2 3.2Å; M180-R265 PolarHBondContact O-NH2 3.05Å; R265-G431 VanDerWaalsContact NH2-CA 3.33Å
266	T	65	Low	83.2	Confident	125 Å²	125	64.9 Å²	64.9	77%	0.767	35%	0.353	S	S	*	.			trans	-114.1	114.2	164.4	53.9	0	0	0	0	108.5	D264	D264-T266 PolarHBondContact O-N 3.38Å
267	V	63.3	Low	83.1	Confident	56 Å²	56	66 Å²	66	34%	0.339	36%	0.359	S	S	.	.			trans	-97.9	117.1	173.7	-174.6	0	0	0	0	107.2	F271 E426	V267-F271 HydrophobicContact CG1-CB 4.41Å; V267-E426 VanDerWaalsContact CG1-O 3.25Å; V267-E426 WeakPolarHBondContact CG1-O 3.31Å; V267-E426 WeakPolarHBondContact CG2-O 3.48Å
268	P	67.8	Low	83.1	Confident	84 Å²	84	65.9 Å²	65.9	55%	0.545	36%	0.358	S	S	.	.			trans	-60.4	143.2	172.1	-21.2	33	0	0	0	110.8	D270 F271	P268-D270 PolarHBondContact O-N 2.85Å; P268-F271 PolarHBondContact O-N 3.26Å
269	E	64.7	Low	83.1	Confident	200 Å²	200	65.9 Å²	65.9	94%	0.935	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.9	178.4	-67	-174.8	164.3	0	0	112.5
270	D	68.3	Low	83.1	Confident	157 Å²	157	68.5 Å²	68.5	84%	0.84	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	47.6	-180	-68.8	-35.2	0	0	0	113.2	P268	P268-D270 PolarHBondContact O-N 2.85Å
271	F	78.4	Confident	83.1	Confident	48 Å²	48	72.7 Å²	72.7	21%	0.211	40%	0.399	C	S	.	.			trans	-78.8	120.4	179.7	176.4	-103.9	0	0	0	112.9	V267 P268 C273 C422 E426 Y427	V267-F271 HydrophobicContact CG1-CB 4.41Å; P268-F271 PolarHBondContact O-N 3.26Å; F271-C273 HydrophobicContact CE1-CB 3.98Å; F271-C273 HydrophobicContact CZ-CB 3.96Å; F271-C422 HydrophobicContact CE1-CB 4.47Å; F271-C422 HydrophobicContact CE2-CB 3.84Å; F271-C422 HydrophobicContact CZ-CB 3.39Å; F271-C422 VanDerWaalsContact CZ-SG 3.52Å; F271-E426 HydrophobicContact CE2-CB 3.81Å; F271-E426 HydrophobicContact CE2-CG 4.47Å; F271-E426 VanDerWaalsContact CE2-OE2 3.26Å; F271-E426 WeakPolarHBondContact CE2-OE2 3.12Å; F271-E426 HydrophobicContact CZ-CB 3.71Å; F271-Y427 HydrophobicContact CD1-CE1 4.36Å; F271-Y427 HydrophobicContact CE1-CD1 4.22Å; F271-Y427 HydrophobicContact CE1-CD2 4.33Å; F271-Y427 AromaticContact CE1-CE1 3.83Å; F271-Y427 HydrophobicContact CE1-CE1 3.83Å; F271-Y427 AromaticContact CE1-CE2 3.95Å; F271-Y427 HydrophobicContact CE1-CE2 3.95Å; F271-Y427 HydrophobicContact CE1-CG 4.46Å; F271-Y427 AromaticContact CE1-CZ 3.69Å; F271-Y427 HydrophobicContact CZ-CE2 4.42Å
272	D	80.6	Confident	82.9	Confident	112 Å²	112	71.7 Å²	71.7	60%	0.599	40%	0.4	S	S	*	.			trans	-117.1	6.5	-178.4	83.7	-11.7	0	0	0	115.4	S274	D272-S274 VanDerWaalsContact C-N 3.32Å; D272-S274 PolarHBondContact O-N 2.82Å; D272-S274 VanDerWaalsContact OD1-CB 3.24Å; D272-S274 WeakPolarHBondContact OD1-CB 3.49Å; D272-S274 PolarHBondContact OD1-N 3.36Å; D272-S274 PolarHBondContact OD1-OG 3.42Å; D272-S274 PolarHBondContact OD2-OG 2.95Å; D272-S274 VanDerWaalsContact OD2-OG 3.09Å
273	C	87.6	Confident	82.9	Confident	7 Å²	7	75.4 Å²	75.4	5%	0.047	42%	0.416	C	S	.	.	S	Bend	trans	51.5	45.4	179.9	-173.5	0	0	0	0	113.5	F271 S335 G421 C422	F271-C273 HydrophobicContact CE1-CB 3.98Å; F271-C273 HydrophobicContact CZ-CB 3.96Å; C273-S335 VanDerWaalsContact O-CB 3.24Å; C273-S335 WeakPolarHBondContact O-CB 3.17Å; C273-S335 PolarHBondContact O-OG 3.36Å; C273-G421 CarbonylContact C-O 3.44Å; C273-C422 HydrophobicContact CB-CB 3.71Å; C273-C422 WeakPolarHBondContact CB-SG 3.22Å; C273-C422 WeakPolarHBondContact SG-CB 3.42Å; C273-C422 PolarHBondContact SG-N 3.46Å; C273-C422 CovalentContact SG-SG 2.02Å; C273-C422 PolarHBondContact SG-SG 2.65Å
274	S	90.4	Very high	83.2	Confident	32 Å²	32	72.2 Å²	72.2	22%	0.224	40%	0.399	C	S	.	.			trans	-127.6	16.7	-176.8	83.4	0	0	0	0	114.8	D272 K390 Y420	D272-S274 VanDerWaalsContact C-N 3.32Å; D272-S274 PolarHBondContact O-N 2.82Å; D272-S274 VanDerWaalsContact OD1-CB 3.24Å; D272-S274 WeakPolarHBondContact OD1-CB 3.49Å; D272-S274 PolarHBondContact OD1-N 3.36Å; D272-S274 PolarHBondContact OD1-OG 3.42Å; D272-S274 PolarHBondContact OD2-OG 2.95Å; D272-S274 VanDerWaalsContact OD2-OG 3.09Å; S274-K390 PolarHBondContact O-NZ 3.21Å; S274-Y420 VanDerWaalsContact O-CD1 3.23Å; S274-Y420 WeakPolarHBondContact O-CD1 3.4Å
275	D	91.9	Very high	84.2	Confident	82 Å²	82	69.7 Å²	69.7	44%	0.439	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147.2	-179.2	-65.7	-38.9	0	0	0	112	Y420 G421	D275-Y420 CarbonylContact O-C 3.59Å; D275-Y420 VanDerWaalsContact O-CA 3.23Å; D275-Y420 WeakPolarHBondContact O-CA 3.41Å; D275-G421 PolarHBondContact N-O 3.3Å; D275-G421 VanDerWaalsContact N-O 3.14Å; D275-G421 PolarHBondContact O-N 3.11Å
276	P	95.9	Very high	85.3	Confident	74 Å²	74	68.7 Å²	68.7	48%	0.481	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	133	174.5	29	-33.4	0	0	0	110.4	E418 Y420	P276-E418 HydrophobicContact CB-CG 3.87Å; P276-Y420 HydrophobicContact CB-CD1 4.25Å; P276-Y420 HydrophobicContact CB-CE1 4.1Å
277	L	94.8	Very high	86.5	Confident	24 Å²	24	69.8 Å²	69.8	13%	0.126	39%	0.394	C	S	.	.			trans	-86.6	-8.6	-177.7	-64	-174.8	0	0	0	113.7	I284 L328 R332 V419	L277-I284 HydrophobicContact CB-CD1 4.44Å; L277-I284 WeakPolarHBondContact O-CG1 3.44Å; L277-L328 HydrophobicContact CD1-CD1 4.02Å; L277-L328 HydrophobicContact CD1-CD2 4.18Å; L277-R332 HydrophobicContact CD1-CB 4.07Å; L277-R332 HydrophobicContact CD1-CG 4.34Å; L277-V419 HydrophobicContact CB-CB 4.49Å; L277-V419 WeakPolarHBondContact CB-O 3.26Å; L277-V419 HydrophobicContact CD1-CB 4.37Å; L277-V419 HydrophobicContact CD1-CG1 3.8Å; L277-V419 PolarHBondContact N-O 2.78Å
278	G	95.6	Very high	88	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	39%	0.387	C	S	.	.	S	Bend	trans	123.9	24.6	160.4	0	0	0	0	0	117	S281 G282 E283 I284 E418	G278-S281 WeakPolarHBondContact CA-OG 3.36Å; G278-G282 PolarHBondContact O-N 3.14Å; G278-E283 PolarHBondContact O-N 2.68Å; G278-I284 PolarHBondContact O-N 3.31Å; G278-I284 VanDerWaalsContact O-N 3.11Å; G278-E418 PolarHBondContact N-OE1 3.14Å
279	M	97.4	Very high	89.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-50.1	169.8	-67	-67.2	-62.7	0	0	110.4	I284 I289 R305 V326 F417 E418	M279-I284 HydrophobicContact CG-CD1 4.14Å; M279-I284 HydrophobicContact SD-CB 4.48Å; M279-I284 HydrophobicContact SD-CD1 4.02Å; M279-I284 HydrophobicContact SD-CG2 4.14Å; M279-I289 HydrophobicContact CE-CD1 3.8Å; M279-I289 HydrophobicContact CE-CG1 4.26Å; M279-I289 HydrophobicContact SD-CD1 4.24Å; M279-I289 HydrophobicContact SD-CG1 4.37Å; M279-R305 HydrophobicContact CE-CG 4.48Å; M279-R305 WeakPolarHBondContact O-CB 3.33Å; M279-R305 VanDerWaalsContact O-CD 3.3Å; M279-R305 WeakPolarHBondContact O-CD 3.24Å; M279-R305 WeakPolarHBondContact O-CG 3.09Å; M279-R305 PolarHBondContact O-NH1 3.13Å; M279-V326 HydrophobicContact SD-CB 4.46Å; M279-V326 HydrophobicContact SD-CG2 4.03Å; M279-F417 WeakPolarHBondContact CB-O 3.3Å; M279-F417 HydrophobicContact CE-CD1 4.07Å; M279-F417 HydrophobicContact CE-CD2 4.31Å; M279-F417 HydrophobicContact CE-CE1 3.5Å; M279-F417 HydrophobicContact CE-CE2 3.78Å; M279-F417 HydrophobicContact CE-CG 4.44Å; M279-F417 HydrophobicContact CE-CZ 3.34Å; M279-F417 HydrophobicContact CG-CD2 4.3Å; M279-F417 HydrophobicContact CG-CE2 4.09Å; M279-F417 HydrophobicContact SD-CE2 3.88Å; M279-F417 HydrophobicContact SD-CZ 3.88Å; M279-E418 WeakPolarHBondContact CB-OE1 3.47Å; M279-E418 WeakPolarHBondContact CG-OE1 3.07Å; M279-E418 PolarHBondContact N-OE1 3.18Å; M279-E418 PolarHBondContact N-OE2 3.06Å
280	E	97.3	Very high	90.9	Very high	100 Å²	100	59.5 Å²	59.5	47%	0.467	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-40.8	-180	-173.8	168.3	-168.6	0	0	112.5	G282 L306 N307 E418	E280-G282 VanDerWaalsContact C-N 3.31Å; E280-G282 PolarHBondContact O-N 3.17Å; E280-L306 HydrophobicContact CB-CB 4.25Å; E280-N307 PolarHBondContact OE1-ND2 3.45Å; E280-N307 PolarHBondContact OE2-ND2 2.99Å; E280-E418 PolarHBondContact N-OE2 2.87Å
281	S	95.6	Very high	92.3	Very high	89 Å²	89	53.1 Å²	53.1	62%	0.622	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-22.3	-176.1	68.9	0	0	0	0	114	G278 E283	G278-S281 WeakPolarHBondContact CA-OG 3.36Å; S281-E283 PolarHBondContact OG-N 3.36Å
282	G	91.7	Very high	93.2	Very high	37 Å²	37	52.8 Å²	52.8	38%	0.381	31%	0.309	S	S	.	.	S	Bend	trans	86.6	1.1	-173	0	0	0	0	0	114.6	G278 E280 I284	G278-G282 PolarHBondContact O-N 3.14Å; E280-G282 VanDerWaalsContact C-N 3.31Å; E280-G282 PolarHBondContact O-N 3.17Å; G282-I284 CarbonylContact O-C 3.59Å; G282-I284 PolarHBondContact O-N 3.2Å
283	E	90.1	Very high	94.1	Very high	91 Å²	91	48.9 Å²	48.9	43%	0.425	29%	0.291	S	S	.	.			trans	-61.1	-34.2	173.4	-177.3	175.4	-180	0	0	111.3	G278 S281 T285	G278-E283 PolarHBondContact O-N 2.68Å; S281-E283 PolarHBondContact OG-N 3.36Å; E283-T285 PolarHBondContact O-N 2.86Å
284	I	92.5	Very high	94.5	Very high	5 Å²	5	53 Å²	53	3%	0.026	31%	0.309	C	S	.	.	S	Bend	trans	-80.2	113.3	162.9	-61.9	175.9	0	0	0	107.5	L277 G278 M279 G282 Q288 I289 R305 V326 L328	L277-I284 HydrophobicContact CB-CD1 4.44Å; L277-I284 WeakPolarHBondContact O-CG1 3.44Å; G278-I284 PolarHBondContact O-N 3.31Å; G278-I284 VanDerWaalsContact O-N 3.11Å; M279-I284 HydrophobicContact CG-CD1 4.14Å; M279-I284 HydrophobicContact SD-CB 4.48Å; M279-I284 HydrophobicContact SD-CD1 4.02Å; M279-I284 HydrophobicContact SD-CG2 4.14Å; G282-I284 CarbonylContact O-C 3.59Å; G282-I284 PolarHBondContact O-N 3.2Å; I284-Q288 HydrophobicContact CG2-CB 3.85Å; I284-I289 HydrophobicContact CG2-CG1 4.11Å; I284-R305 VanDerWaalsContact O-CZ 3.26Å; I284-R305 PolarHBondContact O-NH1 2.82Å; I284-R305 PolarHBondContact O-NH2 3.47Å; I284-V326 HydrophobicContact CD1-CG2 3.92Å; I284-V326 HydrophobicContact CG2-CG2 3.48Å; I284-V326 VanDerWaalsContact CG2-CG2 3.48Å; I284-L328 HydrophobicContact CD1-CD2 3.81Å
285	T	91.6	Very high	94.7	Very high	66 Å²	66	58.7 Å²	58.7	41%	0.405	33%	0.326	S	S	.	.			trans	-72.7	162.7	-179.4	72.8	0	0	0	0	111.4	E283 D287 Q288	E283-T285 PolarHBondContact O-N 2.86Å; T285-D287 VanDerWaalsContact C-N 3.26Å; T285-D287 PolarHBondContact O-N 3.03Å; T285-Q288 WeakPolarHBondContact O-CB 3.43Å; T285-Q288 PolarHBondContact O-N 2.84Å; T285-Q288 PolarHBondContact OG1-OE1 2.74Å
286	S	91.6	Very high	94.9	Very high	53 Å²	53	57.2 Å²	57.2	37%	0.371	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-65	-29.7	-178.7	-61.5	0	0	0	0	113	Q288 I289 R305	S286-Q288 PolarHBondContact O-N 3.22Å; S286-I289 PolarHBondContact O-N 2.97Å; S286-R305 PolarHBondContact OG-NH2 3.26Å
287	D	89.4	Confident	94.8	Very high	149 Å²	149	58.5 Å²	58.5	80%	0.797	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-66.9	-24.1	177.4	-60.4	-32.7	0	0	0	112.6	T285 I289	T285-D287 VanDerWaalsContact C-N 3.26Å; T285-D287 PolarHBondContact O-N 3.03Å; D287-I289 VanDerWaalsContact C-N 3.26Å; D287-I289 PolarHBondContact O-N 3.48Å
288	Q	94	Very high	94.9	Very high	41 Å²	41	59.4 Å²	59.4	19%	0.192	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-78.7	-10.7	175.7	-66.8	175.6	-83.8	0	0	112.7	I284 T285 S286 V326 D327	I284-Q288 HydrophobicContact CG2-CB 3.85Å; T285-Q288 WeakPolarHBondContact O-CB 3.43Å; T285-Q288 PolarHBondContact O-N 2.84Å; T285-Q288 PolarHBondContact OG1-OE1 2.74Å; S286-Q288 PolarHBondContact O-N 3.22Å; Q288-V326 CarbonylContact O-C 3.5Å; Q288-V326 WeakPolarHBondContact O-CA 3.31Å; Q288-D327 HydrophobicContact CB-CB 4.4Å; Q288-D327 WeakPolarHBondContact CB-O 3.34Å; Q288-D327 PolarHBondContact NE2-O 2.88Å; Q288-D327 PolarHBondContact O-N 3.25Å
289	I	97.3	Very high	94.9	Very high	11 Å²	11	60.2 Å²	60.2	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	117.3	-178.4	-51.8	170.9	0	0	0	109	M279 I284 S286 D287 P301 R305 I324	M279-I289 HydrophobicContact CE-CD1 3.8Å; M279-I289 HydrophobicContact CE-CG1 4.26Å; M279-I289 HydrophobicContact SD-CD1 4.24Å; M279-I289 HydrophobicContact SD-CG1 4.37Å; I284-I289 HydrophobicContact CG2-CG1 4.11Å; S286-I289 PolarHBondContact O-N 2.97Å; D287-I289 VanDerWaalsContact C-N 3.26Å; D287-I289 PolarHBondContact O-N 3.48Å; I289-P301 HydrophobicContact CG2-CB 3.92Å; I289-R305 HydrophobicContact CD1-CG 4.43Å; I289-I324 HydrophobicContact CG2-CD1 4.16Å; I289-I324 HydrophobicContact CG2-CG1 4.36Å
290	M	97.3	Very high	94.9	Very high	71 Å²	71	60.7 Å²	60.7	35%	0.35	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.6	-178.4	-69.3	165.3	-89.1	0	0	110.3	W323 I324 Q325 D327 F401	M290-W323 HydrophobicContact CB-CZ3 4.38Å; M290-I324 CarbonylContact O-C 3.5Å; M290-Q325 HydrophobicContact CB-CG 3.81Å; M290-Q325 HydrophobicContact CE-CG 4.48Å; M290-Q325 PolarHBondContact N-O 2.88Å; M290-Q325 PolarHBondContact O-N 2.83Å; M290-Q325 VanDerWaalsContact O-O 3.05Å; M290-D327 HydrophobicContact CE-CB 4.18Å; M290-F401 HydrophobicContact CE-CE1 4.27Å
291	A	97.9	Very high	95	Very high	23 Å²	23	57 Å²	57	19%	0.19	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	163	174.5	0	0	0	0	0	111.3	S293 P301 W313 W323 I324	A291-S293 VanDerWaalsContact C-N 3.3Å; A291-P301 HydrophobicContact CB-CB 4.28Å; A291-P301 HydrophobicContact CB-CG 3.76Å; A291-W313 HydrophobicContact CB-CZ2 3.95Å; A291-W323 VanDerWaalsContact C-CZ3 3.44Å; A291-W323 CarbonylContact C-O 3.42Å; A291-W323 WeakPolarHBondContact CA-O 3.34Å; A291-I324 HydrophobicContact CB-CB 4.38Å; A291-I324 HydrophobicContact CB-CG1 4.26Å
292	S	97.7	Very high	95	Very high	42 Å²	42	56.9 Å²	56.9	29%	0.294	32%	0.316	S	S	.	.	S	Bend	trans	-59.8	-42.8	172.3	48.9	0	0	0	0	111.9	E322 W323	S292-E322 VanDerWaalsContact CB-OE2 3.31Å; S292-E322 WeakPolarHBondContact CB-OE2 3.34Å; S292-E322 WeakPolarHBondContact OG-CA 3.2Å; S292-E322 PolarHBondContact OG-OE2 3.44Å; S292-W323 PolarHBondContact N-O 2.84Å; S292-W323 PolarHBondContact OG-N 3.24Å; S292-W323 PolarHBondContact OG-O 3.08Å
293	S	97.6	Very high	95.3	Very high	30 Å²	30	56.5 Å²	56.5	21%	0.21	30%	0.303	C	S	.	.			trans	-161.3	171.8	179.9	66.1	0	0	0	0	109.6	A291 W313 P315 A316 E322	A291-S293 VanDerWaalsContact C-N 3.3Å; S293-W313 PolarHBondContact O-NE1 3.45Å; S293-P315 WeakPolarHBondContact OG-CB 3.39Å; S293-A316 PolarHBondContact OG-N 3.48Å; S293-E322 PolarHBondContact OG-OE2 3.06Å
294	H	97.3	Very high	95.6	Very high	92 Å²	92	52.2 Å²	52.2	43%	0.426	28%	0.283	S	S	.	.			trans	-142.9	146.8	169	61.9	-87.3	0	0	0	109.7	T314	H294-T314 CarbonylContact C-O 3.52Å; H294-T314 VanDerWaalsContact CA-O 3.31Å; H294-T314 WeakPolarHBondContact CA-O 3.03Å
295	Y	95.3	Very high	95.9	Very high	152 Å²	152	53.4 Å²	53.4	60%	0.596	29%	0.287	S	S	*	.	S	Bend	trans	-66.9	-48.2	-175.2	179.8	-113.5	0	0	0	112.7	T314	Y295-T314 PolarHBondContact N-O 3.32Å
296	N	94.6	Very high	96.2	Very high	51 Å²	51	50.5 Å²	50.5	27%	0.273	27%	0.269	S	S	.	.	S	Bend	trans	-162.9	175.4	174.1	66.7	39.4	0	0	0	109.2	S298 W299 S300	N296-S298 PolarHBondContact O-N 3.23Å; N296-S298 WeakPolarHBondContact OD1-CA 3.48Å; N296-S298 VanDerWaalsContact OD1-CB 3.25Å; N296-S298 WeakPolarHBondContact OD1-CB 3.23Å; N296-S298 PolarHBondContact OD1-N 3.26Å; N296-W299 CarbonylContact O-C 3.51Å; N296-W299 PolarHBondContact O-N 3.16Å; N296-W299 PolarHBondContact OD1-N 3.14Å; N296-S300 PolarHBondContact O-N 2.82Å
297	P	95.4	Very high	96.5	Very high	101 Å²	101	51.8 Å²	51.8	66%	0.656	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-59.5	-24.7	179.7	-27.4	36.9	0	0	0	115.2	W299 S300	P297-W299 PolarHBondContact O-N 2.95Å; P297-S300 WeakPolarHBondContact O-CB 3.47Å; P297-S300 PolarHBondContact O-OG 3.34Å; P297-S300 VanDerWaalsContact O-OG 3.13Å
298	S	95.3	Very high	96.9	Very high	44 Å²	44	46.8 Å²	46.8	31%	0.308	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-76.3	-6.5	174.8	-53.9	0	0	0	0	113.6	N296 R303 N311	N296-S298 PolarHBondContact O-N 3.23Å; N296-S298 WeakPolarHBondContact OD1-CA 3.48Å; N296-S298 VanDerWaalsContact OD1-CB 3.25Å; N296-S298 WeakPolarHBondContact OD1-CB 3.23Å; N296-S298 PolarHBondContact OD1-N 3.26Å; S298-R303 WeakPolarHBondContact O-CD 3.47Å; S298-R303 PolarHBondContact O-NE 3.41Å; S298-N311 WeakPolarHBondContact O-CB 3.33Å; S298-N311 PolarHBondContact O-ND2 3.45Å; S298-N311 VanDerWaalsContact O-ND2 3.1Å
299	W	97	Very high	96.8	Very high	16 Å²	16	52.8 Å²	52.8	6%	0.061	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-129.7	31.5	176.1	-64	84.7	0	0	0	111.8	N296 P297 N311 A312 T314 A342 Y351 A414	N296-W299 CarbonylContact O-C 3.51Å; N296-W299 PolarHBondContact O-N 3.16Å; N296-W299 PolarHBondContact OD1-N 3.14Å; P297-W299 PolarHBondContact O-N 2.95Å; W299-N311 HydrophobicContact CD2-CB 3.93Å; W299-N311 HydrophobicContact CE3-CB 3.92Å; W299-N311 HydrophobicContact CH2-CB 3.87Å; W299-N311 HydrophobicContact CZ2-CB 3.85Å; W299-N311 HydrophobicContact CZ3-CB 3.91Å; W299-A312 CarbonylContact C-O 3.32Å; W299-A312 WeakPolarHBondContact CA-O 3.5Å; W299-A312 HydrophobicContact CE3-CB 4.41Å; W299-A312 HydrophobicContact CZ3-CB 4.2Å; W299-T314 PolarHBondContact O-N 3.19Å; W299-A342 HydrophobicContact CH2-CB 4.44Å; W299-A342 HydrophobicContact CZ3-CB 4.14Å; W299-Y351 HydrophobicContact CH2-CD2 4.32Å; W299-A414 HydrophobicContact CZ3-CB 4.04Å
300	S	97.4	Very high	96.7	Very high	11 Å²	11	54.7 Å²	54.7	8%	0.077	27%	0.273	C	S	.	.			trans	-65.8	161.2	-178.2	53.9	0	0	0	0	112.8	N296 P297 E302 R303	N296-S300 PolarHBondContact O-N 2.82Å; P297-S300 WeakPolarHBondContact O-CB 3.47Å; P297-S300 PolarHBondContact O-OG 3.34Å; P297-S300 VanDerWaalsContact O-OG 3.13Å; S300-E302 PolarHBondContact O-N 3.19Å; S300-E302 VanDerWaalsContact OG-CG 3.29Å; S300-E302 WeakPolarHBondContact OG-CG 3.36Å; S300-E302 PolarHBondContact OG-OE1 3.44Å; S300-R303 WeakPolarHBondContact O-CB 3.17Å; S300-R303 PolarHBondContact O-N 2.82Å; S300-R303 VanDerWaalsContact O-N 3.13Å
301	P	97.6	Very high	96.6	Very high	23 Å²	23	51.6 Å²	51.6	15%	0.149	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.8	-30.6	177.2	-25.3	36	0	0	0	114.1	I289 A291 R303 S304 I324	I289-P301 HydrophobicContact CG2-CB 3.92Å; A291-P301 HydrophobicContact CB-CB 4.28Å; A291-P301 HydrophobicContact CB-CG 3.76Å; P301-R303 PolarHBondContact O-N 2.9Å; P301-S304 WeakPolarHBondContact O-CB 3.4Å; P301-S304 PolarHBondContact O-N 3.19Å; P301-S304 PolarHBondContact O-OG 3.32Å; P301-I324 HydrophobicContact CB-CD1 4.27Å
302	E	96.2	Very high	96.6	Very high	85 Å²	85	50.5 Å²	50.5	40%	0.397	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-62.6	-25.8	177.8	78.5	-154.1	152.1	0	0	113	S300 S304 R305	S300-E302 PolarHBondContact O-N 3.19Å; S300-E302 VanDerWaalsContact OG-CG 3.29Å; S300-E302 WeakPolarHBondContact OG-CG 3.36Å; S300-E302 PolarHBondContact OG-OE1 3.44Å; E302-S304 PolarHBondContact O-N 3.07Å; E302-R305 WeakPolarHBondContact O-CG 3.26Å
303	R	97.4	Very high	96.6	Very high	30 Å²	30	48.5 Å²	48.5	11%	0.113	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-80	0.9	176.7	-60.3	-176.6	172.4	-110.7	1	112.5	S298 S300 P301 R305 Y308 E310 A312 R416	S298-R303 WeakPolarHBondContact O-CD 3.47Å; S298-R303 PolarHBondContact O-NE 3.41Å; S300-R303 WeakPolarHBondContact O-CB 3.17Å; S300-R303 PolarHBondContact O-N 2.82Å; S300-R303 VanDerWaalsContact O-N 3.13Å; P301-R303 PolarHBondContact O-N 2.9Å; R303-R305 PolarHBondContact O-N 2.72Å; R303-Y308 HydrophobicContact CB-CD1 3.98Å; R303-Y308 HydrophobicContact CB-CE1 4.09Å; R303-Y308 HydrophobicContact CB-CG 4.39Å; R303-Y308 HydrophobicContact CG-CD1 4.03Å; R303-Y308 HydrophobicContact CG-CE1 3.61Å; R303-E310 IonicContact CZ-OE2 3.64Å; R303-E310 PolarHBondContact NH1-O 2.85Å; R303-E310 VanDerWaalsContact NH1-O 3.16Å; R303-E310 IonicContact NH1-OE2 2.67Å; R303-E310 PolarHBondContact NH1-OE2 2.84Å; R303-E310 IonicContact NH2-OE2 3.67Å; R303-A312 WeakPolarHBondContact O-CA 2.81Å; R303-R416 WeakPolarHBondContact O-CG 3.13Å
304	S	98.3	Very high	96.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-78.4	-1.1	174.2	71.7	0	0	0	0	114	P301 E302 I324 L415 R416 F417	P301-S304 WeakPolarHBondContact O-CB 3.4Å; P301-S304 PolarHBondContact O-N 3.19Å; P301-S304 PolarHBondContact O-OG 3.32Å; E302-S304 PolarHBondContact O-N 3.07Å; S304-I324 WeakPolarHBondContact OG-CD1 3.41Å; S304-L415 WeakPolarHBondContact CA-O 3.33Å; S304-R416 CarbonylContact O-C 3.08Å; S304-R416 WeakPolarHBondContact O-CA 3.13Å; S304-F417 PolarHBondContact O-N 3.04Å; S304-F417 WeakPolarHBondContact OG-CE1 3.44Å
305	R	98.6	Very high	96.7	Very high	31 Å²	31	43.6 Å²	43.6	12%	0.117	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-62.2	140.8	175.9	-61.8	175.4	-178.9	-78.3	0.2	110.3	M279 I284 S286 I289 E302 R303 N307 Y308 R416	M279-R305 HydrophobicContact CE-CG 4.48Å; M279-R305 WeakPolarHBondContact O-CB 3.33Å; M279-R305 VanDerWaalsContact O-CD 3.3Å; M279-R305 WeakPolarHBondContact O-CD 3.24Å; M279-R305 WeakPolarHBondContact O-CG 3.09Å; M279-R305 PolarHBondContact O-NH1 3.13Å; I284-R305 VanDerWaalsContact O-CZ 3.26Å; I284-R305 PolarHBondContact O-NH1 2.82Å; I284-R305 PolarHBondContact O-NH2 3.47Å; S286-R305 PolarHBondContact OG-NH2 3.26Å; I289-R305 HydrophobicContact CD1-CG 4.43Å; E302-R305 WeakPolarHBondContact O-CG 3.26Å; R303-R305 PolarHBondContact O-N 2.72Å; R305-N307 PolarHBondContact O-N 2.83Å; R305-Y308 HydrophobicContact CB-CD2 4.17Å; R305-Y308 VanDerWaalsContact O-CB 3.31Å; R305-Y308 WeakPolarHBondContact O-CB 3.19Å; R305-Y308 PolarHBondContact O-N 2.8Å; R305-R416 WeakPolarHBondContact O-CB 3.47Å; R305-R416 WeakPolarHBondContact O-CG 3.3Å
306	L	98.1	Very high	96.8	Very high	5 Å²	5	39 Å²	39	3%	0.026	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	142.2	175.5	-160.3	74.8	0	0	0	110	E280 Y308 Q340 V388 F417 E418	E280-L306 HydrophobicContact CB-CB 4.25Å; L306-Y308 PolarHBondContact O-N 3.14Å; L306-Q340 HydrophobicContact CD1-CB 4.27Å; L306-Q340 HydrophobicContact CD1-CG 3.86Å; L306-V388 HydrophobicContact CD1-CG1 4.22Å; L306-V388 HydrophobicContact CD1-CG2 4.25Å; L306-V388 HydrophobicContact CD2-CG1 4.25Å; L306-V388 HydrophobicContact CD2-CG2 4.18Å; L306-V388 HydrophobicContact CG-CG2 4.42Å; L306-F417 PolarHBondContact N-O 2.85Å; L306-F417 VanDerWaalsContact N-O 3.17Å; L306-E418 HydrophobicContact CB-CB 3.97Å; L306-E418 HydrophobicContact CD1-CB 4.48Å; L306-E418 HydrophobicContact CD2-CB 3.77Å; L306-E418 HydrophobicContact CG-CB 4.29Å
307	N	97.5	Very high	96.9	Very high	79 Å²	79	43.2 Å²	43.2	42%	0.422	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	19	-177.5	-58.8	-42.9	0	0	0	115.7	E280 R305 Y309 Q340	E280-N307 PolarHBondContact OE1-ND2 3.45Å; E280-N307 PolarHBondContact OE2-ND2 2.99Å; R305-N307 PolarHBondContact O-N 2.83Å; N307-Y309 PolarHBondContact O-N 2.89Å; N307-Q340 PolarHBondContact OD1-NE2 2.76Å; N307-Q340 PolarHBondContact OD1-OE1 3.29Å
308	Y	96.9	Very high	97	Very high	45 Å²	45	42 Å²	42	18%	0.176	21%	0.21	C	C	.	.			trans	-55.2	135	172.2	-158.2	-89.2	0	0	0	110.4	R303 R305 L306 E310 R416	R303-Y308 HydrophobicContact CB-CD1 3.98Å; R303-Y308 HydrophobicContact CB-CE1 4.09Å; R303-Y308 HydrophobicContact CB-CG 4.39Å; R303-Y308 HydrophobicContact CG-CD1 4.03Å; R303-Y308 HydrophobicContact CG-CE1 3.61Å; R305-Y308 HydrophobicContact CB-CD2 4.17Å; R305-Y308 VanDerWaalsContact O-CB 3.31Å; R305-Y308 WeakPolarHBondContact O-CB 3.19Å; R305-Y308 PolarHBondContact O-N 2.8Å; L306-Y308 PolarHBondContact O-N 3.14Å; Y308-E310 VanDerWaalsContact C-N 3.33Å; Y308-E310 VanDerWaalsContact CD1-O 3.27Å; Y308-E310 WeakPolarHBondContact CD1-O 3.32Å; Y308-E310 PolarHBondContact O-N 2.88Å; Y308-R416 PolarHBondContact O-NH1 2.92Å
309	Y	93.1	Very high	97.1	Very high	166 Å²	166	41.1 Å²	41.1	65%	0.651	20%	0.203	S	C	*	.	S	Bend	trans	-73.7	-21.8	-163.5	62.7	-83.2	0	0	0	113.9	N307	N307-Y309 PolarHBondContact O-N 2.89Å
310	E	93.6	Very high	97	Very high	52 Å²	52	45.1 Å²	45.1	24%	0.243	23%	0.226	C	C	.	.	S	Bend	trans	-137	127.3	-178.4	-82.3	173.6	-175.5	0	0	112.6	R303 Y308 Q345	R303-E310 IonicContact CZ-OE2 3.64Å; R303-E310 PolarHBondContact NH1-O 2.85Å; R303-E310 VanDerWaalsContact NH1-O 3.16Å; R303-E310 IonicContact NH1-OE2 2.67Å; R303-E310 PolarHBondContact NH1-OE2 2.84Å; R303-E310 IonicContact NH2-OE2 3.67Å; Y308-E310 VanDerWaalsContact C-N 3.33Å; Y308-E310 VanDerWaalsContact CD1-O 3.27Å; Y308-E310 WeakPolarHBondContact CD1-O 3.32Å; Y308-E310 PolarHBondContact O-N 2.88Å; E310-Q345 PolarHBondContact OE1-NE2 3.47Å; E310-Q345 PolarHBondContact OE1-OE1 3Å
311	N	96.5	Very high	97	Very high	5 Å²	5	52 Å²	52	3%	0.027	25%	0.254	C	S	.	.			trans	54.2	-150.9	177.1	-61	-18.4	0	0	0	112.1	S298 W299 A342 S344 Q345 E346	S298-N311 WeakPolarHBondContact O-CB 3.33Å; S298-N311 PolarHBondContact O-ND2 3.45Å; S298-N311 VanDerWaalsContact O-ND2 3.1Å; W299-N311 HydrophobicContact CD2-CB 3.93Å; W299-N311 HydrophobicContact CE3-CB 3.92Å; W299-N311 HydrophobicContact CH2-CB 3.87Å; W299-N311 HydrophobicContact CZ2-CB 3.85Å; W299-N311 HydrophobicContact CZ3-CB 3.91Å; N311-A342 WeakPolarHBondContact O-CB 3.31Å; N311-S344 WeakPolarHBondContact OD1-CA 3.43Å; N311-Q345 PolarHBondContact OD1-N 2.76Å; N311-E346 PolarHBondContact ND2-OE1 2.77Å
312	A	97.5	Very high	97	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.253	C	S	.	.			trans	-159	-175.4	177.7	0	0	0	0	0	109.5	W299 R303 A342 A414 R416	W299-A312 CarbonylContact C-O 3.32Å; W299-A312 WeakPolarHBondContact CA-O 3.5Å; W299-A312 HydrophobicContact CE3-CB 4.41Å; W299-A312 HydrophobicContact CZ3-CB 4.2Å; R303-A312 WeakPolarHBondContact O-CA 2.81Å; A312-A342 HydrophobicContact CB-CB 3.49Å; A312-A342 VanDerWaalsContact CB-CB 3.49Å; A312-A414 HydrophobicContact CB-CB 4.16Å; A312-R416 HydrophobicContact CB-CG 3.8Å
313	W	98.5	Very high	97.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-72.5	132	160.7	167.9	74.5	0	0	0	111	A291 S293 P315 W323 I324 P406 I413 A414 L415	A291-W313 HydrophobicContact CB-CZ2 3.95Å; S293-W313 PolarHBondContact O-NE1 3.45Å; W313-P315 HydrophobicContact CH2-CB 4.37Å; W313-P315 HydrophobicContact CH2-CG 4.26Å; W313-P315 HydrophobicContact CZ2-CB 3.87Å; W313-P315 HydrophobicContact CZ2-CG 4.21Å; W313-W323 WeakPolarHBondContact CZ2-O 3.22Å; W313-I324 HydrophobicContact CB-CD1 3.75Å; W313-I324 HydrophobicContact CD2-CB 3.93Å; W313-I324 HydrophobicContact CD2-CD1 3.66Å; W313-I324 HydrophobicContact CD2-CG1 4.34Å; W313-I324 HydrophobicContact CD2-CG2 4.41Å; W313-I324 HydrophobicContact CE3-CB 3.83Å; W313-I324 HydrophobicContact CE3-CD1 4.05Å; W313-I324 HydrophobicContact CE3-CG2 3.82Å; W313-I324 HydrophobicContact CG-CD1 3.52Å; W313-I324 HydrophobicContact CH2-CB 3.94Å; W313-I324 HydrophobicContact CH2-CG2 4.25Å; W313-I324 HydrophobicContact CZ2-CB 4.05Å; W313-I324 HydrophobicContact CZ3-CB 3.83Å; W313-I324 HydrophobicContact CZ3-CG2 3.73Å; W313-P406 HydrophobicContact CZ3-CG 4.37Å; W313-I413 HydrophobicContact CH2-CG2 4.34Å; W313-I413 HydrophobicContact CZ3-CG2 3.88Å; W313-A414 WeakPolarHBondContact O-CA 3.27Å; W313-L415 HydrophobicContact CE3-CB 3.94Å; W313-L415 HydrophobicContact CZ3-CB 4.35Å; W313-L415 PolarHBondContact N-O 2.67Å; W313-L415 PolarHBondContact O-N 2.95Å
314	T	98.6	Very high	97.2	Very high	18 Å²	18	49.4 Å²	49.4	11%	0.11	24%	0.239	C	C	.	.			trans	-135.1	129	169.8	-72.1	0	0	0	0	109	H294 Y295 W299 I413	H294-T314 CarbonylContact C-O 3.52Å; H294-T314 VanDerWaalsContact CA-O 3.31Å; H294-T314 WeakPolarHBondContact CA-O 3.03Å; Y295-T314 PolarHBondContact N-O 3.32Å; W299-T314 PolarHBondContact O-N 3.19Å; T314-I413 VanDerWaalsContact CB-O 3.26Å; T314-I413 WeakPolarHBondContact CB-O 3.12Å; T314-I413 WeakPolarHBondContact CG2-O 3.44Å; T314-I413 PolarHBondContact OG1-O 2.87Å
315	P	98.3	Very high	97.1	Very high	2 Å²	2	50 Å²	50	1%	0.013	24%	0.242	C	C	.	.			trans	-67.9	168.8	177.1	29.7	-35.6	0	0	0	112.3	S293 W313 E317 E322 I413	S293-P315 WeakPolarHBondContact OG-CB 3.39Å; W313-P315 HydrophobicContact CH2-CB 4.37Å; W313-P315 HydrophobicContact CH2-CG 4.26Å; W313-P315 HydrophobicContact CZ2-CB 3.87Å; W313-P315 HydrophobicContact CZ2-CG 4.21Å; P315-E317 VanDerWaalsContact C-N 3.27Å; P315-E317 WeakPolarHBondContact CG-O 3.5Å; P315-E317 PolarHBondContact O-N 2.03Å; P315-E322 HydrophobicContact CB-CB 3.92Å; P315-E322 HydrophobicContact CB-CG 3.6Å; P315-E322 HydrophobicContact CG-CB 3.99Å; P315-E322 HydrophobicContact CG-CG 3.8Å; P315-I413 HydrophobicContact CG-CB 3.92Å; P315-I413 HydrophobicContact CG-CD1 3.95Å; P315-I413 HydrophobicContact CG-CG2 3.94Å
316	A	97.6	Very high	97.1	Very high	55 Å²	55	48.5 Å²	48.5	46%	0.455	24%	0.236	S	C	.	.	S	Bend	trans	-65.2	-31.4	176.5	0	0	0	0	0	112.8	S293	S293-A316 PolarHBondContact OG-N 3.48Å
317	E	96.7	Very high	97	Very high	139 Å²	139	49.3 Å²	49.3	65%	0.65	24%	0.24	S	C	*	.	S	Bend	trans	-132.6	142.6	177.5	-63.8	-173	174.9	0	0	111.4	P315 S319 E322	P315-E317 VanDerWaalsContact C-N 3.27Å; P315-E317 WeakPolarHBondContact CG-O 3.5Å; P315-E317 PolarHBondContact O-N 2.03Å; E317-S319 PolarHBondContact O-N 3.36Å; E317-E322 WeakPolarHBondContact O-CG 3.43Å
318	D	97.3	Very high	96.9	Very high	77 Å²	77	46 Å²	46	41%	0.412	22%	0.223	S	C	.	.			trans	-80.7	87.9	175.6	-74.3	-35.4	0	0	0	111.1	W409 G412 I413	D318-W409 HydrophobicContact CB-CZ2 3.9Å; D318-W409 VanDerWaalsContact O-CZ2 3.32Å; D318-W409 WeakPolarHBondContact O-CZ2 3.37Å; D318-G412 WeakPolarHBondContact OD2-CA 3.45Å; D318-I413 WeakPolarHBondContact OD1-CB 3.39Å; D318-I413 PolarHBondContact OD1-N 3.47Å
319	S	97.6	Very high	96.5	Very high	24 Å²	24	45 Å²	45	17%	0.168	23%	0.226	C	C	.	.			trans	-136.8	148.7	-173.6	154.4	0	0	0	0	112.1	E317 K321 E322	E317-S319 PolarHBondContact O-N 3.36Å; S319-K321 PolarHBondContact O-N 2.83Å; S319-K321 WeakPolarHBondContact OG-CB 3.34Å; S319-K321 PolarHBondContact OG-N 3.25Å; S319-E322 WeakPolarHBondContact O-CB 3.32Å; S319-E322 WeakPolarHBondContact O-CG 3.39Å; S319-E322 PolarHBondContact O-N 2.67Å
320	N	94.5	Very high	96.4	Very high	100 Å²	100	37.6 Å²	37.6	54%	0.535	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	2.4	175.2	69.9	2.2	0	0	0	113.9
321	K	96.1	Very high	96.4	Very high	156 Å²	156	35.1 Å²	35.1	68%	0.678	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-18.9	169.9	-59.6	180	-178.8	175.4	0	112.1	S319	S319-K321 PolarHBondContact O-N 2.83Å; S319-K321 WeakPolarHBondContact OG-CB 3.34Å; S319-K321 PolarHBondContact OG-N 3.25Å
322	E	98.3	Very high	96.2	Very high	25 Å²	25	35.6 Å²	35.6	12%	0.117	19%	0.187	C	C	.	.			trans	-69.3	154.3	179.2	-58	-53.1	124.5	0	0	111.7	S292 S293 P315 E317 S319 P406 I413	S292-E322 VanDerWaalsContact CB-OE2 3.31Å; S292-E322 WeakPolarHBondContact CB-OE2 3.34Å; S292-E322 WeakPolarHBondContact OG-CA 3.2Å; S292-E322 PolarHBondContact OG-OE2 3.44Å; S293-E322 PolarHBondContact OG-OE2 3.06Å; P315-E322 HydrophobicContact CB-CB 3.92Å; P315-E322 HydrophobicContact CB-CG 3.6Å; P315-E322 HydrophobicContact CG-CB 3.99Å; P315-E322 HydrophobicContact CG-CG 3.8Å; E317-E322 WeakPolarHBondContact O-CG 3.43Å; S319-E322 WeakPolarHBondContact O-CB 3.32Å; S319-E322 WeakPolarHBondContact O-CG 3.39Å; S319-E322 PolarHBondContact O-N 2.67Å; E322-P406 WeakPolarHBondContact O-CD 3.24Å; E322-I413 HydrophobicContact CB-CD1 4.43Å
323	W	98.4	Very high	96.1	Very high	59 Å²	59	36.3 Å²	36.3	22%	0.223	19%	0.191	C	C	.	.			trans	-155.7	153.3	-179.7	54.1	-96.5	0	0	0	111.7	M290 A291 S292 W313 Q325 R403 I404 R405	M290-W323 HydrophobicContact CB-CZ3 4.38Å; A291-W323 VanDerWaalsContact C-CZ3 3.44Å; A291-W323 CarbonylContact C-O 3.42Å; A291-W323 WeakPolarHBondContact CA-O 3.34Å; S292-W323 PolarHBondContact N-O 2.84Å; S292-W323 PolarHBondContact OG-N 3.24Å; S292-W323 PolarHBondContact OG-O 3.08Å; W313-W323 WeakPolarHBondContact CZ2-O 3.22Å; W323-Q325 HydrophobicContact CE3-CB 4.04Å; W323-Q325 HydrophobicContact CE3-CG 4.03Å; W323-Q325 HydrophobicContact CZ3-CB 4.13Å; W323-Q325 VanDerWaalsContact CZ3-CD 3.42Å; W323-Q325 HydrophobicContact CZ3-CG 3.6Å; W323-R403 HydrophobicContact CB-CG 3.63Å; W323-R403 HydrophobicContact CD2-CG 4.24Å; W323-R403 HydrophobicContact CE3-CG 4.24Å; W323-R403 HydrophobicContact CG-CG 4.03Å; W323-I404 VanDerWaalsContact CA-O 3.3Å; W323-I404 WeakPolarHBondContact CA-O 3.35Å; W323-R405 HydrophobicContact CB-CG 4.01Å
324	I	98.6	Very high	96	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.5	163.1	-172.5	158.8	0	0	0	108.1	I289 M290 A291 P301 S304 W313 R403 I404 L415 F417	I289-I324 HydrophobicContact CG2-CD1 4.16Å; I289-I324 HydrophobicContact CG2-CG1 4.36Å; M290-I324 CarbonylContact O-C 3.5Å; A291-I324 HydrophobicContact CB-CB 4.38Å; A291-I324 HydrophobicContact CB-CG1 4.26Å; P301-I324 HydrophobicContact CB-CD1 4.27Å; S304-I324 WeakPolarHBondContact OG-CD1 3.41Å; W313-I324 HydrophobicContact CB-CD1 3.75Å; W313-I324 HydrophobicContact CD2-CB 3.93Å; W313-I324 HydrophobicContact CD2-CD1 3.66Å; W313-I324 HydrophobicContact CD2-CG1 4.34Å; W313-I324 HydrophobicContact CD2-CG2 4.41Å; W313-I324 HydrophobicContact CE3-CB 3.83Å; W313-I324 HydrophobicContact CE3-CD1 4.05Å; W313-I324 HydrophobicContact CE3-CG2 3.82Å; W313-I324 HydrophobicContact CG-CD1 3.52Å; W313-I324 HydrophobicContact CH2-CB 3.94Å; W313-I324 HydrophobicContact CH2-CG2 4.25Å; W313-I324 HydrophobicContact CZ2-CB 4.05Å; W313-I324 HydrophobicContact CZ3-CB 3.83Å; W313-I324 HydrophobicContact CZ3-CG2 3.73Å; I324-R403 CarbonylContact O-C 3.57Å; I324-R403 WeakPolarHBondContact O-CA 3.23Å; I324-I404 HydrophobicContact CG2-CB 4.19Å; I324-I404 PolarHBondContact N-O 3.24Å; I324-I404 VanDerWaalsContact N-O 3.13Å; I324-I404 PolarHBondContact O-N 2.8Å; I324-L415 HydrophobicContact CG2-CD2 3.76Å; I324-F417 HydrophobicContact CD1-CE1 3.95Å; I324-F417 HydrophobicContact CG1-CE1 4.04Å; I324-F417 HydrophobicContact CG2-CD1 4.47Å; I324-F417 HydrophobicContact CG2-CE1 4.04Å
325	Q	98.1	Very high	95.9	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	160.4	-177.1	80.7	-175.8	30.9	0	0	111.5	M290 W323 W367 L402 R403	M290-Q325 HydrophobicContact CB-CG 3.81Å; M290-Q325 HydrophobicContact CE-CG 4.48Å; M290-Q325 PolarHBondContact N-O 2.88Å; M290-Q325 PolarHBondContact O-N 2.83Å; M290-Q325 VanDerWaalsContact O-O 3.05Å; W323-Q325 HydrophobicContact CE3-CB 4.04Å; W323-Q325 HydrophobicContact CE3-CG 4.03Å; W323-Q325 HydrophobicContact CZ3-CB 4.13Å; W323-Q325 VanDerWaalsContact CZ3-CD 3.42Å; W323-Q325 HydrophobicContact CZ3-CG 3.6Å; Q325-W367 HydrophobicContact CB-CH2 4.43Å; Q325-L402 CarbonylContact C-O 3.52Å; Q325-L402 WeakPolarHBondContact CA-O 3.33Å; Q325-L402 VanDerWaalsContact CB-O 3.29Å; Q325-L402 WeakPolarHBondContact CB-O 3.33Å; Q325-R403 HydrophobicContact CB-CB 3.8Å; Q325-R403 HydrophobicContact CB-CG 4.06Å; Q325-R403 VanDerWaalsContact OE1-CZ 3.25Å
326	V	98.1	Very high	95.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	135.8	176.2	64	0	0	0	0	110.2	M279 I284 Q288 L328 F401 L402 F417 V419	M279-V326 HydrophobicContact SD-CB 4.46Å; M279-V326 HydrophobicContact SD-CG2 4.03Å; I284-V326 HydrophobicContact CD1-CG2 3.92Å; I284-V326 HydrophobicContact CG2-CG2 3.48Å; I284-V326 VanDerWaalsContact CG2-CG2 3.48Å; Q288-V326 CarbonylContact O-C 3.5Å; Q288-V326 WeakPolarHBondContact O-CA 3.31Å; V326-L328 HydrophobicContact CG1-CD2 4.06Å; V326-L328 HydrophobicContact CG2-CD2 4.27Å; V326-F401 WeakPolarHBondContact O-CA 3.47Å; V326-L402 HydrophobicContact CG1-CB 4.11Å; V326-L402 HydrophobicContact CG1-CD2 4.46Å; V326-L402 PolarHBondContact N-O 2.88Å; V326-L402 PolarHBondContact O-N 2.79Å; V326-L402 VanDerWaalsContact O-N 3.09Å; V326-F417 HydrophobicContact CB-CZ 4.43Å; V326-F417 HydrophobicContact CG1-CE2 4.27Å; V326-V419 HydrophobicContact CG1-CG2 4.08Å
327	D	96.3	Very high	95.8	Very high	21 Å²	21	33.7 Å²	33.7	11%	0.112	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.4	165.9	-174.8	-1.6	0	0	0	109.2	Q288 M290 G329 R400 F401	Q288-D327 HydrophobicContact CB-CB 4.4Å; Q288-D327 WeakPolarHBondContact CB-O 3.34Å; Q288-D327 PolarHBondContact NE2-O 2.88Å; Q288-D327 PolarHBondContact O-N 3.25Å; M290-D327 HydrophobicContact CE-CB 4.18Å; D327-G329 PolarHBondContact O-N 3.09Å; D327-G329 VanDerWaalsContact O-N 3.13Å; D327-G329 WeakPolarHBondContact OD1-CA 3.47Å; D327-G329 PolarHBondContact OD1-N 2.74Å; D327-R400 WeakPolarHBondContact OD1-CG 3.23Å; D327-R400 IonicContact OD1-CZ 2.68Å; D327-R400 IonicContact OD1-NE 3.6Å; D327-R400 PolarHBondContact OD1-NE 3.04Å; D327-R400 IonicContact OD1-NH2 3.65Å; D327-R400 IonicContact OD2-CZ 3.85Å; D327-R400 IonicContact OD2-NE 2.86Å; D327-R400 PolarHBondContact OD2-NE 3.17Å; D327-R400 IonicContact OD2-NH2 3.64Å; D327-R400 PolarHBondContact OD2-NH2 3.17Å; D327-F401 HydrophobicContact CB-CD1 3.85Å; D327-F401 HydrophobicContact CB-CE1 3.46Å; D327-F401 VanDerWaalsContact CB-CE1 3.46Å; D327-F401 HydrophobicContact CB-CZ 4.07Å; D327-F401 VanDerWaalsContact CG-CE1 3.43Å; D327-F401 VanDerWaalsContact CG-CZ 3.47Å; D327-F401 WeakPolarHBondContact OD2-CZ 3.41Å
328	L	93.9	Very high	95.9	Very high	9 Å²	9	27.1 Å²	27.1	5%	0.047	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	3.3	178.6	-56.4	174.1	0	0	0	112.8	L277 I284 V326 F330 R332 I334 R400	L277-L328 HydrophobicContact CD1-CD1 4.02Å; L277-L328 HydrophobicContact CD1-CD2 4.18Å; I284-L328 HydrophobicContact CD1-CD2 3.81Å; V326-L328 HydrophobicContact CG1-CD2 4.06Å; V326-L328 HydrophobicContact CG2-CD2 4.27Å; L328-F330 PolarHBondContact O-N 2.88Å; L328-R332 HydrophobicContact CB-CG 3.95Å; L328-R332 HydrophobicContact CD1-CB 3.87Å; L328-R332 HydrophobicContact CD1-CG 4.04Å; L328-I334 HydrophobicContact CD1-CD1 3.72Å; L328-I334 HydrophobicContact CD1-CG1 4.14Å; L328-R400 WeakPolarHBondContact CB-O 3.36Å; L328-R400 WeakPolarHBondContact CG-O 3.38Å; L328-R400 PolarHBondContact N-O 2.96Å
329	G	88.9	Confident	96	Very high	25 Å²	25	23.4 Å²	23.4	26%	0.258	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.3	-42.6	-178.9	0	0	0	0	0	112.6	D327 R400	D327-G329 PolarHBondContact O-N 3.09Å; D327-G329 VanDerWaalsContact O-N 3.13Å; D327-G329 WeakPolarHBondContact OD1-CA 3.47Å; D327-G329 PolarHBondContact OD1-N 2.74Å; G329-R400 VanDerWaalsContact O-CZ 3.31Å; G329-R400 PolarHBondContact O-NE 3.04Å
330	F	91.2	Very high	96	Very high	10 Å²	10	22.7 Å²	22.7	4%	0.044	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	177	179.4	-159.7	-105	0	0	0	111.9	Y237 T238 L328 R332 M432 L463	Y237-F330 VanDerWaalsContact CB-CE1 3.42Å; Y237-F330 HydrophobicContact CD1-CD1 4.43Å; Y237-F330 HydrophobicContact CD2-CB 3.17Å; Y237-F330 AromaticContact CD2-CD1 3.76Å; Y237-F330 HydrophobicContact CD2-CD1 3.76Å; Y237-F330 AromaticContact CD2-CD2 3.74Å; Y237-F330 HydrophobicContact CD2-CD2 3.74Å; Y237-F330 AromaticContact CD2-CG 3.29Å; Y237-F330 HydrophobicContact CD2-CG 3.29Å; Y237-F330 HydrophobicContact CE2-CB 3.35Å; Y237-F330 HydrophobicContact CE2-CG 4.03Å; Y237-F330 HydrophobicContact CG-CB 3.82Å; Y237-F330 AromaticContact CG-CD1 3.57Å; Y237-F330 HydrophobicContact CG-CD1 3.57Å; Y237-F330 HydrophobicContact CG-CD2 4.3Å; Y237-F330 HydrophobicContact CG-CE1 4.16Å; Y237-F330 AromaticContact CG-CG 3.65Å; Y237-F330 HydrophobicContact CG-CG 3.65Å; T238-F330 HydrophobicContact CG2-CE2 4.39Å; T238-F330 HydrophobicContact CG2-CZ 4.16Å; L328-F330 PolarHBondContact O-N 2.88Å; F330-R332 PolarHBondContact O-N 2.8Å; F330-M432 HydrophobicContact CE1-CE 3.48Å; F330-M432 VanDerWaalsContact CE1-CE 3.48Å; F330-M432 HydrophobicContact CE1-SD 4.13Å; F330-M432 HydrophobicContact CZ-CE 3.84Å; F330-M432 HydrophobicContact CZ-SD 3.97Å; F330-L463 HydrophobicContact CD2-CD1 4.24Å; F330-L463 HydrophobicContact CE2-CD1 3.58Å; F330-L463 HydrophobicContact CZ-CD1 3.79Å
331	L	93.2	Very high	96.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	122.8	178.3	-69.3	179.4	0	0	0	111.5	L398 R400 I424 L462 L463 P547	L331-L398 HydrophobicContact CB-CD1 3.94Å; L331-L398 HydrophobicContact CB-CG 4.25Å; L331-L398 HydrophobicContact CD1-CD2 4.45Å; L331-R400 HydrophobicContact CD2-CB 4.3Å; L331-I424 HydrophobicContact CB-CD1 4.03Å; L331-L462 HydrophobicContact CD1-CD2 3.93Å; L331-L463 HydrophobicContact CD1-CD1 4.09Å; L331-L463 HydrophobicContact CD1-CD2 3.8Å; L331-L463 HydrophobicContact CD1-CG 4.11Å; L331-L463 HydrophobicContact CD2-CD2 4.12Å; L331-L463 HydrophobicContact CG-CD1 4.16Å; L331-L463 HydrophobicContact CG-CD2 3.9Å; L331-L463 HydrophobicContact CG-CG 4.47Å; L331-P547 HydrophobicContact CD1-CG 4.27Å; L331-P547 HydrophobicContact CD2-CG 4.15Å
332	R	93.9	Very high	96.2	Very high	14 Å²	14	10.5 Å²	10.5	5%	0.053	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.6	175.3	-60.1	-58.8	-166.7	-144.2	5.5	111.2	Y237 L277 L328 F330 L398 T399	Y237-R332 PolarHBondContact OH-NH2 2.93Å; L277-R332 HydrophobicContact CD1-CB 4.07Å; L277-R332 HydrophobicContact CD1-CG 4.34Å; L328-R332 HydrophobicContact CB-CG 3.95Å; L328-R332 HydrophobicContact CD1-CB 3.87Å; L328-R332 HydrophobicContact CD1-CG 4.04Å; F330-R332 PolarHBondContact O-N 2.8Å; R332-L398 VanDerWaalsContact C-CD1 3.47Å; R332-L398 WeakPolarHBondContact O-CA 3.18Å; R332-L398 WeakPolarHBondContact O-CD1 3.46Å; R332-T399 PolarHBondContact N-O 2.83Å; R332-T399 PolarHBondContact O-N 2.91Å
333	F	94.8	Very high	96.2	Very high	15 Å²	15	13 Å²	13	7%	0.066	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.5	165.2	-79.5	-71.7	0	0	0	109.1	P396 L398 G421 C422 I424 Y427 L549	F333-P396 HydrophobicContact CD1-CB 4.37Å; F333-L398 HydrophobicContact CD1-CB 4.24Å; F333-L398 HydrophobicContact CD1-CD1 4.33Å; F333-L398 HydrophobicContact CD2-CD1 4.26Å; F333-L398 HydrophobicContact CE1-CB 4Å; F333-L398 HydrophobicContact CE1-CD1 4.34Å; F333-L398 HydrophobicContact CE2-CD1 4.28Å; F333-L398 HydrophobicContact CG-CD1 4.28Å; F333-L398 HydrophobicContact CZ-CD1 4.3Å; F333-L398 HydrophobicContact CZ-CD2 4.4Å; F333-G421 CarbonylContact O-C 3.58Å; F333-G421 WeakPolarHBondContact O-CA 3.29Å; F333-C422 PolarHBondContact N-O 3.33Å; F333-C422 PolarHBondContact O-N 2.81Å; F333-I424 HydrophobicContact CD2-CG1 4.39Å; F333-I424 HydrophobicContact CE2-CG1 4.06Å; F333-Y427 AromaticContact CD2-CE2 3.91Å; F333-Y427 HydrophobicContact CD2-CE2 3.91Å; F333-Y427 HydrophobicContact CE2-CD2 4.44Å; F333-Y427 AromaticContact CE2-CE2 3.93Å; F333-Y427 HydrophobicContact CE2-CE2 3.93Å; F333-L549 HydrophobicContact CE1-CB 4.38Å; F333-L549 HydrophobicContact CE2-CD2 4.06Å; F333-L549 HydrophobicContact CZ-CB 3.78Å; F333-L549 HydrophobicContact CZ-CD2 3.57Å; F333-L549 HydrophobicContact CZ-CG 4.31Å
334	I	96.6	Very high	96.1	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.9	173.3	-55	-176	0	0	0	108.1	L328 L393 P396 T397 T399 L402 V419	L328-I334 HydrophobicContact CD1-CD1 3.72Å; L328-I334 HydrophobicContact CD1-CG1 4.14Å; I334-L393 HydrophobicContact CB-CD2 4.33Å; I334-L393 HydrophobicContact CG2-CD1 4.18Å; I334-L393 HydrophobicContact CG2-CD2 4.03Å; I334-P396 WeakPolarHBondContact O-CA 3.49Å; I334-T397 PolarHBondContact N-O 3.28Å; I334-T397 PolarHBondContact O-N 3.39Å; I334-T399 HydrophobicContact CD1-CG2 3.2Å; I334-T399 HydrophobicContact CG1-CG2 3.89Å; I334-L402 HydrophobicContact CD1-CB 3.95Å; I334-L402 HydrophobicContact CD1-CD1 3.44Å; I334-L402 VanDerWaalsContact CD1-CD1 3.44Å; I334-L402 HydrophobicContact CD1-CG 4.32Å; I334-L402 HydrophobicContact CG2-CD1 3.96Å; I334-V419 HydrophobicContact CD1-CG1 3.95Å; I334-V419 HydrophobicContact CG1-CG1 4.09Å; I334-V419 HydrophobicContact CG2-CG1 3.75Å
335	S	95.6	Very high	95.9	Very high	20 Å²	20	15.3 Å²	15.3	14%	0.14	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-29.4	-177.4	64.6	0	0	0	0	112.8	C273 K392 L393 Y420	C273-S335 VanDerWaalsContact O-CB 3.24Å; C273-S335 WeakPolarHBondContact O-CB 3.17Å; C273-S335 PolarHBondContact O-OG 3.36Å; S335-K392 WeakPolarHBondContact O-CA 3.44Å; S335-L393 PolarHBondContact O-N 3.02Å; S335-Y420 PolarHBondContact N-O 2.81Å; S335-Y420 PolarHBondContact OG-O 3.21Å
336	A	96.8	Very high	95.7	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.008	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	165.3	177.9	0	0	0	0	0	112.5	K390 T391 K392 Y420	A336-K390 HydrophobicContact CB-CG 4.06Å; A336-T391 WeakPolarHBondContact CA-O 3.38Å; A336-T391 WeakPolarHBondContact CB-O 3.39Å; A336-K392 HydrophobicContact CB-CG 4.29Å; A336-Y420 HydrophobicContact CB-CD2 4.23Å; A336-Y420 PolarHBondContact N-O 2.83Å; A336-Y420 PolarHBondContact O-N 2.79Å
337	I	97.9	Very high	95.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.9	172.2	-58.2	168.2	0	0	0	107.7	T339 Y356 V358 K390 T391 L393 L402 I404 E418	I337-T339 HydrophobicContact CG2-CG2 3.96Å; I337-Y356 HydrophobicContact CD1-CE2 4.28Å; I337-V358 HydrophobicContact CD1-CB 4.34Å; I337-V358 HydrophobicContact CD1-CG1 3.99Å; I337-V358 HydrophobicContact CD1-CG2 3.39Å; I337-K390 WeakPolarHBondContact O-CA 3.45Å; I337-T391 PolarHBondContact N-O 3.4Å; I337-T391 PolarHBondContact O-N 2.81Å; I337-L393 HydrophobicContact CD1-CD1 4.3Å; I337-L393 HydrophobicContact CG1-CD1 4.09Å; I337-L402 HydrophobicContact CD1-CD1 3.88Å; I337-L402 HydrophobicContact CD1-CD2 4.39Å; I337-L402 HydrophobicContact CG1-CD1 4.15Å; I337-I404 HydrophobicContact CG2-CD1 3.84Å; I337-E418 WeakPolarHBondContact CA-O 3.35Å
338	G	98	Very high	95.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.7	169.2	0	0	0	0	0	109.7	T389 F417 E418	G338-T389 WeakPolarHBondContact CA-O 3.06Å; G338-F417 CarbonylContact O-C 3.57Å; G338-F417 WeakPolarHBondContact O-CA 3.35Å; G338-F417 VanDerWaalsContact O-CB 3.25Å; G338-F417 WeakPolarHBondContact O-CB 3.18Å; G338-E418 PolarHBondContact N-O 2.78Å; G338-E418 PolarHBondContact O-N 2.87Å
339	T	98.6	Very high	95.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.4	174.8	64	0	0	0	0	111.7	I337 Y356 N382 T389 L415 R416 F417	I337-T339 HydrophobicContact CG2-CG2 3.96Å; T339-Y356 HydrophobicContact CG2-CD1 4.48Å; T339-Y356 HydrophobicContact CG2-CE1 3.73Å; T339-N382 WeakPolarHBondContact CB-OD1 3.39Å; T339-N382 PolarHBondContact O-ND2 2.72Å; T339-N382 PolarHBondContact O-OD1 2.69Å; T339-N382 PolarHBondContact OG1-OD1 3.41Å; T339-T389 PolarHBondContact N-O 2.7Å; T339-T389 PolarHBondContact O-N 3.39Å; T339-L415 HydrophobicContact CG2-CD1 4.04Å; T339-R416 CarbonylContact C-O 3.47Å; T339-R416 WeakPolarHBondContact CA-O 3.45Å; T339-F417 HydrophobicContact CG2-CB 4.34Å
340	Q	98.3	Very high	96.1	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.037	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	151.8	174.3	-82.9	176.9	-41.3	0	0	109	L306 N307 N382 T386 V388 L415 R416	L306-Q340 HydrophobicContact CD1-CB 4.27Å; L306-Q340 HydrophobicContact CD1-CG 3.86Å; N307-Q340 PolarHBondContact OD1-NE2 2.76Å; N307-Q340 PolarHBondContact OD1-OE1 3.29Å; Q340-N382 WeakPolarHBondContact CA-ND2 3.2Å; Q340-N382 PolarHBondContact N-OD1 2.88Å; Q340-T386 PolarHBondContact NE2-O 2.96Å; Q340-V388 HydrophobicContact CG-CB 4.25Å; Q340-V388 HydrophobicContact CG-CG2 3.75Å; Q340-L415 WeakPolarHBondContact O-CA 3.49Å; Q340-R416 HydrophobicContact CB-CB 3.91Å; Q340-R416 PolarHBondContact N-O 3.27Å; Q340-R416 PolarHBondContact O-N 3.22Å
341	G	97.9	Very high	96.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.			trans	-85.7	-154	166.8	0	0	0	0	0	112.1	Y351 P385 R416	G341-Y351 CarbonylContact C-O 3.57Å; G341-Y351 VanDerWaalsContact CA-O 3.28Å; G341-Y351 WeakPolarHBondContact CA-O 3.14Å; G341-P385 CarbonylContact C-O 3.59Å; G341-P385 WeakPolarHBondContact CA-O 2.95Å; G341-P385 PolarHBondContact N-O 3.39Å; G341-R416 PolarHBondContact O-NE 2.89Å; G341-R416 PolarHBondContact O-NH2 3.43Å
342	A	97.6	Very high	96.7	Very high	1 Å²	1	39 Å²	39	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	163.9	169.2	0	0	0	0	0	112.8	W299 N311 A312 Y351 P385 A414	W299-A342 HydrophobicContact CH2-CB 4.44Å; W299-A342 HydrophobicContact CZ3-CB 4.14Å; N311-A342 WeakPolarHBondContact O-CB 3.31Å; A312-A342 HydrophobicContact CB-CB 3.49Å; A312-A342 VanDerWaalsContact CB-CB 3.49Å; A342-Y351 PolarHBondContact N-O 2.84Å; A342-Y351 PolarHBondContact O-N 3.46Å; A342-Y351 VanDerWaalsContact O-O 3.09Å; A342-P385 WeakPolarHBondContact O-CB 3.17Å; A342-A414 HydrophobicContact CB-CB 4.33Å
343	I	97.8	Very high	96.9	Very high	76 Å²	76	38.4 Å²	38.4	39%	0.39	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.7	169.7	-53.4	178.4	0	0	0	106.1	Q345 K349 I350 P385 T386	I343-Q345 PolarHBondContact O-N 2.75Å; I343-K349 WeakPolarHBondContact CA-O 3.42Å; I343-I350 HydrophobicContact CG1-CG2 4.3Å; I343-P385 HydrophobicContact CD1-CG 4.1Å; I343-P385 HydrophobicContact CG1-CB 3.91Å; I343-P385 HydrophobicContact CG1-CG 3.74Å; I343-T386 HydrophobicContact CD1-CG2 4.19Å
344	S	96.6	Very high	97.1	Very high	5 Å²	5	41.3 Å²	41.3	4%	0.035	20%	0.199	C	C	.	.			trans	-62.8	125.5	177.4	162.2	0	0	0	0	109.7	N311 E346 T347 H348 K349	N311-S344 WeakPolarHBondContact OD1-CA 3.43Å; S344-E346 PolarHBondContact O-N 3.39Å; S344-E346 PolarHBondContact OG-N 2.98Å; S344-E346 PolarHBondContact OG-OE2 2.85Å; S344-T347 WeakPolarHBondContact CB-OG1 3.4Å; S344-T347 PolarHBondContact OG-N 3.16Å; S344-T347 PolarHBondContact OG-OG1 2.86Å; S344-H348 WeakPolarHBondContact O-CA 3.42Å; S344-H348 PolarHBondContact O-N 2.98Å; S344-K349 PolarHBondContact N-O 3.01Å
345	Q	94.1	Very high	97.1	Very high	103 Å²	103	41.7 Å²	41.7	48%	0.481	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-33.2	177	-169.1	177.9	22.5	0	0	111.7	E310 N311 I343	E310-Q345 PolarHBondContact OE1-NE2 3.47Å; E310-Q345 PolarHBondContact OE1-OE1 3Å; N311-Q345 PolarHBondContact OD1-N 2.76Å; I343-Q345 PolarHBondContact O-N 2.75Å
346	E	94.6	Very high	97.3	Very high	102 Å²	102	40.8 Å²	40.8	48%	0.477	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-43.5	-176.5	-50.4	83.3	175.6	0	0	112.1	N311 S344	N311-E346 PolarHBondContact ND2-OE1 2.77Å; S344-E346 PolarHBondContact O-N 3.39Å; S344-E346 PolarHBondContact OG-N 2.98Å; S344-E346 PolarHBondContact OG-OE2 2.85Å
347	T	95.1	Very high	97.3	Very high	75 Å²	75	43.2 Å²	43.2	46%	0.46	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-10.2	-169.7	66.4	0	0	0	0	114.3	S344 K349	S344-T347 WeakPolarHBondContact CB-OG1 3.4Å; S344-T347 PolarHBondContact OG-N 3.16Å; S344-T347 PolarHBondContact OG-OG1 2.86Å; T347-K349 PolarHBondContact O-N 2.55Å; T347-K349 WeakPolarHBondContact OG1-CB 3.43Å; T347-K349 PolarHBondContact OG1-N 2.79Å
348	H	95.4	Very high	97.3	Very high	146 Å²	146	43.2 Å²	43.2	68%	0.676	21%	0.206	S	C	*	.			trans	56.8	14.4	-173.1	-59.9	67.5	0	0	0	114	S344	S344-H348 WeakPolarHBondContact O-CA 3.42Å; S344-H348 PolarHBondContact O-N 2.98Å
349	K	96.6	Very high	97.3	Very high	118 Å²	118	43.4 Å²	43.4	51%	0.513	21%	0.207	S	C	.	.			trans	-74.3	146.8	173.7	-72.7	-178.9	177.6	-178.7	0	110.4	I343 S344 T347 Y351	I343-K349 WeakPolarHBondContact CA-O 3.42Å; S344-K349 PolarHBondContact N-O 3.01Å; T347-K349 PolarHBondContact O-N 2.55Å; T347-K349 WeakPolarHBondContact OG1-CB 3.43Å; T347-K349 PolarHBondContact OG1-N 2.79Å; K349-Y351 HydrophobicContact CB-CD2 4.3Å; K349-Y351 HydrophobicContact CB-CE2 3.42Å; K349-Y351 VanDerWaalsContact CB-CE2 3.42Å; K349-Y351 WeakPolarHBondContact CD-OH 3.18Å; K349-Y351 WeakPolarHBondContact O-CD2 3.47Å
350	I	97.4	Very high	97.3	Very high	77 Å²	77	43.5 Å²	43.5	40%	0.395	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.1	179.7	66.8	177.5	0	0	0	110.3	I343 F352 P385 T411	I343-I350 HydrophobicContact CG1-CG2 4.3Å; I350-F352 HydrophobicContact CD1-CE1 4.44Å; I350-P385 HydrophobicContact CB-CB 4.36Å; I350-P385 HydrophobicContact CB-CG 4Å; I350-P385 HydrophobicContact CG2-CG 3.93Å; I350-T411 WeakPolarHBondContact O-CB 3.2Å; I350-T411 PolarHBondContact O-OG1 2.85Å
351	Y	98.2	Very high	97.3	Very high	47 Å²	47	43.1 Å²	43.1	18%	0.184	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.1	180	-61.1	-93.8	0	0	0	109	W299 G341 A342 K349 T411 A414	W299-Y351 HydrophobicContact CH2-CD2 4.32Å; G341-Y351 CarbonylContact C-O 3.57Å; G341-Y351 VanDerWaalsContact CA-O 3.28Å; G341-Y351 WeakPolarHBondContact CA-O 3.14Å; A342-Y351 PolarHBondContact N-O 2.84Å; A342-Y351 PolarHBondContact O-N 3.46Å; A342-Y351 VanDerWaalsContact O-O 3.09Å; K349-Y351 HydrophobicContact CB-CD2 4.3Å; K349-Y351 HydrophobicContact CB-CE2 3.42Å; K349-Y351 VanDerWaalsContact CB-CE2 3.42Å; K349-Y351 WeakPolarHBondContact CD-OH 3.18Å; K349-Y351 WeakPolarHBondContact O-CD2 3.47Å; Y351-T411 HydrophobicContact CD1-CG2 3.83Å; Y351-T411 HydrophobicContact CE1-CG2 3.42Å; Y351-T411 VanDerWaalsContact CE1-CG2 3.42Å; Y351-A414 HydrophobicContact CG-CB 4.42Å
352	F	98.4	Very high	97.1	Very high	12 Å²	12	43.3 Å²	43.3	5%	0.053	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	149.7	174.2	57.5	-90.2	0	0	0	112.6	I350 K354 N382 T383 P385 W409 E410	I350-F352 HydrophobicContact CD1-CE1 4.44Å; F352-K354 HydrophobicContact CD2-CG 3.96Å; F352-K354 HydrophobicContact CE2-CD 4.23Å; F352-K354 HydrophobicContact CE2-CG 3.65Å; F352-N382 HydrophobicContact CB-CB 4.05Å; F352-N382 HydrophobicContact CD2-CB 3.97Å; F352-N382 VanDerWaalsContact CD2-O 3.29Å; F352-N382 WeakPolarHBondContact CD2-O 3.03Å; F352-N382 VanDerWaalsContact CE2-O 3.32Å; F352-N382 WeakPolarHBondContact CE2-O 3.09Å; F352-N382 HydrophobicContact CG-CB 4.33Å; F352-T383 VanDerWaalsContact CZ-O 3.29Å; F352-T383 WeakPolarHBondContact CZ-O 3.4Å; F352-P385 HydrophobicContact CD1-CB 4.43Å; F352-W409 CarbonylContact O-C 3.58Å; F352-W409 VanDerWaalsContact O-CA 3.26Å; F352-W409 WeakPolarHBondContact O-CA 3.3Å; F352-W409 WeakPolarHBondContact O-CB 3.13Å; F352-E410 HydrophobicContact CD1-CB 3.86Å; F352-E410 HydrophobicContact CD1-CG 4.41Å; F352-E410 HydrophobicContact CD2-CB 4Å; F352-E410 HydrophobicContact CE1-CB 3.48Å; F352-E410 VanDerWaalsContact CE1-CB 3.48Å; F352-E410 HydrophobicContact CE1-CG 3.63Å; F352-E410 HydrophobicContact CE2-CB 3.64Å; F352-E410 HydrophobicContact CE2-CG 4.33Å; F352-E410 HydrophobicContact CG-CB 4.1Å; F352-E410 HydrophobicContact CZ-CB 3.36Å; F352-E410 HydrophobicContact CZ-CG 3.59Å; F352-E410 PolarHBondContact N-O 3Å; F352-E410 PolarHBondContact O-N 3.34Å
353	V	98.6	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	121.4	174.4	178.7	0	0	0	0	110.1	S355 Y356 N382 P406 I413 L415	V353-S355 VanDerWaalsContact CG1-O 3.27Å; V353-S355 WeakPolarHBondContact CG1-O 3.38Å; V353-Y356 HydrophobicContact CG1-CD1 4.41Å; V353-N382 PolarHBondContact O-N 2.74Å; V353-P406 HydrophobicContact CG1-CB 4.05Å; V353-P406 HydrophobicContact CG2-CB 4.08Å; V353-P406 HydrophobicContact CG2-CG 4.15Å; V353-I413 HydrophobicContact CG2-CG2 4.06Å; V353-L415 HydrophobicContact CB-CD1 3.98Å; V353-L415 HydrophobicContact CG2-CD1 3.94Å
354	K	98.2	Very high	96.5	Very high	76 Å²	76	43.5 Å²	43.5	33%	0.33	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-32.8	178.6	-71.6	-174.9	-64.7	-150	0	113.2	F352 G381 T408 W409 E410	F352-K354 HydrophobicContact CD2-CG 3.96Å; F352-K354 HydrophobicContact CE2-CD 4.23Å; F352-K354 HydrophobicContact CE2-CG 3.65Å; K354-G381 WeakPolarHBondContact O-CA 3.11Å; K354-G381 PolarHBondContact O-N 2.71Å; K354-T408 WeakPolarHBondContact CA-O 3.49Å; K354-T408 WeakPolarHBondContact CB-OG1 3.34Å; K354-T408 PolarHBondContact N-O 2.83Å; K354-W409 WeakPolarHBondContact CE-O 3.37Å; K354-W409 PolarHBondContact NZ-O 2.61Å; K354-W409 VanDerWaalsContact NZ-O 3.16Å; K354-E410 IonicContact NZ-OE2 3.66Å; K354-E410 PolarHBondContact NZ-OE2 3.12Å
355	S	98.2	Very high	96.3	Very high	9 Å²	9	49.9 Å²	49.9	6%	0.063	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	149.9	175.5	72	0	0	0	0	111.5	V353 F379 V407 T408	V353-S355 VanDerWaalsContact CG1-O 3.27Å; V353-S355 WeakPolarHBondContact CG1-O 3.38Å; S355-F379 WeakPolarHBondContact CA-O 3.34Å; S355-F379 WeakPolarHBondContact CB-O 3.19Å; S355-V407 PolarHBondContact O-N 2.86Å; S355-T408 WeakPolarHBondContact CB-OG1 3.2Å; S355-T408 PolarHBondContact N-O 2.88Å; S355-T408 VanDerWaalsContact N-O 3.08Å; S355-T408 PolarHBondContact N-OG1 3.29Å; S355-T408 PolarHBondContact O-N 2.78Å; S355-T408 PolarHBondContact OG-OG1 3.43Å
356	Y	98.5	Very high	96.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	163.5	-176.6	60	-90	0	0	0	112.3	I337 T339 V353 V358 F379 I404 R405	I337-Y356 HydrophobicContact CD1-CE2 4.28Å; T339-Y356 HydrophobicContact CG2-CD1 4.48Å; T339-Y356 HydrophobicContact CG2-CE1 3.73Å; V353-Y356 HydrophobicContact CG1-CD1 4.41Å; Y356-V358 HydrophobicContact CD2-CG2 3.84Å; Y356-V358 HydrophobicContact CE2-CG2 3.71Å; Y356-F379 HydrophobicContact CD1-CB 4.24Å; Y356-F379 HydrophobicContact CD2-CB 3.78Å; Y356-F379 HydrophobicContact CD2-CD2 4.32Å; Y356-F379 HydrophobicContact CD2-CG 4.24Å; Y356-F379 HydrophobicContact CE1-CB 3.93Å; Y356-F379 HydrophobicContact CE2-CB 3.42Å; Y356-F379 VanDerWaalsContact CE2-CB 3.42Å; Y356-F379 HydrophobicContact CE2-CD1 4.37Å; Y356-F379 HydrophobicContact CE2-CD2 4.16Å; Y356-F379 AromaticContact CE2-CG 3.75Å; Y356-F379 HydrophobicContact CE2-CG 3.75Å; Y356-F379 HydrophobicContact CG-CB 4.17Å; Y356-F379 PolarHBondContact N-O 3.03Å; Y356-F379 PolarHBondContact O-N 3.47Å; Y356-I404 HydrophobicContact CD2-CG2 3.77Å; Y356-I404 HydrophobicContact CE2-CG2 4.48Å; Y356-I404 HydrophobicContact CG-CG2 3.94Å; Y356-R405 CarbonylContact C-O 3.4Å; Y356-R405 WeakPolarHBondContact CA-O 3.48Å; Y356-R405 WeakPolarHBondContact CB-O 3.41Å
357	K	98.1	Very high	96.3	Very high	52 Å²	52	43.6 Å²	43.6	23%	0.226	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	160.9	166.7	-68.3	177.1	-174.7	179.4	0	109.5	I378 R405 V407	K357-I378 HydrophobicContact CG-CG1 4.44Å; K357-R405 HydrophobicContact CB-CB 4.31Å; K357-R405 PolarHBondContact N-O 3.44Å; K357-R405 PolarHBondContact O-N 3.42Å; K357-V407 HydrophobicContact CD-CG2 4.31Å; K357-V407 HydrophobicContact CG-CG2 3.87Å
358	V	98	Very high	96.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.6	178.4	-179	0	0	0	0	108.4	I337 Y356 V360 L370 F379 L402 R403	I337-V358 HydrophobicContact CD1-CB 4.34Å; I337-V358 HydrophobicContact CD1-CG1 3.99Å; I337-V358 HydrophobicContact CD1-CG2 3.39Å; Y356-V358 HydrophobicContact CD2-CG2 3.84Å; Y356-V358 HydrophobicContact CE2-CG2 3.71Å; V358-V360 HydrophobicContact CG1-CG1 4.22Å; V358-L370 HydrophobicContact CB-CD1 3.92Å; V358-L370 HydrophobicContact CB-CG 4.26Å; V358-L370 HydrophobicContact CG1-CD1 3.79Å; V358-L370 HydrophobicContact CG1-CG 4.25Å; V358-L370 PolarHBondContact O-N 2.98Å; V358-F379 HydrophobicContact CB-CD2 4.44Å; V358-F379 HydrophobicContact CB-CE2 3.9Å; V358-F379 HydrophobicContact CB-CZ 4.47Å; V358-F379 HydrophobicContact CG2-CD2 3.72Å; V358-F379 HydrophobicContact CG2-CE2 3.58Å; V358-F379 HydrophobicContact CG2-CG 4.37Å; V358-F379 HydrophobicContact CG2-CZ 4.12Å; V358-L402 HydrophobicContact CG1-CD1 4.13Å; V358-L402 HydrophobicContact CG1-CG 4.05Å; V358-R403 WeakPolarHBondContact CA-O 3.34Å
359	D	98.1	Very high	96.4	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.027	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.2	170.1	-62.1	-20.8	0	0	0	108.2	W367 I368 T369 R403 R405	D359-W367 HydrophobicContact CB-CE3 3.79Å; D359-W367 HydrophobicContact CB-CZ3 4.47Å; D359-I368 CarbonylContact C-O 3.53Å; D359-I368 WeakPolarHBondContact CA-O 3.16Å; D359-T369 WeakPolarHBondContact OD1-CA 3.17Å; D359-T369 WeakPolarHBondContact OD1-CB 3.49Å; D359-T369 VanDerWaalsContact OD1-CG2 3.29Å; D359-T369 WeakPolarHBondContact OD1-CG2 3.41Å; D359-T369 PolarHBondContact OD1-OG1 3.47Å; D359-R403 HydrophobicContact CB-CB 4.26Å; D359-R403 PolarHBondContact N-O 2.83Å; D359-R403 PolarHBondContact O-N 3.02Å; D359-R405 WeakPolarHBondContact OD2-CD 3.38Å; D359-R405 IonicContact OD2-CZ 3.78Å; D359-R405 IonicContact OD2-NE 2.74Å; D359-R405 IonicContact OD2-NH1 3.36Å; D359-R405 PolarHBondContact OD2-NH1 2.81Å
360	V	97.9	Very high	96.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.3	179	-63.6	0	0	0	0	110.2	V358 I368 L370 T397 T399 F401	V358-V360 HydrophobicContact CG1-CG1 4.22Å; V360-I368 HydrophobicContact CG2-CB 4.29Å; V360-I368 WeakPolarHBondContact CG2-O 3.37Å; V360-I368 PolarHBondContact N-O 2.91Å; V360-I368 PolarHBondContact O-N 2.59Å; V360-L370 HydrophobicContact CG1-CD1 4.45Å; V360-L370 HydrophobicContact CG1-CD2 4.04Å; V360-L370 HydrophobicContact CG1-CG 4.27Å; V360-L370 HydrophobicContact CG2-CD2 3.82Å; V360-T397 HydrophobicContact CG2-CG2 4.2Å; V360-T399 HydrophobicContact CB-CG2 4.09Å; V360-T399 HydrophobicContact CG1-CG2 4.01Å; V360-F401 WeakPolarHBondContact CA-O 3.37Å
361	S	97.2	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	142.4	178.5	-178.5	0	0	0	0	112.2	N363 G364 D366 T399 R400 F401 D545	S361-N363 PolarHBondContact OG-N 2.84Å; S361-N363 PolarHBondContact OG-OD1 2.93Å; S361-N363 VanDerWaalsContact OG-OD1 3.09Å; S361-G364 PolarHBondContact OG-N 2.96Å; S361-D366 WeakPolarHBondContact CB-O 3.33Å; S361-D366 PolarHBondContact OG-O 3.49Å; S361-T399 PolarHBondContact N-OG1 2.78Å; S361-T399 VanDerWaalsContact N-OG1 3.12Å; S361-T399 PolarHBondContact O-OG1 2.8Å; S361-R400 PolarHBondContact O-N 2.82Å; S361-F401 PolarHBondContact N-O 2.87Å; S361-F401 VanDerWaalsContact N-O 3.08Å; S361-F401 PolarHBondContact O-N 3.48Å; S361-D545 WeakPolarHBondContact CA-OD2 3.32Å
362	S	94.4	Very high	95.8	Very high	5 Å²	5	36.1 Å²	36.1	4%	0.035	18%	0.175	C	C	.	.	S	Bend	trans	-76.2	-24.8	173.1	76	0	0	0	0	113.8	Q499 D545	S362-Q499 VanDerWaalsContact CB-NE2 3.32Å; S362-Q499 PolarHBondContact OG-NE2 2.8Å; S362-D545 PolarHBondContact N-OD2 3.11Å; S362-D545 PolarHBondContact OG-OD1 2.96Å
363	N	90.6	Very high	95.3	Very high	59 Å²	59	39.2 Å²	39.2	32%	0.316	21%	0.211	S	C	.	.	S	Bend	trans	-131.7	-6.5	-169.2	62.8	9.6	0	0	0	114.8	S361 E365 D366	S361-N363 PolarHBondContact OG-N 2.84Å; S361-N363 PolarHBondContact OG-OD1 2.93Å; S361-N363 VanDerWaalsContact OG-OD1 3.09Å; N363-E365 VanDerWaalsContact C-N 3.28Å; N363-E365 PolarHBondContact O-N 2.91Å; N363-E365 PolarHBondContact OD1-N 3.44Å; N363-D366 PolarHBondContact ND2-OD2 3.25Å; N363-D366 PolarHBondContact OD1-N 2.91Å
364	G	92.7	Very high	94.7	Very high	21 Å²	21	44.5 Å²	44.5	22%	0.216	25%	0.248	C	C	.	.	S	Bend	trans	85.4	-5.1	-179.7	0	0	0	0	0	114.3	S361 W367	S361-G364 PolarHBondContact OG-N 2.96Å; G364-W367 PolarHBondContact O-NE1 3.19Å
365	E	91.7	Very high	94.3	Very high	140 Å²	140	48.6 Å²	48.6	65%	0.654	27%	0.265	S	S	*	.	S	Bend	trans	-106.9	-43.9	179	-61.5	-177	171.2	0	0	111.5	N363 W367	N363-E365 VanDerWaalsContact C-N 3.28Å; N363-E365 PolarHBondContact O-N 2.91Å; N363-E365 PolarHBondContact OD1-N 3.44Å; E365-W367 VanDerWaalsContact O-CD1 3.23Å
366	D	93.3	Very high	94.1	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.102	28%	0.283	C	S	.	.	S	Bend	trans	-95	100.5	-176.7	-77.8	-58.8	0	0	0	111.3	S361 N363 K502 Y544 D545	S361-D366 WeakPolarHBondContact CB-O 3.33Å; S361-D366 PolarHBondContact OG-O 3.49Å; N363-D366 PolarHBondContact ND2-OD2 3.25Å; N363-D366 PolarHBondContact OD1-N 2.91Å; D366-K502 VanDerWaalsContact OD1-CE 3.22Å; D366-K502 WeakPolarHBondContact OD1-CE 3.17Å; D366-K502 IonicContact OD1-NZ 2.82Å; D366-K502 PolarHBondContact OD1-NZ 3.37Å; D366-K502 WeakPolarHBondContact OD2-CE 3.49Å; D366-K502 IonicContact OD2-NZ 3.53Å; D366-K502 PolarHBondContact OD2-NZ 3.31Å; D366-Y544 HydrophobicContact CB-CE2 3.9Å; D366-Y544 VanDerWaalsContact OD1-CE2 3.29Å; D366-Y544 WeakPolarHBondContact OD1-CE2 3.48Å; D366-Y544 PolarHBondContact OD1-OH 3.47Å; D366-D545 HydrophobicContact CB-CB 4.05Å
367	W	96.2	Very high	93.9	Very high	53 Å²	53	54.8 Å²	54.8	20%	0.201	29%	0.292	C	S	.	.			trans	-98.5	132.2	-173.6	-66.7	89.7	0	0	0	113.6	Q325 D359 G364 E365 F401 R403	Q325-W367 HydrophobicContact CB-CH2 4.43Å; D359-W367 HydrophobicContact CB-CE3 3.79Å; D359-W367 HydrophobicContact CB-CZ3 4.47Å; G364-W367 PolarHBondContact O-NE1 3.19Å; E365-W367 VanDerWaalsContact O-CD1 3.23Å; W367-F401 HydrophobicContact CH2-CB 3.66Å; W367-F401 HydrophobicContact CH2-CG 4.46Å; W367-F401 HydrophobicContact CZ2-CB 4.35Å; W367-F401 HydrophobicContact CZ3-CB 4.12Å; W367-R403 HydrophobicContact CE3-CB 4.03Å; W367-R403 HydrophobicContact CH2-CB 3.77Å; W367-R403 VanDerWaalsContact CZ2-CZ 3.42Å; W367-R403 HydrophobicContact CZ3-CB 3.34Å; W367-R403 HydrophobicContact CZ3-CG 4.44Å
368	I	96.4	Very high	93.9	Very high	27 Å²	27	56 Å²	56	14%	0.138	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.2	176.2	-54.1	-62.8	0	0	0	110.3	D359 V360 N543 Y544 D545	D359-I368 CarbonylContact C-O 3.53Å; D359-I368 WeakPolarHBondContact CA-O 3.16Å; V360-I368 HydrophobicContact CG2-CB 4.29Å; V360-I368 WeakPolarHBondContact CG2-O 3.37Å; V360-I368 PolarHBondContact N-O 2.91Å; V360-I368 PolarHBondContact O-N 2.59Å; I368-N543 HydrophobicContact CD1-CB 4.15Å; I368-Y544 HydrophobicContact CD1-CD1 4.16Å; I368-Y544 HydrophobicContact CD1-CE1 3.68Å; I368-D545 HydrophobicContact CD1-CB 4.38Å; I368-D545 HydrophobicContact CG1-CB 4.05Å
369	T	96.6	Very high	93.8	Very high	26 Å²	26	56.1 Å²	56.1	16%	0.16	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.7	170.6	-49.4	0	0	0	0	111.2	D359 Q376	D359-T369 WeakPolarHBondContact OD1-CA 3.17Å; D359-T369 WeakPolarHBondContact OD1-CB 3.49Å; D359-T369 VanDerWaalsContact OD1-CG2 3.29Å; D359-T369 WeakPolarHBondContact OD1-CG2 3.41Å; D359-T369 PolarHBondContact OD1-OG1 3.47Å; T369-Q376 HydrophobicContact CG2-CB 4.13Å; T369-Q376 HydrophobicContact CG2-CG 3.87Å
370	L	95.7	Very high	93.8	Very high	16 Å²	16	62.1 Å²	62.1	8%	0.084	33%	0.329	C	S	.	.			trans	-61.6	141.5	176.5	-63.1	-173.8	0	0	0	111.8	V358 V360 K377 F379 L393 T397	V358-L370 HydrophobicContact CB-CD1 3.92Å; V358-L370 HydrophobicContact CB-CG 4.26Å; V358-L370 HydrophobicContact CG1-CD1 3.79Å; V358-L370 HydrophobicContact CG1-CG 4.25Å; V358-L370 PolarHBondContact O-N 2.98Å; V360-L370 HydrophobicContact CG1-CD1 4.45Å; V360-L370 HydrophobicContact CG1-CD2 4.04Å; V360-L370 HydrophobicContact CG1-CG 4.27Å; V360-L370 HydrophobicContact CG2-CD2 3.82Å; L370-K377 PolarHBondContact O-N 3.42Å; L370-F379 HydrophobicContact CB-CE2 4.48Å; L370-F379 HydrophobicContact CD1-CE2 4.46Å; L370-F379 HydrophobicContact CD1-CZ 4.03Å; L370-L393 HydrophobicContact CD1-CD2 3.51Å; L370-L393 HydrophobicContact CD1-CG 3.82Å; L370-T397 HydrophobicContact CD2-CG2 4.19Å
371	K	93.1	Very high	93.7	Very high	129 Å²	129	62.4 Å²	62.4	56%	0.561	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.9	-176.4	-63.3	-178	-174.6	176.8	0	111.5	K375	K371-K375 VanDerWaalsContact CA-O 3.23Å; K371-K375 WeakPolarHBondContact CA-O 3.31Å; K371-K375 WeakPolarHBondContact CB-O 3.34Å
372	E	90.4	Very high	93.7	Very high	109 Å²	109	62.6 Å²	62.6	51%	0.509	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	109.3	167.9	-178.3	173.4	-117.7	0	0	107.5	S374 K375 K377 P394	E372-S374 PolarHBondContact O-N 2.97Å; E372-K375 PolarHBondContact N-O 3.42Å; E372-K375 PolarHBondContact O-N 2.9Å; E372-K377 HydrophobicContact CB-CB 4.42Å; E372-K377 HydrophobicContact CB-CD 3.86Å; E372-K377 HydrophobicContact CG-CD 4.48Å; E372-K377 IonicContact OE1-NZ 3.63Å; E372-K377 PolarHBondContact OE1-NZ 2.99Å; E372-K377 VanDerWaalsContact OE2-CD 3.29Å; E372-K377 WeakPolarHBondContact OE2-CD 3.39Å; E372-K377 IonicContact OE2-NZ 2.89Å; E372-K377 PolarHBondContact OE2-NZ 3.45Å; E372-P394 HydrophobicContact CB-CG 4.35Å
373	G	86.9	Confident	93.9	Very high	77 Å²	77	67.9 Å²	67.9	79%	0.794	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-124.9	-163.4	0	0	0	0	0	111.4
374	S	85.6	Confident	94.1	Very high	111 Å²	111	66.9 Å²	66.9	78%	0.776	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-11.3	-178.3	58.9	0	0	0	0	114.6	E372	E372-S374 PolarHBondContact O-N 2.97Å
375	K	90.8	Very high	94.3	Very high	162 Å²	162	66.5 Å²	66.5	70%	0.704	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	149.9	-173.4	-65.5	-176.9	-179.5	179	0	111.3	K371 E372 K377	K371-K375 VanDerWaalsContact CA-O 3.23Å; K371-K375 WeakPolarHBondContact CA-O 3.31Å; K371-K375 WeakPolarHBondContact CB-O 3.34Å; E372-K375 PolarHBondContact N-O 3.42Å; E372-K375 PolarHBondContact O-N 2.9Å; K375-K377 PolarHBondContact O-N 2.84Å
376	Q	93.4	Very high	94.5	Very high	93 Å²	93	63.2 Å²	63.2	44%	0.435	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	131.1	171	-68.4	179.3	-13.6	0	0	109.6	T369 I378	T369-Q376 HydrophobicContact CG2-CB 4.13Å; T369-Q376 HydrophobicContact CG2-CG 3.87Å; Q376-I378 PolarHBondContact O-N 3.23Å
377	K	95.3	Very high	94.7	Very high	45 Å²	45	66.8 Å²	66.8	20%	0.196	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-73.5	125.4	178.1	-178.1	69.9	179.8	-167.7	0	108.9	L370 E372 K375 F379 P394	L370-K377 PolarHBondContact O-N 3.42Å; E372-K377 HydrophobicContact CB-CB 4.42Å; E372-K377 HydrophobicContact CB-CD 3.86Å; E372-K377 HydrophobicContact CG-CD 4.48Å; E372-K377 IonicContact OE1-NZ 3.63Å; E372-K377 PolarHBondContact OE1-NZ 2.99Å; E372-K377 VanDerWaalsContact OE2-CD 3.29Å; E372-K377 WeakPolarHBondContact OE2-CD 3.39Å; E372-K377 IonicContact OE2-NZ 2.89Å; E372-K377 PolarHBondContact OE2-NZ 3.45Å; K375-K377 PolarHBondContact O-N 2.84Å; K377-F379 HydrophobicContact CB-CD2 4.43Å; K377-F379 HydrophobicContact CB-CE2 3.85Å; K377-F379 HydrophobicContact CB-CZ 4.23Å; K377-F379 HydrophobicContact CG-CD1 4.42Å; K377-F379 HydrophobicContact CG-CD2 3.87Å; K377-F379 HydrophobicContact CG-CE1 4.09Å; K377-F379 HydrophobicContact CG-CE2 3.5Å; K377-F379 HydrophobicContact CG-CG 4.32Å; K377-F379 HydrophobicContact CG-CZ 3.62Å; K377-P394 HydrophobicContact CD-CG 4.26Å; K377-P394 HydrophobicContact CG-CG 4.27Å
378	I	96.7	Very high	94.8	Very high	79 Å²	79	67.2 Å²	67.2	41%	0.405	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-100.1	118.5	166.1	-60	175.6	0	0	0	106.4	K357 Q376	K357-I378 HydrophobicContact CG-CG1 4.44Å; Q376-I378 PolarHBondContact O-N 3.23Å
379	F	97.4	Very high	94.8	Very high	1 Å²	1	67.7 Å²	67.7	0%	0.004	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135.4	178	-65.7	-98.9	0	0	0	108.8	S355 Y356 V358 L370 K377 T391 L393	S355-F379 WeakPolarHBondContact CA-O 3.34Å; S355-F379 WeakPolarHBondContact CB-O 3.19Å; Y356-F379 HydrophobicContact CD1-CB 4.24Å; Y356-F379 HydrophobicContact CD2-CB 3.78Å; Y356-F379 HydrophobicContact CD2-CD2 4.32Å; Y356-F379 HydrophobicContact CD2-CG 4.24Å; Y356-F379 HydrophobicContact CE1-CB 3.93Å; Y356-F379 HydrophobicContact CE2-CB 3.42Å; Y356-F379 VanDerWaalsContact CE2-CB 3.42Å; Y356-F379 HydrophobicContact CE2-CD1 4.37Å; Y356-F379 HydrophobicContact CE2-CD2 4.16Å; Y356-F379 AromaticContact CE2-CG 3.75Å; Y356-F379 HydrophobicContact CE2-CG 3.75Å; Y356-F379 HydrophobicContact CG-CB 4.17Å; Y356-F379 PolarHBondContact N-O 3.03Å; Y356-F379 PolarHBondContact O-N 3.47Å; V358-F379 HydrophobicContact CB-CD2 4.44Å; V358-F379 HydrophobicContact CB-CE2 3.9Å; V358-F379 HydrophobicContact CB-CZ 4.47Å; V358-F379 HydrophobicContact CG2-CD2 3.72Å; V358-F379 HydrophobicContact CG2-CE2 3.58Å; V358-F379 HydrophobicContact CG2-CG 4.37Å; V358-F379 HydrophobicContact CG2-CZ 4.12Å; L370-F379 HydrophobicContact CB-CE2 4.48Å; L370-F379 HydrophobicContact CD1-CE2 4.46Å; L370-F379 HydrophobicContact CD1-CZ 4.03Å; K377-F379 HydrophobicContact CB-CD2 4.43Å; K377-F379 HydrophobicContact CB-CE2 3.85Å; K377-F379 HydrophobicContact CB-CZ 4.23Å; K377-F379 HydrophobicContact CG-CD1 4.42Å; K377-F379 HydrophobicContact CG-CD2 3.87Å; K377-F379 HydrophobicContact CG-CE1 4.09Å; K377-F379 HydrophobicContact CG-CE2 3.5Å; K377-F379 HydrophobicContact CG-CG 4.32Å; K377-F379 HydrophobicContact CG-CZ 3.62Å; F379-T391 HydrophobicContact CB-CG2 4.48Å; F379-T391 HydrophobicContact CD1-CG2 3.65Å; F379-T391 HydrophobicContact CE1-CG2 4.45Å; F379-L393 HydrophobicContact CE1-CD1 4.45Å; F379-L393 HydrophobicContact CE1-CG 4.43Å; F379-L393 HydrophobicContact CZ-CG 4.42Å
380	Q	97.1	Very high	94.8	Very high	132 Å²	132	70.9 Å²	70.9	62%	0.617	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.1	169	-60.9	-57.5	-43.8	0	0	107.8	T391	Q380-T391 PolarHBondContact O-OG1 2.93Å; Q380-T391 VanDerWaalsContact O-OG1 3.08Å
381	G	95.4	Very high	94.8	Very high	7 Å²	7	71.5 Å²	71.5	7%	0.072	39%	0.391	C	S	.	.			trans	-101.3	-138.9	177	0	0	0	0	0	110.7	K354 T389	K354-G381 WeakPolarHBondContact O-CA 3.11Å; K354-G381 PolarHBondContact O-N 2.71Å; G381-T389 WeakPolarHBondContact O-CG2 3.37Å
382	N	98.2	Very high	94.9	Very high	3 Å²	3	73.3 Å²	73.3	2%	0.016	40%	0.399	C	S	.	.			trans	-83.7	152.6	-167.9	-62.6	88.2	0	0	0	113.3	T339 Q340 F352 V353 N384 D387 T389	T339-N382 WeakPolarHBondContact CB-OD1 3.39Å; T339-N382 PolarHBondContact O-ND2 2.72Å; T339-N382 PolarHBondContact O-OD1 2.69Å; T339-N382 PolarHBondContact OG1-OD1 3.41Å; Q340-N382 WeakPolarHBondContact CA-ND2 3.2Å; Q340-N382 PolarHBondContact N-OD1 2.88Å; F352-N382 HydrophobicContact CB-CB 4.05Å; F352-N382 HydrophobicContact CD2-CB 3.97Å; F352-N382 VanDerWaalsContact CD2-O 3.29Å; F352-N382 WeakPolarHBondContact CD2-O 3.03Å; F352-N382 VanDerWaalsContact CE2-O 3.32Å; F352-N382 WeakPolarHBondContact CE2-O 3.09Å; F352-N382 HydrophobicContact CG-CB 4.33Å; V353-N382 PolarHBondContact O-N 2.74Å; N382-N384 WeakPolarHBondContact CB-O 3.16Å; N382-D387 PolarHBondContact ND2-O 3.22Å; N382-T389 PolarHBondContact ND2-OG1 3.5Å
383	T	97.6	Very high	95.1	Very high	116 Å²	116	68.8 Å²	68.8	71%	0.712	38%	0.378	S	S	*	.	S	Bend	trans	-107.4	-11.5	169.8	55.7	0	0	0	0	112.9	F352	F352-T383 VanDerWaalsContact CZ-O 3.29Å; F352-T383 WeakPolarHBondContact CZ-O 3.4Å
384	N	96.8	Very high	95.3	Very high	39 Å²	39	68.1 Å²	68.1	21%	0.209	36%	0.36	C	S	.	.	S	Bend	trans	-150.3	166.6	178.1	69.6	60.3	0	0	0	109.6	N382 T386 D387	N382-N384 WeakPolarHBondContact CB-O 3.16Å; N384-T386 PolarHBondContact O-N 3.47Å; N384-T386 PolarHBondContact OD1-N 2.77Å; N384-T386 VanDerWaalsContact OD1-N 3.07Å; N384-T386 PolarHBondContact OD1-OG1 2.85Å; N384-D387 VanDerWaalsContact ND2-CG 3.28Å; N384-D387 PolarHBondContact ND2-OD2 3.1Å; N384-D387 WeakPolarHBondContact OD1-CB 3.33Å; N384-D387 PolarHBondContact OD1-N 3.09Å
385	P	95.8	Very high	95.6	Very high	13 Å²	13	67 Å²	67	8%	0.084	34%	0.341	C	S	.	.	S	Bend	trans	-79.1	-10.9	-173.1	31.3	-36.4	0	0	0	115.1	G341 A342 I343 I350 F352 R416	G341-P385 CarbonylContact C-O 3.59Å; G341-P385 WeakPolarHBondContact CA-O 2.95Å; G341-P385 PolarHBondContact N-O 3.39Å; A342-P385 WeakPolarHBondContact O-CB 3.17Å; I343-P385 HydrophobicContact CD1-CG 4.1Å; I343-P385 HydrophobicContact CG1-CB 3.91Å; I343-P385 HydrophobicContact CG1-CG 3.74Å; I350-P385 HydrophobicContact CB-CB 4.36Å; I350-P385 HydrophobicContact CB-CG 4Å; I350-P385 HydrophobicContact CG2-CG 3.93Å; F352-P385 HydrophobicContact CD1-CB 4.43Å; P385-R416 PolarHBondContact O-NH2 3.07Å
386	T	95.8	Very high	95.7	Very high	71 Å²	71	63.1 Å²	63.1	44%	0.436	33%	0.333	S	S	.	.	S	Bend	trans	-110.2	-39.5	-168.5	49.5	0	0	0	0	114.1	Q340 I343 N384	Q340-T386 PolarHBondContact NE2-O 2.96Å; I343-T386 HydrophobicContact CD1-CG2 4.19Å; N384-T386 PolarHBondContact O-N 3.47Å; N384-T386 PolarHBondContact OD1-N 2.77Å; N384-T386 VanDerWaalsContact OD1-N 3.07Å; N384-T386 PolarHBondContact OD1-OG1 2.85Å
387	D	97.4	Very high	95.8	Very high	93 Å²	93	59 Å²	59	50%	0.497	31%	0.314	S	S	.	.	S	Bend	trans	-76.7	136.9	-170.6	-61.7	-10.2	0	0	0	111	N382 N384 T389	N382-D387 PolarHBondContact ND2-O 3.22Å; N384-D387 VanDerWaalsContact ND2-CG 3.28Å; N384-D387 PolarHBondContact ND2-OD2 3.1Å; N384-D387 WeakPolarHBondContact OD1-CB 3.33Å; N384-D387 PolarHBondContact OD1-N 3.09Å; D387-T389 PolarHBondContact O-N 3.09Å
388	V	97.7	Very high	95.8	Very high	63 Å²	63	57 Å²	57	38%	0.382	31%	0.305	S	S	.	.			trans	-73.4	121.8	175.1	-175	0	0	0	0	109.4	L306 Q340	L306-V388 HydrophobicContact CD1-CG1 4.22Å; L306-V388 HydrophobicContact CD1-CG2 4.25Å; L306-V388 HydrophobicContact CD2-CG1 4.25Å; L306-V388 HydrophobicContact CD2-CG2 4.18Å; L306-V388 HydrophobicContact CG-CG2 4.42Å; Q340-V388 HydrophobicContact CG-CB 4.25Å; Q340-V388 HydrophobicContact CG-CG2 3.75Å
389	T	97.5	Very high	95.8	Very high	37 Å²	37	53.3 Å²	53.3	23%	0.227	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	104.1	169.9	-55	0	0	0	0	109.2	G338 T339 G381 N382 D387	G338-T389 WeakPolarHBondContact CA-O 3.06Å; T339-T389 PolarHBondContact N-O 2.7Å; T339-T389 PolarHBondContact O-N 3.39Å; G381-T389 WeakPolarHBondContact O-CG2 3.37Å; N382-T389 PolarHBondContact ND2-OG1 3.5Å; D387-T389 PolarHBondContact O-N 3.09Å
390	K	96.4	Very high	95.7	Very high	93 Å²	93	57.2 Å²	57.2	40%	0.404	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	115	175.5	-172.9	170.2	-178.3	168	0	110.1	S274 A336 I337 Y420	S274-K390 PolarHBondContact O-NZ 3.21Å; A336-K390 HydrophobicContact CB-CG 4.06Å; I337-K390 WeakPolarHBondContact O-CA 3.45Å; K390-Y420 HydrophobicContact CD-CD2 4.05Å; K390-Y420 HydrophobicContact CD-CE2 3.87Å; K390-Y420 HydrophobicContact CD-CG 4.46Å; K390-Y420 HydrophobicContact CG-CD2 4.19Å; K390-Y420 HydrophobicContact CG-CE2 4.04Å; K390-Y420 VanDerWaalsContact NZ-CD1 3.33Å
391	T	95.6	Very high	95.8	Very high	29 Å²	29	51.8 Å²	51.8	18%	0.178	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.6	-179.8	-55	0	0	0	0	110.4	A336 I337 F379 Q380	A336-T391 WeakPolarHBondContact CA-O 3.38Å; A336-T391 WeakPolarHBondContact CB-O 3.39Å; I337-T391 PolarHBondContact N-O 3.4Å; I337-T391 PolarHBondContact O-N 2.81Å; F379-T391 HydrophobicContact CB-CG2 4.48Å; F379-T391 HydrophobicContact CD1-CG2 3.65Å; F379-T391 HydrophobicContact CE1-CG2 4.45Å; Q380-T391 PolarHBondContact O-OG1 2.93Å; Q380-T391 VanDerWaalsContact O-OG1 3.08Å
392	K	95.1	Very high	95.9	Very high	166 Å²	166	51.5 Å²	51.5	72%	0.722	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	142.9	177.8	-64.6	-170.9	178	-170.3	0	111.4	S335 A336	S335-K392 WeakPolarHBondContact O-CA 3.44Å; A336-K392 HydrophobicContact CB-CG 4.29Å
393	L	94.4	Very high	95.9	Very high	14 Å²	14	53.1 Å²	53.1	7%	0.073	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	150.7	170.4	-85.1	66.6	0	0	0	109.9	I334 S335 I337 L370 F379 K395	I334-L393 HydrophobicContact CB-CD2 4.33Å; I334-L393 HydrophobicContact CG2-CD1 4.18Å; I334-L393 HydrophobicContact CG2-CD2 4.03Å; S335-L393 PolarHBondContact O-N 3.02Å; I337-L393 HydrophobicContact CD1-CD1 4.3Å; I337-L393 HydrophobicContact CG1-CD1 4.09Å; L370-L393 HydrophobicContact CD1-CD2 3.51Å; L370-L393 HydrophobicContact CD1-CG 3.82Å; F379-L393 HydrophobicContact CE1-CD1 4.45Å; F379-L393 HydrophobicContact CE1-CG 4.43Å; F379-L393 HydrophobicContact CZ-CG 4.42Å; L393-K395 WeakPolarHBondContact CB-O 3.25Å; L393-K395 PolarHBondContact O-N 3.2Å
394	P	91.6	Very high	95.9	Very high	64 Å²	64	47.6 Å²	47.6	42%	0.416	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	-32	176.6	-25	34.2	0	0	0	113.5	E372 K377	E372-P394 HydrophobicContact CB-CG 4.35Å; K377-P394 HydrophobicContact CD-CG 4.26Å; K377-P394 HydrophobicContact CG-CG 4.27Å
395	K	91.2	Very high	96	Very high	86 Å²	86	49.4 Å²	49.4	37%	0.374	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.8	170.3	62.4	174.6	-176.7	171.8	0	109.4	L393 T397 E548	L393-K395 WeakPolarHBondContact CB-O 3.25Å; L393-K395 PolarHBondContact O-N 3.2Å; K395-T397 PolarHBondContact O-N 2.79Å; K395-T397 PolarHBondContact O-OG1 2.88Å; K395-E548 IonicContact NZ-OE1 3.06Å; K395-E548 PolarHBondContact NZ-OE1 2.82Å; K395-E548 IonicContact NZ-OE2 2.73Å
396	P	92.8	Very high	96.1	Very high	81 Å²	81	48.9 Å²	48.9	53%	0.526	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	127.9	166.8	-25	34.7	0	0	0	109.8	F333 I334	F333-P396 HydrophobicContact CD1-CB 4.37Å; I334-P396 WeakPolarHBondContact O-CA 3.49Å
397	T	95.3	Very high	96.2	Very high	6 Å²	6	47.6 Å²	47.6	4%	0.037	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.7	-172.8	-60.4	0	0	0	0	109.5	I334 V360 L370 K395 T546	I334-T397 PolarHBondContact N-O 3.28Å; I334-T397 PolarHBondContact O-N 3.39Å; V360-T397 HydrophobicContact CG2-CG2 4.2Å; L370-T397 HydrophobicContact CD2-CG2 4.19Å; K395-T397 PolarHBondContact O-N 2.79Å; K395-T397 PolarHBondContact O-OG1 2.88Å; T397-T546 HydrophobicContact CG2-CG2 3.6Å
398	L	96.2	Very high	96.3	Very high	3 Å²	3	46 Å²	46	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.1	176.7	-170.9	57.1	0	0	0	109.3	L331 R332 F333 I424 I497 P547	L331-L398 HydrophobicContact CB-CD1 3.94Å; L331-L398 HydrophobicContact CB-CG 4.25Å; L331-L398 HydrophobicContact CD1-CD2 4.45Å; R332-L398 VanDerWaalsContact C-CD1 3.47Å; R332-L398 WeakPolarHBondContact O-CA 3.18Å; R332-L398 WeakPolarHBondContact O-CD1 3.46Å; F333-L398 HydrophobicContact CD1-CB 4.24Å; F333-L398 HydrophobicContact CD1-CD1 4.33Å; F333-L398 HydrophobicContact CD2-CD1 4.26Å; F333-L398 HydrophobicContact CE1-CB 4Å; F333-L398 HydrophobicContact CE1-CD1 4.34Å; F333-L398 HydrophobicContact CE2-CD1 4.28Å; F333-L398 HydrophobicContact CG-CD1 4.28Å; F333-L398 HydrophobicContact CZ-CD1 4.3Å; F333-L398 HydrophobicContact CZ-CD2 4.4Å; L398-I424 HydrophobicContact CD1-CD1 4Å; L398-I424 HydrophobicContact CD1-CG1 3.9Å; L398-I424 HydrophobicContact CD2-CD1 4.25Å; L398-I497 HydrophobicContact CD2-CD1 4.02Å; L398-I497 HydrophobicContact CD2-CG1 4.3Å; L398-I497 HydrophobicContact CD2-CG2 3.97Å; L398-P547 HydrophobicContact CD2-CB 4.09Å; L398-P547 HydrophobicContact CG-CB 4.42Å; L398-P547 WeakPolarHBondContact O-CD 2.95Å
399	T	96.8	Very high	96.3	Very high	2 Å²	2	46 Å²	46	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	163.7	-178.6	-170.4	0	0	0	0	111.4	R332 I334 V360 S361 F401	R332-T399 PolarHBondContact N-O 2.83Å; R332-T399 PolarHBondContact O-N 2.91Å; I334-T399 HydrophobicContact CD1-CG2 3.2Å; I334-T399 HydrophobicContact CG1-CG2 3.89Å; V360-T399 HydrophobicContact CB-CG2 4.09Å; V360-T399 HydrophobicContact CG1-CG2 4.01Å; S361-T399 PolarHBondContact N-OG1 2.78Å; S361-T399 VanDerWaalsContact N-OG1 3.12Å; S361-T399 PolarHBondContact O-OG1 2.8Å; T399-F401 PolarHBondContact OG1-O 3.44Å
400	R	95.7	Very high	96.3	Very high	84 Å²	84	47.9 Å²	47.9	32%	0.317	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-45.1	172.2	174.3	176.7	167	172.2	-0.2	111.2	D327 L328 G329 L331 S361	D327-R400 WeakPolarHBondContact OD1-CG 3.23Å; D327-R400 IonicContact OD1-CZ 2.68Å; D327-R400 IonicContact OD1-NE 3.6Å; D327-R400 PolarHBondContact OD1-NE 3.04Å; D327-R400 IonicContact OD1-NH2 3.65Å; D327-R400 IonicContact OD2-CZ 3.85Å; D327-R400 IonicContact OD2-NE 2.86Å; D327-R400 PolarHBondContact OD2-NE 3.17Å; D327-R400 IonicContact OD2-NH2 3.64Å; D327-R400 PolarHBondContact OD2-NH2 3.17Å; L328-R400 WeakPolarHBondContact CB-O 3.36Å; L328-R400 WeakPolarHBondContact CG-O 3.38Å; L328-R400 PolarHBondContact N-O 2.96Å; G329-R400 VanDerWaalsContact O-CZ 3.31Å; G329-R400 PolarHBondContact O-NE 3.04Å; L331-R400 HydrophobicContact CD2-CB 4.3Å; S361-R400 PolarHBondContact O-N 2.82Å
401	F	97.8	Very high	96.4	Very high	18 Å²	18	47.2 Å²	47.2	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.5	178.1	-64.7	-97.9	0	0	0	110.6	M290 V326 D327 V360 S361 W367 T399	M290-F401 HydrophobicContact CE-CE1 4.27Å; V326-F401 WeakPolarHBondContact O-CA 3.47Å; D327-F401 HydrophobicContact CB-CD1 3.85Å; D327-F401 HydrophobicContact CB-CE1 3.46Å; D327-F401 VanDerWaalsContact CB-CE1 3.46Å; D327-F401 HydrophobicContact CB-CZ 4.07Å; D327-F401 VanDerWaalsContact CG-CE1 3.43Å; D327-F401 VanDerWaalsContact CG-CZ 3.47Å; D327-F401 WeakPolarHBondContact OD2-CZ 3.41Å; V360-F401 WeakPolarHBondContact CA-O 3.37Å; S361-F401 PolarHBondContact N-O 2.87Å; S361-F401 VanDerWaalsContact N-O 3.08Å; S361-F401 PolarHBondContact O-N 3.48Å; W367-F401 HydrophobicContact CH2-CB 3.66Å; W367-F401 HydrophobicContact CH2-CG 4.46Å; W367-F401 HydrophobicContact CZ2-CB 4.35Å; W367-F401 HydrophobicContact CZ3-CB 4.12Å; T399-F401 PolarHBondContact OG1-O 3.44Å
402	L	98.2	Very high	96.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.3	171	177.9	148.7	0	0	0	109.2	Q325 V326 I334 I337 V358 I404 V419	Q325-L402 CarbonylContact C-O 3.52Å; Q325-L402 WeakPolarHBondContact CA-O 3.33Å; Q325-L402 VanDerWaalsContact CB-O 3.29Å; Q325-L402 WeakPolarHBondContact CB-O 3.33Å; V326-L402 HydrophobicContact CG1-CB 4.11Å; V326-L402 HydrophobicContact CG1-CD2 4.46Å; V326-L402 PolarHBondContact N-O 2.88Å; V326-L402 PolarHBondContact O-N 2.79Å; V326-L402 VanDerWaalsContact O-N 3.09Å; I334-L402 HydrophobicContact CD1-CB 3.95Å; I334-L402 HydrophobicContact CD1-CD1 3.44Å; I334-L402 VanDerWaalsContact CD1-CD1 3.44Å; I334-L402 HydrophobicContact CD1-CG 4.32Å; I334-L402 HydrophobicContact CG2-CD1 3.96Å; I337-L402 HydrophobicContact CD1-CD1 3.88Å; I337-L402 HydrophobicContact CD1-CD2 4.39Å; I337-L402 HydrophobicContact CG1-CD1 4.15Å; V358-L402 HydrophobicContact CG1-CD1 4.13Å; V358-L402 HydrophobicContact CG1-CG 4.05Å; L402-I404 HydrophobicContact CD2-CD1 4.2Å; L402-I404 HydrophobicContact CD2-CG1 3.68Å; L402-V419 HydrophobicContact CD1-CG1 4.17Å; L402-V419 HydrophobicContact CD1-CG2 4.46Å; L402-V419 HydrophobicContact CD2-CG2 4.32Å
403	R	98.5	Very high	96.6	Very high	37 Å²	37	38 Å²	38	14%	0.14	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.3	179.2	179.5	-175.6	-71.2	170.1	-5.4	110.5	W323 I324 Q325 V358 D359 W367 R405	W323-R403 HydrophobicContact CB-CG 3.63Å; W323-R403 HydrophobicContact CD2-CG 4.24Å; W323-R403 HydrophobicContact CE3-CG 4.24Å; W323-R403 HydrophobicContact CG-CG 4.03Å; I324-R403 CarbonylContact O-C 3.57Å; I324-R403 WeakPolarHBondContact O-CA 3.23Å; Q325-R403 HydrophobicContact CB-CB 3.8Å; Q325-R403 HydrophobicContact CB-CG 4.06Å; Q325-R403 VanDerWaalsContact OE1-CZ 3.25Å; V358-R403 WeakPolarHBondContact CA-O 3.34Å; D359-R403 HydrophobicContact CB-CB 4.26Å; D359-R403 PolarHBondContact N-O 2.83Å; D359-R403 PolarHBondContact O-N 3.02Å; W367-R403 HydrophobicContact CE3-CB 4.03Å; W367-R403 HydrophobicContact CH2-CB 3.77Å; W367-R403 VanDerWaalsContact CZ2-CZ 3.42Å; W367-R403 HydrophobicContact CZ3-CB 3.34Å; W367-R403 HydrophobicContact CZ3-CG 4.44Å; R403-R405 HydrophobicContact CG-CG 4.22Å
404	I	98.6	Very high	96.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.2	174.9	-58	177.2	0	0	0	109	W323 I324 I337 Y356 L402 L415 F417	W323-I404 VanDerWaalsContact CA-O 3.3Å; W323-I404 WeakPolarHBondContact CA-O 3.35Å; I324-I404 HydrophobicContact CG2-CB 4.19Å; I324-I404 PolarHBondContact N-O 3.24Å; I324-I404 VanDerWaalsContact N-O 3.13Å; I324-I404 PolarHBondContact O-N 2.8Å; I337-I404 HydrophobicContact CG2-CD1 3.84Å; Y356-I404 HydrophobicContact CD2-CG2 3.77Å; Y356-I404 HydrophobicContact CE2-CG2 4.48Å; Y356-I404 HydrophobicContact CG-CG2 3.94Å; L402-I404 HydrophobicContact CD2-CD1 4.2Å; L402-I404 HydrophobicContact CD2-CG1 3.68Å; I404-L415 HydrophobicContact CB-CD2 4.23Å; I404-L415 HydrophobicContact CD1-CD2 3.94Å; I404-L415 HydrophobicContact CG2-CD2 3.82Å; I404-F417 HydrophobicContact CD1-CB 4.04Å; I404-F417 HydrophobicContact CD1-CD1 4.29Å; I404-F417 HydrophobicContact CD1-CD2 3.66Å; I404-F417 HydrophobicContact CD1-CE2 4.16Å; I404-F417 HydrophobicContact CD1-CG 3.74Å
405	R	98.3	Very high	97.1	Very high	78 Å²	78	34.3 Å²	34.3	29%	0.294	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	102.9	-177.7	-64.9	-175.8	60.7	-176.5	1.7	110.6	W323 Y356 K357 D359 R403 V407	W323-R405 HydrophobicContact CB-CG 4.01Å; Y356-R405 CarbonylContact C-O 3.4Å; Y356-R405 WeakPolarHBondContact CA-O 3.48Å; Y356-R405 WeakPolarHBondContact CB-O 3.41Å; K357-R405 HydrophobicContact CB-CB 4.31Å; K357-R405 PolarHBondContact N-O 3.44Å; K357-R405 PolarHBondContact O-N 3.42Å; D359-R405 WeakPolarHBondContact OD2-CD 3.38Å; D359-R405 IonicContact OD2-CZ 3.78Å; D359-R405 IonicContact OD2-NE 2.74Å; D359-R405 IonicContact OD2-NH1 3.36Å; D359-R405 PolarHBondContact OD2-NH1 2.81Å; R403-R405 HydrophobicContact CG-CG 4.22Å; R405-V407 PolarHBondContact O-N 3.13Å
406	P	98.4	Very high	97.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	137	176.6	-25.2	35.8	0	0	0	111.8	W313 E322 V353 W409 I413	W313-P406 HydrophobicContact CZ3-CG 4.37Å; E322-P406 WeakPolarHBondContact O-CD 3.24Å; V353-P406 HydrophobicContact CG1-CB 4.05Å; V353-P406 HydrophobicContact CG2-CB 4.08Å; V353-P406 HydrophobicContact CG2-CG 4.15Å; P406-W409 HydrophobicContact CB-CE3 4.1Å; P406-W409 HydrophobicContact CB-CZ3 4.29Å; P406-I413 HydrophobicContact CB-CD1 3.9Å; P406-I413 HydrophobicContact CB-CG1 4.11Å; P406-I413 HydrophobicContact CB-CG2 4.23Å; P406-I413 HydrophobicContact CG-CD1 4.16Å; P406-I413 HydrophobicContact CG-CG1 4.45Å; P406-I413 HydrophobicContact CG-CG2 3.72Å
407	V	97.8	Very high	97.8	Very high	44 Å²	44	27.7 Å²	27.7	27%	0.267	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-46.2	177.3	179.1	0	0	0	0	110.5	S355 K357 R405	S355-V407 PolarHBondContact O-N 2.86Å; K357-V407 HydrophobicContact CD-CG2 4.31Å; K357-V407 HydrophobicContact CG-CG2 3.87Å; R405-V407 PolarHBondContact O-N 3.13Å
408	T	98.4	Very high	97.9	Very high	61 Å²	61	27.5 Å²	27.5	37%	0.374	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.2	175.4	61.6	0	0	0	0	110	K354 S355	K354-T408 WeakPolarHBondContact CA-O 3.49Å; K354-T408 WeakPolarHBondContact CB-OG1 3.34Å; K354-T408 PolarHBondContact N-O 2.83Å; S355-T408 WeakPolarHBondContact CB-OG1 3.2Å; S355-T408 PolarHBondContact N-O 2.88Å; S355-T408 VanDerWaalsContact N-O 3.08Å; S355-T408 PolarHBondContact N-OG1 3.29Å; S355-T408 PolarHBondContact O-N 2.78Å; S355-T408 PolarHBondContact OG-OG1 3.43Å
409	W	98.4	Very high	98	Very high	62 Å²	62	27.3 Å²	27.3	24%	0.235	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	169.2	-177	48.4	88.2	0	0	0	111.5	D318 F352 K354 P406 G412 I413	D318-W409 HydrophobicContact CB-CZ2 3.9Å; D318-W409 VanDerWaalsContact O-CZ2 3.32Å; D318-W409 WeakPolarHBondContact O-CZ2 3.37Å; F352-W409 CarbonylContact O-C 3.58Å; F352-W409 VanDerWaalsContact O-CA 3.26Å; F352-W409 WeakPolarHBondContact O-CA 3.3Å; F352-W409 WeakPolarHBondContact O-CB 3.13Å; K354-W409 WeakPolarHBondContact CE-O 3.37Å; K354-W409 PolarHBondContact NZ-O 2.61Å; K354-W409 VanDerWaalsContact NZ-O 3.16Å; P406-W409 HydrophobicContact CB-CE3 4.1Å; P406-W409 HydrophobicContact CB-CZ3 4.29Å; W409-G412 VanDerWaalsContact CD1-C 3.47Å; W409-I413 HydrophobicContact CB-CG1 4.4Å; W409-I413 HydrophobicContact CD2-CD1 4.19Å; W409-I413 HydrophobicContact CD2-CG1 3.51Å; W409-I413 HydrophobicContact CE3-CD1 3.9Å; W409-I413 HydrophobicContact CE3-CG1 3.59Å; W409-I413 HydrophobicContact CG-CG1 3.89Å; W409-I413 HydrophobicContact CH2-CD1 4.1Å; W409-I413 HydrophobicContact CH2-CG1 4.46Å; W409-I413 HydrophobicContact CZ2-CD1 4.37Å; W409-I413 HydrophobicContact CZ2-CG1 4.41Å; W409-I413 HydrophobicContact CZ3-CD1 3.85Å; W409-I413 HydrophobicContact CZ3-CG1 4.08Å
410	E	97.9	Very high	98	Very high	77 Å²	77	28.7 Å²	28.7	36%	0.36	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.1	173.2	-165.9	64.7	-151.8	0	0	109.2	F352 K354 G412	F352-E410 HydrophobicContact CD1-CB 3.86Å; F352-E410 HydrophobicContact CD1-CG 4.41Å; F352-E410 HydrophobicContact CD2-CB 4Å; F352-E410 HydrophobicContact CE1-CB 3.48Å; F352-E410 VanDerWaalsContact CE1-CB 3.48Å; F352-E410 HydrophobicContact CE1-CG 3.63Å; F352-E410 HydrophobicContact CE2-CB 3.64Å; F352-E410 HydrophobicContact CE2-CG 4.33Å; F352-E410 HydrophobicContact CG-CB 4.1Å; F352-E410 HydrophobicContact CZ-CB 3.36Å; F352-E410 HydrophobicContact CZ-CG 3.59Å; F352-E410 PolarHBondContact N-O 3Å; F352-E410 PolarHBondContact O-N 3.34Å; K354-E410 IonicContact NZ-OE2 3.66Å; K354-E410 PolarHBondContact NZ-OE2 3.12Å; E410-G412 PolarHBondContact O-N 3.31Å
411	T	96.9	Very high	98	Very high	79 Å²	79	24.7 Å²	24.7	49%	0.485	12%	0.118	S	C	.	.	S	Bend	trans	62.1	-51.8	-171.2	-43.2	0	0	0	0	115	I350 Y351	I350-T411 WeakPolarHBondContact O-CB 3.2Å; I350-T411 PolarHBondContact O-OG1 2.85Å; Y351-T411 HydrophobicContact CD1-CG2 3.83Å; Y351-T411 HydrophobicContact CE1-CG2 3.42Å; Y351-T411 VanDerWaalsContact CE1-CG2 3.42Å
412	G	97.3	Very high	97.6	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.01	12%	0.115	C	C	.	.	S	Bend	trans	-174.7	173	-177.7	0	0	0	0	0	111.3	D318 W409 E410 A414	D318-G412 WeakPolarHBondContact OD2-CA 3.45Å; W409-G412 VanDerWaalsContact CD1-C 3.47Å; E410-G412 PolarHBondContact O-N 3.31Å; G412-A414 PolarHBondContact O-N 2.76Å
413	I	98.6	Very high	97.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.			trans	-77	116.5	179.4	-62	173.4	0	0	0	109	W313 T314 P315 D318 E322 V353 P406 W409	W313-I413 HydrophobicContact CH2-CG2 4.34Å; W313-I413 HydrophobicContact CZ3-CG2 3.88Å; T314-I413 VanDerWaalsContact CB-O 3.26Å; T314-I413 WeakPolarHBondContact CB-O 3.12Å; T314-I413 WeakPolarHBondContact CG2-O 3.44Å; T314-I413 PolarHBondContact OG1-O 2.87Å; P315-I413 HydrophobicContact CG-CB 3.92Å; P315-I413 HydrophobicContact CG-CD1 3.95Å; P315-I413 HydrophobicContact CG-CG2 3.94Å; D318-I413 WeakPolarHBondContact OD1-CB 3.39Å; D318-I413 PolarHBondContact OD1-N 3.47Å; E322-I413 HydrophobicContact CB-CD1 4.43Å; V353-I413 HydrophobicContact CG2-CG2 4.06Å; P406-I413 HydrophobicContact CB-CD1 3.9Å; P406-I413 HydrophobicContact CB-CG1 4.11Å; P406-I413 HydrophobicContact CB-CG2 4.23Å; P406-I413 HydrophobicContact CG-CD1 4.16Å; P406-I413 HydrophobicContact CG-CG1 4.45Å; P406-I413 HydrophobicContact CG-CG2 3.72Å; W409-I413 HydrophobicContact CB-CG1 4.4Å; W409-I413 HydrophobicContact CD2-CD1 4.19Å; W409-I413 HydrophobicContact CD2-CG1 3.51Å; W409-I413 HydrophobicContact CE3-CD1 3.9Å; W409-I413 HydrophobicContact CE3-CG1 3.59Å; W409-I413 HydrophobicContact CG-CG1 3.89Å; W409-I413 HydrophobicContact CH2-CD1 4.1Å; W409-I413 HydrophobicContact CH2-CG1 4.46Å; W409-I413 HydrophobicContact CZ2-CD1 4.37Å; W409-I413 HydrophobicContact CZ2-CG1 4.41Å; W409-I413 HydrophobicContact CZ3-CD1 3.85Å; W409-I413 HydrophobicContact CZ3-CG1 4.08Å
414	A	98.2	Very high	96.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.			trans	-138.8	129.4	165.3	0	0	0	0	0	109	W299 A312 W313 A342 Y351 G412	W299-A414 HydrophobicContact CZ3-CB 4.04Å; A312-A414 HydrophobicContact CB-CB 4.16Å; W313-A414 WeakPolarHBondContact O-CA 3.27Å; A342-A414 HydrophobicContact CB-CB 4.33Å; Y351-A414 HydrophobicContact CG-CB 4.42Å; G412-A414 PolarHBondContact O-N 2.76Å
415	L	98.4	Very high	95.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-137.8	126.3	-176.2	-159.4	79	0	0	0	112.1	S304 W313 I324 T339 Q340 V353 I404 F417	S304-L415 WeakPolarHBondContact CA-O 3.33Å; W313-L415 HydrophobicContact CE3-CB 3.94Å; W313-L415 HydrophobicContact CZ3-CB 4.35Å; W313-L415 PolarHBondContact N-O 2.67Å; W313-L415 PolarHBondContact O-N 2.95Å; I324-L415 HydrophobicContact CG2-CD2 3.76Å; T339-L415 HydrophobicContact CG2-CD1 4.04Å; Q340-L415 WeakPolarHBondContact O-CA 3.49Å; V353-L415 HydrophobicContact CB-CD1 3.98Å; V353-L415 HydrophobicContact CG2-CD1 3.94Å; I404-L415 HydrophobicContact CB-CD2 4.23Å; I404-L415 HydrophobicContact CD1-CD2 3.94Å; I404-L415 HydrophobicContact CG2-CD2 3.82Å; L415-F417 HydrophobicContact CD2-CB 4.33Å; L415-F417 HydrophobicContact CD2-CD1 4.06Å; L415-F417 HydrophobicContact CD2-CG 4.44Å; L415-F417 HydrophobicContact CG-CB 4.49Å
416	R	98.7	Very high	94.7	Very high	29 Å²	29	24 Å²	24	11%	0.109	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.1	156.1	-72.7	173.3	-61.9	163.5	8.1	108	R303 S304 R305 Y308 A312 T339 Q340 G341 P385	R303-R416 WeakPolarHBondContact O-CG 3.13Å; S304-R416 CarbonylContact O-C 3.08Å; S304-R416 WeakPolarHBondContact O-CA 3.13Å; R305-R416 WeakPolarHBondContact O-CB 3.47Å; R305-R416 WeakPolarHBondContact O-CG 3.3Å; Y308-R416 PolarHBondContact O-NH1 2.92Å; A312-R416 HydrophobicContact CB-CG 3.8Å; T339-R416 CarbonylContact C-O 3.47Å; T339-R416 WeakPolarHBondContact CA-O 3.45Å; Q340-R416 HydrophobicContact CB-CB 3.91Å; Q340-R416 PolarHBondContact N-O 3.27Å; Q340-R416 PolarHBondContact O-N 3.22Å; G341-R416 PolarHBondContact O-NE 2.89Å; G341-R416 PolarHBondContact O-NH2 3.43Å; P385-R416 PolarHBondContact O-NH2 3.07Å
417	F	98.6	Very high	93.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	159.3	-176	75.1	-81.7	0	0	0	113.9	M279 S304 L306 I324 V326 G338 T339 I404 L415 V419	M279-F417 WeakPolarHBondContact CB-O 3.3Å; M279-F417 HydrophobicContact CE-CD1 4.07Å; M279-F417 HydrophobicContact CE-CD2 4.31Å; M279-F417 HydrophobicContact CE-CE1 3.5Å; M279-F417 HydrophobicContact CE-CE2 3.78Å; M279-F417 HydrophobicContact CE-CG 4.44Å; M279-F417 HydrophobicContact CE-CZ 3.34Å; M279-F417 HydrophobicContact CG-CD2 4.3Å; M279-F417 HydrophobicContact CG-CE2 4.09Å; M279-F417 HydrophobicContact SD-CE2 3.88Å; M279-F417 HydrophobicContact SD-CZ 3.88Å; S304-F417 PolarHBondContact O-N 3.04Å; S304-F417 WeakPolarHBondContact OG-CE1 3.44Å; L306-F417 PolarHBondContact N-O 2.85Å; L306-F417 VanDerWaalsContact N-O 3.17Å; I324-F417 HydrophobicContact CD1-CE1 3.95Å; I324-F417 HydrophobicContact CG1-CE1 4.04Å; I324-F417 HydrophobicContact CG2-CD1 4.47Å; I324-F417 HydrophobicContact CG2-CE1 4.04Å; V326-F417 HydrophobicContact CB-CZ 4.43Å; V326-F417 HydrophobicContact CG1-CE2 4.27Å; G338-F417 CarbonylContact O-C 3.57Å; G338-F417 WeakPolarHBondContact O-CA 3.35Å; G338-F417 VanDerWaalsContact O-CB 3.25Å; G338-F417 WeakPolarHBondContact O-CB 3.18Å; T339-F417 HydrophobicContact CG2-CB 4.34Å; I404-F417 HydrophobicContact CD1-CB 4.04Å; I404-F417 HydrophobicContact CD1-CD1 4.29Å; I404-F417 HydrophobicContact CD1-CD2 3.66Å; I404-F417 HydrophobicContact CD1-CE2 4.16Å; I404-F417 HydrophobicContact CD1-CG 3.74Å; L415-F417 HydrophobicContact CD2-CB 4.33Å; L415-F417 HydrophobicContact CD2-CD1 4.06Å; L415-F417 HydrophobicContact CD2-CG 4.44Å; L415-F417 HydrophobicContact CG-CB 4.49Å; F417-V419 HydrophobicContact CD2-CG2 4.05Å; F417-V419 HydrophobicContact CE2-CG2 3.87Å
418	E	98.5	Very high	92.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.5	169	-177.3	58	-86.3	0	0	109.1	P276 G278 M279 E280 L306 I337 G338 Y420	P276-E418 HydrophobicContact CB-CG 3.87Å; G278-E418 PolarHBondContact N-OE1 3.14Å; M279-E418 WeakPolarHBondContact CB-OE1 3.47Å; M279-E418 WeakPolarHBondContact CG-OE1 3.07Å; M279-E418 PolarHBondContact N-OE1 3.18Å; M279-E418 PolarHBondContact N-OE2 3.06Å; E280-E418 PolarHBondContact N-OE2 2.87Å; L306-E418 HydrophobicContact CB-CB 3.97Å; L306-E418 HydrophobicContact CD1-CB 4.48Å; L306-E418 HydrophobicContact CD2-CB 3.77Å; L306-E418 HydrophobicContact CG-CB 4.29Å; I337-E418 WeakPolarHBondContact CA-O 3.35Å; G338-E418 PolarHBondContact N-O 2.78Å; G338-E418 PolarHBondContact O-N 2.87Å; E418-Y420 HydrophobicContact CB-CE2 4.01Å; E418-Y420 HydrophobicContact CG-CD1 4.41Å; E418-Y420 HydrophobicContact CG-CD2 4.46Å; E418-Y420 HydrophobicContact CG-CE1 3.94Å; E418-Y420 HydrophobicContact CG-CE2 4Å
419	V	98.1	Very high	92.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.4	173.2	-173.7	0	0	0	0	107.7	L277 V326 I334 L402 F417	L277-V419 HydrophobicContact CB-CB 4.49Å; L277-V419 WeakPolarHBondContact CB-O 3.26Å; L277-V419 HydrophobicContact CD1-CB 4.37Å; L277-V419 HydrophobicContact CD1-CG1 3.8Å; L277-V419 PolarHBondContact N-O 2.78Å; V326-V419 HydrophobicContact CG1-CG2 4.08Å; I334-V419 HydrophobicContact CD1-CG1 3.95Å; I334-V419 HydrophobicContact CG1-CG1 4.09Å; I334-V419 HydrophobicContact CG2-CG1 3.75Å; L402-V419 HydrophobicContact CD1-CG1 4.17Å; L402-V419 HydrophobicContact CD1-CG2 4.46Å; L402-V419 HydrophobicContact CD2-CG2 4.32Å; F417-V419 HydrophobicContact CD2-CG2 4.05Å; F417-V419 HydrophobicContact CE2-CG2 3.87Å
420	Y	97.3	Very high	91.5	Very high	31 Å²	31	24.7 Å²	24.7	12%	0.122	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.8	178.5	-60.7	-85	0	0	0	110.8	S274 D275 P276 S335 A336 K390 E418	S274-Y420 VanDerWaalsContact O-CD1 3.23Å; S274-Y420 WeakPolarHBondContact O-CD1 3.4Å; D275-Y420 CarbonylContact O-C 3.59Å; D275-Y420 VanDerWaalsContact O-CA 3.23Å; D275-Y420 WeakPolarHBondContact O-CA 3.41Å; P276-Y420 HydrophobicContact CB-CD1 4.25Å; P276-Y420 HydrophobicContact CB-CE1 4.1Å; S335-Y420 PolarHBondContact N-O 2.81Å; S335-Y420 PolarHBondContact OG-O 3.21Å; A336-Y420 HydrophobicContact CB-CD2 4.23Å; A336-Y420 PolarHBondContact N-O 2.83Å; A336-Y420 PolarHBondContact O-N 2.79Å; K390-Y420 HydrophobicContact CD-CD2 4.05Å; K390-Y420 HydrophobicContact CD-CE2 3.87Å; K390-Y420 HydrophobicContact CD-CG 4.46Å; K390-Y420 HydrophobicContact CG-CD2 4.19Å; K390-Y420 HydrophobicContact CG-CE2 4.04Å; K390-Y420 VanDerWaalsContact NZ-CD1 3.33Å; E418-Y420 HydrophobicContact CB-CE2 4.01Å; E418-Y420 HydrophobicContact CG-CD1 4.41Å; E418-Y420 HydrophobicContact CG-CD2 4.46Å; E418-Y420 HydrophobicContact CG-CE1 3.94Å; E418-Y420 HydrophobicContact CG-CE2 4Å
421	G	94.8	Very high	91.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.4	-156.1	-169.6	0	0	0	0	0	113.9	C273 D275 F333	C273-G421 CarbonylContact C-O 3.44Å; D275-G421 PolarHBondContact N-O 3.3Å; D275-G421 VanDerWaalsContact N-O 3.14Å; D275-G421 PolarHBondContact O-N 3.11Å; F333-G421 CarbonylContact O-C 3.58Å; F333-G421 WeakPolarHBondContact O-CA 3.29Å
422	C	90.6	Very high	90.8	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.007	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	168.6	175.1	63.2	0	0	0	0	112	F271 C273 F333 E426	F271-C422 HydrophobicContact CE1-CB 4.47Å; F271-C422 HydrophobicContact CE2-CB 3.84Å; F271-C422 HydrophobicContact CZ-CB 3.39Å; F271-C422 VanDerWaalsContact CZ-SG 3.52Å; C273-C422 HydrophobicContact CB-CB 3.71Å; C273-C422 WeakPolarHBondContact CB-SG 3.22Å; C273-C422 WeakPolarHBondContact SG-CB 3.42Å; C273-C422 PolarHBondContact SG-N 3.46Å; C273-C422 CovalentContact SG-SG 2.02Å; C273-C422 PolarHBondContact SG-SG 2.65Å; F333-C422 PolarHBondContact N-O 3.33Å; F333-C422 PolarHBondContact O-N 2.81Å; C422-E426 WeakPolarHBondContact CB-OE2 3.41Å
423	K	87.4	Confident	90.6	Very high	33 Å²	33	18.3 Å²	18.3	14%	0.143	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	154.6	174.4	-49.7	-177	-168.6	171.4	0	110.5	E182 S425 E426	E182-K423 WeakPolarHBondContact OE1-CD 3.27Å; E182-K423 IonicContact OE1-NZ 2.66Å; E182-K423 IonicContact OE2-NZ 3.63Å; E182-K423 PolarHBondContact OE2-NZ 3.25Å; K423-S425 VanDerWaalsContact C-N 3.25Å; K423-S425 WeakPolarHBondContact CB-OG 3.44Å; K423-S425 PolarHBondContact O-N 3.34Å; K423-E426 HydrophobicContact CB-CG 4.05Å; K423-E426 WeakPolarHBondContact CD-OE1 3.5Å; K423-E426 VanDerWaalsContact CG-OE1 3.23Å; K423-E426 WeakPolarHBondContact CG-OE1 3.15Å; K423-E426 PolarHBondContact N-OE2 2.85Å; K423-E426 VanDerWaalsContact N-OE2 3.16Å; K423-E426 PolarHBondContact O-N 2.93Å
424	I	85.9	Confident	90.2	Very high	9 Å²	9	18.3 Å²	18.3	5%	0.046	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-63.9	-38.8	175.2	-58.8	160.1	0	0	0	110.1	L331 F333 L398 E426 Y427 S430 M432 I497 L579	L331-I424 HydrophobicContact CB-CD1 4.03Å; F333-I424 HydrophobicContact CD2-CG1 4.39Å; F333-I424 HydrophobicContact CE2-CG1 4.06Å; L398-I424 HydrophobicContact CD1-CD1 4Å; L398-I424 HydrophobicContact CD1-CG1 3.9Å; L398-I424 HydrophobicContact CD2-CD1 4.25Å; I424-E426 PolarHBondContact O-N 3.43Å; I424-Y427 PolarHBondContact O-N 2.82Å; I424-S430 WeakPolarHBondContact O-CB 3.41Å; I424-M432 HydrophobicContact CD1-CE 3.62Å; I424-I497 HydrophobicContact CD1-CD1 3.8Å; I424-I497 HydrophobicContact CG2-CD1 4.45Å; I424-L579 HydrophobicContact CG2-CD1 3.73Å; I424-L579 HydrophobicContact CG2-CD2 4.23Å
425	S	77.7	Confident	89.9	Confident	24 Å²	24	18.3 Å²	18.3	17%	0.168	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-62.9	-20.7	-179.2	46.5	0	0	0	0	114.3	E182 K423 Y427	E182-S425 PolarHBondContact OE1-OG 3.39Å; K423-S425 VanDerWaalsContact C-N 3.25Å; K423-S425 WeakPolarHBondContact CB-OG 3.44Å; K423-S425 PolarHBondContact O-N 3.34Å; S425-Y427 VanDerWaalsContact C-N 3.25Å; S425-Y427 PolarHBondContact O-N 2.75Å
426	E	80.4	Confident	89.6	Confident	52 Å²	52	18.3 Å²	18.3	24%	0.243	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-74.9	-14.9	178.4	-73.3	164.9	-164.7	0	0	112.5	V267 F271 C422 K423 I424	V267-E426 VanDerWaalsContact CG1-O 3.25Å; V267-E426 WeakPolarHBondContact CG1-O 3.31Å; V267-E426 WeakPolarHBondContact CG2-O 3.48Å; F271-E426 HydrophobicContact CE2-CB 3.81Å; F271-E426 HydrophobicContact CE2-CG 4.47Å; F271-E426 VanDerWaalsContact CE2-OE2 3.26Å; F271-E426 WeakPolarHBondContact CE2-OE2 3.12Å; F271-E426 HydrophobicContact CZ-CB 3.71Å; C422-E426 WeakPolarHBondContact CB-OE2 3.41Å; K423-E426 HydrophobicContact CB-CG 4.05Å; K423-E426 WeakPolarHBondContact CD-OE1 3.5Å; K423-E426 VanDerWaalsContact CG-OE1 3.23Å; K423-E426 WeakPolarHBondContact CG-OE1 3.15Å; K423-E426 PolarHBondContact N-OE2 2.85Å; K423-E426 VanDerWaalsContact N-OE2 3.16Å; K423-E426 PolarHBondContact O-N 2.93Å; I424-E426 PolarHBondContact O-N 3.43Å
427	Y	79.8	Confident	89.1	Confident	76 Å²	76	17 Å²	17	30%	0.298	9%	0.089	S	C	.	.	S	Bend	trans	-78.4	137.5	169.6	-71.3	-86.5	0	0	0	110.9	F271 F333 I424 S425 C429 S430	F271-Y427 HydrophobicContact CD1-CE1 4.36Å; F271-Y427 HydrophobicContact CE1-CD1 4.22Å; F271-Y427 HydrophobicContact CE1-CD2 4.33Å; F271-Y427 AromaticContact CE1-CE1 3.83Å; F271-Y427 HydrophobicContact CE1-CE1 3.83Å; F271-Y427 AromaticContact CE1-CE2 3.95Å; F271-Y427 HydrophobicContact CE1-CE2 3.95Å; F271-Y427 HydrophobicContact CE1-CG 4.46Å; F271-Y427 AromaticContact CE1-CZ 3.69Å; F271-Y427 HydrophobicContact CZ-CE2 4.42Å; F333-Y427 AromaticContact CD2-CE2 3.91Å; F333-Y427 HydrophobicContact CD2-CE2 3.91Å; F333-Y427 HydrophobicContact CE2-CD2 4.44Å; F333-Y427 AromaticContact CE2-CE2 3.93Å; F333-Y427 HydrophobicContact CE2-CE2 3.93Å; I424-Y427 PolarHBondContact O-N 2.82Å; S425-Y427 VanDerWaalsContact C-N 3.25Å; S425-Y427 PolarHBondContact O-N 2.75Å; Y427-C429 PolarHBondContact O-N 3.01Å; Y427-S430 WeakPolarHBondContact CB-OG 3.27Å; Y427-S430 VanDerWaalsContact O-CB 3.27Å; Y427-S430 WeakPolarHBondContact O-CB 3.24Å; Y427-S430 PolarHBondContact O-N 2.86Å; Y427-S430 PolarHBondContact O-OG 2.85Å
428	P	77.8	Confident	88.4	Confident	68 Å²	68	17.4 Å²	17.4	44%	0.442	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	133.9	-177.2	23.1	-29.3	0	0	0	110.5	S430 K494	P428-S430 PolarHBondContact O-OG 3.47Å; P428-K494 WeakPolarHBondContact O-CD 3Å; P428-K494 PolarHBondContact O-NZ 3.16Å
429	C	83.2	Confident	87.8	Confident	25 Å²	25	20.2 Å²	20.2	17%	0.169	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	48.6	-176.6	-169.8	0	0	0	0	113.1	Y427 K494 G580 C581	Y427-C429 PolarHBondContact O-N 3.01Å; C429-K494 HydrophobicContact CB-CD 4.03Å; C429-G580 CarbonylContact C-O 3.52Å; C429-G580 VanDerWaalsContact SG-C 3.56Å; C429-C581 HydrophobicContact CB-CB 3.94Å; C429-C581 WeakPolarHBondContact CB-SG 3.34Å; C429-C581 WeakPolarHBondContact SG-CB 3.1Å; C429-C581 PolarHBondContact SG-N 3.06Å; C429-C581 CovalentContact SG-SG 2.04Å; C429-C581 PolarHBondContact SG-SG 2.89Å
430	S	86	Confident	87.3	Confident	13 Å²	13	20.4 Å²	20.4	9%	0.091	11%	0.109	C	C	.	.			trans	-124	31.9	-179.8	-54.1	0	0	0	0	112.9	I424 Y427 P428	I424-S430 WeakPolarHBondContact O-CB 3.41Å; Y427-S430 WeakPolarHBondContact CB-OG 3.27Å; Y427-S430 VanDerWaalsContact O-CB 3.27Å; Y427-S430 WeakPolarHBondContact O-CB 3.24Å; Y427-S430 PolarHBondContact O-N 2.86Å; Y427-S430 PolarHBondContact O-OG 2.85Å; P428-S430 PolarHBondContact O-OG 3.47Å
431	G	88	Confident	86.5	Confident	2 Å²	2	22 Å²	22	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.1	173.3	0	0	0	0	0	111.2	R265 L433 L579 G580	R265-G431 VanDerWaalsContact NH2-CA 3.33Å; G431-L433 PolarHBondContact O-N 2.84Å; G431-L579 CarbonylContact O-C 3.5Å; G431-L579 VanDerWaalsContact O-CA 3.3Å; G431-L579 WeakPolarHBondContact O-CA 3.33Å; G431-G580 PolarHBondContact N-O 2.98Å; G431-G580 PolarHBondContact O-N 3.47Å
432	M	91.6	Very high	85.8	Confident	9 Å²	9	24.8 Å²	24.8	4%	0.044	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.8	173.8	-64.9	-172.6	176.5	0	0	109.6	F330 I424 V436 I497 E577 L579	F330-M432 HydrophobicContact CE1-CE 3.48Å; F330-M432 VanDerWaalsContact CE1-CE 3.48Å; F330-M432 HydrophobicContact CE1-SD 4.13Å; F330-M432 HydrophobicContact CZ-CE 3.84Å; F330-M432 HydrophobicContact CZ-SD 3.97Å; I424-M432 HydrophobicContact CD1-CE 3.62Å; M432-V436 HydrophobicContact SD-CB 4.39Å; M432-V436 HydrophobicContact SD-CG2 4.23Å; M432-I497 HydrophobicContact CE-CD1 4.44Å; M432-E577 HydrophobicContact CB-CG 4.1Å; M432-E577 HydrophobicContact CG-CG 3.92Å; M432-E577 HydrophobicContact SD-CG 4.23Å; M432-L579 HydrophobicContact CG-CD2 3.93Å
433	L	92.1	Very high	85.2	Confident	11 Å²	11	31.6 Å²	31.6	6%	0.058	17%	0.173	C	C	.	.			trans	-87.9	-12.9	-172.5	-65.8	-177.1	0	0	0	113.7	G431 I440 L487 K491 V493 E577 L578	G431-L433 PolarHBondContact O-N 2.84Å; L433-I440 HydrophobicContact CB-CD1 4.46Å; L433-L487 HydrophobicContact CB-CD2 4.21Å; L433-L487 HydrophobicContact CD1-CD1 4.22Å; L433-L487 HydrophobicContact CD1-CD2 3.99Å; L433-K491 HydrophobicContact CD2-CD 4.07Å; L433-V493 HydrophobicContact CD1-CG2 4.04Å; L433-E577 PolarHBondContact N-OE1 2.88Å; L433-L578 HydrophobicContact CB-CB 4.17Å; L433-L578 HydrophobicContact CD1-CB 3.97Å; L433-L578 HydrophobicContact CG-CB 4.37Å; L433-L578 PolarHBondContact N-O 2.94Å
434	G	90.4	Very high	85.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	138.1	10.8	163.1	0	0	0	0	0	117.4	S437 G438 L439 I440 E577	G434-S437 WeakPolarHBondContact CA-OG 2.89Å; G434-G438 PolarHBondContact O-N 3.24Å; G434-G438 VanDerWaalsContact O-N 3.14Å; G434-L439 PolarHBondContact O-N 2.83Å; G434-I440 PolarHBondContact O-N 2.94Å; G434-E577 PolarHBondContact N-OE1 3.39Å
435	M	92.3	Very high	85.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-43.7	176	-63.2	-68.1	-65.8	0	0	110.8	I440 I445 R461 V485 L576 E577	M435-I440 HydrophobicContact CG-CD1 4.06Å; M435-I440 HydrophobicContact SD-CB 4.32Å; M435-I440 HydrophobicContact SD-CD1 3.98Å; M435-I440 HydrophobicContact SD-CG2 3.97Å; M435-I445 HydrophobicContact CE-CD1 3.55Å; M435-I445 HydrophobicContact CE-CG1 3.96Å; M435-I445 HydrophobicContact SD-CD1 3.84Å; M435-I445 HydrophobicContact SD-CG1 4Å; M435-R461 WeakPolarHBondContact O-CD 3.39Å; M435-R461 VanDerWaalsContact O-CG 3.28Å; M435-R461 WeakPolarHBondContact O-CG 2.88Å; M435-R461 PolarHBondContact O-NH1 3.48Å; M435-V485 HydrophobicContact CE-CG2 4.28Å; M435-V485 HydrophobicContact SD-CG1 3.91Å; M435-V485 HydrophobicContact SD-CG2 3.91Å; M435-L576 WeakPolarHBondContact CB-O 3.38Å; M435-L576 WeakPolarHBondContact CG-O 3.39Å; M435-E577 HydrophobicContact CB-CB 4.41Å; M435-E577 PolarHBondContact N-OE1 2.63Å; M435-E577 PolarHBondContact N-OE2 3.24Å; M435-E577 VanDerWaalsContact N-OE2 3.13Å
436	V	92.2	Very high	85.9	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-45.4	179	177.4	0	0	0	0	111	G219 P220 T238 M432 G438 L462 L463 E577	G219-V436 WeakPolarHBondContact CA-O 3.25Å; P220-V436 HydrophobicContact CG-CG1 3.64Å; T238-V436 HydrophobicContact CG2-CB 4.28Å; T238-V436 HydrophobicContact CG2-CG1 3.67Å; M432-V436 HydrophobicContact SD-CB 4.39Å; M432-V436 HydrophobicContact SD-CG2 4.23Å; V436-G438 VanDerWaalsContact C-N 3.33Å; V436-G438 PolarHBondContact O-N 3.26Å; V436-L462 HydrophobicContact CG2-CB 3.79Å; V436-L462 HydrophobicContact CG2-CD2 4.26Å; V436-L462 HydrophobicContact CG2-CG 4.41Å; V436-L462 WeakPolarHBondContact CG2-O 3.22Å; V436-L463 HydrophobicContact CG1-CD1 4.31Å; V436-E577 WeakPolarHBondContact CB-OE2 3.3Å; V436-E577 HydrophobicContact CG2-CB 4.24Å; V436-E577 HydrophobicContact CG2-CG 4.19Å; V436-E577 WeakPolarHBondContact CG2-OE2 3.48Å; V436-E577 PolarHBondContact N-OE2 3.01Å
437	S	87.8	Confident	86.5	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.007	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-23.3	-175.2	62.4	0	0	0	0	113.9	G214 F215 G434 L439	G214-S437 CarbonylContact C-O 3.59Å; G214-S437 WeakPolarHBondContact CA-O 3.21Å; F215-S437 WeakPolarHBondContact CD2-O 3.35Å; F215-S437 PolarHBondContact N-O 3.42Å; G434-S437 WeakPolarHBondContact CA-OG 2.89Å; S437-L439 WeakPolarHBondContact OG-CB 3.34Å; S437-L439 PolarHBondContact OG-N 2.79Å
438	G	84.6	Confident	87	Confident	9 Å²	9	29.9 Å²	29.9	9%	0.093	18%	0.178	C	C	.	.	S	Bend	trans	88.2	1.1	-169	0	0	0	0	0	114.4	V218 G434 V436 I440	V218-G438 VanDerWaalsContact CG1-CA 3.49Å; G434-G438 PolarHBondContact O-N 3.24Å; G434-G438 VanDerWaalsContact O-N 3.14Å; V436-G438 VanDerWaalsContact C-N 3.33Å; V436-G438 PolarHBondContact O-N 3.26Å; G438-I440 CarbonylContact C-O 3.05Å; G438-I440 CarbonylContact O-C 3.6Å; G438-I440 PolarHBondContact O-N 3.41Å
439	L	86.5	Confident	87.2	Confident	61 Å²	61	28.5 Å²	28.5	32%	0.319	17%	0.169	S	C	.	.			trans	-60.9	-36.8	174.4	-179.8	66.9	0	0	0	111.8	M180 F215 I240 G434 S437 T441	M180-L439 HydrophobicContact CE-CD2 4.44Å; F215-L439 HydrophobicContact CE2-CB 4.2Å; F215-L439 HydrophobicContact CE2-CD1 4.17Å; I240-L439 HydrophobicContact CD1-CB 3.85Å; I240-L439 HydrophobicContact CD1-CD1 4.16Å; I240-L439 HydrophobicContact CD1-CD2 4.4Å; I240-L439 HydrophobicContact CD1-CG 4.37Å; G434-L439 PolarHBondContact O-N 2.83Å; S437-L439 WeakPolarHBondContact OG-CB 3.34Å; S437-L439 PolarHBondContact OG-N 2.79Å; L439-T441 PolarHBondContact O-N 2.82Å
440	I	86.3	Confident	86.7	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.021	18%	0.181	C	C	.	.	S	Bend	trans	-80.7	113.8	163.7	-64.1	170.3	0	0	0	106	L433 G434 M435 G438 Q444 I445 R461 V485 L487	L433-I440 HydrophobicContact CB-CD1 4.46Å; G434-I440 PolarHBondContact O-N 2.94Å; M435-I440 HydrophobicContact CG-CD1 4.06Å; M435-I440 HydrophobicContact SD-CB 4.32Å; M435-I440 HydrophobicContact SD-CD1 3.98Å; M435-I440 HydrophobicContact SD-CG2 3.97Å; G438-I440 CarbonylContact C-O 3.05Å; G438-I440 CarbonylContact O-C 3.6Å; G438-I440 PolarHBondContact O-N 3.41Å; I440-Q444 HydrophobicContact CG2-CB 3.8Å; I440-I445 HydrophobicContact CG2-CD1 4.24Å; I440-I445 HydrophobicContact CG2-CG1 3.9Å; I440-R461 VanDerWaalsContact O-CZ 3.23Å; I440-R461 PolarHBondContact O-NH1 3.48Å; I440-R461 PolarHBondContact O-NH2 3.42Å; I440-V485 HydrophobicContact CD1-CG1 3.82Å; I440-V485 HydrophobicContact CG2-CG1 3.94Å; I440-L487 HydrophobicContact CD1-CD2 3.87Å
441	T	81.2	Confident	85.5	Confident	65 Å²	65	32.6 Å²	32.6	40%	0.399	19%	0.187	S	C	.	.			trans	-74.4	163.8	-178.9	65.2	0	0	0	0	111.8	L439 N443 Q444	L439-T441 PolarHBondContact O-N 2.82Å; T441-N443 VanDerWaalsContact C-N 3.25Å; T441-N443 PolarHBondContact O-N 3.05Å; T441-Q444 WeakPolarHBondContact O-CB 3.19Å; T441-Q444 PolarHBondContact O-N 3.03Å; T441-Q444 VanDerWaalsContact O-N 3.07Å; T441-Q444 PolarHBondContact OG1-OE1 3.38Å
442	D	81.1	Confident	84.3	Confident	58 Å²	58	35.6 Å²	35.6	31%	0.31	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-61.9	-34.1	179.8	-75.8	-5	0	0	0	112.7	Q444 I445 P457 R461	D442-Q444 PolarHBondContact O-N 3.02Å; D442-I445 PolarHBondContact O-N 2.93Å; D442-P457 HydrophobicContact CB-CB 3.99Å; D442-P457 HydrophobicContact CB-CG 4.11Å; D442-R461 IonicContact OD1-CZ 2.75Å; D442-R461 IonicContact OD1-NE 3.69Å; D442-R461 PolarHBondContact OD1-NE 3.31Å; D442-R461 IonicContact OD1-NH2 3.88Å; D442-R461 PolarHBondContact OD1-NH2 2.8Å
443	N	76.2	Confident	82.9	Confident	144 Å²	144	47.1 Å²	47.1	77%	0.77	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-62.9	-23.5	176.3	-68.9	-17.3	0	0	0	113.1	T441 I445	T441-N443 VanDerWaalsContact C-N 3.25Å; T441-N443 PolarHBondContact O-N 3.05Å; N443-I445 VanDerWaalsContact C-N 3.31Å
444	Q	86.1	Confident	81.7	Confident	39 Å²	39	50.4 Å²	50.4	18%	0.182	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-85.3	-4.8	178.5	-71.2	170.2	-79.2	0	0	112.9	I440 T441 D442 V485 D486	I440-Q444 HydrophobicContact CG2-CB 3.8Å; T441-Q444 WeakPolarHBondContact O-CB 3.19Å; T441-Q444 PolarHBondContact O-N 3.03Å; T441-Q444 VanDerWaalsContact O-N 3.07Å; T441-Q444 PolarHBondContact OG1-OE1 3.38Å; D442-Q444 PolarHBondContact O-N 3.02Å; Q444-V485 CarbonylContact O-C 3.46Å; Q444-V485 WeakPolarHBondContact O-CA 3.39Å; Q444-D486 HydrophobicContact CB-CB 4.14Å; Q444-D486 WeakPolarHBondContact CB-O 3.29Å; Q444-D486 HydrophobicContact CG-CB 4.29Å; Q444-D486 PolarHBondContact NE2-O 3.23Å; Q444-D486 PolarHBondContact O-N 2.92Å
445	I	90.3	Very high	81	Confident	3 Å²	3	52 Å²	52	2%	0.015	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	112.1	-179.1	-58.6	164.3	0	0	0	108	M435 I440 D442 N443 P457 A460 R461 L483 Q484	M435-I445 HydrophobicContact CE-CD1 3.55Å; M435-I445 HydrophobicContact CE-CG1 3.96Å; M435-I445 HydrophobicContact SD-CD1 3.84Å; M435-I445 HydrophobicContact SD-CG1 4Å; I440-I445 HydrophobicContact CG2-CD1 4.24Å; I440-I445 HydrophobicContact CG2-CG1 3.9Å; D442-I445 PolarHBondContact O-N 2.93Å; N443-I445 VanDerWaalsContact C-N 3.31Å; I445-P457 HydrophobicContact CB-CB 3.83Å; I445-P457 HydrophobicContact CG2-CB 3.97Å; I445-A460 HydrophobicContact CG2-CB 4.19Å; I445-R461 HydrophobicContact CD1-CG 4.47Å; I445-L483 HydrophobicContact CG2-CD1 4.03Å; I445-Q484 WeakPolarHBondContact CA-O 3.5Å
446	T	90.3	Very high	80.4	Confident	54 Å²	54	54.5 Å²	54.5	33%	0.331	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.1	-178.5	50.1	0	0	0	0	110.6	Q484	T446-Q484 PolarHBondContact N-O 3.42Å; T446-Q484 PolarHBondContact O-N 3.44Å; T446-Q484 WeakPolarHBondContact OG1-CB 3.29Å
447	A	92	Very high	79.9	Confident	22 Å²	22	55.9 Å²	55.9	18%	0.182	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.9	179.1	0	0	0	0	0	111	W455 W482 L483	A447-W455 HydrophobicContact CB-CH2 3.8Å; A447-W455 HydrophobicContact CB-CZ2 4.06Å; A447-W455 HydrophobicContact CB-CZ3 4.31Å; A447-W482 CarbonylContact C-O 3.6Å; A447-W482 WeakPolarHBondContact CA-O 3.37Å; A447-L483 HydrophobicContact CB-CD1 4.03Å
448	S	90.9	Very high	79.6	Confident	40 Å²	40	60.8 Å²	60.8	28%	0.28	32%	0.322	S	S	.	.	S	Bend	trans	-62.8	-43.1	175.8	54	0	0	0	0	112.8	E481 W482	S448-E481 VanDerWaalsContact OG-CA 3.24Å; S448-E481 WeakPolarHBondContact OG-CA 3.31Å; S448-E481 PolarHBondContact OG-OE2 3.01Å; S448-W482 PolarHBondContact N-O 3.1Å; S448-W482 PolarHBondContact OG-N 3.22Å; S448-W482 PolarHBondContact OG-O 3.22Å
449	S	83.2	Confident	79.8	Confident	38 Å²	38	61.7 Å²	61.7	27%	0.266	33%	0.325	S	S	.	.			trans	-158.2	163.3	-178.2	79.6	0	0	0	0	109.8	W469 L471 E481	S449-W469 PolarHBondContact O-NE1 3.38Å; S449-L471 WeakPolarHBondContact OG-CD2 3.43Å; S449-E481 WeakPolarHBondContact CB-OE2 3.24Å; S449-E481 PolarHBondContact OG-OE1 3.2Å; S449-E481 PolarHBondContact OG-OE2 3.07Å
450	H	71.8	Confident	80.1	Confident	90 Å²	90	58.8 Å²	58.8	42%	0.417	31%	0.31	S	S	.	.			trans	-144.5	146.6	174.7	47.8	-104.1	0	0	0	109.6	D452 W455	H450-D452 PolarHBondContact CD2-O 2.96Å; H450-W455 HydrophobicContact CB-CB 3.58Å; H450-W455 HydrophobicContact CB-CD2 3.88Å; H450-W455 HydrophobicContact CB-CE3 4.21Å; H450-W455 HydrophobicContact CB-CG 3.59Å; H450-W455 AromaticContact ND1-CE3 3.57Å
451	T	61.5	Low	80.4	Confident	34 Å²	34	58.8 Å²	58.8	21%	0.209	31%	0.309	C	S	.	.	S	Bend	trans	-78.8	-28.1	180	62.2	0	0	0	0	114.1	T470 L472 Y503	T451-T470 WeakPolarHBondContact CG2-O 3.03Å; T451-T470 PolarHBondContact N-O 2.83Å; T451-T470 PolarHBondContact OG1-OG1 2.87Å; T451-L472 HydrophobicContact CG2-CB 4.06Å; T451-L472 HydrophobicContact CG2-CD2 3.89Å; T451-L472 HydrophobicContact CG2-CG 3.5Å; T451-L472 VanDerWaalsContact CG2-CG 3.5Å; T451-Y503 WeakPolarHBondContact OG1-CE2 3.42Å
452	D	62.2	Low	81	Confident	66 Å²	66	55.7 Å²	55.7	35%	0.353	29%	0.29	S	S	.	.			trans	-102.8	131.4	-175.2	-153.5	-19	0	0	0	110.1	H450 S454 W455	H450-D452 PolarHBondContact CD2-O 2.96Å; D452-S454 PolarHBondContact O-N 3.12Å; D452-S454 PolarHBondContact OD1-N 3.04Å; D452-S454 PolarHBondContact OD1-OG 2.97Å; D452-S454 VanDerWaalsContact OD1-OG 3.09Å; D452-S454 PolarHBondContact OD2-OG 3.18Å; D452-W455 VanDerWaalsContact O-CB 3.29Å; D452-W455 WeakPolarHBondContact O-CB 3.4Å; D452-W455 PolarHBondContact O-N 3.1Å
453	R	62.9	Low	81.3	Confident	250 Å²	250	55.1 Å²	55.1	94%	0.943	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-17.8	176.8	-72.1	-177.6	179	173.3	-1.3	112.1
454	S	66.8	Low	81.6	Confident	80 Å²	80	50.5 Å²	50.5	56%	0.559	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	13.3	172.9	58.8	0	0	0	0	113.4	D452 V456	D452-S454 PolarHBondContact O-N 3.12Å; D452-S454 PolarHBondContact OD1-N 3.04Å; D452-S454 PolarHBondContact OD1-OG 2.97Å; D452-S454 VanDerWaalsContact OD1-OG 3.09Å; D452-S454 PolarHBondContact OD2-OG 3.18Å; S454-V456 PolarHBondContact O-N 3.03Å; S454-V456 VanDerWaalsContact O-N 3.12Å
455	W	74.7	Confident	81.6	Confident	35 Å²	35	49 Å²	49	13%	0.133	26%	0.258	C	S	.	.			trans	-64.9	117.6	175.8	-180	82.5	0	0	0	110.2	A447 H450 D452 P457 W469 L483	A447-W455 HydrophobicContact CB-CH2 3.8Å; A447-W455 HydrophobicContact CB-CZ2 4.06Å; A447-W455 HydrophobicContact CB-CZ3 4.31Å; H450-W455 HydrophobicContact CB-CB 3.58Å; H450-W455 HydrophobicContact CB-CD2 3.88Å; H450-W455 HydrophobicContact CB-CE3 4.21Å; H450-W455 HydrophobicContact CB-CG 3.59Å; H450-W455 AromaticContact ND1-CE3 3.57Å; D452-W455 VanDerWaalsContact O-CB 3.29Å; D452-W455 WeakPolarHBondContact O-CB 3.4Å; D452-W455 PolarHBondContact O-N 3.1Å; W455-P457 HydrophobicContact CH2-CB 4.31Å; W455-P457 HydrophobicContact CH2-CG 4.26Å; W455-P457 HydrophobicContact CZ3-CG 4.33Å; W455-W469 AromaticContact CE2-CD1 3.94Å; W455-W469 AromaticContact NE1-CD1 3.74Å; W455-L483 HydrophobicContact CZ2-CD1 4.39Å
456	V	80.8	Confident	80.7	Confident	52 Å²	52	58.8 Å²	58.8	32%	0.315	30%	0.295	S	S	.	.			trans	-111.1	152.3	169.7	-72.9	0	0	0	0	111.1	S454 E458 N459	S454-V456 PolarHBondContact O-N 3.03Å; S454-V456 VanDerWaalsContact O-N 3.12Å; V456-E458 VanDerWaalsContact C-N 3.26Å; V456-E458 HydrophobicContact CB-CG 3.98Å; V456-E458 HydrophobicContact CG2-CG 3.31Å; V456-E458 WeakPolarHBondContact CG2-OE1 3.33Å; V456-E458 PolarHBondContact O-N 3.26Å; V456-N459 VanDerWaalsContact CG2-ND2 3.25Å; V456-N459 WeakPolarHBondContact CG2-ND2 3.41Å; V456-N459 PolarHBondContact N-ND2 3.31Å; V456-N459 VanDerWaalsContact O-CB 3.28Å; V456-N459 WeakPolarHBondContact O-CB 3.48Å; V456-N459 PolarHBondContact O-N 2.58Å; V456-N459 PolarHBondContact O-ND2 2.84Å; V456-N459 VanDerWaalsContact O-ND2 3.16Å
457	P	81.3	Confident	80.4	Confident	28 Å²	28	58.8 Å²	58.8	18%	0.182	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-61.2	-29.6	-174.9	-22.4	33.1	0	0	0	114.7	D442 I445 W455 N459 A460	D442-P457 HydrophobicContact CB-CB 3.99Å; D442-P457 HydrophobicContact CB-CG 4.11Å; I445-P457 HydrophobicContact CB-CB 3.83Å; I445-P457 HydrophobicContact CG2-CB 3.97Å; W455-P457 HydrophobicContact CH2-CB 4.31Å; W455-P457 HydrophobicContact CH2-CG 4.26Å; W455-P457 HydrophobicContact CZ3-CG 4.33Å; P457-N459 PolarHBondContact O-N 3.36Å; P457-A460 WeakPolarHBondContact O-CB 3.46Å; P457-A460 PolarHBondContact O-N 3.38Å
458	E	81.1	Confident	80.2	Confident	104 Å²	104	57.8 Å²	57.8	49%	0.486	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-53.1	-28.2	172.5	57.3	165.2	-143	0	0	113	V456 A460 R461	V456-E458 VanDerWaalsContact C-N 3.26Å; V456-E458 HydrophobicContact CB-CG 3.98Å; V456-E458 HydrophobicContact CG2-CG 3.31Å; V456-E458 WeakPolarHBondContact CG2-OE1 3.33Å; V456-E458 PolarHBondContact O-N 3.26Å; E458-A460 PolarHBondContact O-N 2.98Å; E458-A460 VanDerWaalsContact O-N 3.15Å; E458-R461 WeakPolarHBondContact O-CB 3.3Å; E458-R461 WeakPolarHBondContact O-CG 3.44Å; E458-R461 PolarHBondContact O-N 3.19Å; E458-R461 VanDerWaalsContact O-N 3.08Å
459	N	88.3	Confident	80.3	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.15	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-65.3	-19.8	178.3	-69.3	-51.9	0	0	0	112.8	V456 P457 R461 S465 T467 G468	V456-N459 VanDerWaalsContact CG2-ND2 3.25Å; V456-N459 WeakPolarHBondContact CG2-ND2 3.41Å; V456-N459 PolarHBondContact N-ND2 3.31Å; V456-N459 VanDerWaalsContact O-CB 3.28Å; V456-N459 WeakPolarHBondContact O-CB 3.48Å; V456-N459 PolarHBondContact O-N 2.58Å; V456-N459 PolarHBondContact O-ND2 2.84Å; V456-N459 VanDerWaalsContact O-ND2 3.16Å; P457-N459 PolarHBondContact O-N 3.36Å; N459-R461 VanDerWaalsContact C-N 3.34Å; N459-S465 WeakPolarHBondContact CA-OG 3.43Å; N459-S465 VanDerWaalsContact O-CB 3.25Å; N459-S465 WeakPolarHBondContact O-CB 3.34Å; N459-S465 PolarHBondContact O-OG 3.18Å; N459-T467 PolarHBondContact OD1-OG1 2.87Å; N459-G468 CarbonylContact O-C 2.93Å; N459-G468 WeakPolarHBondContact O-CA 3.35Å; N459-G468 PolarHBondContact O-N 3.41Å
460	A	92.6	Very high	80.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-84.5	-8	177.9	0	0	0	0	0	113.3	I445 P457 E458 W469 L483 R575 L576	I445-A460 HydrophobicContact CG2-CB 4.19Å; P457-A460 WeakPolarHBondContact O-CB 3.46Å; P457-A460 PolarHBondContact O-N 3.38Å; E458-A460 PolarHBondContact O-N 2.98Å; E458-A460 VanDerWaalsContact O-N 3.15Å; A460-W469 HydrophobicContact CB-CB 4.4Å; A460-L483 HydrophobicContact CB-CD1 4.21Å; A460-L483 HydrophobicContact CB-CD2 4.01Å; A460-R575 CarbonylContact O-C 3.54Å; A460-R575 VanDerWaalsContact O-CA 3.32Å; A460-R575 WeakPolarHBondContact O-CA 3.34Å; A460-L576 PolarHBondContact O-N 2.9Å
461	R	93.3	Very high	81.6	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.015	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-74.5	136.9	-176.3	-60.9	176.6	179.7	-79.7	0.1	111.6	M435 I440 D442 I445 E458 N459 T464 S465	M435-R461 WeakPolarHBondContact O-CD 3.39Å; M435-R461 VanDerWaalsContact O-CG 3.28Å; M435-R461 WeakPolarHBondContact O-CG 2.88Å; M435-R461 PolarHBondContact O-NH1 3.48Å; I440-R461 VanDerWaalsContact O-CZ 3.23Å; I440-R461 PolarHBondContact O-NH1 3.48Å; I440-R461 PolarHBondContact O-NH2 3.42Å; D442-R461 IonicContact OD1-CZ 2.75Å; D442-R461 IonicContact OD1-NE 3.69Å; D442-R461 PolarHBondContact OD1-NE 3.31Å; D442-R461 IonicContact OD1-NH2 3.88Å; D442-R461 PolarHBondContact OD1-NH2 2.8Å; I445-R461 HydrophobicContact CD1-CG 4.47Å; E458-R461 WeakPolarHBondContact O-CB 3.3Å; E458-R461 WeakPolarHBondContact O-CG 3.44Å; E458-R461 PolarHBondContact O-N 3.19Å; E458-R461 VanDerWaalsContact O-N 3.08Å; N459-R461 VanDerWaalsContact C-N 3.34Å; R461-T464 WeakPolarHBondContact CB-OG1 3.27Å; R461-S465 WeakPolarHBondContact O-CB 3.45Å
462	L	93.7	Very high	82.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	145.8	172.9	-170.9	76	0	0	0	110.4	L331 V436 T464 I497 Q499 P547 L576 E577	L331-L462 HydrophobicContact CD1-CD2 3.93Å; V436-L462 HydrophobicContact CG2-CB 3.79Å; V436-L462 HydrophobicContact CG2-CD2 4.26Å; V436-L462 HydrophobicContact CG2-CG 4.41Å; V436-L462 WeakPolarHBondContact CG2-O 3.22Å; L462-T464 PolarHBondContact O-N 2.79Å; L462-I497 HydrophobicContact CD1-CG2 4.14Å; L462-I497 HydrophobicContact CD2-CB 4.02Å; L462-I497 HydrophobicContact CD2-CD1 4.36Å; L462-I497 HydrophobicContact CD2-CG2 3.66Å; L462-Q499 HydrophobicContact CD1-CB 3.53Å; L462-Q499 HydrophobicContact CD1-CG 4.36Å; L462-P547 HydrophobicContact CD1-CB 4.5Å; L462-L576 PolarHBondContact N-O 3.2Å; L462-E577 HydrophobicContact CB-CB 3.97Å; L462-E577 HydrophobicContact CD2-CB 3.72Å; L462-E577 HydrophobicContact CG-CB 4.48Å
463	L	87.4	Confident	83.9	Confident	46 Å²	46	53.7 Å²	53.7	24%	0.241	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	66	-46	179.5	-59.2	-179.5	0	0	0	117	F330 L331 V436	F330-L463 HydrophobicContact CD2-CD1 4.24Å; F330-L463 HydrophobicContact CE2-CD1 3.58Å; F330-L463 HydrophobicContact CZ-CD1 3.79Å; L331-L463 HydrophobicContact CD1-CD1 4.09Å; L331-L463 HydrophobicContact CD1-CD2 3.8Å; L331-L463 HydrophobicContact CD1-CG 4.11Å; L331-L463 HydrophobicContact CD2-CD2 4.12Å; L331-L463 HydrophobicContact CG-CD1 4.16Å; L331-L463 HydrophobicContact CG-CD2 3.9Å; L331-L463 HydrophobicContact CG-CG 4.47Å; V436-L463 HydrophobicContact CG1-CD1 4.31Å
464	T	82.5	Confident	84.8	Confident	47 Å²	47	46 Å²	46	29%	0.288	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-30.2	-173.5	55.4	0	0	0	0	112.1	V218 P220 R461 L462	V218-T464 VanDerWaalsContact O-CG2 3.29Å; V218-T464 WeakPolarHBondContact O-CG2 3.36Å; P220-T464 HydrophobicContact CG-CG2 3.93Å; R461-T464 WeakPolarHBondContact CB-OG1 3.27Å; L462-T464 PolarHBondContact O-N 2.79Å
465	S	85.6	Confident	85.5	Confident	8 Å²	8	48.8 Å²	48.8	6%	0.056	26%	0.255	C	S	.	.			trans	-79.4	137.3	174	-179.4	0	0	0	0	113.6	N459 R461 T467 G468 R575	N459-S465 WeakPolarHBondContact CA-OG 3.43Å; N459-S465 VanDerWaalsContact O-CB 3.25Å; N459-S465 WeakPolarHBondContact O-CB 3.34Å; N459-S465 PolarHBondContact O-OG 3.18Å; R461-S465 WeakPolarHBondContact O-CB 3.45Å; S465-T467 PolarHBondContact OG-N 3.36Å; S465-T467 VanDerWaalsContact OG-N 3.07Å; S465-T467 PolarHBondContact OG-OG1 3.11Å; S465-G468 PolarHBondContact OG-N 2.81Å; S465-R575 WeakPolarHBondContact O-CD 2.97Å; S465-R575 PolarHBondContact O-NH1 2.91Å
466	R	72.2	Confident	86	Confident	209 Å²	209	54.1 Å²	54.1	79%	0.789	28%	0.281	S	S	*	.	S	Bend	trans	-87.3	-13.7	170.8	-62.5	-173.2	178.7	-148.6	-2	114.1
467	T	84.1	Confident	86.3	Confident	53 Å²	53	54.8 Å²	54.8	33%	0.325	29%	0.287	S	S	.	.	S	Bend	trans	-116	-82.7	-172.6	54.4	0	0	0	0	111.6	N459 S465 G501 K502	N459-T467 PolarHBondContact OD1-OG1 2.87Å; S465-T467 PolarHBondContact OG-N 3.36Å; S465-T467 VanDerWaalsContact OG-N 3.07Å; S465-T467 PolarHBondContact OG-OG1 3.11Å; T467-G501 CarbonylContact O-C 3.48Å; T467-G501 WeakPolarHBondContact O-CA 3.39Å; T467-K502 PolarHBondContact O-N 3.36Å; T467-K502 VanDerWaalsContact O-N 3.09Å
468	G	87.6	Confident	86.6	Confident	1 Å²	1	54 Å²	54	1%	0.01	28%	0.28	C	S	.	.			trans	127.4	160.9	-169.6	0	0	0	0	0	113.2	N459 S465 T470 L574	N459-G468 CarbonylContact O-C 2.93Å; N459-G468 WeakPolarHBondContact O-CA 3.35Å; N459-G468 PolarHBondContact O-N 3.41Å; S465-G468 PolarHBondContact OG-N 2.81Å; G468-T470 PolarHBondContact O-N 2.81Å; G468-L574 CarbonylContact C-O 3.56Å; G468-L574 WeakPolarHBondContact CA-O 3.17Å
469	W	93.3	Very high	86.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	122.6	157.1	173.7	52.6	0	0	0	109.4	S449 W455 A460 L471 W482 L483 P564 M572 G573 L574	S449-W469 PolarHBondContact O-NE1 3.38Å; W455-W469 AromaticContact CE2-CD1 3.94Å; W455-W469 AromaticContact NE1-CD1 3.74Å; A460-W469 HydrophobicContact CB-CB 4.4Å; W469-L471 HydrophobicContact CH2-CD1 3.93Å; W469-L471 HydrophobicContact CZ2-CD1 3.8Å; W469-L471 HydrophobicContact CZ2-CD2 3.99Å; W469-L471 HydrophobicContact CZ2-CG 4.03Å; W469-W482 WeakPolarHBondContact CZ2-O 3.22Å; W469-L483 HydrophobicContact CD2-CB 4Å; W469-L483 HydrophobicContact CD2-CD1 4.35Å; W469-L483 HydrophobicContact CE3-CB 3.5Å; W469-L483 HydrophobicContact CE3-CD2 4.17Å; W469-L483 HydrophobicContact CE3-CG 4.29Å; W469-L483 HydrophobicContact CG-CD1 4.33Å; W469-L483 HydrophobicContact CH2-CB 4.05Å; W469-L483 HydrophobicContact CZ2-CB 4.49Å; W469-L483 HydrophobicContact CZ3-CB 3.53Å; W469-P564 HydrophobicContact CH2-CG 3.84Å; W469-P564 HydrophobicContact CZ3-CG 4.11Å; W469-M572 HydrophobicContact CD2-CE 3.61Å; W469-M572 HydrophobicContact CE3-CE 3.31Å; W469-M572 HydrophobicContact CE3-SD 4.4Å; W469-M572 HydrophobicContact CG-CE 4.34Å; W469-M572 HydrophobicContact CH2-CE 4Å; W469-M572 HydrophobicContact CZ2-CE 4.24Å; W469-M572 HydrophobicContact CZ3-CE 3.53Å; W469-G573 CarbonylContact O-C 3.47Å; W469-G573 VanDerWaalsContact O-CA 3.29Å; W469-G573 WeakPolarHBondContact O-CA 3.24Å; W469-L574 HydrophobicContact CE3-CB 4.09Å; W469-L574 HydrophobicContact CE3-CD2 3.9Å; W469-L574 HydrophobicContact CZ3-CD2 4.18Å; W469-L574 PolarHBondContact N-O 3.05Å; W469-L574 PolarHBondContact O-N 3.33Å
470	T	91.3	Very high	86.7	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.043	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.5	-171.7	55.5	0	0	0	0	112.2	T451 G468 Y503 V508 M572	T451-T470 WeakPolarHBondContact CG2-O 3.03Å; T451-T470 PolarHBondContact N-O 2.83Å; T451-T470 PolarHBondContact OG1-OG1 2.87Å; G468-T470 PolarHBondContact O-N 2.81Å; T470-Y503 HydrophobicContact CG2-CD2 4.09Å; T470-Y503 HydrophobicContact CG2-CG 4.41Å; T470-V508 HydrophobicContact CG2-CG2 4.42Å; T470-M572 WeakPolarHBondContact CA-O 3.28Å; T470-M572 WeakPolarHBondContact CB-O 3.36Å
471	L	89.9	Confident	86.7	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.037	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.6	172.3	-59.7	170.2	0	0	0	110.4	S449 W469 F478 E481 P564 G571 M572	S449-L471 WeakPolarHBondContact OG-CD2 3.43Å; W469-L471 HydrophobicContact CH2-CD1 3.93Å; W469-L471 HydrophobicContact CZ2-CD1 3.8Å; W469-L471 HydrophobicContact CZ2-CD2 3.99Å; W469-L471 HydrophobicContact CZ2-CG 4.03Å; L471-F478 HydrophobicContact CB-CE1 3.87Å; L471-F478 HydrophobicContact CB-CZ 4.22Å; L471-F478 HydrophobicContact CD1-CD1 4.13Å; L471-F478 HydrophobicContact CD1-CE1 4.18Å; L471-E481 HydrophobicContact CD1-CB 3.77Å; L471-E481 HydrophobicContact CD1-CG 3.91Å; L471-P564 HydrophobicContact CD1-CG 3.87Å; L471-G571 WeakPolarHBondContact O-CA 3.44Å; L471-M572 HydrophobicContact CB-CB 3.86Å; L471-M572 HydrophobicContact CB-CE 4.11Å; L471-M572 HydrophobicContact CD1-CE 3.55Å; L471-M572 HydrophobicContact CG-CB 4.49Å; L471-M572 HydrophobicContact CG-CE 3.51Å; L471-M572 PolarHBondContact N-O 2.87Å; L471-M572 VanDerWaalsContact N-O 3.14Å; L471-M572 PolarHBondContact O-N 3.16Å
472	L	86.7	Confident	86.8	Confident	99 Å²	99	63 Å²	63	52%	0.518	33%	0.331	S	S	.	.			trans	-67.9	150.4	179.8	-75.7	-178.9	0	0	0	109.3	T451 Q474 F478 Y503	T451-L472 HydrophobicContact CG2-CB 4.06Å; T451-L472 HydrophobicContact CG2-CD2 3.89Å; T451-L472 HydrophobicContact CG2-CG 3.5Å; T451-L472 VanDerWaalsContact CG2-CG 3.5Å; L472-Q474 PolarHBondContact O-N 3.48Å; L472-F478 WeakPolarHBondContact O-CE1 3.37Å; L472-Y503 HydrophobicContact CD2-CE1 4.45Å
473	P	85.4	Confident	87	Confident	69 Å²	69	63.1 Å²	63.1	45%	0.448	33%	0.332	S	S	.	.			trans	-62.5	129.6	176.2	25	-32.4	0	0	0	110.7	P569	P473-P569 VanDerWaalsContact CB-O 3.31Å; P473-P569 WeakPolarHBondContact CB-O 3.33Å
474	Q	82	Confident	87.4	Confident	88 Å²	88	61.9 Å²	61.9	41%	0.411	33%	0.325	S	S	.	.			trans	-119.5	142	174.9	-64.9	-175	10.3	0	0	110.4	L472 Q476 F478	L472-Q474 PolarHBondContact O-N 3.48Å; Q474-Q476 VanDerWaalsContact C-N 3.33Å; Q474-F478 HydrophobicContact CB-CD1 4.46Å; Q474-F478 HydrophobicContact CB-CE1 4.11Å; Q474-F478 HydrophobicContact CG-CD1 4.18Å; Q474-F478 HydrophobicContact CG-CE1 3.78Å
475	P	81.9	Confident	88.1	Confident	139 Å²	139	59.7 Å²	59.7	90%	0.903	31%	0.311	S	S	*	.	S	Bend	trans	-74.1	-26.5	178	29	-33.6	0	0	0	112.5
476	Q	85.1	Confident	88.5	Confident	148 Å²	148	60.4 Å²	60.4	69%	0.692	31%	0.314	S	S	*	.	S	Bend	trans	-95.8	158.3	174.2	-62.3	-165.1	10.4	0	0	110.3	Q474	Q474-Q476 VanDerWaalsContact C-N 3.33Å
477	P	86.8	Confident	89.4	Confident	66 Å²	66	51 Å²	51	43%	0.429	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-55.1	142.2	170.4	-22.2	33.6	0	0	0	110.8	T479 E565	P477-T479 PolarHBondContact O-N 2.82Å; P477-E565 WeakPolarHBondContact CA-O 3.01Å; P477-E565 WeakPolarHBondContact CB-O 2.97Å
478	F	88.3	Confident	89.5	Confident	11 Å²	11	50 Å²	50	5%	0.048	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-61.2	133.2	177.3	-63.1	-80.6	0	0	0	110.1	L471 L472 Q474 E481 P564 E565 A567 M572	L471-F478 HydrophobicContact CB-CE1 3.87Å; L471-F478 HydrophobicContact CB-CZ 4.22Å; L471-F478 HydrophobicContact CD1-CD1 4.13Å; L471-F478 HydrophobicContact CD1-CE1 4.18Å; L472-F478 WeakPolarHBondContact O-CE1 3.37Å; Q474-F478 HydrophobicContact CB-CD1 4.46Å; Q474-F478 HydrophobicContact CB-CE1 4.11Å; Q474-F478 HydrophobicContact CG-CD1 4.18Å; Q474-F478 HydrophobicContact CG-CE1 3.78Å; F478-E481 HydrophobicContact CB-CB 4.26Å; F478-E481 HydrophobicContact CB-CG 4.1Å; F478-E481 HydrophobicContact CD1-CG 4.1Å; F478-P564 HydrophobicContact CB-CG 4.45Å; F478-P564 WeakPolarHBondContact CB-O 3.36Å; F478-P564 HydrophobicContact CD2-CB 4.24Å; F478-E565 PolarHBondContact N-O 2.04Å; F478-A567 HydrophobicContact CE2-CB 3.79Å; F478-A567 HydrophobicContact CZ-CB 4.37Å; F478-M572 HydrophobicContact CE2-CB 4.29Å; F478-M572 HydrophobicContact CZ-CB 4.15Å
479	T	85.4	Confident	89.6	Confident	99 Å²	99	54.9 Å²	54.9	61%	0.607	30%	0.303	S	S	*	.			trans	-122.2	132.5	177.3	54.8	0	0	0	0	108.9	P477 E481	P477-T479 PolarHBondContact O-N 2.82Å; T479-E481 PolarHBondContact O-N 2.76Å
480	N	85.1	Confident	89.5	Confident	145 Å²	145	59 Å²	59	78%	0.775	32%	0.322	S	S	*	.	S	Bend	trans	62.2	15.4	-179.5	-58.3	-16	0	0	0	115.7
481	E	94.2	Very high	89.5	Confident	31 Å²	31	59.6 Å²	59.6	15%	0.145	32%	0.324	C	S	.	.			trans	-88.4	136.4	169.3	-59.1	-65.5	179.6	0	0	110.4	S448 S449 L471 F478 T479 Y563 P564	S448-E481 VanDerWaalsContact OG-CA 3.24Å; S448-E481 WeakPolarHBondContact OG-CA 3.31Å; S448-E481 PolarHBondContact OG-OE2 3.01Å; S449-E481 WeakPolarHBondContact CB-OE2 3.24Å; S449-E481 PolarHBondContact OG-OE1 3.2Å; S449-E481 PolarHBondContact OG-OE2 3.07Å; L471-E481 HydrophobicContact CD1-CB 3.77Å; L471-E481 HydrophobicContact CD1-CG 3.91Å; F478-E481 HydrophobicContact CB-CB 4.26Å; F478-E481 HydrophobicContact CB-CG 4.1Å; F478-E481 HydrophobicContact CD1-CG 4.1Å; T479-E481 PolarHBondContact O-N 2.76Å; E481-Y563 WeakPolarHBondContact O-CD1 3.22Å; E481-P564 HydrophobicContact CB-CG 3.99Å; E481-P564 WeakPolarHBondContact O-CD 3.29Å
482	W	95.1	Very high	89.7	Confident	51 Å²	51	61.7 Å²	61.7	19%	0.193	34%	0.335	C	S	.	.			trans	-155	149.4	178.4	52.5	-92.9	0	0	0	113.1	A447 S448 W469 Q484 R561 I562 Y563	A447-W482 CarbonylContact C-O 3.6Å; A447-W482 WeakPolarHBondContact CA-O 3.37Å; S448-W482 PolarHBondContact N-O 3.1Å; S448-W482 PolarHBondContact OG-N 3.22Å; S448-W482 PolarHBondContact OG-O 3.22Å; W469-W482 WeakPolarHBondContact CZ2-O 3.22Å; W482-Q484 HydrophobicContact CE3-CB 3.53Å; W482-Q484 HydrophobicContact CZ3-CB 3.38Å; W482-Q484 HydrophobicContact CZ3-CG 4.42Å; W482-R561 HydrophobicContact CB-CB 4.45Å; W482-R561 HydrophobicContact CB-CG 4.21Å; W482-R561 HydrophobicContact CD2-CG 4.27Å; W482-R561 HydrophobicContact CE3-CG 4.03Å; W482-R561 HydrophobicContact CG-CG 4.38Å; W482-I562 WeakPolarHBondContact CA-O 3.47Å; W482-Y563 HydrophobicContact CB-CD1 3.73Å; W482-Y563 HydrophobicContact CB-CE1 3.67Å; W482-Y563 HydrophobicContact CB-CG 4.41Å; W482-Y563 AromaticContact CD1-CE1 3.94Å; W482-Y563 HydrophobicContact CG-CD1 4.49Å; W482-Y563 HydrophobicContact CG-CE1 4.04Å
483	L	96.4	Very high	90.1	Very high	1 Å²	1	57 Å²	57	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.2	161.5	178.8	72.9	0	0	0	107.8	I445 A447 W455 A460 W469 R561 I562 L574 L576	I445-L483 HydrophobicContact CG2-CD1 4.03Å; A447-L483 HydrophobicContact CB-CD1 4.03Å; W455-L483 HydrophobicContact CZ2-CD1 4.39Å; A460-L483 HydrophobicContact CB-CD1 4.21Å; A460-L483 HydrophobicContact CB-CD2 4.01Å; W469-L483 HydrophobicContact CD2-CB 4Å; W469-L483 HydrophobicContact CD2-CD1 4.35Å; W469-L483 HydrophobicContact CE3-CB 3.5Å; W469-L483 HydrophobicContact CE3-CD2 4.17Å; W469-L483 HydrophobicContact CE3-CG 4.29Å; W469-L483 HydrophobicContact CG-CD1 4.33Å; W469-L483 HydrophobicContact CH2-CB 4.05Å; W469-L483 HydrophobicContact CZ2-CB 4.49Å; W469-L483 HydrophobicContact CZ3-CB 3.53Å; L483-R561 CarbonylContact O-C 3.59Å; L483-R561 VanDerWaalsContact O-CA 3.28Å; L483-R561 WeakPolarHBondContact O-CA 3.44Å; L483-I562 PolarHBondContact N-O 3.06Å; L483-I562 PolarHBondContact O-N 2.73Å; L483-L574 HydrophobicContact CD2-CD2 4Å; L483-L576 HydrophobicContact CD2-CD2 4.15Å
484	Q	96.1	Very high	90.4	Very high	21 Å²	21	56.5 Å²	56.5	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.2	-178.3	177.2	177.6	-50.7	0	0	110.6	I445 T446 W482 W524 I560 R561	I445-Q484 WeakPolarHBondContact CA-O 3.5Å; T446-Q484 PolarHBondContact N-O 3.42Å; T446-Q484 PolarHBondContact O-N 3.44Å; T446-Q484 WeakPolarHBondContact OG1-CB 3.29Å; W482-Q484 HydrophobicContact CE3-CB 3.53Å; W482-Q484 HydrophobicContact CZ3-CB 3.38Å; W482-Q484 HydrophobicContact CZ3-CG 4.42Å; Q484-W524 HydrophobicContact CG-CH2 4.14Å; Q484-W524 VanDerWaalsContact OE1-CZ2 3.29Å; Q484-I560 CarbonylContact C-O 3.57Å; Q484-I560 WeakPolarHBondContact CA-O 3.28Å; Q484-R561 HydrophobicContact CB-CG 3.63Å; Q484-R561 HydrophobicContact CG-CG 4.01Å
485	V	97.1	Very high	90.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.7	171.6	-178	0	0	0	0	108.3	M435 I440 Q444 L487 F559 I560 L576 L578	M435-V485 HydrophobicContact CE-CG2 4.28Å; M435-V485 HydrophobicContact SD-CG1 3.91Å; M435-V485 HydrophobicContact SD-CG2 3.91Å; I440-V485 HydrophobicContact CD1-CG1 3.82Å; I440-V485 HydrophobicContact CG2-CG1 3.94Å; Q444-V485 CarbonylContact O-C 3.46Å; Q444-V485 WeakPolarHBondContact O-CA 3.39Å; V485-L487 HydrophobicContact CG1-CD2 4.38Å; V485-F559 WeakPolarHBondContact O-CA 3.36Å; V485-I560 PolarHBondContact N-O 3.42Å; V485-I560 PolarHBondContact O-N 3.19Å; V485-L576 HydrophobicContact CG2-CD2 4.05Å; V485-L578 HydrophobicContact CB-CD1 3.91Å; V485-L578 HydrophobicContact CG1-CD1 3.71Å; V485-L578 HydrophobicContact CG2-CD1 4.34Å
486	D	94.3	Very high	91.6	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.118	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.8	169	-177	3.3	0	0	0	109.6	Q444 G488 R558 F559	Q444-D486 HydrophobicContact CB-CB 4.14Å; Q444-D486 WeakPolarHBondContact CB-O 3.29Å; Q444-D486 HydrophobicContact CG-CB 4.29Å; Q444-D486 PolarHBondContact NE2-O 3.23Å; Q444-D486 PolarHBondContact O-N 2.92Å; D486-G488 PolarHBondContact O-N 3.49Å; D486-G488 WeakPolarHBondContact OD1-CA 3.4Å; D486-G488 PolarHBondContact OD1-N 2.95Å; D486-R558 VanDerWaalsContact OD1-CG 3.24Å; D486-R558 WeakPolarHBondContact OD1-CG 3.44Å; D486-R558 IonicContact OD1-CZ 3.45Å; D486-R558 IonicContact OD1-NE 3.99Å; D486-R558 PolarHBondContact OD1-NE 2.8Å; D486-R558 IonicContact OD1-NH2 3.22Å; D486-R558 IonicContact OD2-CZ 3.49Å; D486-R558 IonicContact OD2-NE 2.91Å; D486-R558 IonicContact OD2-NH2 2.79Å; D486-R558 PolarHBondContact OD2-NH2 2.97Å; D486-F559 HydrophobicContact CB-CD1 3.72Å; D486-F559 HydrophobicContact CB-CE1 3.55Å; D486-F559 WeakPolarHBondContact OD2-CE1 2.97Å
487	L	90.7	Very high	92.1	Very high	11 Å²	11	38.8 Å²	38.8	6%	0.058	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-3.8	178.2	-60.8	172.9	0	0	0	113	L433 I440 V485 E489 K491 V493 R558 L578	L433-L487 HydrophobicContact CB-CD2 4.21Å; L433-L487 HydrophobicContact CD1-CD1 4.22Å; L433-L487 HydrophobicContact CD1-CD2 3.99Å; I440-L487 HydrophobicContact CD1-CD2 3.87Å; V485-L487 HydrophobicContact CG1-CD2 4.38Å; L487-E489 PolarHBondContact O-N 3.49Å; L487-K491 HydrophobicContact CB-CD 4.41Å; L487-K491 HydrophobicContact CB-CG 4.35Å; L487-K491 HydrophobicContact CD1-CB 4.08Å; L487-K491 HydrophobicContact CD1-CG 4.42Å; L487-V493 HydrophobicContact CD1-CG2 3.6Å; L487-R558 VanDerWaalsContact CB-O 3.23Å; L487-R558 WeakPolarHBondContact CB-O 3.43Å; L487-R558 VanDerWaalsContact CG-O 3.24Å; L487-R558 WeakPolarHBondContact CG-O 3.45Å; L487-R558 PolarHBondContact N-O 3.02Å; L487-L578 HydrophobicContact CD2-CD1 3.71Å
488	G	86.9	Confident	92.6	Very high	33 Å²	33	35.7 Å²	35.7	34%	0.34	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.9	-38.5	-177.4	0	0	0	0	0	113	D486 R558	D486-G488 PolarHBondContact O-N 3.49Å; D486-G488 WeakPolarHBondContact OD1-CA 3.4Å; D486-G488 PolarHBondContact OD1-N 2.95Å; G488-R558 VanDerWaalsContact O-CZ 3.22Å; G488-R558 PolarHBondContact O-NE 2.95Å; G488-R558 PolarHBondContact O-NH1 2.89Å
489	E	89.3	Confident	93	Very high	103 Å²	103	35.1 Å²	35.1	48%	0.481	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	169.8	178.7	65.9	-171.1	165.1	0	0	111.1	L487 K491	L487-E489 PolarHBondContact O-N 3.49Å; E489-K491 HydrophobicContact CG-CD 4.47Å; E489-K491 HydrophobicContact CG-CG 4.02Å; E489-K491 PolarHBondContact O-N 3.07Å; E489-K491 WeakPolarHBondContact OE1-CE 3.48Å; E489-K491 IonicContact OE1-NZ 3.15Å; E489-K491 PolarHBondContact OE1-NZ 3.31Å
490	E	91.9	Very high	93.5	Very high	88 Å²	88	30.4 Å²	30.4	41%	0.411	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	120.3	174.9	-64.9	-171.4	153.3	0	0	110.3	N519 L556 R558	E490-N519 PolarHBondContact OE1-ND2 2.85Å; E490-L556 HydrophobicContact CB-CD1 4.23Å; E490-R558 HydrophobicContact CG-CB 4.44Å
491	K	91.8	Very high	93.7	Very high	19 Å²	19	23.5 Å²	23.5	8%	0.083	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	159.3	175	-53.2	-164.3	-177.1	-127.1	0	110.8	L433 L487 E489 V493 T557	L433-K491 HydrophobicContact CD2-CD 4.07Å; L487-K491 HydrophobicContact CB-CD 4.41Å; L487-K491 HydrophobicContact CB-CG 4.35Å; L487-K491 HydrophobicContact CD1-CB 4.08Å; L487-K491 HydrophobicContact CD1-CG 4.42Å; E489-K491 HydrophobicContact CG-CD 4.47Å; E489-K491 HydrophobicContact CG-CG 4.02Å; E489-K491 PolarHBondContact O-N 3.07Å; E489-K491 WeakPolarHBondContact OE1-CE 3.48Å; E489-K491 IonicContact OE1-NZ 3.15Å; E489-K491 PolarHBondContact OE1-NZ 3.31Å; K491-V493 PolarHBondContact O-N 3.13Å; K491-T557 PolarHBondContact N-O 3.2Å; K491-T557 PolarHBondContact O-N 2.91Å; K491-T557 VanDerWaalsContact O-O 3.13Å
492	L	93.4	Very high	93.3	Very high	50 Å²	50	24.9 Å²	24.9	26%	0.262	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	104.5	173	-165.3	70.5	0	0	0	109.2	P554 G580 C581	L492-P554 HydrophobicContact CD1-CB 3.64Å; L492-P554 HydrophobicContact CD2-CB 4.06Å; L492-P554 HydrophobicContact CG-CB 3.89Å; L492-G580 CarbonylContact O-C 3.56Å; L492-G580 WeakPolarHBondContact O-CA 2.94Å; L492-C581 WeakPolarHBondContact CB-O 3.18Å; L492-C581 PolarHBondContact N-O 3.34Å; L492-C581 PolarHBondContact O-N 3.22Å
493	V	94.3	Very high	92.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.6	177.8	-177	0	0	0	0	109.6	L433 L487 K491 L555 T557 I560	L433-V493 HydrophobicContact CD1-CG2 4.04Å; L487-V493 HydrophobicContact CD1-CG2 3.6Å; K491-V493 PolarHBondContact O-N 3.13Å; V493-L555 PolarHBondContact N-O 2.96Å; V493-L555 PolarHBondContact O-N 2.81Å; V493-T557 HydrophobicContact CB-CG2 4.43Å; V493-T557 HydrophobicContact CG2-CG2 3.91Å; V493-I560 HydrophobicContact CB-CD1 4.3Å; V493-I560 HydrophobicContact CG1-CD1 4.01Å; V493-I560 HydrophobicContact CG2-CD1 4.19Å; V493-I560 HydrophobicContact CG2-CG1 4.32Å
494	K	92.8	Very high	92.1	Very high	60 Å²	60	33.7 Å²	33.7	26%	0.261	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-17.5	-177.8	-169.6	175.6	175	-177.9	0	113.2	P428 C429 T551 V552 L579	P428-K494 WeakPolarHBondContact O-CD 3Å; P428-K494 PolarHBondContact O-NZ 3.16Å; C429-K494 HydrophobicContact CB-CD 4.03Å; K494-T551 WeakPolarHBondContact O-CA 3.45Å; K494-V552 WeakPolarHBondContact O-CG2 3.47Å; K494-V552 PolarHBondContact O-N 3.21Å; K494-V552 VanDerWaalsContact O-O 3.13Å; K494-L579 PolarHBondContact N-O 3.47Å
495	G	92.8	Very high	91.5	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	-176.3	177.9	0	0	0	0	0	112.2	R550 L579	G495-R550 CarbonylContact C-O 3.57Å; G495-R550 WeakPolarHBondContact CA-O 3.18Å; G495-L579 PolarHBondContact N-O 2.82Å; G495-L579 VanDerWaalsContact N-O 3.16Å; G495-L579 PolarHBondContact O-N 3.15Å
496	F	94.9	Very high	91.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	150.6	178.3	52.5	-88	0	0	0	109.5	I498 F513 L515 F538 R550 V552 I562 L576 E577 L578	F496-I498 HydrophobicContact CD2-CG2 3.74Å; F496-I498 HydrophobicContact CE2-CG2 3.95Å; F496-F513 HydrophobicContact CE2-CE1 4.36Å; F496-F513 AromaticContact CE2-CE2 3.44Å; F496-F513 HydrophobicContact CE2-CE2 3.44Å; F496-F513 VanDerWaalsContact CE2-CE2 3.44Å; F496-F513 AromaticContact CE2-CZ 3.21Å; F496-F513 HydrophobicContact CE2-CZ 3.21Å; F496-F513 AromaticContact CZ-CE2 3.38Å; F496-F513 HydrophobicContact CZ-CE2 3.38Å; F496-F513 AromaticContact CZ-CZ 3.36Å; F496-F513 HydrophobicContact CZ-CZ 3.36Å; F496-L515 HydrophobicContact CD1-CD2 4.39Å; F496-L515 HydrophobicContact CE1-CD1 4.31Å; F496-L515 HydrophobicContact CE1-CD2 3.87Å; F496-F538 HydrophobicContact CZ-CD1 4.24Å; F496-F538 HydrophobicContact CZ-CE1 4.37Å; F496-R550 HydrophobicContact CD2-CB 4.21Å; F496-R550 HydrophobicContact CE1-CB 4.12Å; F496-R550 HydrophobicContact CE2-CB 3.55Å; F496-R550 HydrophobicContact CE2-CG 4.06Å; F496-R550 HydrophobicContact CZ-CB 3.48Å; F496-R550 VanDerWaalsContact CZ-CB 3.48Å; F496-R550 HydrophobicContact CZ-CG 4.3Å; F496-R550 PolarHBondContact N-O 2.84Å; F496-R550 PolarHBondContact O-N 3.39Å; F496-V552 HydrophobicContact CE1-CG1 4.03Å; F496-I562 HydrophobicContact CD2-CD1 4.45Å; F496-I562 HydrophobicContact CE2-CD1 4.36Å; F496-L576 HydrophobicContact CB-CD1 4.09Å; F496-L576 HydrophobicContact CD2-CD1 4.26Å; F496-E577 CarbonylContact C-O 3.46Å; F496-E577 WeakPolarHBondContact CA-O 3.2Å; F496-E577 WeakPolarHBondContact CB-O 3.25Å; F496-L578 HydrophobicContact CB-CD2 3.79Å
497	I	96.8	Very high	91.1	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.4	178.4	-59.9	167.6	0	0	0	107.2	L398 I424 M432 L462 P547 E548 L549 L576 E577 L579	L398-I497 HydrophobicContact CD2-CD1 4.02Å; L398-I497 HydrophobicContact CD2-CG1 4.3Å; L398-I497 HydrophobicContact CD2-CG2 3.97Å; I424-I497 HydrophobicContact CD1-CD1 3.8Å; I424-I497 HydrophobicContact CG2-CD1 4.45Å; M432-I497 HydrophobicContact CE-CD1 4.44Å; L462-I497 HydrophobicContact CD1-CG2 4.14Å; L462-I497 HydrophobicContact CD2-CB 4.02Å; L462-I497 HydrophobicContact CD2-CD1 4.36Å; L462-I497 HydrophobicContact CD2-CG2 3.66Å; I497-P547 HydrophobicContact CG2-CB 3.63Å; I497-E548 WeakPolarHBondContact CA-O 3.3Å; I497-L549 HydrophobicContact CG1-CD1 4.2Å; I497-L576 WeakPolarHBondContact O-CA 2.98Å; I497-E577 HydrophobicContact CB-CB 4.41Å; I497-E577 PolarHBondContact N-O 2.81Å; I497-E577 PolarHBondContact O-N 2.83Å; I497-L579 HydrophobicContact CD1-CD1 4.09Å; I497-L579 HydrophobicContact CD1-CD2 4.07Å; I497-L579 HydrophobicContact CD1-CG 4.35Å; I497-L579 HydrophobicContact CG1-CD1 4.04Å; I497-L579 HydrophobicContact CG1-CG 4.31Å
498	I	97.1	Very high	91.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.7	175.5	57.1	177.2	0	0	0	110.2	F496 M510 F513 N541 P547 E548 R550 L574 L576	F496-I498 HydrophobicContact CD2-CG2 3.74Å; F496-I498 HydrophobicContact CE2-CG2 3.95Å; I498-M510 HydrophobicContact CD1-CE 4.3Å; I498-M510 HydrophobicContact CG2-CE 4.33Å; I498-F513 HydrophobicContact CD1-CE1 3.81Å; I498-F513 HydrophobicContact CD1-CZ 4.39Å; I498-N541 WeakPolarHBondContact CG1-OD1 3.4Å; I498-N541 PolarHBondContact O-ND2 2.79Å; I498-P547 CarbonylContact O-C 3.55Å; I498-P547 WeakPolarHBondContact O-CA 3.32Å; I498-E548 HydrophobicContact CG1-CB 4.05Å; I498-E548 WeakPolarHBondContact CG1-O 3.42Å; I498-E548 PolarHBondContact N-O 2.85Å; I498-E548 PolarHBondContact O-N 2.82Å; I498-R550 HydrophobicContact CD1-CG 4.43Å; I498-L574 HydrophobicContact CB-CD1 3.9Å; I498-L574 HydrophobicContact CG2-CD1 3.86Å; I498-L576 HydrophobicContact CG2-CD1 4.01Å
499	Q	97	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	147.3	173.2	-167.5	-174.2	22.9	0	0	108.8	S362 L462 N541 D545 P547 L574 R575	S362-Q499 VanDerWaalsContact CB-NE2 3.32Å; S362-Q499 PolarHBondContact OG-NE2 2.8Å; L462-Q499 HydrophobicContact CD1-CB 3.53Å; L462-Q499 HydrophobicContact CD1-CG 4.36Å; Q499-N541 WeakPolarHBondContact CA-ND2 3.14Å; Q499-D545 WeakPolarHBondContact CG-O 3.48Å; Q499-D545 PolarHBondContact NE2-O 3.3Å; Q499-P547 HydrophobicContact CB-CB 4.37Å; Q499-P547 HydrophobicContact CB-CG 4.46Å; Q499-P547 HydrophobicContact CG-CB 4.46Å; Q499-P547 HydrophobicContact CG-CG 4.09Å; Q499-L574 CarbonylContact O-C 3.56Å; Q499-L574 WeakPolarHBondContact O-CA 3.42Å; Q499-R575 HydrophobicContact CB-CB 4.19Å; Q499-R575 PolarHBondContact N-O 3.32Å; Q499-R575 PolarHBondContact O-N 3.18Å
500	G	94.9	Very high	92	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.197	C	C	.	.			trans	-71.8	-160.9	171.7	0	0	0	0	0	111.9	Y544 R575	G500-Y544 CarbonylContact C-O 3.56Å; G500-Y544 VanDerWaalsContact CA-O 3.25Å; G500-Y544 WeakPolarHBondContact CA-O 3.36Å; G500-Y544 PolarHBondContact N-O 3.26Å; G500-R575 PolarHBondContact O-NE 2.71Å; G500-R575 PolarHBondContact O-NH2 3.13Å
501	G	89.8	Confident	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	-172.7	-175.2	0	0	0	0	0	114.3	T467 V508 Y544	T467-G501 CarbonylContact O-C 3.48Å; T467-G501 WeakPolarHBondContact O-CA 3.39Å; G501-V508 PolarHBondContact N-O 3.02Å; G501-V508 PolarHBondContact O-N 3.43Å; G501-Y544 PolarHBondContact N-O 3.36Å
502	K	86.3	Confident	92.4	Very high	60 Å²	60	46.2 Å²	46.2	26%	0.261	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.1	170.3	-69.7	175.4	-178.1	164.8	0	109	D366 T467 N506 Y544	D366-K502 VanDerWaalsContact OD1-CE 3.22Å; D366-K502 WeakPolarHBondContact OD1-CE 3.17Å; D366-K502 IonicContact OD1-NZ 2.82Å; D366-K502 PolarHBondContact OD1-NZ 3.37Å; D366-K502 WeakPolarHBondContact OD2-CE 3.49Å; D366-K502 IonicContact OD2-NZ 3.53Å; D366-K502 PolarHBondContact OD2-NZ 3.31Å; T467-K502 PolarHBondContact O-N 3.36Å; T467-K502 VanDerWaalsContact O-N 3.09Å; K502-N506 WeakPolarHBondContact CA-O 3.25Å; K502-Y544 HydrophobicContact CG-CD2 4.31Å; K502-Y544 HydrophobicContact CG-CE2 4.49Å
503	Y	84.3	Confident	92.5	Very high	37 Å²	37	43.9 Å²	43.9	15%	0.145	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	105.7	168.6	178.6	-112.5	0	0	0	107.9	T451 T470 L472 E505 N506	T451-Y503 WeakPolarHBondContact OG1-CE2 3.42Å; T470-Y503 HydrophobicContact CG2-CD2 4.09Å; T470-Y503 HydrophobicContact CG2-CG 4.41Å; L472-Y503 HydrophobicContact CD2-CE1 4.45Å; Y503-E505 PolarHBondContact O-N 2.95Å; Y503-N506 PolarHBondContact N-O 3.1Å; Y503-N506 WeakPolarHBondContact O-CB 3.45Å; Y503-N506 PolarHBondContact O-N 3.35Å
504	R	82.1	Confident	92.5	Very high	199 Å²	199	47.5 Å²	47.5	75%	0.751	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	-118.7	-163.1	-52.6	176.8	178	-179.2	-2.3	109.3
505	E	84	Confident	92.7	Very high	184 Å²	184	44.6 Å²	44.6	86%	0.86	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	-5.5	174.4	-59.9	-170.3	164.7	0	0	113.5	Y503	Y503-E505 PolarHBondContact O-N 2.95Å
506	N	89.4	Confident	92.8	Very high	84 Å²	84	44.5 Å²	44.5	45%	0.449	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.9	-174.8	-66.6	-51.4	0	0	0	111.7	K502 Y503 V508 A570	K502-N506 WeakPolarHBondContact CA-O 3.25Å; Y503-N506 PolarHBondContact N-O 3.1Å; Y503-N506 WeakPolarHBondContact O-CB 3.45Å; Y503-N506 PolarHBondContact O-N 3.35Å; N506-V508 HydrophobicContact CB-CG1 4.36Å; N506-V508 PolarHBondContact O-N 2.95Å; N506-A570 HydrophobicContact CB-CB 4.16Å
507	K	93.2	Very high	92.9	Very high	115 Å²	115	47 Å²	47	50%	0.5	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	108.7	174.2	-64.9	171.1	178.1	-153.6	0	109.4	Y544	K507-Y544 HydrophobicContact CB-CD1 3.8Å; K507-Y544 HydrophobicContact CB-CD2 4.44Å; K507-Y544 HydrophobicContact CB-CE1 4.42Å; K507-Y544 HydrophobicContact CB-CG 3.81Å; K507-Y544 HydrophobicContact CD-CD1 3.64Å; K507-Y544 HydrophobicContact CD-CE1 3.37Å; K507-Y544 HydrophobicContact CD-CE2 4.44Å; K507-Y544 HydrophobicContact CD-CG 4.28Å; K507-Y544 WeakPolarHBondContact CE-OH 3.42Å; K507-Y544 HydrophobicContact CG-CD1 3.75Å; K507-Y544 HydrophobicContact CG-CD2 4.13Å; K507-Y544 HydrophobicContact CG-CE1 3.87Å; K507-Y544 HydrophobicContact CG-CE2 4.23Å; K507-Y544 HydrophobicContact CG-CG 3.88Å; K507-Y544 PolarHBondContact NZ-OH 3.49Å
508	V	94.1	Very high	92.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.5	-173.9	-69.8	0	0	0	0	110.8	T470 G501 N506 A570	T470-V508 HydrophobicContact CG2-CG2 4.42Å; G501-V508 PolarHBondContact N-O 3.02Å; G501-V508 PolarHBondContact O-N 3.43Å; N506-V508 HydrophobicContact CB-CG1 4.36Å; N506-V508 PolarHBondContact O-N 2.95Å; V508-A570 HydrophobicContact CG1-CB 3.92Å
509	F	95.6	Very high	92.7	Very high	29 Å²	29	50.4 Å²	50.4	13%	0.127	22%	0.221	C	C	.	.			trans	-160.7	152	176.2	57.3	-91.6	0	0	0	112.2	K511 N541 S542 N543 A567 T568 G573	F509-K511 HydrophobicContact CD2-CG 4.13Å; F509-K511 HydrophobicContact CE2-CG 3.86Å; F509-N541 HydrophobicContact CB-CB 4.17Å; F509-N541 HydrophobicContact CD2-CB 4.09Å; F509-N541 VanDerWaalsContact CD2-O 3.22Å; F509-N541 WeakPolarHBondContact CD2-O 3.49Å; F509-N541 WeakPolarHBondContact CE2-O 3.22Å; F509-N541 HydrophobicContact CG-CB 4.4Å; F509-S542 WeakPolarHBondContact CZ-O 3.21Å; F509-N543 VanDerWaalsContact CD1-C 3.41Å; F509-N543 WeakPolarHBondContact CG-O 3.38Å; F509-A567 WeakPolarHBondContact O-CA 3.41Å; F509-T568 HydrophobicContact CD1-CG2 3.29Å; F509-T568 HydrophobicContact CD2-CG2 3.8Å; F509-T568 HydrophobicContact CE1-CG2 3.2Å; F509-T568 HydrophobicContact CE2-CG2 3.72Å; F509-T568 HydrophobicContact CG-CG2 3.6Å; F509-T568 HydrophobicContact CZ-CG2 3.43Å; F509-T568 VanDerWaalsContact CZ-CG2 3.43Å; F509-T568 PolarHBondContact O-N 2.81Å; F509-G573 WeakPolarHBondContact CA-O 3.4Å
510	M	96.3	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.8	173	-170.5	172.2	66.5	0	0	111	I498 F513 G540 N541 I562 P564 M572 G573 L574	I498-M510 HydrophobicContact CD1-CE 4.3Å; I498-M510 HydrophobicContact CG2-CE 4.33Å; M510-F513 HydrophobicContact CE-CB 3.8Å; M510-F513 HydrophobicContact CE-CD1 3.35Å; M510-F513 HydrophobicContact CE-CD2 4.17Å; M510-F513 HydrophobicContact CE-CE1 3.95Å; M510-F513 HydrophobicContact CE-CG 3.49Å; M510-F513 VanDerWaalsContact CE-CG 3.49Å; M510-F513 HydrophobicContact CG-CB 4.32Å; M510-F513 HydrophobicContact SD-CB 3.52Å; M510-F513 VanDerWaalsContact SD-CB 3.52Å; M510-F513 HydrophobicContact SD-CD1 4.16Å; M510-F513 HydrophobicContact SD-CG 3.95Å; M510-G540 CarbonylContact O-C 3.4Å; M510-G540 WeakPolarHBondContact O-CA 3.4Å; M510-N541 PolarHBondContact O-N 3.07Å; M510-I562 HydrophobicContact CE-CG2 3.88Å; M510-I562 HydrophobicContact SD-CG2 3.97Å; M510-P564 HydrophobicContact CG-CB 4.23Å; M510-P564 HydrophobicContact SD-CB 3.81Å; M510-M572 HydrophobicContact CB-CG 4.2Å; M510-M572 HydrophobicContact CB-SD 4.16Å; M510-G573 PolarHBondContact N-O 2.83Å; M510-L574 HydrophobicContact CE-CD1 3.91Å; M510-L574 HydrophobicContact CE-CD2 4.25Å; M510-L574 HydrophobicContact SD-CD2 4.45Å
511	K	95.4	Very high	92.2	Very high	84 Å²	84	55.3 Å²	55.3	37%	0.365	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-33.7	-180	-71.1	-172.5	-178.7	174	0	114	F509 G540 R566 A567	F509-K511 HydrophobicContact CD2-CG 4.13Å; F509-K511 HydrophobicContact CE2-CG 3.86Å; K511-G540 WeakPolarHBondContact O-CA 3.32Å; K511-G540 PolarHBondContact O-N 3.06Å; K511-R566 WeakPolarHBondContact CA-O 3.48Å; K511-R566 HydrophobicContact CB-CB 4.38Å; K511-R566 PolarHBondContact N-O 2.74Å; K511-A567 WeakPolarHBondContact CD-O 3.42Å
512	K	95.5	Very high	92.2	Very high	65 Å²	65	59.8 Å²	59.8	28%	0.283	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145.8	178.6	-68.2	-174.7	176.4	-105.2	0	109.7	I537 F538 E539 E565 R566	K512-I537 HydrophobicContact CB-CG2 4Å; K512-I537 HydrophobicContact CD-CG2 4.16Å; K512-I537 HydrophobicContact CG-CG2 4.32Å; K512-F538 VanDerWaalsContact CA-O 3.31Å; K512-F538 WeakPolarHBondContact CA-O 3.16Å; K512-E539 IonicContact NZ-OE1 3.61Å; K512-E539 PolarHBondContact NZ-OE1 3.14Å; K512-E539 IonicContact NZ-OE2 2.75Å; K512-E565 HydrophobicContact CB-CB 4.26Å; K512-E565 PolarHBondContact O-N 3.48Å; K512-R566 HydrophobicContact CB-CB 4.25Å; K512-R566 PolarHBondContact N-O 2.75Å; K512-R566 VanDerWaalsContact N-O 3.13Å; K512-R566 PolarHBondContact O-N 3.2Å
513	F	95.8	Very high	92.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	166.5	-179.3	68.4	-77.7	0	0	0	112.5	F496 I498 M510 F538 R550 I562 Y563	F496-F513 HydrophobicContact CE2-CE1 4.36Å; F496-F513 AromaticContact CE2-CE2 3.44Å; F496-F513 HydrophobicContact CE2-CE2 3.44Å; F496-F513 VanDerWaalsContact CE2-CE2 3.44Å; F496-F513 AromaticContact CE2-CZ 3.21Å; F496-F513 HydrophobicContact CE2-CZ 3.21Å; F496-F513 AromaticContact CZ-CE2 3.38Å; F496-F513 HydrophobicContact CZ-CE2 3.38Å; F496-F513 AromaticContact CZ-CZ 3.36Å; F496-F513 HydrophobicContact CZ-CZ 3.36Å; I498-F513 HydrophobicContact CD1-CE1 3.81Å; I498-F513 HydrophobicContact CD1-CZ 4.39Å; M510-F513 HydrophobicContact CE-CB 3.8Å; M510-F513 HydrophobicContact CE-CD1 3.35Å; M510-F513 HydrophobicContact CE-CD2 4.17Å; M510-F513 HydrophobicContact CE-CE1 3.95Å; M510-F513 HydrophobicContact CE-CG 3.49Å; M510-F513 VanDerWaalsContact CE-CG 3.49Å; M510-F513 HydrophobicContact CG-CB 4.32Å; M510-F513 HydrophobicContact SD-CB 3.52Å; M510-F513 VanDerWaalsContact SD-CB 3.52Å; M510-F513 HydrophobicContact SD-CD1 4.16Å; M510-F513 HydrophobicContact SD-CG 3.95Å; F513-F538 HydrophobicContact CD1-CB 3.85Å; F513-F538 HydrophobicContact CD2-CB 4.22Å; F513-F538 HydrophobicContact CD2-CD2 4.44Å; F513-F538 HydrophobicContact CE1-CB 3.28Å; F513-F538 HydrophobicContact CE1-CG 4.29Å; F513-F538 HydrophobicContact CE2-CB 3.69Å; F513-F538 AromaticContact CE2-CD2 3.98Å; F513-F538 HydrophobicContact CE2-CD2 3.98Å; F513-F538 AromaticContact CE2-CG 3.88Å; F513-F538 HydrophobicContact CE2-CG 3.88Å; F513-F538 HydrophobicContact CG-CB 4.27Å; F513-F538 HydrophobicContact CZ-CB 3.14Å; F513-F538 HydrophobicContact CZ-CD1 4.25Å; F513-F538 HydrophobicContact CZ-CD2 4.25Å; F513-F538 AromaticContact CZ-CG 3.67Å; F513-F538 HydrophobicContact CZ-CG 3.67Å; F513-F538 PolarHBondContact N-O 3.09Å; F513-F538 VanDerWaalsContact N-O 3.16Å; F513-F538 PolarHBondContact O-N 2.73Å; F513-R550 HydrophobicContact CZ-CG 4.35Å; F513-I562 HydrophobicContact CB-CG2 4.34Å; F513-I562 HydrophobicContact CD2-CD1 4.13Å; F513-I562 HydrophobicContact CD2-CG2 3.9Å; F513-I562 HydrophobicContact CE2-CD1 4Å; F513-I562 HydrophobicContact CG-CG2 4.3Å; F513-Y563 CarbonylContact C-O 3.5Å; F513-Y563 WeakPolarHBondContact CA-O 3.34Å; F513-Y563 VanDerWaalsContact CB-O 3.26Å; F513-Y563 WeakPolarHBondContact CB-O 3.49Å
514	R	95.2	Very high	93.1	Very high	76 Å²	76	63.5 Å²	63.5	29%	0.287	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154	169.9	-69.8	-179.8	-77.9	154.7	4	109.9	V526 P535 I537 Y563 E565	R514-V526 HydrophobicContact CB-CG1 4.26Å; R514-P535 HydrophobicContact CG-CB 4.5Å; R514-I537 HydrophobicContact CG-CG1 4.41Å; R514-Y563 PolarHBondContact N-O 2.78Å; R514-Y563 PolarHBondContact O-N 2.83Å; R514-E565 WeakPolarHBondContact CD-OE1 3.22Å; R514-E565 HydrophobicContact CG-CG 4.47Å; R514-E565 WeakPolarHBondContact CG-OE1 3.38Å; R514-E565 IonicContact CZ-OE1 3.65Å; R514-E565 IonicContact NE-OE1 3.74Å; R514-E565 PolarHBondContact NE-OE1 3.28Å
515	L	95.7	Very high	93.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.3	177.7	-173	72.4	0	0	0	109.7	F496 V526 V527 F538 V552 L555 I560 I562	F496-L515 HydrophobicContact CD1-CD2 4.39Å; F496-L515 HydrophobicContact CE1-CD1 4.31Å; F496-L515 HydrophobicContact CE1-CD2 3.87Å; L515-V526 WeakPolarHBondContact O-CA 3.46Å; L515-V526 WeakPolarHBondContact O-CG1 3.26Å; L515-V527 HydrophobicContact CB-CB 4.44Å; L515-V527 HydrophobicContact CB-CG2 4.11Å; L515-V527 HydrophobicContact CD2-CG2 3.89Å; L515-V527 HydrophobicContact CG-CG2 4.21Å; L515-V527 PolarHBondContact O-N 3.17Å; L515-F538 HydrophobicContact CB-CD2 4.47Å; L515-F538 HydrophobicContact CB-CE2 3.82Å; L515-F538 HydrophobicContact CB-CZ 4.38Å; L515-V552 HydrophobicContact CD2-CG1 3.83Å; L515-L555 HydrophobicContact CD2-CD1 4.1Å; L515-I560 HydrophobicContact CD1-CG2 3.66Å; L515-I562 HydrophobicContact CD1-CD1 3.42Å; L515-I562 VanDerWaalsContact CD1-CD1 3.42Å; L515-I562 HydrophobicContact CD1-CG1 4.47Å
516	G	95.7	Very high	94.1	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	155.9	167.9	0	0	0	0	0	112.5	R525 I560 R561	G516-R525 CarbonylContact C-O 3.46Å; G516-R525 WeakPolarHBondContact CA-O 3.33Å; G516-I560 CarbonylContact O-C 3.53Å; G516-R561 PolarHBondContact N-O 2.94Å; G516-R561 PolarHBondContact O-N 3.38Å
517	Y	96.6	Very high	94.3	Very high	52 Å²	52	53 Å²	53	20%	0.204	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	153.1	-179.4	65.3	-86.1	0	0	0	110.7	R525 V527 L555 F559	Y517-R525 HydrophobicContact CD1-CB 4.32Å; Y517-R525 HydrophobicContact CD2-CB 4.42Å; Y517-R525 HydrophobicContact CE1-CB 3.79Å; Y517-R525 HydrophobicContact CE2-CB 3.9Å; Y517-R525 PolarHBondContact N-O 3.11Å; Y517-R525 PolarHBondContact O-N 2.92Å; Y517-V527 HydrophobicContact CD1-CG2 3.9Å; Y517-V527 HydrophobicContact CE1-CG2 3.97Å; Y517-L555 HydrophobicContact CD1-CD1 4.02Å; Y517-L555 HydrophobicContact CE1-CD2 4.33Å; Y517-L555 HydrophobicContact CG-CD1 4.24Å; Y517-F559 VanDerWaalsContact CA-O 3.31Å; Y517-F559 WeakPolarHBondContact CA-O 3.31Å
518	S	96.9	Very high	94.2	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.028	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	151.4	-177.8	-175.9	0	0	0	0	111.1	N520 G521 D523 T557 R558 F559	S518-N520 PolarHBondContact OG-N 2.97Å; S518-N520 PolarHBondContact OG-OD1 2.93Å; S518-G521 PolarHBondContact OG-N 2.86Å; S518-D523 WeakPolarHBondContact CB-O 3.17Å; S518-D523 PolarHBondContact OG-O 2.93Å; S518-T557 PolarHBondContact N-OG1 2.92Å; S518-T557 PolarHBondContact O-OG1 3.37Å; S518-R558 PolarHBondContact O-N 2.68Å; S518-F559 PolarHBondContact N-O 3.47Å; S518-F559 VanDerWaalsContact N-O 3.08Å; S518-F559 WeakPolarHBondContact O-CA 3.29Å; S518-F559 WeakPolarHBondContact O-CB 3.41Å; S518-F559 WeakPolarHBondContact O-CD2 3.26Å; S518-F559 PolarHBondContact O-N 2.92Å
519	N	94	Very high	93.8	Very high	69 Å²	69	52.5 Å²	52.5	37%	0.369	27%	0.265	S	S	.	.	S	Bend	trans	-100	-18.6	174.4	-64.9	9.4	0	0	0	112.5	E490 T557	E490-N519 PolarHBondContact OE1-ND2 2.85Å; N519-T557 VanDerWaalsContact OD1-CA 3.27Å; N519-T557 WeakPolarHBondContact OD1-CA 3.48Å; N519-T557 PolarHBondContact OD1-OG1 2.84Å
520	N	91.3	Very high	93	Very high	84 Å²	84	58.5 Å²	58.5	45%	0.449	30%	0.304	S	S	.	.	S	Bend	trans	-117.4	-2.2	-176.7	64.7	9.8	0	0	0	113.6	S518 S522 D523	S518-N520 PolarHBondContact OG-N 2.97Å; S518-N520 PolarHBondContact OG-OD1 2.93Å; N520-S522 PolarHBondContact O-N 3.22Å; N520-S522 PolarHBondContact OD1-N 2.83Å; N520-D523 PolarHBondContact ND2-OD2 2.82Å; N520-D523 PolarHBondContact OD1-N 3.17Å
521	G	89.1	Confident	92.1	Very high	18 Å²	18	61.9 Å²	61.9	19%	0.186	33%	0.328	C	S	.	.	S	Bend	trans	76.1	-4.2	179.7	0	0	0	0	0	114.9	S518 W524	S518-G521 PolarHBondContact OG-N 2.86Å; G521-W524 PolarHBondContact O-NE1 2.83Å
522	S	90.7	Very high	91.2	Very high	95 Å²	95	60 Å²	60	66%	0.664	33%	0.333	S	S	*	.	S	Bend	trans	-113.6	-43.6	-176.4	-58.6	0	0	0	0	112.2	N520 W524	N520-S522 PolarHBondContact O-N 3.22Å; N520-S522 PolarHBondContact OD1-N 2.83Å; S522-W524 PolarHBondContact O-N 2.84Å
523	D	94.4	Very high	90.5	Very high	113 Å²	113	63.9 Å²	63.9	60%	0.604	36%	0.356	S	S	*	.	S	Bend	trans	-91.2	103.6	178.9	-65.1	-44.1	0	0	0	110.1	S518 N520	S518-D523 WeakPolarHBondContact CB-O 3.17Å; S518-D523 PolarHBondContact OG-O 2.93Å; N520-D523 PolarHBondContact ND2-OD2 2.82Å; N520-D523 PolarHBondContact OD1-N 3.17Å
524	W	95.1	Very high	90.1	Very high	62 Å²	62	70.7 Å²	70.7	24%	0.235	39%	0.386	C	S	.	.			trans	-99.4	127.4	-175.2	-70.3	90.4	0	0	0	112.1	Q484 G521 S522 F559 R561	Q484-W524 HydrophobicContact CG-CH2 4.14Å; Q484-W524 VanDerWaalsContact OE1-CZ2 3.29Å; G521-W524 PolarHBondContact O-NE1 2.83Å; S522-W524 PolarHBondContact O-N 2.84Å; W524-F559 HydrophobicContact CH2-CB 3.67Å; W524-F559 HydrophobicContact CZ2-CB 4.32Å; W524-F559 HydrophobicContact CZ3-CB 4.31Å; W524-R561 HydrophobicContact CE3-CB 4.15Å; W524-R561 HydrophobicContact CE3-CG 4.24Å; W524-R561 HydrophobicContact CH2-CB 4.02Å; W524-R561 VanDerWaalsContact CH2-CD 3.45Å; W524-R561 HydrophobicContact CH2-CG 3.39Å; W524-R561 HydrophobicContact CZ2-CG 4.02Å; W524-R561 VanDerWaalsContact CZ2-CZ 3.45Å; W524-R561 HydrophobicContact CZ3-CB 3.59Å; W524-R561 HydrophobicContact CZ3-CG 3.53Å
525	R	94.1	Very high	89.7	Confident	170 Å²	170	70.1 Å²	70.1	64%	0.642	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	145.4	168.7	-62.5	-178.7	-174.5	-178.5	3.5	109.3	G516 Y517	G516-R525 CarbonylContact C-O 3.46Å; G516-R525 WeakPolarHBondContact CA-O 3.33Å; Y517-R525 HydrophobicContact CD1-CB 4.32Å; Y517-R525 HydrophobicContact CD2-CB 4.42Å; Y517-R525 HydrophobicContact CE1-CB 3.79Å; Y517-R525 HydrophobicContact CE2-CB 3.9Å; Y517-R525 PolarHBondContact N-O 3.11Å; Y517-R525 PolarHBondContact O-N 2.92Å
526	V	93.3	Very high	89.6	Confident	56 Å²	56	73.5 Å²	73.5	34%	0.339	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.6	175.7	-178.7	0	0	0	0	108.5	R514 L515 S528 P535	R514-V526 HydrophobicContact CB-CG1 4.26Å; L515-V526 WeakPolarHBondContact O-CA 3.46Å; L515-V526 WeakPolarHBondContact O-CG1 3.26Å; V526-S528 PolarHBondContact O-N 2.86Å; V526-P535 HydrophobicContact CB-CB 4.5Å; V526-P535 HydrophobicContact CG1-CB 3.63Å
527	V	93	Very high	89.5	Confident	19 Å²	19	77.5 Å²	77.5	12%	0.115	43%	0.427	C	S	.	.			trans	-60.8	124	175.5	177.1	0	0	0	0	109.4	L515 Y517 K536 F538 L555	L515-V527 HydrophobicContact CB-CB 4.44Å; L515-V527 HydrophobicContact CB-CG2 4.11Å; L515-V527 HydrophobicContact CD2-CG2 3.89Å; L515-V527 HydrophobicContact CG-CG2 4.21Å; L515-V527 PolarHBondContact O-N 3.17Å; Y517-V527 HydrophobicContact CD1-CG2 3.9Å; Y517-V527 HydrophobicContact CE1-CG2 3.97Å; V527-K536 HydrophobicContact CG1-CB 4.35Å; V527-K536 HydrophobicContact CG1-CD 4.28Å; V527-K536 WeakPolarHBondContact O-CB 3.39Å; V527-K536 PolarHBondContact O-N 2.79Å; V527-F538 HydrophobicContact CB-CE2 4.49Å; V527-F538 HydrophobicContact CG1-CZ 4.19Å; V527-L555 HydrophobicContact CG2-CD1 3.82Å
528	S	89.9	Confident	89.5	Confident	59 Å²	59	75.5 Å²	75.5	41%	0.413	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-85.8	158.4	179.3	43.8	0	0	0	0	112.2	V526 K534	V526-S528 PolarHBondContact O-N 2.86Å; S528-K534 CarbonylContact C-O 3.5Å; S528-K534 VanDerWaalsContact CA-O 3.26Å; S528-K534 WeakPolarHBondContact CA-O 3.44Å
529	D	86.7	Confident	89.4	Confident	48 Å²	48	80.3 Å²	80.3	26%	0.257	44%	0.442	S	S	.	.			trans	-67.5	176.7	171.4	71.5	11	0	0	0	111.7	S531 G532 K534	D529-S531 VanDerWaalsContact CG-OG 3.26Å; D529-S531 PolarHBondContact O-N 3.4Å; D529-S531 WeakPolarHBondContact OD1-CA 3.44Å; D529-S531 WeakPolarHBondContact OD1-CB 3.2Å; D529-S531 PolarHBondContact OD1-N 2.88Å; D529-S531 PolarHBondContact OD1-OG 3.14Å; D529-S531 PolarHBondContact OD2-OG 3.49Å; D529-G532 PolarHBondContact O-N 3.27Å; D529-G532 PolarHBondContact OD1-N 3.03Å; D529-K534 PolarHBondContact N-O 3.06Å
530	T	78.8	Confident	89.4	Confident	154 Å²	154	77.2 Å²	77.2	95%	0.945	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.9	179.8	51.6	0	0	0	0	113.8
531	S	77	Confident	89.7	Confident	71 Å²	71	73.5 Å²	73.5	50%	0.497	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-8.8	175.4	78.4	0	0	0	0	113.2	D529 N533	D529-S531 VanDerWaalsContact CG-OG 3.26Å; D529-S531 PolarHBondContact O-N 3.4Å; D529-S531 WeakPolarHBondContact OD1-CA 3.44Å; D529-S531 WeakPolarHBondContact OD1-CB 3.2Å; D529-S531 PolarHBondContact OD1-N 2.88Å; D529-S531 PolarHBondContact OD1-OG 3.14Å; D529-S531 PolarHBondContact OD2-OG 3.49Å; S531-N533 PolarHBondContact O-N 2.75Å; S531-N533 VanDerWaalsContact O-N 3.13Å
532	G	77.4	Confident	89.9	Confident	46 Å²	46	76.4 Å²	76.4	47%	0.474	42%	0.424	S	S	.	.	S	Bend	trans	73.8	-9.3	179.9	0	0	0	0	0	115.1	D529	D529-G532 PolarHBondContact O-N 3.27Å; D529-G532 PolarHBondContact OD1-N 3.03Å
533	N	80.1	Confident	90.1	Very high	145 Å²	145	73.2 Å²	73.2	78%	0.775	40%	0.399	S	S	*	.	S	Bend	trans	-96.6	-12.8	-168	-71.5	-36.4	0	0	0	114.4	S531	S531-N533 PolarHBondContact O-N 2.75Å; S531-N533 VanDerWaalsContact O-N 3.13Å
534	K	86.7	Confident	90.1	Very high	144 Å²	144	68.4 Å²	68.4	63%	0.626	37%	0.373	S	S	*	.	S	Bend	trans	-137	151	-178.5	-67.4	-178.5	-178.3	176.6	0	111	S528 D529 K536	S528-K534 CarbonylContact C-O 3.5Å; S528-K534 VanDerWaalsContact CA-O 3.26Å; S528-K534 WeakPolarHBondContact CA-O 3.44Å; D529-K534 PolarHBondContact N-O 3.06Å; K534-K536 PolarHBondContact O-N 2.66Å
535	P	88.3	Confident	90.1	Very high	63 Å²	63	65.5 Å²	65.5	41%	0.409	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-63.6	133.2	172.7	27.6	-34.2	0	0	0	110.3	R514 V526 I537	R514-P535 HydrophobicContact CG-CB 4.5Å; V526-P535 HydrophobicContact CB-CB 4.5Å; V526-P535 HydrophobicContact CG1-CB 3.63Å; P535-I537 PolarHBondContact O-N 2.82Å
536	K	93.1	Very high	90.2	Very high	71 Å²	71	57.7 Å²	57.7	31%	0.309	33%	0.333	S	S	.	.			trans	-70.4	123.1	177.8	-175.7	171.7	175.8	-177.8	0	109.9	V527 K534 F538	V527-K536 HydrophobicContact CG1-CB 4.35Å; V527-K536 HydrophobicContact CG1-CD 4.28Å; V527-K536 WeakPolarHBondContact O-CB 3.39Å; V527-K536 PolarHBondContact O-N 2.79Å; K534-K536 PolarHBondContact O-N 2.66Å; K536-F538 HydrophobicContact CB-CE2 4.05Å; K536-F538 HydrophobicContact CB-CZ 4.46Å; K536-F538 HydrophobicContact CD-CE1 3.93Å; K536-F538 HydrophobicContact CD-CE2 4Å; K536-F538 HydrophobicContact CD-CZ 3.58Å; K536-F538 HydrophobicContact CG-CD2 4.23Å; K536-F538 HydrophobicContact CG-CE1 4.44Å; K536-F538 HydrophobicContact CG-CE2 3.88Å; K536-F538 HydrophobicContact CG-CZ 4Å
537	I	93.7	Very high	90.3	Very high	84 Å²	84	55.1 Å²	55.1	43%	0.431	32%	0.317	S	S	.	.			trans	-94.2	115.4	172	-58.7	172.1	0	0	0	107.9	K512 R514 P535	K512-I537 HydrophobicContact CB-CG2 4Å; K512-I537 HydrophobicContact CD-CG2 4.16Å; K512-I537 HydrophobicContact CG-CG2 4.32Å; R514-I537 HydrophobicContact CG-CG1 4.41Å; P535-I537 PolarHBondContact O-N 2.82Å
538	F	95.5	Very high	90.4	Very high	10 Å²	10	55.1 Å²	55.1	4%	0.044	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	143.8	177.1	-65.3	-98.5	0	0	0	110.3	F496 K512 F513 L515 V527 K536 R550 V552	F496-F538 HydrophobicContact CZ-CD1 4.24Å; F496-F538 HydrophobicContact CZ-CE1 4.37Å; K512-F538 VanDerWaalsContact CA-O 3.31Å; K512-F538 WeakPolarHBondContact CA-O 3.16Å; F513-F538 HydrophobicContact CD1-CB 3.85Å; F513-F538 HydrophobicContact CD2-CB 4.22Å; F513-F538 HydrophobicContact CD2-CD2 4.44Å; F513-F538 HydrophobicContact CE1-CB 3.28Å; F513-F538 HydrophobicContact CE1-CG 4.29Å; F513-F538 HydrophobicContact CE2-CB 3.69Å; F513-F538 AromaticContact CE2-CD2 3.98Å; F513-F538 HydrophobicContact CE2-CD2 3.98Å; F513-F538 AromaticContact CE2-CG 3.88Å; F513-F538 HydrophobicContact CE2-CG 3.88Å; F513-F538 HydrophobicContact CG-CB 4.27Å; F513-F538 HydrophobicContact CZ-CB 3.14Å; F513-F538 HydrophobicContact CZ-CD1 4.25Å; F513-F538 HydrophobicContact CZ-CD2 4.25Å; F513-F538 AromaticContact CZ-CG 3.67Å; F513-F538 HydrophobicContact CZ-CG 3.67Å; F513-F538 PolarHBondContact N-O 3.09Å; F513-F538 VanDerWaalsContact N-O 3.16Å; F513-F538 PolarHBondContact O-N 2.73Å; L515-F538 HydrophobicContact CB-CD2 4.47Å; L515-F538 HydrophobicContact CB-CE2 3.82Å; L515-F538 HydrophobicContact CB-CZ 4.38Å; V527-F538 HydrophobicContact CB-CE2 4.49Å; V527-F538 HydrophobicContact CG1-CZ 4.19Å; K536-F538 HydrophobicContact CB-CE2 4.05Å; K536-F538 HydrophobicContact CB-CZ 4.46Å; K536-F538 HydrophobicContact CD-CE1 3.93Å; K536-F538 HydrophobicContact CD-CE2 4Å; K536-F538 HydrophobicContact CD-CZ 3.58Å; K536-F538 HydrophobicContact CG-CD2 4.23Å; K536-F538 HydrophobicContact CG-CE1 4.44Å; K536-F538 HydrophobicContact CG-CE2 3.88Å; K536-F538 HydrophobicContact CG-CZ 4Å; F538-R550 HydrophobicContact CD1-CB 4.4Å; F538-V552 HydrophobicContact CE1-CG1 3.74Å; F538-V552 HydrophobicContact CZ-CG1 3.61Å
539	E	95.3	Very high	90.6	Very high	106 Å²	106	53.9 Å²	53.9	50%	0.495	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.1	168	-65.6	-61.8	151.6	0	0	109.5	K512 R550	K512-E539 IonicContact NZ-OE1 3.61Å; K512-E539 PolarHBondContact NZ-OE1 3.14Å; K512-E539 IonicContact NZ-OE2 2.75Å; E539-R550 PolarHBondContact O-NE 2.88Å
540	G	95.2	Very high	91	Very high	3 Å²	3	54 Å²	54	3%	0.031	30%	0.301	C	S	.	.			trans	-82.5	-145.8	179.3	0	0	0	0	0	112.8	M510 K511 R550	M510-G540 CarbonylContact O-C 3.4Å; M510-G540 WeakPolarHBondContact O-CA 3.4Å; K511-G540 WeakPolarHBondContact O-CA 3.32Å; K511-G540 PolarHBondContact O-N 3.06Å; G540-R550 PolarHBondContact O-NH2 2.85Å
541	N	95.7	Very high	91.6	Very high	6 Å²	6	51 Å²	51	3%	0.032	28%	0.283	C	S	.	.			trans	-82.6	154.1	174.8	-62	88	0	0	0	111.9	I498 Q499 F509 M510 N543 T546	I498-N541 WeakPolarHBondContact CG1-OD1 3.4Å; I498-N541 PolarHBondContact O-ND2 2.79Å; Q499-N541 WeakPolarHBondContact CA-ND2 3.14Å; F509-N541 HydrophobicContact CB-CB 4.17Å; F509-N541 HydrophobicContact CD2-CB 4.09Å; F509-N541 VanDerWaalsContact CD2-O 3.22Å; F509-N541 WeakPolarHBondContact CD2-O 3.49Å; F509-N541 WeakPolarHBondContact CE2-O 3.22Å; F509-N541 HydrophobicContact CG-CB 4.4Å; M510-N541 PolarHBondContact O-N 3.07Å; N541-N543 VanDerWaalsContact CB-O 3.28Å; N541-N543 WeakPolarHBondContact CB-O 3.42Å; N541-T546 PolarHBondContact ND2-O 3.41Å
542	S	93.6	Very high	92.3	Very high	80 Å²	80	48.2 Å²	48.2	56%	0.559	26%	0.263	S	S	*	.	S	Bend	trans	-92.7	-16.9	172.9	-61.5	0	0	0	0	113.2	F509	F509-S542 WeakPolarHBondContact CZ-O 3.21Å
543	N	94.4	Very high	92.9	Very high	27 Å²	27	54 Å²	54	14%	0.144	28%	0.277	C	S	.	.	S	Bend	trans	-153.7	-179.4	179.9	68.5	70.9	0	0	0	109.3	I368 F509 N541 D545 T546	I368-N543 HydrophobicContact CD1-CB 4.15Å; F509-N543 VanDerWaalsContact CD1-C 3.41Å; F509-N543 WeakPolarHBondContact CG-O 3.38Å; N541-N543 VanDerWaalsContact CB-O 3.28Å; N541-N543 WeakPolarHBondContact CB-O 3.42Å; N543-D545 PolarHBondContact OD1-N 2.92Å; N543-T546 WeakPolarHBondContact ND2-CB 3.47Å; N543-T546 PolarHBondContact ND2-OG1 3.18Å; N543-T546 PolarHBondContact OD1-N 3.48Å; N543-T546 PolarHBondContact OD1-OG1 2.72Å
544	Y	94.7	Very high	93.4	Very high	13 Å²	13	50.8 Å²	50.8	5%	0.051	27%	0.265	C	S	.	.	S	Bend	trans	-86.2	-15.8	-172	73.9	-78.3	0	0	0	114.7	D366 I368 G500 G501 K502 K507 R575	D366-Y544 HydrophobicContact CB-CE2 3.9Å; D366-Y544 VanDerWaalsContact OD1-CE2 3.29Å; D366-Y544 WeakPolarHBondContact OD1-CE2 3.48Å; D366-Y544 PolarHBondContact OD1-OH 3.47Å; I368-Y544 HydrophobicContact CD1-CD1 4.16Å; I368-Y544 HydrophobicContact CD1-CE1 3.68Å; G500-Y544 CarbonylContact C-O 3.56Å; G500-Y544 VanDerWaalsContact CA-O 3.25Å; G500-Y544 WeakPolarHBondContact CA-O 3.36Å; G500-Y544 PolarHBondContact N-O 3.26Å; G501-Y544 PolarHBondContact N-O 3.36Å; K502-Y544 HydrophobicContact CG-CD2 4.31Å; K502-Y544 HydrophobicContact CG-CE2 4.49Å; K507-Y544 HydrophobicContact CB-CD1 3.8Å; K507-Y544 HydrophobicContact CB-CD2 4.44Å; K507-Y544 HydrophobicContact CB-CE1 4.42Å; K507-Y544 HydrophobicContact CB-CG 3.81Å; K507-Y544 HydrophobicContact CD-CD1 3.64Å; K507-Y544 HydrophobicContact CD-CE1 3.37Å; K507-Y544 HydrophobicContact CD-CE2 4.44Å; K507-Y544 HydrophobicContact CD-CG 4.28Å; K507-Y544 WeakPolarHBondContact CE-OH 3.42Å; K507-Y544 HydrophobicContact CG-CD1 3.75Å; K507-Y544 HydrophobicContact CG-CD2 4.13Å; K507-Y544 HydrophobicContact CG-CE1 3.87Å; K507-Y544 HydrophobicContact CG-CE2 4.23Å; K507-Y544 HydrophobicContact CG-CG 3.88Å; K507-Y544 PolarHBondContact NZ-OH 3.49Å; Y544-R575 PolarHBondContact O-NH2 2.99Å
545	D	95.1	Very high	93.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-116	-44.2	-171.8	-177.7	66.7	0	0	0	113.7	S361 S362 D366 I368 Q499 N543 P547	S361-D545 WeakPolarHBondContact CA-OD2 3.32Å; S362-D545 PolarHBondContact N-OD2 3.11Å; S362-D545 PolarHBondContact OG-OD1 2.96Å; D366-D545 HydrophobicContact CB-CB 4.05Å; I368-D545 HydrophobicContact CD1-CB 4.38Å; I368-D545 HydrophobicContact CG1-CB 4.05Å; Q499-D545 WeakPolarHBondContact CG-O 3.48Å; Q499-D545 PolarHBondContact NE2-O 3.3Å; N543-D545 PolarHBondContact OD1-N 2.92Å; D545-P547 WeakPolarHBondContact O-CD 3.45Å; D545-P547 VanDerWaalsContact O-N 3.16Å
546	T	95.9	Very high	94	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.037	24%	0.241	C	C	.	.	S	Bend	trans	-66.3	116.2	-176.7	-46.1	0	0	0	0	110.9	T397 N541 N543	T397-T546 HydrophobicContact CG2-CG2 3.6Å; N541-T546 PolarHBondContact ND2-O 3.41Å; N543-T546 WeakPolarHBondContact ND2-CB 3.47Å; N543-T546 PolarHBondContact ND2-OG1 3.18Å; N543-T546 PolarHBondContact OD1-N 3.48Å; N543-T546 PolarHBondContact OD1-OG1 2.72Å
547	P	96.4	Very high	94	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.013	23%	0.227	C	C	.	.			trans	-67.8	150.2	175.9	-17.9	32.9	0	0	0	111.5	L331 L398 L462 I497 I498 Q499 D545	L331-P547 HydrophobicContact CD1-CG 4.27Å; L331-P547 HydrophobicContact CD2-CG 4.15Å; L398-P547 HydrophobicContact CD2-CB 4.09Å; L398-P547 HydrophobicContact CG-CB 4.42Å; L398-P547 WeakPolarHBondContact O-CD 2.95Å; L462-P547 HydrophobicContact CD1-CB 4.5Å; I497-P547 HydrophobicContact CG2-CB 3.63Å; I498-P547 CarbonylContact O-C 3.55Å; I498-P547 WeakPolarHBondContact O-CA 3.32Å; Q499-P547 HydrophobicContact CB-CB 4.37Å; Q499-P547 HydrophobicContact CB-CG 4.46Å; Q499-P547 HydrophobicContact CG-CB 4.46Å; Q499-P547 HydrophobicContact CG-CG 4.09Å; D545-P547 WeakPolarHBondContact O-CD 3.45Å; D545-P547 VanDerWaalsContact O-N 3.16Å
548	E	95.1	Very high	94.1	Very high	20 Å²	20	42.5 Å²	42.5	9%	0.093	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.3	-177.8	-72.4	-86.4	174.1	0	0	109.7	K395 I497 I498 R550	K395-E548 IonicContact NZ-OE1 3.06Å; K395-E548 PolarHBondContact NZ-OE1 2.82Å; K395-E548 IonicContact NZ-OE2 2.73Å; I497-E548 WeakPolarHBondContact CA-O 3.3Å; I498-E548 HydrophobicContact CG1-CB 4.05Å; I498-E548 WeakPolarHBondContact CG1-O 3.42Å; I498-E548 PolarHBondContact N-O 2.85Å; I498-E548 PolarHBondContact O-N 2.82Å; E548-R550 IonicContact OE2-CZ 3.76Å; E548-R550 IonicContact OE2-NH1 2.67Å; E548-R550 PolarHBondContact OE2-NH1 2.83Å; E548-R550 IonicContact OE2-NH2 2.8Å; E548-R550 PolarHBondContact OE2-NH2 2.93Å
549	L	94.4	Very high	94.2	Very high	33 Å²	33	43 Å²	43	17%	0.173	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.9	172.3	173.8	62.4	0	0	0	110.2	F333 I497 T551 L579	F333-L549 HydrophobicContact CE1-CB 4.38Å; F333-L549 HydrophobicContact CE2-CD2 4.06Å; F333-L549 HydrophobicContact CZ-CB 3.78Å; F333-L549 HydrophobicContact CZ-CD2 3.57Å; F333-L549 HydrophobicContact CZ-CG 4.31Å; I497-L549 HydrophobicContact CG1-CD1 4.2Å; L549-T551 HydrophobicContact CD1-CG2 4.43Å; L549-T551 HydrophobicContact CD2-CG2 4.25Å; L549-T551 HydrophobicContact CG-CG2 4.21Å; L549-L579 HydrophobicContact CD1-CD1 3.49Å; L549-L579 VanDerWaalsContact CD1-CD1 3.49Å
550	R	94.1	Very high	94.3	Very high	51 Å²	51	38.1 Å²	38.1	19%	0.192	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.4	168.2	-61.9	-62.7	174.6	-107.2	-2.5	109.2	G495 F496 I498 F513 F538 E539 G540 E548	G495-R550 CarbonylContact C-O 3.57Å; G495-R550 WeakPolarHBondContact CA-O 3.18Å; F496-R550 HydrophobicContact CD2-CB 4.21Å; F496-R550 HydrophobicContact CE1-CB 4.12Å; F496-R550 HydrophobicContact CE2-CB 3.55Å; F496-R550 HydrophobicContact CE2-CG 4.06Å; F496-R550 HydrophobicContact CZ-CB 3.48Å; F496-R550 VanDerWaalsContact CZ-CB 3.48Å; F496-R550 HydrophobicContact CZ-CG 4.3Å; F496-R550 PolarHBondContact N-O 2.84Å; F496-R550 PolarHBondContact O-N 3.39Å; I498-R550 HydrophobicContact CD1-CG 4.43Å; F513-R550 HydrophobicContact CZ-CG 4.35Å; F538-R550 HydrophobicContact CD1-CB 4.4Å; E539-R550 PolarHBondContact O-NE 2.88Å; G540-R550 PolarHBondContact O-NH2 2.85Å; E548-R550 IonicContact OE2-CZ 3.76Å; E548-R550 IonicContact OE2-NH1 2.67Å; E548-R550 PolarHBondContact OE2-NH1 2.83Å; E548-R550 IonicContact OE2-NH2 2.8Å; E548-R550 PolarHBondContact OE2-NH2 2.93Å
551	T	91.9	Very high	94.3	Very high	90 Å²	90	39.8 Å²	39.8	55%	0.552	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	150.5	-179.4	54.1	0	0	0	0	111.1	K494 L549	K494-T551 WeakPolarHBondContact O-CA 3.45Å; L549-T551 HydrophobicContact CD1-CG2 4.43Å; L549-T551 HydrophobicContact CD2-CG2 4.25Å; L549-T551 HydrophobicContact CG-CG2 4.21Å
552	V	91.6	Very high	94.4	Very high	12 Å²	12	39.5 Å²	39.5	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.8	175	-67	0	0	0	0	109.2	K494 F496 L515 F538 L555	K494-V552 WeakPolarHBondContact O-CG2 3.47Å; K494-V552 PolarHBondContact O-N 3.21Å; K494-V552 VanDerWaalsContact O-O 3.13Å; F496-V552 HydrophobicContact CE1-CG1 4.03Å; L515-V552 HydrophobicContact CD2-CG1 3.83Å; F538-V552 HydrophobicContact CE1-CG1 3.74Å; F538-V552 HydrophobicContact CZ-CG1 3.61Å; V552-L555 HydrophobicContact CG2-CD1 4.15Å; V552-L555 HydrophobicContact CG2-CG 4.22Å
553	E	89.3	Confident	94.5	Very high	167 Å²	167	37.5 Å²	37.5	78%	0.78	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	142.6	163.9	-68.4	-176.8	173.7	0	0	108.4	L555	E553-L555 WeakPolarHBondContact O-CG 3.31Å; E553-L555 PolarHBondContact O-N 3.25Å; E553-L555 VanDerWaalsContact O-N 3.07Å
554	P	91.1	Very high	94.6	Very high	79 Å²	79	36.3 Å²	36.3	51%	0.513	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	117.9	-174.7	-26.2	34.3	0	0	0	112	L492	L492-P554 HydrophobicContact CD1-CB 3.64Å; L492-P554 HydrophobicContact CD2-CB 4.06Å; L492-P554 HydrophobicContact CG-CB 3.89Å
555	L	92.4	Very high	94.5	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.11	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118	179	-57.8	178.8	0	0	0	108.6	V493 L515 Y517 V527 V552 E553 T557	V493-L555 PolarHBondContact N-O 2.96Å; V493-L555 PolarHBondContact O-N 2.81Å; L515-L555 HydrophobicContact CD2-CD1 4.1Å; Y517-L555 HydrophobicContact CD1-CD1 4.02Å; Y517-L555 HydrophobicContact CE1-CD2 4.33Å; Y517-L555 HydrophobicContact CG-CD1 4.24Å; V527-L555 HydrophobicContact CG2-CD1 3.82Å; V552-L555 HydrophobicContact CG2-CD1 4.15Å; V552-L555 HydrophobicContact CG2-CG 4.22Å; E553-L555 WeakPolarHBondContact O-CG 3.31Å; E553-L555 PolarHBondContact O-N 3.25Å; E553-L555 VanDerWaalsContact O-N 3.07Å; L555-T557 HydrophobicContact CB-CG2 4.22Å; L555-T557 PolarHBondContact O-N 2.93Å
556	L	94.4	Very high	94.4	Very high	83 Å²	83	44.5 Å²	44.5	44%	0.435	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	103.4	167.6	-177.1	62.6	0	0	0	108.2	E490 I583	E490-L556 HydrophobicContact CB-CD1 4.23Å; L556-I583 HydrophobicContact CD1-CD1 3.65Å; L556-I583 HydrophobicContact CD1-CG1 3.86Å
557	T	94.9	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	156.6	-173.3	-168.4	0	0	0	0	112.6	K491 V493 S518 N519 L555 F559 I560	K491-T557 PolarHBondContact N-O 3.2Å; K491-T557 PolarHBondContact O-N 2.91Å; K491-T557 VanDerWaalsContact O-O 3.13Å; V493-T557 HydrophobicContact CB-CG2 4.43Å; V493-T557 HydrophobicContact CG2-CG2 3.91Å; S518-T557 PolarHBondContact N-OG1 2.92Å; S518-T557 PolarHBondContact O-OG1 3.37Å; N519-T557 VanDerWaalsContact OD1-CA 3.27Å; N519-T557 WeakPolarHBondContact OD1-CA 3.48Å; N519-T557 PolarHBondContact OD1-OG1 2.84Å; L555-T557 HydrophobicContact CB-CG2 4.22Å; L555-T557 PolarHBondContact O-N 2.93Å; T557-F559 PolarHBondContact OG1-O 3.03Å; T557-I560 HydrophobicContact CG2-CD1 3.7Å; T557-I560 HydrophobicContact CG2-CG1 4.09Å
558	R	94.9	Very high	94.2	Very high	84 Å²	84	45.7 Å²	45.7	32%	0.317	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-42.7	172.2	175	175.5	165.1	174.3	-1	112	D486 L487 G488 E490 S518	D486-R558 VanDerWaalsContact OD1-CG 3.24Å; D486-R558 WeakPolarHBondContact OD1-CG 3.44Å; D486-R558 IonicContact OD1-CZ 3.45Å; D486-R558 IonicContact OD1-NE 3.99Å; D486-R558 PolarHBondContact OD1-NE 2.8Å; D486-R558 IonicContact OD1-NH2 3.22Å; D486-R558 IonicContact OD2-CZ 3.49Å; D486-R558 IonicContact OD2-NE 2.91Å; D486-R558 IonicContact OD2-NH2 2.79Å; D486-R558 PolarHBondContact OD2-NH2 2.97Å; L487-R558 VanDerWaalsContact CB-O 3.23Å; L487-R558 WeakPolarHBondContact CB-O 3.43Å; L487-R558 VanDerWaalsContact CG-O 3.24Å; L487-R558 WeakPolarHBondContact CG-O 3.45Å; L487-R558 PolarHBondContact N-O 3.02Å; G488-R558 VanDerWaalsContact O-CZ 3.22Å; G488-R558 PolarHBondContact O-NE 2.95Å; G488-R558 PolarHBondContact O-NH1 2.89Å; E490-R558 HydrophobicContact CG-CB 4.44Å; S518-R558 PolarHBondContact O-N 2.68Å
559	F	96.8	Very high	94	Very high	21 Å²	21	50.4 Å²	50.4	9%	0.092	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.7	-178.8	-58.2	-92.5	0	0	0	110.9	V485 D486 Y517 S518 W524 T557	V485-F559 WeakPolarHBondContact O-CA 3.36Å; D486-F559 HydrophobicContact CB-CD1 3.72Å; D486-F559 HydrophobicContact CB-CE1 3.55Å; D486-F559 WeakPolarHBondContact OD2-CE1 2.97Å; Y517-F559 VanDerWaalsContact CA-O 3.31Å; Y517-F559 WeakPolarHBondContact CA-O 3.31Å; S518-F559 PolarHBondContact N-O 3.47Å; S518-F559 VanDerWaalsContact N-O 3.08Å; S518-F559 WeakPolarHBondContact O-CA 3.29Å; S518-F559 WeakPolarHBondContact O-CB 3.41Å; S518-F559 WeakPolarHBondContact O-CD2 3.26Å; S518-F559 PolarHBondContact O-N 2.92Å; W524-F559 HydrophobicContact CH2-CB 3.67Å; W524-F559 HydrophobicContact CZ2-CB 4.32Å; W524-F559 HydrophobicContact CZ3-CB 4.31Å; T557-F559 PolarHBondContact OG1-O 3.03Å
560	I	97.6	Very high	93.9	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140	172.6	-67.8	-83	0	0	0	108.2	Q484 V485 V493 L515 G516 T557 L578	Q484-I560 CarbonylContact C-O 3.57Å; Q484-I560 WeakPolarHBondContact CA-O 3.28Å; V485-I560 PolarHBondContact N-O 3.42Å; V485-I560 PolarHBondContact O-N 3.19Å; V493-I560 HydrophobicContact CB-CD1 4.3Å; V493-I560 HydrophobicContact CG1-CD1 4.01Å; V493-I560 HydrophobicContact CG2-CD1 4.19Å; V493-I560 HydrophobicContact CG2-CG1 4.32Å; L515-I560 HydrophobicContact CD1-CG2 3.66Å; G516-I560 CarbonylContact O-C 3.53Å; T557-I560 HydrophobicContact CG2-CD1 3.7Å; T557-I560 HydrophobicContact CG2-CG1 4.09Å; I560-L578 HydrophobicContact CB-CD1 4.36Å; I560-L578 HydrophobicContact CG1-CD1 4.26Å; I560-L578 HydrophobicContact CG2-CD2 4.17Å
561	R	96.8	Very high	93.7	Very high	38 Å²	38	48.1 Å²	48.1	14%	0.143	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.4	168.7	-90.4	178.7	-174.7	173.9	6.5	112.1	W482 L483 Q484 G516 W524 Y563	W482-R561 HydrophobicContact CB-CB 4.45Å; W482-R561 HydrophobicContact CB-CG 4.21Å; W482-R561 HydrophobicContact CD2-CG 4.27Å; W482-R561 HydrophobicContact CE3-CG 4.03Å; W482-R561 HydrophobicContact CG-CG 4.38Å; L483-R561 CarbonylContact O-C 3.59Å; L483-R561 VanDerWaalsContact O-CA 3.28Å; L483-R561 WeakPolarHBondContact O-CA 3.44Å; Q484-R561 HydrophobicContact CB-CG 3.63Å; Q484-R561 HydrophobicContact CG-CG 4.01Å; G516-R561 PolarHBondContact N-O 2.94Å; G516-R561 PolarHBondContact O-N 3.38Å; W524-R561 HydrophobicContact CE3-CB 4.15Å; W524-R561 HydrophobicContact CE3-CG 4.24Å; W524-R561 HydrophobicContact CH2-CB 4.02Å; W524-R561 VanDerWaalsContact CH2-CD 3.45Å; W524-R561 HydrophobicContact CH2-CG 3.39Å; W524-R561 HydrophobicContact CZ2-CG 4.02Å; W524-R561 VanDerWaalsContact CZ2-CZ 3.45Å; W524-R561 HydrophobicContact CZ3-CB 3.59Å; W524-R561 HydrophobicContact CZ3-CG 3.53Å; R561-Y563 HydrophobicContact CB-CD2 4.17Å; R561-Y563 HydrophobicContact CB-CE2 3.47Å; R561-Y563 VanDerWaalsContact CB-CE2 3.47Å; R561-Y563 WeakPolarHBondContact CD-OH 3.48Å
562	I	97.1	Very high	93.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	116.3	170.7	-59.9	-69.8	0	0	0	108.7	W482 L483 F496 M510 F513 L515 P564 L574 L576	W482-I562 WeakPolarHBondContact CA-O 3.47Å; L483-I562 PolarHBondContact N-O 3.06Å; L483-I562 PolarHBondContact O-N 2.73Å; F496-I562 HydrophobicContact CD2-CD1 4.45Å; F496-I562 HydrophobicContact CE2-CD1 4.36Å; M510-I562 HydrophobicContact CE-CG2 3.88Å; M510-I562 HydrophobicContact SD-CG2 3.97Å; F513-I562 HydrophobicContact CB-CG2 4.34Å; F513-I562 HydrophobicContact CD2-CD1 4.13Å; F513-I562 HydrophobicContact CD2-CG2 3.9Å; F513-I562 HydrophobicContact CE2-CD1 4Å; F513-I562 HydrophobicContact CG-CG2 4.3Å; L515-I562 HydrophobicContact CD1-CD1 3.42Å; L515-I562 VanDerWaalsContact CD1-CD1 3.42Å; L515-I562 HydrophobicContact CD1-CG1 4.47Å; I562-P564 VanDerWaalsContact O-CD 3.31Å; I562-P564 WeakPolarHBondContact O-CD 3.39Å; I562-L574 HydrophobicContact CB-CD2 4.31Å; I562-L574 HydrophobicContact CG2-CD2 3.81Å; I562-L576 HydrophobicContact CG1-CD2 4.05Å
563	Y	95.8	Very high	93.8	Very high	39 Å²	39	43.2 Å²	43.2	15%	0.153	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	98.1	178.2	-63.6	-87.4	0	0	0	110	E481 W482 F513 R514 R561	E481-Y563 WeakPolarHBondContact O-CD1 3.22Å; W482-Y563 HydrophobicContact CB-CD1 3.73Å; W482-Y563 HydrophobicContact CB-CE1 3.67Å; W482-Y563 HydrophobicContact CB-CG 4.41Å; W482-Y563 AromaticContact CD1-CE1 3.94Å; W482-Y563 HydrophobicContact CG-CD1 4.49Å; W482-Y563 HydrophobicContact CG-CE1 4.04Å; F513-Y563 CarbonylContact C-O 3.5Å; F513-Y563 WeakPolarHBondContact CA-O 3.34Å; F513-Y563 VanDerWaalsContact CB-O 3.26Å; F513-Y563 WeakPolarHBondContact CB-O 3.49Å; R514-Y563 PolarHBondContact N-O 2.78Å; R514-Y563 PolarHBondContact O-N 2.83Å; R561-Y563 HydrophobicContact CB-CD2 4.17Å; R561-Y563 HydrophobicContact CB-CE2 3.47Å; R561-Y563 VanDerWaalsContact CB-CE2 3.47Å; R561-Y563 WeakPolarHBondContact CD-OH 3.48Å
564	P	95.4	Very high	94.2	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.013	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	143	175.5	25	-34.4	0	0	0	110.9	W469 L471 F478 E481 M510 I562 M572	W469-P564 HydrophobicContact CH2-CG 3.84Å; W469-P564 HydrophobicContact CZ3-CG 4.11Å; L471-P564 HydrophobicContact CD1-CG 3.87Å; F478-P564 HydrophobicContact CB-CG 4.45Å; F478-P564 WeakPolarHBondContact CB-O 3.36Å; F478-P564 HydrophobicContact CD2-CB 4.24Å; E481-P564 HydrophobicContact CB-CG 3.99Å; E481-P564 WeakPolarHBondContact O-CD 3.29Å; M510-P564 HydrophobicContact CG-CB 4.23Å; M510-P564 HydrophobicContact SD-CB 3.81Å; I562-P564 VanDerWaalsContact O-CD 3.31Å; I562-P564 WeakPolarHBondContact O-CD 3.39Å; P564-M572 HydrophobicContact CB-CG 4.32Å
565	E	93.2	Very high	94.4	Very high	32 Å²	32	32 Å²	32	15%	0.15	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-42.9	171.9	-67.2	-159.4	163.7	0	0	111.9	P477 F478 K512 R514	P477-E565 WeakPolarHBondContact CA-O 3.01Å; P477-E565 WeakPolarHBondContact CB-O 2.97Å; F478-E565 PolarHBondContact N-O 2.04Å; K512-E565 HydrophobicContact CB-CB 4.26Å; K512-E565 PolarHBondContact O-N 3.48Å; R514-E565 WeakPolarHBondContact CD-OE1 3.22Å; R514-E565 HydrophobicContact CG-CG 4.47Å; R514-E565 WeakPolarHBondContact CG-OE1 3.38Å; R514-E565 IonicContact CZ-OE1 3.65Å; R514-E565 IonicContact NE-OE1 3.74Å; R514-E565 PolarHBondContact NE-OE1 3.28Å
566	R	93.8	Very high	94.6	Very high	153 Å²	153	31 Å²	31	58%	0.577	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.8	148.1	179.8	-63.7	-169	-178.9	-156.9	-1.3	110.7	K511 K512	K511-R566 WeakPolarHBondContact CA-O 3.48Å; K511-R566 HydrophobicContact CB-CB 4.38Å; K511-R566 PolarHBondContact N-O 2.74Å; K512-R566 HydrophobicContact CB-CB 4.25Å; K512-R566 PolarHBondContact N-O 2.75Å; K512-R566 VanDerWaalsContact N-O 3.13Å; K512-R566 PolarHBondContact O-N 3.2Å
567	A	94.4	Very high	94.7	Very high	17 Å²	17	27 Å²	27	14%	0.14	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	-165.9	178.5	0	0	0	0	0	112	F478 F509 K511 G571 M572	F478-A567 HydrophobicContact CE2-CB 3.79Å; F478-A567 HydrophobicContact CZ-CB 4.37Å; F509-A567 WeakPolarHBondContact O-CA 3.41Å; K511-A567 WeakPolarHBondContact CD-O 3.42Å; A567-G571 WeakPolarHBondContact CB-O 3.45Å; A567-M572 HydrophobicContact CB-CB 3.6Å; A567-M572 HydrophobicContact CB-CG 3.81Å
568	T	94	Very high	94.8	Very high	16 Å²	16	27 Å²	27	10%	0.098	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-75.6	161.6	172.6	67.7	0	0	0	0	111.2	F509 A570 G571	F509-T568 HydrophobicContact CD1-CG2 3.29Å; F509-T568 HydrophobicContact CD2-CG2 3.8Å; F509-T568 HydrophobicContact CE1-CG2 3.2Å; F509-T568 HydrophobicContact CE2-CG2 3.72Å; F509-T568 HydrophobicContact CG-CG2 3.6Å; F509-T568 HydrophobicContact CZ-CG2 3.43Å; F509-T568 VanDerWaalsContact CZ-CG2 3.43Å; F509-T568 PolarHBondContact O-N 2.81Å; T568-A570 PolarHBondContact O-N 2.77Å; T568-A570 VanDerWaalsContact O-N 3.14Å; T568-G571 PolarHBondContact N-O 3.02Å; T568-G571 PolarHBondContact O-N 3.46Å; T568-G571 VanDerWaalsContact O-N 3.08Å; T568-G571 PolarHBondContact OG1-O 3.29Å
569	P	91	Very high	94.7	Very high	118 Å²	118	23.1 Å²	23.1	77%	0.766	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.3	174.3	-24.1	35.2	0	0	0	114.2	P473	P473-P569 VanDerWaalsContact CB-O 3.31Å; P473-P569 WeakPolarHBondContact CB-O 3.33Å
570	A	90.5	Very high	94.4	Very high	35 Å²	35	22.2 Å²	22.2	29%	0.289	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11	178.6	0	0	0	0	0	113.2	N506 V508 T568	N506-A570 HydrophobicContact CB-CB 4.16Å; V508-A570 HydrophobicContact CG1-CB 3.92Å; T568-A570 PolarHBondContact O-N 2.77Å; T568-A570 VanDerWaalsContact O-N 3.14Å
571	G	91.1	Very high	93.8	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.01	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	132.8	-172.6	-178.1	0	0	0	0	0	112.9	L471 A567 T568	L471-G571 WeakPolarHBondContact O-CA 3.44Å; A567-G571 WeakPolarHBondContact CB-O 3.45Å; T568-G571 PolarHBondContact N-O 3.02Å; T568-G571 PolarHBondContact O-N 3.46Å; T568-G571 VanDerWaalsContact O-N 3.08Å; T568-G571 PolarHBondContact OG1-O 3.29Å
572	M	92.7	Very high	93.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.7	175.9	-163.6	-75.3	-63.7	0	0	109.3	W469 T470 L471 F478 M510 P564 A567 L574	W469-M572 HydrophobicContact CD2-CE 3.61Å; W469-M572 HydrophobicContact CE3-CE 3.31Å; W469-M572 HydrophobicContact CE3-SD 4.4Å; W469-M572 HydrophobicContact CG-CE 4.34Å; W469-M572 HydrophobicContact CH2-CE 4Å; W469-M572 HydrophobicContact CZ2-CE 4.24Å; W469-M572 HydrophobicContact CZ3-CE 3.53Å; T470-M572 WeakPolarHBondContact CA-O 3.28Å; T470-M572 WeakPolarHBondContact CB-O 3.36Å; L471-M572 HydrophobicContact CB-CB 3.86Å; L471-M572 HydrophobicContact CB-CE 4.11Å; L471-M572 HydrophobicContact CD1-CE 3.55Å; L471-M572 HydrophobicContact CG-CB 4.49Å; L471-M572 HydrophobicContact CG-CE 3.51Å; L471-M572 PolarHBondContact N-O 2.87Å; L471-M572 VanDerWaalsContact N-O 3.14Å; L471-M572 PolarHBondContact O-N 3.16Å; F478-M572 HydrophobicContact CE2-CB 4.29Å; F478-M572 HydrophobicContact CZ-CB 4.15Å; M510-M572 HydrophobicContact CB-CG 4.2Å; M510-M572 HydrophobicContact CB-SD 4.16Å; P564-M572 HydrophobicContact CB-CG 4.32Å; A567-M572 HydrophobicContact CB-CB 3.6Å; A567-M572 HydrophobicContact CB-CG 3.81Å; M572-L574 HydrophobicContact CE-CB 4.44Å; M572-L574 HydrophobicContact SD-CB 3.82Å
573	G	93.6	Very high	92.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	135.8	169.2	0	0	0	0	0	108.7	W469 F509 M510	W469-G573 CarbonylContact O-C 3.47Å; W469-G573 VanDerWaalsContact O-CA 3.29Å; W469-G573 WeakPolarHBondContact O-CA 3.24Å; F509-G573 WeakPolarHBondContact CA-O 3.4Å; M510-G573 PolarHBondContact N-O 2.83Å
574	L	95.8	Very high	90.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	126.2	178.6	-178.2	61.3	0	0	0	111.4	G468 W469 L483 I498 Q499 M510 I562 M572	G468-L574 CarbonylContact C-O 3.56Å; G468-L574 WeakPolarHBondContact CA-O 3.17Å; W469-L574 HydrophobicContact CE3-CB 4.09Å; W469-L574 HydrophobicContact CE3-CD2 3.9Å; W469-L574 HydrophobicContact CZ3-CD2 4.18Å; W469-L574 PolarHBondContact N-O 3.05Å; W469-L574 PolarHBondContact O-N 3.33Å; L483-L574 HydrophobicContact CD2-CD2 4Å; I498-L574 HydrophobicContact CB-CD1 3.9Å; I498-L574 HydrophobicContact CG2-CD1 3.86Å; Q499-L574 CarbonylContact O-C 3.56Å; Q499-L574 WeakPolarHBondContact O-CA 3.42Å; M510-L574 HydrophobicContact CE-CD1 3.91Å; M510-L574 HydrophobicContact CE-CD2 4.25Å; M510-L574 HydrophobicContact SD-CD2 4.45Å; I562-L574 HydrophobicContact CB-CD2 4.31Å; I562-L574 HydrophobicContact CG2-CD2 3.81Å; M572-L574 HydrophobicContact CE-CB 4.44Å; M572-L574 HydrophobicContact SD-CB 3.82Å
575	R	96.6	Very high	88.2	Confident	10 Å²	10	40 Å²	40	4%	0.038	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.3	159	-66.6	170.7	-73.7	174.5	1.2	108.2	A460 S465 Q499 G500 Y544	A460-R575 CarbonylContact O-C 3.54Å; A460-R575 VanDerWaalsContact O-CA 3.32Å; A460-R575 WeakPolarHBondContact O-CA 3.34Å; S465-R575 WeakPolarHBondContact O-CD 2.97Å; S465-R575 PolarHBondContact O-NH1 2.91Å; Q499-R575 HydrophobicContact CB-CB 4.19Å; Q499-R575 PolarHBondContact N-O 3.32Å; Q499-R575 PolarHBondContact O-N 3.18Å; G500-R575 PolarHBondContact O-NE 2.71Å; G500-R575 PolarHBondContact O-NH2 3.13Å; Y544-R575 PolarHBondContact O-NH2 2.99Å
576	L	96.9	Very high	85.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	142.4	-165.2	-178.3	67.5	0	0	0	111.8	M435 A460 L462 L483 V485 F496 I497 I498 I562 L578	M435-L576 WeakPolarHBondContact CB-O 3.38Å; M435-L576 WeakPolarHBondContact CG-O 3.39Å; A460-L576 PolarHBondContact O-N 2.9Å; L462-L576 PolarHBondContact N-O 3.2Å; L483-L576 HydrophobicContact CD2-CD2 4.15Å; V485-L576 HydrophobicContact CG2-CD2 4.05Å; F496-L576 HydrophobicContact CB-CD1 4.09Å; F496-L576 HydrophobicContact CD2-CD1 4.26Å; I497-L576 WeakPolarHBondContact O-CA 2.98Å; I498-L576 HydrophobicContact CG2-CD1 4.01Å; I562-L576 HydrophobicContact CG1-CD2 4.05Å; L576-L578 HydrophobicContact CD1-CD2 4.43Å; L576-L578 HydrophobicContact CD2-CD2 4.3Å; L576-L578 HydrophobicContact CG-CD2 4.44Å
577	E	96.5	Very high	82.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.8	159.7	176.7	59.6	-90.4	0	0	109.1	M432 L433 G434 M435 V436 L462 F496 I497 L579	M432-E577 HydrophobicContact CB-CG 4.1Å; M432-E577 HydrophobicContact CG-CG 3.92Å; M432-E577 HydrophobicContact SD-CG 4.23Å; L433-E577 PolarHBondContact N-OE1 2.88Å; G434-E577 PolarHBondContact N-OE1 3.39Å; M435-E577 HydrophobicContact CB-CB 4.41Å; M435-E577 PolarHBondContact N-OE1 2.63Å; M435-E577 PolarHBondContact N-OE2 3.24Å; M435-E577 VanDerWaalsContact N-OE2 3.13Å; V436-E577 WeakPolarHBondContact CB-OE2 3.3Å; V436-E577 HydrophobicContact CG2-CB 4.24Å; V436-E577 HydrophobicContact CG2-CG 4.19Å; V436-E577 WeakPolarHBondContact CG2-OE2 3.48Å; V436-E577 PolarHBondContact N-OE2 3.01Å; L462-E577 HydrophobicContact CB-CB 3.97Å; L462-E577 HydrophobicContact CD2-CB 3.72Å; L462-E577 HydrophobicContact CG-CB 4.48Å; F496-E577 CarbonylContact C-O 3.46Å; F496-E577 WeakPolarHBondContact CA-O 3.2Å; F496-E577 WeakPolarHBondContact CB-O 3.25Å; I497-E577 HydrophobicContact CB-CB 4.41Å; I497-E577 PolarHBondContact N-O 2.81Å; I497-E577 PolarHBondContact O-N 2.83Å; E577-L579 HydrophobicContact CG-CD2 4.3Å
578	L	95.6	Very high	79.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.8	176.8	-61.2	176.2	0	0	0	109.6	L433 V485 L487 F496 I560 L576	L433-L578 HydrophobicContact CB-CB 4.17Å; L433-L578 HydrophobicContact CD1-CB 3.97Å; L433-L578 HydrophobicContact CG-CB 4.37Å; L433-L578 PolarHBondContact N-O 2.94Å; V485-L578 HydrophobicContact CB-CD1 3.91Å; V485-L578 HydrophobicContact CG1-CD1 3.71Å; V485-L578 HydrophobicContact CG2-CD1 4.34Å; L487-L578 HydrophobicContact CD2-CD1 3.71Å; F496-L578 HydrophobicContact CB-CD2 3.79Å; I560-L578 HydrophobicContact CB-CD1 4.36Å; I560-L578 HydrophobicContact CG1-CD1 4.26Å; I560-L578 HydrophobicContact CG2-CD2 4.17Å; L576-L578 HydrophobicContact CD1-CD2 4.43Å; L576-L578 HydrophobicContact CD2-CD2 4.3Å; L576-L578 HydrophobicContact CG-CD2 4.44Å
579	L	93.6	Very high	77.1	Confident	2 Å²	2	55 Å²	55	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.4	179.3	-57.1	-174.3	0	0	0	110.9	I424 G431 M432 K494 G495 I497 L549 E577	I424-L579 HydrophobicContact CG2-CD1 3.73Å; I424-L579 HydrophobicContact CG2-CD2 4.23Å; G431-L579 CarbonylContact O-C 3.5Å; G431-L579 VanDerWaalsContact O-CA 3.3Å; G431-L579 WeakPolarHBondContact O-CA 3.33Å; M432-L579 HydrophobicContact CG-CD2 3.93Å; K494-L579 PolarHBondContact N-O 3.47Å; G495-L579 PolarHBondContact N-O 2.82Å; G495-L579 VanDerWaalsContact N-O 3.16Å; G495-L579 PolarHBondContact O-N 3.15Å; I497-L579 HydrophobicContact CD1-CD1 4.09Å; I497-L579 HydrophobicContact CD1-CD2 4.07Å; I497-L579 HydrophobicContact CD1-CG 4.35Å; I497-L579 HydrophobicContact CG1-CD1 4.04Å; I497-L579 HydrophobicContact CG1-CG 4.31Å; L549-L579 HydrophobicContact CD1-CD1 3.49Å; L549-L579 VanDerWaalsContact CD1-CD1 3.49Å; E577-L579 HydrophobicContact CG-CD2 4.3Å
580	G	90.2	Very high	74.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-160.1	-178	0	0	0	0	0	114.4	C429 G431 L492	C429-G580 CarbonylContact C-O 3.52Å; C429-G580 VanDerWaalsContact SG-C 3.56Å; G431-G580 PolarHBondContact N-O 2.98Å; G431-G580 PolarHBondContact O-N 3.47Å; L492-G580 CarbonylContact O-C 3.56Å; L492-G580 WeakPolarHBondContact O-CA 2.94Å
581	C	86.4	Confident	72.1	Confident	28 Å²	28	59.7 Å²	59.7	19%	0.189	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	165.1	175.6	57.4	0	0	0	0	110.8	C429 L492	C429-C581 HydrophobicContact CB-CB 3.94Å; C429-C581 WeakPolarHBondContact CB-SG 3.34Å; C429-C581 WeakPolarHBondContact SG-CB 3.1Å; C429-C581 PolarHBondContact SG-N 3.06Å; C429-C581 CovalentContact SG-SG 2.04Å; C429-C581 PolarHBondContact SG-SG 2.89Å; L492-C581 WeakPolarHBondContact CB-O 3.18Å; L492-C581 PolarHBondContact N-O 3.34Å; L492-C581 PolarHBondContact O-N 3.22Å
582	E	81.9	Confident	69.4	Low	107 Å²	107	65.7 Å²	65.7	50%	0.5	38%	0.379	S	S	.	.			trans	-72.8	158.8	172	-66.1	-173.1	179.9	0	0	111.5	E584	E582-E584 PolarHBondContact O-N 3.13Å
583	I	77.8	Confident	66.8	Low	102 Å²	102	71.2 Å²	71.2	52%	0.523	42%	0.415	S	S	.	.			trans	-70.8	109.5	176.2	-51.5	169.4	0	0	0	107.4	L556 A585	L556-I583 HydrophobicContact CD1-CD1 3.65Å; L556-I583 HydrophobicContact CD1-CG1 3.86Å; I583-A585 PolarHBondContact O-N 3.02Å; I583-A585 VanDerWaalsContact O-N 3.14Å
584	E	62.9	Low	64	Low	141 Å²	141	75.4 Å²	75.4	66%	0.659	45%	0.449	S	S	*	.			trans	-66.9	115	168.7	-66.1	-170.9	167.2	0	0	107.9	K179 E582	K179-E584 IonicContact NZ-OE1 3.16Å; K179-E584 PolarHBondContact NZ-OE1 3.39Å; E582-E584 PolarHBondContact O-N 3.13Å
585	A	43.2	Very low	60.9	Low	78 Å²	78	81.5 Å²	81.5	65%	0.645	49%	0.489	S	S	*	.			trans	-54.5	135.4	168.3	0	0	0	0	0	107.8	I583 T587	I583-A585 PolarHBondContact O-N 3.02Å; I583-A585 VanDerWaalsContact O-N 3.14Å; A585-T587 PolarHBondContact O-N 3.29Å
586	P	38.5	Very low	57.7	Low	110 Å²	110	86.2 Å²	86.2	71%	0.714	52%	0.523	S	S	*	.			trans	-58.7	109.4	177.4	21.9	-30.1	0	0	0	108	F588	P586-F588 PolarHBondContact O-N 3.48Å
587	T	34.9	Very low	54.6	Low	134 Å²	134	92.7 Å²	92.7	82%	0.822	56%	0.563	S	S	*	*			trans	-62.9	105.7	168.2	39	0	0	0	0	106	A585	A585-T587 PolarHBondContact O-N 3.29Å
588	F	33.9	Very low	51.3	Low	185 Å²	185	99 Å²	99	81%	0.811	60%	0.602	S	S	*	*			trans	-53.2	130.8	165.6	-73.2	-81.1	0	0	0	106.9	P586	P586-F588 PolarHBondContact O-N 3.48Å
589	P	36.7	Very low	48.2	Very low	102 Å²	102	104.7 Å²	104.7	66%	0.662	64%	0.639	S	S	*	*			trans	-54.2	143.1	177.6	21.5	-31.2	0	0	0	108.8	T591	P589-T591 PolarHBondContact O-N 2.75Å
590	P	37.9	Very low	45.3	Very low	121 Å²	121	109.5 Å²	109.5	79%	0.786	67%	0.672	S	S	*	*			trans	-54.7	116	179.9	21	-30.2	0	0	0	107.9	T592	P590-T592 PolarHBondContact O-N 2.72Å
591	T	36.6	Very low	42.4	Very low	132 Å²	132	117.5 Å²	117.5	81%	0.81	72%	0.715	S	S	*	*			trans	-63.3	111.4	173.2	-50.3	0	0	0	0	105.4	P589 P593	P589-T591 PolarHBondContact O-N 2.75Å; T591-P593 VanDerWaalsContact O-CD 3.25Å; T591-P593 WeakPolarHBondContact O-CD 3.35Å; T591-P593 VanDerWaalsContact O-N 3.13Å
592	T	36.4	Very low	39.7	Very low	127 Å²	127	124.9 Å²	124.9	78%	0.779	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-53.4	117.4	179.6	-39	0	0	0	0	108.3	P590 A594	P590-T592 PolarHBondContact O-N 2.72Å; T592-A594 PolarHBondContact O-N 3.04Å
593	P	37	Very low	37.3	Very low	116 Å²	116	126 Å²	126	75%	0.753	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.1	171	-13.8	28.6	0	0	0	108	T591	T591-P593 VanDerWaalsContact O-CD 3.25Å; T591-P593 WeakPolarHBondContact O-CD 3.35Å; T591-P593 VanDerWaalsContact O-N 3.13Å
594	A	35.2	Very low	35	Very low	87 Å²	87	129 Å²	129	72%	0.719	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-55.5	144.8	170.9	0	0	0	0	0	110.1	T592 S596	T592-A594 PolarHBondContact O-N 3.04Å; A594-S596 PolarHBondContact O-N 2.95Å; A594-S596 VanDerWaalsContact O-N 3.11Å
595	P	30.8	Very low	33.9	Very low	128 Å²	128	129.7 Å²	129.7	83%	0.831	79%	0.79	S	S	*	*			trans	-68.1	114	-176.1	26.6	-31.5	0	0	0	110.2	T597	P595-T597 PolarHBondContact O-N 2.87Å
596	S	29.4	Very low	33.5	Very low	109 Å²	109	133 Å²	133	76%	0.762	80%	0.797	S	S	*	*			trans	-77.3	115.1	165.8	55.8	0	0	0	0	109	A594 T598	A594-S596 PolarHBondContact O-N 2.95Å; A594-S596 VanDerWaalsContact O-N 3.11Å; S596-T598 PolarHBondContact O-N 3.02Å
597	T	30.4	Very low	33.3	Very low	136 Å²	136	136.2 Å²	136.2	83%	0.834	80%	0.802	S	S	*	*			trans	-62.2	114.6	168.4	46.2	0	0	0	0	110.2	P595	P595-T597 PolarHBondContact O-N 2.87Å
598	T	28.6	Very low	33.1	Very low	134 Å²	134	134.5 Å²	134.5	82%	0.822	80%	0.802	S	S	*	*			trans	-68	142.9	160.9	22	0	0	0	0	110.3	S596	S596-T598 PolarHBondContact O-N 3.02Å
599	P	30.8	Very low	33	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	80%	0.798	S	S	*	*			trans	-105.5	137.2	136.7	-3.1	22.6	0	0	0	109.5
600	S	31	Very low	32.6	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	80%	0.798	S	S	*	*			trans	-62.2	135.5	171.6	45.4	0	0	0	0	112.7
601	D	29.6	Very low	32.2	Very low	170 Å²	170	133.1 Å²	133.1	91%	0.909	80%	0.799	S	S	*	*			trans	-97.2	108.8	158.6	-81.5	-28	0	0	0	109
602	E	29.6	Very low	32.3	Very low	183 Å²	183	132.8 Å²	132.8	86%	0.855	80%	0.802	S	S	*	*			trans	-78.3	136.6	158	-75.8	177.5	146.9	0	0	108.3
603	C	31.7	Very low	32	Very low	129 Å²	129	130.5 Å²	130.5	87%	0.872	80%	0.804	S	S	*	*			trans	-75.8	134.3	169.5	-64.4	0	0	0	0	110
604	D	30.5	Very low	31.8	Very low	167 Å²	167	132.2 Å²	132.2	89%	0.893	81%	0.813	S	S	*	*			trans	-127.6	128.3	157.4	-102.3	-24.9	0	0	0	110.1
605	D	39	Very low	31.4	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	82%	0.817	S	S	*	*			trans	-64.7	132.4	170.6	-96.9	-40.7	0	0	0	110.3
606	D	35.6	Very low	31.2	Very low	148 Å²	148	129.1 Å²	129.1	79%	0.791	81%	0.812	S	S	*	*			trans	-178.5	131.7	132.9	-95.5	-29.8	0	0	0	112.9
607	Q	34.3	Very low	31.1	Very low	176 Å²	176	130.3 Å²	130.3	82%	0.822	82%	0.815	S	S	*	*			trans	83.6	96.7	156.4	-63.1	174.3	12.5	0	0	120.9
608	A	30.8	Very low	30.8	Very low	98 Å²	98	130.4 Å²	130.4	81%	0.81	82%	0.816	S	S	*	*				55	117.6	121.3	0	0	0	0	0	122.2
609	S	30.6	Very low	30.8	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	82%	0.819	S	S	*	*				90.9	120.7	126.9	-153.2	0	0	0	0	121.3
610	C	27.8	Very low	30.7	Very low	95 Å²	95	132.8 Å²	132.8	64%	0.642	82%	0.82	S	S	*	*			trans	69.2	115.8	136.3	-78.9	0	0	0	0	121.4
611	H	30.9	Very low	30.4	Very low	178 Å²	178	137.1 Å²	137.1	82%	0.824	83%	0.829	S	S	*	*				154.9	145.9	82.6	-104.1	-47.8	0	0	0	112.4
612	S	38.3	Very low	30.3	Very low	125 Å²	125	135.2 Å²	135.2	87%	0.874	82%	0.824	S	S	*	*			trans	-63.6	147.3	169.4	-50.6	0	0	0	0	113.6
613	G	29.1	Very low	30.2	Very low	79 Å²	79	133.1 Å²	133.1	81%	0.814	82%	0.823	S	S	*	*			trans	-164.2	110.7	166.5	0	0	0	0	0	112.4
614	T	34.4	Very low	30	Very low	153 Å²	153	133.2 Å²	133.2	94%	0.939	82%	0.82	S	S	*	*			trans	-66.9	147.5	172.6	39.6	0	0	0	0	113.6
615	G	26.6	Very low	29.9	Very low	79 Å²	79	133.2 Å²	133.2	81%	0.814	82%	0.819	S	S	*	*			trans	160.5	100.8	160.7	0	0	0	0	0	112.2
616	G	27	Very low	29.4	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	82%	0.821	S	S	*	*			trans	-79.1	165	-178.4	0	0	0	0	0	114.3
617	T	26.2	Very low	29.1	Very low	135 Å²	135	134.7 Å²	134.7	83%	0.828	82%	0.822	S	S	*	*				173.2	155	122.8	27.9	0	0	0	0	111.1
618	T	25.2	Very low	28.9	Very low	137 Å²	137	133.1 Å²	133.1	84%	0.84	82%	0.819	S	S	*	*			trans	78	101.5	164.7	55.9	0	0	0	0	119.5
619	M	28.3	Very low	29.3	Very low	183 Å²	183	134 Å²	134	90%	0.901	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.7	144.1	152.6	-72.6	-81	-119.2	0	0	110.1
620	P	28	Very low	29.7	Very low	120 Å²	120	135.8 Å²	135.8	78%	0.779	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-96.5	157.8	156.7	26	-11.2	0	0	0	112.3
621	E	24.6	Very low	30.5	Very low	194 Å²	194	136 Å²	136	91%	0.907	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.8	147.6	-159	-68.9	156.4	140.7	0	0	116.8
622	T	26.6	Very low	31.3	Very low	130 Å²	130	129.7 Å²	129.7	80%	0.798	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-86.7	116.4	165.3	-48.1	0	0	0	0	109.4	T624	T622-T624 PolarHBondContact O-N 2.9Å
623	T	27.7	Very low	32	Very low	138 Å²	138	126.2 Å²	126.2	85%	0.847	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-69.6	118.7	163.4	34.4	0	0	0	0	110
624	T	27.3	Very low	33	Very low	131 Å²	131	129.6 Å²	129.6	80%	0.804	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-74.7	121.6	175.4	38.4	0	0	0	0	111.1	T622	T622-T624 PolarHBondContact O-N 2.9Å
625	L	29.1	Very low	34.2	Very low	167 Å²	167	125.2 Å²	125.2	87%	0.874	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-80.3	125.7	158.6	-75.7	166.8	0	0	0	107.8	V627	L625-V627 PolarHBondContact O-N 2.84Å
626	K	28.2	Very low	36.3	Very low	199 Å²	199	121.7 Å²	121.7	87%	0.865	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-64.3	129.5	174.3	-76.7	-177.1	173.8	-176.2	0	109.5
627	V	30.8	Very low	39	Very low	136 Å²	136	120.7 Å²	120.7	82%	0.824	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-88.4	124.7	162.6	177.1	0	0	0	0	106.1	L625	L625-V627 PolarHBondContact O-N 2.84Å
628	D	29.4	Very low	41.9	Very low	142 Å²	142	114.4 Å²	114.4	76%	0.759	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-66.4	140.5	175.1	-68.6	-43.6	0	0	0	110.7
629	P	38.5	Very low	44.8	Very low	117 Å²	117	111.9 Å²	111.9	76%	0.76	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-74.5	143.5	178.4	29	-31	0	0	0	111.8
630	I	38.9	Very low	47.7	Very low	143 Å²	143	103.2 Å²	103.2	73%	0.733	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-55.7	133.1	174.1	-58.9	163.7	0	0	0	109.7
631	P	45.7	Very low	50.3	Low	99 Å²	99	98 Å²	98	64%	0.643	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-62.9	142.5	177.2	-20	30.9	0	0	0	112.4	F633	P631-F633 PolarHBondContact O-N 3.25Å
632	A	47.9	Very low	52.9	Low	46 Å²	46	95.3 Å²	95.3	38%	0.38	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	8.6	-176.1	0	0	0	0	0	115.9	W635	A632-W635 PolarHBondContact O-NE1 2.93Å
633	F	51.9	Low	55.2	Low	53 Å²	53	91.6 Å²	91.6	23%	0.232	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-19.9	-168.7	-115.8	-120.2	0	0	0	115.9	P631 W635 L713 V794 D796	P631-F633 PolarHBondContact O-N 3.25Å; F633-W635 VanDerWaalsContact C-N 3.33Å; F633-W635 PolarHBondContact O-N 3.19Å; F633-L713 HydrophobicContact CE2-CD2 3.7Å; F633-L713 HydrophobicContact CZ-CD2 4.21Å; F633-V794 HydrophobicContact CD1-CB 3.9Å; F633-V794 HydrophobicContact CE1-CB 3.2Å; F633-V794 HydrophobicContact CE1-CG1 3.47Å; F633-V794 VanDerWaalsContact CE1-CG1 3.47Å; F633-V794 HydrophobicContact CE1-CG2 4.32Å; F633-V794 WeakPolarHBondContact CE1-O 3.1Å; F633-V794 HydrophobicContact CE2-CB 4.05Å; F633-V794 HydrophobicContact CE2-CG1 3.79Å; F633-V794 HydrophobicContact CZ-CB 3.28Å; F633-V794 HydrophobicContact CZ-CG1 3Å; F633-V794 HydrophobicContact CZ-CG2 4.25Å; F633-D796 WeakPolarHBondContact CD1-OD2 3.46Å; F633-D796 HydrophobicContact CE1-CB 4.34Å; F633-D796 WeakPolarHBondContact CE1-OD1 3.48Å; F633-D796 WeakPolarHBondContact CE1-OD2 3.19Å; F633-D796 WeakPolarHBondContact CE2-OD1 3.26Å; F633-D796 VanDerWaalsContact CZ-CG 3.44Å; F633-D796 WeakPolarHBondContact CZ-OD1 3.1Å
634	L	51.3	Low	57.2	Low	149 Å²	149	92.8 Å²	92.8	78%	0.78	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.4	-172.6	-90.9	150.1	0	0	0	114.7
635	W	59.4	Low	59.4	Low	62 Å²	62	91.9 Å²	91.9	24%	0.235	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-7.6	-179.4	59.1	-96.6	0	0	0	114	A632 F633 P704 M705 V706	A632-W635 PolarHBondContact O-NE1 2.93Å; F633-W635 VanDerWaalsContact C-N 3.33Å; F633-W635 PolarHBondContact O-N 3.19Å; W635-P704 HydrophobicContact CD2-CB 4.48Å; W635-P704 HydrophobicContact CE3-CB 3.51Å; W635-P704 HydrophobicContact CE3-CG 3.45Å; W635-P704 VanDerWaalsContact CE3-CG 3.45Å; W635-P704 HydrophobicContact CH2-CB 4.06Å; W635-P704 WeakPolarHBondContact CH2-O 3.27Å; W635-P704 HydrophobicContact CZ3-CB 3.28Å; W635-P704 HydrophobicContact CZ3-CG 3.59Å; W635-P704 WeakPolarHBondContact CZ3-O 3.49Å; W635-M705 VanDerWaalsContact CH2-C 3.42Å; W635-M705 WeakPolarHBondContact CH2-O 3.34Å; W635-M705 VanDerWaalsContact CZ2-O 3.24Å; W635-M705 WeakPolarHBondContact CZ2-O 3.09Å; W635-V706 HydrophobicContact CH2-CB 4.37Å; W635-V706 HydrophobicContact CH2-CG2 3.8Å; W635-V706 HydrophobicContact CZ3-CG2 4.41Å
636	F	70.9	Confident	62	Low	4 Å²	4	87.5 Å²	87.5	2%	0.018	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-30.5	-179.6	-166.7	-79.6	0	0	0	112	W651 V706 V715 V773 I792 V794	F636-W651 HydrophobicContact CD1-CZ2 4.07Å; F636-W651 HydrophobicContact CE1-CH2 4.17Å; F636-W651 AromaticContact CE1-CZ2 3.75Å; F636-W651 HydrophobicContact CE1-CZ2 3.75Å; F636-W651 HydrophobicContact CE2-CZ2 4.31Å; F636-W651 AromaticContact CZ-CH2 3.98Å; F636-W651 HydrophobicContact CZ-CH2 3.98Å; F636-W651 AromaticContact CZ-CZ2 3.89Å; F636-W651 HydrophobicContact CZ-CZ2 3.89Å; F636-W651 PolarHBondContact O-NE1 2.79Å; F636-V706 HydrophobicContact CD2-CG2 3.86Å; F636-V706 HydrophobicContact CE2-CG2 3.75Å; F636-V715 HydrophobicContact CE1-CB 4.48Å; F636-V715 HydrophobicContact CE1-CG1 3.93Å; F636-V715 HydrophobicContact CE1-CG2 3.75Å; F636-V715 HydrophobicContact CZ-CG1 4.37Å; F636-V715 HydrophobicContact CZ-CG2 3.7Å; F636-V773 HydrophobicContact CE2-CB 4.1Å; F636-V773 HydrophobicContact CE2-CG2 3.84Å; F636-V773 HydrophobicContact CZ-CB 3.82Å; F636-V773 HydrophobicContact CZ-CG1 4.26Å; F636-V773 HydrophobicContact CZ-CG2 3.7Å; F636-I792 HydrophobicContact CE1-CG2 4.17Å; F636-V794 HydrophobicContact CB-CG2 4.11Å; F636-V794 HydrophobicContact CD1-CB 4.49Å; F636-V794 HydrophobicContact CD1-CG2 3.09Å; F636-V794 HydrophobicContact CD2-CG2 4.33Å; F636-V794 HydrophobicContact CE1-CG2 3.43Å; F636-V794 VanDerWaalsContact CE1-CG2 3.43Å; F636-V794 HydrophobicContact CG-CG2 3.59Å; F636-V794 HydrophobicContact CZ-CG2 4.19Å
637	A	82.1	Confident	64.8	Low	49 Å²	49	80.5 Å²	80.5	41%	0.405	45%	0.454	S	S	.	.			trans	-71.7	141.9	-179.1	0	0	0	0	0	112.5	I792 K793	A637-I792 CarbonylContact C-O 3.48Å; A637-I792 WeakPolarHBondContact CA-O 3.5Å; A637-K793 HydrophobicContact CB-CB 4.28Å
638	C	88.4	Confident	67.5	Low	3 Å²	3	76.5 Å²	76.5	2%	0.02	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-148.6	120.9	177.4	-165.6	0	0	0	0	113.6	F640 F648 C649 D791 I792	C638-F640 HydrophobicContact CB-CE1 4.46Å; C638-F640 WeakPolarHBondContact SG-CD1 2.98Å; C638-F640 VanDerWaalsContact SG-CE1 3.51Å; C638-F648 PolarHBondContact SG-O 2.95Å; C638-C649 WeakPolarHBondContact CA-SG 3.24Å; C638-C649 HydrophobicContact CB-CB 3.36Å; C638-C649 WeakPolarHBondContact CB-SG 3.44Å; C638-C649 WeakPolarHBondContact SG-CB 3.33Å; C638-C649 CovalentContact SG-SG 2.04Å; C638-C649 PolarHBondContact SG-SG 2.89Å; C638-D791 CarbonylContact O-C 3.55Å; C638-D791 WeakPolarHBondContact O-CA 3.31Å; C638-I792 HydrophobicContact CB-CB 4.41Å; C638-I792 HydrophobicContact CB-CD1 4.48Å; C638-I792 PolarHBondContact N-O 3.03Å; C638-I792 PolarHBondContact O-N 3Å
639	D	86.2	Confident	70.1	Confident	85 Å²	85	70.9 Å²	70.9	46%	0.455	40%	0.397	S	S	.	.			trans	-106.6	9.8	174.2	64.1	-8.4	0	0	0	112.4	G641	D639-G641 PolarHBondContact O-N 3.3Å; D639-G641 PolarHBondContact OD1-N 3.15Å
640	F	89.4	Confident	72.2	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	40%	0.396	C	S	.	.			trans	57.4	9	-179.9	-52.5	-73.3	0	0	0	117.6	C638 S647 F648 N684 I686 L701 I792	C638-F640 HydrophobicContact CB-CE1 4.46Å; C638-F640 WeakPolarHBondContact SG-CD1 2.98Å; C638-F640 VanDerWaalsContact SG-CE1 3.51Å; F640-S647 CarbonylContact C-O 3.6Å; F640-S647 WeakPolarHBondContact CA-O 3.25Å; F640-S647 PolarHBondContact O-N 3.41Å; F640-S647 VanDerWaalsContact O-N 3.16Å; F640-F648 HydrophobicContact CD1-CD1 4.16Å; F640-F648 HydrophobicContact CE1-CD1 4.02Å; F640-N684 HydrophobicContact CB-CB 4.17Å; F640-N684 WeakPolarHBondContact O-CB 3.36Å; F640-N684 PolarHBondContact O-ND2 2.01Å; F640-I686 HydrophobicContact CB-CG2 4.47Å; F640-I686 HydrophobicContact CD1-CB 4.45Å; F640-I686 HydrophobicContact CD1-CG2 3.32Å; F640-I686 HydrophobicContact CD2-CG1 4.38Å; F640-I686 HydrophobicContact CD2-CG2 4.22Å; F640-I686 HydrophobicContact CE1-CB 4.28Å; F640-I686 HydrophobicContact CE1-CD1 3.79Å; F640-I686 HydrophobicContact CE1-CG1 3.95Å; F640-I686 HydrophobicContact CE1-CG2 3.43Å; F640-I686 VanDerWaalsContact CE1-CG2 3.43Å; F640-I686 HydrophobicContact CE2-CD1 4.21Å; F640-I686 HydrophobicContact CE2-CG1 3.8Å; F640-I686 HydrophobicContact CE2-CG2 4.31Å; F640-I686 HydrophobicContact CG-CG2 3.74Å; F640-I686 HydrophobicContact CZ-CB 4.32Å; F640-I686 HydrophobicContact CZ-CD1 3.46Å; F640-I686 VanDerWaalsContact CZ-CD1 3.46Å; F640-I686 HydrophobicContact CZ-CG1 3.54Å; F640-I686 HydrophobicContact CZ-CG2 3.93Å; F640-L701 HydrophobicContact CE1-CD2 4.09Å; F640-L701 HydrophobicContact CZ-CD2 4.23Å; F640-I792 HydrophobicContact CE1-CD1 4.5Å; F640-I792 HydrophobicContact CE2-CD1 4.23Å; F640-I792 HydrophobicContact CE2-CG1 4.45Å; F640-I792 HydrophobicContact CZ-CD1 3.59Å; F640-I792 HydrophobicContact CZ-CG1 4.28Å
641	G	82.1	Confident	74.6	Confident	10 Å²	10	68.2 Å²	68.2	10%	0.103	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.9	-162.7	173.8	0	0	0	0	0	115.1	D639 N684	D639-G641 PolarHBondContact O-N 3.3Å; D639-G641 PolarHBondContact OD1-N 3.15Å; G641-N684 VanDerWaalsContact C-ND2 3.34Å; G641-N684 PolarHBondContact O-N 3.26Å; G641-N684 PolarHBondContact O-ND2 3.28Å
642	W	79.9	Confident	76.6	Confident	139 Å²	139	67.3 Å²	67.3	53%	0.527	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	167.8	-175.1	-59.9	98.8	0	0	0	111.3	N644 D645 N684	W642-N644 PolarHBondContact O-N 2.82Å; W642-D645 PolarHBondContact N-O 2.69Å; W642-D645 CarbonylContact O-C 3.47Å; W642-D645 PolarHBondContact O-N 3.23Å; W642-N684 PolarHBondContact N-ND2 3.07Å; W642-N684 PolarHBondContact O-ND2 2.89Å
643	P	73.1	Confident	78.2	Confident	51 Å²	51	67.2 Å²	67.2	33%	0.331	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.3	-172.1	-20.2	36.6	0	0	0	112.3	S682 N684	P643-S682 WeakPolarHBondContact CD-O 3.21Å; P643-S682 WeakPolarHBondContact CG-O 3.1Å; P643-N684 WeakPolarHBondContact CA-OD1 3.39Å
644	N	70.4	Confident	79.5	Confident	163 Å²	163	68.6 Å²	68.6	87%	0.872	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-7	178.4	-57.7	-27.8	0	0	0	112.9	W642	W642-N644 PolarHBondContact O-N 2.82Å
645	D	73.1	Confident	80.3	Confident	113 Å²	113	63.9 Å²	63.9	60%	0.604	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.5	70.1	179.5	-170.1	24.5	0	0	0	111.3	W642	W642-D645 PolarHBondContact N-O 2.69Å; W642-D645 CarbonylContact O-C 3.47Å; W642-D645 PolarHBondContact O-N 3.23Å
646	P	84.7	Confident	80.2	Confident	75 Å²	75	65.5 Å²	65.5	49%	0.487	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.4	179.2	30.1	-34	0	0	0	111.8	I662 N684	P646-I662 HydrophobicContact CB-CB 4.27Å; P646-I662 HydrophobicContact CB-CD1 4.04Å; P646-I662 HydrophobicContact CB-CG2 3.71Å; P646-N684 WeakPolarHBondContact CA-ND2 3.5Å
647	S	86.8	Confident	79.9	Confident	52 Å²	52	68.4 Å²	68.4	36%	0.364	38%	0.383	S	S	.	.			trans	-144.2	147.7	-176.8	-177.9	0	0	0	0	111.8	F640 C649	F640-S647 CarbonylContact C-O 3.6Å; F640-S647 WeakPolarHBondContact CA-O 3.25Å; F640-S647 PolarHBondContact O-N 3.41Å; F640-S647 VanDerWaalsContact O-N 3.16Å; S647-C649 VanDerWaalsContact C-N 3.29Å; S647-C649 PolarHBondContact OG-N 2.82Å
648	F	87	Confident	79.1	Confident	52 Å²	52	66.5 Å²	66.5	23%	0.228	37%	0.366	C	S	.	.			trans	-91.8	12.9	167.4	-73.2	-80.6	0	0	0	112.2	C638 F640 R650 W651 W660 I662 I686 L701	C638-F648 PolarHBondContact SG-O 2.95Å; F640-F648 HydrophobicContact CD1-CD1 4.16Å; F640-F648 HydrophobicContact CE1-CD1 4.02Å; F648-R650 PolarHBondContact O-N 2.81Å; F648-R650 VanDerWaalsContact O-N 3.1Å; F648-W651 HydrophobicContact CB-CB 4.46Å; F648-W651 WeakPolarHBondContact CB-O 3.25Å; F648-W651 WeakPolarHBondContact O-CA 3Å; F648-W651 WeakPolarHBondContact O-CB 3.28Å; F648-W651 PolarHBondContact O-N 2.86Å; F648-W660 HydrophobicContact CE1-CB 4.19Å; F648-I662 HydrophobicContact CD1-CD1 4.31Å; F648-I662 HydrophobicContact CD1-CG1 4.44Å; F648-I662 HydrophobicContact CD2-CD1 3.76Å; F648-I662 HydrophobicContact CD2-CG1 4.45Å; F648-I662 HydrophobicContact CE1-CD1 4.22Å; F648-I662 HydrophobicContact CE1-CG1 3.95Å; F648-I662 HydrophobicContact CE2-CD1 3.63Å; F648-I662 HydrophobicContact CE2-CG1 3.93Å; F648-I662 HydrophobicContact CG-CD1 4.1Å; F648-I662 HydrophobicContact CZ-CD1 3.89Å; F648-I662 HydrophobicContact CZ-CG1 3.66Å; F648-I686 HydrophobicContact CD1-CG2 4.02Å; F648-I686 HydrophobicContact CE1-CG2 3.47Å; F648-I686 VanDerWaalsContact CE1-CG2 3.47Å; F648-I686 HydrophobicContact CZ-CG2 4.29Å; F648-L701 HydrophobicContact CD1-CD1 3.53Å; F648-L701 HydrophobicContact CE1-CD1 3.95Å; F648-L701 HydrophobicContact CG-CD1 4.29Å
649	C	84.3	Confident	78.6	Confident	23 Å²	23	73.4 Å²	73.4	16%	0.155	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	43.3	176.8	-28.1	0	0	0	0	113.3	C638 S647 W651	C638-C649 WeakPolarHBondContact CA-SG 3.24Å; C638-C649 HydrophobicContact CB-CB 3.36Å; C638-C649 WeakPolarHBondContact CB-SG 3.44Å; C638-C649 WeakPolarHBondContact SG-CB 3.33Å; C638-C649 CovalentContact SG-SG 2.04Å; C638-C649 PolarHBondContact SG-SG 2.89Å; S647-C649 VanDerWaalsContact C-N 3.29Å; S647-C649 PolarHBondContact OG-N 2.82Å; C649-W651 PolarHBondContact O-N 2.83Å
650	R	83.8	Confident	78.7	Confident	196 Å²	196	69.4 Å²	69.4	74%	0.74	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-0.7	-175.3	-53.2	-177.2	174.2	-175.5	-0.2	116.3	F648 P704	F648-R650 PolarHBondContact O-N 2.81Å; F648-R650 VanDerWaalsContact O-N 3.1Å; R650-P704 HydrophobicContact CB-CG 3.95Å; R650-P704 WeakPolarHBondContact O-CG 3.25Å
651	W	88.6	Confident	78.6	Confident	9 Å²	9	72.9 Å²	72.9	3%	0.034	39%	0.387	C	S	.	.			trans	-63.8	143.4	164.4	-66.1	64	0	0	0	109.7	F636 F648 C649 L701 V702 S703 V773 I775 I792	F636-W651 HydrophobicContact CD1-CZ2 4.07Å; F636-W651 HydrophobicContact CE1-CH2 4.17Å; F636-W651 AromaticContact CE1-CZ2 3.75Å; F636-W651 HydrophobicContact CE1-CZ2 3.75Å; F636-W651 HydrophobicContact CE2-CZ2 4.31Å; F636-W651 AromaticContact CZ-CH2 3.98Å; F636-W651 HydrophobicContact CZ-CH2 3.98Å; F636-W651 AromaticContact CZ-CZ2 3.89Å; F636-W651 HydrophobicContact CZ-CZ2 3.89Å; F636-W651 PolarHBondContact O-NE1 2.79Å; F648-W651 HydrophobicContact CB-CB 4.46Å; F648-W651 WeakPolarHBondContact CB-O 3.25Å; F648-W651 WeakPolarHBondContact O-CA 3Å; F648-W651 WeakPolarHBondContact O-CB 3.28Å; F648-W651 PolarHBondContact O-N 2.86Å; C649-W651 PolarHBondContact O-N 2.83Å; W651-L701 HydrophobicContact CB-CD1 3.9Å; W651-L701 HydrophobicContact CB-CD2 3.93Å; W651-L701 HydrophobicContact CB-CG 3.78Å; W651-L701 HydrophobicContact CD2-CD2 4.08Å; W651-L701 HydrophobicContact CD2-CG 4.37Å; W651-L701 HydrophobicContact CE3-CD2 3.79Å; W651-L701 HydrophobicContact CE3-CG 3.85Å; W651-L701 HydrophobicContact CG-CD2 4.18Å; W651-L701 HydrophobicContact CG-CG 4.41Å; W651-V702 CarbonylContact C-O 3.57Å; W651-V702 VanDerWaalsContact CA-O 3.3Å; W651-V702 WeakPolarHBondContact CA-O 3.43Å; W651-V702 VanDerWaalsContact CE3-C 3.45Å; W651-S703 VanDerWaalsContact CE3-N 3.25Å; W651-V773 HydrophobicContact CH2-CB 4.3Å; W651-V773 HydrophobicContact CH2-CG1 4.25Å; W651-V773 WeakPolarHBondContact CZ3-O 3.35Å; W651-I775 HydrophobicContact CH2-CD1 4.15Å; W651-I775 HydrophobicContact CH2-CG1 4.36Å; W651-I775 HydrophobicContact CZ3-CD1 3.95Å; W651-I775 HydrophobicContact CZ3-CG1 3.89Å; W651-I792 HydrophobicContact CD2-CD1 4.47Å; W651-I792 HydrophobicContact CH2-CD1 4.39Å; W651-I792 HydrophobicContact CH2-CG2 3.99Å; W651-I792 HydrophobicContact CZ2-CB 4.48Å; W651-I792 HydrophobicContact CZ2-CD1 4.25Å; W651-I792 HydrophobicContact CZ2-CG2 3.57Å
652	T	87.3	Confident	78.8	Confident	80 Å²	80	74.2 Å²	74.2	49%	0.491	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.2	-175.9	-49.4	0	0	0	0	109.3	V702	T652-V702 PolarHBondContact N-O 3.43Å; T652-V702 PolarHBondContact O-N 3.27Å
653	S	81.7	Confident	78.9	Confident	43 Å²	43	70.4 Å²	70.4	30%	0.301	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	127.5	175.2	-142.6	0	0	0	0	110	D655 R700	S653-D655 WeakPolarHBondContact CB-OD2 3.18Å; S653-D655 PolarHBondContact OG-OD1 2.66Å; S653-D655 PolarHBondContact OG-OD2 3.49Å; S653-R700 CarbonylContact C-O 3.59Å; S653-R700 VanDerWaalsContact CA-O 3.31Å; S653-R700 WeakPolarHBondContact CA-O 3.37Å; S653-R700 PolarHBondContact OG-O 2.83Å
654	E	78.8	Confident	78.9	Confident	82 Å²	82	69.6 Å²	69.6	38%	0.383	37%	0.374	S	S	.	.			trans	-119.3	59.6	177.7	-72.6	-172.7	-177.7	0	0	110.4	R700 V702 R734	E654-R700 HydrophobicContact CB-CB 4.33Å; E654-R700 PolarHBondContact N-O 3.08Å; E654-R700 WeakPolarHBondContact O-CB 3.48Å; E654-V702 HydrophobicContact CB-CG2 4.12Å; E654-V702 HydrophobicContact CG-CG2 3.86Å; E654-R734 IonicContact OE1-NH1 3.66Å; E654-R734 PolarHBondContact OE1-NH1 2.85Å; E654-R734 IonicContact OE2-CZ 3.92Å; E654-R734 IonicContact OE2-NH1 3.54Å; E654-R734 PolarHBondContact OE2-NH1 3.19Å; E654-R734 IonicContact OE2-NH2 3.38Å
655	D	68.1	Low	78.8	Confident	51 Å²	51	65.7 Å²	65.7	27%	0.273	36%	0.36	S	S	.	.			trans	-80.1	134.3	-169.4	-60.1	-46	0	0	0	112.9	S653 S658 R659 A699 R700	S653-D655 WeakPolarHBondContact CB-OD2 3.18Å; S653-D655 PolarHBondContact OG-OD1 2.66Å; S653-D655 PolarHBondContact OG-OD2 3.49Å; D655-S658 WeakPolarHBondContact CB-O 3.26Å; D655-R659 HydrophobicContact CB-CB 4.23Å; D655-R659 WeakPolarHBondContact OD2-CB 3.39Å; D655-A699 WeakPolarHBondContact OD1-CA 3.38Å; D655-R700 PolarHBondContact OD1-N 3.41Å
656	T	58	Low	78.5	Confident	95 Å²	95	61.1 Å²	61.1	58%	0.583	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-119.2	79	170.5	54.9	0	0	0	0	108.9	V698	T656-V698 PolarHBondContact N-O 2.03Å
657	G	64	Low	77.6	Confident	66 Å²	66	58.4 Å²	58.4	68%	0.68	32%	0.322	S	S	*	.	S	Bend	trans	112.6	-94	-179.1	0	0	0	0	0	112.8
658	S	65.9	Low	76.5	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.063	33%	0.331	C	S	.	.	S	Bend	trans	-69.5	141.5	174.1	-85.1	0	0	0	0	110.8	D655 E697 V698 A699	D655-S658 WeakPolarHBondContact CB-O 3.26Å; S658-E697 VanDerWaalsContact OG-CB 3.26Å; S658-E697 WeakPolarHBondContact OG-CB 3.43Å; S658-E697 PolarHBondContact OG-OE2 2.81Å; S658-V698 CarbonylContact O-C 3.29Å; S658-A699 VanDerWaalsContact O-CA 3.25Å; S658-A699 WeakPolarHBondContact O-CA 3.03Å; S658-A699 WeakPolarHBondContact O-CB 3.33Å
659	R	77.6	Confident	75.3	Confident	148 Å²	148	58.5 Å²	58.5	56%	0.558	33%	0.326	S	S	*	.			trans	-119.6	149.9	-177.6	66	177.5	-66.8	172.5	2.4	112.9	D655 Q661 T688	D655-R659 HydrophobicContact CB-CB 4.23Å; D655-R659 WeakPolarHBondContact OD2-CB 3.39Å; R659-Q661 HydrophobicContact CG-CG 3.88Å; R659-T688 WeakPolarHBondContact O-CB 3.5Å; R659-T688 PolarHBondContact O-OG1 3.47Å
660	W	88	Confident	74.1	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	36%	0.357	C	S	.	.			trans	-73	133.1	163.9	-68.2	109.1	0	0	0	109.9	F648 I686 T688 A699 L729 I775 I787 V789	F648-W660 HydrophobicContact CE1-CB 4.19Å; W660-I686 HydrophobicContact CB-CD1 4.42Å; W660-I686 HydrophobicContact CD2-CD1 3.86Å; W660-I686 HydrophobicContact CE3-CB 4.15Å; W660-I686 HydrophobicContact CE3-CD1 3.77Å; W660-I686 HydrophobicContact CE3-CG1 3.96Å; W660-I686 HydrophobicContact CG-CD1 4.15Å; W660-I686 HydrophobicContact CZ3-CD1 4.33Å; W660-I686 HydrophobicContact CZ3-CG1 4.39Å; W660-T688 HydrophobicContact CE3-CG2 4.37Å; W660-T688 HydrophobicContact CH2-CG2 4.21Å; W660-T688 HydrophobicContact CZ3-CG2 4.07Å; W660-A699 HydrophobicContact CD2-CB 4.15Å; W660-A699 HydrophobicContact CG-CB 4.09Å; W660-A699 VanDerWaalsContact NE1-C 3.29Å; W660-A699 PolarHBondContact NE1-O 3.24Å; W660-L729 HydrophobicContact CH2-CD1 4.1Å; W660-L729 HydrophobicContact CZ2-CD1 4.17Å; W660-I775 HydrophobicContact CZ2-CG2 4.26Å; W660-I787 HydrophobicContact CH2-CG2 3.96Å; W660-I787 WeakPolarHBondContact CZ3-O 3.35Å; W660-V789 HydrophobicContact CH2-CG2 3.83Å; W660-V789 HydrophobicContact CZ3-CG2 4.16Å
661	Q	86.6	Confident	73.2	Confident	73 Å²	73	61.3 Å²	61.3	34%	0.341	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.9	179.1	-60.1	-172.4	2.4	0	0	109.5	R659 I686 Y687	R659-Q661 HydrophobicContact CG-CG 3.88Å; Q661-I686 CarbonylContact O-C 3.6Å; Q661-I686 WeakPolarHBondContact O-CA 3.49Å; Q661-Y687 HydrophobicContact CB-CD1 4.11Å; Q661-Y687 HydrophobicContact CB-CE1 3.62Å; Q661-Y687 PolarHBondContact N-O 2.93Å; Q661-Y687 VanDerWaalsContact O-CD1 3.22Å; Q661-Y687 WeakPolarHBondContact O-CD1 3.26Å; Q661-Y687 PolarHBondContact O-N 3Å; Q661-Y687 PolarHBondContact OE1-OH 3.4Å
662	I	87.1	Confident	72.5	Confident	37 Å²	37	61.4 Å²	61.4	19%	0.19	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	136.6	176.7	-60.2	173	0	0	0	109	P646 F648 N684 F685 I686	P646-I662 HydrophobicContact CB-CB 4.27Å; P646-I662 HydrophobicContact CB-CD1 4.04Å; P646-I662 HydrophobicContact CB-CG2 3.71Å; F648-I662 HydrophobicContact CD1-CD1 4.31Å; F648-I662 HydrophobicContact CD1-CG1 4.44Å; F648-I662 HydrophobicContact CD2-CD1 3.76Å; F648-I662 HydrophobicContact CD2-CG1 4.45Å; F648-I662 HydrophobicContact CE1-CD1 4.22Å; F648-I662 HydrophobicContact CE1-CG1 3.95Å; F648-I662 HydrophobicContact CE2-CD1 3.63Å; F648-I662 HydrophobicContact CE2-CG1 3.93Å; F648-I662 HydrophobicContact CG-CD1 4.1Å; F648-I662 HydrophobicContact CZ-CD1 3.89Å; F648-I662 HydrophobicContact CZ-CG1 3.66Å; I662-N684 HydrophobicContact CG2-CB 3.38Å; I662-F685 CarbonylContact C-O 3.58Å; I662-F685 WeakPolarHBondContact CA-O 3.37Å; I662-I686 HydrophobicContact CG1-CG2 3.7Å
663	Q	83.1	Confident	71.9	Confident	59 Å²	59	57.7 Å²	57.7	28%	0.276	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	146	179.4	-175.7	66.6	-12.4	0	0	111.7	S665 G666 N684 F685 Y687	Q663-S665 PolarHBondContact NE2-O 2.81Å; Q663-S665 VanDerWaalsContact NE2-O 3.14Å; Q663-G666 VanDerWaalsContact CG-O 3.25Å; Q663-G666 WeakPolarHBondContact CG-O 3.23Å; Q663-G666 PolarHBondContact NE2-O 3.1Å; Q663-N684 CarbonylContact O-C 3.58Å; Q663-N684 VanDerWaalsContact O-CA 3.31Å; Q663-N684 WeakPolarHBondContact O-CA 3.4Å; Q663-F685 HydrophobicContact CB-CE2 4.27Å; Q663-F685 HydrophobicContact CB-CZ 4.12Å; Q663-F685 HydrophobicContact CG-CZ 4.18Å; Q663-F685 PolarHBondContact N-O 2.96Å; Q663-F685 VanDerWaalsContact O-CD1 3.27Å; Q663-F685 WeakPolarHBondContact O-CD1 3.3Å; Q663-F685 WeakPolarHBondContact O-CE1 3.45Å; Q663-F685 PolarHBondContact O-N 2.95Å; Q663-Y687 HydrophobicContact CB-CD1 3.78Å; Q663-Y687 HydrophobicContact CB-CE1 3.62Å; Q663-Y687 HydrophobicContact CG-CE1 4.25Å
664	S	72.6	Confident	71.9	Confident	34 Å²	34	55.8 Å²	55.8	24%	0.238	32%	0.319	C	S	.	.	S	Bend	trans	-105.6	-23	179.2	44.4	0	0	0	0	114.5	N684	S664-N684 VanDerWaalsContact CB-OD1 3.29Å; S664-N684 WeakPolarHBondContact CB-OD1 3.46Å
665	S	67.4	Low	71.7	Confident	81 Å²	81	57.2 Å²	57.2	57%	0.566	33%	0.33	S	S	*	.	S	Bend	trans	-149.5	102.7	-176	67.9	0	0	0	0	112.9	Q663	Q663-S665 PolarHBondContact NE2-O 2.81Å; Q663-S665 VanDerWaalsContact NE2-O 3.14Å
666	G	66.3	Low	72.2	Confident	17 Å²	17	59 Å²	59	18%	0.175	34%	0.337	C	S	.	.			trans	64.8	143.2	174.9	0	0	0	0	0	114.7	Q663 P674 N675	Q663-G666 VanDerWaalsContact CG-O 3.25Å; Q663-G666 WeakPolarHBondContact CG-O 3.23Å; Q663-G666 PolarHBondContact NE2-O 3.1Å; G666-P674 WeakPolarHBondContact CA-O 3.23Å; G666-N675 PolarHBondContact N-O 3.41Å
667	T	67.5	Low	73.5	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.11	31%	0.312	C	S	.	.			trans	-83.3	158.6	171.4	58.5	0	0	0	0	110.8	T669 G673 F685 Y687 D786	T667-T669 PolarHBondContact O-N 3.07Å; T667-T669 PolarHBondContact OG1-OG1 2.73Å; T667-T669 VanDerWaalsContact OG1-OG1 3.09Å; T667-G673 WeakPolarHBondContact OG1-CA 3.24Å; T667-G673 PolarHBondContact OG1-N 3.36Å; T667-F685 HydrophobicContact CG2-CE2 4.2Å; T667-F685 HydrophobicContact CG2-CZ 4.47Å; T667-Y687 HydrophobicContact CG2-CD1 4.3Å; T667-Y687 HydrophobicContact CG2-CD2 3.47Å; T667-Y687 VanDerWaalsContact CG2-CD2 3.47Å; T667-Y687 HydrophobicContact CG2-CE2 3.9Å; T667-Y687 HydrophobicContact CG2-CG 3.7Å; T667-D786 HydrophobicContact CG2-CB 4.22Å; T667-D786 PolarHBondContact OG1-OD2 2.71Å
668	P	62.3	Low	74.3	Confident	88 Å²	88	54.1 Å²	54.1	57%	0.571	29%	0.291	S	S	*	.	S	Bend	trans	-58.3	-18	178.4	-26.9	34.9	0	0	0	115.2	Y687 L689	P668-Y687 WeakPolarHBondContact CD-OH 3.15Å; P668-Y687 HydrophobicContact CG-CE2 4.37Å; P668-Y687 WeakPolarHBondContact CG-OH 3.01Å; P668-L689 HydrophobicContact CG-CD2 4.43Å
669	T	61.8	Low	74.9	Confident	18 Å²	18	57.4 Å²	57.4	11%	0.11	31%	0.31	C	S	.	.	S	Bend	trans	-90.5	116.8	-179.1	39.7	0	0	0	0	109.9	T667 N671 T672 L689 T691 D786	T667-T669 PolarHBondContact O-N 3.07Å; T667-T669 PolarHBondContact OG1-OG1 2.73Å; T667-T669 VanDerWaalsContact OG1-OG1 3.09Å; T669-N671 PolarHBondContact O-N 3.45Å; T669-N671 VanDerWaalsContact O-N 3.14Å; T669-T672 WeakPolarHBondContact CB-OG1 3.06Å; T669-T672 PolarHBondContact O-N 2.85Å; T669-T672 PolarHBondContact O-OG1 3.38Å; T669-T672 PolarHBondContact OG1-OG1 2.62Å; T669-L689 HydrophobicContact CG2-CD2 3.78Å; T669-T691 HydrophobicContact CG2-CG2 3.84Å; T669-D786 PolarHBondContact OG1-OD1 3.25Å; T669-D786 PolarHBondContact OG1-OD2 2.72Å
670	L	59.5	Low	74	Confident	153 Å²	153	52.8 Å²	52.8	80%	0.801	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	118.3	-176.4	-89.6	127.3	0	0	0	112	T672	L670-T672 VanDerWaalsContact C-N 3.34Å; L670-T672 PolarHBondContact O-N 2.81Å
671	N	66.2	Low	72.7	Confident	126 Å²	126	54.2 Å²	54.2	67%	0.674	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	20.2	173.4	-59.3	-38.4	0	0	0	116.4	T669 H722	T669-N671 PolarHBondContact O-N 3.45Å; T669-N671 VanDerWaalsContact O-N 3.14Å; N671-H722 PolarHBondContact O-CD2 3.17Å
672	T	72.3	Confident	71.6	Confident	10 Å²	10	54.3 Å²	54.3	6%	0.061	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-32.2	177.6	52.8	0	0	0	0	114.4	T669 L670 H720 H722 G785 D786	T669-T672 WeakPolarHBondContact CB-OG1 3.06Å; T669-T672 PolarHBondContact O-N 2.85Å; T669-T672 PolarHBondContact O-OG1 3.38Å; T669-T672 PolarHBondContact OG1-OG1 2.62Å; L670-T672 VanDerWaalsContact C-N 3.34Å; L670-T672 PolarHBondContact O-N 2.81Å; T672-H720 PolarHBondContact O-CE1 3.25Å; T672-H722 WeakPolarHBondContact CB-O 3.17Å; T672-H722 WeakPolarHBondContact O-CB 3.34Å; T672-G785 VanDerWaalsContact CB-CA 3.48Å; T672-D786 VanDerWaalsContact C-OD2 3.25Å; T672-D786 PolarHBondContact OG1-OD2 3.2Å
673	G	75.2	Confident	71	Confident	3 Å²	3	52.7 Å²	52.7	3%	0.031	33%	0.325	C	S	.	.	S	Bend	trans	-97.8	172.6	179.5	0	0	0	0	0	113.2	T667 D786	T667-G673 WeakPolarHBondContact OG1-CA 3.24Å; T667-G673 PolarHBondContact OG1-N 3.36Å; G673-D786 WeakPolarHBondContact CA-OD2 3.12Å; G673-D786 PolarHBondContact N-OD2 3.09Å
674	P	80.8	Confident	71.2	Confident	3 Å²	3	50 Å²	50	2%	0.019	31%	0.313	C	S	.	.			trans	-68.7	137.2	178.4	27.1	-30.6	0	0	0	110.5	G666 M676 F685 H720 W757 A788	G666-P674 WeakPolarHBondContact CA-O 3.23Å; P674-M676 VanDerWaalsContact C-N 3.29Å; P674-F685 HydrophobicContact CB-CZ 4.47Å; P674-F685 HydrophobicContact CG-CD2 3.95Å; P674-F685 HydrophobicContact CG-CE1 4.24Å; P674-F685 HydrophobicContact CG-CE2 3.52Å; P674-F685 HydrophobicContact CG-CG 4.49Å; P674-F685 HydrophobicContact CG-CZ 3.68Å; P674-H720 HydrophobicContact CB-CB 4.46Å; P674-H720 HydrophobicContact CG-CB 4.29Å; P674-W757 HydrophobicContact CB-CH2 4.36Å; P674-W757 HydrophobicContact CB-CZ2 3.46Å; P674-W757 VanDerWaalsContact CB-CZ2 3.46Å; P674-W757 HydrophobicContact CG-CH2 3.81Å; P674-W757 HydrophobicContact CG-CZ2 3.33Å; P674-A788 HydrophobicContact CG-CB 3.78Å
675	N	75.4	Confident	72	Confident	111 Å²	111	48.4 Å²	48.4	59%	0.594	30%	0.301	S	S	*	.	S	Bend	trans	-75.9	-21.4	-179.8	-68.2	-35.1	0	0	0	112.6	G666	G666-N675 PolarHBondContact N-O 3.41Å
676	M	79.3	Confident	73.1	Confident	89 Å²	89	44.6 Å²	44.6	44%	0.438	27%	0.274	S	S	.	.	S	Bend	trans	-149.2	161.3	-177.3	-61.7	179.2	67.1	0	0	108.5	P674 G680 G681 W757	P674-M676 VanDerWaalsContact C-N 3.29Å; M676-G680 WeakPolarHBondContact CE-O 3.46Å; M676-G681 WeakPolarHBondContact CE-O 3.2Å; M676-W757 PolarHBondContact O-NE1 2.88Å
677	D	83.8	Confident	74.3	Confident	8 Å²	8	44 Å²	44	4%	0.043	27%	0.267	C	S	.	.			trans	-55.4	168.2	169.5	76.3	-27.7	0	0	0	112.5	T679 G680 G681 G683 F685 W757 D790	D677-T679 VanDerWaalsContact C-N 3.28Å; D677-T679 PolarHBondContact O-N 3.43Å; D677-T679 PolarHBondContact OD2-OG1 3.09Å; D677-G680 PolarHBondContact O-N 2.77Å; D677-G680 PolarHBondContact OD1-N 2.84Å; D677-G680 VanDerWaalsContact OD1-N 3.11Å; D677-G681 PolarHBondContact OD1-N 2.9Å; D677-G683 WeakPolarHBondContact OD2-CA 3.25Å; D677-G683 PolarHBondContact OD2-N 2.85Å; D677-F685 HydrophobicContact CB-CD1 4.13Å; D677-W757 PolarHBondContact O-NE1 2.83Å; D677-D790 WeakPolarHBondContact CB-OD2 3.31Å
678	H	81.3	Confident	75.1	Confident	51 Å²	51	43.3 Å²	43.3	24%	0.236	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-34.2	-177.9	167.4	-105.5	0	0	0	112.2	G680 W718 W757 D790 D791	H678-G680 PolarHBondContact O-N 3.46Å; H678-W718 HydrophobicContact CB-CB 4.19Å; H678-W718 HydrophobicContact CB-CG 4.36Å; H678-W718 AromaticContact CD2-CD2 3.41Å; H678-W718 VanDerWaalsContact CD2-CD2 3.41Å; H678-W718 AromaticContact CD2-CE2 3.98Å; H678-W718 AromaticContact CD2-CE3 3.29Å; H678-W718 AromaticContact CD2-CG 3.89Å; H678-W718 AromaticContact CD2-CZ3 3.75Å; H678-W718 AromaticContact CE1-CD1 3.83Å; H678-W718 AromaticContact CE1-CD2 3.35Å; H678-W718 AromaticContact CE1-CE2 3.1Å; H678-W718 AromaticContact CE1-CE3 3.88Å; H678-W718 AromaticContact CE1-CG 3.79Å; H678-W718 AromaticContact CE1-CH2 3.94Å; H678-W718 AromaticContact CE1-CZ2 3.43Å; H678-W718 VanDerWaalsContact CE1-CZ2 3.43Å; H678-W718 WeakPolarHBondContact CE1-CZ2 3.39Å; H678-W718 AromaticContact CE1-NE1 3.41Å; H678-W718 PolarHBondContact CE1-NE1 2.99Å; H678-W718 AromaticContact CG-CD2 3.65Å; H678-W718 AromaticContact CG-CE3 3.97Å; H678-W718 AromaticContact CG-CG 3.61Å; H678-W718 AromaticContact ND1-CD1 3.62Å; H678-W718 AromaticContact ND1-CD2 3.61Å; H678-W718 AromaticContact ND1-CE2 3.7Å; H678-W718 AromaticContact ND1-CG 3.55Å; H678-W718 AromaticContact ND1-NE1 3.68Å; H678-W718 AromaticContact NE2-CD2 3.23Å; H678-W718 AromaticContact NE2-CE2 3.29Å; H678-W718 VanDerWaalsContact NE2-CE2 3.29Å; H678-W718 AromaticContact NE2-CE3 3.24Å; H678-W718 AromaticContact NE2-CH2 3.36Å; H678-W718 WeakPolarHBondContact NE2-CH2 3.49Å; H678-W718 AromaticContact NE2-CZ2 3.36Å; H678-W718 WeakPolarHBondContact NE2-CZ2 3.4Å; H678-W718 AromaticContact NE2-CZ3 3.3Å; H678-W718 VanDerWaalsContact NE2-CZ3 3.3Å; H678-W718 WeakPolarHBondContact NE2-CZ3 3.38Å; H678-W757 HydrophobicContact CB-CB 4.44Å; H678-W757 HydrophobicContact CB-CD2 3.93Å; H678-W757 HydrophobicContact CB-CE3 4.34Å; H678-W757 HydrophobicContact CB-CG 3.98Å; H678-W757 AromaticContact CD2-CG 3.98Å; H678-D790 HydrophobicContact CB-CB 4.02Å; H678-D790 WeakPolarHBondContact CB-OD2 3.17Å; H678-D790 PolarHBondContact N-OD2 3.47Å; H678-D791 IonicContact CE1-OD2 3.21Å; H678-D791 IonicContact CG-OD2 3.74Å; H678-D791 IonicContact ND1-OD2 3.49Å; H678-D791 PolarHBondContact ND1-OD2 2.79Å
679	T	78.4	Confident	75.7	Confident	78 Å²	78	41.4 Å²	41.4	48%	0.479	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-8.7	-178.8	76.2	0	0	0	0	114.1	D677 G681	D677-T679 VanDerWaalsContact C-N 3.28Å; D677-T679 PolarHBondContact O-N 3.43Å; D677-T679 PolarHBondContact OD2-OG1 3.09Å; T679-G681 PolarHBondContact O-N 3.4Å
680	G	58.5	Low	75.7	Confident	50 Å²	50	40.5 Å²	40.5	52%	0.515	24%	0.242	S	C	.	.	S	Bend	trans	70.9	14.8	178.7	0	0	0	0	0	113.4	M676 D677 H678	M676-G680 WeakPolarHBondContact CE-O 3.46Å; D677-G680 PolarHBondContact O-N 2.77Å; D677-G680 PolarHBondContact OD1-N 2.84Å; D677-G680 VanDerWaalsContact OD1-N 3.11Å; H678-G680 PolarHBondContact O-N 3.46Å
681	G	60.5	Low	75.9	Confident	32 Å²	32	36.2 Å²	36.2	33%	0.33	22%	0.222	S	C	.	.	S	Bend	trans	-100.2	-155.2	178.6	0	0	0	0	0	111.5	M676 D677 T679 G683	M676-G681 WeakPolarHBondContact CE-O 3.2Å; D677-G681 PolarHBondContact OD1-N 2.9Å; T679-G681 PolarHBondContact O-N 3.4Å; G681-G683 VanDerWaalsContact C-N 3.29Å
682	S	65.1	Low	75.4	Confident	74 Å²	74	30.7 Å²	30.7	52%	0.517	20%	0.195	S	C	.	.	S	Bend	trans	-91.5	22.9	170.1	58	0	0	0	0	112	P643	P643-S682 WeakPolarHBondContact CD-O 3.21Å; P643-S682 WeakPolarHBondContact CG-O 3.1Å
683	G	74.7	Confident	74.5	Confident	4 Å²	4	38 Å²	38	4%	0.041	23%	0.233	C	C	.	.			trans	-72.2	174.4	-179.5	0	0	0	0	0	112.6	D677 G681	D677-G683 WeakPolarHBondContact OD2-CA 3.25Å; D677-G683 PolarHBondContact OD2-N 2.85Å; G681-G683 VanDerWaalsContact C-N 3.29Å
684	N	86.6	Confident	73.4	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	26%	0.264	C	S	.	.			trans	-103.3	158.9	172.9	-57.9	-44.9	0	0	0	111.3	F640 G641 W642 P643 P646 I662 Q663 S664	F640-N684 HydrophobicContact CB-CB 4.17Å; F640-N684 WeakPolarHBondContact O-CB 3.36Å; F640-N684 PolarHBondContact O-ND2 2.01Å; G641-N684 VanDerWaalsContact C-ND2 3.34Å; G641-N684 PolarHBondContact O-N 3.26Å; G641-N684 PolarHBondContact O-ND2 3.28Å; W642-N684 PolarHBondContact N-ND2 3.07Å; W642-N684 PolarHBondContact O-ND2 2.89Å; P643-N684 WeakPolarHBondContact CA-OD1 3.39Å; P646-N684 WeakPolarHBondContact CA-ND2 3.5Å; I662-N684 HydrophobicContact CG2-CB 3.38Å; Q663-N684 CarbonylContact O-C 3.58Å; Q663-N684 VanDerWaalsContact O-CA 3.31Å; Q663-N684 WeakPolarHBondContact O-CA 3.4Å; S664-N684 VanDerWaalsContact CB-OD1 3.29Å; S664-N684 WeakPolarHBondContact CB-OD1 3.46Å
685	F	89.9	Confident	72.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	165.4	165.5	57.6	-86.7	0	0	0	109.2	I662 Q663 T667 P674 D677 Y687 W757 A788 D790	I662-F685 CarbonylContact C-O 3.58Å; I662-F685 WeakPolarHBondContact CA-O 3.37Å; Q663-F685 HydrophobicContact CB-CE2 4.27Å; Q663-F685 HydrophobicContact CB-CZ 4.12Å; Q663-F685 HydrophobicContact CG-CZ 4.18Å; Q663-F685 PolarHBondContact N-O 2.96Å; Q663-F685 VanDerWaalsContact O-CD1 3.27Å; Q663-F685 WeakPolarHBondContact O-CD1 3.3Å; Q663-F685 WeakPolarHBondContact O-CE1 3.45Å; Q663-F685 PolarHBondContact O-N 2.95Å; T667-F685 HydrophobicContact CG2-CE2 4.2Å; T667-F685 HydrophobicContact CG2-CZ 4.47Å; P674-F685 HydrophobicContact CB-CZ 4.47Å; P674-F685 HydrophobicContact CG-CD2 3.95Å; P674-F685 HydrophobicContact CG-CE1 4.24Å; P674-F685 HydrophobicContact CG-CE2 3.52Å; P674-F685 HydrophobicContact CG-CG 4.49Å; P674-F685 HydrophobicContact CG-CZ 3.68Å; D677-F685 HydrophobicContact CB-CD1 4.13Å; F685-Y687 HydrophobicContact CE2-CD1 4.27Å; F685-Y687 HydrophobicContact CE2-CG 4.38Å; F685-W757 HydrophobicContact CB-CH2 3.63Å; F685-W757 HydrophobicContact CB-CZ2 3.9Å; F685-W757 HydrophobicContact CD1-CZ2 4.05Å; F685-W757 AromaticContact CD2-CH2 3.93Å; F685-W757 HydrophobicContact CD2-CH2 3.93Å; F685-W757 HydrophobicContact CD2-CZ2 4.12Å; F685-W757 AromaticContact CG-CH2 3.77Å; F685-W757 HydrophobicContact CG-CH2 3.77Å; F685-W757 AromaticContact CG-CZ2 3.74Å; F685-W757 HydrophobicContact CG-CZ2 3.74Å; F685-A788 HydrophobicContact CD2-CB 3.89Å; F685-A788 HydrophobicContact CE2-CB 4.24Å; F685-D790 HydrophobicContact CB-CB 3.97Å
686	I	90.9	Very high	71.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	145.8	169.7	59.2	169	0	0	0	111.2	F640 F648 W660 Q661 I662 L701 A788 V789	F640-I686 HydrophobicContact CB-CG2 4.47Å; F640-I686 HydrophobicContact CD1-CB 4.45Å; F640-I686 HydrophobicContact CD1-CG2 3.32Å; F640-I686 HydrophobicContact CD2-CG1 4.38Å; F640-I686 HydrophobicContact CD2-CG2 4.22Å; F640-I686 HydrophobicContact CE1-CB 4.28Å; F640-I686 HydrophobicContact CE1-CD1 3.79Å; F640-I686 HydrophobicContact CE1-CG1 3.95Å; F640-I686 HydrophobicContact CE1-CG2 3.43Å; F640-I686 VanDerWaalsContact CE1-CG2 3.43Å; F640-I686 HydrophobicContact CE2-CD1 4.21Å; F640-I686 HydrophobicContact CE2-CG1 3.8Å; F640-I686 HydrophobicContact CE2-CG2 4.31Å; F640-I686 HydrophobicContact CG-CG2 3.74Å; F640-I686 HydrophobicContact CZ-CB 4.32Å; F640-I686 HydrophobicContact CZ-CD1 3.46Å; F640-I686 VanDerWaalsContact CZ-CD1 3.46Å; F640-I686 HydrophobicContact CZ-CG1 3.54Å; F640-I686 HydrophobicContact CZ-CG2 3.93Å; F648-I686 HydrophobicContact CD1-CG2 4.02Å; F648-I686 HydrophobicContact CE1-CG2 3.47Å; F648-I686 VanDerWaalsContact CE1-CG2 3.47Å; F648-I686 HydrophobicContact CZ-CG2 4.29Å; W660-I686 HydrophobicContact CB-CD1 4.42Å; W660-I686 HydrophobicContact CD2-CD1 3.86Å; W660-I686 HydrophobicContact CE3-CB 4.15Å; W660-I686 HydrophobicContact CE3-CD1 3.77Å; W660-I686 HydrophobicContact CE3-CG1 3.96Å; W660-I686 HydrophobicContact CG-CD1 4.15Å; W660-I686 HydrophobicContact CZ3-CD1 4.33Å; W660-I686 HydrophobicContact CZ3-CG1 4.39Å; Q661-I686 CarbonylContact O-C 3.6Å; Q661-I686 WeakPolarHBondContact O-CA 3.49Å; I662-I686 HydrophobicContact CG1-CG2 3.7Å; I686-L701 HydrophobicContact CD1-CD2 3.81Å; I686-A788 CarbonylContact O-C 3.52Å; I686-A788 WeakPolarHBondContact O-CA 2.82Å; I686-A788 WeakPolarHBondContact O-CB 3.3Å; I686-V789 HydrophobicContact CD1-CB 4.08Å; I686-V789 HydrophobicContact CG1-CB 3.87Å; I686-V789 WeakPolarHBondContact CG1-O 3.43Å; I686-V789 PolarHBondContact N-O 2.9Å; I686-V789 PolarHBondContact O-N 2.73Å
687	Y	89.4	Confident	71.2	Confident	6 Å²	6	49 Å²	49	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	158.7	173.5	79.5	-72.2	0	0	0	111.9	Q661 Q663 T667 P668 F685 L689 I787	Q661-Y687 HydrophobicContact CB-CD1 4.11Å; Q661-Y687 HydrophobicContact CB-CE1 3.62Å; Q661-Y687 PolarHBondContact N-O 2.93Å; Q661-Y687 VanDerWaalsContact O-CD1 3.22Å; Q661-Y687 WeakPolarHBondContact O-CD1 3.26Å; Q661-Y687 PolarHBondContact O-N 3Å; Q661-Y687 PolarHBondContact OE1-OH 3.4Å; Q663-Y687 HydrophobicContact CB-CD1 3.78Å; Q663-Y687 HydrophobicContact CB-CE1 3.62Å; Q663-Y687 HydrophobicContact CG-CE1 4.25Å; T667-Y687 HydrophobicContact CG2-CD1 4.3Å; T667-Y687 HydrophobicContact CG2-CD2 3.47Å; T667-Y687 VanDerWaalsContact CG2-CD2 3.47Å; T667-Y687 HydrophobicContact CG2-CE2 3.9Å; T667-Y687 HydrophobicContact CG2-CG 3.7Å; P668-Y687 WeakPolarHBondContact CD-OH 3.15Å; P668-Y687 HydrophobicContact CG-CE2 4.37Å; P668-Y687 WeakPolarHBondContact CG-OH 3.01Å; F685-Y687 HydrophobicContact CE2-CD1 4.27Å; F685-Y687 HydrophobicContact CE2-CG 4.38Å; Y687-L689 HydrophobicContact CD2-CD2 4.28Å; Y687-L689 HydrophobicContact CE2-CD2 3.69Å; Y687-L689 HydrophobicContact CE2-CG 3.86Å; Y687-I787 CarbonylContact C-O 3.49Å; Y687-I787 VanDerWaalsContact CA-O 3.24Å; Y687-I787 WeakPolarHBondContact CA-O 3.38Å
688	T	85.8	Confident	71	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.7	167.1	-163.9	0	0	0	0	109.7	R659 W660 A690 A699 V779 I787	R659-T688 WeakPolarHBondContact O-CB 3.5Å; R659-T688 PolarHBondContact O-OG1 3.47Å; W660-T688 HydrophobicContact CE3-CG2 4.37Å; W660-T688 HydrophobicContact CH2-CG2 4.21Å; W660-T688 HydrophobicContact CZ3-CG2 4.07Å; T688-A690 PolarHBondContact O-N 2.88Å; T688-A699 HydrophobicContact CG2-CB 4.18Å; T688-V779 HydrophobicContact CG2-CG2 4.36Å; T688-I787 HydrophobicContact CG2-CB 4.08Å; T688-I787 PolarHBondContact N-O 2.82Å; T688-I787 PolarHBondContact O-N 2.85Å; T688-I787 VanDerWaalsContact O-N 3.17Å
689	L	73.7	Confident	71.3	Confident	48 Å²	48	47.1 Å²	47.1	25%	0.251	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	117.6	-178.1	-71.1	175.4	0	0	0	109.3	P668 T669 Y687 T691 D786	P668-L689 HydrophobicContact CG-CD2 4.43Å; T669-L689 HydrophobicContact CG2-CD2 3.78Å; Y687-L689 HydrophobicContact CD2-CD2 4.28Å; Y687-L689 HydrophobicContact CE2-CD2 3.69Å; Y687-L689 HydrophobicContact CE2-CG 3.86Å; L689-T691 HydrophobicContact CB-CG2 4.46Å; L689-T691 PolarHBondContact O-N 3.39Å; L689-D786 VanDerWaalsContact CD2-OD1 3.24Å; L689-D786 WeakPolarHBondContact CD2-OD1 3.37Å
690	A	63.2	Low	71.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	63.2	170.8	0	0	0	0	0	109.9	T688 I726 V779 S783 W784 G785	T688-A690 PolarHBondContact O-N 2.88Å; A690-I726 HydrophobicContact CB-CD1 4.5Å; A690-V779 HydrophobicContact CB-CG1 3.96Å; A690-V779 HydrophobicContact CB-CG2 4.12Å; A690-S783 CarbonylContact O-C 3.49Å; A690-S783 WeakPolarHBondContact O-CB 3.2Å; A690-S783 PolarHBondContact O-OG 3.39Å; A690-W784 WeakPolarHBondContact O-CA 3.35Å; A690-W784 PolarHBondContact O-N 2.84Å; A690-G785 VanDerWaalsContact CA-O 3.31Å; A690-G785 WeakPolarHBondContact CA-O 3.18Å; A690-G785 WeakPolarHBondContact CB-O 3.18Å; A690-G785 PolarHBondContact N-O 2.92Å; A690-G785 PolarHBondContact O-N 3.16Å
691	T	63.5	Low	73.5	Confident	63 Å²	63	44.1 Å²	44.1	39%	0.387	24%	0.243	S	C	.	.			trans	-121.3	41.1	-178.7	59.9	0	0	0	0	113.1	T669 L689 L693	T669-T691 HydrophobicContact CG2-CG2 3.84Å; L689-T691 HydrophobicContact CB-CG2 4.46Å; L689-T691 PolarHBondContact O-N 3.39Å; T691-L693 PolarHBondContact O-N 3.37Å
692	G	54.7	Low	74.9	Confident	9 Å²	9	42.6 Å²	42.6	9%	0.093	23%	0.227	C	C	.	.			trans	-74.7	121.6	-171.4	0	0	0	0	0	114.8
693	L	53	Low	76.1	Confident	165 Å²	165	39.1 Å²	39.1	86%	0.864	20%	0.202	S	C	*	.	S	Bend	trans	-89.3	-13.5	166.1	-72.9	167.1	0	0	0	112.8	T691	T691-L693 PolarHBondContact O-N 3.37Å
694	Q	53.3	Low	76.6	Confident	145 Å²	145	40.4 Å²	40.4	68%	0.678	21%	0.21	S	C	*	.	S	Bend	trans	-108.1	174.2	178.9	-70.8	-161.2	-7.8	0	0	113.4
695	E	56	Low	76.3	Confident	168 Å²	168	44 Å²	44	79%	0.785	23%	0.228	S	C	*	.	S	Bend	trans	-70.4	125.4	177	-76.1	179.9	168.1	0	0	111.5
696	S	61.3	Low	75.8	Confident	67 Å²	67	44.4 Å²	44.4	47%	0.469	23%	0.23	S	C	.	.			trans	31.3	92	168.6	-167.9	0	0	0	0	117	V779	S696-V779 WeakPolarHBondContact CA-O 3.33Å
697	E	70.8	Confident	74.7	Confident	56 Å²	56	48.3 Å²	48.3	26%	0.262	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	147.8	173.3	-64.6	-178.1	-164.5	0	0	111.6	S658 V779	S658-E697 VanDerWaalsContact OG-CB 3.26Å; S658-E697 WeakPolarHBondContact OG-CB 3.43Å; S658-E697 PolarHBondContact OG-OE2 2.81Å; E697-V779 PolarHBondContact N-O 3.3Å; E697-V779 VanDerWaalsContact N-O 3.11Å; E697-V779 PolarHBondContact O-N 2.92Å
698	V	81.2	Confident	73.1	Confident	20 Å²	20	49.4 Å²	49.4	12%	0.121	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.6	-172.3	-163.1	0	0	0	0	111.5	T656 S658 R700 E776 L778	T656-V698 PolarHBondContact N-O 2.03Å; S658-V698 CarbonylContact O-C 3.29Å; V698-R700 HydrophobicContact CG1-CG 4Å; V698-E776 HydrophobicContact CG1-CG 3.4Å; V698-L778 HydrophobicContact CG1-CD1 4.44Å; V698-L778 HydrophobicContact CG2-CD1 3.74Å
699	A	87.2	Confident	71.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.4	169.3	0	0	0	0	0	109.8	D655 S658 W660 T688 E776 G777	D655-A699 WeakPolarHBondContact OD1-CA 3.38Å; S658-A699 VanDerWaalsContact O-CA 3.25Å; S658-A699 WeakPolarHBondContact O-CA 3.03Å; S658-A699 WeakPolarHBondContact O-CB 3.33Å; W660-A699 HydrophobicContact CD2-CB 4.15Å; W660-A699 HydrophobicContact CG-CB 4.09Å; W660-A699 VanDerWaalsContact NE1-C 3.29Å; W660-A699 PolarHBondContact NE1-O 3.24Å; T688-A699 HydrophobicContact CG2-CB 4.18Å; A699-E776 CarbonylContact O-C 3.52Å; A699-E776 VanDerWaalsContact O-CA 3.31Å; A699-E776 WeakPolarHBondContact O-CA 3.32Å; A699-G777 PolarHBondContact N-O 3.09Å; A699-G777 PolarHBondContact O-N 3.05Å
700	R	89.9	Confident	70.5	Confident	65 Å²	65	62.7 Å²	62.7	25%	0.245	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.3	-176.5	-73.4	179.8	173	175.2	-0.8	111.4	S653 E654 D655 V698 V774 I775 E776	S653-R700 CarbonylContact C-O 3.59Å; S653-R700 VanDerWaalsContact CA-O 3.31Å; S653-R700 WeakPolarHBondContact CA-O 3.37Å; S653-R700 PolarHBondContact OG-O 2.83Å; E654-R700 HydrophobicContact CB-CB 4.33Å; E654-R700 PolarHBondContact N-O 3.08Å; E654-R700 WeakPolarHBondContact O-CB 3.48Å; D655-R700 PolarHBondContact OD1-N 3.41Å; V698-R700 HydrophobicContact CG1-CG 4Å; R700-V774 HydrophobicContact CG-CG1 4.48Å; R700-I775 CarbonylContact C-O 3.52Å; R700-I775 WeakPolarHBondContact CA-O 3.2Å; R700-E776 HydrophobicContact CG-CB 4.05Å; R700-E776 HydrophobicContact CG-CG 3.86Å; R700-E776 IonicContact CZ-OE2 3.03Å; R700-E776 IonicContact NE-OE2 3.79Å; R700-E776 PolarHBondContact NE-OE2 3.12Å; R700-E776 IonicContact NH2-OE2 3.24Å; R700-E776 PolarHBondContact NH2-OE2 2.89Å
701	L	92.1	Very high	70.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.7	172.5	-168.6	77.6	0	0	0	109.3	F640 F648 W651 I686 V774 I775 I792	F640-L701 HydrophobicContact CE1-CD2 4.09Å; F640-L701 HydrophobicContact CZ-CD2 4.23Å; F648-L701 HydrophobicContact CD1-CD1 3.53Å; F648-L701 HydrophobicContact CE1-CD1 3.95Å; F648-L701 HydrophobicContact CG-CD1 4.29Å; W651-L701 HydrophobicContact CB-CD1 3.9Å; W651-L701 HydrophobicContact CB-CD2 3.93Å; W651-L701 HydrophobicContact CB-CG 3.78Å; W651-L701 HydrophobicContact CD2-CD2 4.08Å; W651-L701 HydrophobicContact CD2-CG 4.37Å; W651-L701 HydrophobicContact CE3-CD2 3.79Å; W651-L701 HydrophobicContact CE3-CG 3.85Å; W651-L701 HydrophobicContact CG-CD2 4.18Å; W651-L701 HydrophobicContact CG-CG 4.41Å; I686-L701 HydrophobicContact CD1-CD2 3.81Å; L701-V774 CarbonylContact O-C 3.55Å; L701-V774 WeakPolarHBondContact O-CA 3.26Å; L701-I775 HydrophobicContact CB-CB 4.35Å; L701-I775 PolarHBondContact N-O 2.74Å; L701-I775 PolarHBondContact O-N 2.79Å; L701-I792 HydrophobicContact CD2-CD1 4.18Å
702	V	91.1	Very high	71.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.4	-170.8	-173.6	0	0	0	0	110.2	W651 T652 E654 Q772 V774	W651-V702 CarbonylContact C-O 3.57Å; W651-V702 VanDerWaalsContact CA-O 3.3Å; W651-V702 WeakPolarHBondContact CA-O 3.43Å; W651-V702 VanDerWaalsContact CE3-C 3.45Å; T652-V702 PolarHBondContact N-O 3.43Å; T652-V702 PolarHBondContact O-N 3.27Å; E654-V702 HydrophobicContact CB-CG2 4.12Å; E654-V702 HydrophobicContact CG-CG2 3.86Å; V702-Q772 HydrophobicContact CG1-CB 3.94Å; V702-Q772 HydrophobicContact CG1-CG 4.35Å; V702-V774 HydrophobicContact CG1-CG2 4.2Å; V702-V774 HydrophobicContact CG2-CG1 4.25Å; V702-V774 HydrophobicContact CG2-CG2 4.22Å
703	S	90.1	Very high	72.6	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-69	158.8	177.6	80.5	0	0	0	0	111.3	W651 Q772 V773	W651-S703 VanDerWaalsContact CE3-N 3.25Å; S703-Q772 PolarHBondContact O-NE2 2.9Å; S703-V773 WeakPolarHBondContact CB-O 3.43Å; S703-V773 PolarHBondContact N-O 2.85Å; S703-V773 PolarHBondContact OG-N 2.81Å
704	P	85.1	Confident	74.2	Confident	31 Å²	31	58.1 Å²	58.1	20%	0.201	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-61.9	166.8	163.4	-13	24.9	0	0	0	111.8	W635 R650 V706	W635-P704 HydrophobicContact CD2-CB 4.48Å; W635-P704 HydrophobicContact CE3-CB 3.51Å; W635-P704 HydrophobicContact CE3-CG 3.45Å; W635-P704 VanDerWaalsContact CE3-CG 3.45Å; W635-P704 HydrophobicContact CH2-CB 4.06Å; W635-P704 WeakPolarHBondContact CH2-O 3.27Å; W635-P704 HydrophobicContact CZ3-CB 3.28Å; W635-P704 HydrophobicContact CZ3-CG 3.59Å; W635-P704 WeakPolarHBondContact CZ3-O 3.49Å; R650-P704 HydrophobicContact CB-CG 3.95Å; R650-P704 WeakPolarHBondContact O-CG 3.25Å; P704-V706 PolarHBondContact O-N 3.39Å
705	M	80.3	Confident	75.8	Confident	79 Å²	79	51.3 Å²	51.3	39%	0.389	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-64.1	117	-175.2	-81.3	-75.6	-177	0	0	112.1	W635 Q736 P770 Q772	W635-M705 VanDerWaalsContact CH2-C 3.42Å; W635-M705 WeakPolarHBondContact CH2-O 3.34Å; W635-M705 VanDerWaalsContact CZ2-O 3.24Å; W635-M705 WeakPolarHBondContact CZ2-O 3.09Å; M705-Q736 HydrophobicContact CE-CG 4.43Å; M705-P770 HydrophobicContact SD-CB 3.92Å; M705-Q772 HydrophobicContact CE-CG 4.3Å; M705-Q772 HydrophobicContact CG-CG 4.34Å; M705-Q772 HydrophobicContact SD-CG 3.85Å
706	V	79.3	Confident	77.5	Confident	8 Å²	8	43.3 Å²	43.3	5%	0.048	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-88.1	115.5	177.4	-176.6	0	0	0	0	109	W635 F636 P704 L713 P770 Y771	W635-V706 HydrophobicContact CH2-CB 4.37Å; W635-V706 HydrophobicContact CH2-CG2 3.8Å; W635-V706 HydrophobicContact CZ3-CG2 4.41Å; F636-V706 HydrophobicContact CD2-CG2 3.86Å; F636-V706 HydrophobicContact CE2-CG2 3.75Å; P704-V706 PolarHBondContact O-N 3.39Å; V706-L713 HydrophobicContact CG1-CD1 3.67Å; V706-P770 WeakPolarHBondContact O-CA 3.28Å; V706-Y771 HydrophobicContact CB-CD2 4.27Å; V706-Y771 HydrophobicContact CB-CE1 4.45Å; V706-Y771 HydrophobicContact CB-CE2 3.96Å; V706-Y771 WeakPolarHBondContact CB-O 3.46Å; V706-Y771 HydrophobicContact CG1-CE1 4.19Å; V706-Y771 HydrophobicContact CG1-CE2 4.03Å; V706-Y771 HydrophobicContact CG2-CE2 4.37Å; V706-Y771 PolarHBondContact N-O 2.68Å; V706-Y771 PolarHBondContact O-N 2.72Å
707	S	67.4	Low	79	Confident	82 Å²	82	40.1 Å²	40.1	57%	0.573	22%	0.217	S	C	*	.			trans	-112.7	81.7	170.9	60.8	0	0	0	0	109.3
708	S	56.2	Low	80.1	Confident	30 Å²	30	39.8 Å²	39.8	21%	0.21	21%	0.213	C	C	.	.			trans	-95.3	113.4	173.4	179.5	0	0	0	0	108.7	S711	S708-S711 PolarHBondContact OG-N 2.99Å; S708-S711 PolarHBondContact OG-O 3.1Å; S708-S711 VanDerWaalsContact OG-O 3.09Å
709	E	54.3	Low	80.6	Confident	186 Å²	186	39 Å²	39	87%	0.869	21%	0.208	S	C	*	.	S	Bend	trans	-83.8	-10.2	176.3	-76.2	-163.5	159.4	0	0	113.8
710	D	51.5	Low	80.8	Confident	143 Å²	143	39.1 Å²	39.1	77%	0.765	21%	0.209	S	C	*	.	S	Bend	trans	-136.4	-7.7	-169.4	-73.9	-49.4	0	0	0	118.8
711	S	64.9	Low	80.7	Confident	60 Å²	60	36 Å²	36	42%	0.42	20%	0.197	S	C	.	.			trans	-155.7	156.5	179.2	66.4	0	0	0	0	117.2	S708	S708-S711 PolarHBondContact OG-N 2.99Å; S708-S711 PolarHBondContact OG-O 3.1Å; S708-S711 VanDerWaalsContact OG-O 3.09Å
712	D	76.3	Confident	80.2	Confident	64 Å²	64	38 Å²	38	34%	0.342	21%	0.206	S	C	.	.			trans	-63.6	147.5	166	-61.6	-24.1	0	0	0	109.8	L763 R766	D712-L763 HydrophobicContact CB-CD1 4.15Å; D712-R766 WeakPolarHBondContact OD1-CB 3.38Å; D712-R766 WeakPolarHBondContact OD1-CG 3.38Å; D712-R766 PolarHBondContact OD1-N 2.91Å
713	L	82.9	Confident	79.6	Confident	10 Å²	10	38.7 Å²	38.7	5%	0.052	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.3	179.8	-58.5	-175.2	0	0	0	111.1	F633 V706 V764 Y771 V794	F633-L713 HydrophobicContact CE2-CD2 3.7Å; F633-L713 HydrophobicContact CZ-CD2 4.21Å; V706-L713 HydrophobicContact CG1-CD1 3.67Å; L713-V764 HydrophobicContact CB-CB 4.26Å; L713-V764 PolarHBondContact N-O 2.86Å; L713-V764 PolarHBondContact O-N 2.79Å; L713-Y771 WeakPolarHBondContact CD1-OH 3.28Å; L713-V794 HydrophobicContact CB-CG1 3.9Å; L713-V794 HydrophobicContact CD2-CG1 4.22Å; L713-V794 HydrophobicContact CG-CG1 4.49Å
714	C	86.6	Confident	78.6	Confident	7 Å²	7	41.8 Å²	41.8	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	101.9	170.7	-173.4	0	0	0	0	110.6	V794 L795 C803	C714-V794 CarbonylContact O-C 3.48Å; C714-V794 VanDerWaalsContact O-CA 3.31Å; C714-V794 WeakPolarHBondContact O-CA 3.23Å; C714-V794 VanDerWaalsContact O-CG1 3.3Å; C714-V794 WeakPolarHBondContact O-CG1 3.14Å; C714-L795 HydrophobicContact CB-CB 4.25Å; C714-L795 PolarHBondContact O-N 3.36Å; C714-C803 WeakPolarHBondContact CA-SG 3.49Å; C714-C803 HydrophobicContact CB-CB 3.85Å; C714-C803 WeakPolarHBondContact CB-SG 3.22Å; C714-C803 VanDerWaalsContact SG-CA 3.54Å; C714-C803 WeakPolarHBondContact SG-CB 3.46Å; C714-C803 CovalentContact SG-SG 2.03Å; C714-C803 PolarHBondContact SG-SG 3.15Å
715	V	88.6	Confident	77.8	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.7	-179.8	179.2	0	0	0	0	109.3	F636 F717 R761 V762 V764 I792 K793 V794	F636-V715 HydrophobicContact CE1-CB 4.48Å; F636-V715 HydrophobicContact CE1-CG1 3.93Å; F636-V715 HydrophobicContact CE1-CG2 3.75Å; F636-V715 HydrophobicContact CZ-CG1 4.37Å; F636-V715 HydrophobicContact CZ-CG2 3.7Å; V715-F717 HydrophobicContact CG1-CD1 4.45Å; V715-R761 CarbonylContact O-C 3.47Å; V715-R761 WeakPolarHBondContact O-CA 3.48Å; V715-V762 HydrophobicContact CB-CG1 3.85Å; V715-V762 HydrophobicContact CG1-CG1 4.41Å; V715-V762 PolarHBondContact N-O 3.23Å; V715-V762 PolarHBondContact O-N 3.37Å; V715-V764 HydrophobicContact CB-CG2 4.32Å; V715-V764 HydrophobicContact CG2-CG2 3.59Å; V715-I792 HydrophobicContact CG1-CG2 4.32Å; V715-K793 WeakPolarHBondContact CA-O 3.42Å; V715-V794 HydrophobicContact CG2-CG2 4.34Å
716	S	90.6	Very high	77.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	141.2	172.7	165.6	0	0	0	0	109.1	E759 G760 I792 K793	S716-E759 PolarHBondContact OG-OE1 2.94Å; S716-G760 WeakPolarHBondContact CA-O 3.34Å; S716-I792 CarbonylContact O-C 3.52Å; S716-I792 WeakPolarHBondContact O-CA 3.43Å; S716-K793 PolarHBondContact N-O 3.19Å; S716-K793 PolarHBondContact O-N 2.94Å; S716-K793 VanDerWaalsContact O-O 3.08Å
717	F	93.2	Very high	77.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.2	177	58.3	-81	0	0	0	109	V715 Y719 L729 I731 W747 E759 G760 V762 V789 I792	V715-F717 HydrophobicContact CG1-CD1 4.45Å; F717-Y719 HydrophobicContact CD2-CD1 4.43Å; F717-Y719 AromaticContact CE2-CD1 3.98Å; F717-Y719 HydrophobicContact CE2-CD1 3.98Å; F717-L729 HydrophobicContact CE2-CD2 4.04Å; F717-I731 HydrophobicContact CD1-CD1 4.16Å; F717-I731 HydrophobicContact CD1-CG1 4.4Å; F717-I731 HydrophobicContact CD2-CD1 4.39Å; F717-I731 HydrophobicContact CE1-CD1 3.67Å; F717-I731 HydrophobicContact CE1-CG1 3.5Å; F717-I731 VanDerWaalsContact CE1-CG1 3.5Å; F717-I731 HydrophobicContact CE2-CD1 3.91Å; F717-I731 HydrophobicContact CE2-CG1 4.26Å; F717-I731 HydrophobicContact CZ-CD1 3.53Å; F717-I731 HydrophobicContact CZ-CG1 3.41Å; F717-I731 VanDerWaalsContact CZ-CG1 3.41Å; F717-W747 HydrophobicContact CE2-CE3 4.45Å; F717-W747 AromaticContact CE2-CH2 3.98Å; F717-W747 HydrophobicContact CE2-CH2 3.98Å; F717-W747 AromaticContact CE2-CZ3 3.93Å; F717-W747 HydrophobicContact CE2-CZ3 3.93Å; F717-W747 HydrophobicContact CZ-CD2 4.01Å; F717-W747 AromaticContact CZ-CE3 3.76Å; F717-W747 HydrophobicContact CZ-CE3 3.76Å; F717-W747 AromaticContact CZ-CH2 3.87Å; F717-W747 HydrophobicContact CZ-CH2 3.87Å; F717-W747 HydrophobicContact CZ-CZ2 4.17Å; F717-W747 AromaticContact CZ-CZ3 3.68Å; F717-W747 HydrophobicContact CZ-CZ3 3.68Å; F717-E759 CarbonylContact O-C 3.5Å; F717-G760 PolarHBondContact N-O 3.17Å; F717-G760 PolarHBondContact O-N 3.44Å; F717-V762 HydrophobicContact CE1-CG1 4.22Å; F717-V789 HydrophobicContact CB-CG1 4.38Å; F717-V789 HydrophobicContact CD2-CG1 4.3Å; F717-I792 HydrophobicContact CB-CG1 4.06Å
718	W	92.8	Very high	78.6	Confident	50 Å²	50	40 Å²	40	19%	0.189	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.8	173.2	-72.6	80.9	0	0	0	110.2	H678 W757 R758 E759 V789 D790 D791	H678-W718 HydrophobicContact CB-CB 4.19Å; H678-W718 HydrophobicContact CB-CG 4.36Å; H678-W718 AromaticContact CD2-CD2 3.41Å; H678-W718 VanDerWaalsContact CD2-CD2 3.41Å; H678-W718 AromaticContact CD2-CE2 3.98Å; H678-W718 AromaticContact CD2-CE3 3.29Å; H678-W718 AromaticContact CD2-CG 3.89Å; H678-W718 AromaticContact CD2-CZ3 3.75Å; H678-W718 AromaticContact CE1-CD1 3.83Å; H678-W718 AromaticContact CE1-CD2 3.35Å; H678-W718 AromaticContact CE1-CE2 3.1Å; H678-W718 AromaticContact CE1-CE3 3.88Å; H678-W718 AromaticContact CE1-CG 3.79Å; H678-W718 AromaticContact CE1-CH2 3.94Å; H678-W718 AromaticContact CE1-CZ2 3.43Å; H678-W718 VanDerWaalsContact CE1-CZ2 3.43Å; H678-W718 WeakPolarHBondContact CE1-CZ2 3.39Å; H678-W718 AromaticContact CE1-NE1 3.41Å; H678-W718 PolarHBondContact CE1-NE1 2.99Å; H678-W718 AromaticContact CG-CD2 3.65Å; H678-W718 AromaticContact CG-CE3 3.97Å; H678-W718 AromaticContact CG-CG 3.61Å; H678-W718 AromaticContact ND1-CD1 3.62Å; H678-W718 AromaticContact ND1-CD2 3.61Å; H678-W718 AromaticContact ND1-CE2 3.7Å; H678-W718 AromaticContact ND1-CG 3.55Å; H678-W718 AromaticContact ND1-NE1 3.68Å; H678-W718 AromaticContact NE2-CD2 3.23Å; H678-W718 AromaticContact NE2-CE2 3.29Å; H678-W718 VanDerWaalsContact NE2-CE2 3.29Å; H678-W718 AromaticContact NE2-CE3 3.24Å; H678-W718 AromaticContact NE2-CH2 3.36Å; H678-W718 WeakPolarHBondContact NE2-CH2 3.49Å; H678-W718 AromaticContact NE2-CZ2 3.36Å; H678-W718 WeakPolarHBondContact NE2-CZ2 3.4Å; H678-W718 AromaticContact NE2-CZ3 3.3Å; H678-W718 VanDerWaalsContact NE2-CZ3 3.3Å; H678-W718 WeakPolarHBondContact NE2-CZ3 3.38Å; W718-W757 HydrophobicContact CB-CE3 4.28Å; W718-W757 HydrophobicContact CE3-CB 4Å; W718-R758 CarbonylContact C-O 3.58Å; W718-R758 VanDerWaalsContact CA-O 3.27Å; W718-R758 WeakPolarHBondContact CA-O 3.27Å; W718-E759 HydrophobicContact CD2-CB 4.08Å; W718-E759 HydrophobicContact CE3-CB 4.15Å; W718-E759 HydrophobicContact CH2-CB 3.94Å; W718-E759 HydrophobicContact CZ2-CB 3.83Å; W718-E759 HydrophobicContact CZ2-CG 4.24Å; W718-E759 HydrophobicContact CZ3-CB 4.09Å; W718-V789 CarbonylContact O-C 3.54Å; W718-V789 WeakPolarHBondContact O-CA 3.36Å; W718-V789 WeakPolarHBondContact O-CG1 3.39Å; W718-D790 HydrophobicContact CB-CB 4.32Å; W718-D790 PolarHBondContact N-O 2.92Å; W718-D790 PolarHBondContact O-N 2.96Å; W718-D791 HydrophobicContact CG-CB 4.37Å
719	Y	92.9	Very high	80.3	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.3	177.4	71.2	-86.9	0	0	0	112	F717 M721 L729 W747 V749 Q753 W757 R758 A788	F717-Y719 HydrophobicContact CD2-CD1 4.43Å; F717-Y719 AromaticContact CE2-CD1 3.98Å; F717-Y719 HydrophobicContact CE2-CD1 3.98Å; Y719-M721 HydrophobicContact CD2-CG 4.19Å; Y719-M721 HydrophobicContact CD2-SD 4.05Å; Y719-M721 HydrophobicContact CE2-SD 4.44Å; Y719-L729 HydrophobicContact CG-CD2 4.1Å; Y719-W747 AromaticContact CD1-CH2 3.95Å; Y719-W747 HydrophobicContact CD1-CH2 3.95Å; Y719-W747 HydrophobicContact CD1-CZ2 4.43Å; Y719-W747 AromaticContact CE1-CH2 3.68Å; Y719-W747 HydrophobicContact CE1-CH2 3.68Å; Y719-W747 AromaticContact CE1-CZ2 3.81Å; Y719-W747 HydrophobicContact CE1-CZ2 3.81Å; Y719-W747 HydrophobicContact CG-CH2 4.48Å; Y719-V749 HydrophobicContact CD2-CG1 4.32Å; Y719-V749 HydrophobicContact CE2-CG1 3.96Å; Y719-Q753 HydrophobicContact CE2-CB 4.24Å; Y719-Q753 HydrophobicContact CE2-CG 4.05Å; Y719-W757 WeakPolarHBondContact O-CA 3.21Å; Y719-R758 HydrophobicContact CD1-CB 4.33Å; Y719-R758 WeakPolarHBondContact CD1-O 3.36Å; Y719-R758 HydrophobicContact CE1-CB 3.84Å; Y719-R758 HydrophobicContact CE2-CB 4.08Å; Y719-R758 PolarHBondContact N-O 3.15Å; Y719-R758 PolarHBondContact O-N 2.95Å; Y719-A788 CarbonylContact C-O 3.53Å; Y719-A788 WeakPolarHBondContact CA-O 3.47Å
720	H	90.7	Very high	82.1	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.014	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.7	174.6	178.1	-66.7	0	0	0	109.1	T672 P674 N755 W757 A788	T672-H720 PolarHBondContact O-CE1 3.25Å; P674-H720 HydrophobicContact CB-CB 4.46Å; P674-H720 HydrophobicContact CG-CB 4.29Å; H720-N755 PolarHBondContact NE2-OD1 2.94Å; H720-W757 HydrophobicContact CB-CD2 3.83Å; H720-W757 HydrophobicContact CB-CE3 3.57Å; H720-W757 HydrophobicContact CB-CG 4.48Å; H720-W757 HydrophobicContact CB-CH2 4.27Å; H720-W757 HydrophobicContact CB-CZ3 3.8Å; H720-A788 HydrophobicContact CB-CB 4.29Å; H720-A788 PolarHBondContact N-O 2.82Å; H720-A788 PolarHBondContact O-N 2.59Å
721	M	88.5	Confident	84.1	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	95.5	-174.7	-73.7	177.9	75.2	0	0	109.9	Y719 I726 G727 L729 V749 Q753 I787	Y719-M721 HydrophobicContact CD2-CG 4.19Å; Y719-M721 HydrophobicContact CD2-SD 4.05Å; Y719-M721 HydrophobicContact CE2-SD 4.44Å; M721-I726 HydrophobicContact CB-CG2 4.01Å; M721-I726 HydrophobicContact CE-CG2 3.56Å; M721-I726 HydrophobicContact CG-CG2 4.26Å; M721-G727 WeakPolarHBondContact CE-O 3.42Å; M721-L729 HydrophobicContact CE-CB 4.39Å; M721-L729 HydrophobicContact SD-CB 3.9Å; M721-V749 HydrophobicContact CE-CG1 4.43Å; M721-V749 HydrophobicContact SD-CG1 3.62Å; M721-Q753 HydrophobicContact CB-CB 4.11Å; M721-Q753 HydrophobicContact CB-CG 4Å; M721-Q753 PolarHBondContact O-N 3.4Å; M721-I787 HydrophobicContact CE-CD1 4.01Å; M721-I787 HydrophobicContact CE-CG1 4.07Å; M721-I787 HydrophobicContact CG-CB 4.3Å; M721-I787 HydrophobicContact CG-CG1 4.18Å; M721-I787 HydrophobicContact CG-CG2 3.89Å; M721-I787 HydrophobicContact SD-CG2 4.17Å
722	H	82.1	Confident	85.4	Confident	42 Å²	42	22.8 Å²	22.8	19%	0.194	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.3	-176.6	-179.7	64.4	0	0	0	112.9	N671 T672 H752 N755	N671-H722 PolarHBondContact O-CD2 3.17Å; T672-H722 WeakPolarHBondContact CB-O 3.17Å; T672-H722 WeakPolarHBondContact O-CB 3.34Å; H722-H752 AromaticContact CE1-CD2 3.93Å; H722-H752 AromaticContact CE1-NE2 3.36Å; H722-H752 PolarHBondContact CE1-NE2 2.75Å; H722-H752 AromaticContact ND1-CD2 3.25Å; H722-H752 PolarHBondContact ND1-CD2 3.13Å; H722-H752 VanDerWaalsContact ND1-CD2 3.25Å; H722-H752 AromaticContact ND1-NE2 2.85Å; H722-H752 PolarHBondContact ND1-NE2 3.05Å; H722-N755 HydrophobicContact CB-CB 4.33Å
723	G	77.4	Confident	86.1	Confident	14 Å²	14	19.9 Å²	19.9	14%	0.144	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-176.3	178.3	0	0	0	0	0	112.2	W784	G723-W784 CarbonylContact C-O 3.58Å; G723-W784 VanDerWaalsContact CA-O 3.26Å; G723-W784 WeakPolarHBondContact CA-O 3.5Å
724	S	68.9	Low	86.3	Confident	65 Å²	65	20 Å²	20	46%	0.455	10%	0.102	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.1	177.4	57.5	0	0	0	0	110.1	W784	S724-W784 PolarHBondContact N-O 2.9Å; S724-W784 PolarHBondContact O-N 3.01Å
725	H	69.8	Low	86.1	Confident	142 Å²	142	21.6 Å²	21.6	66%	0.657	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	41.8	-177.9	-52.5	-74.6	0	0	0	113.8	S783	H725-S783 WeakPolarHBondContact O-CA 3.38Å; H725-S783 WeakPolarHBondContact O-CB 3.49Å
726	I	74.4	Confident	85.2	Confident	8 Å²	8	27.3 Å²	27.3	4%	0.041	14%	0.136	C	C	.	.			trans	-59	141.7	172.7	-59.8	-55.9	0	0	0	110.5	A690 M721 G751 G785 I787	A690-I726 HydrophobicContact CB-CD1 4.5Å; M721-I726 HydrophobicContact CB-CG2 4.01Å; M721-I726 HydrophobicContact CE-CG2 3.56Å; M721-I726 HydrophobicContact CG-CG2 4.26Å; I726-G751 WeakPolarHBondContact O-CA 3.25Å; I726-G751 PolarHBondContact O-N 3.28Å; I726-G785 VanDerWaalsContact CD1-CA 3.5Å; I726-I787 HydrophobicContact CG2-CD1 4.34Å; I726-I787 HydrophobicContact CG2-CG1 3.83Å
727	G	80.7	Confident	84.1	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.			trans	-64	-157.4	178	0	0	0	0	0	115.1	M721 G751 L778	M721-G727 WeakPolarHBondContact CE-O 3.42Å; G727-G751 PolarHBondContact O-N 3.13Å; G727-L778 CarbonylContact C-O 3.59Å; G727-L778 WeakPolarHBondContact CA-O 3.4Å
728	T	87.4	Confident	82.5	Confident	13 Å²	13	39.6 Å²	39.6	8%	0.08	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.4	-177.2	-52.1	0	0	0	0	110.2	H730 T748 V749 S750 L778	T728-H730 VanDerWaalsContact CG2-NE2 3.33Å; T728-H730 WeakPolarHBondContact CG2-NE2 3.03Å; T728-T748 WeakPolarHBondContact CG2-OG1 3.33Å; T728-V749 CarbonylContact C-O 3.57Å; T728-V749 WeakPolarHBondContact CA-O 3.14Å; T728-V749 WeakPolarHBondContact CG2-O 3.32Å; T728-S750 WeakPolarHBondContact OG1-CB 3.38Å; T728-L778 PolarHBondContact N-O 2.8Å; T728-L778 PolarHBondContact O-N 2.9Å
729	L	91.8	Very high	80.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.6	173.4	179.6	66.1	0	0	0	109.1	W660 F717 Y719 M721 W747 T748 V749 I775 E776 I787 V789	W660-L729 HydrophobicContact CH2-CD1 4.1Å; W660-L729 HydrophobicContact CZ2-CD1 4.17Å; F717-L729 HydrophobicContact CE2-CD2 4.04Å; Y719-L729 HydrophobicContact CG-CD2 4.1Å; M721-L729 HydrophobicContact CE-CB 4.39Å; M721-L729 HydrophobicContact SD-CB 3.9Å; L729-W747 HydrophobicContact CB-CZ3 4.33Å; L729-W747 HydrophobicContact CD2-CH2 4.44Å; L729-W747 HydrophobicContact CD2-CZ3 4.02Å; L729-W747 HydrophobicContact CG-CZ3 4.06Å; L729-T748 WeakPolarHBondContact O-CA 3.43Å; L729-V749 HydrophobicContact CB-CG1 4.04Å; L729-V749 PolarHBondContact N-O 2.83Å; L729-V749 PolarHBondContact O-N 3.36Å; L729-I775 HydrophobicContact CD1-CG2 3.79Å; L729-E776 CarbonylContact C-O 3.54Å; L729-E776 WeakPolarHBondContact CA-O 3.46Å; L729-I787 HydrophobicContact CB-CG2 4.26Å; L729-I787 HydrophobicContact CD1-CG2 4.2Å; L729-I787 HydrophobicContact CD2-CG2 4.49Å; L729-V789 HydrophobicContact CD1-CG2 4.03Å; L729-V789 HydrophobicContact CD2-CG2 3.87Å
730	H	93.1	Very high	79.4	Confident	30 Å²	30	48.6 Å²	48.6	14%	0.139	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.9	179.9	-67.8	145.7	0	0	0	111.3	T728 K732 L745 W747 T748 I775 E776	T728-H730 VanDerWaalsContact CG2-NE2 3.33Å; T728-H730 WeakPolarHBondContact CG2-NE2 3.03Å; H730-K732 HydrophobicContact CB-CG 4.31Å; H730-L745 HydrophobicContact CB-CD1 3.72Å; H730-W747 CarbonylContact C-O 3.52Å; H730-W747 WeakPolarHBondContact CA-O 3.4Å; H730-T748 VanDerWaalsContact CD2-CB 3.48Å; H730-T748 WeakPolarHBondContact CD2-CB 3.49Å; H730-T748 PolarHBondContact CD2-OG1 2.81Å; H730-T748 PolarHBondContact NE2-OG1 3.08Å; H730-I775 WeakPolarHBondContact O-CA 3.28Å; H730-E776 HydrophobicContact CB-CB 4.14Å; H730-E776 IonicContact CE1-OE1 3.73Å; H730-E776 IonicContact CG-OE1 2.74Å; H730-E776 PolarHBondContact N-O 3.4Å; H730-E776 IonicContact ND1-OE1 2.85Å; H730-E776 PolarHBondContact ND1-OE1 2.04Å; H730-E776 PolarHBondContact O-N 3.29Å
731	I	92.7	Very high	78.6	Confident	1 Å²	1	53 Å²	53	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.7	162.9	-44.2	-66.8	0	0	0	108.6	F717 L746 W747 V762 V773 V774 I775	F717-I731 HydrophobicContact CD1-CD1 4.16Å; F717-I731 HydrophobicContact CD1-CG1 4.4Å; F717-I731 HydrophobicContact CD2-CD1 4.39Å; F717-I731 HydrophobicContact CE1-CD1 3.67Å; F717-I731 HydrophobicContact CE1-CG1 3.5Å; F717-I731 VanDerWaalsContact CE1-CG1 3.5Å; F717-I731 HydrophobicContact CE2-CD1 3.91Å; F717-I731 HydrophobicContact CE2-CG1 4.26Å; F717-I731 HydrophobicContact CZ-CD1 3.53Å; F717-I731 HydrophobicContact CZ-CG1 3.41Å; F717-I731 VanDerWaalsContact CZ-CG1 3.41Å; I731-L746 PolarHBondContact O-N 3.38Å; I731-W747 HydrophobicContact CB-CB 4.11Å; I731-W747 HydrophobicContact CG1-CB 4.17Å; I731-W747 HydrophobicContact CG1-CD2 4.38Å; I731-W747 HydrophobicContact CG1-CE3 3.83Å; I731-W747 PolarHBondContact N-O 2.78Å; I731-W747 PolarHBondContact O-N 2.6Å; I731-W747 VanDerWaalsContact O-N 3.12Å; I731-V762 HydrophobicContact CB-CG1 4.22Å; I731-V762 HydrophobicContact CG1-CG1 4.43Å; I731-V762 HydrophobicContact CG2-CG1 3.83Å; I731-V773 HydrophobicContact CG2-CG1 3.75Å; I731-V774 CarbonylContact C-O 3.51Å; I731-V774 WeakPolarHBondContact CA-O 3.2Å; I731-I775 HydrophobicContact CD1-CB 4.17Å; I731-I775 HydrophobicContact CD1-CD1 4.28Å; I731-I775 HydrophobicContact CD1-CG1 3.73Å; I731-I775 HydrophobicContact CD1-CG2 3.95Å
732	K	92	Very high	78.1	Confident	27 Å²	27	55 Å²	55	12%	0.117	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	153.6	-175.6	-48.2	-175.6	-176	170.9	0	111.5	H730 D743 I744 L745 V773 V774 E776	H730-K732 HydrophobicContact CB-CG 4.31Å; K732-D743 HydrophobicContact CB-CB 4.49Å; K732-D743 HydrophobicContact CD-CB 4.01Å; K732-I744 CarbonylContact C-O 3.09Å; K732-I744 WeakPolarHBondContact CA-O 3.22Å; K732-I744 WeakPolarHBondContact CB-O 3.47Å; K732-L745 HydrophobicContact CG-CD1 4Å; K732-V773 CarbonylContact O-C 3.57Å; K732-V773 WeakPolarHBondContact O-CA 3.41Å; K732-V774 HydrophobicContact CB-CB 4.26Å; K732-V774 PolarHBondContact N-O 2.96Å; K732-V774 PolarHBondContact O-N 3.34Å; K732-E776 WeakPolarHBondContact CE-OE1 3.17Å; K732-E776 IonicContact NZ-OE1 2.73Å; K732-E776 PolarHBondContact NZ-OE1 3.09Å; K732-E776 IonicContact NZ-OE2 3.36Å; K732-E776 PolarHBondContact NZ-OE2 2.79Å
733	Q	90.4	Very high	78.2	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.009	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.2	167.6	177.2	174.8	37.6	0	0	109.3	I744 L746 V764 P765 I767 Y771 Q772	Q733-I744 PolarHBondContact N-O 3.26Å; Q733-I744 PolarHBondContact O-N 2.85Å; Q733-L746 HydrophobicContact CB-CD1 3.71Å; Q733-L746 HydrophobicContact CB-CD2 4.5Å; Q733-L746 HydrophobicContact CB-CG 4.15Å; Q733-V764 HydrophobicContact CB-CG1 4.4Å; Q733-V764 HydrophobicContact CG-CG1 4.27Å; Q733-P765 PolarHBondContact NE2-O 2.84Å; Q733-I767 HydrophobicContact CG-CD1 4.14Å; Q733-I767 VanDerWaalsContact NE2-CD1 3.31Å; Q733-Y771 HydrophobicContact CG-CD2 3.76Å; Q733-Y771 HydrophobicContact CG-CE2 4.41Å; Q733-Y771 HydrophobicContact CG-CG 4.16Å; Q733-Y771 VanDerWaalsContact NE2-CD2 3.32Å; Q733-Q772 CarbonylContact C-O 3.53Å; Q733-Q772 WeakPolarHBondContact CA-O 3.04Å
734	R	87.6	Confident	78.7	Confident	12 Å²	12	58.8 Å²	58.8	5%	0.045	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.2	-178.8	176.9	174.7	-66.5	170.3	0.3	111.1	E654 A742 D743 Y771 Q772 V774	E654-R734 IonicContact OE1-NH1 3.66Å; E654-R734 PolarHBondContact OE1-NH1 2.85Å; E654-R734 IonicContact OE2-CZ 3.92Å; E654-R734 IonicContact OE2-NH1 3.54Å; E654-R734 PolarHBondContact OE2-NH1 3.19Å; E654-R734 IonicContact OE2-NH2 3.38Å; R734-A742 WeakPolarHBondContact CA-O 3.43Å; R734-D743 VanDerWaalsContact CB-OD1 3.29Å; R734-D743 WeakPolarHBondContact CB-OD1 3.42Å; R734-D743 WeakPolarHBondContact CG-OD1 3.49Å; R734-D743 IonicContact CZ-OD1 2.83Å; R734-D743 IonicContact CZ-OD2 2.95Å; R734-D743 IonicContact NE-OD1 3.57Å; R734-D743 PolarHBondContact NE-OD1 3.42Å; R734-D743 IonicContact NE-OD2 3.39Å; R734-D743 IonicContact NH2-OD1 2.89Å; R734-D743 IonicContact NH2-OD2 2.79Å; R734-D743 PolarHBondContact NH2-OD2 3.39Å; R734-Y771 CarbonylContact O-C 3.48Å; R734-Y771 VanDerWaalsContact O-CA 3.27Å; R734-Y771 WeakPolarHBondContact O-CA 3.47Å; R734-Y771 VanDerWaalsContact O-CB 3.3Å; R734-Y771 WeakPolarHBondContact O-CB 3.47Å; R734-Q772 HydrophobicContact CB-CB 4.36Å; R734-Q772 PolarHBondContact N-O 3.24Å; R734-Q772 PolarHBondContact O-N 2.65Å; R734-V774 HydrophobicContact CB-CG2 3.93Å
735	E	83.3	Confident	79.5	Confident	41 Å²	41	59.9 Å²	59.9	19%	0.192	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142.8	173.6	-170	-176.2	174.9	0	0	110.9	T737 A742 K769	E735-T737 HydrophobicContact CG-CG2 4.5Å; E735-A742 PolarHBondContact N-O 3.47Å; E735-A742 PolarHBondContact O-N 2.8Å; E735-K769 IonicContact OE1-NZ 2.77Å
736	Q	69.1	Low	80.3	Confident	121 Å²	121	54.9 Å²	54.9	57%	0.565	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.9	165.4	-78.2	-157.1	9.7	0	0	110.9	M705	M705-Q736 HydrophobicContact CE-CG 4.43Å
737	T	68	Low	81.1	Confident	57 Å²	57	55 Å²	55	35%	0.35	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	164.4	174.1	72.7	0	0	0	0	111	E735 E739 G740 A742	E735-T737 HydrophobicContact CG-CG2 4.5Å; T737-E739 PolarHBondContact O-N 3.38Å; T737-G740 WeakPolarHBondContact CA-O 3.41Å; T737-G740 PolarHBondContact N-O 3.39Å; T737-G740 PolarHBondContact O-N 2.47Å; T737-G740 PolarHBondContact OG1-N 3.27Å; T737-G740 PolarHBondContact OG1-O 3.05Å; T737-A742 HydrophobicContact CG2-CB 4.23Å
738	E	59.4	Low	81.6	Confident	202 Å²	202	57.9 Å²	57.9	94%	0.944	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.9	179.7	-65.8	-177	176.9	0	0	113.3
739	E	55	Low	81.6	Confident	201 Å²	201	57.8 Å²	57.8	94%	0.939	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-5.2	179.3	-66.4	-177.8	170.2	0	0	113.7	T737	T737-E739 PolarHBondContact O-N 3.38Å
740	G	65.8	Low	81.4	Confident	40 Å²	40	61.3 Å²	61.3	41%	0.412	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	144.1	-169.5	-178.9	0	0	0	0	0	114.5	T737	T737-G740 WeakPolarHBondContact CA-O 3.41Å; T737-G740 PolarHBondContact N-O 3.39Å; T737-G740 PolarHBondContact O-N 2.47Å; T737-G740 PolarHBondContact OG1-N 3.27Å; T737-G740 PolarHBondContact OG1-O 3.05Å
741	T	72.4	Confident	80.8	Confident	96 Å²	96	60.8 Å²	60.8	59%	0.589	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.4	175.1	51.8	0	0	0	0	111.1
742	A	78.9	Confident	80.3	Confident	41 Å²	41	65.6 Å²	65.6	34%	0.339	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.2	175.1	0	0	0	0	0	110.7	R734 E735 T737	R734-A742 WeakPolarHBondContact CA-O 3.43Å; E735-A742 PolarHBondContact N-O 3.47Å; E735-A742 PolarHBondContact O-N 2.8Å; T737-A742 HydrophobicContact CG2-CB 4.23Å
743	D	85	Confident	80	Confident	54 Å²	54	66.5 Å²	66.5	29%	0.289	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.7	179.9	-72	-3.6	0	0	0	110.5	K732 R734	K732-D743 HydrophobicContact CB-CB 4.49Å; K732-D743 HydrophobicContact CD-CB 4.01Å; R734-D743 VanDerWaalsContact CB-OD1 3.29Å; R734-D743 WeakPolarHBondContact CB-OD1 3.42Å; R734-D743 WeakPolarHBondContact CG-OD1 3.49Å; R734-D743 IonicContact CZ-OD1 2.83Å; R734-D743 IonicContact CZ-OD2 2.95Å; R734-D743 IonicContact NE-OD1 3.57Å; R734-D743 PolarHBondContact NE-OD1 3.42Å; R734-D743 IonicContact NE-OD2 3.39Å; R734-D743 IonicContact NH2-OD1 2.89Å; R734-D743 IonicContact NH2-OD2 2.79Å; R734-D743 PolarHBondContact NH2-OD2 3.39Å
744	I	86.3	Confident	79.4	Confident	81 Å²	81	67.2 Å²	67.2	42%	0.415	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.8	176.3	-57	171.6	0	0	0	108.5	K732 Q733 L746	K732-I744 CarbonylContact C-O 3.09Å; K732-I744 WeakPolarHBondContact CA-O 3.22Å; K732-I744 WeakPolarHBondContact CB-O 3.47Å; Q733-I744 PolarHBondContact N-O 3.26Å; Q733-I744 PolarHBondContact O-N 2.85Å; I744-L746 HydrophobicContact CG2-CD2 4.21Å; I744-L746 PolarHBondContact O-N 2.88Å
745	L	86.3	Confident	79.1	Confident	89 Å²	89	70.8 Å²	70.8	47%	0.466	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.2	176.8	-178.4	66.6	0	0	0	110.6	H730 K732 W747	H730-L745 HydrophobicContact CB-CD1 3.72Å; K732-L745 HydrophobicContact CG-CD1 4Å; L745-W747 WeakPolarHBondContact CD1-O 3.41Å
746	L	86.5	Confident	79.1	Confident	37 Å²	37	76.7 Å²	76.7	19%	0.194	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-33.5	-179.1	-60.2	-178.1	0	0	0	113	I731 Q733 I744 V762 V764	I731-L746 PolarHBondContact O-N 3.38Å; Q733-L746 HydrophobicContact CB-CD1 3.71Å; Q733-L746 HydrophobicContact CB-CD2 4.5Å; Q733-L746 HydrophobicContact CB-CG 4.15Å; I744-L746 HydrophobicContact CG2-CD2 4.21Å; I744-L746 PolarHBondContact O-N 2.88Å; L746-V762 HydrophobicContact CB-CG2 3.42Å; L746-V762 VanDerWaalsContact CB-CG2 3.42Å; L746-V762 HydrophobicContact CD1-CG2 4.31Å; L746-V764 HydrophobicContact CD1-CB 4.1Å; L746-V764 HydrophobicContact CD1-CG1 4.01Å; L746-V764 HydrophobicContact CD1-CG2 3.76Å
747	W	91.1	Very high	80.1	Confident	10 Å²	10	72.4 Å²	72.4	4%	0.038	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	144.9	-179.4	-176.9	100.4	0	0	0	111.1	F717 Y719 L729 H730 I731 L745 V749 V762 D805 V808	F717-W747 HydrophobicContact CE2-CE3 4.45Å; F717-W747 AromaticContact CE2-CH2 3.98Å; F717-W747 HydrophobicContact CE2-CH2 3.98Å; F717-W747 AromaticContact CE2-CZ3 3.93Å; F717-W747 HydrophobicContact CE2-CZ3 3.93Å; F717-W747 HydrophobicContact CZ-CD2 4.01Å; F717-W747 AromaticContact CZ-CE3 3.76Å; F717-W747 HydrophobicContact CZ-CE3 3.76Å; F717-W747 AromaticContact CZ-CH2 3.87Å; F717-W747 HydrophobicContact CZ-CH2 3.87Å; F717-W747 HydrophobicContact CZ-CZ2 4.17Å; F717-W747 AromaticContact CZ-CZ3 3.68Å; F717-W747 HydrophobicContact CZ-CZ3 3.68Å; Y719-W747 AromaticContact CD1-CH2 3.95Å; Y719-W747 HydrophobicContact CD1-CH2 3.95Å; Y719-W747 HydrophobicContact CD1-CZ2 4.43Å; Y719-W747 AromaticContact CE1-CH2 3.68Å; Y719-W747 HydrophobicContact CE1-CH2 3.68Å; Y719-W747 AromaticContact CE1-CZ2 3.81Å; Y719-W747 HydrophobicContact CE1-CZ2 3.81Å; Y719-W747 HydrophobicContact CG-CH2 4.48Å; L729-W747 HydrophobicContact CB-CZ3 4.33Å; L729-W747 HydrophobicContact CD2-CH2 4.44Å; L729-W747 HydrophobicContact CD2-CZ3 4.02Å; L729-W747 HydrophobicContact CG-CZ3 4.06Å; H730-W747 CarbonylContact C-O 3.52Å; H730-W747 WeakPolarHBondContact CA-O 3.4Å; I731-W747 HydrophobicContact CB-CB 4.11Å; I731-W747 HydrophobicContact CG1-CB 4.17Å; I731-W747 HydrophobicContact CG1-CD2 4.38Å; I731-W747 HydrophobicContact CG1-CE3 3.83Å; I731-W747 PolarHBondContact N-O 2.78Å; I731-W747 PolarHBondContact O-N 2.6Å; I731-W747 VanDerWaalsContact O-N 3.12Å; L745-W747 WeakPolarHBondContact CD1-O 3.41Å; W747-V749 HydrophobicContact CH2-CB 3.57Å; W747-V749 HydrophobicContact CH2-CG1 3.22Å; W747-V749 HydrophobicContact CZ2-CB 4.01Å; W747-V749 HydrophobicContact CZ2-CG1 4.12Å; W747-V749 HydrophobicContact CZ3-CB 3.96Å; W747-V749 HydrophobicContact CZ3-CG1 3.54Å; W747-V762 HydrophobicContact CB-CB 3.89Å; W747-V762 HydrophobicContact CB-CG2 3.67Å; W747-V762 HydrophobicContact CG-CB 4.41Å; W747-D805 WeakPolarHBondContact CZ2-OD2 3.16Å; W747-D805 PolarHBondContact NE1-OD2 2.86Å; W747-V808 HydrophobicContact CZ2-CG2 4.4Å
748	T	91.2	Very high	81	Confident	60 Å²	60	72.9 Å²	72.9	37%	0.368	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.9	179	-174.9	0	0	0	0	112	T728 L729 H730	T728-T748 WeakPolarHBondContact CG2-OG1 3.33Å; L729-T748 WeakPolarHBondContact O-CA 3.43Å; H730-T748 VanDerWaalsContact CD2-CB 3.48Å; H730-T748 WeakPolarHBondContact CD2-CB 3.49Å; H730-T748 PolarHBondContact CD2-OG1 2.81Å; H730-T748 PolarHBondContact NE2-OG1 3.08Å
749	V	88.1	Confident	82.5	Confident	11 Å²	11	65.1 Å²	65.1	7%	0.067	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	139.1	165.8	75.1	0	0	0	0	109.9	Y719 M721 T728 L729 W747 Q753	Y719-V749 HydrophobicContact CD2-CG1 4.32Å; Y719-V749 HydrophobicContact CE2-CG1 3.96Å; M721-V749 HydrophobicContact CE-CG1 4.43Å; M721-V749 HydrophobicContact SD-CG1 3.62Å; T728-V749 CarbonylContact C-O 3.57Å; T728-V749 WeakPolarHBondContact CA-O 3.14Å; T728-V749 WeakPolarHBondContact CG2-O 3.32Å; L729-V749 HydrophobicContact CB-CG1 4.04Å; L729-V749 PolarHBondContact N-O 2.83Å; L729-V749 PolarHBondContact O-N 3.36Å; W747-V749 HydrophobicContact CH2-CB 3.57Å; W747-V749 HydrophobicContact CH2-CG1 3.22Å; W747-V749 HydrophobicContact CZ2-CB 4.01Å; W747-V749 HydrophobicContact CZ2-CG1 4.12Å; W747-V749 HydrophobicContact CZ3-CB 3.96Å; W747-V749 HydrophobicContact CZ3-CG1 3.54Å; V749-Q753 HydrophobicContact CG2-CG 4Å
750	S	87.1	Confident	84.1	Confident	74 Å²	74	55.6 Å²	55.6	52%	0.517	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	151	-177.8	63.7	0	0	0	0	112.4	T728 Q753	T728-S750 WeakPolarHBondContact OG1-CB 3.38Å; S750-Q753 PolarHBondContact O-NE2 2.86Å
751	G	80.5	Confident	85.2	Confident	20 Å²	20	57 Å²	57	21%	0.206	30%	0.297	C	S	.	.	S	Bend	trans	77.4	-166.9	170.8	0	0	0	0	0	114.3	I726 G727 Q753	I726-G751 WeakPolarHBondContact O-CA 3.25Å; I726-G751 PolarHBondContact O-N 3.28Å; G727-G751 PolarHBondContact O-N 3.13Å; G751-Q753 PolarHBondContact O-N 2.81Å
752	H	82.3	Confident	86	Confident	102 Å²	102	52.6 Å²	52.6	47%	0.472	27%	0.271	S	S	.	.			trans	-74.3	121.1	-174.1	168.4	-75.5	0	0	0	112.1	H722 G754	H722-H752 AromaticContact CE1-CD2 3.93Å; H722-H752 AromaticContact CE1-NE2 3.36Å; H722-H752 PolarHBondContact CE1-NE2 2.75Å; H722-H752 AromaticContact ND1-CD2 3.25Å; H722-H752 PolarHBondContact ND1-CD2 3.13Å; H722-H752 VanDerWaalsContact ND1-CD2 3.25Å; H722-H752 AromaticContact ND1-NE2 2.85Å; H722-H752 PolarHBondContact ND1-NE2 3.05Å; H752-G754 WeakPolarHBondContact CE1-CA 3.25Å; H752-G754 PolarHBondContact CE1-N 3.45Å; H752-G754 VanDerWaalsContact CE1-N 3.26Å; H752-G754 PolarHBondContact ND1-N 2.86Å
753	Q	86.6	Confident	86.3	Confident	46 Å²	46	52.8 Å²	52.8	22%	0.215	27%	0.266	C	S	.	.			trans	-106.4	1.5	-178.2	-59.4	-59.6	-38.6	0	0	113.7	Y719 M721 V749 S750 G751 R758	Y719-Q753 HydrophobicContact CE2-CB 4.24Å; Y719-Q753 HydrophobicContact CE2-CG 4.05Å; M721-Q753 HydrophobicContact CB-CB 4.11Å; M721-Q753 HydrophobicContact CB-CG 4Å; M721-Q753 PolarHBondContact O-N 3.4Å; V749-Q753 HydrophobicContact CG2-CG 4Å; S750-Q753 PolarHBondContact O-NE2 2.86Å; G751-Q753 PolarHBondContact O-N 2.81Å; Q753-R758 PolarHBondContact O-NE 2.84Å; Q753-R758 PolarHBondContact O-NH2 3.04Å
754	G	76.5	Confident	86.4	Confident	16 Å²	16	50.2 Å²	50.2	17%	0.165	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97	157.2	-178.1	0	0	0	0	0	112.8	H752 R756	H752-G754 WeakPolarHBondContact CE1-CA 3.25Å; H752-G754 PolarHBondContact CE1-N 3.45Å; H752-G754 VanDerWaalsContact CE1-N 3.26Å; H752-G754 PolarHBondContact ND1-N 2.86Å; G754-R756 PolarHBondContact O-N 2.79Å
755	N	82.8	Confident	86.1	Confident	88 Å²	88	48.7 Å²	48.7	47%	0.471	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	67.8	-178.7	-166.4	-0.5	0	0	0	111.7	H720 H722	H720-N755 PolarHBondContact NE2-OD1 2.94Å; H722-N755 HydrophobicContact CB-CB 4.33Å
756	R	83.3	Confident	85.8	Confident	164 Å²	164	52.3 Å²	52.3	62%	0.619	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162	153.1	175.4	61.3	-178.6	-66.2	-173.6	-0.4	110.3	G754	G754-R756 PolarHBondContact O-N 2.79Å
757	W	88.4	Confident	85.2	Confident	32 Å²	32	52.3 Å²	52.3	12%	0.121	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	142.2	166.8	-67.1	108.9	0	0	0	111.1	P674 M676 D677 H678 F685 W718 Y719 H720 A788 D790	P674-W757 HydrophobicContact CB-CH2 4.36Å; P674-W757 HydrophobicContact CB-CZ2 3.46Å; P674-W757 VanDerWaalsContact CB-CZ2 3.46Å; P674-W757 HydrophobicContact CG-CH2 3.81Å; P674-W757 HydrophobicContact CG-CZ2 3.33Å; M676-W757 PolarHBondContact O-NE1 2.88Å; D677-W757 PolarHBondContact O-NE1 2.83Å; H678-W757 HydrophobicContact CB-CB 4.44Å; H678-W757 HydrophobicContact CB-CD2 3.93Å; H678-W757 HydrophobicContact CB-CE3 4.34Å; H678-W757 HydrophobicContact CB-CG 3.98Å; H678-W757 AromaticContact CD2-CG 3.98Å; F685-W757 HydrophobicContact CB-CH2 3.63Å; F685-W757 HydrophobicContact CB-CZ2 3.9Å; F685-W757 HydrophobicContact CD1-CZ2 4.05Å; F685-W757 AromaticContact CD2-CH2 3.93Å; F685-W757 HydrophobicContact CD2-CH2 3.93Å; F685-W757 HydrophobicContact CD2-CZ2 4.12Å; F685-W757 AromaticContact CG-CH2 3.77Å; F685-W757 HydrophobicContact CG-CH2 3.77Å; F685-W757 AromaticContact CG-CZ2 3.74Å; F685-W757 HydrophobicContact CG-CZ2 3.74Å; W718-W757 HydrophobicContact CB-CE3 4.28Å; W718-W757 HydrophobicContact CE3-CB 4Å; Y719-W757 WeakPolarHBondContact O-CA 3.21Å; H720-W757 HydrophobicContact CB-CD2 3.83Å; H720-W757 HydrophobicContact CB-CE3 3.57Å; H720-W757 HydrophobicContact CB-CG 4.48Å; H720-W757 HydrophobicContact CB-CH2 4.27Å; H720-W757 HydrophobicContact CB-CZ3 3.8Å; W757-A788 HydrophobicContact CH2-CB 3.64Å; W757-A788 HydrophobicContact CZ3-CB 4.03Å; W757-D790 HydrophobicContact CE3-CB 4.42Å; W757-D790 HydrophobicContact CH2-CB 3.89Å; W757-D790 HydrophobicContact CZ3-CB 3.82Å
758	R	88.3	Confident	84.1	Confident	66 Å²	66	57.9 Å²	57.9	25%	0.249	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.5	176.7	-68.2	-176.8	175.3	-97.5	7	110	W718 Y719 Q753 D807	W718-R758 CarbonylContact C-O 3.58Å; W718-R758 VanDerWaalsContact CA-O 3.27Å; W718-R758 WeakPolarHBondContact CA-O 3.27Å; Y719-R758 HydrophobicContact CD1-CB 4.33Å; Y719-R758 WeakPolarHBondContact CD1-O 3.36Å; Y719-R758 HydrophobicContact CE1-CB 3.84Å; Y719-R758 HydrophobicContact CE2-CB 4.08Å; Y719-R758 PolarHBondContact N-O 3.15Å; Y719-R758 PolarHBondContact O-N 2.95Å; Q753-R758 PolarHBondContact O-NE 2.84Å; Q753-R758 PolarHBondContact O-NH2 3.04Å; R758-D807 IonicContact NH1-OD2 3.81Å; R758-D807 PolarHBondContact NH1-OD2 2.76Å; R758-D807 VanDerWaalsContact NH1-OD2 3.15Å
759	E	90.6	Very high	83.3	Confident	40 Å²	40	59.6 Å²	59.6	19%	0.187	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.5	175.6	-168.1	-175.7	-177	0	0	109.4	S716 F717 W718 R761	S716-E759 PolarHBondContact OG-OE1 2.94Å; F717-E759 CarbonylContact O-C 3.5Å; W718-E759 HydrophobicContact CD2-CB 4.08Å; W718-E759 HydrophobicContact CE3-CB 4.15Å; W718-E759 HydrophobicContact CH2-CB 3.94Å; W718-E759 HydrophobicContact CZ2-CB 3.83Å; W718-E759 HydrophobicContact CZ2-CG 4.24Å; W718-E759 HydrophobicContact CZ3-CB 4.09Å; E759-R761 VanDerWaalsContact CD-NE 3.26Å; E759-R761 HydrophobicContact CG-CG 4.33Å; E759-R761 IonicContact OE1-CZ 2.68Å; E759-R761 IonicContact OE1-NE 2.73Å; E759-R761 PolarHBondContact OE1-NE 3.49Å; E759-R761 IonicContact OE1-NH2 3.04Å; E759-R761 PolarHBondContact OE1-NH2 3.33Å; E759-R761 IonicContact OE2-CZ 2.61Å; E759-R761 IonicContact OE2-NE 2.76Å; E759-R761 PolarHBondContact OE2-NE 2.89Å; E759-R761 IonicContact OE2-NH2 2.71Å; E759-R761 PolarHBondContact OE2-NH2 3.19Å
760	G	88.1	Confident	82.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.7	164.5	0	0	0	0	0	109.8	S716 F717	S716-G760 WeakPolarHBondContact CA-O 3.34Å; F717-G760 PolarHBondContact N-O 3.17Å; F717-G760 PolarHBondContact O-N 3.44Å
761	R	89.1	Confident	82.7	Confident	69 Å²	69	59 Å²	59	26%	0.26	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.3	173.8	-63.5	-173.1	-173.3	166.9	10.3	110.1	V715 E759 C803	V715-R761 CarbonylContact O-C 3.47Å; V715-R761 WeakPolarHBondContact O-CA 3.48Å; E759-R761 VanDerWaalsContact CD-NE 3.26Å; E759-R761 HydrophobicContact CG-CG 4.33Å; E759-R761 IonicContact OE1-CZ 2.68Å; E759-R761 IonicContact OE1-NE 2.73Å; E759-R761 PolarHBondContact OE1-NE 3.49Å; E759-R761 IonicContact OE1-NH2 3.04Å; E759-R761 PolarHBondContact OE1-NH2 3.33Å; E759-R761 IonicContact OE2-CZ 2.61Å; E759-R761 IonicContact OE2-NE 2.76Å; E759-R761 PolarHBondContact OE2-NE 2.89Å; E759-R761 IonicContact OE2-NH2 2.71Å; E759-R761 PolarHBondContact OE2-NH2 3.19Å; R761-C803 CarbonylContact C-O 3.49Å
762	V	88.2	Confident	83.1	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.5	-178.2	63.1	0	0	0	0	111.5	V715 F717 I731 L746 W747 C803	V715-V762 HydrophobicContact CB-CG1 3.85Å; V715-V762 HydrophobicContact CG1-CG1 4.41Å; V715-V762 PolarHBondContact N-O 3.23Å; V715-V762 PolarHBondContact O-N 3.37Å; F717-V762 HydrophobicContact CE1-CG1 4.22Å; I731-V762 HydrophobicContact CB-CG1 4.22Å; I731-V762 HydrophobicContact CG1-CG1 4.43Å; I731-V762 HydrophobicContact CG2-CG1 3.83Å; L746-V762 HydrophobicContact CB-CG2 3.42Å; L746-V762 VanDerWaalsContact CB-CG2 3.42Å; L746-V762 HydrophobicContact CD1-CG2 4.31Å; W747-V762 HydrophobicContact CB-CB 3.89Å; W747-V762 HydrophobicContact CB-CG2 3.67Å; W747-V762 HydrophobicContact CG-CB 4.41Å; V762-C803 PolarHBondContact O-SG 2.73Å
763	L	86	Confident	83.5	Confident	44 Å²	44	54.7 Å²	54.7	23%	0.23	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.5	171.9	-173.3	79.8	0	0	0	109.6	D712 K800 C803	D712-L763 HydrophobicContact CB-CD1 4.15Å; L763-K800 HydrophobicContact CD2-CD 4.1Å; L763-K800 HydrophobicContact CD2-CG 3.54Å; L763-C803 HydrophobicContact CB-CB 4.36Å; L763-C803 HydrophobicContact CD1-CB 4.16Å
764	V	86.4	Confident	83.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	106.9	173.5	-173.6	0	0	0	0	108.2	L713 V715 Q733 L746 Y771 V773	L713-V764 HydrophobicContact CB-CB 4.26Å; L713-V764 PolarHBondContact N-O 2.86Å; L713-V764 PolarHBondContact O-N 2.79Å; V715-V764 HydrophobicContact CB-CG2 4.32Å; V715-V764 HydrophobicContact CG2-CG2 3.59Å; Q733-V764 HydrophobicContact CB-CG1 4.4Å; Q733-V764 HydrophobicContact CG-CG1 4.27Å; L746-V764 HydrophobicContact CD1-CB 4.1Å; L746-V764 HydrophobicContact CD1-CG1 4.01Å; L746-V764 HydrophobicContact CD1-CG2 3.76Å; V764-Y771 HydrophobicContact CG1-CD2 4.28Å; V764-Y771 HydrophobicContact CG1-CE2 3.47Å; V764-Y771 VanDerWaalsContact CG1-CE2 3.47Å; V764-V773 HydrophobicContact CG1-CG2 4.15Å; V764-V773 HydrophobicContact CG2-CG2 4.12Å
765	P	81.4	Confident	84.5	Confident	50 Å²	50	51.8 Å²	51.8	33%	0.325	25%	0.249	S	C	.	.			trans	-69.6	148.5	-174.1	29	-34.1	0	0	0	111.3	Q733	Q733-P765 PolarHBondContact NE2-O 2.84Å
766	R	78.5	Confident	85	Confident	165 Å²	165	47.9 Å²	47.9	62%	0.623	23%	0.228	S	C	*	.			trans	-64.2	136.8	175.6	69.9	-171.2	-179.1	169.3	-0.4	111.5	D712	D712-R766 WeakPolarHBondContact OD1-CB 3.38Å; D712-R766 WeakPolarHBondContact OD1-CG 3.38Å; D712-R766 PolarHBondContact OD1-N 2.91Å
767	I	74.1	Confident	85.2	Confident	37 Å²	37	40.1 Å²	40.1	19%	0.19	20%	0.198	C	C	.	.			trans	-128	141.7	173.4	-60.1	-178.5	0	0	0	108.1	Q733 K769 Y771	Q733-I767 HydrophobicContact CG-CD1 4.14Å; Q733-I767 VanDerWaalsContact NE2-CD1 3.31Å; I767-K769 HydrophobicContact CG2-CB 4.42Å; I767-K769 PolarHBondContact O-N 2.95Å; I767-K769 VanDerWaalsContact O-N 3.1Å; I767-Y771 HydrophobicContact CB-CD1 4.11Å
768	S	68.1	Low	85.1	Confident	126 Å²	126	40.1 Å²	40.1	88%	0.881	20%	0.201	S	C	*	.	S	Bend	trans	-70	-0.7	-178.1	58	0	0	0	0	114.7
769	K	74.6	Confident	84.5	Confident	97 Å²	97	37.1 Å²	37.1	42%	0.422	19%	0.19	S	C	.	.	S	Bend	trans	-123.7	152	178.4	-65.3	-175.9	-169.9	164.9	0	108.9	E735 I767 Y771	E735-K769 IonicContact OE1-NZ 2.77Å; I767-K769 HydrophobicContact CG2-CB 4.42Å; I767-K769 PolarHBondContact O-N 2.95Å; I767-K769 VanDerWaalsContact O-N 3.1Å; K769-Y771 PolarHBondContact O-N 3.03Å
770	P	78.3	Confident	83.4	Confident	72 Å²	72	40.2 Å²	40.2	47%	0.468	20%	0.204	S	C	.	.			trans	-56.4	133.5	174.1	-21.5	32.1	0	0	0	111.2	M705 V706	M705-P770 HydrophobicContact SD-CB 3.92Å; V706-P770 WeakPolarHBondContact O-CA 3.28Å
771	Y	84.3	Confident	82.3	Confident	1 Å²	1	48 Å²	48	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	167.5	-179.8	65.5	-92.5	0	0	0	110.8	V706 L713 Q733 R734 V764 I767 K769 V773	V706-Y771 HydrophobicContact CB-CD2 4.27Å; V706-Y771 HydrophobicContact CB-CE1 4.45Å; V706-Y771 HydrophobicContact CB-CE2 3.96Å; V706-Y771 WeakPolarHBondContact CB-O 3.46Å; V706-Y771 HydrophobicContact CG1-CE1 4.19Å; V706-Y771 HydrophobicContact CG1-CE2 4.03Å; V706-Y771 HydrophobicContact CG2-CE2 4.37Å; V706-Y771 PolarHBondContact N-O 2.68Å; V706-Y771 PolarHBondContact O-N 2.72Å; L713-Y771 WeakPolarHBondContact CD1-OH 3.28Å; Q733-Y771 HydrophobicContact CG-CD2 3.76Å; Q733-Y771 HydrophobicContact CG-CE2 4.41Å; Q733-Y771 HydrophobicContact CG-CG 4.16Å; Q733-Y771 VanDerWaalsContact NE2-CD2 3.32Å; R734-Y771 CarbonylContact O-C 3.48Å; R734-Y771 VanDerWaalsContact O-CA 3.27Å; R734-Y771 WeakPolarHBondContact O-CA 3.47Å; R734-Y771 VanDerWaalsContact O-CB 3.3Å; R734-Y771 WeakPolarHBondContact O-CB 3.47Å; V764-Y771 HydrophobicContact CG1-CD2 4.28Å; V764-Y771 HydrophobicContact CG1-CE2 3.47Å; V764-Y771 VanDerWaalsContact CG1-CE2 3.47Å; I767-Y771 HydrophobicContact CB-CD1 4.11Å; K769-Y771 PolarHBondContact O-N 3.03Å; Y771-V773 HydrophobicContact CE2-CG2 4.45Å
772	Q	89.4	Confident	81.1	Confident	30 Å²	30	52.7 Å²	52.7	14%	0.14	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	154	175.7	-64	174.8	-76.9	0	0	110.6	V702 S703 M705 Q733 R734	V702-Q772 HydrophobicContact CG1-CB 3.94Å; V702-Q772 HydrophobicContact CG1-CG 4.35Å; S703-Q772 PolarHBondContact O-NE2 2.9Å; M705-Q772 HydrophobicContact CE-CG 4.3Å; M705-Q772 HydrophobicContact CG-CG 4.34Å; M705-Q772 HydrophobicContact SD-CG 3.85Å; Q733-Q772 CarbonylContact C-O 3.53Å; Q733-Q772 WeakPolarHBondContact CA-O 3.04Å; R734-Q772 HydrophobicContact CB-CB 4.36Å; R734-Q772 PolarHBondContact N-O 3.24Å; R734-Q772 PolarHBondContact O-N 2.65Å
773	V	90.1	Very high	80.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.6	170.3	179.1	0	0	0	0	108.5	F636 W651 S703 I731 K732 V764 Y771	F636-V773 HydrophobicContact CE2-CB 4.1Å; F636-V773 HydrophobicContact CE2-CG2 3.84Å; F636-V773 HydrophobicContact CZ-CB 3.82Å; F636-V773 HydrophobicContact CZ-CG1 4.26Å; F636-V773 HydrophobicContact CZ-CG2 3.7Å; W651-V773 HydrophobicContact CH2-CB 4.3Å; W651-V773 HydrophobicContact CH2-CG1 4.25Å; W651-V773 WeakPolarHBondContact CZ3-O 3.35Å; S703-V773 WeakPolarHBondContact CB-O 3.43Å; S703-V773 PolarHBondContact N-O 2.85Å; S703-V773 PolarHBondContact OG-N 2.81Å; I731-V773 HydrophobicContact CG2-CG1 3.75Å; K732-V773 CarbonylContact O-C 3.57Å; K732-V773 WeakPolarHBondContact O-CA 3.41Å; V764-V773 HydrophobicContact CG1-CG2 4.15Å; V764-V773 HydrophobicContact CG2-CG2 4.12Å; Y771-V773 HydrophobicContact CE2-CG2 4.45Å
774	V	92.1	Very high	79.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.1	-175.8	-177.4	0	0	0	0	109.3	R700 L701 V702 I731 K732 R734	R700-V774 HydrophobicContact CG-CG1 4.48Å; L701-V774 CarbonylContact O-C 3.55Å; L701-V774 WeakPolarHBondContact O-CA 3.26Å; V702-V774 HydrophobicContact CG1-CG2 4.2Å; V702-V774 HydrophobicContact CG2-CG1 4.25Å; V702-V774 HydrophobicContact CG2-CG2 4.22Å; I731-V774 CarbonylContact C-O 3.51Å; I731-V774 WeakPolarHBondContact CA-O 3.2Å; K732-V774 HydrophobicContact CB-CB 4.26Å; K732-V774 PolarHBondContact N-O 2.96Å; K732-V774 PolarHBondContact O-N 3.34Å; R734-V774 HydrophobicContact CB-CG2 3.93Å
775	I	93.3	Very high	78.5	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	115.6	171.7	-54.4	-175.3	0	0	0	107.8	W651 W660 R700 L701 L729 H730 I731 V789 I792	W651-I775 HydrophobicContact CH2-CD1 4.15Å; W651-I775 HydrophobicContact CH2-CG1 4.36Å; W651-I775 HydrophobicContact CZ3-CD1 3.95Å; W651-I775 HydrophobicContact CZ3-CG1 3.89Å; W660-I775 HydrophobicContact CZ2-CG2 4.26Å; R700-I775 CarbonylContact C-O 3.52Å; R700-I775 WeakPolarHBondContact CA-O 3.2Å; L701-I775 HydrophobicContact CB-CB 4.35Å; L701-I775 PolarHBondContact N-O 2.74Å; L701-I775 PolarHBondContact O-N 2.79Å; L729-I775 HydrophobicContact CD1-CG2 3.79Å; H730-I775 WeakPolarHBondContact O-CA 3.28Å; I731-I775 HydrophobicContact CD1-CB 4.17Å; I731-I775 HydrophobicContact CD1-CD1 4.28Å; I731-I775 HydrophobicContact CD1-CG1 3.73Å; I731-I775 HydrophobicContact CD1-CG2 3.95Å; I775-V789 HydrophobicContact CD1-CG1 4.37Å; I775-V789 HydrophobicContact CG2-CG2 4.29Å; I775-I792 HydrophobicContact CD1-CD1 3.37Å; I775-I792 HydrophobicContact CD1-CG1 3.91Å
776	E	91.7	Very high	78.4	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118.9	-173.5	176.2	-169.6	85.1	0	0	110.9	V698 A699 R700 L729 H730 K732	V698-E776 HydrophobicContact CG1-CG 3.4Å; A699-E776 CarbonylContact O-C 3.52Å; A699-E776 VanDerWaalsContact O-CA 3.31Å; A699-E776 WeakPolarHBondContact O-CA 3.32Å; R700-E776 HydrophobicContact CG-CB 4.05Å; R700-E776 HydrophobicContact CG-CG 3.86Å; R700-E776 IonicContact CZ-OE2 3.03Å; R700-E776 IonicContact NE-OE2 3.79Å; R700-E776 PolarHBondContact NE-OE2 3.12Å; R700-E776 IonicContact NH2-OE2 3.24Å; R700-E776 PolarHBondContact NH2-OE2 2.89Å; L729-E776 CarbonylContact C-O 3.54Å; L729-E776 WeakPolarHBondContact CA-O 3.46Å; H730-E776 HydrophobicContact CB-CB 4.14Å; H730-E776 IonicContact CE1-OE1 3.73Å; H730-E776 IonicContact CG-OE1 2.74Å; H730-E776 PolarHBondContact N-O 3.4Å; H730-E776 IonicContact ND1-OE1 2.85Å; H730-E776 PolarHBondContact ND1-OE1 2.04Å; H730-E776 PolarHBondContact O-N 3.29Å; K732-E776 WeakPolarHBondContact CE-OE1 3.17Å; K732-E776 IonicContact NZ-OE1 2.73Å; K732-E776 PolarHBondContact NZ-OE1 3.09Å; K732-E776 IonicContact NZ-OE2 3.36Å; K732-E776 PolarHBondContact NZ-OE2 2.79Å
777	G	89	Confident	78.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.3	170.2	0	0	0	0	0	110.6	A699	A699-G777 PolarHBondContact N-O 3.09Å; A699-G777 PolarHBondContact O-N 3.05Å
778	L	84.9	Confident	79.7	Confident	33 Å²	33	45.9 Å²	45.9	17%	0.173	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	115.3	178.2	-168.2	87.1	0	0	0	110.4	V698 G727 T728 Q780	V698-L778 HydrophobicContact CG1-CD1 4.44Å; V698-L778 HydrophobicContact CG2-CD1 3.74Å; G727-L778 CarbonylContact C-O 3.59Å; G727-L778 WeakPolarHBondContact CA-O 3.4Å; T728-L778 PolarHBondContact N-O 2.8Å; T728-L778 PolarHBondContact O-N 2.9Å; L778-Q780 HydrophobicContact CD2-CG 4.48Å
779	V	76.1	Confident	80.9	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.5	179.3	176.3	0	0	0	0	110	T688 A690 S696 E697 S783	T688-V779 HydrophobicContact CG2-CG2 4.36Å; A690-V779 HydrophobicContact CB-CG1 3.96Å; A690-V779 HydrophobicContact CB-CG2 4.12Å; S696-V779 WeakPolarHBondContact CA-O 3.33Å; E697-V779 PolarHBondContact N-O 3.3Å; E697-V779 VanDerWaalsContact N-O 3.11Å; E697-V779 PolarHBondContact O-N 2.92Å; V779-S783 WeakPolarHBondContact CG1-OG 2.95Å
780	Q	68.6	Low	81.7	Confident	105 Å²	105	35.3 Å²	35.3	49%	0.491	16%	0.157	S	C	.	.	P	Polyproline II helix	trans	-89.5	162.4	179.9	-65	-177.9	3.1	0	0	112.6	L778 S783	L778-Q780 HydrophobicContact CD2-CG 4.48Å; Q780-S783 WeakPolarHBondContact O-CB 3.15Å; Q780-S783 PolarHBondContact O-N 2.8Å; Q780-S783 PolarHBondContact O-OG 2.77Å
781	R	65	Low	82.2	Confident	163 Å²	163	33.2 Å²	33.2	62%	0.615	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	138.8	-178.8	-166.9	179.7	178.7	-176.6	-0.3	111.5	S783	R781-S783 VanDerWaalsContact C-N 3.25Å; R781-S783 PolarHBondContact O-N 2.77Å
782	K	63.9	Low	82.5	Confident	169 Å²	169	33.3 Å²	33.3	74%	0.735	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	17.6	-175.4	-51.6	178.7	-180	173.5	0	114.5
783	S	66.3	Low	82.5	Confident	5 Å²	5	35.4 Å²	35.4	4%	0.035	15%	0.151	C	C	.	.			trans	-65.9	145	169.3	65	0	0	0	0	111.3	A690 H725 V779 Q780 R781	A690-S783 CarbonylContact O-C 3.49Å; A690-S783 WeakPolarHBondContact O-CB 3.2Å; A690-S783 PolarHBondContact O-OG 3.39Å; H725-S783 WeakPolarHBondContact O-CA 3.38Å; H725-S783 WeakPolarHBondContact O-CB 3.49Å; V779-S783 WeakPolarHBondContact CG1-OG 2.95Å; Q780-S783 WeakPolarHBondContact O-CB 3.15Å; Q780-S783 PolarHBondContact O-N 2.8Å; Q780-S783 PolarHBondContact O-OG 2.77Å; R781-S783 VanDerWaalsContact C-N 3.25Å; R781-S783 PolarHBondContact O-N 2.77Å
784	W	66	Low	82.2	Confident	152 Å²	152	36.3 Å²	36.3	58%	0.576	16%	0.156	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.9	104.7	170.6	-172.8	-77.9	0	0	0	110.1	A690 G723 S724	A690-W784 WeakPolarHBondContact O-CA 3.35Å; A690-W784 PolarHBondContact O-N 2.84Å; G723-W784 CarbonylContact C-O 3.58Å; G723-W784 VanDerWaalsContact CA-O 3.26Å; G723-W784 WeakPolarHBondContact CA-O 3.5Å; S724-W784 PolarHBondContact N-O 2.9Å; S724-W784 PolarHBondContact O-N 3.01Å
785	G	72.9	Confident	81.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.9	-152.4	170	0	0	0	0	0	111.3	T672 A690 I726	T672-G785 VanDerWaalsContact CB-CA 3.48Å; A690-G785 VanDerWaalsContact CA-O 3.31Å; A690-G785 WeakPolarHBondContact CA-O 3.18Å; A690-G785 WeakPolarHBondContact CB-O 3.18Å; A690-G785 PolarHBondContact N-O 2.92Å; A690-G785 PolarHBondContact O-N 3.16Å; I726-G785 VanDerWaalsContact CD1-CA 3.5Å
786	D	80.1	Confident	80.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148.3	-172.3	-48.8	-66	0	0	0	112	T667 T669 T672 G673 L689	T667-D786 HydrophobicContact CG2-CB 4.22Å; T667-D786 PolarHBondContact OG1-OD2 2.71Å; T669-D786 PolarHBondContact OG1-OD1 3.25Å; T669-D786 PolarHBondContact OG1-OD2 2.72Å; T672-D786 VanDerWaalsContact C-OD2 3.25Å; T672-D786 PolarHBondContact OG1-OD2 3.2Å; G673-D786 WeakPolarHBondContact CA-OD2 3.12Å; G673-D786 PolarHBondContact N-OD2 3.09Å; L689-D786 VanDerWaalsContact CD2-OD1 3.24Å; L689-D786 WeakPolarHBondContact CD2-OD1 3.37Å
787	I	88.9	Confident	78.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.5	163.5	-54.6	178.1	0	0	0	105.8	W660 Y687 T688 M721 I726 L729	W660-I787 HydrophobicContact CH2-CG2 3.96Å; W660-I787 WeakPolarHBondContact CZ3-O 3.35Å; Y687-I787 CarbonylContact C-O 3.49Å; Y687-I787 VanDerWaalsContact CA-O 3.24Å; Y687-I787 WeakPolarHBondContact CA-O 3.38Å; T688-I787 HydrophobicContact CG2-CB 4.08Å; T688-I787 PolarHBondContact N-O 2.82Å; T688-I787 PolarHBondContact O-N 2.85Å; T688-I787 VanDerWaalsContact O-N 3.17Å; M721-I787 HydrophobicContact CE-CD1 4.01Å; M721-I787 HydrophobicContact CE-CG1 4.07Å; M721-I787 HydrophobicContact CG-CB 4.3Å; M721-I787 HydrophobicContact CG-CG1 4.18Å; M721-I787 HydrophobicContact CG-CG2 3.89Å; M721-I787 HydrophobicContact SD-CG2 4.17Å; I726-I787 HydrophobicContact CG2-CD1 4.34Å; I726-I787 HydrophobicContact CG2-CG1 3.83Å; L729-I787 HydrophobicContact CB-CG2 4.26Å; L729-I787 HydrophobicContact CD1-CG2 4.2Å; L729-I787 HydrophobicContact CD2-CG2 4.49Å
788	A	91.2	Very high	77.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.6	177.4	0	0	0	0	0	111.1	P674 F685 I686 Y719 H720 W757	P674-A788 HydrophobicContact CG-CB 3.78Å; F685-A788 HydrophobicContact CD2-CB 3.89Å; F685-A788 HydrophobicContact CE2-CB 4.24Å; I686-A788 CarbonylContact O-C 3.52Å; I686-A788 WeakPolarHBondContact O-CA 2.82Å; I686-A788 WeakPolarHBondContact O-CB 3.3Å; Y719-A788 CarbonylContact C-O 3.53Å; Y719-A788 WeakPolarHBondContact CA-O 3.47Å; H720-A788 HydrophobicContact CB-CB 4.29Å; H720-A788 PolarHBondContact N-O 2.82Å; H720-A788 PolarHBondContact O-N 2.59Å; W757-A788 HydrophobicContact CH2-CB 3.64Å; W757-A788 HydrophobicContact CZ3-CB 4.03Å
789	V	92.7	Very high	76.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.8	179.3	178.7	0	0	0	0	109.1	W660 I686 F717 W718 L729 I775 I792	W660-V789 HydrophobicContact CH2-CG2 3.83Å; W660-V789 HydrophobicContact CZ3-CG2 4.16Å; I686-V789 HydrophobicContact CD1-CB 4.08Å; I686-V789 HydrophobicContact CG1-CB 3.87Å; I686-V789 WeakPolarHBondContact CG1-O 3.43Å; I686-V789 PolarHBondContact N-O 2.9Å; I686-V789 PolarHBondContact O-N 2.73Å; F717-V789 HydrophobicContact CB-CG1 4.38Å; F717-V789 HydrophobicContact CD2-CG1 4.3Å; W718-V789 CarbonylContact O-C 3.54Å; W718-V789 WeakPolarHBondContact O-CA 3.36Å; W718-V789 WeakPolarHBondContact O-CG1 3.39Å; L729-V789 HydrophobicContact CD1-CG2 4.03Å; L729-V789 HydrophobicContact CD2-CG2 3.87Å; I775-V789 HydrophobicContact CD1-CG1 4.37Å; I775-V789 HydrophobicContact CG2-CG2 4.29Å; V789-I792 HydrophobicContact CG1-CD1 4.49Å; V789-I792 HydrophobicContact CG1-CG1 4.26Å
790	D	90.9	Very high	75.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	164.5	-178.1	-155.6	1.3	0	0	0	111.6	D677 H678 F685 W718 W757 I792	D677-D790 WeakPolarHBondContact CB-OD2 3.31Å; H678-D790 HydrophobicContact CB-CB 4.02Å; H678-D790 WeakPolarHBondContact CB-OD2 3.17Å; H678-D790 PolarHBondContact N-OD2 3.47Å; F685-D790 HydrophobicContact CB-CB 3.97Å; W718-D790 HydrophobicContact CB-CB 4.32Å; W718-D790 PolarHBondContact N-O 2.92Å; W718-D790 PolarHBondContact O-N 2.96Å; W757-D790 HydrophobicContact CE3-CB 4.42Å; W757-D790 HydrophobicContact CH2-CB 3.89Å; W757-D790 HydrophobicContact CZ3-CB 3.82Å; D790-I792 PolarHBondContact O-N 2.93Å
791	D	88.6	Confident	75.3	Confident	29 Å²	29	57.3 Å²	57.3	16%	0.155	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	50.4	50.3	167.9	-76.5	-31.2	0	0	0	115.6	C638 H678 W718 K793	C638-D791 CarbonylContact O-C 3.55Å; C638-D791 WeakPolarHBondContact O-CA 3.31Å; H678-D791 IonicContact CE1-OD2 3.21Å; H678-D791 IonicContact CG-OD2 3.74Å; H678-D791 IonicContact ND1-OD2 3.49Å; H678-D791 PolarHBondContact ND1-OD2 2.79Å; W718-D791 HydrophobicContact CG-CB 4.37Å; D791-K793 PolarHBondContact O-N 3.07Å
792	I	91.7	Very high	75.5	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130.7	176	-54.2	163.5	0	0	0	109.1	F636 A637 C638 F640 W651 L701 V715 S716 F717 I775 V789 D790	F636-I792 HydrophobicContact CE1-CG2 4.17Å; A637-I792 CarbonylContact C-O 3.48Å; A637-I792 WeakPolarHBondContact CA-O 3.5Å; C638-I792 HydrophobicContact CB-CB 4.41Å; C638-I792 HydrophobicContact CB-CD1 4.48Å; C638-I792 PolarHBondContact N-O 3.03Å; C638-I792 PolarHBondContact O-N 3Å; F640-I792 HydrophobicContact CE1-CD1 4.5Å; F640-I792 HydrophobicContact CE2-CD1 4.23Å; F640-I792 HydrophobicContact CE2-CG1 4.45Å; F640-I792 HydrophobicContact CZ-CD1 3.59Å; F640-I792 HydrophobicContact CZ-CG1 4.28Å; W651-I792 HydrophobicContact CD2-CD1 4.47Å; W651-I792 HydrophobicContact CH2-CD1 4.39Å; W651-I792 HydrophobicContact CH2-CG2 3.99Å; W651-I792 HydrophobicContact CZ2-CB 4.48Å; W651-I792 HydrophobicContact CZ2-CD1 4.25Å; W651-I792 HydrophobicContact CZ2-CG2 3.57Å; L701-I792 HydrophobicContact CD2-CD1 4.18Å; V715-I792 HydrophobicContact CG1-CG2 4.32Å; S716-I792 CarbonylContact O-C 3.52Å; S716-I792 WeakPolarHBondContact O-CA 3.43Å; F717-I792 HydrophobicContact CB-CG1 4.06Å; I775-I792 HydrophobicContact CD1-CD1 3.37Å; I775-I792 HydrophobicContact CD1-CG1 3.91Å; V789-I792 HydrophobicContact CG1-CD1 4.49Å; V789-I792 HydrophobicContact CG1-CG1 4.26Å; D790-I792 PolarHBondContact O-N 2.93Å
793	K	88.4	Confident	76.1	Confident	75 Å²	75	45.9 Å²	45.9	33%	0.326	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	165.3	176.4	60.1	-170.1	171.2	-168.1	0	111.5	A637 V715 S716 D791 L795	A637-K793 HydrophobicContact CB-CB 4.28Å; V715-K793 WeakPolarHBondContact CA-O 3.42Å; S716-K793 PolarHBondContact N-O 3.19Å; S716-K793 PolarHBondContact O-N 2.94Å; S716-K793 VanDerWaalsContact O-O 3.08Å; D791-K793 PolarHBondContact O-N 3.07Å; K793-L795 HydrophobicContact CD-CD2 4.18Å; K793-L795 HydrophobicContact CG-CD2 4.2Å
794	V	84.1	Confident	75.9	Confident	18 Å²	18	51.4 Å²	51.4	11%	0.109	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.5	168.2	-165.6	0	0	0	0	108.9	F633 F636 L713 C714 V715	F633-V794 HydrophobicContact CD1-CB 3.9Å; F633-V794 HydrophobicContact CE1-CB 3.2Å; F633-V794 HydrophobicContact CE1-CG1 3.47Å; F633-V794 VanDerWaalsContact CE1-CG1 3.47Å; F633-V794 HydrophobicContact CE1-CG2 4.32Å; F633-V794 WeakPolarHBondContact CE1-O 3.1Å; F633-V794 HydrophobicContact CE2-CB 4.05Å; F633-V794 HydrophobicContact CE2-CG1 3.79Å; F633-V794 HydrophobicContact CZ-CB 3.28Å; F633-V794 HydrophobicContact CZ-CG1 3Å; F633-V794 HydrophobicContact CZ-CG2 4.25Å; F636-V794 HydrophobicContact CB-CG2 4.11Å; F636-V794 HydrophobicContact CD1-CB 4.49Å; F636-V794 HydrophobicContact CD1-CG2 3.09Å; F636-V794 HydrophobicContact CD2-CG2 4.33Å; F636-V794 HydrophobicContact CE1-CG2 3.43Å; F636-V794 VanDerWaalsContact CE1-CG2 3.43Å; F636-V794 HydrophobicContact CG-CG2 3.59Å; F636-V794 HydrophobicContact CZ-CG2 4.19Å; L713-V794 HydrophobicContact CB-CG1 3.9Å; L713-V794 HydrophobicContact CD2-CG1 4.22Å; L713-V794 HydrophobicContact CG-CG1 4.49Å; C714-V794 CarbonylContact O-C 3.48Å; C714-V794 VanDerWaalsContact O-CA 3.31Å; C714-V794 WeakPolarHBondContact O-CA 3.23Å; C714-V794 VanDerWaalsContact O-CG1 3.3Å; C714-V794 WeakPolarHBondContact O-CG1 3.14Å; V715-V794 HydrophobicContact CG2-CG2 4.34Å
795	L	79.5	Confident	75.7	Confident	40 Å²	40	44.8 Å²	44.8	21%	0.209	26%	0.26	C	S	.	.			trans	-98	113.8	180	-58.3	-180	0	0	0	109.1	C714 K793 L798	C714-L795 HydrophobicContact CB-CB 4.25Å; C714-L795 PolarHBondContact O-N 3.36Å; K793-L795 HydrophobicContact CD-CD2 4.18Å; K793-L795 HydrophobicContact CG-CD2 4.2Å; L795-L798 HydrophobicContact CB-CD1 3.65Å; L795-L798 HydrophobicContact CB-CG 4.42Å; L795-L798 HydrophobicContact CD1-CD1 3.7Å; L795-L798 HydrophobicContact CG-CD1 4.33Å
796	D	66.7	Low	74.9	Confident	118 Å²	118	49.3 Å²	49.3	63%	0.631	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	144.2	177.8	-81	-39.1	0	0	0	112.5	F633	F633-D796 WeakPolarHBondContact CD1-OD2 3.46Å; F633-D796 HydrophobicContact CE1-CB 4.34Å; F633-D796 WeakPolarHBondContact CE1-OD1 3.48Å; F633-D796 WeakPolarHBondContact CE1-OD2 3.19Å; F633-D796 WeakPolarHBondContact CE2-OD1 3.26Å; F633-D796 VanDerWaalsContact CZ-CG 3.44Å; F633-D796 WeakPolarHBondContact CZ-OD1 3.1Å
797	G	58.6	Low	73.8	Confident	89 Å²	89	54.9 Å²	54.9	92%	0.918	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	11.3	169.9	0	0	0	0	0	116.3
798	L	63.2	Low	72	Confident	74 Å²	74	56.5 Å²	56.5	39%	0.387	33%	0.33	S	S	.	.			trans	-88.1	141.5	174.2	-67.8	178.3	0	0	0	111.9	L795 D802	L795-L798 HydrophobicContact CB-CD1 3.65Å; L795-L798 HydrophobicContact CB-CG 4.42Å; L795-L798 HydrophobicContact CD1-CD1 3.7Å; L795-L798 HydrophobicContact CG-CD1 4.33Å; L798-D802 HydrophobicContact CB-CB 4.26Å; L798-D802 HydrophobicContact CD2-CB 4.12Å
799	G	60.7	Low	69.5	Low	34 Å²	34	62.7 Å²	62.7	35%	0.351	37%	0.37	S	S	.	.			trans	-74.1	161.7	172.7	0	0	0	0	0	112.1	S801 D802	G799-S801 PolarHBondContact O-N 3.31Å; G799-D802 PolarHBondContact N-OD2 3.29Å; G799-D802 PolarHBondContact O-N 2.92Å
800	K	61.8	Low	67.1	Low	152 Å²	152	66.5 Å²	66.5	66%	0.661	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.9	-178.7	-163.7	174.5	178.8	171.7	0	113.8	L763	L763-K800 HydrophobicContact CD2-CD 4.1Å; L763-K800 HydrophobicContact CD2-CG 3.54Å
801	S	60.8	Low	64.3	Low	82 Å²	82	74.6 Å²	74.6	57%	0.573	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-17.5	177.8	53.6	0	0	0	0	114.7	G799	G799-S801 PolarHBondContact O-N 3.31Å
802	D	69.4	Low	61.8	Low	90 Å²	90	79 Å²	79	48%	0.481	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-6.7	-176.2	-54.7	-39.1	0	0	0	112.4	L798 G799	L798-D802 HydrophobicContact CB-CB 4.26Å; L798-D802 HydrophobicContact CD2-CB 4.12Å; G799-D802 PolarHBondContact N-OD2 3.29Å; G799-D802 PolarHBondContact O-N 2.92Å
803	C	75.1	Confident	58.8	Low	3 Å²	3	87.2 Å²	87.2	2%	0.02	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	5.7	175	-162.2	0	0	0	0	113.2	C714 R761 V762 L763	C714-C803 WeakPolarHBondContact CA-SG 3.49Å; C714-C803 HydrophobicContact CB-CB 3.85Å; C714-C803 WeakPolarHBondContact CB-SG 3.22Å; C714-C803 VanDerWaalsContact SG-CA 3.54Å; C714-C803 WeakPolarHBondContact SG-CB 3.46Å; C714-C803 CovalentContact SG-SG 2.03Å; C714-C803 PolarHBondContact SG-SG 3.15Å; R761-C803 CarbonylContact C-O 3.49Å; V762-C803 PolarHBondContact O-SG 2.73Å; L763-C803 HydrophobicContact CB-CB 4.36Å; L763-C803 HydrophobicContact CD1-CB 4.16Å
804	E	63.7	Low	56	Low	121 Å²	121	90.9 Å²	90.9	57%	0.565	52%	0.524	S	S	*	.	S	Bend	trans	-78.6	140.3	175.3	-69.5	-177.7	176.8	0	0	110.6
805	D	60.4	Low	53.7	Low	12 Å²	12	96 Å²	96	6%	0.064	56%	0.557	C	S	.	*			trans	-62.7	123.8	176.8	-171.5	-40.2	0	0	0	109.8	W747 D807 V808	W747-D805 WeakPolarHBondContact CZ2-OD2 3.16Å; W747-D805 PolarHBondContact NE1-OD2 2.86Å; D805-D807 PolarHBondContact O-N 2.77Å; D805-D807 VanDerWaalsContact O-N 3.15Å; D805-D807 PolarHBondContact OD1-N 2.87Å; D805-V808 HydrophobicContact CB-CB 4.06Å; D805-V808 HydrophobicContact CB-CG2 4.46Å; D805-V808 PolarHBondContact OD1-N 3.41Å; D805-V808 WeakPolarHBondContact OD2-CG2 3.38Å
806	P	55.8	Low	51.3	Low	96 Å²	96	103.2 Å²	103.2	62%	0.623	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-16.1	-176.9	24.2	-32.2	0	0	0	114.5
807	D	57.3	Low	49.4	Very low	116 Å²	116	104.8 Å²	104.8	62%	0.62	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	-4.6	-173.8	-78.1	-23	0	0	0	114.2	R758 D805	R758-D807 IonicContact NH1-OD2 3.81Å; R758-D807 PolarHBondContact NH1-OD2 2.76Å; R758-D807 VanDerWaalsContact NH1-OD2 3.15Å; D805-D807 PolarHBondContact O-N 2.77Å; D805-D807 VanDerWaalsContact O-N 3.15Å; D805-D807 PolarHBondContact OD1-N 2.87Å
808	V	51.4	Low	48.2	Very low	35 Å²	35	107.2 Å²	107.2	21%	0.212	59%	0.59	C	S	.	*	S	Bend	trans	-120.8	116.7	-178	-175.3	0	0	0	0	111.7	W747 D805 T810	W747-V808 HydrophobicContact CZ2-CG2 4.4Å; D805-V808 HydrophobicContact CB-CB 4.06Å; D805-V808 HydrophobicContact CB-CG2 4.46Å; D805-V808 PolarHBondContact OD1-N 3.41Å; D805-V808 WeakPolarHBondContact OD2-CG2 3.38Å; V808-T810 PolarHBondContact O-N 2.96Å
809	P	39.8	Very low	46.5	Very low	129 Å²	129	111 Å²	111	84%	0.838	61%	0.611	S	S	*	*			trans	-68.1	122.3	178.5	-13.2	26.7	0	0	0	111.5
810	T	40.3	Very low	45.1	Very low	80 Å²	80	116.6 Å²	116.6	49%	0.491	63%	0.633	S	S	.	*			trans	-100.8	101.9	175.7	4.1	0	0	0	0	110	V808	V808-T810 PolarHBondContact O-N 2.96Å
811	E	33.9	Very low	43.5	Very low	172 Å²	172	118.8 Å²	118.8	80%	0.804	65%	0.645	S	S	*	*			trans	-100.2	130.6	153.7	-84.3	-162.5	177	0	0	108.9	M813	E811-M813 PolarHBondContact O-N 3.08Å
812	P	34.2	Very low	42.2	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	65%	0.653	S	S	*	*			trans	-80.2	113.9	175.7	29.8	-28.8	0	0	0	110.1	L814	P812-L814 PolarHBondContact O-N 3.07Å
813	M	30.3	Very low	40.1	Very low	175 Å²	175	126.6 Å²	126.6	86%	0.862	67%	0.67	S	S	*	*			trans	-75.8	111.2	166.5	-66.5	-106.1	91.6	0	0	108.8	E811	E811-M813 PolarHBondContact O-N 3.08Å
814	L	28.9	Very low	37.8	Very low	152 Å²	152	134.5 Å²	134.5	80%	0.796	71%	0.707	S	S	*	*			trans	-69.6	153.9	165.1	-76.7	167	0	0	0	110.2	P812 E816	P812-L814 PolarHBondContact O-N 3.07Å; L814-E816 PolarHBondContact O-N 2.78Å
815	P	35.7	Very low	36.5	Very low	124 Å²	124	135.1 Å²	135.1	81%	0.805	72%	0.719	S	S	*	*			trans	-78.1	113.9	178.5	30.7	-29.1	0	0	0	109.5
816	E	29.4	Very low	34.9	Very low	193 Å²	193	143 Å²	143	90%	0.902	76%	0.755	S	S	*	*			trans	-108.1	142.5	164.1	-83.6	-164.1	169.7	0	0	111.9	L814	L814-E816 PolarHBondContact O-N 2.78Å
817	D	27.7	Very low	33.7	Very low	150 Å²	150	145.7 Å²	145.7	80%	0.802	76%	0.764	S	S	*	*			trans	-43.5	149.6	-176.3	-96.9	-47.5	0	0	0	117.5
818	N	32.4	Very low	32.3	Very low	140 Å²	140	147.3 Å²	147.3	75%	0.749	77%	0.771	S	S	*	*			trans	2.9	117.9	143.1	-93.9	-23.4	0	0	0	116.6
819	N	27.4	Very low	31.1	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	80%	0.796	S	S	*	*				-170.8	145.3	115	-92.9	-32.7	0	0	0	112.9
820	N	31.2	Very low	30.5	Very low	151 Å²	151	152.9 Å²	152.9	81%	0.807	80%	0.798	S	S	*	*			trans	-43.2	138.6	173.2	-63.2	-43.6	0	0	0	114
821	E	28	Very low	29.7	Very low	197 Å²	197	160 Å²	160	92%	0.921	82%	0.817	S	S	*	*				-167.8	132.3	118.2	-104	171.1	-167.3	0	0	111.7
822	I	34.1	Very low	29.6	Very low	143 Å²	143	157.4 Å²	157.4	73%	0.733	82%	0.815	S	S	*	*			trans	-69	144.4	173.1	-65.8	157.9	0	0	0	108.5
823	F	25.8	Very low	29.3	Very low	193 Å²	193	158.8 Å²	158.8	85%	0.846	82%	0.816	S	S	*	*			trans	-171.3	152	133.1	-104	-73	0	0	0	113.1
824	E	26.7	Very low	29.2	Very low	170 Å²	170	157.4 Å²	157.4	79%	0.794	81%	0.811	S	S	*	*			trans	-80.6	167.6	-154.2	-66.1	169.3	135.9	0	0	116.9
825	V	36	Very low	29.1	Very low	133 Å²	133	156.3 Å²	156.3	81%	0.806	81%	0.811	S	S	*	*			trans	-58.1	137.7	168.1	179.5	0	0	0	0	112
826	E	25.8	Very low	28.6	Very low	179 Å²	179	157.9 Å²	157.9	84%	0.836	81%	0.807	S	S	*	*			trans	-149.4	123.3	149.6	-111.4	176.8	-166.8	0	0	112.1
827	D	31.5	Very low	28.3	Very low	151 Å²	151	154.4 Å²	154.4	81%	0.807	80%	0.799	S	S	*	*			trans	-59.6	145.3	159.3	-96.4	-40.5	0	0	0	109.5
828	I	27.2	Very low	28.1	Very low	151 Å²	151	154.2 Å²	154.2	77%	0.774	80%	0.798	S	S	*	*			trans	-159.8	134.7	142.9	-94.4	141.2	0	0	0	111.4
829	T	27.1	Very low	27.7	Very low	119 Å²	119	156.4 Å²	156.4	73%	0.73	80%	0.804	S	S	*	*			trans	-69.5	173.4	172.8	45.9	0	0	0	0	114.3
830	D	27.5	Very low	27.8	Very low	162 Å²	162	157.2 Å²	157.2	87%	0.866	81%	0.806	S	S	*	*			trans	95.6	118.8	163.1	-83.8	-16.6	0	0	0	119.7
831	Y	23.9	Very low	27.5	Very low	228 Å²	228	155.9 Å²	155.9	89%	0.894	81%	0.809	S	S	*	*			trans	-114.2	132.9	165.1	-134.6	-84.2	0	0	0	107.2
832	P	31.4	Very low	27.5	Very low	119 Å²	119	150.3 Å²	150.3	77%	0.773	80%	0.804	S	S	*	*			trans	-94.7	153.9	175.8	34.2	-30.2	0	0	0	113.6
833	D	26.7	Very low	27.5	Very low	150 Å²	150	148.9 Å²	148.9	80%	0.802	81%	0.814	S	S	*	*			trans	-65	143	-179	-89.7	-42	0	0	0	116.4
834	L	29.2	Very low	27.6	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	80%	0.803	S	S	*	*			trans	27.4	131.4	135.5	-72.2	151.6	0	0	0	120.9
835	V	25.8	Very low	27.8	Very low	130 Å²	130	141.7 Å²	141.7	79%	0.788	80%	0.804	S	S	*	*				-160.4	120.4	103	171.2	0	0	0	0	111.5
836	E	25	Very low	27.6	Very low	157 Å²	157	144.2 Å²	144.2	73%	0.734	81%	0.809	S	S	*	*			trans	15.9	129.5	146.4	-57	-179.2	145.6	0	0	122
837	T	24.1	Very low	28.1	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	81%	0.81	S	S	*	*				-174.6	132.6	91.3	26.8	0	0	0	0	113.4
838	N	23.1	Very low	28.2	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	81%	0.811	S	S	*	*			trans	67.7	88.9	145.2	-63.5	-22.4	0	0	0	121
839	Q	25.1	Very low	28.9	Very low	186 Å²	186	144.4 Å²	144.4	87%	0.869	81%	0.812	S	S	*	*				158.4	94.4	104.2	-88.4	-177.5	-2.2	0	0	111.8
840	I	28.2	Very low	29.7	Very low	171 Å²	171	143.9 Å²	143.9	88%	0.877	81%	0.805	S	S	*	*			trans	27.6	103.3	143.4	-48.7	173.7	0	0	0	118.1
841	S	26.1	Very low	30.7	Very low	124 Å²	124	140.9 Å²	140.9	87%	0.867	79%	0.788	S	S	*	*				-165.3	110.3	123.1	60	0	0	0	0	110.1
842	G	28.1	Very low	32.1	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	78%	0.775	S	S	*	*			trans	-142	146.9	174.9	0	0	0	0	0	110.4
843	A	32.7	Very low	33.3	Very low	114 Å²	114	134.1 Å²	134.1	94%	0.942	77%	0.765	S	S	*	*			trans	-61.4	165.3	-160.4	0	0	0	0	0	117.9
844	G	28.7	Very low	34.6	Very low	60 Å²	60	130.6 Å²	130.6	62%	0.619	75%	0.746	S	S	*	*			trans	149.2	127.2	152.1	0	0	0	0	0	115.9
845	N	30.3	Very low	36	Very low	151 Å²	151	128.2 Å²	128.2	81%	0.807	73%	0.733	S	S	*	*			trans	89.2	81.9	148	-50.5	-29.8	0	0	0	118.8	L847	N845-L847 PolarHBondContact O-N 3.4Å; N845-L847 VanDerWaalsContact O-N 3.12Å
846	M	32.6	Very low	37.7	Very low	186 Å²	186	126 Å²	126	92%	0.916	72%	0.72	S	S	*	*	S	Bend	trans	-82.6	50.6	157.6	-149.7	-160.5	-57.2	0	0	111.5
847	L	35.4	Very low	39.6	Very low	162 Å²	162	123.2 Å²	123.2	85%	0.848	71%	0.709	S	S	*	*			trans	-125.4	22.8	174.4	-111.1	161.6	0	0	0	112.4	N845	N845-L847 PolarHBondContact O-N 3.4Å; N845-L847 VanDerWaalsContact O-N 3.12Å
848	K	34.6	Very low	41.4	Very low	193 Å²	193	122.2 Å²	122.2	84%	0.839	70%	0.698	S	S	*	*			trans	-137.8	61.9	174	-80.8	-168.3	176.1	178.7	0	112.6
849	T	41	Very low	43.3	Very low	130 Å²	130	118 Å²	118	80%	0.798	68%	0.684	S	S	*	*			trans	-145.5	35.8	158.9	44.8	0	0	0	0	111.9
850	L	45.2	Very low	44.9	Very low	109 Å²	109	115.7 Å²	115.7	57%	0.571	68%	0.675	S	S	*	*	S	Bend	trans	-116.7	124.7	166.2	-80.7	160.5	0	0	0	109	L854 I855	L850-L854 HydrophobicContact CD2-CD2 3.69Å; L850-I855 HydrophobicContact CB-CD1 3.97Å; L850-I855 HydrophobicContact CB-CG1 4.11Å
851	N	47.7	Very low	46.5	Very low	98 Å²	98	110.7 Å²	110.7	52%	0.524	66%	0.655	S	S	.	*			trans	-57.8	128.2	178.8	-170.8	-15.8	0	0	0	108.7	I853 L854 I855	N851-I853 PolarHBondContact O-N 3.28Å; N851-I853 PolarHBondContact OD1-N 3.37Å; N851-L854 HydrophobicContact CB-CB 4.26Å; N851-L854 WeakPolarHBondContact O-CA 2.98Å; N851-L854 WeakPolarHBondContact O-CB 3.13Å; N851-L854 PolarHBondContact O-N 2.87Å; N851-I855 PolarHBondContact O-N 3.07Å
852	P	52.9	Low	48.2	Very low	94 Å²	94	107.5 Å²	107.5	61%	0.61	64%	0.636	S	S	*	*	H	α-helix	trans	-53.1	-31.8	-179.3	-26.2	32.5	0	0	0	112.9	L854 I855 T856	P852-L854 VanDerWaalsContact C-N 3.33Å; P852-L854 PolarHBondContact O-N 2.88Å; P852-I855 PolarHBondContact O-N 2.94Å; P852-T856 PolarHBondContact O-N 3.32Å; P852-T856 VanDerWaalsContact O-N 3.14Å; P852-T856 PolarHBondContact O-OG1 3.21Å
853	I	56.9	Low	49.8	Very low	111 Å²	111	109 Å²	109	57%	0.569	63%	0.625	S	S	*	*	H	α-helix	trans	-64.3	-37.8	176.5	-62.1	172	0	0	0	111.6	N851 T856 I857	N851-I853 PolarHBondContact O-N 3.28Å; N851-I853 PolarHBondContact OD1-N 3.37Å; I853-T856 PolarHBondContact O-N 3.15Å; I853-I857 HydrophobicContact CG2-CD1 3.83Å; I853-I857 WeakPolarHBondContact O-CD1 3.43Å; I853-I857 VanDerWaalsContact O-CG1 3.23Å; I853-I857 WeakPolarHBondContact O-CG1 3.44Å; I853-I857 PolarHBondContact O-N 1.97Å
854	L	53.4	Low	51	Low	77 Å²	77	105.7 Å²	105.7	40%	0.403	60%	0.602	S	S	.	*	H	α-helix	trans	-71.7	-37.2	-179.2	-172.2	62.7	0	0	0	111.4	L850 N851 P852 I857 I858	L850-L854 HydrophobicContact CD2-CD2 3.69Å; N851-L854 HydrophobicContact CB-CB 4.26Å; N851-L854 WeakPolarHBondContact O-CA 2.98Å; N851-L854 WeakPolarHBondContact O-CB 3.13Å; N851-L854 PolarHBondContact O-N 2.87Å; P852-L854 VanDerWaalsContact C-N 3.33Å; P852-L854 PolarHBondContact O-N 2.88Å; L854-I857 PolarHBondContact O-N 2.52Å; L854-I858 HydrophobicContact CD1-CD1 4.44Å; L854-I858 HydrophobicContact CG-CD1 4.02Å; L854-I858 WeakPolarHBondContact O-CB 3.26Å; L854-I858 WeakPolarHBondContact O-CD1 3.21Å; L854-I858 WeakPolarHBondContact O-CG1 3.35Å; L854-I858 PolarHBondContact O-N 3.33Å
855	I	60.3	Low	52.7	Low	94 Å²	94	108.1 Å²	108.1	48%	0.482	60%	0.604	S	S	.	*	H	α-helix	trans	-65.4	-41.2	175.1	-64.1	174.1	0	0	0	110.4	L850 N851 P852 I858 A859	L850-I855 HydrophobicContact CB-CD1 3.97Å; L850-I855 HydrophobicContact CB-CG1 4.11Å; N851-I855 PolarHBondContact O-N 3.07Å; P852-I855 PolarHBondContact O-N 2.94Å; I855-I858 PolarHBondContact O-N 3.08Å; I855-A859 WeakPolarHBondContact O-CB 3.24Å; I855-A859 PolarHBondContact O-N 3.24Å
856	T	60.1	Low	53.5	Low	84 Å²	84	108 Å²	108	52%	0.515	60%	0.597	S	S	.	*	H	α-helix	trans	-68.1	-36.9	176.7	-35.5	0	0	0	0	112	P852 I853 A859 M860	P852-T856 PolarHBondContact O-N 3.32Å; P852-T856 VanDerWaalsContact O-N 3.14Å; P852-T856 PolarHBondContact O-OG1 3.21Å; I853-T856 PolarHBondContact O-N 3.15Å; T856-A859 PolarHBondContact O-N 3.5Å; T856-M860 HydrophobicContact CG2-CG 4.28Å; T856-M860 VanDerWaalsContact O-CB 3.24Å; T856-M860 WeakPolarHBondContact O-CB 3.38Å; T856-M860 WeakPolarHBondContact O-CG 3.2Å; T856-M860 PolarHBondContact O-N 3.38Å
857	I	64.4	Low	54.6	Low	98 Å²	98	104 Å²	104	50%	0.503	58%	0.579	S	S	.	*	H	α-helix	trans	-64.7	-45.2	175.2	-71.1	166.2	0	0	0	110.5	I853 L854 M860 S861	I853-I857 HydrophobicContact CG2-CD1 3.83Å; I853-I857 WeakPolarHBondContact O-CD1 3.43Å; I853-I857 VanDerWaalsContact O-CG1 3.23Å; I853-I857 WeakPolarHBondContact O-CG1 3.44Å; I853-I857 PolarHBondContact O-N 1.97Å; L854-I857 PolarHBondContact O-N 2.52Å; I857-M860 PolarHBondContact O-N 2.99Å; I857-S861 WeakPolarHBondContact O-CB 3.31Å; I857-S861 PolarHBondContact O-N 3.19Å; I857-S861 PolarHBondContact O-OG 2.76Å
858	I	61.6	Low	55.5	Low	100 Å²	100	98.4 Å²	98.4	51%	0.513	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-43.1	178	-67.6	165.5	0	0	0	110.8	L854 I855 S861 A862	L854-I858 HydrophobicContact CD1-CD1 4.44Å; L854-I858 HydrophobicContact CG-CD1 4.02Å; L854-I858 WeakPolarHBondContact O-CB 3.26Å; L854-I858 WeakPolarHBondContact O-CD1 3.21Å; L854-I858 WeakPolarHBondContact O-CG1 3.35Å; L854-I858 PolarHBondContact O-N 3.33Å; I855-I858 PolarHBondContact O-N 3.08Å; I858-S861 WeakPolarHBondContact CA-OG 3.27Å; I858-S861 PolarHBondContact O-OG 3.04Å; I858-A862 VanDerWaalsContact O-CB 3.3Å; I858-A862 WeakPolarHBondContact O-CB 3.36Å; I858-A862 PolarHBondContact O-N 2.9Å
859	A	64.3	Low	56.3	Low	58 Å²	58	92.1 Å²	92.1	48%	0.479	54%	0.544	S	S	.	.	H	α-helix	trans	-66.8	-40.7	177.9	0	0	0	0	0	112.7	I855 T856 L863	I855-A859 WeakPolarHBondContact O-CB 3.24Å; I855-A859 PolarHBondContact O-N 3.24Å; T856-A859 PolarHBondContact O-N 3.5Å; A859-L863 WeakPolarHBondContact O-CB 3.22Å; A859-L863 PolarHBondContact O-N 3.35Å
860	M	58.6	Low	56.8	Low	136 Å²	136	90.2 Å²	90.2	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-72.9	-33.9	179.3	-69.9	-90.7	-84.2	0	0	112.5	T856 I857 G864	T856-M860 HydrophobicContact CG2-CG 4.28Å; T856-M860 VanDerWaalsContact O-CB 3.24Å; T856-M860 WeakPolarHBondContact O-CB 3.38Å; T856-M860 WeakPolarHBondContact O-CG 3.2Å; T856-M860 PolarHBondContact O-N 3.38Å; I857-M860 PolarHBondContact O-N 2.99Å; M860-G864 PolarHBondContact O-N 3.36Å
861	S	62.6	Low	56.7	Low	66 Å²	66	89 Å²	89	46%	0.462	53%	0.528	S	S	.	.	H	α-helix	trans	-73.8	-37.9	175.2	45.3	0	0	0	0	112.1	I857 I858 G864 V865	I857-S861 WeakPolarHBondContact O-CB 3.31Å; I857-S861 PolarHBondContact O-N 3.19Å; I857-S861 PolarHBondContact O-OG 2.76Å; I858-S861 WeakPolarHBondContact CA-OG 3.27Å; I858-S861 PolarHBondContact O-OG 3.04Å; S861-G864 PolarHBondContact O-N 2.71Å; S861-V865 WeakPolarHBondContact O-CG2 3.48Å; S861-V865 PolarHBondContact O-N 3.19Å
862	A	60.8	Low	56.7	Low	58 Å²	58	86.1 Å²	86.1	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-40.1	170.9	0	0	0	0	0	112.2	I858 V865 F866	I858-A862 VanDerWaalsContact O-CB 3.3Å; I858-A862 WeakPolarHBondContact O-CB 3.36Å; I858-A862 PolarHBondContact O-N 2.9Å; A862-V865 PolarHBondContact O-N 3.31Å; A862-F866 WeakPolarHBondContact O-CB 3.2Å; A862-F866 PolarHBondContact O-N 3.08Å
863	L	61.1	Low	56.3	Low	111 Å²	111	86.4 Å²	86.4	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-66.6	-36.9	176	-143.2	89.9	0	0	0	112.2	A859 F866 L867	A859-L863 WeakPolarHBondContact O-CB 3.22Å; A859-L863 PolarHBondContact O-N 3.35Å; L863-F866 PolarHBondContact O-N 2.9Å; L863-L867 HydrophobicContact CD2-CD1 4.13Å; L863-L867 HydrophobicContact CG-CD1 4.33Å; L863-L867 WeakPolarHBondContact O-CB 3.26Å; L863-L867 WeakPolarHBondContact O-CG 3.24Å; L863-L867 PolarHBondContact O-N 3.38Å
864	G	58.9	Low	55.5	Low	44 Å²	44	86.1 Å²	86.1	45%	0.454	53%	0.525	S	S	.	.	H	α-helix	trans	-67.1	-39.5	176.9	0	0	0	0	0	113.4	M860 S861 G868	M860-G864 PolarHBondContact O-N 3.36Å; S861-G864 PolarHBondContact O-N 2.71Å; G864-G868 PolarHBondContact O-N 3.14Å
865	V	63.2	Low	54.8	Low	110 Å²	110	89.1 Å²	89.1	67%	0.667	54%	0.54	S	S	*	.	H	α-helix	trans	-68.1	-38.3	174.4	175.3	0	0	0	0	110.8	S861 A862 G868 A869	S861-V865 WeakPolarHBondContact O-CG2 3.48Å; S861-V865 PolarHBondContact O-N 3.19Å; A862-V865 PolarHBondContact O-N 3.31Å; V865-G868 PolarHBondContact O-N 2.82Å; V865-A869 WeakPolarHBondContact O-CB 3.47Å; V865-A869 PolarHBondContact O-N 2.7Å
866	F	47.9	Very low	53.8	Low	149 Å²	149	94.3 Å²	94.3	65%	0.654	56%	0.555	S	S	*	*	H	α-helix	trans	-69.8	-40.7	178.7	-146.3	-96.1	0	0	0	112.4	A862 L863 A869 I870	A862-F866 WeakPolarHBondContact O-CB 3.2Å; A862-F866 PolarHBondContact O-N 3.08Å; L863-F866 PolarHBondContact O-N 2.9Å; F866-A869 PolarHBondContact O-N 3.14Å; F866-I870 HydrophobicContact CD1-CD1 3.63Å; F866-I870 HydrophobicContact CE1-CD1 3.83Å; F866-I870 WeakPolarHBondContact O-CD1 3.28Å; F866-I870 VanDerWaalsContact O-CG1 3.26Å; F866-I870 WeakPolarHBondContact O-CG1 3.14Å; F866-I870 PolarHBondContact O-N 3.3Å; F866-I870 VanDerWaalsContact O-N 3.13Å
867	L	55.5	Low	52.6	Low	101 Å²	101	95.5 Å²	95.5	53%	0.529	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-35.4	174.4	-79.3	159.2	0	0	0	112.3	L863 I870 C871	L863-L867 HydrophobicContact CD2-CD1 4.13Å; L863-L867 HydrophobicContact CG-CD1 4.33Å; L863-L867 WeakPolarHBondContact O-CB 3.26Å; L863-L867 WeakPolarHBondContact O-CG 3.24Å; L863-L867 PolarHBondContact O-N 3.38Å; L867-I870 PolarHBondContact O-N 3.47Å; L867-C871 PolarHBondContact O-N 3.32Å
868	G	53.7	Low	51.3	Low	46 Å²	46	94.8 Å²	94.8	47%	0.474	57%	0.574	S	S	.	*	H	α-helix	trans	-65.1	-39.2	173.2	0	0	0	0	0	113.2	G864 V865 G872	G864-G868 PolarHBondContact O-N 3.14Å; V865-G868 PolarHBondContact O-N 2.82Å; G868-G872 PolarHBondContact O-N 3.28Å
869	A	53	Low	50.1	Low	60 Å²	60	95.8 Å²	95.8	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-67.9	-35.6	175.2	0	0	0	0	0	112.4	V865 F866 V873	V865-A869 WeakPolarHBondContact O-CB 3.47Å; V865-A869 PolarHBondContact O-N 2.7Å; F866-A869 PolarHBondContact O-N 3.14Å; A869-V873 VanDerWaalsContact O-CG2 3.28Å; A869-V873 WeakPolarHBondContact O-CG2 3.41Å; A869-V873 PolarHBondContact O-N 3.15Å
870	I	50.6	Low	48.8	Very low	91 Å²	91	97.9 Å²	97.9	47%	0.467	60%	0.6	S	S	.	*	H	α-helix	trans	-73.1	-37.7	177.8	-66.8	166.3	0	0	0	111.4	F866 L867 V874	F866-I870 HydrophobicContact CD1-CD1 3.63Å; F866-I870 HydrophobicContact CE1-CD1 3.83Å; F866-I870 WeakPolarHBondContact O-CD1 3.28Å; F866-I870 VanDerWaalsContact O-CG1 3.26Å; F866-I870 WeakPolarHBondContact O-CG1 3.14Å; F866-I870 PolarHBondContact O-N 3.3Å; F866-I870 VanDerWaalsContact O-N 3.13Å; L867-I870 PolarHBondContact O-N 3.47Å; I870-V874 WeakPolarHBondContact O-CG2 3.45Å
871	C	44.3	Very low	47.5	Very low	84 Å²	84	100.9 Å²	100.9	57%	0.568	61%	0.612	S	S	*	*	H	α-helix	trans	-75.1	-30.4	175.6	-84.6	0	0	0	0	113.9	L867 V873 V874 L875	L867-C871 PolarHBondContact O-N 3.32Å; C871-V873 VanDerWaalsContact C-N 3.35Å; C871-V874 PolarHBondContact O-N 3.36Å; C871-L875 PolarHBondContact O-N 3.28Å
872	G	45.8	Very low	46	Very low	37 Å²	37	101.6 Å²	101.6	38%	0.381	63%	0.63	S	S	.	*	H	α-helix	trans	-66.9	-32.7	175.5	0	0	0	0	0	113.7	G868 Y876	G868-G872 PolarHBondContact O-N 3.28Å; G872-Y876 PolarHBondContact O-N 3.13Å
873	V	45.8	Very low	44.5	Very low	100 Å²	100	102.6 Å²	102.6	61%	0.606	65%	0.646	S	S	*	*	H	α-helix	trans	-76.7	-27.6	179.3	175.2	0	0	0	0	112	A869 C871	A869-V873 VanDerWaalsContact O-CG2 3.28Å; A869-V873 WeakPolarHBondContact O-CG2 3.41Å; A869-V873 PolarHBondContact O-N 3.15Å; C871-V873 VanDerWaalsContact C-N 3.35Å
874	V	40	Very low	42.9	Very low	105 Å²	105	106 Å²	106	64%	0.636	66%	0.661	S	S	*	*	H	α-helix	trans	-77.3	-28.8	177.7	178	0	0	0	0	112.3	I870 C871	I870-V874 WeakPolarHBondContact O-CG2 3.45Å; C871-V874 PolarHBondContact O-N 3.36Å
875	L	39.3	Very low	41.6	Very low	139 Å²	139	108.6 Å²	108.6	73%	0.728	67%	0.672	S	S	*	*	H	α-helix	trans	-76.7	-25.5	174.4	-94	147.1	0	0	0	113.6	C871	C871-L875 PolarHBondContact O-N 3.28Å
876	Y	39.1	Very low	40.2	Very low	204 Å²	204	111.8 Å²	111.8	80%	0.8	68%	0.68	S	S	*	*	H	α-helix	trans	-80.6	-19.5	175.5	-98.5	-88.3	0	0	0	114.1	G872	G872-Y876 PolarHBondContact O-N 3.13Å
877	C	34.3	Very low	39.3	Very low	109 Å²	109	116.6 Å²	116.6	74%	0.736	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-2.1	177.9	-85.9	0	0	0	0	114.9
878	A	37.6	Very low	38	Very low	82 Å²	82	118.9 Å²	118.9	68%	0.678	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	4.2	178.5	0	0	0	0	0	115.1
879	C	36.1	Very low	36.8	Very low	121 Å²	121	123.9 Å²	123.9	82%	0.818	72%	0.721	S	S	*	*	S	Bend	trans	-121	26.8	-178.5	-73.5	0	0	0	0	115.4
880	S	35.9	Very low	35.8	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	73%	0.732	S	S	*	*	S	Bend	trans	-130	53.7	173.9	176.7	0	0	0	0	112.6
881	H	32.3	Very low	34.8	Very low	198 Å²	198	125.9 Å²	125.9	92%	0.917	75%	0.746	S	S	*	*	S	Bend	trans	-153.7	122.8	156.5	-107.6	-10.3	0	0	0	111.7
882	G	30.2	Very low	34.2	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	76%	0.763	S	S	*	*			trans	110.5	123.3	164.1	0	0	0	0	0	115.5
883	G	30.1	Very low	33.4	Very low	79 Å²	79	137 Å²	137	81%	0.814	78%	0.784	S	S	*	*			trans	-93.2	-170	-173.2	0	0	0	0	0	116.7
884	M	27.6	Very low	32.6	Very low	183 Å²	183	139 Å²	139	90%	0.901	79%	0.791	S	S	*	*			trans	85.9	110.6	170.9	-71.5	-173.4	108.2	0	0	119.3
885	S	31.6	Very low	31.9	Very low	99 Å²	99	144.5 Å²	144.5	69%	0.692	80%	0.802	S	S	*	*				63.1	126.3	129.5	69.1	0	0	0	0	122.6
886	E	33.4	Very low	31.3	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	81%	0.809	S	S	*	*			trans	59	111.9	148.9	-64.9	-169.6	174.4	0	0	119.8
887	R	30.1	Very low	30.7	Very low	249 Å²	249	145.3 Å²	145.3	94%	0.94	81%	0.812	S	S	*	*				175.4	151.1	115.6	-93.6	169.5	-172.1	-169.2	3.7	112.8
888	N	27.7	Very low	30.5	Very low	150 Å²	150	148.5 Å²	148.5	80%	0.802	82%	0.816	S	S	*	*			trans	-71.6	157.1	-174.9	-88.8	-26.7	0	0	0	116.3
889	L	29.3	Very low	30	Very low	150 Å²	150	153.1 Å²	153.1	79%	0.785	83%	0.828	S	S	*	*			trans	88.8	119.8	137.4	-83.4	155.4	0	0	0	121.9
890	S	31	Very low	29.6	Very low	103 Å²	103	153.5 Å²	153.5	72%	0.72	83%	0.827	S	S	*	*			trans	62.5	108.1	132.3	66.6	0	0	0	0	120.1
891	A	29.9	Very low	29.3	Very low	91 Å²	91	156.5 Å²	156.5	75%	0.752	84%	0.835	S	S	*	*				163.3	113.9	126.3	0	0	0	0	0	109.4
892	L	30.5	Very low	29.2	Very low	177 Å²	177	150 Å²	150	93%	0.927	82%	0.822	S	S	*	*			trans	-176.8	81.2	135.6	-117.9	89.5	0	0	0	108.8
893	E	29.6	Very low	29	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	82%	0.824	S	S	*	*			trans	-85.5	155.2	151	-80.6	178.6	151.5	0	0	108.7
894	N	28.6	Very low	29	Very low	141 Å²	141	158.7 Å²	158.7	75%	0.754	83%	0.826	S	S	*	*			trans	81.2	102.2	171.8	-60.6	-31.4	0	0	0	116.8
895	Y	26.6	Very low	29	Very low	220 Å²	220	158.4 Å²	158.4	86%	0.863	83%	0.827	S	S	*	*				-156.4	107.9	116.3	-89.9	-70.9	0	0	0	110
896	N	25.9	Very low	28.8	Very low	163 Å²	163	163 Å²	163	87%	0.872	84%	0.835	S	S	*	*			trans	-83.2	137.7	162.3	-92.2	-10.4	0	0	0	108.9
897	F	27.5	Very low	28.4	Very low	197 Å²	197	163.8 Å²	163.8	86%	0.864	84%	0.835	S	S	*	*			trans	-113	112.7	164.8	-102.3	-86.8	0	0	0	109.7
898	E	28.2	Very low	28.3	Very low	177 Å²	177	159.3 Å²	159.3	83%	0.827	83%	0.83	S	S	*	*			trans	-78.9	132.7	164.6	-75.2	-179.9	150.8	0	0	109.8
899	L	27.3	Very low	28.3	Very low	178 Å²	178	160.5 Å²	160.5	93%	0.932	83%	0.828	S	S	*	*			trans	-96.9	116.6	166.8	-83	156.4	0	0	0	108.4
900	V	28.3	Very low	28.2	Very low	130 Å²	130	160.1 Å²	160.1	79%	0.788	83%	0.826	S	S	*	*			trans	-121.2	123.8	169.5	-177.5	0	0	0	0	109.1
901	D	29.3	Very low	27.9	Very low	166 Å²	166	161.4 Å²	161.4	89%	0.888	83%	0.825	S	S	*	*			trans	-85.5	148.7	176.3	-151.9	-4	0	0	0	111.6
902	G	30.5	Very low	27.8	Very low	62 Å²	62	162.5 Å²	162.5	64%	0.639	82%	0.822	S	S	*	*			trans	-91.9	166.7	-147.2	0	0	0	0	0	119.5
903	V	27	Very low	27.6	Very low	145 Å²	145	161.8 Å²	161.8	88%	0.879	81%	0.814	S	S	*	*			trans	-148.6	132.6	155.8	179.3	0	0	0	0	111.7
904	K	29.9	Very low	27.6	Very low	196 Å²	196	159.6 Å²	159.6	85%	0.852	81%	0.808	S	S	*	*			trans	-18.8	136.2	165.9	-73.4	170.4	173.3	168.6	0	118.1
905	L	27.3	Very low	27.6	Very low	178 Å²	178	157.2 Å²	157.2	93%	0.932	80%	0.802	S	S	*	*			trans	-152	153	138.4	-100	168.4	0	0	0	112.7
906	K	26.3	Very low	27.6	Very low	196 Å²	196	157.7 Å²	157.7	85%	0.852	80%	0.804	S	S	*	*			trans	-72.1	148.1	-166.7	-76.6	169	171.5	172.9	0	114.8
907	K	26.5	Very low	27.8	Very low	192 Å²	192	155.3 Å²	155.3	84%	0.835	80%	0.8	S	S	*	*			trans	34.9	107.9	131.4	-131.4	-177.9	-170.4	179.7	0	116.9
908	D	26.7	Very low	27.9	Very low	155 Å²	155	155.2 Å²	155.2	83%	0.829	80%	0.802	S	S	*	*				-172.2	164.2	119.3	-97.8	-27.5	0	0	0	114.8
909	K	28.2	Very low	28	Very low	175 Å²	175	155.2 Å²	155.2	76%	0.761	83%	0.832	S	S	*	*			trans	-64.6	151.4	-161.5	-79.3	164.1	166.6	-180	0	119.7
910	L	26.1	Very low	28.1	Very low	143 Å²	143	154.1 Å²	154.1	75%	0.749	83%	0.827	S	S	*	*				77.7	135.9	129.5	-79.8	158.3	0	0	0	122.8
911	N	25.5	Very low	28.1	Very low	130 Å²	130	155.3 Å²	155.3	70%	0.695	83%	0.829	S	S	*	*			trans	82.3	109.5	154	-70	-7.5	0	0	0	118
912	V	27.8	Very low	28	Very low	113 Å²	113	154.7 Å²	154.7	69%	0.685	83%	0.826	S	S	*	*				80.6	114.5	56.4	178.9	0	0	0	0	112.2
913	Q	26.6	Very low	27.8	Very low	163 Å²	163	160.2 Å²	160.2	76%	0.762	84%	0.837	S	S	*	*			trans	102.3	128.3	142.2	-94.9	170.6	-13.6	0	0	121.8
914	N	29.1	Very low	27.9	Very low	132 Å²	132	161.1 Å²	161.1	71%	0.706	84%	0.835	S	S	*	*			trans	87.8	128.7	147.5	-60.7	-16.4	0	0	0	115.6
915	S	28	Very low	27.8	Very low	91 Å²	91	158.8 Å²	158.8	64%	0.636	83%	0.833	S	S	*	*			cis	177.3	136.3	6.5	30.4	0	0	0	0	108.7
916	Y	27	Very low	27.8	Very low	229 Å²	229	157.4 Å²	157.4	90%	0.898	83%	0.826	S	S	*	*			trans	43.7	139.9	149.5	-56.1	-77	0	0	0	119.6
917	S	30.5	Very low	27.9	Very low	113 Å²	113	154.5 Å²	154.5	79%	0.79	82%	0.824	S	S	*	*			cis	-164.7	157.9	46.5	51.6	0	0	0	0	112.2
918	E	30.5	Very low	28	Very low	196 Å²	196	151.3 Å²	151.3	92%	0.916	82%	0.823	S	S	*	*			trans	-55.2	140.6	-179.9	-64.2	167.1	149.1	0	0	116
919	A	30.3	Very low	28.1	Very low	176 Å²	176	151 Å²	151	100%	1.455	82%	0.823	S	S	*	*			trans	-156.4	0	136.9	0	0	0	0	0	108.7

Retrieved 919 of 919 residues in 1084.3 ms (Link to these results)

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