A0A3Q0KTS7_SCHMA Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTS7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,294 aa.

						>A0A3Q0KTS7_SCHMA|A0A3Q0KTS7
MLWHILFILNLILSSTFSLLETEKLPHFALRSFLSTNDIVYFNFPIPQHTFVTKLSISITFHGCNPENISLTLRSGSFPVVRPLGVSVPNGILEPINSHSLNIPIKESFNLTFTSEDCGTYSQFHVRSINLRNAANIDININGPVVGMWYIGAYMTTSFQKECIAWLLPSVRHDISYIDGHISYNYNAQLRHNQSIVHEKPFIASIHELPSRTIFASHSEEKIFHRKKRRKPFYHSLVQSTADQPMHSPLIPPSSSTESNSNNPYHIRNLSFLVSPFDLELAPMEGRLYLLAIMDEMTSIDVILEDCRIVTPIAPSLGNISVSKPSNSTSKGTRKSSLHDDLPNEIIFDSSACPIIIDGSVEALPSSLSYLHQSQGFRVSTTKKHDYGIGFSPNVGSPSSNAFNYTQDSSIQRIFRLLGLRGSQINHYLYILNQASHVAVYLRLVIIPKFGCALMKNSRNFHHDDYLHRQSKKLSSQFLSIKHENKSFKDKINFNRTTNNINYRFFLSISLLPWINPDWPELTPEYGEKKWLKTHYSTNTQQLITSNFGLFDFNHPGYHDLPLCYIWPTPTRVHLPMKFTYHFTYQPDFGRYASLLHLKPWHIVVIPITLNSVMDMSSVLEIALQLNALNVSWQFNETYREPLPRQIILHGCFARHLTNTPKGFADIHRCPLWIRLATDHGLAVSVAHAISSAASKVFASSQSPRRSERPPNLDTSFNESVDRSFLFFPYPTPGRWYLSLYPECYTAYDAFCGLDQSAVIDVSLIIRSTPCINNHCRQIGEGASLAPSRLLYSNELKVNTSRSRDGSQRWRPPWWSTDGSNKDNTNKENYHFKYNSPFNYVPIKKIGKIPGEGICINLFQRSIHVSTCACPIGYGGLGCMPLPIDYFKTFGLYPNRQILSYDALILALSNFGFIPAILLSVIHRLWIPALVYGYTFLFSTLYHICDTDSNLIPGYNVMHTPNYVSSSSSMFYQSTDIAFKMNIPTSSSSSSKSYIHSQFTSSICVLPVDTLSFCDFFGGIFSIWISTLTIAAIPMKYTQCAFIIGALSLTVAVQIVRYSIGIILVPLIVGLIIILYSWINLCIKLRSLFPPIQWWIISFIPGVLFATIGSSMFFHGQSTRDYTKHHSIWHILIGLSLACFLPWPFRWRIALSPIISVHIPLSCGNLPKRYDYNNDLSNTNSLVIPVEIIQNESENLHVCNNVLDGDRDVNLSNEYMTPTKLSYKSIVINKLTNNLNKLTKFTYKVYRKFTSQVDKLFQLNFLLDPLCTRWPKLKWILPYGYQPKNVLSADTQTD
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	52.2	Low	189 Å²	189	127.5 Å²	127.5	93%	0.931	61%	0.614	S	S	*	*				0	-70.3	0	-78.5	179	71.4	0	0	113.2	W3 H4 I5	M1-W3 VanDerWaalsContact C-N 3.31Å; M1-W3 PolarHBondContact O-N 2.96Å; M1-W3 VanDerWaalsContact O-N 3.08Å; M1-H4 WeakPolarHBondContact O-CA 3.26Å; M1-H4 PolarHBondContact O-N 2.98Å; M1-I5 HydrophobicContact CB-CD1 4.47Å; M1-I5 HydrophobicContact CE-CD1 4.43Å; M1-I5 PolarHBondContact O-N 3.1Å; M1-I5 VanDerWaalsContact O-N 3.09Å
2	L	43.9	Very low	52	Low	130 Å²	130	124.8 Å²	124.8	68%	0.681	60%	0.604	S	S	*	*	H	α-helix	trans	-49.7	-42.7	-166.7	-144.1	79.3	0	0	0	115.3	H4 I5 L6	L2-H4 PolarHBondContact O-N 2.92Å; L2-I5 PolarHBondContact O-N 2.97Å; L2-L6 PolarHBondContact O-N 3.28Å
3	W	40.3	Very low	51.2	Low	223 Å²	223	123.2 Å²	123.2	85%	0.845	60%	0.599	S	S	*	*	H	α-helix	trans	-62.6	-37.9	175.3	-98.2	68.5	0	0	0	114.3	M1 F7	M1-W3 VanDerWaalsContact C-N 3.31Å; M1-W3 PolarHBondContact O-N 2.96Å; M1-W3 VanDerWaalsContact O-N 3.08Å; W3-F7 WeakPolarHBondContact O-CB 3.36Å; W3-F7 PolarHBondContact O-N 3.4Å
4	H	49.2	Very low	50.5	Low	134 Å²	134	121.6 Å²	121.6	62%	0.62	61%	0.607	S	S	*	*	H	α-helix	trans	-71.1	-34.5	172.9	-74.9	-37.7	0	0	0	111.9	M1 L2 F7 I8	M1-H4 WeakPolarHBondContact O-CA 3.26Å; M1-H4 PolarHBondContact O-N 2.98Å; L2-H4 PolarHBondContact O-N 2.92Å; H4-F7 PolarHBondContact O-N 2.98Å; H4-I8 VanDerWaalsContact O-CB 3.28Å; H4-I8 WeakPolarHBondContact O-CB 3.44Å; H4-I8 WeakPolarHBondContact O-CD1 3.45Å; H4-I8 WeakPolarHBondContact O-CG1 3.47Å; H4-I8 PolarHBondContact O-N 3.4Å
5	I	66.6	Low	49.6	Very low	84 Å²	84	119.6 Å²	119.6	43%	0.431	61%	0.609	S	S	.	*	H	α-helix	trans	-62.5	-45.2	174.9	-62.7	171.3	0	0	0	109.8	M1 L2 I8 L9	M1-I5 HydrophobicContact CB-CD1 4.47Å; M1-I5 HydrophobicContact CE-CD1 4.43Å; M1-I5 PolarHBondContact O-N 3.1Å; M1-I5 VanDerWaalsContact O-N 3.09Å; L2-I5 PolarHBondContact O-N 2.97Å; I5-I8 PolarHBondContact O-N 3.26Å; I5-L9 WeakPolarHBondContact O-CB 3.35Å; I5-L9 PolarHBondContact O-N 2.93Å
6	L	59.5	Low	48.7	Very low	105 Å²	105	118.6 Å²	118.6	55%	0.55	61%	0.611	S	S	.	*	H	α-helix	trans	-63.1	-43.2	174.8	-72.8	165.4	0	0	0	112.7	L2 L9 N10	L2-L6 PolarHBondContact O-N 3.28Å; L6-L9 PolarHBondContact O-N 3.21Å; L6-N10 PolarHBondContact O-N 3.19Å
7	F	57.8	Low	47.8	Very low	135 Å²	135	121.7 Å²	121.7	59%	0.592	62%	0.619	S	S	*	*	H	α-helix	trans	-65.1	-40.2	178.1	-167.4	-101.1	0	0	0	112.4	W3 H4 N10 L11	W3-F7 WeakPolarHBondContact O-CB 3.36Å; W3-F7 PolarHBondContact O-N 3.4Å; H4-F7 PolarHBondContact O-N 2.98Å; F7-N10 PolarHBondContact O-N 3.05Å; F7-L11 HydrophobicContact CD1-CD1 3.77Å; F7-L11 HydrophobicContact CE1-CD1 3.54Å; F7-L11 HydrophobicContact CZ-CD1 4.35Å; F7-L11 PolarHBondContact O-N 3.25Å; F7-L11 VanDerWaalsContact O-N 3.08Å
8	I	62.5	Low	47	Very low	92 Å²	92	120.2 Å²	120.2	47%	0.472	62%	0.622	S	S	.	*	H	α-helix	trans	-68.2	-39.8	174.9	-70	166.1	0	0	0	110.8	H4 I5 N10 L11 I12	H4-I8 VanDerWaalsContact O-CB 3.28Å; H4-I8 WeakPolarHBondContact O-CB 3.44Å; H4-I8 WeakPolarHBondContact O-CD1 3.45Å; H4-I8 WeakPolarHBondContact O-CG1 3.47Å; H4-I8 PolarHBondContact O-N 3.4Å; I5-I8 PolarHBondContact O-N 3.26Å; I8-N10 VanDerWaalsContact C-N 3.28Å; I8-N10 PolarHBondContact O-N 3.44Å; I8-L11 PolarHBondContact O-N 2.83Å; I8-I12 HydrophobicContact CG2-CD1 3.71Å; I8-I12 HydrophobicContact CG2-CG1 4.35Å; I8-I12 VanDerWaalsContact O-CG1 3.31Å; I8-I12 WeakPolarHBondContact O-CG1 3.47Å; I8-I12 PolarHBondContact O-N 3.41Å
9	L	56.7	Low	46.6	Very low	97 Å²	97	122.2 Å²	122.2	51%	0.508	63%	0.632	S	S	.	*	H	α-helix	trans	-57.4	-43.7	173.7	-128.5	79	0	0	0	111.5	I5 L6 I12 L13	I5-L9 WeakPolarHBondContact O-CB 3.35Å; I5-L9 PolarHBondContact O-N 2.93Å; L6-L9 PolarHBondContact O-N 3.21Å; L9-I12 PolarHBondContact O-N 2.96Å; L9-L13 WeakPolarHBondContact O-CB 3.21Å; L9-L13 WeakPolarHBondContact O-CG 3.42Å; L9-L13 PolarHBondContact O-N 2.99Å
10	N	51.9	Low	46.3	Very low	116 Å²	116	120.5 Å²	120.5	62%	0.62	62%	0.624	S	S	*	*	H	α-helix	trans	-66.8	-39.3	-179.7	-137	4.5	0	0	0	111.9	L6 F7 I8 S14	L6-N10 PolarHBondContact O-N 3.19Å; F7-N10 PolarHBondContact O-N 3.05Å; I8-N10 VanDerWaalsContact C-N 3.28Å; I8-N10 PolarHBondContact O-N 3.44Å; N10-S14 VanDerWaalsContact O-CB 3.28Å; N10-S14 WeakPolarHBondContact O-CB 3.48Å; N10-S14 PolarHBondContact O-N 3.43Å
11	L	49.3	Very low	46.4	Very low	97 Å²	97	120.4 Å²	120.4	51%	0.508	62%	0.621	S	S	.	*	H	α-helix	trans	-66.3	-38.9	173.6	-85.3	160.1	0	0	0	112.9	F7 I8 S14 S15	F7-L11 HydrophobicContact CD1-CD1 3.77Å; F7-L11 HydrophobicContact CE1-CD1 3.54Å; F7-L11 HydrophobicContact CZ-CD1 4.35Å; F7-L11 PolarHBondContact O-N 3.25Å; F7-L11 VanDerWaalsContact O-N 3.08Å; I8-L11 PolarHBondContact O-N 2.83Å; L11-S14 PolarHBondContact O-N 2.97Å; L11-S15 WeakPolarHBondContact O-CB 3.31Å; L11-S15 PolarHBondContact O-N 2.77Å; L11-S15 PolarHBondContact O-OG 3.4Å; L11-S15 VanDerWaalsContact O-OG 3.06Å
12	I	49.5	Very low	47.1	Very low	96 Å²	96	115.4 Å²	115.4	49%	0.492	60%	0.601	S	S	.	*	H	α-helix	trans	-65.6	-50.5	175.7	-69.1	167.7	0	0	0	109.9	I8 L9 S14 S15	I8-I12 HydrophobicContact CG2-CD1 3.71Å; I8-I12 HydrophobicContact CG2-CG1 4.35Å; I8-I12 VanDerWaalsContact O-CG1 3.31Å; I8-I12 WeakPolarHBondContact O-CG1 3.47Å; I8-I12 PolarHBondContact O-N 3.41Å; L9-I12 PolarHBondContact O-N 2.96Å; I12-S14 PolarHBondContact O-N 2.88Å; I12-S15 PolarHBondContact O-N 3.32Å; I12-S15 PolarHBondContact O-OG 2.95Å
13	L	41.6	Very low	48.1	Very low	103 Å²	103	112.9 Å²	112.9	54%	0.539	59%	0.585	S	S	.	*	H	α-helix	trans	-57.4	-34.7	176.6	-77.4	162.9	0	0	0	113	L9 S15	L9-L13 WeakPolarHBondContact O-CB 3.21Å; L9-L13 WeakPolarHBondContact O-CG 3.42Å; L9-L13 PolarHBondContact O-N 2.99Å; L13-S15 VanDerWaalsContact C-N 3.28Å; L13-S15 PolarHBondContact O-N 2.73Å
14	S	40.8	Very low	49.1	Very low	102 Å²	102	110.9 Å²	110.9	71%	0.713	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-4.2	178.6	-171.8	0	0	0	0	114.9	N10 L11 I12	N10-S14 VanDerWaalsContact O-CB 3.28Å; N10-S14 WeakPolarHBondContact O-CB 3.48Å; N10-S14 PolarHBondContact O-N 3.43Å; L11-S14 PolarHBondContact O-N 2.97Å; I12-S14 PolarHBondContact O-N 2.88Å
15	S	38.1	Very low	50	Low	91 Å²	91	105.1 Å²	105.1	64%	0.636	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	0.6	-169.9	62.1	0	0	0	0	115.6	L11 I12 L13	L11-S15 WeakPolarHBondContact O-CB 3.31Å; L11-S15 PolarHBondContact O-N 2.77Å; L11-S15 PolarHBondContact O-OG 3.4Å; L11-S15 VanDerWaalsContact O-OG 3.06Å; I12-S15 PolarHBondContact O-N 3.32Å; I12-S15 PolarHBondContact O-OG 2.95Å; L13-S15 VanDerWaalsContact C-N 3.28Å; L13-S15 PolarHBondContact O-N 2.73Å
16	T	34.6	Very low	49.8	Very low	103 Å²	103	103.9 Å²	103.9	63%	0.632	55%	0.554	S	S	*	*	S	Bend	trans	-121.2	13.1	-175.5	63.6	0	0	0	0	114.8
17	F	33	Very low	50.4	Low	172 Å²	172	103.2 Å²	103.2	75%	0.754	55%	0.548	S	S	*	.			trans	-94.3	112.2	172.1	-93.7	-86.8	0	0	0	111.2
18	S	34.4	Very low	51	Low	95 Å²	95	97.7 Å²	97.7	66%	0.664	52%	0.523	S	S	*	.			trans	-63.3	138.5	155	41	0	0	0	0	109	L20	S18-L20 PolarHBondContact O-N 3.14Å
19	L	38.8	Very low	51.7	Low	158 Å²	158	95.1 Å²	95.1	83%	0.827	52%	0.516	S	S	*	.	S	Bend	trans	-67.8	99.4	-175.3	-88.8	78.1	0	0	0	111.5
20	L	39.8	Very low	52.6	Low	87 Å²	87	90.5 Å²	90.5	46%	0.455	49%	0.492	S	S	.	.			trans	-124.9	81.6	163.1	-96.1	152.9	0	0	0	106.5	S18 T22	S18-L20 PolarHBondContact O-N 3.14Å; L20-T22 VanDerWaalsContact C-N 3.32Å; L20-T22 PolarHBondContact O-N 3.3Å
21	E	49	Very low	53.6	Low	120 Å²	120	89.5 Å²	89.5	56%	0.561	48%	0.479	S	S	*	.			trans	-76.4	84.8	-176	-166.3	161.1	-132.5	0	0	110	E23	E21-E23 PolarHBondContact O-N 3.03Å
22	T	52.5	Low	54.8	Low	84 Å²	84	85.5 Å²	85.5	52%	0.515	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	97.3	173.8	60.3	0	0	0	0	109.9	L20 K24 V171 R172	L20-T22 VanDerWaalsContact C-N 3.32Å; L20-T22 PolarHBondContact O-N 3.3Å; T22-K24 PolarHBondContact O-N 3.2Å; T22-V171 CarbonylContact C-O 3.57Å; T22-V171 VanDerWaalsContact CA-O 3.3Å; T22-V171 WeakPolarHBondContact CA-O 3.47Å; T22-R172 HydrophobicContact CG2-CB 4.31Å; T22-R172 HydrophobicContact CG2-CG 4.37Å
23	E	63.9	Low	55.9	Low	76 Å²	76	83 Å²	83	36%	0.355	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	115.2	176.2	-169.9	175.7	-170.5	0	0	109.9	E21 L25 S170 V171	E21-E23 PolarHBondContact O-N 3.03Å; E23-L25 PolarHBondContact O-N 3.31Å; E23-S170 WeakPolarHBondContact O-CA 3.34Å; E23-V171 PolarHBondContact N-O 3.23Å; E23-V171 PolarHBondContact O-N 3.08Å
24	K	61.5	Low	57.1	Low	181 Å²	181	85 Å²	85	79%	0.787	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	105.9	170.2	-72.7	-172.7	177.9	-178.2	0	109	T22	T22-K24 PolarHBondContact O-N 3.2Å
25	L	67.9	Low	58.3	Low	14 Å²	14	82.4 Å²	82.4	7%	0.073	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-70.6	154.3	173.1	-68.1	170.5	0	0	0	110	E23 F42 F44 P169 V171	E23-L25 PolarHBondContact O-N 3.31Å; L25-F42 HydrophobicContact CD1-CD2 4.25Å; L25-F42 HydrophobicContact CD1-CE2 4.45Å; L25-F44 HydrophobicContact CD1-CB 4.25Å; L25-F44 HydrophobicContact CD2-CB 4.4Å; L25-P169 HydrophobicContact CB-CB 4.29Å; L25-P169 HydrophobicContact CB-CG 3.85Å; L25-P169 HydrophobicContact CD1-CB 4.13Å; L25-P169 HydrophobicContact CD1-CG 4.33Å; L25-P169 PolarHBondContact N-O 3.03Å; L25-V171 HydrophobicContact CD1-CG2 3.77Å; L25-V171 HydrophobicContact CG-CG2 4.38Å
26	P	62.8	Low	59.3	Low	57 Å²	57	82.6 Å²	82.6	37%	0.37	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-64.6	157	179.5	23.7	-30.5	0	0	0	112.2	F28 S862	P26-F28 HydrophobicContact CG-CE1 4.33Å; P26-F28 HydrophobicContact CG-CZ 3.86Å; P26-F28 WeakPolarHBondContact O-CD2 3.25Å; P26-F28 WeakPolarHBondContact O-CE2 3.32Å; P26-S862 WeakPolarHBondContact CG-OG 3.43Å
27	H	72.1	Confident	60.4	Low	92 Å²	92	83 Å²	83	43%	0.426	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-74.8	138.5	179.5	-48.8	-57.3	0	0	0	111.3	L167 Y963	H27-L167 WeakPolarHBondContact CA-O 3.39Å; H27-Y963 PolarHBondContact CD2-OH 3.29Å; H27-Y963 VanDerWaalsContact CD2-OH 3.29Å
28	F	71.4	Confident	62.2	Low	19 Å²	19	75.9 Å²	75.9	8%	0.083	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.2	-179.5	-58.2	-73.4	0	0	0	110.7	P26 V40 F42 W166 L167 P169	P26-F28 HydrophobicContact CG-CE1 4.33Å; P26-F28 HydrophobicContact CG-CZ 3.86Å; P26-F28 WeakPolarHBondContact O-CD2 3.25Å; P26-F28 WeakPolarHBondContact O-CE2 3.32Å; F28-V40 HydrophobicContact CB-CG1 4.13Å; F28-V40 HydrophobicContact CD1-CG1 3.72Å; F28-V40 HydrophobicContact CE1-CG1 4.43Å; F28-V40 HydrophobicContact CG-CG1 4.07Å; F28-F42 HydrophobicContact CD2-CB 4.48Å; F28-F42 HydrophobicContact CD2-CD1 4.26Å; F28-F42 HydrophobicContact CD2-CG 4.34Å; F28-F42 HydrophobicContact CE1-CB 4Å; F28-F42 HydrophobicContact CE2-CB 3.62Å; F28-F42 HydrophobicContact CE2-CD1 4.1Å; F28-F42 HydrophobicContact CE2-CD2 4.13Å; F28-F42 AromaticContact CE2-CG 3.72Å; F28-F42 HydrophobicContact CE2-CG 3.72Å; F28-F42 HydrophobicContact CZ-CB 3.33Å; F28-F42 AromaticContact CZ-CG 3.99Å; F28-F42 HydrophobicContact CZ-CG 3.99Å; F28-W166 CarbonylContact O-C 3.57Å; F28-W166 WeakPolarHBondContact O-CA 3.29Å; F28-L167 HydrophobicContact CB-CB 4.31Å; F28-L167 PolarHBondContact N-O 2.97Å; F28-L167 PolarHBondContact O-N 3.23Å; F28-P169 HydrophobicContact CD2-CG 3.77Å; F28-P169 HydrophobicContact CE2-CG 3.7Å
29	A	76.5	Confident	63.9	Low	38 Å²	38	72.3 Å²	72.3	31%	0.314	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	112.9	173.1	0	0	0	0	0	110.1	I164 W166	A29-I164 HydrophobicContact CB-CG2 4.2Å; A29-W166 HydrophobicContact CB-CD2 4.26Å; A29-W166 HydrophobicContact CB-CE3 3.93Å; A29-W166 HydrophobicContact CB-CH2 4.12Å; A29-W166 HydrophobicContact CB-CZ2 4.41Å; A29-W166 HydrophobicContact CB-CZ3 3.87Å
30	L	75	Confident	65.5	Low	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	131.3	166.3	-68.5	-177.9	0	0	0	109.7	V40 I69 A153 M155 I164 A165 L167	L30-V40 HydrophobicContact CD2-CB 3.85Å; L30-V40 HydrophobicContact CD2-CG2 3.76Å; L30-I69 HydrophobicContact CD1-CD1 4.44Å; L30-I69 HydrophobicContact CD1-CG1 4.45Å; L30-A153 HydrophobicContact CD1-CB 4.2Å; L30-A153 HydrophobicContact CD2-CB 4.15Å; L30-A153 WeakPolarHBondContact CD2-O 3.31Å; L30-M155 HydrophobicContact CB-CB 4.39Å; L30-M155 HydrophobicContact CD1-CB 4.39Å; L30-I164 WeakPolarHBondContact O-CA 3.43Å; L30-A165 HydrophobicContact CB-CB 4.45Å; L30-A165 PolarHBondContact N-O 3.33Å; L30-A165 PolarHBondContact O-N 3.27Å; L30-L167 HydrophobicContact CD1-CD1 3.68Å; L30-L167 HydrophobicContact CD1-CD2 3.9Å; L30-L167 HydrophobicContact CD1-CG 4.48Å; L30-L167 HydrophobicContact CG-CD1 3.94Å; L30-L167 HydrophobicContact CG-CD2 4.29Å
31	R	73.9	Confident	67.3	Low	94 Å²	94	66.2 Å²	66.2	36%	0.355	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	166.6	164.1	-63.4	-176	-174.5	168.1	7.9	109.3	F33 M958 H959	R31-F33 PolarHBondContact O-N 2.92Å; R31-M958 PolarHBondContact NH1-O 3.3Å; R31-M958 PolarHBondContact NH2-O 2.81Å; R31-M958 VanDerWaalsContact NH2-O 3.14Å; R31-H959 PolarHBondContact NH2-O 3.21Å
32	S	73	Confident	68.5	Low	14 Å²	14	60.7 Å²	60.7	10%	0.098	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-62.6	133.4	166.7	-169.7	0	0	0	0	110.1	L34 T157 C163	S32-L34 PolarHBondContact O-N 2.83Å; S32-L34 VanDerWaalsContact O-N 3.11Å; S32-T157 WeakPolarHBondContact CB-OG1 3.31Å; S32-T157 PolarHBondContact OG-OG1 3.36Å; S32-C163 PolarHBondContact N-O 2.89Å
33	F	73.5	Confident	69.7	Low	44 Å²	44	58 Å²	58	19%	0.193	30%	0.297	C	S	.	.			trans	-65.6	110.4	-175.5	177.3	-92.7	0	0	0	111.7	R31 S35 D38 I39 P83 Y154 M155	R31-F33 PolarHBondContact O-N 2.92Å; F33-S35 WeakPolarHBondContact CD2-O 3.18Å; F33-S35 VanDerWaalsContact CE2-C 3.47Å; F33-S35 WeakPolarHBondContact CE2-O 3.49Å; F33-D38 HydrophobicContact CD2-CB 4.42Å; F33-I39 HydrophobicContact CD2-CG1 4.01Å; F33-I39 HydrophobicContact CE2-CD1 3.99Å; F33-I39 HydrophobicContact CE2-CG1 3.84Å; F33-P83 HydrophobicContact CD1-CB 3.85Å; F33-P83 HydrophobicContact CD2-CB 4.16Å; F33-P83 HydrophobicContact CD2-CG 4.07Å; F33-P83 HydrophobicContact CE1-CB 3.39Å; F33-P83 HydrophobicContact CE1-CG 4.03Å; F33-P83 HydrophobicContact CE2-CB 3.72Å; F33-P83 HydrophobicContact CE2-CG 3.4Å; F33-P83 VanDerWaalsContact CE2-CG 3.4Å; F33-P83 HydrophobicContact CG-CB 4.23Å; F33-P83 HydrophobicContact CZ-CB 3.33Å; F33-P83 HydrophobicContact CZ-CG 3.4Å; F33-P83 VanDerWaalsContact CZ-CG 3.4Å; F33-Y154 HydrophobicContact CB-CD2 4.01Å; F33-Y154 HydrophobicContact CD2-CD2 4.44Å; F33-Y154 HydrophobicContact CG-CD2 4.21Å; F33-M155 WeakPolarHBondContact CB-O 3.37Å; F33-M155 PolarHBondContact N-O 3.25Å
34	L	67.8	Low	70.2	Confident	145 Å²	145	54.4 Å²	54.4	76%	0.759	28%	0.28	S	S	*	.	S	Bend	trans	-116.6	-25.7	171.9	-64.9	172.1	0	0	0	111.5	S32 D38	S32-L34 PolarHBondContact O-N 2.83Å; S32-L34 VanDerWaalsContact O-N 3.11Å; L34-D38 PolarHBondContact N-OD2 3.45Å; L34-D38 VanDerWaalsContact N-OD2 3.14Å
35	S	64.1	Low	70.9	Confident	46 Å²	46	48.2 Å²	48.2	32%	0.322	26%	0.258	S	S	.	.	S	Bend	trans	-149.4	165.4	-173.9	72.6	0	0	0	0	111.2	F33 N37 D38	F33-S35 WeakPolarHBondContact CD2-O 3.18Å; F33-S35 VanDerWaalsContact CE2-C 3.47Å; F33-S35 WeakPolarHBondContact CE2-O 3.49Å; S35-N37 PolarHBondContact O-N 3.49Å; S35-N37 PolarHBondContact OG-N 3.29Å; S35-D38 WeakPolarHBondContact CA-OD2 3.07Å; S35-D38 PolarHBondContact N-OD2 2.79Å; S35-D38 PolarHBondContact O-N 3.41Å; S35-D38 PolarHBondContact OG-OD2 3.22Å
36	T	59.5	Low	71.3	Confident	95 Å²	95	48 Å²	48	58%	0.583	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-59.5	-18	172.8	47.9	0	0	0	0	114	D38 I39	T36-D38 VanDerWaalsContact C-N 3.28Å; T36-I39 PolarHBondContact O-N 3.4Å
37	N	58.7	Low	71.4	Confident	112 Å²	112	47.3 Å²	47.3	60%	0.599	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-77.7	-15.4	179	-60.9	6.4	0	0	0	112.4	S35 I39	S35-N37 PolarHBondContact O-N 3.49Å; S35-N37 PolarHBondContact OG-N 3.29Å; N37-I39 VanDerWaalsContact C-N 3.26Å
38	D	69.2	Low	70.9	Confident	22 Å²	22	48.9 Å²	48.9	12%	0.118	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-85.1	0.6	176.5	-53.2	-67	0	0	0	112.3	F33 L34 S35 T36	F33-D38 HydrophobicContact CD2-CB 4.42Å; L34-D38 PolarHBondContact N-OD2 3.45Å; L34-D38 VanDerWaalsContact N-OD2 3.14Å; S35-D38 WeakPolarHBondContact CA-OD2 3.07Å; S35-D38 PolarHBondContact N-OD2 2.79Å; S35-D38 PolarHBondContact O-N 3.41Å; S35-D38 PolarHBondContact OG-OD2 3.22Å; T36-D38 VanDerWaalsContact C-N 3.28Å
39	I	70.6	Confident	70.4	Confident	20 Å²	20	54.6 Å²	54.6	10%	0.103	29%	0.287	C	S	.	.			trans	-89.9	116.4	173.8	-51.7	172.8	0	0	0	108.8	F33 T36 N37 Y41 V81 P83 A153	F33-I39 HydrophobicContact CD2-CG1 4.01Å; F33-I39 HydrophobicContact CE2-CD1 3.99Å; F33-I39 HydrophobicContact CE2-CG1 3.84Å; T36-I39 PolarHBondContact O-N 3.4Å; N37-I39 VanDerWaalsContact C-N 3.26Å; I39-Y41 HydrophobicContact CB-CE2 4.26Å; I39-Y41 HydrophobicContact CG2-CD2 4.2Å; I39-Y41 HydrophobicContact CG2-CE2 3.57Å; I39-V81 HydrophobicContact CD1-CB 4.27Å; I39-V81 HydrophobicContact CD1-CG1 4.07Å; I39-V81 HydrophobicContact CG1-CG1 4.47Å; I39-V81 HydrophobicContact CG2-CB 4.02Å; I39-V81 HydrophobicContact CG2-CG1 4.01Å; I39-V81 HydrophobicContact CG2-CG2 3.8Å; I39-P83 HydrophobicContact CD1-CG 3.8Å; I39-P83 HydrophobicContact CG1-CG 4.49Å; I39-A153 WeakPolarHBondContact CA-O 3.34Å
40	V	73	Confident	69.8	Low	35 Å²	35	53.3 Å²	53.3	21%	0.212	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.7	177	178.8	0	0	0	0	110.2	F28 L30 A153	F28-V40 HydrophobicContact CB-CG1 4.13Å; F28-V40 HydrophobicContact CD1-CG1 3.72Å; F28-V40 HydrophobicContact CE1-CG1 4.43Å; F28-V40 HydrophobicContact CG-CG1 4.07Å; L30-V40 HydrophobicContact CD2-CB 3.85Å; L30-V40 HydrophobicContact CD2-CG2 3.76Å; V40-A153 PolarHBondContact N-O 3.5Å; V40-A153 PolarHBondContact O-N 3.07Å
41	Y	76.7	Confident	69.3	Low	82 Å²	82	60.8 Å²	60.8	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.8	173	-66.7	-91.5	0	0	0	111.1	I39 F78 P79 V81 I151 G152	I39-Y41 HydrophobicContact CB-CE2 4.26Å; I39-Y41 HydrophobicContact CG2-CD2 4.2Å; I39-Y41 HydrophobicContact CG2-CE2 3.57Å; Y41-F78 AromaticContact CD1-CD1 3.89Å; Y41-F78 HydrophobicContact CD1-CD1 3.89Å; Y41-F78 HydrophobicContact CG-CD1 4.28Å; Y41-F78 HydrophobicContact CG-CE1 4.5Å; Y41-P79 HydrophobicContact CD1-CG 4.5Å; Y41-P79 HydrophobicContact CE1-CG 4.24Å; Y41-V81 HydrophobicContact CE1-CG2 3.84Å; Y41-I151 CarbonylContact C-O 3.58Å; Y41-I151 VanDerWaalsContact CA-O 3.25Å; Y41-I151 WeakPolarHBondContact CA-O 3.42Å; Y41-G152 VanDerWaalsContact CD1-CA 3.46Å
42	F	74.1	Confident	69.1	Low	5 Å²	5	57.1 Å²	57.1	2%	0.022	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	167.1	174	63.7	-85.3	0	0	0	110.9	L25 F28 I57 I151 A153 P169	L25-F42 HydrophobicContact CD1-CD2 4.25Å; L25-F42 HydrophobicContact CD1-CE2 4.45Å; F28-F42 HydrophobicContact CD2-CB 4.48Å; F28-F42 HydrophobicContact CD2-CD1 4.26Å; F28-F42 HydrophobicContact CD2-CG 4.34Å; F28-F42 HydrophobicContact CE1-CB 4Å; F28-F42 HydrophobicContact CE2-CB 3.62Å; F28-F42 HydrophobicContact CE2-CD1 4.1Å; F28-F42 HydrophobicContact CE2-CD2 4.13Å; F28-F42 AromaticContact CE2-CG 3.72Å; F28-F42 HydrophobicContact CE2-CG 3.72Å; F28-F42 HydrophobicContact CZ-CB 3.33Å; F28-F42 AromaticContact CZ-CG 3.99Å; F28-F42 HydrophobicContact CZ-CG 3.99Å; F42-I57 HydrophobicContact CZ-CD1 4.35Å; F42-I151 HydrophobicContact CD1-CB 4.25Å; F42-I151 HydrophobicContact CD1-CG2 4.45Å; F42-I151 HydrophobicContact CD2-CB 4.35Å; F42-I151 HydrophobicContact CE1-CB 3.86Å; F42-I151 HydrophobicContact CE1-CG2 3.69Å; F42-I151 HydrophobicContact CE2-CB 3.98Å; F42-I151 HydrophobicContact CE2-CD1 3.84Å; F42-I151 HydrophobicContact CE2-CG1 4.2Å; F42-I151 HydrophobicContact CE2-CG2 4.42Å; F42-I151 HydrophobicContact CG-CB 4.48Å; F42-I151 HydrophobicContact CZ-CB 3.73Å; F42-I151 HydrophobicContact CZ-CD1 3.87Å; F42-I151 HydrophobicContact CZ-CG1 4.27Å; F42-I151 HydrophobicContact CZ-CG2 3.68Å; F42-I151 PolarHBondContact N-O 3.22Å; F42-I151 PolarHBondContact O-N 2.98Å; F42-A153 HydrophobicContact CE1-CB 4.4Å; F42-P169 HydrophobicContact CE2-CB 4.32Å; F42-P169 HydrophobicContact CE2-CG 4.42Å
43	N	77.9	Confident	69.3	Low	26 Å²	26	56.7 Å²	56.7	14%	0.139	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	165.2	-178.2	61.8	-9.8	0	0	0	112.4	M148 W149 Y150	N43-M148 HydrophobicContact CB-CE 4.07Å; N43-M148 WeakPolarHBondContact ND2-CE 3.34Å; N43-W149 CarbonylContact C-O 3.56Å; N43-W149 WeakPolarHBondContact CA-O 3.31Å; N43-W149 WeakPolarHBondContact CB-O 3.4Å; N43-Y150 HydrophobicContact CB-CD1 3.76Å; N43-Y150 HydrophobicContact CB-CE1 4.06Å; N43-Y150 HydrophobicContact CB-CG 4.21Å
44	F	75.7	Confident	69.5	Low	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.5	172.7	59.6	-82.5	0	0	0	110.6	L25 I46 T53 L55 I141 W149 I151 V171	L25-F44 HydrophobicContact CD1-CB 4.25Å; L25-F44 HydrophobicContact CD2-CB 4.4Å; F44-I46 HydrophobicContact CD2-CG1 4.13Å; F44-I46 HydrophobicContact CE2-CD1 4.04Å; F44-I46 HydrophobicContact CE2-CG1 3.79Å; F44-T53 HydrophobicContact CE2-CG2 4.17Å; F44-L55 HydrophobicContact CE1-CD2 4.11Å; F44-L55 HydrophobicContact CZ-CD2 4.36Å; F44-I141 HydrophobicContact CZ-CD1 4.22Å; F44-W149 HydrophobicContact CD1-CB 4.21Å; F44-W149 HydrophobicContact CD2-CB 4.31Å; F44-W149 HydrophobicContact CE1-CB 3.74Å; F44-W149 HydrophobicContact CE2-CB 3.86Å; F44-W149 HydrophobicContact CE2-CG 4.26Å; F44-W149 HydrophobicContact CG-CB 4.48Å; F44-W149 HydrophobicContact CZ-CB 3.55Å; F44-W149 HydrophobicContact CZ-CG 4.09Å; F44-W149 PolarHBondContact N-O 3.46Å; F44-W149 PolarHBondContact O-N 2.73Å; F44-I151 HydrophobicContact CE1-CD1 3.97Å; F44-I151 HydrophobicContact CE1-CG1 4.3Å; F44-V171 HydrophobicContact CB-CG2 4.02Å; F44-V171 HydrophobicContact CD1-CG2 4.37Å; F44-V171 HydrophobicContact CD2-CG1 3.99Å; F44-V171 HydrophobicContact CD2-CG2 4.03Å; F44-V171 HydrophobicContact CE2-CG1 4.35Å; F44-V171 HydrophobicContact CG-CG2 3.89Å
45	P	75.6	Confident	70.1	Confident	51 Å²	51	50.7 Å²	50.7	33%	0.331	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	142.9	170.3	32.8	-32.1	0	0	0	111.1	M148 H173	P45-M148 HydrophobicContact CB-SD 3.77Å; P45-H173 PolarHBondContact O-CE1 2.91Å; P45-H173 VanDerWaalsContact O-CE1 3.31Å; P45-H173 PolarHBondContact O-NE2 3.35Å
46	I	75.4	Confident	70.9	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.051	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.8	159.4	-60.7	-173.1	0	0	0	108.4	F44 T50 T53 V146 G147 W149	F44-I46 HydrophobicContact CD2-CG1 4.13Å; F44-I46 HydrophobicContact CE2-CD1 4.04Å; F44-I46 HydrophobicContact CE2-CG1 3.79Å; I46-T50 HydrophobicContact CG2-CG2 4.4Å; I46-T53 HydrophobicContact CD1-CG2 4.09Å; I46-T53 HydrophobicContact CG1-CG2 4.19Å; I46-V146 WeakPolarHBondContact O-CG1 3.38Å; I46-G147 PolarHBondContact N-O 3Å; I46-G147 PolarHBondContact O-N 2.95Å; I46-G147 VanDerWaalsContact O-N 3.09Å; I46-W149 VanDerWaalsContact CD1-CD1 3.42Å; I46-W149 HydrophobicContact CD1-CD2 4.45Å; I46-W149 HydrophobicContact CD1-CG 4.12Å; I46-W149 VanDerWaalsContact CD1-NE1 3.33Å; I46-W149 HydrophobicContact CG1-CG 4.48Å
47	P	66.7	Low	71.9	Confident	42 Å²	42	45.6 Å²	45.6	27%	0.273	23%	0.229	S	C	.	.			trans	-64.7	156.3	178.1	-23.7	34.4	0	0	0	114.4	T50	P47-T50 PolarHBondContact O-N 3.08Å; P47-T50 PolarHBondContact O-OG1 2.83Å
48	Q	59.8	Low	72.9	Confident	126 Å²	126	42.8 Å²	42.8	59%	0.589	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	147.9	166.2	-71.5	173.1	-12.6	0	0	110.2	T50 V146	Q48-T50 PolarHBondContact O-N 3.21Å; Q48-V146 HydrophobicContact CB-CG1 4.43Å; Q48-V146 HydrophobicContact CG-CG1 3.71Å
49	H	62.4	Low	73.2	Confident	138 Å²	138	41.9 Å²	41.9	64%	0.639	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	11.7	-177.7	-45.7	-82	0	0	0	116.6
50	T	64	Low	73.5	Confident	12 Å²	12	43.7 Å²	43.7	7%	0.074	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.5	168.6	-47.6	0	0	0	0	110.8	I46 P47 Q48 V52 T53 H173	I46-T50 HydrophobicContact CG2-CG2 4.4Å; P47-T50 PolarHBondContact O-N 3.08Å; P47-T50 PolarHBondContact O-OG1 2.83Å; Q48-T50 PolarHBondContact O-N 3.21Å; T50-V52 WeakPolarHBondContact CG2-O 3.33Å; T50-T53 WeakPolarHBondContact CG2-OG1 3.37Å; T50-H173 HydrophobicContact CG2-CB 3.9Å
51	F	63.9	Low	73.6	Confident	156 Å²	156	42.8 Å²	42.8	68%	0.684	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	-38.6	177.2	-176.3	-111.1	0	0	0	112.5	D174	F51-D174 PolarHBondContact N-O 2.74Å; F51-D174 VanDerWaalsContact N-O 3.17Å
52	V	70.5	Confident	73.3	Confident	18 Å²	18	44.8 Å²	44.8	11%	0.109	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.7	174.3	174.1	0	0	0	0	109.6	T50 K54 N142 D174	T50-V52 WeakPolarHBondContact CG2-O 3.33Å; V52-K54 HydrophobicContact CG1-CG 3.96Å; V52-N142 WeakPolarHBondContact CG1-OD1 3.39Å; V52-N142 HydrophobicContact CG2-CB 4.5Å; V52-N142 WeakPolarHBondContact CG2-OD1 3.41Å; V52-D174 PolarHBondContact O-N 3.28Å
53	T	75.6	Confident	72.6	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129	168.9	-57.3	0	0	0	0	109.2	F44 I46 T50 I141 V171 H173	F44-T53 HydrophobicContact CE2-CG2 4.17Å; I46-T53 HydrophobicContact CD1-CG2 4.09Å; I46-T53 HydrophobicContact CG1-CG2 4.19Å; T50-T53 WeakPolarHBondContact CG2-OG1 3.37Å; T53-I141 PolarHBondContact N-O 2.73Å; T53-I141 PolarHBondContact O-N 3.15Å; T53-V171 HydrophobicContact CG2-CG1 3.66Å; T53-H173 PolarHBondContact OG1-CD2 2.9Å
54	K	78.5	Confident	72.1	Confident	62 Å²	62	47.5 Å²	47.5	27%	0.27	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.2	176.8	-55.4	-166.6	169.1	61.8	0	109.5	V52 N140 V171 R172 D174	V52-K54 HydrophobicContact CG1-CG 3.96Å; K54-N140 WeakPolarHBondContact CD-OD1 3.42Å; K54-N140 VanDerWaalsContact CG-OD1 3.28Å; K54-N140 WeakPolarHBondContact CG-OD1 3.32Å; K54-V171 CarbonylContact O-C 3.49Å; K54-V171 WeakPolarHBondContact O-CA 3.12Å; K54-R172 HydrophobicContact CB-CB 4.45Å; K54-R172 PolarHBondContact N-O 3.34Å; K54-R172 PolarHBondContact O-N 3.05Å; K54-D174 IonicContact NZ-OD2 3.65Å; K54-D174 PolarHBondContact NZ-OD2 2.88Å
55	L	81.1	Confident	71.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	108.5	173.4	167.1	64.1	0	0	0	108.5	F44 I57 I139 I151 P169 S170 V171	F44-L55 HydrophobicContact CE1-CD2 4.11Å; F44-L55 HydrophobicContact CZ-CD2 4.36Å; L55-I57 HydrophobicContact CD1-CD1 4.42Å; L55-I57 HydrophobicContact CD1-CG1 3.95Å; L55-I57 HydrophobicContact CD2-CD1 4.23Å; L55-I57 HydrophobicContact CD2-CG1 4.5Å; L55-I57 HydrophobicContact CG-CD1 4.26Å; L55-I57 HydrophobicContact CG-CG1 3.98Å; L55-I139 HydrophobicContact CB-CB 4.37Å; L55-I139 HydrophobicContact CD2-CD1 4.34Å; L55-I139 PolarHBondContact N-O 2.87Å; L55-I139 PolarHBondContact O-N 3.47Å; L55-I151 HydrophobicContact CD2-CD1 3.39Å; L55-P169 HydrophobicContact CD1-CB 4.32Å; L55-S170 WeakPolarHBondContact CA-O 3.49Å; L55-V171 HydrophobicContact CD1-CG2 3.94Å
56	S	80.4	Confident	71.2	Confident	34 Å²	34	50.4 Å²	50.4	24%	0.238	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.5	176.5	-69.3	0	0	0	0	109.6	D138 S170	S56-D138 VanDerWaalsContact CB-OD1 3.24Å; S56-D138 WeakPolarHBondContact CB-OD1 3.25Å; S56-D138 PolarHBondContact OG-OD1 2.63Å; S56-S170 PolarHBondContact N-O 3.46Å; S56-S170 PolarHBondContact O-N 2.9Å; S56-S170 PolarHBondContact O-OG 3.39Å; S56-S170 VanDerWaalsContact O-OG 3.05Å
57	I	79.7	Confident	71	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	99.6	178.6	-46.2	179.7	0	0	0	108.6	F42 L55 I59 L71 I137 L167 P169	F42-I57 HydrophobicContact CZ-CD1 4.35Å; L55-I57 HydrophobicContact CD1-CD1 4.42Å; L55-I57 HydrophobicContact CD1-CG1 3.95Å; L55-I57 HydrophobicContact CD2-CD1 4.23Å; L55-I57 HydrophobicContact CD2-CG1 4.5Å; L55-I57 HydrophobicContact CG-CD1 4.26Å; L55-I57 HydrophobicContact CG-CG1 3.98Å; I57-I59 HydrophobicContact CG2-CG1 4.1Å; I57-L71 HydrophobicContact CD1-CD1 3.87Å; I57-I137 HydrophobicContact CB-CB 4.42Å; I57-I137 PolarHBondContact N-O 3.36Å; I57-I137 PolarHBondContact O-N 3.11Å; I57-L167 HydrophobicContact CG2-CB 4.17Å; I57-L167 HydrophobicContact CG2-CD2 4.21Å; I57-L167 HydrophobicContact CG2-CG 3.88Å; I57-P169 HydrophobicContact CG1-CB 4.19Å; I57-P169 HydrophobicContact CG2-CB 4.39Å
58	S	79.5	Confident	71.4	Confident	53 Å²	53	53.9 Å²	53.9	37%	0.371	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.9	168	-56.3	0	0	0	0	109.7	N136 L168	S58-N136 WeakPolarHBondContact CA-OD1 3.49Å; S58-N136 PolarHBondContact N-OD1 2.93Å; S58-N136 PolarHBondContact OG-OD1 3.29Å; S58-L168 PolarHBondContact N-O 3.08Å; S58-L168 PolarHBondContact O-N 3.16Å
59	I	76.6	Confident	72.4	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.015	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.5	-174.6	-56.4	167.4	0	0	0	109.1	I57 F61 I69 A134 A135 I137 A165 W166 L167	I57-I59 HydrophobicContact CG2-CG1 4.1Å; I59-F61 HydrophobicContact CB-CZ 4.27Å; I59-F61 HydrophobicContact CG2-CD1 4Å; I59-F61 HydrophobicContact CG2-CE1 3.36Å; I59-F61 HydrophobicContact CG2-CE2 4.31Å; I59-F61 HydrophobicContact CG2-CZ 3.53Å; I59-I69 HydrophobicContact CD1-CD1 3.92Å; I59-I69 HydrophobicContact CG2-CD1 4.36Å; I59-A134 CarbonylContact O-C 3.6Å; I59-A134 WeakPolarHBondContact O-CA 3.31Å; I59-A134 VanDerWaalsContact O-CB 3.32Å; I59-A134 WeakPolarHBondContact O-CB 3.46Å; I59-A135 PolarHBondContact N-O 2.94Å; I59-A135 PolarHBondContact O-N 3.38Å; I59-I137 HydrophobicContact CD1-CD1 3.52Å; I59-I137 HydrophobicContact CD1-CG1 4.01Å; I59-A165 HydrophobicContact CG2-CB 4.13Å; I59-W166 CarbonylContact C-O 3.58Å; I59-W166 VanDerWaalsContact CA-O 3.27Å; I59-W166 WeakPolarHBondContact CA-O 3.43Å; I59-L167 HydrophobicContact CD1-CD1 4.48Å; I59-L167 HydrophobicContact CG1-CD1 4.08Å; I59-L167 HydrophobicContact CG1-CG 4.1Å; I59-L167 HydrophobicContact CG2-CD1 4.11Å
60	T	77.2	Confident	73.4	Confident	59 Å²	59	41.5 Å²	41.5	36%	0.362	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	129.2	171.8	57.6	0	0	0	0	111	A134 W166	T60-A134 HydrophobicContact CG2-CB 4.34Å; T60-W166 PolarHBondContact N-O 3.34Å; T60-W166 PolarHBondContact O-N 2.93Å
61	F	73.7	Confident	74.2	Confident	16 Å²	16	41 Å²	41	7%	0.07	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.3	-176.2	-53.9	-66.4	0	0	0	111	I59 P66 I69 I105 N133 A135 A165	I59-F61 HydrophobicContact CB-CZ 4.27Å; I59-F61 HydrophobicContact CG2-CD1 4Å; I59-F61 HydrophobicContact CG2-CE1 3.36Å; I59-F61 HydrophobicContact CG2-CE2 4.31Å; I59-F61 HydrophobicContact CG2-CZ 3.53Å; F61-P66 HydrophobicContact CD1-CG 3.49Å; F61-P66 VanDerWaalsContact CD1-CG 3.49Å; F61-P66 HydrophobicContact CE1-CG 3.36Å; F61-P66 HydrophobicContact CG-CG 4.27Å; F61-P66 HydrophobicContact CZ-CG 4.06Å; F61-I69 HydrophobicContact CE1-CD1 4.09Å; F61-I105 HydrophobicContact CE1-CD1 4.19Å; F61-I105 HydrophobicContact CE2-CG2 3.72Å; F61-I105 HydrophobicContact CZ-CD1 3.99Å; F61-I105 HydrophobicContact CZ-CG2 3.63Å; F61-N133 WeakPolarHBondContact CD2-O 3.49Å; F61-N133 PolarHBondContact N-O 3.23Å; F61-A135 HydrophobicContact CE2-CB 4.01Å; F61-A135 HydrophobicContact CZ-CB 4.16Å; F61-A165 HydrophobicContact CD1-CB 3.65Å; F61-A165 HydrophobicContact CE1-CB 3.85Å
62	H	70.3	Confident	75.1	Confident	124 Å²	124	34 Å²	34	57%	0.574	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.1	171.4	-95.8	-89.6	0	0	0	110.5	C64 I164	H62-C64 VanDerWaalsContact C-N 3.35Å; H62-C64 PolarHBondContact O-N 3.43Å; H62-I164 PolarHBondContact N-O 3.47Å; H62-I164 PolarHBondContact O-N 3.31Å
63	G	61.1	Low	75.4	Confident	75 Å²	75	33.1 Å²	33.1	77%	0.773	20%	0.196	S	C	*	.	S	Bend	trans	81.6	-3.9	170.5	0	0	0	0	0	116.9
64	C	67.2	Low	75.5	Confident	13 Å²	13	34 Å²	34	9%	0.088	20%	0.198	C	C	.	.			trans	-155.4	159.3	-171.4	56.5	0	0	0	0	113.5	H62 Q160 C163	H62-C64 VanDerWaalsContact C-N 3.35Å; H62-C64 PolarHBondContact O-N 3.43Å; C64-Q160 VanDerWaalsContact CB-OE1 3.28Å; C64-C163 HydrophobicContact CB-CB 3.49Å; C64-C163 VanDerWaalsContact CB-CB 3.49Å; C64-C163 WeakPolarHBondContact CB-SG 3.1Å; C64-C163 WeakPolarHBondContact SG-CA 3.49Å; C64-C163 WeakPolarHBondContact SG-CB 3.39Å; C64-C163 CovalentContact SG-SG 2.02Å; C64-C163 PolarHBondContact SG-SG 2.87Å
65	N	64.9	Low	75.2	Confident	111 Å²	111	32.3 Å²	32.3	59%	0.594	20%	0.195	S	C	*	.			trans	-111.4	93.9	163.6	-79.1	-4.4	0	0	0	108.9
66	P	66.9	Low	74.4	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	22%	0.224	C	C	.	.			trans	-63.9	158	177.3	26.3	-34.2	0	0	0	112.2	F61 I105 M155 T157	F61-P66 HydrophobicContact CD1-CG 3.49Å; F61-P66 VanDerWaalsContact CD1-CG 3.49Å; F61-P66 HydrophobicContact CE1-CG 3.36Å; F61-P66 HydrophobicContact CG-CG 4.27Å; F61-P66 HydrophobicContact CZ-CG 4.06Å; P66-I105 HydrophobicContact CB-CD1 4.01Å; P66-I105 HydrophobicContact CG-CD1 3.67Å; P66-M155 HydrophobicContact CB-CG 3.68Å; P66-M155 HydrophobicContact CB-SD 3.49Å; P66-M155 WeakPolarHBondContact CB-SD 3.36Å; P66-M155 HydrophobicContact CG-CG 4.39Å; P66-M155 HydrophobicContact CG-SD 3.66Å; P66-T157 HydrophobicContact CB-CG2 4.02Å
67	E	70.2	Confident	73.6	Confident	64 Å²	64	35.2 Å²	35.2	30%	0.299	22%	0.224	S	C	.	.	S	Bend	trans	-90.6	-53.5	-173.2	-52.3	-165	124.4	0	0	110.8	I105 K106 T156 S158	E67-I105 PolarHBondContact O-N 3.38Å; E67-K106 IonicContact OE1-NZ 2.67Å; E67-K106 PolarHBondContact OE1-NZ 3.13Å; E67-T156 PolarHBondContact N-O 3.06Å; E67-S158 PolarHBondContact OE1-OG 3Å; E67-S158 PolarHBondContact OE2-OG 3.44Å
68	N	75	Confident	72.8	Confident	61 Å²	61	38.9 Å²	38.9	33%	0.326	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.5	176.9	-59.4	-41.7	0	0	0	110.3	I103 P104 T156	N68-I103 WeakPolarHBondContact CA-O 3.43Å; N68-P104 WeakPolarHBondContact OD1-CA 3.4Å; N68-T156 PolarHBondContact O-N 3.29Å; N68-T156 VanDerWaalsContact O-N 3.14Å; N68-T156 PolarHBondContact O-OG1 2.88Å
69	I	81.5	Confident	72.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.9	158.2	-88.5	165.7	0	0	0	108.1	L30 I59 F61 L71 I103 I105 M155	L30-I69 HydrophobicContact CD1-CD1 4.44Å; L30-I69 HydrophobicContact CD1-CG1 4.45Å; I59-I69 HydrophobicContact CD1-CD1 3.92Å; I59-I69 HydrophobicContact CG2-CD1 4.36Å; F61-I69 HydrophobicContact CE1-CD1 4.09Å; I69-L71 HydrophobicContact CG2-CD2 3.93Å; I69-L71 HydrophobicContact CG2-CG 4.05Å; I69-I103 PolarHBondContact N-O 3.13Å; I69-I103 VanDerWaalsContact N-O 3.07Å; I69-I103 PolarHBondContact O-N 2.99Å; I69-I105 HydrophobicContact CB-CD1 4.01Å; I69-I105 HydrophobicContact CD1-CD1 3.77Å; I69-I105 HydrophobicContact CG1-CD1 3.73Å; I69-M155 HydrophobicContact CD1-SD 4.45Å; I69-M155 HydrophobicContact CG1-CB 3.98Å; I69-M155 HydrophobicContact CG1-CG 3.96Å; I69-M155 HydrophobicContact CG1-SD 4.45Å
70	S	83.3	Confident	72	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.028	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115	-177.2	-70.8	0	0	0	0	109.8	L101 N102 A153 Y154	S70-L101 CarbonylContact C-O 3.59Å; S70-L101 VanDerWaalsContact CA-O 3.29Å; S70-L101 WeakPolarHBondContact CA-O 3.33Å; S70-N102 WeakPolarHBondContact CB-OD1 3.41Å; S70-N102 PolarHBondContact OG-OD1 3.24Å; S70-A153 WeakPolarHBondContact O-CA 3.44Å; S70-Y154 PolarHBondContact N-O 3.34Å; S70-Y154 PolarHBondContact O-N 3.06Å; S70-Y154 PolarHBondContact OG-OH 3.28Å
71	L	82.1	Confident	71.7	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.7	178.1	-57.1	178.5	0	0	0	109.1	I57 I69 L73 L101 I103 I139 I151 A153	I57-L71 HydrophobicContact CD1-CD1 3.87Å; I69-L71 HydrophobicContact CG2-CD2 3.93Å; I69-L71 HydrophobicContact CG2-CG 4.05Å; L71-L73 HydrophobicContact CB-CD1 4.24Å; L71-L101 HydrophobicContact CB-CB 4.45Å; L71-L101 PolarHBondContact N-O 2.94Å; L71-L101 PolarHBondContact O-N 3Å; L71-I103 HydrophobicContact CD1-CD1 4.2Å; L71-I139 HydrophobicContact CD1-CD1 4.21Å; L71-I151 HydrophobicContact CB-CG2 4.5Å; L71-I151 HydrophobicContact CD2-CG2 4.47Å; L71-A153 HydrophobicContact CD2-CB 3.53Å
72	T	81.2	Confident	71.5	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.055	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.2	170.8	-42.7	0	0	0	0	108.8	P79 H99 I151 G152	T72-P79 HydrophobicContact CG2-CB 3.6Å; T72-P79 HydrophobicContact CG2-CG 4.48Å; T72-P79 WeakPolarHBondContact O-CG 3.42Å; T72-H99 CarbonylContact C-O 3.57Å; T72-H99 WeakPolarHBondContact CA-O 3.41Å; T72-I151 CarbonylContact O-C 3.59Å; T72-I151 VanDerWaalsContact O-CA 3.3Å; T72-I151 WeakPolarHBondContact O-CA 3.31Å; T72-G152 PolarHBondContact N-O 3.32Å; T72-G152 PolarHBondContact O-N 3.39Å
73	L	78.4	Confident	71.3	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	147.1	-177.9	-60.7	91	0	0	0	111	L71 S98 H99 L101 I139 W149 I151	L71-L73 HydrophobicContact CB-CD1 4.24Å; L73-S98 WeakPolarHBondContact O-CA 3.19Å; L73-H99 PolarHBondContact N-O 3.05Å; L73-H99 PolarHBondContact O-N 2.74Å; L73-L101 HydrophobicContact CD1-CD1 3.7Å; L73-L101 HydrophobicContact CD1-CG 4.07Å; L73-I139 HydrophobicContact CD2-CD1 4.44Å; L73-W149 HydrophobicContact CB-CZ3 4.37Å; L73-I151 HydrophobicContact CD2-CD1 3.58Å; L73-I151 HydrophobicContact CD2-CG1 4.06Å; L73-I151 HydrophobicContact CG-CD1 3.86Å; L73-I151 HydrophobicContact CG-CG1 3.9Å
74	R	76.2	Confident	71.5	Confident	22 Å²	22	39.4 Å²	39.4	8%	0.083	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	140.5	174.1	178.4	166.1	-166.4	-135.5	-4.7	112.4	S77 F78 P79 N97 Y150	R74-S77 WeakPolarHBondContact CB-O 3.49Å; R74-S77 WeakPolarHBondContact CD-O 3.33Å; R74-S77 WeakPolarHBondContact CG-O 3.36Å; R74-S77 PolarHBondContact NH1-OG 2.87Å; R74-S77 PolarHBondContact NH2-OG 3.4Å; R74-F78 WeakPolarHBondContact CD-O 3.28Å; R74-F78 PolarHBondContact NH1-O 3.3Å; R74-F78 VanDerWaalsContact NH1-O 3.13Å; R74-P79 HydrophobicContact CB-CB 4.04Å; R74-N97 VanDerWaalsContact CG-O 3.24Å; R74-N97 WeakPolarHBondContact CG-O 3.45Å; R74-Y150 PolarHBondContact N-O 3.06Å; R74-Y150 PolarHBondContact O-N 3.1Å
75	S	72	Confident	71.3	Confident	28 Å²	28	41.8 Å²	41.8	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	149.2	170.9	58.4	0	0	0	0	112.3	S77	S75-S77 PolarHBondContact O-N 3.38Å
76	G	65.3	Low	71.1	Confident	60 Å²	60	41.4 Å²	41.4	62%	0.619	25%	0.248	S	C	*	.	S	Bend	trans	69.5	-16.4	173.4	0	0	0	0	0	117.2	M148	G76-M148 PolarHBondContact N-O 3.43Å
77	S	63.2	Low	70.2	Confident	35 Å²	35	46.2 Å²	46.2	25%	0.245	28%	0.282	C	S	.	.	S	Bend	trans	-167.4	164.3	179.9	50.2	0	0	0	0	112.8	R74 S75 Y150	R74-S77 WeakPolarHBondContact CB-O 3.49Å; R74-S77 WeakPolarHBondContact CD-O 3.33Å; R74-S77 WeakPolarHBondContact CG-O 3.36Å; R74-S77 PolarHBondContact NH1-OG 2.87Å; R74-S77 PolarHBondContact NH2-OG 3.4Å; S75-S77 PolarHBondContact O-N 3.38Å; S77-Y150 VanDerWaalsContact C-CD2 3.44Å
78	F	62.9	Low	69.5	Low	76 Å²	76	45.2 Å²	45.2	33%	0.333	28%	0.279	S	S	.	.			trans	-57.7	139.3	-177.8	-68.4	-85.6	0	0	0	113.9	Y41 R74 Y150 R705	Y41-F78 AromaticContact CD1-CD1 3.89Å; Y41-F78 HydrophobicContact CD1-CD1 3.89Å; Y41-F78 HydrophobicContact CG-CD1 4.28Å; Y41-F78 HydrophobicContact CG-CE1 4.5Å; R74-F78 WeakPolarHBondContact CD-O 3.28Å; R74-F78 PolarHBondContact NH1-O 3.3Å; R74-F78 VanDerWaalsContact NH1-O 3.13Å; F78-Y150 AromaticContact CD1-CD1 3.62Å; F78-Y150 HydrophobicContact CD1-CD1 3.62Å; F78-Y150 HydrophobicContact CD1-CE1 4.33Å; F78-Y150 HydrophobicContact CD1-CG 4.32Å; F78-Y150 HydrophobicContact CD2-CD1 4.07Å; F78-Y150 HydrophobicContact CD2-CE1 4.07Å; F78-Y150 AromaticContact CE1-CD1 3.54Å; F78-Y150 HydrophobicContact CE1-CD1 3.54Å; F78-Y150 AromaticContact CE1-CE1 4Å; F78-Y150 HydrophobicContact CE1-CE1 4Å; F78-Y150 AromaticContact CE2-CD1 3.99Å; F78-Y150 HydrophobicContact CE2-CD1 3.99Å; F78-Y150 AromaticContact CE2-CE1 3.71Å; F78-Y150 HydrophobicContact CE2-CE1 3.71Å; F78-Y150 AromaticContact CG-CD1 3.9Å; F78-Y150 HydrophobicContact CG-CD1 3.9Å; F78-Y150 HydrophobicContact CG-CE1 4.38Å; F78-Y150 HydrophobicContact CG-CG 4.44Å; F78-Y150 AromaticContact CZ-CD1 3.73Å; F78-Y150 HydrophobicContact CZ-CD1 3.73Å; F78-Y150 AromaticContact CZ-CE1 3.66Å; F78-Y150 HydrophobicContact CZ-CE1 3.66Å; F78-R705 PolarHBondContact O-NH1 3.4Å
79	P	70.2	Confident	68.1	Low	3 Å²	3	46.7 Å²	46.7	2%	0.019	29%	0.292	C	S	.	.			trans	-71.2	155.8	165.9	30.3	-32.1	0	0	0	110.5	Y41 T72 R74	Y41-P79 HydrophobicContact CD1-CG 4.5Å; Y41-P79 HydrophobicContact CE1-CG 4.24Å; T72-P79 HydrophobicContact CG2-CB 3.6Å; T72-P79 HydrophobicContact CG2-CG 4.48Å; T72-P79 WeakPolarHBondContact O-CG 3.42Å; R74-P79 HydrophobicContact CB-CB 4.04Å
80	V	69.5	Low	66	Low	66 Å²	66	55.1 Å²	55.1	40%	0.4	34%	0.338	S	S	.	.			trans	-96.1	111.4	162.1	163.9	0	0	0	0	106.8	R82 R705	V80-R82 HydrophobicContact CG1-CG 4.35Å; V80-R705 HydrophobicContact CG2-CG 4.07Å; V80-R705 VanDerWaalsContact N-NH1 3.17Å
81	V	69.6	Low	63.8	Low	11 Å²	11	58.8 Å²	58.8	7%	0.067	38%	0.376	C	S	.	.			trans	-70.7	131.4	169.7	178.9	0	0	0	0	108.1	I39 Y41 P83 Y154	I39-V81 HydrophobicContact CD1-CB 4.27Å; I39-V81 HydrophobicContact CD1-CG1 4.07Å; I39-V81 HydrophobicContact CG1-CG1 4.47Å; I39-V81 HydrophobicContact CG2-CB 4.02Å; I39-V81 HydrophobicContact CG2-CG1 4.01Å; I39-V81 HydrophobicContact CG2-CG2 3.8Å; Y41-V81 HydrophobicContact CE1-CG2 3.84Å; V81-P83 HydrophobicContact CG1-CG 4.28Å; V81-P83 WeakPolarHBondContact O-CD 3.19Å; V81-Y154 HydrophobicContact CG1-CD1 3.23Å; V81-Y154 HydrophobicContact CG1-CE1 3.41Å; V81-Y154 VanDerWaalsContact CG1-CE1 3.41Å; V81-Y154 HydrophobicContact CG1-CG 4.3Å
82	R	70.7	Confident	61.9	Low	104 Å²	104	62.8 Å²	62.8	39%	0.392	40%	0.396	S	S	.	.			trans	-113.6	85.9	174	-75.9	-170.7	-75.7	-167.8	-8.9	110.5	V80 L84 G85 E94 Y154	V80-R82 HydrophobicContact CG1-CG 4.35Å; R82-L84 PolarHBondContact O-N 3.33Å; R82-G85 PolarHBondContact O-N 3.4Å; R82-E94 IonicContact CZ-OE1 2.64Å; R82-E94 VanDerWaalsContact CZ-OE1 3.3Å; R82-E94 IonicContact CZ-OE2 3.29Å; R82-E94 VanDerWaalsContact CZ-OE2 3.3Å; R82-E94 VanDerWaalsContact NH1-CD 3.34Å; R82-E94 IonicContact NH1-OE1 2.64Å; R82-E94 PolarHBondContact NH1-OE1 3.04Å; R82-E94 IonicContact NH1-OE2 3.6Å; R82-E94 PolarHBondContact NH1-OE2 3.43Å; R82-E94 IonicContact NH2-OE1 2.69Å; R82-E94 IonicContact NH2-OE2 3.3Å; R82-E94 PolarHBondContact NH2-OE2 3.43Å; R82-Y154 PolarHBondContact O-OH 2.97Å
83	P	65.8	Low	60.3	Low	19 Å²	19	68.6 Å²	68.6	12%	0.123	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-57.2	137.5	172.3	-20.1	32.8	0	0	0	110.5	F33 I39 V81 G85 V86 Y154	F33-P83 HydrophobicContact CD1-CB 3.85Å; F33-P83 HydrophobicContact CD2-CB 4.16Å; F33-P83 HydrophobicContact CD2-CG 4.07Å; F33-P83 HydrophobicContact CE1-CB 3.39Å; F33-P83 HydrophobicContact CE1-CG 4.03Å; F33-P83 HydrophobicContact CE2-CB 3.72Å; F33-P83 HydrophobicContact CE2-CG 3.4Å; F33-P83 VanDerWaalsContact CE2-CG 3.4Å; F33-P83 HydrophobicContact CG-CB 4.23Å; F33-P83 HydrophobicContact CZ-CB 3.33Å; F33-P83 HydrophobicContact CZ-CG 3.4Å; F33-P83 VanDerWaalsContact CZ-CG 3.4Å; I39-P83 HydrophobicContact CD1-CG 3.8Å; I39-P83 HydrophobicContact CG1-CG 4.49Å; V81-P83 HydrophobicContact CG1-CG 4.28Å; V81-P83 WeakPolarHBondContact O-CD 3.19Å; P83-G85 PolarHBondContact O-N 3.3Å; P83-V86 PolarHBondContact O-N 3.2Å; P83-Y154 HydrophobicContact CB-CE2 4.22Å
84	L	65.6	Low	58.9	Low	139 Å²	139	73.2 Å²	73.2	73%	0.728	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	55.7	17.4	175.2	-53.2	174.2	0	0	0	115.6	R82 V86	R82-L84 PolarHBondContact O-N 3.33Å; L84-V86 VanDerWaalsContact C-N 3.34Å; L84-V86 PolarHBondContact O-N 2.64Å
85	G	62.8	Low	57.8	Low	63 Å²	63	73.5 Å²	73.5	65%	0.649	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	70.9	20.8	175.3	0	0	0	0	0	115.6	R82 P83 S87	R82-G85 PolarHBondContact O-N 3.4Å; P83-G85 PolarHBondContact O-N 3.3Å; G85-S87 PolarHBondContact O-N 3.29Å
86	V	60.9	Low	56.9	Low	102 Å²	102	79.3 Å²	79.3	62%	0.618	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-56.1	132.9	179.6	179.5	0	0	0	0	111.2	P83 L84	P83-V86 PolarHBondContact O-N 3.2Å; L84-V86 VanDerWaalsContact C-N 3.34Å; L84-V86 PolarHBondContact O-N 2.64Å
87	S	48.5	Very low	56.7	Low	103 Å²	103	78.8 Å²	78.8	72%	0.72	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-68.5	141.5	-179.1	48.3	0	0	0	0	112.4	G85	G85-S87 PolarHBondContact O-N 3.29Å
88	V	54.6	Low	56.7	Low	42 Å²	42	78.6 Å²	78.6	26%	0.255	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-77.8	136.1	179.8	-174.4	0	0	0	0	109.7	N90 I92 E94	V88-N90 PolarHBondContact O-N 3.33Å; V88-I92 HydrophobicContact CG1-CB 3.68Å; V88-I92 HydrophobicContact CG1-CD1 3.96Å; V88-I92 HydrophobicContact CG1-CG1 4.34Å; V88-I92 HydrophobicContact CG1-CG2 3.93Å; V88-E94 HydrophobicContact CG2-CG 4.46Å; V88-E94 VanDerWaalsContact CG2-OE1 3.24Å; V88-E94 WeakPolarHBondContact CG2-OE1 3.48Å
89	P	44.8	Very low	57.1	Low	92 Å²	92	76 Å²	76	60%	0.597	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-55.4	136.5	176.5	-28.5	35.6	0	0	0	113.9	G91 I92	P89-G91 PolarHBondContact O-N 3.33Å; P89-G91 VanDerWaalsContact O-N 3.13Å; P89-I92 HydrophobicContact CB-CD1 4.49Å; P89-I92 PolarHBondContact O-N 3.21Å
90	N	37.5	Very low	57.1	Low	178 Å²	178	79.8 Å²	79.8	95%	0.952	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	115.9	-179.4	-68.9	-13.8	0	0	0	111.8	V88	V88-N90 PolarHBondContact O-N 3.33Å
91	G	38.4	Very low	57.3	Low	81 Å²	81	77.1 Å²	77.1	84%	0.835	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	123	-14.1	177.8	0	0	0	0	0	114.9	P89	P89-G91 PolarHBondContact O-N 3.33Å; P89-G91 VanDerWaalsContact O-N 3.13Å
92	I	41.9	Very low	57.6	Low	84 Å²	84	81.1 Å²	81.1	43%	0.431	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-88.4	123.2	173.8	-58.7	172.8	0	0	0	109	V88 P89 P704	V88-I92 HydrophobicContact CG1-CB 3.68Å; V88-I92 HydrophobicContact CG1-CD1 3.96Å; V88-I92 HydrophobicContact CG1-CG1 4.34Å; V88-I92 HydrophobicContact CG1-CG2 3.93Å; P89-I92 HydrophobicContact CB-CD1 4.49Å; P89-I92 PolarHBondContact O-N 3.21Å; I92-P704 HydrophobicContact CG2-CB 4.1Å
93	L	46.8	Very low	57.8	Low	132 Å²	132	76.1 Å²	76.1	69%	0.691	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-77.8	127	172.4	-67	164.5	0	0	0	110.2	P95 P704	L93-P95 WeakPolarHBondContact O-CD 3.41Å; L93-P704 HydrophobicContact CB-CG 4.17Å
94	E	49.7	Very low	58.1	Low	97 Å²	97	76.9 Å²	76.9	45%	0.453	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-73.6	122.8	166.4	-69	-172.1	-162	0	0	109.4	R82 V88	R82-E94 IonicContact CZ-OE1 2.64Å; R82-E94 VanDerWaalsContact CZ-OE1 3.3Å; R82-E94 IonicContact CZ-OE2 3.29Å; R82-E94 VanDerWaalsContact CZ-OE2 3.3Å; R82-E94 VanDerWaalsContact NH1-CD 3.34Å; R82-E94 IonicContact NH1-OE1 2.64Å; R82-E94 PolarHBondContact NH1-OE1 3.04Å; R82-E94 IonicContact NH1-OE2 3.6Å; R82-E94 PolarHBondContact NH1-OE2 3.43Å; R82-E94 IonicContact NH2-OE1 2.69Å; R82-E94 IonicContact NH2-OE2 3.3Å; R82-E94 PolarHBondContact NH2-OE2 3.43Å; V88-E94 HydrophobicContact CG2-CG 4.46Å; V88-E94 VanDerWaalsContact CG2-OE1 3.24Å; V88-E94 WeakPolarHBondContact CG2-OE1 3.48Å
95	P	53.2	Low	58.2	Low	29 Å²	29	70.6 Å²	70.6	19%	0.188	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-71.8	136.8	171.6	30.9	-33.4	0	0	0	109.9	L93 N97 S98 R705	L93-P95 WeakPolarHBondContact O-CD 3.41Å; P95-N97 VanDerWaalsContact C-N 3.27Å; P95-N97 PolarHBondContact O-N 2.85Å; P95-S98 PolarHBondContact O-OG 3.47Å; P95-R705 VanDerWaalsContact CD-CZ 3.44Å
96	I	53.5	Low	58.2	Low	149 Å²	149	73.6 Å²	73.6	76%	0.764	43%	0.43	S	S	*	.	S	Bend	trans	-61.4	-36.3	-170.8	-62	160	0	0	0	111.6	S98	I96-S98 VanDerWaalsContact C-N 3.32Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.08Å
97	N	59.8	Low	58.3	Low	49 Å²	49	75.6 Å²	75.6	26%	0.262	43%	0.433	S	S	.	.			trans	-85.3	44.1	-170.8	-33.1	74.3	0	0	0	113.7	R74 P95 D117	R74-N97 VanDerWaalsContact CG-O 3.24Å; R74-N97 WeakPolarHBondContact CG-O 3.45Å; P95-N97 VanDerWaalsContact C-N 3.27Å; P95-N97 PolarHBondContact O-N 2.85Å; N97-D117 PolarHBondContact ND2-OD1 3.46Å; N97-D117 PolarHBondContact ND2-OD2 3.23Å
98	S	63.9	Low	58.9	Low	32 Å²	32	75.5 Å²	75.5	22%	0.224	43%	0.432	C	S	.	.			trans	-130.3	115.6	172.3	53.2	0	0	0	0	113.3	L73 P95 I96	L73-S98 WeakPolarHBondContact O-CA 3.19Å; P95-S98 PolarHBondContact O-OG 3.47Å; I96-S98 VanDerWaalsContact C-N 3.32Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.08Å
99	H	71	Confident	59.4	Low	21 Å²	21	76 Å²	76	10%	0.097	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.9	-171.8	-39.6	-69.8	0	0	0	110	T72 L73 F113 S115 F124	T72-H99 CarbonylContact C-O 3.57Å; T72-H99 WeakPolarHBondContact CA-O 3.41Å; L73-H99 PolarHBondContact N-O 3.05Å; L73-H99 PolarHBondContact O-N 2.74Å; H99-F113 HydrophobicContact CB-CE2 4.29Å; H99-F113 HydrophobicContact CB-CZ 4.46Å; H99-S115 PolarHBondContact CE1-OG 3.36Å; H99-S115 VanDerWaalsContact CE1-OG 3.29Å; H99-F124 AromaticContact CD2-CZ 3.68Å; H99-F124 AromaticContact NE2-CZ 3.91Å
100	S	71.4	Confident	60.3	Low	83 Å²	83	76.7 Å²	76.7	58%	0.58	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.2	177.2	56	0	0	0	0	111.5
101	L	73.8	Confident	61.7	Low	9 Å²	9	71.3 Å²	71.3	5%	0.047	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	116.2	175	-57.3	178.3	0	0	0	109.9	S70 L71 L73 I103 L111 F113 V126 I139	S70-L101 CarbonylContact C-O 3.59Å; S70-L101 VanDerWaalsContact CA-O 3.29Å; S70-L101 WeakPolarHBondContact CA-O 3.33Å; L71-L101 HydrophobicContact CB-CB 4.45Å; L71-L101 PolarHBondContact N-O 2.94Å; L71-L101 PolarHBondContact O-N 3Å; L73-L101 HydrophobicContact CD1-CD1 3.7Å; L73-L101 HydrophobicContact CD1-CG 4.07Å; L101-I103 HydrophobicContact CB-CD1 4.21Å; L101-I103 HydrophobicContact CB-CG1 4.15Å; L101-L111 HydrophobicContact CD2-CD2 4.3Å; L101-F113 HydrophobicContact CD2-CD1 4.43Å; L101-F113 HydrophobicContact CD2-CE1 3.46Å; L101-F113 VanDerWaalsContact CD2-CE1 3.46Å; L101-F113 HydrophobicContact CD2-CZ 3.68Å; L101-V126 HydrophobicContact CD1-CG2 3.83Å; L101-V126 HydrophobicContact CD2-CG2 4.32Å; L101-I139 HydrophobicContact CD1-CD1 3.98Å
102	N	74.9	Confident	62.7	Low	95 Å²	95	71.5 Å²	71.5	51%	0.508	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	108.1	166.6	-67.5	-22	0	0	0	107.5	S70	S70-N102 WeakPolarHBondContact CB-OD1 3.41Å; S70-N102 PolarHBondContact OG-OD1 3.24Å
103	I	74.9	Confident	63.7	Low	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	112.9	-172.6	-61.1	171.7	0	0	0	108.3	N68 I69 L71 L101 F109 V126 I137	N68-I103 WeakPolarHBondContact CA-O 3.43Å; I69-I103 PolarHBondContact N-O 3.13Å; I69-I103 VanDerWaalsContact N-O 3.07Å; I69-I103 PolarHBondContact O-N 2.99Å; L71-I103 HydrophobicContact CD1-CD1 4.2Å; L101-I103 HydrophobicContact CB-CD1 4.21Å; L101-I103 HydrophobicContact CB-CG1 4.15Å; I103-F109 HydrophobicContact CG1-CD1 4.33Å; I103-F109 HydrophobicContact CG1-CE1 4.36Å; I103-F109 HydrophobicContact CG2-CB 4.43Å; I103-F109 HydrophobicContact CG2-CD1 4.13Å; I103-V126 HydrophobicContact CD1-CG1 3.78Å; I103-V126 HydrophobicContact CG1-CG1 4.37Å; I103-I137 HydrophobicContact CD1-CD1 3.9Å; I103-I137 HydrophobicContact CD1-CG2 3.71Å; I103-I137 HydrophobicContact CG2-CD1 4.15Å
104	P	71.2	Confident	64	Low	34 Å²	34	68.3 Å²	68.3	22%	0.221	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.5	174.1	29.7	-33.3	0	0	0	109.9	N68 F109	N68-P104 WeakPolarHBondContact OD1-CA 3.4Å; P104-F109 HydrophobicContact CG-CB 4.12Å; P104-F109 HydrophobicContact CG-CD2 3.71Å; P104-F109 HydrophobicContact CG-CE2 4.34Å; P104-F109 HydrophobicContact CG-CG 4.07Å
105	I	69.3	Low	64.1	Low	8 Å²	8	65 Å²	65	4%	0.041	36%	0.359	C	S	.	.	S	Bend	trans	-97.8	-25.9	-172.7	-62.6	167.8	0	0	0	111.2	F61 P66 E67 I69 E107 N130	F61-I105 HydrophobicContact CE1-CD1 4.19Å; F61-I105 HydrophobicContact CE2-CG2 3.72Å; F61-I105 HydrophobicContact CZ-CD1 3.99Å; F61-I105 HydrophobicContact CZ-CG2 3.63Å; P66-I105 HydrophobicContact CB-CD1 4.01Å; P66-I105 HydrophobicContact CG-CD1 3.67Å; E67-I105 PolarHBondContact O-N 3.38Å; I69-I105 HydrophobicContact CB-CD1 4.01Å; I69-I105 HydrophobicContact CD1-CD1 3.77Å; I69-I105 HydrophobicContact CG1-CD1 3.73Å; I105-E107 PolarHBondContact O-N 3.01Å; I105-N130 PolarHBondContact O-ND2 3.32Å
106	K	62.8	Low	63.9	Low	126 Å²	126	69.6 Å²	69.6	55%	0.548	38%	0.378	S	S	.	.	S	Bend	trans	-69.9	-16.3	-179.1	-64.3	176.8	-175.5	169.3	0	113.5	E67	E67-K106 IonicContact OE1-NZ 2.67Å; E67-K106 PolarHBondContact OE1-NZ 3.13Å
107	E	63.1	Low	63.6	Low	144 Å²	144	63.4 Å²	63.4	67%	0.673	35%	0.346	S	S	*	.	S	Bend	trans	-136	157.1	-173.2	-67.2	176.4	-165.7	0	0	111.9	I105 F109	I105-E107 PolarHBondContact O-N 3.01Å; E107-F109 PolarHBondContact O-N 3.2Å
108	S	60.7	Low	62.7	Low	100 Å²	100	66.5 Å²	66.5	70%	0.699	37%	0.37	S	S	*	.			trans	-77.7	91.5	179	56.8	0	0	0	0	111.5
109	F	65.5	Low	61.3	Low	54 Å²	54	67.5 Å²	67.5	24%	0.237	39%	0.386	C	S	.	.			trans	-81.1	118.4	-178	-169.6	-110.5	0	0	0	112.5	I103 P104 E107 L111 V126 S128	I103-F109 HydrophobicContact CG1-CD1 4.33Å; I103-F109 HydrophobicContact CG1-CE1 4.36Å; I103-F109 HydrophobicContact CG2-CB 4.43Å; I103-F109 HydrophobicContact CG2-CD1 4.13Å; P104-F109 HydrophobicContact CG-CB 4.12Å; P104-F109 HydrophobicContact CG-CD2 3.71Å; P104-F109 HydrophobicContact CG-CE2 4.34Å; P104-F109 HydrophobicContact CG-CG 4.07Å; E107-F109 PolarHBondContact O-N 3.2Å; F109-L111 HydrophobicContact CD1-CB 4.23Å; F109-L111 HydrophobicContact CE1-CB 3.49Å; F109-L111 VanDerWaalsContact CE1-CB 3.49Å; F109-L111 HydrophobicContact CE1-CD2 4.06Å; F109-L111 HydrophobicContact CE1-CG 4.34Å; F109-L111 HydrophobicContact CZ-CB 3.73Å; F109-L111 HydrophobicContact CZ-CD1 4.45Å; F109-L111 HydrophobicContact CZ-CD2 4.03Å; F109-L111 HydrophobicContact CZ-CG 4.28Å; F109-V126 HydrophobicContact CD1-CG1 4.44Å; F109-S128 PolarHBondContact O-N 3.35Å
110	N	63.3	Low	59.9	Low	106 Å²	106	68.5 Å²	68.5	57%	0.567	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.1	164.7	-79.8	-19.3	0	0	0	108.7	V126 R127	N110-V126 WeakPolarHBondContact CA-O 3.16Å; N110-R127 WeakPolarHBondContact OD1-CG 3.26Å
111	L	66.1	Low	58.6	Low	64 Å²	64	71.1 Å²	71.1	34%	0.335	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	120	174	-178	73.9	0	0	0	110	L101 F109 F113 V126	L101-L111 HydrophobicContact CD2-CD2 4.3Å; F109-L111 HydrophobicContact CD1-CB 4.23Å; F109-L111 HydrophobicContact CE1-CB 3.49Å; F109-L111 VanDerWaalsContact CE1-CB 3.49Å; F109-L111 HydrophobicContact CE1-CD2 4.06Å; F109-L111 HydrophobicContact CE1-CG 4.34Å; F109-L111 HydrophobicContact CZ-CB 3.73Å; F109-L111 HydrophobicContact CZ-CD1 4.45Å; F109-L111 HydrophobicContact CZ-CD2 4.03Å; F109-L111 HydrophobicContact CZ-CG 4.28Å; L111-F113 HydrophobicContact CD2-CD1 3.83Å; L111-F113 HydrophobicContact CD2-CE1 4.27Å; L111-F113 HydrophobicContact CG-CD1 4.08Å; L111-V126 HydrophobicContact CB-CB 4.32Å; L111-V126 PolarHBondContact N-O 3.09Å; L111-V126 PolarHBondContact O-N 3.35Å
112	T	59.4	Low	57.5	Low	86 Å²	86	70.8 Å²	70.8	53%	0.528	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.5	164	45.3	0	0	0	0	109.5	F124 H125	T112-F124 WeakPolarHBondContact CA-O 3.46Å; T112-H125 HydrophobicContact CG2-CB 4.17Å; T112-H125 VanDerWaalsContact CG2-CD2 3.44Å; T112-H125 WeakPolarHBondContact CG2-CD2 3.46Å
113	F	63.5	Low	56.5	Low	49 Å²	49	70.4 Å²	70.4	22%	0.215	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.2	170.3	66.8	-78.4	0	0	0	110.2	H99 L101 L111 F124 V126	H99-F113 HydrophobicContact CB-CE2 4.29Å; H99-F113 HydrophobicContact CB-CZ 4.46Å; L101-F113 HydrophobicContact CD2-CD1 4.43Å; L101-F113 HydrophobicContact CD2-CE1 3.46Å; L101-F113 VanDerWaalsContact CD2-CE1 3.46Å; L101-F113 HydrophobicContact CD2-CZ 3.68Å; L111-F113 HydrophobicContact CD2-CD1 3.83Å; L111-F113 HydrophobicContact CD2-CE1 4.27Å; L111-F113 HydrophobicContact CG-CD1 4.08Å; F113-F124 HydrophobicContact CD1-CB 3.78Å; F113-F124 HydrophobicContact CD2-CB 4.36Å; F113-F124 AromaticContact CD2-CD2 3.86Å; F113-F124 HydrophobicContact CD2-CD2 3.86Å; F113-F124 HydrophobicContact CD2-CG 4.43Å; F113-F124 HydrophobicContact CE1-CB 3.28Å; F113-F124 HydrophobicContact CE1-CD2 4.23Å; F113-F124 AromaticContact CE1-CG 3.84Å; F113-F124 HydrophobicContact CE1-CG 3.84Å; F113-F124 HydrophobicContact CE2-CB 3.95Å; F113-F124 AromaticContact CE2-CD2 3.24Å; F113-F124 HydrophobicContact CE2-CD2 3.24Å; F113-F124 AromaticContact CE2-CE2 3.79Å; F113-F124 HydrophobicContact CE2-CE2 3.79Å; F113-F124 AromaticContact CE2-CG 3.69Å; F113-F124 HydrophobicContact CE2-CG 3.69Å; F113-F124 HydrophobicContact CG-CB 4.28Å; F113-F124 HydrophobicContact CZ-CB 3.38Å; F113-F124 HydrophobicContact CZ-CD1 4.01Å; F113-F124 AromaticContact CZ-CD2 3.45Å; F113-F124 HydrophobicContact CZ-CD2 3.45Å; F113-F124 VanDerWaalsContact CZ-CD2 3.45Å; F113-F124 HydrophobicContact CZ-CE2 4.16Å; F113-F124 AromaticContact CZ-CG 3.34Å; F113-F124 HydrophobicContact CZ-CG 3.34Å; F113-F124 PolarHBondContact N-O 3.27Å; F113-F124 VanDerWaalsContact N-O 3.08Å; F113-F124 PolarHBondContact O-N 3.48Å; F113-V126 HydrophobicContact CE1-CG2 4.17Å
114	T	53.8	Low	55.7	Low	100 Å²	100	70.4 Å²	70.4	61%	0.613	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.7	176.5	46.3	0	0	0	0	108.6	S122 Q123	T114-S122 WeakPolarHBondContact CA-O 3.13Å; T114-Q123 HydrophobicContact CG2-CB 4.23Å; T114-Q123 HydrophobicContact CG2-CG 4.06Å
115	S	51.4	Low	55	Low	27 Å²	27	71.9 Å²	71.9	19%	0.189	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.7	168.7	-162.5	0	0	0	0	109.4	H99 S122	H99-S115 PolarHBondContact CE1-OG 3.36Å; H99-S115 VanDerWaalsContact CE1-OG 3.29Å; S115-S122 WeakPolarHBondContact CB-OG 3.29Å; S115-S122 PolarHBondContact N-O 3.16Å; S115-S122 PolarHBondContact O-N 2.97Å; S115-S122 PolarHBondContact O-OG 2.85Å
116	E	47.9	Very low	54.5	Low	126 Å²	126	71.5 Å²	71.5	59%	0.589	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	85.9	-178.4	-173.5	172	-127.2	0	0	109.1	Y121	E116-Y121 HydrophobicContact CB-CE1 4.26Å; E116-Y121 HydrophobicContact CG-CD1 4.37Å; E116-Y121 HydrophobicContact CG-CE1 3.78Å; E116-Y121 WeakPolarHBondContact OE1-CE1 3.46Å; E116-Y121 PolarHBondContact OE1-OH 2.97Å
117	D	48.3	Very low	54.4	Low	18 Å²	18	71.5 Å²	71.5	10%	0.096	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	101.1	-176.5	-107.5	-2.1	0	0	0	109.5	N97 G119 T120	N97-D117 PolarHBondContact ND2-OD1 3.46Å; N97-D117 PolarHBondContact ND2-OD2 3.23Å; D117-G119 VanDerWaalsContact C-N 3.29Å; D117-G119 PolarHBondContact O-N 3.49Å; D117-T120 PolarHBondContact N-O 2.97Å; D117-T120 WeakPolarHBondContact O-CB 3.14Å; D117-T120 PolarHBondContact O-N 2.86Å; D117-T120 PolarHBondContact O-OG1 3.08Å
118	C	39.8	Very low	54.4	Low	114 Å²	114	64.8 Å²	64.8	77%	0.77	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.8	176.2	-62.9	0	0	0	0	114.8	T120	C118-T120 VanDerWaalsContact C-N 3.34Å
119	G	36.4	Very low	54.4	Low	54 Å²	54	63.2 Å²	63.2	56%	0.557	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	3.9	-177.5	0	0	0	0	0	114.6	D117	D117-G119 VanDerWaalsContact C-N 3.29Å; D117-G119 PolarHBondContact O-N 3.49Å
120	T	40.9	Very low	54.1	Low	41 Å²	41	63.7 Å²	63.7	25%	0.252	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.4	168	67.2	0	0	0	0	110.3	D117 C118 S122 P144	D117-T120 PolarHBondContact N-O 2.97Å; D117-T120 WeakPolarHBondContact O-CB 3.14Å; D117-T120 PolarHBondContact O-N 2.86Å; D117-T120 PolarHBondContact O-OG1 3.08Å; C118-T120 VanDerWaalsContact C-N 3.34Å; T120-S122 PolarHBondContact O-N 2.91Å; T120-P144 HydrophobicContact CG2-CG 3.83Å
121	Y	43.7	Very low	53.9	Low	138 Å²	138	64.6 Å²	64.6	54%	0.541	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115.2	172.4	-65.5	-70.3	0	0	0	109.4	E116 N142	E116-Y121 HydrophobicContact CB-CE1 4.26Å; E116-Y121 HydrophobicContact CG-CD1 4.37Å; E116-Y121 HydrophobicContact CG-CE1 3.78Å; E116-Y121 WeakPolarHBondContact OE1-CE1 3.46Å; E116-Y121 PolarHBondContact OE1-OH 2.97Å; Y121-N142 VanDerWaalsContact O-O 3.12Å
122	S	50	Low	53.7	Low	2 Å²	2	71.7 Å²	71.7	1%	0.014	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	101.7	167.7	53	0	0	0	0	109.1	T114 S115 T120 F124 N142	T114-S122 WeakPolarHBondContact CA-O 3.13Å; S115-S122 WeakPolarHBondContact CB-OG 3.29Å; S115-S122 PolarHBondContact N-O 3.16Å; S115-S122 PolarHBondContact O-N 2.97Å; S115-S122 PolarHBondContact O-OG 2.85Å; T120-S122 PolarHBondContact O-N 2.91Å; S122-F124 WeakPolarHBondContact OG-CE2 3.48Å; S122-N142 WeakPolarHBondContact CA-O 3.5Å
123	Q	54	Low	54	Low	87 Å²	87	72.8 Å²	72.8	41%	0.407	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.6	173.1	-171	-172.5	32.1	0	0	108.8	T114 N142	T114-Q123 HydrophobicContact CG2-CB 4.23Å; T114-Q123 HydrophobicContact CG2-CG 4.06Å; Q123-N142 HydrophobicContact CB-CB 4.22Å; Q123-N142 PolarHBondContact N-O 3.31Å; Q123-N142 PolarHBondContact O-N 3.16Å; Q123-N142 VanDerWaalsContact O-N 3.13Å; Q123-N142 PolarHBondContact OE1-ND2 2.91Å; Q123-N142 VanDerWaalsContact OE1-ND2 3.17Å
124	F	57.8	Low	54	Low	1 Å²	1	71.8 Å²	71.8	0%	0.004	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.6	172.3	-63.1	-92	0	0	0	109.4	H99 T112 F113 S122 I139 N140 I141 W149	H99-F124 AromaticContact CD2-CZ 3.68Å; H99-F124 AromaticContact NE2-CZ 3.91Å; T112-F124 WeakPolarHBondContact CA-O 3.46Å; F113-F124 HydrophobicContact CD1-CB 3.78Å; F113-F124 HydrophobicContact CD2-CB 4.36Å; F113-F124 AromaticContact CD2-CD2 3.86Å; F113-F124 HydrophobicContact CD2-CD2 3.86Å; F113-F124 HydrophobicContact CD2-CG 4.43Å; F113-F124 HydrophobicContact CE1-CB 3.28Å; F113-F124 HydrophobicContact CE1-CD2 4.23Å; F113-F124 AromaticContact CE1-CG 3.84Å; F113-F124 HydrophobicContact CE1-CG 3.84Å; F113-F124 HydrophobicContact CE2-CB 3.95Å; F113-F124 AromaticContact CE2-CD2 3.24Å; F113-F124 HydrophobicContact CE2-CD2 3.24Å; F113-F124 AromaticContact CE2-CE2 3.79Å; F113-F124 HydrophobicContact CE2-CE2 3.79Å; F113-F124 AromaticContact CE2-CG 3.69Å; F113-F124 HydrophobicContact CE2-CG 3.69Å; F113-F124 HydrophobicContact CG-CB 4.28Å; F113-F124 HydrophobicContact CZ-CB 3.38Å; F113-F124 HydrophobicContact CZ-CD1 4.01Å; F113-F124 AromaticContact CZ-CD2 3.45Å; F113-F124 HydrophobicContact CZ-CD2 3.45Å; F113-F124 VanDerWaalsContact CZ-CD2 3.45Å; F113-F124 HydrophobicContact CZ-CE2 4.16Å; F113-F124 AromaticContact CZ-CG 3.34Å; F113-F124 HydrophobicContact CZ-CG 3.34Å; F113-F124 PolarHBondContact N-O 3.27Å; F113-F124 VanDerWaalsContact N-O 3.08Å; F113-F124 PolarHBondContact O-N 3.48Å; S122-F124 WeakPolarHBondContact OG-CE2 3.48Å; F124-I139 HydrophobicContact CD1-CG2 4.15Å; F124-N140 VanDerWaalsContact CA-O 3.31Å; F124-N140 WeakPolarHBondContact CA-O 3.33Å; F124-I141 HydrophobicContact CD1-CG1 4.13Å; F124-I141 HydrophobicContact CE1-CD1 4.36Å; F124-I141 HydrophobicContact CE1-CG1 4.01Å; F124-I141 HydrophobicContact CE1-CG2 4.42Å; F124-W149 HydrophobicContact CE1-CH2 4.1Å; F124-W149 HydrophobicContact CE1-CZ3 4.11Å; F124-W149 AromaticContact CZ-CH2 3.84Å; F124-W149 HydrophobicContact CZ-CH2 3.84Å; F124-W149 HydrophobicContact CZ-CZ3 4.13Å
125	H	56.9	Low	54.8	Low	65 Å²	65	67.2 Å²	67.2	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.8	167.9	-177.7	-59.1	0	0	0	108.9	T112 D138 I139 N140	T112-H125 HydrophobicContact CG2-CB 4.17Å; T112-H125 VanDerWaalsContact CG2-CD2 3.44Å; T112-H125 WeakPolarHBondContact CG2-CD2 3.46Å; H125-D138 VanDerWaalsContact O-O 3.11Å; H125-I139 WeakPolarHBondContact O-CA 3.47Å; H125-N140 HydrophobicContact CB-CB 4.25Å; H125-N140 PolarHBondContact N-O 3.23Å; H125-N140 PolarHBondContact O-N 2.99Å; H125-N140 VanDerWaalsContact O-N 3.12Å
126	V	59.4	Low	55.9	Low	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.7	176.3	-173.1	0	0	0	0	109.3	L101 I103 F109 N110 L111 F113 I137 D138 I139	L101-V126 HydrophobicContact CD1-CG2 3.83Å; L101-V126 HydrophobicContact CD2-CG2 4.32Å; I103-V126 HydrophobicContact CD1-CG1 3.78Å; I103-V126 HydrophobicContact CG1-CG1 4.37Å; F109-V126 HydrophobicContact CD1-CG1 4.44Å; N110-V126 WeakPolarHBondContact CA-O 3.16Å; L111-V126 HydrophobicContact CB-CB 4.32Å; L111-V126 PolarHBondContact N-O 3.09Å; L111-V126 PolarHBondContact O-N 3.35Å; F113-V126 HydrophobicContact CE1-CG2 4.17Å; V126-I137 HydrophobicContact CG1-CG2 4.12Å; V126-D138 CarbonylContact C-O 3.54Å; V126-D138 VanDerWaalsContact CA-O 3.27Å; V126-D138 WeakPolarHBondContact CA-O 3.42Å; V126-I139 HydrophobicContact CG2-CG1 4.47Å
127	R	61	Low	57.2	Low	126 Å²	126	61.5 Å²	61.5	48%	0.475	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	123.2	172.6	178.4	168.3	-168.7	-177.5	2.2	110.8	N110 I129 I137 D138	N110-R127 WeakPolarHBondContact OD1-CG 3.26Å; R127-I129 HydrophobicContact CG-CG1 4.21Å; R127-I137 WeakPolarHBondContact O-CA 3.31Å; R127-D138 PolarHBondContact N-O 3.35Å; R127-D138 PolarHBondContact O-N 3.44Å
128	S	62.2	Low	58.6	Low	2 Å²	2	62.5 Å²	62.5	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.8	173.2	-176.1	0	0	0	0	110.8	F109 N136	F109-S128 PolarHBondContact O-N 3.35Å; S128-N136 WeakPolarHBondContact CA-O 3.27Å
129	I	60.4	Low	60.3	Low	67 Å²	67	57 Å²	57	34%	0.344	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118	172.7	-54.9	178.2	0	0	0	108.8	R127 A135 N136	R127-I129 HydrophobicContact CG-CG1 4.21Å; I129-A135 VanDerWaalsContact O-CA 3.27Å; I129-A135 WeakPolarHBondContact O-CA 3.35Å; I129-N136 PolarHBondContact N-O 3.03Å; I129-N136 PolarHBondContact O-N 3.07Å; I129-N136 VanDerWaalsContact O-N 3.09Å
130	N	60.5	Low	62	Low	65 Å²	65	56.4 Å²	56.4	35%	0.348	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	133.7	176.8	-179.9	-43.9	0	0	0	111.2	I105 R132	I105-N130 PolarHBondContact O-ND2 3.32Å; N130-R132 PolarHBondContact OD1-N 2.78Å
131	L	58.9	Low	63.6	Low	125 Å²	125	54.6 Å²	54.6	65%	0.654	26%	0.255	S	S	*	.			trans	-129.6	53.1	177.7	-72.3	168.2	0	0	0	111.3	N133 A134	L131-N133 PolarHBondContact O-N 3.35Å; L131-A134 HydrophobicContact CB-CB 4.37Å; L131-A134 PolarHBondContact N-O 2.8Å; L131-A134 PolarHBondContact O-N 3.16Å
132	R	60.8	Low	64.4	Low	213 Å²	213	50.2 Å²	50.2	80%	0.804	24%	0.242	S	C	*	.	S	Bend	trans	59.5	-63.9	-176	-66	-169.5	-178	-154.4	1.4	115.4	N130	N130-R132 PolarHBondContact OD1-N 2.78Å
133	N	65.7	Low	65	Low	109 Å²	109	51.2 Å²	51.2	58%	0.583	25%	0.252	S	S	*	.	S	Bend	trans	-114.1	4.6	-176.9	-61	20.1	0	0	0	112.1	F61 L131	F61-N133 WeakPolarHBondContact CD2-O 3.49Å; F61-N133 PolarHBondContact N-O 3.23Å; L131-N133 PolarHBondContact O-N 3.35Å
134	A	63.9	Low	64.8	Low	27 Å²	27	50.5 Å²	50.5	22%	0.223	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	157.6	177.3	0	0	0	0	0	110.7	I59 T60 L131	I59-A134 CarbonylContact O-C 3.6Å; I59-A134 WeakPolarHBondContact O-CA 3.31Å; I59-A134 VanDerWaalsContact O-CB 3.32Å; I59-A134 WeakPolarHBondContact O-CB 3.46Å; T60-A134 HydrophobicContact CG2-CB 4.34Å; L131-A134 HydrophobicContact CB-CB 4.37Å; L131-A134 PolarHBondContact N-O 2.8Å; L131-A134 PolarHBondContact O-N 3.16Å
135	A	71.2	Confident	64.9	Low	5 Å²	5	51.7 Å²	51.7	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	147.1	169.7	0	0	0	0	0	109.9	I59 F61 I129	I59-A135 PolarHBondContact N-O 2.94Å; I59-A135 PolarHBondContact O-N 3.38Å; F61-A135 HydrophobicContact CE2-CB 4.01Å; F61-A135 HydrophobicContact CZ-CB 4.16Å; I129-A135 VanDerWaalsContact O-CA 3.27Å; I129-A135 WeakPolarHBondContact O-CA 3.35Å
136	N	74.7	Confident	65.1	Low	32 Å²	32	52 Å²	52	17%	0.171	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.4	166.5	-168.2	69.2	0	0	0	109.9	S58 S128 I129 D138	S58-N136 WeakPolarHBondContact CA-OD1 3.49Å; S58-N136 PolarHBondContact N-OD1 2.93Å; S58-N136 PolarHBondContact OG-OD1 3.29Å; S128-N136 WeakPolarHBondContact CA-O 3.27Å; I129-N136 PolarHBondContact N-O 3.03Å; I129-N136 PolarHBondContact O-N 3.07Å; I129-N136 VanDerWaalsContact O-N 3.09Å; N136-D138 PolarHBondContact ND2-OD1 2.87Å; N136-D138 PolarHBondContact ND2-OD2 3Å
137	I	75.3	Confident	65.5	Low	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	106.1	177.2	-56.1	178.7	0	0	0	108.2	I57 I59 I103 V126 R127 I139	I57-I137 HydrophobicContact CB-CB 4.42Å; I57-I137 PolarHBondContact N-O 3.36Å; I57-I137 PolarHBondContact O-N 3.11Å; I59-I137 HydrophobicContact CD1-CD1 3.52Å; I59-I137 HydrophobicContact CD1-CG1 4.01Å; I103-I137 HydrophobicContact CD1-CD1 3.9Å; I103-I137 HydrophobicContact CD1-CG2 3.71Å; I103-I137 HydrophobicContact CG2-CD1 4.15Å; V126-I137 HydrophobicContact CG1-CG2 4.12Å; R127-I137 WeakPolarHBondContact O-CA 3.31Å; I137-I139 HydrophobicContact CG2-CD1 4.35Å; I137-I139 HydrophobicContact CG2-CG1 4.05Å
138	D	76.1	Confident	65.9	Low	38 Å²	38	50.3 Å²	50.3	20%	0.203	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.3	172.2	-60	-53.2	0	0	0	109.8	S56 H125 V126 R127 N136	S56-D138 VanDerWaalsContact CB-OD1 3.24Å; S56-D138 WeakPolarHBondContact CB-OD1 3.25Å; S56-D138 PolarHBondContact OG-OD1 2.63Å; H125-D138 VanDerWaalsContact O-O 3.11Å; V126-D138 CarbonylContact C-O 3.54Å; V126-D138 VanDerWaalsContact CA-O 3.27Å; V126-D138 WeakPolarHBondContact CA-O 3.42Å; R127-D138 PolarHBondContact N-O 3.35Å; R127-D138 PolarHBondContact O-N 3.44Å; N136-D138 PolarHBondContact ND2-OD1 2.87Å; N136-D138 PolarHBondContact ND2-OD2 3Å
139	I	75.8	Confident	66.5	Low	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	103	175.4	-54.1	179	0	0	0	108	L55 L71 L73 L101 F124 H125 V126 I137 I141	L55-I139 HydrophobicContact CB-CB 4.37Å; L55-I139 HydrophobicContact CD2-CD1 4.34Å; L55-I139 PolarHBondContact N-O 2.87Å; L55-I139 PolarHBondContact O-N 3.47Å; L71-I139 HydrophobicContact CD1-CD1 4.21Å; L73-I139 HydrophobicContact CD2-CD1 4.44Å; L101-I139 HydrophobicContact CD1-CD1 3.98Å; F124-I139 HydrophobicContact CD1-CG2 4.15Å; H125-I139 WeakPolarHBondContact O-CA 3.47Å; V126-I139 HydrophobicContact CG2-CG1 4.47Å; I137-I139 HydrophobicContact CG2-CD1 4.35Å; I137-I139 HydrophobicContact CG2-CG1 4.05Å; I139-I141 HydrophobicContact CG2-CG1 4.25Å
140	N	73.5	Confident	67.2	Low	40 Å²	40	47.9 Å²	47.9	21%	0.214	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.3	167.2	-59.8	-39.6	0	0	0	108.9	K54 F124 H125	K54-N140 WeakPolarHBondContact CD-OD1 3.42Å; K54-N140 VanDerWaalsContact CG-OD1 3.28Å; K54-N140 WeakPolarHBondContact CG-OD1 3.32Å; F124-N140 VanDerWaalsContact CA-O 3.31Å; F124-N140 WeakPolarHBondContact CA-O 3.33Å; H125-N140 HydrophobicContact CB-CB 4.25Å; H125-N140 PolarHBondContact N-O 3.23Å; H125-N140 PolarHBondContact O-N 2.99Å; H125-N140 VanDerWaalsContact O-N 3.12Å
141	I	72.7	Confident	68.1	Low	3 Å²	3	44.8 Å²	44.8	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	103	171.2	-53.4	176.9	0	0	0	106.9	F44 T53 F124 I139 W149	F44-I141 HydrophobicContact CZ-CD1 4.22Å; T53-I141 PolarHBondContact N-O 2.73Å; T53-I141 PolarHBondContact O-N 3.15Å; F124-I141 HydrophobicContact CD1-CG1 4.13Å; F124-I141 HydrophobicContact CE1-CD1 4.36Å; F124-I141 HydrophobicContact CE1-CG1 4.01Å; F124-I141 HydrophobicContact CE1-CG2 4.42Å; I139-I141 HydrophobicContact CG2-CG1 4.25Å; I141-W149 HydrophobicContact CD1-CD2 4.44Å; I141-W149 HydrophobicContact CD1-CE3 4.22Å; I141-W149 HydrophobicContact CD1-CH2 4.37Å; I141-W149 HydrophobicContact CD1-CZ3 4.2Å; I141-W149 HydrophobicContact CG2-CH2 4.29Å; I141-W149 HydrophobicContact CG2-CZ2 4.17Å
142	N	62.5	Low	69.1	Low	47 Å²	47	38.8 Å²	38.8	25%	0.251	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.1	175.8	-53.5	-16.9	0	0	0	108.2	V52 Y121 S122 Q123	V52-N142 WeakPolarHBondContact CG1-OD1 3.39Å; V52-N142 HydrophobicContact CG2-CB 4.5Å; V52-N142 WeakPolarHBondContact CG2-OD1 3.41Å; Y121-N142 VanDerWaalsContact O-O 3.12Å; S122-N142 WeakPolarHBondContact CA-O 3.5Å; Q123-N142 HydrophobicContact CB-CB 4.22Å; Q123-N142 PolarHBondContact N-O 3.31Å; Q123-N142 PolarHBondContact O-N 3.16Å; Q123-N142 VanDerWaalsContact O-N 3.13Å; Q123-N142 PolarHBondContact OE1-ND2 2.91Å; Q123-N142 VanDerWaalsContact OE1-ND2 3.17Å
143	G	61.3	Low	70.2	Confident	23 Å²	23	28.7 Å²	28.7	24%	0.237	18%	0.176	C	C	.	.	S	Bend	trans	154.9	158.2	176.9	0	0	0	0	0	114.5	V145	G143-V145 PolarHBondContact O-N 3.24Å
144	P	50.9	Low	71	Confident	71 Å²	71	24.2 Å²	24.2	46%	0.461	15%	0.15	S	C	.	.			trans	-79.8	30.5	-168.6	34.7	-38.8	0	0	0	115	T120 V146	T120-P144 HydrophobicContact CG2-CG 3.83Å; P144-V146 VanDerWaalsContact C-N 3.31Å; P144-V146 PolarHBondContact O-N 3.05Å
145	V	58.3	Low	71.7	Confident	26 Å²	26	22.9 Å²	22.9	16%	0.158	14%	0.14	C	C	.	.			trans	-86.2	71	-174.7	-168.1	0	0	0	0	111.1	G143 W149	G143-V145 PolarHBondContact O-N 3.24Å; V145-W149 HydrophobicContact CB-CZ2 3.88Å; V145-W149 HydrophobicContact CG1-CZ2 3.74Å; V145-W149 PolarHBondContact O-NE1 3.25Å
146	V	61.4	Low	72	Confident	71 Å²	71	24.1 Å²	24.1	43%	0.43	15%	0.147	S	C	.	.			trans	-67.3	144.1	179.2	-180	0	0	0	0	111.7	I46 Q48 P144	I46-V146 WeakPolarHBondContact O-CG1 3.38Å; Q48-V146 HydrophobicContact CB-CG1 4.43Å; Q48-V146 HydrophobicContact CG-CG1 3.71Å; P144-V146 VanDerWaalsContact C-N 3.31Å; P144-V146 PolarHBondContact O-N 3.05Å
147	G	68.5	Low	71.8	Confident	31 Å²	31	24 Å²	24	32%	0.32	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	123.4	-166.9	174.4	0	0	0	0	0	114	I46	I46-G147 PolarHBondContact N-O 3Å; I46-G147 PolarHBondContact O-N 2.95Å; I46-G147 VanDerWaalsContact O-N 3.09Å
148	M	68.7	Low	71	Confident	60 Å²	60	27.2 Å²	27.2	30%	0.296	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.6	179.9	-67.8	-54.1	-65.2	0	0	111.6	N43 P45 G76 Y150	N43-M148 HydrophobicContact CB-CE 4.07Å; N43-M148 WeakPolarHBondContact ND2-CE 3.34Å; P45-M148 HydrophobicContact CB-SD 3.77Å; G76-M148 PolarHBondContact N-O 3.43Å; M148-Y150 HydrophobicContact CB-CE2 3.74Å
149	W	75.3	Confident	69.9	Low	4 Å²	4	35.6 Å²	35.6	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.3	169.2	-81.8	71.1	0	0	0	110.6	N43 F44 I46 L73 F124 I141 V145	N43-W149 CarbonylContact C-O 3.56Å; N43-W149 WeakPolarHBondContact CA-O 3.31Å; N43-W149 WeakPolarHBondContact CB-O 3.4Å; F44-W149 HydrophobicContact CD1-CB 4.21Å; F44-W149 HydrophobicContact CD2-CB 4.31Å; F44-W149 HydrophobicContact CE1-CB 3.74Å; F44-W149 HydrophobicContact CE2-CB 3.86Å; F44-W149 HydrophobicContact CE2-CG 4.26Å; F44-W149 HydrophobicContact CG-CB 4.48Å; F44-W149 HydrophobicContact CZ-CB 3.55Å; F44-W149 HydrophobicContact CZ-CG 4.09Å; F44-W149 PolarHBondContact N-O 3.46Å; F44-W149 PolarHBondContact O-N 2.73Å; I46-W149 VanDerWaalsContact CD1-CD1 3.42Å; I46-W149 HydrophobicContact CD1-CD2 4.45Å; I46-W149 HydrophobicContact CD1-CG 4.12Å; I46-W149 VanDerWaalsContact CD1-NE1 3.33Å; I46-W149 HydrophobicContact CG1-CG 4.48Å; L73-W149 HydrophobicContact CB-CZ3 4.37Å; F124-W149 HydrophobicContact CE1-CH2 4.1Å; F124-W149 HydrophobicContact CE1-CZ3 4.11Å; F124-W149 AromaticContact CZ-CH2 3.84Å; F124-W149 HydrophobicContact CZ-CH2 3.84Å; F124-W149 HydrophobicContact CZ-CZ3 4.13Å; I141-W149 HydrophobicContact CD1-CD2 4.44Å; I141-W149 HydrophobicContact CD1-CE3 4.22Å; I141-W149 HydrophobicContact CD1-CH2 4.37Å; I141-W149 HydrophobicContact CD1-CZ3 4.2Å; I141-W149 HydrophobicContact CG2-CH2 4.29Å; I141-W149 HydrophobicContact CG2-CZ2 4.17Å; V145-W149 HydrophobicContact CB-CZ2 3.88Å; V145-W149 HydrophobicContact CG1-CZ2 3.74Å; V145-W149 PolarHBondContact O-NE1 3.25Å
150	Y	75.4	Confident	68.8	Low	14 Å²	14	40.4 Å²	40.4	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136	-178.3	-63.5	-99.2	0	0	0	110	N43 R74 S77 F78 M148	N43-Y150 HydrophobicContact CB-CD1 3.76Å; N43-Y150 HydrophobicContact CB-CE1 4.06Å; N43-Y150 HydrophobicContact CB-CG 4.21Å; R74-Y150 PolarHBondContact N-O 3.06Å; R74-Y150 PolarHBondContact O-N 3.1Å; S77-Y150 VanDerWaalsContact C-CD2 3.44Å; F78-Y150 AromaticContact CD1-CD1 3.62Å; F78-Y150 HydrophobicContact CD1-CD1 3.62Å; F78-Y150 HydrophobicContact CD1-CE1 4.33Å; F78-Y150 HydrophobicContact CD1-CG 4.32Å; F78-Y150 HydrophobicContact CD2-CD1 4.07Å; F78-Y150 HydrophobicContact CD2-CE1 4.07Å; F78-Y150 AromaticContact CE1-CD1 3.54Å; F78-Y150 HydrophobicContact CE1-CD1 3.54Å; F78-Y150 AromaticContact CE1-CE1 4Å; F78-Y150 HydrophobicContact CE1-CE1 4Å; F78-Y150 AromaticContact CE2-CD1 3.99Å; F78-Y150 HydrophobicContact CE2-CD1 3.99Å; F78-Y150 AromaticContact CE2-CE1 3.71Å; F78-Y150 HydrophobicContact CE2-CE1 3.71Å; F78-Y150 AromaticContact CG-CD1 3.9Å; F78-Y150 HydrophobicContact CG-CD1 3.9Å; F78-Y150 HydrophobicContact CG-CE1 4.38Å; F78-Y150 HydrophobicContact CG-CG 4.44Å; F78-Y150 AromaticContact CZ-CD1 3.73Å; F78-Y150 HydrophobicContact CZ-CD1 3.73Å; F78-Y150 AromaticContact CZ-CE1 3.66Å; F78-Y150 HydrophobicContact CZ-CE1 3.66Å; M148-Y150 HydrophobicContact CB-CE2 3.74Å
151	I	79.9	Confident	67.8	Low	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.8	176.8	-55.7	-168.2	0	0	0	109.1	Y41 F42 F44 L55 L71 T72 L73	Y41-I151 CarbonylContact C-O 3.58Å; Y41-I151 VanDerWaalsContact CA-O 3.25Å; Y41-I151 WeakPolarHBondContact CA-O 3.42Å; F42-I151 HydrophobicContact CD1-CB 4.25Å; F42-I151 HydrophobicContact CD1-CG2 4.45Å; F42-I151 HydrophobicContact CD2-CB 4.35Å; F42-I151 HydrophobicContact CE1-CB 3.86Å; F42-I151 HydrophobicContact CE1-CG2 3.69Å; F42-I151 HydrophobicContact CE2-CB 3.98Å; F42-I151 HydrophobicContact CE2-CD1 3.84Å; F42-I151 HydrophobicContact CE2-CG1 4.2Å; F42-I151 HydrophobicContact CE2-CG2 4.42Å; F42-I151 HydrophobicContact CG-CB 4.48Å; F42-I151 HydrophobicContact CZ-CB 3.73Å; F42-I151 HydrophobicContact CZ-CD1 3.87Å; F42-I151 HydrophobicContact CZ-CG1 4.27Å; F42-I151 HydrophobicContact CZ-CG2 3.68Å; F42-I151 PolarHBondContact N-O 3.22Å; F42-I151 PolarHBondContact O-N 2.98Å; F44-I151 HydrophobicContact CE1-CD1 3.97Å; F44-I151 HydrophobicContact CE1-CG1 4.3Å; L55-I151 HydrophobicContact CD2-CD1 3.39Å; L71-I151 HydrophobicContact CB-CG2 4.5Å; L71-I151 HydrophobicContact CD2-CG2 4.47Å; T72-I151 CarbonylContact O-C 3.59Å; T72-I151 VanDerWaalsContact O-CA 3.3Å; T72-I151 WeakPolarHBondContact O-CA 3.31Å; L73-I151 HydrophobicContact CD2-CD1 3.58Å; L73-I151 HydrophobicContact CD2-CG1 4.06Å; L73-I151 HydrophobicContact CG-CD1 3.86Å; L73-I151 HydrophobicContact CG-CG1 3.9Å
152	G	79.2	Confident	67.3	Low	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.8	166.6	0	0	0	0	0	110	Y41 T72	Y41-G152 VanDerWaalsContact CD1-CA 3.46Å; T72-G152 PolarHBondContact N-O 3.32Å; T72-G152 PolarHBondContact O-N 3.39Å
153	A	83.1	Confident	67.6	Low	1 Å²	1	53.6 Å²	53.6	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.7	-170.8	0	0	0	0	0	112	L30 I39 V40 F42 S70 L71	L30-A153 HydrophobicContact CD1-CB 4.2Å; L30-A153 HydrophobicContact CD2-CB 4.15Å; L30-A153 WeakPolarHBondContact CD2-O 3.31Å; I39-A153 WeakPolarHBondContact CA-O 3.34Å; V40-A153 PolarHBondContact N-O 3.5Å; V40-A153 PolarHBondContact O-N 3.07Å; F42-A153 HydrophobicContact CE1-CB 4.4Å; S70-A153 WeakPolarHBondContact O-CA 3.44Å; L71-A153 HydrophobicContact CD2-CB 3.53Å
154	Y	82.4	Confident	68.3	Low	14 Å²	14	55 Å²	55	6%	0.055	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	165.5	169.3	73.2	-80.8	0	0	0	111.4	F33 S70 V81 R82 P83 T156	F33-Y154 HydrophobicContact CB-CD2 4.01Å; F33-Y154 HydrophobicContact CD2-CD2 4.44Å; F33-Y154 HydrophobicContact CG-CD2 4.21Å; S70-Y154 PolarHBondContact N-O 3.34Å; S70-Y154 PolarHBondContact O-N 3.06Å; S70-Y154 PolarHBondContact OG-OH 3.28Å; V81-Y154 HydrophobicContact CG1-CD1 3.23Å; V81-Y154 HydrophobicContact CG1-CE1 3.41Å; V81-Y154 VanDerWaalsContact CG1-CE1 3.41Å; V81-Y154 HydrophobicContact CG1-CG 4.3Å; R82-Y154 PolarHBondContact O-OH 2.97Å; P83-Y154 HydrophobicContact CB-CE2 4.22Å; Y154-T156 HydrophobicContact CD2-CG2 4.04Å; Y154-T156 HydrophobicContact CE2-CG2 3.68Å
155	M	80.6	Confident	69.5	Low	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.3	-176.3	178.8	174.7	64.2	0	0	110.5	L30 F33 P66 I69 T157 C163 A165	L30-M155 HydrophobicContact CB-CB 4.39Å; L30-M155 HydrophobicContact CD1-CB 4.39Å; F33-M155 WeakPolarHBondContact CB-O 3.37Å; F33-M155 PolarHBondContact N-O 3.25Å; P66-M155 HydrophobicContact CB-CG 3.68Å; P66-M155 HydrophobicContact CB-SD 3.49Å; P66-M155 WeakPolarHBondContact CB-SD 3.36Å; P66-M155 HydrophobicContact CG-CG 4.39Å; P66-M155 HydrophobicContact CG-SD 3.66Å; I69-M155 HydrophobicContact CD1-SD 4.45Å; I69-M155 HydrophobicContact CG1-CB 3.98Å; I69-M155 HydrophobicContact CG1-CG 3.96Å; I69-M155 HydrophobicContact CG1-SD 4.45Å; M155-T157 HydrophobicContact CG-CG2 4.37Å; M155-C163 HydrophobicContact CE-CB 4.42Å; M155-C163 VanDerWaalsContact CE-SG 3.53Å; M155-A165 HydrophobicContact CE-CB 4.06Å; M155-A165 HydrophobicContact SD-CB 3.59Å; M155-A165 VanDerWaalsContact SD-CB 3.59Å
156	T	75.9	Confident	70.5	Confident	30 Å²	30	54.1 Å²	54.1	18%	0.184	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.1	177.7	55.7	0	0	0	0	111.8	E67 N68 Y154	E67-T156 PolarHBondContact N-O 3.06Å; N68-T156 PolarHBondContact O-N 3.29Å; N68-T156 VanDerWaalsContact O-N 3.14Å; N68-T156 PolarHBondContact O-OG1 2.88Å; Y154-T156 HydrophobicContact CD2-CG2 4.04Å; Y154-T156 HydrophobicContact CE2-CG2 3.68Å
157	T	70.6	Confident	71.3	Confident	29 Å²	29	50.8 Å²	50.8	18%	0.178	25%	0.249	C	C	.	.			trans	-135.8	141	-178.7	70.3	0	0	0	0	112.2	S32 P66 M155 F159 C163	S32-T157 WeakPolarHBondContact CB-OG1 3.31Å; S32-T157 PolarHBondContact OG-OG1 3.36Å; P66-T157 HydrophobicContact CB-CG2 4.02Å; M155-T157 HydrophobicContact CG-CG2 4.37Å; T157-F159 PolarHBondContact O-N 3.29Å; T157-C163 HydrophobicContact CG2-CB 4.17Å
158	S	59.1	Low	71.9	Confident	69 Å²	69	52.3 Å²	52.3	48%	0.483	25%	0.249	S	C	.	.	S	Bend	trans	-71.5	93.3	166.2	36.2	0	0	0	0	111.6	E67	E67-S158 PolarHBondContact OE1-OG 3Å; E67-S158 PolarHBondContact OE2-OG 3.44Å
159	F	52.3	Low	72.5	Confident	214 Å²	214	49.6 Å²	49.6	94%	0.939	24%	0.236	S	C	*	.	S	Bend	trans	56.5	50.5	163.3	-69.6	-86.7	0	0	0	118.5	T157	T157-F159 PolarHBondContact O-N 3.29Å
160	Q	54.1	Low	72.8	Confident	101 Å²	101	51.3 Å²	51.3	47%	0.472	25%	0.249	S	C	.	.			trans	-126.4	125.7	164.9	-69.5	-173.5	-29.4	0	0	111.9	C64	C64-Q160 VanDerWaalsContact CB-OE1 3.28Å
161	K	52.8	Low	73	Confident	207 Å²	207	50.7 Å²	50.7	90%	0.9	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-18.4	-172	-76.9	-171.9	175	-178.1	0	115.6
162	E	60.9	Low	72.9	Confident	157 Å²	157	55.7 Å²	55.7	73%	0.734	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	27.1	-171.3	-61.3	-173.9	170.6	0	0	112.7	I164	E162-I164 PolarHBondContact O-N 3.09Å
163	C	68.7	Low	72.8	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.02	27%	0.267	C	S	.	.			trans	-77.8	119.4	177.9	-177.4	0	0	0	0	111.8	S32 C64 M155 T157	S32-C163 PolarHBondContact N-O 2.89Å; C64-C163 HydrophobicContact CB-CB 3.49Å; C64-C163 VanDerWaalsContact CB-CB 3.49Å; C64-C163 WeakPolarHBondContact CB-SG 3.1Å; C64-C163 WeakPolarHBondContact SG-CA 3.49Å; C64-C163 WeakPolarHBondContact SG-CB 3.39Å; C64-C163 CovalentContact SG-SG 2.02Å; C64-C163 PolarHBondContact SG-SG 2.87Å; M155-C163 HydrophobicContact CE-CB 4.42Å; M155-C163 VanDerWaalsContact CE-SG 3.53Å; T157-C163 HydrophobicContact CG2-CB 4.17Å
164	I	75.9	Confident	71.9	Confident	52 Å²	52	58.1 Å²	58.1	27%	0.267	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.3	176.4	-56.7	179	0	0	0	109.7	A29 L30 H62 E162	A29-I164 HydrophobicContact CB-CG2 4.2Å; L30-I164 WeakPolarHBondContact O-CA 3.43Å; H62-I164 PolarHBondContact N-O 3.47Å; H62-I164 PolarHBondContact O-N 3.31Å; E162-I164 PolarHBondContact O-N 3.09Å
165	A	75.9	Confident	70.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.6	171.3	0	0	0	0	0	109.8	L30 I59 F61 M155 L167	L30-A165 HydrophobicContact CB-CB 4.45Å; L30-A165 PolarHBondContact N-O 3.33Å; L30-A165 PolarHBondContact O-N 3.27Å; I59-A165 HydrophobicContact CG2-CB 4.13Å; F61-A165 HydrophobicContact CD1-CB 3.65Å; F61-A165 HydrophobicContact CE1-CB 3.85Å; M155-A165 HydrophobicContact CE-CB 4.06Å; M155-A165 HydrophobicContact SD-CB 3.59Å; M155-A165 VanDerWaalsContact SD-CB 3.59Å; A165-L167 HydrophobicContact CB-CD1 4.49Å
166	W	78.9	Confident	69	Low	80 Å²	80	64 Å²	64	30%	0.303	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.7	173.4	-66.7	91.6	0	0	0	109.5	F28 A29 I59 T60 L168	F28-W166 CarbonylContact O-C 3.57Å; F28-W166 WeakPolarHBondContact O-CA 3.29Å; A29-W166 HydrophobicContact CB-CD2 4.26Å; A29-W166 HydrophobicContact CB-CE3 3.93Å; A29-W166 HydrophobicContact CB-CH2 4.12Å; A29-W166 HydrophobicContact CB-CZ2 4.41Å; A29-W166 HydrophobicContact CB-CZ3 3.87Å; I59-W166 CarbonylContact C-O 3.58Å; I59-W166 VanDerWaalsContact CA-O 3.27Å; I59-W166 WeakPolarHBondContact CA-O 3.43Å; T60-W166 PolarHBondContact N-O 3.34Å; T60-W166 PolarHBondContact O-N 2.93Å; W166-L168 HydrophobicContact CB-CD1 4.45Å
167	L	78.5	Confident	67	Low	1 Å²	1	72 Å²	72	1%	0.005	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.6	171.8	-86.1	59	0	0	0	109	H27 F28 L30 I57 I59 A165 P169	H27-L167 WeakPolarHBondContact CA-O 3.39Å; F28-L167 HydrophobicContact CB-CB 4.31Å; F28-L167 PolarHBondContact N-O 2.97Å; F28-L167 PolarHBondContact O-N 3.23Å; L30-L167 HydrophobicContact CD1-CD1 3.68Å; L30-L167 HydrophobicContact CD1-CD2 3.9Å; L30-L167 HydrophobicContact CD1-CG 4.48Å; L30-L167 HydrophobicContact CG-CD1 3.94Å; L30-L167 HydrophobicContact CG-CD2 4.29Å; I57-L167 HydrophobicContact CG2-CB 4.17Å; I57-L167 HydrophobicContact CG2-CD2 4.21Å; I57-L167 HydrophobicContact CG2-CG 3.88Å; I59-L167 HydrophobicContact CD1-CD1 4.48Å; I59-L167 HydrophobicContact CG1-CD1 4.08Å; I59-L167 HydrophobicContact CG1-CG 4.1Å; I59-L167 HydrophobicContact CG2-CD1 4.11Å; A165-L167 HydrophobicContact CB-CD1 4.49Å; L167-P169 VanDerWaalsContact C-CD 3.43Å; L167-P169 WeakPolarHBondContact O-CD 3.19Å
168	L	81.8	Confident	65.3	Low	62 Å²	62	77.7 Å²	77.7	33%	0.325	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	76.7	174.4	-57.4	90.5	0	0	0	108.3	S58 W166	S58-L168 PolarHBondContact N-O 3.08Å; S58-L168 PolarHBondContact O-N 3.16Å; W166-L168 HydrophobicContact CB-CD1 4.45Å
169	P	81.4	Confident	63.8	Low	3 Å²	3	80.6 Å²	80.6	2%	0.019	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	143.8	-180	27	-27	0	0	0	112.1	L25 F28 F42 L55 I57 L167	L25-P169 HydrophobicContact CB-CB 4.29Å; L25-P169 HydrophobicContact CB-CG 3.85Å; L25-P169 HydrophobicContact CD1-CB 4.13Å; L25-P169 HydrophobicContact CD1-CG 4.33Å; L25-P169 PolarHBondContact N-O 3.03Å; F28-P169 HydrophobicContact CD2-CG 3.77Å; F28-P169 HydrophobicContact CE2-CG 3.7Å; F42-P169 HydrophobicContact CE2-CB 4.32Å; F42-P169 HydrophobicContact CE2-CG 4.42Å; L55-P169 HydrophobicContact CD1-CB 4.32Å; I57-P169 HydrophobicContact CG1-CB 4.19Å; I57-P169 HydrophobicContact CG2-CB 4.39Å; L167-P169 VanDerWaalsContact C-CD 3.43Å; L167-P169 WeakPolarHBondContact O-CD 3.19Å
170	S	81.8	Confident	62.6	Low	41 Å²	41	73.7 Å²	73.7	29%	0.287	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.1	174.6	57.1	0	0	0	0	109.9	E23 L55 S56	E23-S170 WeakPolarHBondContact O-CA 3.34Å; L55-S170 WeakPolarHBondContact CA-O 3.49Å; S56-S170 PolarHBondContact N-O 3.46Å; S56-S170 PolarHBondContact O-N 2.9Å; S56-S170 PolarHBondContact O-OG 3.39Å; S56-S170 VanDerWaalsContact O-OG 3.05Å
171	V	80	Confident	61.3	Low	1 Å²	1	77.3 Å²	77.3	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	136.8	-178.8	-173.2	0	0	0	0	109	T22 E23 L25 F44 T53 K54 L55 H173	T22-V171 CarbonylContact C-O 3.57Å; T22-V171 VanDerWaalsContact CA-O 3.3Å; T22-V171 WeakPolarHBondContact CA-O 3.47Å; E23-V171 PolarHBondContact N-O 3.23Å; E23-V171 PolarHBondContact O-N 3.08Å; L25-V171 HydrophobicContact CD1-CG2 3.77Å; L25-V171 HydrophobicContact CG-CG2 4.38Å; F44-V171 HydrophobicContact CB-CG2 4.02Å; F44-V171 HydrophobicContact CD1-CG2 4.37Å; F44-V171 HydrophobicContact CD2-CG1 3.99Å; F44-V171 HydrophobicContact CD2-CG2 4.03Å; F44-V171 HydrophobicContact CE2-CG1 4.35Å; F44-V171 HydrophobicContact CG-CG2 3.89Å; T53-V171 HydrophobicContact CG2-CG1 3.66Å; K54-V171 CarbonylContact O-C 3.49Å; K54-V171 WeakPolarHBondContact O-CA 3.12Å; L55-V171 HydrophobicContact CD1-CG2 3.94Å; V171-H173 WeakPolarHBondContact CG1-NE2 3.13Å
172	R	78.1	Confident	59.9	Low	105 Å²	105	74.6 Å²	74.6	40%	0.396	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.6	173.2	170.7	-179.7	162.5	159.3	-0.6	109.3	T22 K54 D174	T22-R172 HydrophobicContact CG2-CB 4.31Å; T22-R172 HydrophobicContact CG2-CG 4.37Å; K54-R172 HydrophobicContact CB-CB 4.45Å; K54-R172 PolarHBondContact N-O 3.34Å; K54-R172 PolarHBondContact O-N 3.05Å; R172-D174 IonicContact CZ-OD1 3.84Å; R172-D174 VanDerWaalsContact CZ-OD1 3.23Å; R172-D174 IonicContact NE-OD1 3.68Å; R172-D174 PolarHBondContact NE-OD1 3.38Å; R172-D174 IonicContact NE-OD2 2.76Å; R172-D174 IonicContact NH2-OD1 3.23Å; R172-D174 PolarHBondContact NH2-OD1 3.07Å; R172-D174 IonicContact NH2-OD2 3.61Å
173	H	75.2	Confident	58.1	Low	8 Å²	8	71.1 Å²	71.1	4%	0.037	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.2	173.7	-57.1	111	0	0	0	109.7	P45 T50 T53 V171 I175	P45-H173 PolarHBondContact O-CE1 2.91Å; P45-H173 VanDerWaalsContact O-CE1 3.31Å; P45-H173 PolarHBondContact O-NE2 3.35Å; T50-H173 HydrophobicContact CG2-CB 3.9Å; T53-H173 PolarHBondContact OG1-CD2 2.9Å; V171-H173 WeakPolarHBondContact CG1-NE2 3.13Å; H173-I175 HydrophobicContact CB-CD1 4.31Å; H173-I175 HydrophobicContact CB-CG1 4.08Å
174	D	65.2	Low	56	Low	43 Å²	43	80.3 Å²	80.3	23%	0.23	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	102	167.7	-66.8	-42.6	0	0	0	108	F51 V52 K54 R172	F51-D174 PolarHBondContact N-O 2.74Å; F51-D174 VanDerWaalsContact N-O 3.17Å; V52-D174 PolarHBondContact O-N 3.28Å; K54-D174 IonicContact NZ-OD2 3.65Å; K54-D174 PolarHBondContact NZ-OD2 2.88Å; R172-D174 IonicContact CZ-OD1 3.84Å; R172-D174 VanDerWaalsContact CZ-OD1 3.23Å; R172-D174 IonicContact NE-OD1 3.68Å; R172-D174 PolarHBondContact NE-OD1 3.38Å; R172-D174 IonicContact NE-OD2 2.76Å; R172-D174 IonicContact NH2-OD1 3.23Å; R172-D174 PolarHBondContact NH2-OD1 3.07Å; R172-D174 IonicContact NH2-OD2 3.61Å
175	I	57.4	Low	53.5	Low	79 Å²	79	84.6 Å²	84.6	41%	0.405	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.9	-174	-57.5	168.5	0	0	0	109.4	H173	H173-I175 HydrophobicContact CB-CD1 4.31Å; H173-I175 HydrophobicContact CB-CG1 4.08Å
176	S	43.6	Very low	51.1	Low	60 Å²	60	94.6 Å²	94.6	42%	0.42	47%	0.472	S	S	.	.			trans	-95.3	119.4	173	48.1	0	0	0	0	111.3	I178	S176-I178 PolarHBondContact O-N 3.36Å
177	Y	34.7	Very low	48.6	Very low	198 Å²	198	98.1 Å²	98.1	78%	0.776	50%	0.497	S	S	*	.			trans	-76.9	103.5	172.9	-134	-96.2	0	0	0	109.3	D179	Y177-D179 HydrophobicContact CD1-CB 4.47Å; Y177-D179 WeakPolarHBondContact CD1-OD2 3.28Å; Y177-D179 WeakPolarHBondContact CE1-OD2 3.13Å; Y177-D179 PolarHBondContact O-N 3.16Å
178	I	34.5	Very low	46	Very low	147 Å²	147	102.4 Å²	102.4	75%	0.754	53%	0.532	S	S	*	.			trans	-94.9	75.1	171.6	-52.3	-179.3	0	0	0	108.1	S176	S176-I178 PolarHBondContact O-N 3.36Å
179	D	27.7	Very low	43.3	Very low	131 Å²	131	108.1 Å²	108.1	70%	0.701	56%	0.557	S	S	*	*			trans	-67.3	135.2	160.5	-98.1	-38.7	0	0	0	108.9	Y177 H181	Y177-D179 HydrophobicContact CD1-CB 4.47Å; Y177-D179 WeakPolarHBondContact CD1-OD2 3.28Å; Y177-D179 WeakPolarHBondContact CE1-OD2 3.13Å; Y177-D179 PolarHBondContact O-N 3.16Å; D179-H181 PolarHBondContact O-N 3.48Å
180	G	28.5	Very low	40.7	Very low	69 Å²	69	116.1 Å²	116.1	71%	0.711	60%	0.599	S	S	*	*	S	Bend	trans	-75	94.2	-165.9	0	0	0	0	0	114.5
181	H	25.1	Very low	38	Very low	176 Å²	176	125.9 Å²	125.9	82%	0.815	63%	0.629	S	S	*	*			trans	-154.2	96.8	153	-96.5	-70	0	0	0	111.5	D179 S183	D179-H181 PolarHBondContact O-N 3.48Å; H181-S183 PolarHBondContact O-N 3.4Å
182	I	24.7	Very low	35.4	Very low	150 Å²	150	134.2 Å²	134.2	77%	0.769	67%	0.668	S	S	*	*			trans	-77.6	83.5	157.1	-59.3	-180	0	0	0	107	Y184	I182-Y184 HydrophobicContact CG2-CD2 4.2Å; I182-Y184 HydrophobicContact CG2-CE2 4.09Å; I182-Y184 PolarHBondContact O-N 2.88Å
183	S	22.5	Very low	32.9	Very low	85 Å²	85	135.4 Å²	135.4	59%	0.594	68%	0.682	S	S	*	*			trans	-70.6	109.9	163.2	51.8	0	0	0	0	108.3	H181 N185	H181-S183 PolarHBondContact O-N 3.4Å; S183-N185 PolarHBondContact O-N 3.34Å
184	Y	24.4	Very low	30.7	Very low	195 Å²	195	143.4 Å²	143.4	77%	0.765	72%	0.72	S	S	*	*			trans	-66	84.5	168.1	-81.7	-92.2	0	0	0	109.6	I182 Y186	I182-Y184 HydrophobicContact CG2-CD2 4.2Å; I182-Y184 HydrophobicContact CG2-CE2 4.09Å; I182-Y184 PolarHBondContact O-N 2.88Å; Y184-Y186 PolarHBondContact O-N 3.08Å
185	N	24.1	Very low	28.7	Very low	143 Å²	143	146 Å²	146	77%	0.765	74%	0.741	S	S	*	*			trans	-70.5	85.7	167.6	-103.6	9.2	0	0	0	108.8	S183 N187	S183-N185 PolarHBondContact O-N 3.34Å; N185-N187 PolarHBondContact O-N 3.08Å
186	Y	24.3	Very low	27.2	Very low	210 Å²	210	149.6 Å²	149.6	82%	0.824	76%	0.759	S	S	*	*			trans	-62.6	96.1	167.7	-114	-90.5	0	0	0	109	Y184 A188	Y184-Y186 PolarHBondContact O-N 3.08Å; Y186-A188 PolarHBondContact O-N 3.16Å
187	N	27.1	Very low	26.3	Very low	154 Å²	154	152.2 Å²	152.2	82%	0.824	77%	0.772	S	S	*	*			trans	-69.7	98	166.1	-91.1	-7.1	0	0	0	108.4	N185 Q189	N185-N187 PolarHBondContact O-N 3.08Å; N187-Q189 PolarHBondContact O-N 2.86Å; N187-Q189 VanDerWaalsContact O-N 3.14Å
188	A	24.5	Very low	25.8	Very low	91 Å²	91	150.5 Å²	150.5	75%	0.752	77%	0.771	S	S	*	*			trans	-75.8	98.6	-177	0	0	0	0	0	111.7	Y186	Y186-A188 PolarHBondContact O-N 3.16Å
189	Q	24.8	Very low	25.4	Very low	181 Å²	181	151.7 Å²	151.7	85%	0.846	77%	0.774	S	S	*	*			trans	-161	147.6	156.7	-109	165.1	25.3	0	0	109.7	N187	N187-Q189 PolarHBondContact O-N 2.86Å; N187-Q189 VanDerWaalsContact O-N 3.14Å
190	L	25.8	Very low	25.1	Very low	172 Å²	172	154.4 Å²	154.4	90%	0.901	78%	0.779	S	S	*	*			trans	65.7	111.3	-173.5	-52.3	155.6	0	0	0	112.6
191	R	26.7	Very low	25.4	Very low	246 Å²	246	155.8 Å²	155.8	93%	0.928	78%	0.776	S	S	*	*			cis	-140.1	165.2	30.4	-72.1	-177.2	174.3	179.4	-1.2	114.2
192	H	24.4	Very low	25.4	Very low	175 Å²	175	155.8 Å²	155.8	81%	0.81	77%	0.774	S	S	*	*			trans	-77.1	160.9	170.7	-111.5	-99.3	0	0	0	113.5
193	N	25.6	Very low	25.5	Very low	130 Å²	130	154.9 Å²	154.9	70%	0.695	77%	0.769	S	S	*	*			trans	90.4	131.1	154.4	-60.4	-10.9	0	0	0	120.8
194	Q	29.1	Very low	25.6	Very low	177 Å²	177	154.6 Å²	154.6	83%	0.827	77%	0.772	S	S	*	*			trans	67.4	107.7	159.8	-65.1	161.2	-13.4	0	0	116.8
195	S	22.3	Very low	25.6	Very low	97 Å²	97	150.3 Å²	150.3	68%	0.678	77%	0.77	S	S	*	*				72.2	107.8	52.1	80.5	0	0	0	0	113.5
196	I	27.3	Very low	25.8	Very low	154 Å²	154	150.4 Å²	150.4	79%	0.79	77%	0.77	S	S	*	*				-177.3	122.3	92.3	-85.3	154.7	0	0	0	105.2
197	V	24.3	Very low	25.9	Very low	115 Å²	115	148 Å²	148	70%	0.697	77%	0.766	S	S	*	*				91.7	114.1	66.6	166.5	0	0	0	0	114.8
198	H	23.7	Very low	25.9	Very low	163 Å²	163	148.7 Å²	148.7	76%	0.755	76%	0.764	S	S	*	*			trans	60.2	158.6	161.1	-66.4	-40.2	0	0	0	119.9
199	E	26.1	Very low	25.9	Very low	171 Å²	171	151.8 Å²	151.8	80%	0.799	77%	0.767	S	S	*	*			cis	-149.6	-158.9	3.3	-137.6	156.5	-156.4	0	0	115.6
200	K	20.9	Very low	26.3	Very low	188 Å²	188	147.9 Å²	147.9	82%	0.817	76%	0.757	S	S	*	*			trans	-161.9	-174.9	-168.5	-123.8	-168	-179.6	179	0	108.6
201	P	36.4	Very low	26.3	Very low	98 Å²	98	144.9 Å²	144.9	64%	0.636	75%	0.75	S	S	*	*			cis	-127.9	-136	-40	27.2	-1.2	0	0	0	111.4
202	F	24.3	Very low	26.3	Very low	176 Å²	176	144.2 Å²	144.2	77%	0.772	75%	0.748	S	S	*	*			trans	91.8	144.4	160.1	-84.9	-140.9	0	0	0	120.1
203	I	25.9	Very low	26.3	Very low	131 Å²	131	141.4 Å²	141.4	67%	0.672	74%	0.743	S	S	*	*			cis	-164.4	156.4	-22.6	-139.4	-168.2	0	0	0	113.3
204	A	25.7	Very low	26.2	Very low	80 Å²	80	141.9 Å²	141.9	66%	0.661	74%	0.744	S	S	*	*			trans	41.2	163.3	143.2	0	0	0	0	0	123.4
205	S	25.1	Very low	26.1	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	75%	0.745	S	S	*	*			cis	-178	173.2	-14.8	40.3	0	0	0	0	111.7
206	I	27.4	Very low	26.1	Very low	146 Å²	146	142.1 Å²	142.1	75%	0.749	75%	0.747	S	S	*	*			trans	136.1	114.9	139.5	-70.3	169.8	0	0	0	118
207	H	26.1	Very low	26	Very low	160 Å²	160	139.3 Å²	139.3	74%	0.741	74%	0.741	S	S	*	*			trans	46.6	161	141.3	-66.2	-118.4	0	0	0	122.7
208	E	27.8	Very low	26.2	Very low	167 Å²	167	142.6 Å²	142.6	78%	0.78	75%	0.748	S	S	*	*			cis	-149.7	-153	13.2	-150.8	138.5	-110.7	0	0	115.9
209	L	23.3	Very low	26.3	Very low	156 Å²	156	140.2 Å²	140.2	82%	0.817	75%	0.75	S	S	*	*			trans	-129	-160.6	-157.7	-106.9	79.1	0	0	0	114.2
210	P	34.2	Very low	26.2	Very low	100 Å²	100	139.7 Å²	139.7	65%	0.649	75%	0.747	S	S	*	*				-142.2	169.7	-63.4	43.2	-25.6	0	0	0	119.3
211	S	25.2	Very low	26.6	Very low	108 Å²	108	138 Å²	138	76%	0.755	74%	0.742	S	S	*	*			trans	71	140.6	137.5	72.1	0	0	0	0	126.7
212	R	27.5	Very low	26	Very low	233 Å²	233	139.3 Å²	139.3	88%	0.879	74%	0.738	S	S	*	*			trans	177.1	120.5	138.7	-97.2	-169.8	176.2	-171.5	-1.4	110.6
213	T	24.3	Very low	26.1	Very low	115 Å²	115	137.6 Å²	137.6	71%	0.706	74%	0.735	S	S	*	*				70.6	134.2	75.2	64.1	0	0	0	0	115.7
214	I	23.4	Very low	26	Very low	140 Å²	140	139.3 Å²	139.3	72%	0.718	74%	0.739	S	S	*	*			cis	-164.9	-169.4	2.5	-138.1	154.8	0	0	0	112.6
215	F	26.8	Very low	26	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.842	74%	0.735	S	S	*	*			trans	87.5	124.1	177.6	-62.2	-78.5	0	0	0	116.6
216	A	22.9	Very low	26	Very low	87 Å²	87	146 Å²	146	72%	0.719	74%	0.736	S	S	*	*			cis	97.4	139.7	28.9	0	0	0	0	0	113.4
217	S	25	Very low	26	Very low	95 Å²	95	147.8 Å²	147.8	66%	0.664	74%	0.738	S	S	*	*			cis	-166.1	166.2	5.3	44.7	0	0	0	0	113.9
218	H	27.7	Very low	25.9	Very low	185 Å²	185	148.8 Å²	148.8	86%	0.856	74%	0.74	S	S	*	*			trans	75.1	151	161	-62.4	-25.8	0	0	0	118.9
219	S	26.1	Very low	25.7	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	74%	0.743	S	S	*	*			cis	-140.3	158.6	1.2	57.6	0	0	0	0	113.9
220	E	24.4	Very low	25.8	Very low	159 Å²	159	155.7 Å²	155.7	74%	0.743	75%	0.748	S	S	*	*			trans	-70.7	168.7	171.2	-55.5	-179.9	127.3	0	0	111.6
221	E	28.1	Very low	25.3	Very low	152 Å²	152	160.3 Å²	160.3	71%	0.71	76%	0.758	S	S	*	*				-177.6	170.7	71.1	-74.9	-154	-171.8	0	0	111.5
222	K	25.2	Very low	25.3	Very low	126 Å²	126	161 Å²	161	55%	0.548	76%	0.76	S	S	.	*			cis	-170.6	167.4	-27.1	-98	-175.7	-154.6	138.6	0	109
223	I	25.7	Very low	25.1	Very low	140 Å²	140	158.7 Å²	158.7	72%	0.718	76%	0.757	S	S	*	*			trans	70.1	134.5	149.6	-72.7	160.4	0	0	0	119.3
224	F	24.9	Very low	25	Very low	168 Å²	168	162.7 Å²	162.7	74%	0.737	76%	0.76	S	S	*	*			cis	-160	138.2	-8.6	-125.3	-155	0	0	0	114.8
225	H	25.7	Very low	25	Very low	125 Å²	125	163.2 Å²	163.2	58%	0.579	76%	0.76	S	S	*	*				59.2	111.9	129.6	-92.8	-44.9	0	0	0	127.1
226	R	23.8	Very low	25	Very low	200 Å²	200	159.1 Å²	159.1	76%	0.755	75%	0.754	S	S	*	*				97.7	144.6	106.7	-128.3	178.1	-168.7	167	1.7	122.5
227	K	27.3	Very low	25.2	Very low	183 Å²	183	161.6 Å²	161.6	80%	0.796	76%	0.755	S	S	*	*			trans	75.6	158	159.2	-62.8	178.2	-178.6	173.6	0	117.7
228	K	23.9	Very low	25.1	Very low	180 Å²	180	162.5 Å²	162.5	78%	0.783	76%	0.756	S	S	*	*			cis	-178.3	131	-44.1	-133.8	-177.4	-178.7	-179.7	0	107.5
229	R	23.4	Very low	25.1	Very low	224 Å²	224	162.1 Å²	162.1	85%	0.845	76%	0.755	S	S	*	*			trans	34	123.5	159.2	-65.8	179.6	171.9	177	-5.1	119.9
230	R	25.6	Very low	25	Very low	244 Å²	244	162 Å²	162	92%	0.921	75%	0.754	S	S	*	*				175.2	135.1	108.9	-98.2	168.7	173.1	163.5	-3.5	113.1
231	K	24.6	Very low	25.2	Very low	197 Å²	197	160.3 Å²	160.3	86%	0.857	76%	0.755	S	S	*	*			trans	-97.6	145.1	146.4	-74	-173.5	176.2	-175.8	0	108.1
232	P	25.6	Very low	25	Very low	122 Å²	122	156.9 Å²	156.9	79%	0.792	75%	0.752	S	S	*	*			trans	-101.4	167.8	153.2	35	-26.9	0	0	0	111.5
233	F	22.5	Very low	25.2	Very low	186 Å²	186	157.1 Å²	157.1	82%	0.816	76%	0.76	S	S	*	*			trans	-127.4	-152.1	-179.4	-120.3	-86.8	0	0	0	109.3
234	Y	23.2	Very low	25.1	Very low	199 Å²	199	158.5 Å²	158.5	78%	0.78	76%	0.763	S	S	*	*			trans	90.4	134.5	170	-63.4	-83.1	0	0	0	116.8
235	H	23.5	Very low	25.4	Very low	151 Å²	151	156.1 Å²	156.1	70%	0.699	76%	0.764	S	S	*	*			cis	-167.6	151.8	-15.5	-151.1	-127.4	0	0	0	113.2
236	S	26.4	Very low	25.3	Very low	105 Å²	105	157.9 Å²	157.9	73%	0.734	78%	0.775	S	S	*	*			trans	160.2	142.9	142.5	46	0	0	0	0	110.3
237	L	26.2	Very low	25.4	Very low	139 Å²	139	155.8 Å²	155.8	73%	0.728	77%	0.773	S	S	*	*			cis	-157	137.9	-10.7	-147.1	91.5	0	0	0	109.6
238	V	24.1	Very low	25.2	Very low	115 Å²	115	151.8 Å²	151.8	70%	0.697	77%	0.768	S	S	*	*			trans	62.5	137.6	152.2	166.5	0	0	0	0	117.4
239	Q	27.9	Very low	25.5	Very low	177 Å²	177	148 Å²	148	83%	0.827	76%	0.762	S	S	*	*			cis	-149.3	151.9	29.4	-151.7	144.8	-4.1	0	0	114
240	S	23.8	Very low	25.5	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	76%	0.761	S	S	*	*			trans	-7.1	155.9	156.3	-79.8	0	0	0	0	122.1
241	T	27.7	Very low	25.6	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	76%	0.756	S	S	*	*			cis	-140.1	151.6	12.1	41.8	0	0	0	0	110.8
242	A	24.3	Very low	25.7	Very low	79 Å²	79	136.3 Å²	136.3	65%	0.653	75%	0.747	S	S	*	*				60.5	132.4	70.7	0	0	0	0	0	114.1
243	D	28.6	Very low	26	Very low	132 Å²	132	136 Å²	136	71%	0.706	75%	0.745	S	S	*	*			cis	-149.5	145.6	12.5	-98.6	-55.6	0	0	0	115.6
244	Q	25.1	Very low	26.2	Very low	169 Å²	169	132.5 Å²	132.5	79%	0.79	74%	0.744	S	S	*	*			trans	64.2	147.6	133.5	-69.2	179.8	48.6	0	0	127.8
245	P	29.9	Very low	26.3	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	75%	0.746	S	S	*	*			trans	-124.3	170.2	177	44.3	-32.6	0	0	0	116.4
246	M	24.3	Very low	26.4	Very low	163 Å²	163	127.2 Å²	127.2	80%	0.803	75%	0.753	S	S	*	*			trans	-147	132.9	159	-72.8	-161.1	80.3	0	0	115.1
247	H	25.6	Very low	26.3	Very low	156 Å²	156	128.7 Å²	128.7	72%	0.722	76%	0.757	S	S	*	*			trans	33.2	117.9	134.1	-63.5	-78	0	0	0	120.8
248	S	22.7	Very low	26.3	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	77%	0.767	S	S	*	*				78.6	157.4	61.8	79.9	0	0	0	0	114.9
249	P	30.2	Very low	26.3	Very low	101 Å²	101	130.6 Å²	130.6	66%	0.656	77%	0.766	S	S	*	*			cis	-143	-169.5	3.6	39.7	-17.4	0	0	0	116.7
250	L	24.6	Very low	26.2	Very low	159 Å²	159	130.4 Å²	130.4	83%	0.832	77%	0.77	S	S	*	*			trans	69.1	152	163.7	-59.4	156.8	0	0	0	116.8
251	I	27.6	Very low	26.2	Very low	157 Å²	157	129.5 Å²	129.5	81%	0.805	76%	0.764	S	S	*	*			cis	-137	146.6	8.2	-61.4	166.8	0	0	0	110.8
252	P	25.9	Very low	26.1	Very low	104 Å²	104	132 Å²	132	68%	0.675	77%	0.773	S	S	*	*			trans	-114.1	-172.5	170	42.4	-33.6	0	0	0	113.4
253	P	32.5	Very low	26.2	Very low	115 Å²	115	134.3 Å²	134.3	75%	0.747	78%	0.775	S	S	*	*			cis	-133.9	170	-34.5	35.1	-17.6	0	0	0	115
254	S	26.6	Very low	26.4	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	77%	0.774	S	S	*	*			trans	-170.2	112.7	139.1	42.3	0	0	0	0	108.7
255	S	25.6	Very low	26.8	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	76%	0.76	S	S	*	*				86	77.4	57.5	75.6	0	0	0	0	114.4
256	S	25.1	Very low	27.2	Very low	120 Å²	120	134.5 Å²	134.5	84%	0.839	77%	0.765	S	S	*	*			trans	-115.8	127.8	149.2	58.4	0	0	0	0	108.6
257	T	23.9	Very low	28	Very low	136 Å²	136	130.4 Å²	130.4	83%	0.834	75%	0.746	S	S	*	*			trans	-77.1	133.9	176.9	46	0	0	0	0	111.3
258	E	26.3	Very low	29.1	Very low	197 Å²	197	130.2 Å²	130.2	92%	0.921	74%	0.739	S	S	*	*			trans	-153.7	166.1	130.1	-124.8	169.2	-148.6	0	0	112.3
259	S	25.3	Very low	30.2	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	74%	0.74	S	S	*	*			trans	-90.9	145.3	-160.8	53.5	0	0	0	0	114.6	S261	S259-S261 PolarHBondContact O-N 3.41Å
260	N	23.9	Very low	31.2	Very low	172 Å²	172	127.8 Å²	127.8	92%	0.92	71%	0.713	S	S	*	*			trans	-54.1	110.9	163.6	-75.5	-30.2	0	0	0	111.6
261	S	25	Very low	32.4	Very low	93 Å²	93	123 Å²	123	65%	0.65	69%	0.693	S	S	*	*			trans	-145.2	125.3	150	60.1	0	0	0	0	110.2	S259 N263	S259-S261 PolarHBondContact O-N 3.41Å; S261-N263 PolarHBondContact O-N 3.14Å
262	N	25.3	Very low	33.5	Very low	176 Å²	176	118 Å²	118	94%	0.941	67%	0.665	S	S	*	*			trans	-76.2	112.1	174.7	-73.5	-11.4	0	0	0	108.2
263	N	27.2	Very low	34.3	Very low	127 Å²	127	121 Å²	121	68%	0.679	68%	0.675	S	S	*	*			trans	-144.2	112.1	179.7	-153.7	-2.1	0	0	0	110.7	S261 Y265	S261-N263 PolarHBondContact O-N 3.14Å; N263-Y265 VanDerWaalsContact C-N 3.35Å; N263-Y265 PolarHBondContact O-N 3.2Å; N263-Y265 VanDerWaalsContact O-N 3.17Å
264	P	31.1	Very low	35.3	Very low	108 Å²	108	119.4 Å²	119.4	70%	0.701	66%	0.662	S	S	*	*			trans	-91	33.7	-159.7	37.1	-38.4	0	0	0	115.1
265	Y	33.8	Very low	36.6	Very low	126 Å²	126	116.2 Å²	116.2	49%	0.494	64%	0.64	S	S	.	*			trans	-132.5	92	-174.1	-62.1	-69.4	0	0	0	113.3	N263 I267	N263-Y265 VanDerWaalsContact C-N 3.35Å; N263-Y265 PolarHBondContact O-N 3.2Å; N263-Y265 VanDerWaalsContact O-N 3.17Å; Y265-I267 PolarHBondContact O-N 2.8Å
266	H	39.9	Very low	38.4	Very low	187 Å²	187	113.2 Å²	113.2	87%	0.866	62%	0.618	S	S	*	*			trans	-75.6	102.5	166.6	-89.6	-70.8	0	0	0	110.7
267	I	40.3	Very low	40.7	Very low	77 Å²	77	108.4 Å²	108.4	40%	0.395	58%	0.582	S	S	.	*			trans	-65.8	131.6	168.6	-57.7	175.4	0	0	0	108.8	Y265 L290	Y265-I267 PolarHBondContact O-N 2.8Å; I267-L290 HydrophobicContact CG2-CB 4.34Å
268	R	48.7	Very low	43.2	Very low	153 Å²	153	105.5 Å²	105.5	58%	0.577	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.2	132.2	172.5	-66.9	-173.7	179.7	-170.5	1.5	110.5	L288 Y289 L290	R268-L288 PolarHBondContact N-O 3.31Å; R268-Y289 HydrophobicContact CB-CD1 4.06Å; R268-Y289 HydrophobicContact CB-CE1 4.23Å; R268-Y289 WeakPolarHBondContact O-CA 3.39Å; R268-L290 PolarHBondContact O-N 3.1Å
269	N	44.8	Very low	45.7	Very low	131 Å²	131	96.5 Å²	96.5	70%	0.701	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	132.1	170	-69.2	1.7	0	0	0	109.3
270	L	51.5	Low	48.3	Very low	17 Å²	17	96.8 Å²	96.8	9%	0.089	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	104.4	-179.7	-163.6	72.8	0	0	0	109.2	F277 Y289 L290 L291 I446	L270-F277 HydrophobicContact CD1-CD1 4.22Å; L270-F277 HydrophobicContact CD1-CE1 4.19Å; L270-F277 HydrophobicContact CD1-CZ 4.44Å; L270-F277 HydrophobicContact CD2-CE1 3.84Å; L270-F277 HydrophobicContact CD2-CZ 3.98Å; L270-Y289 HydrophobicContact CB-CD1 4.22Å; L270-Y289 HydrophobicContact CD1-CD1 4.01Å; L270-Y289 HydrophobicContact CD1-CE1 4.32Å; L270-Y289 HydrophobicContact CD2-CD1 4.35Å; L270-Y289 HydrophobicContact CD2-CG 4.34Å; L270-Y289 HydrophobicContact CG-CD1 4.45Å; L270-L290 PolarHBondContact N-O 2.94Å; L270-L291 HydrophobicContact CD2-CD2 4.26Å; L270-I446 HydrophobicContact CD2-CD1 3.48Å; L270-I446 VanDerWaalsContact CD2-CD1 3.48Å
271	S	51.2	Low	50.6	Low	59 Å²	59	88.6 Å²	88.6	41%	0.413	47%	0.466	S	S	.	.			trans	-91.4	144.7	175	56	0	0	0	0	110.6	L273 V274	S271-L273 PolarHBondContact O-N 3.18Å; S271-V274 PolarHBondContact O-N 3.37Å
272	F	50.4	Low	52.9	Low	50 Å²	50	86.1 Å²	86.1	22%	0.219	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.3	-178.3	-56.1	-64.5	0	0	0	114.7	V274 A292 M297 I300 I446	F272-V274 PolarHBondContact O-N 3.14Å; F272-A292 WeakPolarHBondContact CE2-O 3.3Å; F272-A292 WeakPolarHBondContact CZ-O 3.42Å; F272-M297 HydrophobicContact CE1-CE 3.93Å; F272-M297 HydrophobicContact CE2-CE 3.94Å; F272-M297 HydrophobicContact CZ-CE 3.44Å; F272-M297 VanDerWaalsContact CZ-CE 3.44Å; F272-M297 HydrophobicContact CZ-SD 4.14Å; F272-I300 HydrophobicContact CE1-CD1 4.16Å; F272-I300 HydrophobicContact CE1-CG1 4.38Å; F272-I300 HydrophobicContact CZ-CD1 4.11Å; F272-I446 HydrophobicContact CD1-CG2 3.94Å; F272-I446 HydrophobicContact CE1-CG2 3.94Å
273	L	42.7	Very low	54.9	Low	169 Å²	169	80.5 Å²	80.5	89%	0.885	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-6.7	173.9	-69.9	166.4	0	0	0	113.4	S271	S271-L273 PolarHBondContact O-N 3.18Å
274	V	52.1	Low	56.6	Low	80 Å²	80	79.2 Å²	79.2	49%	0.485	42%	0.416	S	S	.	.	S	Bend	trans	-115.8	50.3	-177.1	-161.1	0	0	0	0	110.6	S271 F272	S271-V274 PolarHBondContact O-N 3.37Å; F272-V274 PolarHBondContact O-N 3.14Å
275	S	55.2	Low	58.5	Low	46 Å²	46	76.8 Å²	76.8	32%	0.322	40%	0.395	S	S	.	.			trans	-126.3	133	172.5	68.2	0	0	0	0	111.1
276	P	61.9	Low	60.2	Low	56 Å²	56	71.8 Å²	71.8	36%	0.364	38%	0.381	S	S	.	.	S	Bend	cis	-63.3	152.3	-4.7	25.9	-34.1	0	0	0	113	R443 L444 V445	P276-R443 HydrophobicContact CB-CG 4.17Å; P276-L444 CarbonylContact C-O 3.53Å; P276-L444 VanDerWaalsContact CA-O 3.26Å; P276-L444 WeakPolarHBondContact CA-O 3.37Å; P276-V445 HydrophobicContact CB-CG2 3.72Å; P276-V445 HydrophobicContact CG-CG2 4.5Å
277	F	73.2	Confident	61.5	Low	18 Å²	18	66.1 Å²	66.1	8%	0.079	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.3	162.1	65	-83.4	0	0	0	110.3	L270 L279 L444 I446	L270-F277 HydrophobicContact CD1-CD1 4.22Å; L270-F277 HydrophobicContact CD1-CE1 4.19Å; L270-F277 HydrophobicContact CD1-CZ 4.44Å; L270-F277 HydrophobicContact CD2-CE1 3.84Å; L270-F277 HydrophobicContact CD2-CZ 3.98Å; F277-L279 HydrophobicContact CD2-CB 4.49Å; F277-L279 HydrophobicContact CE2-CD2 4.47Å; F277-L444 HydrophobicContact CD1-CB 4.3Å; F277-L444 HydrophobicContact CE1-CB 3.82Å; F277-L444 HydrophobicContact CE2-CB 4.07Å; F277-L444 HydrophobicContact CE2-CD1 3.72Å; F277-L444 HydrophobicContact CZ-CB 3.7Å; F277-L444 HydrophobicContact CZ-CD1 3.75Å; F277-L444 HydrophobicContact CZ-CG 4.39Å; F277-L444 PolarHBondContact N-O 2.92Å; F277-L444 PolarHBondContact O-N 3.47Å; F277-I446 HydrophobicContact CE1-CD1 3.83Å; F277-I446 HydrophobicContact CE1-CG1 4.09Å; F277-I446 HydrophobicContact CZ-CD1 4.46Å
278	D	78.3	Confident	62.5	Low	76 Å²	76	63.8 Å²	63.8	41%	0.406	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.7	176.9	-64.1	-81.9	0	0	0	110.1	Y441 L442 R443	D278-Y441 HydrophobicContact CB-CE2 4.39Å; D278-Y441 WeakPolarHBondContact CB-OH 3.49Å; D278-Y441 PolarHBondContact OD1-OH 3.3Å; D278-L442 CarbonylContact C-O 3.43Å; D278-L442 VanDerWaalsContact CA-O 3.29Å; D278-L442 WeakPolarHBondContact CA-O 3.34Å; D278-R443 WeakPolarHBondContact OD1-CB 3.32Å; D278-R443 VanDerWaalsContact OD1-CD 3.31Å; D278-R443 WeakPolarHBondContact OD1-CD 3.34Å; D278-R443 WeakPolarHBondContact OD1-CG 3.22Å; D278-R443 IonicContact OD1-NE 3.63Å; D278-R443 PolarHBondContact OD1-NE 3.05Å; D278-R443 IonicContact OD2-NE 2.68Å
279	L	77.7	Confident	63.4	Low	7 Å²	7	57 Å²	57	4%	0.037	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	112.1	-169.5	-177.5	63.5	0	0	0	112.7	F277 L281 Y289 I431 Y441 L442 L444	F277-L279 HydrophobicContact CD2-CB 4.49Å; F277-L279 HydrophobicContact CE2-CD2 4.47Å; L279-L281 HydrophobicContact CD2-CD1 4.34Å; L279-L281 HydrophobicContact CD2-CD2 4.41Å; L279-L281 HydrophobicContact CD2-CG 4.31Å; L279-L281 HydrophobicContact CG-CD2 4.39Å; L279-L281 HydrophobicContact CG-CG 4.2Å; L279-Y289 WeakPolarHBondContact CD1-OH 3.31Å; L279-Y289 HydrophobicContact CD2-CE2 4.32Å; L279-I431 HydrophobicContact CD2-CD1 4.2Å; L279-I431 HydrophobicContact CD2-CG2 4.36Å; L279-Y441 CarbonylContact O-C 3.57Å; L279-L442 HydrophobicContact CB-CB 4.21Å; L279-L442 HydrophobicContact CD2-CD1 4.28Å; L279-L442 PolarHBondContact N-O 2.96Å; L279-L442 WeakPolarHBondContact O-CB 3.33Å; L279-L442 PolarHBondContact O-N 3.41Å; L279-L444 HydrophobicContact CD2-CD1 4.46Å
280	E	80.3	Confident	64.4	Low	104 Å²	104	52.1 Å²	52.1	49%	0.486	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.9	168.3	-171	176.1	-167.4	0	0	110.8	R287	E280-R287 PolarHBondContact O-NH1 3.14Å; E280-R287 PolarHBondContact O-NH2 3.06Å
281	L	72.4	Confident	65.2	Low	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.6	176.2	-67.6	173.6	0	0	0	110.3	L279 E285 R287 I431 N433 A439 V440 L442	L279-L281 HydrophobicContact CD2-CD1 4.34Å; L279-L281 HydrophobicContact CD2-CD2 4.41Å; L279-L281 HydrophobicContact CD2-CG 4.31Å; L279-L281 HydrophobicContact CG-CD2 4.39Å; L279-L281 HydrophobicContact CG-CG 4.2Å; L281-E285 HydrophobicContact CB-CB 4.38Å; L281-E285 HydrophobicContact CD2-CB 4.41Å; L281-E285 HydrophobicContact CD2-CG 4.27Å; L281-R287 HydrophobicContact CD2-CB 4.37Å; L281-R287 HydrophobicContact CD2-CG 3.77Å; L281-I431 HydrophobicContact CD1-CG2 4Å; L281-N433 HydrophobicContact CB-CB 3.83Å; L281-N433 HydrophobicContact CD1-CB 4.21Å; L281-N433 PolarHBondContact O-ND2 3.3Å; L281-A439 CarbonylContact O-C 3.57Å; L281-A439 VanDerWaalsContact O-CA 3.28Å; L281-A439 WeakPolarHBondContact O-CA 3.45Å; L281-V440 PolarHBondContact N-O 2.82Å; L281-V440 PolarHBondContact O-N 2.93Å; L281-L442 HydrophobicContact CD1-CD1 4.25Å
282	A	72.4	Confident	65.9	Low	42 Å²	42	51.7 Å²	51.7	35%	0.347	29%	0.291	S	S	.	.			trans	-64.4	168.6	172.5	0	0	0	0	0	111.6	M284 E285 N433	A282-M284 PolarHBondContact O-N 3.27Å; A282-E285 HydrophobicContact CB-CB 4.05Å; A282-E285 PolarHBondContact N-OE2 3.05Å; A282-E285 VanDerWaalsContact O-CB 3.24Å; A282-E285 WeakPolarHBondContact O-CB 3.31Å; A282-E285 PolarHBondContact O-N 3.1Å; A282-N433 PolarHBondContact O-ND2 3.01Å
283	P	67.8	Low	66.6	Low	57 Å²	57	50.2 Å²	50.2	37%	0.37	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	133.1	178.2	-19.9	30.6	0	0	0	111.5	E285 A435 S436	P283-E285 PolarHBondContact O-N 3.18Å; P283-E285 VanDerWaalsContact O-N 3.11Å; P283-A435 CarbonylContact C-O 3.53Å; P283-A435 WeakPolarHBondContact CA-O 3.37Å; P283-S436 WeakPolarHBondContact CB-O 3.12Å
284	M	63	Low	67.5	Low	100 Å²	100	47.4 Å²	47.4	49%	0.493	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	8.9	-172.1	-53.8	-93.1	70.3	0	0	116.1	A282 N433 Q434 A435	A282-M284 PolarHBondContact O-N 3.27Å; M284-N433 WeakPolarHBondContact CA-O 3.46Å; M284-Q434 VanDerWaalsContact CE-O 3.25Å; M284-Q434 WeakPolarHBondContact CE-O 3.39Å; M284-A435 PolarHBondContact N-O 2.77Å
285	E	70.5	Confident	67.6	Low	58 Å²	58	48 Å²	48	27%	0.271	27%	0.269	S	S	.	.			trans	-76.6	135	-179.8	-164.2	-169.9	170.3	0	0	111.7	L281 A282 P283 R287 N433	L281-E285 HydrophobicContact CB-CB 4.38Å; L281-E285 HydrophobicContact CD2-CB 4.41Å; L281-E285 HydrophobicContact CD2-CG 4.27Å; A282-E285 HydrophobicContact CB-CB 4.05Å; A282-E285 PolarHBondContact N-OE2 3.05Å; A282-E285 VanDerWaalsContact O-CB 3.24Å; A282-E285 WeakPolarHBondContact O-CB 3.31Å; A282-E285 PolarHBondContact O-N 3.1Å; P283-E285 PolarHBondContact O-N 3.18Å; P283-E285 VanDerWaalsContact O-N 3.11Å; E285-R287 IonicContact OE1-CZ 3.23Å; E285-R287 IonicContact OE1-NE 3.88Å; E285-R287 PolarHBondContact OE1-NE 3.45Å; E285-R287 IonicContact OE1-NH2 3.93Å; E285-R287 PolarHBondContact OE1-NH2 3.14Å; E285-R287 IonicContact OE2-CZ 2.75Å; E285-R287 IonicContact OE2-NE 2.6Å; E285-R287 IonicContact OE2-NH2 2.72Å; E285-R287 PolarHBondContact OE2-NH2 3.22Å; E285-N433 PolarHBondContact O-N 3.01Å
286	G	69.3	Low	67.8	Low	20 Å²	20	51.8 Å²	51.8	21%	0.206	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.6	169.6	0	0	0	0	0	112.9	I431	G286-I431 CarbonylContact C-O 3.28Å; G286-I431 WeakPolarHBondContact CA-O 3.42Å
287	R	68.1	Low	67.7	Low	69 Å²	69	49.8 Å²	49.8	26%	0.26	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.6	-176.9	-67	-178.3	-173.8	149.3	15.8	111.2	E280 L281 E285 Y289 Y430 I431	E280-R287 PolarHBondContact O-NH1 3.14Å; E280-R287 PolarHBondContact O-NH2 3.06Å; L281-R287 HydrophobicContact CD2-CB 4.37Å; L281-R287 HydrophobicContact CD2-CG 3.77Å; E285-R287 IonicContact OE1-CZ 3.23Å; E285-R287 IonicContact OE1-NE 3.88Å; E285-R287 PolarHBondContact OE1-NE 3.45Å; E285-R287 IonicContact OE1-NH2 3.93Å; E285-R287 PolarHBondContact OE1-NH2 3.14Å; E285-R287 IonicContact OE2-CZ 2.75Å; E285-R287 IonicContact OE2-NE 2.6Å; E285-R287 IonicContact OE2-NH2 2.72Å; E285-R287 PolarHBondContact OE2-NH2 3.22Å; R287-Y289 HydrophobicContact CB-CE2 4.04Å; R287-Y430 WeakPolarHBondContact O-CD2 3.28Å; R287-I431 PolarHBondContact N-O 2.96Å; R287-I431 PolarHBondContact O-N 2.9Å
288	L	61.5	Low	67	Low	27 Å²	27	52.3 Å²	52.3	14%	0.141	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.8	-176.8	-171	70	0	0	0	110.7	R268 Y428 Y430	R268-L288 PolarHBondContact N-O 3.31Å; L288-Y428 HydrophobicContact CD2-CD1 4.32Å; L288-Y428 HydrophobicContact CG-CD1 4.34Å; L288-Y430 HydrophobicContact CB-CD2 4.21Å; L288-Y430 HydrophobicContact CD1-CD2 4.01Å; L288-Y430 HydrophobicContact CD1-CG 4.38Å
289	Y	66.7	Low	66.3	Low	10 Å²	10	49.2 Å²	49.2	4%	0.039	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.6	179.4	-62.3	-87.1	0	0	0	110.7	R268 L270 L279 R287 Y428 L429 I431	R268-Y289 HydrophobicContact CB-CD1 4.06Å; R268-Y289 HydrophobicContact CB-CE1 4.23Å; R268-Y289 WeakPolarHBondContact O-CA 3.39Å; L270-Y289 HydrophobicContact CB-CD1 4.22Å; L270-Y289 HydrophobicContact CD1-CD1 4.01Å; L270-Y289 HydrophobicContact CD1-CE1 4.32Å; L270-Y289 HydrophobicContact CD2-CD1 4.35Å; L270-Y289 HydrophobicContact CD2-CG 4.34Å; L270-Y289 HydrophobicContact CG-CD1 4.45Å; L279-Y289 WeakPolarHBondContact CD1-OH 3.31Å; L279-Y289 HydrophobicContact CD2-CE2 4.32Å; R287-Y289 HydrophobicContact CB-CE2 4.04Å; Y289-Y428 WeakPolarHBondContact O-CA 3.34Å; Y289-L429 PolarHBondContact N-O 2.91Å; Y289-L429 PolarHBondContact O-N 2.87Å; Y289-I431 HydrophobicContact CD2-CD1 4.37Å; Y289-I431 HydrophobicContact CE2-CD1 4.13Å
290	L	66.7	Low	65.9	Low	29 Å²	29	48.9 Å²	48.9	15%	0.152	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.7	167.8	177.4	67	0	0	0	109.2	I267 R268 L270 N426 Y428	I267-L290 HydrophobicContact CG2-CB 4.34Å; R268-L290 PolarHBondContact O-N 3.1Å; L270-L290 PolarHBondContact N-O 2.94Å; L290-N426 HydrophobicContact CD1-CB 3.67Å; L290-Y428 HydrophobicContact CB-CD1 4.37Å; L290-Y428 HydrophobicContact CB-CE1 4.26Å; L290-Y428 HydrophobicContact CD1-CD1 4.03Å; L290-Y428 HydrophobicContact CD1-CE1 3.62Å; L290-Y428 HydrophobicContact CG-CE1 4.5Å
291	L	68.9	Low	65.3	Low	7 Å²	7	44.3 Å²	44.3	4%	0.037	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.9	172.3	-67.2	170.2	0	0	0	109.3	L270 I300 L417 H427 L429 I446	L270-L291 HydrophobicContact CD2-CD2 4.26Å; L291-I300 HydrophobicContact CD1-CD1 4.19Å; L291-L417 HydrophobicContact CD1-CD1 4.05Å; L291-H427 WeakPolarHBondContact CB-O 3.32Å; L291-H427 PolarHBondContact N-O 3.31Å; L291-L429 HydrophobicContact CD1-CB 4.09Å; L291-L429 HydrophobicContact CG-CB 4.17Å; L291-I446 HydrophobicContact CD2-CD1 4.33Å
292	A	65.4	Low	65.2	Low	61 Å²	61	44.3 Å²	44.3	50%	0.504	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-70.4	130.7	164	0	0	0	0	0	108.9	F272	F272-A292 WeakPolarHBondContact CE2-O 3.3Å; F272-A292 WeakPolarHBondContact CZ-O 3.42Å
293	I	65.4	Low	65.1	Low	18 Å²	18	43.2 Å²	43.2	9%	0.092	23%	0.234	C	C	.	.			trans	-115.4	133.8	-179.9	-74.6	171.6	0	0	0	109.7	M297 I300 L420 S423 H427	I293-M297 HydrophobicContact CG1-SD 4.28Å; I293-M297 HydrophobicContact CG2-CB 4.4Å; I293-M297 HydrophobicContact CG2-SD 4.17Å; I293-I300 HydrophobicContact CG1-CD1 4.44Å; I293-L420 HydrophobicContact CD1-CB 4.35Å; I293-L420 HydrophobicContact CD1-CD2 3.96Å; I293-S423 WeakPolarHBondContact O-CA 3.42Å; I293-S423 WeakPolarHBondContact O-CB 3.32Å; I293-H427 HydrophobicContact CD1-CB 3.63Å; I293-H427 VanDerWaalsContact CD1-CD2 3.48Å; I293-H427 WeakPolarHBondContact CD1-CD2 3.27Å; I293-H427 WeakPolarHBondContact CD1-ND1 3.45Å
294	M	60.9	Low	65.4	Low	111 Å²	111	41.2 Å²	41.2	55%	0.547	22%	0.22	S	C	.	.			trans	-85.3	148.2	169.8	-63.8	177.6	68	0	0	109.4	M297 F450	M294-M297 WeakPolarHBondContact O-CB 3.48Å; M294-M297 PolarHBondContact O-N 3.2Å; M294-F450 HydrophobicContact CB-CE1 4.16Å; M294-F450 HydrophobicContact CB-CZ 4.4Å; M294-F450 HydrophobicContact SD-CZ 4.1Å
295	D	55.2	Low	65.9	Low	93 Å²	93	39.9 Å²	39.9	50%	0.497	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	159.4	167.1	-65.4	-60.2	0	0	0	110.9	M297 G422 S423	D295-M297 PolarHBondContact O-N 3.34Å; D295-M297 VanDerWaalsContact O-N 3.1Å; D295-G422 VanDerWaalsContact OD1-CA 3.25Å; D295-G422 WeakPolarHBondContact OD1-CA 3.29Å; D295-S423 PolarHBondContact OD1-N 3.49Å; D295-S423 PolarHBondContact OD1-OG 3Å; D295-S423 WeakPolarHBondContact OD2-CB 3.24Å; D295-S423 PolarHBondContact OD2-OG 2.88Å
296	E	58.2	Low	66.1	Low	125 Å²	125	39.2 Å²	39.2	58%	0.584	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	-4.7	-169.8	-48.3	-168.6	162.8	0	0	116.9	T298 F450 L454	E296-T298 PolarHBondContact O-N 3Å; E296-F450 HydrophobicContact CB-CD1 4.36Å; E296-L454 VanDerWaalsContact OE2-CD1 3.27Å; E296-L454 WeakPolarHBondContact OE2-CD1 3.33Å
297	M	60.9	Low	66.4	Low	13 Å²	13	39.9 Å²	39.9	6%	0.064	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126.5	175.7	-165.4	-175.4	-138.5	0	0	111.9	F272 I293 M294 D295 I300 L420 P448 F450	F272-M297 HydrophobicContact CE1-CE 3.93Å; F272-M297 HydrophobicContact CE2-CE 3.94Å; F272-M297 HydrophobicContact CZ-CE 3.44Å; F272-M297 VanDerWaalsContact CZ-CE 3.44Å; F272-M297 HydrophobicContact CZ-SD 4.14Å; I293-M297 HydrophobicContact CG1-SD 4.28Å; I293-M297 HydrophobicContact CG2-CB 4.4Å; I293-M297 HydrophobicContact CG2-SD 4.17Å; M294-M297 WeakPolarHBondContact O-CB 3.48Å; M294-M297 PolarHBondContact O-N 3.2Å; D295-M297 PolarHBondContact O-N 3.34Å; D295-M297 VanDerWaalsContact O-N 3.1Å; M297-I300 HydrophobicContact CE-CD1 3.89Å; M297-I300 HydrophobicContact CE-CG1 3.39Å; M297-I300 HydrophobicContact SD-CD1 3.82Å; M297-I300 HydrophobicContact SD-CG1 3.76Å; M297-L420 HydrophobicContact CB-CD1 4.41Å; M297-L420 HydrophobicContact CG-CD1 3.72Å; M297-L420 HydrophobicContact SD-CD1 3.68Å; M297-P448 HydrophobicContact CE-CB 3.23Å; M297-F450 HydrophobicContact CB-CD1 4.25Å; M297-F450 HydrophobicContact CB-CE1 3.97Å; M297-F450 HydrophobicContact CG-CE1 4.38Å
298	T	57	Low	66.7	Low	72 Å²	72	44 Å²	44	44%	0.442	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-34	-174.3	50.4	0	0	0	0	113.8	E296 K449	E296-T298 PolarHBondContact O-N 3Å; T298-K449 PolarHBondContact N-O 2.95Å; T298-K449 PolarHBondContact OG1-O 2.82Å
299	S	64.5	Low	67	Low	11 Å²	11	47.4 Å²	47.4	8%	0.077	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	162.4	173.4	63.9	0	0	0	0	112.1	L417 K449	S299-L417 VanDerWaalsContact CA-O 3.24Å; S299-L417 WeakPolarHBondContact CA-O 3.36Å; S299-L417 WeakPolarHBondContact CB-O 3.32Å; S299-K449 PolarHBondContact N-O 3.07Å; S299-K449 WeakPolarHBondContact O-CB 3.46Å; S299-K449 PolarHBondContact O-N 3.01Å; S299-K449 WeakPolarHBondContact OG-CB 3.44Å
300	I	69	Low	66.9	Low	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.2	170.4	-72.4	160.2	0	0	0	108.2	F272 L291 I293 M297 V302 R416 L417 L420 I446	F272-I300 HydrophobicContact CE1-CD1 4.16Å; F272-I300 HydrophobicContact CE1-CG1 4.38Å; F272-I300 HydrophobicContact CZ-CD1 4.11Å; L291-I300 HydrophobicContact CD1-CD1 4.19Å; I293-I300 HydrophobicContact CG1-CD1 4.44Å; M297-I300 HydrophobicContact CE-CD1 3.89Å; M297-I300 HydrophobicContact CE-CG1 3.39Å; M297-I300 HydrophobicContact SD-CD1 3.82Å; M297-I300 HydrophobicContact SD-CG1 3.76Å; I300-V302 HydrophobicContact CG2-CG2 4.12Å; I300-R416 CarbonylContact O-C 3.54Å; I300-R416 WeakPolarHBondContact O-CA 3.5Å; I300-L417 HydrophobicContact CB-CB 4.23Å; I300-L417 HydrophobicContact CB-CD1 4.21Å; I300-L417 HydrophobicContact CG2-CD1 4.1Å; I300-L417 PolarHBondContact N-O 2.93Å; I300-L417 VanDerWaalsContact N-O 3.11Å; I300-L417 PolarHBondContact O-N 3.24Å; I300-L420 HydrophobicContact CD1-CD1 3.95Å; I300-L420 HydrophobicContact CD1-CD2 4.4Å; I300-L420 HydrophobicContact CG1-CD1 3.89Å; I300-I446 HydrophobicContact CG2-CG2 3.46Å; I300-I446 VanDerWaalsContact CG2-CG2 3.46Å
301	D	68	Low	66.2	Low	8 Å²	8	53.8 Å²	53.8	4%	0.043	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.4	171.8	-66.9	-21.5	0	0	0	109.3	I414 R416 I446 I447 K449	D301-I414 HydrophobicContact CB-CG2 4.22Å; D301-R416 WeakPolarHBondContact OD1-CB 3.31Å; D301-R416 VanDerWaalsContact OD1-CG 3.31Å; D301-R416 WeakPolarHBondContact OD1-CG 3.16Å; D301-R416 IonicContact OD1-CZ 3.19Å; D301-R416 IonicContact OD1-NE 4Å; D301-R416 PolarHBondContact OD1-NE 3.37Å; D301-R416 IonicContact OD1-NH2 2.68Å; D301-R416 PolarHBondContact OD1-NH2 3.38Å; D301-R416 IonicContact OD2-CZ 3.26Å; D301-R416 IonicContact OD2-NE 3.82Å; D301-R416 IonicContact OD2-NH2 3.68Å; D301-R416 PolarHBondContact OD2-NH2 3.32Å; D301-I446 WeakPolarHBondContact O-CA 3.3Å; D301-I447 HydrophobicContact CB-CB 4.33Å; D301-I447 PolarHBondContact N-O 3.28Å; D301-I447 PolarHBondContact O-N 3.35Å; D301-K449 WeakPolarHBondContact OD2-CE 3.12Å; D301-K449 IonicContact OD2-NZ 2.9Å
302	V	70.4	Confident	64.9	Low	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.7	172	-175.5	0	0	0	0	108.4	I300 I414 F415 L417 L429 L444 V445 I446	I300-V302 HydrophobicContact CG2-CG2 4.12Å; V302-I414 WeakPolarHBondContact O-CA 3.47Å; V302-F415 HydrophobicContact CB-CB 4.39Å; V302-F415 PolarHBondContact N-O 3.07Å; V302-F415 PolarHBondContact O-N 2.82Å; V302-L417 HydrophobicContact CG2-CD1 4.02Å; V302-L429 HydrophobicContact CG2-CD2 4.46Å; V302-L444 HydrophobicContact CG1-CD2 4.09Å; V302-V445 CarbonylContact C-O 3.59Å; V302-V445 WeakPolarHBondContact CA-O 3.44Å; V302-I446 HydrophobicContact CG1-CG1 4.38Å; V302-I446 HydrophobicContact CG2-CD1 4.45Å; V302-I446 HydrophobicContact CG2-CG1 4.26Å
303	I	69.8	Low	63.1	Low	18 Å²	18	63.8 Å²	63.8	9%	0.092	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.4	-177.3	-51.7	-174.6	0	0	0	109.1	Q412 I414 L444 V445 I447	I303-Q412 HydrophobicContact CG2-CB 4.11Å; I303-Q412 HydrophobicContact CG2-CG 4.45Å; I303-I414 HydrophobicContact CD1-CD1 4.4Å; I303-I414 HydrophobicContact CD1-CG1 4.45Å; I303-I414 HydrophobicContact CG1-CG1 4.12Å; I303-I414 HydrophobicContact CG1-CG2 4.28Å; I303-I414 HydrophobicContact CG2-CG1 4.31Å; I303-L444 WeakPolarHBondContact O-CA 3.36Å; I303-V445 HydrophobicContact CB-CB 4.33Å; I303-V445 PolarHBondContact N-O 3.41Å; I303-V445 PolarHBondContact O-N 3.46Å; I303-I447 HydrophobicContact CD1-CD1 3.63Å; I303-I447 HydrophobicContact CD1-CG1 4.27Å
304	L	74.6	Confident	61.5	Low	16 Å²	16	67 Å²	67	8%	0.084	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	110.2	168.2	-179.2	66.2	0	0	0	109.2	D306 C307 R413 L442 L444	L304-D306 WeakPolarHBondContact CD1-O 3.28Å; L304-C307 HydrophobicContact CD1-CB 4.41Å; L304-C307 HydrophobicContact CD2-CB 4.35Å; L304-R413 HydrophobicContact CB-CB 4.22Å; L304-R413 HydrophobicContact CD2-CB 4.42Å; L304-R413 PolarHBondContact N-O 2.9Å; L304-L442 HydrophobicContact CD1-CD2 3.58Å; L304-L444 HydrophobicContact CB-CD2 4.35Å; L304-L444 HydrophobicContact CD1-CD2 3.95Å
305	E	74	Confident	59.9	Low	71 Å²	71	67.2 Å²	67.2	33%	0.332	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-43.2	178.2	-65.7	-164.9	142	0	0	112.4	R443 V445	E305-R443 HydrophobicContact CB-CB 4.24Å; E305-R443 HydrophobicContact CB-CG 4.25Å; E305-R443 PolarHBondContact N-O 2.78Å; E305-R443 WeakPolarHBondContact OE2-CD 3.42Å; E305-R443 IonicContact OE2-CZ 2.89Å; E305-R443 IonicContact OE2-NE 3.09Å; E305-R443 IonicContact OE2-NH1 2.9Å; E305-R443 PolarHBondContact OE2-NH1 3.41Å; E305-V445 HydrophobicContact CG-CG2 3.91Å; E305-V445 WeakPolarHBondContact OE1-CG2 3.34Å
306	D	74.1	Confident	58.7	Low	44 Å²	44	68.5 Å²	68.5	24%	0.235	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147.5	-174.2	-159.3	-20.3	0	0	0	110.3	L304 R308 L442 R443	L304-D306 WeakPolarHBondContact CD1-O 3.28Å; D306-R308 WeakPolarHBondContact OD1-CG 3.26Å; D306-R308 IonicContact OD1-NE 3.23Å; D306-R308 PolarHBondContact OD1-NE 3.39Å; D306-R308 VanDerWaalsContact OD1-NE 3.09Å; D306-R308 IonicContact OD2-CZ 3.37Å; D306-R308 IonicContact OD2-NE 2.8Å; D306-R308 PolarHBondContact OD2-NE 2.86Å; D306-R308 IonicContact OD2-NH2 3.91Å; D306-R308 PolarHBondContact OD2-NH2 3.17Å; D306-L442 WeakPolarHBondContact O-CA 3.46Å; D306-R443 HydrophobicContact CB-CB 3.86Å; D306-R443 PolarHBondContact O-N 3.35Å
307	C	76.3	Confident	57.4	Low	35 Å²	35	70.6 Å²	70.6	24%	0.236	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	116	178.1	179.5	0	0	0	0	109.4	L304 C353 Y441 L442	L304-C307 HydrophobicContact CD1-CB 4.41Å; L304-C307 HydrophobicContact CD2-CB 4.35Å; C307-C353 HydrophobicContact CB-CB 3.8Å; C307-C353 WeakPolarHBondContact CB-SG 3.34Å; C307-C353 WeakPolarHBondContact SG-CB 3.33Å; C307-C353 CovalentContact SG-SG 2.04Å; C307-C353 PolarHBondContact SG-SG 3.47Å; C307-Y441 CarbonylContact C-O 3.56Å; C307-Y441 WeakPolarHBondContact CA-O 3.36Å; C307-L442 HydrophobicContact CB-CD2 3.91Å
308	R	73.1	Confident	55.8	Low	154 Å²	154	73.2 Å²	73.2	58%	0.581	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.6	-174.3	-51.1	-171.4	-171.9	-169.5	5.6	111.8	D306 V440 Y441	D306-R308 WeakPolarHBondContact OD1-CG 3.26Å; D306-R308 IonicContact OD1-NE 3.23Å; D306-R308 PolarHBondContact OD1-NE 3.39Å; D306-R308 VanDerWaalsContact OD1-NE 3.09Å; D306-R308 IonicContact OD2-CZ 3.37Å; D306-R308 IonicContact OD2-NE 2.8Å; D306-R308 PolarHBondContact OD2-NE 2.86Å; D306-R308 IonicContact OD2-NH2 3.91Å; D306-R308 PolarHBondContact OD2-NH2 3.17Å; R308-V440 WeakPolarHBondContact O-CA 3.44Å; R308-V440 WeakPolarHBondContact O-CG1 3.35Å; R308-Y441 PolarHBondContact N-O 3.23Å; R308-Y441 PolarHBondContact O-N 3.19Å
309	I	67.4	Low	54.2	Low	100 Å²	100	77.4 Å²	77.4	51%	0.513	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.5	177.9	-62.3	178.3	0	0	0	108.7	V438	I309-V438 HydrophobicContact CG2-CB 3.95Å; I309-V438 HydrophobicContact CG2-CG1 3.32Å; I309-V438 HydrophobicContact CG2-CG2 4.5Å
310	V	65.8	Low	52.5	Low	59 Å²	59	85 Å²	85	36%	0.358	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	108.3	-178.5	-175.1	0	0	0	0	109.3	V438 A439	V310-V438 VanDerWaalsContact O-CG1 3.23Å; V310-V438 WeakPolarHBondContact O-CG1 3.24Å; V310-A439 HydrophobicContact CB-CB 4.23Å; V310-A439 PolarHBondContact N-O 2.99Å
311	T	51.6	Low	50.4	Low	114 Å²	114	90.3 Å²	90.3	70%	0.699	53%	0.53	S	S	*	.			trans	-76.3	139.4	-177	45.7	0	0	0	0	112.4
312	P	40.6	Very low	48.6	Very low	108 Å²	108	96.7 Å²	96.7	70%	0.701	57%	0.569	S	S	*	*			trans	-74.5	131.4	173.7	30.1	-33.2	0	0	0	110.7	A314	P312-A314 PolarHBondContact O-N 3.37Å; P312-A314 VanDerWaalsContact O-N 3.15Å
313	I	29	Very low	46.5	Very low	169 Å²	169	102 Å²	102	87%	0.867	61%	0.606	S	S	*	*			trans	-66.5	112.7	176.8	-58.9	172.2	0	0	0	109.3
314	A	31.1	Very low	44.4	Very low	85 Å²	85	110.3 Å²	110.3	70%	0.702	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-74.2	129.5	175.6	0	0	0	0	0	111.1	P312	P312-A314 PolarHBondContact O-N 3.37Å; P312-A314 VanDerWaalsContact O-N 3.15Å
315	P	28.1	Very low	42.2	Very low	116 Å²	116	114.9 Å²	114.9	75%	0.753	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-74.5	138.8	176.8	30.3	-34	0	0	0	111.3	L317	P315-L317 PolarHBondContact O-N 3.22Å
316	S	29.5	Very low	39.9	Very low	121 Å²	121	116.2 Å²	116.2	85%	0.846	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-75.3	121.4	-176.4	56.9	0	0	0	0	113.5
317	L	31	Very low	37.6	Very low	169 Å²	169	121.4 Å²	121.4	89%	0.885	72%	0.717	S	S	*	*			trans	-115.4	146.4	147.9	-79.5	82.3	0	0	0	107.9	P315	P315-L317 PolarHBondContact O-N 3.22Å
318	G	26.5	Very low	35.3	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	74%	0.744	S	S	*	*			cis	132.2	87.6	6.5	0	0	0	0	0	109.9
319	N	24.9	Very low	33.1	Very low	160 Å²	160	123.5 Å²	123.5	86%	0.856	75%	0.751	S	S	*	*			trans	-4.2	119.5	178.6	-63.8	-12.6	0	0	0	118.5
320	I	28.6	Very low	31.3	Very low	170 Å²	170	124 Å²	124	87%	0.872	76%	0.764	S	S	*	*			trans	-144.1	139.3	138	-96.9	137.8	0	0	0	108.8
321	S	23.6	Very low	29.4	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	79%	0.79	S	S	*	*			trans	-90.1	147.1	-173	54.3	0	0	0	0	113.6
322	V	29.9	Very low	28.3	Very low	143 Å²	143	128.7 Å²	128.7	87%	0.867	79%	0.787	S	S	*	*			trans	-129.2	144.3	162.5	-177.5	0	0	0	0	110.1
323	S	26.8	Very low	27.7	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	79%	0.792	S	S	*	*			trans	-92.6	151.7	-166.8	52.7	0	0	0	0	115.3
324	K	25.1	Very low	27.6	Very low	194 Å²	194	131.9 Å²	131.9	84%	0.843	79%	0.789	S	S	*	*			trans	-55.9	161.5	154.4	-84.1	176.4	179.9	174.5	0	110.7
325	P	28.4	Very low	27.4	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	79%	0.793	S	S	*	*			cis	-152.4	177.4	44.3	42	-20.2	0	0	0	120.1
326	S	25.7	Very low	27.3	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	79%	0.791	S	S	*	*			trans	47.9	115	147.4	55.8	0	0	0	0	120.5
327	N	25.9	Very low	27.1	Very low	154 Å²	154	135.3 Å²	135.3	82%	0.824	79%	0.787	S	S	*	*				89.5	105.7	60.7	-85.7	-3.2	0	0	0	115.3
328	S	29	Very low	26.8	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	78%	0.784	S	S	*	*				-176.3	162	128	43.8	0	0	0	0	110.9
329	T	26.7	Very low	26.8	Very low	119 Å²	119	139.8 Å²	139.8	73%	0.73	79%	0.789	S	S	*	*				-179.1	107.4	-76.1	37.1	0	0	0	0	110
330	S	29.2	Very low	26.8	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	78%	0.781	S	S	*	*			trans	-155.2	112.1	148.7	46.7	0	0	0	0	107.4
331	K	26.1	Very low	26.7	Very low	208 Å²	208	137.7 Å²	137.7	90%	0.904	78%	0.78	S	S	*	*				73.5	115.1	74.5	-73.9	179.1	179.7	176.1	0	112.3
332	G	28.3	Very low	26.7	Very low	62 Å²	62	138.7 Å²	138.7	64%	0.639	78%	0.776	S	S	*	*			cis	170.5	-166.2	-10.4	0	0	0	0	0	116.4
333	T	28.5	Very low	26.7	Very low	131 Å²	131	137.7 Å²	137.7	80%	0.804	77%	0.772	S	S	*	*			trans	71	136.4	148.3	59.7	0	0	0	0	119
334	R	26.7	Very low	26.7	Very low	213 Å²	213	139.3 Å²	139.3	80%	0.804	77%	0.772	S	S	*	*			cis	-166.1	144.1	5.1	-123.5	171.3	-177.8	179.5	1.9	111.5
335	K	27	Very low	26.7	Very low	185 Å²	185	138.6 Å²	138.6	80%	0.804	77%	0.772	S	S	*	*			trans	64.7	155.7	154.8	-68.4	-175.6	176	-168.2	0	117.3
336	S	25.7	Very low	26.6	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	77%	0.773	S	S	*	*			cis	-178.3	151.4	-18.1	50.1	0	0	0	0	109.2
337	S	25.9	Very low	26.6	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	78%	0.779	S	S	*	*			cis	-179.4	155.5	-14.9	49	0	0	0	0	110.7
338	L	23.7	Very low	26.6	Very low	159 Å²	159	144 Å²	144	83%	0.832	78%	0.776	S	S	*	*			trans	70.4	97	159.2	-157.6	83.1	0	0	0	119.1
339	H	27.6	Very low	26.7	Very low	172 Å²	172	144.1 Å²	144.1	80%	0.796	77%	0.768	S	S	*	*				-158.6	173.7	120	-116	-64.8	0	0	0	110
340	D	24.4	Very low	26.9	Very low	129 Å²	129	144.2 Å²	144.2	69%	0.69	77%	0.773	S	S	*	*			trans	-73.8	146	-175.1	-41.4	-94.7	0	0	0	111.7
341	D	26.7	Very low	27.4	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	76%	0.759	S	S	*	*				-176.4	170.1	110.2	-114.9	-38.4	0	0	0	114.1
342	L	24.2	Very low	28.6	Very low	133 Å²	133	135.8 Å²	135.8	70%	0.696	75%	0.745	S	S	*	*			trans	-66.6	146	179.3	-154.5	69	0	0	0	112.2	N344	L342-N344 PolarHBondContact O-N 3.08Å
343	P	29.3	Very low	30.2	Very low	122 Å²	122	133.7 Å²	133.7	79%	0.792	72%	0.72	S	S	*	*			trans	-66.5	104.6	167.5	27.7	-33.4	0	0	0	109.4
344	N	26.1	Very low	32.1	Very low	143 Å²	143	129 Å²	129	77%	0.765	69%	0.692	S	S	*	*			trans	-54.5	148.9	-173.2	-77	-52.1	0	0	0	113.9	L342	L342-N344 PolarHBondContact O-N 3.08Å
345	E	25.6	Very low	33.9	Very low	179 Å²	179	120.1 Å²	120.1	84%	0.836	66%	0.66	S	S	*	*			trans	-54.7	146.1	170.4	-60.9	178.9	119	0	0	111.1	I347	E345-I347 PolarHBondContact O-N 3.47Å
346	I	26.6	Very low	35.7	Very low	149 Å²	149	114.5 Å²	114.5	76%	0.764	64%	0.638	S	S	*	*			trans	-72	96.3	172.7	-61.1	175.7	0	0	0	107.6	F348	I346-F348 PolarHBondContact O-N 3.3Å
347	I	25.4	Very low	37.5	Very low	157 Å²	157	111.3 Å²	111.3	81%	0.805	61%	0.613	S	S	*	*			trans	-60.5	106.4	173.4	-60.8	174.6	0	0	0	108	E345	E345-I347 PolarHBondContact O-N 3.47Å
348	F	27.1	Very low	38.8	Very low	171 Å²	171	110.9 Å²	110.9	75%	0.75	60%	0.602	S	S	*	*			trans	-68.8	134.1	172.1	-92	-95.5	0	0	0	110.2	I346 S350	I346-F348 PolarHBondContact O-N 3.3Å; F348-S350 PolarHBondContact O-N 3.49Å
349	D	31.2	Very low	40.2	Very low	118 Å²	118	104.9 Å²	104.9	63%	0.631	58%	0.579	S	S	*	*			trans	-63.7	124.6	-177.5	-177.5	35.9	0	0	0	111.5	S351	D349-S351 PolarHBondContact O-N 3.35Å; D349-S351 VanDerWaalsContact O-N 3.07Å; D349-S351 VanDerWaalsContact OD2-CB 3.29Å; D349-S351 WeakPolarHBondContact OD2-CB 3.49Å; D349-S351 PolarHBondContact OD2-OG 3Å
350	S	30.4	Very low	41.1	Very low	120 Å²	120	98.8 Å²	98.8	84%	0.839	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	3	-172.4	56.2	0	0	0	0	114.1	F348 A352	F348-S350 PolarHBondContact O-N 3.49Å; S350-A352 VanDerWaalsContact C-N 3.31Å; S350-A352 PolarHBondContact O-N 3.43Å
351	S	39.3	Very low	41.9	Very low	70 Å²	70	96.3 Å²	96.3	49%	0.49	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-18.6	179.7	71.6	0	0	0	0	114.5	D349 R413	D349-S351 PolarHBondContact O-N 3.35Å; D349-S351 VanDerWaalsContact O-N 3.07Å; D349-S351 VanDerWaalsContact OD2-CB 3.29Å; D349-S351 WeakPolarHBondContact OD2-CB 3.49Å; D349-S351 PolarHBondContact OD2-OG 3Å; S351-R413 PolarHBondContact O-NH2 3.14Å
352	A	52	Low	42.2	Very low	73 Å²	73	96.1 Å²	96.1	60%	0.603	54%	0.539	S	S	*	.			trans	-106.8	42.4	-162.4	0	0	0	0	0	115.8	S350 P354	S350-A352 VanDerWaalsContact C-N 3.31Å; S350-A352 PolarHBondContact O-N 3.43Å; A352-P354 WeakPolarHBondContact O-CD 3.18Å; A352-P354 VanDerWaalsContact O-N 3.15Å
353	C	62.1	Low	42.4	Very low	17 Å²	17	92.1 Å²	92.1	12%	0.115	53%	0.525	C	S	.	.			trans	-52.9	115.9	174.6	-174.9	0	0	0	0	112.1	C307 I355 R413	C307-C353 HydrophobicContact CB-CB 3.8Å; C307-C353 WeakPolarHBondContact CB-SG 3.34Å; C307-C353 WeakPolarHBondContact SG-CB 3.33Å; C307-C353 CovalentContact SG-SG 2.04Å; C307-C353 PolarHBondContact SG-SG 3.47Å; C353-I355 PolarHBondContact O-N 3.4Å; C353-R413 PolarHBondContact O-NH1 3.45Å
354	P	67.8	Low	42.2	Very low	33 Å²	33	92.6 Å²	92.6	21%	0.214	52%	0.52	C	S	.	.			trans	-95.1	64.4	-162.7	37.8	-37.3	0	0	0	112.7	A352 Q434 A435 V440	A352-P354 WeakPolarHBondContact O-CD 3.18Å; A352-P354 VanDerWaalsContact O-N 3.15Å; P354-Q434 WeakPolarHBondContact O-CA 3.41Å; P354-Q434 VanDerWaalsContact O-CB 3.24Å; P354-Q434 WeakPolarHBondContact O-CB 3.44Å; P354-Q434 WeakPolarHBondContact O-CG 3.49Å; P354-Q434 PolarHBondContact O-N 3.05Å; P354-A435 HydrophobicContact CG-CB 4.23Å; P354-V440 HydrophobicContact CG-CG2 4.17Å
355	I	64.4	Low	42.2	Very low	26 Å²	26	88.9 Å²	88.9	13%	0.133	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.7	-165.2	-54.5	-167.4	0	0	0	112.4	C353 I357 I431 L432 V440 L442	C353-I355 PolarHBondContact O-N 3.4Å; I355-I357 HydrophobicContact CG2-CG1 4.5Å; I355-I431 HydrophobicContact CG2-CG2 3.91Å; I355-L432 WeakPolarHBondContact CA-O 3.3Å; I355-L432 WeakPolarHBondContact CG2-O 3.4Å; I355-V440 HydrophobicContact CD1-CB 4.36Å; I355-V440 HydrophobicContact CD1-CG1 3.81Å; I355-L442 HydrophobicContact CD1-CD1 3.59Å; I355-L442 HydrophobicContact CD1-CD2 3.28Å; I355-L442 HydrophobicContact CD1-CG 3.71Å
356	I	64.5	Low	42.1	Very low	67 Å²	67	85.1 Å²	85.1	34%	0.344	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.2	167.1	-68.1	169.9	0	0	0	109	D358 I431 L432 Q434	I356-D358 HydrophobicContact CG2-CB 4.27Å; I356-I431 WeakPolarHBondContact O-CA 3.39Å; I356-L432 HydrophobicContact CB-CB 4.47Å; I356-L432 PolarHBondContact N-O 3.39Å; I356-L432 PolarHBondContact O-N 3.06Å; I356-Q434 HydrophobicContact CD1-CG 4.23Å; I356-Q434 HydrophobicContact CG1-CG 4.1Å
357	I	63	Low	42	Very low	34 Å²	34	82.3 Å²	82.3	17%	0.174	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.2	161.5	-59.2	-179.9	0	0	0	106.3	I355 F415 L429 Y430 I431 L444	I355-I357 HydrophobicContact CG2-CG1 4.5Å; I357-F415 HydrophobicContact CD1-CD2 4.04Å; I357-F415 HydrophobicContact CD1-CE2 3.88Å; I357-F415 HydrophobicContact CD1-CZ 4.36Å; I357-L429 HydrophobicContact CG2-CD1 3.57Å; I357-Y430 WeakPolarHBondContact CA-O 3.48Å; I357-I431 HydrophobicContact CG1-CG1 4.43Å; I357-I431 HydrophobicContact CG1-CG2 4.31Å; I357-L444 HydrophobicContact CD1-CD2 4.09Å
358	D	54	Low	41.9	Very low	100 Å²	100	81 Å²	81	54%	0.535	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151	179.1	-161.5	-1.4	0	0	0	110.1	I356 Y430	I356-D358 HydrophobicContact CG2-CB 4.27Å; D358-Y430 PolarHBondContact N-O 3.48Å; D358-Y430 PolarHBondContact O-N 3.06Å
359	G	52.4	Low	41.8	Very low	33 Å²	33	77.2 Å²	77.2	34%	0.34	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	120.9	-172.7	0	0	0	0	0	111.8	Y428	G359-Y428 WeakPolarHBondContact CA-O 3.5Å
360	S	47.6	Very low	41.5	Very low	43 Å²	43	80.9 Å²	80.9	30%	0.301	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162.6	-172.2	73	0	0	0	0	113.9	Y428	S360-Y428 PolarHBondContact N-O 3.46Å; S360-Y428 VanDerWaalsContact N-O 3.08Å; S360-Y428 PolarHBondContact O-N 2.83Å
361	V	40.9	Very low	41.2	Very low	78 Å²	78	80.8 Å²	80.8	47%	0.473	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	126	167	177.5	0	0	0	0	107.2	A363 I425	V361-A363 PolarHBondContact O-N 3.49Å; V361-I425 HydrophobicContact CG1-CG2 3.83Å
362	E	33	Very low	40.6	Very low	153 Å²	153	84.6 Å²	84.6	72%	0.715	49%	0.485	S	S	*	.	S	Bend	trans	58.3	34.8	167.2	-63	176.5	162.4	0	0	117.8
363	A	28.4	Very low	39.4	Very low	49 Å²	49	88.6 Å²	88.6	41%	0.405	49%	0.491	S	S	.	.			trans	-114.4	112	172.5	0	0	0	0	0	113.7	V361	V361-A363 PolarHBondContact O-N 3.49Å
364	L	24.1	Very low	37.6	Very low	131 Å²	131	93.7 Å²	93.7	69%	0.686	53%	0.527	S	S	*	.			trans	-84.3	136.3	156.1	-103.8	88.2	0	0	0	109.5
365	P	26.8	Very low	35.6	Very low	65 Å²	65	99.4 Å²	99.4	42%	0.422	55%	0.551	S	S	.	*			trans	-87.6	143.4	175.9	33.9	-33.2	0	0	0	112.4
366	S	23.1	Very low	33.7	Very low	101 Å²	101	101.8 Å²	101.8	71%	0.706	58%	0.581	S	S	*	*			trans	-129.6	124	168.3	60.8	0	0	0	0	111.3
367	S	24.1	Very low	31.7	Very low	89 Å²	89	108.4 Å²	108.4	62%	0.622	61%	0.608	S	S	*	*			trans	63.6	129.5	172.8	46.2	0	0	0	0	119.2
368	L	23.8	Very low	29.7	Very low	130 Å²	130	118.1 Å²	118.1	68%	0.681	64%	0.643	S	S	*	*			trans	-62.3	154.5	176.8	-66	63.6	0	0	0	111.2
369	S	24	Very low	28.3	Very low	92 Å²	92	119.3 Å²	119.3	64%	0.643	65%	0.653	S	S	*	*				173	165.5	74.2	51.2	0	0	0	0	113.5
370	Y	24.9	Very low	26.9	Very low	195 Å²	195	122.5 Å²	122.5	77%	0.765	67%	0.67	S	S	*	*			trans	51.4	108	166.1	-58.9	-68.4	0	0	0	120.1
371	L	25.7	Very low	25.9	Very low	117 Å²	117	126.4 Å²	126.4	61%	0.613	69%	0.692	S	S	*	*			trans	-145	75	156.3	-146.5	165.8	0	0	0	112
372	H	26.2	Very low	25.1	Very low	150 Å²	150	127.2 Å²	127.2	69%	0.694	70%	0.698	S	S	*	*			trans	-83.8	110.4	166.2	-111.9	-95.3	0	0	0	109.7
373	Q	26.7	Very low	24.7	Very low	158 Å²	158	129.6 Å²	129.6	74%	0.738	71%	0.706	S	S	*	*			trans	-177.5	105	134.3	-105.7	-179	4.8	0	0	111.5	Q375	Q373-Q375 PolarHBondContact O-N 3.07Å
374	S	24.5	Very low	24.7	Very low	123 Å²	123	135 Å²	135	86%	0.86	72%	0.72	S	S	*	*			trans	-73.7	112.4	157.1	39.3	0	0	0	0	109
375	Q	25.8	Very low	24.7	Very low	154 Å²	154	137.1 Å²	137.1	72%	0.72	73%	0.726	S	S	*	*			trans	-84.9	124.3	162.5	-73.3	-165	-21.6	0	0	108.8	Q373 F377	Q373-Q375 PolarHBondContact O-N 3.07Å; Q375-F377 PolarHBondContact O-N 3.37Å
376	G	23.9	Very low	24.9	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	75%	0.746	S	S	*	*			trans	-62.3	127	-176.2	0	0	0	0	0	112.3	R378	G376-R378 PolarHBondContact O-N 3.08Å
377	F	22.7	Very low	24.9	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.904	76%	0.756	S	S	*	*			trans	-70.2	111.3	174.4	-115.6	-94.6	0	0	0	110	Q375 V379	Q375-F377 PolarHBondContact O-N 3.37Å; F377-V379 PolarHBondContact O-N 3.33Å
378	R	22	Very low	25	Very low	239 Å²	239	147.2 Å²	147.2	90%	0.902	76%	0.764	S	S	*	*			trans	-77.9	91.2	-179.6	-160.7	-178.5	-162	-178.9	6.1	109.6	G376 S380	G376-R378 PolarHBondContact O-N 3.08Å; R378-S380 PolarHBondContact O-N 3.41Å; R378-S380 VanDerWaalsContact O-N 3.09Å
379	V	24.3	Very low	25	Very low	124 Å²	124	149.7 Å²	149.7	75%	0.752	78%	0.776	S	S	*	*			trans	-59.9	112	174.9	179.1	0	0	0	0	109.5	F377 T381	F377-V379 PolarHBondContact O-N 3.33Å; V379-T381 HydrophobicContact CG1-CG2 4.42Å; V379-T381 PolarHBondContact O-N 2.9Å
380	S	21.9	Very low	25	Very low	101 Å²	101	148.8 Å²	148.8	71%	0.706	78%	0.781	S	S	*	*			trans	-84.9	95.2	176.5	56.5	0	0	0	0	110.3	R378 T382	R378-S380 PolarHBondContact O-N 3.41Å; R378-S380 VanDerWaalsContact O-N 3.09Å; S380-T382 PolarHBondContact O-N 2.99Å
381	T	26.7	Very low	24.9	Very low	124 Å²	124	149.7 Å²	149.7	76%	0.761	79%	0.789	S	S	*	*			trans	-71.8	108.2	172.6	42.9	0	0	0	0	110.6	V379 K383	V379-T381 HydrophobicContact CG1-CG2 4.42Å; V379-T381 PolarHBondContact O-N 2.9Å; T381-K383 PolarHBondContact O-N 3.12Å
382	T	25.5	Very low	24.8	Very low	95 Å²	95	149.3 Å²	149.3	58%	0.583	80%	0.797	S	S	*	*			trans	-79.2	97.1	-176.7	47.5	0	0	0	0	111.7	S380 L550	S380-T382 PolarHBondContact O-N 2.99Å; T382-L550 HydrophobicContact CG2-CD2 3.48Å; T382-L550 VanDerWaalsContact CG2-CD2 3.48Å
383	K	24.4	Very low	24.9	Very low	203 Å²	203	146.9 Å²	146.9	88%	0.883	79%	0.794	S	S	*	*			trans	-74.7	130.1	161.6	-70.6	-172.5	175.4	-174.9	0	110	T381	T381-K383 PolarHBondContact O-N 3.12Å
384	K	26.6	Very low	24.7	Very low	163 Å²	163	146.2 Å²	146.2	71%	0.709	80%	0.796	S	S	*	*			trans	-106.4	152.8	155.2	-109.6	179.1	177.2	175.4	0	108.7
385	H	26.1	Very low	24.7	Very low	176 Å²	176	147.3 Å²	147.3	82%	0.815	80%	0.797	S	S	*	*			trans	-85.9	155.6	-175.1	-80.9	-84.9	0	0	0	112.5
386	D	29.2	Very low	24.6	Very low	158 Å²	158	143.7 Å²	143.7	85%	0.845	80%	0.8	S	S	*	*			trans	-127.3	163.4	137.7	-113	-44.3	0	0	0	110.3
387	Y	24.4	Very low	24.5	Very low	232 Å²	232	145.7 Å²	145.7	91%	0.91	80%	0.803	S	S	*	*			trans	-90	139.1	-173.9	-80.1	-108.7	0	0	0	112.4
388	G	26.5	Very low	24.7	Very low	77 Å²	77	141.6 Å²	141.6	79%	0.794	80%	0.797	S	S	*	*			trans	-169.3	114.3	173.8	0	0	0	0	0	113.1
389	I	23.7	Very low	24.8	Very low	182 Å²	182	135.8 Å²	135.8	93%	0.933	79%	0.793	S	S	*	*			trans	-81.6	133.2	179.8	-60.3	160.3	0	0	0	109.5
390	G	23.6	Very low	24.7	Very low	72 Å²	72	135.2 Å²	135.2	74%	0.742	79%	0.794	S	S	*	*			trans	175.5	133.4	171.3	0	0	0	0	0	115.9
391	F	23.4	Very low	24.8	Very low	215 Å²	215	137.4 Å²	137.4	94%	0.943	80%	0.798	S	S	*	*			trans	-73.8	158.5	-177.3	-78.5	-105.4	0	0	0	114.9
392	S	21.7	Very low	24.6	Very low	109 Å²	109	136.1 Å²	136.1	76%	0.762	80%	0.8	S	S	*	*			trans	-72.3	170.3	158.7	-145.3	0	0	0	0	110.4
393	P	29.4	Very low	24.4	Very low	99 Å²	99	140 Å²	140	64%	0.643	81%	0.809	S	S	*	*			cis	-146.6	-178.9	14.3	44.5	-24.8	0	0	0	118.9
394	N	22.8	Very low	24.2	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	81%	0.806	S	S	*	*			trans	74.8	127	144.8	-77.6	-4.1	0	0	0	123.6
395	V	23.9	Very low	24	Very low	146 Å²	146	140 Å²	140	89%	0.885	81%	0.812	S	S	*	*			trans	68.5	121.1	142.7	179.7	0	0	0	0	119
396	G	23.3	Very low	23.8	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	81%	0.807	S	S	*	*			trans	148.9	108.3	160.8	0	0	0	0	0	114.8
397	S	21.8	Very low	23.5	Very low	118 Å²	118	138.5 Å²	138.5	83%	0.825	81%	0.808	S	S	*	*			trans	-109	172.8	157.6	63.9	0	0	0	0	108.5
398	P	27.6	Very low	23.4	Very low	120 Å²	120	135 Å²	135	78%	0.779	81%	0.805	S	S	*	*			cis	-130.4	175.9	-1.2	42.1	-27.7	0	0	0	114.1
399	S	23.9	Very low	23.3	Very low	117 Å²	117	136 Å²	136	82%	0.818	80%	0.8	S	S	*	*			trans	-161.7	153	142.3	47.5	0	0	0	0	110.6
400	S	22.3	Very low	23.5	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	79%	0.786	S	S	*	*			trans	-86.6	133.2	-177.6	53.3	0	0	0	0	112.2
401	N	24.9	Very low	24.2	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	79%	0.791	S	S	*	*			trans	-138.1	119	155	-96.6	-38.4	0	0	0	108.7	F403	N401-F403 PolarHBondContact O-N 3.45Å
402	A	21.5	Very low	25.3	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	77%	0.767	S	S	*	*			trans	-77.8	118.7	175.3	0	0	0	0	0	109.3
403	F	22.1	Very low	26.9	Very low	176 Å²	176	129.9 Å²	129.9	77%	0.772	75%	0.748	S	S	*	*			trans	-101.5	107.6	166.4	-95.3	-86.6	0	0	0	109.3	N401 Y405	N401-F403 PolarHBondContact O-N 3.45Å; F403-Y405 PolarHBondContact O-N 2.9Å
404	N	20.4	Very low	28	Very low	154 Å²	154	130 Å²	130	82%	0.824	74%	0.742	S	S	*	*			trans	-64.6	103.6	166.4	-70.4	-14.7	0	0	0	108.5
405	Y	21.9	Very low	29.7	Very low	214 Å²	214	126.5 Å²	126.5	84%	0.839	72%	0.721	S	S	*	*			trans	-88.1	112.6	158.1	-101.9	-90.3	0	0	0	108.1	F403	F403-Y405 PolarHBondContact O-N 2.9Å
406	T	21.4	Very low	31.1	Very low	114 Å²	114	126.6 Å²	126.6	70%	0.699	71%	0.705	S	S	*	*			trans	-65.4	134.4	173.9	39.8	0	0	0	0	110.1	D408	T406-D408 VanDerWaalsContact C-N 3.29Å; T406-D408 PolarHBondContact O-N 2.89Å
407	Q	22.5	Very low	32.6	Very low	187 Å²	187	124.7 Å²	124.7	87%	0.874	68%	0.677	S	S	*	*			trans	-81	71.7	-174	-172	179.3	-0	0	0	110.8	S409	Q407-S409 PolarHBondContact O-N 2.88Å
408	D	23.8	Very low	33.9	Very low	159 Å²	159	125.4 Å²	125.4	85%	0.85	67%	0.67	S	S	*	*			trans	-66.5	118.7	173.4	-88	-29.7	0	0	0	110.2	T406	T406-D408 VanDerWaalsContact C-N 3.29Å; T406-D408 PolarHBondContact O-N 2.89Å
409	S	23.9	Very low	34.9	Very low	98 Å²	98	122 Å²	122	69%	0.685	66%	0.657	S	S	*	*			trans	-108.8	165.9	-173.9	52.6	0	0	0	0	111.1	Q407	Q407-S409 PolarHBondContact O-N 2.88Å
410	S	28.5	Very low	36.5	Very low	90 Å²	90	117.8 Å²	117.8	63%	0.629	63%	0.625	S	S	*	*			trans	64.1	85.4	174.8	67.9	0	0	0	0	117.1	Q412	S410-Q412 VanDerWaalsContact C-N 3.3Å; S410-Q412 PolarHBondContact O-N 3.28Å; S410-Q412 VanDerWaalsContact O-N 3.08Å
411	I	36.5	Very low	37.7	Very low	169 Å²	169	119.3 Å²	119.3	87%	0.867	61%	0.614	S	S	*	*			trans	-77.5	85.6	155.4	-56.5	178.2	0	0	0	108.1	R413	I411-R413 PolarHBondContact O-N 3.37Å
412	Q	48.1	Very low	39.1	Very low	92 Å²	92	113.5 Å²	113.5	43%	0.43	59%	0.589	S	S	.	*			trans	-59.9	125.7	172.8	-69.1	-174	-17.5	0	0	110.4	I303 S410	I303-Q412 HydrophobicContact CG2-CB 4.11Å; I303-Q412 HydrophobicContact CG2-CG 4.45Å; S410-Q412 VanDerWaalsContact C-N 3.3Å; S410-Q412 PolarHBondContact O-N 3.28Å; S410-Q412 VanDerWaalsContact O-N 3.08Å
413	R	53.6	Low	40.8	Very low	99 Å²	99	111.5 Å²	111.5	37%	0.374	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	117.4	175.5	-64.7	-174.7	-177.7	173.1	2.1	109.6	L304 S351 C353 I411 F415	L304-R413 HydrophobicContact CB-CB 4.22Å; L304-R413 HydrophobicContact CD2-CB 4.42Å; L304-R413 PolarHBondContact N-O 2.9Å; S351-R413 PolarHBondContact O-NH2 3.14Å; C353-R413 PolarHBondContact O-NH1 3.45Å; I411-R413 PolarHBondContact O-N 3.37Å; R413-F415 HydrophobicContact CB-CE2 3.76Å; R413-F415 HydrophobicContact CB-CZ 4.17Å
414	I	53.9	Low	42.3	Very low	100 Å²	100	111.6 Å²	111.6	51%	0.513	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	123.9	179.7	-52.3	-178.8	0	0	0	110	D301 V302 I303	D301-I414 HydrophobicContact CB-CG2 4.22Å; V302-I414 WeakPolarHBondContact O-CA 3.47Å; I303-I414 HydrophobicContact CD1-CD1 4.4Å; I303-I414 HydrophobicContact CD1-CG1 4.45Å; I303-I414 HydrophobicContact CG1-CG1 4.12Å; I303-I414 HydrophobicContact CG1-CG2 4.28Å; I303-I414 HydrophobicContact CG2-CG1 4.31Å
415	F	58	Low	43.9	Very low	72 Å²	72	106.2 Å²	106.2	32%	0.316	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	109.2	178	-57.8	-96.1	0	0	0	109.4	V302 I357 R413	V302-F415 HydrophobicContact CB-CB 4.39Å; V302-F415 PolarHBondContact N-O 3.07Å; V302-F415 PolarHBondContact O-N 2.82Å; I357-F415 HydrophobicContact CD1-CD2 4.04Å; I357-F415 HydrophobicContact CD1-CE2 3.88Å; I357-F415 HydrophobicContact CD1-CZ 4.36Å; R413-F415 HydrophobicContact CB-CE2 3.76Å; R413-F415 HydrophobicContact CB-CZ 4.17Å
416	R	53.4	Low	45.6	Very low	147 Å²	147	100 Å²	100	56%	0.555	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	110.1	-179.6	179.2	166.9	-72.5	156.5	4	111.8	I300 D301 L418	I300-R416 CarbonylContact O-C 3.54Å; I300-R416 WeakPolarHBondContact O-CA 3.5Å; D301-R416 WeakPolarHBondContact OD1-CB 3.31Å; D301-R416 VanDerWaalsContact OD1-CG 3.31Å; D301-R416 WeakPolarHBondContact OD1-CG 3.16Å; D301-R416 IonicContact OD1-CZ 3.19Å; D301-R416 IonicContact OD1-NE 4Å; D301-R416 PolarHBondContact OD1-NE 3.37Å; D301-R416 IonicContact OD1-NH2 2.68Å; D301-R416 PolarHBondContact OD1-NH2 3.38Å; D301-R416 IonicContact OD2-CZ 3.26Å; D301-R416 IonicContact OD2-NE 3.82Å; D301-R416 IonicContact OD2-NH2 3.68Å; D301-R416 PolarHBondContact OD2-NH2 3.32Å; R416-L418 HydrophobicContact CG-CD2 3.78Å; R416-L418 HydrophobicContact CG-CG 4.1Å
417	L	54.8	Low	47.3	Very low	38 Å²	38	95.2 Å²	95.2	20%	0.199	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115	172.1	-66.3	163.1	0	0	0	109.6	L291 S299 I300 V302 L429	L291-L417 HydrophobicContact CD1-CD1 4.05Å; S299-L417 VanDerWaalsContact CA-O 3.24Å; S299-L417 WeakPolarHBondContact CA-O 3.36Å; S299-L417 WeakPolarHBondContact CB-O 3.32Å; I300-L417 HydrophobicContact CB-CB 4.23Å; I300-L417 HydrophobicContact CB-CD1 4.21Å; I300-L417 HydrophobicContact CG2-CD1 4.1Å; I300-L417 PolarHBondContact N-O 2.93Å; I300-L417 VanDerWaalsContact N-O 3.11Å; I300-L417 PolarHBondContact O-N 3.24Å; V302-L417 HydrophobicContact CG2-CD1 4.02Å; L417-L429 HydrophobicContact CD1-CD1 4.31Å
418	L	49.6	Very low	49.5	Very low	133 Å²	133	87.8 Å²	87.8	70%	0.696	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	154.4	-178.8	-65.6	176.2	0	0	0	111.7	R416	R416-L418 HydrophobicContact CG-CD2 3.78Å; R416-L418 HydrophobicContact CG-CG 4.1Å
419	G	48.6	Very low	51.6	Low	49 Å²	49	80.2 Å²	80.2	51%	0.505	42%	0.417	S	S	.	.			trans	90	15.1	167.3	0	0	0	0	0	116.1
420	L	56.1	Low	53.8	Low	27 Å²	27	78.8 Å²	78.8	14%	0.141	40%	0.398	C	S	.	.			trans	-46.7	146.3	176.3	-50.9	-178.9	0	0	0	112.1	I293 M297 I300	I293-L420 HydrophobicContact CD1-CB 4.35Å; I293-L420 HydrophobicContact CD1-CD2 3.96Å; M297-L420 HydrophobicContact CB-CD1 4.41Å; M297-L420 HydrophobicContact CG-CD1 3.72Å; M297-L420 HydrophobicContact SD-CD1 3.68Å; I300-L420 HydrophobicContact CD1-CD1 3.95Å; I300-L420 HydrophobicContact CD1-CD2 4.4Å; I300-L420 HydrophobicContact CG1-CD1 3.89Å
421	R	49	Very low	55.9	Low	144 Å²	144	74.5 Å²	74.5	54%	0.543	37%	0.368	S	S	.	.			trans	-133.9	52.2	-165.1	-154.3	180	-174	-175	-0.5	115.1	I425 H427	R421-I425 HydrophobicContact CB-CD1 4.13Å; R421-I425 HydrophobicContact CG-CD1 3.96Å; R421-H427 PolarHBondContact N-NE2 2.64Å
422	G	53.7	Low	57.3	Low	25 Å²	25	68.3 Å²	68.3	26%	0.258	34%	0.336	S	S	.	.			trans	73.8	171.3	173.8	0	0	0	0	0	114.2	D295 Q424	D295-G422 VanDerWaalsContact OD1-CA 3.25Å; D295-G422 WeakPolarHBondContact OD1-CA 3.29Å; G422-Q424 PolarHBondContact O-N 2.86Å
423	S	56.3	Low	58.7	Low	55 Å²	55	63.9 Å²	63.9	39%	0.385	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-18	-176.9	59.1	0	0	0	0	114.6	I293 D295 I425	I293-S423 WeakPolarHBondContact O-CA 3.42Å; I293-S423 WeakPolarHBondContact O-CB 3.32Å; D295-S423 PolarHBondContact OD1-N 3.49Å; D295-S423 PolarHBondContact OD1-OG 3Å; D295-S423 WeakPolarHBondContact OD2-CB 3.24Å; D295-S423 PolarHBondContact OD2-OG 2.88Å; S423-I425 PolarHBondContact O-N 3Å
424	Q	54.6	Low	59.2	Low	177 Å²	177	63.2 Å²	63.2	83%	0.827	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.3	-174.7	-67	-77.7	-64.9	0	0	114.9	G422	G422-Q424 PolarHBondContact O-N 2.86Å
425	I	54.3	Low	59.7	Low	42 Å²	42	59.4 Å²	59.4	22%	0.215	30%	0.3	C	S	.	.	S	Bend	trans	-122.7	122.5	-171	-62.9	175.8	0	0	0	110.2	V361 R421 S423 H427	V361-I425 HydrophobicContact CG1-CG2 3.83Å; R421-I425 HydrophobicContact CB-CD1 4.13Å; R421-I425 HydrophobicContact CG-CD1 3.96Å; S423-I425 PolarHBondContact O-N 3Å; I425-H427 PolarHBondContact O-CE1 3.48Å; I425-H427 PolarHBondContact O-N 3.41Å; I425-H427 PolarHBondContact O-ND1 2.93Å
426	N	56.8	Low	59.6	Low	84 Å²	84	58.5 Å²	58.5	45%	0.449	30%	0.303	S	S	.	.			trans	-67.5	122	177.2	-73.9	-19.3	0	0	0	111.3	L290 Y428	L290-N426 HydrophobicContact CD1-CB 3.67Å; N426-Y428 HydrophobicContact CB-CE2 3.83Å
427	H	58.4	Low	59.6	Low	12 Å²	12	57.7 Å²	57.7	6%	0.056	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140	173.5	-64.8	49.2	0	0	0	109.1	L291 I293 R421 I425	L291-H427 WeakPolarHBondContact CB-O 3.32Å; L291-H427 PolarHBondContact N-O 3.31Å; I293-H427 HydrophobicContact CD1-CB 3.63Å; I293-H427 VanDerWaalsContact CD1-CD2 3.48Å; I293-H427 WeakPolarHBondContact CD1-CD2 3.27Å; I293-H427 WeakPolarHBondContact CD1-ND1 3.45Å; R421-H427 PolarHBondContact N-NE2 2.64Å; I425-H427 PolarHBondContact O-CE1 3.48Å; I425-H427 PolarHBondContact O-N 3.41Å; I425-H427 PolarHBondContact O-ND1 2.93Å
428	Y	66.8	Low	60.1	Low	31 Å²	31	58 Å²	58	12%	0.122	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.4	-172.8	-61.2	-89.2	0	0	0	111.8	L288 Y289 L290 G359 S360 N426	L288-Y428 HydrophobicContact CD2-CD1 4.32Å; L288-Y428 HydrophobicContact CG-CD1 4.34Å; Y289-Y428 WeakPolarHBondContact O-CA 3.34Å; L290-Y428 HydrophobicContact CB-CD1 4.37Å; L290-Y428 HydrophobicContact CB-CE1 4.26Å; L290-Y428 HydrophobicContact CD1-CD1 4.03Å; L290-Y428 HydrophobicContact CD1-CE1 3.62Å; L290-Y428 HydrophobicContact CG-CE1 4.5Å; G359-Y428 WeakPolarHBondContact CA-O 3.5Å; S360-Y428 PolarHBondContact N-O 3.46Å; S360-Y428 VanDerWaalsContact N-O 3.08Å; S360-Y428 PolarHBondContact O-N 2.83Å; N426-Y428 HydrophobicContact CB-CE2 3.83Å
429	L	68.8	Low	61.2	Low	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.6	174.2	-177.6	68.6	0	0	0	108.8	Y289 L291 V302 I357 L417 I431 I446	Y289-L429 PolarHBondContact N-O 2.91Å; Y289-L429 PolarHBondContact O-N 2.87Å; L291-L429 HydrophobicContact CD1-CB 4.09Å; L291-L429 HydrophobicContact CG-CB 4.17Å; V302-L429 HydrophobicContact CG2-CD2 4.46Å; I357-L429 HydrophobicContact CG2-CD1 3.57Å; L417-L429 HydrophobicContact CD1-CD1 4.31Å; L429-I431 HydrophobicContact CD2-CD1 4.36Å; L429-I431 HydrophobicContact CG-CG1 4.37Å; L429-I446 HydrophobicContact CD2-CD1 4.18Å
430	Y	69.4	Low	62.6	Low	69 Å²	69	50.4 Å²	50.4	27%	0.271	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.8	178.2	-176.1	-114.4	0	0	0	110.3	R287 L288 I357 D358 L432	R287-Y430 WeakPolarHBondContact O-CD2 3.28Å; L288-Y430 HydrophobicContact CB-CD2 4.21Å; L288-Y430 HydrophobicContact CD1-CD2 4.01Å; L288-Y430 HydrophobicContact CD1-CG 4.38Å; I357-Y430 WeakPolarHBondContact CA-O 3.48Å; D358-Y430 PolarHBondContact N-O 3.48Å; D358-Y430 PolarHBondContact O-N 3.06Å; Y430-L432 HydrophobicContact CD1-CB 4.49Å; Y430-L432 HydrophobicContact CE1-CB 3.79Å; Y430-L432 HydrophobicContact CE1-CD2 4.27Å
431	I	72.4	Confident	63.8	Low	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126	-177.7	-51	-177.4	0	0	0	108.3	L279 L281 G286 R287 Y289 I355 I356 I357 L429 L442 L444	L279-I431 HydrophobicContact CD2-CD1 4.2Å; L279-I431 HydrophobicContact CD2-CG2 4.36Å; L281-I431 HydrophobicContact CD1-CG2 4Å; G286-I431 CarbonylContact C-O 3.28Å; G286-I431 WeakPolarHBondContact CA-O 3.42Å; R287-I431 PolarHBondContact N-O 2.96Å; R287-I431 PolarHBondContact O-N 2.9Å; Y289-I431 HydrophobicContact CD2-CD1 4.37Å; Y289-I431 HydrophobicContact CE2-CD1 4.13Å; I355-I431 HydrophobicContact CG2-CG2 3.91Å; I356-I431 WeakPolarHBondContact O-CA 3.39Å; I357-I431 HydrophobicContact CG1-CG1 4.43Å; I357-I431 HydrophobicContact CG1-CG2 4.31Å; L429-I431 HydrophobicContact CD2-CD1 4.36Å; L429-I431 HydrophobicContact CG-CG1 4.37Å; I431-L442 HydrophobicContact CG2-CD1 4.17Å; I431-L444 HydrophobicContact CD1-CD1 3.57Å
432	L	67.4	Low	65.3	Low	38 Å²	38	46.1 Å²	46.1	20%	0.199	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124	-172.9	171	64.7	0	0	0	111.9	I355 I356 Y430	I355-L432 WeakPolarHBondContact CA-O 3.3Å; I355-L432 WeakPolarHBondContact CG2-O 3.4Å; I356-L432 HydrophobicContact CB-CB 4.47Å; I356-L432 PolarHBondContact N-O 3.39Å; I356-L432 PolarHBondContact O-N 3.06Å; Y430-L432 HydrophobicContact CD1-CB 4.49Å; Y430-L432 HydrophobicContact CE1-CB 3.79Å; Y430-L432 HydrophobicContact CE1-CD2 4.27Å
433	N	77	Confident	66.6	Low	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	121.8	166.8	180	10.7	0	0	0	110	L281 A282 M284 E285 A435 V438 V440	L281-N433 HydrophobicContact CB-CB 3.83Å; L281-N433 HydrophobicContact CD1-CB 4.21Å; L281-N433 PolarHBondContact O-ND2 3.3Å; A282-N433 PolarHBondContact O-ND2 3.01Å; M284-N433 WeakPolarHBondContact CA-O 3.46Å; E285-N433 PolarHBondContact O-N 3.01Å; N433-A435 VanDerWaalsContact OD1-CB 3.32Å; N433-A435 WeakPolarHBondContact OD1-CB 3.44Å; N433-A435 PolarHBondContact OD1-N 3.24Å; N433-V438 PolarHBondContact ND2-O 3.45Å; N433-V440 WeakPolarHBondContact OD1-CG2 3.44Å
434	Q	64.6	Low	67.6	Low	84 Å²	84	46.6 Å²	46.6	39%	0.393	23%	0.228	S	C	.	.			trans	-88.8	-9.7	177.8	-55	-168.8	-89.6	0	0	113.6	M284 P354 I356 S436	M284-Q434 VanDerWaalsContact CE-O 3.25Å; M284-Q434 WeakPolarHBondContact CE-O 3.39Å; P354-Q434 WeakPolarHBondContact O-CA 3.41Å; P354-Q434 VanDerWaalsContact O-CB 3.24Å; P354-Q434 WeakPolarHBondContact O-CB 3.44Å; P354-Q434 WeakPolarHBondContact O-CG 3.49Å; P354-Q434 PolarHBondContact O-N 3.05Å; I356-Q434 HydrophobicContact CD1-CG 4.23Å; I356-Q434 HydrophobicContact CG1-CG 4.1Å; Q434-S436 PolarHBondContact O-N 3.45Å
435	A	64.4	Low	68.7	Low	20 Å²	20	39.1 Å²	39.1	17%	0.165	19%	0.194	C	C	.	.			trans	-70.1	128.3	177.8	0	0	0	0	0	110.7	P283 M284 P354 N433	P283-A435 CarbonylContact C-O 3.53Å; P283-A435 WeakPolarHBondContact CA-O 3.37Å; M284-A435 PolarHBondContact N-O 2.77Å; P354-A435 HydrophobicContact CG-CB 4.23Å; N433-A435 VanDerWaalsContact OD1-CB 3.32Å; N433-A435 WeakPolarHBondContact OD1-CB 3.44Å; N433-A435 PolarHBondContact OD1-N 3.24Å
436	S	56.1	Low	69.6	Low	54 Å²	54	37.5 Å²	37.5	38%	0.378	19%	0.186	S	C	.	.	S	Bend	trans	-78.3	-21.2	-178.7	56.8	0	0	0	0	114.2	P283 Q434	P283-S436 WeakPolarHBondContact CB-O 3.12Å; Q434-S436 PolarHBondContact O-N 3.45Å
437	H	52.4	Low	70.3	Confident	130 Å²	130	36.3 Å²	36.3	60%	0.602	18%	0.179	S	C	*	.	S	Bend	trans	-134.8	1.8	-170.5	-56.1	-47.3	0	0	0	115.2
438	V	66.1	Low	70.8	Confident	45 Å²	45	38.1 Å²	38.1	27%	0.273	19%	0.191	S	C	.	.			trans	-136.2	137.6	-177.4	-143.7	0	0	0	0	111.6	I309 V310 N433	I309-V438 HydrophobicContact CG2-CB 3.95Å; I309-V438 HydrophobicContact CG2-CG1 3.32Å; I309-V438 HydrophobicContact CG2-CG2 4.5Å; V310-V438 VanDerWaalsContact O-CG1 3.23Å; V310-V438 WeakPolarHBondContact O-CG1 3.24Å; N433-V438 PolarHBondContact ND2-O 3.45Å
439	A	73	Confident	70.6	Confident	20 Å²	20	40.4 Å²	40.4	17%	0.165	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	150.8	173.7	0	0	0	0	0	110.1	L281 V310	L281-A439 CarbonylContact O-C 3.57Å; L281-A439 VanDerWaalsContact O-CA 3.28Å; L281-A439 WeakPolarHBondContact O-CA 3.45Å; V310-A439 HydrophobicContact CB-CB 4.23Å; V310-A439 PolarHBondContact N-O 2.99Å
440	V	76.6	Confident	70	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.9	-177.4	-172.7	0	0	0	0	110.1	L281 R308 P354 I355 N433 L442	L281-V440 PolarHBondContact N-O 2.82Å; L281-V440 PolarHBondContact O-N 2.93Å; R308-V440 WeakPolarHBondContact O-CA 3.44Å; R308-V440 WeakPolarHBondContact O-CG1 3.35Å; P354-V440 HydrophobicContact CG-CG2 4.17Å; I355-V440 HydrophobicContact CD1-CB 4.36Å; I355-V440 HydrophobicContact CD1-CG1 3.81Å; N433-V440 WeakPolarHBondContact OD1-CG2 3.44Å; V440-L442 HydrophobicContact CG1-CD2 4.49Å
441	Y	82.1	Confident	69	Low	79 Å²	79	43 Å²	43	31%	0.31	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142	170.9	179.9	-81.3	0	0	0	110	D278 L279 C307 R308	D278-Y441 HydrophobicContact CB-CE2 4.39Å; D278-Y441 WeakPolarHBondContact CB-OH 3.49Å; D278-Y441 PolarHBondContact OD1-OH 3.3Å; L279-Y441 CarbonylContact O-C 3.57Å; C307-Y441 CarbonylContact C-O 3.56Å; C307-Y441 WeakPolarHBondContact CA-O 3.36Å; R308-Y441 PolarHBondContact N-O 3.23Å; R308-Y441 PolarHBondContact O-N 3.19Å
442	L	80.4	Confident	67.3	Low	2 Å²	2	48.7 Å²	48.7	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	155.3	-179.4	-65.9	169.4	0	0	0	112.6	D278 L279 L281 L304 D306 C307 I355 I431 V440 L444	D278-L442 CarbonylContact C-O 3.43Å; D278-L442 VanDerWaalsContact CA-O 3.29Å; D278-L442 WeakPolarHBondContact CA-O 3.34Å; L279-L442 HydrophobicContact CB-CB 4.21Å; L279-L442 HydrophobicContact CD2-CD1 4.28Å; L279-L442 PolarHBondContact N-O 2.96Å; L279-L442 WeakPolarHBondContact O-CB 3.33Å; L279-L442 PolarHBondContact O-N 3.41Å; L281-L442 HydrophobicContact CD1-CD1 4.25Å; L304-L442 HydrophobicContact CD1-CD2 3.58Å; D306-L442 WeakPolarHBondContact O-CA 3.46Å; C307-L442 HydrophobicContact CB-CD2 3.91Å; I355-L442 HydrophobicContact CD1-CD1 3.59Å; I355-L442 HydrophobicContact CD1-CD2 3.28Å; I355-L442 HydrophobicContact CD1-CG 3.71Å; I431-L442 HydrophobicContact CG2-CD1 4.17Å; V440-L442 HydrophobicContact CG1-CD2 4.49Å; L442-L444 HydrophobicContact CD1-CD1 4.39Å
443	R	81	Confident	65.7	Low	90 Å²	90	51.1 Å²	51.1	34%	0.34	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.5	165.1	-167.2	168.5	-148	-123.6	11.2	111.4	P276 D278 E305 D306	P276-R443 HydrophobicContact CB-CG 4.17Å; D278-R443 WeakPolarHBondContact OD1-CB 3.32Å; D278-R443 VanDerWaalsContact OD1-CD 3.31Å; D278-R443 WeakPolarHBondContact OD1-CD 3.34Å; D278-R443 WeakPolarHBondContact OD1-CG 3.22Å; D278-R443 IonicContact OD1-NE 3.63Å; D278-R443 PolarHBondContact OD1-NE 3.05Å; D278-R443 IonicContact OD2-NE 2.68Å; E305-R443 HydrophobicContact CB-CB 4.24Å; E305-R443 HydrophobicContact CB-CG 4.25Å; E305-R443 PolarHBondContact N-O 2.78Å; E305-R443 WeakPolarHBondContact OE2-CD 3.42Å; E305-R443 IonicContact OE2-CZ 2.89Å; E305-R443 IonicContact OE2-NE 3.09Å; E305-R443 IonicContact OE2-NH1 2.9Å; E305-R443 PolarHBondContact OE2-NH1 3.41Å; D306-R443 HydrophobicContact CB-CB 3.86Å; D306-R443 PolarHBondContact O-N 3.35Å
444	L	78.1	Confident	63.6	Low	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.9	-169.9	-70.5	161.8	0	0	0	111.8	P276 F277 L279 V302 I303 L304 I357 I431 L442	P276-L444 CarbonylContact C-O 3.53Å; P276-L444 VanDerWaalsContact CA-O 3.26Å; P276-L444 WeakPolarHBondContact CA-O 3.37Å; F277-L444 HydrophobicContact CD1-CB 4.3Å; F277-L444 HydrophobicContact CE1-CB 3.82Å; F277-L444 HydrophobicContact CE2-CB 4.07Å; F277-L444 HydrophobicContact CE2-CD1 3.72Å; F277-L444 HydrophobicContact CZ-CB 3.7Å; F277-L444 HydrophobicContact CZ-CD1 3.75Å; F277-L444 HydrophobicContact CZ-CG 4.39Å; F277-L444 PolarHBondContact N-O 2.92Å; F277-L444 PolarHBondContact O-N 3.47Å; L279-L444 HydrophobicContact CD2-CD1 4.46Å; V302-L444 HydrophobicContact CG1-CD2 4.09Å; I303-L444 WeakPolarHBondContact O-CA 3.36Å; L304-L444 HydrophobicContact CB-CD2 4.35Å; L304-L444 HydrophobicContact CD1-CD2 3.95Å; I357-L444 HydrophobicContact CD1-CD2 4.09Å; I431-L444 HydrophobicContact CD1-CD1 3.57Å; L442-L444 HydrophobicContact CD1-CD1 4.39Å
445	V	76.1	Confident	61.9	Low	20 Å²	20	60.6 Å²	60.6	12%	0.121	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.1	171.9	172.3	0	0	0	0	109.4	P276 V302 I303 E305 I447	P276-V445 HydrophobicContact CB-CG2 3.72Å; P276-V445 HydrophobicContact CG-CG2 4.5Å; V302-V445 CarbonylContact C-O 3.59Å; V302-V445 WeakPolarHBondContact CA-O 3.44Å; I303-V445 HydrophobicContact CB-CB 4.33Å; I303-V445 PolarHBondContact N-O 3.41Å; I303-V445 PolarHBondContact O-N 3.46Å; E305-V445 HydrophobicContact CG-CG2 3.91Å; E305-V445 WeakPolarHBondContact OE1-CG2 3.34Å; V445-I447 HydrophobicContact CG1-CD1 4.4Å; V445-I447 HydrophobicContact CG1-CG1 3.88Å
446	I	74.4	Confident	60.3	Low	8 Å²	8	69 Å²	69	4%	0.041	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.4	177.8	-62.1	-170.3	0	0	0	108.9	L270 F272 F277 L291 I300 D301 V302 L429	L270-I446 HydrophobicContact CD2-CD1 3.48Å; L270-I446 VanDerWaalsContact CD2-CD1 3.48Å; F272-I446 HydrophobicContact CD1-CG2 3.94Å; F272-I446 HydrophobicContact CE1-CG2 3.94Å; F277-I446 HydrophobicContact CE1-CD1 3.83Å; F277-I446 HydrophobicContact CE1-CG1 4.09Å; F277-I446 HydrophobicContact CZ-CD1 4.46Å; L291-I446 HydrophobicContact CD2-CD1 4.33Å; I300-I446 HydrophobicContact CG2-CG2 3.46Å; I300-I446 VanDerWaalsContact CG2-CG2 3.46Å; D301-I446 WeakPolarHBondContact O-CA 3.3Å; V302-I446 HydrophobicContact CG1-CG1 4.38Å; V302-I446 HydrophobicContact CG2-CD1 4.45Å; V302-I446 HydrophobicContact CG2-CG1 4.26Å; L429-I446 HydrophobicContact CD2-CD1 4.18Å
447	I	70.9	Confident	59	Low	60 Å²	60	73.6 Å²	73.6	31%	0.308	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.4	-178.6	-52.8	-173.1	0	0	0	109.9	D301 I303 V445	D301-I447 HydrophobicContact CB-CB 4.33Å; D301-I447 PolarHBondContact N-O 3.28Å; D301-I447 PolarHBondContact O-N 3.35Å; I303-I447 HydrophobicContact CD1-CD1 3.63Å; I303-I447 HydrophobicContact CD1-CG1 4.27Å; V445-I447 HydrophobicContact CG1-CD1 4.4Å; V445-I447 HydrophobicContact CG1-CG1 3.88Å
448	P	69	Low	57.8	Low	49 Å²	49	71.9 Å²	71.9	32%	0.318	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.4	174.6	32.7	-36.7	0	0	0	111.4	M297 F450	M297-P448 HydrophobicContact CE-CB 3.23Å; P448-F450 HydrophobicContact CB-CE2 3.87Å; P448-F450 HydrophobicContact CB-CZ 4.39Å; P448-F450 HydrophobicContact CG-CE2 4.27Å
449	K	61.6	Low	55.9	Low	79 Å²	79	80.7 Å²	80.7	34%	0.343	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.5	170.7	-54.6	-64.5	178.8	-172.1	0	110.3	T298 S299 D301	T298-K449 PolarHBondContact N-O 2.95Å; T298-K449 PolarHBondContact OG1-O 2.82Å; S299-K449 PolarHBondContact N-O 3.07Å; S299-K449 WeakPolarHBondContact O-CB 3.46Å; S299-K449 PolarHBondContact O-N 3.01Å; S299-K449 WeakPolarHBondContact OG-CB 3.44Å; D301-K449 WeakPolarHBondContact OD2-CE 3.12Å; D301-K449 IonicContact OD2-NZ 2.9Å
450	F	57.7	Low	53.7	Low	91 Å²	91	86.7 Å²	86.7	40%	0.399	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	157.8	-179.1	-64.4	-89.1	0	0	0	110.5	M294 E296 M297 P448	M294-F450 HydrophobicContact CB-CE1 4.16Å; M294-F450 HydrophobicContact CB-CZ 4.4Å; M294-F450 HydrophobicContact SD-CZ 4.1Å; E296-F450 HydrophobicContact CB-CD1 4.36Å; M297-F450 HydrophobicContact CB-CD1 4.25Å; M297-F450 HydrophobicContact CB-CE1 3.97Å; M297-F450 HydrophobicContact CG-CE1 4.38Å; P448-F450 HydrophobicContact CB-CE2 3.87Å; P448-F450 HydrophobicContact CB-CZ 4.39Å; P448-F450 HydrophobicContact CG-CE2 4.27Å
451	G	48.8	Very low	51.3	Low	33 Å²	33	96.6 Å²	96.6	34%	0.34	50%	0.495	S	S	.	.			trans	-77.5	146.7	-178.9	0	0	0	0	0	113.6	A453	G451-A453 PolarHBondContact O-N 3.42Å
452	C	34.8	Very low	48.7	Very low	119 Å²	119	101 Å²	101	80%	0.804	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	29.9	-178.6	-54.3	0	0	0	0	115.2
453	A	34.9	Very low	46.1	Very low	90 Å²	90	108.2 Å²	108.2	74%	0.744	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-28.4	176.5	0	0	0	0	0	112.6	G451	G451-A453 PolarHBondContact O-N 3.42Å
454	L	33.2	Very low	43.4	Very low	109 Å²	109	110.4 Å²	110.4	57%	0.571	57%	0.569	S	S	*	*			trans	-111.7	54.9	-167.9	-118	165.8	0	0	0	114	E296	E296-L454 VanDerWaalsContact OE2-CD1 3.27Å; E296-L454 WeakPolarHBondContact OE2-CD1 3.33Å
455	M	29.3	Very low	40.9	Very low	173 Å²	173	117.6 Å²	117.6	85%	0.852	61%	0.608	S	S	*	*	S	Bend	trans	-119.4	23.6	167.7	-146.9	176.4	-167.6	0	0	112.9
456	K	30.1	Very low	38.5	Very low	197 Å²	197	127.4 Å²	127.4	86%	0.857	65%	0.645	S	S	*	*	S	Bend	trans	-110.8	-2.9	-176	-121.6	179.1	-176.5	179	0	115.5
457	N	27.7	Very low	36.3	Very low	151 Å²	151	134.3 Å²	134.3	81%	0.807	68%	0.68	S	S	*	*	S	Bend	trans	-125.5	9.6	-174.4	-99.5	2	0	0	0	115.4
458	S	29	Very low	34.2	Very low	94 Å²	94	139.3 Å²	139.3	66%	0.657	70%	0.702	S	S	*	*			trans	-102.9	77.4	168.7	48.4	0	0	0	0	110.9
459	R	25.6	Very low	32.2	Very low	229 Å²	229	147.8 Å²	147.8	86%	0.864	73%	0.728	S	S	*	*			trans	-69	151.4	158.7	-69.5	-178.5	179.7	171.4	-0.4	108.5
460	N	25.9	Very low	30.7	Very low	147 Å²	147	152 Å²	152	79%	0.786	75%	0.749	S	S	*	*			trans	74	78.8	179.1	-48.2	-6.3	0	0	0	115
461	F	26.1	Very low	29.2	Very low	209 Å²	209	151.6 Å²	151.6	92%	0.917	76%	0.757	S	S	*	*				-140.8	133.2	126.4	-104.7	-79.2	0	0	0	108.3
462	H	28.8	Very low	28.1	Very low	170 Å²	170	159.4 Å²	159.4	79%	0.787	78%	0.782	S	S	*	*			trans	-73.7	134.7	172.6	-80.8	-105.3	0	0	0	108.6
463	H	24.4	Very low	27.7	Very low	154 Å²	154	163.2 Å²	163.2	71%	0.713	79%	0.785	S	S	*	*				72.7	133.7	75.1	-128.8	-71.8	0	0	0	112.3
464	D	25	Very low	27.3	Very low	136 Å²	136	166.3 Å²	166.3	73%	0.727	79%	0.788	S	S	*	*			trans	69.9	86.6	171.1	-49.3	-33.1	0	0	0	117.3
465	D	25.8	Very low	26.8	Very low	152 Å²	152	166.7 Å²	166.7	81%	0.813	80%	0.8	S	S	*	*				-157.5	170.5	106	-130.1	-32.2	0	0	0	113.2
466	Y	25.3	Very low	26.5	Very low	226 Å²	226	163.8 Å²	163.8	89%	0.886	80%	0.797	S	S	*	*			trans	66.2	77.6	179	-70.1	-79.9	0	0	0	118.2
467	L	27.4	Very low	26.4	Very low	152 Å²	152	162.8 Å²	162.8	80%	0.796	80%	0.795	S	S	*	*			trans	-104.7	151.1	159.9	-112.9	171.4	0	0	0	111.5
468	H	28	Very low	26.3	Very low	166 Å²	166	164.3 Å²	164.3	77%	0.769	80%	0.795	S	S	*	*			trans	68.6	147.4	172.2	-67.6	-38.6	0	0	0	116.9
469	R	27.2	Very low	26	Very low	227 Å²	227	167.8 Å²	167.8	86%	0.857	81%	0.805	S	S	*	*			cis	-139.8	148.6	8.2	-109.7	155.5	-175.7	168.8	0.9	106.2
470	Q	28.9	Very low	26	Very low	167 Å²	167	161.9 Å²	161.9	78%	0.78	80%	0.799	S	S	*	*			cis	-134.7	169	10.7	-64.5	-158.9	75.5	0	0	108.7
471	S	26.7	Very low	26.1	Very low	83 Å²	83	163.3 Å²	163.3	58%	0.58	81%	0.805	S	S	*	*			cis	73.2	133.4	27.4	68.7	0	0	0	0	116.2
472	K	25.1	Very low	26	Very low	196 Å²	196	161.4 Å²	161.4	85%	0.852	80%	0.796	S	S	*	*			cis	-162	169.1	3.5	-126.1	170.6	-175.9	175.8	0	110.6
473	K	27.8	Very low	25.9	Very low	199 Å²	199	160.6 Å²	160.6	87%	0.865	79%	0.792	S	S	*	*			trans	77	139.9	175.6	-63.3	-176.1	178.5	179.4	0	115.3
474	L	26.6	Very low	26	Very low	155 Å²	155	162.6 Å²	162.6	81%	0.812	80%	0.802	S	S	*	*			cis	-151.6	124.7	-6.4	-165	76.6	0	0	0	111.9
475	S	21.7	Very low	25.9	Very low	117 Å²	117	163.2 Å²	163.2	82%	0.818	81%	0.805	S	S	*	*			trans	-163.7	96.8	166.8	46.8	0	0	0	0	112.2
476	S	23.4	Very low	26	Very low	112 Å²	112	165.6 Å²	165.6	78%	0.783	81%	0.808	S	S	*	*			trans	-175.8	59.8	170.2	56.1	0	0	0	0	114.6
477	Q	28.3	Very low	26	Very low	177 Å²	177	159.7 Å²	159.7	83%	0.827	80%	0.801	S	S	*	*			trans	-155.6	138.6	160.5	-71.3	-159.5	-16.8	0	0	108.5
478	F	25.9	Very low	25.9	Very low	183 Å²	183	161.3 Å²	161.3	80%	0.803	80%	0.801	S	S	*	*			cis	-155.9	140.7	-18.9	-120.1	-64.8	0	0	0	106.6
479	L	23	Very low	25.8	Very low	166 Å²	166	160.8 Å²	160.8	87%	0.869	80%	0.797	S	S	*	*			trans	-153.6	82.1	173.7	-131.5	178.4	0	0	0	113.5
480	S	23.9	Very low	25.9	Very low	106 Å²	106	155.5 Å²	155.5	74%	0.741	79%	0.785	S	S	*	*			trans	159.7	111.3	137	49	0	0	0	0	112.9
481	I	28.6	Very low	25.8	Very low	177 Å²	177	156.3 Å²	156.3	91%	0.908	79%	0.786	S	S	*	*			trans	-136.8	154.5	144.4	-64.5	-171	0	0	0	105.9
482	K	23.6	Very low	26	Very low	169 Å²	169	159.5 Å²	159.5	74%	0.735	80%	0.795	S	S	*	*			trans	-139.6	154.3	-163.1	-167.2	-172	177.6	-172.5	0	110.3
483	H	26.5	Very low	26.1	Very low	153 Å²	153	156 Å²	156	71%	0.708	79%	0.786	S	S	*	*			trans	73	148.9	-174.2	-56	-87.1	0	0	0	112.5
484	E	27.3	Very low	26.1	Very low	195 Å²	195	154.6 Å²	154.6	91%	0.911	78%	0.78	S	S	*	*			cis	-122.3	-152.2	32.2	-62.4	-167.9	105.5	0	0	116.5
485	N	23.6	Very low	26.2	Very low	150 Å²	150	153.3 Å²	153.3	80%	0.802	77%	0.774	S	S	*	*			trans	-148.4	167.9	-155.5	-130	-17.5	0	0	0	111.5
486	K	28.4	Very low	26.5	Very low	201 Å²	201	157.4 Å²	157.4	87%	0.874	77%	0.772	S	S	*	*			trans	79.1	162.6	178.3	-54.2	171.3	179.9	172.6	0	116.2
487	S	23.3	Very low	26.8	Very low	103 Å²	103	157 Å²	157	72%	0.72	77%	0.765	S	S	*	*			cis	171.8	113.7	-36.7	177.9	0	0	0	0	108.8
488	F	27.2	Very low	26.9	Very low	185 Å²	185	153.7 Å²	153.7	81%	0.811	76%	0.757	S	S	*	*			trans	166.7	136.7	152.4	-114	-109.4	0	0	0	106
489	K	24.9	Very low	27	Very low	156 Å²	156	151.6 Å²	151.6	68%	0.678	75%	0.754	S	S	*	*			cis	100	125.1	19.4	-154.3	-161.9	178.3	-165.4	0	113.6
490	D	29.6	Very low	27.4	Very low	115 Å²	115	149.5 Å²	149.5	62%	0.615	74%	0.744	S	S	*	*			trans	66.6	154.7	173.6	-60.3	-47.7	0	0	0	117.1
491	K	26.6	Very low	27.5	Very low	184 Å²	184	151 Å²	151	80%	0.8	74%	0.742	S	S	*	*			cis	-170	-164.4	-43.8	-130.7	176.3	-178.2	177.1	0	107.5
492	I	30.9	Very low	27.5	Very low	150 Å²	150	149.6 Å²	149.6	77%	0.769	74%	0.736	S	S	*	*			trans	77.7	127.3	170.2	-60.4	172.2	0	0	0	113.3
493	N	27.7	Very low	27.5	Very low	122 Å²	122	151.5 Å²	151.5	65%	0.652	74%	0.74	S	S	*	*			cis	-150.9	157.3	-0.5	-117	3.9	0	0	0	113.4
494	F	27.4	Very low	27.4	Very low	170 Å²	170	154.5 Å²	154.5	75%	0.746	75%	0.745	S	S	*	*			trans	29.5	127.6	145.6	-71.7	-125.2	0	0	0	117.8
495	N	27.6	Very low	27.3	Very low	129 Å²	129	152.5 Å²	152.5	69%	0.69	73%	0.734	S	S	*	*			cis	-169.1	177.3	36.2	-131.5	-12	0	0	0	109.4
496	R	29.3	Very low	27.3	Very low	202 Å²	202	153.3 Å²	153.3	76%	0.762	73%	0.731	S	S	*	*			cis	-159.2	162.9	2.2	-153.8	-176.7	-171.5	167.3	2.5	109.1
497	T	29.8	Very low	27.2	Very low	105 Å²	105	150.7 Å²	150.7	64%	0.644	73%	0.725	S	S	*	*			trans	29.6	135.7	148.8	47.8	0	0	0	0	122.9
498	T	30	Very low	27.2	Very low	106 Å²	106	150.4 Å²	150.4	65%	0.65	72%	0.723	S	S	*	*			cis	-176.8	144.2	-10.6	13.6	0	0	0	0	110.3
499	N	28.9	Very low	27.2	Very low	140 Å²	140	149.8 Å²	149.8	75%	0.749	73%	0.727	S	S	*	*			trans	60.4	151.5	144.7	-57.4	3.7	0	0	0	119.3
500	N	29.8	Very low	27.2	Very low	121 Å²	121	147 Å²	147	65%	0.647	73%	0.727	S	S	*	*			cis	-153	148.9	-2.3	-109.1	4.7	0	0	0	107.9
501	I	27.6	Very low	27	Very low	138 Å²	138	149.7 Å²	149.7	71%	0.708	74%	0.741	S	S	*	*				55.8	123.4	82.2	-57.6	178.8	0	0	0	112
502	N	27.8	Very low	26.9	Very low	147 Å²	147	148 Å²	148	79%	0.786	74%	0.739	S	S	*	*			cis	-152.7	-171.1	15.2	-140.5	-16.6	0	0	0	115.2
503	Y	23.6	Very low	26.9	Very low	210 Å²	210	145.4 Å²	145.4	82%	0.824	73%	0.732	S	S	*	*			trans	-83.2	163.1	-174.4	-83.8	-95.5	0	0	0	118.9
504	R	24.8	Very low	26.7	Very low	215 Å²	215	150.1 Å²	150.1	81%	0.811	74%	0.741	S	S	*	*			trans	93.1	117.1	141.9	-88.5	178	178.9	-173.5	1	123.2
505	F	24.7	Very low	26.7	Very low	154 Å²	154	147.1 Å²	147.1	68%	0.675	73%	0.731	S	S	*	*			trans	84.1	129.4	131.7	-86.2	-55.4	0	0	0	125.1
506	F	24.3	Very low	26.7	Very low	166 Å²	166	144.6 Å²	144.6	73%	0.728	72%	0.718	S	S	*	*			trans	76.9	121.8	145.4	-79	-57.9	0	0	0	124
507	L	25.2	Very low	26.8	Very low	146 Å²	146	140.3 Å²	140.3	76%	0.764	72%	0.717	S	S	*	*			trans	73.4	103.4	141.7	-82.8	157.4	0	0	0	121.8
508	S	24.1	Very low	26.7	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	71%	0.707	S	S	*	*			trans	58.9	112.5	134.7	62.6	0	0	0	0	120.8
509	I	26.5	Very low	26.5	Very low	173 Å²	173	145.6 Å²	145.6	89%	0.887	72%	0.719	S	S	*	*				-152.7	147.7	122.3	-100.6	151.2	0	0	0	107.9
510	S	25.2	Very low	26.2	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	72%	0.718	S	S	*	*			trans	-102.1	132.4	-176.9	179.2	0	0	0	0	111.9
511	L	25.6	Very low	25.9	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	72%	0.724	S	S	*	*			trans	-149.3	112.8	161	-91.2	175.7	0	0	0	110.3
512	L	24.7	Very low	25.8	Very low	148 Å²	148	148.7 Å²	148.7	78%	0.775	74%	0.737	S	S	*	*			trans	-84.6	173.1	164.2	-82.9	103.4	0	0	0	110.7
513	P	29.4	Very low	25.6	Very low	95 Å²	95	146.8 Å²	146.8	62%	0.617	73%	0.731	S	S	*	*			cis	-117.4	-166.8	-14.3	37.1	-21.1	0	0	0	111.2
514	W	25.5	Very low	25.8	Very low	222 Å²	222	142.1 Å²	142.1	84%	0.841	73%	0.726	S	S	*	*				-151.3	114.5	77.5	-97.3	50.8	0	0	0	112.7
515	I	25.8	Very low	26	Very low	106 Å²	106	141.1 Å²	141.1	54%	0.544	73%	0.731	S	S	.	*			trans	62.1	104.4	137.9	-49.6	172.9	0	0	0	118.3
516	N	29.3	Very low	26	Very low	77 Å²	77	145.4 Å²	145.4	41%	0.412	74%	0.744	S	S	.	*			trans	66.4	66.2	148.8	-156.4	-4	0	0	0	118.6	D518 D805	N516-D518 WeakPolarHBondContact CA-OD2 3.44Å; N516-D518 PolarHBondContact N-OD2 2.85Å; N516-D805 WeakPolarHBondContact CB-OD1 3.49Å; N516-D805 VanDerWaalsContact CB-OD2 3.29Å; N516-D805 WeakPolarHBondContact CB-OD2 3.5Å; N516-D805 PolarHBondContact ND2-OD1 2.99Å; N516-D805 PolarHBondContact ND2-OD2 3.12Å
517	P	31.2	Very low	26.2	Very low	112 Å²	112	140.9 Å²	140.9	73%	0.727	74%	0.744	S	S	*	*				-106.7	24.8	129	-6.4	26.7	0	0	0	111.5	W519	P517-W519 PolarHBondContact O-N 3.18Å
518	D	27.4	Very low	26.3	Very low	81 Å²	81	143.2 Å²	143.2	43%	0.433	75%	0.751	S	S	.	*			trans	-84.3	63.5	-146.4	-67.4	-43	0	0	0	115.9	N516	N516-D518 WeakPolarHBondContact CA-OD2 3.44Å; N516-D518 PolarHBondContact N-OD2 2.85Å
519	W	24.5	Very low	26.3	Very low	240 Å²	240	147.3 Å²	147.3	91%	0.909	76%	0.757	S	S	*	*			trans	-128.2	83.1	140.1	-98	72.6	0	0	0	108.1	P517	P517-W519 PolarHBondContact O-N 3.18Å
520	P	24.4	Very low	26.3	Very low	113 Å²	113	149 Å²	149	73%	0.734	76%	0.758	S	S	*	*			trans	-75.8	134.9	178.4	30.1	-33.2	0	0	0	111.4
521	E	23.6	Very low	26.3	Very low	164 Å²	164	154.8 Å²	154.8	77%	0.766	77%	0.765	S	S	*	*			trans	-68	135.4	166.7	-66.4	170.6	119.7	0	0	110.2	T523	E521-T523 VanDerWaalsContact C-N 3.28Å; E521-T523 HydrophobicContact CB-CG2 4.13Å; E521-T523 PolarHBondContact O-N 2.95Å
522	L	23.5	Very low	26.3	Very low	187 Å²	187	154.4 Å²	154.4	98%	0.979	76%	0.763	S	S	*	*			trans	-71.5	96.2	153.6	-85.1	168	0	0	0	107.6
523	T	25.5	Very low	26.2	Very low	107 Å²	107	155.3 Å²	155.3	66%	0.656	76%	0.761	S	S	*	*			trans	-74.6	166.7	177	29.8	0	0	0	0	110.5	E521	E521-T523 VanDerWaalsContact C-N 3.28Å; E521-T523 HydrophobicContact CB-CG2 4.13Å; E521-T523 PolarHBondContact O-N 2.95Å
524	P	26.7	Very low	26.1	Very low	113 Å²	113	157.6 Å²	157.6	73%	0.734	77%	0.773	S	S	*	*			cis	-142.6	162.6	28.7	41.8	-23.5	0	0	0	118.6
525	E	28.4	Very low	26	Very low	193 Å²	193	154.3 Å²	154.3	90%	0.902	77%	0.766	S	S	*	*				-153.1	152.4	120.1	-124.6	175.3	-171	0	0	111.2
526	Y	26.3	Very low	26.1	Very low	244 Å²	244	160 Å²	160	96%	0.957	78%	0.783	S	S	*	*			trans	-86.3	127.4	-177	-103.1	-112.9	0	0	0	111.1
527	G	27.8	Very low	25.9	Very low	71 Å²	71	160.6 Å²	160.6	73%	0.732	79%	0.793	S	S	*	*			trans	-169.1	117.9	174.4	0	0	0	0	0	112.8
528	E	27.2	Very low	25.6	Very low	195 Å²	195	160.7 Å²	160.7	91%	0.911	79%	0.792	S	S	*	*			trans	-52.9	135	-168.3	-58.1	-172.8	129.7	0	0	115.7
529	K	25	Very low	25.5	Very low	183 Å²	183	164.8 Å²	164.8	80%	0.796	81%	0.814	S	S	*	*			trans	-99.1	122.7	159	-78.2	178.3	179.6	165.6	0	110
530	K	25.4	Very low	25.5	Very low	210 Å²	210	159 Å²	159	91%	0.913	81%	0.805	S	S	*	*			trans	-111.7	105.3	166.9	-140.1	171.4	-168	169.1	0	109.7
531	W	24.3	Very low	25.5	Very low	219 Å²	219	163.3 Å²	163.3	83%	0.83	82%	0.815	S	S	*	*			trans	-84.8	136.2	174.7	-74.8	86.9	0	0	0	110.6
532	L	25.9	Very low	25.5	Very low	163 Å²	163	163.8 Å²	163.8	85%	0.853	82%	0.818	S	S	*	*			trans	-106.8	115.1	161	-105.8	162.3	0	0	0	108.5
533	K	22.8	Very low	25.6	Very low	167 Å²	167	162.2 Å²	162.2	73%	0.726	81%	0.809	S	S	*	*			trans	-86.8	142.7	164.3	-70.9	-177.7	177.4	-178.2	0	108.8
534	T	27.9	Very low	25.5	Very low	143 Å²	143	164.8 Å²	164.8	88%	0.877	82%	0.817	S	S	*	*			trans	-130.8	115.9	158	0.3	0	0	0	0	108.4
535	H	23.6	Very low	25.3	Very low	152 Å²	152	165.2 Å²	165.2	70%	0.704	82%	0.818	S	S	*	*			trans	-90.4	141.5	168.9	-75.6	-98.8	0	0	0	109
536	Y	27.5	Very low	25	Very low	225 Å²	225	160.6 Å²	160.6	88%	0.882	81%	0.807	S	S	*	*			trans	-166.2	110.9	133.1	-93.8	-70.7	0	0	0	104.9
537	S	25.4	Very low	25	Very low	91 Å²	91	155.2 Å²	155.2	64%	0.636	80%	0.795	S	S	*	*				56.6	133.7	77.5	132.7	0	0	0	0	112.1
538	T	24.2	Very low	24.7	Very low	113 Å²	113	162.7 Å²	162.7	69%	0.693	81%	0.808	S	S	*	*			cis	176.7	110.1	-4.1	21.5	0	0	0	0	103.8
539	N	24.8	Very low	24.6	Very low	168 Å²	168	155.1 Å²	155.1	90%	0.898	78%	0.782	S	S	*	*			trans	168.2	138.2	162.3	-90.3	-20.9	0	0	0	107.2
540	T	26.2	Very low	24.6	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.724	78%	0.78	S	S	*	*			cis	-128.8	166.7	4.9	49.6	0	0	0	0	111.7	Q542	T540-Q542 PolarHBondContact O-N 3.22Å
541	Q	22.7	Very low	24.7	Very low	204 Å²	204	152.4 Å²	152.4	95%	0.953	78%	0.777	S	S	*	*			trans	-82.7	83.6	176.6	-69.2	177.1	-60.5	0	0	112
542	Q	24.2	Very low	24.9	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.813	77%	0.767	S	S	*	*			trans	-154	68.9	170.3	-119.3	179.2	8.7	0	0	112.4	T540	T540-Q542 PolarHBondContact O-N 3.22Å
543	L	25.1	Very low	25.1	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	77%	0.765	S	S	*	*			trans	-174.7	83.4	161.4	-106.1	158.9	0	0	0	110.7
544	I	23.2	Very low	25.3	Very low	161 Å²	161	147.3 Å²	147.3	83%	0.826	77%	0.766	S	S	*	*			trans	-129.7	134.4	163.3	-62	-178.5	0	0	0	106.7
545	T	22.8	Very low	25.6	Very low	122 Å²	122	146.8 Å²	146.8	75%	0.748	75%	0.753	S	S	*	*	S	Bend	trans	75.7	152.3	-165.3	75.2	0	0	0	0	115.4
546	S	23.1	Very low	25.7	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	75%	0.753	S	S	*	*			trans	52.3	88.2	-179.4	54.9	0	0	0	0	119.4
547	N	24.8	Very low	25.8	Very low	131 Å²	131	136.3 Å²	136.3	70%	0.701	74%	0.736	S	S	*	*				-179.8	101.8	123.7	-98.2	-52.8	0	0	0	112.8
548	F	23.5	Very low	26	Very low	228 Å²	228	141.9 Å²	141.9	100%	1	74%	0.744	S	S	*	*			trans	-137.1	98	152.9	-104.1	-80.3	0	0	0	105.9
549	G	24.3	Very low	26.1	Very low	36 Å²	36	144.5 Å²	144.5	37%	0.371	75%	0.748	S	S	.	*			trans	-171.1	105.4	-170.2	0	0	0	0	0	115.1
550	L	24.9	Very low	26.2	Very low	142 Å²	142	143.6 Å²	143.6	74%	0.743	74%	0.743	S	S	*	*			trans	61.3	128.8	165.4	-73.1	75.2	0	0	0	117.6	T382	T382-L550 HydrophobicContact CG2-CD2 3.48Å; T382-L550 VanDerWaalsContact CG2-CD2 3.48Å
551	F	26.5	Very low	26.2	Very low	194 Å²	194	145.3 Å²	145.3	85%	0.851	75%	0.747	S	S	*	*			trans	-78.8	139.9	154.5	-80.1	-102.1	0	0	0	108.8	F553	F551-F553 HydrophobicContact CB-CE2 4.44Å
552	D	29.9	Very low	26.3	Very low	116 Å²	116	140.7 Å²	140.7	62%	0.62	74%	0.735	S	S	*	*			trans	-104.8	136.8	166.2	-169.8	-11.4	0	0	0	108.5	N554	D552-N554 PolarHBondContact OD1-N 2.96Å
553	F	28.7	Very low	26.4	Very low	184 Å²	184	139.1 Å²	139.1	81%	0.807	73%	0.732	S	S	*	*	S	Bend	trans	-100.8	-8	179.9	-84	-89.8	0	0	0	113.1	F551	F551-F553 HydrophobicContact CB-CE2 4.44Å
554	N	29.1	Very low	26.3	Very low	141 Å²	141	137 Å²	137	75%	0.754	73%	0.728	S	S	*	*			trans	-97.4	17.3	-170	-67	-11.9	0	0	0	114.2	D552 P556	D552-N554 PolarHBondContact OD1-N 2.96Å; N554-P556 WeakPolarHBondContact O-CD 3.24Å
555	H	33.3	Very low	26.3	Very low	133 Å²	133	139.8 Å²	139.8	62%	0.616	73%	0.73	S	S	*	*			trans	-73.3	122.3	177.4	-164.4	-49.9	0	0	0	110.4	G557	H555-G557 PolarHBondContact ND1-N 2.84Å; H555-G557 PolarHBondContact O-N 3.48Å
556	P	25.2	Very low	26.3	Very low	106 Å²	106	141.5 Å²	141.5	69%	0.688	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-69.9	12.5	-175.9	28.5	-36.4	0	0	0	115	N554 Y558	N554-P556 WeakPolarHBondContact O-CD 3.24Å; P556-Y558 VanDerWaalsContact C-N 3.33Å
557	G	29.1	Very low	26.2	Very low	51 Å²	51	147.1 Å²	147.1	53%	0.526	74%	0.739	S	S	.	*	G	3₁₀ helix	trans	-86.7	0.7	177.9	0	0	0	0	0	114.3	H555	H555-G557 PolarHBondContact ND1-N 2.84Å; H555-G557 PolarHBondContact O-N 3.48Å
558	Y	30	Very low	26.2	Very low	207 Å²	207	146.2 Å²	146.2	81%	0.812	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-106.1	0.1	-179.8	-80.3	-78.7	0	0	0	114.4	P556	P556-Y558 VanDerWaalsContact C-N 3.33Å
559	H	27.4	Very low	26.1	Very low	169 Å²	169	141.7 Å²	141.7	78%	0.782	73%	0.732	S	S	*	*	S	Bend	trans	-89.3	-21.1	-179	-82.6	-80.4	0	0	0	114.5
560	D	26	Very low	26	Very low	149 Å²	149	145.6 Å²	145.6	80%	0.797	75%	0.751	S	S	*	*			trans	-117.9	90.4	-179.5	-74.1	-56.1	0	0	0	112.5
561	L	26.2	Very low	26	Very low	153 Å²	153	145.1 Å²	145.1	80%	0.801	75%	0.754	S	S	*	*			trans	-144.9	114.1	164.2	-101.5	173.7	0	0	0	110.6
562	P	25.7	Very low	25.9	Very low	108 Å²	108	147.3 Å²	147.3	70%	0.701	76%	0.756	S	S	*	*			trans	-84.5	154.3	-175.5	33.5	-35.8	0	0	0	113.7
563	L	25.4	Very low	25.7	Very low	141 Å²	141	148.2 Å²	148.2	74%	0.738	77%	0.766	S	S	*	*	S	Bend	trans	39.8	108.5	149.8	-75	151.3	0	0	0	119.2
564	C	22.9	Very low	25.5	Very low	108 Å²	108	148.4 Å²	148.4	73%	0.73	77%	0.769	S	S	*	*			trans	56.5	79.7	141.7	-61.5	0	0	0	0	118.7
565	Y	23	Very low	25.4	Very low	219 Å²	219	149.6 Å²	149.6	86%	0.859	77%	0.774	S	S	*	*			trans	-99	113.7	153.4	-99.1	-91.7	0	0	0	111.6
566	I	22.6	Very low	25.2	Very low	159 Å²	159	148.8 Å²	148.8	82%	0.815	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-80.9	116.4	169.6	-61.5	173.3	0	0	0	108
567	W	22.1	Very low	25.2	Very low	214 Å²	214	151.7 Å²	151.7	81%	0.811	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-79.1	131.9	169.2	-79	65.1	0	0	0	110	T569	W567-T569 PolarHBondContact O-N 3.4Å
568	P	24	Very low	25	Very low	113 Å²	113	155.2 Å²	155.2	73%	0.734	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.8	133.4	169.4	28.7	-33.2	0	0	0	109.4	P570	P568-P570 VanDerWaalsContact O-CD 3.24Å; P568-P570 WeakPolarHBondContact O-CD 3.46Å
569	T	21.6	Very low	24.8	Very low	133 Å²	133	152.6 Å²	152.6	82%	0.816	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.9	116.4	-166.6	50.1	0	0	0	0	113.6	W567	W567-T569 PolarHBondContact O-N 3.4Å
570	P	23.2	Very low	24.7	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.4	147.4	160.4	32.4	-31.2	0	0	0	109.8	P568	P568-P570 VanDerWaalsContact O-CD 3.24Å; P568-P570 WeakPolarHBondContact O-CD 3.46Å
571	T	25.1	Very low	24.7	Very low	132 Å²	132	151 Å²	151	81%	0.81	77%	0.772	S	S	*	*	S	Bend	trans	-79.7	152	-173.2	47.9	0	0	0	0	113.5
572	R	24.5	Very low	24.6	Very low	241 Å²	241	150.9 Å²	150.9	91%	0.909	77%	0.767	S	S	*	*	S	Bend	trans	75.8	122.8	175.9	-63.6	-176.4	170.9	171	-1.8	116.9
573	V	24.5	Very low	24.7	Very low	134 Å²	134	150.2 Å²	150.2	81%	0.812	75%	0.753	S	S	*	*			trans	64.6	76.8	164.1	-161.4	0	0	0	0	117.4
574	H	24.9	Very low	24.8	Very low	188 Å²	188	149.5 Å²	149.5	87%	0.87	76%	0.755	S	S	*	*			trans	-155.9	108.1	136.5	-100.7	-69.5	0	0	0	110.6
575	L	26.3	Very low	25.3	Very low	167 Å²	167	148.9 Å²	148.9	87%	0.874	74%	0.738	S	S	*	*			trans	-123.2	102.6	168.1	-104.1	169.8	0	0	0	108.3	M577	L575-M577 PolarHBondContact O-N 3.47Å
576	P	28.9	Very low	25.7	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	72%	0.724	S	S	*	*			trans	-92.1	82.1	-171.6	34.6	-33.8	0	0	0	112
577	M	25.5	Very low	26.2	Very low	167 Å²	167	138.1 Å²	138.1	82%	0.823	70%	0.695	S	S	*	*			trans	-134.2	115.2	173.4	-73.6	-158.6	173.4	0	0	115.1	L575	L575-M577 PolarHBondContact O-N 3.47Å
578	K	26.4	Very low	26.7	Very low	124 Å²	124	134 Å²	134	54%	0.539	69%	0.688	S	S	.	*			trans	14.9	119.9	143.5	-61.2	178.7	175.9	-174.3	0	117.7
579	F	25	Very low	27.2	Very low	152 Å²	152	138.3 Å²	138.3	67%	0.667	70%	0.696	S	S	*	*				-166.8	130.6	118.8	-102.5	-68.9	0	0	0	110.9
580	T	24.7	Very low	28.1	Very low	122 Å²	122	135 Å²	135	75%	0.748	69%	0.689	S	S	*	*			trans	-129.2	107.9	173.3	45.9	0	0	0	0	109
581	Y	25.8	Very low	28.7	Very low	162 Å²	162	136.5 Å²	136.5	64%	0.635	68%	0.679	S	S	*	*			trans	-79.5	118.6	169.3	-81.1	-82.1	0	0	0	109.4	F583	Y581-F583 PolarHBondContact O-N 3.31Å
582	H	24.9	Very low	29.5	Very low	151 Å²	151	133.4 Å²	133.4	70%	0.699	65%	0.653	S	S	*	*			trans	-86.9	108.4	178.7	-125.3	-96.5	0	0	0	109.7
583	F	27.2	Very low	30.3	Very low	95 Å²	95	125.1 Å²	125.1	42%	0.417	64%	0.636	S	S	.	*			trans	-109.9	117.5	165.3	-77.3	-83.2	0	0	0	108.6	Y581	Y581-F583 PolarHBondContact O-N 3.31Å
584	T	27.4	Very low	31.5	Very low	125 Å²	125	119.7 Å²	119.7	77%	0.767	60%	0.604	S	S	*	*			trans	-94.8	141.6	172.5	43.1	0	0	0	0	110
585	Y	34.3	Very low	32.7	Very low	95 Å²	95	114.2 Å²	114.2	37%	0.373	58%	0.581	S	S	.	*			trans	-144.6	133.8	174.7	177.4	-112.6	0	0	0	111	P587 Y592	Y585-P587 HydrophobicContact CD1-CG 4.11Å; Y585-P587 HydrophobicContact CE1-CB 3.66Å; Y585-P587 HydrophobicContact CE1-CG 3.71Å; Y585-Y592 HydrophobicContact CD2-CD2 4.26Å; Y585-Y592 HydrophobicContact CE2-CD2 4.38Å
586	Q	31.7	Very low	34.4	Very low	123 Å²	123	107 Å²	107	58%	0.575	54%	0.543	S	S	*	.			trans	-125.5	119.8	179.1	-176.3	164.4	-19.8	0	0	107.4	D588	Q586-D588 PolarHBondContact O-N 2.8Å
587	P	32	Very low	36.1	Very low	30 Å²	30	107.1 Å²	107.1	20%	0.195	53%	0.533	C	S	.	.			trans	-86.7	71.9	-159.1	-10.7	29.9	0	0	0	115	Y585 M614	Y585-P587 HydrophobicContact CD1-CG 4.11Å; Y585-P587 HydrophobicContact CE1-CB 3.66Å; Y585-P587 HydrophobicContact CE1-CG 3.71Å; P587-M614 HydrophobicContact CB-CE 3.71Å; P587-M614 HydrophobicContact CG-CE 3.98Å
588	D	32.8	Very low	38.2	Very low	127 Å²	127	99.5 Å²	99.5	68%	0.679	50%	0.496	S	S	*	.			trans	-92.7	99.3	164.7	-71.3	-46.2	0	0	0	110.3	Q586	Q586-D588 PolarHBondContact O-N 2.8Å
589	F	33.6	Very low	39.9	Very low	203 Å²	203	97.7 Å²	97.7	89%	0.89	49%	0.488	S	S	*	.	S	Bend	trans	58.4	103.3	171.9	-63	-89.6	0	0	0	119
590	G	41.9	Very low	42	Very low	65 Å²	65	91.8 Å²	91.8	67%	0.67	47%	0.465	S	S	*	.	S	Bend	trans	87.6	93.4	133.9	0	0	0	0	0	119.4
591	R	34.9	Very low	44	Very low	148 Å²	148	91.7 Å²	91.7	56%	0.558	45%	0.451	S	S	*	.			trans	63.7	94.5	162.8	-57.1	-174.2	157.3	175.7	-2.6	116.3	R767	R591-R767 HydrophobicContact CB-CG 4.25Å; R591-R767 HydrophobicContact CG-CG 3.99Å
592	Y	41.7	Very low	45.9	Very low	67 Å²	67	88.4 Å²	88.4	26%	0.263	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.3	163.2	-168.7	-105.1	0	0	0	111.4	Y585 S594 I765 I766	Y585-Y592 HydrophobicContact CD2-CD2 4.26Å; Y585-Y592 HydrophobicContact CE2-CD2 4.38Å; Y592-S594 VanDerWaalsContact CE1-CB 3.41Å; Y592-I765 WeakPolarHBondContact O-CA 3.41Å; Y592-I766 PolarHBondContact N-O 3.1Å; Y592-I766 PolarHBondContact O-N 3.18Å
593	A	42.4	Very low	48.1	Very low	67 Å²	67	83.2 Å²	83.2	55%	0.554	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	128.4	170.3	0	0	0	0	0	108.8	L764 I765	A593-L764 WeakPolarHBondContact CA-O 3.24Å; A593-I765 HydrophobicContact CB-CG1 3.91Å
594	S	48.5	Very low	50.2	Low	20 Å²	20	80 Å²	80	14%	0.14	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	138.3	-178.4	-178.7	0	0	0	0	111.4	Y592 S763 L764	Y592-S594 VanDerWaalsContact CE1-CB 3.41Å; S594-S763 WeakPolarHBondContact O-CA 3.37Å; S594-L764 PolarHBondContact N-O 3.04Å; S594-L764 PolarHBondContact O-N 2.88Å
595	L	51.3	Low	52.4	Low	73 Å²	73	75.5 Å²	75.5	38%	0.382	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.8	175.9	-164.6	69.4	0	0	0	108.9	D761	L595-D761 HydrophobicContact CD1-CB 4.15Å; L595-D761 HydrophobicContact CG-CB 4.49Å
596	L	62.4	Low	54.2	Low	15 Å²	15	72 Å²	72	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	109.9	179	-63.7	171.9	0	0	0	109.6	L598 I606 L740 I760 V762 L764	L596-L598 HydrophobicContact CB-CD2 4.05Å; L596-L598 HydrophobicContact CB-CG 4.25Å; L596-L598 PolarHBondContact O-N 3.47Å; L596-L598 VanDerWaalsContact O-N 3.13Å; L596-I606 HydrophobicContact CD1-CD1 3.74Å; L596-L740 HydrophobicContact CD1-CD1 3.66Å; L596-I760 VanDerWaalsContact O-O 3.1Å; L596-V762 HydrophobicContact CB-CB 4.4Å; L596-V762 WeakPolarHBondContact CB-O 3.44Å; L596-V762 PolarHBondContact N-O 3.31Å; L596-V762 PolarHBondContact O-N 2.69Å; L596-L764 HydrophobicContact CD1-CB 3.85Å; L596-L764 HydrophobicContact CD1-CD2 3.85Å; L596-L764 HydrophobicContact CG-CB 4.48Å
597	H	64	Low	56	Low	119 Å²	119	67.9 Å²	67.9	55%	0.551	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	85.3	172.7	-68.3	-57.1	0	0	0	110.2	V759 D761	H597-V759 HydrophobicContact CB-CG1 3.49Å; H597-V759 VanDerWaalsContact CB-CG1 3.49Å; H597-D761 IonicContact CE1-OD1 2.74Å; H597-D761 PolarHBondContact CE1-OD1 3.19Å; H597-D761 IonicContact CE1-OD2 3.86Å; H597-D761 IonicContact CG-OD1 3.24Å; H597-D761 IonicContact ND1-OD1 3.35Å; H597-D761 PolarHBondContact ND1-OD1 2.93Å; H597-D761 IonicContact ND1-OD2 3.59Å
598	L	68.3	Low	57.7	Low	6 Å²	6	67.3 Å²	67.3	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	138.5	-177.3	-57.2	-175.1	0	0	0	111.3	L596 V604 L649 L740 P742 I760 V762	L596-L598 HydrophobicContact CB-CD2 4.05Å; L596-L598 HydrophobicContact CB-CG 4.25Å; L596-L598 PolarHBondContact O-N 3.47Å; L596-L598 VanDerWaalsContact O-N 3.13Å; L598-V604 HydrophobicContact CD2-CB 4.11Å; L598-V604 HydrophobicContact CD2-CG2 3.67Å; L598-L649 HydrophobicContact CD1-CD1 3.93Å; L598-L740 HydrophobicContact CD1-CB 4.18Å; L598-L740 HydrophobicContact CD1-CD1 4.41Å; L598-P742 HydrophobicContact CB-CG 3.94Å; L598-P742 HydrophobicContact CD1-CG 4.19Å; L598-I760 PolarHBondContact N-O 3.15Å; L598-I760 PolarHBondContact O-N 3.35Å; L598-V762 HydrophobicContact CD1-CB 4.24Å; L598-V762 HydrophobicContact CD1-CG2 3.72Å; L598-V762 HydrophobicContact CG-CG2 4.23Å
599	K	63.4	Low	59.4	Low	87 Å²	87	64.2 Å²	64.2	38%	0.378	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-85.4	144.2	168.3	-68.6	-157.1	178.5	-150.9	0	110.8	H602 Q756	K599-H602 HydrophobicContact CB-CB 4.22Å; K599-H602 WeakPolarHBondContact O-CB 3.01Å; K599-H602 PolarHBondContact O-N 2.8Å; K599-Q756 PolarHBondContact NZ-O 3.06Å
600	P	68.1	Low	60.9	Low	27 Å²	27	55.2 Å²	55.2	18%	0.175	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	141.6	175.9	-22.8	33.1	0	0	0	111	H602 C744 A758 I760	P600-H602 PolarHBondContact O-N 2.87Å; P600-H602 VanDerWaalsContact O-N 3.08Å; P600-H602 PolarHBondContact O-ND1 3.43Å; P600-C744 HydrophobicContact CB-CB 4.1Å; P600-C744 HydrophobicContact CG-CB 4.49Å; P600-A758 WeakPolarHBondContact CD-O 3.43Å; P600-A758 HydrophobicContact CG-CB 4.38Å; P600-A758 VanDerWaalsContact CG-O 3.29Å; P600-A758 WeakPolarHBondContact CG-O 3.33Å; P600-I760 HydrophobicContact CB-CD1 4.4Å; P600-I760 HydrophobicContact CG-CD1 3.99Å; P600-I760 HydrophobicContact CG-CG1 4.45Å
601	W	67.8	Low	61.8	Low	120 Å²	120	55.7 Å²	55.7	46%	0.455	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	4.4	179.8	-44.8	100	0	0	0	115.8	Y741 P742 E743 C744 Y745	W601-Y741 HydrophobicContact CE3-CE2 4.45Å; W601-P742 PolarHBondContact N-O 3.45Å; W601-E743 HydrophobicContact CE3-CB 4.22Å; W601-E743 HydrophobicContact CE3-CG 4.07Å; W601-E743 HydrophobicContact CH2-CB 3.74Å; W601-E743 HydrophobicContact CH2-CG 4.23Å; W601-E743 HydrophobicContact CZ2-CB 4.46Å; W601-E743 HydrophobicContact CZ3-CB 3.6Å; W601-E743 HydrophobicContact CZ3-CG 3.58Å; W601-C744 WeakPolarHBondContact CZ2-O 3.29Å; W601-Y745 HydrophobicContact CH2-CE1 4.04Å; W601-Y745 HydrophobicContact CH2-CE2 4.42Å; W601-Y745 AromaticContact CH2-CZ 3.88Å
602	H	66.2	Low	62.9	Low	93 Å²	93	52.2 Å²	52.2	43%	0.431	28%	0.278	S	S	.	.			trans	-93.5	140.1	176.9	-67.4	57.8	0	0	0	111	K599 P600 P742	K599-H602 HydrophobicContact CB-CB 4.22Å; K599-H602 WeakPolarHBondContact O-CB 3.01Å; K599-H602 PolarHBondContact O-N 2.8Å; P600-H602 PolarHBondContact O-N 2.87Å; P600-H602 VanDerWaalsContact O-N 3.08Å; P600-H602 PolarHBondContact O-ND1 3.43Å; H602-P742 VanDerWaalsContact O-CD 3.28Å; H602-P742 WeakPolarHBondContact O-CD 3.41Å
603	I	70.3	Confident	63.1	Low	42 Å²	42	54.1 Å²	54.1	22%	0.215	30%	0.296	C	S	.	.			trans	-98.1	123.8	175.9	-56	174.5	0	0	0	109	V605 P661 F664 L740 Y741	I603-V605 HydrophobicContact CG2-CG2 4.09Å; I603-P661 HydrophobicContact CD1-CG 4.18Å; I603-F664 HydrophobicContact CD1-CE2 4.19Å; I603-F664 HydrophobicContact CG1-CE2 4.39Å; I603-F664 HydrophobicContact CG2-CE2 3.93Å; I603-F664 HydrophobicContact CG2-CZ 4.07Å; I603-L740 WeakPolarHBondContact CA-O 3.29Å; I603-Y741 HydrophobicContact CD1-CD2 4.47Å; I603-Y741 HydrophobicContact CG1-CD2 3.67Å; I603-Y741 HydrophobicContact CG1-CE2 4.49Å; I603-Y741 HydrophobicContact CG1-CG 4.16Å
604	V	71.5	Confident	63.4	Low	27 Å²	27	52.9 Å²	52.9	16%	0.164	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.9	170.1	174	0	0	0	0	108.4	L598 I606 S739 L740	L598-V604 HydrophobicContact CD2-CB 4.11Å; L598-V604 HydrophobicContact CD2-CG2 3.67Å; V604-I606 HydrophobicContact CG1-CG1 4.19Å; V604-S739 CarbonylContact O-C 3.44Å; V604-S739 VanDerWaalsContact O-CA 3.3Å; V604-S739 WeakPolarHBondContact O-CA 3.21Å; V604-L740 PolarHBondContact N-O 3.1Å; V604-L740 PolarHBondContact O-N 2.77Å
605	V	73.5	Confident	63.5	Low	32 Å²	32	54.1 Å²	54.1	19%	0.194	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.8	178	-171.8	0	0	0	0	109.9	I603 L657 Y737	I603-V605 HydrophobicContact CG2-CG2 4.09Å; V605-L657 HydrophobicContact CB-CD1 4.42Å; V605-L657 HydrophobicContact CG1-CD1 3.67Å; V605-L657 HydrophobicContact CG1-CG 4.3Å; V605-Y737 HydrophobicContact CG1-CD1 4.09Å; V605-Y737 HydrophobicContact CG1-CG 4.36Å
606	I	72.6	Confident	63.1	Low	20 Å²	20	55.6 Å²	55.6	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.7	-174.5	-54.1	174	0	0	0	108.6	L596 V604 I608 Y737 L738 L740 L764	L596-I606 HydrophobicContact CD1-CD1 3.74Å; V604-I606 HydrophobicContact CG1-CG1 4.19Å; I606-I608 HydrophobicContact CG2-CG1 4.33Å; I606-Y737 WeakPolarHBondContact O-CA 3.41Å; I606-L738 HydrophobicContact CB-CB 4.4Å; I606-L738 PolarHBondContact N-O 2.81Å; I606-L738 PolarHBondContact O-N 3.43Å; I606-L740 HydrophobicContact CD1-CD1 4.31Å; I606-L764 HydrophobicContact CD1-CD2 3.6Å
607	P	69.4	Low	62.4	Low	38 Å²	38	57.4 Å²	57.4	25%	0.247	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	130.5	174.1	30.3	-32.6	0	0	0	110.6	Y737	P607-Y737 HydrophobicContact CB-CD1 4.11Å; P607-Y737 HydrophobicContact CB-CE1 4.03Å
608	I	67.2	Low	61.6	Low	18 Å²	18	52.1 Å²	52.1	9%	0.092	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	118.2	-179	-65.2	162	0	0	0	108.4	I606 L610 F653 W736 L738 I766	I606-I608 HydrophobicContact CG2-CG1 4.33Å; I608-L610 HydrophobicContact CG2-CD2 3.96Å; I608-L610 HydrophobicContact CG2-CG 4.24Å; I608-F653 HydrophobicContact CD1-CE2 3.92Å; I608-W736 PolarHBondContact N-O 3.18Å; I608-W736 PolarHBondContact O-N 2.86Å; I608-L738 HydrophobicContact CD1-CB 3.62Å; I608-L738 HydrophobicContact CD1-CD2 4.3Å; I608-I766 HydrophobicContact CD1-CD1 3.68Å; I608-I766 HydrophobicContact CG1-CD1 4.33Å
609	T	68.1	Low	60.8	Low	61 Å²	61	52.1 Å²	52.1	37%	0.374	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.7	176.9	26	0	0	0	0	111.2	R735	T609-R735 HydrophobicContact CG2-CB 4.07Å; T609-R735 HydrophobicContact CG2-CG 4.2Å
610	L	66.5	Low	60.6	Low	14 Å²	14	48.1 Å²	48.1	7%	0.073	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.8	-177.6	-64.6	178.1	0	0	0	110.7	I608 L620 F653 Y730 P731 P733 G734 W736	I608-L610 HydrophobicContact CG2-CD2 3.96Å; I608-L610 HydrophobicContact CG2-CG 4.24Å; L610-L620 HydrophobicContact CD1-CD2 4.16Å; L610-L620 HydrophobicContact CD2-CD1 4.34Å; L610-L620 HydrophobicContact CD2-CD2 4.25Å; L610-F653 HydrophobicContact CD1-CZ 4.46Å; L610-Y730 HydrophobicContact CB-CE1 4.39Å; L610-Y730 WeakPolarHBondContact CB-OH 3.45Å; L610-Y730 HydrophobicContact CD2-CE2 4.16Å; L610-P731 HydrophobicContact CD1-CB 3.62Å; L610-P731 HydrophobicContact CD1-CG 3.63Å; L610-P733 WeakPolarHBondContact O-CA 3.37Å; L610-P733 VanDerWaalsContact O-CB 3.28Å; L610-P733 WeakPolarHBondContact O-CB 3.11Å; L610-G734 PolarHBondContact N-O 3.47Å; L610-G734 PolarHBondContact O-N 2.84Å; L610-W736 HydrophobicContact CD1-CG 4.38Å
611	N	60.1	Low	60.1	Low	75 Å²	75	47.6 Å²	47.6	40%	0.401	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-76.4	141.3	-179.3	-173.4	-13	0	0	0	111.1	V613 M614 Y730	N611-V613 VanDerWaalsContact C-N 3.33Å; N611-V613 PolarHBondContact O-N 2.7Å; N611-V613 PolarHBondContact OD1-N 3.05Å; N611-V613 VanDerWaalsContact OD1-N 3.08Å; N611-M614 HydrophobicContact CB-CE 4.18Å; N611-M614 PolarHBondContact O-N 3Å; N611-Y730 PolarHBondContact N-OH 3.33Å; N611-Y730 VanDerWaalsContact N-OH 3.09Å; N611-Y730 VanDerWaalsContact O-CE1 3.28Å; N611-Y730 WeakPolarHBondContact O-CE1 3.24Å; N611-Y730 PolarHBondContact O-OH 3.28Å
612	S	57	Low	59.7	Low	76 Å²	76	42 Å²	42	53%	0.531	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-66.8	-29	176.8	52.5	0	0	0	0	113.6	M614 D615	S612-M614 PolarHBondContact O-N 2.89Å; S612-M614 VanDerWaalsContact O-N 3.17Å; S612-D615 VanDerWaalsContact O-CB 3.3Å; S612-D615 WeakPolarHBondContact O-CB 3.35Å; S612-D615 PolarHBondContact O-N 3.01Å
613	V	47.6	Very low	59.3	Low	106 Å²	106	38 Å²	38	64%	0.642	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-60.5	-28	179.6	-179	0	0	0	0	112.1	N611	N611-V613 VanDerWaalsContact C-N 3.33Å; N611-V613 PolarHBondContact O-N 2.7Å; N611-V613 PolarHBondContact OD1-N 3.05Å; N611-V613 VanDerWaalsContact OD1-N 3.08Å
614	M	47	Very low	58.8	Low	42 Å²	42	36.2 Å²	36.2	21%	0.207	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-86.3	-1.4	177.6	-69.7	-169.5	-73.9	0	0	114.6	P587 N611 S612 M616 S618 Y730 S768	P587-M614 HydrophobicContact CB-CE 3.71Å; P587-M614 HydrophobicContact CG-CE 3.98Å; N611-M614 HydrophobicContact CB-CE 4.18Å; N611-M614 PolarHBondContact O-N 3Å; S612-M614 PolarHBondContact O-N 2.89Å; S612-M614 VanDerWaalsContact O-N 3.17Å; M614-M616 PolarHBondContact O-N 3.45Å; M614-S618 WeakPolarHBondContact O-CB 3.31Å; M614-S618 PolarHBondContact O-OG 3.44Å; M614-Y730 HydrophobicContact CB-CE1 4.23Å; M614-Y730 HydrophobicContact CB-CE2 3.88Å; M614-S768 PolarHBondContact SD-OG 3.36Å
615	D	50.6	Low	58.1	Low	46 Å²	46	36.2 Å²	36.2	25%	0.246	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-71.7	-3.9	172.7	-158	-2.4	0	0	0	112.4	S612 S617 R706 Y730	S612-D615 VanDerWaalsContact O-CB 3.3Å; S612-D615 WeakPolarHBondContact O-CB 3.35Å; S612-D615 PolarHBondContact O-N 3.01Å; D615-S617 PolarHBondContact O-N 3.06Å; D615-R706 PolarHBondContact O-NH2 3.27Å; D615-R706 IonicContact OD1-CZ 3.91Å; D615-R706 IonicContact OD1-NH1 3.77Å; D615-R706 PolarHBondContact OD1-NH1 2.92Å; D615-R706 IonicContact OD1-NH2 3.4Å; D615-Y730 HydrophobicContact CB-CD1 3.92Å; D615-Y730 HydrophobicContact CB-CE1 4.25Å
616	M	43.7	Very low	57.3	Low	103 Å²	103	35.2 Å²	35.2	51%	0.507	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	66.9	169.3	-66.8	-71.7	-80.6	0	0	111.7	M614 S618	M614-M616 PolarHBondContact O-N 3.45Å; M616-S618 PolarHBondContact O-N 2.9Å
617	S	48.6	Very low	56.4	Low	53 Å²	53	36.4 Å²	36.4	37%	0.371	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	39.9	173.2	-55.4	0	0	0	0	114.7	D615 C771	D615-S617 PolarHBondContact O-N 3.06Å; S617-C771 WeakPolarHBondContact O-CA 3.32Å; S617-C771 WeakPolarHBondContact O-CB 3.31Å; S617-C771 PolarHBondContact O-N 3.48Å; S617-C771 PolarHBondContact O-SG 2.85Å
618	S	46.1	Very low	55.2	Low	9 Å²	9	37 Å²	37	6%	0.063	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	161.3	169.1	74.6	0	0	0	0	113.1	M614 M616 Y730 T769	M614-S618 WeakPolarHBondContact O-CB 3.31Å; M614-S618 PolarHBondContact O-OG 3.44Å; M616-S618 PolarHBondContact O-N 2.9Å; S618-Y730 WeakPolarHBondContact O-CB 3.38Å; S618-Y730 PolarHBondContact O-N 2.72Å; S618-Y730 WeakPolarHBondContact OG-CD2 3.23Å; S618-T769 CarbonylContact C-O 3.57Å; S618-T769 WeakPolarHBondContact CA-O 3.34Å; S618-T769 VanDerWaalsContact CB-O 3.25Å; S618-T769 WeakPolarHBondContact CB-O 3.37Å
619	V	52.7	Low	54	Low	5 Å²	5	40.6 Å²	40.6	3%	0.03	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.6	164.3	153	0	0	0	0	108.9	P711 F727 F728 S768 T769 C776	V619-P711 HydrophobicContact CG2-CG 4.13Å; V619-F727 HydrophobicContact CG1-CB 4.09Å; V619-F727 HydrophobicContact CG1-CD1 3.84Å; V619-F727 HydrophobicContact CG1-CG 4.45Å; V619-F728 WeakPolarHBondContact CA-O 3.33Å; V619-S768 WeakPolarHBondContact O-CA 3.33Å; V619-T769 PolarHBondContact N-O 3Å; V619-T769 PolarHBondContact O-N 3.22Å; V619-C776 HydrophobicContact CB-CB 4.08Å; V619-C776 HydrophobicContact CG2-CB 3.94Å; V619-C776 WeakPolarHBondContact CG2-SG 3.5Å
620	L	57.2	Low	52.3	Low	4 Å²	4	44.2 Å²	44.2	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	103.7	170.2	-172.3	66.2	0	0	0	108.2	L610 I622 F653 F728 P731 I766	L610-L620 HydrophobicContact CD1-CD2 4.16Å; L610-L620 HydrophobicContact CD2-CD1 4.34Å; L610-L620 HydrophobicContact CD2-CD2 4.25Å; L620-I622 HydrophobicContact CD2-CD1 4.17Å; L620-I622 HydrophobicContact CD2-CG1 4.38Å; L620-I622 HydrophobicContact CG-CD1 4.49Å; L620-I622 HydrophobicContact CG-CG1 4.15Å; L620-F653 HydrophobicContact CD2-CE1 4.32Å; L620-F653 HydrophobicContact CD2-CZ 4.22Å; L620-F728 PolarHBondContact N-O 3.06Å; L620-F728 PolarHBondContact O-N 3.4Å; L620-P731 HydrophobicContact CD2-CG 3.78Å; L620-I766 HydrophobicContact CD1-CG2 4.01Å
621	E	58.6	Low	50.6	Low	16 Å²	16	48.1 Å²	48.1	8%	0.075	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	116	168.2	172.7	-164.6	164.7	0	0	107.8	F727 R767	E621-F727 HydrophobicContact CB-CD1 3.92Å; E621-F727 HydrophobicContact CB-CE1 3.86Å; E621-F727 HydrophobicContact CG-CD1 4.2Å; E621-F727 HydrophobicContact CG-CE1 3.74Å; E621-F727 HydrophobicContact CG-CZ 4.47Å; E621-R767 HydrophobicContact CB-CB 4.13Å; E621-R767 VanDerWaalsContact CD-CD 3.48Å; E621-R767 PolarHBondContact N-O 2.93Å; E621-R767 PolarHBondContact O-N 3.28Å; E621-R767 WeakPolarHBondContact OE1-CD 3.49Å; E621-R767 IonicContact OE1-CZ 2.71Å; E621-R767 IonicContact OE1-NH1 2.83Å; E621-R767 PolarHBondContact OE1-NH1 3.4Å; E621-R767 WeakPolarHBondContact OE2-CD 3.36Å; E621-R767 IonicContact OE2-NH1 3.13Å
622	I	59.2	Low	49.4	Very low	3 Å²	3	48.3 Å²	48.3	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112	164.4	-56.2	-178.7	0	0	0	106.5	L620 F653 L726 F728 L738 L764	L620-I622 HydrophobicContact CD2-CD1 4.17Å; L620-I622 HydrophobicContact CD2-CG1 4.38Å; L620-I622 HydrophobicContact CG-CD1 4.49Å; L620-I622 HydrophobicContact CG-CG1 4.15Å; I622-F653 HydrophobicContact CD1-CD1 4.47Å; I622-F653 HydrophobicContact CD1-CD2 4.31Å; I622-F653 HydrophobicContact CD1-CE2 4.36Å; I622-F653 HydrophobicContact CD1-CG 4.38Å; I622-F653 HydrophobicContact CD1-CZ 4.48Å; I622-L726 PolarHBondContact N-O 2.93Å; I622-L726 VanDerWaalsContact N-O 3.07Å; I622-L726 WeakPolarHBondContact O-CB 3.44Å; I622-L726 PolarHBondContact O-N 2.86Å; I622-L726 VanDerWaalsContact O-N 3.1Å; I622-F728 HydrophobicContact CD1-CD2 4.38Å; I622-F728 HydrophobicContact CD1-CE2 4.27Å; I622-L738 HydrophobicContact CG2-CD2 4.45Å; I622-L764 HydrophobicContact CG2-CD1 4.14Å
623	A	58.7	Low	48.2	Very low	7 Å²	7	54.5 Å²	54.5	6%	0.058	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.3	175.5	0	0	0	0	0	109.5	F725 I765	A623-F725 HydrophobicContact CB-CD1 3.98Å; A623-F725 HydrophobicContact CB-CE1 4.34Å; A623-I765 HydrophobicContact CB-CB 4.23Å; A623-I765 PolarHBondContact N-O 2.84Å; A623-I765 PolarHBondContact O-N 3.39Å
624	L	58.1	Low	47.4	Very low	6 Å²	6	57.7 Å²	57.7	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.1	173.5	-74.9	166.4	0	0	0	107.4	L649 I674 L676 S724 L740 V762 L764	L624-L649 HydrophobicContact CD2-CD2 4.49Å; L624-I674 HydrophobicContact CD1-CD1 4.35Å; L624-L676 HydrophobicContact CB-CD1 3.74Å; L624-L676 HydrophobicContact CD1-CD1 4.42Å; L624-S724 PolarHBondContact O-OG 2.83Å; L624-L740 HydrophobicContact CD1-CD2 4.11Å; L624-L740 HydrophobicContact CD2-CD1 4.44Å; L624-L740 HydrophobicContact CD2-CD2 4.13Å; L624-V762 HydrophobicContact CD2-CG1 3.81Å; L624-L764 HydrophobicContact CD2-CB 4.37Å; L624-L764 HydrophobicContact CD2-CD1 3.79Å; L624-L764 HydrophobicContact CG-CD1 4.44Å
625	Q	58.7	Low	46.5	Very low	26 Å²	26	64.3 Å²	64.3	12%	0.121	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.8	172.4	176.7	177.9	8.5	0	0	108.6	V721 R723 S763	Q625-V721 PolarHBondContact NE2-O 2.98Å; Q625-R723 HydrophobicContact CB-CG 4.12Å; Q625-R723 HydrophobicContact CG-CG 4.08Å; Q625-R723 VanDerWaalsContact OE1-CZ 3.25Å; Q625-S763 PolarHBondContact N-O 3.24Å; Q625-S763 PolarHBondContact O-N 3.45Å
626	L	56.6	Low	45.4	Very low	12 Å²	12	69 Å²	69	6%	0.063	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.1	161.3	-77.5	153.3	0	0	0	106.9	A628 I647 L649 L676 T678 I760 V762	L626-A628 PolarHBondContact O-N 3.29Å; L626-I647 HydrophobicContact CD2-CG2 3.96Å; L626-L649 HydrophobicContact CD1-CB 4.11Å; L626-L649 HydrophobicContact CD2-CB 4.38Å; L626-L649 HydrophobicContact CD2-CD2 4.48Å; L626-L649 HydrophobicContact CG-CD2 4.42Å; L626-L676 HydrophobicContact CD1-CB 4.15Å; L626-T678 HydrophobicContact CB-CG2 4.32Å; L626-T678 HydrophobicContact CD1-CG2 3.75Å; L626-I760 HydrophobicContact CD2-CG2 3.87Å; L626-V762 HydrophobicContact CD2-CG2 3.94Å
627	N	53.2	Low	44.7	Very low	44 Å²	44	73.8 Å²	73.8	24%	0.235	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-72.5	118.4	172.7	-90.5	-6.3	0	0	0	109.2	D761	N627-D761 HydrophobicContact CB-CB 4.22Å; N627-D761 PolarHBondContact N-O 3.48Å; N627-D761 VanDerWaalsContact N-O 3.07Å
628	A	43.9	Very low	43.7	Very low	52 Å²	52	76.1 Å²	76.1	43%	0.43	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-57.6	145.9	165.6	0	0	0	0	0	110.2	L626 N630	L626-A628 PolarHBondContact O-N 3.29Å; A628-N630 PolarHBondContact O-N 2.78Å
629	L	41	Very low	42.9	Very low	93 Å²	93	86.3 Å²	86.3	49%	0.487	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-59.6	-5.3	-165.1	-99.9	84.4	0	0	0	116.7	V631 S632 P642	L629-V631 VanDerWaalsContact C-N 3.26Å; L629-V631 PolarHBondContact O-N 2.89Å; L629-S632 PolarHBondContact O-OG 3.29Å; L629-S632 VanDerWaalsContact O-OG 3.06Å; L629-P642 HydrophobicContact CD2-CB 3.69Å; L629-P642 HydrophobicContact CD2-CG 3.6Å
630	N	32.8	Very low	42	Very low	136 Å²	136	97.4 Å²	97.4	73%	0.727	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-70.2	-16.2	-178.1	-70.7	0.8	0	0	0	114.2	A628	A628-N630 PolarHBondContact O-N 2.78Å
631	V	31.8	Very low	40.7	Very low	96 Å²	96	105.9 Å²	105.9	58%	0.582	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-78.8	-23	-177	-170.3	0	0	0	0	112.7	L629 W633	L629-V631 VanDerWaalsContact C-N 3.26Å; L629-V631 PolarHBondContact O-N 2.89Å; V631-W633 VanDerWaalsContact C-N 3.34Å; V631-W633 PolarHBondContact O-N 3.39Å
632	S	34	Very low	39.6	Very low	80 Å²	80	108.6 Å²	108.6	56%	0.559	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-82.1	-6.7	179.4	54.2	0	0	0	0	114.5	L629 Q634	L629-S632 PolarHBondContact O-OG 3.29Å; L629-S632 VanDerWaalsContact O-OG 3.06Å; S632-Q634 PolarHBondContact O-N 3.16Å
633	W	31.8	Very low	38.6	Very low	205 Å²	205	113.5 Å²	113.5	78%	0.777	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-68.3	3.9	-177.9	-85.5	69.9	0	0	0	115.4	V631	V631-W633 VanDerWaalsContact C-N 3.34Å; V631-W633 PolarHBondContact O-N 3.39Å
634	Q	31.1	Very low	37.8	Very low	173 Å²	173	116.8 Å²	116.8	81%	0.808	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-109	6.6	-174.9	-146.6	168	6.6	0	0	114.7	S632	S632-Q634 PolarHBondContact O-N 3.16Å
635	F	28.7	Very low	37.4	Very low	181 Å²	181	121.4 Å²	121.4	79%	0.794	59%	0.594	S	S	*	*	S	Bend	trans	-137.7	113.6	174.7	-83.1	-86.9	0	0	0	113.5
636	N	27.7	Very low	37.3	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	61%	0.605	S	S	*	*			trans	66.9	121.1	169	-65.1	-9.4	0	0	0	119.5	T638	N636-T638 VanDerWaalsContact C-N 3.26Å; N636-T638 PolarHBondContact O-N 3.41Å; N636-T638 VanDerWaalsContact O-N 3.08Å
637	E	27.6	Very low	37.3	Very low	205 Å²	205	124.3 Å²	124.3	96%	0.958	61%	0.607	S	S	*	*	S	Bend	trans	-77.6	20.9	-176.3	-54.7	-176.5	122	0	0	115.7
638	T	28.6	Very low	37.7	Very low	101 Å²	101	123.2 Å²	123.2	62%	0.62	60%	0.602	S	S	*	*			trans	-109.9	10.6	-159	57.6	0	0	0	0	117.1	N636	N636-T638 VanDerWaalsContact C-N 3.26Å; N636-T638 PolarHBondContact O-N 3.41Å; N636-T638 VanDerWaalsContact O-N 3.08Å
639	Y	29.8	Very low	38.9	Very low	223 Å²	223	120.8 Å²	120.8	88%	0.875	58%	0.581	S	S	*	*	S	Bend	trans	-134.5	148	175.7	-75	-79	0	0	0	113.5
640	R	32.1	Very low	40.3	Very low	239 Å²	239	116.9 Å²	116.9	90%	0.902	56%	0.56	S	S	*	*			trans	-62.3	156.5	-177.6	-73.3	178.1	172.3	160.6	-3.2	112.2
641	E	31.1	Very low	42.3	Very low	182 Å²	182	110.4 Å²	110.4	85%	0.85	53%	0.526	S	S	*	.			trans	-41.3	123.7	176.7	-61.8	179.4	148.1	0	0	112.3	L643	E641-L643 PolarHBondContact O-N 3.06Å; E641-L643 VanDerWaalsContact O-N 3.12Å
642	P	35.8	Very low	44.4	Very low	73 Å²	73	105.9 Å²	105.9	47%	0.474	50%	0.498	S	S	.	.			trans	-71.2	111.1	-179.1	27.4	-32.7	0	0	0	110	L629	L629-P642 HydrophobicContact CD2-CB 3.69Å; L629-P642 HydrophobicContact CD2-CG 3.6Å
643	L	38.4	Very low	46.4	Very low	105 Å²	105	102 Å²	102	55%	0.55	47%	0.472	S	S	.	.			trans	-49.3	141.4	175.2	-72.3	168.5	0	0	0	111.6	E641 R645	E641-L643 PolarHBondContact O-N 3.06Å; E641-L643 VanDerWaalsContact O-N 3.12Å; L643-R645 WeakPolarHBondContact O-CG 3.37Å; L643-R645 PolarHBondContact O-N 3.23Å
644	P	41.8	Very low	48.5	Very low	77 Å²	77	92.3 Å²	92.3	50%	0.5	44%	0.435	S	S	.	.			trans	-59.7	130.2	174.3	23.4	-32	0	0	0	111	A747	P644-A747 HydrophobicContact CB-CB 4.23Å; P644-A747 HydrophobicContact CG-CB 4.07Å; P644-A747 WeakPolarHBondContact O-CB 3.4Å; P644-A747 PolarHBondContact O-N 2.98Å; P644-A747 VanDerWaalsContact O-N 3.17Å
645	R	49.8	Very low	50.5	Low	102 Å²	102	88.6 Å²	88.6	39%	0.385	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.7	-174.9	-72.3	164.1	-172.9	-172.4	0.3	109.8	L643 I647 Y745	L643-R645 WeakPolarHBondContact O-CG 3.37Å; L643-R645 PolarHBondContact O-N 3.23Å; R645-I647 PolarHBondContact O-N 3.31Å; R645-Y745 CarbonylContact C-O 3.58Å; R645-Y745 WeakPolarHBondContact CA-O 3.45Å
646	Q	54.8	Low	52.6	Low	79 Å²	79	86.4 Å²	86.4	37%	0.369	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	109.2	168.5	-43.2	-170.4	-63.1	0	0	108.2	D679 C744 Y745	Q646-D679 HydrophobicContact CB-CB 4.05Å; Q646-D679 HydrophobicContact CG-CB 3.79Å; Q646-D679 PolarHBondContact NE2-OD2 2.95Å; Q646-C744 WeakPolarHBondContact O-CA 3.34Å; Q646-Y745 PolarHBondContact N-O 3.43Å; Q646-Y745 PolarHBondContact O-N 2.66Å
647	I	57.9	Low	54.7	Low	20 Å²	20	84.2 Å²	84.2	10%	0.103	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.7	175.1	-63.8	171.1	0	0	0	107.8	L626 R645 A677 T678 I760	L626-I647 HydrophobicContact CD2-CG2 3.96Å; R645-I647 PolarHBondContact O-N 3.31Å; I647-A677 VanDerWaalsContact O-CA 3.29Å; I647-A677 WeakPolarHBondContact O-CA 3.38Å; I647-T678 PolarHBondContact O-N 3.35Å; I647-T678 VanDerWaalsContact O-N 3.09Å; I647-I760 HydrophobicContact CD1-CD1 4.37Å; I647-I760 HydrophobicContact CD1-CG1 4.21Å; I647-I760 HydrophobicContact CD1-CG2 4.28Å; I647-I760 HydrophobicContact CG1-CD1 4.43Å; I647-I760 HydrophobicContact CG2-CD1 4.08Å; I647-I760 HydrophobicContact CG2-CG2 4.05Å
648	I	62	Low	56.7	Low	22 Å²	22	74.5 Å²	74.5	11%	0.113	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	100.1	177.2	-53.7	-172.2	0	0	0	108.7	H650 R675 L676 A677 P742 E743 Y745	I648-H650 WeakPolarHBondContact CG2-NE2 3.39Å; I648-R675 HydrophobicContact CG2-CG 3.84Å; I648-L676 CarbonylContact C-O 3.52Å; I648-L676 VanDerWaalsContact CA-O 3.27Å; I648-L676 WeakPolarHBondContact CA-O 3.49Å; I648-A677 HydrophobicContact CG1-CB 4.1Å; I648-P742 WeakPolarHBondContact O-CA 3.2Å; I648-E743 HydrophobicContact CB-CB 4.31Å; I648-E743 PolarHBondContact N-O 3.43Å; I648-E743 PolarHBondContact O-N 2.81Å; I648-Y745 HydrophobicContact CD1-CD2 4.29Å; I648-Y745 HydrophobicContact CD1-CE2 3.85Å; I648-Y745 HydrophobicContact CG1-CD2 4.43Å; I648-Y745 HydrophobicContact CG1-CE2 4.22Å
649	L	68.9	Low	58.6	Low	1 Å²	1	74.3 Å²	74.3	1%	0.005	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.9	175.6	-179.1	65.9	0	0	0	110.3	L598 L624 L626 R675 L676 L740 P742 V762	L598-L649 HydrophobicContact CD1-CD1 3.93Å; L624-L649 HydrophobicContact CD2-CD2 4.49Å; L626-L649 HydrophobicContact CD1-CB 4.11Å; L626-L649 HydrophobicContact CD2-CB 4.38Å; L626-L649 HydrophobicContact CD2-CD2 4.48Å; L626-L649 HydrophobicContact CG-CD2 4.42Å; L649-R675 WeakPolarHBondContact O-CA 3.4Å; L649-L676 HydrophobicContact CB-CB 4.47Å; L649-L676 PolarHBondContact N-O 2.92Å; L649-L676 PolarHBondContact O-N 2.99Å; L649-L740 HydrophobicContact CD1-CB 4.48Å; L649-P742 HydrophobicContact CD1-CB 4.04Å; L649-V762 HydrophobicContact CD1-CG2 4.37Å; L649-V762 HydrophobicContact CD2-CB 4.47Å; L649-V762 HydrophobicContact CD2-CG1 3.69Å; L649-V762 HydrophobicContact CD2-CG2 3.86Å
650	H	70.3	Confident	60.5	Low	10 Å²	10	66.4 Å²	66.4	5%	0.046	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.6	166.4	-66.8	-91.6	0	0	0	110.4	I648 F664 W673 I674 R675 L740 Y741 E743	I648-H650 WeakPolarHBondContact CG2-NE2 3.39Å; H650-F664 HydrophobicContact CB-CD1 3.89Å; H650-F664 HydrophobicContact CB-CE1 4.28Å; H650-W673 AromaticContact CE1-CE2 3.92Å; H650-W673 AromaticContact CE1-CZ2 3.34Å; H650-W673 WeakPolarHBondContact CE1-CZ2 3.47Å; H650-W673 AromaticContact CG-NE1 3.95Å; H650-W673 AromaticContact ND1-CE2 3.34Å; H650-W673 VanDerWaalsContact ND1-CE2 3.34Å; H650-W673 AromaticContact ND1-CZ2 3.26Å; H650-W673 VanDerWaalsContact ND1-CZ2 3.26Å; H650-W673 WeakPolarHBondContact ND1-CZ2 3.4Å; H650-W673 AromaticContact ND1-NE1 3.1Å; H650-W673 PolarHBondContact ND1-NE1 3.07Å; H650-I674 CarbonylContact C-O 3.58Å; H650-I674 WeakPolarHBondContact CA-O 3.5Å; H650-R675 VanDerWaalsContact CE1-CD 3.5Å; H650-R675 WeakPolarHBondContact CE1-CD 3.06Å; H650-R675 PolarHBondContact CE1-NE 3.46Å; H650-R675 PolarHBondContact NE2-NE 3.39Å; H650-L740 CarbonylContact O-C 3.56Å; H650-L740 WeakPolarHBondContact O-CA 3.4Å; H650-Y741 HydrophobicContact CB-CD1 4.01Å; H650-Y741 WeakPolarHBondContact CB-O 3.45Å; H650-Y741 PolarHBondContact N-O 2.88Å; H650-Y741 PolarHBondContact O-N 3.34Å; H650-E743 IonicContact CD2-OE2 3.77Å; H650-E743 IonicContact NE2-OE2 3.81Å; H650-E743 PolarHBondContact NE2-OE2 3.35Å
651	G	74.5	Confident	61.7	Low	1 Å²	1	58.2 Å²	58.2	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	158.8	167.9	0	0	0	0	0	111.2	W673 I674 S739	G651-W673 CarbonylContact O-C 3.53Å; G651-W673 WeakPolarHBondContact O-CA 3.41Å; G651-I674 PolarHBondContact N-O 3.2Å; G651-I674 PolarHBondContact O-N 3.45Å; G651-S739 CarbonylContact C-O 3.55Å; G651-S739 WeakPolarHBondContact CA-O 3.3Å
652	C	75.6	Confident	63.3	Low	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	124.8	173	-170.7	0	0	0	0	110.7	T658 F664 C670 L672 L738 S739	C652-T658 PolarHBondContact SG-OG1 3.4Å; C652-F664 HydrophobicContact CB-CD1 3.7Å; C652-F664 HydrophobicContact CB-CE1 3.73Å; C652-F664 HydrophobicContact CB-CG 4.44Å; C652-F664 HydrophobicContact CB-CZ 4.46Å; C652-C670 VanDerWaalsContact CA-SG 3.52Å; C652-C670 HydrophobicContact CB-CB 4.27Å; C652-C670 WeakPolarHBondContact CB-SG 3.41Å; C652-C670 WeakPolarHBondContact SG-CA 3.44Å; C652-C670 WeakPolarHBondContact SG-CB 3.43Å; C652-C670 CovalentContact SG-SG 2.02Å; C652-C670 PolarHBondContact SG-SG 2.86Å; C652-L672 WeakPolarHBondContact CA-O 3.2Å; C652-L738 CarbonylContact O-C 3.54Å; C652-L738 WeakPolarHBondContact O-CA 3.3Å; C652-S739 PolarHBondContact N-O 2.98Å; C652-S739 PolarHBondContact O-N 3.01Å
653	F	76.1	Confident	64.7	Low	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.6	173	-167.1	-121.3	0	0	0	110.9	I608 L610 L620 I622 L672 P731 W736 Y737 L738	I608-F653 HydrophobicContact CD1-CE2 3.92Å; L610-F653 HydrophobicContact CD1-CZ 4.46Å; L620-F653 HydrophobicContact CD2-CE1 4.32Å; L620-F653 HydrophobicContact CD2-CZ 4.22Å; I622-F653 HydrophobicContact CD1-CD1 4.47Å; I622-F653 HydrophobicContact CD1-CD2 4.31Å; I622-F653 HydrophobicContact CD1-CE2 4.36Å; I622-F653 HydrophobicContact CD1-CG 4.38Å; I622-F653 HydrophobicContact CD1-CZ 4.48Å; F653-L672 HydrophobicContact CB-CB 4.05Å; F653-L672 HydrophobicContact CB-CD1 4.12Å; F653-L672 HydrophobicContact CD1-CD1 3.72Å; F653-L672 HydrophobicContact CG-CD1 4.4Å; F653-L672 PolarHBondContact N-O 2.97Å; F653-L672 WeakPolarHBondContact O-CB 3.43Å; F653-P731 HydrophobicContact CE1-CG 3.93Å; F653-W736 AromaticContact CD1-CE3 3.85Å; F653-W736 HydrophobicContact CD1-CE3 3.85Å; F653-W736 HydrophobicContact CD1-CZ3 4.27Å; F653-W736 HydrophobicContact CD2-CB 4.41Å; F653-W736 HydrophobicContact CE1-CB 4.32Å; F653-W736 AromaticContact CE1-CD2 3.86Å; F653-W736 HydrophobicContact CE1-CD2 3.86Å; F653-W736 AromaticContact CE1-CE3 3.58Å; F653-W736 HydrophobicContact CE1-CE3 3.58Å; F653-W736 HydrophobicContact CE1-CG 4.19Å; F653-W736 HydrophobicContact CE1-CZ3 4.2Å; F653-W736 HydrophobicContact CE2-CB 3.53Å; F653-W736 HydrophobicContact CE2-CG 4.26Å; F653-W736 HydrophobicContact CG-CE3 4.42Å; F653-W736 HydrophobicContact CZ-CB 3.48Å; F653-W736 VanDerWaalsContact CZ-CB 3.48Å; F653-W736 AromaticContact CZ-CD2 3.89Å; F653-W736 HydrophobicContact CZ-CD2 3.89Å; F653-W736 AromaticContact CZ-CE3 3.95Å; F653-W736 HydrophobicContact CZ-CE3 3.95Å; F653-W736 AromaticContact CZ-CG 3.7Å; F653-W736 HydrophobicContact CZ-CG 3.7Å; F653-Y737 WeakPolarHBondContact CA-O 3.09Å; F653-L738 HydrophobicContact CD2-CB 4.13Å
654	A	75.6	Confident	65.8	Low	1 Å²	1	50 Å²	50	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160	-169.6	0	0	0	0	0	112.9	H656 P671 W736 Y737	A654-H656 VanDerWaalsContact C-N 3.27Å; A654-H656 WeakPolarHBondContact CB-O 3.14Å; A654-P671 HydrophobicContact CB-CG 4.3Å; A654-W736 CarbonylContact O-C 3.43Å; A654-W736 WeakPolarHBondContact O-CA 3.27Å; A654-Y737 PolarHBondContact N-O 2.88Å; A654-Y737 PolarHBondContact O-N 2.82Å
655	R	73.1	Confident	66.4	Low	95 Å²	95	50 Å²	50	36%	0.358	25%	0.253	S	S	.	.	S	Bend	trans	-80.6	-5.6	166.3	-76.6	-173.3	166.3	-139.5	-10.4	113.5	T732 P733 W736	R655-T732 PolarHBondContact NH2-O 3.01Å; R655-T732 PolarHBondContact NH2-OG1 3.3Å; R655-T732 VanDerWaalsContact NH2-OG1 3.15Å; R655-P733 PolarHBondContact NH2-O 3.31Å; R655-W736 HydrophobicContact CG-CD2 3.8Å; R655-W736 HydrophobicContact CG-CE3 3.97Å; R655-W736 HydrophobicContact CG-CG 4.38Å; R655-W736 HydrophobicContact CG-CH2 4.08Å; R655-W736 HydrophobicContact CG-CZ2 3.91Å; R655-W736 HydrophobicContact CG-CZ3 4.12Å
656	H	74	Confident	67	Low	135 Å²	135	47.6 Å²	47.6	63%	0.625	25%	0.247	S	C	*	.	S	Bend	trans	-120.4	150.2	179.5	-57.2	-58.7	0	0	0	111.2	A654 T658	A654-H656 VanDerWaalsContact C-N 3.27Å; A654-H656 WeakPolarHBondContact CB-O 3.14Å; H656-T658 PolarHBondContact O-N 2.94Å
657	L	69.9	Low	67.1	Low	97 Å²	97	49 Å²	49	51%	0.508	26%	0.256	S	S	.	.			trans	-72.1	117.7	-176.1	-155.8	86.8	0	0	0	111.3	V605 N659 Y737	V605-L657 HydrophobicContact CB-CD1 4.42Å; V605-L657 HydrophobicContact CG1-CD1 3.67Å; V605-L657 HydrophobicContact CG1-CG 4.3Å; L657-N659 HydrophobicContact CD2-CB 4.29Å; L657-N659 PolarHBondContact O-N 2.86Å; L657-Y737 HydrophobicContact CD1-CD1 3.73Å; L657-Y737 HydrophobicContact CD1-CE1 3.84Å; L657-Y737 HydrophobicContact CD1-CG 4.15Å
658	T	69.5	Low	67.2	Low	2 Å²	2	55.8 Å²	55.8	1%	0.012	29%	0.287	C	S	.	.			trans	-98.9	84.7	179.3	9.4	0	0	0	0	111.1	C652 H656 G663 R669 C670 S739	C652-T658 PolarHBondContact SG-OG1 3.4Å; H656-T658 PolarHBondContact O-N 2.94Å; T658-G663 WeakPolarHBondContact CG2-O 3.23Å; T658-R669 HydrophobicContact CG2-CB 4.2Å; T658-C670 HydrophobicContact CG2-CB 4.24Å; T658-S739 WeakPolarHBondContact CB-OG 3.32Å; T658-S739 PolarHBondContact O-OG 3.02Å; T658-S739 WeakPolarHBondContact OG1-CB 3.43Å; T658-S739 PolarHBondContact OG1-OG 3.37Å
659	N	70	Confident	67.4	Low	97 Å²	97	61.4 Å²	61.4	52%	0.519	31%	0.307	S	S	.	.			trans	-105.6	14.4	-171.1	68.4	-11	0	0	0	115.1	L657	L657-N659 HydrophobicContact CD2-CB 4.29Å; L657-N659 PolarHBondContact O-N 2.86Å
660	T	69	Low	67.3	Low	56 Å²	56	61.6 Å²	61.6	34%	0.344	31%	0.308	S	S	.	.	S	Bend	trans	-140.5	143.1	-179.7	45.5	0	0	0	0	110.5	K662 G663	T660-K662 VanDerWaalsContact C-N 3.32Å; T660-K662 PolarHBondContact O-N 3.05Å; T660-G663 WeakPolarHBondContact O-CA 3.44Å; T660-G663 PolarHBondContact O-N 3.39Å
661	P	58.3	Low	66.9	Low	67 Å²	67	62 Å²	62	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-41.7	-177.1	-26	35.7	0	0	0	112.8	I603 G663 F664 Y741	I603-P661 HydrophobicContact CD1-CG 4.18Å; P661-G663 PolarHBondContact O-N 3.2Å; P661-F664 WeakPolarHBondContact O-CB 3.46Å; P661-F664 PolarHBondContact O-N 3.01Å; P661-Y741 HydrophobicContact CB-CE1 4.08Å; P661-Y741 HydrophobicContact CB-CE2 4.4Å; P661-Y741 HydrophobicContact CG-CE2 4.07Å
662	K	63.9	Low	66.4	Low	184 Å²	184	62 Å²	62	80%	0.8	31%	0.311	S	S	*	.	H	α-helix	trans	-59.4	-28.5	173.7	-170.8	173.1	-178.4	177.4	0	112.9	T660 F664 A665 D666	T660-K662 VanDerWaalsContact C-N 3.32Å; T660-K662 PolarHBondContact O-N 3.05Å; K662-F664 VanDerWaalsContact C-N 3.33Å; K662-A665 PolarHBondContact O-N 3.31Å; K662-D666 PolarHBondContact O-N 3.34Å
663	G	65.4	Low	65.8	Low	1 Å²	1	65.3 Å²	65.3	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-69.2	-24.8	176.2	0	0	0	0	0	114.2	T658 T660 P661 C670	T658-G663 WeakPolarHBondContact CG2-O 3.23Å; T660-G663 WeakPolarHBondContact O-CA 3.44Å; T660-G663 PolarHBondContact O-N 3.39Å; P661-G663 PolarHBondContact O-N 3.2Å; G663-C670 VanDerWaalsContact O-CB 3.28Å; G663-C670 WeakPolarHBondContact O-CB 3.2Å
664	F	62	Low	65.2	Low	4 Å²	4	65.6 Å²	65.6	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-71.8	-30.7	174.1	-78.5	-108.1	0	0	0	112.1	I603 H650 C652 P661 K662 C670 W673 S739	I603-F664 HydrophobicContact CD1-CE2 4.19Å; I603-F664 HydrophobicContact CG1-CE2 4.39Å; I603-F664 HydrophobicContact CG2-CE2 3.93Å; I603-F664 HydrophobicContact CG2-CZ 4.07Å; H650-F664 HydrophobicContact CB-CD1 3.89Å; H650-F664 HydrophobicContact CB-CE1 4.28Å; C652-F664 HydrophobicContact CB-CD1 3.7Å; C652-F664 HydrophobicContact CB-CE1 3.73Å; C652-F664 HydrophobicContact CB-CG 4.44Å; C652-F664 HydrophobicContact CB-CZ 4.46Å; P661-F664 WeakPolarHBondContact O-CB 3.46Å; P661-F664 PolarHBondContact O-N 3.01Å; K662-F664 VanDerWaalsContact C-N 3.33Å; F664-C670 WeakPolarHBondContact O-CB 3.19Å; F664-W673 PolarHBondContact O-NE1 3.03Å; F664-S739 WeakPolarHBondContact CE1-O 3.4Å; F664-S739 VanDerWaalsContact CZ-CB 3.47Å
665	A	54.3	Low	64.3	Low	77 Å²	77	69.5 Å²	69.5	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-91.7	-8.6	179.1	0	0	0	0	0	114.1	K662	K662-A665 PolarHBondContact O-N 3.31Å
666	D	62.7	Low	63.5	Low	51 Å²	51	65.2 Å²	65.2	27%	0.273	32%	0.324	S	S	.	.			trans	-86	110.9	177	175.9	-4.5	0	0	0	110.1	K662 H668 R669 C670	K662-D666 PolarHBondContact O-N 3.34Å; D666-H668 PolarHBondContact O-N 3.34Å; D666-H668 WeakPolarHBondContact OD1-CB 3.45Å; D666-H668 IonicContact OD1-CD2 2.76Å; D666-H668 PolarHBondContact OD1-N 3.5Å; D666-R669 HydrophobicContact CB-CB 4.17Å; D666-R669 HydrophobicContact CB-CG 4.34Å; D666-R669 PolarHBondContact O-N 2.95Å; D666-R669 WeakPolarHBondContact OD2-CD 3.44Å; D666-R669 VanDerWaalsContact OD2-CG 3.3Å; D666-R669 WeakPolarHBondContact OD2-CG 3.46Å; D666-R669 IonicContact OD2-NE 3.7Å; D666-R669 PolarHBondContact OD2-NE 3.42Å; D666-C670 PolarHBondContact O-N 3.34Å
667	I	55.4	Low	62.4	Low	108 Å²	108	60.3 Å²	60.3	55%	0.554	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.2	-177.1	-159.8	168	0	0	0	114.2	A693	I667-A693 HydrophobicContact CD1-CB 4.24Å
668	H	60.6	Low	61.5	Low	163 Å²	163	57.5 Å²	57.5	76%	0.755	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-27.7	176.1	-64.8	-75.1	0	0	0	113	D666	D666-H668 PolarHBondContact O-N 3.34Å; D666-H668 WeakPolarHBondContact OD1-CB 3.45Å; D666-H668 IonicContact OD1-CD2 2.76Å; D666-H668 PolarHBondContact OD1-N 3.5Å
669	R	65.7	Low	60.3	Low	140 Å²	140	60.3 Å²	60.3	53%	0.528	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-32.6	176.5	-66	176.7	-174.3	-128.8	-7.3	112.1	T658 D666	T658-R669 HydrophobicContact CG2-CB 4.2Å; D666-R669 HydrophobicContact CB-CB 4.17Å; D666-R669 HydrophobicContact CB-CG 4.34Å; D666-R669 PolarHBondContact O-N 2.95Å; D666-R669 WeakPolarHBondContact OD2-CD 3.44Å; D666-R669 VanDerWaalsContact OD2-CG 3.3Å; D666-R669 WeakPolarHBondContact OD2-CG 3.46Å; D666-R669 IonicContact OD2-NE 3.7Å; D666-R669 PolarHBondContact OD2-NE 3.42Å
670	C	67.3	Low	58.8	Low	4 Å²	4	65.2 Å²	65.2	3%	0.027	33%	0.328	C	S	.	.			trans	-124.8	80.5	179	-163.6	0	0	0	0	111.8	C652 T658 G663 F664 D666 L672 W673	C652-C670 VanDerWaalsContact CA-SG 3.52Å; C652-C670 HydrophobicContact CB-CB 4.27Å; C652-C670 WeakPolarHBondContact CB-SG 3.41Å; C652-C670 WeakPolarHBondContact SG-CA 3.44Å; C652-C670 WeakPolarHBondContact SG-CB 3.43Å; C652-C670 CovalentContact SG-SG 2.02Å; C652-C670 PolarHBondContact SG-SG 2.86Å; T658-C670 HydrophobicContact CG2-CB 4.24Å; G663-C670 VanDerWaalsContact O-CB 3.28Å; G663-C670 WeakPolarHBondContact O-CB 3.2Å; F664-C670 WeakPolarHBondContact O-CB 3.19Å; D666-C670 PolarHBondContact O-N 3.34Å; C670-L672 PolarHBondContact O-N 3.12Å; C670-W673 WeakPolarHBondContact SG-CA 3.48Å; C670-W673 PolarHBondContact SG-N 3.44Å
671	P	62.2	Low	57	Low	18 Å²	18	64.9 Å²	64.9	12%	0.117	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.6	178	26.9	-35.7	0	0	0	113.6	A654 V697	A654-P671 HydrophobicContact CB-CG 4.3Å; P671-V697 HydrophobicContact CB-CB 4.02Å; P671-V697 HydrophobicContact CB-CG1 3.72Å; P671-V697 HydrophobicContact CB-CG2 3.66Å; P671-V697 HydrophobicContact CG-CG1 4.27Å
672	L	63.5	Low	55.7	Low	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	67.8	179.4	-57.2	165.7	0	0	0	109.1	C652 F653 C670 A694 F698 F728 W736	C652-L672 WeakPolarHBondContact CA-O 3.2Å; F653-L672 HydrophobicContact CB-CB 4.05Å; F653-L672 HydrophobicContact CB-CD1 4.12Å; F653-L672 HydrophobicContact CD1-CD1 3.72Å; F653-L672 HydrophobicContact CG-CD1 4.4Å; F653-L672 PolarHBondContact N-O 2.97Å; F653-L672 WeakPolarHBondContact O-CB 3.43Å; C670-L672 PolarHBondContact O-N 3.12Å; L672-A694 HydrophobicContact CD2-CB 3.26Å; L672-F698 HydrophobicContact CD1-CE1 4.31Å; L672-F698 HydrophobicContact CD1-CE2 3.6Å; L672-F698 HydrophobicContact CD1-CZ 3.41Å; L672-F698 VanDerWaalsContact CD1-CZ 3.41Å; L672-F698 HydrophobicContact CD2-CD2 4.44Å; L672-F698 HydrophobicContact CD2-CE2 3.82Å; L672-F698 HydrophobicContact CD2-CZ 4.49Å; L672-F698 HydrophobicContact CG-CE2 4.34Å; L672-F728 HydrophobicContact CD1-CE1 4.43Å; L672-F728 HydrophobicContact CD1-CZ 4.3Å; L672-F728 HydrophobicContact CD2-CE1 3.89Å; L672-F728 HydrophobicContact CD2-CZ 4.24Å; L672-W736 HydrophobicContact CD1-CZ3 4.5Å
673	W	62.2	Low	54.3	Low	70 Å²	70	58.7 Å²	58.7	27%	0.265	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	147.8	166.4	-168.3	48.2	0	0	0	110.1	H650 G651 F664 C670 I690	H650-W673 AromaticContact CE1-CE2 3.92Å; H650-W673 AromaticContact CE1-CZ2 3.34Å; H650-W673 WeakPolarHBondContact CE1-CZ2 3.47Å; H650-W673 AromaticContact CG-NE1 3.95Å; H650-W673 AromaticContact ND1-CE2 3.34Å; H650-W673 VanDerWaalsContact ND1-CE2 3.34Å; H650-W673 AromaticContact ND1-CZ2 3.26Å; H650-W673 VanDerWaalsContact ND1-CZ2 3.26Å; H650-W673 WeakPolarHBondContact ND1-CZ2 3.4Å; H650-W673 AromaticContact ND1-NE1 3.1Å; H650-W673 PolarHBondContact ND1-NE1 3.07Å; G651-W673 CarbonylContact O-C 3.53Å; G651-W673 WeakPolarHBondContact O-CA 3.41Å; F664-W673 PolarHBondContact O-NE1 3.03Å; C670-W673 WeakPolarHBondContact SG-CA 3.48Å; C670-W673 PolarHBondContact SG-N 3.44Å; W673-I690 WeakPolarHBondContact O-CD1 3.14Å; W673-I690 WeakPolarHBondContact O-CG1 3.32Å; W673-I690 WeakPolarHBondContact O-CG2 3.42Å
674	I	65	Low	53	Low	6 Å²	6	62.2 Å²	62.2	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.6	174.2	-48.3	174	0	0	0	105.8	L624 H650 G651 L676 L726	L624-I674 HydrophobicContact CD1-CD1 4.35Å; H650-I674 CarbonylContact C-O 3.58Å; H650-I674 WeakPolarHBondContact CA-O 3.5Å; G651-I674 PolarHBondContact N-O 3.2Å; G651-I674 PolarHBondContact O-N 3.45Å; I674-L676 HydrophobicContact CG2-CG 4.49Å; I674-L726 HydrophobicContact CD1-CD2 3.5Å; I674-L726 HydrophobicContact CG1-CD2 3.65Å; I674-L726 HydrophobicContact CG2-CD2 4.36Å
675	R	55.5	Low	52	Low	83 Å²	83	63 Å²	63	31%	0.313	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	127.2	173.4	-165.8	-178.3	-158.2	-164.4	8.6	109.8	I648 L649 H650 V686 E743	I648-R675 HydrophobicContact CG2-CG 3.84Å; L649-R675 WeakPolarHBondContact O-CA 3.4Å; H650-R675 VanDerWaalsContact CE1-CD 3.5Å; H650-R675 WeakPolarHBondContact CE1-CD 3.06Å; H650-R675 PolarHBondContact CE1-NE 3.46Å; H650-R675 PolarHBondContact NE2-NE 3.39Å; R675-V686 HydrophobicContact CB-CG2 4.34Å; R675-E743 IonicContact NH2-OE2 3.3Å
676	L	57.1	Low	51.5	Low	6 Å²	6	61.9 Å²	61.9	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.1	175.4	-56	175	0	0	0	107.9	L624 L626 I648 L649 I674 S724	L624-L676 HydrophobicContact CB-CD1 3.74Å; L624-L676 HydrophobicContact CD1-CD1 4.42Å; L626-L676 HydrophobicContact CD1-CB 4.15Å; I648-L676 CarbonylContact C-O 3.52Å; I648-L676 VanDerWaalsContact CA-O 3.27Å; I648-L676 WeakPolarHBondContact CA-O 3.49Å; L649-L676 HydrophobicContact CB-CB 4.47Å; L649-L676 PolarHBondContact N-O 2.92Å; L649-L676 PolarHBondContact O-N 2.99Å; I674-L676 HydrophobicContact CG2-CG 4.49Å; L676-S724 WeakPolarHBondContact CD1-OG 3.26Å; L676-S724 WeakPolarHBondContact CD2-OG 2.95Å
677	A	50.7	Low	50.5	Low	31 Å²	31	59.6 Å²	59.6	26%	0.256	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.6	178.3	0	0	0	0	0	109.6	I647 I648	I647-A677 VanDerWaalsContact O-CA 3.29Å; I647-A677 WeakPolarHBondContact O-CA 3.38Å; I648-A677 HydrophobicContact CG1-CB 4.1Å
678	T	51.1	Low	49.4	Very low	39 Å²	39	62.4 Å²	62.4	24%	0.239	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	111.2	-172.5	54.1	0	0	0	0	112.6	L626 I647	L626-T678 HydrophobicContact CB-CG2 4.32Å; L626-T678 HydrophobicContact CD1-CG2 3.75Å; I647-T678 PolarHBondContact O-N 3.35Å; I647-T678 VanDerWaalsContact O-N 3.09Å
679	D	45.3	Very low	48.2	Very low	60 Å²	60	56.8 Å²	56.8	32%	0.321	30%	0.302	S	S	.	.	S	Bend	trans	-168.9	35	179.1	48.9	-78.9	0	0	0	114.5	Q646	Q646-D679 HydrophobicContact CB-CB 4.05Å; Q646-D679 HydrophobicContact CG-CB 3.79Å; Q646-D679 PolarHBondContact NE2-OD2 2.95Å
680	H	36.7	Very low	47.3	Very low	200 Å²	200	50.8 Å²	50.8	93%	0.926	28%	0.28	S	S	*	.	S	Bend	trans	77.8	22.3	-174.3	-49.5	-74.5	0	0	0	116.9
681	G	32.4	Very low	46.1	Very low	50 Å²	50	52.7 Å²	52.7	52%	0.515	29%	0.293	S	S	.	.	S	Bend	trans	-117.4	149.1	152.7	0	0	0	0	0	110.3	A683	G681-A683 PolarHBondContact O-N 3.27Å
682	L	30.7	Very low	45.1	Very low	107 Å²	107	55 Å²	55	56%	0.56	31%	0.31	S	S	*	.			trans	-43.5	136.3	177.9	-91.7	73	0	0	0	111.3	V684 F717	L682-V684 VanDerWaalsContact O-CG2 3.27Å; L682-V684 WeakPolarHBondContact O-CG2 3.49Å; L682-V684 PolarHBondContact O-N 3.45Å; L682-F717 HydrophobicContact CB-CD1 4.23Å; L682-F717 HydrophobicContact CB-CE1 4.27Å; L682-F717 HydrophobicContact CD2-CD1 4.32Å; L682-F717 HydrophobicContact CG-CD1 3.89Å; L682-F717 HydrophobicContact CG-CE1 3.97Å
683	A	35.2	Very low	44.3	Very low	14 Å²	14	55.9 Å²	55.9	12%	0.116	32%	0.317	C	S	.	.			trans	-68	92.9	178.6	0	0	0	0	0	110.7	G681 S685 F717	G681-A683 PolarHBondContact O-N 3.27Å; A683-S685 VanDerWaalsContact C-N 3.3Å; A683-S685 PolarHBondContact O-N 2.75Å; A683-F717 HydrophobicContact CB-CD2 3.6Å; A683-F717 HydrophobicContact CB-CE2 3.44Å; A683-F717 VanDerWaalsContact CB-CE2 3.44Å; A683-F717 HydrophobicContact CB-CG 4.35Å; A683-F717 HydrophobicContact CB-CZ 4.1Å
684	V	37.2	Very low	43.7	Very low	74 Å²	74	52.7 Å²	52.7	45%	0.448	31%	0.306	S	S	.	.			trans	-74.2	82.1	-176.5	-170.4	0	0	0	0	110.3	L682 V686 W815	L682-V684 VanDerWaalsContact O-CG2 3.27Å; L682-V684 WeakPolarHBondContact O-CG2 3.49Å; L682-V684 PolarHBondContact O-N 3.45Å; V684-V686 WeakPolarHBondContact O-CG2 3.43Å; V684-V686 PolarHBondContact O-N 3.08Å; V684-V686 VanDerWaalsContact O-N 3.08Å; V684-W815 HydrophobicContact CG1-CH2 4.41Å; V684-W815 HydrophobicContact CG2-CH2 3.83Å; V684-W815 HydrophobicContact CG2-CZ2 4.31Å
685	S	42	Very low	42.9	Very low	21 Å²	21	54.4 Å²	54.4	15%	0.147	32%	0.319	C	S	.	.			trans	-58.9	112.1	164	-176.5	0	0	0	0	108.8	A683 A687	A683-S685 VanDerWaalsContact C-N 3.3Å; A683-S685 PolarHBondContact O-N 2.75Å; S685-A687 PolarHBondContact O-N 2.94Å
686	V	42.7	Very low	42.5	Very low	54 Å²	54	57.6 Å²	57.6	33%	0.327	34%	0.335	S	S	.	.			trans	-74.7	22.3	-176	-162.7	0	0	0	0	111.8	R675 V684 H688 A689	R675-V686 HydrophobicContact CB-CG2 4.34Å; V684-V686 WeakPolarHBondContact O-CG2 3.43Å; V684-V686 PolarHBondContact O-N 3.08Å; V684-V686 VanDerWaalsContact O-N 3.08Å; V686-H688 PolarHBondContact O-N 3.38Å; V686-A689 PolarHBondContact O-N 3.1Å
687	A	41.3	Very low	42.2	Very low	2 Å²	2	59.4 Å²	59.4	2%	0.017	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-18.6	-166.9	0	0	0	0	0	114.8	S685 A689 I690 S691 T715 L726	S685-A687 PolarHBondContact O-N 2.94Å; A687-A689 PolarHBondContact O-N 3.01Å; A687-I690 CarbonylContact O-C 3.57Å; A687-I690 PolarHBondContact O-N 3.15Å; A687-S691 WeakPolarHBondContact O-CB 3.43Å; A687-S691 PolarHBondContact O-N 2.96Å; A687-T715 HydrophobicContact CB-CG2 3.31Å; A687-L726 HydrophobicContact CB-CD1 4.41Å
688	H	32.6	Very low	42.2	Very low	168 Å²	168	58.3 Å²	58.3	78%	0.778	34%	0.335	S	S	*	.	H	α-helix	trans	-64.7	-37.4	177.1	-163.6	70.7	0	0	0	112.9	V686	V686-H688 PolarHBondContact O-N 3.38Å
689	A	36.2	Very low	42	Very low	45 Å²	45	59.4 Å²	59.4	37%	0.372	35%	0.349	S	S	.	.	H	α-helix	trans	-73.5	-42.6	172.7	0	0	0	0	0	111.1	V686 A687 S691 S692 W810	V686-A689 PolarHBondContact O-N 3.1Å; A687-A689 PolarHBondContact O-N 3.01Å; A689-S691 VanDerWaalsContact C-N 3.29Å; A689-S691 PolarHBondContact O-N 2.94Å; A689-S692 PolarHBondContact O-N 2.88Å; A689-W810 HydrophobicContact CB-CZ3 4.28Å
690	I	45.4	Very low	42.1	Very low	13 Å²	13	61.2 Å²	61.2	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-61.8	-36.1	179.1	-62.6	149.5	0	0	0	110.8	W673 A687 S692 A693 A694	W673-I690 WeakPolarHBondContact O-CD1 3.14Å; W673-I690 WeakPolarHBondContact O-CG1 3.32Å; W673-I690 WeakPolarHBondContact O-CG2 3.42Å; A687-I690 CarbonylContact O-C 3.57Å; A687-I690 PolarHBondContact O-N 3.15Å; I690-S692 PolarHBondContact O-N 2.9Å; I690-S692 VanDerWaalsContact O-N 3.13Å; I690-A693 CarbonylContact O-C 3.55Å; I690-A693 PolarHBondContact O-N 3.34Å; I690-A694 WeakPolarHBondContact O-CB 3.47Å; I690-A694 PolarHBondContact O-N 3.36Å
691	S	43.9	Very low	42.4	Very low	44 Å²	44	53.6 Å²	53.6	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-55.8	-32.7	177.7	-174.6	0	0	0	0	113.1	A687 A689 S695	A687-S691 WeakPolarHBondContact O-CB 3.43Å; A687-S691 PolarHBondContact O-N 2.96Å; A689-S691 VanDerWaalsContact C-N 3.29Å; A689-S691 PolarHBondContact O-N 2.94Å; S691-S695 VanDerWaalsContact O-CB 3.26Å; S691-S695 WeakPolarHBondContact O-CB 3.38Å; S691-S695 PolarHBondContact O-N 3.34Å; S691-S695 PolarHBondContact O-OG 3.49Å
692	S	41.5	Very low	42.7	Very low	67 Å²	67	53.1 Å²	53.1	47%	0.469	32%	0.32	S	S	.	.	H	α-helix	trans	-76.7	-38	176.7	-170.7	0	0	0	0	112.1	A689 I690 S695 K696	A689-S692 PolarHBondContact O-N 2.88Å; I690-S692 PolarHBondContact O-N 2.9Å; I690-S692 VanDerWaalsContact O-N 3.13Å; S692-S695 PolarHBondContact O-OG 3.41Å; S692-K696 WeakPolarHBondContact O-CB 3.44Å; S692-K696 WeakPolarHBondContact O-CG 3.21Å; S692-K696 PolarHBondContact O-N 2.94Å
693	A	45.1	Very low	42.9	Very low	19 Å²	19	51 Å²	51	16%	0.157	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-48.2	173.4	0	0	0	0	0	111.3	I667 I690 S695 K696 V697	I667-A693 HydrophobicContact CD1-CB 4.24Å; I690-A693 CarbonylContact O-C 3.55Å; I690-A693 PolarHBondContact O-N 3.34Å; A693-S695 PolarHBondContact O-N 3.49Å; A693-K696 PolarHBondContact O-N 3.42Å; A693-V697 WeakPolarHBondContact O-CB 3.4Å; A693-V697 WeakPolarHBondContact O-CG2 3.45Å; A693-V697 PolarHBondContact O-N 3.43Å
694	A	50	Low	42.7	Very low	3 Å²	3	53.9 Å²	53.9	3%	0.025	33%	0.331	C	S	.	.	H	α-helix	trans	-54.7	-52.9	176.1	0	0	0	0	0	111.9	L672 I690 K696 V697 F698	L672-A694 HydrophobicContact CD2-CB 3.26Å; I690-A694 WeakPolarHBondContact O-CB 3.47Å; I690-A694 PolarHBondContact O-N 3.36Å; A694-K696 PolarHBondContact O-N 3.28Å; A694-V697 PolarHBondContact O-N 2.69Å; A694-F698 HydrophobicContact CB-CD2 4.35Å; A694-F698 VanDerWaalsContact O-CB 3.32Å; A694-F698 WeakPolarHBondContact O-CB 3.13Å; A694-F698 VanDerWaalsContact O-CD2 3.25Å; A694-F698 WeakPolarHBondContact O-CD2 3.32Å; A694-F698 PolarHBondContact O-N 2.89Å
695	S	48.1	Very low	42.6	Very low	43 Å²	43	53.3 Å²	53.3	30%	0.301	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-40.5	179.1	53.8	0	0	0	0	112.2	S691 S692 A693 A699	S691-S695 VanDerWaalsContact O-CB 3.26Å; S691-S695 WeakPolarHBondContact O-CB 3.38Å; S691-S695 PolarHBondContact O-N 3.34Å; S691-S695 PolarHBondContact O-OG 3.49Å; S692-S695 PolarHBondContact O-OG 3.41Å; A693-S695 PolarHBondContact O-N 3.49Å; S695-A699 WeakPolarHBondContact O-CB 3.4Å; S695-A699 PolarHBondContact O-N 3.3Å
696	K	46.8	Very low	42	Very low	150 Å²	150	56.8 Å²	56.8	65%	0.652	33%	0.331	S	S	*	.	H	α-helix	trans	-64.2	-46.6	173.9	-78.2	179.5	176.3	-178.8	0	112.9	S692 A693 A694 S700	S692-K696 WeakPolarHBondContact O-CB 3.44Å; S692-K696 WeakPolarHBondContact O-CG 3.21Å; S692-K696 PolarHBondContact O-N 2.94Å; A693-K696 PolarHBondContact O-N 3.42Å; A694-K696 PolarHBondContact O-N 3.28Å; K696-S700 WeakPolarHBondContact O-CB 3.4Å; K696-S700 PolarHBondContact O-N 3.14Å; K696-S700 PolarHBondContact O-OG 3.15Å
697	V	51.3	Low	41.3	Very low	44 Å²	44	60.1 Å²	60.1	27%	0.267	36%	0.357	S	S	.	.	H	α-helix	trans	-71.1	-46	-176.4	174.2	0	0	0	0	110.7	P671 A693 A694 A699 S700 S701	P671-V697 HydrophobicContact CB-CB 4.02Å; P671-V697 HydrophobicContact CB-CG1 3.72Å; P671-V697 HydrophobicContact CB-CG2 3.66Å; P671-V697 HydrophobicContact CG-CG1 4.27Å; A693-V697 WeakPolarHBondContact O-CB 3.4Å; A693-V697 WeakPolarHBondContact O-CG2 3.45Å; A693-V697 PolarHBondContact O-N 3.43Å; A694-V697 PolarHBondContact O-N 2.69Å; V697-A699 PolarHBondContact O-N 3.11Å; V697-S700 WeakPolarHBondContact CA-OG 3.26Å; V697-S700 PolarHBondContact O-N 3.43Å; V697-S700 VanDerWaalsContact O-N 3.17Å; V697-S700 PolarHBondContact O-OG 3.06Å; V697-S701 PolarHBondContact O-N 3.17Å
698	F	51.6	Low	40.7	Very low	7 Å²	7	63.9 Å²	63.9	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-60.7	-46.1	173.6	-75.9	-57.5	0	0	0	111.6	L672 A694 S700 S701 Q702 F728 P731 W736	L672-F698 HydrophobicContact CD1-CE1 4.31Å; L672-F698 HydrophobicContact CD1-CE2 3.6Å; L672-F698 HydrophobicContact CD1-CZ 3.41Å; L672-F698 VanDerWaalsContact CD1-CZ 3.41Å; L672-F698 HydrophobicContact CD2-CD2 4.44Å; L672-F698 HydrophobicContact CD2-CE2 3.82Å; L672-F698 HydrophobicContact CD2-CZ 4.49Å; L672-F698 HydrophobicContact CG-CE2 4.34Å; A694-F698 HydrophobicContact CB-CD2 4.35Å; A694-F698 VanDerWaalsContact O-CB 3.32Å; A694-F698 WeakPolarHBondContact O-CB 3.13Å; A694-F698 VanDerWaalsContact O-CD2 3.25Å; A694-F698 WeakPolarHBondContact O-CD2 3.32Å; A694-F698 PolarHBondContact O-N 2.89Å; F698-S700 VanDerWaalsContact C-N 3.27Å; F698-S700 PolarHBondContact O-N 3.01Å; F698-S701 WeakPolarHBondContact CA-OG 3.48Å; F698-S701 CarbonylContact O-C 3.59Å; F698-S701 PolarHBondContact O-N 2.93Å; F698-S701 PolarHBondContact O-OG 2.92Å; F698-Q702 WeakPolarHBondContact O-CB 3.24Å; F698-Q702 VanDerWaalsContact O-CG 3.3Å; F698-Q702 WeakPolarHBondContact O-CG 3.43Å; F698-Q702 PolarHBondContact O-N 2.98Å; F698-F728 HydrophobicContact CE2-CB 4.23Å; F698-F728 AromaticContact CE2-CD1 3.59Å; F698-F728 HydrophobicContact CE2-CD1 3.59Å; F698-F728 HydrophobicContact CE2-CE1 4.11Å; F698-F728 HydrophobicContact CE2-CG 4.04Å; F698-F728 HydrophobicContact CZ-CB 4.26Å; F698-F728 HydrophobicContact CZ-CD1 4.2Å; F698-F728 HydrophobicContact CZ-CG 4.2Å; F698-P731 HydrophobicContact CE1-CB 3.88Å; F698-P731 HydrophobicContact CE1-CG 3.98Å; F698-P731 HydrophobicContact CZ-CG 4.27Å; F698-W736 HydrophobicContact CD1-CH2 4.48Å; F698-W736 AromaticContact CE1-CH2 3.88Å; F698-W736 HydrophobicContact CE1-CH2 3.88Å; F698-W736 HydrophobicContact CE1-CZ2 4.4Å; F698-W736 HydrophobicContact CE1-CZ3 4.43Å
699	A	46.6	Very low	40.9	Very low	63 Å²	63	64 Å²	64	52%	0.521	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-31.2	175.2	0	0	0	0	0	113.4	S695 V697 S701	S695-A699 WeakPolarHBondContact O-CB 3.4Å; S695-A699 PolarHBondContact O-N 3.3Å; V697-A699 PolarHBondContact O-N 3.11Å; A699-S701 VanDerWaalsContact C-N 3.32Å
700	S	46.2	Very low	40.8	Very low	97 Å²	97	64.3 Å²	64.3	68%	0.678	37%	0.366	S	S	*	.	H	α-helix	trans	-74.9	-21.3	173.6	74.5	0	0	0	0	113.7	K696 V697 F698	K696-S700 WeakPolarHBondContact O-CB 3.4Å; K696-S700 PolarHBondContact O-N 3.14Å; K696-S700 PolarHBondContact O-OG 3.15Å; V697-S700 WeakPolarHBondContact CA-OG 3.26Å; V697-S700 PolarHBondContact O-N 3.43Å; V697-S700 VanDerWaalsContact O-N 3.17Å; V697-S700 PolarHBondContact O-OG 3.06Å; F698-S700 VanDerWaalsContact C-N 3.27Å; F698-S700 PolarHBondContact O-N 3.01Å
701	S	43.2	Very low	40.3	Very low	40 Å²	40	66.4 Å²	66.4	28%	0.28	38%	0.38	S	S	.	.	H	α-helix	trans	-95.1	-26.4	177.8	77	0	0	0	0	113.7	V697 F698 A699 T732	V697-S701 PolarHBondContact O-N 3.17Å; F698-S701 WeakPolarHBondContact CA-OG 3.48Å; F698-S701 CarbonylContact O-C 3.59Å; F698-S701 PolarHBondContact O-N 2.93Å; F698-S701 PolarHBondContact O-OG 2.92Å; A699-S701 VanDerWaalsContact C-N 3.32Å; S701-T732 VanDerWaalsContact O-CG2 3.22Å; S701-T732 WeakPolarHBondContact O-CG2 3.37Å
702	Q	40	Very low	40	Very low	41 Å²	41	68 Å²	68	19%	0.192	39%	0.385	C	S	.	.	S	Bend	trans	-72.2	146.8	177.2	-77.2	172.9	-14.6	0	0	110.3	F698	F698-Q702 WeakPolarHBondContact O-CB 3.24Å; F698-Q702 VanDerWaalsContact O-CG 3.3Å; F698-Q702 WeakPolarHBondContact O-CG 3.43Å; F698-Q702 PolarHBondContact O-N 2.98Å
703	S	33.8	Very low	39.7	Very low	63 Å²	63	66.3 Å²	66.3	44%	0.441	37%	0.371	S	S	.	.			trans	-63.8	149.9	175.1	79.7	0	0	0	0	110.9	R705	S703-R705 PolarHBondContact O-N 3.18Å
704	P	31.9	Very low	39.2	Very low	74 Å²	74	66.6 Å²	66.6	48%	0.481	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	11.7	-173.5	-23.2	33.7	0	0	0	117.2	I92 L93	I92-P704 HydrophobicContact CG2-CB 4.1Å; L93-P704 HydrophobicContact CB-CG 4.17Å
705	R	33.9	Very low	38.8	Very low	62 Å²	62	68.4 Å²	68.4	23%	0.234	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-0.8	-169.7	-67.8	-179.4	172.7	-176.2	-1.4	114.6	F78 V80 P95 S703	F78-R705 PolarHBondContact O-NH1 3.4Å; V80-R705 HydrophobicContact CG2-CG 4.07Å; V80-R705 VanDerWaalsContact N-NH1 3.17Å; P95-R705 VanDerWaalsContact CD-CZ 3.44Å; S703-R705 PolarHBondContact O-N 3.18Å
706	R	29.3	Very low	38.3	Very low	93 Å²	93	69.3 Å²	69.3	35%	0.351	39%	0.387	S	S	.	.			trans	-98.2	100.9	173.4	-143.9	179.2	-159.8	150.8	6.5	108.8	D615 E708	D615-R706 PolarHBondContact O-NH2 3.27Å; D615-R706 IonicContact OD1-CZ 3.91Å; D615-R706 IonicContact OD1-NH1 3.77Å; D615-R706 PolarHBondContact OD1-NH1 2.92Å; D615-R706 IonicContact OD1-NH2 3.4Å; R706-E708 VanDerWaalsContact C-N 3.34Å
707	S	28.1	Very low	37.9	Very low	125 Å²	125	64.4 Å²	64.4	87%	0.874	37%	0.365	S	S	*	.			trans	-88.5	6.7	-173.1	52.6	0	0	0	0	114.7
708	E	30.3	Very low	37.5	Very low	80 Å²	80	65.9 Å²	65.9	37%	0.374	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-79.1	131.5	179	-64.6	179.6	162.2	0	0	110.8	R706 N857	R706-E708 VanDerWaalsContact C-N 3.34Å; E708-N857 PolarHBondContact OE1-ND2 3.33Å
709	R	36.1	Very low	37	Very low	171 Å²	171	72.4 Å²	72.4	65%	0.645	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-60.1	139.5	165.6	-73.2	177.1	175.4	150.2	-2.7	108.2	G851	R709-G851 PolarHBondContact NH1-O 2.93Å; R709-G851 VanDerWaalsContact NH1-O 3.16Å
710	P	34.6	Very low	36.5	Very low	52 Å²	52	74.1 Å²	74.1	34%	0.338	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-57.3	145.2	173.6	26.7	-35.5	0	0	0	110	P729	P710-P729 HydrophobicContact CB-CG 3.96Å
711	P	34.3	Very low	36.3	Very low	56 Å²	56	71.6 Å²	71.6	36%	0.364	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-57.5	144.1	173.9	25.9	-34	0	0	0	109.6	V619 L713	V619-P711 HydrophobicContact CG2-CG 4.13Å; P711-L713 PolarHBondContact O-N 3.49Å
712	N	36.3	Very low	36.4	Very low	78 Å²	78	72.9 Å²	72.9	42%	0.417	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-60	131.9	-177	-64.7	-53.3	0	0	0	110.4	D714 P787	N712-D714 VanDerWaalsContact C-N 3.29Å; N712-D714 PolarHBondContact O-N 2.9Å; N712-P787 VanDerWaalsContact CG-CD 3.48Å; N712-P787 VanDerWaalsContact OD1-CD 3.3Å; N712-P787 WeakPolarHBondContact OD1-CD 3.35Å
713	L	36.3	Very low	36.6	Very low	32 Å²	32	75.2 Å²	75.2	17%	0.168	40%	0.402	C	S	.	.			trans	-65.5	92.6	167.7	-90.2	64.8	0	0	0	108.4	P711 T715 L726 F727 F728	P711-L713 PolarHBondContact O-N 3.49Å; L713-T715 PolarHBondContact O-N 2.92Å; L713-L726 HydrophobicContact CD2-CD1 3.72Å; L713-L726 HydrophobicContact CG-CD1 4.13Å; L713-F727 WeakPolarHBondContact CD1-O 3.26Å; L713-F728 HydrophobicContact CD2-CE1 4.41Å
714	D	35.4	Very low	37.1	Very low	25 Å²	25	72.9 Å²	72.9	13%	0.134	39%	0.385	C	S	.	.			trans	-74.8	110	165.2	-175	4.4	0	0	0	108.6	N712 S716 R777	N712-D714 VanDerWaalsContact C-N 3.29Å; N712-D714 PolarHBondContact O-N 2.9Å; D714-S716 WeakPolarHBondContact OD1-CB 3.32Å; D714-S716 PolarHBondContact OD1-N 3.25Å; D714-S716 PolarHBondContact OD1-OG 3.44Å; D714-S716 PolarHBondContact OD2-OG 3.18Å; D714-S716 VanDerWaalsContact OD2-OG 3.1Å; D714-R777 IonicContact OD2-CZ 2.83Å; D714-R777 IonicContact OD2-NH1 3.8Å; D714-R777 IonicContact OD2-NH2 3.77Å; D714-R777 PolarHBondContact OD2-NH2 2.91Å
715	T	40.4	Very low	37.8	Very low	41 Å²	41	71.7 Å²	71.7	25%	0.252	37%	0.373	S	S	.	.			trans	-113.3	41.9	172.5	64.7	0	0	0	0	111	A687 L713 F717 L726	A687-T715 HydrophobicContact CB-CG2 3.31Å; L713-T715 PolarHBondContact O-N 2.92Å; T715-F717 PolarHBondContact O-N 2.92Å; T715-L726 HydrophobicContact CG2-CD1 3.92Å
716	S	37.5	Very low	38.4	Very low	61 Å²	61	69.2 Å²	69.2	43%	0.427	36%	0.364	S	S	.	.			trans	-54.1	105.4	165.4	40.7	0	0	0	0	110.4	D714 N718	D714-S716 WeakPolarHBondContact OD1-CB 3.32Å; D714-S716 PolarHBondContact OD1-N 3.25Å; D714-S716 PolarHBondContact OD1-OG 3.44Å; D714-S716 PolarHBondContact OD2-OG 3.18Å; D714-S716 VanDerWaalsContact OD2-OG 3.1Å; S716-N718 PolarHBondContact O-N 3.04Å
717	F	39.5	Very low	39.3	Very low	48 Å²	48	66 Å²	66	21%	0.211	35%	0.353	C	S	.	.			trans	-69.9	121.6	165.3	175.1	-114.9	0	0	0	108.3	L682 A683 T715 E719 D722	L682-F717 HydrophobicContact CB-CD1 4.23Å; L682-F717 HydrophobicContact CB-CE1 4.27Å; L682-F717 HydrophobicContact CD2-CD1 4.32Å; L682-F717 HydrophobicContact CG-CD1 3.89Å; L682-F717 HydrophobicContact CG-CE1 3.97Å; A683-F717 HydrophobicContact CB-CD2 3.6Å; A683-F717 HydrophobicContact CB-CE2 3.44Å; A683-F717 VanDerWaalsContact CB-CE2 3.44Å; A683-F717 HydrophobicContact CB-CG 4.35Å; A683-F717 HydrophobicContact CB-CZ 4.1Å; T715-F717 PolarHBondContact O-N 2.92Å; F717-E719 HydrophobicContact CD1-CG 4.01Å; F717-E719 HydrophobicContact CE1-CB 4.43Å; F717-E719 HydrophobicContact CE1-CG 3.8Å; F717-D722 WeakPolarHBondContact CZ-OD1 3.41Å
718	N	42.6	Very low	40.5	Very low	75 Å²	75	60 Å²	60	40%	0.401	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-98.4	103.8	174.8	-173.6	-13.3	0	0	0	109.5	S716 S720 V721 D722	S716-N718 PolarHBondContact O-N 3.04Å; N718-S720 PolarHBondContact O-N 3.06Å; N718-S720 PolarHBondContact OD1-N 3.19Å; N718-S720 VanDerWaalsContact OD1-N 3.1Å; N718-S720 PolarHBondContact OD1-OG 2.84Å; N718-V721 HydrophobicContact CB-CG2 4.25Å; N718-V721 PolarHBondContact O-N 3.45Å; N718-D722 PolarHBondContact O-N 3.04Å
719	E	40.3	Very low	41.3	Very low	144 Å²	144	57 Å²	57	67%	0.673	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-21.2	179.8	-63.3	-179.9	158.6	0	0	113.9	F717	F717-E719 HydrophobicContact CD1-CG 4.01Å; F717-E719 HydrophobicContact CE1-CB 4.43Å; F717-E719 HydrophobicContact CE1-CG 3.8Å
720	S	37.3	Very low	42.3	Very low	98 Å²	98	49.2 Å²	49.2	69%	0.685	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.8	177.3	66.6	0	0	0	0	115	N718	N718-S720 PolarHBondContact O-N 3.06Å; N718-S720 PolarHBondContact OD1-N 3.19Å; N718-S720 VanDerWaalsContact OD1-N 3.1Å; N718-S720 PolarHBondContact OD1-OG 2.84Å
721	V	41.4	Very low	43.5	Very low	45 Å²	45	46.8 Å²	46.8	27%	0.273	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.8	-4.8	-171.2	-143.5	0	0	0	0	115.4	Q625 N718 R723	Q625-V721 PolarHBondContact NE2-O 2.98Å; N718-V721 HydrophobicContact CB-CG2 4.25Å; N718-V721 PolarHBondContact O-N 3.45Å; V721-R723 HydrophobicContact CB-CB 4.48Å; V721-R723 HydrophobicContact CB-CG 4.26Å; V721-R723 HydrophobicContact CG1-CG 4.19Å; V721-R723 PolarHBondContact O-N 3.39Å
722	D	46	Very low	44.8	Very low	66 Å²	66	45.5 Å²	45.5	35%	0.353	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	40.8	-174.3	-74.5	-35.9	0	0	0	114.1	F717 N718	F717-D722 WeakPolarHBondContact CZ-OD1 3.41Å; N718-D722 PolarHBondContact O-N 3.04Å
723	R	43.9	Very low	46	Very low	91 Å²	91	43.9 Å²	43.9	34%	0.343	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.7	-179.2	-77.9	176.8	-179	150.6	9.8	112.3	Q625 V721 F725	Q625-R723 HydrophobicContact CB-CG 4.12Å; Q625-R723 HydrophobicContact CG-CG 4.08Å; Q625-R723 VanDerWaalsContact OE1-CZ 3.25Å; V721-R723 HydrophobicContact CB-CB 4.48Å; V721-R723 HydrophobicContact CB-CG 4.26Å; V721-R723 HydrophobicContact CG1-CG 4.19Å; V721-R723 PolarHBondContact O-N 3.39Å; R723-F725 HydrophobicContact CB-CE2 4Å; R723-F725 HydrophobicContact CB-CZ 4.13Å
724	S	44.1	Very low	47.4	Very low	14 Å²	14	43.5 Å²	43.5	10%	0.098	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.1	162.3	62	0	0	0	0	109.8	L624 L676	L624-S724 PolarHBondContact O-OG 2.83Å; L676-S724 WeakPolarHBondContact CD1-OG 3.26Å; L676-S724 WeakPolarHBondContact CD2-OG 2.95Å
725	F	45.9	Very low	49	Very low	48 Å²	48	48.5 Å²	48.5	21%	0.211	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146.4	172.3	-58.6	-85.9	0	0	0	110	A623 R723 F727	A623-F725 HydrophobicContact CB-CD1 3.98Å; A623-F725 HydrophobicContact CB-CE1 4.34Å; R723-F725 HydrophobicContact CB-CE2 4Å; R723-F725 HydrophobicContact CB-CZ 4.13Å; F725-F727 HydrophobicContact CB-CD2 4.18Å; F725-F727 HydrophobicContact CB-CE2 3.54Å; F725-F727 HydrophobicContact CB-CZ 3.99Å; F725-F727 HydrophobicContact CD1-CZ 4.28Å; F725-F727 HydrophobicContact CG-CE2 4.22Å; F725-F727 HydrophobicContact CG-CZ 4.3Å
726	L	47.5	Very low	50.7	Low	11 Å²	11	46.8 Å²	46.8	6%	0.058	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	98.9	172.8	-158.2	63.3	0	0	0	109	I622 I674 A687 L713 T715 F728	I622-L726 PolarHBondContact N-O 2.93Å; I622-L726 VanDerWaalsContact N-O 3.07Å; I622-L726 WeakPolarHBondContact O-CB 3.44Å; I622-L726 PolarHBondContact O-N 2.86Å; I622-L726 VanDerWaalsContact O-N 3.1Å; I674-L726 HydrophobicContact CD1-CD2 3.5Å; I674-L726 HydrophobicContact CG1-CD2 3.65Å; I674-L726 HydrophobicContact CG2-CD2 4.36Å; A687-L726 HydrophobicContact CB-CD1 4.41Å; L713-L726 HydrophobicContact CD2-CD1 3.72Å; L713-L726 HydrophobicContact CG-CD1 4.13Å; T715-L726 HydrophobicContact CG2-CD1 3.92Å; L726-F728 HydrophobicContact CD2-CE1 4.21Å; L726-F728 HydrophobicContact CD2-CE2 3.85Å; L726-F728 HydrophobicContact CD2-CZ 3.38Å; L726-F728 HydrophobicContact CG-CE1 4.06Å; L726-F728 HydrophobicContact CG-CE2 3.95Å; L726-F728 HydrophobicContact CG-CZ 3.58Å
727	F	47.3	Very low	52.5	Low	25 Å²	25	46.3 Å²	46.3	11%	0.11	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.3	179.7	-61.3	-78.2	0	0	0	110	V619 E621 L713 F725	V619-F727 HydrophobicContact CG1-CB 4.09Å; V619-F727 HydrophobicContact CG1-CD1 3.84Å; V619-F727 HydrophobicContact CG1-CG 4.45Å; E621-F727 HydrophobicContact CB-CD1 3.92Å; E621-F727 HydrophobicContact CB-CE1 3.86Å; E621-F727 HydrophobicContact CG-CD1 4.2Å; E621-F727 HydrophobicContact CG-CE1 3.74Å; E621-F727 HydrophobicContact CG-CZ 4.47Å; L713-F727 WeakPolarHBondContact CD1-O 3.26Å; F725-F727 HydrophobicContact CB-CD2 4.18Å; F725-F727 HydrophobicContact CB-CE2 3.54Å; F725-F727 HydrophobicContact CB-CZ 3.99Å; F725-F727 HydrophobicContact CD1-CZ 4.28Å; F725-F727 HydrophobicContact CG-CE2 4.22Å; F725-F727 HydrophobicContact CG-CZ 4.3Å
728	F	53.3	Low	54.4	Low	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.3	172	-60	-62.7	0	0	0	110.5	V619 L620 I622 L672 F698 L713 L726	V619-F728 WeakPolarHBondContact CA-O 3.33Å; L620-F728 PolarHBondContact N-O 3.06Å; L620-F728 PolarHBondContact O-N 3.4Å; I622-F728 HydrophobicContact CD1-CD2 4.38Å; I622-F728 HydrophobicContact CD1-CE2 4.27Å; L672-F728 HydrophobicContact CD1-CE1 4.43Å; L672-F728 HydrophobicContact CD1-CZ 4.3Å; L672-F728 HydrophobicContact CD2-CE1 3.89Å; L672-F728 HydrophobicContact CD2-CZ 4.24Å; F698-F728 HydrophobicContact CE2-CB 4.23Å; F698-F728 AromaticContact CE2-CD1 3.59Å; F698-F728 HydrophobicContact CE2-CD1 3.59Å; F698-F728 HydrophobicContact CE2-CE1 4.11Å; F698-F728 HydrophobicContact CE2-CG 4.04Å; F698-F728 HydrophobicContact CZ-CB 4.26Å; F698-F728 HydrophobicContact CZ-CD1 4.2Å; F698-F728 HydrophobicContact CZ-CG 4.2Å; L713-F728 HydrophobicContact CD2-CE1 4.41Å; L726-F728 HydrophobicContact CD2-CE1 4.21Å; L726-F728 HydrophobicContact CD2-CE2 3.85Å; L726-F728 HydrophobicContact CD2-CZ 3.38Å; L726-F728 HydrophobicContact CG-CE1 4.06Å; L726-F728 HydrophobicContact CG-CE2 3.95Å; L726-F728 HydrophobicContact CG-CZ 3.58Å
729	P	47.6	Very low	56.1	Low	17 Å²	17	40.5 Å²	40.5	11%	0.11	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	146.8	159.2	30	-36	0	0	0	108.4	P710 P731	P710-P729 HydrophobicContact CB-CG 3.96Å; P729-P731 VanDerWaalsContact O-CD 3.3Å; P729-P731 WeakPolarHBondContact O-CD 3.41Å; P729-P731 VanDerWaalsContact O-N 3.08Å
730	Y	55.8	Low	57.9	Low	7 Å²	7	33.6 Å²	33.6	3%	0.027	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-51.8	121.1	-176.8	-163.7	-105.7	0	0	0	111.2	L610 N611 M614 D615 S618	L610-Y730 HydrophobicContact CB-CE1 4.39Å; L610-Y730 WeakPolarHBondContact CB-OH 3.45Å; L610-Y730 HydrophobicContact CD2-CE2 4.16Å; N611-Y730 PolarHBondContact N-OH 3.33Å; N611-Y730 VanDerWaalsContact N-OH 3.09Å; N611-Y730 VanDerWaalsContact O-CE1 3.28Å; N611-Y730 WeakPolarHBondContact O-CE1 3.24Å; N611-Y730 PolarHBondContact O-OH 3.28Å; M614-Y730 HydrophobicContact CB-CE1 4.23Å; M614-Y730 HydrophobicContact CB-CE2 3.88Å; D615-Y730 HydrophobicContact CB-CD1 3.92Å; D615-Y730 HydrophobicContact CB-CE1 4.25Å; S618-Y730 WeakPolarHBondContact O-CB 3.38Å; S618-Y730 PolarHBondContact O-N 2.72Å; S618-Y730 WeakPolarHBondContact OG-CD2 3.23Å
731	P	60.2	Low	59.7	Low	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-62.1	158.1	179.2	-24.2	33.7	0	0	0	111.7	L610 L620 F653 F698 P729 W736	L610-P731 HydrophobicContact CD1-CB 3.62Å; L610-P731 HydrophobicContact CD1-CG 3.63Å; L620-P731 HydrophobicContact CD2-CG 3.78Å; F653-P731 HydrophobicContact CE1-CG 3.93Å; F698-P731 HydrophobicContact CE1-CB 3.88Å; F698-P731 HydrophobicContact CE1-CG 3.98Å; F698-P731 HydrophobicContact CZ-CG 4.27Å; P729-P731 VanDerWaalsContact O-CD 3.3Å; P729-P731 WeakPolarHBondContact O-CD 3.41Å; P729-P731 VanDerWaalsContact O-N 3.08Å; P731-W736 HydrophobicContact CB-CD2 4.43Å; P731-W736 HydrophobicContact CB-CH2 4.36Å; P731-W736 HydrophobicContact CB-CZ2 3.65Å
732	T	61.5	Low	61.2	Low	29 Å²	29	27.6 Å²	27.6	18%	0.178	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-56.6	130.1	171.6	36.3	0	0	0	0	110.7	R655 S701 W736	R655-T732 PolarHBondContact NH2-O 3.01Å; R655-T732 PolarHBondContact NH2-OG1 3.3Å; R655-T732 VanDerWaalsContact NH2-OG1 3.15Å; S701-T732 VanDerWaalsContact O-CG2 3.22Å; S701-T732 WeakPolarHBondContact O-CG2 3.37Å; T732-W736 PolarHBondContact O-NE1 2.9Å
733	P	61.9	Low	62.2	Low	44 Å²	44	25.9 Å²	25.9	29%	0.286	12%	0.123	S	C	.	.	S	Bend	trans	-61	158.7	-173.2	23.7	-34.3	0	0	0	112.6	L610 R655	L610-P733 WeakPolarHBondContact O-CA 3.37Å; L610-P733 VanDerWaalsContact O-CB 3.28Å; L610-P733 WeakPolarHBondContact O-CB 3.11Å; R655-P733 PolarHBondContact NH2-O 3.31Å
734	G	66.8	Low	63.2	Low	25 Å²	25	22.4 Å²	22.4	26%	0.258	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	119.3	-167.3	-168.5	0	0	0	0	0	112.7	L610	L610-G734 PolarHBondContact N-O 3.47Å; L610-G734 PolarHBondContact O-N 2.84Å
735	R	69	Low	63.8	Low	129 Å²	129	26 Å²	26	49%	0.487	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.5	-177.1	-169.4	175.3	-69.1	177.4	-0.5	111.7	T609 Y737	T609-R735 HydrophobicContact CG2-CB 4.07Å; T609-R735 HydrophobicContact CG2-CG 4.2Å; R735-Y737 WeakPolarHBondContact CD-OH 3.26Å; R735-Y737 HydrophobicContact CG-CE1 4.47Å
736	W	75.6	Confident	64.2	Low	5 Å²	5	26 Å²	26	2%	0.019	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	167.2	170.4	-68.5	75.4	0	0	0	109.2	I608 L610 F653 A654 R655 L672 F698 P731 T732	I608-W736 PolarHBondContact N-O 3.18Å; I608-W736 PolarHBondContact O-N 2.86Å; L610-W736 HydrophobicContact CD1-CG 4.38Å; F653-W736 AromaticContact CD1-CE3 3.85Å; F653-W736 HydrophobicContact CD1-CE3 3.85Å; F653-W736 HydrophobicContact CD1-CZ3 4.27Å; F653-W736 HydrophobicContact CD2-CB 4.41Å; F653-W736 HydrophobicContact CE1-CB 4.32Å; F653-W736 AromaticContact CE1-CD2 3.86Å; F653-W736 HydrophobicContact CE1-CD2 3.86Å; F653-W736 AromaticContact CE1-CE3 3.58Å; F653-W736 HydrophobicContact CE1-CE3 3.58Å; F653-W736 HydrophobicContact CE1-CG 4.19Å; F653-W736 HydrophobicContact CE1-CZ3 4.2Å; F653-W736 HydrophobicContact CE2-CB 3.53Å; F653-W736 HydrophobicContact CE2-CG 4.26Å; F653-W736 HydrophobicContact CG-CE3 4.42Å; F653-W736 HydrophobicContact CZ-CB 3.48Å; F653-W736 VanDerWaalsContact CZ-CB 3.48Å; F653-W736 AromaticContact CZ-CD2 3.89Å; F653-W736 HydrophobicContact CZ-CD2 3.89Å; F653-W736 AromaticContact CZ-CE3 3.95Å; F653-W736 HydrophobicContact CZ-CE3 3.95Å; F653-W736 AromaticContact CZ-CG 3.7Å; F653-W736 HydrophobicContact CZ-CG 3.7Å; A654-W736 CarbonylContact O-C 3.43Å; A654-W736 WeakPolarHBondContact O-CA 3.27Å; R655-W736 HydrophobicContact CG-CD2 3.8Å; R655-W736 HydrophobicContact CG-CE3 3.97Å; R655-W736 HydrophobicContact CG-CG 4.38Å; R655-W736 HydrophobicContact CG-CH2 4.08Å; R655-W736 HydrophobicContact CG-CZ2 3.91Å; R655-W736 HydrophobicContact CG-CZ3 4.12Å; L672-W736 HydrophobicContact CD1-CZ3 4.5Å; F698-W736 HydrophobicContact CD1-CH2 4.48Å; F698-W736 AromaticContact CE1-CH2 3.88Å; F698-W736 HydrophobicContact CE1-CH2 3.88Å; F698-W736 HydrophobicContact CE1-CZ2 4.4Å; F698-W736 HydrophobicContact CE1-CZ3 4.43Å; P731-W736 HydrophobicContact CB-CD2 4.43Å; P731-W736 HydrophobicContact CB-CH2 4.36Å; P731-W736 HydrophobicContact CB-CZ2 3.65Å; T732-W736 PolarHBondContact O-NE1 2.9Å
737	Y	75.3	Confident	64.1	Low	52 Å²	52	27.8 Å²	27.8	20%	0.204	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.3	177.3	-59.3	-79.9	0	0	0	109.3	V605 I606 P607 F653 A654 L657 R735	V605-Y737 HydrophobicContact CG1-CD1 4.09Å; V605-Y737 HydrophobicContact CG1-CG 4.36Å; I606-Y737 WeakPolarHBondContact O-CA 3.41Å; P607-Y737 HydrophobicContact CB-CD1 4.11Å; P607-Y737 HydrophobicContact CB-CE1 4.03Å; F653-Y737 WeakPolarHBondContact CA-O 3.09Å; A654-Y737 PolarHBondContact N-O 2.88Å; A654-Y737 PolarHBondContact O-N 2.82Å; L657-Y737 HydrophobicContact CD1-CD1 3.73Å; L657-Y737 HydrophobicContact CD1-CE1 3.84Å; L657-Y737 HydrophobicContact CD1-CG 4.15Å; R735-Y737 WeakPolarHBondContact CD-OH 3.26Å; R735-Y737 HydrophobicContact CG-CE1 4.47Å
738	L	79.3	Confident	63.7	Low	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	103.1	167	176.1	62.2	0	0	0	108.5	I606 I608 I622 C652 F653 L740 L764	I606-L738 HydrophobicContact CB-CB 4.4Å; I606-L738 PolarHBondContact N-O 2.81Å; I606-L738 PolarHBondContact O-N 3.43Å; I608-L738 HydrophobicContact CD1-CB 3.62Å; I608-L738 HydrophobicContact CD1-CD2 4.3Å; I622-L738 HydrophobicContact CG2-CD2 4.45Å; C652-L738 CarbonylContact O-C 3.54Å; C652-L738 WeakPolarHBondContact O-CA 3.3Å; F653-L738 HydrophobicContact CD2-CB 4.13Å; L738-L740 HydrophobicContact CD1-CD2 4.24Å; L738-L740 HydrophobicContact CG-CD2 4.34Å; L738-L740 HydrophobicContact CG-CG 4.44Å; L738-L764 HydrophobicContact CD2-CD1 3.76Å; L738-L764 HydrophobicContact CD2-CD2 3.86Å
739	S	78.4	Confident	62.9	Low	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	138.4	174.3	-44.8	0	0	0	0	109.8	V604 G651 C652 T658 F664	V604-S739 CarbonylContact O-C 3.44Å; V604-S739 VanDerWaalsContact O-CA 3.3Å; V604-S739 WeakPolarHBondContact O-CA 3.21Å; G651-S739 CarbonylContact C-O 3.55Å; G651-S739 WeakPolarHBondContact CA-O 3.3Å; C652-S739 PolarHBondContact N-O 2.98Å; C652-S739 PolarHBondContact O-N 3.01Å; T658-S739 WeakPolarHBondContact CB-OG 3.32Å; T658-S739 PolarHBondContact O-OG 3.02Å; T658-S739 WeakPolarHBondContact OG1-CB 3.43Å; T658-S739 PolarHBondContact OG1-OG 3.37Å; F664-S739 WeakPolarHBondContact CE1-O 3.4Å; F664-S739 VanDerWaalsContact CZ-CB 3.47Å
740	L	78.5	Confident	62.2	Low	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139.9	178.4	-62.3	177	0	0	0	110	L596 L598 I603 V604 I606 L624 L649 H650 L738	L596-L740 HydrophobicContact CD1-CD1 3.66Å; L598-L740 HydrophobicContact CD1-CB 4.18Å; L598-L740 HydrophobicContact CD1-CD1 4.41Å; I603-L740 WeakPolarHBondContact CA-O 3.29Å; V604-L740 PolarHBondContact N-O 3.1Å; V604-L740 PolarHBondContact O-N 2.77Å; I606-L740 HydrophobicContact CD1-CD1 4.31Å; L624-L740 HydrophobicContact CD1-CD2 4.11Å; L624-L740 HydrophobicContact CD2-CD1 4.44Å; L624-L740 HydrophobicContact CD2-CD2 4.13Å; L649-L740 HydrophobicContact CD1-CB 4.48Å; H650-L740 CarbonylContact O-C 3.56Å; H650-L740 WeakPolarHBondContact O-CA 3.4Å; L738-L740 HydrophobicContact CD1-CD2 4.24Å; L738-L740 HydrophobicContact CG-CD2 4.34Å; L738-L740 HydrophobicContact CG-CG 4.44Å
741	Y	75.4	Confident	61.2	Low	17 Å²	17	54.2 Å²	54.2	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	106.8	-175.3	166.2	-113.7	0	0	0	109.9	W601 I603 H650 P661 E743	W601-Y741 HydrophobicContact CE3-CE2 4.45Å; I603-Y741 HydrophobicContact CD1-CD2 4.47Å; I603-Y741 HydrophobicContact CG1-CD2 3.67Å; I603-Y741 HydrophobicContact CG1-CE2 4.49Å; I603-Y741 HydrophobicContact CG1-CG 4.16Å; H650-Y741 HydrophobicContact CB-CD1 4.01Å; H650-Y741 WeakPolarHBondContact CB-O 3.45Å; H650-Y741 PolarHBondContact N-O 2.88Å; H650-Y741 PolarHBondContact O-N 3.34Å; P661-Y741 HydrophobicContact CB-CE1 4.08Å; P661-Y741 HydrophobicContact CB-CE2 4.4Å; P661-Y741 HydrophobicContact CG-CE2 4.07Å; Y741-E743 HydrophobicContact CD1-CG 4.23Å; Y741-E743 HydrophobicContact CE1-CG 3.44Å; Y741-E743 VanDerWaalsContact CE1-CG 3.44Å; Y741-E743 VanDerWaalsContact CE1-OE1 3.24Å; Y741-E743 WeakPolarHBondContact CE1-OE1 3.38Å; Y741-E743 PolarHBondContact OH-OE1 3.07Å
742	P	72.7	Confident	60	Low	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122	178.6	33.2	-27.4	0	0	0	112.1	L598 W601 H602 I648 L649 I760	L598-P742 HydrophobicContact CB-CG 3.94Å; L598-P742 HydrophobicContact CD1-CG 4.19Å; W601-P742 PolarHBondContact N-O 3.45Å; H602-P742 VanDerWaalsContact O-CD 3.28Å; H602-P742 WeakPolarHBondContact O-CD 3.41Å; I648-P742 WeakPolarHBondContact O-CA 3.2Å; L649-P742 HydrophobicContact CD1-CB 4.04Å; P742-I760 HydrophobicContact CB-CD1 3.84Å; P742-I760 HydrophobicContact CG-CD1 4.18Å
743	E	66.2	Low	58.6	Low	29 Å²	29	60.5 Å²	60.5	14%	0.136	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	146.4	165.3	-51.6	-168.8	132.2	0	0	108.9	W601 I648 H650 R675 Y741 Y745	W601-E743 HydrophobicContact CE3-CB 4.22Å; W601-E743 HydrophobicContact CE3-CG 4.07Å; W601-E743 HydrophobicContact CH2-CB 3.74Å; W601-E743 HydrophobicContact CH2-CG 4.23Å; W601-E743 HydrophobicContact CZ2-CB 4.46Å; W601-E743 HydrophobicContact CZ3-CB 3.6Å; W601-E743 HydrophobicContact CZ3-CG 3.58Å; I648-E743 HydrophobicContact CB-CB 4.31Å; I648-E743 PolarHBondContact N-O 3.43Å; I648-E743 PolarHBondContact O-N 2.81Å; H650-E743 IonicContact CD2-OE2 3.77Å; H650-E743 IonicContact NE2-OE2 3.81Å; H650-E743 PolarHBondContact NE2-OE2 3.35Å; R675-E743 IonicContact NH2-OE2 3.3Å; Y741-E743 HydrophobicContact CD1-CG 4.23Å; Y741-E743 HydrophobicContact CE1-CG 3.44Å; Y741-E743 VanDerWaalsContact CE1-CG 3.44Å; Y741-E743 VanDerWaalsContact CE1-OE1 3.24Å; Y741-E743 WeakPolarHBondContact CE1-OE1 3.38Å; Y741-E743 PolarHBondContact OH-OE1 3.07Å; E743-Y745 HydrophobicContact CB-CE2 3.76Å; E743-Y745 PolarHBondContact OE2-OH 3.1Å
744	C	64	Low	57.7	Low	18 Å²	18	66.1 Å²	66.1	12%	0.122	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	123.1	-178.5	-172.2	0	0	0	0	110.9	P600 W601 Q646 I760	P600-C744 HydrophobicContact CB-CB 4.1Å; P600-C744 HydrophobicContact CG-CB 4.49Å; W601-C744 WeakPolarHBondContact CZ2-O 3.29Å; Q646-C744 WeakPolarHBondContact O-CA 3.34Å; C744-I760 HydrophobicContact CB-CD1 4.36Å
745	Y	57.6	Low	56.6	Low	90 Å²	90	70.2 Å²	70.2	35%	0.353	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.1	-177.7	-53.3	-92.6	0	0	0	110	W601 R645 Q646 I648 E743	W601-Y745 HydrophobicContact CH2-CE1 4.04Å; W601-Y745 HydrophobicContact CH2-CE2 4.42Å; W601-Y745 AromaticContact CH2-CZ 3.88Å; R645-Y745 CarbonylContact C-O 3.58Å; R645-Y745 WeakPolarHBondContact CA-O 3.45Å; Q646-Y745 PolarHBondContact N-O 3.43Å; Q646-Y745 PolarHBondContact O-N 2.66Å; I648-Y745 HydrophobicContact CD1-CD2 4.29Å; I648-Y745 HydrophobicContact CD1-CE2 3.85Å; I648-Y745 HydrophobicContact CG1-CD2 4.43Å; I648-Y745 HydrophobicContact CG1-CE2 4.22Å; E743-Y745 HydrophobicContact CB-CE2 3.76Å; E743-Y745 PolarHBondContact OE2-OH 3.1Å
746	T	54	Low	55.3	Low	49 Å²	49	71 Å²	71	30%	0.301	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	143.5	173.3	47.7	0	0	0	0	110.4	Y748 A750	T746-Y748 WeakPolarHBondContact CB-O 3.49Å; T746-Y748 PolarHBondContact O-N 3.18Å; T746-Y748 PolarHBondContact OG1-O 3Å; T746-A750 PolarHBondContact OG1-O 3.07Å
747	A	46.4	Very low	53.7	Low	48 Å²	48	74.5 Å²	74.5	40%	0.397	40%	0.402	S	S	.	.	S	Bend	trans	-71.3	-6.5	179.1	0	0	0	0	0	114.6	P644	P644-A747 HydrophobicContact CB-CB 4.23Å; P644-A747 HydrophobicContact CG-CB 4.07Å; P644-A747 WeakPolarHBondContact O-CB 3.4Å; P644-A747 PolarHBondContact O-N 2.98Å; P644-A747 VanDerWaalsContact O-N 3.17Å
748	Y	38.2	Very low	52.6	Low	185 Å²	185	73 Å²	73	73%	0.725	40%	0.4	S	S	*	.	S	Bend	trans	-143.8	165.6	177.5	-70	-79.3	0	0	0	110.1	T746 A750	T746-Y748 WeakPolarHBondContact CB-O 3.49Å; T746-Y748 PolarHBondContact O-N 3.18Å; T746-Y748 PolarHBondContact OG1-O 3Å; Y748-A750 PolarHBondContact O-N 3.14Å
749	D	36.2	Very low	51.6	Low	166 Å²	166	76.2 Å²	76.2	89%	0.888	42%	0.42	S	S	*	.	S	Bend	trans	-67.4	30	-171.6	-57.5	-61.6	0	0	0	116.4	F751	D749-F751 PolarHBondContact O-N 3.5Å
750	A	33.4	Very low	50.9	Low	48 Å²	48	76.6 Å²	76.6	40%	0.397	42%	0.422	S	S	.	.			trans	-68.1	120.9	167.2	0	0	0	0	0	109.7	T746 Y748 C752	T746-A750 PolarHBondContact OG1-O 3.07Å; Y748-A750 PolarHBondContact O-N 3.14Å; A750-C752 PolarHBondContact O-N 3.1Å
751	F	34.2	Very low	50.1	Low	205 Å²	205	78.8 Å²	78.8	90%	0.899	43%	0.434	S	S	*	.			trans	-47.6	137.6	170.2	-84.3	-109.3	0	0	0	110.9	D749 G753	D749-F751 PolarHBondContact O-N 3.5Å; F751-G753 PolarHBondContact O-N 3.18Å
752	C	34.6	Very low	49.6	Very low	102 Å²	102	78 Å²	78	69%	0.689	43%	0.431	S	S	*	.			trans	-65.9	80.2	165.9	-70.8	0	0	0	0	110.4	A750	A750-C752 PolarHBondContact O-N 3.1Å
753	G	33.9	Very low	49	Very low	58 Å²	58	79 Å²	79	60%	0.598	44%	0.437	S	S	*	.			trans	-57.4	152.7	167	0	0	0	0	0	110.7	F751 D755	F751-G753 PolarHBondContact O-N 3.18Å; G753-D755 PolarHBondContact O-N 3.41Å
754	L	42.8	Very low	49	Very low	162 Å²	162	77.8 Å²	77.8	85%	0.848	43%	0.432	S	S	*	.			trans	-74.7	43.7	-175.2	-73.4	160.7	0	0	0	113	Q756	L754-Q756 VanDerWaalsContact C-N 3.33Å; L754-Q756 PolarHBondContact O-N 3.11Å
755	D	43.7	Very low	48.7	Very low	111 Å²	111	77.9 Å²	77.9	59%	0.594	43%	0.431	S	S	*	.			trans	-81.2	81.5	-177.3	-150.5	-21.2	0	0	0	110.4	G753 S757 A758	G753-D755 PolarHBondContact O-N 3.41Å; D755-S757 VanDerWaalsContact CG-OG 3.29Å; D755-S757 PolarHBondContact O-N 3.42Å; D755-S757 WeakPolarHBondContact OD1-CB 3.45Å; D755-S757 PolarHBondContact OD1-OG 2.63Å; D755-A758 PolarHBondContact O-N 3.45Å
756	Q	41.4	Very low	48.8	Very low	145 Å²	145	74.7 Å²	74.7	68%	0.678	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	4.2	-176.2	-58.7	-179.2	11.7	0	0	114.1	K599 L754	K599-Q756 PolarHBondContact NZ-O 3.06Å; L754-Q756 VanDerWaalsContact C-N 3.33Å; L754-Q756 PolarHBondContact O-N 3.11Å
757	S	41	Very low	48.8	Very low	79 Å²	79	74.8 Å²	74.8	55%	0.552	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.7	179.8	66.8	0	0	0	0	114	D755 V759	D755-S757 VanDerWaalsContact CG-OG 3.29Å; D755-S757 PolarHBondContact O-N 3.42Å; D755-S757 WeakPolarHBondContact OD1-CB 3.45Å; D755-S757 PolarHBondContact OD1-OG 2.63Å; S757-V759 PolarHBondContact O-N 2.92Å
758	A	53.5	Low	49.2	Very low	20 Å²	20	74.5 Å²	74.5	17%	0.165	41%	0.41	C	S	.	.			trans	-73.4	64.7	-171.4	0	0	0	0	0	114	P600 D755	P600-A758 WeakPolarHBondContact CD-O 3.43Å; P600-A758 HydrophobicContact CG-CB 4.38Å; P600-A758 VanDerWaalsContact CG-O 3.29Å; P600-A758 WeakPolarHBondContact CG-O 3.33Å; D755-A758 PolarHBondContact O-N 3.45Å
759	V	57.2	Low	49.8	Very low	68 Å²	68	67.7 Å²	67.7	41%	0.412	39%	0.387	S	S	.	.			trans	-62.7	140.4	175	176.9	0	0	0	0	111	H597 S757	H597-V759 HydrophobicContact CB-CG1 3.49Å; H597-V759 VanDerWaalsContact CB-CG1 3.49Å; S757-V759 PolarHBondContact O-N 2.92Å
760	I	64.2	Low	50.1	Low	9 Å²	9	64.3 Å²	64.3	5%	0.046	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.6	177.3	-60.9	170.7	0	0	0	108.3	L596 L598 P600 L626 I647 P742 C744 V762	L596-I760 VanDerWaalsContact O-O 3.1Å; L598-I760 PolarHBondContact N-O 3.15Å; L598-I760 PolarHBondContact O-N 3.35Å; P600-I760 HydrophobicContact CB-CD1 4.4Å; P600-I760 HydrophobicContact CG-CD1 3.99Å; P600-I760 HydrophobicContact CG-CG1 4.45Å; L626-I760 HydrophobicContact CD2-CG2 3.87Å; I647-I760 HydrophobicContact CD1-CD1 4.37Å; I647-I760 HydrophobicContact CD1-CG1 4.21Å; I647-I760 HydrophobicContact CD1-CG2 4.28Å; I647-I760 HydrophobicContact CG1-CD1 4.43Å; I647-I760 HydrophobicContact CG2-CD1 4.08Å; I647-I760 HydrophobicContact CG2-CG2 4.05Å; P742-I760 HydrophobicContact CB-CD1 3.84Å; P742-I760 HydrophobicContact CG-CD1 4.18Å; C744-I760 HydrophobicContact CB-CD1 4.36Å; I760-V762 HydrophobicContact CG2-CG2 4.19Å; I760-V762 PolarHBondContact O-N 3Å
761	D	61.4	Low	50.6	Low	46 Å²	46	62.9 Å²	62.9	25%	0.246	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	107.5	-174.8	-77.5	12.5	0	0	0	111.6	L595 H597 N627	L595-D761 HydrophobicContact CD1-CB 4.15Å; L595-D761 HydrophobicContact CG-CB 4.49Å; H597-D761 IonicContact CE1-OD1 2.74Å; H597-D761 PolarHBondContact CE1-OD1 3.19Å; H597-D761 IonicContact CE1-OD2 3.86Å; H597-D761 IonicContact CG-OD1 3.24Å; H597-D761 IonicContact ND1-OD1 3.35Å; H597-D761 PolarHBondContact ND1-OD1 2.93Å; H597-D761 IonicContact ND1-OD2 3.59Å; N627-D761 HydrophobicContact CB-CB 4.22Å; N627-D761 PolarHBondContact N-O 3.48Å; N627-D761 VanDerWaalsContact N-O 3.07Å
762	V	65.4	Low	50.7	Low	0 Å²	0	59.1 Å²	59.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.3	178.9	-179.2	0	0	0	0	110	L596 L598 L624 L626 L649 I760 L764	L596-V762 HydrophobicContact CB-CB 4.4Å; L596-V762 WeakPolarHBondContact CB-O 3.44Å; L596-V762 PolarHBondContact N-O 3.31Å; L596-V762 PolarHBondContact O-N 2.69Å; L598-V762 HydrophobicContact CD1-CB 4.24Å; L598-V762 HydrophobicContact CD1-CG2 3.72Å; L598-V762 HydrophobicContact CG-CG2 4.23Å; L624-V762 HydrophobicContact CD2-CG1 3.81Å; L626-V762 HydrophobicContact CD2-CG2 3.94Å; L649-V762 HydrophobicContact CD1-CG2 4.37Å; L649-V762 HydrophobicContact CD2-CB 4.47Å; L649-V762 HydrophobicContact CD2-CG1 3.69Å; L649-V762 HydrophobicContact CD2-CG2 3.86Å; I760-V762 HydrophobicContact CG2-CG2 4.19Å; I760-V762 PolarHBondContact O-N 3Å; V762-L764 PolarHBondContact O-N 3.03Å
763	S	60	Low	50.8	Low	20 Å²	20	58 Å²	58	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	111.1	169.9	177	0	0	0	0	109.6	S594 Q625	S594-S763 WeakPolarHBondContact O-CA 3.37Å; Q625-S763 PolarHBondContact N-O 3.24Å; Q625-S763 PolarHBondContact O-N 3.45Å
764	L	66	Low	50.9	Low	4 Å²	4	58.4 Å²	58.4	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.1	174.5	171.7	61.5	0	0	0	109.5	A593 S594 L596 I606 I622 L624 L738 V762 I766	A593-L764 WeakPolarHBondContact CA-O 3.24Å; S594-L764 PolarHBondContact N-O 3.04Å; S594-L764 PolarHBondContact O-N 2.88Å; L596-L764 HydrophobicContact CD1-CB 3.85Å; L596-L764 HydrophobicContact CD1-CD2 3.85Å; L596-L764 HydrophobicContact CG-CB 4.48Å; I606-L764 HydrophobicContact CD1-CD2 3.6Å; I622-L764 HydrophobicContact CG2-CD1 4.14Å; L624-L764 HydrophobicContact CD2-CB 4.37Å; L624-L764 HydrophobicContact CD2-CD1 3.79Å; L624-L764 HydrophobicContact CG-CD1 4.44Å; L738-L764 HydrophobicContact CD2-CD1 3.76Å; L738-L764 HydrophobicContact CD2-CD2 3.86Å; V762-L764 PolarHBondContact O-N 3.03Å; L764-I766 HydrophobicContact CD1-CD1 4.22Å; L764-I766 HydrophobicContact CD1-CG1 3.88Å; L764-I766 HydrophobicContact CD2-CD1 4.16Å; L764-I766 HydrophobicContact CG-CD1 4.3Å; L764-I766 HydrophobicContact CG-CG1 4.14Å
765	I	58.7	Low	50.8	Low	20 Å²	20	55.3 Å²	55.3	10%	0.103	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.7	174.8	-65.8	173.5	0	0	0	108.3	Y592 A593 A623 R767	Y592-I765 WeakPolarHBondContact O-CA 3.41Å; A593-I765 HydrophobicContact CB-CG1 3.91Å; A623-I765 HydrophobicContact CB-CB 4.23Å; A623-I765 PolarHBondContact N-O 2.84Å; A623-I765 PolarHBondContact O-N 3.39Å; I765-R767 HydrophobicContact CG2-CG 4.06Å; I765-R767 VanDerWaalsContact CG2-NE 3.34Å
766	I	58.6	Low	50.8	Low	23 Å²	23	51.8 Å²	51.8	12%	0.118	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.5	175.1	-58.6	177.4	0	0	0	108.6	Y592 I608 L620 L764	Y592-I766 PolarHBondContact N-O 3.1Å; Y592-I766 PolarHBondContact O-N 3.18Å; I608-I766 HydrophobicContact CD1-CD1 3.68Å; I608-I766 HydrophobicContact CG1-CD1 4.33Å; L620-I766 HydrophobicContact CD1-CG2 4.01Å; L764-I766 HydrophobicContact CD1-CD1 4.22Å; L764-I766 HydrophobicContact CD1-CG1 3.88Å; L764-I766 HydrophobicContact CD2-CD1 4.16Å; L764-I766 HydrophobicContact CG-CD1 4.3Å; L764-I766 HydrophobicContact CG-CG1 4.14Å
767	R	53.9	Low	50.8	Low	52 Å²	52	48.7 Å²	48.7	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	129.5	-177.1	-70.6	163.1	179.2	172.7	1.5	110.4	R591 E621 I765	R591-R767 HydrophobicContact CB-CG 4.25Å; R591-R767 HydrophobicContact CG-CG 3.99Å; E621-R767 HydrophobicContact CB-CB 4.13Å; E621-R767 VanDerWaalsContact CD-CD 3.48Å; E621-R767 PolarHBondContact N-O 2.93Å; E621-R767 PolarHBondContact O-N 3.28Å; E621-R767 WeakPolarHBondContact OE1-CD 3.49Å; E621-R767 IonicContact OE1-CZ 2.71Å; E621-R767 IonicContact OE1-NH1 2.83Å; E621-R767 PolarHBondContact OE1-NH1 3.4Å; E621-R767 WeakPolarHBondContact OE2-CD 3.36Å; E621-R767 IonicContact OE2-NH1 3.13Å; I765-R767 HydrophobicContact CG2-CG 4.06Å; I765-R767 VanDerWaalsContact CG2-NE 3.34Å
768	S	54.3	Low	50.7	Low	42 Å²	42	51.3 Å²	51.3	29%	0.294	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.1	157	43.9	0	0	0	0	108.7	M614 V619	M614-S768 PolarHBondContact SD-OG 3.36Å; V619-S768 WeakPolarHBondContact O-CA 3.33Å
769	T	51.6	Low	49.7	Very low	41 Å²	41	59.3 Å²	59.3	25%	0.252	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.2	169.9	50.6	0	0	0	0	109.2	S618 V619 C771 C776	S618-T769 CarbonylContact C-O 3.57Å; S618-T769 WeakPolarHBondContact CA-O 3.34Å; S618-T769 VanDerWaalsContact CB-O 3.25Å; S618-T769 WeakPolarHBondContact CB-O 3.37Å; V619-T769 PolarHBondContact N-O 3Å; V619-T769 PolarHBondContact O-N 3.22Å; T769-C771 PolarHBondContact O-N 3.4Å; T769-C776 PolarHBondContact OG1-O 3.15Å
770	P	43.2	Very low	48.3	Very low	96 Å²	96	59.6 Å²	59.6	62%	0.623	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	121.4	171.5	27.6	-32.4	0	0	0	108.7	I772	P770-I772 PolarHBondContact O-N 3.24Å
771	C	42.9	Very low	46.7	Very low	17 Å²	17	64.8 Å²	64.8	12%	0.115	36%	0.355	C	S	.	.			trans	-78.8	105.8	-179.1	-51.4	0	0	0	0	109.6	S617 T769 N773 C776	S617-C771 WeakPolarHBondContact O-CA 3.32Å; S617-C771 WeakPolarHBondContact O-CB 3.31Å; S617-C771 PolarHBondContact O-N 3.48Å; S617-C771 PolarHBondContact O-SG 2.85Å; T769-C771 PolarHBondContact O-N 3.4Å; C771-N773 PolarHBondContact O-N 2.97Å; C771-C776 HydrophobicContact CB-CB 4.02Å; C771-C776 WeakPolarHBondContact CB-SG 3.28Å; C771-C776 VanDerWaalsContact SG-CA 3.6Å; C771-C776 WeakPolarHBondContact SG-CB 3.41Å; C771-C776 CovalentContact SG-SG 2.03Å; C771-C776 PolarHBondContact SG-SG 3.21Å
772	I	37.3	Very low	45.1	Very low	127 Å²	127	65.7 Å²	65.7	65%	0.651	37%	0.374	S	S	*	.	B	Isolated β-bridge	trans	-77.2	122.9	174.3	-59.5	175.4	0	0	0	107.4	P770 N774 H775	P770-I772 PolarHBondContact O-N 3.24Å; I772-N774 VanDerWaalsContact C-N 3.31Å; I772-N774 PolarHBondContact O-N 3.12Å; I772-H775 PolarHBondContact O-N 3.26Å
773	N	35.2	Very low	43.2	Very low	79 Å²	79	69.8 Å²	69.8	42%	0.422	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	43.7	-178.9	-58.3	-21.7	0	0	0	114	C771 H775	C771-N773 PolarHBondContact O-N 2.97Å; N773-H775 PolarHBondContact O-N 3.05Å; N773-H775 VanDerWaalsContact O-N 3.1Å
774	N	37.4	Very low	41.7	Very low	65 Å²	65	71.3 Å²	71.3	35%	0.348	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	21.1	-175.1	-68.9	9.6	0	0	0	114.7	I772	I772-N774 VanDerWaalsContact C-N 3.31Å; I772-N774 PolarHBondContact O-N 3.12Å
775	H	40.3	Very low	39.7	Very low	97 Å²	97	78.6 Å²	78.6	45%	0.449	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-104.5	103.8	167.5	-72.7	-3.7	0	0	0	110	I772 N773 F999	I772-H775 PolarHBondContact O-N 3.26Å; N773-H775 PolarHBondContact O-N 3.05Å; N773-H775 VanDerWaalsContact O-N 3.1Å; H775-F999 AromaticContact CE1-CD2 3.63Å; H775-F999 AromaticContact CE1-CE2 3.68Å; H775-F999 AromaticContact NE2-CD2 3.5Å; H775-F999 AromaticContact NE2-CG 3.93Å
776	C	44.3	Very low	38.1	Very low	38 Å²	38	81.2 Å²	81.2	26%	0.257	48%	0.482	S	S	.	.			trans	-90.4	8.1	-176	-52.3	0	0	0	0	114.4	V619 T769 C771	V619-C776 HydrophobicContact CB-CB 4.08Å; V619-C776 HydrophobicContact CG2-CB 3.94Å; V619-C776 WeakPolarHBondContact CG2-SG 3.5Å; T769-C776 PolarHBondContact OG1-O 3.15Å; C771-C776 HydrophobicContact CB-CB 4.02Å; C771-C776 WeakPolarHBondContact CB-SG 3.28Å; C771-C776 VanDerWaalsContact SG-CA 3.6Å; C771-C776 WeakPolarHBondContact SG-CB 3.41Å; C771-C776 CovalentContact SG-SG 2.03Å; C771-C776 PolarHBondContact SG-SG 3.21Å
777	R	41.5	Very low	36.5	Very low	80 Å²	80	84.2 Å²	84.2	30%	0.302	50%	0.503	S	S	.	.	S	Bend	trans	-117.4	155.7	-176.9	-73.5	-170.8	176.1	-176.5	-2.6	112	D714 E781 G782	D714-R777 IonicContact OD2-CZ 2.83Å; D714-R777 IonicContact OD2-NH1 3.8Å; D714-R777 IonicContact OD2-NH2 3.77Å; D714-R777 PolarHBondContact OD2-NH2 2.91Å; R777-E781 PolarHBondContact NH1-O 3.14Å; R777-G782 PolarHBondContact NH1-O 3.08Å
778	Q	37.7	Very low	35	Very low	134 Å²	134	85.9 Å²	85.9	63%	0.626	52%	0.522	S	S	*	.			trans	-73.9	153.3	167.2	-59.7	-163.8	-82.6	0	0	110.6	G780	Q778-G780 PolarHBondContact O-N 2.74Å
779	I	32.2	Very low	33.7	Very low	187 Å²	187	94.7 Å²	94.7	96%	0.959	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	104.6	-179.4	-59.2	172.4	0	0	0	109.2
780	G	28.9	Very low	32.5	Very low	75 Å²	75	97.5 Å²	97.5	77%	0.773	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	152.7	-26.5	175.8	0	0	0	0	0	115.1	Q778 G782	Q778-G780 PolarHBondContact O-N 2.74Å; G780-G782 PolarHBondContact O-N 2.98Å
781	E	30.2	Very low	31.6	Very low	118 Å²	118	100 Å²	100	55%	0.551	57%	0.569	S	S	*	*	S	Bend	trans	-90.8	108.4	-173.3	-68.8	176.8	162.8	0	0	112.4	R777	R777-E781 PolarHBondContact NH1-O 3.14Å
782	G	27.6	Very low	30.8	Very low	64 Å²	64	106.2 Å²	106.2	66%	0.66	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-53.1	140.8	-168.5	0	0	0	0	0	115.8	R777 G780 S784	R777-G782 PolarHBondContact NH1-O 3.08Å; G780-G782 PolarHBondContact O-N 2.98Å; G782-S784 PolarHBondContact O-N 3.5Å
783	A	25.3	Very low	30.2	Very low	87 Å²	87	105.3 Å²	105.3	72%	0.719	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-67.8	121.3	-173.4	0	0	0	0	0	113
784	S	27.7	Very low	29.8	Very low	51 Å²	51	108.2 Å²	108.2	36%	0.357	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-71.1	125.9	169.6	56.8	0	0	0	0	110.8	G782	G782-S784 PolarHBondContact O-N 3.5Å
785	L	25.5	Very low	29.3	Very low	157 Å²	157	111.3 Å²	111.3	82%	0.822	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-56.5	138.9	175.9	-75.6	138.2	0	0	0	111.9
786	A	23.9	Very low	28.7	Very low	75 Å²	75	113.5 Å²	113.5	62%	0.62	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-73.3	133.4	177.1	0	0	0	0	0	111.7	S788	A786-S788 PolarHBondContact O-N 3.27Å
787	P	24.8	Very low	27.7	Very low	87 Å²	87	121 Å²	121	57%	0.565	67%	0.667	S	S	*	*			trans	-79.5	102.5	174.6	31.5	-31.7	0	0	0	110.7	N712 R789	N712-P787 VanDerWaalsContact CG-CD 3.48Å; N712-P787 VanDerWaalsContact OD1-CD 3.3Å; N712-P787 WeakPolarHBondContact OD1-CD 3.35Å; P787-R789 PolarHBondContact O-N 3.35Å
788	S	23.6	Very low	26.9	Very low	86 Å²	86	121.5 Å²	121.5	60%	0.601	68%	0.678	S	S	*	*			trans	-71.8	90.8	173.2	46	0	0	0	0	111.7	A786 E852	A786-S788 PolarHBondContact O-N 3.27Å; S788-E852 WeakPolarHBondContact CB-OE1 3.43Å
789	R	27.6	Very low	26.2	Very low	227 Å²	227	122 Å²	122	86%	0.857	69%	0.686	S	S	*	*			trans	-159.6	112.5	160.4	-117.4	162.6	-171.4	162.4	3.6	115	P787	P787-R789 PolarHBondContact O-N 3.35Å
790	L	25	Very low	25.8	Very low	100 Å²	100	119.2 Å²	119.2	52%	0.524	68%	0.677	S	S	.	*			trans	-83.3	117.9	154.8	-119.5	167	0	0	0	108.1	P850	L790-P850 HydrophobicContact CD1-CG 3.96Å
791	L	25.4	Very low	25.7	Very low	148 Å²	148	120.9 Å²	120.9	78%	0.775	68%	0.677	S	S	*	*			trans	-88.5	103.3	166.4	-80.6	172.2	0	0	0	109	S793	L791-S793 PolarHBondContact O-N 2.97Å
792	Y	25.5	Very low	25.5	Very low	149 Å²	149	127.1 Å²	127.1	58%	0.584	70%	0.696	S	S	*	*			trans	-60.3	130.1	168	-89.2	-97.3	0	0	0	110.2	N794	Y792-N794 VanDerWaalsContact C-N 3.31Å; Y792-N794 PolarHBondContact O-N 3.01Å
793	S	25.5	Very low	25.3	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	70%	0.7	S	S	*	*	S	Bend	trans	-72.5	-19.1	-178.8	55	0	0	0	0	114.6	L791	L791-S793 PolarHBondContact O-N 2.97Å
794	N	26.2	Very low	25.4	Very low	139 Å²	139	136 Å²	136	74%	0.743	71%	0.707	S	S	*	*	S	Bend	trans	-113.8	-2.5	-160	-70.3	19	0	0	0	116.1	Y792	Y792-N794 VanDerWaalsContact C-N 3.31Å; Y792-N794 PolarHBondContact O-N 3.01Å
795	E	26.6	Very low	25.5	Very low	130 Å²	130	136.5 Å²	136.5	61%	0.607	71%	0.706	S	S	*	*			trans	-106.1	2.2	176.9	-74	-160.8	158.5	0	0	114.7	K797 K848	E795-K797 PolarHBondContact O-N 3.26Å; E795-K848 IonicContact OE1-NZ 2.68Å; E795-K848 PolarHBondContact OE1-NZ 3.37Å; E795-K848 IonicContact OE2-NZ 3.88Å; E795-K848 PolarHBondContact OE2-NZ 2.88Å
796	L	27.3	Very low	25.6	Very low	143 Å²	143	132 Å²	132	75%	0.749	70%	0.698	S	S	*	*			trans	-80.2	48.9	174.7	-138.7	91.2	0	0	0	113.3	V798	L796-V798 HydrophobicContact CD2-CG2 3.93Å; L796-V798 HydrophobicContact CG-CG2 3.95Å; L796-V798 PolarHBondContact O-N 2.97Å
797	K	23	Very low	25.8	Very low	195 Å²	195	131 Å²	131	85%	0.848	69%	0.686	S	S	*	*			trans	-69.8	73.6	154.5	-82.3	-168.7	177.1	-178.4	0	108.5	E795 N799	E795-K797 PolarHBondContact O-N 3.26Å; K797-N799 PolarHBondContact O-N 3.24Å
798	V	25.6	Very low	25.9	Very low	91 Å²	91	134.1 Å²	134.1	55%	0.552	69%	0.693	S	S	*	*			trans	-58.4	120	156.1	178.1	0	0	0	0	105.9	L796 T800	L796-V798 HydrophobicContact CD2-CG2 3.93Å; L796-V798 HydrophobicContact CG-CG2 3.95Å; L796-V798 PolarHBondContact O-N 2.97Å; V798-T800 VanDerWaalsContact C-N 3.29Å; V798-T800 HydrophobicContact CG1-CG2 4.28Å; V798-T800 PolarHBondContact O-N 3.24Å
799	N	22.5	Very low	26.1	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	71%	0.705	S	S	*	*			trans	-63.5	98.8	164	-83.5	-17	0	0	0	106.8	K797 S801	K797-N799 PolarHBondContact O-N 3.24Å; N799-S801 PolarHBondContact O-N 3.23Å
800	T	24.6	Very low	26.1	Very low	128 Å²	128	139.5 Å²	139.5	79%	0.785	70%	0.7	S	S	*	*			trans	-74.8	66.2	177.9	41.5	0	0	0	0	109.7	V798 R802	V798-T800 VanDerWaalsContact C-N 3.29Å; V798-T800 HydrophobicContact CG1-CG2 4.28Å; V798-T800 PolarHBondContact O-N 3.24Å; T800-R802 PolarHBondContact O-N 3.39Å
801	S	25.7	Very low	26.1	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	71%	0.709	S	S	*	*			trans	-65.2	82.4	172.5	53.8	0	0	0	0	109.8	N799 S803	N799-S801 PolarHBondContact O-N 3.23Å; S801-S803 PolarHBondContact O-N 3.42Å
802	R	25.7	Very low	26.1	Very low	250 Å²	250	139.3 Å²	139.3	94%	0.943	69%	0.69	S	S	*	*	S	Bend	trans	27.6	74.9	167.9	-70	-179.3	171.5	172.2	-2.7	115.4	T800	T800-R802 PolarHBondContact O-N 3.39Å
803	S	25.3	Very low	26.2	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	70%	0.703	S	S	*	*			trans	-105.4	116	142.8	-149	0	0	0	0	107.5	S801	S801-S803 PolarHBondContact O-N 3.42Å
804	R	27	Very low	26.7	Very low	230 Å²	230	144 Å²	144	87%	0.868	71%	0.708	S	S	*	*			trans	-60.8	136.6	137.7	-65	173	-179.4	163.6	-0.9	104.1
805	D	28.6	Very low	26.8	Very low	62 Å²	62	143.8 Å²	143.8	33%	0.332	70%	0.696	S	S	.	*			trans	173.9	57.6	-156	-48.2	72.2	0	0	0	110.3	N516 S807	N516-D805 WeakPolarHBondContact CB-OD1 3.49Å; N516-D805 VanDerWaalsContact CB-OD2 3.29Å; N516-D805 WeakPolarHBondContact CB-OD2 3.5Å; N516-D805 PolarHBondContact ND2-OD1 2.99Å; N516-D805 PolarHBondContact ND2-OD2 3.12Å; D805-S807 VanDerWaalsContact C-N 3.32Å; D805-S807 PolarHBondContact O-N 3.22Å
806	G	28.6	Very low	26.8	Very low	64 Å²	64	141.9 Å²	141.9	66%	0.66	70%	0.697	S	S	*	*			trans	-74	-10	-161.3	0	0	0	0	0	116.7	Q808	G806-Q808 PolarHBondContact O-N 3.49Å
807	S	27.7	Very low	26.8	Very low	52 Å²	52	141.1 Å²	141.1	36%	0.364	70%	0.699	S	S	.	*			trans	-86.7	108.4	-170.9	64.9	0	0	0	0	113.5	D805 R809	D805-S807 VanDerWaalsContact C-N 3.32Å; D805-S807 PolarHBondContact O-N 3.22Å; S807-R809 PolarHBondContact O-N 2.71Å; S807-R809 VanDerWaalsContact O-N 3.08Å
808	Q	26.5	Very low	27.1	Very low	154 Å²	154	138.5 Å²	138.5	72%	0.72	69%	0.694	S	S	*	*			trans	-69.2	101.2	168.9	-70.2	-172.6	-1	0	0	110.9	G806 W810	G806-Q808 PolarHBondContact O-N 3.49Å; Q808-W810 PolarHBondContact O-N 2.83Å
809	R	27.4	Very low	27.1	Very low	224 Å²	224	138.3 Å²	138.3	85%	0.845	71%	0.71	S	S	*	*			trans	-76.3	106	172.7	-67.9	-173.9	-179.8	-166	-0.8	110.5	S807 R811	S807-R809 PolarHBondContact O-N 2.71Å; S807-R809 VanDerWaalsContact O-N 3.08Å; R809-R811 VanDerWaalsContact C-N 3.25Å; R809-R811 PolarHBondContact O-N 2.77Å
810	W	27.8	Very low	27.2	Very low	201 Å²	201	136 Å²	136	76%	0.761	71%	0.705	S	S	*	*			trans	-77.9	2.7	177.1	-77.5	80.3	0	0	0	114.9	A689 Q808	A689-W810 HydrophobicContact CB-CZ3 4.28Å; Q808-W810 PolarHBondContact O-N 2.83Å
811	R	26.3	Very low	27.4	Very low	186 Å²	186	137.8 Å²	137.8	70%	0.702	71%	0.71	S	S	*	*	S	Bend	trans	-89.1	134.6	176.8	-68.9	-170.9	-176.7	176.6	2.1	111.6	R809	R809-R811 VanDerWaalsContact C-N 3.25Å; R809-R811 PolarHBondContact O-N 2.77Å
812	P	25.1	Very low	27.4	Very low	59 Å²	59	141.6 Å²	141.6	38%	0.383	71%	0.713	S	S	.	*			trans	-69.5	152.1	173.5	29.2	-34.7	0	0	0	111.9	W814 W815	P812-W814 PolarHBondContact O-N 3.16Å; P812-W815 PolarHBondContact O-N 3.5Å; P812-W815 VanDerWaalsContact O-N 3.13Å
813	P	27.7	Very low	27.5	Very low	134 Å²	134	136.4 Å²	136.4	87%	0.87	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-11.2	-165.7	-25	35.7	0	0	0	117.1
814	W	34.9	Very low	27.7	Very low	222 Å²	222	138.1 Å²	138.1	84%	0.841	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-9.2	178	49.1	36.7	0	0	0	114.3	P812 S816	P812-W814 PolarHBondContact O-N 3.16Å; W814-S816 PolarHBondContact O-N 2.85Å
815	W	28.3	Very low	27.7	Very low	134 Å²	134	132.7 Å²	132.7	51%	0.508	70%	0.697	S	S	.	*			trans	-87.1	45.8	-176.9	-151.8	-66	0	0	0	112.2	V684 P812	V684-W815 HydrophobicContact CG1-CH2 4.41Å; V684-W815 HydrophobicContact CG2-CH2 3.83Å; V684-W815 HydrophobicContact CG2-CZ2 4.31Å; P812-W815 PolarHBondContact O-N 3.5Å; P812-W815 VanDerWaalsContact O-N 3.13Å
816	S	27.7	Very low	27.6	Very low	90 Å²	90	136.6 Å²	136.6	63%	0.629	72%	0.718	S	S	*	*			trans	-119.7	53.4	-173.8	-170.7	0	0	0	0	111.7	W814 D818	W814-S816 PolarHBondContact O-N 2.85Å; S816-D818 PolarHBondContact O-N 3.4Å; S816-D818 VanDerWaalsContact O-N 3.11Å
817	T	26	Very low	27.5	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	72%	0.722	S	S	*	*			trans	-83.2	46.6	175.6	51.9	0	0	0	0	112.6	G819	T817-G819 VanDerWaalsContact C-N 3.26Å; T817-G819 PolarHBondContact O-N 2.17Å
818	D	29.2	Very low	27.3	Very low	140 Å²	140	145.6 Å²	145.6	75%	0.749	74%	0.735	S	S	*	*			trans	-80.7	78.4	170.8	-72.3	-20.2	0	0	0	109	S816 S820	S816-D818 PolarHBondContact O-N 3.4Å; S816-D818 VanDerWaalsContact O-N 3.11Å; D818-S820 PolarHBondContact O-N 3.06Å
819	G	26	Very low	27.3	Very low	87 Å²	87	145 Å²	145	90%	0.897	74%	0.736	S	S	*	*			trans	-72.6	49.2	178.5	0	0	0	0	0	113.7	T817	T817-G819 VanDerWaalsContact C-N 3.26Å; T817-G819 PolarHBondContact O-N 2.17Å
820	S	24.9	Very low	27.2	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	73%	0.734	S	S	*	*			trans	-146.8	74.6	-178.5	65.7	0	0	0	0	113.3	D818	D818-S820 PolarHBondContact O-N 3.06Å
821	N	28.8	Very low	27	Very low	167 Å²	167	142.9 Å²	142.9	89%	0.893	74%	0.737	S	S	*	*			trans	-150	122.1	135.1	-111.3	-16.5	0	0	0	110.2
822	K	26.4	Very low	27	Very low	189 Å²	189	143.1 Å²	143.1	82%	0.822	74%	0.744	S	S	*	*			trans	-83.2	130.7	165.1	-59.3	174.2	179.5	174.5	0	106.9
823	D	28	Very low	27	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	76%	0.76	S	S	*	*				171.5	164.6	112.8	-84.8	-17.8	0	0	0	111.9
824	N	28.9	Very low	26.8	Very low	141 Å²	141	153.4 Å²	153.4	75%	0.754	76%	0.764	S	S	*	*			trans	64.7	68.1	165.7	-60.1	-23.2	0	0	0	118.1
825	T	26.2	Very low	26.3	Very low	116 Å²	116	149.3 Å²	149.3	71%	0.712	76%	0.758	S	S	*	*				40.5	100.6	119.8	60.3	0	0	0	0	118.4
826	N	27.4	Very low	26.2	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	76%	0.76	S	S	*	*				-170.1	135.7	111.9	-102.9	-56.6	0	0	0	113.6
827	K	25.7	Very low	26.2	Very low	167 Å²	167	147.8 Å²	147.8	73%	0.726	77%	0.765	S	S	*	*			trans	50.2	113.9	155.3	-64	-172.6	174.1	-168.3	0	121.1
828	E	24.7	Very low	26.2	Very low	138 Å²	138	149.3 Å²	149.3	65%	0.645	76%	0.762	S	S	*	*			trans	79.4	112.3	130.9	-64.9	168.1	-129.7	0	0	120.5
829	N	24.9	Very low	26	Very low	140 Å²	140	149 Å²	149	75%	0.749	76%	0.76	S	S	*	*			trans	66.1	60.7	134.8	-60.1	-31.9	0	0	0	120
830	Y	25.5	Very low	26.1	Very low	201 Å²	201	155 Å²	155	79%	0.788	76%	0.757	S	S	*	*			trans	-124.8	76.6	155.9	-74.8	-77.4	0	0	0	113.6	F832	Y830-F832 PolarHBondContact O-N 2.84Å
831	H	25.3	Very low	26.3	Very low	180 Å²	180	156 Å²	156	83%	0.833	76%	0.758	S	S	*	*			trans	-62.2	116	145	-82.2	-81.2	0	0	0	107.7	K833	H831-K833 PolarHBondContact O-N 3.24Å
832	F	25.6	Very low	26.4	Very low	192 Å²	192	152.7 Å²	152.7	84%	0.842	75%	0.747	S	S	*	*			trans	-70.6	76.8	174	-89.7	-91.9	0	0	0	111.3	Y830	Y830-F832 PolarHBondContact O-N 2.84Å
833	K	23.9	Very low	26.7	Very low	168 Å²	168	150 Å²	150	73%	0.73	74%	0.739	S	S	*	*			trans	-65.8	135.7	161.2	-86.7	-176.7	173.3	176.5	0	109.3	H831 N835	H831-K833 PolarHBondContact O-N 3.24Å; K833-N835 PolarHBondContact O-N 3.2Å
834	Y	25.5	Very low	27	Very low	240 Å²	240	153.3 Å²	153.3	94%	0.941	75%	0.747	S	S	*	*			trans	-56.4	106.2	158.1	-96.6	-107.8	0	0	0	108.9
835	N	24	Very low	27.3	Very low	136 Å²	136	154.6 Å²	154.6	73%	0.727	75%	0.746	S	S	*	*			trans	-83.1	126.3	170.1	-81.5	-27.9	0	0	0	109.2	K833	K833-N835 PolarHBondContact O-N 3.2Å
836	S	25.2	Very low	27.7	Very low	78 Å²	78	154 Å²	154	55%	0.545	74%	0.737	S	S	.	*			trans	-71.7	156.8	176.4	59.8	0	0	0	0	111.4	F838	S836-F838 PolarHBondContact O-N 2.97Å
837	P	28.4	Very low	27.9	Very low	114 Å²	114	150.9 Å²	150.9	74%	0.74	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	13.7	-173.3	30.5	-37.3	0	0	0	115.1
838	F	26.4	Very low	28.3	Very low	158 Å²	158	149.5 Å²	149.5	69%	0.693	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	9.4	-171.1	-74.5	-74.4	0	0	0	115.3	S836 Y840	S836-F838 PolarHBondContact O-N 2.97Å; F838-Y840 PolarHBondContact O-N 2.92Å
839	N	25.4	Very low	28.6	Very low	133 Å²	133	147 Å²	147	71%	0.711	72%	0.724	S	S	*	*	S	Bend	trans	-91.2	99.9	175.3	-84.4	-12.9	0	0	0	112.6
840	Y	27.5	Very low	29	Very low	215 Å²	215	142.3 Å²	142.3	84%	0.843	70%	0.701	S	S	*	*			trans	21.9	93.2	153.9	-125.7	-91.3	0	0	0	117.8	F838	F838-Y840 PolarHBondContact O-N 2.92Å
841	V	29.6	Very low	29.6	Very low	115 Å²	115	133.3 Å²	133.3	70%	0.697	67%	0.67	S	S	*	*			trans	-81.1	128.5	169.8	-179.2	0	0	0	0	110.2	I843	V841-I843 PolarHBondContact O-N 2.68Å
842	P	29.1	Very low	30.4	Very low	99 Å²	99	130.2 Å²	130.2	64%	0.643	66%	0.656	S	S	*	*			trans	-63.1	135	179.4	-25.7	35.6	0	0	0	114	K844 K845	P842-K844 PolarHBondContact O-N 2.82Å; P842-K845 PolarHBondContact O-N 2.97Å
843	I	32.8	Very low	31	Very low	131 Å²	131	122.2 Å²	122.2	67%	0.672	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-54.9	-23.7	-168.3	-66.1	167.5	0	0	0	114.6	V841 K845 I846	V841-I843 PolarHBondContact O-N 2.68Å; I843-K845 PolarHBondContact O-N 3.5Å; I843-I846 HydrophobicContact CB-CD1 4.48Å; I843-I846 HydrophobicContact CG2-CD1 4.09Å; I843-I846 WeakPolarHBondContact O-CG1 3.49Å
844	K	35.2	Very low	31.9	Very low	212 Å²	212	119.2 Å²	119.2	92%	0.922	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-68.9	2.4	-177.6	-74	-171.6	173.5	-177.6	0	116.2	P842	P842-K844 PolarHBondContact O-N 2.82Å
845	K	35.9	Very low	32.8	Very low	168 Å²	168	110.7 Å²	110.7	73%	0.73	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-112.7	5.4	179.8	-79.1	-170	174.5	-178.1	0	116.2	P842 I843 G847	P842-K845 PolarHBondContact O-N 2.97Å; I843-K845 PolarHBondContact O-N 3.5Å; K845-G847 VanDerWaalsContact C-N 3.31Å; K845-G847 PolarHBondContact O-N 2.68Å
846	I	34.5	Very low	33.8	Very low	103 Å²	103	106.6 Å²	106.6	53%	0.528	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-67.8	-21.8	-169.4	-68.8	171.7	0	0	0	114.5	I843 K848	I843-I846 HydrophobicContact CB-CD1 4.48Å; I843-I846 HydrophobicContact CG2-CD1 4.09Å; I843-I846 WeakPolarHBondContact O-CG1 3.49Å; I846-K848 VanDerWaalsContact C-N 3.31Å; I846-K848 PolarHBondContact O-N 2.51Å
847	G	30.8	Very low	34.4	Very low	81 Å²	81	104.3 Å²	104.3	84%	0.835	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-73.1	9.9	-167.5	0	0	0	0	0	119.4	K845	K845-G847 VanDerWaalsContact C-N 3.31Å; K845-G847 PolarHBondContact O-N 2.68Å
848	K	33.5	Very low	35	Very low	137 Å²	137	102.3 Å²	102.3	60%	0.596	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-145.4	21.2	-173.9	-86.7	-165.6	170	-177.8	0	116.7	E795 I846	E795-K848 IonicContact OE1-NZ 2.68Å; E795-K848 PolarHBondContact OE1-NZ 3.37Å; E795-K848 IonicContact OE2-NZ 3.88Å; E795-K848 PolarHBondContact OE2-NZ 2.88Å; I846-K848 VanDerWaalsContact C-N 3.31Å; I846-K848 PolarHBondContact O-N 2.51Å
849	I	32.4	Very low	35.6	Very low	85 Å²	85	99 Å²	99	44%	0.436	52%	0.521	S	S	.	.			trans	-121	115.9	-179.5	-54.4	177	0	0	0	110.5	E852 Y874	I849-E852 HydrophobicContact CG2-CG 4.3Å; I849-Y874 WeakPolarHBondContact O-CE1 3.26Å; I849-Y874 PolarHBondContact O-OH 2.82Å; I849-Y874 VanDerWaalsContact O-OH 3.09Å
850	P	33.2	Very low	36	Very low	42 Å²	42	98 Å²	98	27%	0.273	51%	0.512	S	S	.	.			trans	-106.2	137.5	176.2	35.4	-29.8	0	0	0	114.1	L790	L790-P850 HydrophobicContact CD1-CG 3.96Å
851	G	36.4	Very low	36.7	Very low	13 Å²	13	99.5 Å²	99.5	13%	0.134	52%	0.516	C	S	.	.			trans	80	61.3	160.5	0	0	0	0	0	116.7	R709 C879	R709-G851 PolarHBondContact NH1-O 2.93Å; R709-G851 VanDerWaalsContact NH1-O 3.16Å; G851-C879 WeakPolarHBondContact CA-O 3.44Å; G851-C879 PolarHBondContact N-O 3.14Å
852	E	42.3	Very low	37.4	Very low	115 Å²	115	95.4 Å²	95.4	54%	0.537	49%	0.493	S	S	.	.			trans	-106.7	29.7	172.1	-63.7	-162.4	149.9	0	0	113.6	S788 I849 P871	S788-E852 WeakPolarHBondContact CB-OE1 3.43Å; I849-E852 HydrophobicContact CG2-CG 4.3Å; E852-P871 HydrophobicContact CB-CG 4.24Å; E852-P871 WeakPolarHBondContact O-CD 3.46Å
853	G	39.3	Very low	37.6	Very low	24 Å²	24	95.7 Å²	95.7	25%	0.247	49%	0.487	C	S	.	.	S	Bend	trans	-100.6	155.9	176.2	0	0	0	0	0	114.4	C855 A869	G853-C855 PolarHBondContact O-N 3.26Å; G853-A869 CarbonylContact C-O 3.57Å; G853-A869 WeakPolarHBondContact CA-O 3.5Å
854	I	43.3	Very low	38.1	Very low	104 Å²	104	93.6 Å²	93.6	53%	0.533	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	100.3	178.5	-53.6	174.5	0	0	0	108.7	I856 A869 F999	I854-I856 HydrophobicContact CG2-CG2 4.49Å; I854-A869 HydrophobicContact CB-CB 4.21Å; I854-A869 PolarHBondContact N-O 3.12Å; I854-A869 PolarHBondContact O-N 3.34Å; I854-F999 HydrophobicContact CG2-CE1 4.01Å; I854-F999 HydrophobicContact CG2-CZ 3.92Å
855	C	43.6	Very low	38.4	Very low	61 Å²	61	87 Å²	87	41%	0.412	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.2	173.9	-62.2	0	0	0	0	111.6	G853 T867 C868	G853-C855 PolarHBondContact O-N 3.26Å; C855-T867 CarbonylContact C-O 3.57Å; C855-T867 WeakPolarHBondContact CA-O 2.99Å; C855-C868 HydrophobicContact CB-CB 4.11Å; C855-C868 WeakPolarHBondContact CB-SG 3.43Å; C855-C868 WeakPolarHBondContact SG-CB 3.45Å; C855-C868 CovalentContact SG-SG 2.05Å; C855-C868 PolarHBondContact SG-SG 3.49Å
856	I	43.9	Very low	38.7	Very low	51 Å²	51	81.3 Å²	81.3	26%	0.262	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.8	174.9	60.9	176.2	0	0	0	110	I854 T867 F999	I854-I856 HydrophobicContact CG2-CG2 4.49Å; I856-T867 HydrophobicContact CD1-CG2 4.07Å; I856-T867 HydrophobicContact CG1-CG2 3.59Å; I856-T867 PolarHBondContact N-O 2.92Å; I856-T867 PolarHBondContact O-N 3.35Å; I856-F999 HydrophobicContact CG2-CE1 3.92Å
857	N	39.8	Very low	39.4	Very low	29 Å²	29	78.1 Å²	78.1	16%	0.155	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117	176.9	-69.3	-11.5	0	0	0	108.7	E708 V865 S866	E708-N857 PolarHBondContact OE1-ND2 3.33Å; N857-V865 CarbonylContact C-O 3.59Å; N857-V865 WeakPolarHBondContact CA-O 3.43Å; N857-S866 VanDerWaalsContact OD1-CA 3.31Å; N857-S866 WeakPolarHBondContact OD1-CA 3.39Å; N857-S866 WeakPolarHBondContact OD1-CB 3.07Å
858	L	39.8	Very low	40	Very low	72 Å²	72	74.7 Å²	74.7	38%	0.377	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122	179.3	-94.7	160.5	0	0	0	109.3	H864 V865	L858-H864 WeakPolarHBondContact O-CA 3.48Å; L858-V865 PolarHBondContact N-O 2.86Å; L858-V865 PolarHBondContact O-N 2.72Å
859	F	39	Very low	40.5	Very low	89 Å²	89	69.7 Å²	69.7	39%	0.39	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	102.3	177.2	-150.6	-71.7	0	0	0	109.1	I863 H864	F859-I863 WeakPolarHBondContact CA-O 3.21Å; F859-H864 HydrophobicContact CD2-CB 4.11Å; F859-H864 AromaticContact CD2-CD2 3.66Å; F859-H864 HydrophobicContact CE2-CB 4.07Å; F859-H864 AromaticContact CE2-CD2 3.87Å
860	Q	34.9	Very low	41.2	Very low	113 Å²	113	66.7 Å²	66.7	53%	0.528	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	111.5	176.8	-75.4	-164.6	-5.7	0	0	110.7	S862 I863	Q860-S862 VanDerWaalsContact C-N 3.27Å; Q860-S862 PolarHBondContact O-N 2.91Å; Q860-I863 PolarHBondContact N-O 3.5Å; Q860-I863 PolarHBondContact O-N 2.75Å
861	R	41.9	Very low	41.7	Very low	245 Å²	245	67 Å²	67	93%	0.925	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	-72.7	179.3	-59.3	-177.5	-178.3	179.3	1.4	114.4
862	S	43.7	Very low	42.1	Very low	30 Å²	30	72.7 Å²	72.7	21%	0.21	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.7	7	-175.2	62	0	0	0	0	113.6	P26 Q860	P26-S862 WeakPolarHBondContact CG-OG 3.43Å; Q860-S862 VanDerWaalsContact C-N 3.27Å; Q860-S862 PolarHBondContact O-N 2.91Å
863	I	34	Very low	42.1	Very low	104 Å²	104	68.3 Å²	68.3	53%	0.533	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.3	-176.9	-61.1	177.4	0	0	0	109.4	F859 Q860 V865	F859-I863 WeakPolarHBondContact CA-O 3.21Å; Q860-I863 PolarHBondContact N-O 3.5Å; Q860-I863 PolarHBondContact O-N 2.75Å; I863-V865 HydrophobicContact CG2-CG2 3.89Å
864	H	42.2	Very low	42.6	Very low	87 Å²	87	69.1 Å²	69.1	40%	0.403	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.2	173.2	176.8	-62.1	0	0	0	109.7	L858 F859	L858-H864 WeakPolarHBondContact O-CA 3.48Å; F859-H864 HydrophobicContact CD2-CB 4.11Å; F859-H864 AromaticContact CD2-CD2 3.66Å; F859-H864 HydrophobicContact CE2-CB 4.07Å; F859-H864 AromaticContact CE2-CD2 3.87Å
865	V	41	Very low	42.9	Very low	74 Å²	74	64.9 Å²	64.9	45%	0.448	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133	175.1	171.1	0	0	0	0	109.8	N857 L858 I863	N857-V865 CarbonylContact C-O 3.59Å; N857-V865 WeakPolarHBondContact CA-O 3.43Å; L858-V865 PolarHBondContact N-O 2.86Å; L858-V865 PolarHBondContact O-N 2.72Å; I863-V865 HydrophobicContact CG2-CG2 3.89Å
866	S	43.8	Very low	43.1	Very low	49 Å²	49	64.5 Å²	64.5	34%	0.343	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.5	172.2	54.8	0	0	0	0	109.7	N857 L877	N857-S866 VanDerWaalsContact OD1-CA 3.31Å; N857-S866 WeakPolarHBondContact OD1-CA 3.39Å; N857-S866 WeakPolarHBondContact OD1-CB 3.07Å; S866-L877 WeakPolarHBondContact OG-CD2 3.22Å
867	T	47.7	Very low	43.1	Very low	35 Å²	35	67.6 Å²	67.6	22%	0.215	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	147.3	177.4	-175.5	0	0	0	0	110.6	C855 I856	C855-T867 CarbonylContact C-O 3.57Å; C855-T867 WeakPolarHBondContact CA-O 2.99Å; I856-T867 HydrophobicContact CD1-CG2 4.07Å; I856-T867 HydrophobicContact CG1-CG2 3.59Å; I856-T867 PolarHBondContact N-O 2.92Å; I856-T867 PolarHBondContact O-N 3.35Å
868	C	43.4	Very low	43.6	Very low	10 Å²	10	68.1 Å²	68.1	7%	0.068	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	118	-171.2	-65.2	0	0	0	0	112.3	C855 C870 L877	C855-C868 HydrophobicContact CB-CB 4.11Å; C855-C868 WeakPolarHBondContact CB-SG 3.43Å; C855-C868 WeakPolarHBondContact SG-CB 3.45Å; C855-C868 CovalentContact SG-SG 2.05Å; C855-C868 PolarHBondContact SG-SG 3.49Å; C868-C870 PolarHBondContact O-N 3.32Å; C868-L877 PolarHBondContact SG-O 3.23Å
869	A	45.9	Very low	44	Very low	32 Å²	32	64.7 Å²	64.7	26%	0.264	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	85.8	170.7	0	0	0	0	0	110.2	G853 I854 I952	G853-A869 CarbonylContact C-O 3.57Å; G853-A869 WeakPolarHBondContact CA-O 3.5Å; I854-A869 HydrophobicContact CB-CB 4.21Å; I854-A869 PolarHBondContact N-O 3.12Å; I854-A869 PolarHBondContact O-N 3.34Å; A869-I952 HydrophobicContact CB-CG2 3.78Å
870	C	46.4	Very low	44.5	Very low	21 Å²	21	66.1 Å²	66.1	14%	0.142	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-79.6	141.5	179.8	-56.1	0	0	0	0	112.6	C868 Y874 C879 P953	C868-C870 PolarHBondContact O-N 3.32Å; C870-Y874 VanDerWaalsContact CB-O 3.29Å; C870-Y874 WeakPolarHBondContact CB-O 3.43Å; C870-C879 WeakPolarHBondContact CA-SG 3.25Å; C870-C879 HydrophobicContact CB-CB 3.73Å; C870-C879 WeakPolarHBondContact CB-SG 3.17Å; C870-C879 WeakPolarHBondContact SG-CA 3.44Å; C870-C879 WeakPolarHBondContact SG-CB 3.22Å; C870-C879 CovalentContact SG-SG 2.04Å; C870-C879 PolarHBondContact SG-SG 3.26Å; C870-P953 HydrophobicContact CB-CG 4.46Å
871	P	43.9	Very low	45	Very low	48 Å²	48	64.5 Å²	64.5	31%	0.312	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-70.1	160.9	171.1	29.4	-33.9	0	0	0	111.7	E852 G873 Y874	E852-P871 HydrophobicContact CB-CG 4.24Å; E852-P871 WeakPolarHBondContact O-CD 3.46Å; P871-G873 PolarHBondContact O-N 2.78Å; P871-Y874 HydrophobicContact CG-CD2 3.89Å; P871-Y874 HydrophobicContact CG-CG 4.34Å; P871-Y874 WeakPolarHBondContact O-CB 3.17Å; P871-Y874 PolarHBondContact O-N 3.29Å
872	I	43.9	Very low	45.3	Very low	133 Å²	133	55.5 Å²	55.5	68%	0.682	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	123.5	-179.7	-55.8	151.8	0	0	0	109.8	P894	I872-P894 HydrophobicContact CD1-CG 3.8Å; I872-P894 HydrophobicContact CG1-CG 4.16Å
873	G	43.8	Very low	45.4	Very low	23 Å²	23	57.9 Å²	57.9	24%	0.237	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.7	-12.5	-173.4	0	0	0	0	0	114.9	P871 L882 F887	P871-G873 PolarHBondContact O-N 2.78Å; G873-L882 PolarHBondContact O-N 3.47Å; G873-F887 VanDerWaalsContact C-CZ 3.47Å
874	Y	49.2	Very low	46	Very low	41 Å²	41	59.8 Å²	59.8	16%	0.161	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.8	-168.4	-60.7	-96.2	0	0	0	112.8	I849 C870 P871 C879 M880 P881	I849-Y874 WeakPolarHBondContact O-CE1 3.26Å; I849-Y874 PolarHBondContact O-OH 2.82Å; I849-Y874 VanDerWaalsContact O-OH 3.09Å; C870-Y874 VanDerWaalsContact CB-O 3.29Å; C870-Y874 WeakPolarHBondContact CB-O 3.43Å; P871-Y874 HydrophobicContact CG-CD2 3.89Å; P871-Y874 HydrophobicContact CG-CG 4.34Å; P871-Y874 WeakPolarHBondContact O-CB 3.17Å; P871-Y874 PolarHBondContact O-N 3.29Å; Y874-C879 WeakPolarHBondContact CD1-O 2.92Å; Y874-M880 CarbonylContact C-O 3.55Å; Y874-M880 VanDerWaalsContact CA-O 3.28Å; Y874-M880 WeakPolarHBondContact CA-O 3.25Å; Y874-P881 VanDerWaalsContact CD1-CA 3.49Å; Y874-P881 HydrophobicContact CD1-CB 3.98Å; Y874-P881 HydrophobicContact CE1-CB 3.66Å; Y874-P881 HydrophobicContact CE1-CG 4.26Å
875	G	49.6	Very low	46.2	Very low	15 Å²	15	61.3 Å²	61.3	16%	0.155	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	175.5	-179.6	0	0	0	0	0	115.3	C879 M880	G875-C879 CarbonylContact O-C 3.58Å; G875-C879 WeakPolarHBondContact O-CA 3.43Å; G875-M880 PolarHBondContact N-O 3.18Å; G875-M880 PolarHBondContact O-N 3.31Å
876	G	48.3	Very low	46.1	Very low	54 Å²	54	64.1 Å²	64.1	56%	0.557	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	175.8	-177.7	0	0	0	0	0	114.3	G878 C879	G876-G878 PolarHBondContact O-N 3.49Å; G876-C879 PolarHBondContact O-N 3.48Å
877	L	43.6	Very low	45.8	Very low	115 Å²	115	64.2 Å²	64.2	60%	0.602	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-6.7	-171.5	-69.1	170.6	0	0	0	116.5	S866 C868	S866-L877 WeakPolarHBondContact OG-CD2 3.22Å; C868-L877 PolarHBondContact SG-O 3.23Å
878	G	49.9	Very low	45.3	Very low	40 Å²	40	71.3 Å²	71.3	41%	0.412	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	10.2	174.5	0	0	0	0	0	114.1	G876 M880	G876-G878 PolarHBondContact O-N 3.49Å; G878-M880 PolarHBondContact O-N 2.87Å
879	C	47.9	Very low	45.2	Very low	1 Å²	1	76.1 Å²	76.1	1%	0.007	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	61.5	-170.5	-60.5	0	0	0	0	112.5	G851 C870 Y874 G875 G876	G851-C879 WeakPolarHBondContact CA-O 3.44Å; G851-C879 PolarHBondContact N-O 3.14Å; C870-C879 WeakPolarHBondContact CA-SG 3.25Å; C870-C879 HydrophobicContact CB-CB 3.73Å; C870-C879 WeakPolarHBondContact CB-SG 3.17Å; C870-C879 WeakPolarHBondContact SG-CA 3.44Å; C870-C879 WeakPolarHBondContact SG-CB 3.22Å; C870-C879 CovalentContact SG-SG 2.04Å; C870-C879 PolarHBondContact SG-SG 3.26Å; Y874-C879 WeakPolarHBondContact CD1-O 2.92Å; G875-C879 CarbonylContact O-C 3.58Å; G875-C879 WeakPolarHBondContact O-CA 3.43Å; G876-C879 PolarHBondContact O-N 3.48Å
880	M	48.7	Very low	44.7	Very low	119 Å²	119	81.1 Å²	81.1	59%	0.586	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	147.5	176.5	-66.7	177.1	-76.8	0	0	110	Y874 G875 G878 L882	Y874-M880 CarbonylContact C-O 3.55Å; Y874-M880 VanDerWaalsContact CA-O 3.28Å; Y874-M880 WeakPolarHBondContact CA-O 3.25Å; G875-M880 PolarHBondContact N-O 3.18Å; G875-M880 PolarHBondContact O-N 3.31Å; G878-M880 PolarHBondContact O-N 2.87Å; M880-L882 PolarHBondContact O-N 3.46Å
881	P	46.2	Very low	44.2	Very low	78 Å²	78	83 Å²	83	51%	0.506	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	122.7	177.8	24.2	-32.4	0	0	0	109.9	Y874	Y874-P881 VanDerWaalsContact CD1-CA 3.49Å; Y874-P881 HydrophobicContact CD1-CB 3.98Å; Y874-P881 HydrophobicContact CE1-CB 3.66Å; Y874-P881 HydrophobicContact CE1-CG 4.26Å
882	L	48.3	Very low	43.7	Very low	56 Å²	56	85.5 Å²	85.5	29%	0.293	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-79.6	136.6	176.7	-81.4	165.9	0	0	0	109.5	G873 M880 Y886 F887	G873-L882 PolarHBondContact O-N 3.47Å; M880-L882 PolarHBondContact O-N 3.46Å; L882-Y886 HydrophobicContact CD2-CD1 4.36Å; L882-Y886 HydrophobicContact CD2-CG 4.48Å; L882-F887 HydrophobicContact CB-CD2 4.35Å; L882-F887 HydrophobicContact CB-CE2 3.51Å; L882-F887 HydrophobicContact CB-CZ 3.96Å; L882-F887 HydrophobicContact CD1-CE2 4.41Å; L882-F887 HydrophobicContact CD1-CZ 4.05Å
883	P	46.1	Very low	43.2	Very low	81 Å²	81	89.4 Å²	89.4	53%	0.526	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-62.8	146.7	177.7	25.7	-32.6	0	0	0	110.8	D885 Y886	P883-D885 PolarHBondContact O-N 3.17Å; P883-D885 VanDerWaalsContact O-N 3.14Å; P883-Y886 HydrophobicContact CG-CD2 4.23Å; P883-Y886 VanDerWaalsContact O-CB 3.28Å; P883-Y886 WeakPolarHBondContact O-CB 3.49Å; P883-Y886 PolarHBondContact O-N 3.35Å
884	I	46.9	Very low	42.8	Very low	144 Å²	144	92.4 Å²	92.4	74%	0.738	50%	0.503	S	S	*	.	H	α-helix	trans	-59.6	-34	-167.4	-64.8	168.6	0	0	0	112.3	Y886 F887	I884-Y886 PolarHBondContact O-N 3.29Å; I884-F887 PolarHBondContact O-N 2.84Å
885	D	45	Very low	42.1	Very low	119 Å²	119	97.1 Å²	97.1	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-67.6	-22.4	178.5	-56.4	-62.7	0	0	0	113.5	P883 K888 T889	P883-D885 PolarHBondContact O-N 3.17Å; P883-D885 VanDerWaalsContact O-N 3.14Å; D885-K888 PolarHBondContact O-N 3.05Å; D885-T889 PolarHBondContact O-OG1 2.6Å
886	Y	40.3	Very low	41.6	Very low	132 Å²	132	107.8 Å²	107.8	52%	0.518	57%	0.566	S	S	.	*	H	α-helix	trans	-68.2	-37.5	173.8	-123.1	-92.9	0	0	0	111.8	L882 P883 I884 K888 T889 F890	L882-Y886 HydrophobicContact CD2-CD1 4.36Å; L882-Y886 HydrophobicContact CD2-CG 4.48Å; P883-Y886 HydrophobicContact CG-CD2 4.23Å; P883-Y886 VanDerWaalsContact O-CB 3.28Å; P883-Y886 WeakPolarHBondContact O-CB 3.49Å; P883-Y886 PolarHBondContact O-N 3.35Å; I884-Y886 PolarHBondContact O-N 3.29Å; Y886-K888 VanDerWaalsContact C-N 3.3Å; Y886-K888 PolarHBondContact O-N 2.97Å; Y886-T889 PolarHBondContact O-N 2.96Å; Y886-F890 AromaticContact CD1-CD2 3.95Å; Y886-F890 HydrophobicContact CD1-CD2 3.95Å; Y886-F890 HydrophobicContact CD1-CE2 4.05Å; Y886-F890 HydrophobicContact CE1-CD2 4.13Å; Y886-F890 AromaticContact CE1-CE2 3.77Å; Y886-F890 HydrophobicContact CE1-CE2 3.77Å; Y886-F890 PolarHBondContact O-N 2.83Å
887	F	37.1	Very low	41.2	Very low	52 Å²	52	112.1 Å²	112.1	23%	0.228	57%	0.572	C	S	.	*	H	α-helix	trans	-66	-33.3	177.1	-78.6	-78.2	0	0	0	113	G873 L882 I884 T889 G891 L892	G873-F887 VanDerWaalsContact C-CZ 3.47Å; L882-F887 HydrophobicContact CB-CD2 4.35Å; L882-F887 HydrophobicContact CB-CE2 3.51Å; L882-F887 HydrophobicContact CB-CZ 3.96Å; L882-F887 HydrophobicContact CD1-CE2 4.41Å; L882-F887 HydrophobicContact CD1-CZ 4.05Å; I884-F887 PolarHBondContact O-N 2.84Å; F887-T889 VanDerWaalsContact C-N 3.31Å; F887-T889 PolarHBondContact O-N 2.88Å; F887-G891 PolarHBondContact O-N 2.83Å; F887-L892 HydrophobicContact CD1-CB 3.85Å; F887-L892 HydrophobicContact CE1-CB 4.08Å; F887-L892 HydrophobicContact CE1-CD1 4.34Å
888	K	37.6	Very low	41.4	Very low	183 Å²	183	113 Å²	113	80%	0.796	58%	0.576	S	S	*	*	H	α-helix	trans	-71.7	-27.5	-176.9	-152.1	175.4	-174.7	-179	0	112.7	D885 Y886	D885-K888 PolarHBondContact O-N 3.05Å; Y886-K888 VanDerWaalsContact C-N 3.3Å; Y886-K888 PolarHBondContact O-N 2.97Å
889	T	40.1	Very low	41.6	Very low	112 Å²	112	113.2 Å²	113.2	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-88.1	-30.8	-177.3	-52.7	0	0	0	0	113	D885 Y886 F887	D885-T889 PolarHBondContact O-OG1 2.6Å; Y886-T889 PolarHBondContact O-N 2.96Å; F887-T889 VanDerWaalsContact C-N 3.31Å; F887-T889 PolarHBondContact O-N 2.88Å
890	F	35.6	Very low	42.2	Very low	136 Å²	136	113.9 Å²	113.9	60%	0.596	57%	0.573	S	S	*	*	H	α-helix	trans	-106.7	3.1	-174.4	-74.8	-79.1	0	0	0	115.6	Y886 L892	Y886-F890 AromaticContact CD1-CD2 3.95Å; Y886-F890 HydrophobicContact CD1-CD2 3.95Å; Y886-F890 HydrophobicContact CD1-CE2 4.05Å; Y886-F890 HydrophobicContact CE1-CD2 4.13Å; Y886-F890 AromaticContact CE1-CE2 3.77Å; Y886-F890 HydrophobicContact CE1-CE2 3.77Å; Y886-F890 PolarHBondContact O-N 2.83Å; F890-L892 VanDerWaalsContact C-N 3.27Å; F890-L892 HydrophobicContact CB-CD1 4.26Å; F890-L892 HydrophobicContact CB-CG 4.29Å; F890-L892 PolarHBondContact O-N 3.06Å
891	G	35.1	Very low	43.3	Very low	61 Å²	61	116 Å²	116	63%	0.629	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.3	18.7	170.1	0	0	0	0	0	115.8	F887 Y893	F887-G891 PolarHBondContact O-N 2.83Å; G891-Y893 PolarHBondContact O-N 2.81Å
892	L	34.5	Very low	44.5	Very low	101 Å²	101	115.8 Å²	115.8	53%	0.529	57%	0.57	S	S	.	*			trans	-73	48	-173.6	-70.7	168.9	0	0	0	114.5	F887 F890	F887-L892 HydrophobicContact CD1-CB 3.85Å; F887-L892 HydrophobicContact CE1-CB 4.08Å; F887-L892 HydrophobicContact CE1-CD1 4.34Å; F890-L892 VanDerWaalsContact C-N 3.27Å; F890-L892 HydrophobicContact CB-CD1 4.26Å; F890-L892 HydrophobicContact CB-CG 4.29Å; F890-L892 PolarHBondContact O-N 3.06Å
893	Y	34.1	Very low	45.6	Very low	214 Å²	214	113.1 Å²	113.1	84%	0.839	56%	0.556	S	S	*	*			trans	-83.3	126.4	160.1	-96.8	-89.5	0	0	0	109.1	G891 N895	G891-Y893 PolarHBondContact O-N 2.81Å; Y893-N895 VanDerWaalsContact C-N 3.29Å; Y893-N895 PolarHBondContact O-N 3.29Å
894	P	35.1	Very low	47.2	Very low	86 Å²	86	113.2 Å²	113.2	56%	0.558	55%	0.551	S	S	*	*			trans	-72.8	86.3	176	30.7	-34.8	0	0	0	109.6	I872 R896	I872-P894 HydrophobicContact CD1-CG 3.8Å; I872-P894 HydrophobicContact CG1-CG 4.16Å; P894-R896 PolarHBondContact O-N 2.78Å
895	N	34.4	Very low	49	Very low	140 Å²	140	109 Å²	109	75%	0.749	53%	0.53	S	S	*	.			trans	-62.3	133.7	170.4	-139.6	-6.9	0	0	0	108.1	Y893 Q897	Y893-N895 VanDerWaalsContact C-N 3.29Å; Y893-N895 PolarHBondContact O-N 3.29Å; N895-Q897 PolarHBondContact O-N 3.31Å
896	R	38.7	Very low	50.8	Low	239 Å²	239	103.6 Å²	103.6	90%	0.902	50%	0.501	S	S	*	.			trans	-79.4	40.1	-162.5	-155.3	-174.5	-172.7	-166.5	3.4	114	P894	P894-R896 PolarHBondContact O-N 2.78Å
897	Q	39.4	Very low	53	Low	146 Å²	146	97.6 Å²	97.6	68%	0.682	48%	0.479	S	S	*	.			trans	-79.4	119.8	170.5	-70.5	-179.8	-30.4	0	0	108.3	N895 L899	N895-Q897 PolarHBondContact O-N 3.31Å; Q897-L899 PolarHBondContact O-N 2.95Å
898	I	49.4	Very low	55.5	Low	134 Å²	134	99.4 Å²	99.4	69%	0.687	49%	0.49	S	S	*	.	S	Bend	trans	-76.5	-10.4	-177	-65.1	170.9	0	0	0	111.5	I1003	I898-I1003 HydrophobicContact CG2-CD1 4.08Å; I898-I1003 HydrophobicContact CG2-CG1 4.24Å; I898-I1003 VanDerWaalsContact O-CD1 3.26Å; I898-I1003 WeakPolarHBondContact O-CD1 3.5Å
899	L	53.4	Low	58.1	Low	43 Å²	43	90.9 Å²	90.9	23%	0.225	45%	0.454	C	S	.	.	S	Bend	trans	-142.8	145.4	177	-145.1	77.7	0	0	0	108.5	Q897 A903 L904 I944 I1003	Q897-L899 PolarHBondContact O-N 2.95Å; L899-A903 HydrophobicContact CD2-CB 3.83Å; L899-A903 HydrophobicContact CG-CB 3.7Å; L899-L904 HydrophobicContact CD2-CB 4.37Å; L899-L904 HydrophobicContact CD2-CD1 4.4Å; L899-I944 HydrophobicContact CD1-CG2 4.15Å; L899-I944 HydrophobicContact CD2-CG1 4.42Å; L899-I1003 HydrophobicContact CD1-CD1 4.44Å; L899-I1003 HydrophobicContact CD1-CG2 4.24Å
900	S	61.1	Low	60.5	Low	16 Å²	16	85.6 Å²	85.6	11%	0.112	42%	0.421	C	S	.	.			trans	-70.9	157.7	175.7	78.9	0	0	0	0	111.7	D902 A903 L904	S900-D902 VanDerWaalsContact C-N 3.3Å; S900-D902 PolarHBondContact O-N 2.67Å; S900-A903 WeakPolarHBondContact O-CB 3.49Å; S900-A903 PolarHBondContact O-N 2.72Å; S900-A903 VanDerWaalsContact OG-CB 3.3Å; S900-A903 WeakPolarHBondContact OG-CB 3.38Å; S900-A903 PolarHBondContact OG-N 3.07Å; S900-A903 VanDerWaalsContact OG-N 3.09Å; S900-L904 PolarHBondContact O-N 3.17Å
901	Y	70.6	Confident	63.2	Low	164 Å²	164	83.9 Å²	83.9	64%	0.643	41%	0.413	S	S	*	.	H	α-helix	trans	-62.2	-40.2	177	-179.6	-109.9	0	0	0	111.6	L904 I905	Y901-L904 PolarHBondContact O-N 3.2Å; Y901-I905 HydrophobicContact CD1-CD1 3.96Å; Y901-I905 HydrophobicContact CE1-CD1 3.46Å; Y901-I905 VanDerWaalsContact CE1-CD1 3.46Å; Y901-I905 HydrophobicContact CE1-CG1 4.48Å; Y901-I905 HydrophobicContact CE2-CD1 4.23Å; Y901-I905 WeakPolarHBondContact O-CG1 3.37Å; Y901-I905 PolarHBondContact O-N 3.33Å; Y901-I905 VanDerWaalsContact O-N 3.09Å
902	D	70.9	Confident	65.8	Low	73 Å²	73	81.5 Å²	81.5	39%	0.39	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-46.9	174.6	-70.3	-73.8	0	0	0	112.3	S900 L904 I905 L906 T1123	S900-D902 VanDerWaalsContact C-N 3.3Å; S900-D902 PolarHBondContact O-N 2.67Å; D902-L904 VanDerWaalsContact C-N 3.28Å; D902-L904 PolarHBondContact O-N 2.81Å; D902-I905 PolarHBondContact O-N 2.88Å; D902-L906 WeakPolarHBondContact O-CB 3.26Å; D902-L906 PolarHBondContact O-N 2.92Å; D902-T1123 HydrophobicContact CB-CG2 3.73Å; D902-T1123 WeakPolarHBondContact OD1-CB 3.46Å; D902-T1123 WeakPolarHBondContact OD1-CG2 3.45Å; D902-T1123 PolarHBondContact OD1-OG1 2.81Å
903	A	72.1	Confident	68.6	Low	0 Å²	0	77 Å²	77	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-54	-46	174	0	0	0	0	0	111.8	L899 S900 L906 A907 T947	L899-A903 HydrophobicContact CD2-CB 3.83Å; L899-A903 HydrophobicContact CG-CB 3.7Å; S900-A903 WeakPolarHBondContact O-CB 3.49Å; S900-A903 PolarHBondContact O-N 2.72Å; S900-A903 VanDerWaalsContact OG-CB 3.3Å; S900-A903 WeakPolarHBondContact OG-CB 3.38Å; S900-A903 PolarHBondContact OG-N 3.07Å; S900-A903 VanDerWaalsContact OG-N 3.09Å; A903-L906 PolarHBondContact O-N 3.49Å; A903-A907 WeakPolarHBondContact O-CB 3.17Å; A903-A907 PolarHBondContact O-N 2.91Å; A903-T947 WeakPolarHBondContact CA-OG1 3.36Å; A903-T947 HydrophobicContact CB-CG2 4.27Å; A903-T947 WeakPolarHBondContact CB-OG1 3.39Å
904	L	80.1	Confident	71.4	Confident	83 Å²	83	69.4 Å²	69.4	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-67.7	-42	-175.2	-173.7	63.1	0	0	0	112.2	L899 S900 Y901 D902 L908	L899-L904 HydrophobicContact CD2-CB 4.37Å; L899-L904 HydrophobicContact CD2-CD1 4.4Å; S900-L904 PolarHBondContact O-N 3.17Å; Y901-L904 PolarHBondContact O-N 3.2Å; D902-L904 VanDerWaalsContact C-N 3.28Å; D902-L904 PolarHBondContact O-N 2.81Å; L904-L908 HydrophobicContact CD1-CD1 3.98Å; L904-L908 HydrophobicContact CD1-CG 4.18Å; L904-L908 HydrophobicContact CG-CD1 3.86Å; L904-L908 HydrophobicContact CG-CG 4.43Å; L904-L908 VanDerWaalsContact O-CB 3.25Å; L904-L908 WeakPolarHBondContact O-CB 3.33Å; L904-L908 WeakPolarHBondContact O-CG 3.27Å; L904-L908 PolarHBondContact O-N 2.9Å
905	I	84.3	Confident	74	Confident	55 Å²	55	68 Å²	68	28%	0.282	33%	0.329	S	S	.	.	H	α-helix	trans	-65.5	-45.7	175.4	-59.7	171.9	0	0	0	110	Y901 D902 A907 L908 S909 S1127	Y901-I905 HydrophobicContact CD1-CD1 3.96Å; Y901-I905 HydrophobicContact CE1-CD1 3.46Å; Y901-I905 VanDerWaalsContact CE1-CD1 3.46Å; Y901-I905 HydrophobicContact CE1-CG1 4.48Å; Y901-I905 HydrophobicContact CE2-CD1 4.23Å; Y901-I905 WeakPolarHBondContact O-CG1 3.37Å; Y901-I905 PolarHBondContact O-N 3.33Å; Y901-I905 VanDerWaalsContact O-N 3.09Å; D902-I905 PolarHBondContact O-N 2.88Å; I905-A907 VanDerWaalsContact C-N 3.34Å; I905-A907 PolarHBondContact O-N 2.95Å; I905-L908 PolarHBondContact O-N 3.01Å; I905-S909 WeakPolarHBondContact O-CB 3.09Å; I905-S909 PolarHBondContact O-N 3.27Å; I905-S1127 WeakPolarHBondContact CG2-OG 3.48Å
906	L	83.8	Confident	76.8	Confident	6 Å²	6	61.3 Å²	61.3	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-43.2	-177.1	-146.1	62.5	0	0	0	111.1	D902 A903 S909 H943 T947 T1123 H1126 S1127	D902-L906 WeakPolarHBondContact O-CB 3.26Å; D902-L906 PolarHBondContact O-N 2.92Å; A903-L906 PolarHBondContact O-N 3.49Å; L906-S909 PolarHBondContact O-OG 3.36Å; L906-H943 HydrophobicContact CB-CB 4.03Å; L906-H943 HydrophobicContact CD2-CB 3.9Å; L906-H943 WeakPolarHBondContact CD2-ND1 3.5Å; L906-H943 HydrophobicContact CG-CB 3.86Å; L906-T947 HydrophobicContact CD2-CG2 4.22Å; L906-T1123 HydrophobicContact CB-CG2 4.44Å; L906-T1123 HydrophobicContact CD1-CG2 3.99Å; L906-T1123 WeakPolarHBondContact CD1-O 3.27Å; L906-H1126 HydrophobicContact CD1-CB 4.08Å; L906-S1127 VanDerWaalsContact CD1-OG 3.27Å; L906-S1127 WeakPolarHBondContact CD1-OG 3.48Å
907	A	86.1	Confident	79.3	Confident	6 Å²	6	51.5 Å²	51.5	5%	0.05	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-43.5	173.6	0	0	0	0	0	113.3	A903 I905 S909 T940 I944	A903-A907 WeakPolarHBondContact O-CB 3.17Å; A903-A907 PolarHBondContact O-N 2.91Å; I905-A907 VanDerWaalsContact C-N 3.34Å; I905-A907 PolarHBondContact O-N 2.95Å; A907-S909 VanDerWaalsContact C-N 3.33Å; A907-S909 PolarHBondContact O-N 3.3Å; A907-T940 HydrophobicContact CB-CG2 4.23Å; A907-I944 HydrophobicContact CB-CD1 4.23Å; A907-I944 HydrophobicContact CB-CG1 3.64Å
908	L	89.1	Confident	81.7	Confident	90 Å²	90	48.9 Å²	48.9	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-70.3	-28.2	178.6	-72.9	173.5	0	0	0	112.8	L904 I905 N910 F911	L904-L908 HydrophobicContact CD1-CD1 3.98Å; L904-L908 HydrophobicContact CD1-CG 4.18Å; L904-L908 HydrophobicContact CG-CD1 3.86Å; L904-L908 HydrophobicContact CG-CG 4.43Å; L904-L908 VanDerWaalsContact O-CB 3.25Å; L904-L908 WeakPolarHBondContact O-CB 3.33Å; L904-L908 WeakPolarHBondContact O-CG 3.27Å; L904-L908 PolarHBondContact O-N 2.9Å; I905-L908 PolarHBondContact O-N 3.01Å; L908-N910 PolarHBondContact O-N 2.61Å; L908-F911 HydrophobicContact CD2-CD2 4.31Å; L908-F911 HydrophobicContact CD2-CE2 4.01Å; L908-F911 HydrophobicContact CD2-CZ 4.35Å; L908-F911 VanDerWaalsContact O-CB 3.29Å; L908-F911 WeakPolarHBondContact O-CB 3.35Å; L908-F911 WeakPolarHBondContact O-CD2 3.46Å; L908-F911 PolarHBondContact O-N 3.49Å
909	S	92	Very high	83.5	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.028	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-31.6	179.4	76	0	0	0	0	112.9	I905 L906 A907 F911 G912 S1127 H1130 I1131	I905-S909 WeakPolarHBondContact O-CB 3.09Å; I905-S909 PolarHBondContact O-N 3.27Å; L906-S909 PolarHBondContact O-OG 3.36Å; A907-S909 VanDerWaalsContact C-N 3.33Å; A907-S909 PolarHBondContact O-N 3.3Å; S909-F911 PolarHBondContact O-N 2.96Å; S909-F911 VanDerWaalsContact O-N 3.14Å; S909-G912 PolarHBondContact O-N 2.9Å; S909-S1127 WeakPolarHBondContact CB-O 3.24Å; S909-H1130 WeakPolarHBondContact OG-CB 3.4Å; S909-I1131 WeakPolarHBondContact O-CG1 3.44Å
910	N	91.5	Very high	85.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.3	-13.9	175.2	-96.3	-76.5	0	0	0	114.2	L908 G912 F913 F936 S939 T940	L908-N910 PolarHBondContact O-N 2.61Å; N910-G912 PolarHBondContact O-N 3.47Å; N910-G912 VanDerWaalsContact O-N 3.1Å; N910-F913 WeakPolarHBondContact O-CD2 3.45Å; N910-F913 PolarHBondContact O-N 2.86Å; N910-F913 WeakPolarHBondContact OD1-CD2 3.33Å; N910-F913 VanDerWaalsContact OD1-CE2 3.24Å; N910-F913 WeakPolarHBondContact OD1-CE2 3.07Å; N910-F936 HydrophobicContact CB-CD2 4.24Å; N910-F936 WeakPolarHBondContact O-CD2 3.21Å; N910-S939 PolarHBondContact ND2-OG 3.36Å; N910-S939 VanDerWaalsContact OD1-CB 3.23Å; N910-S939 WeakPolarHBondContact OD1-CB 3.39Å; N910-S939 PolarHBondContact OD1-OG 2.99Å; N910-T940 WeakPolarHBondContact CB-OG1 3.28Å
911	F	91.7	Very high	86.4	Confident	100 Å²	100	43 Å²	43	44%	0.439	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-63.4	-14.9	170.2	-74.8	-122.8	0	0	0	111.8	L908 S909 F913 I914 F936	L908-F911 HydrophobicContact CD2-CD2 4.31Å; L908-F911 HydrophobicContact CD2-CE2 4.01Å; L908-F911 HydrophobicContact CD2-CZ 4.35Å; L908-F911 VanDerWaalsContact O-CB 3.29Å; L908-F911 WeakPolarHBondContact O-CB 3.35Å; L908-F911 WeakPolarHBondContact O-CD2 3.46Å; L908-F911 PolarHBondContact O-N 3.49Å; S909-F911 PolarHBondContact O-N 2.96Å; S909-F911 VanDerWaalsContact O-N 3.14Å; F911-F913 PolarHBondContact O-N 2.82Å; F911-I914 HydrophobicContact CB-CD1 3.94Å; F911-I914 HydrophobicContact CD1-CD1 3.42Å; F911-I914 VanDerWaalsContact CD1-CD1 3.42Å; F911-I914 HydrophobicContact CE1-CD1 4.12Å; F911-I914 HydrophobicContact CG-CD1 3.87Å; F911-I914 WeakPolarHBondContact O-CB 3.38Å; F911-I914 WeakPolarHBondContact O-CG1 3.22Å; F911-I914 PolarHBondContact O-N 2.77Å; F911-F936 AromaticContact CD2-CE2 3.99Å; F911-F936 HydrophobicContact CD2-CE2 3.99Å; F911-F936 HydrophobicContact CE2-CE2 4.14Å; F911-F936 HydrophobicContact CE2-CZ 4.39Å; F911-F936 HydrophobicContact CG-CE2 4.41Å
912	G	90	Very high	86.9	Confident	12 Å²	12	36 Å²	36	12%	0.124	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-58.3	-18.1	168.2	0	0	0	0	0	115.2	S909 N910 P915 G1134	S909-G912 PolarHBondContact O-N 2.9Å; N910-G912 PolarHBondContact O-N 3.47Å; N910-G912 VanDerWaalsContact O-N 3.1Å; G912-P915 WeakPolarHBondContact O-CD 3.49Å; G912-G1134 CarbonylContact O-C 3.44Å; G912-G1134 VanDerWaalsContact O-C 3.28Å; G912-G1134 WeakPolarHBondContact O-CA 3.48Å
913	F	92.5	Very high	87.4	Confident	5 Å²	5	34.1 Å²	34.1	2%	0.022	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-79.9	-18.5	172.2	-72.7	-90.7	0	0	0	113.6	N910 F911 A916 I917 T935 F936 I1133 L1137	N910-F913 WeakPolarHBondContact O-CD2 3.45Å; N910-F913 PolarHBondContact O-N 2.86Å; N910-F913 WeakPolarHBondContact OD1-CD2 3.33Å; N910-F913 VanDerWaalsContact OD1-CE2 3.24Å; N910-F913 WeakPolarHBondContact OD1-CE2 3.07Å; F911-F913 PolarHBondContact O-N 2.82Å; F913-A916 PolarHBondContact O-N 3.35Å; F913-A916 VanDerWaalsContact O-N 3.1Å; F913-I917 HydrophobicContact CB-CD1 4.31Å; F913-I917 WeakPolarHBondContact O-CG1 3.35Å; F913-I917 PolarHBondContact O-N 2.97Å; F913-T935 HydrophobicContact CE1-CG2 3.92Å; F913-T935 HydrophobicContact CZ-CG2 3.93Å; F913-F936 HydrophobicContact CB-CB 4.13Å; F913-I1133 HydrophobicContact CE2-CG2 4.48Å; F913-I1133 HydrophobicContact CZ-CG2 3.94Å; F913-L1137 HydrophobicContact CD1-CD1 3.9Å; F913-L1137 HydrophobicContact CE1-CD1 3.51Å
914	I	92.6	Very high	88	Confident	56 Å²	56	38.7 Å²	38.7	29%	0.287	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-42.3	-175.9	-65.1	174.5	0	0	0	112.9	F911 A916 I917 L918	F911-I914 HydrophobicContact CB-CD1 3.94Å; F911-I914 HydrophobicContact CD1-CD1 3.42Å; F911-I914 VanDerWaalsContact CD1-CD1 3.42Å; F911-I914 HydrophobicContact CE1-CD1 4.12Å; F911-I914 HydrophobicContact CG-CD1 3.87Å; F911-I914 WeakPolarHBondContact O-CB 3.38Å; F911-I914 WeakPolarHBondContact O-CG1 3.22Å; F911-I914 PolarHBondContact O-N 2.77Å; I914-A916 VanDerWaalsContact C-N 3.33Å; I914-A916 PolarHBondContact O-N 3.38Å; I914-I917 PolarHBondContact O-N 3.33Å; I914-L918 HydrophobicContact CG2-CD1 3.78Å; I914-L918 HydrophobicContact CG2-CG 4.11Å; I914-L918 WeakPolarHBondContact O-CB 3.48Å; I914-L918 WeakPolarHBondContact O-CG 3.4Å; I914-L918 PolarHBondContact O-N 3.18Å
915	P	91	Very high	88.3	Confident	55 Å²	55	35.2 Å²	35.2	36%	0.357	18%	0.181	S	C	.	.	H	α-helix	trans	-55.8	-43.2	173.2	-27.4	36.3	0	0	0	113.3	G912 L918 L919 L1135 A1138	G912-P915 WeakPolarHBondContact O-CD 3.49Å; P915-L918 PolarHBondContact O-N 2.94Å; P915-L919 VanDerWaalsContact O-CB 3.3Å; P915-L919 WeakPolarHBondContact O-CB 3.4Å; P915-L919 PolarHBondContact O-N 3.01Å; P915-L1135 HydrophobicContact CG-CD2 4.38Å; P915-A1138 HydrophobicContact CB-CB 4.16Å
916	A	91.7	Very high	88.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.5	-39.2	178.9	0	0	0	0	0	112.2	F913 I914 S920 Y932 L1137 A1138	F913-A916 PolarHBondContact O-N 3.35Å; F913-A916 VanDerWaalsContact O-N 3.1Å; I914-A916 VanDerWaalsContact C-N 3.33Å; I914-A916 PolarHBondContact O-N 3.38Å; A916-S920 VanDerWaalsContact O-CB 3.31Å; A916-S920 WeakPolarHBondContact O-CB 3.28Å; A916-S920 PolarHBondContact O-N 2.87Å; A916-S920 PolarHBondContact O-OG 3.21Å; A916-Y932 HydrophobicContact CB-CD2 3.8Å; A916-Y932 HydrophobicContact CB-CE2 4.03Å; A916-L1137 HydrophobicContact CB-CB 4.11Å; A916-A1138 HydrophobicContact CB-CB 4Å
917	I	92.7	Very high	88.8	Confident	34 Å²	34	42.3 Å²	42.3	17%	0.174	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-48.1	174.9	-63.5	162.7	0	0	0	110.5	F913 I914 S920 V921 F936	F913-I917 HydrophobicContact CB-CD1 4.31Å; F913-I917 WeakPolarHBondContact O-CG1 3.35Å; F913-I917 PolarHBondContact O-N 2.97Å; I914-I917 PolarHBondContact O-N 3.33Å; I917-S920 PolarHBondContact O-OG 2.96Å; I917-V921 WeakPolarHBondContact O-CG2 3.24Å; I917-V921 PolarHBondContact O-N 3.29Å; I917-F936 HydrophobicContact CD1-CB 3.93Å; I917-F936 HydrophobicContact CD1-CD1 4.38Å; I917-F936 HydrophobicContact CD1-CG 4.27Å
918	L	89.3	Confident	89.2	Confident	91 Å²	91	42.2 Å²	42.2	48%	0.476	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-48.6	178.7	-70.8	173.9	0	0	0	111.5	I914 P915 S920 V921 I922	I914-L918 HydrophobicContact CG2-CD1 3.78Å; I914-L918 HydrophobicContact CG2-CG 4.11Å; I914-L918 WeakPolarHBondContact O-CB 3.48Å; I914-L918 WeakPolarHBondContact O-CG 3.4Å; I914-L918 PolarHBondContact O-N 3.18Å; P915-L918 PolarHBondContact O-N 2.94Å; L918-S920 PolarHBondContact O-N 3.27Å; L918-V921 PolarHBondContact O-N 2.02Å; L918-I922 VanDerWaalsContact O-CD1 3.32Å; L918-I922 WeakPolarHBondContact O-CD1 3.44Å; L918-I922 VanDerWaalsContact O-CG1 3.22Å; L918-I922 WeakPolarHBondContact O-CG1 3.36Å; L918-I922 PolarHBondContact O-N 3.23Å
919	L	86.8	Confident	89.3	Confident	28 Å²	28	38.6 Å²	38.6	15%	0.147	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-40	-178.2	-149.2	83	0	0	0	111.8	P915 I922 H923 L1141 F1257	P915-L919 VanDerWaalsContact O-CB 3.3Å; P915-L919 WeakPolarHBondContact O-CB 3.4Å; P915-L919 PolarHBondContact O-N 3.01Å; L919-I922 PolarHBondContact O-N 2.92Å; L919-H923 VanDerWaalsContact O-CB 3.3Å; L919-H923 WeakPolarHBondContact O-CB 3.37Å; L919-H923 PolarHBondContact O-CD2 3.43Å; L919-H923 VanDerWaalsContact O-CG 3.25Å; L919-H923 PolarHBondContact O-N 3.49Å; L919-L1141 HydrophobicContact CB-CD1 3.9Å; L919-L1141 HydrophobicContact CD2-CB 4.17Å; L919-L1141 HydrophobicContact CD2-CD1 4.1Å; L919-F1257 HydrophobicContact CD1-CD1 3.87Å; L919-F1257 HydrophobicContact CD1-CE1 4.19Å
920	S	89.7	Confident	89.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-35.8	175.3	54.6	0	0	0	0	113	A916 I917 L918 H923 R924 L925 A929	A916-S920 VanDerWaalsContact O-CB 3.31Å; A916-S920 WeakPolarHBondContact O-CB 3.28Å; A916-S920 PolarHBondContact O-N 2.87Å; A916-S920 PolarHBondContact O-OG 3.21Å; I917-S920 PolarHBondContact O-OG 2.96Å; L918-S920 PolarHBondContact O-N 3.27Å; S920-H923 CarbonylContact O-C 3.54Å; S920-R924 PolarHBondContact O-N 2.92Å; S920-L925 PolarHBondContact O-N 2.97Å; S920-A929 WeakPolarHBondContact OG-CA 3.25Å; S920-A929 WeakPolarHBondContact OG-CB 3.45Å
921	V	86.2	Confident	89.6	Confident	41 Å²	41	45.1 Å²	45.1	25%	0.248	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-42.3	171.3	171.5	0	0	0	0	111.9	I917 L918 R924 A929 Y1246	I917-V921 WeakPolarHBondContact O-CG2 3.24Å; I917-V921 PolarHBondContact O-N 3.29Å; L918-V921 PolarHBondContact O-N 2.02Å; V921-R924 PolarHBondContact O-N 2.91Å; V921-R924 VanDerWaalsContact O-N 3.14Å; V921-A929 HydrophobicContact CG2-CB 3.74Å; V921-Y1246 HydrophobicContact CG1-CE2 3.92Å
922	I	81.2	Confident	89.8	Confident	18 Å²	18	40.4 Å²	40.4	9%	0.092	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-47.3	176.2	-63.7	155.2	0	0	0	110	L918 L919 R924 V1253	L918-I922 VanDerWaalsContact O-CD1 3.32Å; L918-I922 WeakPolarHBondContact O-CD1 3.44Å; L918-I922 VanDerWaalsContact O-CG1 3.22Å; L918-I922 WeakPolarHBondContact O-CG1 3.36Å; L918-I922 PolarHBondContact O-N 3.23Å; L919-I922 PolarHBondContact O-N 2.92Å; I922-R924 WeakPolarHBondContact O-CG 3.29Å; I922-R924 PolarHBondContact O-N 2.9Å; I922-R924 VanDerWaalsContact O-N 3.14Å; I922-V1253 HydrophobicContact CD1-CG1 3.39Å; I922-V1253 HydrophobicContact CG1-CG1 3.78Å; I922-V1253 HydrophobicContact CG2-CG1 4.4Å
923	H	82	Confident	90	Very high	32 Å²	32	41 Å²	41	15%	0.148	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-2.2	176.9	-67.7	-169.5	0	0	0	113.6	L919 S920 L925 P1142 W1143 P1144	L919-H923 VanDerWaalsContact O-CB 3.3Å; L919-H923 WeakPolarHBondContact O-CB 3.37Å; L919-H923 PolarHBondContact O-CD2 3.43Å; L919-H923 VanDerWaalsContact O-CG 3.25Å; L919-H923 PolarHBondContact O-N 3.49Å; S920-H923 CarbonylContact O-C 3.54Å; H923-L925 HydrophobicContact CB-CD1 3.81Å; H923-L925 HydrophobicContact CB-CG 3.99Å; H923-L925 PolarHBondContact O-N 3.46Å; H923-P1142 PolarHBondContact CE1-O 3.23Å; H923-P1142 PolarHBondContact ND1-O 2.92Å; H923-W1143 AromaticContact CE1-CD1 3.88Å; H923-P1144 HydrophobicContact CB-CG 3.76Å
924	R	83.1	Confident	90.2	Very high	96 Å²	96	43.9 Å²	43.9	36%	0.362	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	28.8	179.4	-45.5	179.7	-167.6	-174.4	2.7	113.2	S920 V921 I922 W926 D1254	S920-R924 PolarHBondContact O-N 2.92Å; V921-R924 PolarHBondContact O-N 2.91Å; V921-R924 VanDerWaalsContact O-N 3.14Å; I922-R924 WeakPolarHBondContact O-CG 3.29Å; I922-R924 PolarHBondContact O-N 2.9Å; I922-R924 VanDerWaalsContact O-N 3.14Å; R924-W926 VanDerWaalsContact O-CD1 3.22Å; R924-W926 PolarHBondContact O-N 3.46Å; R924-W926 PolarHBondContact O-NE1 2.9Å; R924-D1254 IonicContact NH2-OD2 3.16Å; R924-D1254 PolarHBondContact NH2-OD2 2.86Å; R924-D1254 VanDerWaalsContact NH2-OD2 3.16Å
925	L	87.4	Confident	90.3	Very high	11 Å²	11	41.3 Å²	41.3	6%	0.058	21%	0.207	C	C	.	.			trans	-90.7	72.6	177.7	-66.4	172.1	0	0	0	109.4	S920 H923 I927 P928 A929 L1141 P1142	S920-L925 PolarHBondContact O-N 2.97Å; H923-L925 HydrophobicContact CB-CD1 3.81Å; H923-L925 HydrophobicContact CB-CG 3.99Å; H923-L925 PolarHBondContact O-N 3.46Å; L925-I927 PolarHBondContact O-N 2.9Å; L925-P928 HydrophobicContact CB-CB 4.46Å; L925-P928 HydrophobicContact CB-CG 4.07Å; L925-P928 VanDerWaalsContact O-CD 3.31Å; L925-P928 WeakPolarHBondContact O-CD 3.44Å; L925-A929 PolarHBondContact O-N 3.03Å; L925-L1141 HydrophobicContact CD1-CD2 3.72Å; L925-P1142 HydrophobicContact CD1-CG 4.23Å
926	W	88.2	Confident	90.5	Very high	146 Å²	146	41 Å²	41	55%	0.553	20%	0.2	S	C	*	.	H	α-helix	trans	-60.5	-35.6	-170.1	-58.5	104.5	0	0	0	115.1	R924 A929 L930 Y1246	R924-W926 VanDerWaalsContact O-CD1 3.22Å; R924-W926 PolarHBondContact O-N 3.46Å; R924-W926 PolarHBondContact O-NE1 2.9Å; W926-A929 PolarHBondContact O-N 3.1Å; W926-L930 WeakPolarHBondContact O-CG 3.15Å; W926-L930 PolarHBondContact O-N 3.36Å; W926-Y1246 AromaticContact CH2-CZ 3.94Å; W926-Y1246 VanDerWaalsContact CH2-OH 3.28Å; W926-Y1246 WeakPolarHBondContact CH2-OH 3.41Å
927	I	91	Very high	90.6	Very high	64 Å²	64	45.3 Å²	45.3	33%	0.328	22%	0.223	S	C	.	.	H	α-helix	trans	-70.5	-49.9	-179.7	-68.8	176	0	0	0	111.3	L925 A929 L930 V931 I1025 F1042	L925-I927 PolarHBondContact O-N 2.9Å; I927-A929 VanDerWaalsContact C-N 3.32Å; I927-A929 PolarHBondContact O-N 3.42Å; I927-L930 PolarHBondContact O-N 3.4Å; I927-V931 WeakPolarHBondContact O-CG2 3.35Å; I927-V931 PolarHBondContact O-N 3.06Å; I927-I1025 HydrophobicContact CG2-CD1 4.05Å; I927-I1025 HydrophobicContact CG2-CG2 4.31Å; I927-F1042 HydrophobicContact CB-CE2 4.29Å; I927-F1042 HydrophobicContact CD1-CD2 3.76Å; I927-F1042 HydrophobicContact CD1-CE2 3.7Å; I927-F1042 HydrophobicContact CG2-CD2 4.09Å; I927-F1042 HydrophobicContact CG2-CE2 3.93Å; I927-F1042 HydrophobicContact CG2-CZ 4.29Å
928	P	92.7	Very high	90.5	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-51.9	-46	167	-29.1	33.8	0	0	0	113.6	L925 L930 V931 Y932 I1025 T1029	L925-P928 HydrophobicContact CB-CB 4.46Å; L925-P928 HydrophobicContact CB-CG 4.07Å; L925-P928 VanDerWaalsContact O-CD 3.31Å; L925-P928 WeakPolarHBondContact O-CD 3.44Å; P928-L930 VanDerWaalsContact C-N 3.31Å; P928-L930 PolarHBondContact O-N 3.09Å; P928-V931 PolarHBondContact O-N 3.17Å; P928-Y932 HydrophobicContact CB-CD2 4.28Å; P928-Y932 HydrophobicContact CB-CE2 3.78Å; P928-Y932 WeakPolarHBondContact O-CB 3.13Å; P928-Y932 WeakPolarHBondContact O-CD2 3.5Å; P928-Y932 PolarHBondContact O-N 3.07Å; P928-I1025 HydrophobicContact CB-CG2 4.2Å; P928-I1025 HydrophobicContact CG-CG2 3.76Å; P928-T1029 HydrophobicContact CG-CG2 3.63Å
929	A	92.9	Very high	90.7	Very high	13 Å²	13	41.3 Å²	41.3	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-40.9	179.5	0	0	0	0	0	112.9	S920 V921 L925 W926 I927 G933	S920-A929 WeakPolarHBondContact OG-CA 3.25Å; S920-A929 WeakPolarHBondContact OG-CB 3.45Å; V921-A929 HydrophobicContact CG2-CB 3.74Å; L925-A929 PolarHBondContact O-N 3.03Å; W926-A929 PolarHBondContact O-N 3.1Å; I927-A929 VanDerWaalsContact C-N 3.32Å; I927-A929 PolarHBondContact O-N 3.42Å; A929-G933 PolarHBondContact O-N 3.4Å
930	L	94.5	Very high	90.8	Very high	128 Å²	128	41 Å²	41	67%	0.67	20%	0.199	S	C	*	.	H	α-helix	trans	-68.3	-41.5	175.7	-73.9	169.2	0	0	0	112.5	W926 I927 P928 G933 Y934	W926-L930 WeakPolarHBondContact O-CG 3.15Å; W926-L930 PolarHBondContact O-N 3.36Å; I927-L930 PolarHBondContact O-N 3.4Å; P928-L930 VanDerWaalsContact C-N 3.31Å; P928-L930 PolarHBondContact O-N 3.09Å; L930-G933 PolarHBondContact O-N 2.84Å; L930-Y934 WeakPolarHBondContact O-CB 3.26Å; L930-Y934 PolarHBondContact O-N 3.08Å
931	V	95.1	Very high	90.7	Very high	14 Å²	14	43.3 Å²	43.3	9%	0.085	21%	0.212	C	C	.	.	H	α-helix	trans	-77	-38.7	-175.9	174.3	0	0	0	0	112.1	I927 P928 G933 Y934 T935 F1021 I1025	I927-V931 WeakPolarHBondContact O-CG2 3.35Å; I927-V931 PolarHBondContact O-N 3.06Å; P928-V931 PolarHBondContact O-N 3.17Å; V931-G933 VanDerWaalsContact C-N 3.34Å; V931-Y934 PolarHBondContact O-N 2.86Å; V931-T935 WeakPolarHBondContact O-CB 3.28Å; V931-T935 PolarHBondContact O-N 3.05Å; V931-T935 PolarHBondContact O-OG1 3.48Å; V931-F1021 HydrophobicContact CB-CD1 4.37Å; V931-F1021 HydrophobicContact CG1-CB 4.37Å; V931-F1021 HydrophobicContact CG1-CD1 3.58Å; V931-F1021 HydrophobicContact CG1-CE1 4.21Å; V931-F1021 HydrophobicContact CG1-CG 4.17Å; V931-F1021 HydrophobicContact CG2-CD1 3.78Å; V931-F1021 HydrophobicContact CG2-CE1 3.53Å; V931-F1021 HydrophobicContact CG2-CZ 4.48Å; V931-I1025 HydrophobicContact CB-CG1 4.38Å; V931-I1025 HydrophobicContact CG1-CG1 4.15Å; V931-I1025 HydrophobicContact CG2-CG1 4.16Å
932	Y	95.3	Very high	90.7	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-39.1	170.3	-56.5	-21.1	0	0	0	110.9	A916 P928 T935 F936 S1026 L1137 L1141	A916-Y932 HydrophobicContact CB-CD2 3.8Å; A916-Y932 HydrophobicContact CB-CE2 4.03Å; P928-Y932 HydrophobicContact CB-CD2 4.28Å; P928-Y932 HydrophobicContact CB-CE2 3.78Å; P928-Y932 WeakPolarHBondContact O-CB 3.13Å; P928-Y932 WeakPolarHBondContact O-CD2 3.5Å; P928-Y932 PolarHBondContact O-N 3.07Å; Y932-T935 PolarHBondContact O-N 3.33Å; Y932-F936 WeakPolarHBondContact O-CB 3.48Å; Y932-F936 PolarHBondContact O-N 2.66Å; Y932-S1026 PolarHBondContact OH-OG 3.23Å; Y932-L1137 HydrophobicContact CD1-CD1 4.34Å; Y932-L1137 HydrophobicContact CE1-CB 4.48Å; Y932-L1137 HydrophobicContact CE1-CD1 4.29Å; Y932-L1137 HydrophobicContact CE1-CD2 4.3Å; Y932-L1141 HydrophobicContact CE2-CD1 4.23Å; Y932-L1141 HydrophobicContact CE2-CD2 4.27Å; Y932-L1141 HydrophobicContact CE2-CG 4.45Å
933	G	95	Very high	90.7	Very high	23 Å²	23	41.8 Å²	41.8	24%	0.237	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-39.1	175.3	0	0	0	0	0	113.8	A929 L930 V931 L937	A929-G933 PolarHBondContact O-N 3.4Å; L930-G933 PolarHBondContact O-N 2.84Å; V931-G933 VanDerWaalsContact C-N 3.34Å; G933-L937 WeakPolarHBondContact O-CB 3.46Å; G933-L937 PolarHBondContact O-N 3.06Å; G933-L937 VanDerWaalsContact O-N 3.08Å
934	Y	95.6	Very high	90.6	Very high	66 Å²	66	41.9 Å²	41.9	26%	0.259	20%	0.202	S	C	.	.	H	α-helix	trans	-59.8	-48.7	170.8	173.3	-83.1	0	0	0	110.9	L930 V931 L937 F938 C1014 F1017	L930-Y934 WeakPolarHBondContact O-CB 3.26Å; L930-Y934 PolarHBondContact O-N 3.08Å; V931-Y934 PolarHBondContact O-N 2.86Å; Y934-L937 PolarHBondContact O-N 2.75Å; Y934-F938 HydrophobicContact CD1-CD2 4.15Å; Y934-F938 AromaticContact CD2-CD2 3.59Å; Y934-F938 HydrophobicContact CD2-CD2 3.59Å; Y934-F938 AromaticContact CD2-CE2 3.54Å; Y934-F938 HydrophobicContact CD2-CE2 3.54Å; Y934-F938 AromaticContact CE1-CD2 3.99Å; Y934-F938 HydrophobicContact CE1-CD2 3.99Å; Y934-F938 AromaticContact CE2-CD2 3.42Å; Y934-F938 HydrophobicContact CE2-CD2 3.42Å; Y934-F938 VanDerWaalsContact CE2-CD2 3.42Å; Y934-F938 AromaticContact CE2-CE2 3.3Å; Y934-F938 HydrophobicContact CE2-CE2 3.3Å; Y934-F938 HydrophobicContact CE2-CG 4.49Å; Y934-F938 HydrophobicContact CE2-CZ 4.29Å; Y934-F938 AromaticContact CG-CD2 3.94Å; Y934-F938 HydrophobicContact CG-CD2 3.94Å; Y934-F938 HydrophobicContact CG-CE2 4.33Å; Y934-F938 AromaticContact CZ-CD2 3.62Å; Y934-F938 AromaticContact CZ-CE2 3.93Å; Y934-F938 WeakPolarHBondContact O-CD2 3.44Å; Y934-F938 PolarHBondContact O-N 3.04Å; Y934-C1014 WeakPolarHBondContact CE1-O 3.04Å; Y934-C1014 WeakPolarHBondContact OH-CA 3.47Å; Y934-C1014 WeakPolarHBondContact OH-CB 3.02Å; Y934-C1014 PolarHBondContact OH-SG 3.23Å; Y934-F1017 AromaticContact CE1-CD1 3.88Å; Y934-F1017 HydrophobicContact CE1-CD1 3.88Å; Y934-F1017 HydrophobicContact CE1-CE1 4.48Å
935	T	94.9	Very high	90	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-50.4	-178.3	-54	0	0	0	0	111.1	F913 V931 Y932 L937 F938 S939 G1018 S1022	F913-T935 HydrophobicContact CE1-CG2 3.92Å; F913-T935 HydrophobicContact CZ-CG2 3.93Å; V931-T935 WeakPolarHBondContact O-CB 3.28Å; V931-T935 PolarHBondContact O-N 3.05Å; V931-T935 PolarHBondContact O-OG1 3.48Å; Y932-T935 PolarHBondContact O-N 3.33Å; T935-L937 VanDerWaalsContact C-N 3.33Å; T935-L937 PolarHBondContact O-N 2.9Å; T935-F938 PolarHBondContact O-N 2.85Å; T935-S939 WeakPolarHBondContact O-CB 3.12Å; T935-S939 PolarHBondContact O-N 2.99Å; T935-G1018 WeakPolarHBondContact OG1-CA 3.5Å; T935-G1018 PolarHBondContact OG1-O 2.8Å; T935-S1022 PolarHBondContact OG1-OG 3.09Å
936	F	94.6	Very high	89.1	Confident	50 Å²	50	39.2 Å²	39.2	22%	0.219	20%	0.195	C	C	.	.	H	α-helix	trans	-51.4	-49.8	173.1	164.5	-113	0	0	0	112.4	N910 F911 F913 I917 Y932 T940	N910-F936 HydrophobicContact CB-CD2 4.24Å; N910-F936 WeakPolarHBondContact O-CD2 3.21Å; F911-F936 AromaticContact CD2-CE2 3.99Å; F911-F936 HydrophobicContact CD2-CE2 3.99Å; F911-F936 HydrophobicContact CE2-CE2 4.14Å; F911-F936 HydrophobicContact CE2-CZ 4.39Å; F911-F936 HydrophobicContact CG-CE2 4.41Å; F913-F936 HydrophobicContact CB-CB 4.13Å; I917-F936 HydrophobicContact CD1-CB 3.93Å; I917-F936 HydrophobicContact CD1-CD1 4.38Å; I917-F936 HydrophobicContact CD1-CG 4.27Å; Y932-F936 WeakPolarHBondContact O-CB 3.48Å; Y932-F936 PolarHBondContact O-N 2.66Å; F936-T940 VanDerWaalsContact O-CB 3.24Å; F936-T940 WeakPolarHBondContact O-CB 3.48Å; F936-T940 PolarHBondContact O-N 2.85Å; F936-T940 VanDerWaalsContact O-N 3.1Å; F936-T940 PolarHBondContact O-OG1 2.9Å
937	L	93.6	Very high	87.5	Confident	90 Å²	90	33.1 Å²	33.1	47%	0.471	17%	0.174	S	C	.	.	H	α-helix	trans	-64.3	-51.8	-177.4	178.4	63.6	0	0	0	112	G933 Y934 T935 L941	G933-L937 WeakPolarHBondContact O-CB 3.46Å; G933-L937 PolarHBondContact O-N 3.06Å; G933-L937 VanDerWaalsContact O-N 3.08Å; Y934-L937 PolarHBondContact O-N 2.75Å; T935-L937 VanDerWaalsContact C-N 3.33Å; T935-L937 PolarHBondContact O-N 2.9Å; L937-L941 HydrophobicContact CD1-CD1 4.02Å; L937-L941 HydrophobicContact CD1-CG 4.49Å; L937-L941 HydrophobicContact CG-CD1 4.14Å; L937-L941 WeakPolarHBondContact O-CB 2.97Å; L937-L941 VanDerWaalsContact O-CG 3.29Å; L937-L941 WeakPolarHBondContact O-CG 3.38Å; L937-L941 PolarHBondContact O-N 2.8Å
938	F	92.5	Very high	85.2	Confident	40 Å²	40	31 Å²	31	18%	0.175	16%	0.163	C	C	.	.	H	α-helix	trans	-75.8	-33.2	-174.4	-78.3	-74	0	0	0	113.2	Y934 T935 L941 Y942 L1006 L1011 C1014	Y934-F938 HydrophobicContact CD1-CD2 4.15Å; Y934-F938 AromaticContact CD2-CD2 3.59Å; Y934-F938 HydrophobicContact CD2-CD2 3.59Å; Y934-F938 AromaticContact CD2-CE2 3.54Å; Y934-F938 HydrophobicContact CD2-CE2 3.54Å; Y934-F938 AromaticContact CE1-CD2 3.99Å; Y934-F938 HydrophobicContact CE1-CD2 3.99Å; Y934-F938 AromaticContact CE2-CD2 3.42Å; Y934-F938 HydrophobicContact CE2-CD2 3.42Å; Y934-F938 VanDerWaalsContact CE2-CD2 3.42Å; Y934-F938 AromaticContact CE2-CE2 3.3Å; Y934-F938 HydrophobicContact CE2-CE2 3.3Å; Y934-F938 HydrophobicContact CE2-CG 4.49Å; Y934-F938 HydrophobicContact CE2-CZ 4.29Å; Y934-F938 AromaticContact CG-CD2 3.94Å; Y934-F938 HydrophobicContact CG-CD2 3.94Å; Y934-F938 HydrophobicContact CG-CE2 4.33Å; Y934-F938 AromaticContact CZ-CD2 3.62Å; Y934-F938 AromaticContact CZ-CE2 3.93Å; Y934-F938 WeakPolarHBondContact O-CD2 3.44Å; Y934-F938 PolarHBondContact O-N 3.04Å; T935-F938 PolarHBondContact O-N 2.85Å; F938-L941 PolarHBondContact O-N 2.93Å; F938-Y942 VanDerWaalsContact O-CB 3.26Å; F938-Y942 WeakPolarHBondContact O-CB 3.3Å; F938-Y942 PolarHBondContact O-N 3.11Å; F938-L1006 HydrophobicContact CE1-CD1 4.28Å; F938-L1011 HydrophobicContact CD1-CD2 4.19Å; F938-C1014 HydrophobicContact CB-CB 3.67Å; F938-C1014 HydrophobicContact CD1-CB 3.5Å; F938-C1014 HydrophobicContact CD2-CB 4.27Å; F938-C1014 HydrophobicContact CE1-CB 4.21Å; F938-C1014 HydrophobicContact CG-CB 3.54Å
939	S	92	Very high	82.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67	-44.1	173.4	-163.1	0	0	0	0	111.7	N910 T935 L941 Y942 H943 D1015 H1130	N910-S939 PolarHBondContact ND2-OG 3.36Å; N910-S939 VanDerWaalsContact OD1-CB 3.23Å; N910-S939 WeakPolarHBondContact OD1-CB 3.39Å; N910-S939 PolarHBondContact OD1-OG 2.99Å; T935-S939 WeakPolarHBondContact O-CB 3.12Å; T935-S939 PolarHBondContact O-N 2.99Å; S939-L941 VanDerWaalsContact C-N 3.35Å; S939-L941 PolarHBondContact O-N 3Å; S939-Y942 PolarHBondContact O-N 2.92Å; S939-H943 PolarHBondContact O-CD2 2.79Å; S939-H943 PolarHBondContact O-N 3.1Å; S939-H943 PolarHBondContact OG-CD2 2.92Å; S939-H943 PolarHBondContact OG-NE2 3.09Å; S939-D1015 VanDerWaalsContact CA-OD1 3.26Å; S939-D1015 WeakPolarHBondContact CA-OD1 3.45Å; S939-D1015 WeakPolarHBondContact CB-OD1 3.29Å; S939-D1015 PolarHBondContact OG-OD1 3.08Å; S939-H1130 PolarHBondContact OG-CE1 2.87Å
940	T	90.3	Very high	79.7	Confident	21 Å²	21	36.7 Å²	36.7	13%	0.129	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-45.7	174	-55.5	0	0	0	0	111.1	A907 N910 F936 I944	A907-T940 HydrophobicContact CB-CG2 4.23Å; N910-T940 WeakPolarHBondContact CB-OG1 3.28Å; F936-T940 VanDerWaalsContact O-CB 3.24Å; F936-T940 WeakPolarHBondContact O-CB 3.48Å; F936-T940 PolarHBondContact O-N 2.85Å; F936-T940 VanDerWaalsContact O-N 3.1Å; F936-T940 PolarHBondContact O-OG1 2.9Å; T940-I944 HydrophobicContact CG2-CD1 4.05Å; T940-I944 WeakPolarHBondContact O-CB 3.04Å; T940-I944 WeakPolarHBondContact O-CD1 3.33Å; T940-I944 WeakPolarHBondContact O-CG1 3.03Å; T940-I944 PolarHBondContact O-N 2.85Å; T940-I944 VanDerWaalsContact O-N 3.12Å
941	L	87	Confident	76.7	Confident	50 Å²	50	34.5 Å²	34.5	26%	0.262	18%	0.184	S	C	.	.	H	α-helix	trans	-66	-38.8	176.7	-72.2	170.9	0	0	0	112.7	L937 F938 S939 C945 L1011	L937-L941 HydrophobicContact CD1-CD1 4.02Å; L937-L941 HydrophobicContact CD1-CG 4.49Å; L937-L941 HydrophobicContact CG-CD1 4.14Å; L937-L941 WeakPolarHBondContact O-CB 2.97Å; L937-L941 VanDerWaalsContact O-CG 3.29Å; L937-L941 WeakPolarHBondContact O-CG 3.38Å; L937-L941 PolarHBondContact O-N 2.8Å; F938-L941 PolarHBondContact O-N 2.93Å; S939-L941 VanDerWaalsContact C-N 3.35Å; S939-L941 PolarHBondContact O-N 3Å; L941-C945 PolarHBondContact O-N 3.39Å; L941-C945 PolarHBondContact O-SG 2.76Å; L941-L1011 HydrophobicContact CB-CD2 3.89Å
942	Y	85.2	Confident	73.5	Confident	24 Å²	24	37.1 Å²	37.1	9%	0.094	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-50.7	177.5	173.7	-115	0	0	0	111.6	F938 S939 I944 C945 D946 V1008 L1011 S1012 D1015	F938-Y942 VanDerWaalsContact O-CB 3.26Å; F938-Y942 WeakPolarHBondContact O-CB 3.3Å; F938-Y942 PolarHBondContact O-N 3.11Å; S939-Y942 PolarHBondContact O-N 2.92Å; Y942-I944 VanDerWaalsContact C-N 3.34Å; Y942-I944 PolarHBondContact O-N 2.6Å; Y942-C945 CarbonylContact O-C 3.44Å; Y942-C945 WeakPolarHBondContact O-CA 3.28Å; Y942-C945 WeakPolarHBondContact O-CB 3.08Å; Y942-C945 PolarHBondContact O-N 3.37Å; Y942-D946 HydrophobicContact CE1-CB 4.28Å; Y942-D946 HydrophobicContact CE2-CB 4.01Å; Y942-D946 VanDerWaalsContact CZ-OD2 3.23Å; Y942-D946 PolarHBondContact O-N 3.46Å; Y942-D946 PolarHBondContact OH-OD2 2.99Å; Y942-V1008 HydrophobicContact CD2-CG1 4.39Å; Y942-V1008 HydrophobicContact CE2-CG1 3.9Å; Y942-L1011 HydrophobicContact CD2-CB 3.87Å; Y942-L1011 HydrophobicContact CG-CB 4.43Å; Y942-S1012 VanDerWaalsContact CE2-CB 3.43Å; Y942-D1015 HydrophobicContact CD1-CB 4.02Å; Y942-D1015 HydrophobicContact CG-CB 4.11Å
943	H	82.8	Confident	70.4	Confident	3 Å²	3	40.5 Å²	40.5	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-72.8	-23.9	-176.6	-69.2	-51.5	0	0	0	114.3	L906 S939 C945 T947 H1126 H1130	L906-H943 HydrophobicContact CB-CB 4.03Å; L906-H943 HydrophobicContact CD2-CB 3.9Å; L906-H943 WeakPolarHBondContact CD2-ND1 3.5Å; L906-H943 HydrophobicContact CG-CB 3.86Å; S939-H943 PolarHBondContact O-CD2 2.79Å; S939-H943 PolarHBondContact O-N 3.1Å; S939-H943 PolarHBondContact OG-CD2 2.92Å; S939-H943 PolarHBondContact OG-NE2 3.09Å; H943-C945 PolarHBondContact O-N 2.75Å; H943-T947 PolarHBondContact O-OG1 3.02Å; H943-H1126 AromaticContact CE1-CD2 3.72Å; H943-H1126 AromaticContact CE1-NE2 3.24Å; H943-H1126 PolarHBondContact CE1-NE2 2.9Å; H943-H1126 AromaticContact NE2-NE2 3.55Å; H943-H1130 AromaticContact CD2-CE1 3.78Å; H943-H1130 AromaticContact CD2-NE2 2.97Å; H943-H1130 PolarHBondContact CD2-NE2 2.86Å; H943-H1130 AromaticContact CE1-NE2 2.84Å; H943-H1130 PolarHBondContact CE1-NE2 2.84Å; H943-H1130 AromaticContact CG-NE2 3.82Å; H943-H1130 AromaticContact ND1-NE2 3.75Å; H943-H1130 AromaticContact NE2-CE1 3.06Å; H943-H1130 PolarHBondContact NE2-CE1 3.25Å; H943-H1130 AromaticContact NE2-NE2 2.17Å; H943-H1130 PolarHBondContact NE2-NE2 2.78Å
944	I	78.5	Confident	67.2	Low	34 Å²	34	40.7 Å²	40.7	17%	0.174	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-37.1	164	-78.3	171.9	0	0	0	110.9	L899 A907 T940 Y942 T947 I1003	L899-I944 HydrophobicContact CD1-CG2 4.15Å; L899-I944 HydrophobicContact CD2-CG1 4.42Å; A907-I944 HydrophobicContact CB-CD1 4.23Å; A907-I944 HydrophobicContact CB-CG1 3.64Å; T940-I944 HydrophobicContact CG2-CD1 4.05Å; T940-I944 WeakPolarHBondContact O-CB 3.04Å; T940-I944 WeakPolarHBondContact O-CD1 3.33Å; T940-I944 WeakPolarHBondContact O-CG1 3.03Å; T940-I944 PolarHBondContact O-N 2.85Å; T940-I944 VanDerWaalsContact O-N 3.12Å; Y942-I944 VanDerWaalsContact C-N 3.34Å; Y942-I944 PolarHBondContact O-N 2.6Å; I944-T947 PolarHBondContact O-OG1 2.8Å; I944-I1003 HydrophobicContact CG2-CG2 3.45Å; I944-I1003 VanDerWaalsContact CG2-CG2 3.45Å
945	C	71.9	Confident	63.9	Low	3 Å²	3	45.9 Å²	45.9	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-90	-42.7	-171.8	-69.7	0	0	0	0	114.8	L941 Y942 H943 T947 D948 S949 C1004 V1008 L1011	L941-C945 PolarHBondContact O-N 3.39Å; L941-C945 PolarHBondContact O-SG 2.76Å; Y942-C945 CarbonylContact O-C 3.44Å; Y942-C945 WeakPolarHBondContact O-CA 3.28Å; Y942-C945 WeakPolarHBondContact O-CB 3.08Å; Y942-C945 PolarHBondContact O-N 3.37Å; H943-C945 PolarHBondContact O-N 2.75Å; C945-T947 VanDerWaalsContact C-N 3.31Å; C945-T947 PolarHBondContact O-N 2.83Å; C945-D948 WeakPolarHBondContact O-CB 3.48Å; C945-D948 PolarHBondContact O-N 2.75Å; C945-D948 VanDerWaalsContact O-N 3.1Å; C945-S949 PolarHBondContact O-N 3Å; C945-S949 PolarHBondContact O-OG 2.84Å; C945-C1004 WeakPolarHBondContact CA-SG 3.41Å; C945-C1004 HydrophobicContact CB-CB 4.14Å; C945-C1004 WeakPolarHBondContact CB-SG 3.41Å; C945-C1004 WeakPolarHBondContact SG-CB 3.4Å; C945-C1004 CovalentContact SG-SG 2.02Å; C945-C1004 PolarHBondContact SG-SG 3.21Å; C945-V1008 HydrophobicContact CB-CG2 4.31Å; C945-L1011 HydrophobicContact CB-CD1 3.97Å; C945-L1011 VanDerWaalsContact SG-CD1 3.58Å
946	D	67.3	Low	60.6	Low	47 Å²	47	52 Å²	52	25%	0.251	28%	0.275	S	S	.	.	H	α-helix	trans	-55.7	-46.5	-177.9	-169.2	6.5	0	0	0	111.4	Y942 D948 S949 N950	Y942-D946 HydrophobicContact CE1-CB 4.28Å; Y942-D946 HydrophobicContact CE2-CB 4.01Å; Y942-D946 VanDerWaalsContact CZ-OD2 3.23Å; Y942-D946 PolarHBondContact O-N 3.46Å; Y942-D946 PolarHBondContact OH-OD2 2.99Å; D946-D948 PolarHBondContact O-N 3.35Å; D946-S949 WeakPolarHBondContact CA-OG 3.35Å; D946-S949 PolarHBondContact O-N 2.91Å; D946-S949 PolarHBondContact O-OG 2.82Å; D946-N950 PolarHBondContact O-ND2 3.12Å
947	T	54.7	Low	57.2	Low	19 Å²	19	55 Å²	55	12%	0.117	30%	0.297	C	S	.	.	H	α-helix	trans	-68.4	-32.6	176.8	47.8	0	0	0	0	113.8	A903 L906 H943 I944 C945 N950 L951	A903-T947 WeakPolarHBondContact CA-OG1 3.36Å; A903-T947 HydrophobicContact CB-CG2 4.27Å; A903-T947 WeakPolarHBondContact CB-OG1 3.39Å; L906-T947 HydrophobicContact CD2-CG2 4.22Å; H943-T947 PolarHBondContact O-OG1 3.02Å; I944-T947 PolarHBondContact O-OG1 2.8Å; C945-T947 VanDerWaalsContact C-N 3.31Å; C945-T947 PolarHBondContact O-N 2.83Å; T947-N950 PolarHBondContact O-N 3.1Å; T947-L951 WeakPolarHBondContact O-CD1 3.33Å
948	D	43.8	Very low	53.9	Low	19 Å²	19	57.1 Å²	57.1	10%	0.102	31%	0.305	C	S	.	.	H	α-helix	trans	-71.1	-35.5	177.2	-105.5	17.7	0	0	0	111.9	C945 D946 N950 L951 I952 S1001 I1003	C945-D948 WeakPolarHBondContact O-CB 3.48Å; C945-D948 PolarHBondContact O-N 2.75Å; C945-D948 VanDerWaalsContact O-N 3.1Å; D946-D948 PolarHBondContact O-N 3.35Å; D948-N950 PolarHBondContact O-N 3.01Å; D948-N950 VanDerWaalsContact O-N 3.14Å; D948-L951 PolarHBondContact O-N 2.56Å; D948-I952 PolarHBondContact O-N 3.39Å; D948-S1001 WeakPolarHBondContact OD2-CB 3.3Å; D948-S1001 PolarHBondContact OD2-OG 3.35Å; D948-I1003 VanDerWaalsContact OD2-CD1 3.28Å; D948-I1003 WeakPolarHBondContact OD2-CD1 3.45Å
949	S	35.7	Very low	50.8	Low	50 Å²	50	59.3 Å²	59.3	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-57.1	-27.3	172.5	6.9	0	0	0	0	112.7	C945 D946	C945-S949 PolarHBondContact O-N 3Å; C945-S949 PolarHBondContact O-OG 2.84Å; D946-S949 WeakPolarHBondContact CA-OG 3.35Å; D946-S949 PolarHBondContact O-N 2.91Å; D946-S949 PolarHBondContact O-OG 2.82Å
950	N	32.9	Very low	47.4	Very low	86 Å²	86	65.3 Å²	65.3	46%	0.46	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-6	177.5	-65.6	-66.1	0	0	0	113.8	D946 T947 D948 I952	D946-N950 PolarHBondContact O-ND2 3.12Å; T947-N950 PolarHBondContact O-N 3.1Å; D948-N950 PolarHBondContact O-N 3.01Å; D948-N950 VanDerWaalsContact O-N 3.14Å; N950-I952 CarbonylContact C-O 3.59Å
951	L	32	Very low	44.5	Very low	82 Å²	82	67.4 Å²	67.4	43%	0.429	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-4.6	175.2	-91.6	86.2	0	0	0	114.5	T947 D948 Y955	T947-L951 WeakPolarHBondContact O-CD1 3.33Å; D948-L951 PolarHBondContact O-N 2.56Å; L951-Y955 HydrophobicContact CG-CE2 4.45Å
952	I	29	Very low	41.5	Very low	69 Å²	69	71.7 Å²	71.7	35%	0.354	39%	0.39	S	S	.	.	S	Bend	trans	-54.7	136.6	143.5	-63.5	174.9	0	0	0	106.2	A869 D948 N950 G954	A869-I952 HydrophobicContact CB-CG2 3.78Å; D948-I952 PolarHBondContact O-N 3.39Å; N950-I952 CarbonylContact C-O 3.59Å; I952-G954 PolarHBondContact O-N 2.81Å
953	P	29.3	Very low	38.6	Very low	72 Å²	72	80.1 Å²	80.1	47%	0.468	42%	0.423	S	S	.	.	S	Bend	trans	-69.4	58.4	-173	25.4	-35.6	0	0	0	116.1	C870 Y955	C870-P953 HydrophobicContact CB-CG 4.46Å; P953-Y955 VanDerWaalsContact C-N 3.33Å
954	G	27.7	Very low	35.9	Very low	28 Å²	28	85.1 Å²	85.1	29%	0.289	45%	0.454	S	S	.	.			trans	-95.4	35.7	160.2	0	0	0	0	0	112.1	I952 N956 V957	I952-G954 PolarHBondContact O-N 2.81Å; G954-N956 PolarHBondContact O-N 3.13Å; G954-V957 PolarHBondContact O-N 2.91Å
955	Y	25.6	Very low	33.3	Very low	174 Å²	174	88.8 Å²	88.8	68%	0.682	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	70	169.5	-92.7	-80.3	0	0	0	110.8	L951 P953	L951-Y955 HydrophobicContact CG-CE2 4.45Å; P953-Y955 VanDerWaalsContact C-N 3.33Å
956	N	25.4	Very low	31.1	Very low	132 Å²	132	93.3 Å²	93.3	71%	0.706	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-170.2	23.4	160.6	-96.4	-27	0	0	0	113	G954 M958	G954-N956 PolarHBondContact O-N 3.13Å; N956-M958 PolarHBondContact O-N 3.48Å
957	V	25	Very low	29.1	Very low	113 Å²	113	96.1 Å²	96.1	69%	0.685	54%	0.538	S	S	*	.			trans	-76	68.8	166	-173.5	0	0	0	0	109.5	G954 H959	G954-V957 PolarHBondContact O-N 2.91Å; V957-H959 PolarHBondContact O-N 2.96Å
958	M	24.1	Very low	27.6	Very low	133 Å²	133	100.4 Å²	100.4	66%	0.655	57%	0.568	S	S	*	*			trans	-89.6	93.6	-175.9	-168.9	169.5	173.3	0	0	111.8	R31 N956	R31-M958 PolarHBondContact NH1-O 3.3Å; R31-M958 PolarHBondContact NH2-O 2.81Å; R31-M958 VanDerWaalsContact NH2-O 3.14Å; N956-M958 PolarHBondContact O-N 3.48Å
959	H	26.5	Very low	26.7	Very low	86 Å²	86	104.5 Å²	104.5	40%	0.398	60%	0.598	S	S	.	*			trans	65.9	107.7	177.6	-63.9	-132.9	0	0	0	115.7	R31 V957 P961 T1119	R31-H959 PolarHBondContact NH2-O 3.21Å; V957-H959 PolarHBondContact O-N 2.96Å; H959-P961 VanDerWaalsContact O-CD 3.26Å; H959-P961 WeakPolarHBondContact O-CD 3.42Å; H959-T1119 WeakPolarHBondContact CE1-CG2 3.33Å; H959-T1119 PolarHBondContact CE1-OG1 2.76Å; H959-T1119 PolarHBondContact NE2-OG1 2.68Å
960	T	21.7	Very low	26.1	Very low	127 Å²	127	109.7 Å²	109.7	78%	0.779	62%	0.619	S	S	*	*			trans	-82.6	100.6	134.2	48.3	0	0	0	0	108.5
961	P	27.6	Very low	25.6	Very low	64 Å²	64	113.3 Å²	113.3	42%	0.416	63%	0.631	S	S	.	*			trans	-72.1	132.4	168.3	30.9	-31.8	0	0	0	109.1	H959	H959-P961 VanDerWaalsContact O-CD 3.26Å; H959-P961 WeakPolarHBondContact O-CD 3.42Å
962	N	24.9	Very low	25.2	Very low	141 Å²	141	119.1 Å²	119.1	75%	0.754	65%	0.649	S	S	*	*			trans	-62.6	167.1	168.5	-85	-39.5	0	0	0	111.3	V964	N962-V964 PolarHBondContact O-N 3.44Å; N962-V964 VanDerWaalsContact O-N 3.1Å
963	Y	24.2	Very low	24.8	Very low	200 Å²	200	123.5 Å²	123.5	78%	0.784	67%	0.668	S	S	*	*			trans	-43.7	117.3	159	-85.8	-108.1	0	0	0	110.5	H27	H27-Y963 PolarHBondContact CD2-OH 3.29Å; H27-Y963 VanDerWaalsContact CD2-OH 3.29Å
964	V	25.9	Very low	24.5	Very low	108 Å²	108	124.1 Å²	124.1	66%	0.655	67%	0.673	S	S	*	*			trans	-115.9	100.7	166.2	177.9	0	0	0	0	108.3	N962 S966	N962-V964 PolarHBondContact O-N 3.44Å; N962-V964 VanDerWaalsContact O-N 3.1Å; V964-S966 VanDerWaalsContact C-N 3.29Å; V964-S966 PolarHBondContact O-N 2.92Å
965	S	25.3	Very low	24.2	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	69%	0.691	S	S	*	*			trans	-68.9	89.6	161.4	52.1	0	0	0	0	109.3
966	S	23.9	Very low	24.1	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	70%	0.695	S	S	*	*			trans	41	104.7	152.2	58.5	0	0	0	0	118.9	V964	V964-S966 VanDerWaalsContact C-N 3.29Å; V964-S966 PolarHBondContact O-N 2.92Å
967	S	25.4	Very low	24.1	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	70%	0.701	S	S	*	*				-171.6	121.8	127.5	-81.7	0	0	0	0	113.8
968	S	24	Very low	24	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	71%	0.707	S	S	*	*			trans	58.2	112.2	140.4	-51.3	0	0	0	0	123.7
969	S	24.5	Very low	24	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	72%	0.718	S	S	*	*				77.1	111.9	126.1	60.8	0	0	0	0	124.6
970	M	24.2	Very low	23.8	Very low	160 Å²	160	135 Å²	135	79%	0.788	74%	0.737	S	S	*	*			trans	88.4	112.7	130.1	-65.8	-173.4	71.9	0	0	123.6
971	F	21.4	Very low	23.9	Very low	161 Å²	161	137.7 Å²	137.7	71%	0.706	74%	0.743	S	S	*	*			trans	24.6	131.4	135.3	-57.1	-83.6	0	0	0	121.7
972	Y	23.2	Very low	23.6	Very low	205 Å²	205	141.6 Å²	141.6	80%	0.804	76%	0.76	S	S	*	*				-172.8	175.4	99.7	-117.1	-93.8	0	0	0	114.8
973	Q	21.4	Very low	23.6	Very low	161 Å²	161	143 Å²	143	75%	0.752	77%	0.766	S	S	*	*			trans	-63.8	171.5	175.9	-84.1	164	-76.2	0	0	115.2
974	S	22.8	Very low	23.6	Very low	84 Å²	84	138.2 Å²	138.2	59%	0.587	76%	0.759	S	S	*	*			cis	-168.1	171.7	-2.7	41.6	0	0	0	0	113.5
975	T	22	Very low	23.5	Very low	107 Å²	107	139 Å²	139	66%	0.656	77%	0.765	S	S	*	*			trans	38.8	129.9	143.3	55	0	0	0	0	123.5
976	D	22	Very low	23.3	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	77%	0.765	S	S	*	*			trans	53	129.7	132.4	-49.3	-28.1	0	0	0	123.1
977	I	26.4	Very low	23.4	Very low	161 Å²	161	140.6 Å²	140.6	83%	0.826	78%	0.775	S	S	*	*				-165.2	135.2	120.8	-96	150.6	0	0	0	108.2	F979	I977-F979 HydrophobicContact CG2-CD2 4.4Å
978	A	21.8	Very low	23.3	Very low	99 Å²	99	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	-116	140.8	172.3	0	0	0	0	0	110.2
979	F	26	Very low	23.4	Very low	202 Å²	202	142 Å²	142	89%	0.886	79%	0.785	S	S	*	*			trans	-124	157.9	176	-120.9	-92.2	0	0	0	112.5	I977	I977-F979 HydrophobicContact CG2-CD2 4.4Å
980	K	20.4	Very low	23.3	Very low	182 Å²	182	142.1 Å²	142.1	79%	0.791	79%	0.786	S	S	*	*			trans	-146.3	118.6	-146.7	168.7	-166.2	175.4	-173	0	111.5
981	M	24.6	Very low	23.2	Very low	183 Å²	183	139.5 Å²	139.5	90%	0.901	78%	0.784	S	S	*	*			trans	-147	151.6	164.8	-74.4	-160	174.8	0	0	112.4
982	N	22	Very low	23.4	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	79%	0.791	S	S	*	*			trans	-124.5	155.7	176	-68.1	-30.2	0	0	0	109.1
983	I	23.7	Very low	23.3	Very low	170 Å²	170	137.1 Å²	137.1	87%	0.872	79%	0.792	S	S	*	*			trans	167.5	151.6	137.2	-90	158.7	0	0	0	110.1
984	P	25.5	Very low	23.4	Very low	100 Å²	100	139.6 Å²	139.6	65%	0.649	80%	0.796	S	S	*	*			trans	-131.4	-179.6	-144.9	41.9	-25.8	0	0	0	118.5
985	T	23.6	Very low	23.4	Very low	126 Å²	126	142.6 Å²	142.6	77%	0.773	80%	0.804	S	S	*	*			trans	83.8	134.7	149.2	34	0	0	0	0	123.5
986	S	21.5	Very low	23.5	Very low	112 Å²	112	145 Å²	145	78%	0.783	81%	0.808	S	S	*	*			trans	63.4	115.9	147.8	60.7	0	0	0	0	121.8
987	S	25.6	Very low	23.6	Very low	129 Å²	129	142.7 Å²	142.7	90%	0.902	80%	0.803	S	S	*	*				-166.5	168.3	107.8	48	0	0	0	0	111.4
988	S	21.7	Very low	23.6	Very low	116 Å²	116	140.9 Å²	140.9	81%	0.811	79%	0.79	S	S	*	*			trans	-107.3	142.1	-170.3	54.9	0	0	0	0	113.5
989	S	26.9	Very low	23.7	Very low	129 Å²	129	142.6 Å²	142.6	90%	0.902	78%	0.78	S	S	*	*			trans	-152	157.8	147.4	52.3	0	0	0	0	110.3
990	S	22	Very low	23.8	Very low	108 Å²	108	135 Å²	135	76%	0.755	75%	0.75	S	S	*	*			trans	-119.7	167.3	-163.3	55.2	0	0	0	0	113.1
991	S	23.3	Very low	24.6	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	72%	0.721	S	S	*	*			trans	61.6	97.5	161.9	62.2	0	0	0	0	118.7
992	K	24.3	Very low	25.3	Very low	199 Å²	199	125 Å²	125	87%	0.865	72%	0.721	S	S	*	*				-158.7	141.4	102.9	-102	157	-173.2	173.3	0	111
993	S	22.4	Very low	26.8	Very low	118 Å²	118	120.9 Å²	120.9	83%	0.825	70%	0.698	S	S	*	*			trans	-86.9	113.7	-171.1	49.8	0	0	0	0	112.1
994	Y	22.3	Very low	28.4	Very low	213 Å²	213	113.2 Å²	113.2	84%	0.835	66%	0.66	S	S	*	*			trans	-132.6	114.8	163.3	-80.1	-83.6	0	0	0	109
995	I	23.9	Very low	30.3	Very low	146 Å²	146	113.7 Å²	113.7	75%	0.749	66%	0.66	S	S	*	*			trans	-138.9	95.7	155.8	-57.5	-177.9	0	0	0	106.5
996	H	23.4	Very low	32.2	Very low	159 Å²	159	110.7 Å²	110.7	74%	0.736	64%	0.639	S	S	*	*			trans	-103	93.4	166.7	-161.4	-54.3	0	0	0	106.5	Q998	H996-Q998 PolarHBondContact O-N 3.1Å; H996-Q998 VanDerWaalsContact O-N 3.08Å
997	S	24.4	Very low	34.2	Very low	95 Å²	95	108.7 Å²	108.7	66%	0.664	62%	0.624	S	S	*	*			trans	-76.4	97.3	-174.2	55.8	0	0	0	0	111.2
998	Q	25.3	Very low	36.3	Very low	122 Å²	122	104.8 Å²	104.8	57%	0.57	59%	0.594	S	S	*	*			trans	-106.2	156	163.8	-72.8	-177.8	-23.2	0	0	109.7	H996 T1000	H996-Q998 PolarHBondContact O-N 3.1Å; H996-Q998 VanDerWaalsContact O-N 3.08Å; Q998-T1000 PolarHBondContact O-N 2.67Å
999	F	25.5	Very low	38.5	Very low	136 Å²	136	103 Å²	103	60%	0.596	58%	0.575	S	S	*	*	S	Bend	trans	-79.5	66	174.2	-91	-88.9	0	0	0	111	H775 I854 I856	H775-F999 AromaticContact CE1-CD2 3.63Å; H775-F999 AromaticContact CE1-CE2 3.68Å; H775-F999 AromaticContact NE2-CD2 3.5Å; H775-F999 AromaticContact NE2-CG 3.93Å; I854-F999 HydrophobicContact CG2-CE1 4.01Å; I854-F999 HydrophobicContact CG2-CZ 3.92Å; I856-F999 HydrophobicContact CG2-CE1 3.92Å
1000	T	28	Very low	41.1	Very low	42 Å²	42	99.8 Å²	99.8	26%	0.258	55%	0.551	S	S	.	*	S	Bend	trans	-126.7	171.2	165	51.3	0	0	0	0	107	Q998 C1004	Q998-T1000 PolarHBondContact O-N 2.67Å; T1000-C1004 VanDerWaalsContact CB-O 3.22Å; T1000-C1004 WeakPolarHBondContact CB-O 3.35Å; T1000-C1004 HydrophobicContact CG2-CB 4.37Å; T1000-C1004 PolarHBondContact OG1-O 3.1Å
1001	S	36.4	Very low	44	Very low	27 Å²	27	94.8 Å²	94.8	19%	0.189	52%	0.515	C	S	.	.			trans	-60.9	156.8	160.1	100.2	0	0	0	0	108.4	D948 I1003 C1004	D948-S1001 WeakPolarHBondContact OD2-CB 3.3Å; D948-S1001 PolarHBondContact OD2-OG 3.35Å; S1001-I1003 PolarHBondContact O-N 2.84Å; S1001-I1003 PolarHBondContact OG-N 3.37Å; S1001-C1004 PolarHBondContact O-N 3.08Å; S1001-C1004 PolarHBondContact OG-SG 2.86Å
1002	S	39.5	Very low	46.9	Very low	128 Å²	128	90 Å²	90	90%	0.895	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-3.3	-179.6	48.2	0	0	0	0	114.5
1003	I	53.3	Low	50	Low	60 Å²	60	82.6 Å²	82.6	31%	0.308	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-17.8	174	-66.8	107.3	0	0	0	112.2	I898 L899 I944 D948 S1001	I898-I1003 HydrophobicContact CG2-CD1 4.08Å; I898-I1003 HydrophobicContact CG2-CG1 4.24Å; I898-I1003 VanDerWaalsContact O-CD1 3.26Å; I898-I1003 WeakPolarHBondContact O-CD1 3.5Å; L899-I1003 HydrophobicContact CD1-CD1 4.44Å; L899-I1003 HydrophobicContact CD1-CG2 4.24Å; I944-I1003 HydrophobicContact CG2-CG2 3.45Å; I944-I1003 VanDerWaalsContact CG2-CG2 3.45Å; D948-I1003 VanDerWaalsContact OD2-CD1 3.28Å; D948-I1003 WeakPolarHBondContact OD2-CD1 3.45Å; S1001-I1003 PolarHBondContact O-N 2.84Å; S1001-I1003 PolarHBondContact OG-N 3.37Å
1004	C	57.7	Low	53.3	Low	9 Å²	9	77.7 Å²	77.7	6%	0.061	42%	0.415	C	S	.	.			trans	-96.1	120.6	-163.8	-73	0	0	0	0	114.2	C945 T1000 S1001	C945-C1004 WeakPolarHBondContact CA-SG 3.41Å; C945-C1004 HydrophobicContact CB-CB 4.14Å; C945-C1004 WeakPolarHBondContact CB-SG 3.41Å; C945-C1004 WeakPolarHBondContact SG-CB 3.4Å; C945-C1004 CovalentContact SG-SG 2.02Å; C945-C1004 PolarHBondContact SG-SG 3.21Å; T1000-C1004 VanDerWaalsContact CB-O 3.22Å; T1000-C1004 WeakPolarHBondContact CB-O 3.35Å; T1000-C1004 HydrophobicContact CG2-CB 4.37Å; T1000-C1004 PolarHBondContact OG1-O 3.1Å; S1001-C1004 PolarHBondContact O-N 3.08Å; S1001-C1004 PolarHBondContact OG-SG 2.86Å
1005	V	64.9	Low	56.5	Low	109 Å²	109	68 Å²	68	66%	0.661	38%	0.378	S	S	*	.	S	Bend	trans	-83.6	-19.3	-171.2	-174.8	0	0	0	0	113.3
1006	L	64.4	Low	59.7	Low	64 Å²	64	63.9 Å²	63.9	34%	0.335	36%	0.355	S	S	.	.	S	Bend	trans	-141	159.2	-175.8	-74.7	170.3	0	0	0	110.3	F938 L1011	F938-L1006 HydrophobicContact CE1-CD1 4.28Å; L1006-L1011 HydrophobicContact CB-CD1 4.22Å; L1006-L1011 HydrophobicContact CB-CD2 4Å; L1006-L1011 HydrophobicContact CB-CG 3.86Å; L1006-L1011 HydrophobicContact CD1-CD2 4Å
1007	P	63.3	Low	63	Low	70 Å²	70	57.3 Å²	57.3	46%	0.455	32%	0.324	S	S	.	.			trans	-58.5	138.8	173	-22.1	33.5	0	0	0	111.7	D1009 T1010 L1011	P1007-D1009 PolarHBondContact O-N 2.85Å; P1007-T1010 WeakPolarHBondContact O-CB 3.41Å; P1007-T1010 PolarHBondContact O-N 3.07Å; P1007-L1011 PolarHBondContact O-N 2.82Å
1008	V	69.8	Low	66.3	Low	46 Å²	46	52.8 Å²	52.8	28%	0.279	29%	0.292	S	S	.	.	H	α-helix	trans	-58	-38.1	-177.4	-173.9	0	0	0	0	111.6	Y942 C945 T1010 L1011 S1012	Y942-V1008 HydrophobicContact CD2-CG1 4.39Å; Y942-V1008 HydrophobicContact CE2-CG1 3.9Å; C945-V1008 HydrophobicContact CB-CG2 4.31Å; V1008-T1010 VanDerWaalsContact C-N 3.34Å; V1008-T1010 PolarHBondContact O-N 2.93Å; V1008-L1011 PolarHBondContact O-N 2.82Å; V1008-S1012 WeakPolarHBondContact O-CB 3.43Å; V1008-S1012 PolarHBondContact O-N 2.94Å
1009	D	68	Low	69.4	Low	78 Å²	78	48 Å²	48	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-57.1	-43.8	173.7	-107.9	-53.6	0	0	0	112.9	P1007 S1012 F1013 R1057	P1007-D1009 PolarHBondContact O-N 2.85Å; D1009-S1012 PolarHBondContact O-N 3.3Å; D1009-S1012 PolarHBondContact O-OG 2.03Å; D1009-F1013 PolarHBondContact O-N 3.1Å; D1009-F1013 VanDerWaalsContact O-N 3.11Å; D1009-R1057 IonicContact OD1-CZ 2.69Å; D1009-R1057 VanDerWaalsContact OD1-CZ 3.24Å; D1009-R1057 IonicContact OD1-NH1 2.85Å; D1009-R1057 PolarHBondContact OD1-NH1 2.99Å; D1009-R1057 IonicContact OD1-NH2 3.7Å; D1009-R1057 PolarHBondContact OD1-NH2 3.44Å
1010	T	81.1	Confident	72.6	Confident	63 Å²	63	42 Å²	42	39%	0.387	25%	0.25	S	C	.	.	H	α-helix	trans	-69.3	-40.6	177.9	-50.8	0	0	0	0	111.4	P1007 V1008 F1013 C1014	P1007-T1010 WeakPolarHBondContact O-CB 3.41Å; P1007-T1010 PolarHBondContact O-N 3.07Å; V1008-T1010 VanDerWaalsContact C-N 3.34Å; V1008-T1010 PolarHBondContact O-N 2.93Å; T1010-F1013 PolarHBondContact O-N 2.92Å; T1010-C1014 PolarHBondContact O-N 3.22Å; T1010-C1014 VanDerWaalsContact O-N 3.1Å; T1010-C1014 PolarHBondContact O-SG 3.3Å; T1010-C1014 VanDerWaalsContact O-SG 3.37Å
1011	L	83	Confident	75.8	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-43	175.4	-71.3	171.5	0	0	0	111.5	F938 L941 Y942 C945 L1006 P1007 V1008 F1013 C1014 D1015	F938-L1011 HydrophobicContact CD1-CD2 4.19Å; L941-L1011 HydrophobicContact CB-CD2 3.89Å; Y942-L1011 HydrophobicContact CD2-CB 3.87Å; Y942-L1011 HydrophobicContact CG-CB 4.43Å; C945-L1011 HydrophobicContact CB-CD1 3.97Å; C945-L1011 VanDerWaalsContact SG-CD1 3.58Å; L1006-L1011 HydrophobicContact CB-CD1 4.22Å; L1006-L1011 HydrophobicContact CB-CD2 4Å; L1006-L1011 HydrophobicContact CB-CG 3.86Å; L1006-L1011 HydrophobicContact CD1-CD2 4Å; P1007-L1011 PolarHBondContact O-N 2.82Å; V1008-L1011 PolarHBondContact O-N 2.82Å; L1011-F1013 VanDerWaalsContact C-N 3.32Å; L1011-F1013 PolarHBondContact O-N 2.59Å; L1011-C1014 PolarHBondContact O-N 3.03Å; L1011-D1015 PolarHBondContact O-N 3.33Å
1012	S	84.1	Confident	78.5	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-40.2	175.7	80.1	0	0	0	0	112	Y942 V1008 D1009 C1014 D1015 F1016 R1057	Y942-S1012 VanDerWaalsContact CE2-CB 3.43Å; V1008-S1012 WeakPolarHBondContact O-CB 3.43Å; V1008-S1012 PolarHBondContact O-N 2.94Å; D1009-S1012 PolarHBondContact O-N 3.3Å; D1009-S1012 PolarHBondContact O-OG 2.03Å; S1012-C1014 PolarHBondContact O-N 3.35Å; S1012-D1015 PolarHBondContact O-N 3.45Å; S1012-F1016 VanDerWaalsContact O-CD2 3.26Å; S1012-F1016 WeakPolarHBondContact O-CD2 3.42Å; S1012-F1016 PolarHBondContact O-N 3.09Å; S1012-R1057 PolarHBondContact OG-NH1 3.29Å; S1012-R1057 VanDerWaalsContact OG-NH1 3.16Å
1013	F	88.6	Confident	81	Confident	45 Å²	45	35.1 Å²	35.1	20%	0.197	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-45.7	175.4	171.5	-89.5	0	0	0	111.3	D1009 T1010 L1011 F1017 T1050 V1053 Q1054	D1009-F1013 PolarHBondContact O-N 3.1Å; D1009-F1013 VanDerWaalsContact O-N 3.11Å; T1010-F1013 PolarHBondContact O-N 2.92Å; L1011-F1013 VanDerWaalsContact C-N 3.32Å; L1011-F1013 PolarHBondContact O-N 2.59Å; F1013-F1017 HydrophobicContact CE1-CB 4.47Å; F1013-F1017 WeakPolarHBondContact O-CB 3.4Å; F1013-F1017 PolarHBondContact O-N 2.91Å; F1013-T1050 HydrophobicContact CZ-CG2 4.23Å; F1013-V1053 HydrophobicContact CD2-CB 4.11Å; F1013-V1053 HydrophobicContact CD2-CG1 3.49Å; F1013-V1053 VanDerWaalsContact CD2-CG1 3.49Å; F1013-V1053 HydrophobicContact CE2-CB 3.78Å; F1013-V1053 HydrophobicContact CE2-CG1 3.69Å; F1013-V1053 HydrophobicContact CG-CG1 4.36Å; F1013-Q1054 HydrophobicContact CD2-CG 4.16Å; F1013-Q1054 HydrophobicContact CE2-CG 3.73Å
1014	C	91.7	Very high	82.9	Confident	14 Å²	14	33.6 Å²	33.6	10%	0.095	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-38.6	178.8	-66.5	0	0	0	0	113	Y934 F938 T1010 L1011 S1012 G1018	Y934-C1014 WeakPolarHBondContact CE1-O 3.04Å; Y934-C1014 WeakPolarHBondContact OH-CA 3.47Å; Y934-C1014 WeakPolarHBondContact OH-CB 3.02Å; Y934-C1014 PolarHBondContact OH-SG 3.23Å; F938-C1014 HydrophobicContact CB-CB 3.67Å; F938-C1014 HydrophobicContact CD1-CB 3.5Å; F938-C1014 HydrophobicContact CD2-CB 4.27Å; F938-C1014 HydrophobicContact CE1-CB 4.21Å; F938-C1014 HydrophobicContact CG-CB 3.54Å; T1010-C1014 PolarHBondContact O-N 3.22Å; T1010-C1014 VanDerWaalsContact O-N 3.1Å; T1010-C1014 PolarHBondContact O-SG 3.3Å; T1010-C1014 VanDerWaalsContact O-SG 3.37Å; L1011-C1014 PolarHBondContact O-N 3.03Å; S1012-C1014 PolarHBondContact O-N 3.35Å; C1014-G1018 PolarHBondContact O-N 3.34Å
1015	D	91.1	Very high	84.6	Confident	11 Å²	11	33.1 Å²	33.1	6%	0.059	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-58.6	175.9	175.5	56.7	0	0	0	111.7	S939 Y942 L1011 S1012 F1017 G1018 G1019 H1130	S939-D1015 VanDerWaalsContact CA-OD1 3.26Å; S939-D1015 WeakPolarHBondContact CA-OD1 3.45Å; S939-D1015 WeakPolarHBondContact CB-OD1 3.29Å; S939-D1015 PolarHBondContact OG-OD1 3.08Å; Y942-D1015 HydrophobicContact CD1-CB 4.02Å; Y942-D1015 HydrophobicContact CG-CB 4.11Å; L1011-D1015 PolarHBondContact O-N 3.33Å; S1012-D1015 PolarHBondContact O-N 3.45Å; D1015-F1017 VanDerWaalsContact C-N 3.34Å; D1015-F1017 PolarHBondContact O-N 2.68Å; D1015-G1018 PolarHBondContact O-N 3.18Å; D1015-G1018 VanDerWaalsContact O-N 3.15Å; D1015-G1019 PolarHBondContact O-N 2.75Å; D1015-H1130 IonicContact OD1-CE1 3.66Å
1016	F	90.1	Very high	85.9	Confident	58 Å²	58	28.2 Å²	28.2	25%	0.254	16%	0.156	S	C	.	.	H	α-helix	trans	-57.9	-44.2	177.5	-79.3	-69.9	0	0	0	112	S1012 I1020 V1053 R1057 Y1058	S1012-F1016 VanDerWaalsContact O-CD2 3.26Å; S1012-F1016 WeakPolarHBondContact O-CD2 3.42Å; S1012-F1016 PolarHBondContact O-N 3.09Å; F1016-I1020 WeakPolarHBondContact O-CD1 3.49Å; F1016-I1020 WeakPolarHBondContact O-CG1 3.32Å; F1016-I1020 PolarHBondContact O-N 2.96Å; F1016-I1020 VanDerWaalsContact O-N 3.15Å; F1016-V1053 HydrophobicContact CB-CG1 4.05Å; F1016-R1057 HydrophobicContact CD2-CB 4.21Å; F1016-R1057 HydrophobicContact CG-CB 4.34Å; F1016-Y1058 HydrophobicContact CE2-CD1 4.16Å; F1016-Y1058 AromaticContact CE2-CE1 3.94Å; F1016-Y1058 HydrophobicContact CE2-CE1 3.94Å; F1016-Y1058 HydrophobicContact CZ-CD1 4.1Å; F1016-Y1058 HydrophobicContact CZ-CE1 4.27Å
1017	F	93.7	Very high	87.2	Confident	22 Å²	22	25.8 Å²	25.8	10%	0.096	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-46.2	176.2	176.8	-95.5	0	0	0	112.1	Y934 F1013 D1015 F1021 A1046 L1049 V1053	Y934-F1017 AromaticContact CE1-CD1 3.88Å; Y934-F1017 HydrophobicContact CE1-CD1 3.88Å; Y934-F1017 HydrophobicContact CE1-CE1 4.48Å; F1013-F1017 HydrophobicContact CE1-CB 4.47Å; F1013-F1017 WeakPolarHBondContact O-CB 3.4Å; F1013-F1017 PolarHBondContact O-N 2.91Å; D1015-F1017 VanDerWaalsContact C-N 3.34Å; D1015-F1017 PolarHBondContact O-N 2.68Å; F1017-F1021 HydrophobicContact CE1-CB 4.42Å; F1017-F1021 HydrophobicContact CE1-CD1 4.1Å; F1017-F1021 HydrophobicContact CE1-CG 4.45Å; F1017-F1021 HydrophobicContact CZ-CB 4.45Å; F1017-F1021 HydrophobicContact CZ-CD1 4.18Å; F1017-F1021 HydrophobicContact CZ-CG 4.28Å; F1017-F1021 WeakPolarHBondContact O-CB 3.25Å; F1017-F1021 PolarHBondContact O-N 2.65Å; F1017-A1046 HydrophobicContact CZ-CB 4.49Å; F1017-L1049 HydrophobicContact CD2-CB 4.02Å; F1017-L1049 HydrophobicContact CE2-CB 3.85Å; F1017-V1053 HydrophobicContact CB-CG2 4.41Å
1018	G	92.7	Very high	88.6	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-48.6	179.2	0	0	0	0	0	112.7	T935 C1014 D1015 I1020 F1021 S1022	T935-G1018 WeakPolarHBondContact OG1-CA 3.5Å; T935-G1018 PolarHBondContact OG1-O 2.8Å; C1014-G1018 PolarHBondContact O-N 3.34Å; D1015-G1018 PolarHBondContact O-N 3.18Å; D1015-G1018 VanDerWaalsContact O-N 3.15Å; G1018-I1020 PolarHBondContact O-N 3.14Å; G1018-F1021 PolarHBondContact O-N 3.3Å; G1018-S1022 WeakPolarHBondContact O-CB 3.14Å; G1018-S1022 PolarHBondContact O-N 2.95Å; G1018-S1022 PolarHBondContact O-OG 2.96Å
1019	G	91.5	Very high	89.7	Confident	22 Å²	22	20.5 Å²	20.5	23%	0.227	11%	0.11	C	C	.	.	H	α-helix	trans	-59.2	-48.9	179.2	0	0	0	0	0	112.7	D1015 S1022 I1023	D1015-G1019 PolarHBondContact O-N 2.75Å; G1019-S1022 WeakPolarHBondContact O-CB 3.09Å; G1019-S1022 PolarHBondContact O-N 3.49Å; G1019-I1023 PolarHBondContact O-N 3.41Å
1020	I	92.1	Very high	90.8	Very high	8 Å²	8	17.1 Å²	17.1	4%	0.041	9%	0.092	C	C	.	.	H	α-helix	trans	-70.3	-40.6	-179.1	-54	156	0	0	0	111	F1016 G1018 S1022 I1023 W1024 L1049 V1053 I1062 I1063 P1066	F1016-I1020 WeakPolarHBondContact O-CD1 3.49Å; F1016-I1020 WeakPolarHBondContact O-CG1 3.32Å; F1016-I1020 PolarHBondContact O-N 2.96Å; F1016-I1020 VanDerWaalsContact O-N 3.15Å; G1018-I1020 PolarHBondContact O-N 3.14Å; I1020-S1022 VanDerWaalsContact C-N 3.33Å; I1020-S1022 PolarHBondContact O-N 2.87Å; I1020-I1023 PolarHBondContact O-N 3.04Å; I1020-W1024 PolarHBondContact O-N 2.85Å; I1020-L1049 HydrophobicContact CB-CD2 4.36Å; I1020-L1049 HydrophobicContact CG2-CD1 4.03Å; I1020-L1049 HydrophobicContact CG2-CD2 3.5Å; I1020-L1049 HydrophobicContact CG2-CG 4.43Å; I1020-V1053 HydrophobicContact CD1-CG2 3.97Å; I1020-I1062 HydrophobicContact CD1-CB 4.41Å; I1020-I1062 HydrophobicContact CD1-CD1 3.94Å; I1020-I1062 HydrophobicContact CD1-CG1 4.01Å; I1020-I1062 HydrophobicContact CD1-CG2 3.63Å; I1020-I1062 HydrophobicContact CG1-CG2 4.47Å; I1020-I1063 HydrophobicContact CG1-CG1 4.29Å; I1020-P1066 HydrophobicContact CG2-CB 4.46Å; I1020-P1066 HydrophobicContact CG2-CG 3.92Å
1021	F	94.4	Very high	91.2	Very high	24 Å²	24	14.1 Å²	14.1	11%	0.105	7%	0.074	C	C	.	.	H	α-helix	trans	-68	-33.6	178.4	-169.4	-135.2	0	0	0	111.7	V931 F1017 G1018 W1024 I1025 A1046 L1049	V931-F1021 HydrophobicContact CB-CD1 4.37Å; V931-F1021 HydrophobicContact CG1-CB 4.37Å; V931-F1021 HydrophobicContact CG1-CD1 3.58Å; V931-F1021 HydrophobicContact CG1-CE1 4.21Å; V931-F1021 HydrophobicContact CG1-CG 4.17Å; V931-F1021 HydrophobicContact CG2-CD1 3.78Å; V931-F1021 HydrophobicContact CG2-CE1 3.53Å; V931-F1021 HydrophobicContact CG2-CZ 4.48Å; F1017-F1021 HydrophobicContact CE1-CB 4.42Å; F1017-F1021 HydrophobicContact CE1-CD1 4.1Å; F1017-F1021 HydrophobicContact CE1-CG 4.45Å; F1017-F1021 HydrophobicContact CZ-CB 4.45Å; F1017-F1021 HydrophobicContact CZ-CD1 4.18Å; F1017-F1021 HydrophobicContact CZ-CG 4.28Å; F1017-F1021 WeakPolarHBondContact O-CB 3.25Å; F1017-F1021 PolarHBondContact O-N 2.65Å; G1018-F1021 PolarHBondContact O-N 3.3Å; F1021-W1024 PolarHBondContact O-N 3.42Å; F1021-I1025 HydrophobicContact CD1-CG1 4.4Å; F1021-I1025 HydrophobicContact CD2-CD1 4.38Å; F1021-I1025 HydrophobicContact CD2-CG1 4.12Å; F1021-I1025 HydrophobicContact CE1-CD1 4.35Å; F1021-I1025 HydrophobicContact CE1-CG1 4.24Å; F1021-I1025 HydrophobicContact CE2-CD1 3.73Å; F1021-I1025 HydrophobicContact CE2-CG1 3.96Å; F1021-I1025 HydrophobicContact CG-CG1 4.34Å; F1021-I1025 HydrophobicContact CZ-CD1 3.72Å; F1021-I1025 HydrophobicContact CZ-CG1 4.01Å; F1021-I1025 WeakPolarHBondContact O-CB 3.37Å; F1021-I1025 VanDerWaalsContact O-CG1 3.24Å; F1021-I1025 WeakPolarHBondContact O-CG1 3.32Å; F1021-I1025 PolarHBondContact O-N 3.48Å; F1021-A1046 HydrophobicContact CE1-CB 4.5Å; F1021-A1046 HydrophobicContact CE2-CB 3.88Å; F1021-A1046 HydrophobicContact CZ-CB 3.79Å; F1021-L1049 HydrophobicContact CB-CD1 4Å; F1021-L1049 HydrophobicContact CD2-CD1 3.97Å; F1021-L1049 HydrophobicContact CG-CD1 4.44Å
1022	S	94.1	Very high	91.5	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.007	7%	0.074	C	C	.	.	H	α-helix	trans	-56.4	-51.2	170.5	-70	0	0	0	0	111.6	T935 G1018 G1019 I1020 W1024 I1025 S1026	T935-S1022 PolarHBondContact OG1-OG 3.09Å; G1018-S1022 WeakPolarHBondContact O-CB 3.14Å; G1018-S1022 PolarHBondContact O-N 2.95Å; G1018-S1022 PolarHBondContact O-OG 2.96Å; G1019-S1022 WeakPolarHBondContact O-CB 3.09Å; G1019-S1022 PolarHBondContact O-N 3.49Å; I1020-S1022 VanDerWaalsContact C-N 3.33Å; I1020-S1022 PolarHBondContact O-N 2.87Å; S1022-W1024 VanDerWaalsContact C-N 3.33Å; S1022-W1024 PolarHBondContact O-N 3Å; S1022-I1025 PolarHBondContact O-N 3.01Å; S1022-S1026 PolarHBondContact O-N 2.93Å; S1022-S1026 PolarHBondContact O-OG 2.93Å
1023	I	90.4	Very high	91.8	Very high	29 Å²	29	15.7 Å²	15.7	15%	0.149	8%	0.082	C	C	.	.	H	α-helix	trans	-57.3	-46.3	177.2	-64.1	167.2	0	0	0	110.8	G1019 I1020 S1026 T1027 I1063 L1067	G1019-I1023 PolarHBondContact O-N 3.41Å; I1020-I1023 PolarHBondContact O-N 3.04Å; I1023-S1026 PolarHBondContact O-N 3.04Å; I1023-T1027 WeakPolarHBondContact O-CG2 3.26Å; I1023-T1027 PolarHBondContact O-N 3.32Å; I1023-T1027 VanDerWaalsContact O-N 3.14Å; I1023-I1063 HydrophobicContact CD1-CG2 4.35Å; I1023-L1067 HydrophobicContact CG2-CB 4.5Å; I1023-L1067 HydrophobicContact CG2-CD1 4.33Å; I1023-L1067 HydrophobicContact CG2-CG 4.17Å
1024	W	93.8	Very high	91.8	Very high	27 Å²	27	16.1 Å²	16.1	10%	0.102	9%	0.089	C	C	.	.	H	α-helix	trans	-59.1	-49.7	177.8	-178.1	-112.1	0	0	0	112.4	I1020 F1021 S1022 S1026 T1027 L1028 A1041 L1049 P1066 V1069 I1073	I1020-W1024 PolarHBondContact O-N 2.85Å; F1021-W1024 PolarHBondContact O-N 3.42Å; S1022-W1024 VanDerWaalsContact C-N 3.33Å; S1022-W1024 PolarHBondContact O-N 3Å; W1024-S1026 PolarHBondContact O-N 2.91Å; W1024-T1027 PolarHBondContact O-N 3.48Å; W1024-T1027 PolarHBondContact O-OG1 3.31Å; W1024-L1028 HydrophobicContact CD2-CD1 4.24Å; W1024-L1028 HydrophobicContact CG-CD1 4.43Å; W1024-L1028 HydrophobicContact CZ2-CD1 4Å; W1024-L1028 PolarHBondContact O-N 2.68Å; W1024-A1041 PolarHBondContact NE1-O 2.78Å; W1024-L1049 HydrophobicContact CB-CD1 4.5Å; W1024-P1066 HydrophobicContact CE3-CB 3.97Å; W1024-V1069 HydrophobicContact CH2-CG1 3.82Å; W1024-V1069 HydrophobicContact CZ3-CB 4.13Å; W1024-V1069 HydrophobicContact CZ3-CG1 3.86Å; W1024-I1073 HydrophobicContact CH2-CD1 4.12Å
1025	I	93.7	Very high	91.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-43.1	178.1	-67.5	-60.5	0	0	0	111.5	I927 P928 V931 F1021 S1022 T1027 L1028 T1029 F1042	I927-I1025 HydrophobicContact CG2-CD1 4.05Å; I927-I1025 HydrophobicContact CG2-CG2 4.31Å; P928-I1025 HydrophobicContact CB-CG2 4.2Å; P928-I1025 HydrophobicContact CG-CG2 3.76Å; V931-I1025 HydrophobicContact CB-CG1 4.38Å; V931-I1025 HydrophobicContact CG1-CG1 4.15Å; V931-I1025 HydrophobicContact CG2-CG1 4.16Å; F1021-I1025 HydrophobicContact CD1-CG1 4.4Å; F1021-I1025 HydrophobicContact CD2-CD1 4.38Å; F1021-I1025 HydrophobicContact CD2-CG1 4.12Å; F1021-I1025 HydrophobicContact CE1-CD1 4.35Å; F1021-I1025 HydrophobicContact CE1-CG1 4.24Å; F1021-I1025 HydrophobicContact CE2-CD1 3.73Å; F1021-I1025 HydrophobicContact CE2-CG1 3.96Å; F1021-I1025 HydrophobicContact CG-CG1 4.34Å; F1021-I1025 HydrophobicContact CZ-CD1 3.72Å; F1021-I1025 HydrophobicContact CZ-CG1 4.01Å; F1021-I1025 WeakPolarHBondContact O-CB 3.37Å; F1021-I1025 VanDerWaalsContact O-CG1 3.24Å; F1021-I1025 WeakPolarHBondContact O-CG1 3.32Å; F1021-I1025 PolarHBondContact O-N 3.48Å; S1022-I1025 PolarHBondContact O-N 3.01Å; I1025-T1027 PolarHBondContact O-N 2.87Å; I1025-L1028 PolarHBondContact O-N 2.97Å; I1025-T1029 PolarHBondContact O-N 2.81Å; I1025-T1029 PolarHBondContact O-OG1 2.93Å; I1025-F1042 HydrophobicContact CD1-CB 4.2Å; I1025-F1042 HydrophobicContact CD1-CD1 3.17Å; I1025-F1042 HydrophobicContact CD1-CE1 3.46Å; I1025-F1042 VanDerWaalsContact CD1-CE1 3.46Å; I1025-F1042 HydrophobicContact CD1-CG 3.75Å; I1025-F1042 HydrophobicContact CD1-CZ 4.28Å; I1025-F1042 HydrophobicContact CG2-CE1 4.39Å
1026	S	92.6	Very high	91.4	Very high	5 Å²	5	25.1 Å²	25.1	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-56.7	-52.7	177.4	-55.5	0	0	0	0	111.2	Y932 S1022 I1023 W1024 L1028 T1029 I1030 L1137	Y932-S1026 PolarHBondContact OH-OG 3.23Å; S1022-S1026 PolarHBondContact O-N 2.93Å; S1022-S1026 PolarHBondContact O-OG 2.93Å; I1023-S1026 PolarHBondContact O-N 3.04Å; W1024-S1026 PolarHBondContact O-N 2.91Å; S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact O-N 2.84Å; S1026-T1029 PolarHBondContact O-N 2.96Å; S1026-T1029 PolarHBondContact O-OG1 2.83Å; S1026-I1030 WeakPolarHBondContact O-CD1 3.28Å; S1026-I1030 VanDerWaalsContact O-CG1 3.24Å; S1026-I1030 WeakPolarHBondContact O-CG1 3.41Å; S1026-I1030 PolarHBondContact O-N 3.46Å; S1026-I1030 VanDerWaalsContact O-N 3.07Å; S1026-L1137 VanDerWaalsContact OG-CD2 3.24Å; S1026-L1137 WeakPolarHBondContact OG-CD2 3.13Å
1027	T	92.2	Very high	91.4	Very high	13 Å²	13	30.4 Å²	30.4	8%	0.08	15%	0.147	C	C	.	.	H	α-helix	trans	-57.5	-41.1	-177.9	61.9	0	0	0	0	112.8	I1023 W1024 I1025 T1029 I1030 A1031 I1074	I1023-T1027 WeakPolarHBondContact O-CG2 3.26Å; I1023-T1027 PolarHBondContact O-N 3.32Å; I1023-T1027 VanDerWaalsContact O-N 3.14Å; W1024-T1027 PolarHBondContact O-N 3.48Å; W1024-T1027 PolarHBondContact O-OG1 3.31Å; I1025-T1027 PolarHBondContact O-N 2.87Å; T1027-T1029 PolarHBondContact O-N 2.83Å; T1027-I1030 PolarHBondContact O-N 2.76Å; T1027-A1031 PolarHBondContact O-N 2.83Å; T1027-A1031 VanDerWaalsContact O-N 3.1Å; T1027-I1074 HydrophobicContact CG2-CD1 4.03Å; T1027-I1074 WeakPolarHBondContact O-CG1 3.23Å
1028	L	92.8	Very high	91.3	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-69.5	-30.3	178	-71.3	174.4	0	0	0	113.8	W1024 I1025 S1026 T1038 A1041 F1042 I1073 S1162	W1024-L1028 HydrophobicContact CD2-CD1 4.24Å; W1024-L1028 HydrophobicContact CG-CD1 4.43Å; W1024-L1028 HydrophobicContact CZ2-CD1 4Å; W1024-L1028 PolarHBondContact O-N 2.68Å; I1025-L1028 PolarHBondContact O-N 2.97Å; S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact O-N 2.84Å; L1028-T1038 HydrophobicContact CB-CG2 4.12Å; L1028-A1041 HydrophobicContact CD1-CB 3.67Å; L1028-A1041 HydrophobicContact CD2-CB 3.95Å; L1028-A1041 HydrophobicContact CG-CB 4.5Å; L1028-F1042 HydrophobicContact CB-CD1 4.34Å; L1028-F1042 HydrophobicContact CB-CE1 3.71Å; L1028-F1042 HydrophobicContact CD1-CD1 3.59Å; L1028-F1042 HydrophobicContact CD1-CE1 3.85Å; L1028-F1042 HydrophobicContact CG-CE1 4.47Å; L1028-I1073 HydrophobicContact CD2-CD1 4.3Å; L1028-I1073 HydrophobicContact CD2-CG2 4.28Å; L1028-S1162 VanDerWaalsContact O-CB 3.26Å; L1028-S1162 WeakPolarHBondContact O-CB 3.49Å; L1028-S1162 PolarHBondContact O-OG 3.02Å
1029	T	91.5	Very high	91.2	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-73.6	-32.6	171.9	55.8	0	0	0	0	113.7	P928 I1025 S1026 T1027 A1031 F1042 S1162	P928-T1029 HydrophobicContact CG-CG2 3.63Å; I1025-T1029 PolarHBondContact O-N 2.81Å; I1025-T1029 PolarHBondContact O-OG1 2.93Å; S1026-T1029 PolarHBondContact O-N 2.96Å; S1026-T1029 PolarHBondContact O-OG1 2.83Å; T1027-T1029 PolarHBondContact O-N 2.83Å; T1029-A1031 VanDerWaalsContact C-N 3.34Å; T1029-F1042 HydrophobicContact CG2-CZ 4.37Å; T1029-S1162 PolarHBondContact O-OG 2.81Å
1030	I	91.2	Very high	91.3	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.036	18%	0.177	C	C	.	.	H	α-helix	trans	-73.2	-28.1	177.8	-64.2	160.6	0	0	0	111.8	S1026 T1027 A1032 I1074 W1078 W1094 F1140 W1147	S1026-I1030 WeakPolarHBondContact O-CD1 3.28Å; S1026-I1030 VanDerWaalsContact O-CG1 3.24Å; S1026-I1030 WeakPolarHBondContact O-CG1 3.41Å; S1026-I1030 PolarHBondContact O-N 3.46Å; S1026-I1030 VanDerWaalsContact O-N 3.07Å; T1027-I1030 PolarHBondContact O-N 2.76Å; I1030-A1032 PolarHBondContact O-N 2.96Å; I1030-I1074 HydrophobicContact CB-CD1 4.37Å; I1030-I1074 HydrophobicContact CG2-CD1 4.19Å; I1030-I1074 HydrophobicContact CG2-CG1 4.39Å; I1030-I1074 HydrophobicContact CG2-CG2 4.46Å; I1030-W1078 HydrophobicContact CG2-CH2 4.18Å; I1030-W1078 HydrophobicContact CG2-CZ2 3.39Å; I1030-W1078 PolarHBondContact O-NE1 2.83Å; I1030-W1094 HydrophobicContact CG2-CH2 4.03Å; I1030-F1140 HydrophobicContact CD1-CB 3.83Å; I1030-F1140 HydrophobicContact CD1-CG 4.44Å; I1030-F1140 WeakPolarHBondContact CD1-O 3.08Å; I1030-F1140 WeakPolarHBondContact CG1-O 3.44Å; I1030-W1147 HydrophobicContact CG2-CH2 4.34Å; I1030-W1147 WeakPolarHBondContact O-CH2 3.22Å; I1030-W1147 VanDerWaalsContact O-CZ3 3.31Å; I1030-W1147 WeakPolarHBondContact O-CZ3 3.32Å
1031	A	90.2	Very high	91.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.8	179.5	0	0	0	0	0	114.6	T1027 T1029 I1033 I1073 I1074 S1077	T1027-A1031 PolarHBondContact O-N 2.83Å; T1027-A1031 VanDerWaalsContact O-N 3.1Å; T1029-A1031 VanDerWaalsContact C-N 3.34Å; A1031-I1033 VanDerWaalsContact C-N 3.33Å; A1031-I1033 HydrophobicContact CB-CD1 3.72Å; A1031-I1033 HydrophobicContact CB-CG1 3.84Å; A1031-I1033 PolarHBondContact O-N 3.08Å; A1031-I1073 HydrophobicContact CB-CG2 4.08Å; A1031-I1074 HydrophobicContact CB-CG1 4.21Å; A1031-S1077 VanDerWaalsContact O-CB 3.25Å; A1031-S1077 WeakPolarHBondContact O-CB 3.34Å; A1031-S1077 PolarHBondContact O-OG 2.95Å
1032	A	89.2	Confident	91.3	Very high	3 Å²	3	36.7 Å²	36.7	3%	0.025	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	42.5	179.4	0	0	0	0	0	115	I1030 L1081 F1089 W1147 L1151 S1162 C1163	I1030-A1032 PolarHBondContact O-N 2.96Å; A1032-L1081 HydrophobicContact CB-CD1 4.26Å; A1032-F1089 HydrophobicContact CB-CE1 4.16Å; A1032-F1089 HydrophobicContact CB-CZ 4.06Å; A1032-W1147 HydrophobicContact CB-CE3 4.25Å; A1032-W1147 HydrophobicContact CB-CZ3 4.06Å; A1032-L1151 HydrophobicContact CB-CD1 4.44Å; A1032-S1162 WeakPolarHBondContact CA-OG 3.34Å; A1032-S1162 PolarHBondContact N-OG 3.33Å; A1032-C1163 HydrophobicContact CB-CB 4.21Å
1033	I	89.5	Confident	91.2	Very high	34 Å²	34	41.8 Å²	41.8	17%	0.174	21%	0.208	C	C	.	.			trans	-89.2	146.6	-175.8	-64.2	176.2	0	0	0	110.6	A1031 M1035 Y1037 T1038 I1073 S1162	A1031-I1033 VanDerWaalsContact C-N 3.33Å; A1031-I1033 HydrophobicContact CB-CD1 3.72Å; A1031-I1033 HydrophobicContact CB-CG1 3.84Å; A1031-I1033 PolarHBondContact O-N 3.08Å; I1033-M1035 PolarHBondContact O-N 2.87Å; I1033-Y1037 HydrophobicContact CG2-CD2 4.4Å; I1033-T1038 PolarHBondContact O-OG1 2.89Å; I1033-I1073 HydrophobicContact CD1-CG2 3.57Å; I1033-S1162 PolarHBondContact N-OG 3.36Å; I1033-S1162 PolarHBondContact O-N 3.24Å
1034	P	88.4	Confident	91.4	Very high	54 Å²	54	45.4 Å²	45.4	35%	0.351	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-54.7	131.1	172.9	-27.2	35.7	0	0	0	113	K1036 Y1037 T1038 L1161	P1034-K1036 PolarHBondContact O-N 3.36Å; P1034-Y1037 HydrophobicContact CB-CD2 4.29Å; P1034-Y1037 PolarHBondContact O-N 3.31Å; P1034-T1038 PolarHBondContact O-OG1 3.31Å; P1034-L1161 HydrophobicContact CG-CD2 4.25Å
1035	M	87.2	Confident	91.3	Very high	45 Å²	45	44.3 Å²	44.3	22%	0.222	22%	0.224	C	C	.	.	H	α-helix	trans	-53.4	-32.4	-163.6	-169.7	62.9	70.6	0	0	114.7	I1033 Y1037 T1038 Q1039 P1160 L1161	I1033-M1035 PolarHBondContact O-N 2.87Å; M1035-Y1037 VanDerWaalsContact C-N 3.35Å; M1035-Y1037 PolarHBondContact O-N 3.35Å; M1035-T1038 PolarHBondContact O-N 2.91Å; M1035-Q1039 HydrophobicContact CG-CG 4.04Å; M1035-Q1039 WeakPolarHBondContact O-CB 3.27Å; M1035-Q1039 VanDerWaalsContact O-CG 3.31Å; M1035-Q1039 WeakPolarHBondContact O-CG 3.45Å; M1035-Q1039 PolarHBondContact O-N 3.03Å; M1035-Q1039 HydrophobicContact SD-CG 4.17Å; M1035-P1160 HydrophobicContact CB-CB 3.95Å; M1035-P1160 HydrophobicContact CB-CG 4Å; M1035-P1160 WeakPolarHBondContact CB-O 3.24Å; M1035-P1160 PolarHBondContact N-O 3.03Å; M1035-L1161 WeakPolarHBondContact CE-O 3.5Å
1036	K	87.3	Confident	91.2	Very high	169 Å²	169	45.5 Å²	45.5	74%	0.735	23%	0.234	S	C	*	.	H	α-helix	trans	-53.9	-48.3	177.5	-65.6	-174.4	178.7	-177.2	0	112.2	P1034 C1040	P1034-K1036 PolarHBondContact O-N 3.36Å; K1036-C1040 PolarHBondContact O-N 2.95Å; K1036-C1040 PolarHBondContact O-SG 3.05Å; K1036-C1040 VanDerWaalsContact O-SG 3.38Å
1037	Y	91.3	Very high	91.3	Very high	170 Å²	170	50.8 Å²	50.8	67%	0.667	26%	0.261	S	S	*	.	H	α-helix	trans	-73.9	-38.7	-179.2	-57.4	-66.6	0	0	0	111.6	I1033 P1034 M1035 Q1039 C1040 A1041	I1033-Y1037 HydrophobicContact CG2-CD2 4.4Å; P1034-Y1037 HydrophobicContact CB-CD2 4.29Å; P1034-Y1037 PolarHBondContact O-N 3.31Å; M1035-Y1037 VanDerWaalsContact C-N 3.35Å; M1035-Y1037 PolarHBondContact O-N 3.35Å; Y1037-Q1039 VanDerWaalsContact C-N 3.33Å; Y1037-Q1039 PolarHBondContact O-N 2.65Å; Y1037-C1040 WeakPolarHBondContact O-CB 3.31Å; Y1037-C1040 PolarHBondContact O-N 3Å; Y1037-A1041 PolarHBondContact O-N 2.83Å
1038	T	91.4	Very high	91.2	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-41.2	177.9	-39.4	0	0	0	0	111.6	L1028 I1033 P1034 M1035 A1041 F1042	L1028-T1038 HydrophobicContact CB-CG2 4.12Å; I1033-T1038 PolarHBondContact O-OG1 2.89Å; P1034-T1038 PolarHBondContact O-OG1 3.31Å; M1035-T1038 PolarHBondContact O-N 2.91Å; T1038-A1041 PolarHBondContact O-N 3.07Å; T1038-F1042 HydrophobicContact CG2-CD1 4.33Å; T1038-F1042 HydrophobicContact CG2-CE1 3.69Å; T1038-F1042 HydrophobicContact CG2-CE2 3.88Å; T1038-F1042 HydrophobicContact CG2-CZ 3.44Å; T1038-F1042 VanDerWaalsContact CG2-CZ 3.44Å; T1038-F1042 WeakPolarHBondContact O-CD1 3.15Å; T1038-F1042 WeakPolarHBondContact O-CD2 3.32Å; T1038-F1042 WeakPolarHBondContact O-CG 3.33Å; T1038-F1042 PolarHBondContact O-N 2.9Å
1039	Q	90.9	Very high	91.2	Very high	94 Å²	94	53.9 Å²	53.9	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-41.1	175.3	-75.5	172	-35.8	0	0	112.4	M1035 Y1037 F1042 I1043	M1035-Q1039 HydrophobicContact CG-CG 4.04Å; M1035-Q1039 WeakPolarHBondContact O-CB 3.27Å; M1035-Q1039 VanDerWaalsContact O-CG 3.31Å; M1035-Q1039 WeakPolarHBondContact O-CG 3.45Å; M1035-Q1039 PolarHBondContact O-N 3.03Å; M1035-Q1039 HydrophobicContact SD-CG 4.17Å; Y1037-Q1039 VanDerWaalsContact C-N 3.33Å; Y1037-Q1039 PolarHBondContact O-N 2.65Å; Q1039-F1042 PolarHBondContact O-N 2.84Å; Q1039-I1043 WeakPolarHBondContact O-CG1 3.44Å; Q1039-I1043 PolarHBondContact O-N 3.13Å; Q1039-I1043 VanDerWaalsContact O-N 3.11Å
1040	C	93.3	Very high	91.2	Very high	74 Å²	74	56.1 Å²	56.1	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-44.3	172.4	-62.8	0	0	0	0	111.7	K1036 Y1037 F1042 I1043 I1044	K1036-C1040 PolarHBondContact O-N 2.95Å; K1036-C1040 PolarHBondContact O-SG 3.05Å; K1036-C1040 VanDerWaalsContact O-SG 3.38Å; Y1037-C1040 WeakPolarHBondContact O-CB 3.31Å; Y1037-C1040 PolarHBondContact O-N 3Å; C1040-F1042 VanDerWaalsContact C-N 3.33Å; C1040-F1042 PolarHBondContact O-N 3.15Å; C1040-I1043 PolarHBondContact O-N 3.21Å; C1040-I1044 WeakPolarHBondContact O-CB 3.46Å; C1040-I1044 VanDerWaalsContact O-CG1 3.29Å; C1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; C1040-I1044 PolarHBondContact O-N 2.97Å
1041	A	93	Very high	91.1	Very high	23 Å²	23	59.7 Å²	59.7	19%	0.19	32%	0.318	C	S	.	.	H	α-helix	trans	-66.2	-31.7	178	0	0	0	0	0	113.2	W1024 L1028 Y1037 T1038 G1045	W1024-A1041 PolarHBondContact NE1-O 2.78Å; L1028-A1041 HydrophobicContact CD1-CB 3.67Å; L1028-A1041 HydrophobicContact CD2-CB 3.95Å; L1028-A1041 HydrophobicContact CG-CB 4.5Å; Y1037-A1041 PolarHBondContact O-N 2.83Å; T1038-A1041 PolarHBondContact O-N 3.07Å; A1041-G1045 PolarHBondContact O-N 2.97Å
1042	F	93	Very high	91.1	Very high	15 Å²	15	61.1 Å²	61.1	7%	0.066	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-48.4	171.1	-64.5	-24.4	0	0	0	111.7	I927 I1025 L1028 T1029 T1038 Q1039 C1040 G1045 A1046	I927-F1042 HydrophobicContact CB-CE2 4.29Å; I927-F1042 HydrophobicContact CD1-CD2 3.76Å; I927-F1042 HydrophobicContact CD1-CE2 3.7Å; I927-F1042 HydrophobicContact CG2-CD2 4.09Å; I927-F1042 HydrophobicContact CG2-CE2 3.93Å; I927-F1042 HydrophobicContact CG2-CZ 4.29Å; I1025-F1042 HydrophobicContact CD1-CB 4.2Å; I1025-F1042 HydrophobicContact CD1-CD1 3.17Å; I1025-F1042 HydrophobicContact CD1-CE1 3.46Å; I1025-F1042 VanDerWaalsContact CD1-CE1 3.46Å; I1025-F1042 HydrophobicContact CD1-CG 3.75Å; I1025-F1042 HydrophobicContact CD1-CZ 4.28Å; I1025-F1042 HydrophobicContact CG2-CE1 4.39Å; L1028-F1042 HydrophobicContact CB-CD1 4.34Å; L1028-F1042 HydrophobicContact CB-CE1 3.71Å; L1028-F1042 HydrophobicContact CD1-CD1 3.59Å; L1028-F1042 HydrophobicContact CD1-CE1 3.85Å; L1028-F1042 HydrophobicContact CG-CE1 4.47Å; T1029-F1042 HydrophobicContact CG2-CZ 4.37Å; T1038-F1042 HydrophobicContact CG2-CD1 4.33Å; T1038-F1042 HydrophobicContact CG2-CE1 3.69Å; T1038-F1042 HydrophobicContact CG2-CE2 3.88Å; T1038-F1042 HydrophobicContact CG2-CZ 3.44Å; T1038-F1042 VanDerWaalsContact CG2-CZ 3.44Å; T1038-F1042 WeakPolarHBondContact O-CD1 3.15Å; T1038-F1042 WeakPolarHBondContact O-CD2 3.32Å; T1038-F1042 WeakPolarHBondContact O-CG 3.33Å; T1038-F1042 PolarHBondContact O-N 2.9Å; Q1039-F1042 PolarHBondContact O-N 2.84Å; C1040-F1042 VanDerWaalsContact C-N 3.33Å; C1040-F1042 PolarHBondContact O-N 3.15Å; F1042-G1045 PolarHBondContact O-N 3.17Å; F1042-A1046 WeakPolarHBondContact O-CB 3.39Å; F1042-A1046 PolarHBondContact O-N 2.94Å
1043	I	93.3	Very high	91	Very high	109 Å²	109	61 Å²	61	56%	0.559	33%	0.328	S	S	*	.	H	α-helix	trans	-66.2	-46.9	-178.9	-66	166.2	0	0	0	111	Q1039 C1040 G1045 A1046 L1047	Q1039-I1043 WeakPolarHBondContact O-CG1 3.44Å; Q1039-I1043 PolarHBondContact O-N 3.13Å; Q1039-I1043 VanDerWaalsContact O-N 3.11Å; C1040-I1043 PolarHBondContact O-N 3.21Å; I1043-G1045 PolarHBondContact O-N 3.12Å; I1043-A1046 PolarHBondContact O-N 2.92Å; I1043-L1047 HydrophobicContact CG2-CD1 4.06Å; I1043-L1047 WeakPolarHBondContact O-CG 3.39Å; I1043-L1047 PolarHBondContact O-N 2.91Å; I1043-L1047 VanDerWaalsContact O-N 3.08Å
1044	I	92.7	Very high	90.7	Very high	104 Å²	104	66 Å²	66	53%	0.533	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-47.3	177.5	-67.8	166.1	0	0	0	110	C1040 A1046 L1047 S1048	C1040-I1044 WeakPolarHBondContact O-CB 3.46Å; C1040-I1044 VanDerWaalsContact O-CG1 3.29Å; C1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; C1040-I1044 PolarHBondContact O-N 2.97Å; I1044-A1046 PolarHBondContact O-N 2.91Å; I1044-L1047 PolarHBondContact O-N 2.8Å; I1044-S1048 WeakPolarHBondContact O-CB 3.42Å; I1044-S1048 PolarHBondContact O-N 2.81Å; I1044-S1048 PolarHBondContact O-OG 2.84Å; I1044-S1048 VanDerWaalsContact O-OG 3.12Å
1045	G	92.5	Very high	90.4	Very high	5 Å²	5	69.5 Å²	69.5	5%	0.052	37%	0.366	C	S	.	.	H	α-helix	trans	-57.7	-46.2	177.3	0	0	0	0	0	113.3	A1041 F1042 I1043 L1047 S1048 L1049	A1041-G1045 PolarHBondContact O-N 2.97Å; F1042-G1045 PolarHBondContact O-N 3.17Å; I1043-G1045 PolarHBondContact O-N 3.12Å; G1045-L1047 PolarHBondContact O-N 3.07Å; G1045-S1048 PolarHBondContact O-N 3.41Å; G1045-L1049 VanDerWaalsContact O-CB 3.28Å; G1045-L1049 WeakPolarHBondContact O-CB 3.34Å; G1045-L1049 VanDerWaalsContact O-CG 3.26Å; G1045-L1049 WeakPolarHBondContact O-CG 3.27Å; G1045-L1049 PolarHBondContact O-N 2.89Å
1046	A	92.7	Very high	90	Very high	25 Å²	25	70.7 Å²	70.7	21%	0.207	38%	0.375	C	S	.	.	H	α-helix	trans	-60.8	-44.2	177.9	0	0	0	0	0	112.6	F1017 F1021 F1042 I1043 I1044 T1050	F1017-A1046 HydrophobicContact CZ-CB 4.49Å; F1021-A1046 HydrophobicContact CE1-CB 4.5Å; F1021-A1046 HydrophobicContact CE2-CB 3.88Å; F1021-A1046 HydrophobicContact CZ-CB 3.79Å; F1042-A1046 WeakPolarHBondContact O-CB 3.39Å; F1042-A1046 PolarHBondContact O-N 2.94Å; I1043-A1046 PolarHBondContact O-N 2.92Å; I1044-A1046 PolarHBondContact O-N 2.91Å; A1046-T1050 WeakPolarHBondContact O-CB 3.49Å; A1046-T1050 PolarHBondContact O-N 3.17Å; A1046-T1050 PolarHBondContact O-OG1 2.95Å
1047	L	93.1	Very high	89.6	Confident	116 Å²	116	65.1 Å²	65.1	61%	0.607	35%	0.35	S	S	*	.	H	α-helix	trans	-67.5	-45.7	178.5	-68.2	172.3	0	0	0	111.7	I1043 I1044 G1045 T1050 V1051	I1043-L1047 HydrophobicContact CG2-CD1 4.06Å; I1043-L1047 WeakPolarHBondContact O-CG 3.39Å; I1043-L1047 PolarHBondContact O-N 2.91Å; I1043-L1047 VanDerWaalsContact O-N 3.08Å; I1044-L1047 PolarHBondContact O-N 2.8Å; G1045-L1047 PolarHBondContact O-N 3.07Å; L1047-T1050 PolarHBondContact O-N 2.8Å; L1047-V1051 PolarHBondContact O-N 3.09Å
1048	S	91	Very high	88.6	Confident	69 Å²	69	64.6 Å²	64.6	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-42	178.4	-63.5	0	0	0	0	112.6	I1044 G1045 V1051 A1052	I1044-S1048 WeakPolarHBondContact O-CB 3.42Å; I1044-S1048 PolarHBondContact O-N 2.81Å; I1044-S1048 PolarHBondContact O-OG 2.84Å; I1044-S1048 VanDerWaalsContact O-OG 3.12Å; G1045-S1048 PolarHBondContact O-N 3.41Å; S1048-V1051 PolarHBondContact O-N 2.81Å; S1048-A1052 WeakPolarHBondContact O-CB 3.21Å; S1048-A1052 PolarHBondContact O-N 3.43Å
1049	L	92.6	Very high	88	Confident	11 Å²	11	67.2 Å²	67.2	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-68.9	-37.6	178.2	-71.7	174	0	0	0	112.3	F1017 I1020 F1021 W1024 G1045 V1051 A1052 V1053 P1066	F1017-L1049 HydrophobicContact CD2-CB 4.02Å; F1017-L1049 HydrophobicContact CE2-CB 3.85Å; I1020-L1049 HydrophobicContact CB-CD2 4.36Å; I1020-L1049 HydrophobicContact CG2-CD1 4.03Å; I1020-L1049 HydrophobicContact CG2-CD2 3.5Å; I1020-L1049 HydrophobicContact CG2-CG 4.43Å; F1021-L1049 HydrophobicContact CB-CD1 4Å; F1021-L1049 HydrophobicContact CD2-CD1 3.97Å; F1021-L1049 HydrophobicContact CG-CD1 4.44Å; W1024-L1049 HydrophobicContact CB-CD1 4.5Å; G1045-L1049 VanDerWaalsContact O-CB 3.28Å; G1045-L1049 WeakPolarHBondContact O-CB 3.34Å; G1045-L1049 VanDerWaalsContact O-CG 3.26Å; G1045-L1049 WeakPolarHBondContact O-CG 3.27Å; G1045-L1049 PolarHBondContact O-N 2.89Å; L1049-V1051 VanDerWaalsContact C-N 3.27Å; L1049-V1051 PolarHBondContact O-N 3.43Å; L1049-A1052 PolarHBondContact O-N 2.81Å; L1049-V1053 WeakPolarHBondContact O-CB 3.29Å; L1049-V1053 VanDerWaalsContact O-CG2 3.24Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.47Å; L1049-V1053 PolarHBondContact O-N 2.76Å; L1049-P1066 HydrophobicContact CD2-CG 4Å
1050	T	91.3	Very high	87.5	Confident	50 Å²	50	67.1 Å²	67.1	31%	0.307	37%	0.368	S	S	.	.	H	α-helix	trans	-53	-46.1	174.1	-60.5	0	0	0	0	111.3	F1013 A1046 L1047 Q1054	F1013-T1050 HydrophobicContact CZ-CG2 4.23Å; A1046-T1050 WeakPolarHBondContact O-CB 3.49Å; A1046-T1050 PolarHBondContact O-N 3.17Å; A1046-T1050 PolarHBondContact O-OG1 2.95Å; L1047-T1050 PolarHBondContact O-N 2.8Å; T1050-Q1054 WeakPolarHBondContact O-CG 3.17Å
1051	V	89.5	Confident	86.8	Confident	83 Å²	83	65.1 Å²	65.1	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-71.9	-44.9	177.8	179.6	0	0	0	0	111.5	L1047 S1048 L1049 V1053 Q1054 I1055	L1047-V1051 PolarHBondContact O-N 3.09Å; S1048-V1051 PolarHBondContact O-N 2.81Å; L1049-V1051 VanDerWaalsContact C-N 3.27Å; L1049-V1051 PolarHBondContact O-N 3.43Å; V1051-V1053 PolarHBondContact O-N 3.09Å; V1051-Q1054 PolarHBondContact O-N 3.24Å; V1051-I1055 HydrophobicContact CG1-CD1 3.86Å; V1051-I1055 WeakPolarHBondContact O-CG1 3.28Å; V1051-I1055 PolarHBondContact O-N 2.85Å
1052	A	88.9	Confident	86.4	Confident	29 Å²	29	64.6 Å²	64.6	24%	0.24	35%	0.353	C	S	.	.	H	α-helix	trans	-61.3	-42.4	-177.7	0	0	0	0	0	112.8	S1048 L1049 Q1054 I1055 V1056 I1062	S1048-A1052 WeakPolarHBondContact O-CB 3.21Å; S1048-A1052 PolarHBondContact O-N 3.43Å; L1049-A1052 PolarHBondContact O-N 2.81Å; A1052-Q1054 PolarHBondContact O-N 2.81Å; A1052-I1055 PolarHBondContact O-N 3.02Å; A1052-V1056 WeakPolarHBondContact O-CG2 3.19Å; A1052-V1056 PolarHBondContact O-N 2.86Å; A1052-I1062 HydrophobicContact CB-CD1 3.94Å; A1052-I1062 HydrophobicContact CB-CG1 4.1Å
1053	V	88.2	Confident	85.9	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66.9	-37.1	-179.6	178.2	0	0	0	0	110.7	F1013 F1016 F1017 I1020 L1049 V1051 I1055 R1057 I1062	F1013-V1053 HydrophobicContact CD2-CB 4.11Å; F1013-V1053 HydrophobicContact CD2-CG1 3.49Å; F1013-V1053 VanDerWaalsContact CD2-CG1 3.49Å; F1013-V1053 HydrophobicContact CE2-CB 3.78Å; F1013-V1053 HydrophobicContact CE2-CG1 3.69Å; F1013-V1053 HydrophobicContact CG-CG1 4.36Å; F1016-V1053 HydrophobicContact CB-CG1 4.05Å; F1017-V1053 HydrophobicContact CB-CG2 4.41Å; I1020-V1053 HydrophobicContact CD1-CG2 3.97Å; L1049-V1053 WeakPolarHBondContact O-CB 3.29Å; L1049-V1053 VanDerWaalsContact O-CG2 3.24Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.47Å; L1049-V1053 PolarHBondContact O-N 2.76Å; V1051-V1053 PolarHBondContact O-N 3.09Å; V1053-I1055 VanDerWaalsContact C-N 3.29Å; V1053-I1055 PolarHBondContact O-N 2.92Å; V1053-R1057 HydrophobicContact CG1-CB 3.81Å; V1053-R1057 VanDerWaalsContact O-CB 3.23Å; V1053-R1057 WeakPolarHBondContact O-CB 3.37Å; V1053-R1057 PolarHBondContact O-N 3.08Å; V1053-R1057 VanDerWaalsContact O-N 3.14Å; V1053-I1062 HydrophobicContact CB-CD1 4.24Å; V1053-I1062 HydrophobicContact CG2-CD1 3.65Å
1054	Q	82.8	Confident	85.6	Confident	139 Å²	139	66 Å²	66	65%	0.65	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-33.5	175.8	-74.5	-179.8	-2.7	0	0	113.5	F1013 T1050 V1051 A1052	F1013-Q1054 HydrophobicContact CD2-CG 4.16Å; F1013-Q1054 HydrophobicContact CE2-CG 3.73Å; T1050-Q1054 WeakPolarHBondContact O-CG 3.17Å; V1051-Q1054 PolarHBondContact O-N 3.24Å; A1052-Q1054 PolarHBondContact O-N 2.81Å
1055	I	81.7	Confident	85.3	Confident	128 Å²	128	65.4 Å²	65.4	66%	0.656	36%	0.362	S	S	*	.	H	α-helix	trans	-91.6	-40.4	-175.3	-52.6	170.3	0	0	0	111.4	V1051 A1052 V1053	V1051-I1055 HydrophobicContact CG1-CD1 3.86Å; V1051-I1055 WeakPolarHBondContact O-CG1 3.28Å; V1051-I1055 PolarHBondContact O-N 2.85Å; A1052-I1055 PolarHBondContact O-N 3.02Å; V1053-I1055 VanDerWaalsContact C-N 3.29Å; V1053-I1055 PolarHBondContact O-N 2.92Å
1056	V	79.6	Confident	85.1	Confident	70 Å²	70	65.9 Å²	65.9	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-142.3	38.4	-168.7	-70	0	0	0	0	114.8	A1052 Y1058 S1059 I1062	A1052-V1056 WeakPolarHBondContact O-CG2 3.19Å; A1052-V1056 PolarHBondContact O-N 2.86Å; V1056-Y1058 PolarHBondContact O-N 2.73Å; V1056-S1059 WeakPolarHBondContact O-CB 3.37Å; V1056-S1059 PolarHBondContact O-N 3.1Å; V1056-I1062 HydrophobicContact CG2-CD1 4.5Å
1057	R	77.9	Confident	85	Confident	53 Å²	53	67.8 Å²	67.8	20%	0.2	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-34.3	178.9	56.8	-172.5	-170.8	-158	-1	115.8	D1009 S1012 F1016 V1053	D1009-R1057 IonicContact OD1-CZ 2.69Å; D1009-R1057 VanDerWaalsContact OD1-CZ 3.24Å; D1009-R1057 IonicContact OD1-NH1 2.85Å; D1009-R1057 PolarHBondContact OD1-NH1 2.99Å; D1009-R1057 IonicContact OD1-NH2 3.7Å; D1009-R1057 PolarHBondContact OD1-NH2 3.44Å; S1012-R1057 PolarHBondContact OG-NH1 3.29Å; S1012-R1057 VanDerWaalsContact OG-NH1 3.16Å; F1016-R1057 HydrophobicContact CD2-CB 4.21Å; F1016-R1057 HydrophobicContact CG-CB 4.34Å; V1053-R1057 HydrophobicContact CG1-CB 3.81Å; V1053-R1057 VanDerWaalsContact O-CB 3.23Å; V1053-R1057 WeakPolarHBondContact O-CB 3.37Å; V1053-R1057 PolarHBondContact O-N 3.08Å; V1053-R1057 VanDerWaalsContact O-N 3.14Å
1058	Y	71.9	Confident	84.9	Confident	158 Å²	158	66.5 Å²	66.5	62%	0.62	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.2	-178.8	-50.6	-64	0	0	0	115.1	F1016 V1056	F1016-Y1058 HydrophobicContact CE2-CD1 4.16Å; F1016-Y1058 AromaticContact CE2-CE1 3.94Å; F1016-Y1058 HydrophobicContact CE2-CE1 3.94Å; F1016-Y1058 HydrophobicContact CZ-CD1 4.1Å; F1016-Y1058 HydrophobicContact CZ-CE1 4.27Å; V1056-Y1058 PolarHBondContact O-N 2.73Å
1059	S	78.2	Confident	85	Confident	56 Å²	56	66.1 Å²	66.1	39%	0.392	36%	0.358	S	S	.	.			trans	-87.4	127.4	-177.8	-179.7	0	0	0	0	112.1	V1056 G1061 I1062	V1056-S1059 WeakPolarHBondContact O-CB 3.37Å; V1056-S1059 PolarHBondContact O-N 3.1Å; S1059-G1061 PolarHBondContact O-N 3.33Å; S1059-G1061 PolarHBondContact OG-N 2.89Å; S1059-I1062 WeakPolarHBondContact O-CB 3.3Å; S1059-I1062 WeakPolarHBondContact O-CG2 3.48Å; S1059-I1062 PolarHBondContact O-N 2.79Å
1060	I	79.2	Confident	84.9	Confident	93 Å²	93	65.6 Å²	65.6	48%	0.477	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.8	176.4	-53.6	170.7	0	0	0	111.8	I1062 I1063 L1064 F1114	I1060-I1062 PolarHBondContact O-N 2.79Å; I1060-I1063 PolarHBondContact O-N 2.87Å; I1060-L1064 HydrophobicContact CG2-CD1 3.96Å; I1060-L1064 HydrophobicContact CG2-CG 4.44Å; I1060-L1064 PolarHBondContact O-N 2.84Å; I1060-F1114 HydrophobicContact CD1-CE1 3.93Å; I1060-F1114 HydrophobicContact CG1-CE1 4.17Å; I1060-F1114 HydrophobicContact CG2-CE1 3.99Å; I1060-F1114 HydrophobicContact CG2-CZ 3.85Å
1061	G	79.4	Confident	85	Confident	31 Å²	31	67 Å²	67	32%	0.32	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-26.7	176.3	0	0	0	0	0	114.3	S1059 I1063 L1064 V1065	S1059-G1061 PolarHBondContact O-N 3.33Å; S1059-G1061 PolarHBondContact OG-N 2.89Å; G1061-I1063 VanDerWaalsContact C-N 3.28Å; G1061-I1063 PolarHBondContact O-N 3.47Å; G1061-L1064 PolarHBondContact O-N 2.82Å; G1061-V1065 WeakPolarHBondContact O-CG2 3.33Å; G1061-V1065 PolarHBondContact O-N 2.98Å
1062	I	84.4	Confident	85.2	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.062	36%	0.363	C	S	.	.	H	α-helix	trans	-69.9	-25.4	-179.6	-149.1	176.7	0	0	0	112.8	I1020 A1052 V1053 V1056 S1059 I1060 P1066	I1020-I1062 HydrophobicContact CD1-CB 4.41Å; I1020-I1062 HydrophobicContact CD1-CD1 3.94Å; I1020-I1062 HydrophobicContact CD1-CG1 4.01Å; I1020-I1062 HydrophobicContact CD1-CG2 3.63Å; I1020-I1062 HydrophobicContact CG1-CG2 4.47Å; A1052-I1062 HydrophobicContact CB-CD1 3.94Å; A1052-I1062 HydrophobicContact CB-CG1 4.1Å; V1053-I1062 HydrophobicContact CB-CD1 4.24Å; V1053-I1062 HydrophobicContact CG2-CD1 3.65Å; V1056-I1062 HydrophobicContact CG2-CD1 4.5Å; S1059-I1062 WeakPolarHBondContact O-CB 3.3Å; S1059-I1062 WeakPolarHBondContact O-CG2 3.48Å; S1059-I1062 PolarHBondContact O-N 2.79Å; I1060-I1062 PolarHBondContact O-N 2.79Å; I1062-P1066 WeakPolarHBondContact O-CD 3.32Å; I1062-P1066 WeakPolarHBondContact O-CG 3.27Å
1063	I	83.3	Confident	85.4	Confident	62 Å²	62	69 Å²	69	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-88.7	-43.7	174.3	-60.2	172.1	0	0	0	109.7	I1020 I1023 I1060 G1061 V1065 L1067	I1020-I1063 HydrophobicContact CG1-CG1 4.29Å; I1023-I1063 HydrophobicContact CD1-CG2 4.35Å; I1060-I1063 PolarHBondContact O-N 2.87Å; G1061-I1063 VanDerWaalsContact C-N 3.28Å; G1061-I1063 PolarHBondContact O-N 3.47Å; I1063-V1065 PolarHBondContact O-N 3.46Å; I1063-L1067 VanDerWaalsContact O-CB 3.31Å; I1063-L1067 WeakPolarHBondContact O-CB 3.42Å; I1063-L1067 PolarHBondContact O-N 2.87Å
1064	L	86.1	Confident	85.6	Confident	91 Å²	91	69.5 Å²	69.5	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-44.5	-177.6	-82.3	167.8	0	0	0	113.3	I1060 G1061 L1067 I1068	I1060-L1064 HydrophobicContact CG2-CD1 3.96Å; I1060-L1064 HydrophobicContact CG2-CG 4.44Å; I1060-L1064 PolarHBondContact O-N 2.84Å; G1061-L1064 PolarHBondContact O-N 2.82Å; L1064-L1067 PolarHBondContact O-N 3.21Å; L1064-I1068 HydrophobicContact CB-CD1 4.37Å; L1064-I1068 HydrophobicContact CD2-CD1 4.44Å; L1064-I1068 WeakPolarHBondContact O-CB 3.24Å; L1064-I1068 VanDerWaalsContact O-CG1 3.27Å; L1064-I1068 WeakPolarHBondContact O-CG1 3.18Å; L1064-I1068 PolarHBondContact O-N 3.11Å
1065	V	87.6	Confident	86.1	Confident	92 Å²	92	67.6 Å²	67.6	56%	0.558	36%	0.359	S	S	*	.	H	α-helix	trans	-64.3	-51.3	-173.4	169.6	0	0	0	0	112.7	G1061 I1063 L1067 I1068 V1069	G1061-V1065 WeakPolarHBondContact O-CG2 3.33Å; G1061-V1065 PolarHBondContact O-N 2.98Å; I1063-V1065 PolarHBondContact O-N 3.46Å; V1065-L1067 VanDerWaalsContact C-N 3.27Å; V1065-L1067 PolarHBondContact O-N 2.9Å; V1065-I1068 PolarHBondContact O-N 3.39Å; V1065-V1069 VanDerWaalsContact O-CG2 3.32Å; V1065-V1069 WeakPolarHBondContact O-CG2 3.45Å; V1065-V1069 PolarHBondContact O-N 3.41Å
1066	P	88.3	Confident	86.6	Confident	15 Å²	15	69.5 Å²	69.5	10%	0.097	36%	0.36	C	S	.	.	H	α-helix	trans	-60.1	-35.9	174.9	-24.5	35.1	0	0	0	113.2	I1020 W1024 L1049 I1062 G1070	I1020-P1066 HydrophobicContact CG2-CB 4.46Å; I1020-P1066 HydrophobicContact CG2-CG 3.92Å; W1024-P1066 HydrophobicContact CE3-CB 3.97Å; L1049-P1066 HydrophobicContact CD2-CG 4Å; I1062-P1066 WeakPolarHBondContact O-CD 3.32Å; I1062-P1066 WeakPolarHBondContact O-CG 3.27Å; P1066-G1070 PolarHBondContact O-N 2.93Å
1067	L	89.1	Confident	87.2	Confident	65 Å²	65	67 Å²	67	34%	0.34	35%	0.345	S	S	.	.	H	α-helix	trans	-71.6	-44	-177.2	-154.4	165.4	0	0	0	111.3	I1023 I1063 L1064 V1065 G1070 L1071	I1023-L1067 HydrophobicContact CG2-CB 4.5Å; I1023-L1067 HydrophobicContact CG2-CD1 4.33Å; I1023-L1067 HydrophobicContact CG2-CG 4.17Å; I1063-L1067 VanDerWaalsContact O-CB 3.31Å; I1063-L1067 WeakPolarHBondContact O-CB 3.42Å; I1063-L1067 PolarHBondContact O-N 2.87Å; L1064-L1067 PolarHBondContact O-N 3.21Å; V1065-L1067 VanDerWaalsContact C-N 3.27Å; V1065-L1067 PolarHBondContact O-N 2.9Å; L1067-G1070 PolarHBondContact O-N 2.8Å; L1067-L1071 HydrophobicContact CD2-CD1 3.62Å; L1067-L1071 HydrophobicContact CD2-CG 4.08Å; L1067-L1071 WeakPolarHBondContact O-CB 3.45Å; L1067-L1071 WeakPolarHBondContact O-CG 3.43Å; L1067-L1071 PolarHBondContact O-N 2.88Å
1068	I	91.9	Very high	87.9	Confident	89 Å²	89	65.3 Å²	65.3	46%	0.456	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-46.9	174.1	-68.7	165.3	0	0	0	110.9	L1064 V1065 G1070 L1071 I1072	L1064-I1068 HydrophobicContact CB-CD1 4.37Å; L1064-I1068 HydrophobicContact CD2-CD1 4.44Å; L1064-I1068 WeakPolarHBondContact O-CB 3.24Å; L1064-I1068 VanDerWaalsContact O-CG1 3.27Å; L1064-I1068 WeakPolarHBondContact O-CG1 3.18Å; L1064-I1068 PolarHBondContact O-N 3.11Å; V1065-I1068 PolarHBondContact O-N 3.39Å; I1068-G1070 VanDerWaalsContact C-N 3.35Å; I1068-G1070 PolarHBondContact O-N 2.95Å; I1068-L1071 PolarHBondContact O-N 2.72Å; I1068-I1072 HydrophobicContact CG2-CD1 4.08Å; I1068-I1072 WeakPolarHBondContact O-CG1 3.49Å; I1068-I1072 PolarHBondContact O-N 3.01Å
1069	V	92.8	Very high	88.8	Confident	61 Å²	61	62.5 Å²	62.5	37%	0.37	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-41.7	178.2	174.1	0	0	0	0	111	W1024 V1065 I1072 I1073	W1024-V1069 HydrophobicContact CH2-CG1 3.82Å; W1024-V1069 HydrophobicContact CZ3-CB 4.13Å; W1024-V1069 HydrophobicContact CZ3-CG1 3.86Å; V1065-V1069 VanDerWaalsContact O-CG2 3.32Å; V1065-V1069 WeakPolarHBondContact O-CG2 3.45Å; V1065-V1069 PolarHBondContact O-N 3.41Å; V1069-I1072 PolarHBondContact O-N 2.77Å; V1069-I1073 HydrophobicContact CG1-CD1 3.97Å; V1069-I1073 WeakPolarHBondContact O-CG1 3.3Å; V1069-I1073 PolarHBondContact O-N 2.85Å; V1069-I1073 VanDerWaalsContact O-N 3.09Å
1070	G	91.1	Very high	89.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-42.8	174.7	0	0	0	0	0	113.1	P1066 L1067 I1068 I1073 I1074	P1066-G1070 PolarHBondContact O-N 2.93Å; L1067-G1070 PolarHBondContact O-N 2.8Å; I1068-G1070 VanDerWaalsContact C-N 3.35Å; I1068-G1070 PolarHBondContact O-N 2.95Å; G1070-I1073 PolarHBondContact O-N 2.66Å; G1070-I1074 VanDerWaalsContact O-CG1 3.32Å; G1070-I1074 WeakPolarHBondContact O-CG1 3.44Å; G1070-I1074 PolarHBondContact O-N 2.87Å
1071	L	92.5	Very high	89.8	Confident	80 Å²	80	58.8 Å²	58.8	42%	0.419	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-41.4	175.5	-76.2	170.5	0	0	0	112.5	L1067 I1068 I1073 I1074 L1075	L1067-L1071 HydrophobicContact CD2-CD1 3.62Å; L1067-L1071 HydrophobicContact CD2-CG 4.08Å; L1067-L1071 WeakPolarHBondContact O-CB 3.45Å; L1067-L1071 WeakPolarHBondContact O-CG 3.43Å; L1067-L1071 PolarHBondContact O-N 2.88Å; I1068-L1071 PolarHBondContact O-N 2.72Å; L1071-I1073 VanDerWaalsContact C-N 3.33Å; L1071-I1073 PolarHBondContact O-N 2.82Å; L1071-I1074 PolarHBondContact O-N 2.69Å; L1071-L1075 WeakPolarHBondContact O-CB 3.34Å; L1071-L1075 VanDerWaalsContact O-CG 3.31Å; L1071-L1075 WeakPolarHBondContact O-CG 2.94Å; L1071-L1075 PolarHBondContact O-N 2.92Å
1072	I	94.8	Very high	90.3	Very high	107 Å²	107	58.8 Å²	58.8	55%	0.549	30%	0.304	S	S	.	.	H	α-helix	trans	-61.4	-42.7	175.6	-67.2	164.8	0	0	0	110.7	I1068 V1069 Y1076	I1068-I1072 HydrophobicContact CG2-CD1 4.08Å; I1068-I1072 WeakPolarHBondContact O-CG1 3.49Å; I1068-I1072 PolarHBondContact O-N 3.01Å; V1069-I1072 PolarHBondContact O-N 2.77Å; I1072-Y1076 WeakPolarHBondContact O-CB 3.31Å; I1072-Y1076 PolarHBondContact O-N 3.34Å
1073	I	93.4	Very high	90.5	Very high	46 Å²	46	63.9 Å²	63.9	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-64.7	-43.5	177.5	-67.1	165.1	0	0	0	111.4	W1024 L1028 A1031 I1033 V1069 G1070 L1071 S1077	W1024-I1073 HydrophobicContact CH2-CD1 4.12Å; L1028-I1073 HydrophobicContact CD2-CD1 4.3Å; L1028-I1073 HydrophobicContact CD2-CG2 4.28Å; A1031-I1073 HydrophobicContact CB-CG2 4.08Å; I1033-I1073 HydrophobicContact CD1-CG2 3.57Å; V1069-I1073 HydrophobicContact CG1-CD1 3.97Å; V1069-I1073 WeakPolarHBondContact O-CG1 3.3Å; V1069-I1073 PolarHBondContact O-N 2.85Å; V1069-I1073 VanDerWaalsContact O-N 3.09Å; G1070-I1073 PolarHBondContact O-N 2.66Å; L1071-I1073 VanDerWaalsContact C-N 3.33Å; L1071-I1073 PolarHBondContact O-N 2.82Å; I1073-S1077 WeakPolarHBondContact O-CB 3.39Å; I1073-S1077 PolarHBondContact O-N 2.92Å
1074	I	92.1	Very high	90.7	Very high	11 Å²	11	67.6 Å²	67.6	6%	0.056	34%	0.344	C	S	.	.	H	α-helix	trans	-60.8	-53.2	175.8	-69.4	164.8	0	0	0	110.4	T1027 I1030 A1031 G1070 L1071 Y1076 S1077 W1078	T1027-I1074 HydrophobicContact CG2-CD1 4.03Å; T1027-I1074 WeakPolarHBondContact O-CG1 3.23Å; I1030-I1074 HydrophobicContact CB-CD1 4.37Å; I1030-I1074 HydrophobicContact CG2-CD1 4.19Å; I1030-I1074 HydrophobicContact CG2-CG1 4.39Å; I1030-I1074 HydrophobicContact CG2-CG2 4.46Å; A1031-I1074 HydrophobicContact CB-CG1 4.21Å; G1070-I1074 VanDerWaalsContact O-CG1 3.32Å; G1070-I1074 WeakPolarHBondContact O-CG1 3.44Å; G1070-I1074 PolarHBondContact O-N 2.87Å; L1071-I1074 PolarHBondContact O-N 2.69Å; I1074-Y1076 PolarHBondContact O-N 2.73Å; I1074-S1077 PolarHBondContact O-N 2.89Å; I1074-W1078 HydrophobicContact CG2-CD2 3.52Å; I1074-W1078 VanDerWaalsContact CG2-CE2 3.5Å; I1074-W1078 HydrophobicContact CG2-CE3 3.76Å; I1074-W1078 HydrophobicContact CG2-CG 4.11Å; I1074-W1078 HydrophobicContact CG2-CH2 4Å; I1074-W1078 HydrophobicContact CG2-CZ2 3.79Å; I1074-W1078 HydrophobicContact CG2-CZ3 3.96Å; I1074-W1078 WeakPolarHBondContact O-CB 3.48Å; I1074-W1078 PolarHBondContact O-N 3.42Å
1075	L	92.7	Very high	90.5	Very high	99 Å²	99	64.5 Å²	64.5	52%	0.518	33%	0.328	S	S	.	.	H	α-helix	trans	-58.2	-48	-178.5	-74.3	168.2	0	0	0	111.4	L1071 S1077 W1078 I1079	L1071-L1075 WeakPolarHBondContact O-CB 3.34Å; L1071-L1075 VanDerWaalsContact O-CG 3.31Å; L1071-L1075 WeakPolarHBondContact O-CG 2.94Å; L1071-L1075 PolarHBondContact O-N 2.92Å; L1075-S1077 VanDerWaalsContact C-N 3.35Å; L1075-S1077 PolarHBondContact O-N 3.29Å; L1075-W1078 PolarHBondContact O-N 2.98Å; L1075-I1079 VanDerWaalsContact O-CB 3.32Å; L1075-I1079 WeakPolarHBondContact O-CB 3.22Å; L1075-I1079 WeakPolarHBondContact O-CD1 3.45Å; L1075-I1079 WeakPolarHBondContact O-CG1 3.46Å; L1075-I1079 PolarHBondContact O-N 2.91Å
1076	Y	93.1	Very high	90.2	Very high	169 Å²	169	71.6 Å²	71.6	66%	0.663	35%	0.345	S	S	*	.	H	α-helix	trans	-60.2	-43.4	177.7	179.7	-100.1	0	0	0	112.2	I1072 I1074 N1080	I1072-Y1076 WeakPolarHBondContact O-CB 3.31Å; I1072-Y1076 PolarHBondContact O-N 3.34Å; I1074-Y1076 PolarHBondContact O-N 2.73Å; Y1076-N1080 WeakPolarHBondContact CE1-ND2 3.44Å; Y1076-N1080 WeakPolarHBondContact CE2-ND2 3.26Å; Y1076-N1080 VanDerWaalsContact CZ-ND2 3.27Å; Y1076-N1080 WeakPolarHBondContact O-CB 3.47Å; Y1076-N1080 PolarHBondContact O-N 2.86Å; Y1076-N1080 PolarHBondContact O-ND2 3.18Å
1077	S	92.4	Very high	89.8	Confident	16 Å²	16	73 Å²	73	11%	0.112	36%	0.356	C	S	.	.	H	α-helix	trans	-68	-48.1	179.1	-164.6	0	0	0	0	111.9	A1031 I1073 I1074 L1075 I1079 N1080 L1081	A1031-S1077 VanDerWaalsContact O-CB 3.25Å; A1031-S1077 WeakPolarHBondContact O-CB 3.34Å; A1031-S1077 PolarHBondContact O-OG 2.95Å; I1073-S1077 WeakPolarHBondContact O-CB 3.39Å; I1073-S1077 PolarHBondContact O-N 2.92Å; I1074-S1077 PolarHBondContact O-N 2.89Å; L1075-S1077 VanDerWaalsContact C-N 3.35Å; L1075-S1077 PolarHBondContact O-N 3.29Å; S1077-I1079 PolarHBondContact O-N 2.85Å; S1077-N1080 PolarHBondContact O-N 2.93Å; S1077-L1081 VanDerWaalsContact O-CG 3.31Å; S1077-L1081 WeakPolarHBondContact O-CG 3.44Å; S1077-L1081 PolarHBondContact O-N 3.14Å
1078	W	91.1	Very high	89.4	Confident	18 Å²	18	75.1 Å²	75.1	7%	0.068	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-42	179.8	-71	1.2	0	0	0	112.6	I1030 I1074 L1075 N1080 L1081 C1082 F1089 P1090 W1094 W1095 F1099 W1147	I1030-W1078 HydrophobicContact CG2-CH2 4.18Å; I1030-W1078 HydrophobicContact CG2-CZ2 3.39Å; I1030-W1078 PolarHBondContact O-NE1 2.83Å; I1074-W1078 HydrophobicContact CG2-CD2 3.52Å; I1074-W1078 VanDerWaalsContact CG2-CE2 3.5Å; I1074-W1078 HydrophobicContact CG2-CE3 3.76Å; I1074-W1078 HydrophobicContact CG2-CG 4.11Å; I1074-W1078 HydrophobicContact CG2-CH2 4Å; I1074-W1078 HydrophobicContact CG2-CZ2 3.79Å; I1074-W1078 HydrophobicContact CG2-CZ3 3.96Å; I1074-W1078 WeakPolarHBondContact O-CB 3.48Å; I1074-W1078 PolarHBondContact O-N 3.42Å; L1075-W1078 PolarHBondContact O-N 2.98Å; W1078-N1080 PolarHBondContact O-N 2.04Å; W1078-L1081 PolarHBondContact O-N 3.23Å; W1078-C1082 WeakPolarHBondContact O-CB 3.47Å; W1078-C1082 PolarHBondContact O-N 2.71Å; W1078-C1082 PolarHBondContact O-SG 3.21Å; W1078-F1089 AromaticContact CD1-CD1 3.9Å; W1078-F1089 AromaticContact CD1-CE1 3.89Å; W1078-F1089 HydrophobicContact CG-CD1 4.4Å; W1078-P1090 HydrophobicContact CD2-CG 4.27Å; W1078-P1090 VanDerWaalsContact CE2-CD 3.4Å; W1078-P1090 HydrophobicContact CH2-CG 4.05Å; W1078-P1090 HydrophobicContact CZ2-CG 3.4Å; W1078-P1090 VanDerWaalsContact CZ2-CG 3.4Å; W1078-W1094 AromaticContact CH2-CZ3 3.94Å; W1078-W1094 HydrophobicContact CH2-CZ3 3.94Å; W1078-W1094 HydrophobicContact CZ2-CH2 4.4Å; W1078-W1094 AromaticContact CZ2-CZ3 3.99Å; W1078-W1094 HydrophobicContact CZ2-CZ3 3.99Å; W1078-W1095 HydrophobicContact CE3-CH2 4.2Å; W1078-W1095 AromaticContact CE3-CZ2 3.88Å; W1078-W1095 HydrophobicContact CE3-CZ2 3.88Å; W1078-W1095 HydrophobicContact CH2-CH2 4.38Å; W1078-W1095 HydrophobicContact CH2-CZ2 4.16Å; W1078-W1095 AromaticContact CZ3-CH2 3.52Å; W1078-W1095 HydrophobicContact CZ3-CH2 3.52Å; W1078-W1095 AromaticContact CZ3-CZ2 3.41Å; W1078-W1095 HydrophobicContact CZ3-CZ2 3.41Å; W1078-W1095 VanDerWaalsContact CZ3-CZ2 3.41Å; W1078-W1095 HydrophobicContact CZ3-CZ3 4.47Å; W1078-F1099 HydrophobicContact CH2-CD2 4.4Å; W1078-F1099 HydrophobicContact CH2-CE2 4.15Å; W1078-F1099 HydrophobicContact CH2-CZ 4.45Å; W1078-W1147 HydrophobicContact CZ2-CH2 4.48Å
1079	I	91.3	Very high	88.9	Confident	99 Å²	99	71 Å²	71	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-47.1	175	-70.6	166	0	0	0	110.6	L1075 S1077 L1081 C1082 I1083	L1075-I1079 VanDerWaalsContact O-CB 3.32Å; L1075-I1079 WeakPolarHBondContact O-CB 3.22Å; L1075-I1079 WeakPolarHBondContact O-CD1 3.45Å; L1075-I1079 WeakPolarHBondContact O-CG1 3.46Å; L1075-I1079 PolarHBondContact O-N 2.91Å; S1077-I1079 PolarHBondContact O-N 2.85Å; I1079-L1081 VanDerWaalsContact C-N 3.32Å; I1079-L1081 PolarHBondContact O-N 2.9Å; I1079-C1082 PolarHBondContact O-N 3.2Å; I1079-I1083 HydrophobicContact CG2-CD1 3.75Å; I1079-I1083 VanDerWaalsContact O-CG1 3.26Å; I1079-I1083 WeakPolarHBondContact O-CG1 3.36Å; I1079-I1083 PolarHBondContact O-N 2.92Å
1080	N	90.9	Very high	88.5	Confident	58 Å²	58	68.1 Å²	68.1	31%	0.31	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-36.3	176.9	-81.7	-64.3	0	0	0	113	Y1076 S1077 W1078 K1084	Y1076-N1080 WeakPolarHBondContact CE1-ND2 3.44Å; Y1076-N1080 WeakPolarHBondContact CE2-ND2 3.26Å; Y1076-N1080 VanDerWaalsContact CZ-ND2 3.27Å; Y1076-N1080 WeakPolarHBondContact O-CB 3.47Å; Y1076-N1080 PolarHBondContact O-N 2.86Å; Y1076-N1080 PolarHBondContact O-ND2 3.18Å; S1077-N1080 PolarHBondContact O-N 2.93Å; W1078-N1080 PolarHBondContact O-N 2.04Å; N1080-K1084 WeakPolarHBondContact O-CG 3.04Å; N1080-K1084 PolarHBondContact O-N 2.96Å
1081	L	88.3	Confident	88	Confident	13 Å²	13	68.7 Å²	68.7	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-70.6	-44.4	176.3	-70.6	171.9	0	0	0	111.5	A1032 S1077 W1078 I1079 I1083 K1084 L1085 F1089 L1151 I1155	A1032-L1081 HydrophobicContact CB-CD1 4.26Å; S1077-L1081 VanDerWaalsContact O-CG 3.31Å; S1077-L1081 WeakPolarHBondContact O-CG 3.44Å; S1077-L1081 PolarHBondContact O-N 3.14Å; W1078-L1081 PolarHBondContact O-N 3.23Å; I1079-L1081 VanDerWaalsContact C-N 3.32Å; I1079-L1081 PolarHBondContact O-N 2.9Å; L1081-I1083 PolarHBondContact O-N 2.88Å; L1081-K1084 PolarHBondContact O-N 2.85Å; L1081-L1085 VanDerWaalsContact O-CB 3.25Å; L1081-L1085 WeakPolarHBondContact O-CB 3.04Å; L1081-L1085 WeakPolarHBondContact O-CG 3.24Å; L1081-L1085 PolarHBondContact O-N 2.82Å; L1081-F1089 HydrophobicContact CB-CB 4.34Å; L1081-F1089 HydrophobicContact CB-CD1 4Å; L1081-F1089 HydrophobicContact CB-CG 4.2Å; L1081-F1089 HydrophobicContact CD1-CD1 3.66Å; L1081-F1089 HydrophobicContact CD1-CE1 3.49Å; L1081-F1089 VanDerWaalsContact CD1-CE1 3.49Å; L1081-F1089 HydrophobicContact CD1-CG 4.42Å; L1081-F1089 HydrophobicContact CD1-CZ 4.13Å; L1081-F1089 HydrophobicContact CG-CD1 4.49Å; L1081-L1151 HydrophobicContact CD1-CD2 4.27Å; L1081-L1151 HydrophobicContact CD2-CD2 3.8Å; L1081-I1155 HydrophobicContact CD2-CD1 4.2Å
1082	C	88.8	Confident	87.5	Confident	31 Å²	31	67.8 Å²	67.8	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-58.2	-44.8	174.5	-71.3	0	0	0	0	112.4	W1078 I1079 K1084 L1085 R1086 S1087 F1089	W1078-C1082 WeakPolarHBondContact O-CB 3.47Å; W1078-C1082 PolarHBondContact O-N 2.71Å; W1078-C1082 PolarHBondContact O-SG 3.21Å; I1079-C1082 PolarHBondContact O-N 3.2Å; C1082-K1084 VanDerWaalsContact C-N 3.33Å; C1082-K1084 PolarHBondContact O-N 2.88Å; C1082-L1085 PolarHBondContact O-N 2.83Å; C1082-R1086 WeakPolarHBondContact O-CA 3.36Å; C1082-R1086 PolarHBondContact O-N 2.92Å; C1082-S1087 WeakPolarHBondContact CA-O 3.17Å; C1082-F1089 PolarHBondContact SG-N 2.96Å
1083	I	89.1	Confident	86.8	Confident	119 Å²	119	62.8 Å²	62.8	61%	0.61	30%	0.301	S	S	*	.	H	α-helix	trans	-60.4	-43	178	-70.8	165.8	0	0	0	110.9	I1079 L1081	I1079-I1083 HydrophobicContact CG2-CD1 3.75Å; I1079-I1083 VanDerWaalsContact O-CG1 3.26Å; I1079-I1083 WeakPolarHBondContact O-CG1 3.36Å; I1079-I1083 PolarHBondContact O-N 2.92Å; L1081-I1083 PolarHBondContact O-N 2.88Å
1084	K	87.1	Confident	86.5	Confident	140 Å²	140	60.6 Å²	60.6	61%	0.609	29%	0.289	S	S	*	.	H	α-helix	trans	-75.1	-36.2	179.2	-67.9	178.7	-179.8	-173.9	0	113.2	N1080 L1081 C1082 R1086 I1154	N1080-K1084 WeakPolarHBondContact O-CG 3.04Å; N1080-K1084 PolarHBondContact O-N 2.96Å; L1081-K1084 PolarHBondContact O-N 2.85Å; C1082-K1084 VanDerWaalsContact C-N 3.33Å; C1082-K1084 PolarHBondContact O-N 2.88Å; K1084-R1086 VanDerWaalsContact C-N 3.34Å; K1084-I1154 HydrophobicContact CB-CD1 3.61Å; K1084-I1154 HydrophobicContact CB-CG1 4.36Å; K1084-I1154 HydrophobicContact CD-CG2 4.26Å
1085	L	82	Confident	86.2	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-78.2	-15.5	179	-77.1	169.1	0	0	0	113.8	L1081 C1082 S1087 F1089 A1150 L1151 I1154	L1081-L1085 VanDerWaalsContact O-CB 3.25Å; L1081-L1085 WeakPolarHBondContact O-CB 3.04Å; L1081-L1085 WeakPolarHBondContact O-CG 3.24Å; L1081-L1085 PolarHBondContact O-N 2.82Å; C1082-L1085 PolarHBondContact O-N 2.83Å; L1085-S1087 PolarHBondContact O-N 2.97Å; L1085-S1087 PolarHBondContact O-OG 3.41Å; L1085-F1089 HydrophobicContact CD1-CB 3.72Å; L1085-F1089 HydrophobicContact CD1-CD2 3.85Å; L1085-F1089 HydrophobicContact CD1-CG 4.05Å; L1085-A1150 WeakPolarHBondContact CD2-O 3.43Å; L1085-L1151 HydrophobicContact CD1-CD2 4.31Å; L1085-I1154 HydrophobicContact CB-CD1 4.19Å; L1085-I1154 HydrophobicContact CD2-CD1 3.38Å; L1085-I1154 HydrophobicContact CD2-CG1 4.38Å; L1085-I1154 HydrophobicContact CG-CD1 3.43Å; L1085-I1154 VanDerWaalsContact CG-CD1 3.43Å
1086	R	81.9	Confident	85.9	Confident	241 Å²	241	62.8 Å²	62.8	91%	0.909	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	23.5	-166.8	-62.9	-175.6	173.4	-175.3	-1.5	113.7	C1082 K1084	C1082-R1086 WeakPolarHBondContact O-CA 3.36Å; C1082-R1086 PolarHBondContact O-N 2.92Å; K1084-R1086 VanDerWaalsContact C-N 3.34Å
1087	S	79.6	Confident	85.5	Confident	45 Å²	45	58.2 Å²	58.2	32%	0.315	28%	0.282	S	S	.	.	S	Bend	trans	-153.1	158	-175.1	54	0	0	0	0	110.1	C1082 L1085 F1089	C1082-S1087 WeakPolarHBondContact CA-O 3.17Å; L1085-S1087 PolarHBondContact O-N 2.97Å; L1085-S1087 PolarHBondContact O-OG 3.41Å; S1087-F1089 PolarHBondContact O-N 3.01Å
1088	L	81.3	Confident	85.2	Confident	108 Å²	108	57.9 Å²	57.9	57%	0.565	28%	0.28	S	S	*	.			trans	-72.7	124.5	-170.3	-166.2	74.8	0	0	0	111.9
1089	F	81.8	Confident	85.1	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	29%	0.285	C	S	.	.	S	Bend	trans	-120.3	136.3	175.2	-176.7	-88.4	0	0	0	110.7	A1032 W1078 L1081 C1082 L1085 S1087 W1147 L1151	A1032-F1089 HydrophobicContact CB-CE1 4.16Å; A1032-F1089 HydrophobicContact CB-CZ 4.06Å; W1078-F1089 AromaticContact CD1-CD1 3.9Å; W1078-F1089 AromaticContact CD1-CE1 3.89Å; W1078-F1089 HydrophobicContact CG-CD1 4.4Å; L1081-F1089 HydrophobicContact CB-CB 4.34Å; L1081-F1089 HydrophobicContact CB-CD1 4Å; L1081-F1089 HydrophobicContact CB-CG 4.2Å; L1081-F1089 HydrophobicContact CD1-CD1 3.66Å; L1081-F1089 HydrophobicContact CD1-CE1 3.49Å; L1081-F1089 VanDerWaalsContact CD1-CE1 3.49Å; L1081-F1089 HydrophobicContact CD1-CG 4.42Å; L1081-F1089 HydrophobicContact CD1-CZ 4.13Å; L1081-F1089 HydrophobicContact CG-CD1 4.49Å; C1082-F1089 PolarHBondContact SG-N 2.96Å; L1085-F1089 HydrophobicContact CD1-CB 3.72Å; L1085-F1089 HydrophobicContact CD1-CD2 3.85Å; L1085-F1089 HydrophobicContact CD1-CG 4.05Å; S1087-F1089 PolarHBondContact O-N 3.01Å; F1089-W1147 HydrophobicContact CE1-CE3 4.29Å; F1089-W1147 HydrophobicContact CE1-CZ3 4.1Å; F1089-W1147 HydrophobicContact CE2-CE3 4.36Å; F1089-W1147 HydrophobicContact CZ-CD2 4.15Å; F1089-W1147 AromaticContact CZ-CE3 3.55Å; F1089-W1147 HydrophobicContact CZ-CE3 3.55Å; F1089-W1147 AromaticContact CZ-CZ3 3.83Å; F1089-W1147 HydrophobicContact CZ-CZ3 3.83Å; F1089-L1151 HydrophobicContact CD2-CD2 4.06Å; F1089-L1151 HydrophobicContact CD2-CG 4.36Å; F1089-L1151 HydrophobicContact CE2-CD1 3.86Å; F1089-L1151 HydrophobicContact CE2-CD2 3.7Å; F1089-L1151 HydrophobicContact CE2-CG 3.65Å; F1089-L1151 HydrophobicContact CZ-CD1 3.89Å; F1089-L1151 HydrophobicContact CZ-CD2 4.13Å; F1089-L1151 HydrophobicContact CZ-CG 4.17Å
1090	P	82.6	Confident	85.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	S	Bend	cis	-65.1	162.5	-6.6	-22.5	35.3	0	0	0	113	W1078 W1094 W1095 W1147	W1078-P1090 HydrophobicContact CD2-CG 4.27Å; W1078-P1090 VanDerWaalsContact CE2-CD 3.4Å; W1078-P1090 HydrophobicContact CH2-CG 4.05Å; W1078-P1090 HydrophobicContact CZ2-CG 3.4Å; W1078-P1090 VanDerWaalsContact CZ2-CG 3.4Å; P1090-W1094 HydrophobicContact CB-CD2 4.47Å; P1090-W1094 HydrophobicContact CB-CE3 3.82Å; P1090-W1094 HydrophobicContact CB-CZ3 4.36Å; P1090-W1094 HydrophobicContact CG-CE3 3.94Å; P1090-W1094 HydrophobicContact CG-CZ3 3.96Å; P1090-W1095 PolarHBondContact O-NE1 2.92Å; P1090-W1147 HydrophobicContact CB-CH2 4.09Å; P1090-W1147 HydrophobicContact CB-CZ2 3.56Å; P1090-W1147 HydrophobicContact CG-CH2 3.52Å; P1090-W1147 HydrophobicContact CG-CZ2 3.48Å; P1090-W1147 VanDerWaalsContact CG-CZ2 3.48Å; P1090-W1147 HydrophobicContact CG-CZ3 4.3Å
1091	P	81.3	Confident	85.3	Confident	13 Å²	13	57.4 Å²	57.4	8%	0.084	28%	0.279	C	S	.	.			trans	-64.6	143.7	-177.6	26.9	-35.5	0	0	0	112.3	Q1093 W1094 P1278	P1091-Q1093 VanDerWaalsContact C-N 3.28Å; P1091-Q1093 HydrophobicContact CB-CG 4.48Å; P1091-Q1093 PolarHBondContact O-N 3.43Å; P1091-Q1093 VanDerWaalsContact O-N 3.08Å; P1091-W1094 PolarHBondContact O-N 2.89Å; P1091-P1278 HydrophobicContact CB-CB 4.29Å; P1091-P1278 HydrophobicContact CG-CB 4.47Å
1092	I	82.3	Confident	85.5	Confident	61 Å²	61	56.8 Å²	56.8	31%	0.313	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-27.9	-162.6	-159.8	150.1	0	0	0	115.5	W1094 W1095 I1096 W1275	I1092-W1094 VanDerWaalsContact C-N 3.26Å; I1092-W1094 PolarHBondContact O-N 2.91Å; I1092-W1095 WeakPolarHBondContact O-CB 3.24Å; I1092-W1095 PolarHBondContact O-N 3.08Å; I1092-I1096 HydrophobicContact CG1-CD1 4.33Å; I1092-I1096 PolarHBondContact O-N 3.47Å; I1092-I1096 VanDerWaalsContact O-N 3.16Å; I1092-W1275 HydrophobicContact CD1-CZ3 4.02Å; I1092-W1275 HydrophobicContact CG1-CZ3 4.28Å; I1092-W1275 HydrophobicContact CG2-CE3 3.86Å; I1092-W1275 HydrophobicContact CG2-CZ3 3.7Å
1093	Q	81	Confident	85.7	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-52.1	-40.5	168.5	65.8	-161.5	-59.2	0	0	113.7	P1091 I1097 W1143 R1146 L1263 I1276	P1091-Q1093 VanDerWaalsContact C-N 3.28Å; P1091-Q1093 HydrophobicContact CB-CG 4.48Å; P1091-Q1093 PolarHBondContact O-N 3.43Å; P1091-Q1093 VanDerWaalsContact O-N 3.08Å; Q1093-I1097 VanDerWaalsContact O-CB 3.29Å; Q1093-I1097 WeakPolarHBondContact O-CB 3.44Å; Q1093-I1097 WeakPolarHBondContact O-CG1 3.37Å; Q1093-I1097 PolarHBondContact O-N 3.49Å; Q1093-W1143 HydrophobicContact CG-CZ3 4.02Å; Q1093-R1146 VanDerWaalsContact OE1-CD 3.24Å; Q1093-L1263 HydrophobicContact CB-CD1 4.37Å; Q1093-I1276 HydrophobicContact CB-CG2 3.77Å; Q1093-I1276 WeakPolarHBondContact CB-O 3.36Å
1094	W	85.9	Confident	85.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-78.2	-30.1	-176.3	-176.6	85.2	0	0	0	110.9	I1030 W1078 P1090 P1091 I1092 S1098 F1099 L1141 W1143 W1147	I1030-W1094 HydrophobicContact CG2-CH2 4.03Å; W1078-W1094 AromaticContact CH2-CZ3 3.94Å; W1078-W1094 HydrophobicContact CH2-CZ3 3.94Å; W1078-W1094 HydrophobicContact CZ2-CH2 4.4Å; W1078-W1094 AromaticContact CZ2-CZ3 3.99Å; W1078-W1094 HydrophobicContact CZ2-CZ3 3.99Å; P1090-W1094 HydrophobicContact CB-CD2 4.47Å; P1090-W1094 HydrophobicContact CB-CE3 3.82Å; P1090-W1094 HydrophobicContact CB-CZ3 4.36Å; P1090-W1094 HydrophobicContact CG-CE3 3.94Å; P1090-W1094 HydrophobicContact CG-CZ3 3.96Å; P1091-W1094 PolarHBondContact O-N 2.89Å; I1092-W1094 VanDerWaalsContact C-N 3.26Å; I1092-W1094 PolarHBondContact O-N 2.91Å; W1094-S1098 PolarHBondContact NE1-OG 2.97Å; W1094-S1098 CarbonylContact O-C 3.53Å; W1094-S1098 WeakPolarHBondContact O-CA 3.31Å; W1094-S1098 WeakPolarHBondContact O-CB 3.33Å; W1094-S1098 PolarHBondContact O-N 3.39Å; W1094-F1099 HydrophobicContact CE3-CB 3.98Å; W1094-F1099 HydrophobicContact CH2-CB 4.13Å; W1094-F1099 AromaticContact CH2-CD2 3.7Å; W1094-F1099 HydrophobicContact CH2-CD2 3.7Å; W1094-F1099 HydrophobicContact CH2-CG 4.32Å; W1094-F1099 HydrophobicContact CZ3-CB 3.69Å; W1094-F1099 AromaticContact CZ3-CD2 3.71Å; W1094-F1099 HydrophobicContact CZ3-CD2 3.71Å; W1094-F1099 AromaticContact CZ3-CG 3.96Å; W1094-F1099 HydrophobicContact CZ3-CG 3.96Å; W1094-F1099 PolarHBondContact O-N 3.06Å; W1094-L1141 PolarHBondContact NE1-O 2.95Å; W1094-L1141 VanDerWaalsContact NE1-O 3.08Å; W1094-W1143 AromaticContact CD1-CD1 3.77Å; W1094-W1143 AromaticContact CD1-CD2 3.74Å; W1094-W1143 AromaticContact CD1-CE2 3.67Å; W1094-W1143 AromaticContact CD1-CG 3.83Å; W1094-W1143 AromaticContact CD1-NE1 3.67Å; W1094-W1143 AromaticContact NE1-CD1 3.93Å; W1094-W1143 AromaticContact NE1-NE1 3.95Å; W1094-W1147 AromaticContact CD1-NE1 3.85Å; W1094-W1147 AromaticContact CD2-CZ2 3.7Å; W1094-W1147 HydrophobicContact CD2-CZ2 3.7Å; W1094-W1147 AromaticContact CE2-CZ2 3.7Å; W1094-W1147 AromaticContact CE3-CZ2 3.82Å; W1094-W1147 HydrophobicContact CE3-CZ2 3.82Å; W1094-W1147 HydrophobicContact CG-CZ2 4.32Å; W1094-W1147 AromaticContact CG-NE1 3.76Å; W1094-W1147 HydrophobicContact CH2-CH2 4.33Å; W1094-W1147 AromaticContact CH2-CZ2 3.96Å; W1094-W1147 HydrophobicContact CH2-CZ2 3.96Å; W1094-W1147 HydrophobicContact CZ2-CH2 4.47Å; W1094-W1147 AromaticContact CZ2-CZ2 3.85Å; W1094-W1147 HydrophobicContact CZ2-CZ2 3.85Å; W1094-W1147 HydrophobicContact CZ3-CH2 4.44Å; W1094-W1147 AromaticContact CZ3-CZ2 3.94Å; W1094-W1147 HydrophobicContact CZ3-CZ2 3.94Å
1095	W	86.8	Confident	86.2	Confident	68 Å²	68	53.4 Å²	53.4	26%	0.258	26%	0.262	S	S	.	.	I	π-helix	trans	-59.8	-52.4	169.8	-75.9	86.5	0	0	0	111.5	W1078 P1090 I1092 F1099 I1100	W1078-W1095 HydrophobicContact CE3-CH2 4.2Å; W1078-W1095 AromaticContact CE3-CZ2 3.88Å; W1078-W1095 HydrophobicContact CE3-CZ2 3.88Å; W1078-W1095 HydrophobicContact CH2-CH2 4.38Å; W1078-W1095 HydrophobicContact CH2-CZ2 4.16Å; W1078-W1095 AromaticContact CZ3-CH2 3.52Å; W1078-W1095 HydrophobicContact CZ3-CH2 3.52Å; W1078-W1095 AromaticContact CZ3-CZ2 3.41Å; W1078-W1095 HydrophobicContact CZ3-CZ2 3.41Å; W1078-W1095 VanDerWaalsContact CZ3-CZ2 3.41Å; W1078-W1095 HydrophobicContact CZ3-CZ3 4.47Å; P1090-W1095 PolarHBondContact O-NE1 2.92Å; I1092-W1095 WeakPolarHBondContact O-CB 3.24Å; I1092-W1095 PolarHBondContact O-N 3.08Å; W1095-F1099 HydrophobicContact CD2-CD1 4.46Å; W1095-F1099 AromaticContact CE3-CD1 3.58Å; W1095-F1099 HydrophobicContact CE3-CD1 3.58Å; W1095-F1099 HydrophobicContact CE3-CE1 4.08Å; W1095-F1099 HydrophobicContact CE3-CG 4.36Å; W1095-F1099 HydrophobicContact CH2-CE1 4.41Å; W1095-F1099 AromaticContact CZ3-CD1 3.67Å; W1095-F1099 HydrophobicContact CZ3-CD1 3.67Å; W1095-F1099 AromaticContact CZ3-CE1 3.66Å; W1095-F1099 HydrophobicContact CZ3-CE1 3.66Å; W1095-F1099 PolarHBondContact O-N 2.77Å; W1095-I1100 WeakPolarHBondContact O-CB 3.35Å; W1095-I1100 WeakPolarHBondContact O-CG1 3.25Å; W1095-I1100 PolarHBondContact O-N 2.02Å
1096	I	85.1	Confident	86.6	Confident	89 Å²	89	53.2 Å²	53.2	46%	0.456	26%	0.264	S	S	.	.	I	π-helix	trans	-69.6	-45.7	-175.4	-63.1	168.5	0	0	0	111.7	I1092 P1101	I1092-I1096 HydrophobicContact CG1-CD1 4.33Å; I1092-I1096 PolarHBondContact O-N 3.47Å; I1092-I1096 VanDerWaalsContact O-N 3.16Å; I1096-P1101 WeakPolarHBondContact O-CD 3.42Å
1097	I	84.3	Confident	87	Confident	73 Å²	73	45.4 Å²	45.4	37%	0.374	24%	0.243	S	C	.	.	I	π-helix	trans	-91.9	-23.7	-168.2	-58.2	171.8	0	0	0	112.6	Q1093 W1143 L1259 L1263	Q1093-I1097 VanDerWaalsContact O-CB 3.29Å; Q1093-I1097 WeakPolarHBondContact O-CB 3.44Å; Q1093-I1097 WeakPolarHBondContact O-CG1 3.37Å; Q1093-I1097 PolarHBondContact O-N 3.49Å; I1097-W1143 HydrophobicContact CB-CH2 4.19Å; I1097-W1143 HydrophobicContact CD1-CH2 4.47Å; I1097-W1143 HydrophobicContact CG2-CH2 4.17Å; I1097-W1143 HydrophobicContact CG2-CZ2 4.25Å; I1097-L1259 HydrophobicContact CD1-CD2 3.78Å; I1097-L1259 HydrophobicContact CG2-CD2 3.87Å; I1097-L1263 HydrophobicContact CD1-CD1 4.02Å; I1097-L1263 HydrophobicContact CD1-CD2 4.38Å; I1097-L1263 HydrophobicContact CD1-CG 4.4Å
1098	S	86.6	Confident	87.6	Confident	8 Å²	8	46.8 Å²	46.8	6%	0.056	25%	0.246	C	C	.	.	I	π-helix	trans	-121.6	-60	-171.5	-136.1	0	0	0	0	111.8	W1094 G1102 C1139	W1094-S1098 PolarHBondContact NE1-OG 2.97Å; W1094-S1098 CarbonylContact O-C 3.53Å; W1094-S1098 WeakPolarHBondContact O-CA 3.31Å; W1094-S1098 WeakPolarHBondContact O-CB 3.33Å; W1094-S1098 PolarHBondContact O-N 3.39Å; S1098-G1102 PolarHBondContact O-N 2.85Å; S1098-C1139 CarbonylContact C-O 3.59Å; S1098-C1139 VanDerWaalsContact CB-O 3.31Å; S1098-C1139 WeakPolarHBondContact CB-O 3.42Å; S1098-C1139 WeakPolarHBondContact O-CB 3.31Å; S1098-C1139 PolarHBondContact OG-O 3.23Å
1099	F	90.2	Very high	87.8	Confident	39 Å²	39	41.7 Å²	41.7	17%	0.171	22%	0.22	C	C	.	.	I	π-helix	trans	-68.4	-50.9	-171	-171.4	-105.3	0	0	0	113.6	W1078 W1094 W1095 G1102 V1103 F1140	W1078-F1099 HydrophobicContact CH2-CD2 4.4Å; W1078-F1099 HydrophobicContact CH2-CE2 4.15Å; W1078-F1099 HydrophobicContact CH2-CZ 4.45Å; W1094-F1099 HydrophobicContact CE3-CB 3.98Å; W1094-F1099 HydrophobicContact CH2-CB 4.13Å; W1094-F1099 AromaticContact CH2-CD2 3.7Å; W1094-F1099 HydrophobicContact CH2-CD2 3.7Å; W1094-F1099 HydrophobicContact CH2-CG 4.32Å; W1094-F1099 HydrophobicContact CZ3-CB 3.69Å; W1094-F1099 AromaticContact CZ3-CD2 3.71Å; W1094-F1099 HydrophobicContact CZ3-CD2 3.71Å; W1094-F1099 AromaticContact CZ3-CG 3.96Å; W1094-F1099 HydrophobicContact CZ3-CG 3.96Å; W1094-F1099 PolarHBondContact O-N 3.06Å; W1095-F1099 HydrophobicContact CD2-CD1 4.46Å; W1095-F1099 AromaticContact CE3-CD1 3.58Å; W1095-F1099 HydrophobicContact CE3-CD1 3.58Å; W1095-F1099 HydrophobicContact CE3-CE1 4.08Å; W1095-F1099 HydrophobicContact CE3-CG 4.36Å; W1095-F1099 HydrophobicContact CH2-CE1 4.41Å; W1095-F1099 AromaticContact CZ3-CD1 3.67Å; W1095-F1099 HydrophobicContact CZ3-CD1 3.67Å; W1095-F1099 AromaticContact CZ3-CE1 3.66Å; W1095-F1099 HydrophobicContact CZ3-CE1 3.66Å; W1095-F1099 PolarHBondContact O-N 2.77Å; F1099-G1102 WeakPolarHBondContact O-CA 3.3Å; F1099-G1102 PolarHBondContact O-N 3.35Å; F1099-G1102 VanDerWaalsContact O-N 3.12Å; F1099-V1103 HydrophobicContact CD1-CG2 4.09Å; F1099-V1103 HydrophobicContact CE1-CG2 3.73Å; F1099-V1103 HydrophobicContact CE2-CG2 4.27Å; F1099-V1103 HydrophobicContact CZ-CG2 3.83Å; F1099-V1103 WeakPolarHBondContact O-CG2 3.49Å; F1099-V1103 PolarHBondContact O-N 2.87Å; F1099-F1140 HydrophobicContact CD2-CD1 4.03Å; F1099-F1140 HydrophobicContact CD2-CE1 4.05Å; F1099-F1140 HydrophobicContact CE2-CD1 4.33Å; F1099-F1140 HydrophobicContact CE2-CE1 4.11Å
1100	I	92	Very high	87.8	Confident	87 Å²	87	44 Å²	44	45%	0.446	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-46.1	-177.6	-69.9	167.7	0	0	0	111.5	W1095 G1102 V1103 L1104	W1095-I1100 WeakPolarHBondContact O-CB 3.35Å; W1095-I1100 WeakPolarHBondContact O-CG1 3.25Å; W1095-I1100 PolarHBondContact O-N 2.02Å; I1100-G1102 VanDerWaalsContact C-N 3.33Å; I1100-G1102 PolarHBondContact O-N 3.42Å; I1100-V1103 PolarHBondContact O-N 3.2Å; I1100-L1104 HydrophobicContact CG2-CD1 4.43Å; I1100-L1104 PolarHBondContact O-N 3.31Å
1101	P	93.2	Very high	87.8	Confident	39 Å²	39	46.8 Å²	46.8	25%	0.253	26%	0.256	S	S	.	.	H	α-helix	trans	-57.6	-41.3	169.6	-27.7	36.6	0	0	0	113.6	I1096 L1104 F1105	I1096-P1101 WeakPolarHBondContact O-CD 3.42Å; P1101-L1104 WeakPolarHBondContact O-CB 3.48Å; P1101-L1104 PolarHBondContact O-N 2.74Å; P1101-F1105 HydrophobicContact CB-CE2 4.35Å; P1101-F1105 WeakPolarHBondContact O-CD2 3.45Å; P1101-F1105 WeakPolarHBondContact O-CG 3.42Å; P1101-F1105 PolarHBondContact O-N 2.87Å
1102	G	92	Very high	87.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-44.8	176.4	0	0	0	0	0	113.1	S1098 F1099 I1100 L1104 F1105 A1106 S1136 C1139 F1140	S1098-G1102 PolarHBondContact O-N 2.85Å; F1099-G1102 WeakPolarHBondContact O-CA 3.3Å; F1099-G1102 PolarHBondContact O-N 3.35Å; F1099-G1102 VanDerWaalsContact O-N 3.12Å; I1100-G1102 VanDerWaalsContact C-N 3.33Å; I1100-G1102 PolarHBondContact O-N 3.42Å; G1102-L1104 VanDerWaalsContact C-N 3.35Å; G1102-F1105 PolarHBondContact O-N 3.43Å; G1102-A1106 WeakPolarHBondContact O-CB 3.38Å; G1102-A1106 PolarHBondContact O-N 2.77Å; G1102-S1136 WeakPolarHBondContact O-CB 3.34Å; G1102-C1139 VanDerWaalsContact CA-CB 3.44Å; G1102-F1140 WeakPolarHBondContact O-CZ 3.22Å
1103	V	92.6	Very high	87.2	Confident	57 Å²	57	49.3 Å²	49.3	35%	0.345	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-42.2	174.3	175.2	0	0	0	0	110.7	F1099 I1100 A1106 T1107 F1140	F1099-V1103 HydrophobicContact CD1-CG2 4.09Å; F1099-V1103 HydrophobicContact CE1-CG2 3.73Å; F1099-V1103 HydrophobicContact CE2-CG2 4.27Å; F1099-V1103 HydrophobicContact CZ-CG2 3.83Å; F1099-V1103 WeakPolarHBondContact O-CG2 3.49Å; F1099-V1103 PolarHBondContact O-N 2.87Å; I1100-V1103 PolarHBondContact O-N 3.2Å; V1103-A1106 PolarHBondContact O-N 2.8Å; V1103-T1107 HydrophobicContact CG1-CG2 4.18Å; V1103-T1107 WeakPolarHBondContact O-CG2 3.46Å; V1103-T1107 PolarHBondContact O-N 2.84Å; V1103-T1107 PolarHBondContact O-OG1 3.29Å; V1103-T1107 VanDerWaalsContact O-OG1 3.06Å; V1103-F1140 HydrophobicContact CG2-CE1 3.91Å; V1103-F1140 HydrophobicContact CG2-CZ 4.18Å
1104	L	94.1	Very high	86.7	Confident	93 Å²	93	54.8 Å²	54.8	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-46.7	176.3	-98.1	160.6	0	0	0	112.7	I1100 P1101 G1102 A1106 T1107 I1108	I1100-L1104 HydrophobicContact CG2-CD1 4.43Å; I1100-L1104 PolarHBondContact O-N 3.31Å; P1101-L1104 WeakPolarHBondContact O-CB 3.48Å; P1101-L1104 PolarHBondContact O-N 2.74Å; G1102-L1104 VanDerWaalsContact C-N 3.35Å; L1104-A1106 VanDerWaalsContact C-N 3.34Å; L1104-A1106 PolarHBondContact O-N 2.85Å; L1104-T1107 PolarHBondContact O-N 3.08Å; L1104-T1107 PolarHBondContact O-OG1 2.84Å; L1104-I1108 HydrophobicContact CD2-CD1 4.13Å; L1104-I1108 WeakPolarHBondContact O-CB 3.49Å; L1104-I1108 WeakPolarHBondContact O-CD1 3.49Å; L1104-I1108 WeakPolarHBondContact O-CG1 3.45Å; L1104-I1108 PolarHBondContact O-N 2.74Å
1105	F	93.8	Very high	85.7	Confident	70 Å²	70	62.6 Å²	62.6	31%	0.307	33%	0.325	S	S	.	.	H	α-helix	trans	-64.3	-40.1	175.7	-63.5	-45	0	0	0	111.9	P1101 G1102 G1109 L1132 L1135	P1101-F1105 HydrophobicContact CB-CE2 4.35Å; P1101-F1105 WeakPolarHBondContact O-CD2 3.45Å; P1101-F1105 WeakPolarHBondContact O-CG 3.42Å; P1101-F1105 PolarHBondContact O-N 2.87Å; G1102-F1105 PolarHBondContact O-N 3.43Å; F1105-G1109 PolarHBondContact O-N 2.86Å; F1105-L1132 HydrophobicContact CB-CD2 4.31Å; F1105-L1132 HydrophobicContact CD1-CD2 3.75Å; F1105-L1132 HydrophobicContact CG-CD2 4.38Å; F1105-L1135 HydrophobicContact CD2-CB 4.28Å
1106	A	90.7	Very high	84.2	Confident	23 Å²	23	60.8 Å²	60.8	19%	0.19	33%	0.327	C	S	.	.	H	α-helix	trans	-65.9	-40.7	177.3	0	0	0	0	0	112.8	G1102 V1103 L1104 S1110 F1140	G1102-A1106 WeakPolarHBondContact O-CB 3.38Å; G1102-A1106 PolarHBondContact O-N 2.77Å; V1103-A1106 PolarHBondContact O-N 2.8Å; L1104-A1106 VanDerWaalsContact C-N 3.34Å; L1104-A1106 PolarHBondContact O-N 2.85Å; A1106-S1110 WeakPolarHBondContact O-CB 3.34Å; A1106-S1110 PolarHBondContact O-N 2.91Å; A1106-F1140 HydrophobicContact CB-CE2 4.19Å; A1106-F1140 HydrophobicContact CB-CZ 4.22Å
1107	T	90.4	Very high	82.4	Confident	76 Å²	76	64.8 Å²	64.8	47%	0.466	34%	0.344	S	S	.	.	H	α-helix	trans	-74	-37.3	178.6	55.2	0	0	0	0	112.7	V1103 L1104 S1111	V1103-T1107 HydrophobicContact CG1-CG2 4.18Å; V1103-T1107 WeakPolarHBondContact O-CG2 3.46Å; V1103-T1107 PolarHBondContact O-N 2.84Å; V1103-T1107 PolarHBondContact O-OG1 3.29Å; V1103-T1107 VanDerWaalsContact O-OG1 3.06Å; L1104-T1107 PolarHBondContact O-N 3.08Å; L1104-T1107 PolarHBondContact O-OG1 2.84Å; T1107-S1111 VanDerWaalsContact O-CB 3.26Å; T1107-S1111 WeakPolarHBondContact O-CB 3.02Å; T1107-S1111 PolarHBondContact O-N 3.33Å; T1107-S1111 PolarHBondContact O-OG 3.36Å
1108	I	90.7	Very high	80.8	Confident	74 Å²	74	63.7 Å²	63.7	38%	0.379	34%	0.343	S	S	.	.	H	α-helix	trans	-68.1	-43.7	174.4	-64.3	166.1	0	0	0	110.5	L1104 S1111 M1112 L1132	L1104-I1108 HydrophobicContact CD2-CD1 4.13Å; L1104-I1108 WeakPolarHBondContact O-CB 3.49Å; L1104-I1108 WeakPolarHBondContact O-CD1 3.49Å; L1104-I1108 WeakPolarHBondContact O-CG1 3.45Å; L1104-I1108 PolarHBondContact O-N 2.74Å; I1108-S1111 PolarHBondContact O-N 2.81Å; I1108-S1111 PolarHBondContact O-OG 2.72Å; I1108-S1111 VanDerWaalsContact O-OG 3.05Å; I1108-M1112 HydrophobicContact CG2-SD 4.26Å; I1108-M1112 WeakPolarHBondContact O-CB 3.32Å; I1108-M1112 VanDerWaalsContact O-CG 3.3Å; I1108-M1112 WeakPolarHBondContact O-CG 3.49Å; I1108-M1112 PolarHBondContact O-N 3.48Å; I1108-L1132 HydrophobicContact CB-CD1 4.35Å; I1108-L1132 HydrophobicContact CG2-CD1 3.82Å
1109	G	86.3	Confident	79.1	Confident	2 Å²	2	67.4 Å²	67.4	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-52.9	175.2	0	0	0	0	0	111.2	F1105 S1111 M1112 F1113	F1105-G1109 PolarHBondContact O-N 2.86Å; G1109-S1111 PolarHBondContact O-N 2.84Å; G1109-M1112 PolarHBondContact O-N 2.85Å; G1109-F1113 PolarHBondContact O-N 3.39Å
1110	S	82.5	Confident	77.4	Confident	51 Å²	51	76.2 Å²	76.2	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-56.4	-45.7	177.6	-174.9	0	0	0	0	112.3	A1106 F1113 F1114	A1106-S1110 WeakPolarHBondContact O-CB 3.34Å; A1106-S1110 PolarHBondContact O-N 2.91Å; S1110-F1113 PolarHBondContact O-N 2.82Å; S1110-F1114 WeakPolarHBondContact O-CD2 3.36Å; S1110-F1114 PolarHBondContact O-N 2.98Å; S1110-F1114 VanDerWaalsContact O-N 3.12Å; S1110-F1114 WeakPolarHBondContact OG-CE2 3.01Å
1111	S	82.5	Confident	76.2	Confident	59 Å²	59	74.4 Å²	74.4	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-44.3	177.9	71.1	0	0	0	0	111.6	T1107 I1108 G1109 F1113 F1114 H1115	T1107-S1111 VanDerWaalsContact O-CB 3.26Å; T1107-S1111 WeakPolarHBondContact O-CB 3.02Å; T1107-S1111 PolarHBondContact O-N 3.33Å; T1107-S1111 PolarHBondContact O-OG 3.36Å; I1108-S1111 PolarHBondContact O-N 2.81Å; I1108-S1111 PolarHBondContact O-OG 2.72Å; I1108-S1111 VanDerWaalsContact O-OG 3.05Å; G1109-S1111 PolarHBondContact O-N 2.84Å; S1111-F1113 VanDerWaalsContact C-N 3.28Å; S1111-F1113 PolarHBondContact O-N 2.79Å; S1111-F1114 CarbonylContact O-C 3.48Å; S1111-F1114 PolarHBondContact O-N 3.47Å; S1111-F1114 VanDerWaalsContact O-N 3.12Å; S1111-H1115 WeakPolarHBondContact O-CB 3.38Å; S1111-H1115 PolarHBondContact O-N 3.48Å
1112	M	79.5	Confident	75.2	Confident	44 Å²	44	78 Å²	78	22%	0.217	40%	0.398	C	S	.	.	H	α-helix	trans	-60	-34.7	175.4	-74.2	-175.4	70.2	0	0	113.3	I1108 G1109 G1116 I1128 L1132	I1108-M1112 HydrophobicContact CG2-SD 4.26Å; I1108-M1112 WeakPolarHBondContact O-CB 3.32Å; I1108-M1112 VanDerWaalsContact O-CG 3.3Å; I1108-M1112 WeakPolarHBondContact O-CG 3.49Å; I1108-M1112 PolarHBondContact O-N 3.48Å; G1109-M1112 PolarHBondContact O-N 2.85Å; M1112-G1116 PolarHBondContact O-N 3.48Å; M1112-I1128 HydrophobicContact CE-CB 3.99Å; M1112-I1128 HydrophobicContact CE-CD1 3.91Å; M1112-I1128 HydrophobicContact CE-CG2 3.67Å; M1112-I1128 HydrophobicContact SD-CG2 3.66Å; M1112-L1132 HydrophobicContact SD-CD1 4.24Å
1113	F	71	Confident	74.4	Confident	83 Å²	83	79.2 Å²	79.2	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-66.5	-41.6	174.4	-173.9	-91.7	0	0	0	111.9	G1109 S1110 S1111 H1126 W1129	G1109-F1113 PolarHBondContact O-N 3.39Å; S1110-F1113 PolarHBondContact O-N 2.82Å; S1111-F1113 VanDerWaalsContact C-N 3.28Å; S1111-F1113 PolarHBondContact O-N 2.79Å; F1113-H1126 AromaticContact CE2-ND1 3.91Å; F1113-W1129 HydrophobicContact CB-CG 4.43Å; F1113-W1129 HydrophobicContact CD2-CD2 4.48Å; F1113-W1129 HydrophobicContact CD2-CG 4.28Å
1114	F	70.2	Confident	73.9	Confident	116 Å²	116	82.1 Å²	82.1	51%	0.509	41%	0.414	S	S	.	.	H	α-helix	trans	-80.5	-22.5	177.8	-65.3	-59	0	0	0	114.4	I1060 S1110 S1111	I1060-F1114 HydrophobicContact CD1-CE1 3.93Å; I1060-F1114 HydrophobicContact CG1-CE1 4.17Å; I1060-F1114 HydrophobicContact CG2-CE1 3.99Å; I1060-F1114 HydrophobicContact CG2-CZ 3.85Å; S1110-F1114 WeakPolarHBondContact O-CD2 3.36Å; S1110-F1114 PolarHBondContact O-N 2.98Å; S1110-F1114 VanDerWaalsContact O-N 3.12Å; S1110-F1114 WeakPolarHBondContact OG-CE2 3.01Å; S1111-F1114 CarbonylContact O-C 3.48Å; S1111-F1114 PolarHBondContact O-N 3.47Å; S1111-F1114 VanDerWaalsContact O-N 3.12Å
1115	H	65.6	Low	73.3	Confident	163 Å²	163	80.6 Å²	80.6	76%	0.755	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.3	175.8	-114.5	71.9	0	0	0	114	S1111 Q1117	S1111-H1115 WeakPolarHBondContact O-CB 3.38Å; S1111-H1115 PolarHBondContact O-N 3.48Å; H1115-Q1117 PolarHBondContact O-N 2.83Å
1116	G	54.4	Low	72.8	Confident	30 Å²	30	78.1 Å²	78.1	31%	0.309	39%	0.393	S	S	.	.			trans	-70.4	56.8	-174.8	0	0	0	0	0	115	M1112 S1118	M1112-G1116 PolarHBondContact O-N 3.48Å; G1116-S1118 VanDerWaalsContact C-N 3.3Å; G1116-S1118 PolarHBondContact O-N 2.97Å
1117	Q	48.3	Very low	72.6	Confident	173 Å²	173	77.2 Å²	77.2	81%	0.808	39%	0.386	S	S	*	.			trans	-80.6	-5.4	-171.6	-136	169.2	8.6	0	0	114.1	H1115	H1115-Q1117 PolarHBondContact O-N 2.83Å
1118	S	51	Low	72.6	Confident	51 Å²	51	77.1 Å²	77.1	36%	0.357	38%	0.382	S	S	.	.			trans	-97.3	114.6	174.1	174.9	0	0	0	0	111.5	G1116 R1120 D1121 Y1122	G1116-S1118 VanDerWaalsContact C-N 3.3Å; G1116-S1118 PolarHBondContact O-N 2.97Å; S1118-R1120 PolarHBondContact O-N 3.26Å; S1118-R1120 PolarHBondContact OG-N 2.9Å; S1118-D1121 PolarHBondContact O-N 3.15Å; S1118-D1121 PolarHBondContact OG-OD2 3.02Å; S1118-Y1122 PolarHBondContact O-N 2.05Å
1119	T	50.9	Low	72.4	Confident	86 Å²	86	75.9 Å²	75.9	53%	0.528	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.1	172.3	47.4	0	0	0	0	113.5	H959	H959-T1119 WeakPolarHBondContact CE1-CG2 3.33Å; H959-T1119 PolarHBondContact CE1-OG1 2.76Å; H959-T1119 PolarHBondContact NE2-OG1 2.68Å
1120	R	53.4	Low	72.5	Confident	224 Å²	224	76 Å²	76	85%	0.845	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-23.7	176.3	-87.5	-177.1	166.9	-179.5	-5.2	113.9	S1118	S1118-R1120 PolarHBondContact O-N 3.26Å; S1118-R1120 PolarHBondContact OG-N 2.9Å
1121	D	68	Low	73	Confident	48 Å²	48	76.9 Å²	76.9	26%	0.257	37%	0.372	S	S	.	.	S	Bend	trans	-118.8	10.2	-175.4	-65.3	-78.2	0	0	0	113.2	S1118 T1123 K1124 H1125	S1118-D1121 PolarHBondContact O-N 3.15Å; S1118-D1121 PolarHBondContact OG-OD2 3.02Å; D1121-T1123 VanDerWaalsContact C-N 3.32Å; D1121-T1123 PolarHBondContact O-N 3.43Å; D1121-K1124 PolarHBondContact O-N 2.8Å; D1121-K1124 WeakPolarHBondContact OD1-CD 3.44Å; D1121-K1124 WeakPolarHBondContact OD1-CE 3.41Å; D1121-K1124 IonicContact OD1-NZ 2.72Å; D1121-K1124 PolarHBondContact OD1-NZ 3.4Å; D1121-H1125 PolarHBondContact O-N 3.45Å; D1121-H1125 PolarHBondContact O-ND1 2.84Å
1122	Y	71.4	Confident	73.5	Confident	114 Å²	114	75.1 Å²	75.1	45%	0.447	36%	0.358	S	S	.	.	H	α-helix	trans	-51.8	-48	178.2	175.5	-100.4	0	0	0	112	S1118 K1124 H1125 H1126	S1118-Y1122 PolarHBondContact O-N 2.05Å; Y1122-K1124 VanDerWaalsContact C-N 3.26Å; Y1122-K1124 PolarHBondContact O-N 2.92Å; Y1122-H1125 PolarHBondContact O-N 2.8Å; Y1122-H1126 HydrophobicContact CE1-CB 4.38Å; Y1122-H1126 HydrophobicContact CE2-CB 4.48Å; Y1122-H1126 VanDerWaalsContact O-CB 3.32Å; Y1122-H1126 WeakPolarHBondContact O-CB 3.39Å; Y1122-H1126 PolarHBondContact O-N 3.01Å
1123	T	74.4	Confident	74	Confident	26 Å²	26	74.3 Å²	74.3	16%	0.16	35%	0.354	C	S	.	.	H	α-helix	trans	-52.8	-43.9	177.4	-38.5	0	0	0	0	112.1	D902 L906 D1121 S1127	D902-T1123 HydrophobicContact CB-CG2 3.73Å; D902-T1123 WeakPolarHBondContact OD1-CB 3.46Å; D902-T1123 WeakPolarHBondContact OD1-CG2 3.45Å; D902-T1123 PolarHBondContact OD1-OG1 2.81Å; L906-T1123 HydrophobicContact CB-CG2 4.44Å; L906-T1123 HydrophobicContact CD1-CG2 3.99Å; L906-T1123 WeakPolarHBondContact CD1-O 3.27Å; D1121-T1123 VanDerWaalsContact C-N 3.32Å; D1121-T1123 PolarHBondContact O-N 3.43Å; T1123-S1127 VanDerWaalsContact O-CB 3.26Å; T1123-S1127 WeakPolarHBondContact O-CB 3.27Å; T1123-S1127 PolarHBondContact O-N 3.07Å; T1123-S1127 PolarHBondContact O-OG 3.07Å
1124	K	81.7	Confident	75	Confident	119 Å²	119	70.4 Å²	70.4	52%	0.517	34%	0.337	S	S	.	.	H	α-helix	trans	-70.2	-46.9	-178.1	-59.7	175.4	-167.2	157.4	0	111.1	D1121 Y1122 H1126 S1127 I1128	D1121-K1124 PolarHBondContact O-N 2.8Å; D1121-K1124 WeakPolarHBondContact OD1-CD 3.44Å; D1121-K1124 WeakPolarHBondContact OD1-CE 3.41Å; D1121-K1124 IonicContact OD1-NZ 2.72Å; D1121-K1124 PolarHBondContact OD1-NZ 3.4Å; Y1122-K1124 VanDerWaalsContact C-N 3.26Å; Y1122-K1124 PolarHBondContact O-N 2.92Å; K1124-H1126 PolarHBondContact O-N 3.23Å; K1124-S1127 PolarHBondContact O-N 3.29Å; K1124-I1128 VanDerWaalsContact O-CG1 3.28Å; K1124-I1128 WeakPolarHBondContact O-CG1 3.37Å; K1124-I1128 PolarHBondContact O-N 2.73Å
1125	H	82.2	Confident	76	Confident	61 Å²	61	67.6 Å²	67.6	28%	0.282	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-42.1	179.4	-70.3	80.8	0	0	0	111.5	D1121 Y1122 I1128 W1129	D1121-H1125 PolarHBondContact O-N 3.45Å; D1121-H1125 PolarHBondContact O-ND1 2.84Å; Y1122-H1125 PolarHBondContact O-N 2.8Å; H1125-I1128 PolarHBondContact O-N 2.68Å; H1125-W1129 WeakPolarHBondContact O-CB 3.49Å; H1125-W1129 PolarHBondContact O-N 2.78Å
1126	H	82.7	Confident	77.3	Confident	17 Å²	17	59.9 Å²	59.9	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-68.5	-38.3	177	-162.4	58.3	0	0	0	111.9	L906 H943 F1113 Y1122 K1124 I1128 W1129 H1130	L906-H1126 HydrophobicContact CD1-CB 4.08Å; H943-H1126 AromaticContact CE1-CD2 3.72Å; H943-H1126 AromaticContact CE1-NE2 3.24Å; H943-H1126 PolarHBondContact CE1-NE2 2.9Å; H943-H1126 AromaticContact NE2-NE2 3.55Å; F1113-H1126 AromaticContact CE2-ND1 3.91Å; Y1122-H1126 HydrophobicContact CE1-CB 4.38Å; Y1122-H1126 HydrophobicContact CE2-CB 4.48Å; Y1122-H1126 VanDerWaalsContact O-CB 3.32Å; Y1122-H1126 WeakPolarHBondContact O-CB 3.39Å; Y1122-H1126 PolarHBondContact O-N 3.01Å; K1124-H1126 PolarHBondContact O-N 3.23Å; H1126-I1128 PolarHBondContact O-N 3.13Å; H1126-W1129 WeakPolarHBondContact O-CB 3.34Å; H1126-W1129 PolarHBondContact O-N 3.48Å; H1126-H1130 AromaticContact CD2-CD2 3.94Å; H1126-H1130 AromaticContact CD2-NE2 2.88Å; H1126-H1130 PolarHBondContact CD2-NE2 3.02Å; H1126-H1130 AromaticContact CE1-NE2 3.37Å; H1126-H1130 PolarHBondContact CE1-NE2 2.78Å; H1126-H1130 AromaticContact CG-NE2 3.83Å; H1126-H1130 AromaticContact NE2-NE2 2.51Å; H1126-H1130 PolarHBondContact NE2-NE2 3.14Å; H1126-H1130 PolarHBondContact O-CD2 3.08Å; H1126-H1130 PolarHBondContact O-N 2.89Å
1127	S	88.4	Confident	79.1	Confident	5 Å²	5	58.8 Å²	58.8	4%	0.035	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-42.5	171.6	-60.5	0	0	0	0	112.5	I905 L906 S909 T1123 K1124 W1129 H1130 I1131	I905-S1127 WeakPolarHBondContact CG2-OG 3.48Å; L906-S1127 VanDerWaalsContact CD1-OG 3.27Å; L906-S1127 WeakPolarHBondContact CD1-OG 3.48Å; S909-S1127 WeakPolarHBondContact CB-O 3.24Å; T1123-S1127 VanDerWaalsContact O-CB 3.26Å; T1123-S1127 WeakPolarHBondContact O-CB 3.27Å; T1123-S1127 PolarHBondContact O-N 3.07Å; T1123-S1127 PolarHBondContact O-OG 3.07Å; K1124-S1127 PolarHBondContact O-N 3.29Å; S1127-W1129 VanDerWaalsContact C-N 3.32Å; S1127-H1130 PolarHBondContact O-N 3.09Å; S1127-I1131 WeakPolarHBondContact O-CG1 3.32Å; S1127-I1131 PolarHBondContact O-N 3.11Å
1128	I	88.7	Confident	81.1	Confident	73 Å²	73	51.2 Å²	51.2	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-67.6	-35.8	176.9	-66.9	163.7	0	0	0	110.6	M1112 K1124 H1125 H1126 I1131 L1132	M1112-I1128 HydrophobicContact CE-CB 3.99Å; M1112-I1128 HydrophobicContact CE-CD1 3.91Å; M1112-I1128 HydrophobicContact CE-CG2 3.67Å; M1112-I1128 HydrophobicContact SD-CG2 3.66Å; K1124-I1128 VanDerWaalsContact O-CG1 3.28Å; K1124-I1128 WeakPolarHBondContact O-CG1 3.37Å; K1124-I1128 PolarHBondContact O-N 2.73Å; H1125-I1128 PolarHBondContact O-N 2.68Å; H1126-I1128 PolarHBondContact O-N 3.13Å; I1128-I1131 PolarHBondContact O-N 2.63Å; I1128-L1132 HydrophobicContact CG2-CD1 3.68Å; I1128-L1132 HydrophobicContact CG2-CG 4.16Å; I1128-L1132 WeakPolarHBondContact O-CB 3.48Å; I1128-L1132 VanDerWaalsContact O-CG 3.31Å; I1128-L1132 WeakPolarHBondContact O-CG 2.95Å; I1128-L1132 PolarHBondContact O-N 2.78Å
1129	W	87.6	Confident	83	Confident	48 Å²	48	49.9 Å²	49.9	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-48.3	172.4	177.7	88.3	0	0	0	112.3	F1113 H1125 H1126 S1127 I1131 L1132 I1133	F1113-W1129 HydrophobicContact CB-CG 4.43Å; F1113-W1129 HydrophobicContact CD2-CD2 4.48Å; F1113-W1129 HydrophobicContact CD2-CG 4.28Å; H1125-W1129 WeakPolarHBondContact O-CB 3.49Å; H1125-W1129 PolarHBondContact O-N 2.78Å; H1126-W1129 WeakPolarHBondContact O-CB 3.34Å; H1126-W1129 PolarHBondContact O-N 3.48Å; S1127-W1129 VanDerWaalsContact C-N 3.32Å; W1129-I1131 VanDerWaalsContact C-N 3.33Å; W1129-I1131 PolarHBondContact O-N 3.29Å; W1129-L1132 PolarHBondContact O-N 2.85Å; W1129-I1133 HydrophobicContact CD2-CG2 4.45Å; W1129-I1133 HydrophobicContact CE3-CG2 4.33Å; W1129-I1133 HydrophobicContact CH2-CG2 4.31Å; W1129-I1133 HydrophobicContact CZ2-CG2 4.43Å; W1129-I1133 HydrophobicContact CZ3-CG2 4.26Å; W1129-I1133 WeakPolarHBondContact O-CB 3.3Å; W1129-I1133 WeakPolarHBondContact O-CG2 3.42Å; W1129-I1133 PolarHBondContact O-N 3.37Å
1130	H	89	Confident	85	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-57.7	-43.1	176.6	-78.8	-65.9	0	0	0	112.8	S909 S939 H943 D1015 H1126 S1127 G1134	S909-H1130 WeakPolarHBondContact OG-CB 3.4Å; S939-H1130 PolarHBondContact OG-CE1 2.87Å; H943-H1130 AromaticContact CD2-CE1 3.78Å; H943-H1130 AromaticContact CD2-NE2 2.97Å; H943-H1130 PolarHBondContact CD2-NE2 2.86Å; H943-H1130 AromaticContact CE1-NE2 2.84Å; H943-H1130 PolarHBondContact CE1-NE2 2.84Å; H943-H1130 AromaticContact CG-NE2 3.82Å; H943-H1130 AromaticContact ND1-NE2 3.75Å; H943-H1130 AromaticContact NE2-CE1 3.06Å; H943-H1130 PolarHBondContact NE2-CE1 3.25Å; H943-H1130 AromaticContact NE2-NE2 2.17Å; H943-H1130 PolarHBondContact NE2-NE2 2.78Å; D1015-H1130 IonicContact OD1-CE1 3.66Å; H1126-H1130 AromaticContact CD2-CD2 3.94Å; H1126-H1130 AromaticContact CD2-NE2 2.88Å; H1126-H1130 PolarHBondContact CD2-NE2 3.02Å; H1126-H1130 AromaticContact CE1-NE2 3.37Å; H1126-H1130 PolarHBondContact CE1-NE2 2.78Å; H1126-H1130 AromaticContact CG-NE2 3.83Å; H1126-H1130 AromaticContact NE2-NE2 2.51Å; H1126-H1130 PolarHBondContact NE2-NE2 3.14Å; H1126-H1130 PolarHBondContact O-CD2 3.08Å; H1126-H1130 PolarHBondContact O-N 2.89Å; S1127-H1130 PolarHBondContact O-N 3.09Å; H1130-G1134 PolarHBondContact O-N 2.7Å
1131	I	91.8	Very high	86.7	Confident	70 Å²	70	36.7 Å²	36.7	36%	0.359	18%	0.178	S	C	.	.	H	α-helix	trans	-65.7	-48.2	177.6	-65.8	165.2	0	0	0	110.6	S909 S1127 I1128 W1129 L1135	S909-I1131 WeakPolarHBondContact O-CG1 3.44Å; S1127-I1131 WeakPolarHBondContact O-CG1 3.32Å; S1127-I1131 PolarHBondContact O-N 3.11Å; I1128-I1131 PolarHBondContact O-N 2.63Å; W1129-I1131 VanDerWaalsContact C-N 3.33Å; W1129-I1131 PolarHBondContact O-N 3.29Å; I1131-L1135 HydrophobicContact CG2-CD1 3.93Å; I1131-L1135 WeakPolarHBondContact O-CB 2.95Å; I1131-L1135 VanDerWaalsContact O-CG 3.27Å; I1131-L1135 WeakPolarHBondContact O-CG 2.99Å; I1131-L1135 PolarHBondContact O-N 3.14Å
1132	L	92.9	Very high	87.6	Confident	23 Å²	23	34.4 Å²	34.4	12%	0.12	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-41.2	-178.2	-72.3	173	0	0	0	112.6	F1105 I1108 M1112 I1128 W1129 S1136	F1105-L1132 HydrophobicContact CB-CD2 4.31Å; F1105-L1132 HydrophobicContact CD1-CD2 3.75Å; F1105-L1132 HydrophobicContact CG-CD2 4.38Å; I1108-L1132 HydrophobicContact CB-CD1 4.35Å; I1108-L1132 HydrophobicContact CG2-CD1 3.82Å; M1112-L1132 HydrophobicContact SD-CD1 4.24Å; I1128-L1132 HydrophobicContact CG2-CD1 3.68Å; I1128-L1132 HydrophobicContact CG2-CG 4.16Å; I1128-L1132 WeakPolarHBondContact O-CB 3.48Å; I1128-L1132 VanDerWaalsContact O-CG 3.31Å; I1128-L1132 WeakPolarHBondContact O-CG 2.95Å; I1128-L1132 PolarHBondContact O-N 2.78Å; W1129-L1132 PolarHBondContact O-N 2.85Å; L1132-S1136 WeakPolarHBondContact O-CB 3.34Å; L1132-S1136 PolarHBondContact O-N 3.47Å
1133	I	90.3	Very high	88.1	Confident	27 Å²	27	30.9 Å²	30.9	14%	0.138	15%	0.151	C	C	.	.	H	α-helix	trans	-68.9	-42.6	178.3	-158.4	71	0	0	0	110.7	F913 W1129 L1135 S1136 L1137	F913-I1133 HydrophobicContact CE2-CG2 4.48Å; F913-I1133 HydrophobicContact CZ-CG2 3.94Å; W1129-I1133 HydrophobicContact CD2-CG2 4.45Å; W1129-I1133 HydrophobicContact CE3-CG2 4.33Å; W1129-I1133 HydrophobicContact CH2-CG2 4.31Å; W1129-I1133 HydrophobicContact CZ2-CG2 4.43Å; W1129-I1133 HydrophobicContact CZ3-CG2 4.26Å; W1129-I1133 WeakPolarHBondContact O-CB 3.3Å; W1129-I1133 WeakPolarHBondContact O-CG2 3.42Å; W1129-I1133 PolarHBondContact O-N 3.37Å; I1133-L1135 PolarHBondContact O-N 2.89Å; I1133-S1136 WeakPolarHBondContact O-CB 3.45Å; I1133-S1136 PolarHBondContact O-N 2.66Å; I1133-S1136 VanDerWaalsContact O-N 3.11Å; I1133-S1136 PolarHBondContact O-OG 3.49Å; I1133-L1137 WeakPolarHBondContact O-CG 3.32Å; I1133-L1137 PolarHBondContact O-N 3.32Å
1134	G	91.5	Very high	88.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-42	175.6	0	0	0	0	0	113.3	G912 H1130 L1137 A1138	G912-G1134 CarbonylContact O-C 3.44Å; G912-G1134 VanDerWaalsContact O-C 3.28Å; G912-G1134 WeakPolarHBondContact O-CA 3.48Å; H1130-G1134 PolarHBondContact O-N 2.7Å; G1134-L1137 PolarHBondContact O-N 2.89Å; G1134-A1138 PolarHBondContact O-N 2.79Å
1135	L	91.7	Very high	88	Confident	58 Å²	58	25.9 Å²	25.9	30%	0.304	13%	0.129	S	C	.	.	H	α-helix	trans	-66.7	-38.7	172.3	-70.1	172.9	0	0	0	112.3	P915 F1105 I1131 I1133 L1137 A1138 C1139	P915-L1135 HydrophobicContact CG-CD2 4.38Å; F1105-L1135 HydrophobicContact CD2-CB 4.28Å; I1131-L1135 HydrophobicContact CG2-CD1 3.93Å; I1131-L1135 WeakPolarHBondContact O-CB 2.95Å; I1131-L1135 VanDerWaalsContact O-CG 3.27Å; I1131-L1135 WeakPolarHBondContact O-CG 2.99Å; I1131-L1135 PolarHBondContact O-N 3.14Å; I1133-L1135 PolarHBondContact O-N 2.89Å; L1135-L1137 VanDerWaalsContact C-N 3.31Å; L1135-L1137 PolarHBondContact O-N 2.99Å; L1135-A1138 WeakPolarHBondContact O-CB 2.9Å; L1135-A1138 PolarHBondContact O-N 3.29Å; L1135-A1138 VanDerWaalsContact O-N 3.16Å; L1135-C1139 PolarHBondContact O-N 3.37Å
1136	S	93.7	Very high	87.7	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.007	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-41.4	175.6	83.4	0	0	0	0	111.8	G1102 L1132 I1133 A1138 C1139 F1140	G1102-S1136 WeakPolarHBondContact O-CB 3.34Å; L1132-S1136 WeakPolarHBondContact O-CB 3.34Å; L1132-S1136 PolarHBondContact O-N 3.47Å; I1133-S1136 WeakPolarHBondContact O-CB 3.45Å; I1133-S1136 PolarHBondContact O-N 2.66Å; I1133-S1136 VanDerWaalsContact O-N 3.11Å; I1133-S1136 PolarHBondContact O-OG 3.49Å; S1136-A1138 VanDerWaalsContact C-N 3.31Å; S1136-A1138 PolarHBondContact O-N 3Å; S1136-C1139 WeakPolarHBondContact O-CB 3.25Å; S1136-C1139 PolarHBondContact O-N 3.07Å; S1136-F1140 WeakPolarHBondContact O-CB 3.3Å; S1136-F1140 WeakPolarHBondContact O-CD2 3.48Å; S1136-F1140 WeakPolarHBondContact O-CG 3.08Å; S1136-F1140 PolarHBondContact O-N 2.87Å
1137	L	92.4	Very high	87.8	Confident	6 Å²	6	22.5 Å²	22.5	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-65	-32.7	177.3	-62.9	169.8	0	0	0	112.4	F913 A916 Y932 S1026 I1133 G1134 L1135	F913-L1137 HydrophobicContact CD1-CD1 3.9Å; F913-L1137 HydrophobicContact CE1-CD1 3.51Å; A916-L1137 HydrophobicContact CB-CB 4.11Å; Y932-L1137 HydrophobicContact CD1-CD1 4.34Å; Y932-L1137 HydrophobicContact CE1-CB 4.48Å; Y932-L1137 HydrophobicContact CE1-CD1 4.29Å; Y932-L1137 HydrophobicContact CE1-CD2 4.3Å; S1026-L1137 VanDerWaalsContact OG-CD2 3.24Å; S1026-L1137 WeakPolarHBondContact OG-CD2 3.13Å; I1133-L1137 WeakPolarHBondContact O-CG 3.32Å; I1133-L1137 PolarHBondContact O-N 3.32Å; G1134-L1137 PolarHBondContact O-N 2.89Å; L1135-L1137 VanDerWaalsContact C-N 3.31Å; L1135-L1137 PolarHBondContact O-N 2.99Å
1138	A	89.9	Confident	87.3	Confident	14 Å²	14	22.9 Å²	22.9	12%	0.116	11%	0.114	C	C	.	.	H	α-helix	trans	-67.9	-45.8	172.3	0	0	0	0	0	111.5	P915 A916 G1134 L1135 S1136 F1140 L1141	P915-A1138 HydrophobicContact CB-CB 4.16Å; A916-A1138 HydrophobicContact CB-CB 4Å; G1134-A1138 PolarHBondContact O-N 2.79Å; L1135-A1138 WeakPolarHBondContact O-CB 2.9Å; L1135-A1138 PolarHBondContact O-N 3.29Å; L1135-A1138 VanDerWaalsContact O-N 3.16Å; S1136-A1138 VanDerWaalsContact C-N 3.31Å; S1136-A1138 PolarHBondContact O-N 3Å; A1138-F1140 VanDerWaalsContact C-N 3.3Å; A1138-F1140 PolarHBondContact O-N 2.73Å; A1138-L1141 PolarHBondContact O-N 3Å
1139	C	90.7	Very high	86.8	Confident	24 Å²	24	21.4 Å²	21.4	16%	0.162	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-32.2	175.4	-76.2	0	0	0	0	113.4	S1098 G1102 L1135 S1136	S1098-C1139 CarbonylContact C-O 3.59Å; S1098-C1139 VanDerWaalsContact CB-O 3.31Å; S1098-C1139 WeakPolarHBondContact CB-O 3.42Å; S1098-C1139 WeakPolarHBondContact O-CB 3.31Å; S1098-C1139 PolarHBondContact OG-O 3.23Å; G1102-C1139 VanDerWaalsContact CA-CB 3.44Å; L1135-C1139 PolarHBondContact O-N 3.37Å; S1136-C1139 WeakPolarHBondContact O-CB 3.25Å; S1136-C1139 PolarHBondContact O-N 3.07Å
1140	F	91.6	Very high	86.4	Confident	32 Å²	32	19.7 Å²	19.7	14%	0.14	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.1	179.5	-69.5	-41.4	0	0	0	114.9	I1030 F1099 G1102 V1103 A1106 S1136 A1138	I1030-F1140 HydrophobicContact CD1-CB 3.83Å; I1030-F1140 HydrophobicContact CD1-CG 4.44Å; I1030-F1140 WeakPolarHBondContact CD1-O 3.08Å; I1030-F1140 WeakPolarHBondContact CG1-O 3.44Å; F1099-F1140 HydrophobicContact CD2-CD1 4.03Å; F1099-F1140 HydrophobicContact CD2-CE1 4.05Å; F1099-F1140 HydrophobicContact CE2-CD1 4.33Å; F1099-F1140 HydrophobicContact CE2-CE1 4.11Å; G1102-F1140 WeakPolarHBondContact O-CZ 3.22Å; V1103-F1140 HydrophobicContact CG2-CE1 3.91Å; V1103-F1140 HydrophobicContact CG2-CZ 4.18Å; A1106-F1140 HydrophobicContact CB-CE2 4.19Å; A1106-F1140 HydrophobicContact CB-CZ 4.22Å; S1136-F1140 WeakPolarHBondContact O-CB 3.3Å; S1136-F1140 WeakPolarHBondContact O-CD2 3.48Å; S1136-F1140 WeakPolarHBondContact O-CG 3.08Å; S1136-F1140 PolarHBondContact O-N 2.87Å; A1138-F1140 VanDerWaalsContact C-N 3.3Å; A1138-F1140 PolarHBondContact O-N 2.73Å
1141	L	89.9	Confident	86.1	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.102	C	C	.	.			trans	-70	130.4	177.9	-80.7	158.1	0	0	0	111.8	L919 L925 Y932 W1094 A1138	L919-L1141 HydrophobicContact CB-CD1 3.9Å; L919-L1141 HydrophobicContact CD2-CB 4.17Å; L919-L1141 HydrophobicContact CD2-CD1 4.1Å; L925-L1141 HydrophobicContact CD1-CD2 3.72Å; Y932-L1141 HydrophobicContact CE2-CD1 4.23Å; Y932-L1141 HydrophobicContact CE2-CD2 4.27Å; Y932-L1141 HydrophobicContact CE2-CG 4.45Å; W1094-L1141 PolarHBondContact NE1-O 2.95Å; W1094-L1141 VanDerWaalsContact NE1-O 3.08Å; A1138-L1141 PolarHBondContact O-N 3Å
1142	P	86.6	Confident	85.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.			trans	-68.2	154.5	175	29.4	-34.7	0	0	0	110.8	H923 L925 P1144 W1147 C1163	H923-P1142 PolarHBondContact CE1-O 3.23Å; H923-P1142 PolarHBondContact ND1-O 2.92Å; L925-P1142 HydrophobicContact CD1-CG 4.23Å; P1142-P1144 WeakPolarHBondContact O-CD 3.48Å; P1142-W1147 HydrophobicContact CB-CD2 3.76Å; P1142-W1147 HydrophobicContact CB-CE3 3.78Å; P1142-W1147 HydrophobicContact CB-CG 4.5Å; P1142-W1147 HydrophobicContact CB-CH2 3.78Å; P1142-W1147 HydrophobicContact CB-CZ2 3.73Å; P1142-W1147 HydrophobicContact CB-CZ3 3.8Å; P1142-C1163 HydrophobicContact CB-CB 3.97Å; P1142-C1163 HydrophobicContact CG-CB 3.96Å
1143	W	83.2	Confident	84.8	Confident	39 Å²	39	22.4 Å²	22.4	15%	0.148	13%	0.127	C	C	.	.			trans	-98.3	97.2	178.3	-63.7	-4	0	0	0	109.7	H923 Q1093 W1094 I1097 F1145 R1146 W1147 L1259	H923-W1143 AromaticContact CE1-CD1 3.88Å; Q1093-W1143 HydrophobicContact CG-CZ3 4.02Å; W1094-W1143 AromaticContact CD1-CD1 3.77Å; W1094-W1143 AromaticContact CD1-CD2 3.74Å; W1094-W1143 AromaticContact CD1-CE2 3.67Å; W1094-W1143 AromaticContact CD1-CG 3.83Å; W1094-W1143 AromaticContact CD1-NE1 3.67Å; W1094-W1143 AromaticContact NE1-CD1 3.93Å; W1094-W1143 AromaticContact NE1-NE1 3.95Å; I1097-W1143 HydrophobicContact CB-CH2 4.19Å; I1097-W1143 HydrophobicContact CD1-CH2 4.47Å; I1097-W1143 HydrophobicContact CG2-CH2 4.17Å; I1097-W1143 HydrophobicContact CG2-CZ2 4.25Å; W1143-F1145 VanDerWaalsContact C-N 3.31Å; W1143-F1145 PolarHBondContact O-N 3.2Å; W1143-F1145 VanDerWaalsContact O-N 3.15Å; W1143-R1146 PolarHBondContact O-N 3.07Å; W1143-W1147 WeakPolarHBondContact O-CB 3.34Å; W1143-W1147 VanDerWaalsContact O-CD1 3.25Å; W1143-W1147 PolarHBondContact O-N 3.39Å; W1143-L1259 HydrophobicContact CH2-CD2 3.5Å; W1143-L1259 HydrophobicContact CZ2-CD2 4.15Å; W1143-L1259 HydrophobicContact CZ3-CD2 4.19Å
1144	P	78.3	Confident	84.4	Confident	13 Å²	13	24.3 Å²	24.3	8%	0.084	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-39.2	-161	-22.7	32.3	0	0	0	113	H923 P1142 R1148 C1163	H923-P1144 HydrophobicContact CB-CG 3.76Å; P1142-P1144 WeakPolarHBondContact O-CD 3.48Å; P1144-R1148 WeakPolarHBondContact O-CB 3.1Å; P1144-R1148 WeakPolarHBondContact O-CG 3.29Å; P1144-R1148 PolarHBondContact O-N 3.31Å; P1144-C1163 WeakPolarHBondContact CB-O 3.42Å; P1144-C1163 WeakPolarHBondContact CG-O 3.36Å
1145	F	74.2	Confident	83.8	Confident	28 Å²	28	25.6 Å²	25.6	12%	0.123	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-56.8	-179.9	-177	-110.1	0	0	0	112.4	W1143 W1147 R1148 I1149 L1166 Y1170 Y1281	W1143-F1145 VanDerWaalsContact C-N 3.31Å; W1143-F1145 PolarHBondContact O-N 3.2Å; W1143-F1145 VanDerWaalsContact O-N 3.15Å; F1145-W1147 VanDerWaalsContact C-N 3.32Å; F1145-W1147 PolarHBondContact O-N 3.2Å; F1145-R1148 PolarHBondContact O-N 3.02Å; F1145-I1149 HydrophobicContact CD1-CD1 3.98Å; F1145-I1149 HydrophobicContact CD2-CD1 4.25Å; F1145-I1149 HydrophobicContact CE1-CD1 3.65Å; F1145-I1149 HydrophobicContact CE2-CD1 3.94Å; F1145-I1149 HydrophobicContact CG-CD1 4.27Å; F1145-I1149 HydrophobicContact CZ-CD1 3.63Å; F1145-I1149 WeakPolarHBondContact O-CG1 3.42Å; F1145-I1149 PolarHBondContact O-N 3.46Å; F1145-L1166 HydrophobicContact CD2-CD1 4.07Å; F1145-Y1170 HydrophobicContact CE2-CD2 4Å; F1145-Y1170 AromaticContact CE2-CE2 3.82Å; F1145-Y1170 HydrophobicContact CE2-CE2 3.82Å; F1145-Y1170 HydrophobicContact CZ-CE2 4.11Å; F1145-Y1281 HydrophobicContact CE1-CE2 4.08Å
1146	R	76.6	Confident	83.1	Confident	6 Å²	6	25.9 Å²	25.9	2%	0.023	15%	0.151	C	C	.	.	H	α-helix	trans	-67.5	-31.4	-179.1	-68.7	-168	177.9	-136.8	-9.4	112.4	Q1093 W1143 A1150 N1260 D1264 P1278 Y1281	Q1093-R1146 VanDerWaalsContact OE1-CD 3.24Å; W1143-R1146 PolarHBondContact O-N 3.07Å; R1146-A1150 PolarHBondContact O-N 2.87Å; R1146-N1260 PolarHBondContact NE-OD1 3.31Å; R1146-N1260 PolarHBondContact NH2-OD1 2.94Å; R1146-D1264 IonicContact CZ-OD1 3.57Å; R1146-D1264 IonicContact NH1-OD1 2.73Å; R1146-D1264 IonicContact NH2-OD1 3.74Å; R1146-D1264 PolarHBondContact NH2-OD1 3.1Å; R1146-D1264 IonicContact NH2-OD2 3.65Å; R1146-P1278 HydrophobicContact CB-CG 4.25Å; R1146-P1278 HydrophobicContact CG-CG 4.28Å; R1146-Y1281 PolarHBondContact NH2-OH 2.76Å
1147	W	84.2	Confident	82	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.9	-42.9	173.9	-76.8	43	0	0	0	112.5	I1030 A1032 W1078 F1089 P1090 W1094 P1142 W1143 F1145 A1150 L1151 C1163	I1030-W1147 HydrophobicContact CG2-CH2 4.34Å; I1030-W1147 WeakPolarHBondContact O-CH2 3.22Å; I1030-W1147 VanDerWaalsContact O-CZ3 3.31Å; I1030-W1147 WeakPolarHBondContact O-CZ3 3.32Å; A1032-W1147 HydrophobicContact CB-CE3 4.25Å; A1032-W1147 HydrophobicContact CB-CZ3 4.06Å; W1078-W1147 HydrophobicContact CZ2-CH2 4.48Å; F1089-W1147 HydrophobicContact CE1-CE3 4.29Å; F1089-W1147 HydrophobicContact CE1-CZ3 4.1Å; F1089-W1147 HydrophobicContact CE2-CE3 4.36Å; F1089-W1147 HydrophobicContact CZ-CD2 4.15Å; F1089-W1147 AromaticContact CZ-CE3 3.55Å; F1089-W1147 HydrophobicContact CZ-CE3 3.55Å; F1089-W1147 AromaticContact CZ-CZ3 3.83Å; F1089-W1147 HydrophobicContact CZ-CZ3 3.83Å; P1090-W1147 HydrophobicContact CB-CH2 4.09Å; P1090-W1147 HydrophobicContact CB-CZ2 3.56Å; P1090-W1147 HydrophobicContact CG-CH2 3.52Å; P1090-W1147 HydrophobicContact CG-CZ2 3.48Å; P1090-W1147 VanDerWaalsContact CG-CZ2 3.48Å; P1090-W1147 HydrophobicContact CG-CZ3 4.3Å; W1094-W1147 AromaticContact CD1-NE1 3.85Å; W1094-W1147 AromaticContact CD2-CZ2 3.7Å; W1094-W1147 HydrophobicContact CD2-CZ2 3.7Å; W1094-W1147 AromaticContact CE2-CZ2 3.7Å; W1094-W1147 AromaticContact CE3-CZ2 3.82Å; W1094-W1147 HydrophobicContact CE3-CZ2 3.82Å; W1094-W1147 HydrophobicContact CG-CZ2 4.32Å; W1094-W1147 AromaticContact CG-NE1 3.76Å; W1094-W1147 HydrophobicContact CH2-CH2 4.33Å; W1094-W1147 AromaticContact CH2-CZ2 3.96Å; W1094-W1147 HydrophobicContact CH2-CZ2 3.96Å; W1094-W1147 HydrophobicContact CZ2-CH2 4.47Å; W1094-W1147 AromaticContact CZ2-CZ2 3.85Å; W1094-W1147 HydrophobicContact CZ2-CZ2 3.85Å; W1094-W1147 HydrophobicContact CZ3-CH2 4.44Å; W1094-W1147 AromaticContact CZ3-CZ2 3.94Å; W1094-W1147 HydrophobicContact CZ3-CZ2 3.94Å; P1142-W1147 HydrophobicContact CB-CD2 3.76Å; P1142-W1147 HydrophobicContact CB-CE3 3.78Å; P1142-W1147 HydrophobicContact CB-CG 4.5Å; P1142-W1147 HydrophobicContact CB-CH2 3.78Å; P1142-W1147 HydrophobicContact CB-CZ2 3.73Å; P1142-W1147 HydrophobicContact CB-CZ3 3.8Å; W1143-W1147 WeakPolarHBondContact O-CB 3.34Å; W1143-W1147 VanDerWaalsContact O-CD1 3.25Å; W1143-W1147 PolarHBondContact O-N 3.39Å; F1145-W1147 VanDerWaalsContact C-N 3.32Å; F1145-W1147 PolarHBondContact O-N 3.2Å; W1147-A1150 PolarHBondContact O-N 2.02Å; W1147-L1151 WeakPolarHBondContact O-CB 3.4Å; W1147-L1151 WeakPolarHBondContact O-CG 3Å; W1147-L1151 PolarHBondContact O-N 3.46Å; W1147-C1163 HydrophobicContact CD2-CB 4.49Å; W1147-C1163 HydrophobicContact CE3-CB 3.62Å; W1147-C1163 HydrophobicContact CZ3-CB 4.06Å
1148	R	79.3	Confident	81.3	Confident	14 Å²	14	37 Å²	37	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-29.5	178.8	-69.2	-72.9	-78.9	-115.7	9.7	112.9	P1144 F1145 S1152 V1157 I1159 G1164 N1165 L1166	P1144-R1148 WeakPolarHBondContact O-CB 3.1Å; P1144-R1148 WeakPolarHBondContact O-CG 3.29Å; P1144-R1148 PolarHBondContact O-N 3.31Å; F1145-R1148 PolarHBondContact O-N 3.02Å; R1148-S1152 PolarHBondContact O-N 2.75Å; R1148-S1152 VanDerWaalsContact O-N 3.14Å; R1148-V1157 PolarHBondContact NH2-O 3.35Å; R1148-I1159 VanDerWaalsContact CZ-O 3.31Å; R1148-I1159 PolarHBondContact NH1-O 3.26Å; R1148-I1159 PolarHBondContact NH2-O 3.5Å; R1148-G1164 PolarHBondContact NH1-O 3.44Å; R1148-N1165 PolarHBondContact NH1-OD1 2.93Å; R1148-L1166 HydrophobicContact CB-CD1 3.71Å
1149	I	76.6	Confident	80.7	Confident	41 Å²	41	39.7 Å²	39.7	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-48.8	168.9	-69.6	167.7	0	0	0	110.2	F1145 L1151 S1152 Y1281	F1145-I1149 HydrophobicContact CD1-CD1 3.98Å; F1145-I1149 HydrophobicContact CD2-CD1 4.25Å; F1145-I1149 HydrophobicContact CE1-CD1 3.65Å; F1145-I1149 HydrophobicContact CE2-CD1 3.94Å; F1145-I1149 HydrophobicContact CG-CD1 4.27Å; F1145-I1149 HydrophobicContact CZ-CD1 3.63Å; F1145-I1149 WeakPolarHBondContact O-CG1 3.42Å; F1145-I1149 PolarHBondContact O-N 3.46Å; I1149-L1151 PolarHBondContact O-N 3.37Å; I1149-S1152 PolarHBondContact O-N 3.36Å; I1149-S1152 PolarHBondContact O-OG 2.98Å; I1149-S1152 VanDerWaalsContact O-OG 3.05Å; I1149-Y1281 HydrophobicContact CD1-CD2 4.1Å
1150	A	79.8	Confident	80.2	Confident	13 Å²	13	41.3 Å²	41.3	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-25.4	178.2	0	0	0	0	0	113.9	L1085 R1146 W1147	L1085-A1150 WeakPolarHBondContact CD2-O 3.43Å; R1146-A1150 PolarHBondContact O-N 2.87Å; W1147-A1150 PolarHBondContact O-N 2.02Å
1151	L	82.3	Confident	79.8	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-93.8	-10.3	-179.9	-71.3	169.5	0	0	0	114.8	A1032 L1081 L1085 F1089 W1147 I1149 P1153 I1154 I1155 L1161	A1032-L1151 HydrophobicContact CB-CD1 4.44Å; L1081-L1151 HydrophobicContact CD1-CD2 4.27Å; L1081-L1151 HydrophobicContact CD2-CD2 3.8Å; L1085-L1151 HydrophobicContact CD1-CD2 4.31Å; F1089-L1151 HydrophobicContact CD2-CD2 4.06Å; F1089-L1151 HydrophobicContact CD2-CG 4.36Å; F1089-L1151 HydrophobicContact CE2-CD1 3.86Å; F1089-L1151 HydrophobicContact CE2-CD2 3.7Å; F1089-L1151 HydrophobicContact CE2-CG 3.65Å; F1089-L1151 HydrophobicContact CZ-CD1 3.89Å; F1089-L1151 HydrophobicContact CZ-CD2 4.13Å; F1089-L1151 HydrophobicContact CZ-CG 4.17Å; W1147-L1151 WeakPolarHBondContact O-CB 3.4Å; W1147-L1151 WeakPolarHBondContact O-CG 3Å; W1147-L1151 PolarHBondContact O-N 3.46Å; I1149-L1151 PolarHBondContact O-N 3.37Å; L1151-P1153 VanDerWaalsContact C-N 3.32Å; L1151-I1154 PolarHBondContact O-N 3.31Å; L1151-I1155 HydrophobicContact CD2-CD1 4.25Å; L1151-I1155 PolarHBondContact O-N 3.26Å; L1151-L1161 HydrophobicContact CD1-CD1 3.95Å
1152	S	80.2	Confident	79.7	Confident	52 Å²	52	39.9 Å²	39.9	36%	0.364	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-27.9	-176	69.7	0	0	0	0	115.6	R1148 I1149 I1154	R1148-S1152 PolarHBondContact O-N 2.75Å; R1148-S1152 VanDerWaalsContact O-N 3.14Å; I1149-S1152 PolarHBondContact O-N 3.36Å; I1149-S1152 PolarHBondContact O-OG 2.98Å; I1149-S1152 VanDerWaalsContact O-OG 3.05Å; S1152-I1154 PolarHBondContact O-N 3.46Å
1153	P	78.2	Confident	79.4	Confident	101 Å²	101	39.9 Å²	39.9	66%	0.656	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-9.8	177.4	-21.4	35	0	0	0	115.2	L1151	L1151-P1153 VanDerWaalsContact C-N 3.32Å
1154	I	80.7	Confident	79.2	Confident	66 Å²	66	38.3 Å²	38.3	34%	0.338	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-38.7	-175.4	-60.8	155.9	0	0	0	111.8	K1084 L1085 L1151 S1152	K1084-I1154 HydrophobicContact CB-CD1 3.61Å; K1084-I1154 HydrophobicContact CB-CG1 4.36Å; K1084-I1154 HydrophobicContact CD-CG2 4.26Å; L1085-I1154 HydrophobicContact CB-CD1 4.19Å; L1085-I1154 HydrophobicContact CD2-CD1 3.38Å; L1085-I1154 HydrophobicContact CD2-CG1 4.38Å; L1085-I1154 HydrophobicContact CG-CD1 3.43Å; L1085-I1154 VanDerWaalsContact CG-CD1 3.43Å; L1151-I1154 PolarHBondContact O-N 3.31Å; S1152-I1154 PolarHBondContact O-N 3.46Å
1155	I	79.2	Confident	78.8	Confident	28 Å²	28	41.6 Å²	41.6	14%	0.144	24%	0.235	C	C	.	.	S	Bend	trans	-114.1	109.9	-173.4	-51.5	-177.8	0	0	0	108.4	L1081 L1151 V1157 I1159 L1161	L1081-I1155 HydrophobicContact CD2-CD1 4.2Å; L1151-I1155 HydrophobicContact CD2-CD1 4.25Å; L1151-I1155 PolarHBondContact O-N 3.26Å; I1155-V1157 PolarHBondContact O-N 2.77Å; I1155-I1159 HydrophobicContact CG2-CB 3.95Å; I1155-I1159 HydrophobicContact CG2-CD1 3.94Å; I1155-I1159 HydrophobicContact CG2-CG1 4.48Å; I1155-I1159 HydrophobicContact CG2-CG2 4.15Å; I1155-L1161 HydrophobicContact CD1-CD1 4.23Å; I1155-L1161 HydrophobicContact CD1-CD2 4.11Å; I1155-L1161 HydrophobicContact CG2-CD1 4.1Å; I1155-L1161 HydrophobicContact CG2-CD2 4.28Å; I1155-L1161 HydrophobicContact CG2-CG 4.44Å
1156	S	76.6	Confident	78.4	Confident	64 Å²	64	42.6 Å²	42.6	45%	0.448	24%	0.241	S	C	.	.			trans	-47.1	134.7	176.7	174.4	0	0	0	0	111.6	H1158 I1159	S1156-H1158 PolarHBondContact O-N 2.71Å; S1156-I1159 PolarHBondContact O-N 2.83Å
1157	V	72.1	Confident	77.4	Confident	68 Å²	68	43.7 Å²	43.7	41%	0.412	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.6	-174.6	-174.3	0	0	0	0	112.2	R1148 I1155 L1166	R1148-V1157 PolarHBondContact NH2-O 3.35Å; I1155-V1157 PolarHBondContact O-N 2.77Å; V1157-L1166 HydrophobicContact CG1-CB 4.34Å; V1157-L1166 HydrophobicContact CG1-CD2 3.98Å
1158	H	76.4	Confident	75.7	Confident	172 Å²	172	53.2 Å²	53.2	80%	0.796	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-19	175.9	-56.4	-66.9	0	0	0	114.8	S1156	S1156-H1158 PolarHBondContact O-N 2.71Å
1159	I	78.3	Confident	73.9	Confident	71 Å²	71	62 Å²	62	36%	0.364	32%	0.324	S	S	.	.	S	Bend	trans	-75.3	126.5	-177.6	-62.7	171.7	0	0	0	109.8	R1148 I1155 S1156	R1148-I1159 VanDerWaalsContact CZ-O 3.31Å; R1148-I1159 PolarHBondContact NH1-O 3.26Å; R1148-I1159 PolarHBondContact NH2-O 3.5Å; I1155-I1159 HydrophobicContact CG2-CB 3.95Å; I1155-I1159 HydrophobicContact CG2-CD1 3.94Å; I1155-I1159 HydrophobicContact CG2-CG1 4.48Å; I1155-I1159 HydrophobicContact CG2-CG2 4.15Å; S1156-I1159 PolarHBondContact O-N 2.83Å
1160	P	79.5	Confident	72.3	Confident	57 Å²	57	65.8 Å²	65.8	37%	0.37	34%	0.337	S	S	.	.			trans	-77.5	128	175.7	30.3	-33.4	0	0	0	111.3	M1035 N1165	M1035-P1160 HydrophobicContact CB-CB 3.95Å; M1035-P1160 HydrophobicContact CB-CG 4Å; M1035-P1160 WeakPolarHBondContact CB-O 3.24Å; M1035-P1160 PolarHBondContact N-O 3.03Å; P1160-N1165 WeakPolarHBondContact CA-OD1 3.37Å
1161	L	83.8	Confident	70	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-116.7	153.3	-178.9	-66.9	167.6	0	0	0	110.9	P1034 M1035 L1151 I1155 C1163 G1164	P1034-L1161 HydrophobicContact CG-CD2 4.25Å; M1035-L1161 WeakPolarHBondContact CE-O 3.5Å; L1151-L1161 HydrophobicContact CD1-CD1 3.95Å; I1155-L1161 HydrophobicContact CD1-CD1 4.23Å; I1155-L1161 HydrophobicContact CD1-CD2 4.11Å; I1155-L1161 HydrophobicContact CG2-CD1 4.1Å; I1155-L1161 HydrophobicContact CG2-CD2 4.28Å; I1155-L1161 HydrophobicContact CG2-CG 4.44Å; L1161-C1163 PolarHBondContact O-N 3.13Å; L1161-G1164 PolarHBondContact O-N 2.7Å; L1161-G1164 VanDerWaalsContact O-N 3.08Å
1162	S	87.5	Confident	67.8	Low	3 Å²	3	80.1 Å²	80.1	2%	0.021	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.7	-180	67.9	0	0	0	0	114.3	L1028 T1029 A1032 I1033 G1164	L1028-S1162 VanDerWaalsContact O-CB 3.26Å; L1028-S1162 WeakPolarHBondContact O-CB 3.49Å; L1028-S1162 PolarHBondContact O-OG 3.02Å; T1029-S1162 PolarHBondContact O-OG 2.81Å; A1032-S1162 WeakPolarHBondContact CA-OG 3.34Å; A1032-S1162 PolarHBondContact N-OG 3.33Å; I1033-S1162 PolarHBondContact N-OG 3.36Å; I1033-S1162 PolarHBondContact O-N 3.24Å; S1162-G1164 PolarHBondContact O-N 2.89Å
1163	C	81.3	Confident	65.4	Low	0 Å²	0	84.1 Å²	84.1	0%	0	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4	174.9	60.4	0	0	0	0	114.7	A1032 P1142 P1144 W1147 L1161	A1032-C1163 HydrophobicContact CB-CB 4.21Å; P1142-C1163 HydrophobicContact CB-CB 3.97Å; P1142-C1163 HydrophobicContact CG-CB 3.96Å; P1144-C1163 WeakPolarHBondContact CB-O 3.42Å; P1144-C1163 WeakPolarHBondContact CG-O 3.36Å; W1147-C1163 HydrophobicContact CD2-CB 4.49Å; W1147-C1163 HydrophobicContact CE3-CB 3.62Å; W1147-C1163 HydrophobicContact CZ3-CB 4.06Å; L1161-C1163 PolarHBondContact O-N 3.13Å
1164	G	77.5	Confident	63	Low	6 Å²	6	86.3 Å²	86.3	6%	0.062	42%	0.422	C	S	.	.			trans	100.5	169.5	175.5	0	0	0	0	0	114.3	R1148 L1161 S1162	R1148-G1164 PolarHBondContact NH1-O 3.44Å; L1161-G1164 PolarHBondContact O-N 2.7Å; L1161-G1164 VanDerWaalsContact O-N 3.08Å; S1162-G1164 PolarHBondContact O-N 2.89Å
1165	N	71.3	Confident	60.5	Low	83 Å²	83	90.1 Å²	90.1	44%	0.444	44%	0.443	S	S	.	.			trans	-107.3	150.4	-175.2	-76.5	-20.9	0	0	0	112.6	R1148 P1160	R1148-N1165 PolarHBondContact NH1-OD1 2.93Å; P1160-N1165 WeakPolarHBondContact CA-OD1 3.37Å
1166	L	64.6	Low	58.3	Low	48 Å²	48	95.1 Å²	95.1	25%	0.251	47%	0.47	S	S	.	.			trans	-63.3	139.4	174.2	-146.9	78.4	0	0	0	110.2	F1145 R1148 V1157 K1168	F1145-L1166 HydrophobicContact CD2-CD1 4.07Å; R1148-L1166 HydrophobicContact CB-CD1 3.71Å; V1157-L1166 HydrophobicContact CG1-CB 4.34Å; V1157-L1166 HydrophobicContact CG1-CD2 3.98Å; L1166-K1168 PolarHBondContact O-N 3.16Å
1167	P	56.8	Low	56.1	Low	30 Å²	30	96.8 Å²	96.8	20%	0.195	48%	0.482	C	S	.	.			trans	-63.9	132.7	175.6	-23.6	34.9	0	0	0	112.2	R1169 Y1170	P1167-R1169 PolarHBondContact O-N 3.04Å; P1167-Y1170 PolarHBondContact O-N 3.23Å
1168	K	47.7	Very low	53.9	Low	200 Å²	200	100.2 Å²	100.2	87%	0.87	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	48.3	171.4	-63.7	-168.2	173.3	-164	0	114	L1166	L1166-K1168 PolarHBondContact O-N 3.16Å
1169	R	42.4	Very low	51.6	Low	197 Å²	197	96.9 Å²	96.9	74%	0.743	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.4	12.8	175	-144.2	-179.8	-173.1	-177.7	-0.2	113	P1167	P1167-R1169 PolarHBondContact O-N 3.04Å
1170	Y	41.9	Very low	49.1	Very low	122 Å²	122	101.5 Å²	101.5	48%	0.478	52%	0.515	S	S	.	.			trans	-114.3	59.8	160.3	-85.3	-81.1	0	0	0	107.5	F1145 P1167	F1145-Y1170 HydrophobicContact CE2-CD2 4Å; F1145-Y1170 AromaticContact CE2-CE2 3.82Å; F1145-Y1170 HydrophobicContact CE2-CE2 3.82Å; F1145-Y1170 HydrophobicContact CZ-CE2 4.11Å; P1167-Y1170 PolarHBondContact O-N 3.23Å
1171	D	32.3	Very low	46.7	Very low	129 Å²	129	103.7 Å²	103.7	69%	0.69	53%	0.531	S	S	*	.			trans	-76.9	124.9	159.4	-64.1	-52.9	0	0	0	106.2	N1173	D1171-N1173 PolarHBondContact O-N 2.84Å
1172	Y	36.5	Very low	44	Very low	185 Å²	185	110.1 Å²	110.1	73%	0.725	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	19.6	-162.8	-142.6	-92	0	0	0	113.7
1173	N	28.5	Very low	41.1	Very low	136 Å²	136	116 Å²	116	73%	0.727	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	0.1	-152.9	-67	20.8	0	0	0	115.2	D1171	D1171-N1173 PolarHBondContact O-N 2.84Å
1174	N	28.3	Very low	38.5	Very low	148 Å²	148	122.3 Å²	122.3	79%	0.791	63%	0.633	S	S	*	*	S	Bend	trans	-113.4	-18.6	-174.1	-93.2	63.6	0	0	0	115.8
1175	D	29	Very low	36.1	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	66%	0.663	S	S	*	*	S	Bend	trans	-109.7	-3.6	-179.5	-64	-36.5	0	0	0	113	S1177	D1175-S1177 PolarHBondContact O-N 2.79Å
1176	L	32	Very low	34	Very low	133 Å²	133	129.4 Å²	129.4	70%	0.696	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	48.6	-176.1	-159.6	75.8	0	0	0	113
1177	S	31.4	Very low	32.1	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	-9	171.9	61.9	0	0	0	0	113.7	D1175	D1175-S1177 PolarHBondContact O-N 2.79Å
1178	N	26	Very low	30.6	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	74%	0.736	S	S	*	*	S	Bend	trans	-149.4	81.8	177.6	-88	-52.1	0	0	0	111.7
1179	T	26.8	Very low	29.7	Very low	103 Å²	103	139.7 Å²	139.7	63%	0.632	73%	0.734	S	S	*	*			trans	172.3	125.2	139.9	25.7	0	0	0	0	111	S1181 L1287	T1179-S1181 PolarHBondContact O-N 2.8Å; T1179-L1287 HydrophobicContact CG2-CD2 4Å
1180	N	27.2	Very low	28.8	Very low	168 Å²	168	139.3 Å²	139.3	90%	0.898	74%	0.741	S	S	*	*			trans	-82.4	104.4	170	-70.9	-24.1	0	0	0	109.7
1181	S	28.1	Very low	27.9	Very low	102 Å²	102	141.4 Å²	141.4	71%	0.713	76%	0.76	S	S	*	*			trans	163.1	88.9	144.1	47.2	0	0	0	0	115.2	T1179	T1179-S1181 PolarHBondContact O-N 2.8Å
1182	L	26.1	Very low	27.6	Very low	136 Å²	136	144.6 Å²	144.6	71%	0.712	77%	0.771	S	S	*	*				-170.9	120.1	123.3	-112.9	150.8	0	0	0	111.3	Q1282	L1182-Q1282 HydrophobicContact CD1-CG 4.39Å
1183	V	26.8	Very low	27	Very low	126 Å²	126	141.4 Å²	141.4	76%	0.764	78%	0.776	S	S	*	*			trans	-87.1	128.5	-178.6	178.3	0	0	0	0	110.4
1184	I	27.4	Very low	26.8	Very low	133 Å²	133	143.3 Å²	143.3	68%	0.682	78%	0.78	S	S	*	*			trans	-122.9	119.4	149.7	-60.6	179.3	0	0	0	105.4	V1186	I1184-V1186 PolarHBondContact O-N 3Å
1185	P	27.2	Very low	26.7	Very low	106 Å²	106	143.1 Å²	143.1	69%	0.688	78%	0.779	S	S	*	*			trans	-72.8	119.6	-176.6	29.1	-32.9	0	0	0	110.3
1186	V	27.7	Very low	26.4	Very low	132 Å²	132	144.4 Å²	144.4	80%	0.8	79%	0.785	S	S	*	*			trans	-125.8	53.2	162.1	-166.9	0	0	0	0	108.3	I1184	I1184-V1186 PolarHBondContact O-N 3Å
1187	E	24.7	Very low	26.2	Very low	173 Å²	173	147 Å²	147	81%	0.808	79%	0.793	S	S	*	*			trans	-76.6	160.2	150.4	-67	-173.2	131.5	0	0	108.5
1188	I	25.7	Very low	25.8	Very low	160 Å²	160	148.1 Å²	148.1	82%	0.821	80%	0.796	S	S	*	*	S	Bend	trans	65.9	68	-174.5	-39.4	174.8	0	0	0	113
1189	I	26.9	Very low	25.7	Very low	161 Å²	161	147.6 Å²	147.6	83%	0.826	80%	0.802	S	S	*	*				-164.9	85	111.3	-84.7	146.9	0	0	0	107.6
1190	Q	23.9	Very low	25.6	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.883	81%	0.808	S	S	*	*			trans	-143.6	87	159.7	-87.3	-167.2	-49.9	0	0	107
1191	N	24.2	Very low	25.4	Very low	166 Å²	166	148.7 Å²	148.7	89%	0.888	80%	0.803	S	S	*	*	S	Bend	trans	-177.9	63.3	162.2	-98	-11.6	0	0	0	109.5
1192	E	24.9	Very low	25.3	Very low	195 Å²	195	149.7 Å²	149.7	91%	0.911	81%	0.805	S	S	*	*	S	Bend	trans	-174.5	70.8	157.2	-112.2	177.7	-164.4	0	0	110.1
1193	S	24.5	Very low	25.3	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	81%	0.811	S	S	*	*			trans	-169.8	62.1	167.6	41.9	0	0	0	0	112.4
1194	E	25	Very low	25.1	Very low	175 Å²	175	152.3 Å²	152.3	82%	0.818	82%	0.815	S	S	*	*			trans	-64.8	160.2	157.5	-68.1	-168.7	132.7	0	0	110.7
1195	N	24.4	Very low	25	Very low	144 Å²	144	149.5 Å²	149.5	77%	0.77	82%	0.819	S	S	*	*			trans	70	69.7	167.2	-55.8	-55.2	0	0	0	118.1
1196	L	24.7	Very low	24.8	Very low	172 Å²	172	152.2 Å²	152.2	90%	0.901	83%	0.828	S	S	*	*				-149.7	129.1	121.8	-150.2	67.4	0	0	0	111.8
1197	H	26.8	Very low	24.8	Very low	187 Å²	187	157.3 Å²	157.3	87%	0.866	83%	0.832	S	S	*	*			trans	-78.1	140	-174.1	-106.9	-91.7	0	0	0	113.5
1198	V	23.6	Very low	24.7	Very low	125 Å²	125	156.6 Å²	156.6	76%	0.758	83%	0.834	S	S	*	*			trans	-87.7	139.6	169.7	174.3	0	0	0	0	109.9
1199	C	22.7	Very low	24.9	Very low	128 Å²	128	155.7 Å²	155.7	87%	0.865	84%	0.836	S	S	*	*			trans	-154	124.4	151.8	-122.4	0	0	0	0	111.3
1200	N	25	Very low	24.7	Very low	144 Å²	144	155 Å²	155	77%	0.77	83%	0.834	S	S	*	*			trans	-121.8	129.2	163.2	-92.2	-22.9	0	0	0	107
1201	N	22.8	Very low	24.7	Very low	149 Å²	149	152.9 Å²	152.9	80%	0.797	83%	0.828	S	S	*	*				167.1	129.1	124	-84.2	-19.8	0	0	0	113.3
1202	V	25.7	Very low	24.8	Very low	124 Å²	124	150.2 Å²	150.2	75%	0.752	82%	0.822	S	S	*	*			trans	35.9	116.2	132.7	-170.2	0	0	0	0	119.3
1203	L	25.8	Very low	24.8	Very low	161 Å²	161	147.3 Å²	147.3	84%	0.843	81%	0.813	S	S	*	*				-164.8	168.2	125.4	-107.2	160.8	0	0	0	111.6
1204	D	23.9	Very low	25	Very low	155 Å²	155	150.7 Å²	150.7	83%	0.829	82%	0.816	S	S	*	*			trans	-77.6	165.9	-165.5	-57.9	-77.8	0	0	0	115.9
1205	G	25.6	Very low	25.1	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	81%	0.814	S	S	*	*			trans	169.8	98.7	166.1	0	0	0	0	0	115.1
1206	D	23.5	Very low	25.1	Very low	163 Å²	163	153.8 Å²	153.8	87%	0.872	82%	0.82	S	S	*	*			trans	-65.2	145.2	164	-76.7	-50.9	0	0	0	111.7
1207	R	25.8	Very low	25.3	Very low	238 Å²	238	151 Å²	151	90%	0.898	81%	0.811	S	S	*	*			trans	-175.9	133	134	-102.7	157.3	-160.3	-163.1	4.6	113.5
1208	D	23.8	Very low	25.3	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	81%	0.809	S	S	*	*			trans	-66	144.9	159.7	-53.6	-84.2	0	0	0	111.2
1209	V	29.2	Very low	25.6	Very low	141 Å²	141	148.1 Å²	148.1	86%	0.855	81%	0.809	S	S	*	*			trans	-135	129.8	159.9	-179.2	0	0	0	0	108.8
1210	N	23.2	Very low	25.9	Very low	148 Å²	148	152 Å²	152	79%	0.791	81%	0.811	S	S	*	*			trans	-97.5	140.6	-174.5	-103.6	-45.4	0	0	0	113
1211	L	23.6	Very low	26	Very low	144 Å²	144	152.5 Å²	152.5	75%	0.754	81%	0.813	S	S	*	*			trans	49.3	99.5	131.4	-163.1	80.9	0	0	0	120.5
1212	S	27.1	Very low	26.5	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	81%	0.805	S	S	*	*			trans	-167.6	110.9	131.8	44.1	0	0	0	0	108.8
1213	N	24.5	Very low	27.3	Very low	134 Å²	134	152.6 Å²	152.6	72%	0.717	80%	0.804	S	S	*	*				65.2	91	87.6	-76	-1.9	0	0	0	114.3
1214	E	28.9	Very low	27.8	Very low	191 Å²	191	152.6 Å²	152.6	89%	0.893	80%	0.797	S	S	*	*				-150.9	164.8	123.9	-133.8	166.2	-148.3	0	0	112.2
1215	Y	25.5	Very low	28.8	Very low	200 Å²	200	147.3 Å²	147.3	78%	0.784	77%	0.772	S	S	*	*			trans	-95.9	137.6	-147.6	-68.7	-104.7	0	0	0	115.5
1216	M	26	Very low	30.2	Very low	184 Å²	184	149 Å²	149	91%	0.906	76%	0.763	S	S	*	*			trans	-144.7	141.4	130.8	-165.5	136.4	65.5	0	0	110.6
1217	T	27.7	Very low	31.6	Very low	114 Å²	114	145.4 Å²	145.4	70%	0.699	75%	0.746	S	S	*	*			trans	-90.5	132.7	-154.6	47.9	0	0	0	0	115.3
1218	P	28.1	Very low	33.2	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	73%	0.726	S	S	*	*			trans	-108.3	110.7	167.6	34.9	-25.8	0	0	0	112.1
1219	T	29.5	Very low	34.8	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	71%	0.713	S	S	*	*			trans	-110.1	132.4	172.3	57	0	0	0	0	112.6
1220	K	28.1	Very low	36.4	Very low	208 Å²	208	136.7 Å²	136.7	90%	0.904	70%	0.704	S	S	*	*			trans	65.7	60.2	169.7	-58.4	-179.9	179.3	175.3	0	117.1
1221	L	27.3	Very low	38.3	Very low	156 Å²	156	135 Å²	135	82%	0.817	69%	0.694	S	S	*	*			trans	-84.9	110.5	158	-156.7	76.4	0	0	0	110.5
1222	S	34.3	Very low	40.4	Very low	90 Å²	90	130.9 Å²	130.9	63%	0.629	68%	0.676	S	S	*	*			trans	-77.8	163.4	-174.1	-176.2	0	0	0	0	114	K1224 S1225	S1222-K1224 PolarHBondContact O-N 2.98Å; S1222-S1225 PolarHBondContact O-N 3.5Å
1223	Y	42.5	Very low	42.3	Very low	184 Å²	184	130.8 Å²	130.8	72%	0.722	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-39.1	-21.5	-178.2	-176.6	-108.8	0	0	0	117.2	S1225 I1226	Y1223-S1225 PolarHBondContact O-N 3.48Å; Y1223-I1226 PolarHBondContact O-N 2.93Å
1224	K	34.8	Very low	44.4	Very low	162 Å²	162	129 Å²	129	70%	0.704	66%	0.657	S	S	*	*	H	α-helix	trans	-53.4	-33.9	172.7	-76.6	-176.2	173.1	179.1	0	113.7	S1222 I1226 V1227 I1228	S1222-K1224 PolarHBondContact O-N 2.98Å; K1224-I1226 VanDerWaalsContact C-N 3.33Å; K1224-I1226 PolarHBondContact O-N 2.73Å; K1224-V1227 PolarHBondContact O-N 3.31Å; K1224-I1228 HydrophobicContact CB-CD1 4.3Å; K1224-I1228 VanDerWaalsContact O-CG1 3.3Å; K1224-I1228 WeakPolarHBondContact O-CG1 3.26Å; K1224-I1228 PolarHBondContact O-N 3.17Å
1225	S	46.5	Very low	46.4	Very low	44 Å²	44	124.4 Å²	124.4	31%	0.308	64%	0.638	S	S	.	*	H	α-helix	trans	-60.4	-38.6	-176.2	59.8	0	0	0	0	113.5	S1222 Y1223 I1228 N1229	S1222-S1225 PolarHBondContact O-N 3.5Å; Y1223-S1225 PolarHBondContact O-N 3.48Å; S1225-I1228 PolarHBondContact O-N 2.89Å; S1225-N1229 PolarHBondContact O-N 2.04Å
1226	I	53.2	Low	48.5	Very low	111 Å²	111	118.7 Å²	118.7	57%	0.569	62%	0.621	S	S	*	*	H	α-helix	trans	-67.9	-43.4	-179.9	-59.8	174.5	0	0	0	110.6	Y1223 K1224 K1230	Y1223-I1226 PolarHBondContact O-N 2.93Å; K1224-I1226 VanDerWaalsContact C-N 3.33Å; K1224-I1226 PolarHBondContact O-N 2.73Å; I1226-K1230 WeakPolarHBondContact O-CB 3.36Å; I1226-K1230 PolarHBondContact O-N 2.89Å
1227	V	54.3	Low	50.6	Low	86 Å²	86	117.6 Å²	117.6	52%	0.521	61%	0.611	S	S	.	*	H	α-helix	trans	-65.1	-43.8	177	-178.1	0	0	0	0	110.7	K1224 K1230 L1231	K1224-V1227 PolarHBondContact O-N 3.31Å; V1227-K1230 PolarHBondContact O-N 2.73Å; V1227-L1231 WeakPolarHBondContact O-CB 3.5Å; V1227-L1231 PolarHBondContact O-N 3.08Å
1228	I	58.2	Low	52.7	Low	95 Å²	95	116.9 Å²	116.9	49%	0.487	60%	0.603	S	S	.	*	H	α-helix	trans	-61	-51.5	176.9	-69.3	166.4	0	0	0	110.4	K1224 S1225 K1230 L1231 T1232	K1224-I1228 HydrophobicContact CB-CD1 4.3Å; K1224-I1228 VanDerWaalsContact O-CG1 3.3Å; K1224-I1228 WeakPolarHBondContact O-CG1 3.26Å; K1224-I1228 PolarHBondContact O-N 3.17Å; S1225-I1228 PolarHBondContact O-N 2.89Å; I1228-K1230 VanDerWaalsContact C-N 3.29Å; I1228-K1230 PolarHBondContact O-N 3.35Å; I1228-L1231 WeakPolarHBondContact O-CB 3.36Å; I1228-L1231 PolarHBondContact O-N 2.89Å; I1228-L1231 VanDerWaalsContact O-N 3.07Å; I1228-T1232 PolarHBondContact O-N 3.21Å; I1228-T1232 PolarHBondContact O-OG1 3.36Å
1229	N	57.6	Low	54.7	Low	107 Å²	107	114.3 Å²	114.3	57%	0.572	59%	0.585	S	S	*	*	H	α-helix	trans	-60.5	-36.2	178.7	-89.9	-9	0	0	0	113.2	S1225 N1233	S1225-N1229 PolarHBondContact O-N 2.04Å; N1229-N1233 WeakPolarHBondContact O-CB 3.28Å; N1229-N1233 PolarHBondContact O-N 2.57Å
1230	K	63.5	Low	56.6	Low	153 Å²	153	116 Å²	116	67%	0.665	58%	0.582	S	S	*	*	H	α-helix	trans	-68	-37	175.4	-160.1	169.4	-173.3	174.8	0	111.9	I1226 V1227 I1228 N1234	I1226-K1230 WeakPolarHBondContact O-CB 3.36Å; I1226-K1230 PolarHBondContact O-N 2.89Å; V1227-K1230 PolarHBondContact O-N 2.73Å; I1228-K1230 VanDerWaalsContact C-N 3.29Å; I1228-K1230 PolarHBondContact O-N 3.35Å; K1230-N1234 PolarHBondContact O-N 3.37Å
1231	L	63	Low	58.8	Low	111 Å²	111	112.5 Å²	112.5	58%	0.581	57%	0.567	S	S	*	*	H	α-helix	trans	-68.1	-47.2	173.8	-163.3	74.9	0	0	0	111.5	V1227 I1228 N1233 N1234 L1235	V1227-L1231 WeakPolarHBondContact O-CB 3.5Å; V1227-L1231 PolarHBondContact O-N 3.08Å; I1228-L1231 WeakPolarHBondContact O-CB 3.36Å; I1228-L1231 PolarHBondContact O-N 2.89Å; I1228-L1231 VanDerWaalsContact O-N 3.07Å; L1231-N1233 PolarHBondContact O-N 3.46Å; L1231-N1234 PolarHBondContact O-N 3.42Å; L1231-L1235 HydrophobicContact CG-CD1 4.23Å; L1231-L1235 PolarHBondContact O-N 3.45Å
1232	T	67.6	Low	60.9	Low	59 Å²	59	108.6 Å²	108.6	36%	0.362	55%	0.549	S	S	.	.	H	α-helix	trans	-59.7	-41.6	177.9	-53.7	0	0	0	0	111.9	I1228 L1235 N1236	I1228-T1232 PolarHBondContact O-N 3.21Å; I1228-T1232 PolarHBondContact O-OG1 3.36Å; T1232-L1235 PolarHBondContact O-N 3.28Å; T1232-N1236 WeakPolarHBondContact O-CB 3.38Å; T1232-N1236 PolarHBondContact O-N 3.07Å
1233	N	66.8	Low	62.8	Low	106 Å²	106	111 Å²	111	57%	0.567	55%	0.545	S	S	*	.	H	α-helix	trans	-68.3	-35.4	176	-90.6	-27.4	0	0	0	113.2	N1229 L1231 N1236 K1237	N1229-N1233 WeakPolarHBondContact O-CB 3.28Å; N1229-N1233 PolarHBondContact O-N 2.57Å; L1231-N1233 PolarHBondContact O-N 3.46Å; N1233-N1236 PolarHBondContact O-N 3.47Å; N1233-K1237 PolarHBondContact O-N 3.45Å
1234	N	69.6	Low	64.2	Low	98 Å²	98	110 Å²	110	52%	0.524	55%	0.545	S	S	.	.	H	α-helix	trans	-69.9	-40	173.3	-78.2	-12.2	0	0	0	111.8	K1230 L1231 K1237 L1238	K1230-N1234 PolarHBondContact O-N 3.37Å; L1231-N1234 PolarHBondContact O-N 3.42Å; N1234-K1237 PolarHBondContact O-N 2.98Å; N1234-L1238 WeakPolarHBondContact O-CB 3.47Å; N1234-L1238 PolarHBondContact O-N 3Å
1235	L	69.4	Low	65.9	Low	93 Å²	93	105.8 Å²	105.8	49%	0.487	53%	0.532	S	S	.	.	H	α-helix	trans	-60.3	-44.3	171.2	-79.2	163	0	0	0	111.4	L1231 T1232 K1237 L1238 T1239	L1231-L1235 HydrophobicContact CG-CD1 4.23Å; L1231-L1235 PolarHBondContact O-N 3.45Å; T1232-L1235 PolarHBondContact O-N 3.28Å; L1235-K1237 PolarHBondContact O-N 3.01Å; L1235-L1238 PolarHBondContact O-N 2.93Å; L1235-T1239 WeakPolarHBondContact O-CG2 3.47Å; L1235-T1239 PolarHBondContact O-N 3.06Å; L1235-T1239 PolarHBondContact O-OG1 2.8Å; L1235-T1239 VanDerWaalsContact O-OG1 3.1Å
1236	N	70.2	Confident	67	Low	81 Å²	81	107.2 Å²	107.2	43%	0.433	53%	0.532	S	S	.	.	H	α-helix	trans	-66.2	-32.7	176.3	-80.9	-23.5	0	0	0	113.6	T1232 N1233 T1239 K1240	T1232-N1236 WeakPolarHBondContact O-CB 3.38Å; T1232-N1236 PolarHBondContact O-N 3.07Å; N1233-N1236 PolarHBondContact O-N 3.47Å; N1236-T1239 WeakPolarHBondContact CA-OG1 3.34Å; N1236-T1239 PolarHBondContact O-OG1 3.35Å; N1236-K1240 WeakPolarHBondContact O-CB 3.18Å; N1236-K1240 VanDerWaalsContact O-CG 3.31Å; N1236-K1240 WeakPolarHBondContact O-CG 3.34Å; N1236-K1240 PolarHBondContact O-N 2.92Å; N1236-K1240 VanDerWaalsContact O-N 3.16Å
1237	K	69.7	Low	67.7	Low	160 Å²	160	109 Å²	109	70%	0.696	53%	0.531	S	S	*	.	H	α-helix	trans	-67.6	-44.4	169	-81.9	-174.9	174.8	-178.6	0	111.2	N1233 N1234 L1235 K1240 F1241	N1233-K1237 PolarHBondContact O-N 3.45Å; N1234-K1237 PolarHBondContact O-N 2.98Å; L1235-K1237 PolarHBondContact O-N 3.01Å; K1237-K1240 PolarHBondContact O-N 3.28Å; K1237-F1241 WeakPolarHBondContact O-CB 3.5Å; K1237-F1241 PolarHBondContact O-N 3.13Å
1238	L	71.6	Confident	68.2	Low	100 Å²	100	111.8 Å²	111.8	52%	0.524	54%	0.536	S	S	.	.	H	α-helix	trans	-65	-45.5	-179.8	-173.7	63.6	0	0	0	111.7	N1234 L1235 F1241 T1242	N1234-L1238 WeakPolarHBondContact O-CB 3.47Å; N1234-L1238 PolarHBondContact O-N 3Å; L1235-L1238 PolarHBondContact O-N 2.93Å; L1238-F1241 PolarHBondContact O-N 2.95Å; L1238-T1242 HydrophobicContact CD1-CG2 4.28Å; L1238-T1242 HydrophobicContact CG-CG2 4.43Å; L1238-T1242 WeakPolarHBondContact O-CG2 3.45Å; L1238-T1242 PolarHBondContact O-N 3.25Å; L1238-T1242 PolarHBondContact O-OG1 3.23Å
1239	T	70.6	Confident	68.4	Low	72 Å²	72	112.9 Å²	112.9	44%	0.442	54%	0.538	S	S	.	.	H	α-helix	trans	-67	-38.3	177.4	55.4	0	0	0	0	112.4	L1235 N1236 F1241 T1242 Y1243	L1235-T1239 WeakPolarHBondContact O-CG2 3.47Å; L1235-T1239 PolarHBondContact O-N 3.06Å; L1235-T1239 PolarHBondContact O-OG1 2.8Å; L1235-T1239 VanDerWaalsContact O-OG1 3.1Å; N1236-T1239 WeakPolarHBondContact CA-OG1 3.34Å; N1236-T1239 PolarHBondContact O-OG1 3.35Å; T1239-F1241 VanDerWaalsContact C-N 3.32Å; T1239-F1241 PolarHBondContact O-N 3.34Å; T1239-T1242 WeakPolarHBondContact CA-OG1 3.26Å; T1239-T1242 PolarHBondContact O-OG1 3.11Å; T1239-Y1243 WeakPolarHBondContact O-CB 3.33Å; T1239-Y1243 PolarHBondContact O-N 2.99Å
1240	K	70.6	Confident	68.4	Low	161 Å²	161	108.4 Å²	108.4	70%	0.7	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-37.4	170.8	-77.3	-177.5	178.4	-177.4	0	111.9	N1236 K1237 K1244	N1236-K1240 WeakPolarHBondContact O-CB 3.18Å; N1236-K1240 VanDerWaalsContact O-CG 3.31Å; N1236-K1240 WeakPolarHBondContact O-CG 3.34Å; N1236-K1240 PolarHBondContact O-N 2.92Å; N1236-K1240 VanDerWaalsContact O-N 3.16Å; K1237-K1240 PolarHBondContact O-N 3.28Å; K1240-K1244 VanDerWaalsContact O-CB 3.29Å; K1240-K1244 WeakPolarHBondContact O-CB 3.49Å; K1240-K1244 PolarHBondContact O-N 3.06Å; K1240-K1244 VanDerWaalsContact O-N 3.08Å
1241	F	74.4	Confident	68.2	Low	134 Å²	134	103.8 Å²	103.8	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-69.2	-52.4	176	-177.9	-98.7	0	0	0	112.1	K1237 L1238 T1239 Y1243 K1244 V1245	K1237-F1241 WeakPolarHBondContact O-CB 3.5Å; K1237-F1241 PolarHBondContact O-N 3.13Å; L1238-F1241 PolarHBondContact O-N 2.95Å; T1239-F1241 VanDerWaalsContact C-N 3.32Å; T1239-F1241 PolarHBondContact O-N 3.34Å; F1241-Y1243 VanDerWaalsContact C-N 3.32Å; F1241-Y1243 PolarHBondContact O-N 2.96Å; F1241-K1244 PolarHBondContact O-N 3.06Å; F1241-K1244 VanDerWaalsContact O-N 3.08Å; F1241-V1245 HydrophobicContact CD1-CG2 4.18Å; F1241-V1245 HydrophobicContact CE1-CG2 3.77Å; F1241-V1245 HydrophobicContact CE2-CG2 4.23Å; F1241-V1245 HydrophobicContact CZ-CG2 3.8Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.33Å; F1241-V1245 PolarHBondContact O-N 3.28Å
1242	T	71.2	Confident	68.1	Low	73 Å²	73	104.2 Å²	104.2	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-37	179.2	57.4	0	0	0	0	111.6	L1238 T1239 V1245 Y1246	L1238-T1242 HydrophobicContact CD1-CG2 4.28Å; L1238-T1242 HydrophobicContact CG-CG2 4.43Å; L1238-T1242 WeakPolarHBondContact O-CG2 3.45Å; L1238-T1242 PolarHBondContact O-N 3.25Å; L1238-T1242 PolarHBondContact O-OG1 3.23Å; T1239-T1242 WeakPolarHBondContact CA-OG1 3.26Å; T1239-T1242 PolarHBondContact O-OG1 3.11Å; T1242-V1245 PolarHBondContact O-N 3.09Å; T1242-Y1246 WeakPolarHBondContact O-CB 3.06Å; T1242-Y1246 PolarHBondContact O-N 3.21Å
1243	Y	72.9	Confident	67.5	Low	141 Å²	141	102.4 Å²	102.4	55%	0.553	49%	0.489	S	S	*	.	H	α-helix	trans	-62.8	-41.1	171.4	-179.5	-98.1	0	0	0	112.4	T1239 F1241 R1247	T1239-Y1243 WeakPolarHBondContact O-CB 3.33Å; T1239-Y1243 PolarHBondContact O-N 2.99Å; F1241-Y1243 VanDerWaalsContact C-N 3.32Å; F1241-Y1243 PolarHBondContact O-N 2.96Å; Y1243-R1247 WeakPolarHBondContact O-CB 3.41Å; Y1243-R1247 PolarHBondContact O-N 3.42Å
1244	K	71.9	Confident	66.8	Low	162 Å²	162	98.8 Å²	98.8	70%	0.704	47%	0.47	S	S	*	.	H	α-helix	trans	-68.2	-38.6	177.8	-166	174.5	-175	179.5	0	111.9	K1240 F1241 K1248	K1240-K1244 VanDerWaalsContact O-CB 3.29Å; K1240-K1244 WeakPolarHBondContact O-CB 3.49Å; K1240-K1244 PolarHBondContact O-N 3.06Å; K1240-K1244 VanDerWaalsContact O-N 3.08Å; F1241-K1244 PolarHBondContact O-N 3.06Å; F1241-K1244 VanDerWaalsContact O-N 3.08Å; K1244-K1248 WeakPolarHBondContact O-CB 3.05Å; K1244-K1248 PolarHBondContact O-N 3.25Å; K1244-K1248 VanDerWaalsContact O-N 3.16Å
1245	V	71.7	Confident	66	Low	74 Å²	74	102.2 Å²	102.2	45%	0.448	48%	0.48	S	S	.	.	H	α-helix	trans	-67.1	-52.2	173.2	173	0	0	0	0	110.6	F1241 T1242 R1247 K1248 F1249	F1241-V1245 HydrophobicContact CD1-CG2 4.18Å; F1241-V1245 HydrophobicContact CE1-CG2 3.77Å; F1241-V1245 HydrophobicContact CE2-CG2 4.23Å; F1241-V1245 HydrophobicContact CZ-CG2 3.8Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.33Å; F1241-V1245 PolarHBondContact O-N 3.28Å; T1242-V1245 PolarHBondContact O-N 3.09Å; V1245-R1247 PolarHBondContact O-N 3.45Å; V1245-K1248 PolarHBondContact O-N 3.33Å; V1245-K1248 VanDerWaalsContact O-N 3.14Å; V1245-F1249 WeakPolarHBondContact O-CB 3.48Å; V1245-F1249 PolarHBondContact O-N 2.99Å
1246	Y	68.1	Low	65	Low	74 Å²	74	104.7 Å²	104.7	29%	0.29	49%	0.493	S	S	.	.	H	α-helix	trans	-53.1	-51.9	176.3	172.3	-98.9	0	0	0	111.3	V921 W926 T1242 K1248 F1249 T1250	V921-Y1246 HydrophobicContact CG1-CE2 3.92Å; W926-Y1246 AromaticContact CH2-CZ 3.94Å; W926-Y1246 VanDerWaalsContact CH2-OH 3.28Å; W926-Y1246 WeakPolarHBondContact CH2-OH 3.41Å; T1242-Y1246 WeakPolarHBondContact O-CB 3.06Å; T1242-Y1246 PolarHBondContact O-N 3.21Å; Y1246-K1248 VanDerWaalsContact C-N 3.3Å; Y1246-K1248 PolarHBondContact O-N 3.24Å; Y1246-F1249 PolarHBondContact O-N 3.22Å; Y1246-T1250 HydrophobicContact CD1-CG2 4.43Å; Y1246-T1250 HydrophobicContact CD2-CG2 3.93Å; Y1246-T1250 HydrophobicContact CE1-CG2 4.05Å; Y1246-T1250 HydrophobicContact CE2-CG2 3.5Å; Y1246-T1250 VanDerWaalsContact CE2-CG2 3.5Å; Y1246-T1250 HydrophobicContact CG-CG2 4.37Å; Y1246-T1250 WeakPolarHBondContact O-CG2 3.06Å; Y1246-T1250 PolarHBondContact O-N 3.35Å; Y1246-T1250 PolarHBondContact O-OG1 3.49Å
1247	R	68	Low	64.1	Low	149 Å²	149	107.3 Å²	107.3	56%	0.562	50%	0.501	S	S	*	.	H	α-helix	trans	-61.6	-34.9	179.5	-172.7	178.7	-177.6	-167	2.8	112.8	Y1243 V1245 T1250 S1251	Y1243-R1247 WeakPolarHBondContact O-CB 3.41Å; Y1243-R1247 PolarHBondContact O-N 3.42Å; V1245-R1247 PolarHBondContact O-N 3.45Å; R1247-T1250 PolarHBondContact O-OG1 3.18Å; R1247-S1251 WeakPolarHBondContact O-CB 3.29Å; R1247-S1251 PolarHBondContact O-N 3.04Å
1248	K	64.8	Low	63.4	Low	145 Å²	145	102.5 Å²	102.5	63%	0.63	48%	0.481	S	S	*	.	H	α-helix	trans	-73.1	-44	175.5	-167	-179.8	-178.9	-173.3	0	111.1	K1244 V1245 Y1246 S1251 Q1252	K1244-K1248 WeakPolarHBondContact O-CB 3.05Å; K1244-K1248 PolarHBondContact O-N 3.25Å; K1244-K1248 VanDerWaalsContact O-N 3.16Å; V1245-K1248 PolarHBondContact O-N 3.33Å; V1245-K1248 VanDerWaalsContact O-N 3.14Å; Y1246-K1248 VanDerWaalsContact C-N 3.3Å; Y1246-K1248 PolarHBondContact O-N 3.24Å; K1248-S1251 PolarHBondContact O-N 3.23Å; K1248-Q1252 PolarHBondContact O-N 2.76Å; K1248-Q1252 VanDerWaalsContact O-N 3.1Å
1249	F	63.8	Low	62.6	Low	118 Å²	118	100.1 Å²	100.1	52%	0.518	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-54.8	177.9	-175.1	-103.1	0	0	0	111.3	V1245 Y1246 S1251 Q1252 V1253	V1245-F1249 WeakPolarHBondContact O-CB 3.48Å; V1245-F1249 PolarHBondContact O-N 2.99Å; Y1246-F1249 PolarHBondContact O-N 3.22Å; F1249-S1251 VanDerWaalsContact C-N 3.26Å; F1249-S1251 PolarHBondContact O-N 2.64Å; F1249-Q1252 PolarHBondContact O-N 3.41Å; F1249-V1253 HydrophobicContact CD1-CG2 4.1Å; F1249-V1253 HydrophobicContact CD2-CG2 4.16Å; F1249-V1253 HydrophobicContact CE1-CG2 3.84Å; F1249-V1253 HydrophobicContact CE2-CG2 3.91Å; F1249-V1253 HydrophobicContact CG-CG2 4.26Å; F1249-V1253 HydrophobicContact CZ-CG2 3.74Å; F1249-V1253 WeakPolarHBondContact O-CB 3.47Å; F1249-V1253 WeakPolarHBondContact O-CG2 3.49Å; F1249-V1253 PolarHBondContact O-N 2.87Å
1250	T	58	Low	61.8	Low	13 Å²	13	98.4 Å²	98.4	8%	0.08	46%	0.456	C	S	.	.	H	α-helix	trans	-58.8	-38.2	175.8	60.6	0	0	0	0	111.6	Y1246 R1247 Q1252 V1253 D1254	Y1246-T1250 HydrophobicContact CD1-CG2 4.43Å; Y1246-T1250 HydrophobicContact CD2-CG2 3.93Å; Y1246-T1250 HydrophobicContact CE1-CG2 4.05Å; Y1246-T1250 HydrophobicContact CE2-CG2 3.5Å; Y1246-T1250 VanDerWaalsContact CE2-CG2 3.5Å; Y1246-T1250 HydrophobicContact CG-CG2 4.37Å; Y1246-T1250 WeakPolarHBondContact O-CG2 3.06Å; Y1246-T1250 PolarHBondContact O-N 3.35Å; Y1246-T1250 PolarHBondContact O-OG1 3.49Å; R1247-T1250 PolarHBondContact O-OG1 3.18Å; T1250-Q1252 VanDerWaalsContact C-N 3.26Å; T1250-Q1252 PolarHBondContact O-N 3.47Å; T1250-V1253 PolarHBondContact O-N 3.02Å; T1250-D1254 WeakPolarHBondContact O-CB 3.29Å; T1250-D1254 VanDerWaalsContact O-CG 3.28Å; T1250-D1254 PolarHBondContact O-N 3.29Å
1251	S	58.9	Low	61	Low	55 Å²	55	99.3 Å²	99.3	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-69.7	-16.7	177.4	-172.6	0	0	0	0	114.7	R1247 K1248 F1249	R1247-S1251 WeakPolarHBondContact O-CB 3.29Å; R1247-S1251 PolarHBondContact O-N 3.04Å; K1248-S1251 PolarHBondContact O-N 3.23Å; F1249-S1251 VanDerWaalsContact C-N 3.26Å; F1249-S1251 PolarHBondContact O-N 2.64Å
1252	Q	59.7	Low	60.4	Low	120 Å²	120	98 Å²	98	56%	0.561	46%	0.459	S	S	*	.	H	α-helix	trans	-96.7	-35.2	171.9	-71.1	-172.9	-67.8	0	0	111.7	K1248 F1249 T1250 K1255 L1256	K1248-Q1252 PolarHBondContact O-N 2.76Å; K1248-Q1252 VanDerWaalsContact O-N 3.1Å; F1249-Q1252 PolarHBondContact O-N 3.41Å; T1250-Q1252 VanDerWaalsContact C-N 3.26Å; T1250-Q1252 PolarHBondContact O-N 3.47Å; Q1252-K1255 WeakPolarHBondContact O-CB 3.38Å; Q1252-K1255 PolarHBondContact O-N 3.41Å; Q1252-L1256 PolarHBondContact O-N 2.97Å; Q1252-L1256 VanDerWaalsContact O-N 3.1Å
1253	V	55.7	Low	60	Low	21 Å²	21	95.2 Å²	95.2	13%	0.127	44%	0.441	C	S	.	.	H	α-helix	trans	-74	-35.2	176.8	179	0	0	0	0	111.8	I922 F1249 T1250 K1255 L1256 F1257	I922-V1253 HydrophobicContact CD1-CG1 3.39Å; I922-V1253 HydrophobicContact CG1-CG1 3.78Å; I922-V1253 HydrophobicContact CG2-CG1 4.4Å; F1249-V1253 HydrophobicContact CD1-CG2 4.1Å; F1249-V1253 HydrophobicContact CD2-CG2 4.16Å; F1249-V1253 HydrophobicContact CE1-CG2 3.84Å; F1249-V1253 HydrophobicContact CE2-CG2 3.91Å; F1249-V1253 HydrophobicContact CG-CG2 4.26Å; F1249-V1253 HydrophobicContact CZ-CG2 3.74Å; F1249-V1253 WeakPolarHBondContact O-CB 3.47Å; F1249-V1253 WeakPolarHBondContact O-CG2 3.49Å; F1249-V1253 PolarHBondContact O-N 2.87Å; T1250-V1253 PolarHBondContact O-N 3.02Å; V1253-K1255 PolarHBondContact O-N 3.48Å; V1253-L1256 PolarHBondContact O-N 3.25Å; V1253-F1257 HydrophobicContact CG1-CD2 4.05Å; V1253-F1257 PolarHBondContact O-N 3.08Å
1254	D	52.9	Low	59.6	Low	31 Å²	31	89.2 Å²	89.2	17%	0.166	42%	0.419	C	S	.	.	H	α-helix	trans	-55.5	-30.9	167.1	-85.1	-30.1	0	0	0	111.1	R924 T1250 Q1258	R924-D1254 IonicContact NH2-OD2 3.16Å; R924-D1254 PolarHBondContact NH2-OD2 2.86Å; R924-D1254 VanDerWaalsContact NH2-OD2 3.16Å; T1250-D1254 WeakPolarHBondContact O-CB 3.29Å; T1250-D1254 VanDerWaalsContact O-CG 3.28Å; T1250-D1254 PolarHBondContact O-N 3.29Å; D1254-Q1258 WeakPolarHBondContact O-CB 3.39Å; D1254-Q1258 VanDerWaalsContact O-CD 3.26Å; D1254-Q1258 WeakPolarHBondContact O-CG 3.18Å; D1254-Q1258 PolarHBondContact O-NE2 3.49Å
1255	K	51.7	Low	59.4	Low	170 Å²	170	84.6 Å²	84.6	74%	0.739	41%	0.406	S	S	*	.	H	α-helix	trans	-81.4	-28.2	174.1	-80.5	-168.5	170.4	-166.3	0	113.9	Q1252 V1253	Q1252-K1255 WeakPolarHBondContact O-CB 3.38Å; Q1252-K1255 PolarHBondContact O-N 3.41Å; V1253-K1255 PolarHBondContact O-N 3.48Å
1256	L	48.8	Very low	59.2	Low	145 Å²	145	84.8 Å²	84.8	76%	0.759	40%	0.404	S	S	*	.	H	α-helix	trans	-87.3	-39	-176.2	-123	80.4	0	0	0	113.1	Q1252 V1253	Q1252-L1256 PolarHBondContact O-N 2.97Å; Q1252-L1256 VanDerWaalsContact O-N 3.1Å; V1253-L1256 PolarHBondContact O-N 3.25Å
1257	F	50.5	Low	59.3	Low	135 Å²	135	81.7 Å²	81.7	59%	0.592	39%	0.393	S	S	*	.	H	α-helix	trans	-97.2	-10.6	-173.8	-100.2	-89.1	0	0	0	114.4	L919 V1253 L1259	L919-F1257 HydrophobicContact CD1-CD1 3.87Å; L919-F1257 HydrophobicContact CD1-CE1 4.19Å; V1253-F1257 HydrophobicContact CG1-CD2 4.05Å; V1253-F1257 PolarHBondContact O-N 3.08Å; F1257-L1259 PolarHBondContact O-N 3.44Å
1258	Q	55	Low	59.3	Low	59 Å²	59	77.7 Å²	77.7	28%	0.276	39%	0.385	S	S	.	.	S	Bend	trans	-69.9	114.1	167.3	-77.4	-178.9	32	0	0	109.4	D1254 N1260 F1261	D1254-Q1258 WeakPolarHBondContact O-CB 3.39Å; D1254-Q1258 VanDerWaalsContact O-CD 3.26Å; D1254-Q1258 WeakPolarHBondContact O-CG 3.18Å; D1254-Q1258 PolarHBondContact O-NE2 3.49Å; Q1258-N1260 PolarHBondContact O-N 3.46Å; Q1258-N1260 PolarHBondContact OE1-ND2 3.14Å; Q1258-N1260 VanDerWaalsContact OE1-ND2 3.16Å; Q1258-F1261 PolarHBondContact O-N 2.94Å
1259	L	55.8	Low	59.7	Low	51 Å²	51	80.5 Å²	80.5	27%	0.267	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-0.5	-173.8	-150.8	66.8	0	0	0	114.7	I1097 W1143 F1257 F1261 L1262 L1263	I1097-L1259 HydrophobicContact CD1-CD2 3.78Å; I1097-L1259 HydrophobicContact CG2-CD2 3.87Å; W1143-L1259 HydrophobicContact CH2-CD2 3.5Å; W1143-L1259 HydrophobicContact CZ2-CD2 4.15Å; W1143-L1259 HydrophobicContact CZ3-CD2 4.19Å; F1257-L1259 PolarHBondContact O-N 3.44Å; L1259-F1261 PolarHBondContact O-N 3.45Å; L1259-L1262 HydrophobicContact CD1-CB 4.28Å; L1259-L1262 HydrophobicContact CD1-CD1 4.39Å; L1259-L1262 HydrophobicContact CG-CB 4.41Å; L1259-L1262 PolarHBondContact O-N 3.43Å; L1259-L1263 HydrophobicContact CD2-CD1 3.83Å; L1259-L1263 HydrophobicContact CD2-CG 4.36Å; L1259-L1263 HydrophobicContact CG-CD1 4.27Å; L1259-L1263 PolarHBondContact O-N 3.09Å
1260	N	53.6	Low	60.2	Low	36 Å²	36	82.6 Å²	82.6	19%	0.193	40%	0.396	C	S	.	.	H	α-helix	trans	-44.4	-42.4	165.3	-50.2	-8.2	0	0	0	111.5	R1146 Q1258 L1262 D1264 P1265	R1146-N1260 PolarHBondContact NE-OD1 3.31Å; R1146-N1260 PolarHBondContact NH2-OD1 2.94Å; Q1258-N1260 PolarHBondContact O-N 3.46Å; Q1258-N1260 PolarHBondContact OE1-ND2 3.14Å; Q1258-N1260 VanDerWaalsContact OE1-ND2 3.16Å; N1260-L1262 PolarHBondContact O-N 3.02Å; N1260-L1262 VanDerWaalsContact O-N 3.07Å; N1260-D1264 WeakPolarHBondContact CB-OD2 3.3Å; N1260-D1264 WeakPolarHBondContact O-CB 3.46Å; N1260-D1264 PolarHBondContact O-N 3.24Å; N1260-P1265 WeakPolarHBondContact O-CD 3.38Å
1261	F	54.3	Low	60.9	Low	179 Å²	179	86.5 Å²	86.5	79%	0.785	42%	0.422	S	S	*	.	H	α-helix	trans	-66.8	-10.9	-178.7	-150.8	-87.9	0	0	0	114.3	Q1258 L1259	Q1258-F1261 PolarHBondContact O-N 2.94Å; L1259-F1261 PolarHBondContact O-N 3.45Å
1262	L	60.7	Low	61.7	Low	107 Å²	107	92.8 Å²	92.8	56%	0.56	44%	0.442	S	S	*	.	H	α-helix	trans	-117.1	-49.5	-177.4	-146.9	166.4	0	0	0	111.1	L1259 N1260 L1266	L1259-L1262 HydrophobicContact CD1-CB 4.28Å; L1259-L1262 HydrophobicContact CD1-CD1 4.39Å; L1259-L1262 HydrophobicContact CG-CB 4.41Å; L1259-L1262 PolarHBondContact O-N 3.43Å; N1260-L1262 PolarHBondContact O-N 3.02Å; N1260-L1262 VanDerWaalsContact O-N 3.07Å; L1262-L1266 HydrophobicContact CD2-CD1 3.83Å; L1262-L1266 WeakPolarHBondContact O-CB 3.47Å; L1262-L1266 WeakPolarHBondContact O-CD1 3.18Å; L1262-L1266 WeakPolarHBondContact O-CG 3.45Å; L1262-L1266 PolarHBondContact O-N 3.15Å
1263	L	62.8	Low	62.2	Low	14 Å²	14	89.7 Å²	89.7	7%	0.073	43%	0.429	C	S	.	.	H	α-helix	trans	-72.2	-40.7	178.2	-86.4	167.4	0	0	0	113.4	Q1093 I1097 L1259 L1266 C1267 I1276	Q1093-L1263 HydrophobicContact CB-CD1 4.37Å; I1097-L1263 HydrophobicContact CD1-CD1 4.02Å; I1097-L1263 HydrophobicContact CD1-CD2 4.38Å; I1097-L1263 HydrophobicContact CD1-CG 4.4Å; L1259-L1263 HydrophobicContact CD2-CD1 3.83Å; L1259-L1263 HydrophobicContact CD2-CG 4.36Å; L1259-L1263 HydrophobicContact CG-CD1 4.27Å; L1259-L1263 PolarHBondContact O-N 3.09Å; L1263-L1266 PolarHBondContact O-N 3.31Å; L1263-C1267 WeakPolarHBondContact O-CB 3.34Å; L1263-C1267 PolarHBondContact O-N 3.13Å; L1263-C1267 PolarHBondContact O-SG 3.49Å; L1263-I1276 HydrophobicContact CD2-CG2 3.91Å
1264	D	65.8	Low	62.9	Low	16 Å²	16	93.9 Å²	93.9	9%	0.086	45%	0.446	C	S	.	.	H	α-helix	trans	-71.6	-43.6	-172	-59.1	2.1	0	0	0	110.6	R1146 N1260 L1266 C1267 T1268 Y1281 P1283	R1146-D1264 IonicContact CZ-OD1 3.57Å; R1146-D1264 IonicContact NH1-OD1 2.73Å; R1146-D1264 IonicContact NH2-OD1 3.74Å; R1146-D1264 PolarHBondContact NH2-OD1 3.1Å; R1146-D1264 IonicContact NH2-OD2 3.65Å; N1260-D1264 WeakPolarHBondContact CB-OD2 3.3Å; N1260-D1264 WeakPolarHBondContact O-CB 3.46Å; N1260-D1264 PolarHBondContact O-N 3.24Å; D1264-L1266 VanDerWaalsContact C-N 3.35Å; D1264-L1266 PolarHBondContact O-N 2.97Å; D1264-C1267 PolarHBondContact O-N 2.86Å; D1264-T1268 PolarHBondContact O-N 3.27Å; D1264-T1268 PolarHBondContact O-OG1 2.81Å; D1264-Y1281 PolarHBondContact OD2-OH 3.23Å; D1264-P1283 HydrophobicContact CB-CB 3.66Å
1265	P	66.5	Low	63.8	Low	65 Å²	65	99.9 Å²	99.9	42%	0.422	47%	0.466	S	S	.	.	H	α-helix	trans	-60.3	-35.6	168.7	-27.8	37.5	0	0	0	114.8	N1260 T1268 R1269	N1260-P1265 WeakPolarHBondContact O-CD 3.38Å; P1265-T1268 WeakPolarHBondContact CA-OG1 3.24Å; P1265-T1268 PolarHBondContact O-OG1 2.9Å; P1265-T1268 VanDerWaalsContact O-OG1 3.05Å; P1265-R1269 VanDerWaalsContact O-CB 3.27Å; P1265-R1269 WeakPolarHBondContact O-CB 3.28Å; P1265-R1269 PolarHBondContact O-N 3.45Å
1266	L	67.8	Low	64.6	Low	78 Å²	78	93 Å²	93	41%	0.408	44%	0.437	S	S	.	.	H	α-helix	trans	-64.8	-44.2	174.3	-88.2	170	0	0	0	111.2	L1262 L1263 D1264 R1269 W1270	L1262-L1266 HydrophobicContact CD2-CD1 3.83Å; L1262-L1266 WeakPolarHBondContact O-CB 3.47Å; L1262-L1266 WeakPolarHBondContact O-CD1 3.18Å; L1262-L1266 WeakPolarHBondContact O-CG 3.45Å; L1262-L1266 PolarHBondContact O-N 3.15Å; L1263-L1266 PolarHBondContact O-N 3.31Å; D1264-L1266 VanDerWaalsContact C-N 3.35Å; D1264-L1266 PolarHBondContact O-N 2.97Å; L1266-R1269 PolarHBondContact O-N 3.04Å; L1266-W1270 PolarHBondContact O-N 3.39Å
1267	C	69.4	Low	65.4	Low	9 Å²	9	86.9 Å²	86.9	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-69.8	-34.1	179.4	-64.3	0	0	0	0	112.7	L1263 D1264 W1270 P1271 L1277	L1263-C1267 WeakPolarHBondContact O-CB 3.34Å; L1263-C1267 PolarHBondContact O-N 3.13Å; L1263-C1267 PolarHBondContact O-SG 3.49Å; D1264-C1267 PolarHBondContact O-N 2.86Å; C1267-W1270 CarbonylContact O-C 3.39Å; C1267-P1271 WeakPolarHBondContact O-CA 3.24Å; C1267-L1277 HydrophobicContact CB-CD1 3.98Å; C1267-L1277 HydrophobicContact CB-CG 4.4Å
1268	T	68.1	Low	65.9	Low	65 Å²	65	80.6 Å²	80.6	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-71.2	-32.6	172.2	53.2	0	0	0	0	112.4	D1264 P1265 P1283 V1286	D1264-T1268 PolarHBondContact O-N 3.27Å; D1264-T1268 PolarHBondContact O-OG1 2.81Å; P1265-T1268 WeakPolarHBondContact CA-OG1 3.24Å; P1265-T1268 PolarHBondContact O-OG1 2.9Å; P1265-T1268 VanDerWaalsContact O-OG1 3.05Å; T1268-P1283 HydrophobicContact CG2-CG 4.11Å; T1268-V1286 HydrophobicContact CG2-CG2 4.19Å
1269	R	74.4	Confident	66.1	Low	204 Å²	204	87.7 Å²	87.7	77%	0.77	40%	0.403	S	S	*	.	H	α-helix	trans	-80.3	-26.6	177.9	-167.9	174.3	-175.2	172	3	113.3	P1265 L1266	P1265-R1269 VanDerWaalsContact O-CB 3.27Å; P1265-R1269 WeakPolarHBondContact O-CB 3.28Å; P1265-R1269 PolarHBondContact O-N 3.45Å; L1266-R1269 PolarHBondContact O-N 3.04Å
1270	W	74	Confident	66.2	Low	162 Å²	162	88.7 Å²	88.7	61%	0.614	43%	0.426	S	S	*	.			trans	-134.2	81.4	179.8	-71.8	74.3	0	0	0	110.1	L1266 C1267 K1272 L1273	L1266-W1270 PolarHBondContact O-N 3.39Å; C1267-W1270 CarbonylContact O-C 3.39Å; W1270-K1272 PolarHBondContact O-N 3.06Å; W1270-L1273 HydrophobicContact CB-CD1 3.88Å; W1270-L1273 HydrophobicContact CB-CG 4.13Å; W1270-L1273 WeakPolarHBondContact O-CB 3.47Å; W1270-L1273 PolarHBondContact O-N 3.01Å
1271	P	72.5	Confident	66.5	Low	95 Å²	95	88.6 Å²	88.6	62%	0.617	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-61	-18.6	-174.5	21.2	-32.9	0	0	0	114.5	C1267 L1273 K1274	C1267-P1271 WeakPolarHBondContact O-CA 3.24Å; P1271-L1273 PolarHBondContact O-N 3.2Å; P1271-L1273 VanDerWaalsContact O-N 3.13Å; P1271-K1274 VanDerWaalsContact O-CB 3.31Å; P1271-K1274 WeakPolarHBondContact O-CB 3.28Å; P1271-K1274 PolarHBondContact O-N 3.27Å; P1271-K1274 VanDerWaalsContact O-N 3.13Å
1272	K	75.1	Confident	66.7	Low	187 Å²	187	84.2 Å²	84.2	81%	0.813	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-61	-14.5	169.4	-68.4	-172.9	177.4	-178.1	0	113.9	W1270 W1275	W1270-K1272 PolarHBondContact O-N 3.06Å; K1272-W1275 PolarHBondContact O-NE1 2.79Å
1273	L	71.9	Confident	66.6	Low	55 Å²	55	79.4 Å²	79.4	29%	0.288	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-91.6	1.8	176.4	-61.5	177.3	0	0	0	113.9	W1270 P1271 W1275 I1276	W1270-L1273 HydrophobicContact CB-CD1 3.88Å; W1270-L1273 HydrophobicContact CB-CG 4.13Å; W1270-L1273 WeakPolarHBondContact O-CB 3.47Å; W1270-L1273 PolarHBondContact O-N 3.01Å; P1271-L1273 PolarHBondContact O-N 3.2Å; P1271-L1273 VanDerWaalsContact O-N 3.13Å; L1273-W1275 PolarHBondContact O-N 2.9Å; L1273-I1276 HydrophobicContact CB-CD1 4.26Å; L1273-I1276 HydrophobicContact CD2-CD1 4Å; L1273-I1276 WeakPolarHBondContact O-CB 3.41Å; L1273-I1276 WeakPolarHBondContact O-CG1 3.29Å; L1273-I1276 PolarHBondContact O-N 2.69Å
1274	K	68.5	Low	66.2	Low	109 Å²	109	86.2 Å²	86.2	47%	0.474	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-57.6	-21.2	-175.5	-160.2	169.3	-174	174	0	113.8	P1271 I1276 L1277	P1271-K1274 VanDerWaalsContact O-CB 3.31Å; P1271-K1274 WeakPolarHBondContact O-CB 3.28Å; P1271-K1274 PolarHBondContact O-N 3.27Å; P1271-K1274 VanDerWaalsContact O-N 3.13Å; K1274-I1276 PolarHBondContact O-N 2.87Å; K1274-L1277 PolarHBondContact O-N 2.64Å
1275	W	73.3	Confident	65.3	Low	157 Å²	157	91.2 Å²	91.2	60%	0.595	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-67.2	-14.9	173.2	66.9	-92.3	0	0	0	115.1	I1092 K1272 L1273	I1092-W1275 HydrophobicContact CD1-CZ3 4.02Å; I1092-W1275 HydrophobicContact CG1-CZ3 4.28Å; I1092-W1275 HydrophobicContact CG2-CE3 3.86Å; I1092-W1275 HydrophobicContact CG2-CZ3 3.7Å; K1272-W1275 PolarHBondContact O-NE1 2.79Å; L1273-W1275 PolarHBondContact O-N 2.9Å
1276	I	68.7	Low	64.2	Low	26 Å²	26	89.9 Å²	89.9	13%	0.133	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-79	-26.3	177.1	-61.3	-180	0	0	0	111	Q1093 L1263 L1273 K1274	Q1093-I1276 HydrophobicContact CB-CG2 3.77Å; Q1093-I1276 WeakPolarHBondContact CB-O 3.36Å; L1263-I1276 HydrophobicContact CD2-CG2 3.91Å; L1273-I1276 HydrophobicContact CB-CD1 4.26Å; L1273-I1276 HydrophobicContact CD2-CD1 4Å; L1273-I1276 WeakPolarHBondContact O-CB 3.41Å; L1273-I1276 WeakPolarHBondContact O-CG1 3.29Å; L1273-I1276 PolarHBondContact O-N 2.69Å; K1274-I1276 PolarHBondContact O-N 2.87Å
1277	L	65.3	Low	62.9	Low	15 Å²	15	91.2 Å²	91.2	8%	0.079	43%	0.434	C	S	.	.	S	Bend	trans	-70.1	150.3	177	-64.6	178.1	0	0	0	111	C1267 K1274 Y1281 P1283	C1267-L1277 HydrophobicContact CB-CD1 3.98Å; C1267-L1277 HydrophobicContact CB-CG 4.4Å; K1274-L1277 PolarHBondContact O-N 2.64Å; L1277-Y1281 HydrophobicContact CB-CD1 4.4Å; L1277-Y1281 HydrophobicContact CD1-CD1 4.32Å; L1277-Y1281 HydrophobicContact CD2-CD1 4.09Å; L1277-Y1281 HydrophobicContact CD2-CE1 4.21Å; L1277-P1283 HydrophobicContact CD1-CG 4.26Å
1278	P	61.4	Low	61.5	Low	4 Å²	4	95.5 Å²	95.5	3%	0.026	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-69.7	146.1	179.7	26.5	-23.4	0	0	0	110.4	P1091 R1146 G1280 Y1281	P1091-P1278 HydrophobicContact CB-CB 4.29Å; P1091-P1278 HydrophobicContact CG-CB 4.47Å; R1146-P1278 HydrophobicContact CB-CG 4.25Å; R1146-P1278 HydrophobicContact CG-CG 4.28Å; P1278-G1280 PolarHBondContact O-N 3.18Å; P1278-Y1281 HydrophobicContact CG-CG 4.13Å; P1278-Y1281 WeakPolarHBondContact O-CB 3.15Å; P1278-Y1281 PolarHBondContact O-N 3.47Å
1279	Y	58.4	Low	60.2	Low	207 Å²	207	95.4 Å²	95.4	81%	0.812	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	128.9	-176.1	-141.1	-93.1	0	0	0	110.9
1280	G	56.9	Low	58.5	Low	72 Å²	72	91.8 Å²	91.8	74%	0.742	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-5	-175.5	0	0	0	0	0	116.7	P1278	P1278-G1280 PolarHBondContact O-N 3.18Å
1281	Y	60.9	Low	56.9	Low	34 Å²	34	89.3 Å²	89.3	13%	0.133	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-91.2	118.4	177.9	-178.5	-93.5	0	0	0	112.5	F1145 R1146 I1149 D1264 L1277 P1278	F1145-Y1281 HydrophobicContact CE1-CE2 4.08Å; R1146-Y1281 PolarHBondContact NH2-OH 2.76Å; I1149-Y1281 HydrophobicContact CD1-CD2 4.1Å; D1264-Y1281 PolarHBondContact OD2-OH 3.23Å; L1277-Y1281 HydrophobicContact CB-CD1 4.4Å; L1277-Y1281 HydrophobicContact CD1-CD1 4.32Å; L1277-Y1281 HydrophobicContact CD2-CD1 4.09Å; L1277-Y1281 HydrophobicContact CD2-CE1 4.21Å; P1278-Y1281 HydrophobicContact CG-CG 4.13Å; P1278-Y1281 WeakPolarHBondContact O-CB 3.15Å; P1278-Y1281 PolarHBondContact O-N 3.47Å
1282	Q	58.3	Low	55.1	Low	88 Å²	88	93.8 Å²	93.8	41%	0.411	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-102.7	136	167.2	-62.3	-136.3	46.5	0	0	110.8	L1182	L1182-Q1282 HydrophobicContact CD1-CG 4.39Å
1283	P	58	Low	53.1	Low	5 Å²	5	90.7 Å²	90.7	3%	0.032	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-74.9	139.6	176	29.9	-31	0	0	0	111	D1264 T1268 L1277 N1285 V1286	D1264-P1283 HydrophobicContact CB-CB 3.66Å; T1268-P1283 HydrophobicContact CG2-CG 4.11Å; L1277-P1283 HydrophobicContact CD1-CG 4.26Å; P1283-N1285 PolarHBondContact O-N 2.8Å; P1283-V1286 HydrophobicContact CG-CG2 3.96Å; P1283-V1286 PolarHBondContact O-N 2.88Å
1284	K	54.2	Low	51.2	Low	157 Å²	157	99.7 Å²	99.7	68%	0.683	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.3	-168	-79.4	-157.6	169.5	-153.7	0	116.7
1285	N	47.1	Very low	50.4	Low	121 Å²	121	99.3 Å²	99.3	65%	0.647	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	6.8	-173.1	-66.1	21.2	0	0	0	114.2	P1283	P1283-N1285 PolarHBondContact O-N 2.8Å
1286	V	45.1	Very low	49.2	Very low	37 Å²	37	96.2 Å²	96.2	22%	0.224	53%	0.526	C	S	.	.	S	Bend	trans	-81.9	-33.2	177.7	178.1	0	0	0	0	112	T1268 P1283 S1288 A1289	T1268-V1286 HydrophobicContact CG2-CG2 4.19Å; P1283-V1286 HydrophobicContact CG-CG2 3.96Å; P1283-V1286 PolarHBondContact O-N 2.88Å; V1286-S1288 PolarHBondContact O-N 3.2Å; V1286-A1289 PolarHBondContact O-N 2.78Å
1287	L	40	Very low	48.1	Very low	107 Å²	107	100.1 Å²	100.1	56%	0.56	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	7.1	-178.3	-90.8	103	0	0	0	115.7	T1179	T1179-L1287 HydrophobicContact CG2-CD2 4Å
1288	S	40	Very low	47.1	Very low	98 Å²	98	105.1 Å²	105.1	69%	0.685	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	15.9	-179.3	68.5	0	0	0	0	114	V1286	V1286-S1288 PolarHBondContact O-N 3.2Å
1289	A	40.1	Very low	46.2	Very low	63 Å²	63	111.4 Å²	111.4	52%	0.521	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.3	-48	176.6	0	0	0	0	0	111.4	V1286 T1291	V1286-A1289 PolarHBondContact O-N 2.78Å; A1289-T1291 PolarHBondContact O-N 3.18Å; A1289-T1291 VanDerWaalsContact O-N 3.1Å
1290	D	39.4	Very low	45.3	Very low	129 Å²	129	105.1 Å²	105.1	69%	0.69	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	23.2	-171.8	-54.3	-26.3	0	0	0	113.5
1291	T	39.1	Very low	44.5	Very low	110 Å²	110	107.4 Å²	107.4	68%	0.675	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	33.9	179.8	67.3	0	0	0	0	112.7	A1289	A1289-T1291 PolarHBondContact O-N 3.18Å; A1289-T1291 VanDerWaalsContact O-N 3.1Å
1292	Q	36.7	Very low	43.3	Very low	188 Å²	188	113.1 Å²	113.1	88%	0.879	62%	0.62	S	S	*	*	S	Bend	trans	-132.6	11.5	172.2	-100.7	-173.4	-14.9	0	0	113.6
1293	T	31.9	Very low	42	Very low	122 Å²	122	115.2 Å²	115.2	75%	0.748	64%	0.638	S	S	*	*			trans	-143.9	70.4	177.2	56.8	0	0	0	0	111.4
1294	D	32.6	Very low	40.6	Very low	245 Å²	245	125.2 Å²	125.2	100%	1.31	69%	0.693	S	S	*	*			trans	-159.2	0	154.8	-96.1	-24.4	0	0	0	107.5

Retrieved 1,294 of 1,294 residues in 287.5 ms (Link to these results)

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