A0A3Q0KU10_SCHMA Loading...

mitogen-activated protein kinase kinase kinase

AlphaFold DB (A0A5K4EWT7), UniProt , Accession A0A3Q0KU10, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,660 aa.

						>A0A3Q0KU10_SCHMA|A0A3Q0KU10
MYITMVEDKPISYQESATENHNTLASSKMDPIFSGKHCEASSEYVTAIYSYMPQHSDEINLRTGQKVKILSKDCRHSGAEGWWVGQEPKTGYVGVFPSGYVLNPDDIASSESPGANEMKANSFEQNKWNDVTFGIGNNTDKIVATKTKEEISLDKKSPDSEVILRHGHVRTIPATELVQQQFIGSGAFGKVYRGLWREQDIALKVFDLATNQVDNEALHLCRLSHRNIVRFYGICRLDNSNSPALVMEYAYGGSLNMVLNQRPLLGPLVLLDWALQIASGMAYLHTDARICHRDLKSSNRNIFSYSPLKSKNRLQSFLTREGRFYFSVNQSFKAVDRCICFSIIFHLKKFQVKCLKSVLIREAVQKPFSLNELQRCTLLITDFGMACRSSQLAPQQSKLGTVAYAAPEVCRQEGFSFKSDIWSYGVVLWELLTLDIPFRAMEQPRLLFIIAMYNYTLYVPPGVPDLFVQLLKDCWSPTPDSRPKFENIMARLKSCKDCSFVDLEPSELAQIQQNWRELIAVHYKEEQQTVAEALSSSFRSGSLDFSTELLTQLEMLRDYRESLDRVRADLVEKAHQLHIKEELYNRVADTMGQHFMFLAVLAANHFKDPTHKIQTAQPKPPPPRKRPFVRSIFKRWGTNGNPCSTHNDYVNSAYSSTNNFQVKDRKRSINSSQCTSNNRPHLNVNTNNSSDLNNSFCDETQSISRDTSSRVGCSQGGIPLISPPTDMKHVVHVDSDWFTGQGLCESTMRLFPSAKFTSSSVGSNNDKYRNMSSGHCYSPQIRTFVNTKSDSNMTDKSNPKSPRIYSSGNNITDLRSREQRFVDVQTSSQRNLNRLPRKQNFIRKFENKNNLDFLQKSSNHSVGFSNFFTPINSCCYETNNDLHHSEHSGYHHCRVIQPIIGTDNRIRNNSSPPFFERRRSASGPVTFFTRYSKTSDQLKNNTDESLFDGRLNELLCMICDPSMPLPTSGCTQHFSGRSLSTTTPPTACFSSDITESSYFLKPTGNSTVENVLLSAFRLLASFCFWGVEPDIDDGKANSLIPLYSTPRSFHNFGKISYPVAYCTLQSSQSYSKQKNAVRNATNSSLLFGQNESDFQHVLSGNSVCPIGKRKYKFSIQNTRRIQSADRRRNYKYNTSLKCPVCVNMGLDSVHPYEKFPDHQVEFGDPHSPFLGMLAGSGRRPNPSPNMKEINHSNFPIIPPHEMISSDKIENYFTHQHNEFLKDIKQKIGEQQQCKHTKLSDNNNNNSHQYTQCSLCNDNQMEIVVKNESTGKLNNAFHCPHLSVYIDYCQNGTRNKDIDVATIKTTLPYIPSSSHLAQRWSFEHSKELHKDICSSFCSFLSCRKLSIDCQSSMISDCLRSVDKHSVSESVGPSIERNSTSQFSHSLVSMNPVGMSRDAYLKATQDGFLNRTIYEPSEDHKFCYSSYSNQTSQSDSFQRSNDNQSSLNSDVYPNIHALFIENDSKSESGSEFESYDDANESDYPNFILHSSSSPKHSQRPQNFYSPSKIHLSDSDKPPENNDYSYNLNVNIHTCRDDDDRVTLVPIESEELSSVIQPYSDNAGKEETLAEYYNGNSTSKMAVKRVLHRSQAMRERHRPAFLTLFRNRSLPSCVDSDCSCLESCSFLLCPSDNSVDEVSEFPHQAESSKSPSGPFVSLHSTFI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.7	Very low	27.2	Very low	233 Å²	233	156.5 Å²	156.5	100%	1.148	79%	0.789	S	S	*	*				0	114.7	0	-69	153.1	175.2	0	0	105.5
2	Y	22.6	Very low	27	Very low	220 Å²	220	151.2 Å²	151.2	86%	0.863	78%	0.777	S	S	*	*			cis	60.3	136.2	43.1	-67.8	-45.3	0	0	0	112.3
3	I	27.4	Very low	26.7	Very low	148 Å²	148	156.7 Å²	156.7	76%	0.759	79%	0.785	S	S	*	*			cis	-144.3	-178.3	9.6	-129.8	156.6	0	0	0	113
4	T	25.7	Very low	26.6	Very low	109 Å²	109	156.9 Å²	156.9	67%	0.669	78%	0.782	S	S	*	*			trans	-74.7	150.1	-172.4	44.6	0	0	0	0	117.2
5	M	26.9	Very low	26.5	Very low	169 Å²	169	156.5 Å²	156.5	83%	0.833	78%	0.777	S	S	*	*			trans	41	135.7	142.7	-54.3	-168.6	-42.5	0	0	121.6
6	V	29.6	Very low	26.5	Very low	134 Å²	134	154.5 Å²	154.5	81%	0.812	78%	0.783	S	S	*	*				-172	175.9	111.5	146.9	0	0	0	0	109.3
7	E	26.9	Very low	26.4	Very low	167 Å²	167	150.1 Å²	150.1	78%	0.78	78%	0.775	S	S	*	*			trans	-88.3	173.8	-151.7	-64.8	144.9	128.1	0	0	118.1
8	D	28.4	Very low	26.6	Very low	121 Å²	121	148.4 Å²	148.4	65%	0.647	77%	0.773	S	S	*	*			trans	69.1	106.5	151.5	-82.7	4.1	0	0	0	124.7
9	K	25.3	Very low	26.5	Very low	165 Å²	165	149.1 Å²	149.1	72%	0.717	77%	0.772	S	S	*	*				53.6	151.9	112.1	-67.3	-168.1	-156.6	85.2	0	121.1
10	P	34.4	Very low	26.6	Very low	102 Å²	102	148.1 Å²	148.1	66%	0.662	77%	0.768	S	S	*	*			cis	-140	-163	-48.2	34.4	-12.2	0	0	0	112.9
11	I	24.5	Very low	26.8	Very low	153 Å²	153	148 Å²	148	79%	0.785	76%	0.763	S	S	*	*			trans	104.8	139.4	154.7	-61.9	154.9	0	0	0	119.9
12	S	24.7	Very low	26.7	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	74%	0.742	S	S	*	*			trans	65.2	98.3	158.6	62.9	0	0	0	0	123.8
13	Y	23.4	Very low	26.9	Very low	223 Å²	223	137.8 Å²	137.8	88%	0.875	73%	0.733	S	S	*	*				62.5	142.2	106.2	-85.8	-70.9	0	0	0	124.9
14	Q	25.1	Very low	26.9	Very low	160 Å²	160	138.5 Å²	138.5	75%	0.748	74%	0.737	S	S	*	*			trans	67.6	146.8	155.2	-71.4	-168.1	-72.4	0	0	118.2
15	E	24.7	Very low	27	Very low	150 Å²	150	136.9 Å²	136.9	70%	0.701	74%	0.735	S	S	*	*			cis	172.5	170.5	-21.1	-115.7	-178.1	142.7	0	0	105.2
16	S	26.3	Very low	26.9	Very low	125 Å²	125	134.6 Å²	134.6	87%	0.874	74%	0.735	S	S	*	*			trans	69.5	152.7	170.9	81.3	0	0	0	0	117.3
17	A	25.7	Very low	27	Very low	79 Å²	79	132.8 Å²	132.8	65%	0.653	73%	0.729	S	S	*	*			cis	-169	-179.5	-22.5	0	0	0	0	0	109.5
18	T	28.9	Very low	27	Very low	121 Å²	121	134.1 Å²	134.1	74%	0.742	73%	0.732	S	S	*	*			trans	68.9	117.3	169.4	58.4	0	0	0	0	115.5
19	E	25.7	Very low	26.9	Very low	160 Å²	160	137.3 Å²	137.3	75%	0.748	75%	0.745	S	S	*	*				81.5	110.9	56.9	-72.7	179.4	174.7	0	0	114.8
20	N	29	Very low	26.8	Very low	129 Å²	129	137 Å²	137	69%	0.69	75%	0.752	S	S	*	*				174.7	123.1	102.2	-93.5	-65.5	0	0	0	115.6
21	H	29.2	Very low	26.9	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.676	75%	0.753	S	S	*	*				43.8	132.1	129	-81.9	-54	0	0	0	124.8
22	N	27.1	Very low	27.1	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	75%	0.75	S	S	*	*				77.4	143.6	125.2	-69.6	5.3	0	0	0	121
23	T	26.7	Very low	27.3	Very low	108 Å²	108	141.8 Å²	141.8	66%	0.663	76%	0.761	S	S	*	*			cis	-162.8	178.2	-20.3	-25.1	0	0	0	0	109.9
24	L	27.3	Very low	27.5	Very low	162 Å²	162	136.5 Å²	136.5	85%	0.848	76%	0.756	S	S	*	*			trans	70.8	163	163.2	-88.8	80.4	0	0	0	118.5
25	A	26.1	Very low	27.5	Very low	76 Å²	76	132.3 Å²	132.3	63%	0.628	76%	0.757	S	S	*	*			cis	-176.8	145.9	-49.5	0	0	0	0	0	111.9
26	S	26.8	Very low	27.7	Very low	120 Å²	120	135.3 Å²	135.3	84%	0.839	77%	0.767	S	S	*	*			trans	71.2	156.9	164.6	89.4	0	0	0	0	116.9
27	S	30.2	Very low	27.6	Very low	96 Å²	96	138 Å²	138	67%	0.671	77%	0.766	S	S	*	*			cis	-150.6	139.1	4.8	67.1	0	0	0	0	115.2
28	K	27.6	Very low	27.6	Very low	195 Å²	195	140.4 Å²	140.4	85%	0.848	78%	0.776	S	S	*	*			trans	50.5	116.9	144.4	-62.3	176.3	178.5	178	0	120.6
29	M	26.4	Very low	27.5	Very low	189 Å²	189	143.3 Å²	143.3	93%	0.931	78%	0.781	S	S	*	*				-163.4	129	94.5	-101	-169.2	-177.6	0	0	112.8
30	D	23.1	Very low	27.6	Very low	159 Å²	159	141 Å²	141	85%	0.85	79%	0.789	S	S	*	*			trans	-117.3	174.9	166	-88.5	-55.9	0	0	0	106.8
31	P	35.5	Very low	27.8	Very low	105 Å²	105	139.1 Å²	139.1	68%	0.682	79%	0.787	S	S	*	*			cis	-146.5	-161.6	22.3	29.9	-2.3	0	0	0	116.6
32	I	29.4	Very low	28.5	Very low	141 Å²	141	136 Å²	136	72%	0.723	78%	0.781	S	S	*	*			trans	79.3	108.2	159.1	-33.8	-177.5	0	0	0	114.8
33	F	28.9	Very low	30.6	Very low	201 Å²	201	134.5 Å²	134.5	88%	0.882	77%	0.77	S	S	*	*			cis	-136.5	151	48.1	-117.9	-78.3	0	0	0	114.2
34	S	27	Very low	33.5	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	76%	0.757	S	S	*	*			trans	-108.9	150.7	-172.3	54.9	0	0	0	0	115
35	G	25.5	Very low	36.4	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	72%	0.717	S	S	*	*			trans	98.1	101	137.6	0	0	0	0	0	118.7
36	K	28.8	Very low	39.4	Very low	212 Å²	212	124.9 Å²	124.9	92%	0.922	70%	0.699	S	S	*	*				-155.9	142.9	104	-105.3	177.6	-178.8	-171.6	0	110.6
37	H	25	Very low	42.2	Very low	183 Å²	183	119.2 Å²	119.2	85%	0.847	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-72.3	143.4	174.4	-75.8	-118.7	0	0	0	110.2
38	C	25.9	Very low	44.8	Very low	128 Å²	128	117.8 Å²	117.8	87%	0.865	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-103.8	123.1	152.1	-67.2	0	0	0	0	107
39	E	26.9	Very low	47	Very low	183 Å²	183	112.9 Å²	112.9	86%	0.855	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-77.7	139.1	173.7	-66.8	173.5	127.1	0	0	109.7	S41	E39-S41 PolarHBondContact O-N 2.75Å
40	A	27.6	Very low	49.6	Very low	110 Å²	110	107.2 Å²	107.2	91%	0.909	60%	0.6	S	S	*	*			trans	-95.7	82.4	-171.5	0	0	0	0	0	111.9
41	S	32.9	Very low	52.4	Low	91 Å²	91	100 Å²	100	64%	0.636	56%	0.561	S	S	*	*			trans	-97.6	99.7	174.8	59	0	0	0	0	112.2	E39 E43	E39-S41 PolarHBondContact O-N 2.75Å; S41-E43 PolarHBondContact O-N 2.85Å
42	S	44.9	Very low	54.6	Low	79 Å²	79	102 Å²	102	55%	0.552	56%	0.563	S	S	*	*			trans	33	69.7	155.3	49.5	0	0	0	0	118.5	Y44	S42-Y44 PolarHBondContact O-N 3.26Å
43	E	70.9	Confident	57.2	Low	101 Å²	101	97.8 Å²	97.8	47%	0.472	54%	0.544	S	S	.	.			trans	-70.8	59.2	175.2	-66.4	-171.4	108	0	0	114.6	S41 K68 I69	S41-E43 PolarHBondContact O-N 2.85Å; E43-K68 CarbonylContact O-C 3.34Å; E43-K68 VanDerWaalsContact O-CA 3.25Å; E43-K68 WeakPolarHBondContact O-CA 3.29Å; E43-K68 WeakPolarHBondContact O-CG 3.32Å; E43-I69 HydrophobicContact CB-CB 4.23Å; E43-I69 PolarHBondContact O-N 2.83Å
44	Y	86.1	Confident	59.5	Low	104 Å²	104	91.2 Å²	91.2	41%	0.408	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.5	174.4	-76.5	-85.7	0	0	0	112.1	S42 K68 P88 P104	S42-Y44 PolarHBondContact O-N 3.26Å; Y44-K68 HydrophobicContact CD1-CB 3.99Å; Y44-K68 HydrophobicContact CD1-CG 4.37Å; Y44-K68 HydrophobicContact CE1-CB 3.62Å; Y44-K68 HydrophobicContact CE1-CG 3.97Å; Y44-K68 HydrophobicContact CE2-CG 4.24Å; Y44-P88 HydrophobicContact CD1-CG 4.36Å; Y44-P88 HydrophobicContact CE1-CB 4.39Å; Y44-P88 HydrophobicContact CE1-CG 3.8Å; Y44-P104 WeakPolarHBondContact O-CD 3.44Å; Y44-P104 WeakPolarHBondContact O-CG 3.5Å
45	V	88.3	Confident	61.8	Low	0 Å²	0	91 Å²	91	0%	0	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	154.3	175.7	-64.7	0	0	0	0	110.9	K66 V67 I69 W83 F96 V101 L102 N103	V45-K66 CarbonylContact O-C 3.24Å; V45-K66 WeakPolarHBondContact O-CA 3.44Å; V45-V67 HydrophobicContact CG2-CB 4.4Å; V45-V67 PolarHBondContact N-O 2.72Å; V45-V67 PolarHBondContact O-N 2.75Å; V45-I69 HydrophobicContact CB-CD1 4.4Å; V45-I69 HydrophobicContact CG1-CD1 3.5Å; V45-I69 VanDerWaalsContact CG1-CD1 3.5Å; V45-I69 HydrophobicContact CG1-CG1 4.12Å; V45-I69 HydrophobicContact CG2-CD1 3.98Å; V45-I69 HydrophobicContact CG2-CG1 3.86Å; V45-W83 HydrophobicContact CG1-CZ3 4.42Å; V45-F96 HydrophobicContact CG2-CZ 4.38Å; V45-V101 HydrophobicContact CB-CB 4.02Å; V45-V101 HydrophobicContact CB-CG2 4.19Å; V45-V101 HydrophobicContact CG2-CB 3.79Å; V45-V101 HydrophobicContact CG2-CG1 3.99Å; V45-V101 HydrophobicContact CG2-CG2 3.86Å; V45-L102 WeakPolarHBondContact CA-O 3.37Å; V45-L102 WeakPolarHBondContact CB-O 3.43Å; V45-N103 HydrophobicContact CG1-CB 4.28Å
46	T	89.2	Confident	64.4	Low	41 Å²	41	92.8 Å²	92.8	25%	0.252	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.6	180	-52.3	0	0	0	0	109.8	I48 V101 L102	T46-I48 PolarHBondContact O-N 2.68Å; T46-V101 CarbonylContact O-C 3.34Å; T46-V101 WeakPolarHBondContact O-CA 2.99Å; T46-L102 PolarHBondContact N-O 3.25Å; T46-L102 PolarHBondContact O-N 3.41Å
47	A	87	Confident	67.1	Low	1 Å²	1	87.3 Å²	87.3	1%	0.008	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	115.7	174.8	0	0	0	0	0	110.6	L61 R62 G64 Q65 Y100 V101	A47-L61 HydrophobicContact CB-CB 3.96Å; A47-L61 HydrophobicContact CB-CD1 4.25Å; A47-L61 HydrophobicContact CB-CG 4.49Å; A47-R62 WeakPolarHBondContact CB-O 3.4Å; A47-G64 PolarHBondContact O-N 2.93Å; A47-Q65 HydrophobicContact CB-CB 4.4Å; A47-Q65 WeakPolarHBondContact CB-O 3.26Å; A47-Q65 PolarHBondContact N-O 3.1Å; A47-Y100 CarbonylContact C-O 3.56Å; A47-Y100 VanDerWaalsContact CA-O 3.32Å; A47-Y100 WeakPolarHBondContact CA-O 3.29Å; A47-V101 HydrophobicContact CB-CG1 4.4Å
48	I	83.4	Confident	70.2	Confident	65 Å²	65	79 Å²	79	33%	0.333	45%	0.446	S	S	.	.	S	Bend	trans	-80	-25.3	174.1	49.6	169.5	0	0	0	111.2	T46 T63 Y100 L102	T46-I48 PolarHBondContact O-N 2.68Å; I48-T63 WeakPolarHBondContact O-CG2 3.24Å; I48-T63 PolarHBondContact O-OG1 3.05Å; I48-Y100 VanDerWaalsContact CG1-O 3.32Å; I48-Y100 WeakPolarHBondContact CG1-O 3.45Å; I48-Y100 PolarHBondContact N-O 2.04Å; I48-L102 HydrophobicContact CG2-CB 3.8Å
49	Y	74.2	Confident	73.2	Confident	92 Å²	92	73 Å²	73	36%	0.361	41%	0.405	S	S	.	.	S	Bend	trans	-128.3	152.2	-178.2	-57.5	-48.1	0	0	0	110.9	T63 Y100 P158	Y49-T63 WeakPolarHBondContact CA-OG1 3.16Å; Y49-Y100 HydrophobicContact CD2-CD1 4.49Å; Y49-Y100 PolarHBondContact N-O 2.87Å; Y49-P158 HydrophobicContact CD1-CB 3.34Å; Y49-P158 HydrophobicContact CD1-CG 3.61Å; Y49-P158 HydrophobicContact CD2-CB 3.32Å; Y49-P158 HydrophobicContact CD2-CG 4.27Å; Y49-P158 HydrophobicContact CE1-CB 3.68Å; Y49-P158 HydrophobicContact CE1-CG 4.27Å; Y49-P158 HydrophobicContact CE2-CB 3.65Å; Y49-P158 HydrophobicContact CG-CB 3.15Å; Y49-P158 HydrophobicContact CG-CG 3.61Å
50	S	82	Confident	76.1	Confident	71 Å²	71	67 Å²	67	50%	0.497	38%	0.379	S	S	.	.			trans	-84.4	134.8	174.7	-58.2	0	0	0	0	109.5	L61 T63	S50-L61 CarbonylContact C-O 3.54Å; S50-L61 WeakPolarHBondContact CA-O 3.43Å; S50-T63 PolarHBondContact N-OG1 3.29Å; S50-T63 PolarHBondContact OG-N 3.39Å; S50-T63 PolarHBondContact OG-OG1 3.13Å; S50-T63 VanDerWaalsContact OG-OG1 3.05Å
51	Y	82.2	Confident	78.9	Confident	8 Å²	8	61.8 Å²	61.8	3%	0.031	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-131	113.4	-175.9	-174.5	-100.4	0	0	0	110.2	E58 N60 L61 W82 P97 Y100	Y51-E58 WeakPolarHBondContact CE1-OE2 3.15Å; Y51-E58 PolarHBondContact OH-OE2 3.14Å; Y51-E58 VanDerWaalsContact OH-OE2 3.13Å; Y51-N60 WeakPolarHBondContact O-CA 3.15Å; Y51-N60 PolarHBondContact O-OD1 2.87Å; Y51-L61 PolarHBondContact N-O 2.84Å; Y51-L61 PolarHBondContact O-N 2.72Å; Y51-W82 VanDerWaalsContact OH-CH2 3.27Å; Y51-W82 WeakPolarHBondContact OH-CH2 3.19Å; Y51-P97 HydrophobicContact CD1-CG 4.33Å; Y51-P97 HydrophobicContact CD2-CG 3.75Å; Y51-P97 HydrophobicContact CE1-CG 4.3Å; Y51-P97 HydrophobicContact CE2-CG 3.71Å; Y51-P97 HydrophobicContact CG-CG 4.07Å; Y51-Y100 AromaticContact CD2-CD1 3.9Å; Y51-Y100 HydrophobicContact CD2-CD1 3.9Å; Y51-Y100 AromaticContact CD2-CE1 3.67Å; Y51-Y100 HydrophobicContact CD2-CE1 3.67Å; Y51-Y100 HydrophobicContact CD2-CE2 4.44Å; Y51-Y100 HydrophobicContact CD2-CG 4.41Å; Y51-Y100 AromaticContact CD2-CZ 3.95Å; Y51-Y100 HydrophobicContact CG-CD1 4.35Å
52	M	80.6	Confident	81.4	Confident	147 Å²	147	65.8 Å²	65.8	72%	0.724	34%	0.337	S	S	*	.			trans	-81.3	129.2	170.8	-76.4	-70	-168	0	0	109.7	Q54	M52-Q54 PolarHBondContact O-N 3.01Å
53	P	83.8	Confident	83.3	Confident	52 Å²	52	66.2 Å²	66.2	34%	0.338	34%	0.337	S	S	.	.			trans	-67.9	127.5	-178	27.9	-33.1	0	0	0	110.8	E58 N60	P53-E58 WeakPolarHBondContact CA-OE2 3.41Å; P53-E58 HydrophobicContact CB-CB 3.58Å; P53-N60 HydrophobicContact CG-CB 4.19Å
54	Q	76.5	Confident	83.7	Confident	62 Å²	62	64 Å²	64	29%	0.29	34%	0.34	S	S	.	.	S	Bend	trans	-83.6	-21.2	177.2	-56.7	-170.8	28	0	0	112.3	M52 E58	M52-Q54 PolarHBondContact O-N 3.01Å; Q54-E58 PolarHBondContact N-OE2 2.97Å
55	H	76.3	Confident	83.8	Confident	108 Å²	108	60.4 Å²	60.4	50%	0.5	33%	0.327	S	S	.	.	S	Bend	trans	-136.5	160.7	-179.8	-61.4	-52.9	0	0	0	112.5	D57 E58	H55-D57 WeakPolarHBondContact CB-OD1 3.1Å; H55-D57 PolarHBondContact O-N 2.8Å; H55-D57 VanDerWaalsContact O-N 3.16Å; H55-E58 HydrophobicContact CB-CG 4.18Å; H55-E58 WeakPolarHBondContact CB-OE1 3.27Å; H55-E58 IonicContact CD2-OE1 2.71Å; H55-E58 PolarHBondContact CD2-OE1 3.18Å; H55-E58 IonicContact CG-OE1 2.74Å; H55-E58 PolarHBondContact N-OE1 2.88Å; H55-E58 WeakPolarHBondContact O-CB 3.41Å; H55-E58 PolarHBondContact O-N 3.18Å
56	S	79	Confident	83.8	Confident	111 Å²	111	66.6 Å²	66.6	78%	0.776	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-1.5	-170.4	54.4	0	0	0	0	115.8	Y92	S56-Y92 PolarHBondContact O-OH 3.4Å; S56-Y92 VanDerWaalsContact O-OH 3.08Å
57	D	86.6	Confident	83.9	Confident	96 Å²	96	64.7 Å²	64.7	51%	0.513	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	5.2	178.8	49.7	-38.6	0	0	0	112.1	H55 G94 V95	H55-D57 WeakPolarHBondContact CB-OD1 3.1Å; H55-D57 PolarHBondContact O-N 2.8Å; H55-D57 VanDerWaalsContact O-N 3.16Å; D57-G94 CarbonylContact O-C 3.53Å; D57-G94 WeakPolarHBondContact O-CA 3.45Å; D57-V95 PolarHBondContact O-N 3.16Å
58	E	90.2	Very high	84.2	Confident	9 Å²	9	67.8 Å²	67.8	4%	0.042	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-95.9	152.3	177.3	-62.1	176.2	-158.4	0	0	112.2	Y51 P53 Q54 H55 W82 Y92 V95	Y51-E58 WeakPolarHBondContact CE1-OE2 3.15Å; Y51-E58 PolarHBondContact OH-OE2 3.14Å; Y51-E58 VanDerWaalsContact OH-OE2 3.13Å; P53-E58 WeakPolarHBondContact CA-OE2 3.41Å; P53-E58 HydrophobicContact CB-CB 3.58Å; Q54-E58 PolarHBondContact N-OE2 2.97Å; H55-E58 HydrophobicContact CB-CG 4.18Å; H55-E58 WeakPolarHBondContact CB-OE1 3.27Å; H55-E58 IonicContact CD2-OE1 2.71Å; H55-E58 PolarHBondContact CD2-OE1 3.18Å; H55-E58 IonicContact CG-OE1 2.74Å; H55-E58 PolarHBondContact N-OE1 2.88Å; H55-E58 WeakPolarHBondContact O-CB 3.41Å; H55-E58 PolarHBondContact O-N 3.18Å; E58-W82 HydrophobicContact CG-CH2 4.4Å; E58-W82 HydrophobicContact CG-CZ3 3.95Å; E58-Y92 WeakPolarHBondContact O-CE1 3.3Å; E58-Y92 PolarHBondContact O-OH 3.33Å; E58-V95 CarbonylContact C-O 3.58Å; E58-V95 WeakPolarHBondContact CA-O 3.12Å; E58-V95 HydrophobicContact CG-CG2 3.85Å
59	I	88.2	Confident	84.6	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-92.2	133.7	175.5	-59.2	-174.5	0	0	0	110.5	L61 V67 G85 Y92 V95 F96	I59-L61 HydrophobicContact CG2-CD2 4.03Å; I59-L61 PolarHBondContact O-N 3.18Å; I59-V67 HydrophobicContact CD1-CG1 4.39Å; I59-G85 WeakPolarHBondContact CD1-O 3.42Å; I59-Y92 HydrophobicContact CG1-CD1 4.07Å; I59-Y92 HydrophobicContact CG1-CE1 4.04Å; I59-V95 PolarHBondContact N-O 3.42Å; I59-F96 HydrophobicContact CD1-CD1 4.22Å
60	N	87.7	Confident	85.4	Confident	58 Å²	58	63.8 Å²	63.8	31%	0.31	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-72.3	117.4	166.4	-171.1	-28.8	0	0	0	110.2	Y51 P53 Q65	Y51-N60 WeakPolarHBondContact O-CA 3.15Å; Y51-N60 PolarHBondContact O-OD1 2.87Å; P53-N60 HydrophobicContact CG-CB 4.19Å; N60-Q65 PolarHBondContact O-NE2 3.26Å; N60-Q65 PolarHBondContact O-OE1 3.41Å
61	L	87.4	Confident	85.8	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-100.1	133.7	173.2	-51.6	-179.5	0	0	0	109.9	A47 S50 Y51 I59 V67 F96 V101	A47-L61 HydrophobicContact CB-CB 3.96Å; A47-L61 HydrophobicContact CB-CD1 4.25Å; A47-L61 HydrophobicContact CB-CG 4.49Å; S50-L61 CarbonylContact C-O 3.54Å; S50-L61 WeakPolarHBondContact CA-O 3.43Å; Y51-L61 PolarHBondContact N-O 2.84Å; Y51-L61 PolarHBondContact O-N 2.72Å; I59-L61 HydrophobicContact CG2-CD2 4.03Å; I59-L61 PolarHBondContact O-N 3.18Å; L61-V67 HydrophobicContact CD2-CG2 3.56Å; L61-F96 HydrophobicContact CD1-CB 4.16Å; L61-F96 HydrophobicContact CD1-CD2 4.21Å; L61-F96 HydrophobicContact CD1-CG 4.43Å; L61-F96 HydrophobicContact CD2-CB 4.37Å; L61-F96 HydrophobicContact CD2-CG 4.43Å; L61-F96 HydrophobicContact CG-CB 4.4Å; L61-V101 HydrophobicContact CD1-CG1 4.06Å
62	R	84.1	Confident	86.1	Confident	174 Å²	174	66 Å²	66	66%	0.657	34%	0.343	S	S	*	.			trans	-106.6	144.4	161.9	-60.8	179.1	-179.1	-120.6	0.2	109	A47 G64 Q65	A47-R62 WeakPolarHBondContact CB-O 3.4Å; R62-G64 PolarHBondContact O-N 2.85Å; R62-Q65 HydrophobicContact CB-CB 4.38Å; R62-Q65 WeakPolarHBondContact O-CB 3.28Å; R62-Q65 PolarHBondContact O-N 3.46Å
63	T	84.8	Confident	85.9	Confident	89 Å²	89	61.1 Å²	61.1	55%	0.546	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	129.7	173.8	-64	0	0	0	0	110.3	I48 Y49 S50	I48-T63 WeakPolarHBondContact O-CG2 3.24Å; I48-T63 PolarHBondContact O-OG1 3.05Å; Y49-T63 WeakPolarHBondContact CA-OG1 3.16Å; S50-T63 PolarHBondContact N-OG1 3.29Å; S50-T63 PolarHBondContact OG-N 3.39Å; S50-T63 PolarHBondContact OG-OG1 3.13Å; S50-T63 VanDerWaalsContact OG-OG1 3.05Å
64	G	80.2	Confident	85.7	Confident	53 Å²	53	61 Å²	61	55%	0.546	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-6.7	-173.2	0	0	0	0	0	115.5	A47 R62 K66	A47-G64 PolarHBondContact O-N 2.93Å; R62-G64 PolarHBondContact O-N 2.85Å; G64-K66 PolarHBondContact O-N 3.12Å
65	Q	87.6	Confident	85.3	Confident	30 Å²	30	67.7 Å²	67.7	14%	0.14	34%	0.343	C	S	.	.			trans	-71.1	125.3	178.1	-176	174.9	-31.5	0	0	110.9	A47 N60 R62	A47-Q65 HydrophobicContact CB-CB 4.4Å; A47-Q65 WeakPolarHBondContact CB-O 3.26Å; A47-Q65 PolarHBondContact N-O 3.1Å; N60-Q65 PolarHBondContact O-NE2 3.26Å; N60-Q65 PolarHBondContact O-OE1 3.41Å; R62-Q65 HydrophobicContact CB-CB 4.38Å; R62-Q65 WeakPolarHBondContact O-CB 3.28Å; R62-Q65 PolarHBondContact O-N 3.46Å
66	K	89.6	Confident	85.4	Confident	130 Å²	130	68.7 Å²	68.7	57%	0.565	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	135	168.5	-66.6	-170.2	177	-172.7	0	110.1	V45 G64 P88	V45-K66 CarbonylContact O-C 3.24Å; V45-K66 WeakPolarHBondContact O-CA 3.44Å; G64-K66 PolarHBondContact O-N 3.12Å; K66-P88 WeakPolarHBondContact O-CD 3.42Å; K66-P88 WeakPolarHBondContact O-CG 3.19Å
67	V	90.6	Very high	85.5	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132.6	173.1	177.9	0	0	0	0	108	V45 I59 L61 F96	V45-V67 HydrophobicContact CG2-CB 4.4Å; V45-V67 PolarHBondContact N-O 2.72Å; V45-V67 PolarHBondContact O-N 2.75Å; I59-V67 HydrophobicContact CD1-CG1 4.39Å; L61-V67 HydrophobicContact CD2-CG2 3.56Å; V67-F96 HydrophobicContact CG1-CD1 4.26Å; V67-F96 HydrophobicContact CG1-CE1 3.7Å; V67-F96 HydrophobicContact CG1-CZ 4.11Å
68	K	92.7	Very high	84.8	Confident	66 Å²	66	62.6 Å²	62.6	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	127.9	171	-167.2	-167	170.6	-173.1	0	108.2	E43 Y44 L70 G85 Q86	E43-K68 CarbonylContact O-C 3.34Å; E43-K68 VanDerWaalsContact O-CA 3.25Å; E43-K68 WeakPolarHBondContact O-CA 3.29Å; E43-K68 WeakPolarHBondContact O-CG 3.32Å; Y44-K68 HydrophobicContact CD1-CB 3.99Å; Y44-K68 HydrophobicContact CD1-CG 4.37Å; Y44-K68 HydrophobicContact CE1-CB 3.62Å; Y44-K68 HydrophobicContact CE1-CG 3.97Å; Y44-K68 HydrophobicContact CE2-CG 4.24Å; K68-L70 HydrophobicContact CD-CD2 4.28Å; K68-G85 CarbonylContact O-C 3.43Å; K68-G85 WeakPolarHBondContact O-CA 3.33Å; K68-Q86 HydrophobicContact CB-CB 4.33Å; K68-Q86 PolarHBondContact N-O 2.99Å; K68-Q86 PolarHBondContact O-N 3.27Å
69	I	92.3	Very high	83.8	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	143.1	170.6	-66.5	-175.1	0	0	0	109.1	E43 V45 K72 W83 F96	E43-I69 HydrophobicContact CB-CB 4.23Å; E43-I69 PolarHBondContact O-N 2.83Å; V45-I69 HydrophobicContact CB-CD1 4.4Å; V45-I69 HydrophobicContact CG1-CD1 3.5Å; V45-I69 VanDerWaalsContact CG1-CD1 3.5Å; V45-I69 HydrophobicContact CG1-CG1 4.12Å; V45-I69 HydrophobicContact CG2-CD1 3.98Å; V45-I69 HydrophobicContact CG2-CG1 3.86Å; I69-K72 HydrophobicContact CD1-CD 4.44Å; I69-K72 HydrophobicContact CD1-CG 4.28Å; I69-K72 HydrophobicContact CG2-CG 3.93Å; I69-W83 HydrophobicContact CD1-CD2 4.27Å; I69-W83 HydrophobicContact CD1-CE3 3.44Å; I69-W83 VanDerWaalsContact CD1-CE3 3.44Å; I69-W83 HydrophobicContact CD1-CZ3 3.64Å; I69-W83 HydrophobicContact CG1-CE3 4.38Å; I69-F96 HydrophobicContact CG1-CZ 4.43Å
70	L	91.3	Very high	83.1	Confident	71 Å²	71	66.9 Å²	66.9	37%	0.372	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	-25	171.4	-63.5	-178.1	0	0	0	112.1	K68 V84 Q86 V93	K68-L70 HydrophobicContact CD-CD2 4.28Å; L70-V84 HydrophobicContact CB-CG1 4.34Å; L70-V84 PolarHBondContact N-O 3.09Å; L70-Q86 HydrophobicContact CD1-CB 4.05Å; L70-Q86 HydrophobicContact CG-CB 4.29Å; L70-V93 HydrophobicContact CD1-CB 4.49Å; L70-V93 HydrophobicContact CD1-CG1 3.88Å; L70-V93 HydrophobicContact CD1-CG2 3.78Å
71	S	90.1	Very high	82.5	Confident	15 Å²	15	64.9 Å²	64.9	11%	0.105	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	127.3	170.8	174.8	0	0	0	0	112	D73 H76 V84	S71-D73 WeakPolarHBondContact OG-CB 3.46Å; S71-D73 PolarHBondContact OG-N 2.92Å; S71-D73 PolarHBondContact OG-O 3.46Å; S71-H76 PolarHBondContact OG-ND1 3.04Å; S71-V84 PolarHBondContact N-O 3.35Å; S71-V84 PolarHBondContact O-N 3.44Å
72	K	87.6	Confident	82.6	Confident	110 Å²	110	66.2 Å²	66.2	48%	0.478	35%	0.345	S	S	.	.			trans	-86	-6.5	164.9	-60	-174.8	178	175.1	0	113.4	I69 W83	I69-K72 HydrophobicContact CD1-CD 4.44Å; I69-K72 HydrophobicContact CD1-CG 4.28Å; I69-K72 HydrophobicContact CG2-CG 3.93Å; K72-W83 HydrophobicContact CB-CG 4.38Å; K72-W83 HydrophobicContact CD-CD2 4.5Å; K72-W83 HydrophobicContact CD-CH2 4.34Å; K72-W83 HydrophobicContact CD-CZ2 3.97Å; K72-W83 HydrophobicContact CG-CD2 3.96Å; K72-W83 HydrophobicContact CG-CG 4.18Å; K72-W83 HydrophobicContact CG-CZ2 4.26Å
73	D	78.1	Confident	83	Confident	46 Å²	46	60.7 Å²	60.7	25%	0.246	32%	0.324	C	S	.	.			trans	-77.2	123	-178.6	-169.7	-26.7	0	0	0	111.8	S71 R75 H76 S77	S71-D73 WeakPolarHBondContact OG-CB 3.46Å; S71-D73 PolarHBondContact OG-N 2.92Å; S71-D73 PolarHBondContact OG-O 3.46Å; D73-R75 PolarHBondContact O-N 3.13Å; D73-R75 VanDerWaalsContact O-N 3.14Å; D73-R75 VanDerWaalsContact OD1-CB 3.23Å; D73-R75 WeakPolarHBondContact OD1-CB 3.3Å; D73-R75 VanDerWaalsContact OD1-CG 3.27Å; D73-R75 WeakPolarHBondContact OD1-CG 3.02Å; D73-R75 PolarHBondContact OD1-N 3.36Å; D73-R75 IonicContact OD1-NE 3.2Å; D73-R75 PolarHBondContact OD1-NE 3.44Å; D73-R75 VanDerWaalsContact OD1-NE 3.12Å; D73-R75 IonicContact OD2-CZ 2.7Å; D73-R75 IonicContact OD2-NE 3.94Å; D73-R75 PolarHBondContact OD2-NE 2.98Å; D73-R75 IonicContact OD2-NH2 3.66Å; D73-R75 PolarHBondContact OD2-NH2 2.9Å; D73-H76 PolarHBondContact O-N 3.08Å; D73-S77 PolarHBondContact O-N 3.45Å; D73-S77 PolarHBondContact O-OG 3.26Å
74	C	78.2	Confident	83.4	Confident	48 Å²	48	57.4 Å²	57.4	32%	0.324	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-15.5	178.9	60.4	0	0	0	0	114.1	H76 S77 G78 A79	C74-H76 PolarHBondContact O-N 3.4Å; C74-S77 WeakPolarHBondContact CA-OG 3.41Å; C74-G78 CarbonylContact O-C 3.52Å; C74-G78 WeakPolarHBondContact O-CA 3.13Å; C74-G78 PolarHBondContact O-N 3.06Å; C74-A79 VanDerWaalsContact CB-O 3.23Å; C74-A79 WeakPolarHBondContact CB-O 3.47Å
75	R	68.1	Low	83.9	Confident	203 Å²	203	54.9 Å²	54.9	77%	0.766	28%	0.278	S	S	*	.	H	α-helix	trans	-72.9	-15.9	171.6	-60.7	177.3	-67.3	177.2	1.7	113.2	D73	D73-R75 PolarHBondContact O-N 3.13Å; D73-R75 VanDerWaalsContact O-N 3.14Å; D73-R75 VanDerWaalsContact OD1-CB 3.23Å; D73-R75 WeakPolarHBondContact OD1-CB 3.3Å; D73-R75 VanDerWaalsContact OD1-CG 3.27Å; D73-R75 WeakPolarHBondContact OD1-CG 3.02Å; D73-R75 PolarHBondContact OD1-N 3.36Å; D73-R75 IonicContact OD1-NE 3.2Å; D73-R75 PolarHBondContact OD1-NE 3.44Å; D73-R75 VanDerWaalsContact OD1-NE 3.12Å; D73-R75 IonicContact OD2-CZ 2.7Å; D73-R75 IonicContact OD2-NE 3.94Å; D73-R75 PolarHBondContact OD2-NE 2.98Å; D73-R75 IonicContact OD2-NH2 3.66Å; D73-R75 PolarHBondContact OD2-NH2 2.9Å
76	H	79.7	Confident	84.2	Confident	129 Å²	129	56.2 Å²	56.2	60%	0.597	28%	0.284	S	S	*	.	H	α-helix	trans	-103.5	-34.8	175.6	-58.3	141.4	0	0	0	112.7	S71 D73 C74 V84	S71-H76 PolarHBondContact OG-ND1 3.04Å; D73-H76 PolarHBondContact O-N 3.08Å; C74-H76 PolarHBondContact O-N 3.4Å; H76-V84 HydrophobicContact CB-CG2 3.85Å
77	S	80.8	Confident	84.2	Confident	13 Å²	13	52 Å²	52	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-88	-6.8	176	53.7	0	0	0	0	114.4	D73 C74 A79 W82	D73-S77 PolarHBondContact O-N 3.45Å; D73-S77 PolarHBondContact O-OG 3.26Å; C74-S77 WeakPolarHBondContact CA-OG 3.41Å; S77-A79 PolarHBondContact O-N 3.21Å; S77-A79 PolarHBondContact OG-O 3.29Å; S77-W82 VanDerWaalsContact CB-O 3.25Å; S77-W82 WeakPolarHBondContact CB-O 3.43Å; S77-W82 PolarHBondContact OG-O 3.24Å
78	G	71.3	Confident	83.7	Confident	67 Å²	67	55.2 Å²	55.2	69%	0.691	29%	0.288	S	S	*	.	S	Bend	trans	81.6	-17.8	177.4	0	0	0	0	0	115.4	C74	C74-G78 CarbonylContact O-C 3.52Å; C74-G78 WeakPolarHBondContact O-CA 3.13Å; C74-G78 PolarHBondContact O-N 3.06Å
79	A	69.7	Low	83	Confident	26 Å²	26	61.2 Å²	61.2	22%	0.215	31%	0.314	C	S	.	.	S	Bend	trans	-144.1	158.3	-179.4	0	0	0	0	0	112.4	C74 S77 W82	C74-A79 VanDerWaalsContact CB-O 3.23Å; C74-A79 WeakPolarHBondContact CB-O 3.47Å; S77-A79 PolarHBondContact O-N 3.21Å; S77-A79 PolarHBondContact OG-O 3.29Å; A79-W82 HydrophobicContact CB-CB 4.42Å; A79-W82 HydrophobicContact CB-CG 4.13Å
80	E	73.2	Confident	82.6	Confident	74 Å²	74	65.3 Å²	65.3	35%	0.346	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	147.2	167.5	-178.4	173.8	-99.8	0	0	109.8	R165	E80-R165 HydrophobicContact CB-CG 4.27Å; E80-R165 IonicContact OE1-CZ 2.66Å; E80-R165 IonicContact OE1-NE 3.06Å; E80-R165 IonicContact OE1-NH1 3.12Å; E80-R165 IonicContact OE1-NH2 2.94Å; E80-R165 PolarHBondContact OE1-NH2 3.15Å; E80-R165 IonicContact OE2-CZ 2.75Å; E80-R165 IonicContact OE2-NE 3.55Å; E80-R165 PolarHBondContact OE2-NE 3.39Å; E80-R165 IonicContact OE2-NH2 3.93Å; E80-R165 PolarHBondContact OE2-NH2 3.18Å
81	G	76.2	Confident	82.3	Confident	15 Å²	15	63.7 Å²	63.7	16%	0.155	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	7.4	-169.5	0	0	0	0	0	113.7	P97 S98	G81-P97 CarbonylContact O-C 3.49Å; G81-P97 WeakPolarHBondContact O-CA 3.36Å; G81-S98 WeakPolarHBondContact CA-OG 3.3Å; G81-S98 PolarHBondContact O-N 3.41Å; G81-S98 PolarHBondContact O-OG 3.5Å
82	W	88.9	Confident	82.2	Confident	30 Å²	30	67.5 Å²	67.5	11%	0.114	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.5	176.1	-68	77.9	0	0	0	110.2	Y51 E58 S77 A79 V95 F96	Y51-W82 VanDerWaalsContact OH-CH2 3.27Å; Y51-W82 WeakPolarHBondContact OH-CH2 3.19Å; E58-W82 HydrophobicContact CG-CH2 4.4Å; E58-W82 HydrophobicContact CG-CZ3 3.95Å; S77-W82 VanDerWaalsContact CB-O 3.25Å; S77-W82 WeakPolarHBondContact CB-O 3.43Å; S77-W82 PolarHBondContact OG-O 3.24Å; A79-W82 HydrophobicContact CB-CB 4.42Å; A79-W82 HydrophobicContact CB-CG 4.13Å; W82-V95 HydrophobicContact CE3-CB 4.12Å; W82-V95 HydrophobicContact CE3-CG2 3.77Å; W82-V95 HydrophobicContact CZ3-CG2 3.98Å; W82-F96 WeakPolarHBondContact CA-O 3.46Å
83	W	92.4	Very high	82.3	Confident	57 Å²	57	65.6 Å²	65.6	22%	0.216	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	151.2	175.9	-65.9	-17.4	0	0	0	110.6	V45 I69 K72 V95 F96 S98 V101	V45-W83 HydrophobicContact CG1-CZ3 4.42Å; I69-W83 HydrophobicContact CD1-CD2 4.27Å; I69-W83 HydrophobicContact CD1-CE3 3.44Å; I69-W83 VanDerWaalsContact CD1-CE3 3.44Å; I69-W83 HydrophobicContact CD1-CZ3 3.64Å; I69-W83 HydrophobicContact CG1-CE3 4.38Å; K72-W83 HydrophobicContact CB-CG 4.38Å; K72-W83 HydrophobicContact CD-CD2 4.5Å; K72-W83 HydrophobicContact CD-CH2 4.34Å; K72-W83 HydrophobicContact CD-CZ2 3.97Å; K72-W83 HydrophobicContact CG-CD2 3.96Å; K72-W83 HydrophobicContact CG-CG 4.18Å; K72-W83 HydrophobicContact CG-CZ2 4.26Å; W83-V95 CarbonylContact O-C 3.38Å; W83-V95 VanDerWaalsContact O-CA 3.26Å; W83-V95 WeakPolarHBondContact O-CA 3.27Å; W83-F96 HydrophobicContact CB-CE1 4.26Å; W83-F96 HydrophobicContact CB-CE2 4.17Å; W83-F96 HydrophobicContact CB-CZ 3.85Å; W83-F96 HydrophobicContact CE3-CE2 4.14Å; W83-F96 HydrophobicContact CE3-CZ 4.28Å; W83-F96 PolarHBondContact N-O 3.1Å; W83-F96 PolarHBondContact O-N 2.9Å; W83-S98 VanDerWaalsContact CE2-CB 3.45Å; W83-V101 HydrophobicContact CE3-CG2 3.96Å; W83-V101 HydrophobicContact CZ3-CG2 3.69Å
84	V	92.4	Very high	83	Confident	20 Å²	20	63.8 Å²	63.8	12%	0.121	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.5	168.9	-167.8	0	0	0	0	108.2	L70 S71 H76 V93 V95	L70-V84 HydrophobicContact CB-CG1 4.34Å; L70-V84 PolarHBondContact N-O 3.09Å; S71-V84 PolarHBondContact N-O 3.35Å; S71-V84 PolarHBondContact O-N 3.44Å; H76-V84 HydrophobicContact CB-CG2 3.85Å; V84-V93 HydrophobicContact CG1-CG1 4.17Å; V84-V95 HydrophobicContact CG2-CG1 4.26Å
85	G	92.2	Very high	83.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-168.2	173.1	0	0	0	0	0	113.7	I59 K68 V93 G94	I59-G85 WeakPolarHBondContact CD1-O 3.42Å; K68-G85 CarbonylContact O-C 3.43Å; K68-G85 WeakPolarHBondContact O-CA 3.33Å; G85-V93 WeakPolarHBondContact O-CA 3.4Å; G85-G94 PolarHBondContact N-O 3.13Å; G85-G94 PolarHBondContact O-N 3.1Å
86	Q	93.1	Very high	84.8	Confident	59 Å²	59	52.8 Å²	52.8	28%	0.276	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.7	-179.8	-168.6	172	31	0	0	110.1	K68 L70 P88 G91 Y92 V93	K68-Q86 HydrophobicContact CB-CB 4.33Å; K68-Q86 PolarHBondContact N-O 2.99Å; K68-Q86 PolarHBondContact O-N 3.27Å; L70-Q86 HydrophobicContact CD1-CB 4.05Å; L70-Q86 HydrophobicContact CG-CB 4.29Å; Q86-P88 WeakPolarHBondContact O-CD 3.35Å; Q86-G91 WeakPolarHBondContact CG-O 3.47Å; Q86-G91 PolarHBondContact NE2-O 2.99Å; Q86-Y92 CarbonylContact C-O 3.54Å; Q86-Y92 VanDerWaalsContact CA-O 3.29Å; Q86-Y92 WeakPolarHBondContact CA-O 3.31Å; Q86-V93 HydrophobicContact CB-CG2 4.02Å; Q86-V93 HydrophobicContact CG-CG2 3.78Å
87	E	89.1	Confident	85.1	Confident	40 Å²	40	46.6 Å²	46.6	19%	0.187	27%	0.267	C	S	.	.			trans	-71.4	119.8	168.1	-177.6	-173.3	-174	0	0	109.2	K89 T90 G91 Y92	E87-K89 PolarHBondContact O-N 2.97Å; E87-T90 WeakPolarHBondContact CB-OG1 3.09Å; E87-T90 VanDerWaalsContact CD-OG1 3.3Å; E87-T90 PolarHBondContact O-N 2.67Å; E87-T90 WeakPolarHBondContact OE2-CB 3.19Å; E87-T90 WeakPolarHBondContact OE2-CG2 3.36Å; E87-T90 PolarHBondContact OE2-OG1 2.75Å; E87-G91 WeakPolarHBondContact O-CA 3.3Å; E87-G91 PolarHBondContact O-N 3.34Å; E87-Y92 PolarHBondContact N-O 2.87Å
88	P	80.9	Confident	85.5	Confident	68 Å²	68	47.1 Å²	47.1	44%	0.442	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.8	-172.1	-21.5	35.1	0	0	0	114.7	Y44 K66 Q86	Y44-P88 HydrophobicContact CD1-CG 4.36Å; Y44-P88 HydrophobicContact CE1-CB 4.39Å; Y44-P88 HydrophobicContact CE1-CG 3.8Å; K66-P88 WeakPolarHBondContact O-CD 3.42Å; K66-P88 WeakPolarHBondContact O-CG 3.19Å; Q86-P88 WeakPolarHBondContact O-CD 3.35Å
89	K	78.4	Confident	86	Confident	192 Å²	192	45.3 Å²	45.3	84%	0.835	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-35.2	-178.6	-70	-173.1	175.6	-175.9	0	113.6	E87	E87-K89 PolarHBondContact O-N 2.97Å
90	T	83.9	Confident	86.7	Confident	88 Å²	88	44.4 Å²	44.4	54%	0.54	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-15.6	-176.2	58.5	0	0	0	0	112.4	E87 Y92	E87-T90 WeakPolarHBondContact CB-OG1 3.09Å; E87-T90 VanDerWaalsContact CD-OG1 3.3Å; E87-T90 PolarHBondContact O-N 2.67Å; E87-T90 WeakPolarHBondContact OE2-CB 3.19Å; E87-T90 WeakPolarHBondContact OE2-CG2 3.36Å; E87-T90 PolarHBondContact OE2-OG1 2.75Å; T90-Y92 PolarHBondContact O-N 2.68Å; T90-Y92 VanDerWaalsContact OG1-CB 3.29Å; T90-Y92 WeakPolarHBondContact OG1-CB 3.19Å; T90-Y92 PolarHBondContact OG1-N 2.77Å
91	G	84.2	Confident	87.3	Confident	37 Å²	37	41.5 Å²	41.5	38%	0.381	23%	0.23	S	C	.	.			trans	70.9	1.2	-169.7	0	0	0	0	0	113.8	Q86 E87	Q86-G91 WeakPolarHBondContact CG-O 3.47Å; Q86-G91 PolarHBondContact NE2-O 2.99Å; E87-G91 WeakPolarHBondContact O-CA 3.3Å; E87-G91 PolarHBondContact O-N 3.34Å
92	Y	87.1	Confident	87.8	Confident	95 Å²	95	43.8 Å²	43.8	37%	0.373	24%	0.238	S	C	.	.			trans	-65.6	131.7	-175.9	179.4	-96.6	0	0	0	111.4	S56 E58 I59 Q86 E87 T90	S56-Y92 PolarHBondContact O-OH 3.4Å; S56-Y92 VanDerWaalsContact O-OH 3.08Å; E58-Y92 WeakPolarHBondContact O-CE1 3.3Å; E58-Y92 PolarHBondContact O-OH 3.33Å; I59-Y92 HydrophobicContact CG1-CD1 4.07Å; I59-Y92 HydrophobicContact CG1-CE1 4.04Å; Q86-Y92 CarbonylContact C-O 3.54Å; Q86-Y92 VanDerWaalsContact CA-O 3.29Å; Q86-Y92 WeakPolarHBondContact CA-O 3.31Å; E87-Y92 PolarHBondContact N-O 2.87Å; T90-Y92 PolarHBondContact O-N 2.68Å; T90-Y92 VanDerWaalsContact OG1-CB 3.29Å; T90-Y92 WeakPolarHBondContact OG1-CB 3.19Å; T90-Y92 PolarHBondContact OG1-N 2.77Å
93	V	91.1	Very high	87.2	Confident	71 Å²	71	43.4 Å²	43.4	43%	0.43	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	134	-178.7	171.8	0	0	0	0	109.7	L70 V84 G85 Q86	L70-V93 HydrophobicContact CD1-CB 4.49Å; L70-V93 HydrophobicContact CD1-CG1 3.88Å; L70-V93 HydrophobicContact CD1-CG2 3.78Å; V84-V93 HydrophobicContact CG1-CG1 4.17Å; G85-V93 WeakPolarHBondContact O-CA 3.4Å; Q86-V93 HydrophobicContact CB-CG2 4.02Å; Q86-V93 HydrophobicContact CG-CG2 3.78Å
94	G	91.9	Very high	85.7	Confident	7 Å²	7	43.7 Å²	43.7	7%	0.072	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	-175	179.7	0	0	0	0	0	112	D57 G85	D57-G94 CarbonylContact O-C 3.53Å; D57-G94 WeakPolarHBondContact O-CA 3.45Å; G85-G94 PolarHBondContact N-O 3.13Å; G85-G94 PolarHBondContact O-N 3.1Å
95	V	92.1	Very high	83.8	Confident	20 Å²	20	46.5 Å²	46.5	12%	0.121	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	154.1	177.2	-56.5	0	0	0	0	112.1	D57 E58 I59 W82 W83 V84	D57-V95 PolarHBondContact O-N 3.16Å; E58-V95 CarbonylContact C-O 3.58Å; E58-V95 WeakPolarHBondContact CA-O 3.12Å; E58-V95 HydrophobicContact CG-CG2 3.85Å; I59-V95 PolarHBondContact N-O 3.42Å; W82-V95 HydrophobicContact CE3-CB 4.12Å; W82-V95 HydrophobicContact CE3-CG2 3.77Å; W82-V95 HydrophobicContact CZ3-CG2 3.98Å; W83-V95 CarbonylContact O-C 3.38Å; W83-V95 VanDerWaalsContact O-CA 3.26Å; W83-V95 WeakPolarHBondContact O-CA 3.27Å; V84-V95 HydrophobicContact CG2-CG1 4.26Å
96	F	92	Very high	81.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.8	173.2	61.5	-86.6	0	0	0	110.3	V45 I59 L61 V67 I69 W82 W83 S98 V101	V45-F96 HydrophobicContact CG2-CZ 4.38Å; I59-F96 HydrophobicContact CD1-CD1 4.22Å; L61-F96 HydrophobicContact CD1-CB 4.16Å; L61-F96 HydrophobicContact CD1-CD2 4.21Å; L61-F96 HydrophobicContact CD1-CG 4.43Å; L61-F96 HydrophobicContact CD2-CB 4.37Å; L61-F96 HydrophobicContact CD2-CG 4.43Å; L61-F96 HydrophobicContact CG-CB 4.4Å; V67-F96 HydrophobicContact CG1-CD1 4.26Å; V67-F96 HydrophobicContact CG1-CE1 3.7Å; V67-F96 HydrophobicContact CG1-CZ 4.11Å; I69-F96 HydrophobicContact CG1-CZ 4.43Å; W82-F96 WeakPolarHBondContact CA-O 3.46Å; W83-F96 HydrophobicContact CB-CE1 4.26Å; W83-F96 HydrophobicContact CB-CE2 4.17Å; W83-F96 HydrophobicContact CB-CZ 3.85Å; W83-F96 HydrophobicContact CE3-CE2 4.14Å; W83-F96 HydrophobicContact CE3-CZ 4.28Å; W83-F96 PolarHBondContact N-O 3.1Å; W83-F96 PolarHBondContact O-N 2.9Å; F96-S98 PolarHBondContact O-N 3.31Å; F96-V101 HydrophobicContact CD2-CG1 3.89Å; F96-V101 HydrophobicContact CD2-CG2 4.47Å; F96-V101 HydrophobicContact CE2-CB 4.33Å; F96-V101 HydrophobicContact CE2-CG1 3.62Å; F96-V101 HydrophobicContact CE2-CG2 3.72Å
97	P	87.3	Confident	79.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.9	178.9	27.4	-35.3	0	0	0	111.7	Y51 G81 G99 Y100	Y51-P97 HydrophobicContact CD1-CG 4.33Å; Y51-P97 HydrophobicContact CD2-CG 3.75Å; Y51-P97 HydrophobicContact CE1-CG 4.3Å; Y51-P97 HydrophobicContact CE2-CG 3.71Å; Y51-P97 HydrophobicContact CG-CG 4.07Å; G81-P97 CarbonylContact O-C 3.49Å; G81-P97 WeakPolarHBondContact O-CA 3.36Å; P97-G99 VanDerWaalsContact C-N 3.29Å; P97-G99 PolarHBondContact O-N 3.05Å; P97-Y100 HydrophobicContact CB-CD2 3.64Å; P97-Y100 HydrophobicContact CB-CE2 3.97Å; P97-Y100 HydrophobicContact CG-CD2 3.31Å; P97-Y100 HydrophobicContact CG-CE2 3.7Å; P97-Y100 HydrophobicContact CG-CG 3.8Å; P97-Y100 PolarHBondContact O-N 2.96Å
98	S	88	Confident	76.9	Confident	23 Å²	23	55.4 Å²	55.4	16%	0.161	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-65.9	-28.8	-175.3	55.3	0	0	0	0	113.4	G81 W83 F96 Y100 V101	G81-S98 WeakPolarHBondContact CA-OG 3.3Å; G81-S98 PolarHBondContact O-N 3.41Å; G81-S98 PolarHBondContact O-OG 3.5Å; W83-S98 VanDerWaalsContact CE2-CB 3.45Å; F96-S98 PolarHBondContact O-N 3.31Å; S98-Y100 PolarHBondContact O-N 3.27Å; S98-V101 VanDerWaalsContact O-CG2 3.23Å; S98-V101 WeakPolarHBondContact O-CG2 3.48Å; S98-V101 PolarHBondContact O-N 3.03Å
99	G	81	Confident	74.5	Confident	30 Å²	30	57.1 Å²	57.1	31%	0.309	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-70	-5.2	176.4	0	0	0	0	0	115.4	P97	P97-G99 VanDerWaalsContact C-N 3.29Å; P97-G99 PolarHBondContact O-N 3.05Å
100	Y	85.8	Confident	72.2	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.027	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-98.7	-0.7	178.2	-70.7	-118.4	0	0	0	112.5	A47 I48 Y49 Y51 P97 S98 P158 D159	A47-Y100 CarbonylContact C-O 3.56Å; A47-Y100 VanDerWaalsContact CA-O 3.32Å; A47-Y100 WeakPolarHBondContact CA-O 3.29Å; I48-Y100 VanDerWaalsContact CG1-O 3.32Å; I48-Y100 WeakPolarHBondContact CG1-O 3.45Å; I48-Y100 PolarHBondContact N-O 2.04Å; Y49-Y100 HydrophobicContact CD2-CD1 4.49Å; Y49-Y100 PolarHBondContact N-O 2.87Å; Y51-Y100 AromaticContact CD2-CD1 3.9Å; Y51-Y100 HydrophobicContact CD2-CD1 3.9Å; Y51-Y100 AromaticContact CD2-CE1 3.67Å; Y51-Y100 HydrophobicContact CD2-CE1 3.67Å; Y51-Y100 HydrophobicContact CD2-CE2 4.44Å; Y51-Y100 HydrophobicContact CD2-CG 4.41Å; Y51-Y100 AromaticContact CD2-CZ 3.95Å; Y51-Y100 HydrophobicContact CG-CD1 4.35Å; P97-Y100 HydrophobicContact CB-CD2 3.64Å; P97-Y100 HydrophobicContact CB-CE2 3.97Å; P97-Y100 HydrophobicContact CG-CD2 3.31Å; P97-Y100 HydrophobicContact CG-CE2 3.7Å; P97-Y100 HydrophobicContact CG-CG 3.8Å; P97-Y100 PolarHBondContact O-N 2.96Å; S98-Y100 PolarHBondContact O-N 3.27Å; Y100-P158 WeakPolarHBondContact CE1-O 3.48Å; Y100-P158 VanDerWaalsContact CZ-O 3.29Å; Y100-P158 PolarHBondContact OH-O 3.35Å; Y100-P158 VanDerWaalsContact OH-O 3.06Å; Y100-D159 PolarHBondContact OH-OD1 3.25Å
101	V	86.1	Confident	69.3	Low	12 Å²	12	55.7 Å²	55.7	7%	0.073	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.5	179.1	-61	0	0	0	0	111.8	V45 T46 A47 L61 W83 F96 S98	V45-V101 HydrophobicContact CB-CB 4.02Å; V45-V101 HydrophobicContact CB-CG2 4.19Å; V45-V101 HydrophobicContact CG2-CB 3.79Å; V45-V101 HydrophobicContact CG2-CG1 3.99Å; V45-V101 HydrophobicContact CG2-CG2 3.86Å; T46-V101 CarbonylContact O-C 3.34Å; T46-V101 WeakPolarHBondContact O-CA 2.99Å; A47-V101 HydrophobicContact CB-CG1 4.4Å; L61-V101 HydrophobicContact CD1-CG1 4.06Å; W83-V101 HydrophobicContact CE3-CG2 3.96Å; W83-V101 HydrophobicContact CZ3-CG2 3.69Å; F96-V101 HydrophobicContact CD2-CG1 3.89Å; F96-V101 HydrophobicContact CD2-CG2 4.47Å; F96-V101 HydrophobicContact CE2-CB 4.33Å; F96-V101 HydrophobicContact CE2-CG1 3.62Å; F96-V101 HydrophobicContact CE2-CG2 3.72Å; S98-V101 VanDerWaalsContact O-CG2 3.23Å; S98-V101 WeakPolarHBondContact O-CG2 3.48Å; S98-V101 PolarHBondContact O-N 3.03Å
102	L	85.3	Confident	66.6	Low	63 Å²	63	59.4 Å²	59.4	33%	0.33	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.4	174.1	-160.1	99.4	0	0	0	110.1	V45 T46 I48 I107	V45-L102 WeakPolarHBondContact CA-O 3.37Å; V45-L102 WeakPolarHBondContact CB-O 3.43Å; T46-L102 PolarHBondContact N-O 3.25Å; T46-L102 PolarHBondContact O-N 3.41Å; I48-L102 HydrophobicContact CG2-CB 3.8Å; L102-I107 HydrophobicContact CD2-CD1 3.67Å; L102-I107 HydrophobicContact CD2-CG1 3.48Å; L102-I107 VanDerWaalsContact CD2-CG1 3.48Å
103	N	76.8	Confident	63.8	Low	23 Å²	23	61.3 Å²	61.3	12%	0.123	38%	0.381	C	S	.	.			trans	-81.3	139.4	172.7	-161.5	43.7	0	0	0	109.9	V45 D105 D106	V45-N103 HydrophobicContact CG1-CB 4.28Å; N103-D105 PolarHBondContact ND2-OD2 3.06Å; N103-D105 PolarHBondContact O-N 3.3Å; N103-D106 HydrophobicContact CB-CB 4.38Å; N103-D106 VanDerWaalsContact CB-CG 3.49Å; N103-D106 WeakPolarHBondContact CB-OD2 3.23Å; N103-D106 PolarHBondContact N-OD2 3.35Å; N103-D106 WeakPolarHBondContact O-CB 3.36Å; N103-D106 PolarHBondContact O-N 3.43Å; N103-D106 VanDerWaalsContact O-N 3.15Å
104	P	60.6	Low	60.6	Low	62 Å²	62	61.8 Å²	61.8	40%	0.403	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.2	175.8	-26.8	36.3	0	0	0	113.1	Y44 D106 I107	Y44-P104 WeakPolarHBondContact O-CD 3.44Å; Y44-P104 WeakPolarHBondContact O-CG 3.5Å; P104-D106 VanDerWaalsContact C-N 3.29Å; P104-D106 PolarHBondContact O-N 3.31Å; P104-I107 PolarHBondContact O-N 2.97Å
105	D	52.9	Low	57.4	Low	80 Å²	80	66 Å²	66	43%	0.428	43%	0.434	S	S	.	.	H	α-helix	trans	-69.8	-25.9	-178.5	-42.1	-50.1	0	0	0	112.6	N103 I107 A108 S109	N103-D105 PolarHBondContact ND2-OD2 3.06Å; N103-D105 PolarHBondContact O-N 3.3Å; D105-I107 PolarHBondContact O-N 3.41Å; D105-A108 PolarHBondContact O-N 2.81Å; D105-S109 PolarHBondContact O-N 2.75Å
106	D	50.6	Low	54.4	Low	99 Å²	99	72.2 Å²	72.2	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-68.8	-14.9	178.5	-58.1	-18.3	0	0	0	112.1	N103 P104	N103-D106 HydrophobicContact CB-CB 4.38Å; N103-D106 VanDerWaalsContact CB-CG 3.49Å; N103-D106 WeakPolarHBondContact CB-OD2 3.23Å; N103-D106 PolarHBondContact N-OD2 3.35Å; N103-D106 WeakPolarHBondContact O-CB 3.36Å; N103-D106 PolarHBondContact O-N 3.43Å; N103-D106 VanDerWaalsContact O-N 3.15Å; P104-D106 VanDerWaalsContact C-N 3.29Å; P104-D106 PolarHBondContact O-N 3.31Å
107	I	44	Very low	51.1	Low	113 Å²	113	80.4 Å²	80.4	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-86.7	-37.2	171	-52.9	-179.9	0	0	0	110.3	L102 P104 D105 S110	L102-I107 HydrophobicContact CD2-CD1 3.67Å; L102-I107 HydrophobicContact CD2-CG1 3.48Å; L102-I107 VanDerWaalsContact CD2-CG1 3.48Å; P104-I107 PolarHBondContact O-N 2.97Å; D105-I107 PolarHBondContact O-N 3.41Å; I107-S110 PolarHBondContact O-OG 3.36Å
108	A	34.6	Very low	48	Very low	73 Å²	73	88.5 Å²	88.5	60%	0.603	55%	0.545	S	S	*	.	H	α-helix	trans	-77.4	-23.7	-172.3	0	0	0	0	0	114	D105 S110	D105-A108 PolarHBondContact O-N 2.81Å; A108-S110 PolarHBondContact O-N 3.24Å
109	S	31.8	Very low	45.2	Very low	104 Å²	104	96.8 Å²	96.8	73%	0.727	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	26.1	-175.5	68.6	0	0	0	0	115.4	D105	D105-S109 PolarHBondContact O-N 2.75Å
110	S	28.3	Very low	42.4	Very low	100 Å²	100	99.9 Å²	99.9	70%	0.699	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-11.2	-175.4	61.2	0	0	0	0	115.6	I107 A108	I107-S110 PolarHBondContact O-OG 3.36Å; A108-S110 PolarHBondContact O-N 3.24Å
111	E	23.9	Very low	39.3	Very low	150 Å²	150	107 Å²	107	70%	0.701	64%	0.639	S	S	*	*			trans	-122	84.3	178	-70.9	-173.3	171.8	0	0	111.6	K146	E111-K146 IonicContact OE1-NZ 2.83Å; E111-K146 PolarHBondContact OE1-NZ 3.21Å; E111-K146 IonicContact OE2-NZ 3.99Å
112	S	27.9	Very low	36.3	Very low	115 Å²	115	111.5 Å²	111.5	80%	0.804	67%	0.672	S	S	*	*			trans	-154.6	128.9	159.2	60.2	0	0	0	0	112.7
113	P	27.6	Very low	33.4	Very low	135 Å²	135	116.8 Å²	116.8	88%	0.877	69%	0.692	S	S	*	*			trans	-104.9	125.3	-174.3	35.8	-31.2	0	0	0	115.3
114	G	23.5	Very low	30.9	Very low	81 Å²	81	123.6 Å²	123.6	84%	0.835	72%	0.723	S	S	*	*			trans	85.9	105.4	142.4	0	0	0	0	0	120.1
115	A	25.9	Very low	29.2	Very low	95 Å²	95	128.2 Å²	128.2	79%	0.785	74%	0.74	S	S	*	*			trans	-163	104.5	141.5	0	0	0	0	0	112.7
116	N	28.2	Very low	28	Very low	151 Å²	151	129.8 Å²	129.8	81%	0.807	75%	0.748	S	S	*	*			trans	45.9	104.7	149.5	-57.1	3.8	0	0	0	121.8
117	E	23	Very low	26.9	Very low	172 Å²	172	134.8 Å²	134.8	80%	0.804	77%	0.765	S	S	*	*				36	111.5	123	-56.4	-175.1	148.4	0	0	120.6
118	M	23.3	Very low	26	Very low	170 Å²	170	137.2 Å²	137.2	84%	0.837	77%	0.767	S	S	*	*				172.1	107.7	98.3	-92.5	-154.5	175.2	0	0	113.3
119	K	27.2	Very low	25.6	Very low	197 Å²	197	141 Å²	141	86%	0.857	78%	0.777	S	S	*	*			trans	154.6	108.3	131.5	-88	175.6	179.8	179.9	0	110.8
120	A	22.8	Very low	25.3	Very low	96 Å²	96	143.3 Å²	143.3	79%	0.793	78%	0.781	S	S	*	*			trans	-80.5	122.6	170	0	0	0	0	0	110.6
121	N	21.9	Very low	25.3	Very low	156 Å²	156	143.3 Å²	143.3	83%	0.834	78%	0.777	S	S	*	*				-176.9	149.2	129.2	-96.4	-35.4	0	0	0	111.4
122	S	22.3	Very low	25.5	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	78%	0.778	S	S	*	*	S	Bend	trans	55.4	85.5	177.9	60.4	0	0	0	0	117.2
123	F	24.7	Very low	25.8	Very low	174 Å²	174	141.6 Å²	141.6	76%	0.763	76%	0.763	S	S	*	*				-172.2	100.5	120.8	-122	-100.1	0	0	0	111.1	Q125	F123-Q125 HydrophobicContact CD1-CG 4.14Å; F123-Q125 HydrophobicContact CE1-CG 3.87Å
124	E	24.1	Very low	25.7	Very low	166 Å²	166	138.6 Å²	138.6	78%	0.776	76%	0.757	S	S	*	*			trans	-119.6	84.2	161.8	-86.4	-162.1	-159.8	0	0	110	N126	E124-N126 VanDerWaalsContact C-N 3.35Å; E124-N126 PolarHBondContact O-N 2.93Å; E124-N126 PolarHBondContact OE2-ND2 3.49Å
125	Q	25.5	Very low	25.9	Very low	159 Å²	159	141.2 Å²	141.2	74%	0.743	75%	0.75	S	S	*	*			trans	-89.4	76.7	160.5	-76	-171.2	-29.9	0	0	108.7	F123 K127	F123-Q125 HydrophobicContact CD1-CG 4.14Å; F123-Q125 HydrophobicContact CE1-CG 3.87Å; Q125-K127 PolarHBondContact O-N 3.45Å; Q125-K127 VanDerWaalsContact O-N 3.12Å
126	N	27.6	Very low	26	Very low	112 Å²	112	139.9 Å²	139.9	60%	0.599	75%	0.746	S	S	*	*			trans	-66	113.1	-179.1	-76.5	-39.9	0	0	0	111.2	E124 W128	E124-N126 VanDerWaalsContact C-N 3.35Å; E124-N126 PolarHBondContact O-N 2.93Å; E124-N126 PolarHBondContact OE2-ND2 3.49Å; N126-W128 PolarHBondContact O-N 2.89Å
127	K	26.5	Very low	25.8	Very low	205 Å²	205	140.4 Å²	140.4	89%	0.891	75%	0.748	S	S	*	*			trans	-53.7	121.4	176.1	-73.5	177.9	174.9	176.4	0	110.7	Q125 N129	Q125-K127 PolarHBondContact O-N 3.45Å; Q125-K127 VanDerWaalsContact O-N 3.12Å; K127-N129 PolarHBondContact O-N 3.04Å
128	W	25.5	Very low	26	Very low	163 Å²	163	139.8 Å²	139.8	62%	0.617	75%	0.751	S	S	*	*			trans	-87.4	95.3	162.8	-78.7	58.7	0	0	0	109.5	N126 M489 K493	N126-W128 PolarHBondContact O-N 2.89Å; W128-M489 HydrophobicContact CH2-SD 4.37Å; W128-K493 VanDerWaalsContact CH2-CE 3.42Å
129	N	26.8	Very low	26.2	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	75%	0.747	S	S	*	*			trans	-157.7	39	163.6	-109.7	-16.2	0	0	0	113.2	K127	K127-N129 PolarHBondContact O-N 3.04Å
130	D	25.2	Very low	26.1	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	75%	0.746	S	S	*	*			trans	-154.5	87.3	163.4	-103.1	-37	0	0	0	112.3
131	V	27.6	Very low	26.2	Very low	100 Å²	100	140.9 Å²	140.9	61%	0.606	75%	0.751	S	S	*	*			trans	-141.7	76.1	157.2	-172.6	0	0	0	0	107.8	F133	V131-F133 HydrophobicContact CG1-CD2 3.96Å; V131-F133 HydrophobicContact CG1-CE2 3.84Å; V131-F133 HydrophobicContact CG1-CZ 4.39Å
132	T	29	Very low	26.3	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	75%	0.751	S	S	*	*			trans	-85.6	109.3	163.9	-53.2	0	0	0	0	107.2	G134	T132-G134 PolarHBondContact O-N 3.33Å; T132-G134 VanDerWaalsContact O-N 3.1Å
133	F	32.8	Very low	26.5	Very low	110 Å²	110	142.9 Å²	142.9	48%	0.482	76%	0.756	S	S	.	*			trans	-70.8	103.8	173.4	-75.3	-94.6	0	0	0	109.3	V131 K496	V131-F133 HydrophobicContact CG1-CD2 3.96Å; V131-F133 HydrophobicContact CG1-CE2 3.84Å; V131-F133 HydrophobicContact CG1-CZ 4.39Å; F133-K496 VanDerWaalsContact CZ-CE 3.48Å
134	G	26.8	Very low	26.5	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	76%	0.757	S	S	*	*			trans	-69.5	133	163.3	0	0	0	0	0	109.9	T132	T132-G134 PolarHBondContact O-N 3.33Å; T132-G134 VanDerWaalsContact O-N 3.1Å
135	I	27.3	Very low	26.4	Very low	135 Å²	135	137.1 Å²	137.1	69%	0.692	76%	0.757	S	S	*	*			trans	-85.8	116	167	-59.2	174.5	0	0	0	106.5
136	G	26.7	Very low	26.5	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	76%	0.756	S	S	*	*			trans	-168.1	127.7	179.1	0	0	0	0	0	110.1
137	N	26	Very low	26.2	Very low	162 Å²	162	139.5 Å²	139.5	87%	0.866	77%	0.772	S	S	*	*			trans	-72.8	159.5	-178.4	-63.7	-11.7	0	0	0	111	T139	N137-T139 PolarHBondContact O-N 3.15Å
138	N	25.5	Very low	26.1	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	77%	0.771	S	S	*	*			trans	-45.8	119.6	-177.4	-67.7	-41.5	0	0	0	114.4
139	T	27.3	Very low	26	Very low	123 Å²	123	140.9 Å²	140.9	76%	0.755	79%	0.785	S	S	*	*				-170.8	147	107	29.7	0	0	0	0	113.9	N137	N137-T139 PolarHBondContact O-N 3.15Å
140	D	26	Very low	25.8	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	79%	0.789	S	S	*	*			trans	56	144.6	153	-60.8	-28.7	0	0	0	124.1
141	K	26	Very low	25.8	Very low	205 Å²	205	143 Å²	143	89%	0.891	79%	0.789	S	S	*	*			trans	-96.9	125	179.6	-59.2	171.2	-178.3	172.5	0	111
142	I	23.6	Very low	25.6	Very low	165 Å²	165	144.1 Å²	144.1	85%	0.846	80%	0.801	S	S	*	*			trans	-135.7	138.7	156.1	-61.8	-175.8	0	0	0	109.5
143	V	26.6	Very low	25.4	Very low	140 Å²	140	146.9 Å²	146.9	85%	0.848	81%	0.811	S	S	*	*			trans	-102.3	132.3	170.9	174.8	0	0	0	0	108.8
144	A	24.4	Very low	25.1	Very low	95 Å²	95	148.7 Å²	148.7	79%	0.785	83%	0.825	S	S	*	*			trans	-144.4	151.3	171.9	0	0	0	0	0	110.8
145	T	22.7	Very low	25	Very low	125 Å²	125	154.8 Å²	154.8	77%	0.767	83%	0.831	S	S	*	*			trans	-121.6	138.4	-165.4	50.8	0	0	0	0	114.6
146	K	26.3	Very low	24.9	Very low	170 Å²	170	157 Å²	157	74%	0.739	84%	0.835	S	S	*	*			trans	43.8	95.2	156.5	-69.1	179.8	-179.2	169.9	0	117.4	E111	E111-K146 IonicContact OE1-NZ 2.83Å; E111-K146 PolarHBondContact OE1-NZ 3.21Å; E111-K146 IonicContact OE2-NZ 3.99Å
147	T	21.4	Very low	24.9	Very low	151 Å²	151	159.3 Å²	159.3	93%	0.926	84%	0.841	S	S	*	*			trans	-131.4	160.6	137.8	43.5	0	0	0	0	109.6
148	K	24.9	Very low	25	Very low	200 Å²	200	153.4 Å²	153.4	87%	0.87	81%	0.812	S	S	*	*			trans	-98.2	139	179.7	-61.7	176.1	179.4	178.2	0	110.3
149	E	23.2	Very low	25.1	Very low	196 Å²	196	150.5 Å²	150.5	92%	0.916	80%	0.796	S	S	*	*			trans	-167.9	168	132.6	-110.1	161.5	-154	0	0	110.5
150	E	23.2	Very low	25.2	Very low	194 Å²	194	148.5 Å²	148.5	91%	0.907	79%	0.787	S	S	*	*			trans	-95.2	122	-162.4	-60.3	179.8	123.6	0	0	113.2
151	I	24	Very low	25.4	Very low	156 Å²	156	145 Å²	145	80%	0.8	77%	0.766	S	S	*	*			trans	-133.5	121.6	159.5	-58.8	-177.1	0	0	0	110.5	L153	I151-L153 PolarHBondContact O-N 2.84Å
152	S	23.8	Very low	25.6	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	74%	0.741	S	S	*	*			trans	-20.7	116.6	167.8	-50.8	0	0	0	0	116.6
153	L	25.7	Very low	25.9	Very low	178 Å²	178	133.8 Å²	133.8	93%	0.932	72%	0.718	S	S	*	*			trans	-110.7	143.4	167.7	-94.4	169.2	0	0	0	112	I151	I151-L153 PolarHBondContact O-N 2.84Å
154	D	25.6	Very low	26.1	Very low	147 Å²	147	130.6 Å²	130.6	79%	0.786	70%	0.696	S	S	*	*			trans	-82.4	161.5	-161.4	-143.5	-22.7	0	0	0	114.6	K156	D154-K156 PolarHBondContact O-N 3.49Å
155	K	24.4	Very low	26.2	Very low	202 Å²	202	132.6 Å²	132.6	88%	0.878	68%	0.684	S	S	*	*			trans	-68.6	96.8	-171.7	-62.4	170.9	-175.2	171.2	0	112.3
156	K	26	Very low	26.6	Very low	180 Å²	180	135.1 Å²	135.1	78%	0.783	69%	0.686	S	S	*	*			trans	-86.6	129.7	164.5	-70.6	-177.5	178.5	176.1	0	110.5	D154	D154-K156 PolarHBondContact O-N 3.49Å
157	S	26.5	Very low	27.3	Very low	117 Å²	117	128 Å²	128	82%	0.818	66%	0.662	S	S	*	*			trans	-76.9	131.5	-173.7	43.4	0	0	0	0	113.1
158	P	27.3	Very low	28.7	Very low	37 Å²	37	128.7 Å²	128.7	24%	0.24	65%	0.654	C	S	.	*			trans	-110.4	76.4	-179.9	38.9	-30.1	0	0	0	112.7	Y49 Y100	Y49-P158 HydrophobicContact CD1-CB 3.34Å; Y49-P158 HydrophobicContact CD1-CG 3.61Å; Y49-P158 HydrophobicContact CD2-CB 3.32Å; Y49-P158 HydrophobicContact CD2-CG 4.27Å; Y49-P158 HydrophobicContact CE1-CB 3.68Å; Y49-P158 HydrophobicContact CE1-CG 4.27Å; Y49-P158 HydrophobicContact CE2-CB 3.65Å; Y49-P158 HydrophobicContact CG-CB 3.15Å; Y49-P158 HydrophobicContact CG-CG 3.61Å; Y100-P158 WeakPolarHBondContact CE1-O 3.48Å; Y100-P158 VanDerWaalsContact CZ-O 3.29Å; Y100-P158 PolarHBondContact OH-O 3.35Å; Y100-P158 VanDerWaalsContact OH-O 3.06Å
159	D	28.4	Very low	30.9	Very low	99 Å²	99	120.3 Å²	120.3	53%	0.529	62%	0.619	S	S	.	*			trans	-129.2	84.2	167.3	-88.8	-42.8	0	0	0	109.5	Y100 R230	Y100-D159 PolarHBondContact OH-OD1 3.25Å; D159-R230 PolarHBondContact O-NH1 2.86Å; D159-R230 PolarHBondContact O-NH2 2.98Å
160	S	29.8	Very low	33.8	Very low	81 Å²	81	113.9 Å²	113.9	57%	0.566	59%	0.587	S	S	*	*			trans	-155.9	35.8	-176.7	65.7	0	0	0	0	116.8
161	E	29.3	Very low	36.7	Very low	85 Å²	85	109.5 Å²	109.5	40%	0.397	57%	0.574	S	S	.	*			trans	-155.8	104.4	155.8	-124.8	172.9	-166	0	0	113.4	I163	E161-I163 HydrophobicContact CG-CD1 4.44Å; E161-I163 HydrophobicContact CG-CG1 4.4Å
162	V	30.6	Very low	39.8	Very low	60 Å²	60	102.2 Å²	102.2	36%	0.364	54%	0.536	S	S	.	.			trans	-139.3	91.5	164.6	-179.6	0	0	0	0	107.8	L164	V162-L164 PolarHBondContact O-N 3.34Å
163	I	29.5	Very low	42.8	Very low	73 Å²	73	99 Å²	99	37%	0.374	51%	0.512	S	S	.	.			trans	-84.2	101.5	-175.9	-59.6	177.5	0	0	0	109.7	E161 R165	E161-I163 HydrophobicContact CG-CD1 4.44Å; E161-I163 HydrophobicContact CG-CG1 4.4Å; I163-R165 VanDerWaalsContact C-N 3.32Å; I163-R165 HydrophobicContact CG2-CG 4.37Å; I163-R165 PolarHBondContact O-N 2.87Å
164	L	31.1	Very low	45.7	Very low	74 Å²	74	91.2 Å²	91.2	39%	0.387	47%	0.473	S	S	.	.			trans	-72.2	78.3	177.1	-70.1	175.2	0	0	0	112.3	V162 R170	V162-L164 PolarHBondContact O-N 3.34Å; L164-R170 HydrophobicContact CD1-CB 4.15Å
165	R	26.5	Very low	48.6	Very low	137 Å²	137	89.9 Å²	89.9	52%	0.517	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	144.6	167.9	-79.3	-161.2	169.8	-149.9	-2	111.2	E80 I163	E80-R165 HydrophobicContact CB-CG 4.27Å; E80-R165 IonicContact OE1-CZ 2.66Å; E80-R165 IonicContact OE1-NE 3.06Å; E80-R165 IonicContact OE1-NH1 3.12Å; E80-R165 IonicContact OE1-NH2 2.94Å; E80-R165 PolarHBondContact OE1-NH2 3.15Å; E80-R165 IonicContact OE2-CZ 2.75Å; E80-R165 IonicContact OE2-NE 3.55Å; E80-R165 PolarHBondContact OE2-NE 3.39Å; E80-R165 IonicContact OE2-NH2 3.93Å; E80-R165 PolarHBondContact OE2-NH2 3.18Å; I163-R165 VanDerWaalsContact C-N 3.32Å; I163-R165 HydrophobicContact CG2-CG 4.37Å; I163-R165 PolarHBondContact O-N 2.87Å
166	H	30.7	Very low	51.6	Low	177 Å²	177	83.1 Å²	83.1	82%	0.819	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	0.6	-174.2	-54.3	99.8	0	0	0	117.9	H168	H166-H168 PolarHBondContact O-N 3.12Å
167	G	41.2	Very low	54.6	Low	22 Å²	22	75.4 Å²	75.4	23%	0.227	41%	0.41	C	S	.	.	S	Bend	trans	67.8	7.2	169.2	0	0	0	0	0	115.2	V169	G167-V169 PolarHBondContact O-N 3.4Å; G167-V169 VanDerWaalsContact O-N 3.13Å
168	H	51.8	Low	57.3	Low	164 Å²	164	73.9 Å²	73.9	76%	0.759	40%	0.395	S	S	*	.			trans	-64.2	107.2	157.7	-88.3	1.5	0	0	0	108.5	H166 R170	H166-H168 PolarHBondContact O-N 3.12Å; H168-R170 PolarHBondContact O-N 3.11Å
169	V	71.2	Confident	59.4	Low	24 Å²	24	79.3 Å²	79.3	15%	0.145	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-61.5	130.9	165.9	176.2	0	0	0	0	107.9	G167 T171 A217 C221 F231 I234	G167-V169 PolarHBondContact O-N 3.4Å; G167-V169 VanDerWaalsContact O-N 3.13Å; V169-T171 PolarHBondContact O-N 3.12Å; V169-T171 VanDerWaalsContact O-N 3.16Å; V169-A217 HydrophobicContact CG1-CB 4.27Å; V169-A217 HydrophobicContact CG2-CB 3.95Å; V169-C221 HydrophobicContact CG2-CB 4.09Å; V169-F231 HydrophobicContact CG1-CE1 3.76Å; V169-F231 HydrophobicContact CG1-CZ 3.66Å; V169-I234 HydrophobicContact CB-CD1 4.13Å; V169-I234 HydrophobicContact CG1-CB 4.16Å; V169-I234 HydrophobicContact CG1-CD1 3.65Å; V169-I234 HydrophobicContact CG1-CG1 3.68Å; V169-I234 HydrophobicContact CG2-CD1 4.46Å
170	R	83.4	Confident	61.8	Low	62 Å²	62	78 Å²	78	23%	0.234	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-57.7	120	175.6	-177.7	178.4	-173.2	153.6	3.3	109	L164 H168 I172 Y232 G233 I234	L164-R170 HydrophobicContact CD1-CB 4.15Å; H168-R170 PolarHBondContact O-N 3.11Å; R170-I172 HydrophobicContact CG-CG1 4.33Å; R170-Y232 WeakPolarHBondContact CD-O 3.39Å; R170-G233 CarbonylContact O-C 3.52Å; R170-G233 WeakPolarHBondContact O-CA 3.42Å; R170-I234 PolarHBondContact O-N 3.18Å
171	T	85	Confident	64.4	Low	102 Å²	102	79.4 Å²	79.4	63%	0.626	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	123.5	168.9	-55.8	0	0	0	0	108.7	V169 I234	V169-T171 PolarHBondContact O-N 3.12Å; V169-T171 VanDerWaalsContact O-N 3.16Å; T171-I234 CarbonylContact C-O 3.56Å; T171-I234 VanDerWaalsContact CA-O 3.3Å; T171-I234 WeakPolarHBondContact CA-O 3.5Å
172	I	88.9	Confident	67	Low	2 Å²	2	79.2 Å²	79.2	1%	0.01	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.7	174.1	-66.5	169.2	0	0	0	107.4	R170 E176 L177 W196 I234 C235 V246	R170-I172 HydrophobicContact CG-CG1 4.33Å; I172-E176 HydrophobicContact CG2-CB 4.4Å; I172-L177 HydrophobicContact CG2-CD2 3.89Å; I172-W196 HydrophobicContact CD1-CD2 4.2Å; I172-W196 HydrophobicContact CD1-CE3 4.42Å; I172-W196 HydrophobicContact CD1-CH2 4.15Å; I172-W196 HydrophobicContact CD1-CZ2 3.91Å; I172-W196 HydrophobicContact CD1-CZ3 4.4Å; I172-W196 HydrophobicContact CG1-CZ2 4.11Å; I172-W196 HydrophobicContact CG2-CG 4.44Å; I172-I234 PolarHBondContact N-O 2.92Å; I172-C235 WeakPolarHBondContact O-CA 3.29Å; I172-V246 HydrophobicContact CB-CG2 4.42Å; I172-V246 HydrophobicContact CD1-CB 3.9Å; I172-V246 HydrophobicContact CD1-CG1 3.91Å; I172-V246 HydrophobicContact CD1-CG2 3.95Å
173	P	86.6	Confident	69.5	Low	56 Å²	56	78.6 Å²	78.6	36%	0.364	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	139.3	174.6	-20.2	32.2	0	0	0	111.1	T175 E176	P173-T175 PolarHBondContact O-N 3.04Å; P173-T175 VanDerWaalsContact O-N 3.16Å; P173-E176 HydrophobicContact CB-CG 4.35Å; P173-E176 HydrophobicContact CG-CG 4.26Å; P173-E176 PolarHBondContact O-N 3.34Å
174	A	85.9	Confident	71.7	Confident	14 Å²	14	75.1 Å²	75.1	12%	0.116	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-60	-26.8	175.1	0	0	0	0	0	112.6	E176 L177 C235 L237	A174-E176 PolarHBondContact O-N 3.48Å; A174-L177 WeakPolarHBondContact O-CB 3.39Å; A174-L177 PolarHBondContact O-N 3.18Å; A174-C235 VanDerWaalsContact CA-SG 3.59Å; A174-L237 HydrophobicContact CB-CD2 4.2Å
175	T	86.1	Confident	73.6	Confident	120 Å²	120	73.6 Å²	73.6	74%	0.736	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-69.1	-12.6	174.1	52	0	0	0	0	114.8	P173 L177	P173-T175 PolarHBondContact O-N 3.04Å; P173-T175 VanDerWaalsContact O-N 3.16Å; T175-L177 VanDerWaalsContact C-N 3.35Å
176	E	88.6	Confident	75.4	Confident	59 Å²	59	68.3 Å²	68.3	28%	0.276	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-87.3	-4	168	-63.9	-168.4	-161.6	0	0	112.7	I172 P173 A174 W196 R197	I172-E176 HydrophobicContact CG2-CB 4.4Å; P173-E176 HydrophobicContact CB-CG 4.35Å; P173-E176 HydrophobicContact CG-CG 4.26Å; P173-E176 PolarHBondContact O-N 3.34Å; A174-E176 PolarHBondContact O-N 3.48Å; E176-W196 PolarHBondContact OE2-NE1 3.25Å; E176-R197 VanDerWaalsContact CD-NH2 3.29Å; E176-R197 IonicContact OE1-CZ 2.75Å; E176-R197 IonicContact OE1-NH2 2.68Å; E176-R197 PolarHBondContact OE1-NH2 3Å; E176-R197 IonicContact OE2-CZ 3.23Å; E176-R197 VanDerWaalsContact OE2-CZ 3.25Å; E176-R197 IonicContact OE2-NE 3.75Å; E176-R197 PolarHBondContact OE2-NE 3.36Å; E176-R197 IonicContact OE2-NH2 2.77Å; E176-R197 PolarHBondContact OE2-NH2 2.88Å
177	L	87.7	Confident	76.8	Confident	18 Å²	18	62.6 Å²	62.6	9%	0.094	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.5	-175.6	-51.1	-180	0	0	0	111.6	I172 A174 T175 W196 I201 L203 C235 L237	I172-L177 HydrophobicContact CG2-CD2 3.89Å; A174-L177 WeakPolarHBondContact O-CB 3.39Å; A174-L177 PolarHBondContact O-N 3.18Å; T175-L177 VanDerWaalsContact C-N 3.35Å; L177-W196 HydrophobicContact CD2-CB 3.95Å; L177-W196 HydrophobicContact CD2-CG 4.14Å; L177-I201 HydrophobicContact CD2-CD1 3.73Å; L177-L203 HydrophobicContact CD1-CD1 3.98Å; L177-L203 HydrophobicContact CD1-CD2 3.67Å; L177-L203 HydrophobicContact CD1-CG 4.46Å; L177-C235 HydrophobicContact CD1-CB 3.98Å; L177-C235 WeakPolarHBondContact CD1-SG 3.43Å; L177-L237 HydrophobicContact CD1-CD2 4.31Å
178	V	84.6	Confident	77.9	Confident	86 Å²	86	63 Å²	63	52%	0.521	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.2	-179.6	-179.1	0	0	0	0	110.6	L195	V178-L195 HydrophobicContact CB-CB 4.22Å; V178-L195 PolarHBondContact N-O 3.29Å; V178-L195 PolarHBondContact O-N 2.66Å
179	Q	70.1	Confident	79	Confident	150 Å²	150	55.3 Å²	55.3	70%	0.701	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47	87.7	169.1	-170.7	177.7	-10.9	0	0	116.3	Q181	Q179-Q181 PolarHBondContact O-N 3.41Å
180	Q	78.7	Confident	79.6	Confident	73 Å²	73	57.8 Å²	57.8	34%	0.341	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	92.2	-178.8	-61.4	-176.3	16.3	0	0	112.7	Y192 R193 L203	Q180-Y192 HydrophobicContact CB-CD1 4.14Å; Q180-Y192 HydrophobicContact CB-CG 4.34Å; Q180-R193 CarbonylContact C-O 3.46Å; Q180-R193 VanDerWaalsContact CA-O 3.3Å; Q180-R193 WeakPolarHBondContact CA-O 3.37Å; Q180-L203 HydrophobicContact CG-CD1 3.92Å
181	Q	85.3	Confident	79.7	Confident	110 Å²	110	55.1 Å²	55.1	51%	0.514	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	121.4	173.6	-178.6	-174.8	16.8	0	0	110.9	Q179 I183 Y192 R193	Q179-Q181 PolarHBondContact O-N 3.41Å; Q181-I183 PolarHBondContact O-N 2.72Å; Q181-Y192 CarbonylContact O-C 3.59Å; Q181-Y192 WeakPolarHBondContact O-CA 3.35Å; Q181-R193 HydrophobicContact CB-CB 4.39Å; Q181-R193 PolarHBondContact N-O 2.83Å; Q181-R193 PolarHBondContact O-N 3.17Å
182	F	84.5	Confident	79.9	Confident	81 Å²	81	52.8 Å²	52.8	36%	0.355	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	123.4	174.9	179.1	-103.1	0	0	0	111.9	G184 K190 Y192	F182-G184 VanDerWaalsContact CE2-C 3.41Å; F182-G184 WeakPolarHBondContact CE2-O 3.37Å; F182-G184 VanDerWaalsContact CZ-CA 3.43Å; F182-G184 WeakPolarHBondContact CZ-O 3.22Å; F182-K190 HydrophobicContact CE2-CB 4.16Å; F182-K190 HydrophobicContact CE2-CD 4.46Å; F182-K190 HydrophobicContact CE2-CG 4.38Å; F182-Y192 HydrophobicContact CB-CD1 3.97Å; F182-Y192 HydrophobicContact CB-CE1 3.91Å; F182-Y192 HydrophobicContact CD2-CD1 4.38Å; F182-Y192 AromaticContact CD2-CE1 3.94Å; F182-Y192 HydrophobicContact CD2-CE1 3.94Å; F182-Y192 HydrophobicContact CG-CE1 4.43Å
183	I	82.2	Confident	80.1	Confident	46 Å²	46	56.4 Å²	56.4	24%	0.236	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-35.9	175.9	-24.3	161	0	0	0	110.9	Q181 V191 R193 Y249 C354	Q181-I183 PolarHBondContact O-N 2.72Å; I183-V191 HydrophobicContact CD1-CB 4.4Å; I183-V191 HydrophobicContact CD1-CG1 3.92Å; I183-V191 PolarHBondContact N-O 2.71Å; I183-R193 HydrophobicContact CD1-CB 4.2Å; I183-R193 HydrophobicContact CG1-CB 4.03Å; I183-R193 VanDerWaalsContact CG1-N 3.27Å; I183-Y249 HydrophobicContact CD1-CD2 4.16Å; I183-Y249 HydrophobicContact CD1-CE2 3.67Å; I183-Y249 HydrophobicContact CG1-CE2 4.36Å; I183-C354 HydrophobicContact CB-CB 4.31Å; I183-C354 HydrophobicContact CG2-CB 4.41Å; I183-C354 WeakPolarHBondContact CG2-SG 3.35Å; I183-C354 PolarHBondContact O-SG 3.42Å
184	G	75	Confident	80.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.5	-173.7	179.2	0	0	0	0	0	114.2	F182 K190 V191	F182-G184 VanDerWaalsContact CE2-C 3.41Å; F182-G184 WeakPolarHBondContact CE2-O 3.37Å; F182-G184 VanDerWaalsContact CZ-CA 3.43Å; F182-G184 WeakPolarHBondContact CZ-O 3.22Å; G184-K190 CarbonylContact O-C 3.44Å; G184-V191 PolarHBondContact N-O 2.94Å; G184-V191 PolarHBondContact O-N 3.16Å
185	S	71.3	Confident	80.6	Confident	43 Å²	43	56 Å²	56	30%	0.301	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	170.4	178.7	57.6	0	0	0	0	110.4	G189 V352	S185-G189 CarbonylContact C-O 3.48Å; S185-G189 VanDerWaalsContact CA-O 3.23Å; S185-G189 WeakPolarHBondContact CA-O 3.3Å; S185-G189 WeakPolarHBondContact CB-O 3.39Å; S185-V352 VanDerWaalsContact O-CG1 3.23Å; S185-V352 WeakPolarHBondContact O-CG1 3.26Å
186	G	63.8	Low	80.9	Confident	25 Å²	25	51.1 Å²	51.1	26%	0.258	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-163	174.3	0	0	0	0	0	111	F188 G189	G186-F188 PolarHBondContact O-N 3.39Å; G186-G189 PolarHBondContact N-O 3.31Å; G186-G189 PolarHBondContact O-N 3.13Å; G186-G189 VanDerWaalsContact O-N 3.15Å
187	A	60.4	Low	80.9	Confident	57 Å²	57	53.7 Å²	53.7	47%	0.471	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-7.3	-167	0	0	0	0	0	116.9
188	F	65.2	Low	80.9	Confident	32 Å²	32	62 Å²	62	14%	0.14	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-3.2	-177.7	-54.7	-71.1	0	0	0	113.7	G186 F206 M385	G186-F188 PolarHBondContact O-N 3.39Å; F188-F206 HydrophobicContact CB-CD1 4.42Å; F188-F206 HydrophobicContact CB-CE1 4.19Å; F188-F206 WeakPolarHBondContact O-CD1 3.38Å; F188-M385 HydrophobicContact CE1-SD 4.47Å; F188-M385 HydrophobicContact CZ-CG 4.08Å; F188-M385 HydrophobicContact CZ-SD 4.21Å
189	G	74.2	Confident	81.1	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.8	-158.4	-179.3	0	0	0	0	0	115.1	S185 G186 V205 D207	S185-G189 CarbonylContact C-O 3.48Å; S185-G189 VanDerWaalsContact CA-O 3.23Å; S185-G189 WeakPolarHBondContact CA-O 3.3Å; S185-G189 WeakPolarHBondContact CB-O 3.39Å; G186-G189 PolarHBondContact N-O 3.31Å; G186-G189 PolarHBondContact O-N 3.13Å; G186-G189 VanDerWaalsContact O-N 3.15Å; G189-V205 CarbonylContact C-O 3.46Å; G189-V205 WeakPolarHBondContact CA-O 3.31Å; G189-D207 WeakPolarHBondContact CA-OD2 3.38Å
190	K	83.8	Confident	82.3	Confident	76 Å²	76	55.6 Å²	55.6	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	146	-175.5	-57	-174	-175.6	84.6	0	110.3	F182 G184 Y192 K204 V205 D207	F182-K190 HydrophobicContact CE2-CB 4.16Å; F182-K190 HydrophobicContact CE2-CD 4.46Å; F182-K190 HydrophobicContact CE2-CG 4.38Å; G184-K190 CarbonylContact O-C 3.44Å; K190-Y192 HydrophobicContact CB-CD2 4.45Å; K190-Y192 HydrophobicContact CB-CE2 3.6Å; K190-Y192 WeakPolarHBondContact CD-OH 3.34Å; K190-K204 CarbonylContact O-C 3.59Å; K190-K204 WeakPolarHBondContact O-CA 3.47Å; K190-V205 PolarHBondContact N-O 3.45Å; K190-V205 PolarHBondContact O-N 3.34Å; K190-D207 IonicContact NZ-OD1 3.22Å; K190-D207 PolarHBondContact NZ-OD1 2.82Å; K190-D207 IonicContact NZ-OD2 3.68Å
191	V	86.7	Confident	83	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.2	179.5	-157.7	0	0	0	0	109.9	I183 G184 A202 L203 K204 L355	I183-V191 HydrophobicContact CD1-CB 4.4Å; I183-V191 HydrophobicContact CD1-CG1 3.92Å; I183-V191 PolarHBondContact N-O 2.71Å; G184-V191 PolarHBondContact N-O 2.94Å; G184-V191 PolarHBondContact O-N 3.16Å; V191-A202 HydrophobicContact CG1-CB 4.42Å; V191-L203 CarbonylContact C-O 3.56Å; V191-L203 VanDerWaalsContact CA-O 3.3Å; V191-L203 WeakPolarHBondContact CA-O 3.17Å; V191-K204 HydrophobicContact CG1-CB 4.48Å; V191-L355 HydrophobicContact CG2-CD1 4.43Å; V191-L355 HydrophobicContact CG2-CD2 3.4Å; V191-L355 VanDerWaalsContact CG2-CD2 3.4Å; V191-L355 HydrophobicContact CG2-CG 3.74Å
192	Y	89.2	Confident	83.3	Confident	53 Å²	53	47.4 Å²	47.4	21%	0.208	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	147	178.2	-57.4	-102.3	0	0	0	109.7	Q180 Q181 F182 K190 A202 L203 V205	Q180-Y192 HydrophobicContact CB-CD1 4.14Å; Q180-Y192 HydrophobicContact CB-CG 4.34Å; Q181-Y192 CarbonylContact O-C 3.59Å; Q181-Y192 WeakPolarHBondContact O-CA 3.35Å; F182-Y192 HydrophobicContact CB-CD1 3.97Å; F182-Y192 HydrophobicContact CB-CE1 3.91Å; F182-Y192 HydrophobicContact CD2-CD1 4.38Å; F182-Y192 AromaticContact CD2-CE1 3.94Å; F182-Y192 HydrophobicContact CD2-CE1 3.94Å; F182-Y192 HydrophobicContact CG-CE1 4.43Å; K190-Y192 HydrophobicContact CB-CD2 4.45Å; K190-Y192 HydrophobicContact CB-CE2 3.6Å; K190-Y192 WeakPolarHBondContact CD-OH 3.34Å; Y192-A202 CarbonylContact O-C 3.56Å; Y192-A202 WeakPolarHBondContact O-CA 3.35Å; Y192-L203 PolarHBondContact N-O 3.44Å; Y192-L203 PolarHBondContact O-N 3.01Å; Y192-V205 HydrophobicContact CD2-CG2 3.75Å; Y192-V205 HydrophobicContact CE2-CB 4.26Å; Y192-V205 HydrophobicContact CE2-CG2 3.85Å
193	R	92.3	Very high	83.6	Confident	78 Å²	78	43.5 Å²	43.5	29%	0.294	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.4	161.1	179.4	-175.5	179.1	-165.2	1.3	106.7	Q180 Q181 I183 D200 I201 Y249	Q180-R193 CarbonylContact C-O 3.46Å; Q180-R193 VanDerWaalsContact CA-O 3.3Å; Q180-R193 WeakPolarHBondContact CA-O 3.37Å; Q181-R193 HydrophobicContact CB-CB 4.39Å; Q181-R193 PolarHBondContact N-O 2.83Å; Q181-R193 PolarHBondContact O-N 3.17Å; I183-R193 HydrophobicContact CD1-CB 4.2Å; I183-R193 HydrophobicContact CG1-CB 4.03Å; I183-R193 VanDerWaalsContact CG1-N 3.27Å; R193-D200 IonicContact CZ-OD1 2.63Å; R193-D200 VanDerWaalsContact CZ-OD1 3.25Å; R193-D200 IonicContact CZ-OD2 3.25Å; R193-D200 IonicContact NE-OD1 2.68Å; R193-D200 PolarHBondContact NE-OD1 3.18Å; R193-D200 IonicContact NE-OD2 2.77Å; R193-D200 VanDerWaalsContact NH2-CG 3.25Å; R193-D200 IonicContact NH2-OD1 3.96Å; R193-D200 PolarHBondContact NH2-OD1 3.37Å; R193-D200 IonicContact NH2-OD2 3.98Å; R193-D200 PolarHBondContact NH2-OD2 3.24Å; R193-I201 WeakPolarHBondContact CA-O 3.37Å; R193-Y249 HydrophobicContact CB-CD2 3.97Å; R193-Y249 HydrophobicContact CB-CE2 3.64Å; R193-Y249 HydrophobicContact CG-CD2 3.76Å; R193-Y249 HydrophobicContact CG-CE2 3.65Å; R193-Y249 HydrophobicContact CG-CG 4.31Å
194	G	91.4	Very high	83.8	Confident	2 Å²	2	41.4 Å²	41.4	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	176.5	171.5	0	0	0	0	0	111.1	I201	G194-I201 VanDerWaalsContact C-CG1 3.43Å; G194-I201 PolarHBondContact N-O 3.42Å; G194-I201 WeakPolarHBondContact O-CG1 3.3Å; G194-I201 PolarHBondContact O-N 2.88Å
195	L	92.7	Very high	84.4	Confident	60 Å²	60	41.9 Å²	41.9	31%	0.314	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.8	167.2	-70.1	164	0	0	0	108.9	V178 Q199	V178-L195 HydrophobicContact CB-CB 4.22Å; V178-L195 PolarHBondContact N-O 3.29Å; V178-L195 PolarHBondContact O-N 2.66Å; L195-Q199 WeakPolarHBondContact CA-O 3.46Å
196	W	91.8	Very high	84.8	Confident	17 Å²	17	40 Å²	40	6%	0.064	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	116.2	172	172.7	62.9	0	0	0	108.6	I172 E176 L177 E198 Q199 I201 Y232	I172-W196 HydrophobicContact CD1-CD2 4.2Å; I172-W196 HydrophobicContact CD1-CE3 4.42Å; I172-W196 HydrophobicContact CD1-CH2 4.15Å; I172-W196 HydrophobicContact CD1-CZ2 3.91Å; I172-W196 HydrophobicContact CD1-CZ3 4.4Å; I172-W196 HydrophobicContact CG1-CZ2 4.11Å; I172-W196 HydrophobicContact CG2-CG 4.44Å; E176-W196 PolarHBondContact OE2-NE1 3.25Å; L177-W196 HydrophobicContact CD2-CB 3.95Å; L177-W196 HydrophobicContact CD2-CG 4.14Å; W196-E198 VanDerWaalsContact C-N 3.31Å; W196-E198 PolarHBondContact O-N 3.4Å; W196-Q199 PolarHBondContact N-O 3.2Å; W196-Q199 WeakPolarHBondContact O-CB 3.44Å; W196-Q199 PolarHBondContact O-N 3.43Å; W196-I201 HydrophobicContact CB-CD1 3.59Å; W196-I201 HydrophobicContact CB-CG1 4.15Å; W196-I201 HydrophobicContact CB-CG2 4.11Å; W196-Y232 HydrophobicContact CE3-CG 4.45Å; W196-Y232 HydrophobicContact CZ3-CD1 4.04Å; W196-Y232 HydrophobicContact CZ3-CG 4.11Å
197	R	88.8	Confident	85.1	Confident	113 Å²	113	43 Å²	43	43%	0.426	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	51.3	-175.5	-56.7	178.5	-179.2	-143.3	-3.5	112	E176 Q199	E176-R197 VanDerWaalsContact CD-NH2 3.29Å; E176-R197 IonicContact OE1-CZ 2.75Å; E176-R197 IonicContact OE1-NH2 2.68Å; E176-R197 PolarHBondContact OE1-NH2 3Å; E176-R197 IonicContact OE2-CZ 3.23Å; E176-R197 VanDerWaalsContact OE2-CZ 3.25Å; E176-R197 IonicContact OE2-NE 3.75Å; E176-R197 PolarHBondContact OE2-NE 3.36Å; E176-R197 IonicContact OE2-NH2 2.77Å; E176-R197 PolarHBondContact OE2-NH2 2.88Å; R197-Q199 PolarHBondContact O-N 2.92Å
198	E	87	Confident	85.2	Confident	192 Å²	192	46.2 Å²	46.2	90%	0.897	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	-10.6	-176.1	-57.1	178.8	179.7	0	0	116.1	W196	W196-E198 VanDerWaalsContact C-N 3.31Å; W196-E198 PolarHBondContact O-N 3.4Å
199	Q	89.9	Confident	84.7	Confident	83 Å²	83	48 Å²	48	39%	0.388	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.7	175.7	-179.6	55	53.8	0	0	112	L195 W196 R197	L195-Q199 WeakPolarHBondContact CA-O 3.46Å; W196-Q199 PolarHBondContact N-O 3.2Å; W196-Q199 WeakPolarHBondContact O-CB 3.44Å; W196-Q199 PolarHBondContact O-N 3.43Å; R197-Q199 PolarHBondContact O-N 2.92Å
200	D	93.3	Very high	83.9	Confident	19 Å²	19	52.2 Å²	52.2	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	129.2	168.8	-102.9	-46.2	0	0	0	111.2	R193 Y251	R193-D200 IonicContact CZ-OD1 2.63Å; R193-D200 VanDerWaalsContact CZ-OD1 3.25Å; R193-D200 IonicContact CZ-OD2 3.25Å; R193-D200 IonicContact NE-OD1 2.68Å; R193-D200 PolarHBondContact NE-OD1 3.18Å; R193-D200 IonicContact NE-OD2 2.77Å; R193-D200 VanDerWaalsContact NH2-CG 3.25Å; R193-D200 IonicContact NH2-OD1 3.96Å; R193-D200 PolarHBondContact NH2-OD1 3.37Å; R193-D200 IonicContact NH2-OD2 3.98Å; R193-D200 PolarHBondContact NH2-OD2 3.24Å; D200-Y251 WeakPolarHBondContact CB-OH 3.43Å; D200-Y251 VanDerWaalsContact CG-OH 3.3Å; D200-Y251 WeakPolarHBondContact OD2-CE1 3.31Å; D200-Y251 PolarHBondContact OD2-OH 3.43Å
201	I	93.9	Very high	82.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	154	-176.6	54.1	159	0	0	0	112.8	L177 R193 G194 W196 L203 Y232 V246 M247	L177-I201 HydrophobicContact CD2-CD1 3.73Å; R193-I201 WeakPolarHBondContact CA-O 3.37Å; G194-I201 VanDerWaalsContact C-CG1 3.43Å; G194-I201 PolarHBondContact N-O 3.42Å; G194-I201 WeakPolarHBondContact O-CG1 3.3Å; G194-I201 PolarHBondContact O-N 2.88Å; W196-I201 HydrophobicContact CB-CD1 3.59Å; W196-I201 HydrophobicContact CB-CG1 4.15Å; W196-I201 HydrophobicContact CB-CG2 4.11Å; I201-L203 HydrophobicContact CD1-CD1 3.93Å; I201-L203 HydrophobicContact CD1-CG 4Å; I201-Y232 HydrophobicContact CG2-CD2 3.9Å; I201-Y232 HydrophobicContact CG2-CE2 3.82Å; I201-V246 HydrophobicContact CB-CG1 4.18Å; I201-V246 HydrophobicContact CD1-CG1 3.68Å; I201-V246 HydrophobicContact CG2-CG1 4.13Å; I201-M247 CarbonylContact C-O 3.59Å; I201-M247 VanDerWaalsContact CA-O 3.31Å; I201-M247 WeakPolarHBondContact CA-O 3.48Å; I201-M247 WeakPolarHBondContact CB-O 3.33Å
202	A	92.4	Very high	81.3	Confident	10 Å²	10	58.2 Å²	58.2	8%	0.083	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.4	165.4	0	0	0	0	0	110.3	V191 Y192 M247 Y249	V191-A202 HydrophobicContact CG1-CB 4.42Å; Y192-A202 CarbonylContact O-C 3.56Å; Y192-A202 WeakPolarHBondContact O-CA 3.35Å; A202-M247 HydrophobicContact CB-CB 4.41Å; A202-M247 PolarHBondContact N-O 3.35Å; A202-M247 PolarHBondContact O-N 3.03Å; A202-Y249 HydrophobicContact CB-CD2 4.49Å
203	L	90.5	Very high	80.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	97.9	176.7	-82.5	155.6	0	0	0	109.5	L177 Q180 V191 Y192 I201 V205 C235 A244 L245 V246	L177-L203 HydrophobicContact CD1-CD1 3.98Å; L177-L203 HydrophobicContact CD1-CD2 3.67Å; L177-L203 HydrophobicContact CD1-CG 4.46Å; Q180-L203 HydrophobicContact CG-CD1 3.92Å; V191-L203 CarbonylContact C-O 3.56Å; V191-L203 VanDerWaalsContact CA-O 3.3Å; V191-L203 WeakPolarHBondContact CA-O 3.17Å; Y192-L203 PolarHBondContact N-O 3.44Å; Y192-L203 PolarHBondContact O-N 3.01Å; I201-L203 HydrophobicContact CD1-CD1 3.93Å; I201-L203 HydrophobicContact CD1-CG 4Å; L203-V205 PolarHBondContact O-N 3.41Å; L203-C235 HydrophobicContact CD2-CB 4.45Å; L203-A244 HydrophobicContact CD2-CB 4.34Å; L203-L245 WeakPolarHBondContact CA-O 3.2Å; L203-V246 HydrophobicContact CD2-CG2 3.88Å
204	K	87.1	Confident	79	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	95.4	174.5	178.6	176.9	170	-176.6	0	108.7	K190 V191 F206 E216 A244 L245 M247 L355 D382	K190-K204 CarbonylContact O-C 3.59Å; K190-K204 WeakPolarHBondContact O-CA 3.47Å; V191-K204 HydrophobicContact CG1-CB 4.48Å; K204-F206 HydrophobicContact CB-CE2 4.49Å; K204-F206 HydrophobicContact CD-CE2 4.27Å; K204-F206 HydrophobicContact CD-CZ 4.05Å; K204-F206 HydrophobicContact CG-CE2 3.84Å; K204-F206 HydrophobicContact CG-CZ 4.08Å; K204-F206 VanDerWaalsContact O-CD2 3.29Å; K204-F206 WeakPolarHBondContact O-CD2 3.5Å; K204-F206 VanDerWaalsContact O-CE2 3.25Å; K204-F206 WeakPolarHBondContact O-CE2 3.48Å; K204-E216 IonicContact NZ-OE1 2.94Å; K204-E216 PolarHBondContact NZ-OE1 2.89Å; K204-E216 IonicContact NZ-OE2 2.88Å; K204-E216 PolarHBondContact NZ-OE2 3.41Å; K204-A244 CarbonylContact O-C 3.59Å; K204-A244 WeakPolarHBondContact O-CA 3.43Å; K204-L245 HydrophobicContact CB-CB 4.39Å; K204-L245 HydrophobicContact CD-CD1 4.36Å; K204-L245 PolarHBondContact N-O 3.27Å; K204-L245 PolarHBondContact O-N 3.36Å; K204-M247 HydrophobicContact CB-CE 3.5Å; K204-M247 HydrophobicContact CD-CE 4.04Å; K204-M247 HydrophobicContact CG-CE 4.43Å; K204-L355 HydrophobicContact CD-CD2 3.75Å; K204-L355 HydrophobicContact CG-CD2 4.15Å; K204-D382 IonicContact NZ-OD1 3.37Å; K204-D382 PolarHBondContact NZ-OD1 3.02Å
205	V	86.4	Confident	77.8	Confident	10 Å²	10	59.6 Å²	59.6	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.3	-178.9	-173.6	0	0	0	0	109.7	G189 K190 Y192 L203 L237 A244	G189-V205 CarbonylContact C-O 3.46Å; G189-V205 WeakPolarHBondContact CA-O 3.31Å; K190-V205 PolarHBondContact N-O 3.45Å; K190-V205 PolarHBondContact O-N 3.34Å; Y192-V205 HydrophobicContact CD2-CG2 3.75Å; Y192-V205 HydrophobicContact CE2-CB 4.26Å; Y192-V205 HydrophobicContact CE2-CG2 3.85Å; L203-V205 PolarHBondContact O-N 3.41Å; V205-L237 HydrophobicContact CB-CD1 4.44Å; V205-L237 HydrophobicContact CG1-CD1 3.87Å; V205-L237 HydrophobicContact CG2-CD1 3.63Å; V205-A244 HydrophobicContact CB-CB 4.27Å; V205-A244 HydrophobicContact CG2-CB 3.86Å
206	F	80.1	Confident	76.9	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.018	30%	0.296	C	S	.	.			trans	-98.2	133.8	-178	-65.9	-109.5	0	0	0	110.5	F188 K204 L208 V213 E216 P243 L245	F188-F206 HydrophobicContact CB-CD1 4.42Å; F188-F206 HydrophobicContact CB-CE1 4.19Å; F188-F206 WeakPolarHBondContact O-CD1 3.38Å; K204-F206 HydrophobicContact CB-CE2 4.49Å; K204-F206 HydrophobicContact CD-CE2 4.27Å; K204-F206 HydrophobicContact CD-CZ 4.05Å; K204-F206 HydrophobicContact CG-CE2 3.84Å; K204-F206 HydrophobicContact CG-CZ 4.08Å; K204-F206 VanDerWaalsContact O-CD2 3.29Å; K204-F206 WeakPolarHBondContact O-CD2 3.5Å; K204-F206 VanDerWaalsContact O-CE2 3.25Å; K204-F206 WeakPolarHBondContact O-CE2 3.48Å; F206-L208 PolarHBondContact O-N 3.41Å; F206-V213 HydrophobicContact CB-CG2 3.76Å; F206-V213 HydrophobicContact CD1-CG2 3.66Å; F206-V213 HydrophobicContact CD2-CB 4.38Å; F206-V213 HydrophobicContact CD2-CG1 4.15Å; F206-V213 HydrophobicContact CD2-CG2 3.39Å; F206-V213 HydrophobicContact CE1-CG2 4.02Å; F206-V213 HydrophobicContact CE2-CB 4.41Å; F206-V213 HydrophobicContact CE2-CG1 3.99Å; F206-V213 HydrophobicContact CE2-CG2 3.8Å; F206-V213 HydrophobicContact CG-CG2 3.32Å; F206-V213 HydrophobicContact CZ-CG2 4.08Å; F206-E216 WeakPolarHBondContact CZ-OE2 3.34Å; F206-P243 PolarHBondContact N-O 2.86Å; F206-L245 HydrophobicContact CE2-CD1 3.7Å; F206-L245 HydrophobicContact CE2-CG 3.8Å; F206-L245 HydrophobicContact CZ-CD1 3.69Å; F206-L245 HydrophobicContact CZ-CG 4.29Å
207	D	70.7	Confident	76.2	Confident	89 Å²	89	56 Å²	56	48%	0.476	29%	0.293	S	S	.	.	S	Bend	trans	-71.6	-15.7	-176.6	-67	-50.8	0	0	0	113.2	G189 K190	G189-D207 WeakPolarHBondContact CA-OD2 3.38Å; K190-D207 IonicContact NZ-OD1 3.22Å; K190-D207 PolarHBondContact NZ-OD1 2.82Å; K190-D207 IonicContact NZ-OD2 3.68Å
208	L	63	Low	75.5	Confident	124 Å²	124	53.6 Å²	53.6	65%	0.649	29%	0.288	S	S	*	.	S	Bend	trans	-136.9	135.9	176.1	-69.7	172.5	0	0	0	111	F206 T210	F206-L208 PolarHBondContact O-N 3.41Å; L208-T210 VanDerWaalsContact C-N 3.25Å; L208-T210 PolarHBondContact O-N 3.26Å
209	A	54.1	Low	75	Confident	70 Å²	70	44.8 Å²	44.8	58%	0.579	25%	0.247	S	C	*	.			trans	-84.3	35.9	-169.3	0	0	0	0	0	114.9	P243	A209-P243 HydrophobicContact CB-CG 4.06Å
210	T	56.5	Low	74.6	Confident	89 Å²	89	40.9 Å²	40.9	55%	0.546	23%	0.229	S	C	.	.	S	Bend	trans	-121.3	102.1	-162.7	53.2	0	0	0	0	114	L208 Q212	L208-T210 VanDerWaalsContact C-N 3.25Å; L208-T210 PolarHBondContact O-N 3.26Å; T210-Q212 PolarHBondContact O-N 3.13Å
211	N	57.1	Low	74.1	Confident	119 Å²	119	41 Å²	41	64%	0.636	23%	0.231	S	C	*	.	S	Bend	trans	59.3	-30	164.1	-57.5	-4.2	0	0	0	118.6	N215	N211-N215 PolarHBondContact O-N 2.77Å; N211-N215 VanDerWaalsContact O-N 3.1Å; N211-N215 PolarHBondContact O-ND2 2.83Å
212	Q	59.1	Low	73.5	Confident	89 Å²	89	47.4 Å²	47.4	42%	0.416	26%	0.255	S	S	.	.	H	α-helix	trans	-67.9	-38.9	-178.3	-69.1	-179.2	0	0	0	111.5	T210 N215 E216	T210-Q212 PolarHBondContact O-N 3.13Å; Q212-N215 PolarHBondContact O-N 3.33Å; Q212-E216 WeakPolarHBondContact O-CB 3.2Å; Q212-E216 PolarHBondContact O-N 2.93Å
213	V	66	Low	73.3	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-68.3	-41.4	178.6	-163.4	0	0	0	0	111.4	F206 N215 E216 A217 P243 L245	F206-V213 HydrophobicContact CB-CG2 3.76Å; F206-V213 HydrophobicContact CD1-CG2 3.66Å; F206-V213 HydrophobicContact CD2-CB 4.38Å; F206-V213 HydrophobicContact CD2-CG1 4.15Å; F206-V213 HydrophobicContact CD2-CG2 3.39Å; F206-V213 HydrophobicContact CE1-CG2 4.02Å; F206-V213 HydrophobicContact CE2-CB 4.41Å; F206-V213 HydrophobicContact CE2-CG1 3.99Å; F206-V213 HydrophobicContact CE2-CG2 3.8Å; F206-V213 HydrophobicContact CG-CG2 3.32Å; F206-V213 HydrophobicContact CZ-CG2 4.08Å; V213-N215 VanDerWaalsContact C-N 3.35Å; V213-N215 PolarHBondContact O-N 2.91Å; V213-E216 PolarHBondContact O-N 3.47Å; V213-A217 WeakPolarHBondContact O-CB 3.44Å; V213-A217 PolarHBondContact O-N 3.38Å; V213-P243 HydrophobicContact CB-CB 4.31Å; V213-P243 HydrophobicContact CB-CG 4.39Å; V213-P243 HydrophobicContact CG1-CB 4.18Å; V213-P243 HydrophobicContact CG2-CB 4.12Å; V213-P243 HydrophobicContact CG2-CG 3.76Å; V213-L245 HydrophobicContact CG1-CD2 3.8Å; V213-L245 HydrophobicContact CG1-CG 3.99Å
214	D	68.4	Low	73.2	Confident	79 Å²	79	51.4 Å²	51.4	42%	0.422	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-42.7	176.8	-55.9	-61	0	0	0	110.8	L218	D214-L218 WeakPolarHBondContact O-CB 3.13Å; D214-L218 WeakPolarHBondContact O-CD1 3.39Å; D214-L218 WeakPolarHBondContact O-CG 3.49Å; D214-L218 PolarHBondContact O-N 3.37Å
215	N	65.8	Low	73.5	Confident	80 Å²	80	53.9 Å²	53.9	43%	0.428	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-45.9	175	-76.2	-37.7	0	0	0	112.8	N211 Q212 V213 A217 L218 H219	N211-N215 PolarHBondContact O-N 2.77Å; N211-N215 VanDerWaalsContact O-N 3.1Å; N211-N215 PolarHBondContact O-ND2 2.83Å; Q212-N215 PolarHBondContact O-N 3.33Å; V213-N215 VanDerWaalsContact C-N 3.35Å; V213-N215 PolarHBondContact O-N 2.91Å; N215-A217 VanDerWaalsContact C-N 3.35Å; N215-A217 PolarHBondContact O-N 3.27Å; N215-L218 PolarHBondContact O-N 3.49Å; N215-H219 PolarHBondContact O-N 3.2Å; N215-H219 VanDerWaalsContact O-N 3.15Å; N215-H219 PolarHBondContact O-ND1 3.08Å
216	E	72.9	Confident	73.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-41.3	178.8	-168.1	164.3	177.9	0	0	110.7	K204 F206 Q212 V213 H219 L220 L245 F383 G384	K204-E216 IonicContact NZ-OE1 2.94Å; K204-E216 PolarHBondContact NZ-OE1 2.89Å; K204-E216 IonicContact NZ-OE2 2.88Å; K204-E216 PolarHBondContact NZ-OE2 3.41Å; F206-E216 WeakPolarHBondContact CZ-OE2 3.34Å; Q212-E216 WeakPolarHBondContact O-CB 3.2Å; Q212-E216 PolarHBondContact O-N 2.93Å; V213-E216 PolarHBondContact O-N 3.47Å; E216-H219 PolarHBondContact O-N 2.79Å; E216-L220 HydrophobicContact CG-CD1 3.97Å; E216-L220 VanDerWaalsContact O-CB 3.31Å; E216-L220 WeakPolarHBondContact O-CB 3.45Å; E216-L220 WeakPolarHBondContact O-CG 3.44Å; E216-L220 PolarHBondContact O-N 3.34Å; E216-L245 HydrophobicContact CB-CD1 4Å; E216-L245 HydrophobicContact CG-CD1 3.61Å; E216-F383 HydrophobicContact CG-CB 4.02Å; E216-F383 PolarHBondContact OE1-N 3.33Å; E216-G384 VanDerWaalsContact OE2-CA 3.28Å; E216-G384 WeakPolarHBondContact OE2-CA 3.44Å; E216-G384 PolarHBondContact OE2-N 3.49Å
217	A	78.2	Confident	74.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-39.8	175.3	0	0	0	0	0	113.8	V169 V213 N215 H219 L220 C221 F231 I234 L245	V169-A217 HydrophobicContact CG1-CB 4.27Å; V169-A217 HydrophobicContact CG2-CB 3.95Å; V213-A217 WeakPolarHBondContact O-CB 3.44Å; V213-A217 PolarHBondContact O-N 3.38Å; N215-A217 VanDerWaalsContact C-N 3.35Å; N215-A217 PolarHBondContact O-N 3.27Å; A217-H219 PolarHBondContact O-N 3.46Å; A217-L220 PolarHBondContact O-N 2.96Å; A217-C221 WeakPolarHBondContact O-CB 3.3Å; A217-C221 PolarHBondContact O-N 3.49Å; A217-C221 PolarHBondContact O-SG 2.96Å; A217-F231 HydrophobicContact CB-CZ 4.03Å; A217-I234 HydrophobicContact CB-CD1 3.66Å; A217-I234 HydrophobicContact CB-CG1 3.99Å; A217-L245 HydrophobicContact CB-CD2 3.76Å
218	L	73.5	Confident	75.7	Confident	63 Å²	63	56.8 Å²	56.8	33%	0.33	30%	0.296	S	S	.	.	H	α-helix	trans	-70.6	-17.3	177.7	-76.9	169.2	0	0	0	113.6	D214 N215 R388	D214-L218 WeakPolarHBondContact O-CB 3.13Å; D214-L218 WeakPolarHBondContact O-CD1 3.39Å; D214-L218 WeakPolarHBondContact O-CG 3.49Å; D214-L218 PolarHBondContact O-N 3.37Å; N215-L218 PolarHBondContact O-N 3.49Å; L218-R388 PolarHBondContact O-NH1 3.3Å
219	H	76.4	Confident	77	Confident	7 Å²	7	51 Å²	51	3%	0.032	27%	0.267	C	S	.	.	H	α-helix	trans	-83	-59.2	164.1	-68	123.6	0	0	0	110.3	N215 E216 A217 C221 R222 I290 A386	N215-H219 PolarHBondContact O-N 3.2Å; N215-H219 VanDerWaalsContact O-N 3.15Å; N215-H219 PolarHBondContact O-ND1 3.08Å; E216-H219 PolarHBondContact O-N 2.79Å; A217-H219 PolarHBondContact O-N 3.46Å; H219-C221 VanDerWaalsContact C-N 3.34Å; H219-C221 PolarHBondContact O-N 2.98Å; H219-R222 PolarHBondContact O-N 3.45Å; H219-I290 HydrophobicContact CB-CD1 3.94Å; H219-A386 PolarHBondContact CE1-O 3.37Å; H219-A386 PolarHBondContact ND1-O 2.85Å
220	L	81.7	Confident	78.7	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-54.5	-39.4	-177.2	-81.2	172	0	0	0	114.6	E216 A217 R222 L223 V229 F231 L245 M247 F383	E216-L220 HydrophobicContact CG-CD1 3.97Å; E216-L220 VanDerWaalsContact O-CB 3.31Å; E216-L220 WeakPolarHBondContact O-CB 3.45Å; E216-L220 WeakPolarHBondContact O-CG 3.44Å; E216-L220 PolarHBondContact O-N 3.34Å; A217-L220 PolarHBondContact O-N 2.96Å; L220-R222 PolarHBondContact O-N 2.74Å; L220-L223 HydrophobicContact CD2-CD1 4.48Å; L220-L223 PolarHBondContact O-N 3.47Å; L220-V229 HydrophobicContact CD2-CG1 4.29Å; L220-F231 HydrophobicContact CB-CB 3.87Å; L220-F231 HydrophobicContact CB-CD1 3.86Å; L220-F231 HydrophobicContact CB-CD2 4.07Å; L220-F231 HydrophobicContact CB-CE1 4.37Å; L220-F231 HydrophobicContact CB-CG 3.67Å; L220-F231 HydrophobicContact CD1-CB 4.47Å; L220-F231 HydrophobicContact CD1-CD2 3.84Å; L220-F231 HydrophobicContact CD1-CE2 4.31Å; L220-F231 HydrophobicContact CD1-CG 4.24Å; L220-F231 HydrophobicContact CD2-CB 4.23Å; L220-F231 HydrophobicContact CG-CB 4.43Å; L220-F231 HydrophobicContact CG-CG 4.45Å; L220-L245 HydrophobicContact CD1-CD1 4.05Å; L220-M247 HydrophobicContact CD1-SD 4.19Å; L220-F383 HydrophobicContact CD2-CD2 3.4Å; L220-F383 VanDerWaalsContact CD2-CD2 3.4Å; L220-F383 HydrophobicContact CD2-CE2 3.72Å; L220-F383 HydrophobicContact CD2-CG 4.36Å; L220-F383 HydrophobicContact CG-CD2 3.98Å
221	C	82.3	Confident	80.4	Confident	20 Å²	20	47.8 Å²	47.8	14%	0.135	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-2	-176.4	74.7	0	0	0	0	115.1	V169 A217 H219 F231	V169-C221 HydrophobicContact CG2-CB 4.09Å; A217-C221 WeakPolarHBondContact O-CB 3.3Å; A217-C221 PolarHBondContact O-N 3.49Å; A217-C221 PolarHBondContact O-SG 2.96Å; H219-C221 VanDerWaalsContact C-N 3.34Å; H219-C221 PolarHBondContact O-N 2.98Å; C221-F231 HydrophobicContact CB-CD1 4.16Å; C221-F231 HydrophobicContact CB-CE1 3.89Å
222	R	80.6	Confident	81.9	Confident	136 Å²	136	44.1 Å²	44.1	51%	0.513	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	12.4	177.1	-46.4	-170.3	-162.1	-178.3	-0.5	112.8	H219 L220	H219-R222 PolarHBondContact O-N 3.45Å; L220-R222 PolarHBondContact O-N 2.74Å
223	L	88.5	Confident	83.4	Confident	17 Å²	17	39.9 Å²	39.9	9%	0.089	19%	0.188	C	C	.	.			trans	-107	123.1	179.8	-61.1	177.7	0	0	0	110.4	L220 I228 Y283 L284 A288 I290 F383	L220-L223 HydrophobicContact CD2-CD1 4.48Å; L220-L223 PolarHBondContact O-N 3.47Å; L223-I228 HydrophobicContact CB-CG2 4.08Å; L223-I228 HydrophobicContact CD1-CG2 4.13Å; L223-Y283 HydrophobicContact CB-CE1 4.3Å; L223-Y283 HydrophobicContact CD2-CD1 4.48Å; L223-Y283 HydrophobicContact CD2-CE1 3.7Å; L223-L284 HydrophobicContact CD1-CD2 3.82Å; L223-L284 HydrophobicContact CD2-CD2 3.74Å; L223-L284 HydrophobicContact CG-CD2 4.46Å; L223-A288 HydrophobicContact CD2-CB 3.51Å; L223-I290 HydrophobicContact CD2-CD1 4.17Å; L223-F383 HydrophobicContact CD1-CD1 4.28Å; L223-F383 HydrophobicContact CD1-CD2 4.49Å; L223-F383 HydrophobicContact CD1-CE1 4Å; L223-F383 HydrophobicContact CD1-CE2 4.19Å; L223-F383 HydrophobicContact CD1-CZ 3.95Å
224	S	88.8	Confident	84.4	Confident	76 Å²	76	40.7 Å²	40.7	53%	0.531	19%	0.192	S	C	.	.			trans	-144	101.9	173.4	-173	0	0	0	0	108.7	Y283	S224-Y283 PolarHBondContact N-OH 3.02Å; S224-Y283 PolarHBondContact O-OH 2.81Å
225	H	94	Very high	85.4	Confident	54 Å²	54	36.9 Å²	36.9	25%	0.25	17%	0.172	C	C	.	.			trans	-159.5	147.4	178.8	174.6	-105.9	0	0	0	109.8	N227 I228 S279 Y283	H225-N227 PolarHBondContact ND1-N 3.29Å; H225-N227 PolarHBondContact O-N 2.94Å; H225-N227 VanDerWaalsContact O-N 3.08Å; H225-I228 HydrophobicContact CB-CB 4.48Å; H225-I228 HydrophobicContact CB-CG1 3.92Å; H225-I228 PolarHBondContact O-N 3.14Å; H225-S279 PolarHBondContact CE1-OG 3.05Å; H225-S279 PolarHBondContact NE2-OG 2.89Å; H225-Y283 HydrophobicContact CB-CD1 3.5Å; H225-Y283 VanDerWaalsContact CB-CD1 3.5Å; H225-Y283 HydrophobicContact CB-CD2 4.11Å; H225-Y283 HydrophobicContact CB-CE1 3.7Å; H225-Y283 HydrophobicContact CB-CE2 4.3Å; H225-Y283 HydrophobicContact CB-CG 3.72Å; H225-Y283 AromaticContact CG-CG 3.91Å
226	R	94.3	Very high	86.3	Confident	151 Å²	151	40.3 Å²	40.3	57%	0.57	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-36	-172.9	179.3	175.6	174.8	-157.3	-8	113.7	R361 T377 L379	R226-R361 PolarHBondContact O-NH1 3.19Å; R226-T377 HydrophobicContact CG-CG2 3.9Å; R226-T377 PolarHBondContact NH2-OG1 3.03Å; R226-L379 VanDerWaalsContact O-CD2 3.3Å; R226-L379 WeakPolarHBondContact O-CD2 3.4Å
227	N	95.6	Very high	86.6	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.043	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	15.5	-176.2	-59.9	110.4	0	0	0	114.5	H225 Q276 L378 I380	H225-N227 PolarHBondContact ND1-N 3.29Å; H225-N227 PolarHBondContact O-N 2.94Å; H225-N227 VanDerWaalsContact O-N 3.08Å; N227-Q276 WeakPolarHBondContact CB-O 3.33Å; N227-Q276 PolarHBondContact ND2-OE1 3.07Å; N227-L378 VanDerWaalsContact CA-O 3.29Å; N227-L378 WeakPolarHBondContact CA-O 3.49Å; N227-L378 WeakPolarHBondContact CB-O 3.43Å; N227-L378 PolarHBondContact ND2-O 3.42Å; N227-I380 PolarHBondContact O-N 3.08Å
228	I	92.6	Very high	86.1	Confident	4 Å²	4	47 Å²	47	2%	0.021	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-111	141.5	168.6	-55.1	-58.3	0	0	0	107.7	L223 H225 R230 Y283 L284 I380 F383	L223-I228 HydrophobicContact CB-CG2 4.08Å; L223-I228 HydrophobicContact CD1-CG2 4.13Å; H225-I228 HydrophobicContact CB-CB 4.48Å; H225-I228 HydrophobicContact CB-CG1 3.92Å; H225-I228 PolarHBondContact O-N 3.14Å; I228-R230 PolarHBondContact O-N 3.39Å; I228-Y283 HydrophobicContact CG1-CD1 3.95Å; I228-Y283 HydrophobicContact CG1-CE1 4.32Å; I228-L284 HydrophobicContact CD1-CD1 3.78Å; I228-L284 HydrophobicContact CD1-CD2 4.27Å; I228-L284 HydrophobicContact CD1-CG 3.88Å; I228-I380 HydrophobicContact CD1-CB 3.91Å; I228-I380 HydrophobicContact CD1-CD1 4.35Å; I228-I380 HydrophobicContact CD1-CG2 4.49Å; I228-F383 HydrophobicContact CD1-CZ 4.36Å; I228-F383 HydrophobicContact CG2-CE2 3.98Å; I228-F383 HydrophobicContact CG2-CZ 3.83Å
229	V	91.6	Very high	85.5	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	24%	0.242	C	C	.	.			trans	-59.9	130.9	174.7	69.4	0	0	0	0	110.2	L220 M247 E248 L379 I380 F383	L220-V229 HydrophobicContact CD2-CG1 4.29Å; V229-M247 HydrophobicContact CG2-CB 4.34Å; V229-E248 HydrophobicContact CG2-CB 4.02Å; V229-L379 HydrophobicContact CB-CB 4.47Å; V229-I380 PolarHBondContact N-O 3.45Å; V229-F383 HydrophobicContact CG1-CE2 4.4Å
230	R	89.8	Confident	85	Confident	65 Å²	65	55.3 Å²	55.3	25%	0.245	27%	0.265	C	S	.	.			trans	-70.1	138	176.8	-171	-174	-174.9	97.9	-16.9	110.5	D159 I228 Y232 M247 E248	D159-R230 PolarHBondContact O-NH1 2.86Å; D159-R230 PolarHBondContact O-NH2 2.98Å; I228-R230 PolarHBondContact O-N 3.39Å; R230-Y232 VanDerWaalsContact CD-CE1 3.49Å; R230-Y232 HydrophobicContact CG-CE1 4.15Å; R230-M247 CarbonylContact O-C 3.37Å; R230-M247 WeakPolarHBondContact O-CA 3.21Å; R230-E248 HydrophobicContact CB-CB 3.95Å; R230-E248 PolarHBondContact N-OE2 2.96Å; R230-E248 VanDerWaalsContact N-OE2 3.15Å; R230-E248 PolarHBondContact O-N 2.92Å
231	F	90.8	Very high	84.5	Confident	25 Å²	25	60 Å²	60	11%	0.11	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.4	175.6	174.4	-111.8	0	0	0	110.7	V169 A217 L220 C221 G233 I234 L245 V246 M247	V169-F231 HydrophobicContact CG1-CE1 3.76Å; V169-F231 HydrophobicContact CG1-CZ 3.66Å; A217-F231 HydrophobicContact CB-CZ 4.03Å; L220-F231 HydrophobicContact CB-CB 3.87Å; L220-F231 HydrophobicContact CB-CD1 3.86Å; L220-F231 HydrophobicContact CB-CD2 4.07Å; L220-F231 HydrophobicContact CB-CE1 4.37Å; L220-F231 HydrophobicContact CB-CG 3.67Å; L220-F231 HydrophobicContact CD1-CB 4.47Å; L220-F231 HydrophobicContact CD1-CD2 3.84Å; L220-F231 HydrophobicContact CD1-CE2 4.31Å; L220-F231 HydrophobicContact CD1-CG 4.24Å; L220-F231 HydrophobicContact CD2-CB 4.23Å; L220-F231 HydrophobicContact CG-CB 4.43Å; L220-F231 HydrophobicContact CG-CG 4.45Å; C221-F231 HydrophobicContact CB-CD1 4.16Å; C221-F231 HydrophobicContact CB-CE1 3.89Å; F231-G233 WeakPolarHBondContact CE2-O 3.09Å; F231-G233 WeakPolarHBondContact CZ-O 3.48Å; F231-I234 HydrophobicContact CZ-CG1 4.42Å; F231-L245 HydrophobicContact CE2-CB 4.12Å; F231-L245 HydrophobicContact CE2-CD2 3.55Å; F231-L245 HydrophobicContact CE2-CG 4.41Å; F231-L245 HydrophobicContact CZ-CD2 4.04Å; F231-V246 WeakPolarHBondContact CD2-O 3.43Å; F231-M247 HydrophobicContact CD2-CG 4.06Å
232	Y	89.5	Confident	84.2	Confident	42 Å²	42	60.1 Å²	60.1	17%	0.165	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-32.6	-178	-59.9	-65.5	0	0	0	113	R170 W196 I201 R230 V246 M247 E248	R170-Y232 WeakPolarHBondContact CD-O 3.39Å; W196-Y232 HydrophobicContact CE3-CG 4.45Å; W196-Y232 HydrophobicContact CZ3-CD1 4.04Å; W196-Y232 HydrophobicContact CZ3-CG 4.11Å; I201-Y232 HydrophobicContact CG2-CD2 3.9Å; I201-Y232 HydrophobicContact CG2-CE2 3.82Å; R230-Y232 VanDerWaalsContact CD-CE1 3.49Å; R230-Y232 HydrophobicContact CG-CE1 4.15Å; Y232-V246 HydrophobicContact CD2-CG1 4.25Å; Y232-V246 PolarHBondContact N-O 2.7Å; Y232-M247 VanDerWaalsContact CE2-C 3.48Å; Y232-E248 HydrophobicContact CE2-CB 4.35Å
233	G	89.6	Confident	84.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163	-177.9	-179.4	0	0	0	0	0	115	R170 F231 V246	R170-G233 CarbonylContact O-C 3.52Å; R170-G233 WeakPolarHBondContact O-CA 3.42Å; F231-G233 WeakPolarHBondContact CE2-O 3.09Å; F231-G233 WeakPolarHBondContact CZ-O 3.48Å; G233-V246 PolarHBondContact N-O 2.87Å; G233-V246 WeakPolarHBondContact O-CB 3.09Å; G233-V246 PolarHBondContact O-N 3.49Å
234	I	88.4	Confident	84.3	Confident	21 Å²	21	53.6 Å²	53.6	11%	0.108	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	138.4	166.1	-72.2	162.5	0	0	0	108.8	V169 R170 T171 I172 A217 F231 A244 L245	V169-I234 HydrophobicContact CB-CD1 4.13Å; V169-I234 HydrophobicContact CG1-CB 4.16Å; V169-I234 HydrophobicContact CG1-CD1 3.65Å; V169-I234 HydrophobicContact CG1-CG1 3.68Å; V169-I234 HydrophobicContact CG2-CD1 4.46Å; R170-I234 PolarHBondContact O-N 3.18Å; T171-I234 CarbonylContact C-O 3.56Å; T171-I234 VanDerWaalsContact CA-O 3.3Å; T171-I234 WeakPolarHBondContact CA-O 3.5Å; I172-I234 PolarHBondContact N-O 2.92Å; A217-I234 HydrophobicContact CB-CD1 3.66Å; A217-I234 HydrophobicContact CB-CG1 3.99Å; F231-I234 HydrophobicContact CZ-CG1 4.42Å; I234-A244 CarbonylContact C-O 3.53Å; I234-A244 VanDerWaalsContact CA-O 3.31Å; I234-A244 WeakPolarHBondContact CA-O 3.32Å; I234-L245 HydrophobicContact CG1-CD2 4.13Å
235	C	87.9	Confident	84.3	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	152	159.7	-178.6	0	0	0	0	109.6	I172 A174 L177 L203 A244 V246	I172-C235 WeakPolarHBondContact O-CA 3.29Å; A174-C235 VanDerWaalsContact CA-SG 3.59Å; L177-C235 HydrophobicContact CD1-CB 3.98Å; L177-C235 WeakPolarHBondContact CD1-SG 3.43Å; L203-C235 HydrophobicContact CD2-CB 4.45Å; C235-A244 HydrophobicContact CB-CB 4.47Å; C235-A244 PolarHBondContact N-O 2.9Å; C235-A244 PolarHBondContact O-N 3.23Å; C235-V246 HydrophobicContact CB-CG2 3.86Å
236	R	84.7	Confident	84.2	Confident	152 Å²	152	47.4 Å²	47.4	57%	0.574	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.4	160.1	-68.6	-178.2	179.1	179.7	-0.7	107.3
237	L	80	Confident	84.1	Confident	24 Å²	24	40.6 Å²	40.6	13%	0.126	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.2	-175.4	-67.2	173.2	0	0	0	110.7	A174 L177 V205 N239 S240 N241 S242	A174-L237 HydrophobicContact CB-CD2 4.2Å; L177-L237 HydrophobicContact CD1-CD2 4.31Å; V205-L237 HydrophobicContact CB-CD1 4.44Å; V205-L237 HydrophobicContact CG1-CD1 3.87Å; V205-L237 HydrophobicContact CG2-CD1 3.63Å; L237-N239 PolarHBondContact O-N 3.23Å; L237-N239 VanDerWaalsContact O-N 3.08Å; L237-S240 PolarHBondContact O-N 2.99Å; L237-S240 VanDerWaalsContact O-N 3.15Å; L237-N241 WeakPolarHBondContact O-CA 3.46Å; L237-N241 PolarHBondContact O-N 2.8Å; L237-S242 PolarHBondContact N-O 2.91Å; L237-S242 VanDerWaalsContact N-O 3.13Å
238	D	67.4	Low	83.9	Confident	117 Å²	117	41.4 Å²	41.4	63%	0.626	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.6	-165	-59.3	-30.1	0	0	0	114.4
239	N	61.7	Low	83.9	Confident	172 Å²	172	43 Å²	43	92%	0.92	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-14.9	-175.5	-66.3	-0.8	0	0	0	114.7	L237	L237-N239 PolarHBondContact O-N 3.23Å; L237-N239 VanDerWaalsContact O-N 3.08Å
240	S	65.1	Low	83.9	Confident	72 Å²	72	43.2 Å²	43.2	50%	0.503	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-8.9	-176.7	66.9	0	0	0	0	114.3	L237 S242	L237-S240 PolarHBondContact O-N 2.99Å; L237-S240 VanDerWaalsContact O-N 3.15Å; S240-S242 WeakPolarHBondContact CB-OG 3.41Å; S240-S242 PolarHBondContact O-N 2.87Å; S240-S242 WeakPolarHBondContact OG-CB 3.28Å; S240-S242 PolarHBondContact OG-N 2.99Å; S240-S242 VanDerWaalsContact OG-N 3.15Å; S240-S242 PolarHBondContact OG-OG 2.85Å
241	N	70.4	Confident	83.9	Confident	99 Å²	99	45 Å²	45	53%	0.529	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	18.4	-166.3	-166.9	35.9	0	0	0	113.3	L237 P243	L237-N241 WeakPolarHBondContact O-CA 3.46Å; L237-N241 PolarHBondContact O-N 2.8Å; N241-P243 WeakPolarHBondContact O-CD 3.46Å
242	S	77.3	Confident	83.8	Confident	24 Å²	24	44 Å²	44	17%	0.168	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	123.2	176.5	-63.8	0	0	0	0	109.2	L237 S240	L237-S242 PolarHBondContact N-O 2.91Å; L237-S242 VanDerWaalsContact N-O 3.13Å; S240-S242 WeakPolarHBondContact CB-OG 3.41Å; S240-S242 PolarHBondContact O-N 2.87Å; S240-S242 WeakPolarHBondContact OG-CB 3.28Å; S240-S242 PolarHBondContact OG-N 2.99Å; S240-S242 VanDerWaalsContact OG-N 3.15Å; S240-S242 PolarHBondContact OG-OG 2.85Å
243	P	84.3	Confident	83.7	Confident	15 Å²	15	43.1 Å²	43.1	10%	0.097	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	141.9	172.7	29.8	-33.3	0	0	0	110.1	F206 A209 V213 N241	F206-P243 PolarHBondContact N-O 2.86Å; A209-P243 HydrophobicContact CB-CG 4.06Å; V213-P243 HydrophobicContact CB-CB 4.31Å; V213-P243 HydrophobicContact CB-CG 4.39Å; V213-P243 HydrophobicContact CG1-CB 4.18Å; V213-P243 HydrophobicContact CG2-CB 4.12Å; V213-P243 HydrophobicContact CG2-CG 3.76Å; N241-P243 WeakPolarHBondContact O-CD 3.46Å
244	A	87.4	Confident	83.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.2	-178.6	0	0	0	0	0	111	L203 K204 V205 I234 C235	L203-A244 HydrophobicContact CD2-CB 4.34Å; K204-A244 CarbonylContact O-C 3.59Å; K204-A244 WeakPolarHBondContact O-CA 3.43Å; V205-A244 HydrophobicContact CB-CB 4.27Å; V205-A244 HydrophobicContact CG2-CB 3.86Å; I234-A244 CarbonylContact C-O 3.53Å; I234-A244 VanDerWaalsContact CA-O 3.31Å; I234-A244 WeakPolarHBondContact CA-O 3.32Å; C235-A244 HydrophobicContact CB-CB 4.47Å; C235-A244 PolarHBondContact N-O 2.9Å; C235-A244 PolarHBondContact O-N 3.23Å
245	L	88.5	Confident	83.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	128.9	171	-60.7	166.1	0	0	0	109.3	L203 K204 F206 V213 E216 A217 L220 F231 I234 M247	L203-L245 WeakPolarHBondContact CA-O 3.2Å; K204-L245 HydrophobicContact CB-CB 4.39Å; K204-L245 HydrophobicContact CD-CD1 4.36Å; K204-L245 PolarHBondContact N-O 3.27Å; K204-L245 PolarHBondContact O-N 3.36Å; F206-L245 HydrophobicContact CE2-CD1 3.7Å; F206-L245 HydrophobicContact CE2-CG 3.8Å; F206-L245 HydrophobicContact CZ-CD1 3.69Å; F206-L245 HydrophobicContact CZ-CG 4.29Å; V213-L245 HydrophobicContact CG1-CD2 3.8Å; V213-L245 HydrophobicContact CG1-CG 3.99Å; E216-L245 HydrophobicContact CB-CD1 4Å; E216-L245 HydrophobicContact CG-CD1 3.61Å; A217-L245 HydrophobicContact CB-CD2 3.76Å; L220-L245 HydrophobicContact CD1-CD1 4.05Å; F231-L245 HydrophobicContact CE2-CB 4.12Å; F231-L245 HydrophobicContact CE2-CD2 3.55Å; F231-L245 HydrophobicContact CE2-CG 4.41Å; F231-L245 HydrophobicContact CZ-CD2 4.04Å; I234-L245 HydrophobicContact CG1-CD2 4.13Å; L245-M247 HydrophobicContact CB-CE 4.35Å; L245-M247 HydrophobicContact CB-CG 4.28Å; L245-M247 HydrophobicContact CB-SD 4.26Å
246	V	91.1	Very high	83.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.4	173.6	-167.9	0	0	0	0	108.1	I172 I201 L203 F231 Y232 G233 C235	I172-V246 HydrophobicContact CB-CG2 4.42Å; I172-V246 HydrophobicContact CD1-CB 3.9Å; I172-V246 HydrophobicContact CD1-CG1 3.91Å; I172-V246 HydrophobicContact CD1-CG2 3.95Å; I201-V246 HydrophobicContact CB-CG1 4.18Å; I201-V246 HydrophobicContact CD1-CG1 3.68Å; I201-V246 HydrophobicContact CG2-CG1 4.13Å; L203-V246 HydrophobicContact CD2-CG2 3.88Å; F231-V246 WeakPolarHBondContact CD2-O 3.43Å; Y232-V246 HydrophobicContact CD2-CG1 4.25Å; Y232-V246 PolarHBondContact N-O 2.7Å; G233-V246 PolarHBondContact N-O 2.87Å; G233-V246 WeakPolarHBondContact O-CB 3.09Å; G233-V246 PolarHBondContact O-N 3.49Å; C235-V246 HydrophobicContact CB-CG2 3.86Å
247	M	92	Very high	83.6	Confident	9 Å²	9	37.1 Å²	37.1	4%	0.044	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	169	-171.7	-63.2	175.9	-62.3	0	0	110.9	I201 A202 K204 L220 V229 R230 F231 Y232 L245	I201-M247 CarbonylContact C-O 3.59Å; I201-M247 VanDerWaalsContact CA-O 3.31Å; I201-M247 WeakPolarHBondContact CA-O 3.48Å; I201-M247 WeakPolarHBondContact CB-O 3.33Å; A202-M247 HydrophobicContact CB-CB 4.41Å; A202-M247 PolarHBondContact N-O 3.35Å; A202-M247 PolarHBondContact O-N 3.03Å; K204-M247 HydrophobicContact CB-CE 3.5Å; K204-M247 HydrophobicContact CD-CE 4.04Å; K204-M247 HydrophobicContact CG-CE 4.43Å; L220-M247 HydrophobicContact CD1-SD 4.19Å; V229-M247 HydrophobicContact CG2-CB 4.34Å; R230-M247 CarbonylContact O-C 3.37Å; R230-M247 WeakPolarHBondContact O-CA 3.21Å; F231-M247 HydrophobicContact CD2-CG 4.06Å; Y232-M247 VanDerWaalsContact CE2-C 3.48Å; L245-M247 HydrophobicContact CB-CE 4.35Å; L245-M247 HydrophobicContact CB-CG 4.28Å; L245-M247 HydrophobicContact CB-SD 4.26Å
248	E	91.4	Very high	84	Confident	24 Å²	24	36 Å²	36	11%	0.112	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	135.1	167.6	169.1	174.5	-154.6	0	0	112.4	V229 R230 Y232 R361 L379	V229-E248 HydrophobicContact CG2-CB 4.02Å; R230-E248 HydrophobicContact CB-CB 3.95Å; R230-E248 PolarHBondContact N-OE2 2.96Å; R230-E248 VanDerWaalsContact N-OE2 3.15Å; R230-E248 PolarHBondContact O-N 2.92Å; Y232-E248 HydrophobicContact CE2-CB 4.35Å; E248-R361 VanDerWaalsContact CD-NH2 3.25Å; E248-R361 IonicContact OE1-CZ 3.06Å; E248-R361 IonicContact OE1-NE 3.96Å; E248-R361 PolarHBondContact OE1-NE 3.36Å; E248-R361 IonicContact OE1-NH2 2.72Å; E248-R361 PolarHBondContact OE1-NH2 2.93Å; E248-R361 IonicContact OE2-CZ 3.01Å; E248-R361 IonicContact OE2-NH2 3.92Å; E248-R361 PolarHBondContact OE2-NH2 3.47Å; E248-L379 HydrophobicContact CG-CD1 4.34Å
249	Y	92.5	Very high	85	Confident	38 Å²	38	30.6 Å²	30.6	15%	0.149	17%	0.168	C	C	.	.			trans	-82.7	116.3	172.3	-175.2	-99.7	0	0	0	110.7	I183 R193 A202 Y251	I183-Y249 HydrophobicContact CD1-CD2 4.16Å; I183-Y249 HydrophobicContact CD1-CE2 3.67Å; I183-Y249 HydrophobicContact CG1-CE2 4.36Å; R193-Y249 HydrophobicContact CB-CD2 3.97Å; R193-Y249 HydrophobicContact CB-CE2 3.64Å; R193-Y249 HydrophobicContact CG-CD2 3.76Å; R193-Y249 HydrophobicContact CG-CE2 3.65Å; R193-Y249 HydrophobicContact CG-CG 4.31Å; A202-Y249 HydrophobicContact CB-CD2 4.49Å; Y249-Y251 AromaticContact CD1-CD1 3.63Å; Y249-Y251 HydrophobicContact CD1-CD1 3.63Å; Y249-Y251 HydrophobicContact CD1-CD2 4.08Å; Y249-Y251 AromaticContact CD1-CE1 3.74Å; Y249-Y251 HydrophobicContact CD1-CE1 3.74Å; Y249-Y251 HydrophobicContact CD1-CE2 4.2Å; Y249-Y251 AromaticContact CD1-CG 3.8Å; Y249-Y251 HydrophobicContact CD1-CG 3.8Å; Y249-Y251 AromaticContact CE1-CD1 3.5Å; Y249-Y251 HydrophobicContact CE1-CD1 3.5Å; Y249-Y251 VanDerWaalsContact CE1-CD1 3.5Å; Y249-Y251 AromaticContact CE1-CE1 3.93Å; Y249-Y251 HydrophobicContact CE1-CE1 3.93Å; Y249-Y251 AromaticContact CE1-CG 3.87Å; Y249-Y251 HydrophobicContact CE1-CG 3.87Å; Y249-Y251 PolarHBondContact O-N 2.89Å
250	A	92.1	Very high	86.1	Confident	9 Å²	9	26 Å²	26	7%	0.074	14%	0.144	C	C	.	.			trans	-90.4	100.9	177.5	0	0	0	0	0	110.4	G252 G253 L359 I360 L379	A250-G252 VanDerWaalsContact C-N 3.3Å; A250-G252 PolarHBondContact O-N 2.8Å; A250-G253 PolarHBondContact O-N 2.92Å; A250-L359 HydrophobicContact CB-CB 3.68Å; A250-L359 HydrophobicContact CB-CD1 3.72Å; A250-L359 HydrophobicContact CB-CG 4.33Å; A250-I360 CarbonylContact C-O 3.59Å; A250-I360 WeakPolarHBondContact CB-O 3.39Å; A250-L379 HydrophobicContact CB-CD1 4.41Å
251	Y	90.5	Very high	87.1	Confident	103 Å²	103	26.7 Å²	26.7	40%	0.404	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.7	-169.8	-66.7	-92.4	0	0	0	113.8	D200 Y249 G253 R361	D200-Y251 WeakPolarHBondContact CB-OH 3.43Å; D200-Y251 VanDerWaalsContact CG-OH 3.3Å; D200-Y251 WeakPolarHBondContact OD2-CE1 3.31Å; D200-Y251 PolarHBondContact OD2-OH 3.43Å; Y249-Y251 AromaticContact CD1-CD1 3.63Å; Y249-Y251 HydrophobicContact CD1-CD1 3.63Å; Y249-Y251 HydrophobicContact CD1-CD2 4.08Å; Y249-Y251 AromaticContact CD1-CE1 3.74Å; Y249-Y251 HydrophobicContact CD1-CE1 3.74Å; Y249-Y251 HydrophobicContact CD1-CE2 4.2Å; Y249-Y251 AromaticContact CD1-CG 3.8Å; Y249-Y251 HydrophobicContact CD1-CG 3.8Å; Y249-Y251 AromaticContact CE1-CD1 3.5Å; Y249-Y251 HydrophobicContact CE1-CD1 3.5Å; Y249-Y251 VanDerWaalsContact CE1-CD1 3.5Å; Y249-Y251 AromaticContact CE1-CE1 3.93Å; Y249-Y251 HydrophobicContact CE1-CE1 3.93Å; Y249-Y251 AromaticContact CE1-CG 3.87Å; Y249-Y251 HydrophobicContact CE1-CG 3.87Å; Y249-Y251 PolarHBondContact O-N 2.89Å; Y251-G253 PolarHBondContact O-N 3.28Å; Y251-R361 WeakPolarHBondContact CD2-O 3.48Å; Y251-R361 PolarHBondContact N-O 3.05Å
252	G	87.9	Confident	87.9	Confident	3 Å²	3	27.4 Å²	27.4	3%	0.031	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-7.3	177.5	0	0	0	0	0	114	A250 M257 I360 E362	A250-G252 VanDerWaalsContact C-N 3.3Å; A250-G252 PolarHBondContact O-N 2.8Å; G252-M257 VanDerWaalsContact O-CE 3.23Å; G252-M257 WeakPolarHBondContact O-CE 3.47Å; G252-I360 WeakPolarHBondContact CA-O 3.21Å; G252-I360 PolarHBondContact N-O 2.88Å; G252-E362 WeakPolarHBondContact CA-O 3.45Å; G252-E362 PolarHBondContact N-O 2.94Å
253	G	87	Confident	88.3	Confident	23 Å²	23	26.9 Å²	26.9	24%	0.237	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	67.7	-148.9	-176.6	0	0	0	0	0	112.2	A250 Y251 L359 I360	A250-G253 PolarHBondContact O-N 2.92Å; Y251-G253 PolarHBondContact O-N 3.28Å; G253-L359 CarbonylContact O-C 3.42Å; G253-L359 WeakPolarHBondContact O-CA 3.29Å; G253-L359 WeakPolarHBondContact O-CB 3.29Å; G253-I360 PolarHBondContact O-N 3.44Å
254	S	87.4	Confident	88.4	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	140	-174.6	51.5	0	0	0	0	114.1	N256 M257 K353 K356	S254-N256 VanDerWaalsContact C-N 3.29Å; S254-N256 PolarHBondContact O-N 3.22Å; S254-M257 WeakPolarHBondContact O-CA 3.37Å; S254-M257 WeakPolarHBondContact O-CB 3.3Å; S254-M257 PolarHBondContact O-N 3.44Å; S254-K353 PolarHBondContact OG-O 3.39Å; S254-K353 VanDerWaalsContact OG-O 3.07Å; S254-K356 WeakPolarHBondContact OG-CD 3.47Å; S254-K356 WeakPolarHBondContact OG-CE 3.34Å; S254-K356 PolarHBondContact OG-NZ 3.28Å
255	L	90.4	Very high	88.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-49.2	-45.9	-179.1	173.5	60.5	0	0	0	112.7	M257 V258 L259 W273 I277 V358 L378 L431	L255-M257 PolarHBondContact O-N 2.7Å; L255-M257 VanDerWaalsContact O-N 3.17Å; L255-V258 WeakPolarHBondContact O-CA 3.18Å; L255-V258 WeakPolarHBondContact O-CB 3.41Å; L255-V258 PolarHBondContact O-N 3.02Å; L255-L259 HydrophobicContact CD1-CD1 4.17Å; L255-L259 HydrophobicContact CD1-CD2 4.1Å; L255-L259 HydrophobicContact CD1-CG 3.96Å; L255-L259 HydrophobicContact CD2-CD1 4.26Å; L255-L259 HydrophobicContact CG-CD1 3.85Å; L255-L259 HydrophobicContact CG-CG 4.06Å; L255-L259 PolarHBondContact O-N 2.82Å; L255-W273 HydrophobicContact CD1-CE3 3.61Å; L255-W273 HydrophobicContact CD1-CH2 4.22Å; L255-W273 HydrophobicContact CD1-CZ3 3.38Å; L255-I277 HydrophobicContact CD2-CD1 4.01Å; L255-V358 HydrophobicContact CB-CB 4.14Å; L255-V358 HydrophobicContact CB-CG1 4.03Å; L255-V358 HydrophobicContact CD2-CB 4.15Å; L255-V358 HydrophobicContact CD2-CG1 3.78Å; L255-V358 PolarHBondContact N-O 3.18Å; L255-L378 HydrophobicContact CD1-CD2 4.42Å; L255-L378 HydrophobicContact CD2-CD1 4.38Å; L255-L431 HydrophobicContact CD2-CD2 4.42Å
256	N	86.7	Confident	88.3	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.027	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-23.6	177	172.3	-98.5	0	0	0	114.3	S254 V258 N260 S297 S298 K356	S254-N256 VanDerWaalsContact C-N 3.29Å; S254-N256 PolarHBondContact O-N 3.22Å; N256-V258 VanDerWaalsContact C-N 3.28Å; N256-V258 PolarHBondContact O-N 3.19Å; N256-N260 VanDerWaalsContact CG-ND2 3.35Å; N256-N260 PolarHBondContact ND2-ND2 3.25Å; N256-N260 PolarHBondContact ND2-OD1 3.24Å; N256-N260 VanDerWaalsContact O-CB 3.23Å; N256-N260 WeakPolarHBondContact O-CB 3.4Å; N256-N260 PolarHBondContact O-N 3.32Å; N256-N260 PolarHBondContact O-ND2 3.47Å; N256-N260 PolarHBondContact OD1-ND2 2.62Å; N256-S297 WeakPolarHBondContact CB-O 3.39Å; N256-S297 WeakPolarHBondContact CB-OG 3.44Å; N256-S298 WeakPolarHBondContact ND2-CB 3.49Å; N256-S298 PolarHBondContact ND2-OG 3.3Å; N256-S298 PolarHBondContact OD1-OG 2.8Å; N256-K356 HydrophobicContact CB-CD 4.27Å; N256-K356 PolarHBondContact OD1-NZ 2.79Å
257	M	85.1	Confident	88.4	Confident	39 Å²	39	30.9 Å²	30.9	19%	0.192	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-41.4	170.5	-179.3	175.3	64.6	0	0	110.8	G252 S254 L255 Q261 K353	G252-M257 VanDerWaalsContact O-CE 3.23Å; G252-M257 WeakPolarHBondContact O-CE 3.47Å; S254-M257 WeakPolarHBondContact O-CA 3.37Å; S254-M257 WeakPolarHBondContact O-CB 3.3Å; S254-M257 PolarHBondContact O-N 3.44Å; L255-M257 PolarHBondContact O-N 2.7Å; L255-M257 VanDerWaalsContact O-N 3.17Å; M257-Q261 PolarHBondContact O-NE2 2.98Å; M257-K353 HydrophobicContact CG-CD 4.3Å; M257-K353 HydrophobicContact SD-CD 4.01Å
258	V	87.3	Confident	88.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71.8	-55.3	177.6	177.9	0	0	0	0	109.7	L255 N256 N260 Q261 P263 W273 I360 V364 F368 L373	L255-V258 WeakPolarHBondContact O-CA 3.18Å; L255-V258 WeakPolarHBondContact O-CB 3.41Å; L255-V258 PolarHBondContact O-N 3.02Å; N256-V258 VanDerWaalsContact C-N 3.28Å; N256-V258 PolarHBondContact O-N 3.19Å; V258-N260 VanDerWaalsContact C-N 3.35Å; V258-N260 PolarHBondContact O-N 3.41Å; V258-Q261 WeakPolarHBondContact O-CB 3.4Å; V258-Q261 PolarHBondContact O-N 3.24Å; V258-P263 HydrophobicContact CG1-CB 4.47Å; V258-P263 HydrophobicContact CG1-CG 3.85Å; V258-P263 WeakPolarHBondContact O-CD 3.35Å; V258-W273 HydrophobicContact CG1-CH2 4.11Å; V258-I360 HydrophobicContact CB-CD1 4.19Å; V258-I360 HydrophobicContact CG2-CD1 3.48Å; V258-I360 VanDerWaalsContact CG2-CD1 3.48Å; V258-V364 HydrophobicContact CG2-CG2 4.33Å; V258-F368 HydrophobicContact CB-CZ 4.23Å; V258-F368 HydrophobicContact CG1-CD2 4.42Å; V258-F368 HydrophobicContact CG1-CE2 4.11Å; V258-F368 HydrophobicContact CG1-CZ 4.16Å; V258-F368 HydrophobicContact CG2-CE1 3.93Å; V258-F368 HydrophobicContact CG2-CE2 4.48Å; V258-F368 HydrophobicContact CG2-CZ 3.74Å; V258-L373 HydrophobicContact CG1-CD2 4.22Å
259	L	88.8	Confident	88.5	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-56.4	-41	-177.4	-56.4	-178.5	0	0	0	113.8	L255 Q261 R262 L265 W273 E430 L431 L434	L255-L259 HydrophobicContact CD1-CD1 4.17Å; L255-L259 HydrophobicContact CD1-CD2 4.1Å; L255-L259 HydrophobicContact CD1-CG 3.96Å; L255-L259 HydrophobicContact CD2-CD1 4.26Å; L255-L259 HydrophobicContact CG-CD1 3.85Å; L255-L259 HydrophobicContact CG-CG 4.06Å; L255-L259 PolarHBondContact O-N 2.82Å; L259-Q261 PolarHBondContact O-N 3.38Å; L259-R262 PolarHBondContact O-N 3.18Å; L259-L265 HydrophobicContact CD2-CD1 3.87Å; L259-W273 HydrophobicContact CD2-CZ3 4.13Å; L259-E430 HydrophobicContact CD1-CB 4.23Å; L259-L431 HydrophobicContact CD1-CD2 4.17Å; L259-L431 HydrophobicContact CD2-CD2 4.02Å; L259-L434 HydrophobicContact CD2-CD2 3.74Å
260	N	85.4	Confident	88.6	Confident	77 Å²	77	31.8 Å²	31.8	41%	0.412	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17	177.3	-74.7	-24.4	0	0	0	114.2	N256 V258	N256-N260 VanDerWaalsContact CG-ND2 3.35Å; N256-N260 PolarHBondContact ND2-ND2 3.25Å; N256-N260 PolarHBondContact ND2-OD1 3.24Å; N256-N260 VanDerWaalsContact O-CB 3.23Å; N256-N260 WeakPolarHBondContact O-CB 3.4Å; N256-N260 PolarHBondContact O-N 3.32Å; N256-N260 PolarHBondContact O-ND2 3.47Å; N256-N260 PolarHBondContact OD1-ND2 2.62Å; V258-N260 VanDerWaalsContact C-N 3.35Å; V258-N260 PolarHBondContact O-N 3.41Å
261	Q	85.7	Confident	88.6	Confident	86 Å²	86	31.7 Å²	31.7	40%	0.402	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	1.5	178.3	-67.8	171	107.6	0	0	112.7	M257 V258 L259 K366 F368	M257-Q261 PolarHBondContact O-NE2 2.98Å; V258-Q261 WeakPolarHBondContact O-CB 3.4Å; V258-Q261 PolarHBondContact O-N 3.24Å; L259-Q261 PolarHBondContact O-N 3.38Å; Q261-K366 VanDerWaalsContact NE2-NZ 3.16Å; Q261-F368 HydrophobicContact CB-CE2 4.17Å; Q261-F368 VanDerWaalsContact NE2-CE2 3.31Å; Q261-F368 VanDerWaalsContact NE2-CZ 3.29Å
262	R	86.2	Confident	88.8	Confident	114 Å²	114	29.1 Å²	29.1	43%	0.43	15%	0.151	S	C	.	.			trans	48	59.3	179.6	-63.1	175.7	177.3	168.4	-2.5	112.7	L259 L434 D435	L259-R262 PolarHBondContact O-N 3.18Å; R262-L434 HydrophobicContact CG-CB 4.14Å; R262-D435 IonicContact CZ-OD1 2.68Å; R262-D435 IonicContact NE-OD1 2.65Å; R262-D435 IonicContact NH2-OD1 3.16Å; R262-D435 PolarHBondContact NH2-OD1 2.95Å
263	P	85.5	Confident	89.2	Confident	13 Å²	13	29 Å²	29	8%	0.084	15%	0.149	C	C	.	.			trans	-62.3	162.1	176.4	31.7	-40.3	0	0	0	111.7	V258 L265 F368 L373 L434	V258-P263 HydrophobicContact CG1-CB 4.47Å; V258-P263 HydrophobicContact CG1-CG 3.85Å; V258-P263 WeakPolarHBondContact O-CD 3.35Å; P263-L265 VanDerWaalsContact C-N 3.27Å; P263-L265 HydrophobicContact CG-CD1 3.76Å; P263-L265 HydrophobicContact CG-CG 3.9Å; P263-L265 PolarHBondContact O-N 3.1Å; P263-F368 HydrophobicContact CB-CB 4.49Å; P263-F368 HydrophobicContact CB-CD2 4.03Å; P263-L373 HydrophobicContact CB-CD1 3.92Å; P263-L373 HydrophobicContact CG-CD1 4.41Å; P263-L434 WeakPolarHBondContact O-CD1 3.49Å
264	L	87.3	Confident	89.6	Confident	89 Å²	89	27.9 Å²	27.9	47%	0.466	14%	0.138	S	C	.	.			trans	-73.4	81.3	169.3	-156.5	82.2	0	0	0	109.8	L370 P505 A509	L264-L370 WeakPolarHBondContact O-CD1 3.3Å; L264-P505 WeakPolarHBondContact CD1-O 3.4Å; L264-P505 HydrophobicContact CD2-CB 3.86Å; L264-P505 HydrophobicContact CG-CB 3.88Å; L264-A509 HydrophobicContact CD1-CB 3.68Å
265	L	85.5	Confident	90.1	Very high	2 Å²	2	29 Å²	29	1%	0.01	14%	0.144	C	C	.	.			trans	-87.1	106.1	175.6	-86.3	162.3	0	0	0	109.6	L259 P263 V269 W273 L373 L434 L508	L259-L265 HydrophobicContact CD2-CD1 3.87Å; P263-L265 VanDerWaalsContact C-N 3.27Å; P263-L265 HydrophobicContact CG-CD1 3.76Å; P263-L265 HydrophobicContact CG-CG 3.9Å; P263-L265 PolarHBondContact O-N 3.1Å; L265-V269 HydrophobicContact CD2-CB 4Å; L265-V269 HydrophobicContact CD2-CG1 3.54Å; L265-W273 HydrophobicContact CD1-CE3 4.47Å; L265-W273 HydrophobicContact CD1-CZ3 4.02Å; L265-W273 HydrophobicContact CD2-CD2 4.45Å; L265-W273 HydrophobicContact CD2-CE3 4.14Å; L265-W273 HydrophobicContact CD2-CH2 4Å; L265-W273 HydrophobicContact CD2-CZ2 4.29Å; L265-W273 HydrophobicContact CD2-CZ3 3.9Å; L265-L373 HydrophobicContact CD2-CD1 4.11Å; L265-L373 HydrophobicContact CG-CD1 4.35Å; L265-L434 HydrophobicContact CD1-CD1 4.33Å; L265-L434 HydrophobicContact CD1-CD2 3.63Å; L265-L508 WeakPolarHBondContact O-CD2 3.21Å
266	G	89.2	Confident	90.4	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.031	15%	0.146	C	C	.	.			trans	-65	154.8	171.1	0	0	0	0	0	112.3	L268 V269 L270	G266-L268 VanDerWaalsContact C-N 3.29Å; G266-L268 PolarHBondContact O-N 3.18Å; G266-V269 PolarHBondContact O-N 3.29Å; G266-L270 PolarHBondContact O-N 3.44Å; G266-L270 VanDerWaalsContact O-N 3.15Å
267	P	92.4	Very high	90.8	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.032	15%	0.145	C	C	.	.	H	α-helix	trans	-56.6	-40.1	-172.6	-22.2	28.7	0	0	0	114	V269 L270 L271 F500 L503 L508	P267-V269 VanDerWaalsContact C-N 3.35Å; P267-V269 PolarHBondContact O-N 3.34Å; P267-L270 PolarHBondContact O-N 3.45Å; P267-L271 WeakPolarHBondContact O-CB 3.27Å; P267-L271 PolarHBondContact O-N 3.36Å; P267-F500 HydrophobicContact CB-CD1 3.97Å; P267-F500 HydrophobicContact CB-CE1 3.73Å; P267-F500 HydrophobicContact CB-CZ 4.17Å; P267-F500 WeakPolarHBondContact CB-O 3.41Å; P267-F500 WeakPolarHBondContact CG-O 3.48Å; P267-L503 VanDerWaalsContact CD-O 3.31Å; P267-L503 WeakPolarHBondContact CD-O 3.38Å; P267-L503 HydrophobicContact CG-CB 3.85Å; P267-L503 WeakPolarHBondContact CG-O 3.33Å; P267-L508 HydrophobicContact CB-CD2 4.14Å; P267-L508 HydrophobicContact CG-CB 4.46Å; P267-L508 HydrophobicContact CG-CD2 3.78Å
268	L	91.8	Very high	91.4	Very high	85 Å²	85	27.5 Å²	27.5	45%	0.445	14%	0.136	S	C	.	.	H	α-helix	trans	-62.5	-38.9	178.5	-65.3	175.7	0	0	0	112.5	G266 L271 D272 V501	G266-L268 VanDerWaalsContact C-N 3.29Å; G266-L268 PolarHBondContact O-N 3.18Å; L268-L271 PolarHBondContact O-N 2.95Å; L268-D272 VanDerWaalsContact O-CB 3.31Å; L268-D272 WeakPolarHBondContact O-CB 3.4Å; L268-D272 PolarHBondContact O-N 2.96Å; L268-V501 HydrophobicContact CD2-CB 3.92Å; L268-V501 HydrophobicContact CD2-CG1 3.89Å
269	V	93.2	Very high	91.9	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.024	14%	0.143	C	C	.	.	H	α-helix	trans	-70.2	-41	178.4	-172.7	0	0	0	0	110.4	L265 G266 P267 W273 L370 L373 Q374	L265-V269 HydrophobicContact CD2-CB 4Å; L265-V269 HydrophobicContact CD2-CG1 3.54Å; G266-V269 PolarHBondContact O-N 3.29Å; P267-V269 VanDerWaalsContact C-N 3.35Å; P267-V269 PolarHBondContact O-N 3.34Å; V269-W273 HydrophobicContact CG1-CD2 4.31Å; V269-W273 HydrophobicContact CG1-CG 4.45Å; V269-W273 HydrophobicContact CG1-CZ2 4.26Å; V269-W273 VanDerWaalsContact O-CB 3.3Å; V269-W273 WeakPolarHBondContact O-CB 3.3Å; V269-W273 VanDerWaalsContact O-CD1 3.27Å; V269-W273 VanDerWaalsContact O-CG 3.23Å; V269-W273 PolarHBondContact O-N 3Å; V269-L370 HydrophobicContact CG2-CD1 3.83Å; V269-L373 HydrophobicContact CG1-CB 4.07Å; V269-L373 WeakPolarHBondContact CG1-O 3.34Å; V269-Q374 HydrophobicContact CG2-CB 3.82Å; V269-Q374 HydrophobicContact CG2-CG 4.14Å
270	L	94.2	Very high	92.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.6	-45.5	174.9	-172.6	160.2	0	0	0	111.5	G266 P267 W273 A274 L431 L432 F500 L508	G266-L270 PolarHBondContact O-N 3.44Å; G266-L270 VanDerWaalsContact O-N 3.15Å; P267-L270 PolarHBondContact O-N 3.45Å; L270-W273 PolarHBondContact O-N 3.23Å; L270-A274 WeakPolarHBondContact O-CB 3.33Å; L270-A274 PolarHBondContact O-N 3.02Å; L270-L431 VanDerWaalsContact CD1-O 3.27Å; L270-L431 WeakPolarHBondContact CD1-O 3.33Å; L270-L431 HydrophobicContact CG-CB 4.36Å; L270-L432 HydrophobicContact CD2-CD2 4.05Å; L270-F500 HydrophobicContact CD1-CZ 4.29Å; L270-F500 HydrophobicContact CD2-CE1 4.44Å; L270-F500 HydrophobicContact CD2-CZ 4.27Å; L270-L508 HydrophobicContact CD1-CD2 4.31Å
271	L	94.1	Very high	92.7	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	12%	0.123	C	C	.	.	H	α-helix	trans	-67.2	-42.3	-180	-173.7	61.7	0	0	0	112.1	P267 L268 A274 L275 F467 L492 C495 V501	P267-L271 WeakPolarHBondContact O-CB 3.27Å; P267-L271 PolarHBondContact O-N 3.36Å; L268-L271 PolarHBondContact O-N 2.95Å; L271-A274 PolarHBondContact O-N 3Å; L271-L275 HydrophobicContact CG-CD1 4.36Å; L271-L275 WeakPolarHBondContact O-CB 3.25Å; L271-L275 WeakPolarHBondContact O-CG 3.46Å; L271-L275 PolarHBondContact O-N 2.74Å; L271-F467 HydrophobicContact CD1-CZ 4.37Å; L271-L492 HydrophobicContact CD1-CB 4.03Å; L271-L492 HydrophobicContact CD1-CD2 3.91Å; L271-C495 HydrophobicContact CD2-CB 4.39Å; L271-V501 HydrophobicContact CD2-CG1 3.94Å
272	D	94	Very high	93.2	Very high	50 Å²	50	21 Å²	21	27%	0.267	11%	0.107	S	C	.	.	H	α-helix	trans	-63.2	-47	174.3	179.1	76.6	0	0	0	111.5	L268 A274 L275 Q276	L268-D272 VanDerWaalsContact O-CB 3.31Å; L268-D272 WeakPolarHBondContact O-CB 3.4Å; L268-D272 PolarHBondContact O-N 2.96Å; D272-A274 VanDerWaalsContact C-N 3.31Å; D272-A274 PolarHBondContact O-N 2.69Å; D272-L275 CarbonylContact O-C 3.45Å; D272-L275 WeakPolarHBondContact O-CB 3.3Å; D272-L275 PolarHBondContact O-N 2.75Å; D272-L275 VanDerWaalsContact O-N 3.08Å; D272-Q276 WeakPolarHBondContact O-CB 3.14Å; D272-Q276 WeakPolarHBondContact O-CG 3.43Å; D272-Q276 PolarHBondContact O-N 3.33Å; D272-Q276 PolarHBondContact OD2-NE2 3.13Å
273	W	95.8	Very high	93.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.4	-40.2	175.7	-76.1	17.2	0	0	0	112.4	L255 V258 L259 L265 V269 L270 Q276 I277 I360 L373 C376 L378 L431	L255-W273 HydrophobicContact CD1-CE3 3.61Å; L255-W273 HydrophobicContact CD1-CH2 4.22Å; L255-W273 HydrophobicContact CD1-CZ3 3.38Å; V258-W273 HydrophobicContact CG1-CH2 4.11Å; L259-W273 HydrophobicContact CD2-CZ3 4.13Å; L265-W273 HydrophobicContact CD1-CE3 4.47Å; L265-W273 HydrophobicContact CD1-CZ3 4.02Å; L265-W273 HydrophobicContact CD2-CD2 4.45Å; L265-W273 HydrophobicContact CD2-CE3 4.14Å; L265-W273 HydrophobicContact CD2-CH2 4Å; L265-W273 HydrophobicContact CD2-CZ2 4.29Å; L265-W273 HydrophobicContact CD2-CZ3 3.9Å; V269-W273 HydrophobicContact CG1-CD2 4.31Å; V269-W273 HydrophobicContact CG1-CG 4.45Å; V269-W273 HydrophobicContact CG1-CZ2 4.26Å; V269-W273 VanDerWaalsContact O-CB 3.3Å; V269-W273 WeakPolarHBondContact O-CB 3.3Å; V269-W273 VanDerWaalsContact O-CD1 3.27Å; V269-W273 VanDerWaalsContact O-CG 3.23Å; V269-W273 PolarHBondContact O-N 3Å; L270-W273 PolarHBondContact O-N 3.23Å; W273-Q276 PolarHBondContact O-N 3.2Å; W273-I277 WeakPolarHBondContact O-CG1 3.17Å; W273-I277 PolarHBondContact O-N 2.86Å; W273-I360 HydrophobicContact CH2-CD1 4.36Å; W273-L373 HydrophobicContact CH2-CD2 4.01Å; W273-L373 HydrophobicContact CZ2-CB 4.08Å; W273-L373 HydrophobicContact CZ2-CD2 4.04Å; W273-L373 PolarHBondContact NE1-O 3.19Å; W273-C376 HydrophobicContact CZ2-CB 4.06Å; W273-L378 HydrophobicContact CB-CD1 3.65Å; W273-L378 HydrophobicContact CD2-CD1 4.06Å; W273-L378 HydrophobicContact CD2-CD2 4.38Å; W273-L378 HydrophobicContact CD2-CG 4.49Å; W273-L378 HydrophobicContact CE3-CD1 4.46Å; W273-L378 HydrophobicContact CG-CD1 3.71Å; W273-L378 HydrophobicContact CG-CG 4.22Å; W273-L431 HydrophobicContact CB-CD2 4.45Å; W273-L431 HydrophobicContact CE3-CD2 3.94Å
274	A	96	Very high	94	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.8	-40	174.2	0	0	0	0	0	112.4	L270 L271 D272 A278 Y424 L428 L431 L492	L270-A274 WeakPolarHBondContact O-CB 3.33Å; L270-A274 PolarHBondContact O-N 3.02Å; L271-A274 PolarHBondContact O-N 3Å; D272-A274 VanDerWaalsContact C-N 3.31Å; D272-A274 PolarHBondContact O-N 2.69Å; A274-A278 WeakPolarHBondContact O-CB 3.47Å; A274-A278 PolarHBondContact O-N 3.01Å; A274-A278 VanDerWaalsContact O-N 3.13Å; A274-Y424 PolarHBondContact O-OH 2.95Å; A274-L428 HydrophobicContact CB-CD1 3.96Å; A274-L431 HydrophobicContact CB-CD1 4.1Å; A274-L492 HydrophobicContact CB-CD1 4.13Å
275	L	96.5	Very high	94.3	Very high	27 Å²	27	13.6 Å²	13.6	14%	0.141	7%	0.072	C	C	.	.	H	α-helix	trans	-68.4	-41.5	175.3	-78.7	167.7	0	0	0	112.6	L271 D272 I277 A278 S279 M489 L492 K493	L271-L275 HydrophobicContact CG-CD1 4.36Å; L271-L275 WeakPolarHBondContact O-CB 3.25Å; L271-L275 WeakPolarHBondContact O-CG 3.46Å; L271-L275 PolarHBondContact O-N 2.74Å; D272-L275 CarbonylContact O-C 3.45Å; D272-L275 WeakPolarHBondContact O-CB 3.3Å; D272-L275 PolarHBondContact O-N 2.75Å; D272-L275 VanDerWaalsContact O-N 3.08Å; L275-I277 PolarHBondContact O-N 3.42Å; L275-A278 PolarHBondContact O-N 3.32Å; L275-S279 WeakPolarHBondContact O-CB 3.44Å; L275-S279 PolarHBondContact O-N 3.22Å; L275-M489 HydrophobicContact CD2-CB 4.26Å; L275-M489 HydrophobicContact CD2-CG 4.31Å; L275-L492 HydrophobicContact CD2-CB 3.61Å; L275-L492 HydrophobicContact CD2-CD1 4.19Å; L275-L492 HydrophobicContact CG-CB 3.98Å; L275-L492 HydrophobicContact CG-CD1 4.39Å; L275-K493 HydrophobicContact CD1-CG 4.43Å; L275-K493 HydrophobicContact CD2-CG 4.09Å
276	Q	97	Very high	94.5	Very high	11 Å²	11	16.9 Å²	16.9	5%	0.051	9%	0.092	C	C	.	.	H	α-helix	trans	-60.5	-44.6	178.3	-77.1	-162.9	62.2	0	0	112	N227 D272 W273 S279 G280 C376 T377 L378	N227-Q276 WeakPolarHBondContact CB-O 3.33Å; N227-Q276 PolarHBondContact ND2-OE1 3.07Å; D272-Q276 WeakPolarHBondContact O-CB 3.14Å; D272-Q276 WeakPolarHBondContact O-CG 3.43Å; D272-Q276 PolarHBondContact O-N 3.33Å; D272-Q276 PolarHBondContact OD2-NE2 3.13Å; W273-Q276 PolarHBondContact O-N 3.2Å; Q276-S279 PolarHBondContact O-N 3.14Å; Q276-G280 PolarHBondContact O-N 3.36Å; Q276-G280 VanDerWaalsContact O-N 3.1Å; Q276-C376 PolarHBondContact NE2-O 3.39Å; Q276-T377 VanDerWaalsContact OE1-CA 3.25Å; Q276-L378 HydrophobicContact CB-CB 4.33Å
277	I	96.5	Very high	94.5	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-66.9	-43	175.5	-60.5	169.2	0	0	0	110.4	L255 W273 L275 S279 G280 M281 L295 V358 L378 I380 Y424 V427 L431	L255-I277 HydrophobicContact CD2-CD1 4.01Å; W273-I277 WeakPolarHBondContact O-CG1 3.17Å; W273-I277 PolarHBondContact O-N 2.86Å; L275-I277 PolarHBondContact O-N 3.42Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 3.31Å; I277-G280 PolarHBondContact O-N 3.32Å; I277-M281 WeakPolarHBondContact O-CG 3.32Å; I277-M281 PolarHBondContact O-N 3.48Å; I277-L295 HydrophobicContact CG2-CD1 4.47Å; I277-V358 HydrophobicContact CD1-CG1 4.15Å; I277-V358 HydrophobicContact CG1-CG1 4.22Å; I277-L378 HydrophobicContact CD1-CD1 3.87Å; I277-L378 HydrophobicContact CG1-CD1 3.83Å; I277-I380 HydrophobicContact CG2-CD1 4.29Å; I277-Y424 HydrophobicContact CB-CE2 4.07Å; I277-Y424 HydrophobicContact CG2-CD2 3.8Å; I277-Y424 HydrophobicContact CG2-CE2 3.85Å; I277-V427 HydrophobicContact CD1-CG1 3.86Å; I277-L431 HydrophobicContact CD1-CD1 4.3Å
278	A	97.3	Very high	94.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-36.9	177.6	0	0	0	0	0	112.6	A274 L275 M281 A282 Y424 F485 I488 M489	A274-A278 WeakPolarHBondContact O-CB 3.47Å; A274-A278 PolarHBondContact O-N 3.01Å; A274-A278 VanDerWaalsContact O-N 3.13Å; L275-A278 PolarHBondContact O-N 3.32Å; A278-M281 PolarHBondContact O-N 3.3Å; A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 2.84Å; A278-Y424 HydrophobicContact CB-CE2 4.01Å; A278-F485 HydrophobicContact CB-CD1 4.05Å; A278-I488 HydrophobicContact CB-CG2 4.23Å; A278-M489 HydrophobicContact CB-CG 3.64Å
279	S	97.5	Very high	94.1	Very high	21 Å²	21	26.2 Å²	26.2	15%	0.147	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-49	176	-173.7	0	0	0	0	111.9	H225 L275 Q276 I277 M281 A282 Y283 M489	H225-S279 PolarHBondContact CE1-OG 3.05Å; H225-S279 PolarHBondContact NE2-OG 2.89Å; L275-S279 WeakPolarHBondContact O-CB 3.44Å; L275-S279 PolarHBondContact O-N 3.22Å; Q276-S279 PolarHBondContact O-N 3.14Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 3.31Å; S279-M281 VanDerWaalsContact C-N 3.28Å; S279-M281 PolarHBondContact O-N 3.08Å; S279-A282 PolarHBondContact O-N 3.02Å; S279-Y283 PolarHBondContact O-N 3.39Å; S279-Y283 VanDerWaalsContact O-N 3.13Å; S279-M489 VanDerWaalsContact CA-SD 3.6Å
280	G	95.7	Very high	93.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.7	-40.6	174	0	0	0	0	0	112.8	Q276 I277 L284	Q276-G280 PolarHBondContact O-N 3.36Å; Q276-G280 VanDerWaalsContact O-N 3.1Å; I277-G280 PolarHBondContact O-N 3.32Å; G280-L284 WeakPolarHBondContact O-CG 3.32Å; G280-L284 PolarHBondContact O-N 2.98Å
281	M	95.8	Very high	93.3	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-72.2	-34.5	177.3	-70.7	-57.1	-51.9	0	0	114	I277 A278 S279 L284 H285 H292 L295 I380 D420 F485	I277-M281 WeakPolarHBondContact O-CG 3.32Å; I277-M281 PolarHBondContact O-N 3.48Å; A278-M281 PolarHBondContact O-N 3.3Å; S279-M281 VanDerWaalsContact C-N 3.28Å; S279-M281 PolarHBondContact O-N 3.08Å; M281-L284 HydrophobicContact CE-CD1 4.41Å; M281-L284 PolarHBondContact O-N 3.24Å; M281-L284 HydrophobicContact SD-CD1 3.78Å; M281-H285 WeakPolarHBondContact CE-NE2 3.42Å; M281-H285 PolarHBondContact O-N 3.09Å; M281-H292 HydrophobicContact CE-CB 4.03Å; M281-H292 HydrophobicContact SD-CB 4.38Å; M281-L295 HydrophobicContact CE-CD2 4.32Å; M281-L295 HydrophobicContact CG-CD2 3.89Å; M281-L295 HydrophobicContact SD-CD1 4.02Å; M281-L295 HydrophobicContact SD-CD2 3.82Å; M281-L295 HydrophobicContact SD-CG 4.38Å; M281-I380 HydrophobicContact CG-CD1 3.8Å; M281-I380 HydrophobicContact SD-CD1 3.88Å; M281-D420 HydrophobicContact CE-CB 3.7Å; M281-F485 HydrophobicContact CB-CD1 3.74Å; M281-F485 HydrophobicContact CB-CD2 3.75Å; M281-F485 HydrophobicContact CB-CE1 3.54Å; M281-F485 HydrophobicContact CB-CE2 3.55Å; M281-F485 HydrophobicContact CB-CG 3.85Å; M281-F485 HydrophobicContact CB-CZ 3.45Å; M281-F485 VanDerWaalsContact CB-CZ 3.45Å; M281-F485 HydrophobicContact CE-CE2 4.05Å; M281-F485 HydrophobicContact CE-CZ 4.27Å; M281-F485 HydrophobicContact CG-CE1 4.04Å; M281-F485 HydrophobicContact CG-CE2 4.25Å; M281-F485 HydrophobicContact CG-CZ 3.81Å
282	A	95.9	Very high	93	Very high	9 Å²	9	25.7 Å²	25.7	7%	0.074	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-48.8	173.5	0	0	0	0	0	111.3	A278 S279 L284 H285 T286 F485 M489	A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 2.84Å; S279-A282 PolarHBondContact O-N 3.02Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 PolarHBondContact O-N 2.93Å; A282-H285 PolarHBondContact O-N 3.36Å; A282-T286 WeakPolarHBondContact O-CB 3.31Å; A282-T286 PolarHBondContact O-N 3.1Å; A282-F485 HydrophobicContact CB-CB 3.78Å; A282-M489 HydrophobicContact CB-CE 3.53Å
283	Y	95.5	Very high	92.5	Very high	41 Å²	41	24.7 Å²	24.7	16%	0.161	12%	0.122	C	C	.	.	I	π-helix	trans	-56.6	-43	175.3	172.6	-103.9	0	0	0	112.5	L223 S224 H225 I228 S279 D287 A288	L223-Y283 HydrophobicContact CB-CE1 4.3Å; L223-Y283 HydrophobicContact CD2-CD1 4.48Å; L223-Y283 HydrophobicContact CD2-CE1 3.7Å; S224-Y283 PolarHBondContact N-OH 3.02Å; S224-Y283 PolarHBondContact O-OH 2.81Å; H225-Y283 HydrophobicContact CB-CD1 3.5Å; H225-Y283 VanDerWaalsContact CB-CD1 3.5Å; H225-Y283 HydrophobicContact CB-CD2 4.11Å; H225-Y283 HydrophobicContact CB-CE1 3.7Å; H225-Y283 HydrophobicContact CB-CE2 4.3Å; H225-Y283 HydrophobicContact CB-CG 3.72Å; H225-Y283 AromaticContact CG-CG 3.91Å; I228-Y283 HydrophobicContact CG1-CD1 3.95Å; I228-Y283 HydrophobicContact CG1-CE1 4.32Å; S279-Y283 PolarHBondContact O-N 3.39Å; S279-Y283 VanDerWaalsContact O-N 3.13Å; Y283-D287 HydrophobicContact CD2-CB 3.86Å; Y283-D287 WeakPolarHBondContact CD2-OD2 3.49Å; Y283-D287 HydrophobicContact CE2-CB 3.98Å; Y283-D287 WeakPolarHBondContact O-CB 3.3Å; Y283-D287 PolarHBondContact O-N 3.03Å; Y283-A288 PolarHBondContact O-N 3.18Å
284	L	92.4	Very high	91.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-62.6	-43.6	176.7	-72.8	167.5	0	0	0	112.4	L223 I228 G280 M281 A282 R289 I290 I380 F383	L223-L284 HydrophobicContact CD1-CD2 3.82Å; L223-L284 HydrophobicContact CD2-CD2 3.74Å; L223-L284 HydrophobicContact CG-CD2 4.46Å; I228-L284 HydrophobicContact CD1-CD1 3.78Å; I228-L284 HydrophobicContact CD1-CD2 4.27Å; I228-L284 HydrophobicContact CD1-CG 3.88Å; G280-L284 WeakPolarHBondContact O-CG 3.32Å; G280-L284 PolarHBondContact O-N 2.98Å; M281-L284 HydrophobicContact CE-CD1 4.41Å; M281-L284 PolarHBondContact O-N 3.24Å; M281-L284 HydrophobicContact SD-CD1 3.78Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 PolarHBondContact O-N 2.93Å; L284-R289 PolarHBondContact O-N 3.42Å; L284-I290 CarbonylContact C-O 3.55Å; L284-I290 PolarHBondContact O-N 3.09Å; L284-I380 HydrophobicContact CD1-CG2 4.31Å; L284-F383 HydrophobicContact CD1-CE1 3.79Å; L284-F383 HydrophobicContact CD1-CZ 4.27Å; L284-F383 HydrophobicContact CD2-CD1 4.49Å; L284-F383 HydrophobicContact CD2-CE1 3.61Å; L284-F383 HydrophobicContact CD2-CZ 4.19Å; L284-F383 HydrophobicContact CG-CE1 4.37Å
285	H	93.2	Very high	91.6	Very high	20 Å²	20	25.3 Å²	25.3	9%	0.093	13%	0.125	C	C	.	.	I	π-helix	trans	-76.3	-46.9	-175.7	-76.1	-160.7	0	0	0	113.4	M281 A282 R289 F417 D420 F485	M281-H285 WeakPolarHBondContact CE-NE2 3.42Å; M281-H285 PolarHBondContact O-N 3.09Å; A282-H285 PolarHBondContact O-N 3.36Å; H285-R289 WeakPolarHBondContact O-CA 3.35Å; H285-F417 HydrophobicContact CB-CD1 4.13Å; H285-F417 HydrophobicContact CB-CE1 4.41Å; H285-F417 AromaticContact CD2-CD1 3.48Å; H285-F417 VanDerWaalsContact CD2-CD1 3.48Å; H285-F417 WeakPolarHBondContact CD2-CD1 3.45Å; H285-F417 AromaticContact CE1-CD1 3.94Å; H285-F417 PolarHBondContact CE1-O 3.21Å; H285-F417 AromaticContact CG-CD1 3.61Å; H285-F417 AromaticContact ND1-CD1 3.9Å; H285-F417 AromaticContact NE2-CD1 3.69Å; H285-D420 IonicContact CD2-OD2 3.41Å; H285-D420 IonicContact CE1-OD2 3.44Å; H285-D420 IonicContact NE2-OD2 2.89Å; H285-D420 PolarHBondContact NE2-OD2 2.92Å; H285-F485 AromaticContact CE1-CD2 3.77Å; H285-F485 AromaticContact CE1-CE2 3.46Å; H285-F485 VanDerWaalsContact CE1-CE2 3.46Å; H285-F485 WeakPolarHBondContact CE1-CE2 3.37Å; H285-F485 AromaticContact ND1-CD2 3.54Å; H285-F485 AromaticContact ND1-CE2 3.75Å
286	T	91.1	Very high	91.1	Very high	70 Å²	70	24.1 Å²	24.1	43%	0.429	12%	0.119	S	C	.	.	I	π-helix	trans	-90	-48.8	-168.7	-70.6	0	0	0	0	111.7	A282 E486	A282-T286 WeakPolarHBondContact O-CB 3.31Å; A282-T286 PolarHBondContact O-N 3.1Å; T286-E486 PolarHBondContact OG1-OE1 2.99Å
287	D	88.7	Confident	90.2	Very high	110 Å²	110	23.6 Å²	23.6	59%	0.588	12%	0.116	S	C	*	.	I	π-helix	trans	-87	-55.1	-176	-54.9	-55.2	0	0	0	111.8	Y283	Y283-D287 HydrophobicContact CD2-CB 3.86Å; Y283-D287 WeakPolarHBondContact CD2-OD2 3.49Å; Y283-D287 HydrophobicContact CE2-CB 3.98Å; Y283-D287 WeakPolarHBondContact O-CB 3.3Å; Y283-D287 PolarHBondContact O-N 3.03Å
288	A	87	Confident	88.5	Confident	17 Å²	17	24.1 Å²	24.1	14%	0.14	12%	0.12	C	C	.	.	S	Bend	trans	-77.3	-23.3	-177.1	0	0	0	0	0	113.7	L223 Y283 I290	L223-A288 HydrophobicContact CD2-CB 3.51Å; Y283-A288 PolarHBondContact O-N 3.18Å; A288-I290 VanDerWaalsContact C-N 3.32Å; A288-I290 HydrophobicContact CB-CD1 4.07Å; A288-I290 HydrophobicContact CB-CG1 4.22Å; A288-I290 PolarHBondContact O-N 3.11Å
289	R	88.2	Confident	86.1	Confident	163 Å²	163	25.6 Å²	25.6	62%	0.615	13%	0.128	S	C	*	.			trans	56.9	40.1	-175.1	-55.6	-177.9	-178.2	-175.5	0.5	113.8	L284 H285 R388 S389	L284-R289 PolarHBondContact O-N 3.42Å; H285-R289 WeakPolarHBondContact O-CA 3.35Å; R289-R388 WeakPolarHBondContact O-CA 3.43Å; R289-S389 PolarHBondContact O-N 3.38Å
290	I	86.2	Confident	83.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.8	-179.5	-65.6	172.2	0	0	0	109.5	H219 L223 L284 A288 A386 C387 R388	H219-I290 HydrophobicContact CB-CD1 3.94Å; L223-I290 HydrophobicContact CD2-CD1 4.17Å; L284-I290 CarbonylContact C-O 3.55Å; L284-I290 PolarHBondContact O-N 3.09Å; A288-I290 VanDerWaalsContact C-N 3.32Å; A288-I290 HydrophobicContact CB-CD1 4.07Å; A288-I290 HydrophobicContact CB-CG1 4.22Å; A288-I290 PolarHBondContact O-N 3.11Å; I290-A386 HydrophobicContact CG2-CB 3.76Å; I290-C387 WeakPolarHBondContact CA-O 3.33Å; I290-R388 HydrophobicContact CG1-CG 4.23Å
291	C	84.2	Confident	80	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.8	166.4	173.6	0	0	0	0	108.6	R293 A386 C387 L392 S416 F417 D420	C291-R293 HydrophobicContact CB-CG 4.5Å; C291-R293 VanDerWaalsContact SG-CG 3.56Å; C291-A386 CarbonylContact O-C 3.59Å; C291-A386 VanDerWaalsContact O-CA 3.23Å; C291-A386 WeakPolarHBondContact O-CA 3.32Å; C291-A386 WeakPolarHBondContact O-CB 3.48Å; C291-C387 PolarHBondContact N-O 3.15Å; C291-C387 PolarHBondContact O-N 2.78Å; C291-L392 HydrophobicContact CB-CD2 4.16Å; C291-S416 PolarHBondContact SG-O 2.85Å; C291-F417 HydrophobicContact CB-CD1 4.02Å; C291-F417 HydrophobicContact CB-CE1 4.17Å; C291-D420 WeakPolarHBondContact CA-OD2 3.38Å; C291-D420 PolarHBondContact SG-OD1 3.12Å; C291-D420 PolarHBondContact SG-OD2 2.66Å
292	H	87.8	Confident	76.6	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.			trans	-78.8	-36.5	-173	-171.1	-26.4	0	0	0	112.4	M281 D294 I380 T381 D420	M281-H292 HydrophobicContact CE-CB 4.03Å; M281-H292 HydrophobicContact SD-CB 4.38Å; H292-D294 PolarHBondContact O-N 3.44Å; H292-I380 VanDerWaalsContact CD2-CG2 3.44Å; H292-I380 WeakPolarHBondContact CD2-CG2 3.25Å; H292-I380 WeakPolarHBondContact NE2-CG2 2.95Å; H292-T381 PolarHBondContact CE1-O 3.03Å; H292-T381 PolarHBondContact NE2-O 2.91Å; H292-D420 PolarHBondContact N-OD1 2.82Å; H292-D420 PolarHBondContact N-OD2 2.84Å
293	R	84.7	Confident	73.2	Confident	29 Å²	29	46.4 Å²	46.4	11%	0.109	22%	0.217	C	C	.	.	S	Bend	trans	63.9	-13.4	178.5	-56.5	-165	178.6	159.5	-14.4	117.8	C291 M385 C387 L392 F415 D420	C291-R293 HydrophobicContact CB-CG 4.5Å; C291-R293 VanDerWaalsContact SG-CG 3.56Å; R293-M385 HydrophobicContact CB-CB 4.21Å; R293-M385 VanDerWaalsContact CD-O 3.31Å; R293-M385 WeakPolarHBondContact CD-O 3.27Å; R293-C387 PolarHBondContact NH2-SG 2.87Å; R293-L392 VanDerWaalsContact NH2-CD2 3.34Å; R293-F415 HydrophobicContact CB-CD1 3.59Å; R293-F415 HydrophobicContact CB-CE1 3.67Å; R293-F415 HydrophobicContact CB-CG 4.18Å; R293-F415 HydrophobicContact CB-CZ 4.31Å; R293-F415 VanDerWaalsContact CD-CG 3.47Å; R293-F415 HydrophobicContact CG-CB 3.83Å; R293-F415 HydrophobicContact CG-CD1 3.54Å; R293-F415 HydrophobicContact CG-CD2 4.49Å; R293-F415 HydrophobicContact CG-CE1 4.15Å; R293-F415 HydrophobicContact CG-CG 3.73Å; R293-F415 VanDerWaalsContact NE-CB 3.33Å; R293-F415 VanDerWaalsContact O-CE1 3.24Å; R293-F415 WeakPolarHBondContact O-CE1 3.39Å; R293-D420 PolarHBondContact N-OD1 3.26Å
294	D	83.8	Confident	69.8	Low	13 Å²	13	48.6 Å²	48.6	7%	0.07	24%	0.237	C	C	.	.			trans	-143.4	34.7	-177.4	-157	29.5	0	0	0	112.8	H292 K296 S357 M385	H292-D294 PolarHBondContact O-N 3.44Å; D294-K296 PolarHBondContact O-N 3.05Å; D294-K296 WeakPolarHBondContact OD1-CE 3.46Å; D294-K296 IonicContact OD1-NZ 2.85Å; D294-K296 PolarHBondContact OD1-NZ 3.04Å; D294-K296 VanDerWaalsContact OD2-CE 3.29Å; D294-K296 WeakPolarHBondContact OD2-CE 3.46Å; D294-K296 IonicContact OD2-NZ 2.78Å; D294-K296 PolarHBondContact OD2-NZ 3.19Å; D294-S357 WeakPolarHBondContact O-CB 3.41Å; D294-S357 PolarHBondContact O-OG 2.7Å; D294-M385 HydrophobicContact CB-CB 4.29Å; D294-M385 HydrophobicContact CB-CG 4.38Å
295	L	88.2	Confident	66.4	Low	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.255	C	S	.	.			trans	-66.7	118.2	176.6	178.4	69.5	0	0	0	110.8	I277 M281 V358 I380 S423	I277-L295 HydrophobicContact CG2-CD1 4.47Å; M281-L295 HydrophobicContact CE-CD2 4.32Å; M281-L295 HydrophobicContact CG-CD2 3.89Å; M281-L295 HydrophobicContact SD-CD1 4.02Å; M281-L295 HydrophobicContact SD-CD2 3.82Å; M281-L295 HydrophobicContact SD-CG 4.38Å; L295-V358 HydrophobicContact CD1-CG2 4.14Å; L295-I380 HydrophobicContact CD1-CG2 4.42Å; L295-S423 WeakPolarHBondContact O-CB 3.23Å
296	K	85.7	Confident	63	Low	2 Å²	2	56.8 Å²	56.8	1%	0.009	28%	0.283	C	S	.	.			trans	-163.2	153	-179.8	60.6	-156.3	169.7	-173	0	111.3	D294 S298 N299 T401 Y404	D294-K296 PolarHBondContact O-N 3.05Å; D294-K296 WeakPolarHBondContact OD1-CE 3.46Å; D294-K296 IonicContact OD1-NZ 2.85Å; D294-K296 PolarHBondContact OD1-NZ 3.04Å; D294-K296 VanDerWaalsContact OD2-CE 3.29Å; D294-K296 WeakPolarHBondContact OD2-CE 3.46Å; D294-K296 IonicContact OD2-NZ 2.78Å; D294-K296 PolarHBondContact OD2-NZ 3.19Å; K296-S298 WeakPolarHBondContact CD-O 3.28Å; K296-S298 WeakPolarHBondContact CG-O 3.09Å; K296-N299 WeakPolarHBondContact CE-OD1 3.31Å; K296-N299 PolarHBondContact NZ-OD1 3.08Å; K296-T401 PolarHBondContact NZ-OG1 2.74Å; K296-Y404 HydrophobicContact CB-CD1 3.55Å; K296-Y404 HydrophobicContact CB-CD2 3.61Å; K296-Y404 HydrophobicContact CB-CE1 3.57Å; K296-Y404 HydrophobicContact CB-CE2 3.61Å; K296-Y404 HydrophobicContact CB-CG 3.58Å; K296-Y404 HydrophobicContact CD-CD2 4.31Å
297	S	78.2	Confident	59.9	Low	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-77.1	-32.8	167.2	89.2	0	0	0	0	111.4	N256 K356 E430	N256-S297 WeakPolarHBondContact CB-O 3.39Å; N256-S297 WeakPolarHBondContact CB-OG 3.44Å; S297-K356 WeakPolarHBondContact O-CD 3.33Å; S297-E430 VanDerWaalsContact CB-OE2 3.27Å; S297-E430 WeakPolarHBondContact CB-OE2 3.25Å; S297-E430 PolarHBondContact OG-OE1 2.84Å; S297-E430 PolarHBondContact OG-OE2 3.04Å
298	S	62.5	Low	56.9	Low	11 Å²	11	59.7 Å²	59.7	8%	0.077	30%	0.302	C	S	.	.			trans	-122.4	131.4	-166.2	-157.7	0	0	0	0	113.3	N256 K296 Y404	N256-S298 WeakPolarHBondContact ND2-CB 3.49Å; N256-S298 PolarHBondContact ND2-OG 3.3Å; N256-S298 PolarHBondContact OD1-OG 2.8Å; K296-S298 WeakPolarHBondContact CD-O 3.28Å; K296-S298 WeakPolarHBondContact CG-O 3.09Å; S298-Y404 WeakPolarHBondContact CB-OH 3.48Å; S298-Y404 PolarHBondContact N-OH 3.19Å
299	N	46.7	Very low	54	Low	32 Å²	32	69.1 Å²	69.1	17%	0.171	34%	0.34	C	S	.	.			trans	-115.7	75.6	-178.2	-153.5	-3.9	0	0	0	111.3	K296 N301 L355 K356 T401	K296-N299 WeakPolarHBondContact CE-OD1 3.31Å; K296-N299 PolarHBondContact NZ-OD1 3.08Å; N299-N301 PolarHBondContact O-N 3.3Å; N299-L355 WeakPolarHBondContact CB-O 3.39Å; N299-L355 PolarHBondContact ND2-O 2.85Å; N299-K356 HydrophobicContact CB-CG 3.99Å; N299-T401 PolarHBondContact OD1-OG1 3.13Å
300	R	40.7	Very low	51.2	Low	148 Å²	148	63.9 Å²	63.9	56%	0.558	33%	0.328	S	S	*	.			trans	-78.1	49.5	176.6	-86.1	-168.7	172.5	-172.2	-0.6	112.7
301	N	24.7	Very low	48.5	Very low	60 Å²	60	68.8 Å²	68.8	32%	0.321	35%	0.35	S	S	.	.			trans	-124.1	65.6	175.2	-83.3	-9.7	0	0	0	111.2	N299 Q443	N299-N301 PolarHBondContact O-N 3.3Å; N301-Q443 PolarHBondContact OD1-NE2 3.46Å
302	I	24.3	Very low	45.9	Very low	93 Å²	93	75 Å²	75	48%	0.477	38%	0.383	S	S	.	.			trans	-125.2	137.6	157.7	-48.7	-178.4	0	0	0	106.1	S304	I302-S304 PolarHBondContact O-N 2.91Å
303	F	23.6	Very low	43.1	Very low	166 Å²	166	85 Å²	85	73%	0.728	42%	0.42	S	S	*	.			trans	-71.9	55.4	157.6	-83.8	-114.9	0	0	0	108.8	Y305 R567	F303-Y305 PolarHBondContact O-N 3.06Å; F303-Y305 VanDerWaalsContact O-N 3.14Å; F303-R567 VanDerWaalsContact CD1-NH2 3.3Å
304	S	23.5	Very low	40.4	Very low	86 Å²	86	90 Å²	90	60%	0.601	45%	0.449	S	S	*	.			trans	-63.2	120.9	175.4	57.3	0	0	0	0	106.4	I302 S306	I302-S304 PolarHBondContact O-N 2.91Å; S304-S306 PolarHBondContact O-N 2.72Å
305	Y	22.3	Very low	37.9	Very low	96 Å²	96	96.4 Å²	96.4	38%	0.376	48%	0.478	S	S	.	.			trans	-43.9	130.2	172.1	-78.7	-146.5	0	0	0	108.7	F303 P307 V571 A574 H575	F303-Y305 PolarHBondContact O-N 3.06Å; F303-Y305 VanDerWaalsContact O-N 3.14Å; Y305-P307 WeakPolarHBondContact O-CD 3.48Å; Y305-P307 VanDerWaalsContact O-N 3.11Å; Y305-V571 HydrophobicContact CD1-CB 4.28Å; Y305-V571 HydrophobicContact CD1-CG1 3.66Å; Y305-V571 HydrophobicContact CD1-CG2 4.08Å; Y305-V571 HydrophobicContact CD2-CG2 3.87Å; Y305-V571 HydrophobicContact CE1-CB 3.99Å; Y305-V571 HydrophobicContact CE1-CG1 3.63Å; Y305-V571 HydrophobicContact CE1-CG2 4.06Å; Y305-V571 WeakPolarHBondContact CE1-O 3.23Å; Y305-V571 HydrophobicContact CE2-CG2 3.87Å; Y305-V571 HydrophobicContact CG-CG1 4.31Å; Y305-V571 HydrophobicContact CG-CG2 3.96Å; Y305-V571 VanDerWaalsContact CZ-O 3.23Å; Y305-V571 WeakPolarHBondContact OH-CA 3.31Å; Y305-V571 PolarHBondContact OH-O 2.59Å; Y305-A574 WeakPolarHBondContact OH-CB 3.46Å; Y305-H575 HydrophobicContact CE1-CB 4.21Å; Y305-H575 PolarHBondContact OH-N 2.75Å
306	S	21	Very low	35	Very low	96 Å²	96	100.5 Å²	100.5	67%	0.671	51%	0.507	S	S	*	.			trans	-58.4	113.2	154.5	-62.8	0	0	0	0	105.9	S304 L308	S304-S306 PolarHBondContact O-N 2.72Å; S306-L308 PolarHBondContact O-N 2.77Å
307	P	25.8	Very low	32.2	Very low	120 Å²	120	109 Å²	109	78%	0.779	54%	0.544	S	S	*	.			trans	-57.6	117.2	158.8	27.5	-31.9	0	0	0	104.4	Y305 K309	Y305-P307 WeakPolarHBondContact O-CD 3.48Å; Y305-P307 VanDerWaalsContact O-N 3.11Å; P307-K309 PolarHBondContact O-N 2.85Å
308	L	25	Very low	29.8	Very low	121 Å²	121	116.4 Å²	116.4	63%	0.634	58%	0.583	S	S	*	*			trans	-48.1	135.9	-168.1	-79.1	163.9	0	0	0	109.8	S306 S310	S306-L308 PolarHBondContact O-N 2.77Å; L308-S310 WeakPolarHBondContact CB-OG 3.47Å; L308-S310 PolarHBondContact O-N 3.27Å; L308-S310 PolarHBondContact O-OG 3.2Å
309	K	27.7	Very low	28.1	Very low	215 Å²	215	121.5 Å²	121.5	94%	0.935	61%	0.614	S	S	*	*	S	Bend	trans	-71.6	43.1	168.7	-77.5	-169.7	172.4	-173.5	0	110.9	P307	P307-K309 PolarHBondContact O-N 2.85Å
310	S	29.5	Very low	27.1	Very low	54 Å²	54	130.6 Å²	130.6	38%	0.378	65%	0.646	S	S	.	*			trans	-95.1	6.8	175.6	56.6	0	0	0	0	112.8	L308 N312 R313	L308-S310 WeakPolarHBondContact CB-OG 3.47Å; L308-S310 PolarHBondContact O-N 3.27Å; L308-S310 PolarHBondContact O-OG 3.2Å; S310-N312 PolarHBondContact O-N 2.87Å; S310-R313 PolarHBondContact O-N 3.21Å
311	K	28.9	Very low	26.5	Very low	103 Å²	103	132.1 Å²	132.1	45%	0.448	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.8	-24.1	172.8	-95	-168.5	162.6	-151.4	0	114	F1024	K311-F1024 HydrophobicContact CD-CE1 3.81Å; K311-F1024 HydrophobicContact CD-CZ 4.23Å; K311-F1024 HydrophobicContact CG-CE1 4.5Å
312	N	30.1	Very low	26.5	Very low	131 Å²	131	132.4 Å²	132.4	70%	0.701	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	23.2	179.3	-62	16.3	0	0	0	113.4	S310	S310-N312 PolarHBondContact O-N 2.87Å
313	R	27.7	Very low	26.7	Very low	208 Å²	208	138.9 Å²	138.9	79%	0.785	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	-6.6	172.9	-98.5	-168.7	177.5	-162.2	-1	116.5	S310	S310-R313 PolarHBondContact O-N 3.21Å
314	L	28.2	Very low	26.8	Very low	134 Å²	134	137.8 Å²	137.8	70%	0.702	69%	0.69	S	S	*	*	S	Bend	trans	-101.8	-1	173.6	-88.3	164.7	0	0	0	114.3
315	Q	30.9	Very low	26.9	Very low	149 Å²	149	142.8 Å²	142.8	70%	0.696	70%	0.697	S	S	*	*	S	Bend	trans	-97.9	-2	-179.5	-159.1	164.5	-4.7	0	0	113.5
316	S	27.8	Very low	26.9	Very low	86 Å²	86	147.3 Å²	147.3	60%	0.601	72%	0.719	S	S	*	*	S	Bend	trans	-107.5	8.6	178.7	61.9	0	0	0	0	114.2
317	F	27.7	Very low	27.1	Very low	180 Å²	180	148.4 Å²	148.4	79%	0.789	73%	0.727	S	S	*	*	S	Bend	trans	-119.3	5.8	-174.9	-110.6	-78.7	0	0	0	114.2
318	L	26.5	Very low	27	Very low	155 Å²	155	147.2 Å²	147.2	81%	0.812	72%	0.717	S	S	*	*	S	Bend	trans	-126.7	22.5	-177.2	-74.9	171.3	0	0	0	113.4
319	T	26.4	Very low	27.1	Very low	118 Å²	118	147.5 Å²	147.5	72%	0.724	72%	0.719	S	S	*	*	S	Bend	trans	-138.3	51.4	177.5	57.9	0	0	0	0	112.9
320	R	26.1	Very low	26.9	Very low	224 Å²	224	145 Å²	145	85%	0.845	71%	0.711	S	S	*	*	S	Bend	trans	-158.9	125	154.3	-110.6	170.2	-170.3	-177	0.7	109.3
321	E	29.2	Very low	26.8	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	73%	0.73	S	S	*	*			trans	62.1	141.5	173.2	-63	161.7	-136.4	0	0	116.6
322	G	25.2	Very low	26.8	Very low	66 Å²	66	152.7 Å²	152.7	68%	0.68	75%	0.752	S	S	*	*			cis	147.3	97.6	-15.5	0	0	0	0	0	114
323	R	27.9	Very low	26.4	Very low	228 Å²	228	155.7 Å²	155.7	86%	0.86	76%	0.759	S	S	*	*			trans	74.6	152.8	174.5	-55.5	174.6	178.7	-170.6	-0.5	114
324	F	24.7	Very low	26.3	Very low	144 Å²	144	150.4 Å²	150.4	63%	0.632	76%	0.76	S	S	*	*			cis	-156.6	164	-2.4	-125.9	-36.7	0	0	0	113.3
325	Y	26.1	Very low	26.4	Very low	191 Å²	191	150 Å²	150	75%	0.749	76%	0.762	S	S	*	*			trans	72.4	119.6	155.8	-76.1	-65.8	0	0	0	123.4
326	F	21.9	Very low	26.4	Very low	190 Å²	190	150 Å²	150	83%	0.833	77%	0.767	S	S	*	*			trans	-80.3	157.8	151	-90.8	-106.5	0	0	0	111	V328	F326-V328 HydrophobicContact CB-CG2 4.27Å; F326-V328 HydrophobicContact CD1-CG2 4.1Å
327	S	26.7	Very low	26.4	Very low	120 Å²	120	157.7 Å²	157.7	84%	0.839	78%	0.783	S	S	*	*			trans	-128.3	157.1	144	-169.4	0	0	0	0	109.1
328	V	23.9	Very low	26.4	Very low	95 Å²	95	153.8 Å²	153.8	58%	0.576	78%	0.777	S	S	*	*			trans	-144.6	161.2	-163.4	-169.9	0	0	0	0	110.6	F326	F326-V328 HydrophobicContact CB-CG2 4.27Å; F326-V328 HydrophobicContact CD1-CG2 4.1Å
329	N	25.7	Very low	26.6	Very low	126 Å²	126	152.6 Å²	152.6	67%	0.674	77%	0.77	S	S	*	*			trans	99.1	146.1	165.5	-52.2	-57.3	0	0	0	115.6
330	Q	24.8	Very low	26.7	Very low	162 Å²	162	152 Å²	152	76%	0.757	77%	0.769	S	S	*	*			cis	-163.5	134.2	-18.2	-114.3	170.7	44.5	0	0	108.3
331	S	27.2	Very low	26.9	Very low	113 Å²	113	149 Å²	149	79%	0.79	76%	0.763	S	S	*	*			trans	163	96.6	142.1	-79	0	0	0	0	112
332	F	27.5	Very low	27	Very low	206 Å²	206	144.2 Å²	144.2	90%	0.904	75%	0.749	S	S	*	*				-175.3	150.6	112.4	-108.8	-81.3	0	0	0	109.1
333	K	22.9	Very low	27.4	Very low	195 Å²	195	146.4 Å²	146.4	85%	0.848	74%	0.744	S	S	*	*			trans	-124.8	150.7	176.7	-77.8	-178.8	177.2	175.3	0	109.2
334	A	25.4	Very low	27.7	Very low	97 Å²	97	142.4 Å²	142.4	80%	0.802	74%	0.738	S	S	*	*			trans	65.5	144.9	-172.5	0	0	0	0	0	113
335	V	30.5	Very low	27.9	Very low	124 Å²	124	142.7 Å²	142.7	75%	0.752	74%	0.74	S	S	*	*	S	Bend	cis	-121	151	10.9	172.7	0	0	0	0	111.7
336	D	30.7	Very low	28.1	Very low	150 Å²	150	141 Å²	141	80%	0.802	74%	0.738	S	S	*	*			trans	48.9	122.2	164.6	-63.8	-13.5	0	0	0	124.4	C338	D336-C338 PolarHBondContact O-N 3.31Å
337	R	27.3	Very low	28.5	Very low	248 Å²	248	139.1 Å²	139.1	94%	0.936	74%	0.736	S	S	*	*			trans	-90.4	78.8	167.4	-65.7	171.2	170.3	168.2	-5.3	111.5
338	C	27.3	Very low	28.4	Very low	97 Å²	97	140.1 Å²	140.1	66%	0.655	73%	0.725	S	S	*	*			trans	-156	114.6	162.7	-101.6	0	0	0	0	112.2	D336	D336-C338 PolarHBondContact O-N 3.31Å
339	I	31.7	Very low	28.6	Very low	130 Å²	130	145.1 Å²	145.1	67%	0.667	74%	0.739	S	S	*	*	S	Bend	trans	171.7	-45.4	152.1	-95.7	153.5	0	0	0	111.2	F341 S342 I343	I339-F341 VanDerWaalsContact C-N 3.25Å; I339-F341 PolarHBondContact O-N 3.35Å; I339-S342 PolarHBondContact O-N 3.5Å; I339-S342 VanDerWaalsContact O-N 3.15Å; I339-I343 HydrophobicContact CG2-CD1 4.31Å
340	C	28.6	Very low	28.7	Very low	106 Å²	106	146.8 Å²	146.8	72%	0.716	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-6.6	-160.4	-61.2	0	0	0	0	117.5
341	F	30.7	Very low	28.9	Very low	162 Å²	162	145.6 Å²	145.6	71%	0.711	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-11.3	175.4	-108.5	-80.8	0	0	0	114.7	I339 L1018	I339-F341 VanDerWaalsContact C-N 3.25Å; I339-F341 PolarHBondContact O-N 3.35Å; F341-L1018 HydrophobicContact CB-CD1 4.27Å; F341-L1018 HydrophobicContact CD1-CD1 3.47Å; F341-L1018 VanDerWaalsContact CD1-CD1 3.47Å; F341-L1018 HydrophobicContact CE1-CD1 3.98Å; F341-L1018 HydrophobicContact CE1-CD2 4.44Å; F341-L1018 HydrophobicContact CG-CD1 3.95Å
342	S	30.3	Very low	29	Very low	78 Å²	78	143.1 Å²	143.1	55%	0.545	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-31.6	-178.4	-64.7	0	0	0	0	113.3	I339	I339-S342 PolarHBondContact O-N 3.5Å; I339-S342 VanDerWaalsContact O-N 3.15Å
343	I	34	Very low	29.5	Very low	113 Å²	113	136.1 Å²	136.1	58%	0.579	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-41.7	-170.2	-62.3	174.5	0	0	0	111.9	I339 F345 H346	I339-I343 HydrophobicContact CG2-CD1 4.31Å; I343-F345 VanDerWaalsContact C-N 3.33Å; I343-F345 PolarHBondContact O-N 3.18Å; I343-H346 PolarHBondContact O-N 2.96Å
344	I	33.2	Very low	30.1	Very low	143 Å²	143	128.4 Å²	128.4	73%	0.733	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-23.6	-173.7	-64.5	176.8	0	0	0	112.7
345	F	28.9	Very low	31.1	Very low	151 Å²	151	124.2 Å²	124.2	66%	0.662	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-11.9	-179.9	-136.4	-91.1	0	0	0	114.2	I343	I343-F345 VanDerWaalsContact C-N 3.33Å; I343-F345 PolarHBondContact O-N 3.18Å
346	H	31.8	Very low	33	Very low	155 Å²	155	119 Å²	119	72%	0.718	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-11.7	-178.8	-104.6	3.7	0	0	0	115	I343 K348	I343-H346 PolarHBondContact O-N 2.96Å; H346-K348 PolarHBondContact O-N 3.03Å
347	L	29.3	Very low	35.4	Very low	151 Å²	151	111.9 Å²	111.9	79%	0.791	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	7.5	178.5	-64.7	176.2	0	0	0	114.5
348	K	25.3	Very low	38.3	Very low	141 Å²	141	100.1 Å²	100.1	61%	0.613	50%	0.503	S	S	*	.	S	Bend	trans	-92.1	107.8	172.9	-78.2	-179.2	177.2	172.9	0	111.6	H346	H346-K348 PolarHBondContact O-N 3.03Å
349	K	28.9	Very low	41.4	Very low	199 Å²	199	96.5 Å²	96.5	87%	0.865	48%	0.477	S	S	*	.			trans	84.3	40.4	169.5	-55.2	-178.6	175.9	174.3	0	119	Q351	K349-Q351 PolarHBondContact O-N 2.96Å
350	F	26.5	Very low	44.2	Very low	162 Å²	162	90.3 Å²	90.3	71%	0.711	45%	0.446	S	S	*	.			trans	-74.7	71.2	152.5	-90	-82.8	0	0	0	111.5	V352	F350-V352 PolarHBondContact O-N 2.94Å; F350-V352 VanDerWaalsContact O-N 3.15Å
351	Q	29.2	Very low	47.2	Very low	137 Å²	137	88.1 Å²	88.1	64%	0.64	42%	0.422	S	S	*	.			trans	-75.8	96	163.1	-96.7	-167.9	-20.4	0	0	109	K349 K353	K349-Q351 PolarHBondContact O-N 2.96Å; Q351-K353 HydrophobicContact CB-CD 4.27Å; Q351-K353 WeakPolarHBondContact O-CB 3.34Å; Q351-K353 WeakPolarHBondContact O-CD 3.38Å; Q351-K353 VanDerWaalsContact O-CG 3.25Å; Q351-K353 WeakPolarHBondContact O-CG 3.38Å; Q351-K353 PolarHBondContact O-N 2.79Å
352	V	29.7	Very low	50.2	Low	60 Å²	60	83 Å²	83	36%	0.364	40%	0.4	S	S	.	.			trans	-45.5	122.7	166.7	-173	0	0	0	0	110.4	S185 F350	S185-V352 VanDerWaalsContact O-CG1 3.23Å; S185-V352 WeakPolarHBondContact O-CG1 3.26Å; F350-V352 PolarHBondContact O-N 2.94Å; F350-V352 VanDerWaalsContact O-N 3.15Å
353	K	38.2	Very low	52.9	Low	59 Å²	59	82.5 Å²	82.5	26%	0.257	40%	0.401	S	S	.	.			trans	-142	3	-158.5	-103.3	170.4	-173.8	157.9	0	118.5	S254 M257 Q351 K356	S254-K353 PolarHBondContact OG-O 3.39Å; S254-K353 VanDerWaalsContact OG-O 3.07Å; M257-K353 HydrophobicContact CG-CD 4.3Å; M257-K353 HydrophobicContact SD-CD 4.01Å; Q351-K353 HydrophobicContact CB-CD 4.27Å; Q351-K353 WeakPolarHBondContact O-CB 3.34Å; Q351-K353 WeakPolarHBondContact O-CD 3.38Å; Q351-K353 VanDerWaalsContact O-CG 3.25Å; Q351-K353 WeakPolarHBondContact O-CG 3.38Å; Q351-K353 PolarHBondContact O-N 2.79Å; K353-K356 WeakPolarHBondContact O-CE 3.46Å
354	C	34.8	Very low	55.3	Low	33 Å²	33	78.1 Å²	78.1	22%	0.223	38%	0.38	C	S	.	.			trans	-115.7	6.8	-147.4	-54.1	0	0	0	0	116.9	I183	I183-C354 HydrophobicContact CB-CB 4.31Å; I183-C354 HydrophobicContact CG2-CB 4.41Å; I183-C354 WeakPolarHBondContact CG2-SG 3.35Å; I183-C354 PolarHBondContact O-SG 3.42Å
355	L	47.4	Very low	57.6	Low	10 Å²	10	78.3 Å²	78.3	5%	0.052	38%	0.378	C	S	.	.			trans	-112.5	89.1	162.6	-66.5	-178.1	0	0	0	108.6	V191 K204 N299 D382	V191-L355 HydrophobicContact CG2-CD1 4.43Å; V191-L355 HydrophobicContact CG2-CD2 3.4Å; V191-L355 VanDerWaalsContact CG2-CD2 3.4Å; V191-L355 HydrophobicContact CG2-CG 3.74Å; K204-L355 HydrophobicContact CD-CD2 3.75Å; K204-L355 HydrophobicContact CG-CD2 4.15Å; N299-L355 WeakPolarHBondContact CB-O 3.39Å; N299-L355 PolarHBondContact ND2-O 2.85Å; L355-D382 WeakPolarHBondContact CA-OD2 3.43Å; L355-D382 WeakPolarHBondContact CD2-OD1 3.31Å
356	K	69.7	Low	60	Low	15 Å²	15	76.8 Å²	76.8	7%	0.065	37%	0.371	C	S	.	.			trans	-144.6	138.7	172.5	-46.2	-165.9	-159	156	0	109.2	S254 N256 S297 N299 K353 V358 L359 T381 D382	S254-K356 WeakPolarHBondContact OG-CD 3.47Å; S254-K356 WeakPolarHBondContact OG-CE 3.34Å; S254-K356 PolarHBondContact OG-NZ 3.28Å; N256-K356 HydrophobicContact CB-CD 4.27Å; N256-K356 PolarHBondContact OD1-NZ 2.79Å; S297-K356 WeakPolarHBondContact O-CD 3.33Å; N299-K356 HydrophobicContact CB-CG 3.99Å; K353-K356 WeakPolarHBondContact O-CE 3.46Å; K356-V358 PolarHBondContact O-N 3.2Å; K356-L359 WeakPolarHBondContact O-CD2 3.46Å; K356-T381 WeakPolarHBondContact O-CG2 3.24Å; K356-D382 PolarHBondContact N-OD2 2.72Å
357	S	80.2	Confident	62.3	Low	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	-70.5	-4.4	-164.3	-26.8	0	0	0	0	116.1	D294 I380 T381	D294-S357 WeakPolarHBondContact O-CB 3.41Å; D294-S357 PolarHBondContact O-OG 2.7Å; S357-I380 VanDerWaalsContact O-CA 3.3Å; S357-I380 WeakPolarHBondContact O-CA 3.2Å; S357-T381 WeakPolarHBondContact CA-O 3.47Å; S357-T381 WeakPolarHBondContact CB-O 3.43Å; S357-T381 PolarHBondContact O-N 2.91Å
358	V	89.3	Confident	64.8	Low	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	122.2	171	-169.6	0	0	0	0	110.6	L255 I277 L295 K356 L378 L379	L255-V358 HydrophobicContact CB-CB 4.14Å; L255-V358 HydrophobicContact CB-CG1 4.03Å; L255-V358 HydrophobicContact CD2-CB 4.15Å; L255-V358 HydrophobicContact CD2-CG1 3.78Å; L255-V358 PolarHBondContact N-O 3.18Å; I277-V358 HydrophobicContact CD1-CG1 4.15Å; I277-V358 HydrophobicContact CG1-CG1 4.22Å; L295-V358 HydrophobicContact CD1-CG2 4.14Å; K356-V358 PolarHBondContact O-N 3.2Å; V358-L378 HydrophobicContact CG1-CB 4.29Å; V358-L378 HydrophobicContact CG1-CD1 4.44Å; V358-L379 CarbonylContact C-O 3.57Å; V358-L379 WeakPolarHBondContact CA-O 3.48Å
359	L	91.3	Very high	67.6	Low	22 Å²	22	65.2 Å²	65.2	12%	0.115	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	164.7	179.7	-51.8	-178.8	0	0	0	111.6	A250 G253 K356 L378 L379 T381	A250-L359 HydrophobicContact CB-CB 3.68Å; A250-L359 HydrophobicContact CB-CD1 3.72Å; A250-L359 HydrophobicContact CB-CG 4.33Å; G253-L359 CarbonylContact O-C 3.42Å; G253-L359 WeakPolarHBondContact O-CA 3.29Å; G253-L359 WeakPolarHBondContact O-CB 3.29Å; K356-L359 WeakPolarHBondContact O-CD2 3.46Å; L359-L378 CarbonylContact O-C 2.94Å; L359-L378 WeakPolarHBondContact O-CA 3.41Å; L359-L379 HydrophobicContact CB-CB 4.48Å; L359-L379 PolarHBondContact N-O 3.45Å; L359-L379 PolarHBondContact O-N 2.89Å; L359-T381 HydrophobicContact CD1-CG2 3.86Å; L359-T381 HydrophobicContact CD2-CG2 4.35Å; L359-T381 HydrophobicContact CG-CG2 3.75Å
360	I	91.5	Very high	70.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.6	171.8	-65.2	162.5	0	0	0	107.9	A250 G252 G253 V258 W273 V364 C376 L378	A250-I360 CarbonylContact C-O 3.59Å; A250-I360 WeakPolarHBondContact CB-O 3.39Å; G252-I360 WeakPolarHBondContact CA-O 3.21Å; G252-I360 PolarHBondContact N-O 2.88Å; G253-I360 PolarHBondContact O-N 3.44Å; V258-I360 HydrophobicContact CB-CD1 4.19Å; V258-I360 HydrophobicContact CG2-CD1 3.48Å; V258-I360 VanDerWaalsContact CG2-CD1 3.48Å; W273-I360 HydrophobicContact CH2-CD1 4.36Å; I360-V364 HydrophobicContact CG2-CG1 4.35Å; I360-C376 HydrophobicContact CG2-CB 3.88Å; I360-L378 HydrophobicContact CB-CD2 4.48Å; I360-L378 HydrophobicContact CG1-CD2 3.55Å
361	R	91.7	Very high	72.9	Confident	59 Å²	59	55.4 Å²	55.4	22%	0.223	30%	0.295	C	S	.	.	S	Bend	trans	-61.7	-52.8	-177	165.1	175.8	-84.9	136.5	5.3	111.7	R226 E248 Y251 T377 L379	R226-R361 PolarHBondContact O-NH1 3.19Å; E248-R361 VanDerWaalsContact CD-NH2 3.25Å; E248-R361 IonicContact OE1-CZ 3.06Å; E248-R361 IonicContact OE1-NE 3.96Å; E248-R361 PolarHBondContact OE1-NE 3.36Å; E248-R361 IonicContact OE1-NH2 2.72Å; E248-R361 PolarHBondContact OE1-NH2 2.93Å; E248-R361 IonicContact OE2-CZ 3.01Å; E248-R361 IonicContact OE2-NH2 3.92Å; E248-R361 PolarHBondContact OE2-NH2 3.47Å; Y251-R361 WeakPolarHBondContact CD2-O 3.48Å; Y251-R361 PolarHBondContact N-O 3.05Å; R361-T377 WeakPolarHBondContact CB-O 3Å; R361-T377 PolarHBondContact N-O 3.01Å; R361-L379 HydrophobicContact CB-CD1 3.89Å; R361-L379 HydrophobicContact CB-CG 4.1Å
362	E	92.2	Very high	75.5	Confident	54 Å²	54	51.1 Å²	51.1	25%	0.252	28%	0.275	S	S	.	.	S	Bend	trans	-83.1	155.3	-169.8	-57	76.3	-171.7	0	0	111.7	G252 C376 T377	G252-E362 WeakPolarHBondContact CA-O 3.45Å; G252-E362 PolarHBondContact N-O 2.94Å; E362-C376 VanDerWaalsContact OE2-CA 3.32Å; E362-C376 WeakPolarHBondContact OE2-CA 3.47Å; E362-T377 VanDerWaalsContact CD-N 3.3Å; E362-T377 WeakPolarHBondContact OE1-CB 3.5Å; E362-T377 PolarHBondContact OE1-N 2.68Å; E362-T377 PolarHBondContact OE1-OG1 3.48Å; E362-T377 PolarHBondContact OE2-N 3.19Å
363	A	87.8	Confident	78.3	Confident	68 Å²	68	48.2 Å²	48.2	56%	0.562	26%	0.258	S	S	*	.			trans	-71	133	177.5	0	0	0	0	0	110.7
364	V	84.9	Confident	80.7	Confident	22 Å²	22	48.6 Å²	48.6	13%	0.133	26%	0.26	C	S	.	.			trans	-122.2	123.7	176.8	-71.9	0	0	0	0	110.9	V258 I360 F368 L373 C376	V258-V364 HydrophobicContact CG2-CG2 4.33Å; I360-V364 HydrophobicContact CG2-CG1 4.35Å; V364-F368 HydrophobicContact CB-CD1 4.03Å; V364-F368 HydrophobicContact CB-CE1 4.04Å; V364-F368 HydrophobicContact CG2-CD1 4.31Å; V364-F368 HydrophobicContact CG2-CE1 3.81Å; V364-L373 HydrophobicContact CG1-CD2 4.28Å; V364-C376 WeakPolarHBondContact CG1-SG 3.01Å
365	Q	80.8	Confident	83.2	Confident	147 Å²	147	56.6 Å²	56.6	69%	0.687	29%	0.286	S	S	*	.			trans	-87.1	-178.8	-178.3	-57	-158.9	29.9	0	0	112.2	F368 E372	Q365-F368 WeakPolarHBondContact O-CD1 3.5Å; Q365-F368 WeakPolarHBondContact O-CE1 3.23Å; Q365-E372 WeakPolarHBondContact CB-OE1 3.48Å; Q365-E372 PolarHBondContact N-OE1 2.66Å
366	K	78.7	Confident	85.4	Confident	118 Å²	118	56.1 Å²	56.1	51%	0.513	28%	0.283	S	S	.	.	S	Bend	trans	-134.7	129.6	-179.3	-64.2	-171.3	-173.7	-170.5	0	110.8	Q261 F368	Q261-K366 VanDerWaalsContact NE2-NZ 3.16Å; K366-F368 HydrophobicContact CD-CZ 4.43Å; K366-F368 HydrophobicContact CG-CE1 4.11Å; K366-F368 HydrophobicContact CG-CZ 4.18Å
367	P	80.1	Confident	86.6	Confident	125 Å²	125	55.7 Å²	55.7	81%	0.812	28%	0.282	S	S	*	.	S	Bend	cis	-62	149.9	-2.6	28.9	-36.4	0	0	0	112.4	S369	P367-S369 PolarHBondContact O-N 3.14Å
368	F	83.4	Confident	87.3	Confident	31 Å²	31	55.7 Å²	55.7	14%	0.136	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-72.5	124.5	-179.2	-58.9	-68.8	0	0	0	110	V258 Q261 P263 V364 Q365 K366 L373	V258-F368 HydrophobicContact CB-CZ 4.23Å; V258-F368 HydrophobicContact CG1-CD2 4.42Å; V258-F368 HydrophobicContact CG1-CE2 4.11Å; V258-F368 HydrophobicContact CG1-CZ 4.16Å; V258-F368 HydrophobicContact CG2-CE1 3.93Å; V258-F368 HydrophobicContact CG2-CE2 4.48Å; V258-F368 HydrophobicContact CG2-CZ 3.74Å; Q261-F368 HydrophobicContact CB-CE2 4.17Å; Q261-F368 VanDerWaalsContact NE2-CE2 3.31Å; Q261-F368 VanDerWaalsContact NE2-CZ 3.29Å; P263-F368 HydrophobicContact CB-CB 4.49Å; P263-F368 HydrophobicContact CB-CD2 4.03Å; V364-F368 HydrophobicContact CB-CD1 4.03Å; V364-F368 HydrophobicContact CB-CE1 4.04Å; V364-F368 HydrophobicContact CG2-CD1 4.31Å; V364-F368 HydrophobicContact CG2-CE1 3.81Å; Q365-F368 WeakPolarHBondContact O-CD1 3.5Å; Q365-F368 WeakPolarHBondContact O-CE1 3.23Å; K366-F368 HydrophobicContact CD-CZ 4.43Å; K366-F368 HydrophobicContact CG-CE1 4.11Å; K366-F368 HydrophobicContact CG-CZ 4.18Å; F368-L373 HydrophobicContact CB-CD1 4.09Å; F368-L373 HydrophobicContact CB-CD2 4.29Å; F368-L373 HydrophobicContact CB-CG 4.28Å; F368-L373 HydrophobicContact CD1-CD2 4.36Å; F368-L373 HydrophobicContact CG-CD2 4.49Å
369	S	83.2	Confident	87.5	Confident	49 Å²	49	55.7 Å²	55.7	34%	0.343	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-84.2	147.3	170.4	72.4	0	0	0	0	111.5	P367 N371 E372 L373	P367-S369 PolarHBondContact O-N 3.14Å; S369-N371 PolarHBondContact O-N 3.04Å; S369-E372 VanDerWaalsContact CB-OE2 3.3Å; S369-E372 WeakPolarHBondContact CB-OE2 3.19Å; S369-E372 PolarHBondContact N-OE2 3.23Å; S369-E372 PolarHBondContact O-N 3.28Å; S369-E372 VanDerWaalsContact OG-CG 3.25Å; S369-E372 WeakPolarHBondContact OG-CG 3.36Å; S369-E372 PolarHBondContact OG-N 2.98Å; S369-E372 PolarHBondContact OG-OE2 3.11Å; S369-L373 WeakPolarHBondContact O-CG 3.32Å; S369-L373 PolarHBondContact O-N 2.89Å
370	L	82.1	Confident	87.5	Confident	53 Å²	53	54.7 Å²	54.7	28%	0.277	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-37.6	176.5	-175.6	66.8	0	0	0	111.6	L264 V269 E372 L373 Q374 P505	L264-L370 WeakPolarHBondContact O-CD1 3.3Å; V269-L370 HydrophobicContact CG2-CD1 3.83Å; L370-E372 PolarHBondContact O-N 3.34Å; L370-L373 PolarHBondContact O-N 2.92Å; L370-Q374 WeakPolarHBondContact O-CB 3.5Å; L370-Q374 PolarHBondContact O-N 3.16Å; L370-P505 HydrophobicContact CD2-CB 4.44Å; L370-P505 HydrophobicContact CD2-CG 3.75Å
371	N	84	Confident	87.3	Confident	101 Å²	101	55.1 Å²	55.1	54%	0.54	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-31.9	-179.7	-67.1	-9.5	0	0	0	113.4	S369 R375	S369-N371 PolarHBondContact O-N 3.04Å; N371-R375 WeakPolarHBondContact O-CD 3.35Å; N371-R375 VanDerWaalsContact O-CG 3.31Å; N371-R375 WeakPolarHBondContact O-CG 3.46Å
372	E	85.6	Confident	86.7	Confident	47 Å²	47	52.6 Å²	52.6	22%	0.22	27%	0.27	C	S	.	.	H	α-helix	trans	-68.8	-48.9	169	-74.4	163.3	108.7	0	0	110.6	Q365 S369 L370 Q374 R375 C376	Q365-E372 WeakPolarHBondContact CB-OE1 3.48Å; Q365-E372 PolarHBondContact N-OE1 2.66Å; S369-E372 VanDerWaalsContact CB-OE2 3.3Å; S369-E372 WeakPolarHBondContact CB-OE2 3.19Å; S369-E372 PolarHBondContact N-OE2 3.23Å; S369-E372 PolarHBondContact O-N 3.28Å; S369-E372 VanDerWaalsContact OG-CG 3.25Å; S369-E372 WeakPolarHBondContact OG-CG 3.36Å; S369-E372 PolarHBondContact OG-N 2.98Å; S369-E372 PolarHBondContact OG-OE2 3.11Å; L370-E372 PolarHBondContact O-N 3.34Å; E372-Q374 VanDerWaalsContact C-N 3.32Å; E372-Q374 PolarHBondContact O-N 3.41Å; E372-R375 PolarHBondContact O-N 3.22Å; E372-C376 PolarHBondContact O-N 3.3Å; E372-C376 PolarHBondContact O-SG 2.97Å
373	L	87.9	Confident	85.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-36.3	-176	-61.8	-177.6	0	0	0	112.5	V258 P263 L265 V269 W273 V364 F368 S369 L370 R375 C376	V258-L373 HydrophobicContact CG1-CD2 4.22Å; P263-L373 HydrophobicContact CB-CD1 3.92Å; P263-L373 HydrophobicContact CG-CD1 4.41Å; L265-L373 HydrophobicContact CD2-CD1 4.11Å; L265-L373 HydrophobicContact CG-CD1 4.35Å; V269-L373 HydrophobicContact CG1-CB 4.07Å; V269-L373 WeakPolarHBondContact CG1-O 3.34Å; W273-L373 HydrophobicContact CH2-CD2 4.01Å; W273-L373 HydrophobicContact CZ2-CB 4.08Å; W273-L373 HydrophobicContact CZ2-CD2 4.04Å; W273-L373 PolarHBondContact NE1-O 3.19Å; V364-L373 HydrophobicContact CG1-CD2 4.28Å; F368-L373 HydrophobicContact CB-CD1 4.09Å; F368-L373 HydrophobicContact CB-CD2 4.29Å; F368-L373 HydrophobicContact CB-CG 4.28Å; F368-L373 HydrophobicContact CD1-CD2 4.36Å; F368-L373 HydrophobicContact CG-CD2 4.49Å; S369-L373 WeakPolarHBondContact O-CG 3.32Å; S369-L373 PolarHBondContact O-N 2.89Å; L370-L373 PolarHBondContact O-N 2.92Å; L373-R375 PolarHBondContact O-N 3.18Å; L373-C376 WeakPolarHBondContact O-CB 3.32Å; L373-C376 PolarHBondContact O-N 3.14Å
374	Q	87.6	Confident	84.6	Confident	66 Å²	66	47.6 Å²	47.6	31%	0.308	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-22.1	174.9	-169.1	178.5	12.4	0	0	113.3	V269 L370 E372	V269-Q374 HydrophobicContact CG2-CB 3.82Å; V269-Q374 HydrophobicContact CG2-CG 4.14Å; L370-Q374 WeakPolarHBondContact O-CB 3.5Å; L370-Q374 PolarHBondContact O-N 3.16Å; E372-Q374 VanDerWaalsContact C-N 3.32Å; E372-Q374 PolarHBondContact O-N 3.41Å
375	R	88.8	Confident	83.5	Confident	201 Å²	201	48.1 Å²	48.1	76%	0.758	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-3.5	177.8	-66.9	174.9	-175.9	-157.6	-0	113.3	N371 E372 L373 T377	N371-R375 WeakPolarHBondContact O-CD 3.35Å; N371-R375 VanDerWaalsContact O-CG 3.31Å; N371-R375 WeakPolarHBondContact O-CG 3.46Å; E372-R375 PolarHBondContact O-N 3.22Å; L373-R375 PolarHBondContact O-N 3.18Å; R375-T377 PolarHBondContact O-N 3Å
376	C	92.5	Very high	82.8	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.007	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-73.3	123.3	-176.1	-71.2	0	0	0	0	112.9	W273 Q276 I360 E362 V364 E372 L373	W273-C376 HydrophobicContact CZ2-CB 4.06Å; Q276-C376 PolarHBondContact NE2-O 3.39Å; I360-C376 HydrophobicContact CG2-CB 3.88Å; E362-C376 VanDerWaalsContact OE2-CA 3.32Å; E362-C376 WeakPolarHBondContact OE2-CA 3.47Å; V364-C376 WeakPolarHBondContact CG1-SG 3.01Å; E372-C376 PolarHBondContact O-N 3.3Å; E372-C376 PolarHBondContact O-SG 2.97Å; L373-C376 WeakPolarHBondContact O-CB 3.32Å; L373-C376 PolarHBondContact O-N 3.14Å
377	T	94.3	Very high	82.1	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.031	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-85.7	125	163.8	-47.4	0	0	0	0	110	R226 Q276 R361 E362 R375 L379	R226-T377 HydrophobicContact CG-CG2 3.9Å; R226-T377 PolarHBondContact NH2-OG1 3.03Å; Q276-T377 VanDerWaalsContact OE1-CA 3.25Å; R361-T377 WeakPolarHBondContact CB-O 3Å; R361-T377 PolarHBondContact N-O 3.01Å; E362-T377 VanDerWaalsContact CD-N 3.3Å; E362-T377 WeakPolarHBondContact OE1-CB 3.5Å; E362-T377 PolarHBondContact OE1-N 2.68Å; E362-T377 PolarHBondContact OE1-OG1 3.48Å; E362-T377 PolarHBondContact OE2-N 3.19Å; R375-T377 PolarHBondContact O-N 3Å; T377-L379 HydrophobicContact CG2-CD2 4.35Å
378	L	95	Very high	81	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136	174.7	-60.2	-170.6	0	0	0	111.5	N227 L255 W273 Q276 I277 V358 L359 I360	N227-L378 VanDerWaalsContact CA-O 3.29Å; N227-L378 WeakPolarHBondContact CA-O 3.49Å; N227-L378 WeakPolarHBondContact CB-O 3.43Å; N227-L378 PolarHBondContact ND2-O 3.42Å; L255-L378 HydrophobicContact CD1-CD2 4.42Å; L255-L378 HydrophobicContact CD2-CD1 4.38Å; W273-L378 HydrophobicContact CB-CD1 3.65Å; W273-L378 HydrophobicContact CD2-CD1 4.06Å; W273-L378 HydrophobicContact CD2-CD2 4.38Å; W273-L378 HydrophobicContact CD2-CG 4.49Å; W273-L378 HydrophobicContact CE3-CD1 4.46Å; W273-L378 HydrophobicContact CG-CD1 3.71Å; W273-L378 HydrophobicContact CG-CG 4.22Å; Q276-L378 HydrophobicContact CB-CB 4.33Å; I277-L378 HydrophobicContact CD1-CD1 3.87Å; I277-L378 HydrophobicContact CG1-CD1 3.83Å; V358-L378 HydrophobicContact CG1-CB 4.29Å; V358-L378 HydrophobicContact CG1-CD1 4.44Å; L359-L378 CarbonylContact O-C 2.94Å; L359-L378 WeakPolarHBondContact O-CA 3.41Å; I360-L378 HydrophobicContact CB-CD2 4.48Å; I360-L378 HydrophobicContact CG1-CD2 3.55Å
379	L	93.4	Very high	79.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.2	-178.9	-55.6	-178.9	0	0	0	111.4	R226 V229 E248 A250 V358 L359 R361 T377	R226-L379 VanDerWaalsContact O-CD2 3.3Å; R226-L379 WeakPolarHBondContact O-CD2 3.4Å; V229-L379 HydrophobicContact CB-CB 4.47Å; E248-L379 HydrophobicContact CG-CD1 4.34Å; A250-L379 HydrophobicContact CB-CD1 4.41Å; V358-L379 CarbonylContact C-O 3.57Å; V358-L379 WeakPolarHBondContact CA-O 3.48Å; L359-L379 HydrophobicContact CB-CB 4.48Å; L359-L379 PolarHBondContact N-O 3.45Å; L359-L379 PolarHBondContact O-N 2.89Å; R361-L379 HydrophobicContact CB-CD1 3.89Å; R361-L379 HydrophobicContact CB-CG 4.1Å; T377-L379 HydrophobicContact CG2-CD2 4.35Å
380	I	92.3	Very high	77.7	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.6	173.3	-57.4	178.8	0	0	0	110.1	N227 I228 V229 I277 M281 L284 H292 L295 S357 F383	N227-I380 PolarHBondContact O-N 3.08Å; I228-I380 HydrophobicContact CD1-CB 3.91Å; I228-I380 HydrophobicContact CD1-CD1 4.35Å; I228-I380 HydrophobicContact CD1-CG2 4.49Å; V229-I380 PolarHBondContact N-O 3.45Å; I277-I380 HydrophobicContact CG2-CD1 4.29Å; M281-I380 HydrophobicContact CG-CD1 3.8Å; M281-I380 HydrophobicContact SD-CD1 3.88Å; L284-I380 HydrophobicContact CD1-CG2 4.31Å; H292-I380 VanDerWaalsContact CD2-CG2 3.44Å; H292-I380 WeakPolarHBondContact CD2-CG2 3.25Å; H292-I380 WeakPolarHBondContact NE2-CG2 2.95Å; L295-I380 HydrophobicContact CD1-CG2 4.42Å; S357-I380 VanDerWaalsContact O-CA 3.3Å; S357-I380 WeakPolarHBondContact O-CA 3.2Å; I380-F383 HydrophobicContact CG2-CZ 4.11Å
381	T	87.7	Confident	76.5	Confident	8 Å²	8	39.6 Å²	39.6	5%	0.049	20%	0.203	C	C	.	.			trans	-150.5	-174.5	-173.4	-168.7	0	0	0	0	112.2	H292 K356 S357 L359	H292-T381 PolarHBondContact CE1-O 3.03Å; H292-T381 PolarHBondContact NE2-O 2.91Å; K356-T381 WeakPolarHBondContact O-CG2 3.24Å; S357-T381 WeakPolarHBondContact CA-O 3.47Å; S357-T381 WeakPolarHBondContact CB-O 3.43Å; S357-T381 PolarHBondContact O-N 2.91Å; L359-T381 HydrophobicContact CD1-CG2 3.86Å; L359-T381 HydrophobicContact CD2-CG2 4.35Å; L359-T381 HydrophobicContact CG-CG2 3.75Å
382	D	79.6	Confident	75.2	Confident	6 Å²	6	37 Å²	37	3%	0.032	19%	0.189	C	C	.	.			trans	62.9	58.6	-178	-79.6	-43.2	0	0	0	113.8	K204 L355 K356 G384	K204-D382 IonicContact NZ-OD1 3.37Å; K204-D382 PolarHBondContact NZ-OD1 3.02Å; L355-D382 WeakPolarHBondContact CA-OD2 3.43Å; L355-D382 WeakPolarHBondContact CD2-OD1 3.31Å; K356-D382 PolarHBondContact N-OD2 2.72Å; D382-G384 PolarHBondContact O-N 2.93Å
383	F	74.2	Confident	73.3	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-78.9	9.9	177.2	-61.1	-81.7	0	0	0	113.9	E216 L220 L223 I228 V229 L284 I380 M385 A386	E216-F383 HydrophobicContact CG-CB 4.02Å; E216-F383 PolarHBondContact OE1-N 3.33Å; L220-F383 HydrophobicContact CD2-CD2 3.4Å; L220-F383 VanDerWaalsContact CD2-CD2 3.4Å; L220-F383 HydrophobicContact CD2-CE2 3.72Å; L220-F383 HydrophobicContact CD2-CG 4.36Å; L220-F383 HydrophobicContact CG-CD2 3.98Å; L223-F383 HydrophobicContact CD1-CD1 4.28Å; L223-F383 HydrophobicContact CD1-CD2 4.49Å; L223-F383 HydrophobicContact CD1-CE1 4Å; L223-F383 HydrophobicContact CD1-CE2 4.19Å; L223-F383 HydrophobicContact CD1-CZ 3.95Å; I228-F383 HydrophobicContact CD1-CZ 4.36Å; I228-F383 HydrophobicContact CG2-CE2 3.98Å; I228-F383 HydrophobicContact CG2-CZ 3.83Å; V229-F383 HydrophobicContact CG1-CE2 4.4Å; L284-F383 HydrophobicContact CD1-CE1 3.79Å; L284-F383 HydrophobicContact CD1-CZ 4.27Å; L284-F383 HydrophobicContact CD2-CD1 4.49Å; L284-F383 HydrophobicContact CD2-CE1 3.61Å; L284-F383 HydrophobicContact CD2-CZ 4.19Å; L284-F383 HydrophobicContact CG-CE1 4.37Å; I380-F383 HydrophobicContact CG2-CZ 4.11Å; F383-M385 PolarHBondContact O-N 2.85Å; F383-M385 VanDerWaalsContact O-N 3.16Å; F383-A386 HydrophobicContact CB-CB 3.91Å; F383-A386 HydrophobicContact CD1-CB 3.96Å; F383-A386 HydrophobicContact CG-CB 4.46Å; F383-A386 VanDerWaalsContact O-CB 3.23Å; F383-A386 WeakPolarHBondContact O-CB 3.34Å; F383-A386 PolarHBondContact O-N 3Å
384	G	60.8	Low	71.3	Confident	16 Å²	16	42.4 Å²	42.4	17%	0.165	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-63.7	-18.4	-178.6	0	0	0	0	0	115.1	E216 D382	E216-G384 VanDerWaalsContact OE2-CA 3.28Å; E216-G384 WeakPolarHBondContact OE2-CA 3.44Å; E216-G384 PolarHBondContact OE2-N 3.49Å; D382-G384 PolarHBondContact O-N 2.93Å
385	M	62.4	Low	69.2	Low	33 Å²	33	46.3 Å²	46.3	16%	0.163	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-101.6	-8.6	170.2	-66.2	-65.1	-69.2	0	0	113.1	F188 R293 D294 F383 K398	F188-M385 HydrophobicContact CE1-SD 4.47Å; F188-M385 HydrophobicContact CZ-CG 4.08Å; F188-M385 HydrophobicContact CZ-SD 4.21Å; R293-M385 HydrophobicContact CB-CB 4.21Å; R293-M385 VanDerWaalsContact CD-O 3.31Å; R293-M385 WeakPolarHBondContact CD-O 3.27Å; D294-M385 HydrophobicContact CB-CB 4.29Å; D294-M385 HydrophobicContact CB-CG 4.38Å; F383-M385 PolarHBondContact O-N 2.85Å; F383-M385 VanDerWaalsContact O-N 3.16Å; M385-K398 VanDerWaalsContact CE-O 3.3Å; M385-K398 WeakPolarHBondContact CE-O 3.49Å
386	A	65.4	Low	67	Low	9 Å²	9	44.8 Å²	44.8	7%	0.074	25%	0.253	C	S	.	.			trans	-71.3	154	-170.3	0	0	0	0	0	112.4	H219 I290 C291 F383	H219-A386 PolarHBondContact CE1-O 3.37Å; H219-A386 PolarHBondContact ND1-O 2.85Å; I290-A386 HydrophobicContact CG2-CB 3.76Å; C291-A386 CarbonylContact O-C 3.59Å; C291-A386 VanDerWaalsContact O-CA 3.23Å; C291-A386 WeakPolarHBondContact O-CA 3.32Å; C291-A386 WeakPolarHBondContact O-CB 3.48Å; F383-A386 HydrophobicContact CB-CB 3.91Å; F383-A386 HydrophobicContact CD1-CB 3.96Å; F383-A386 HydrophobicContact CG-CB 4.46Å; F383-A386 VanDerWaalsContact O-CB 3.23Å; F383-A386 WeakPolarHBondContact O-CB 3.34Å; F383-A386 PolarHBondContact O-N 3Å
387	C	63.5	Low	64.9	Low	12 Å²	12	46.4 Å²	46.4	8%	0.081	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	145.8	-169.5	-166.5	0	0	0	0	112.6	I290 C291 R293 Q391	I290-C387 WeakPolarHBondContact CA-O 3.33Å; C291-C387 PolarHBondContact N-O 3.15Å; C291-C387 PolarHBondContact O-N 2.78Å; R293-C387 PolarHBondContact NH2-SG 2.87Å; C387-Q391 WeakPolarHBondContact SG-CB 3.41Å
388	R	57.1	Low	62.8	Low	56 Å²	56	53.9 Å²	53.9	21%	0.211	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	151.1	175	-77.2	-171.9	158.8	82.3	15.4	112.4	L218 R289 I290 S390 Q391	L218-R388 PolarHBondContact O-NH1 3.3Å; R289-R388 WeakPolarHBondContact O-CA 3.43Å; I290-R388 HydrophobicContact CG1-CG 4.23Å; R388-S390 PolarHBondContact O-N 2.83Å; R388-S390 VanDerWaalsContact O-N 3.16Å; R388-Q391 PolarHBondContact O-N 3.25Å
389	S	56.4	Low	60.9	Low	53 Å²	53	56.2 Å²	56.2	37%	0.371	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-52.5	-36.6	176.8	57.7	0	0	0	0	114	R289 Q391 L392	R289-S389 PolarHBondContact O-N 3.38Å; S389-Q391 PolarHBondContact O-N 3.49Å; S389-L392 WeakPolarHBondContact O-CG 3.48Å; S389-L392 PolarHBondContact O-N 2.87Å
390	S	41.6	Very low	59.4	Low	104 Å²	104	56.9 Å²	56.9	73%	0.727	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-70.4	-5.5	177.1	55	0	0	0	0	115.1	R388	R388-S390 PolarHBondContact O-N 2.83Å; R388-S390 VanDerWaalsContact O-N 3.16Å
391	Q	56.9	Low	58.7	Low	110 Å²	110	57.2 Å²	57.2	51%	0.514	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-121.7	14.1	-178.6	-69.6	174.5	-26.8	0	0	112.2	C387 R388 S389 A393	C387-Q391 WeakPolarHBondContact SG-CB 3.41Å; R388-Q391 PolarHBondContact O-N 3.25Å; S389-Q391 PolarHBondContact O-N 3.49Å; Q391-A393 PolarHBondContact O-N 2.86Å
392	L	55.4	Low	58.5	Low	48 Å²	48	57.1 Å²	57.1	25%	0.251	32%	0.317	S	S	.	.			trans	-73.6	31.6	175.8	-61.1	178.7	0	0	0	114	C291 R293 S389	C291-L392 HydrophobicContact CB-CD2 4.16Å; R293-L392 VanDerWaalsContact NH2-CD2 3.34Å; S389-L392 WeakPolarHBondContact O-CG 3.48Å; S389-L392 PolarHBondContact O-N 2.87Å
393	A	46.2	Very low	59	Low	60 Å²	60	57.4 Å²	57.4	50%	0.496	32%	0.32	S	S	.	.			trans	-61.3	146.9	169.4	0	0	0	0	0	110.1	Q391 Q395	Q391-A393 PolarHBondContact O-N 2.86Å; A393-Q395 PolarHBondContact O-N 2.8Å
394	P	47.2	Very low	59.9	Low	100 Å²	100	57.8 Å²	57.8	65%	0.649	32%	0.322	S	S	*	.			trans	-74.2	69.5	178.5	31.9	-36.1	0	0	0	111.1
395	Q	43.4	Very low	61.3	Low	148 Å²	148	57.5 Å²	57.5	69%	0.692	32%	0.318	S	S	*	.			trans	-73.8	144.9	163.6	-67.8	-174.9	-16.5	0	0	109.2	A393 S397	A393-Q395 PolarHBondContact O-N 2.8Å; Q395-S397 PolarHBondContact O-N 2.8Å
396	Q	42.4	Very low	62.8	Low	168 Å²	168	55.9 Å²	55.9	79%	0.785	31%	0.31	S	S	*	.			trans	-72.9	64.1	169.9	-67.7	-172.8	-55	0	0	111	K398	Q396-K398 PolarHBondContact O-N 3.47Å
397	S	47.5	Very low	64.1	Low	36 Å²	36	55.5 Å²	55.5	25%	0.252	31%	0.306	S	S	.	.			trans	-65.3	128.8	173.2	54.3	0	0	0	0	109.9	Q395 L399 F415	Q395-S397 PolarHBondContact O-N 2.8Å; S397-L399 PolarHBondContact O-N 3.38Å; S397-L399 VanDerWaalsContact O-N 3.17Å; S397-F415 VanDerWaalsContact OG-CE2 3.29Å; S397-F415 WeakPolarHBondContact OG-CE2 3.44Å
398	K	50.2	Low	65.5	Low	162 Å²	162	55.5 Å²	55.5	70%	0.704	31%	0.305	S	S	*	.			trans	-39.5	116.6	178.9	-168	175.9	-173.6	176.9	0	111.3	M385 Q396 G400	M385-K398 VanDerWaalsContact CE-O 3.3Å; M385-K398 WeakPolarHBondContact CE-O 3.49Å; Q396-K398 PolarHBondContact O-N 3.47Å; K398-G400 PolarHBondContact O-N 3.27Å
399	L	55.4	Low	67.1	Low	50 Å²	50	53 Å²	53	26%	0.262	30%	0.296	S	S	.	.			trans	-61	134.8	-169.8	-152.2	123.1	0	0	0	110.8	S397 V402 Q412 L447	S397-L399 PolarHBondContact O-N 3.38Å; S397-L399 VanDerWaalsContact O-N 3.17Å; L399-V402 HydrophobicContact CD2-CG2 3.81Å; L399-Q412 HydrophobicContact CD1-CG 4.38Å; L399-L447 HydrophobicContact CD1-CD1 4.39Å; L399-L447 HydrophobicContact CD2-CD1 3.77Å
400	G	62.1	Low	68.5	Low	13 Å²	13	51 Å²	51	13%	0.134	28%	0.282	C	S	.	.			trans	-70.7	-166	-175.2	0	0	0	0	0	113.5	K398 V402	K398-G400 PolarHBondContact O-N 3.27Å; G400-V402 PolarHBondContact O-N 3.13Å
401	T	77	Confident	70.6	Confident	8 Å²	8	50 Å²	50	5%	0.049	26%	0.262	C	S	.	.			trans	-69.6	102.3	173.5	-57.7	0	0	0	0	109.5	K296 N299 A403 Y404	K296-T401 PolarHBondContact NZ-OG1 2.74Å; N299-T401 PolarHBondContact OD1-OG1 3.13Å; T401-A403 PolarHBondContact O-N 3.43Å; T401-Y404 HydrophobicContact CG2-CD2 3.91Å; T401-Y404 HydrophobicContact CG2-CE2 4.11Å; T401-Y404 PolarHBondContact O-N 3.46Å
402	V	84.3	Confident	71.8	Confident	6 Å²	6	50 Å²	50	4%	0.036	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-42.6	-40.2	-169.5	178.4	0	0	0	0	114.3	L399 G400 Y404 A405 Q443 L446 L447 I450	L399-V402 HydrophobicContact CD2-CG2 3.81Å; G400-V402 PolarHBondContact O-N 3.13Å; V402-Y404 PolarHBondContact O-N 2.91Å; V402-Y404 VanDerWaalsContact O-N 3.07Å; V402-A405 PolarHBondContact O-N 3Å; V402-Q443 HydrophobicContact CG2-CB 4.34Å; V402-L446 HydrophobicContact CG1-CB 4.22Å; V402-L446 HydrophobicContact CG1-CD2 4.19Å; V402-L446 HydrophobicContact CG1-CG 3.98Å; V402-L447 HydrophobicContact CG1-CB 3.81Å; V402-L447 HydrophobicContact CG1-CD1 4.24Å; V402-L447 HydrophobicContact CG2-CB 4.33Å; V402-L447 HydrophobicContact CG2-CD1 4.45Å; V402-I450 HydrophobicContact CG1-CD1 4.39Å
403	A	89.8	Confident	73	Confident	13 Å²	13	53 Å²	53	11%	0.107	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-59.3	-17.5	179.7	0	0	0	0	0	115.6	T401 P437 F438 L446	T401-A403 PolarHBondContact O-N 3.43Å; A403-P437 HydrophobicContact CB-CB 4.23Å; A403-F438 HydrophobicContact CB-CD2 3.89Å; A403-F438 HydrophobicContact CB-CE2 4.4Å; A403-L446 HydrophobicContact CB-CD2 4.01Å
404	Y	92.8	Very high	74.5	Confident	9 Å²	9	51 Å²	51	4%	0.035	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-110.7	-4	177.1	-58.9	-94.6	0	0	0	112.7	K296 S298 T401 V402 S423 V426 V427 E430	K296-Y404 HydrophobicContact CB-CD1 3.55Å; K296-Y404 HydrophobicContact CB-CD2 3.61Å; K296-Y404 HydrophobicContact CB-CE1 3.57Å; K296-Y404 HydrophobicContact CB-CE2 3.61Å; K296-Y404 HydrophobicContact CB-CG 3.58Å; K296-Y404 HydrophobicContact CD-CD2 4.31Å; S298-Y404 WeakPolarHBondContact CB-OH 3.48Å; S298-Y404 PolarHBondContact N-OH 3.19Å; T401-Y404 HydrophobicContact CG2-CD2 3.91Å; T401-Y404 HydrophobicContact CG2-CE2 4.11Å; T401-Y404 PolarHBondContact O-N 3.46Å; V402-Y404 PolarHBondContact O-N 2.91Å; V402-Y404 VanDerWaalsContact O-N 3.07Å; Y404-S423 WeakPolarHBondContact O-CB 3.35Å; Y404-S423 PolarHBondContact O-OG 3.03Å; Y404-V426 HydrophobicContact CD1-CB 3.8Å; Y404-V426 HydrophobicContact CD1-CG1 3.36Å; Y404-V426 HydrophobicContact CE1-CB 4.28Å; Y404-V426 HydrophobicContact CE1-CG1 3.48Å; Y404-V426 VanDerWaalsContact CE1-CG1 3.48Å; Y404-V426 HydrophobicContact CG-CG1 4.1Å; Y404-V427 HydrophobicContact CD1-CG2 4.22Å; Y404-V427 HydrophobicContact CE1-CG2 4Å; Y404-E430 VanDerWaalsContact CE1-OE2 3.25Å; Y404-E430 WeakPolarHBondContact CE1-OE2 3.37Å; Y404-E430 PolarHBondContact OH-OE1 3.17Å; Y404-E430 VanDerWaalsContact OH-OE1 3.11Å; Y404-E430 PolarHBondContact OH-OE2 3.24Å
405	A	90.8	Very high	76.2	Confident	9 Å²	9	47.5 Å²	47.5	7%	0.074	24%	0.235	C	C	.	.			trans	-83	141.1	-175.7	0	0	0	0	0	111.5	V402 V409 C410 W422	V402-A405 PolarHBondContact O-N 3Å; A405-V409 HydrophobicContact CB-CB 4.4Å; A405-V409 HydrophobicContact CB-CG1 4.03Å; A405-C410 VanDerWaalsContact CB-SG 3.58Å; A405-W422 PolarHBondContact O-NE1 2.83Å
406	A	93.9	Very high	78.4	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.			trans	-78.7	157.9	177.5	0	0	0	0	0	112	E408 V409 C410 W422	A406-E408 VanDerWaalsContact C-N 3.27Å; A406-E408 VanDerWaalsContact CB-CD 3.48Å; A406-E408 VanDerWaalsContact CB-OE1 3.27Å; A406-E408 WeakPolarHBondContact CB-OE1 3.23Å; A406-E408 WeakPolarHBondContact CB-OE2 3.47Å; A406-E408 PolarHBondContact O-N 2.94Å; A406-V409 HydrophobicContact CB-CG2 4.34Å; A406-V409 WeakPolarHBondContact O-CA 3.44Å; A406-V409 WeakPolarHBondContact O-CB 3.21Å; A406-V409 PolarHBondContact O-N 3.12Å; A406-C410 PolarHBondContact O-N 3.38Å; A406-C410 PolarHBondContact O-SG 2.78Å; A406-W422 HydrophobicContact CB-CB 3.79Å; A406-W422 HydrophobicContact CB-CD2 3.98Å; A406-W422 HydrophobicContact CB-CE3 4.44Å; A406-W422 HydrophobicContact CB-CG 3.66Å
407	P	92.4	Very high	80.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-54	-38.1	-178.7	-29.6	37.5	0	0	0	114.5	C410 R411 W422 I450 N454	P407-C410 PolarHBondContact O-N 2.74Å; P407-R411 WeakPolarHBondContact O-CB 3.34Å; P407-R411 WeakPolarHBondContact O-CG 3.31Å; P407-R411 PolarHBondContact O-N 2.66Å; P407-R411 PolarHBondContact O-NE 2.69Å; P407-W422 VanDerWaalsContact CD-CZ3 3.41Å; P407-W422 HydrophobicContact CG-CE3 4.35Å; P407-W422 HydrophobicContact CG-CH2 3.56Å; P407-W422 HydrophobicContact CG-CZ2 4.11Å; P407-W422 HydrophobicContact CG-CZ3 3.68Å; P407-I450 WeakPolarHBondContact CB-O 3.47Å; P407-I450 HydrophobicContact CG-CG2 4.14Å; P407-N454 WeakPolarHBondContact CB-OD1 3.42Å; P407-N454 HydrophobicContact CG-CB 4.05Å
408	E	92.8	Very high	83.1	Confident	13 Å²	13	36.8 Å²	36.8	6%	0.061	18%	0.183	C	C	.	.	H	α-helix	trans	-69.6	-35	176.2	70.6	-77.8	-175.2	0	0	112.9	A406 R411 Q412 E413 P479 R482	A406-E408 VanDerWaalsContact C-N 3.27Å; A406-E408 VanDerWaalsContact CB-CD 3.48Å; A406-E408 VanDerWaalsContact CB-OE1 3.27Å; A406-E408 WeakPolarHBondContact CB-OE1 3.23Å; A406-E408 WeakPolarHBondContact CB-OE2 3.47Å; A406-E408 PolarHBondContact O-N 2.94Å; E408-R411 PolarHBondContact O-N 2.72Å; E408-Q412 PolarHBondContact O-N 3.04Å; E408-E413 HydrophobicContact CB-CB 4.32Å; E408-E413 PolarHBondContact O-N 2.9Å; E408-P479 HydrophobicContact CG-CG 4.21Å; E408-R482 IonicContact OE1-CZ 2.77Å; E408-R482 IonicContact OE1-NH1 3.56Å; E408-R482 PolarHBondContact OE1-NH1 3.23Å; E408-R482 IonicContact OE1-NH2 3.57Å; E408-R482 IonicContact OE2-CZ 3.18Å; E408-R482 IonicContact OE2-NH1 2.79Å; E408-R482 PolarHBondContact OE2-NH1 3.18Å; E408-R482 IonicContact OE2-NH2 3.57Å; E408-R482 PolarHBondContact OE2-NH2 2.98Å
409	V	89.8	Confident	85.1	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-68.7	-43.7	173.8	173	0	0	0	0	110.2	A405 A406 R411 Q412 G414 F415	A405-V409 HydrophobicContact CB-CB 4.4Å; A405-V409 HydrophobicContact CB-CG1 4.03Å; A406-V409 HydrophobicContact CB-CG2 4.34Å; A406-V409 WeakPolarHBondContact O-CA 3.44Å; A406-V409 WeakPolarHBondContact O-CB 3.21Å; A406-V409 PolarHBondContact O-N 3.12Å; V409-R411 PolarHBondContact O-N 2.73Å; V409-Q412 PolarHBondContact O-N 3.07Å; V409-G414 WeakPolarHBondContact CG2-O 3.49Å; V409-F415 HydrophobicContact CB-CE1 4.33Å; V409-F415 HydrophobicContact CB-CZ 4.45Å; V409-F415 HydrophobicContact CG1-CD1 4.22Å; V409-F415 HydrophobicContact CG1-CD2 4.48Å; V409-F415 HydrophobicContact CG1-CE1 3.53Å; V409-F415 HydrophobicContact CG1-CE2 3.82Å; V409-F415 HydrophobicContact CG1-CZ 3.32Å; V409-F415 HydrophobicContact CG2-CD1 3.64Å; V409-F415 HydrophobicContact CG2-CE1 3.77Å; V409-F415 HydrophobicContact CG2-CG 4.06Å; V409-F415 HydrophobicContact CG2-CZ 4.28Å
410	C	86	Confident	87	Confident	10 Å²	10	26.8 Å²	26.8	7%	0.068	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-31.3	175.3	-70.6	0	0	0	0	112.7	A405 A406 P407 Q412 L447 I450 A451	A405-C410 VanDerWaalsContact CB-SG 3.58Å; A406-C410 PolarHBondContact O-N 3.38Å; A406-C410 PolarHBondContact O-SG 2.78Å; P407-C410 PolarHBondContact O-N 2.74Å; C410-Q412 VanDerWaalsContact C-N 3.33Å; C410-L447 HydrophobicContact CB-CD1 3.68Å; C410-I450 HydrophobicContact CB-CG2 4.23Å; C410-A451 HydrophobicContact CB-CB 3.88Å
411	R	86.6	Confident	88.6	Confident	84 Å²	84	26.3 Å²	26.3	32%	0.317	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.3	172.3	-75.3	179.9	-85.7	128.7	1.8	114.6	P407 E408 V409 E413 A451 M452	P407-R411 WeakPolarHBondContact O-CB 3.34Å; P407-R411 WeakPolarHBondContact O-CG 3.31Å; P407-R411 PolarHBondContact O-N 2.66Å; P407-R411 PolarHBondContact O-NE 2.69Å; E408-R411 PolarHBondContact O-N 2.72Å; V409-R411 PolarHBondContact O-N 2.73Å; R411-E413 HydrophobicContact CB-CG 3.92Å; R411-E413 WeakPolarHBondContact CD-OE1 3.5Å; R411-E413 IonicContact CZ-OE1 3.8Å; R411-E413 IonicContact CZ-OE2 3.68Å; R411-E413 IonicContact NE-OE1 3.59Å; R411-E413 IonicContact NH1-OE1 2.74Å; R411-E413 PolarHBondContact NH1-OE1 2.96Å; R411-E413 IonicContact NH1-OE2 3.56Å; R411-E413 PolarHBondContact NH1-OE2 2.9Å; R411-E413 PolarHBondContact O-N 2.99Å; R411-A451 VanDerWaalsContact CD-O 3.24Å; R411-A451 WeakPolarHBondContact CD-O 3.19Å; R411-A451 HydrophobicContact CG-CB 3.92Å; R411-A451 PolarHBondContact NE-O 2.91Å; R411-A451 VanDerWaalsContact NE-O 3.14Å; R411-M452 HydrophobicContact CG-CE 4.09Å
412	Q	81.2	Confident	89.6	Confident	109 Å²	109	26.1 Å²	26.1	51%	0.509	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	23.2	-174	-52.8	-174.7	9.9	0	0	114.8	L399 E408 V409 C410 G414	L399-Q412 HydrophobicContact CD1-CG 4.38Å; E408-Q412 PolarHBondContact O-N 3.04Å; V409-Q412 PolarHBondContact O-N 3.07Å; C410-Q412 VanDerWaalsContact C-N 3.33Å; Q412-G414 PolarHBondContact O-N 2.97Å
413	E	81.8	Confident	90.1	Very high	112 Å²	112	26.2 Å²	26.2	52%	0.523	13%	0.131	S	C	.	.	S	Bend	trans	-75	-16.4	179.9	-68.3	169.5	-173.3	0	0	112.7	E408 R411	E408-E413 HydrophobicContact CB-CB 4.32Å; E408-E413 PolarHBondContact O-N 2.9Å; R411-E413 HydrophobicContact CB-CG 3.92Å; R411-E413 WeakPolarHBondContact CD-OE1 3.5Å; R411-E413 IonicContact CZ-OE1 3.8Å; R411-E413 IonicContact CZ-OE2 3.68Å; R411-E413 IonicContact NE-OE1 3.59Å; R411-E413 IonicContact NH1-OE1 2.74Å; R411-E413 PolarHBondContact NH1-OE1 2.96Å; R411-E413 IonicContact NH1-OE2 3.56Å; R411-E413 PolarHBondContact NH1-OE2 2.9Å; R411-E413 PolarHBondContact O-N 2.99Å
414	G	77.3	Confident	90.5	Very high	18 Å²	18	25.6 Å²	25.6	19%	0.186	13%	0.126	C	C	.	.			trans	138.6	176	174	0	0	0	0	0	112.6	V409 Q412	V409-G414 WeakPolarHBondContact CG2-O 3.49Å; Q412-G414 PolarHBondContact O-N 2.97Å
415	F	83.4	Confident	90.7	Very high	26 Å²	26	25.2 Å²	25.2	11%	0.114	13%	0.125	C	C	.	.			trans	-110.7	149.8	171.2	-81.5	-92.2	0	0	0	110.2	R293 S397 V409	R293-F415 HydrophobicContact CB-CD1 3.59Å; R293-F415 HydrophobicContact CB-CE1 3.67Å; R293-F415 HydrophobicContact CB-CG 4.18Å; R293-F415 HydrophobicContact CB-CZ 4.31Å; R293-F415 VanDerWaalsContact CD-CG 3.47Å; R293-F415 HydrophobicContact CG-CB 3.83Å; R293-F415 HydrophobicContact CG-CD1 3.54Å; R293-F415 HydrophobicContact CG-CD2 4.49Å; R293-F415 HydrophobicContact CG-CE1 4.15Å; R293-F415 HydrophobicContact CG-CG 3.73Å; R293-F415 VanDerWaalsContact NE-CB 3.33Å; R293-F415 VanDerWaalsContact O-CE1 3.24Å; R293-F415 WeakPolarHBondContact O-CE1 3.39Å; S397-F415 VanDerWaalsContact OG-CE2 3.29Å; S397-F415 WeakPolarHBondContact OG-CE2 3.44Å; V409-F415 HydrophobicContact CB-CE1 4.33Å; V409-F415 HydrophobicContact CB-CZ 4.45Å; V409-F415 HydrophobicContact CG1-CD1 4.22Å; V409-F415 HydrophobicContact CG1-CD2 4.48Å; V409-F415 HydrophobicContact CG1-CE1 3.53Å; V409-F415 HydrophobicContact CG1-CE2 3.82Å; V409-F415 HydrophobicContact CG1-CZ 3.32Å; V409-F415 HydrophobicContact CG2-CD1 3.64Å; V409-F415 HydrophobicContact CG2-CE1 3.77Å; V409-F415 HydrophobicContact CG2-CG 4.06Å; V409-F415 HydrophobicContact CG2-CZ 4.28Å
416	S	88.6	Confident	90.9	Very high	33 Å²	33	24.9 Å²	24.9	23%	0.231	12%	0.122	C	C	.	.			trans	-150.1	169.6	177.4	68.9	0	0	0	0	111.7	C291 K418 S419 D420	C291-S416 PolarHBondContact SG-O 2.85Å; S416-K418 PolarHBondContact O-N 2.63Å; S416-K418 VanDerWaalsContact O-N 3.1Å; S416-K418 WeakPolarHBondContact OG-CB 3.33Å; S416-K418 PolarHBondContact OG-N 3.44Å; S416-K418 VanDerWaalsContact OG-N 3.14Å; S416-S419 PolarHBondContact N-OG 3.47Å; S416-S419 PolarHBondContact O-N 2.59Å; S416-S419 PolarHBondContact O-OG 3.14Å; S416-S419 PolarHBondContact OG-N 3.49Å; S416-D420 PolarHBondContact O-N 3.37Å
417	F	92.5	Very high	91	Very high	54 Å²	54	24.9 Å²	24.9	24%	0.237	12%	0.122	C	C	.	.	H	α-helix	trans	-51	-33.5	166.3	-59.6	-56.1	0	0	0	111.9	H285 C291 S419 D420 I421	H285-F417 HydrophobicContact CB-CD1 4.13Å; H285-F417 HydrophobicContact CB-CE1 4.41Å; H285-F417 AromaticContact CD2-CD1 3.48Å; H285-F417 VanDerWaalsContact CD2-CD1 3.48Å; H285-F417 WeakPolarHBondContact CD2-CD1 3.45Å; H285-F417 AromaticContact CE1-CD1 3.94Å; H285-F417 PolarHBondContact CE1-O 3.21Å; H285-F417 AromaticContact CG-CD1 3.61Å; H285-F417 AromaticContact ND1-CD1 3.9Å; H285-F417 AromaticContact NE2-CD1 3.69Å; C291-F417 HydrophobicContact CB-CD1 4.02Å; C291-F417 HydrophobicContact CB-CE1 4.17Å; F417-S419 VanDerWaalsContact C-N 3.35Å; F417-S419 PolarHBondContact O-N 3.06Å; F417-D420 PolarHBondContact O-N 3.23Å; F417-I421 WeakPolarHBondContact O-CD1 3.27Å; F417-I421 PolarHBondContact O-N 3.33Å
418	K	95.6	Very high	91.2	Very high	40 Å²	40	24.9 Å²	24.9	17%	0.174	12%	0.122	C	C	.	.	H	α-helix	trans	-71	-23.9	177.8	-54.4	-51.5	-156.2	102.1	0	113.8	S416 I421 W422 P479 D480 R482	S416-K418 PolarHBondContact O-N 2.63Å; S416-K418 VanDerWaalsContact O-N 3.1Å; S416-K418 WeakPolarHBondContact OG-CB 3.33Å; S416-K418 PolarHBondContact OG-N 3.44Å; S416-K418 VanDerWaalsContact OG-N 3.14Å; K418-I421 HydrophobicContact CD-CD1 3.8Å; K418-W422 PolarHBondContact O-N 2.95Å; K418-P479 HydrophobicContact CB-CB 3.63Å; K418-P479 WeakPolarHBondContact CB-O 3.44Å; K418-P479 WeakPolarHBondContact CD-O 3.32Å; K418-P479 HydrophobicContact CG-CB 4.12Å; K418-P479 WeakPolarHBondContact CG-O 3.31Å; K418-P479 PolarHBondContact NZ-O 2.95Å; K418-D480 PolarHBondContact NZ-O 3.25Å; K418-R482 PolarHBondContact NZ-O 3.24Å; K418-R482 VanDerWaalsContact O-CD 3.31Å; K418-R482 WeakPolarHBondContact O-CD 3.29Å; K418-R482 PolarHBondContact O-NH1 2.64Å
419	S	93.6	Very high	91.4	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-74.2	-35	171.5	54.3	0	0	0	0	112	S416 F417 I421 W422 S423	S416-S419 PolarHBondContact N-OG 3.47Å; S416-S419 PolarHBondContact O-N 2.59Å; S416-S419 PolarHBondContact O-OG 3.14Å; S416-S419 PolarHBondContact OG-N 3.49Å; F417-S419 VanDerWaalsContact C-N 3.35Å; F417-S419 PolarHBondContact O-N 3.06Å; S419-I421 VanDerWaalsContact C-N 3.27Å; S419-I421 PolarHBondContact O-N 3.15Å; S419-W422 WeakPolarHBondContact O-CB 3.42Å; S419-W422 PolarHBondContact O-N 2.98Å; S419-S423 PolarHBondContact O-N 3.29Å; S419-S423 VanDerWaalsContact O-N 3.13Å; S419-S423 PolarHBondContact O-OG 3.11Å; S419-S423 VanDerWaalsContact O-OG 3.13Å
420	D	94.4	Very high	91.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.4	-32.8	174.7	-61.5	-27.5	0	0	0	112	M281 H285 C291 H292 R293 S416 F417 S423 Y424	M281-D420 HydrophobicContact CE-CB 3.7Å; H285-D420 IonicContact CD2-OD2 3.41Å; H285-D420 IonicContact CE1-OD2 3.44Å; H285-D420 IonicContact NE2-OD2 2.89Å; H285-D420 PolarHBondContact NE2-OD2 2.92Å; C291-D420 WeakPolarHBondContact CA-OD2 3.38Å; C291-D420 PolarHBondContact SG-OD1 3.12Å; C291-D420 PolarHBondContact SG-OD2 2.66Å; H292-D420 PolarHBondContact N-OD1 2.82Å; H292-D420 PolarHBondContact N-OD2 2.84Å; R293-D420 PolarHBondContact N-OD1 3.26Å; S416-D420 PolarHBondContact O-N 3.37Å; F417-D420 PolarHBondContact O-N 3.23Å; D420-S423 PolarHBondContact O-N 3.1Å; D420-Y424 PolarHBondContact O-N 3.01Å
421	I	97	Very high	92	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-38.2	176.1	-70.3	153.7	0	0	0	111.6	F417 K418 S419 Y424 G425 C474 R482 P483 F485 I488	F417-I421 WeakPolarHBondContact O-CD1 3.27Å; F417-I421 PolarHBondContact O-N 3.33Å; K418-I421 HydrophobicContact CD-CD1 3.8Å; S419-I421 VanDerWaalsContact C-N 3.27Å; S419-I421 PolarHBondContact O-N 3.15Å; I421-Y424 PolarHBondContact O-N 3.32Å; I421-G425 PolarHBondContact O-N 3.37Å; I421-C474 HydrophobicContact CG2-CB 4.22Å; I421-R482 HydrophobicContact CG2-CB 3.87Å; I421-P483 WeakPolarHBondContact CD1-O 3.38Å; I421-P483 WeakPolarHBondContact CG2-O 3.35Å; I421-F485 HydrophobicContact CG1-CD2 4.02Å; I421-F485 HydrophobicContact CG1-CE2 3.54Å; I421-F485 HydrophobicContact CG1-CZ 4.03Å; I421-I488 HydrophobicContact CG2-CD1 4.19Å
422	W	96.8	Very high	92.4	Very high	4 Å²	4	20 Å²	20	2%	0.015	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-46.5	171.8	174.6	-74	0	0	0	110.9	A405 A406 P407 K418 S419 Y424 G425 V426 I450 T456 W475	A405-W422 PolarHBondContact O-NE1 2.83Å; A406-W422 HydrophobicContact CB-CB 3.79Å; A406-W422 HydrophobicContact CB-CD2 3.98Å; A406-W422 HydrophobicContact CB-CE3 4.44Å; A406-W422 HydrophobicContact CB-CG 3.66Å; P407-W422 VanDerWaalsContact CD-CZ3 3.41Å; P407-W422 HydrophobicContact CG-CE3 4.35Å; P407-W422 HydrophobicContact CG-CH2 3.56Å; P407-W422 HydrophobicContact CG-CZ2 4.11Å; P407-W422 HydrophobicContact CG-CZ3 3.68Å; K418-W422 PolarHBondContact O-N 2.95Å; S419-W422 WeakPolarHBondContact O-CB 3.42Å; S419-W422 PolarHBondContact O-N 2.98Å; W422-Y424 VanDerWaalsContact C-N 3.31Å; W422-Y424 PolarHBondContact O-N 3.43Å; W422-G425 WeakPolarHBondContact O-CA 3.31Å; W422-G425 PolarHBondContact O-N 3Å; W422-G425 VanDerWaalsContact O-N 3.08Å; W422-V426 PolarHBondContact O-N 3.01Å; W422-V426 VanDerWaalsContact O-N 3.14Å; W422-I450 HydrophobicContact CZ2-CG2 4.36Å; W422-T456 HydrophobicContact CH2-CG2 3.93Å; W422-W475 AromaticContact CD2-CD1 3.67Å; W422-W475 HydrophobicContact CD2-CG 4.41Å; W422-W475 AromaticContact CE2-CD1 3.94Å; W422-W475 HydrophobicContact CE3-CB 3.98Å; W422-W475 AromaticContact CE3-CD1 3.94Å; W422-W475 HydrophobicContact CE3-CG 4.32Å; W422-W475 AromaticContact CG-CD1 3.96Å; W422-W475 HydrophobicContact CH2-CB 4.2Å; W422-W475 HydrophobicContact CZ3-CB 3.79Å; W422-W475 HydrophobicContact CZ3-CG 4.4Å; W422-W475 VanDerWaalsContact CZ3-O 3.28Å; W422-W475 WeakPolarHBondContact CZ3-O 3.35Å; W422-W475 PolarHBondContact O-NE1 2.89Å
423	S	95.3	Very high	93	Very high	7 Å²	7	14.9 Å²	14.9	5%	0.049	8%	0.077	C	C	.	.	H	α-helix	trans	-61.5	-38	177	-50.3	0	0	0	0	112.2	L295 Y404 S419 D420 V426 V427	L295-S423 WeakPolarHBondContact O-CB 3.23Å; Y404-S423 WeakPolarHBondContact O-CB 3.35Å; Y404-S423 PolarHBondContact O-OG 3.03Å; S419-S423 PolarHBondContact O-N 3.29Å; S419-S423 VanDerWaalsContact O-N 3.13Å; S419-S423 PolarHBondContact O-OG 3.11Å; S419-S423 VanDerWaalsContact O-OG 3.13Å; D420-S423 PolarHBondContact O-N 3.1Å; S423-V426 WeakPolarHBondContact O-CB 3.41Å; S423-V426 PolarHBondContact O-N 2.68Å; S423-V427 PolarHBondContact O-N 2.93Å
424	Y	97	Very high	93.5	Very high	1 Å²	1	9.8 Å²	9.8	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-62.6	-41.3	171.3	176.1	-92.6	0	0	0	112.3	A274 I277 A278 D420 I421 W422 V426 V427 L428 F485 I488 L492	A274-Y424 PolarHBondContact O-OH 2.95Å; I277-Y424 HydrophobicContact CB-CE2 4.07Å; I277-Y424 HydrophobicContact CG2-CD2 3.8Å; I277-Y424 HydrophobicContact CG2-CE2 3.85Å; A278-Y424 HydrophobicContact CB-CE2 4.01Å; D420-Y424 PolarHBondContact O-N 3.01Å; I421-Y424 PolarHBondContact O-N 3.32Å; W422-Y424 VanDerWaalsContact C-N 3.31Å; W422-Y424 PolarHBondContact O-N 3.43Å; Y424-V426 PolarHBondContact O-N 2.87Å; Y424-V427 CarbonylContact O-C 3.15Å; Y424-V427 PolarHBondContact O-N 2.68Å; Y424-V427 VanDerWaalsContact O-N 3.09Å; Y424-L428 HydrophobicContact CE1-CB 4.28Å; Y424-L428 HydrophobicContact CE1-CD2 4.26Å; Y424-L428 WeakPolarHBondContact O-CB 3.23Å; Y424-L428 PolarHBondContact O-N 3.01Å; Y424-F485 HydrophobicContact CD1-CE1 4.02Å; Y424-F485 AromaticContact CD2-CE1 3.7Å; Y424-F485 HydrophobicContact CD2-CE1 3.7Å; Y424-F485 HydrophobicContact CD2-CZ 4.37Å; Y424-F485 HydrophobicContact CE2-CE1 4.29Å; Y424-F485 AromaticContact CG-CE1 3.54Å; Y424-F485 HydrophobicContact CG-CE1 3.54Å; Y424-F485 HydrophobicContact CG-CZ 4.02Å; Y424-I488 HydrophobicContact CD1-CD1 4.15Å; Y424-I488 HydrophobicContact CD1-CG2 4.33Å; Y424-I488 HydrophobicContact CE1-CD1 4.41Å; Y424-I488 HydrophobicContact CE1-CG2 3.56Å; Y424-L492 VanDerWaalsContact OH-CD1 3.3Å; Y424-L492 WeakPolarHBondContact OH-CD1 3.11Å
425	G	97.6	Very high	94.2	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-55.8	-40	172.9	0	0	0	0	0	112.4	I421 W422 L428 W429 L471 W475	I421-G425 PolarHBondContact O-N 3.37Å; W422-G425 WeakPolarHBondContact O-CA 3.31Å; W422-G425 PolarHBondContact O-N 3Å; W422-G425 VanDerWaalsContact O-N 3.08Å; G425-L428 PolarHBondContact O-N 3.26Å; G425-W429 PolarHBondContact O-N 2.97Å; G425-L471 WeakPolarHBondContact O-CD2 3.43Å; G425-W475 VanDerWaalsContact O-CZ2 3.32Å; G425-W475 WeakPolarHBondContact O-CZ2 3.23Å
426	V	96.2	Very high	94.4	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.012	5%	0.047	C	C	.	.	H	α-helix	trans	-65.2	-43.1	174	177.5	0	0	0	0	111.9	Y404 W422 S423 Y424 W429 E430 P437 L457 W475	Y404-V426 HydrophobicContact CD1-CB 3.8Å; Y404-V426 HydrophobicContact CD1-CG1 3.36Å; Y404-V426 HydrophobicContact CE1-CB 4.28Å; Y404-V426 HydrophobicContact CE1-CG1 3.48Å; Y404-V426 VanDerWaalsContact CE1-CG1 3.48Å; Y404-V426 HydrophobicContact CG-CG1 4.1Å; W422-V426 PolarHBondContact O-N 3.01Å; W422-V426 VanDerWaalsContact O-N 3.14Å; S423-V426 WeakPolarHBondContact O-CB 3.41Å; S423-V426 PolarHBondContact O-N 2.68Å; Y424-V426 PolarHBondContact O-N 2.87Å; V426-W429 PolarHBondContact O-N 3.17Å; V426-E430 PolarHBondContact O-N 2.84Å; V426-P437 HydrophobicContact CG1-CB 3.93Å; V426-P437 HydrophobicContact CG1-CG 3.64Å; V426-L457 HydrophobicContact CB-CD1 4.37Å; V426-L457 HydrophobicContact CG1-CD1 4Å; V426-L457 HydrophobicContact CG2-CD1 4.12Å; V426-W475 HydrophobicContact CG2-CZ2 4.3Å
427	V	95.2	Very high	94.5	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.006	4%	0.039	C	C	.	.	H	α-helix	trans	-66.1	-36.6	176.3	175.6	0	0	0	0	112	I277 Y404 S423 Y424 E430 L431	I277-V427 HydrophobicContact CD1-CG1 3.86Å; Y404-V427 HydrophobicContact CD1-CG2 4.22Å; Y404-V427 HydrophobicContact CE1-CG2 4Å; S423-V427 PolarHBondContact O-N 2.93Å; Y424-V427 CarbonylContact O-C 3.15Å; Y424-V427 PolarHBondContact O-N 2.68Å; Y424-V427 VanDerWaalsContact O-N 3.09Å; V427-E430 WeakPolarHBondContact O-CB 3.23Å; V427-E430 PolarHBondContact O-N 2.87Å; V427-L431 WeakPolarHBondContact O-CG 3.44Å; V427-L431 PolarHBondContact O-N 2.84Å
428	L	96.3	Very high	94.4	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-64.4	-39	173.5	179.3	61	0	0	0	111.5	A274 Y424 G425 L431 L432 F467 L470 L471	A274-L428 HydrophobicContact CB-CD1 3.96Å; Y424-L428 HydrophobicContact CE1-CB 4.28Å; Y424-L428 HydrophobicContact CE1-CD2 4.26Å; Y424-L428 WeakPolarHBondContact O-CB 3.23Å; Y424-L428 PolarHBondContact O-N 3.01Å; G425-L428 PolarHBondContact O-N 3.26Å; L428-L431 PolarHBondContact O-N 3.17Å; L428-L432 HydrophobicContact CD1-CD1 4.25Å; L428-L432 HydrophobicContact CD1-CG 4.39Å; L428-L432 HydrophobicContact CG-CD1 4Å; L428-L432 WeakPolarHBondContact O-CB 3.44Å; L428-L432 VanDerWaalsContact O-CG 3.31Å; L428-L432 WeakPolarHBondContact O-CG 3.25Å; L428-L432 PolarHBondContact O-N 2.8Å; L428-F467 HydrophobicContact CD1-CD1 4.39Å; L428-F467 HydrophobicContact CD1-CE1 4.41Å; L428-L470 HydrophobicContact CD2-CD2 3.74Å; L428-L470 HydrophobicContact CD2-CG 4.06Å; L428-L471 HydrophobicContact CB-CD2 4.14Å; L428-L471 HydrophobicContact CD2-CD2 3.99Å; L428-L471 HydrophobicContact CD2-CG 4.48Å; L428-L471 HydrophobicContact CG-CD2 4.07Å
429	W	96.5	Very high	93.8	Very high	2 Å²	2	8.4 Å²	8.4	1%	0.008	4%	0.038	C	C	.	.	H	α-helix	trans	-65.6	-36.9	172.5	-176.8	99.5	0	0	0	112.5	G425 V426 L432 T433 D435 P437 L457 Y458 L471 W475 I519	G425-W429 PolarHBondContact O-N 2.97Å; V426-W429 PolarHBondContact O-N 3.17Å; W429-L432 PolarHBondContact O-N 3.02Å; W429-T433 HydrophobicContact CD2-CG2 4.03Å; W429-T433 HydrophobicContact CG-CG2 4.38Å; W429-T433 HydrophobicContact CZ2-CG2 4.17Å; W429-T433 WeakPolarHBondContact O-CB 3.27Å; W429-T433 WeakPolarHBondContact O-CG2 3.22Å; W429-T433 PolarHBondContact O-N 2.91Å; W429-T433 PolarHBondContact O-OG1 2.93Å; W429-D435 HydrophobicContact CH2-CB 4.26Å; W429-D435 HydrophobicContact CZ3-CB 4.35Å; W429-P437 HydrophobicContact CE3-CG 4.29Å; W429-P437 HydrophobicContact CZ3-CG 4.24Å; W429-L457 HydrophobicContact CB-CD1 4.1Å; W429-L457 HydrophobicContact CD2-CB 4.28Å; W429-L457 HydrophobicContact CD2-CD1 3.73Å; W429-L457 HydrophobicContact CD2-CD2 4.48Å; W429-L457 HydrophobicContact CD2-CG 4.38Å; W429-L457 HydrophobicContact CE3-CD1 3.91Å; W429-L457 HydrophobicContact CE3-CD2 4.48Å; W429-L457 HydrophobicContact CG-CB 4.32Å; W429-L457 HydrophobicContact CG-CD1 3.84Å; W429-L457 HydrophobicContact CH2-CD2 4.3Å; W429-L457 HydrophobicContact CZ2-CB 4.48Å; W429-L457 HydrophobicContact CZ2-CD2 4.24Å; W429-L457 HydrophobicContact CZ3-CD2 4.42Å; W429-Y458 PolarHBondContact NE1-O 3.38Å; W429-L471 HydrophobicContact CB-CD2 4.24Å; W429-W475 HydrophobicContact CB-CH2 3.89Å; W429-W475 HydrophobicContact CB-CZ2 4.02Å; W429-W475 AromaticContact CD1-CH2 3.79Å; W429-W475 HydrophobicContact CG-CH2 4.03Å; W429-I519 HydrophobicContact CH2-CD1 4.1Å; W429-I519 HydrophobicContact CH2-CG2 4.32Å; W429-I519 HydrophobicContact CZ2-CD1 3.54Å; W429-I519 HydrophobicContact CZ2-CG1 4.09Å; W429-I519 HydrophobicContact CZ2-CG2 4.19Å
430	E	94.4	Very high	93	Very high	2 Å²	2	11 Å²	11	1%	0.009	6%	0.06	C	C	.	.	H	α-helix	trans	-63.1	-41.3	172	-71.2	-166.6	102.7	0	0	112.2	L259 S297 Y404 V426 V427 L434 P437	L259-E430 HydrophobicContact CD1-CB 4.23Å; S297-E430 VanDerWaalsContact CB-OE2 3.27Å; S297-E430 WeakPolarHBondContact CB-OE2 3.25Å; S297-E430 PolarHBondContact OG-OE1 2.84Å; S297-E430 PolarHBondContact OG-OE2 3.04Å; Y404-E430 VanDerWaalsContact CE1-OE2 3.25Å; Y404-E430 WeakPolarHBondContact CE1-OE2 3.37Å; Y404-E430 PolarHBondContact OH-OE1 3.17Å; Y404-E430 VanDerWaalsContact OH-OE1 3.11Å; Y404-E430 PolarHBondContact OH-OE2 3.24Å; V426-E430 PolarHBondContact O-N 2.84Å; V427-E430 WeakPolarHBondContact O-CB 3.23Å; V427-E430 PolarHBondContact O-N 2.87Å; E430-L434 VanDerWaalsContact O-CA 3.29Å; E430-L434 WeakPolarHBondContact O-CA 3.28Å; E430-L434 PolarHBondContact O-N 2.77Å; E430-P437 HydrophobicContact CG-CG 3.43Å; E430-P437 VanDerWaalsContact CG-CG 3.43Å; E430-P437 VanDerWaalsContact OE1-CD 3.28Å; E430-P437 WeakPolarHBondContact OE1-CD 3.36Å
431	L	94.3	Very high	92.2	Very high	1 Å²	1	12 Å²	12	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-45.4	175.2	-71.8	173.6	0	0	0	111.8	L255 L259 L270 W273 A274 I277 V427 L428 L434	L255-L431 HydrophobicContact CD2-CD2 4.42Å; L259-L431 HydrophobicContact CD1-CD2 4.17Å; L259-L431 HydrophobicContact CD2-CD2 4.02Å; L270-L431 VanDerWaalsContact CD1-O 3.27Å; L270-L431 WeakPolarHBondContact CD1-O 3.33Å; L270-L431 HydrophobicContact CG-CB 4.36Å; W273-L431 HydrophobicContact CB-CD2 4.45Å; W273-L431 HydrophobicContact CE3-CD2 3.94Å; A274-L431 HydrophobicContact CB-CD1 4.1Å; I277-L431 HydrophobicContact CD1-CD1 4.3Å; V427-L431 WeakPolarHBondContact O-CG 3.44Å; V427-L431 PolarHBondContact O-N 2.84Å; L428-L431 PolarHBondContact O-N 3.17Å; L431-L434 WeakPolarHBondContact O-CD2 3.3Å
432	L	94.3	Very high	91.2	Very high	2 Å²	2	17 Å²	17	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-40.5	-179.8	-74.9	165.3	0	0	0	112.9	L270 L428 W429 F467 L471 Q512 W515	L270-L432 HydrophobicContact CD2-CD2 4.05Å; L428-L432 HydrophobicContact CD1-CD1 4.25Å; L428-L432 HydrophobicContact CD1-CG 4.39Å; L428-L432 HydrophobicContact CG-CD1 4Å; L428-L432 WeakPolarHBondContact O-CB 3.44Å; L428-L432 VanDerWaalsContact O-CG 3.31Å; L428-L432 WeakPolarHBondContact O-CG 3.25Å; L428-L432 PolarHBondContact O-N 2.8Å; W429-L432 PolarHBondContact O-N 3.02Å; L432-F467 HydrophobicContact CD1-CB 3.87Å; L432-F467 HydrophobicContact CD1-CD1 3.99Å; L432-F467 HydrophobicContact CD1-CG 4.01Å; L432-F467 HydrophobicContact CD2-CB 4.47Å; L432-F467 HydrophobicContact CD2-CD1 4.03Å; L432-F467 HydrophobicContact CD2-CD2 3.98Å; L432-F467 HydrophobicContact CD2-CE1 4.21Å; L432-F467 HydrophobicContact CD2-CE2 4.17Å; L432-F467 HydrophobicContact CD2-CG 3.92Å; L432-F467 HydrophobicContact CD2-CZ 4.28Å; L432-L471 HydrophobicContact CD1-CD1 4.05Å; L432-Q512 WeakPolarHBondContact O-CG 3.38Å; L432-Q512 PolarHBondContact O-NE2 3.5Å; L432-W515 VanDerWaalsContact O-CZ3 3.3Å; L432-W515 WeakPolarHBondContact O-CZ3 3.3Å
433	T	94.2	Very high	90.4	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-97.9	-23.9	-172.3	62.1	0	0	0	0	114.3	W429 D435 R516 I519	W429-T433 HydrophobicContact CD2-CG2 4.03Å; W429-T433 HydrophobicContact CG-CG2 4.38Å; W429-T433 HydrophobicContact CZ2-CG2 4.17Å; W429-T433 WeakPolarHBondContact O-CB 3.27Å; W429-T433 WeakPolarHBondContact O-CG2 3.22Å; W429-T433 PolarHBondContact O-N 2.91Å; W429-T433 PolarHBondContact O-OG1 2.93Å; T433-D435 PolarHBondContact O-N 2.89Å; T433-D435 PolarHBondContact OG1-N 3.06Å; T433-R516 WeakPolarHBondContact O-CD 3Å; T433-R516 VanDerWaalsContact O-CG 3.3Å; T433-R516 WeakPolarHBondContact O-CG 3.47Å; T433-R516 PolarHBondContact O-NH1 3.4Å; T433-I519 HydrophobicContact CG2-CD1 3.67Å
434	L	93.1	Very high	89.4	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.026	13%	0.132	C	C	.	.			trans	51.7	43.2	-163.8	-44.5	-177.1	0	0	0	112.3	L259 R262 P263 L265 E430 L431	L259-L434 HydrophobicContact CD2-CD2 3.74Å; R262-L434 HydrophobicContact CG-CB 4.14Å; P263-L434 WeakPolarHBondContact O-CD1 3.49Å; L265-L434 HydrophobicContact CD1-CD1 4.33Å; L265-L434 HydrophobicContact CD1-CD2 3.63Å; E430-L434 VanDerWaalsContact O-CA 3.29Å; E430-L434 WeakPolarHBondContact O-CA 3.28Å; E430-L434 PolarHBondContact O-N 2.77Å; L431-L434 WeakPolarHBondContact O-CD2 3.3Å
435	D	91.6	Very high	88.7	Confident	8 Å²	8	29.2 Å²	29.2	4%	0.043	15%	0.149	C	C	.	.	S	Bend	trans	-132.8	171.3	-177.2	-142.7	66.7	0	0	0	113.1	R262 W429 T433 R439 R516	R262-D435 IonicContact CZ-OD1 2.68Å; R262-D435 IonicContact NE-OD1 2.65Å; R262-D435 IonicContact NH2-OD1 3.16Å; R262-D435 PolarHBondContact NH2-OD1 2.95Å; W429-D435 HydrophobicContact CH2-CB 4.26Å; W429-D435 HydrophobicContact CZ3-CB 4.35Å; T433-D435 PolarHBondContact O-N 2.89Å; T433-D435 PolarHBondContact OG1-N 3.06Å; D435-R439 VanDerWaalsContact CG-CZ 3.49Å; D435-R439 IonicContact OD1-CZ 2.87Å; D435-R439 VanDerWaalsContact OD1-CZ 3.23Å; D435-R439 IonicContact OD1-NH1 2.7Å; D435-R439 PolarHBondContact OD1-NH1 2.88Å; D435-R439 IonicContact OD1-NH2 2.84Å; D435-R439 PolarHBondContact OD1-NH2 3.06Å; D435-R439 IonicContact OD2-CZ 2.72Å; D435-R439 IonicContact OD2-NE 3.88Å; D435-R439 IonicContact OD2-NH1 3.17Å; D435-R439 PolarHBondContact OD2-NH1 3.29Å; D435-R439 IonicContact OD2-NH2 2.73Å; D435-R439 PolarHBondContact OD2-NH2 2.77Å; D435-R516 HydrophobicContact CB-CG 3.92Å; D435-R516 WeakPolarHBondContact OD1-CD 3.48Å
436	I	88.6	Confident	88.1	Confident	24 Å²	24	29.5 Å²	29.5	12%	0.123	15%	0.151	C	C	.	.			trans	-98.6	123.6	-170.4	-64.2	173.6	0	0	0	109.1	F438 R439	I436-F438 PolarHBondContact O-N 2.95Å; I436-R439 HydrophobicContact CB-CB 4.18Å; I436-R439 HydrophobicContact CG2-CB 4.41Å; I436-R439 PolarHBondContact O-N 3.25Å; I436-R439 VanDerWaalsContact O-N 3.12Å
437	P	90.9	Very high	87.5	Confident	10 Å²	10	32 Å²	32	7%	0.065	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	127.2	-179.9	-29.6	38.2	0	0	0	111.3	A403 V426 W429 E430 R439 L457	A403-P437 HydrophobicContact CB-CB 4.23Å; V426-P437 HydrophobicContact CG1-CB 3.93Å; V426-P437 HydrophobicContact CG1-CG 3.64Å; W429-P437 HydrophobicContact CE3-CG 4.29Å; W429-P437 HydrophobicContact CZ3-CG 4.24Å; E430-P437 HydrophobicContact CG-CG 3.43Å; E430-P437 VanDerWaalsContact CG-CG 3.43Å; E430-P437 VanDerWaalsContact OE1-CD 3.28Å; E430-P437 WeakPolarHBondContact OE1-CD 3.36Å; P437-R439 PolarHBondContact O-N 2.93Å; P437-R439 VanDerWaalsContact O-N 3.1Å; P437-L457 HydrophobicContact CB-CD1 4.25Å; P437-L457 HydrophobicContact CB-CD2 4.03Å
438	F	89.2	Confident	86.7	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.026	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	37	-179.6	-45.8	-77.4	0	0	0	114.4	A403 I436 A440 M441 L446 I450 Y455 L457 Y523	A403-F438 HydrophobicContact CB-CD2 3.89Å; A403-F438 HydrophobicContact CB-CE2 4.4Å; I436-F438 PolarHBondContact O-N 2.95Å; F438-A440 PolarHBondContact O-N 3.22Å; F438-M441 HydrophobicContact CB-CB 4.36Å; F438-M441 HydrophobicContact CD1-CE 4.12Å; F438-M441 PolarHBondContact O-N 2.64Å; F438-L446 HydrophobicContact CB-CD1 3.89Å; F438-L446 HydrophobicContact CB-CD2 3.86Å; F438-L446 HydrophobicContact CD1-CD1 3.65Å; F438-L446 HydrophobicContact CD2-CD1 3.72Å; F438-L446 HydrophobicContact CD2-CD2 3.68Å; F438-L446 HydrophobicContact CD2-CG 4.28Å; F438-L446 HydrophobicContact CE1-CD1 4Å; F438-L446 HydrophobicContact CE2-CD1 4.05Å; F438-L446 HydrophobicContact CE2-CD2 4.41Å; F438-L446 HydrophobicContact CG-CD1 3.47Å; F438-L446 VanDerWaalsContact CG-CD1 3.47Å; F438-L446 HydrophobicContact CG-CD2 3.93Å; F438-L446 HydrophobicContact CG-CG 4.35Å; F438-L446 HydrophobicContact CZ-CD1 4.17Å; F438-I450 HydrophobicContact CE2-CD1 4.17Å; F438-I450 HydrophobicContact CZ-CD1 4.26Å; F438-Y455 HydrophobicContact CD1-CD1 4.45Å; F438-Y455 HydrophobicContact CD1-CE1 4.02Å; F438-Y455 AromaticContact CE1-CD1 3.76Å; F438-Y455 HydrophobicContact CE1-CD1 3.76Å; F438-Y455 AromaticContact CE1-CE1 3.62Å; F438-Y455 HydrophobicContact CE1-CE1 3.62Å; F438-L457 HydrophobicContact CD1-CD2 3.59Å; F438-L457 HydrophobicContact CD1-CG 4.4Å; F438-L457 HydrophobicContact CD2-CD2 3.74Å; F438-L457 HydrophobicContact CD2-CG 4.44Å; F438-L457 HydrophobicContact CE1-CB 4.49Å; F438-L457 HydrophobicContact CE1-CD2 3.51Å; F438-L457 HydrophobicContact CE1-CG 3.82Å; F438-L457 HydrophobicContact CE2-CD2 3.68Å; F438-L457 HydrophobicContact CE2-CG 3.88Å; F438-L457 HydrophobicContact CG-CD2 3.72Å; F438-L457 HydrophobicContact CZ-CD2 3.59Å; F438-L457 HydrophobicContact CZ-CG 3.56Å; F438-Y523 HydrophobicContact CD1-CE1 4.45Å
439	R	82.5	Confident	86.2	Confident	94 Å²	94	38.6 Å²	38.6	36%	0.355	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-37.5	-39.3	-169.5	176.8	177.9	-76	136.3	4.5	116.2	D435 I436 P437	D435-R439 VanDerWaalsContact CG-CZ 3.49Å; D435-R439 IonicContact OD1-CZ 2.87Å; D435-R439 VanDerWaalsContact OD1-CZ 3.23Å; D435-R439 IonicContact OD1-NH1 2.7Å; D435-R439 PolarHBondContact OD1-NH1 2.88Å; D435-R439 IonicContact OD1-NH2 2.84Å; D435-R439 PolarHBondContact OD1-NH2 3.06Å; D435-R439 IonicContact OD2-CZ 2.72Å; D435-R439 IonicContact OD2-NE 3.88Å; D435-R439 IonicContact OD2-NH1 3.17Å; D435-R439 PolarHBondContact OD2-NH1 3.29Å; D435-R439 IonicContact OD2-NH2 2.73Å; D435-R439 PolarHBondContact OD2-NH2 2.77Å; I436-R439 HydrophobicContact CB-CB 4.18Å; I436-R439 HydrophobicContact CG2-CB 4.41Å; I436-R439 PolarHBondContact O-N 3.25Å; I436-R439 VanDerWaalsContact O-N 3.12Å; P437-R439 PolarHBondContact O-N 2.93Å; P437-R439 VanDerWaalsContact O-N 3.1Å
440	A	77	Confident	85.8	Confident	57 Å²	57	38.5 Å²	38.5	47%	0.471	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	7.1	-172.7	0	0	0	0	0	115.1	F438 Q527	F438-A440 PolarHBondContact O-N 3.22Å; A440-Q527 PolarHBondContact O-NE2 2.83Å
441	M	78.9	Confident	85.4	Confident	21 Å²	21	38.8 Å²	38.8	10%	0.103	20%	0.196	C	C	.	.			trans	-103.5	137.3	178.8	-64	-143	-120.4	0	0	113.1	F438 L446 I449 Y455 Y523	F438-M441 HydrophobicContact CB-CB 4.36Å; F438-M441 HydrophobicContact CD1-CE 4.12Å; F438-M441 PolarHBondContact O-N 2.64Å; M441-L446 HydrophobicContact CB-CB 4.4Å; M441-L446 HydrophobicContact CE-CD1 4.49Å; M441-I449 HydrophobicContact CE-CD1 3.63Å; M441-I449 HydrophobicContact SD-CD1 3.63Å; M441-Y455 HydrophobicContact CE-CD1 4.39Å; M441-Y455 HydrophobicContact CE-CE1 3.55Å; M441-Y523 HydrophobicContact CE-CD1 4.36Å; M441-Y523 HydrophobicContact CE-CE1 4.25Å
442	E	76.3	Confident	84.8	Confident	107 Å²	107	43.7 Å²	43.7	50%	0.5	22%	0.22	S	C	.	.			trans	-76	139.3	175	-67.6	175.8	-148.6	0	0	110.9	P444 R445 L446 R560	E442-P444 VanDerWaalsContact C-CD 3.47Å; E442-R445 PolarHBondContact O-N 2.78Å; E442-R445 VanDerWaalsContact O-N 3.09Å; E442-L446 PolarHBondContact O-N 2.91Å; E442-R560 IonicContact OE1-CZ 3.9Å; E442-R560 IonicContact OE1-NH2 3.58Å; E442-R560 PolarHBondContact OE1-NH2 3.49Å; E442-R560 IonicContact OE2-CZ 3.25Å; E442-R560 IonicContact OE2-NE 2.71Å; E442-R560 PolarHBondContact OE2-NE 2.95Å; E442-R560 IonicContact OE2-NH2 2.97Å; E442-R560 PolarHBondContact OE2-NH2 2.95Å
443	Q	78.9	Confident	84.4	Confident	76 Å²	76	48.1 Å²	48.1	36%	0.355	24%	0.237	S	C	.	.	H	α-helix	trans	-53.1	-39.7	-173	-68.7	-160.2	40	0	0	114.7	N301 V402 L446 L447	N301-Q443 PolarHBondContact OD1-NE2 3.46Å; V402-Q443 HydrophobicContact CG2-CB 4.34Å; Q443-L446 PolarHBondContact O-N 2.79Å; Q443-L447 VanDerWaalsContact O-CB 3.26Å; Q443-L447 WeakPolarHBondContact O-CB 2.99Å; Q443-L447 PolarHBondContact O-N 3.31Å
444	P	73.4	Confident	84.1	Confident	99 Å²	99	49.8 Å²	49.8	64%	0.643	25%	0.246	S	C	*	.	H	α-helix	trans	-65.2	-41.4	177.6	-22.9	34.9	0	0	0	113.5	E442 F448	E442-P444 VanDerWaalsContact C-CD 3.47Å; P444-F448 PolarHBondContact O-N 3.25Å; P444-F448 VanDerWaalsContact O-N 3.1Å
445	R	82.6	Confident	84	Confident	95 Å²	95	51.6 Å²	51.6	36%	0.358	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-43.7	175	174	174.8	167.8	164.4	-2.6	110.7	E442 F448 I449	E442-R445 PolarHBondContact O-N 2.78Å; E442-R445 VanDerWaalsContact O-N 3.09Å; R445-F448 PolarHBondContact O-N 2.81Å; R445-I449 PolarHBondContact O-N 3.17Å; R445-I449 VanDerWaalsContact O-N 3.08Å
446	L	85.5	Confident	84.1	Confident	6 Å²	6	54 Å²	54	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-42.8	178.7	-174.4	60.7	0	0	0	111.7	V402 A403 F438 M441 E442 Q443 F448 I449 I450	V402-L446 HydrophobicContact CG1-CB 4.22Å; V402-L446 HydrophobicContact CG1-CD2 4.19Å; V402-L446 HydrophobicContact CG1-CG 3.98Å; A403-L446 HydrophobicContact CB-CD2 4.01Å; F438-L446 HydrophobicContact CB-CD1 3.89Å; F438-L446 HydrophobicContact CB-CD2 3.86Å; F438-L446 HydrophobicContact CD1-CD1 3.65Å; F438-L446 HydrophobicContact CD2-CD1 3.72Å; F438-L446 HydrophobicContact CD2-CD2 3.68Å; F438-L446 HydrophobicContact CD2-CG 4.28Å; F438-L446 HydrophobicContact CE1-CD1 4Å; F438-L446 HydrophobicContact CE2-CD1 4.05Å; F438-L446 HydrophobicContact CE2-CD2 4.41Å; F438-L446 HydrophobicContact CG-CD1 3.47Å; F438-L446 VanDerWaalsContact CG-CD1 3.47Å; F438-L446 HydrophobicContact CG-CD2 3.93Å; F438-L446 HydrophobicContact CG-CG 4.35Å; F438-L446 HydrophobicContact CZ-CD1 4.17Å; M441-L446 HydrophobicContact CB-CB 4.4Å; M441-L446 HydrophobicContact CE-CD1 4.49Å; E442-L446 PolarHBondContact O-N 2.91Å; Q443-L446 PolarHBondContact O-N 2.79Å; L446-F448 PolarHBondContact O-N 2.75Å; L446-I449 HydrophobicContact CD1-CD1 4.24Å; L446-I449 HydrophobicContact CD1-CG1 4.38Å; L446-I449 WeakPolarHBondContact O-CG1 3.44Å; L446-I449 PolarHBondContact O-N 2.91Å; L446-I450 HydrophobicContact CD1-CD1 3.81Å; L446-I450 HydrophobicContact CD1-CG1 4.17Å; L446-I450 HydrophobicContact CG-CD1 3.81Å; L446-I450 HydrophobicContact CG-CG1 4.49Å; L446-I450 WeakPolarHBondContact O-CB 3.2Å; L446-I450 VanDerWaalsContact O-CG1 3.31Å; L446-I450 WeakPolarHBondContact O-CG1 3.45Å; L446-I450 PolarHBondContact O-N 2.77Å
447	L	83.7	Confident	84.4	Confident	53 Å²	53	53 Å²	53	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-59.4	-47.6	176.3	178.3	61.2	0	0	0	110.9	L399 V402 C410 Q443 A451	L399-L447 HydrophobicContact CD1-CD1 4.39Å; L399-L447 HydrophobicContact CD2-CD1 3.77Å; V402-L447 HydrophobicContact CG1-CB 3.81Å; V402-L447 HydrophobicContact CG1-CD1 4.24Å; V402-L447 HydrophobicContact CG2-CB 4.33Å; V402-L447 HydrophobicContact CG2-CD1 4.45Å; C410-L447 HydrophobicContact CB-CD1 3.68Å; Q443-L447 VanDerWaalsContact O-CB 3.26Å; Q443-L447 WeakPolarHBondContact O-CB 2.99Å; Q443-L447 PolarHBondContact O-N 3.31Å; L447-A451 WeakPolarHBondContact O-CB 3.47Å; L447-A451 PolarHBondContact O-N 3.39Å
448	F	78.7	Confident	84.5	Confident	116 Å²	116	55.5 Å²	55.5	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-46.4	178.7	-177.8	-102.4	0	0	0	112.5	P444 R445 L446 A451 M452 Y453	P444-F448 PolarHBondContact O-N 3.25Å; P444-F448 VanDerWaalsContact O-N 3.1Å; R445-F448 PolarHBondContact O-N 2.81Å; L446-F448 PolarHBondContact O-N 2.75Å; F448-A451 PolarHBondContact O-N 3.33Å; F448-M452 HydrophobicContact CD2-CG 3.88Å; F448-M452 HydrophobicContact CE2-CG 3.71Å; F448-M452 HydrophobicContact CG-CG 4.4Å; F448-M452 HydrophobicContact CZ-CG 4.09Å; F448-M452 VanDerWaalsContact O-CB 3.31Å; F448-M452 WeakPolarHBondContact O-CB 3.23Å; F448-M452 WeakPolarHBondContact O-CG 3.29Å; F448-M452 PolarHBondContact O-N 2.94Å; F448-Y453 HydrophobicContact CD1-CE2 4.42Å; F448-Y453 AromaticContact CE1-CE2 3.91Å; F448-Y453 HydrophobicContact CE1-CE2 3.91Å
449	I	85.3	Confident	84.8	Confident	25 Å²	25	56.9 Å²	56.9	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-73.2	-34.9	-177.4	66.1	-179.6	0	0	0	113.5	M441 R445 L446 Y453 N454 Y455	M441-I449 HydrophobicContact CE-CD1 3.63Å; M441-I449 HydrophobicContact SD-CD1 3.63Å; R445-I449 PolarHBondContact O-N 3.17Å; R445-I449 VanDerWaalsContact O-N 3.08Å; L446-I449 HydrophobicContact CD1-CD1 4.24Å; L446-I449 HydrophobicContact CD1-CG1 4.38Å; L446-I449 WeakPolarHBondContact O-CG1 3.44Å; L446-I449 PolarHBondContact O-N 2.91Å; I449-Y453 HydrophobicContact CB-CD2 4.3Å; I449-Y453 HydrophobicContact CG2-CD2 4.27Å; I449-Y453 CarbonylContact O-C 3.48Å; I449-Y453 WeakPolarHBondContact O-CA 3.44Å; I449-Y453 WeakPolarHBondContact O-CB 3.21Å; I449-Y453 PolarHBondContact O-N 3.4Å; I449-N454 PolarHBondContact O-N 3.44Å; I449-Y455 HydrophobicContact CB-CG 4.4Å; I449-Y455 HydrophobicContact CD1-CD1 3.64Å; I449-Y455 HydrophobicContact CD1-CD2 4.32Å; I449-Y455 HydrophobicContact CD1-CE1 3.99Å; I449-Y455 HydrophobicContact CD1-CG 3.82Å; I449-Y455 HydrophobicContact CG1-CD1 4.12Å; I449-Y455 HydrophobicContact CG1-CG 4.06Å; I449-Y455 WeakPolarHBondContact O-CB 3.26Å; I449-Y455 PolarHBondContact O-N 2.99Å
450	I	88.2	Confident	85.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.5	-43.8	172.7	-64.4	173.3	0	0	0	109.9	V402 P407 C410 W422 F438 L446 N454	V402-I450 HydrophobicContact CG1-CD1 4.39Å; P407-I450 WeakPolarHBondContact CB-O 3.47Å; P407-I450 HydrophobicContact CG-CG2 4.14Å; C410-I450 HydrophobicContact CB-CG2 4.23Å; W422-I450 HydrophobicContact CZ2-CG2 4.36Å; F438-I450 HydrophobicContact CE2-CD1 4.17Å; F438-I450 HydrophobicContact CZ-CD1 4.26Å; L446-I450 HydrophobicContact CD1-CD1 3.81Å; L446-I450 HydrophobicContact CD1-CG1 4.17Å; L446-I450 HydrophobicContact CG-CD1 3.81Å; L446-I450 HydrophobicContact CG-CG1 4.49Å; L446-I450 WeakPolarHBondContact O-CB 3.2Å; L446-I450 VanDerWaalsContact O-CG1 3.31Å; L446-I450 WeakPolarHBondContact O-CG1 3.45Å; L446-I450 PolarHBondContact O-N 2.77Å; I450-N454 WeakPolarHBondContact O-CA 3.2Å; I450-N454 PolarHBondContact O-N 2.91Å
451	A	86.2	Confident	86.2	Confident	8 Å²	8	53.7 Å²	53.7	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-46.4	-179.5	0	0	0	0	0	113.3	C410 R411 L447 F448	C410-A451 HydrophobicContact CB-CB 3.88Å; R411-A451 VanDerWaalsContact CD-O 3.24Å; R411-A451 WeakPolarHBondContact CD-O 3.19Å; R411-A451 HydrophobicContact CG-CB 3.92Å; R411-A451 PolarHBondContact NE-O 2.91Å; R411-A451 VanDerWaalsContact NE-O 3.14Å; L447-A451 WeakPolarHBondContact O-CB 3.47Å; L447-A451 PolarHBondContact O-N 3.39Å; F448-A451 PolarHBondContact O-N 3.33Å
452	M	81.8	Confident	86.7	Confident	104 Å²	104	55.8 Å²	55.8	51%	0.512	29%	0.294	S	S	.	.	H	α-helix	trans	-94.2	-32.2	-169	-61.3	-65.6	105.3	0	0	113.9	R411 F448	R411-M452 HydrophobicContact CG-CE 4.09Å; F448-M452 HydrophobicContact CD2-CG 3.88Å; F448-M452 HydrophobicContact CE2-CG 3.71Å; F448-M452 HydrophobicContact CG-CG 4.4Å; F448-M452 HydrophobicContact CZ-CG 4.09Å; F448-M452 VanDerWaalsContact O-CB 3.31Å; F448-M452 WeakPolarHBondContact O-CB 3.23Å; F448-M452 WeakPolarHBondContact O-CG 3.29Å; F448-M452 PolarHBondContact O-N 2.94Å
453	Y	85.4	Confident	87.5	Confident	95 Å²	95	51.2 Å²	51.2	37%	0.373	27%	0.273	S	S	.	.	H	α-helix	trans	-118	5.1	-175.1	-52.5	-70	0	0	0	113.4	F448 I449 Y455 F845	F448-Y453 HydrophobicContact CD1-CE2 4.42Å; F448-Y453 AromaticContact CE1-CE2 3.91Å; F448-Y453 HydrophobicContact CE1-CE2 3.91Å; I449-Y453 HydrophobicContact CB-CD2 4.3Å; I449-Y453 HydrophobicContact CG2-CD2 4.27Å; I449-Y453 CarbonylContact O-C 3.48Å; I449-Y453 WeakPolarHBondContact O-CA 3.44Å; I449-Y453 WeakPolarHBondContact O-CB 3.21Å; I449-Y453 PolarHBondContact O-N 3.4Å; Y453-Y455 PolarHBondContact O-N 3.23Å; Y453-F845 HydrophobicContact CE1-CB 4.28Å
454	N	88.9	Confident	88.1	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.193	27%	0.268	C	S	.	.			trans	56	25.8	-175.8	-47.2	-76	0	0	0	114.2	P407 I449 I450 T456 P477	P407-N454 WeakPolarHBondContact CB-OD1 3.42Å; P407-N454 HydrophobicContact CG-CB 4.05Å; I449-N454 PolarHBondContact O-N 3.44Å; I450-N454 WeakPolarHBondContact O-CA 3.2Å; I450-N454 PolarHBondContact O-N 2.91Å; N454-T456 PolarHBondContact O-N 3.49Å; N454-P477 HydrophobicContact CB-CB 4.08Å; N454-P477 HydrophobicContact CB-CG 4.02Å
455	Y	89.9	Confident	89	Confident	43 Å²	43	50.5 Å²	50.5	17%	0.169	27%	0.268	C	S	.	.			trans	-55.2	127.6	-169.3	-174.9	-89.7	0	0	0	113.4	F438 M441 I449 Y453 E526	F438-Y455 HydrophobicContact CD1-CD1 4.45Å; F438-Y455 HydrophobicContact CD1-CE1 4.02Å; F438-Y455 AromaticContact CE1-CD1 3.76Å; F438-Y455 HydrophobicContact CE1-CD1 3.76Å; F438-Y455 AromaticContact CE1-CE1 3.62Å; F438-Y455 HydrophobicContact CE1-CE1 3.62Å; M441-Y455 HydrophobicContact CE-CD1 4.39Å; M441-Y455 HydrophobicContact CE-CE1 3.55Å; I449-Y455 HydrophobicContact CB-CG 4.4Å; I449-Y455 HydrophobicContact CD1-CD1 3.64Å; I449-Y455 HydrophobicContact CD1-CD2 4.32Å; I449-Y455 HydrophobicContact CD1-CE1 3.99Å; I449-Y455 HydrophobicContact CD1-CG 3.82Å; I449-Y455 HydrophobicContact CG1-CD1 4.12Å; I449-Y455 HydrophobicContact CG1-CG 4.06Å; I449-Y455 WeakPolarHBondContact O-CB 3.26Å; I449-Y455 PolarHBondContact O-N 2.99Å; Y453-Y455 PolarHBondContact O-N 3.23Å; Y455-E526 WeakPolarHBondContact CE2-OE1 3.37Å; Y455-E526 VanDerWaalsContact CZ-OE1 3.26Å; Y455-E526 PolarHBondContact OH-OE1 3.12Å; Y455-E526 PolarHBondContact OH-OE2 3.35Å
456	T	94.1	Very high	89.4	Confident	58 Å²	58	47.9 Å²	47.9	36%	0.356	26%	0.261	S	S	.	.			trans	-104.6	169.8	-178.5	63.9	0	0	0	0	112.4	W422 N454 W475	W422-T456 HydrophobicContact CH2-CG2 3.93Å; N454-T456 PolarHBondContact O-N 3.49Å; T456-W475 HydrophobicContact CG2-CB 3.78Å; T456-W475 HydrophobicContact CG2-CD2 4.47Å; T456-W475 HydrophobicContact CG2-CE3 4.27Å; T456-W475 HydrophobicContact CG2-CG 4.31Å
457	L	94.5	Very high	89.9	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.26	C	S	.	.			trans	-66.7	146	169	-69.1	159.8	0	0	0	110.9	V426 W429 P437 F438 V459 W475 Y523	V426-L457 HydrophobicContact CB-CD1 4.37Å; V426-L457 HydrophobicContact CG1-CD1 4Å; V426-L457 HydrophobicContact CG2-CD1 4.12Å; W429-L457 HydrophobicContact CB-CD1 4.1Å; W429-L457 HydrophobicContact CD2-CB 4.28Å; W429-L457 HydrophobicContact CD2-CD1 3.73Å; W429-L457 HydrophobicContact CD2-CD2 4.48Å; W429-L457 HydrophobicContact CD2-CG 4.38Å; W429-L457 HydrophobicContact CE3-CD1 3.91Å; W429-L457 HydrophobicContact CE3-CD2 4.48Å; W429-L457 HydrophobicContact CG-CB 4.32Å; W429-L457 HydrophobicContact CG-CD1 3.84Å; W429-L457 HydrophobicContact CH2-CD2 4.3Å; W429-L457 HydrophobicContact CZ2-CB 4.48Å; W429-L457 HydrophobicContact CZ2-CD2 4.24Å; W429-L457 HydrophobicContact CZ3-CD2 4.42Å; P437-L457 HydrophobicContact CB-CD1 4.25Å; P437-L457 HydrophobicContact CB-CD2 4.03Å; F438-L457 HydrophobicContact CD1-CD2 3.59Å; F438-L457 HydrophobicContact CD1-CG 4.4Å; F438-L457 HydrophobicContact CD2-CD2 3.74Å; F438-L457 HydrophobicContact CD2-CG 4.44Å; F438-L457 HydrophobicContact CE1-CB 4.49Å; F438-L457 HydrophobicContact CE1-CD2 3.51Å; F438-L457 HydrophobicContact CE1-CG 3.82Å; F438-L457 HydrophobicContact CE2-CD2 3.68Å; F438-L457 HydrophobicContact CE2-CG 3.88Å; F438-L457 HydrophobicContact CG-CD2 3.72Å; F438-L457 HydrophobicContact CZ-CD2 3.59Å; F438-L457 HydrophobicContact CZ-CG 3.56Å; L457-V459 PolarHBondContact O-N 3.4Å; L457-W475 HydrophobicContact CB-CH2 3.69Å; L457-W475 HydrophobicContact CB-CZ2 4.3Å; L457-W475 HydrophobicContact CB-CZ3 4.09Å; L457-W475 HydrophobicContact CD1-CH2 3.95Å; L457-W475 HydrophobicContact CD1-CZ2 3.8Å; L457-W475 HydrophobicContact CG-CH2 4.34Å; L457-W475 HydrophobicContact CG-CZ2 4.48Å; L457-Y523 WeakPolarHBondContact CD2-OH 3.06Å
458	Y	94.2	Very high	90.5	Very high	62 Å²	62	45.9 Å²	45.9	24%	0.243	25%	0.252	C	S	.	.			trans	-66.2	126.9	170.3	177.2	-107.8	0	0	0	110.5	W429 P460 P461 L518 I519 H522	W429-Y458 PolarHBondContact NE1-O 3.38Å; Y458-P460 HydrophobicContact CD1-CG 4.17Å; Y458-P460 HydrophobicContact CE1-CB 4.24Å; Y458-P460 HydrophobicContact CE1-CG 4.04Å; Y458-P461 WeakPolarHBondContact OH-CD 3.48Å; Y458-L518 HydrophobicContact CE1-CB 4.4Å; Y458-I519 HydrophobicContact CD1-CG1 3.96Å; Y458-H522 HydrophobicContact CD1-CB 3.99Å; Y458-H522 HydrophobicContact CD2-CB 4.35Å; Y458-H522 AromaticContact CD2-CD2 3.7Å; Y458-H522 AromaticContact CD2-CE1 3.59Å; Y458-H522 AromaticContact CD2-CG 3.62Å; Y458-H522 AromaticContact CD2-ND1 3.55Å; Y458-H522 AromaticContact CD2-NE2 3.68Å; Y458-H522 HydrophobicContact CE1-CB 4.14Å; Y458-H522 AromaticContact CE2-CG 4Å; Y458-H522 AromaticContact CE2-ND1 3.66Å; Y458-H522 HydrophobicContact CG-CB 4.09Å; Y458-H522 AromaticContact CG-CD2 3.62Å; Y458-H522 AromaticContact CG-CG 3.67Å
459	V	95.8	Very high	91.3	Very high	36 Å²	36	45.3 Å²	45.3	22%	0.218	25%	0.25	C	S	.	.			trans	-100.8	114	174.3	-176.6	0	0	0	0	108.1	L457 V463 V468 L471 W475	L457-V459 PolarHBondContact O-N 3.4Å; V459-V463 HydrophobicContact CG1-CB 4.17Å; V459-V463 HydrophobicContact CG1-CG1 4.32Å; V459-V463 HydrophobicContact CG1-CG2 4.22Å; V459-V468 HydrophobicContact CG1-CG2 4.09Å; V459-L471 HydrophobicContact CG1-CD1 4.35Å; V459-L471 HydrophobicContact CG2-CD1 4.05Å; V459-W475 HydrophobicContact CG2-CZ3 3.86Å
460	P	95	Very high	91.8	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.019	24%	0.244	C	C	.	.			trans	-64.8	149.7	-177.6	-28.1	39.4	0	0	0	113.6	Y458 V463 W515 L518 I519	Y458-P460 HydrophobicContact CD1-CG 4.17Å; Y458-P460 HydrophobicContact CE1-CB 4.24Å; Y458-P460 HydrophobicContact CE1-CG 4.04Å; P460-V463 HydrophobicContact CB-CG2 4.41Å; P460-V463 WeakPolarHBondContact O-CG2 3.47Å; P460-V463 PolarHBondContact O-N 3.1Å; P460-W515 HydrophobicContact CB-CB 4.06Å; P460-W515 HydrophobicContact CB-CG 3.9Å; P460-W515 HydrophobicContact CG-CB 3.92Å; P460-W515 HydrophobicContact CG-CG 4.18Å; P460-L518 HydrophobicContact CB-CD1 4.41Å; P460-I519 HydrophobicContact CG-CD1 3.8Å; P460-I519 HydrophobicContact CG-CG1 3.67Å
461	P	92.1	Very high	92.3	Very high	81 Å²	81	44.2 Å²	44.2	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	145.8	166.6	27.7	-35.2	0	0	0	110.7	Y458 W515 L518	Y458-P461 WeakPolarHBondContact OH-CD 3.48Å; P461-W515 PolarHBondContact O-NE1 3.08Å; P461-L518 HydrophobicContact CG-CD1 4.05Å
462	G	90.5	Very high	92.8	Very high	65 Å²	65	49.7 Å²	49.7	67%	0.67	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	-8.4	-176.3	0	0	0	0	0	115.1	W515	G462-W515 WeakPolarHBondContact O-CZ2 3.23Å
463	V	92.9	Very high	93.5	Very high	11 Å²	11	47.7 Å²	47.7	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-62.5	130.2	163.2	176.5	0	0	0	0	108.3	V459 P460 F467 V468 W515	V459-V463 HydrophobicContact CG1-CB 4.17Å; V459-V463 HydrophobicContact CG1-CG1 4.32Å; V459-V463 HydrophobicContact CG1-CG2 4.22Å; P460-V463 HydrophobicContact CB-CG2 4.41Å; P460-V463 WeakPolarHBondContact O-CG2 3.47Å; P460-V463 PolarHBondContact O-N 3.1Å; V463-F467 HydrophobicContact CG1-CB 3.86Å; V463-V468 HydrophobicContact CB-CG2 3.92Å; V463-V468 HydrophobicContact CG1-CG2 3.87Å; V463-V468 VanDerWaalsContact O-CG2 3.22Å; V463-V468 WeakPolarHBondContact O-CG2 3.17Å; V463-W515 VanDerWaalsContact CA-CZ2 3.48Å; V463-W515 HydrophobicContact CB-CH2 4.49Å; V463-W515 HydrophobicContact CB-CZ2 4.16Å; V463-W515 HydrophobicContact CG2-CD2 3.88Å; V463-W515 HydrophobicContact CG2-CE3 4.15Å; V463-W515 HydrophobicContact CG2-CH2 4.01Å; V463-W515 HydrophobicContact CG2-CZ2 3.7Å; V463-W515 HydrophobicContact CG2-CZ3 4.21Å
464	P	92	Very high	94.1	Very high	39 Å²	39	43.1 Å²	43.1	25%	0.253	24%	0.241	S	C	.	.			trans	-60.1	141.8	-176.3	-23.8	31.3	0	0	0	113.3	L466 F467 V468 F500	P464-L466 PolarHBondContact O-N 2.96Å; P464-L466 VanDerWaalsContact O-N 3.08Å; P464-F467 HydrophobicContact CB-CD2 4.05Å; P464-F467 HydrophobicContact CG-CD2 4.08Å; P464-F467 HydrophobicContact CG-CE2 4.48Å; P464-F467 PolarHBondContact O-N 3.41Å; P464-V468 PolarHBondContact O-N 2.97Å; P464-F500 HydrophobicContact CG-CB 4.05Å; P464-F500 HydrophobicContact CG-CD2 3.72Å; P464-F500 HydrophobicContact CG-CG 4.16Å
465	D	91.5	Very high	94.5	Very high	120 Å²	120	42 Å²	42	64%	0.642	23%	0.233	S	C	*	.	H	α-helix	trans	-55.5	-33.7	-171.1	-82.6	-48.2	0	0	0	114.5	F467 V468 Q469	D465-F467 VanDerWaalsContact C-N 3.32Å; D465-F467 PolarHBondContact O-N 3.49Å; D465-V468 PolarHBondContact O-N 3.37Å; D465-Q469 WeakPolarHBondContact O-CB 3.45Å; D465-Q469 VanDerWaalsContact O-CG 3.27Å; D465-Q469 WeakPolarHBondContact O-CG 2.98Å; D465-Q469 PolarHBondContact O-N 3.06Å
466	L	92.2	Very high	94.9	Very high	40 Å²	40	41.1 Å²	41.1	21%	0.209	23%	0.234	C	C	.	.	H	α-helix	trans	-56.3	-47.2	174.2	-174.9	81.7	0	0	0	111.3	P464 L470 R491 C495	P464-L466 PolarHBondContact O-N 2.96Å; P464-L466 VanDerWaalsContact O-N 3.08Å; L466-L470 WeakPolarHBondContact O-CB 3.39Å; L466-L470 PolarHBondContact O-N 2.86Å; L466-R491 HydrophobicContact CD1-CB 4.37Å; L466-R491 WeakPolarHBondContact CD2-O 3.45Å; L466-C495 HydrophobicContact CD2-CB 3.44Å; L466-C495 VanDerWaalsContact CD2-CB 3.44Å; L466-C495 WeakPolarHBondContact CD2-SG 3.29Å
467	F	95.3	Very high	94.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-71.9	-38.4	178	-65.5	-67.6	0	0	0	111.5	L271 L428 L432 V463 P464 D465 Q469 L470 L471 L492 F500	L271-F467 HydrophobicContact CD1-CZ 4.37Å; L428-F467 HydrophobicContact CD1-CD1 4.39Å; L428-F467 HydrophobicContact CD1-CE1 4.41Å; L432-F467 HydrophobicContact CD1-CB 3.87Å; L432-F467 HydrophobicContact CD1-CD1 3.99Å; L432-F467 HydrophobicContact CD1-CG 4.01Å; L432-F467 HydrophobicContact CD2-CB 4.47Å; L432-F467 HydrophobicContact CD2-CD1 4.03Å; L432-F467 HydrophobicContact CD2-CD2 3.98Å; L432-F467 HydrophobicContact CD2-CE1 4.21Å; L432-F467 HydrophobicContact CD2-CE2 4.17Å; L432-F467 HydrophobicContact CD2-CG 3.92Å; L432-F467 HydrophobicContact CD2-CZ 4.28Å; V463-F467 HydrophobicContact CG1-CB 3.86Å; P464-F467 HydrophobicContact CB-CD2 4.05Å; P464-F467 HydrophobicContact CG-CD2 4.08Å; P464-F467 HydrophobicContact CG-CE2 4.48Å; P464-F467 PolarHBondContact O-N 3.41Å; D465-F467 VanDerWaalsContact C-N 3.32Å; D465-F467 PolarHBondContact O-N 3.49Å; F467-Q469 VanDerWaalsContact C-N 3.34Å; F467-Q469 PolarHBondContact O-N 3.39Å; F467-L470 PolarHBondContact O-N 2.95Å; F467-L471 WeakPolarHBondContact O-CB 3.42Å; F467-L471 VanDerWaalsContact O-CG 3.26Å; F467-L471 WeakPolarHBondContact O-CG 3.48Å; F467-L471 PolarHBondContact O-N 3.15Å; F467-L492 HydrophobicContact CD1-CD2 4.37Å; F467-L492 HydrophobicContact CE1-CD2 3.74Å; F467-F500 AromaticContact CE2-CD1 3.7Å; F467-F500 HydrophobicContact CE2-CD1 3.7Å; F467-F500 HydrophobicContact CE2-CD2 4.29Å; F467-F500 AromaticContact CE2-CE1 3.76Å; F467-F500 HydrophobicContact CE2-CE1 3.76Å; F467-F500 HydrophobicContact CE2-CE2 4.32Å; F467-F500 AromaticContact CE2-CG 3.97Å; F467-F500 HydrophobicContact CE2-CG 3.97Å; F467-F500 HydrophobicContact CE2-CZ 4.07Å; F467-F500 HydrophobicContact CZ-CD1 4.09Å; F467-F500 AromaticContact CZ-CE1 3.87Å; F467-F500 HydrophobicContact CZ-CE1 3.87Å; F467-F500 HydrophobicContact CZ-CZ 4.4Å
468	V	95.7	Very high	94.7	Very high	18 Å²	18	44.7 Å²	44.7	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-45.5	175.8	177.4	0	0	0	0	111.1	V459 V463 P464 D465 K472	V459-V468 HydrophobicContact CG1-CG2 4.09Å; V463-V468 HydrophobicContact CB-CG2 3.92Å; V463-V468 HydrophobicContact CG1-CG2 3.87Å; V463-V468 VanDerWaalsContact O-CG2 3.22Å; V463-V468 WeakPolarHBondContact O-CG2 3.17Å; P464-V468 PolarHBondContact O-N 2.97Å; D465-V468 PolarHBondContact O-N 3.37Å; V468-K472 HydrophobicContact CG1-CD 4.12Å; V468-K472 WeakPolarHBondContact O-CB 3.42Å; V468-K472 WeakPolarHBondContact O-CD 3.41Å; V468-K472 VanDerWaalsContact O-CG 3.23Å; V468-K472 WeakPolarHBondContact O-CG 3.33Å; V468-K472 PolarHBondContact O-N 3.36Å; V468-K472 VanDerWaalsContact O-N 3.16Å
469	Q	95.6	Very high	94.7	Very high	104 Å²	104	43.3 Å²	43.3	49%	0.486	26%	0.256	S	S	.	.	H	α-helix	trans	-66.5	-47.6	175	-66.8	174.1	15.3	0	0	111.1	D465 F467 L471 K472 D473 R491	D465-Q469 WeakPolarHBondContact O-CB 3.45Å; D465-Q469 VanDerWaalsContact O-CG 3.27Å; D465-Q469 WeakPolarHBondContact O-CG 2.98Å; D465-Q469 PolarHBondContact O-N 3.06Å; F467-Q469 VanDerWaalsContact C-N 3.34Å; F467-Q469 PolarHBondContact O-N 3.39Å; Q469-L471 VanDerWaalsContact C-N 3.32Å; Q469-L471 PolarHBondContact O-N 2.84Å; Q469-K472 WeakPolarHBondContact O-CB 3.38Å; Q469-K472 PolarHBondContact O-N 3.38Å; Q469-K472 VanDerWaalsContact O-N 3.13Å; Q469-D473 PolarHBondContact O-N 3.45Å; Q469-D473 VanDerWaalsContact O-OD2 3.06Å; Q469-R491 VanDerWaalsContact CB-NH2 3.33Å
470	L	96.6	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-40.1	-178.4	-175.8	59.6	0	0	0	112.5	L428 L466 F467 C474 I488 L492	L428-L470 HydrophobicContact CD2-CD2 3.74Å; L428-L470 HydrophobicContact CD2-CG 4.06Å; L466-L470 WeakPolarHBondContact O-CB 3.39Å; L466-L470 PolarHBondContact O-N 2.86Å; F467-L470 PolarHBondContact O-N 2.95Å; L470-C474 WeakPolarHBondContact O-CB 3.46Å; L470-C474 PolarHBondContact O-N 2.97Å; L470-C474 PolarHBondContact O-SG 2.69Å; L470-I488 HydrophobicContact CD1-CB 4.45Å; L470-I488 HydrophobicContact CD1-CG1 4.09Å; L470-I488 HydrophobicContact CD1-CG2 4.32Å; L470-I488 HydrophobicContact CD2-CG2 4.47Å; L470-L492 HydrophobicContact CD2-CD2 3.68Å; L470-L492 HydrophobicContact CD2-CG 3.95Å
471	L	97.6	Very high	94.7	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-65.6	-46.1	173.4	-70.1	173.8	0	0	0	111.8	G425 L428 W429 L432 V459 F467 Q469 D473 C474 W475	G425-L471 WeakPolarHBondContact O-CD2 3.43Å; L428-L471 HydrophobicContact CB-CD2 4.14Å; L428-L471 HydrophobicContact CD2-CD2 3.99Å; L428-L471 HydrophobicContact CD2-CG 4.48Å; L428-L471 HydrophobicContact CG-CD2 4.07Å; W429-L471 HydrophobicContact CB-CD2 4.24Å; L432-L471 HydrophobicContact CD1-CD1 4.05Å; V459-L471 HydrophobicContact CG1-CD1 4.35Å; V459-L471 HydrophobicContact CG2-CD1 4.05Å; F467-L471 WeakPolarHBondContact O-CB 3.42Å; F467-L471 VanDerWaalsContact O-CG 3.26Å; F467-L471 WeakPolarHBondContact O-CG 3.48Å; F467-L471 PolarHBondContact O-N 3.15Å; Q469-L471 VanDerWaalsContact C-N 3.32Å; Q469-L471 PolarHBondContact O-N 2.84Å; L471-D473 VanDerWaalsContact C-N 3.31Å; L471-D473 PolarHBondContact O-N 2.88Å; L471-C474 PolarHBondContact O-N 2.65Å; L471-W475 HydrophobicContact CB-CE3 4.19Å; L471-W475 HydrophobicContact CB-CH2 4.26Å; L471-W475 HydrophobicContact CB-CZ3 3.97Å; L471-W475 HydrophobicContact CD1-CH2 4.3Å; L471-W475 HydrophobicContact CD2-CH2 3.87Å; L471-W475 HydrophobicContact CD2-CZ2 3.92Å; L471-W475 HydrophobicContact CD2-CZ3 4.44Å; L471-W475 HydrophobicContact CG-CH2 4.38Å; L471-W475 WeakPolarHBondContact O-CB 3.46Å; L471-W475 PolarHBondContact O-N 2.7Å
472	K	96.8	Very high	94.9	Very high	123 Å²	123	47.6 Å²	47.6	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-58.8	-40.9	176.2	-75.3	168.8	-179.3	173.8	0	112.2	V468 Q469 W475 S476	V468-K472 HydrophobicContact CG1-CD 4.12Å; V468-K472 WeakPolarHBondContact O-CB 3.42Å; V468-K472 WeakPolarHBondContact O-CD 3.41Å; V468-K472 VanDerWaalsContact O-CG 3.23Å; V468-K472 WeakPolarHBondContact O-CG 3.33Å; V468-K472 PolarHBondContact O-N 3.36Å; V468-K472 VanDerWaalsContact O-N 3.16Å; Q469-K472 WeakPolarHBondContact O-CB 3.38Å; Q469-K472 PolarHBondContact O-N 3.38Å; Q469-K472 VanDerWaalsContact O-N 3.13Å; K472-W475 CarbonylContact O-C 3.5Å; K472-W475 PolarHBondContact O-N 2.93Å; K472-S476 PolarHBondContact O-N 2.95Å
473	D	97.8	Very high	95.3	Very high	62 Å²	62	45.2 Å²	45.2	33%	0.332	25%	0.251	S	S	.	.	H	α-helix	trans	-71.5	-42.7	179.8	-61.1	-35.1	0	0	0	111.4	Q469 L471 W475 S476 R482 P483 R491	Q469-D473 PolarHBondContact O-N 3.45Å; Q469-D473 VanDerWaalsContact O-OD2 3.06Å; L471-D473 VanDerWaalsContact C-N 3.31Å; L471-D473 PolarHBondContact O-N 2.88Å; D473-W475 VanDerWaalsContact C-N 3.27Å; D473-W475 PolarHBondContact O-N 2.98Å; D473-S476 PolarHBondContact O-N 3.21Å; D473-R482 WeakPolarHBondContact O-CA 3.19Å; D473-P483 HydrophobicContact CB-CG 4.14Å; D473-P483 WeakPolarHBondContact O-CD 3.38Å; D473-R491 IonicContact OD2-CZ 2.8Å; D473-R491 IonicContact OD2-NH1 2.68Å; D473-R491 PolarHBondContact OD2-NH1 3.19Å; D473-R491 IonicContact OD2-NH2 3.82Å; D473-R491 PolarHBondContact OD2-NH2 2.9Å
474	C	98.1	Very high	95.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-31.8	173.5	-73.1	0	0	0	0	112.9	I421 L470 L471 R482	I421-C474 HydrophobicContact CG2-CB 4.22Å; L470-C474 WeakPolarHBondContact O-CB 3.46Å; L470-C474 PolarHBondContact O-N 2.97Å; L470-C474 PolarHBondContact O-SG 2.69Å; L471-C474 PolarHBondContact O-N 2.65Å; C474-R482 VanDerWaalsContact O-CD 3.29Å; C474-R482 WeakPolarHBondContact O-CD 3.13Å
475	W	97.2	Very high	95.7	Very high	11 Å²	11	49.1 Å²	49.1	4%	0.042	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	24.6	176.4	-58.5	-33.6	0	0	0	114.4	W422 G425 V426 W429 T456 L457 V459 L471 K472 D473 P477	W422-W475 AromaticContact CD2-CD1 3.67Å; W422-W475 HydrophobicContact CD2-CG 4.41Å; W422-W475 AromaticContact CE2-CD1 3.94Å; W422-W475 HydrophobicContact CE3-CB 3.98Å; W422-W475 AromaticContact CE3-CD1 3.94Å; W422-W475 HydrophobicContact CE3-CG 4.32Å; W422-W475 AromaticContact CG-CD1 3.96Å; W422-W475 HydrophobicContact CH2-CB 4.2Å; W422-W475 HydrophobicContact CZ3-CB 3.79Å; W422-W475 HydrophobicContact CZ3-CG 4.4Å; W422-W475 VanDerWaalsContact CZ3-O 3.28Å; W422-W475 WeakPolarHBondContact CZ3-O 3.35Å; W422-W475 PolarHBondContact O-NE1 2.89Å; G425-W475 VanDerWaalsContact O-CZ2 3.32Å; G425-W475 WeakPolarHBondContact O-CZ2 3.23Å; V426-W475 HydrophobicContact CG2-CZ2 4.3Å; W429-W475 HydrophobicContact CB-CH2 3.89Å; W429-W475 HydrophobicContact CB-CZ2 4.02Å; W429-W475 AromaticContact CD1-CH2 3.79Å; W429-W475 HydrophobicContact CG-CH2 4.03Å; T456-W475 HydrophobicContact CG2-CB 3.78Å; T456-W475 HydrophobicContact CG2-CD2 4.47Å; T456-W475 HydrophobicContact CG2-CE3 4.27Å; T456-W475 HydrophobicContact CG2-CG 4.31Å; L457-W475 HydrophobicContact CB-CH2 3.69Å; L457-W475 HydrophobicContact CB-CZ2 4.3Å; L457-W475 HydrophobicContact CB-CZ3 4.09Å; L457-W475 HydrophobicContact CD1-CH2 3.95Å; L457-W475 HydrophobicContact CD1-CZ2 3.8Å; L457-W475 HydrophobicContact CG-CH2 4.34Å; L457-W475 HydrophobicContact CG-CZ2 4.48Å; V459-W475 HydrophobicContact CG2-CZ3 3.86Å; L471-W475 HydrophobicContact CB-CE3 4.19Å; L471-W475 HydrophobicContact CB-CH2 4.26Å; L471-W475 HydrophobicContact CB-CZ3 3.97Å; L471-W475 HydrophobicContact CD1-CH2 4.3Å; L471-W475 HydrophobicContact CD2-CH2 3.87Å; L471-W475 HydrophobicContact CD2-CZ2 3.92Å; L471-W475 HydrophobicContact CD2-CZ3 4.44Å; L471-W475 HydrophobicContact CG-CH2 4.38Å; L471-W475 WeakPolarHBondContact O-CB 3.46Å; L471-W475 PolarHBondContact O-N 2.7Å; K472-W475 CarbonylContact O-C 3.5Å; K472-W475 PolarHBondContact O-N 2.93Å; D473-W475 VanDerWaalsContact C-N 3.27Å; D473-W475 PolarHBondContact O-N 2.98Å; W475-P477 WeakPolarHBondContact O-CD 3.31Å
476	S	96.6	Very high	95.9	Very high	26 Å²	26	46.5 Å²	46.5	18%	0.182	25%	0.247	C	C	.	.			trans	-59.4	129.4	174.1	-163.2	0	0	0	0	110.9	K472 D473 T478 S481 R482	K472-S476 PolarHBondContact O-N 2.95Å; D473-S476 PolarHBondContact O-N 3.21Å; S476-T478 PolarHBondContact O-N 3.3Å; S476-S481 WeakPolarHBondContact OG-CB 3.24Å; S476-R482 PolarHBondContact O-NE 2.96Å; S476-R482 PolarHBondContact O-NH2 2.87Å; S476-R482 VanDerWaalsContact O-NH2 3.17Å
477	P	91.7	Very high	96.1	Very high	59 Å²	59	48.9 Å²	48.9	38%	0.383	26%	0.26	S	S	.	.	S	Bend	trans	-59.3	-26.5	176.8	-28.3	36.8	0	0	0	113.6	N454 W475 P479	N454-P477 HydrophobicContact CB-CB 4.08Å; N454-P477 HydrophobicContact CB-CG 4.02Å; W475-P477 WeakPolarHBondContact O-CD 3.31Å; P477-P479 WeakPolarHBondContact O-CD 3.41Å
478	T	92.9	Very high	96.2	Very high	77 Å²	77	48.9 Å²	48.9	47%	0.472	26%	0.26	S	S	.	.	S	Bend	trans	-89.1	115.8	172.1	-56.8	0	0	0	0	109.5	S476 D480 S481	S476-T478 PolarHBondContact O-N 3.3Å; T478-D480 VanDerWaalsContact C-N 3.3Å; T478-D480 PolarHBondContact O-N 3.23Å; T478-S481 WeakPolarHBondContact O-CB 3.26Å; T478-S481 PolarHBondContact O-N 3.25Å; T478-S481 VanDerWaalsContact O-N 3.16Å
479	P	95.1	Very high	96.3	Very high	34 Å²	34	49 Å²	49	22%	0.221	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-58.7	-38.1	-175.4	-25.4	34.8	0	0	0	113.6	E408 K418 P477 S481 R482	E408-P479 HydrophobicContact CG-CG 4.21Å; K418-P479 HydrophobicContact CB-CB 3.63Å; K418-P479 WeakPolarHBondContact CB-O 3.44Å; K418-P479 WeakPolarHBondContact CD-O 3.32Å; K418-P479 HydrophobicContact CG-CB 4.12Å; K418-P479 WeakPolarHBondContact CG-O 3.31Å; K418-P479 PolarHBondContact NZ-O 2.95Å; P477-P479 WeakPolarHBondContact O-CD 3.41Å; P479-S481 VanDerWaalsContact C-N 3.27Å; P479-S481 PolarHBondContact O-N 2.82Å; P479-R482 WeakPolarHBondContact O-CB 3.23Å; P479-R482 WeakPolarHBondContact O-CG 3.23Å; P479-R482 PolarHBondContact O-N 3.36Å; P479-R482 VanDerWaalsContact O-N 3.13Å
480	D	93.8	Very high	96.2	Very high	132 Å²	132	46.9 Å²	46.9	71%	0.706	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-65.8	-27.7	-179.1	-65.4	-52.2	0	0	0	113.9	K418 T478 R482	K418-D480 PolarHBondContact NZ-O 3.25Å; T478-D480 VanDerWaalsContact C-N 3.3Å; T478-D480 PolarHBondContact O-N 3.23Å; D480-R482 VanDerWaalsContact C-N 3.27Å; D480-R482 PolarHBondContact O-N 2.89Å
481	S	96.2	Very high	96.2	Very high	74 Å²	74	49.3 Å²	49.3	52%	0.517	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-72.3	-16.7	175.7	-55.5	0	0	0	0	113.8	S476 T478 P479	S476-S481 WeakPolarHBondContact OG-CB 3.24Å; T478-S481 WeakPolarHBondContact O-CB 3.26Å; T478-S481 PolarHBondContact O-N 3.25Å; T478-S481 VanDerWaalsContact O-N 3.16Å; P479-S481 VanDerWaalsContact C-N 3.27Å; P479-S481 PolarHBondContact O-N 2.82Å
482	R	97.6	Very high	96	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.011	27%	0.269	C	S	.	.	S	Bend	trans	-70.3	138	-179.6	-56.2	176.5	-168.4	149.2	10.3	111.3	E408 K418 I421 D473 C474 S476 P479 D480	E408-R482 IonicContact OE1-CZ 2.77Å; E408-R482 IonicContact OE1-NH1 3.56Å; E408-R482 PolarHBondContact OE1-NH1 3.23Å; E408-R482 IonicContact OE1-NH2 3.57Å; E408-R482 IonicContact OE2-CZ 3.18Å; E408-R482 IonicContact OE2-NH1 2.79Å; E408-R482 PolarHBondContact OE2-NH1 3.18Å; E408-R482 IonicContact OE2-NH2 3.57Å; E408-R482 PolarHBondContact OE2-NH2 2.98Å; K418-R482 PolarHBondContact NZ-O 3.24Å; K418-R482 VanDerWaalsContact O-CD 3.31Å; K418-R482 WeakPolarHBondContact O-CD 3.29Å; K418-R482 PolarHBondContact O-NH1 2.64Å; I421-R482 HydrophobicContact CG2-CB 3.87Å; D473-R482 WeakPolarHBondContact O-CA 3.19Å; C474-R482 VanDerWaalsContact O-CD 3.29Å; C474-R482 WeakPolarHBondContact O-CD 3.13Å; S476-R482 PolarHBondContact O-NE 2.96Å; S476-R482 PolarHBondContact O-NH2 2.87Å; S476-R482 VanDerWaalsContact O-NH2 3.17Å; P479-R482 WeakPolarHBondContact O-CB 3.23Å; P479-R482 WeakPolarHBondContact O-CG 3.23Å; P479-R482 PolarHBondContact O-N 3.36Å; P479-R482 VanDerWaalsContact O-N 3.13Å; D480-R482 VanDerWaalsContact C-N 3.27Å; D480-R482 PolarHBondContact O-N 2.89Å
483	P	97.3	Very high	95.8	Very high	15 Å²	15	47.3 Å²	47.3	10%	0.097	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-68.5	150.4	-175.1	28.9	-35	0	0	0	111.9	I421 D473 N487 I488	I421-P483 WeakPolarHBondContact CD1-O 3.38Å; I421-P483 WeakPolarHBondContact CG2-O 3.35Å; D473-P483 HydrophobicContact CB-CG 4.14Å; D473-P483 WeakPolarHBondContact O-CD 3.38Å; P483-N487 HydrophobicContact CB-CB 4.22Å; P483-I488 HydrophobicContact CB-CG1 4.17Å; P483-I488 HydrophobicContact CG-CD1 4.21Å; P483-I488 HydrophobicContact CG-CG1 3.88Å
484	K	96.8	Very high	95.4	Very high	130 Å²	130	47.2 Å²	47.2	57%	0.565	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-73.5	160.7	168.7	-55.9	-174.8	177.6	-178.3	0	111.3	E486 N487 I488	K484-E486 VanDerWaalsContact C-N 3.26Å; K484-E486 WeakPolarHBondContact CB-OE2 3.35Å; K484-E486 PolarHBondContact O-N 3.5Å; K484-N487 WeakPolarHBondContact O-CB 3.38Å; K484-N487 PolarHBondContact O-N 3Å; K484-I488 WeakPolarHBondContact O-CG1 3.21Å; K484-I488 PolarHBondContact O-N 2.81Å
485	F	97.4	Very high	94.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-29.5	179.5	-81.6	-74.6	0	0	0	114.1	A278 M281 A282 H285 I421 Y424 N487 I488 M489	A278-F485 HydrophobicContact CB-CD1 4.05Å; M281-F485 HydrophobicContact CB-CD1 3.74Å; M281-F485 HydrophobicContact CB-CD2 3.75Å; M281-F485 HydrophobicContact CB-CE1 3.54Å; M281-F485 HydrophobicContact CB-CE2 3.55Å; M281-F485 HydrophobicContact CB-CG 3.85Å; M281-F485 HydrophobicContact CB-CZ 3.45Å; M281-F485 VanDerWaalsContact CB-CZ 3.45Å; M281-F485 HydrophobicContact CE-CE2 4.05Å; M281-F485 HydrophobicContact CE-CZ 4.27Å; M281-F485 HydrophobicContact CG-CE1 4.04Å; M281-F485 HydrophobicContact CG-CE2 4.25Å; M281-F485 HydrophobicContact CG-CZ 3.81Å; A282-F485 HydrophobicContact CB-CB 3.78Å; H285-F485 AromaticContact CE1-CD2 3.77Å; H285-F485 AromaticContact CE1-CE2 3.46Å; H285-F485 VanDerWaalsContact CE1-CE2 3.46Å; H285-F485 WeakPolarHBondContact CE1-CE2 3.37Å; H285-F485 AromaticContact ND1-CD2 3.54Å; H285-F485 AromaticContact ND1-CE2 3.75Å; I421-F485 HydrophobicContact CG1-CD2 4.02Å; I421-F485 HydrophobicContact CG1-CE2 3.54Å; I421-F485 HydrophobicContact CG1-CZ 4.03Å; Y424-F485 HydrophobicContact CD1-CE1 4.02Å; Y424-F485 AromaticContact CD2-CE1 3.7Å; Y424-F485 HydrophobicContact CD2-CE1 3.7Å; Y424-F485 HydrophobicContact CD2-CZ 4.37Å; Y424-F485 HydrophobicContact CE2-CE1 4.29Å; Y424-F485 AromaticContact CG-CE1 3.54Å; Y424-F485 HydrophobicContact CG-CE1 3.54Å; Y424-F485 HydrophobicContact CG-CZ 4.02Å; F485-N487 VanDerWaalsContact C-N 3.35Å; F485-N487 PolarHBondContact O-N 3.29Å; F485-I488 HydrophobicContact CD1-CD1 3.88Å; F485-I488 HydrophobicContact CE1-CD1 4.02Å; F485-I488 HydrophobicContact CG-CD1 4.39Å; F485-I488 PolarHBondContact O-N 2.97Å; F485-M489 WeakPolarHBondContact O-CG 3.31Å; F485-M489 PolarHBondContact O-N 2.85Å
486	E	95.7	Very high	93.5	Very high	65 Å²	65	51.1 Å²	51.1	30%	0.304	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-43.4	172.6	-56.3	80	-175	0	0	111.2	T286 K484 M489 A490	T286-E486 PolarHBondContact OG1-OE1 2.99Å; K484-E486 VanDerWaalsContact C-N 3.26Å; K484-E486 WeakPolarHBondContact CB-OE2 3.35Å; K484-E486 PolarHBondContact O-N 3.5Å; E486-M489 PolarHBondContact O-N 2.86Å; E486-A490 WeakPolarHBondContact O-CB 3.44Å; E486-A490 PolarHBondContact O-N 2.99Å
487	N	96.4	Very high	92.4	Very high	90 Å²	90	56.9 Å²	56.9	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-36.1	177.1	-60.3	18.6	0	0	0	111.7	P483 K484 F485 R491	P483-N487 HydrophobicContact CB-CB 4.22Å; K484-N487 WeakPolarHBondContact O-CB 3.38Å; K484-N487 PolarHBondContact O-N 3Å; F485-N487 VanDerWaalsContact C-N 3.35Å; F485-N487 PolarHBondContact O-N 3.29Å; N487-R491 WeakPolarHBondContact O-CG 3.41Å; N487-R491 PolarHBondContact O-N 3.08Å; N487-R491 VanDerWaalsContact O-N 3.13Å
488	I	97.6	Very high	91.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-50.1	174.3	-65.6	172.7	0	0	0	109.8	A278 I421 Y424 L470 P483 K484 F485 A490 R491 L492	A278-I488 HydrophobicContact CB-CG2 4.23Å; I421-I488 HydrophobicContact CG2-CD1 4.19Å; Y424-I488 HydrophobicContact CD1-CD1 4.15Å; Y424-I488 HydrophobicContact CD1-CG2 4.33Å; Y424-I488 HydrophobicContact CE1-CD1 4.41Å; Y424-I488 HydrophobicContact CE1-CG2 3.56Å; L470-I488 HydrophobicContact CD1-CB 4.45Å; L470-I488 HydrophobicContact CD1-CG1 4.09Å; L470-I488 HydrophobicContact CD1-CG2 4.32Å; L470-I488 HydrophobicContact CD2-CG2 4.47Å; P483-I488 HydrophobicContact CB-CG1 4.17Å; P483-I488 HydrophobicContact CG-CD1 4.21Å; P483-I488 HydrophobicContact CG-CG1 3.88Å; K484-I488 WeakPolarHBondContact O-CG1 3.21Å; K484-I488 PolarHBondContact O-N 2.81Å; F485-I488 HydrophobicContact CD1-CD1 3.88Å; F485-I488 HydrophobicContact CE1-CD1 4.02Å; F485-I488 HydrophobicContact CG-CD1 4.39Å; F485-I488 PolarHBondContact O-N 2.97Å; I488-A490 PolarHBondContact O-N 2.86Å; I488-R491 PolarHBondContact O-N 3.34Å; I488-L492 HydrophobicContact CG2-CD1 3.9Å; I488-L492 HydrophobicContact CG2-CG 4.5Å; I488-L492 WeakPolarHBondContact O-CG 3.49Å; I488-L492 PolarHBondContact O-N 3.13Å
489	M	96.9	Very high	91.5	Very high	20 Å²	20	56.4 Å²	56.4	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-61.3	-40.7	177.8	-73.4	-171.6	-68.4	0	0	112.5	W128 L275 A278 S279 A282 F485 E486 L492 K493	W128-M489 HydrophobicContact CH2-SD 4.37Å; L275-M489 HydrophobicContact CD2-CB 4.26Å; L275-M489 HydrophobicContact CD2-CG 4.31Å; A278-M489 HydrophobicContact CB-CG 3.64Å; S279-M489 VanDerWaalsContact CA-SD 3.6Å; A282-M489 HydrophobicContact CB-CE 3.53Å; F485-M489 WeakPolarHBondContact O-CG 3.31Å; F485-M489 PolarHBondContact O-N 2.85Å; E486-M489 PolarHBondContact O-N 2.86Å; M489-L492 PolarHBondContact O-N 3.16Å; M489-K493 WeakPolarHBondContact O-CB 3.41Å; M489-K493 WeakPolarHBondContact O-CG 3.13Å; M489-K493 PolarHBondContact O-N 3.3Å
490	A	94.9	Very high	91.1	Very high	60 Å²	60	55 Å²	55	50%	0.496	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-46.5	176.3	0	0	0	0	0	111.8	E486 I488 K493 S494	E486-A490 WeakPolarHBondContact O-CB 3.44Å; E486-A490 PolarHBondContact O-N 2.99Å; I488-A490 PolarHBondContact O-N 2.86Å; A490-K493 PolarHBondContact O-N 2.97Å; A490-S494 PolarHBondContact O-N 3.07Å; A490-S494 VanDerWaalsContact O-N 3.09Å
491	R	94.8	Very high	90.9	Very high	51 Å²	51	49.9 Å²	49.9	19%	0.192	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-45.7	177.9	-70.9	169.1	76.8	175.8	14.6	112.2	L466 Q469 D473 N487 I488 K493 S494 C495	L466-R491 HydrophobicContact CD1-CB 4.37Å; L466-R491 WeakPolarHBondContact CD2-O 3.45Å; Q469-R491 VanDerWaalsContact CB-NH2 3.33Å; D473-R491 IonicContact OD2-CZ 2.8Å; D473-R491 IonicContact OD2-NH1 2.68Å; D473-R491 PolarHBondContact OD2-NH1 3.19Å; D473-R491 IonicContact OD2-NH2 3.82Å; D473-R491 PolarHBondContact OD2-NH2 2.9Å; N487-R491 WeakPolarHBondContact O-CG 3.41Å; N487-R491 PolarHBondContact O-N 3.08Å; N487-R491 VanDerWaalsContact O-N 3.13Å; I488-R491 PolarHBondContact O-N 3.34Å; R491-K493 VanDerWaalsContact C-N 3.33Å; R491-K493 PolarHBondContact O-N 2.7Å; R491-S494 WeakPolarHBondContact CA-OG 3.45Å; R491-S494 PolarHBondContact O-N 3.39Å; R491-S494 VanDerWaalsContact O-N 3.13Å; R491-S494 PolarHBondContact O-OG 3.06Å; R491-C495 PolarHBondContact O-N 3.41Å
492	L	94.4	Very high	90.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-41.6	176.3	-69.4	171.6	0	0	0	111.6	L271 A274 L275 Y424 F467 L470 I488 M489 S494 C495	L271-L492 HydrophobicContact CD1-CB 4.03Å; L271-L492 HydrophobicContact CD1-CD2 3.91Å; A274-L492 HydrophobicContact CB-CD1 4.13Å; L275-L492 HydrophobicContact CD2-CB 3.61Å; L275-L492 HydrophobicContact CD2-CD1 4.19Å; L275-L492 HydrophobicContact CG-CB 3.98Å; L275-L492 HydrophobicContact CG-CD1 4.39Å; Y424-L492 VanDerWaalsContact OH-CD1 3.3Å; Y424-L492 WeakPolarHBondContact OH-CD1 3.11Å; F467-L492 HydrophobicContact CD1-CD2 4.37Å; F467-L492 HydrophobicContact CE1-CD2 3.74Å; L470-L492 HydrophobicContact CD2-CD2 3.68Å; L470-L492 HydrophobicContact CD2-CG 3.95Å; I488-L492 HydrophobicContact CG2-CD1 3.9Å; I488-L492 HydrophobicContact CG2-CG 4.5Å; I488-L492 WeakPolarHBondContact O-CG 3.49Å; I488-L492 PolarHBondContact O-N 3.13Å; M489-L492 PolarHBondContact O-N 3.16Å; L492-S494 VanDerWaalsContact C-N 3.29Å; L492-S494 PolarHBondContact O-N 3.48Å; L492-C495 PolarHBondContact O-N 2.65Å
493	K	92.3	Very high	90.3	Very high	83 Å²	83	54.3 Å²	54.3	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-59.4	-37.3	173.7	-76.5	-177.9	179.3	-169.2	0	112.7	W128 L275 M489 A490 R491 C495 K496	W128-K493 VanDerWaalsContact CH2-CE 3.42Å; L275-K493 HydrophobicContact CD1-CG 4.43Å; L275-K493 HydrophobicContact CD2-CG 4.09Å; M489-K493 WeakPolarHBondContact O-CB 3.41Å; M489-K493 WeakPolarHBondContact O-CG 3.13Å; M489-K493 PolarHBondContact O-N 3.3Å; A490-K493 PolarHBondContact O-N 2.97Å; R491-K493 VanDerWaalsContact C-N 3.33Å; R491-K493 PolarHBondContact O-N 2.7Å; K493-C495 PolarHBondContact O-N 2.74Å; K493-K496 WeakPolarHBondContact O-CB 3.15Å; K493-K496 WeakPolarHBondContact O-CG 3.08Å; K493-K496 PolarHBondContact O-N 3.39Å; K493-K496 VanDerWaalsContact O-N 3.1Å
494	S	88.9	Confident	90	Very high	60 Å²	60	59.3 Å²	59.3	42%	0.42	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-71.2	-4.6	175.5	58.9	0	0	0	0	115.2	A490 R491 L492 K496	A490-S494 PolarHBondContact O-N 3.07Å; A490-S494 VanDerWaalsContact O-N 3.09Å; R491-S494 WeakPolarHBondContact CA-OG 3.45Å; R491-S494 PolarHBondContact O-N 3.39Å; R491-S494 VanDerWaalsContact O-N 3.13Å; R491-S494 PolarHBondContact O-OG 3.06Å; L492-S494 VanDerWaalsContact C-N 3.29Å; L492-S494 PolarHBondContact O-N 3.48Å; S494-K496 VanDerWaalsContact C-N 3.28Å
495	C	83.2	Confident	89.8	Confident	2 Å²	2	54 Å²	54	1%	0.014	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-86.1	7.4	166	-126.7	0	0	0	0	113.5	L271 L466 R491 L492 K493 D497 C498 V501	L271-C495 HydrophobicContact CD2-CB 4.39Å; L466-C495 HydrophobicContact CD2-CB 3.44Å; L466-C495 VanDerWaalsContact CD2-CB 3.44Å; L466-C495 WeakPolarHBondContact CD2-SG 3.29Å; R491-C495 PolarHBondContact O-N 3.41Å; L492-C495 PolarHBondContact O-N 2.65Å; K493-C495 PolarHBondContact O-N 2.74Å; C495-D497 PolarHBondContact O-N 2.65Å; C495-C498 WeakPolarHBondContact CA-SG 3.41Å; C495-C498 HydrophobicContact CB-CB 4.09Å; C495-C498 WeakPolarHBondContact CB-SG 3.34Å; C495-C498 PolarHBondContact O-SG 2.91Å; C495-C498 WeakPolarHBondContact SG-CB 3.19Å; C495-C498 CovalentContact SG-SG 2.04Å; C495-C498 PolarHBondContact SG-SG 2.99Å; C495-V501 WeakPolarHBondContact O-CG1 3.41Å
496	K	73.3	Confident	89.5	Confident	90 Å²	90	57.4 Å²	57.4	39%	0.391	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-65.4	-22.5	162.8	-72.7	-172.7	175.2	-156.6	0	112.4	F133 K493 S494 V501	F133-K496 VanDerWaalsContact CZ-CE 3.48Å; K493-K496 WeakPolarHBondContact O-CB 3.15Å; K493-K496 WeakPolarHBondContact O-CG 3.08Å; K493-K496 PolarHBondContact O-N 3.39Å; K493-K496 VanDerWaalsContact O-N 3.1Å; S494-K496 VanDerWaalsContact C-N 3.28Å; K496-V501 WeakPolarHBondContact O-CG2 3.34Å
497	D	72.9	Confident	89.4	Confident	147 Å²	147	59 Å²	59	79%	0.786	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-107.4	20.6	-176.5	-38.8	-68.1	0	0	0	111.3	C495	C495-D497 PolarHBondContact O-N 2.65Å
498	C	80.5	Confident	89.3	Confident	29 Å²	29	54.7 Å²	54.7	20%	0.196	30%	0.303	C	S	.	.	S	Bend	trans	-119.2	142.9	-175.1	85.5	0	0	0	0	111.3	C495 F500 V501	C495-C498 WeakPolarHBondContact CA-SG 3.41Å; C495-C498 HydrophobicContact CB-CB 4.09Å; C495-C498 WeakPolarHBondContact CB-SG 3.34Å; C495-C498 PolarHBondContact O-SG 2.91Å; C495-C498 WeakPolarHBondContact SG-CB 3.19Å; C495-C498 CovalentContact SG-SG 2.04Å; C495-C498 PolarHBondContact SG-SG 2.99Å; C498-F500 PolarHBondContact O-N 3.29Å; C498-V501 VanDerWaalsContact O-CG2 3.27Å; C498-V501 WeakPolarHBondContact O-CG2 3.27Å; C498-V501 PolarHBondContact O-N 3.38Å
499	S	84.8	Confident	89.1	Confident	97 Å²	97	55.9 Å²	55.9	68%	0.678	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	0.8	-175.4	58.6	0	0	0	0	116.4	D502	S499-D502 WeakPolarHBondContact CA-OD2 3.41Å
500	F	87.8	Confident	89	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.026	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-30.1	169.1	174.5	-97.2	0	0	0	112.5	P267 L270 P464 F467 C498 D502 L503 L508	P267-F500 HydrophobicContact CB-CD1 3.97Å; P267-F500 HydrophobicContact CB-CE1 3.73Å; P267-F500 HydrophobicContact CB-CZ 4.17Å; P267-F500 WeakPolarHBondContact CB-O 3.41Å; P267-F500 WeakPolarHBondContact CG-O 3.48Å; L270-F500 HydrophobicContact CD1-CZ 4.29Å; L270-F500 HydrophobicContact CD2-CE1 4.44Å; L270-F500 HydrophobicContact CD2-CZ 4.27Å; P464-F500 HydrophobicContact CG-CB 4.05Å; P464-F500 HydrophobicContact CG-CD2 3.72Å; P464-F500 HydrophobicContact CG-CG 4.16Å; F467-F500 AromaticContact CE2-CD1 3.7Å; F467-F500 HydrophobicContact CE2-CD1 3.7Å; F467-F500 HydrophobicContact CE2-CD2 4.29Å; F467-F500 AromaticContact CE2-CE1 3.76Å; F467-F500 HydrophobicContact CE2-CE1 3.76Å; F467-F500 HydrophobicContact CE2-CE2 4.32Å; F467-F500 AromaticContact CE2-CG 3.97Å; F467-F500 HydrophobicContact CE2-CG 3.97Å; F467-F500 HydrophobicContact CE2-CZ 4.07Å; F467-F500 HydrophobicContact CZ-CD1 4.09Å; F467-F500 AromaticContact CZ-CE1 3.87Å; F467-F500 HydrophobicContact CZ-CE1 3.87Å; F467-F500 HydrophobicContact CZ-CZ 4.4Å; C498-F500 PolarHBondContact O-N 3.29Å; F500-D502 VanDerWaalsContact C-N 3.3Å; F500-L503 HydrophobicContact CD2-CD1 3.96Å; F500-L508 HydrophobicContact CE2-CD1 3.7Å; F500-L508 HydrophobicContact CE2-CD2 4.24Å; F500-L508 HydrophobicContact CZ-CD1 4.25Å; F500-L508 HydrophobicContact CZ-CD2 4.04Å
501	V	88.5	Confident	88.9	Confident	23 Å²	23	60.4 Å²	60.4	14%	0.139	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-18.4	178	-66.7	0	0	0	0	113.6	L268 L271 C495 K496 C498 L503	L268-V501 HydrophobicContact CD2-CB 3.92Å; L268-V501 HydrophobicContact CD2-CG1 3.89Å; L271-V501 HydrophobicContact CD2-CG1 3.94Å; C495-V501 WeakPolarHBondContact O-CG1 3.41Å; K496-V501 WeakPolarHBondContact O-CG2 3.34Å; C498-V501 VanDerWaalsContact O-CG2 3.27Å; C498-V501 WeakPolarHBondContact O-CG2 3.27Å; C498-V501 PolarHBondContact O-N 3.38Å; V501-L503 VanDerWaalsContact C-N 3.33Å
502	D	89.9	Confident	88.9	Confident	126 Å²	126	58 Å²	58	67%	0.674	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.4	178	-53.2	-44	0	0	0	113.5	S499 F500	S499-D502 WeakPolarHBondContact CA-OD2 3.41Å; F500-D502 VanDerWaalsContact C-N 3.3Å
503	L	91.1	Very high	88.9	Confident	44 Å²	44	62.1 Å²	62.1	23%	0.23	33%	0.334	C	S	.	.	S	Bend	trans	-72.5	135.1	179.9	-68.6	170.5	0	0	0	111.7	P267 F500 V501 I511	P267-L503 VanDerWaalsContact CD-O 3.31Å; P267-L503 WeakPolarHBondContact CD-O 3.38Å; P267-L503 HydrophobicContact CG-CB 3.85Å; P267-L503 WeakPolarHBondContact CG-O 3.33Å; F500-L503 HydrophobicContact CD2-CD1 3.96Å; V501-L503 VanDerWaalsContact C-N 3.33Å; L503-I511 HydrophobicContact CD1-CD1 4.1Å; L503-I511 HydrophobicContact CD2-CD1 4.26Å
504	E	91.7	Very high	89.1	Confident	121 Å²	121	62.2 Å²	62.2	57%	0.565	34%	0.339	S	S	*	.			trans	-67.6	148.1	172.2	-81	-67	153	0	0	111.1	S506 E507 L508	E504-S506 PolarHBondContact O-N 3.22Å; E504-S506 VanDerWaalsContact O-N 3.1Å; E504-E507 HydrophobicContact CB-CG 4.06Å; E504-E507 PolarHBondContact N-OE2 3.35Å; E504-E507 WeakPolarHBondContact O-CB 3.35Å; E504-E507 PolarHBondContact O-N 2.81Å; E504-L508 PolarHBondContact O-N 3.08Å
505	P	92	Very high	89.4	Confident	17 Å²	17	59.6 Å²	59.6	11%	0.11	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-25.9	-178.5	-24.9	35.7	0	0	0	114	L264 L370 A509	L264-P505 WeakPolarHBondContact CD1-O 3.4Å; L264-P505 HydrophobicContact CD2-CB 3.86Å; L264-P505 HydrophobicContact CG-CB 3.88Å; L370-P505 HydrophobicContact CD2-CB 4.44Å; L370-P505 HydrophobicContact CD2-CG 3.75Å; P505-A509 VanDerWaalsContact O-CB 3.3Å; P505-A509 WeakPolarHBondContact O-CB 3.18Å; P505-A509 PolarHBondContact O-N 3.49Å; P505-A509 VanDerWaalsContact O-N 3.12Å
506	S	92.4	Very high	89.9	Confident	74 Å²	74	60.5 Å²	60.5	52%	0.517	32%	0.323	S	S	.	.	H	α-helix	trans	-70	-44.6	172.1	47.6	0	0	0	0	112.5	E504 A509 Q510	E504-S506 PolarHBondContact O-N 3.22Å; E504-S506 VanDerWaalsContact O-N 3.1Å; S506-A509 PolarHBondContact O-N 3.09Å; S506-Q510 PolarHBondContact O-N 3.03Å
507	E	93.6	Very high	90.9	Very high	98 Å²	98	61.1 Å²	61.1	46%	0.458	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-47.3	177.3	-61	-179.9	132.5	0	0	110.8	E504 A509 Q510 I511	E504-E507 HydrophobicContact CB-CG 4.06Å; E504-E507 PolarHBondContact N-OE2 3.35Å; E504-E507 WeakPolarHBondContact O-CB 3.35Å; E504-E507 PolarHBondContact O-N 2.81Å; E507-A509 VanDerWaalsContact C-N 3.31Å; E507-A509 PolarHBondContact O-N 2.78Å; E507-Q510 PolarHBondContact O-N 3.43Å; E507-I511 WeakPolarHBondContact O-CB 3.4Å; E507-I511 VanDerWaalsContact O-CG1 3.3Å; E507-I511 WeakPolarHBondContact O-CG1 3.37Å; E507-I511 PolarHBondContact O-N 2.83Å
508	L	93.5	Very high	92	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-41.7	175.4	179.7	57	0	0	0	111.2	L265 P267 L270 F500 E504 Q510 I511 Q512	L265-L508 WeakPolarHBondContact O-CD2 3.21Å; P267-L508 HydrophobicContact CB-CD2 4.14Å; P267-L508 HydrophobicContact CG-CB 4.46Å; P267-L508 HydrophobicContact CG-CD2 3.78Å; L270-L508 HydrophobicContact CD1-CD2 4.31Å; F500-L508 HydrophobicContact CE2-CD1 3.7Å; F500-L508 HydrophobicContact CE2-CD2 4.24Å; F500-L508 HydrophobicContact CZ-CD1 4.25Å; F500-L508 HydrophobicContact CZ-CD2 4.04Å; E504-L508 PolarHBondContact O-N 3.08Å; L508-Q510 VanDerWaalsContact C-N 3.32Å; L508-Q510 PolarHBondContact O-N 3.17Å; L508-I511 PolarHBondContact O-N 3.49Å; L508-Q512 HydrophobicContact CD1-CG 3.99Å; L508-Q512 HydrophobicContact CG-CG 4.31Å; L508-Q512 WeakPolarHBondContact O-CB 3.35Å; L508-Q512 WeakPolarHBondContact O-CG 3.23Å; L508-Q512 PolarHBondContact O-N 3.41Å
509	A	93.2	Very high	92.6	Very high	24 Å²	24	55.4 Å²	55.4	20%	0.198	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-36.3	177.1	0	0	0	0	0	113.2	L264 P505 S506 E507 Q513	L264-A509 HydrophobicContact CD1-CB 3.68Å; P505-A509 VanDerWaalsContact O-CB 3.3Å; P505-A509 WeakPolarHBondContact O-CB 3.18Å; P505-A509 PolarHBondContact O-N 3.49Å; P505-A509 VanDerWaalsContact O-N 3.12Å; S506-A509 PolarHBondContact O-N 3.09Å; E507-A509 VanDerWaalsContact C-N 3.31Å; E507-A509 PolarHBondContact O-N 2.78Å; A509-Q513 PolarHBondContact O-N 3.41Å
510	Q	94.3	Very high	92.9	Very high	120 Å²	120	53.4 Å²	53.4	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-71	-43.2	175.3	-173.9	60.6	37.4	0	0	112	S506 E507 L508 Q512 Q513 N514	S506-Q510 PolarHBondContact O-N 3.03Å; E507-Q510 PolarHBondContact O-N 3.43Å; L508-Q510 VanDerWaalsContact C-N 3.32Å; L508-Q510 PolarHBondContact O-N 3.17Å; Q510-Q512 VanDerWaalsContact C-N 3.34Å; Q510-Q512 PolarHBondContact O-N 3.22Å; Q510-Q513 WeakPolarHBondContact O-CB 3.02Å; Q510-Q513 PolarHBondContact O-N 3.13Å; Q510-Q513 VanDerWaalsContact O-N 3.11Å; Q510-N514 PolarHBondContact O-N 3.42Å; Q510-N514 VanDerWaalsContact O-N 3.12Å
511	I	94.3	Very high	93.1	Very high	56 Å²	56	56.9 Å²	56.9	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-58.5	-47.2	173.1	-71.3	164.9	0	0	0	110.1	L503 E507 L508 Q513 N514 W515	L503-I511 HydrophobicContact CD1-CD1 4.1Å; L503-I511 HydrophobicContact CD2-CD1 4.26Å; E507-I511 WeakPolarHBondContact O-CB 3.4Å; E507-I511 VanDerWaalsContact O-CG1 3.3Å; E507-I511 WeakPolarHBondContact O-CG1 3.37Å; E507-I511 PolarHBondContact O-N 2.83Å; L508-I511 PolarHBondContact O-N 3.49Å; I511-Q513 VanDerWaalsContact C-N 3.28Å; I511-Q513 PolarHBondContact O-N 3.16Å; I511-N514 WeakPolarHBondContact O-CB 3.26Å; I511-N514 PolarHBondContact O-N 2.85Å; I511-W515 HydrophobicContact CG2-CD2 3.98Å; I511-W515 HydrophobicContact CG2-CE3 4.44Å; I511-W515 HydrophobicContact CG2-CH2 3.83Å; I511-W515 HydrophobicContact CG2-CZ2 3.27Å; I511-W515 HydrophobicContact CG2-CZ3 4.38Å; I511-W515 PolarHBondContact O-N 3.47Å
512	Q	95	Very high	93.2	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-30.1	175.5	-71.2	-179.9	-21.1	0	0	112.9	L432 L508 Q510 W515 R516	L432-Q512 WeakPolarHBondContact O-CG 3.38Å; L432-Q512 PolarHBondContact O-NE2 3.5Å; L508-Q512 HydrophobicContact CD1-CG 3.99Å; L508-Q512 HydrophobicContact CG-CG 4.31Å; L508-Q512 WeakPolarHBondContact O-CB 3.35Å; L508-Q512 WeakPolarHBondContact O-CG 3.23Å; L508-Q512 PolarHBondContact O-N 3.41Å; Q510-Q512 VanDerWaalsContact C-N 3.34Å; Q510-Q512 PolarHBondContact O-N 3.22Å; Q512-W515 HydrophobicContact CB-CE3 4.49Å; Q512-W515 HydrophobicContact CG-CE3 3.98Å; Q512-W515 HydrophobicContact CG-CZ3 4.05Å; Q512-R516 VanDerWaalsContact C-CZ 3.48Å; Q512-R516 WeakPolarHBondContact O-CG 3.16Å; Q512-R516 VanDerWaalsContact O-CZ 3.26Å; Q512-R516 PolarHBondContact O-N 2.85Å; Q512-R516 VanDerWaalsContact O-N 3.07Å; Q512-R516 PolarHBondContact O-NE 2.89Å
513	Q	94.4	Very high	93	Very high	85 Å²	85	52.8 Å²	52.8	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-64.3	-50.5	172.8	175.6	166.4	-25.1	0	0	111.1	A509 Q510 I511 W515 R516 E517	A509-Q513 PolarHBondContact O-N 3.41Å; Q510-Q513 WeakPolarHBondContact O-CB 3.02Å; Q510-Q513 PolarHBondContact O-N 3.13Å; Q510-Q513 VanDerWaalsContact O-N 3.11Å; I511-Q513 VanDerWaalsContact C-N 3.28Å; I511-Q513 PolarHBondContact O-N 3.16Å; Q513-W515 VanDerWaalsContact C-N 3.33Å; Q513-W515 PolarHBondContact O-N 2.84Å; Q513-R516 VanDerWaalsContact CA-NH2 3.3Å; Q513-R516 WeakPolarHBondContact O-CB 3.42Å; Q513-R516 PolarHBondContact O-N 2.71Å; Q513-R516 VanDerWaalsContact O-N 3.08Å; Q513-E517 WeakPolarHBondContact CG-OE1 3.29Å; Q513-E517 PolarHBondContact NE2-OE1 3.37Å; Q513-E517 PolarHBondContact O-N 2.85Å
514	N	95.7	Very high	92.7	Very high	86 Å²	86	57.3 Å²	57.3	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-55.8	-46.7	175.4	-177.1	13.7	0	0	0	111.4	Q510 I511 R516 E517 L518	Q510-N514 PolarHBondContact O-N 3.42Å; Q510-N514 VanDerWaalsContact O-N 3.12Å; I511-N514 WeakPolarHBondContact O-CB 3.26Å; I511-N514 PolarHBondContact O-N 2.85Å; N514-R516 VanDerWaalsContact C-N 3.31Å; N514-R516 PolarHBondContact O-N 2.74Å; N514-E517 PolarHBondContact O-N 2.99Å; N514-E517 VanDerWaalsContact O-N 3.14Å; N514-L518 WeakPolarHBondContact O-CG 3.28Å; N514-L518 PolarHBondContact O-N 2.78Å
515	W	95.6	Very high	92.5	Very high	5 Å²	5	56 Å²	56	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-54	-44	174.3	-70.6	-9.5	0	0	0	113.2	L432 P460 P461 G462 V463 I511 Q512 Q513 L518 I519	L432-W515 VanDerWaalsContact O-CZ3 3.3Å; L432-W515 WeakPolarHBondContact O-CZ3 3.3Å; P460-W515 HydrophobicContact CB-CB 4.06Å; P460-W515 HydrophobicContact CB-CG 3.9Å; P460-W515 HydrophobicContact CG-CB 3.92Å; P460-W515 HydrophobicContact CG-CG 4.18Å; P461-W515 PolarHBondContact O-NE1 3.08Å; G462-W515 WeakPolarHBondContact O-CZ2 3.23Å; V463-W515 VanDerWaalsContact CA-CZ2 3.48Å; V463-W515 HydrophobicContact CB-CH2 4.49Å; V463-W515 HydrophobicContact CB-CZ2 4.16Å; V463-W515 HydrophobicContact CG2-CD2 3.88Å; V463-W515 HydrophobicContact CG2-CE3 4.15Å; V463-W515 HydrophobicContact CG2-CH2 4.01Å; V463-W515 HydrophobicContact CG2-CZ2 3.7Å; V463-W515 HydrophobicContact CG2-CZ3 4.21Å; I511-W515 HydrophobicContact CG2-CD2 3.98Å; I511-W515 HydrophobicContact CG2-CE3 4.44Å; I511-W515 HydrophobicContact CG2-CH2 3.83Å; I511-W515 HydrophobicContact CG2-CZ2 3.27Å; I511-W515 HydrophobicContact CG2-CZ3 4.38Å; I511-W515 PolarHBondContact O-N 3.47Å; Q512-W515 HydrophobicContact CB-CE3 4.49Å; Q512-W515 HydrophobicContact CG-CE3 3.98Å; Q512-W515 HydrophobicContact CG-CZ3 4.05Å; Q513-W515 VanDerWaalsContact C-N 3.33Å; Q513-W515 PolarHBondContact O-N 2.84Å; W515-L518 PolarHBondContact O-N 3.37Å; W515-I519 VanDerWaalsContact O-CD1 3.3Å; W515-I519 WeakPolarHBondContact O-CD1 3.42Å; W515-I519 WeakPolarHBondContact O-CG1 3.13Å; W515-I519 PolarHBondContact O-N 2.81Å
516	R	93.7	Very high	91.8	Very high	21 Å²	21	57.3 Å²	57.3	8%	0.079	30%	0.297	C	S	.	.	H	α-helix	trans	-68	-34.9	178.8	-70.9	179.4	-64.2	-109.2	2.8	113.1	T433 D435 Q512 Q513 N514 A520	T433-R516 WeakPolarHBondContact O-CD 3Å; T433-R516 VanDerWaalsContact O-CG 3.3Å; T433-R516 WeakPolarHBondContact O-CG 3.47Å; T433-R516 PolarHBondContact O-NH1 3.4Å; D435-R516 HydrophobicContact CB-CG 3.92Å; D435-R516 WeakPolarHBondContact OD1-CD 3.48Å; Q512-R516 VanDerWaalsContact C-CZ 3.48Å; Q512-R516 WeakPolarHBondContact O-CG 3.16Å; Q512-R516 VanDerWaalsContact O-CZ 3.26Å; Q512-R516 PolarHBondContact O-N 2.85Å; Q512-R516 VanDerWaalsContact O-N 3.07Å; Q512-R516 PolarHBondContact O-NE 2.89Å; Q513-R516 VanDerWaalsContact CA-NH2 3.3Å; Q513-R516 WeakPolarHBondContact O-CB 3.42Å; Q513-R516 PolarHBondContact O-N 2.71Å; Q513-R516 VanDerWaalsContact O-N 3.08Å; N514-R516 VanDerWaalsContact C-N 3.31Å; N514-R516 PolarHBondContact O-N 2.74Å; R516-A520 WeakPolarHBondContact O-CB 3.12Å; R516-A520 PolarHBondContact O-N 2.77Å
517	E	94.4	Very high	90.9	Very high	103 Å²	103	57.2 Å²	57.2	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-68.5	-43.7	174.9	-70.4	169.7	-161.6	0	0	110.6	Q513 N514 I519 A520 V521	Q513-E517 WeakPolarHBondContact CG-OE1 3.29Å; Q513-E517 PolarHBondContact NE2-OE1 3.37Å; Q513-E517 PolarHBondContact O-N 2.85Å; N514-E517 PolarHBondContact O-N 2.99Å; N514-E517 VanDerWaalsContact O-N 3.14Å; E517-I519 PolarHBondContact O-N 3.28Å; E517-A520 PolarHBondContact O-N 3.36Å; E517-V521 WeakPolarHBondContact O-CG2 3.04Å; E517-V521 PolarHBondContact O-N 3.03Å
518	L	95.1	Very high	89.9	Confident	54 Å²	54	56.8 Å²	56.8	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-41.7	172.9	-67	169.1	0	0	0	112.6	Y458 P460 P461 N514 W515 A520 V521 H522	Y458-L518 HydrophobicContact CE1-CB 4.4Å; P460-L518 HydrophobicContact CB-CD1 4.41Å; P461-L518 HydrophobicContact CG-CD1 4.05Å; N514-L518 WeakPolarHBondContact O-CG 3.28Å; N514-L518 PolarHBondContact O-N 2.78Å; W515-L518 PolarHBondContact O-N 3.37Å; L518-A520 VanDerWaalsContact C-N 3.35Å; L518-A520 PolarHBondContact O-N 2.81Å; L518-V521 PolarHBondContact O-N 2.85Å; L518-H522 WeakPolarHBondContact O-CB 3.45Å; L518-H522 PolarHBondContact O-N 2.87Å
519	I	93.4	Very high	89	Confident	1 Å²	1	60 Å²	60	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-43.3	173.6	-70.3	158	0	0	0	111.2	W429 T433 Y458 P460 W515 E517 H522 Y523	W429-I519 HydrophobicContact CH2-CD1 4.1Å; W429-I519 HydrophobicContact CH2-CG2 4.32Å; W429-I519 HydrophobicContact CZ2-CD1 3.54Å; W429-I519 HydrophobicContact CZ2-CG1 4.09Å; W429-I519 HydrophobicContact CZ2-CG2 4.19Å; T433-I519 HydrophobicContact CG2-CD1 3.67Å; Y458-I519 HydrophobicContact CD1-CG1 3.96Å; P460-I519 HydrophobicContact CG-CD1 3.8Å; P460-I519 HydrophobicContact CG-CG1 3.67Å; W515-I519 VanDerWaalsContact O-CD1 3.3Å; W515-I519 WeakPolarHBondContact O-CD1 3.42Å; W515-I519 WeakPolarHBondContact O-CG1 3.13Å; W515-I519 PolarHBondContact O-N 2.81Å; E517-I519 PolarHBondContact O-N 3.28Å; I519-H522 PolarHBondContact O-N 3.36Å; I519-Y523 HydrophobicContact CG2-CD2 3.75Å; I519-Y523 HydrophobicContact CG2-CE2 3.37Å; I519-Y523 WeakPolarHBondContact O-CD2 3.41Å; I519-Y523 PolarHBondContact O-N 3.16Å; I519-Y523 VanDerWaalsContact O-N 3.11Å
520	A	91.5	Very high	87.7	Confident	56 Å²	56	61.5 Å²	61.5	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-67.3	-40	179.3	0	0	0	0	0	112.3	R516 E517 L518 K524	R516-A520 WeakPolarHBondContact O-CB 3.12Å; R516-A520 PolarHBondContact O-N 2.77Å; E517-A520 PolarHBondContact O-N 3.36Å; L518-A520 VanDerWaalsContact C-N 3.35Å; L518-A520 PolarHBondContact O-N 2.81Å; A520-K524 WeakPolarHBondContact O-CB 3.49Å; A520-K524 PolarHBondContact O-N 2.92Å; A520-K524 VanDerWaalsContact O-N 3.15Å
521	V	92.1	Very high	86	Confident	79 Å²	79	58.1 Å²	58.1	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-49.1	172.4	172	0	0	0	0	110.4	E517 L518 Y523 K524 E525	E517-V521 WeakPolarHBondContact O-CG2 3.04Å; E517-V521 PolarHBondContact O-N 3.03Å; L518-V521 PolarHBondContact O-N 2.85Å; V521-Y523 PolarHBondContact O-N 2.91Å; V521-K524 PolarHBondContact O-N 2.97Å; V521-K524 VanDerWaalsContact O-N 3.09Å; V521-E525 HydrophobicContact CG1-CG 4.18Å; V521-E525 PolarHBondContact O-N 2.97Å
522	H	90.5	Very high	84.7	Confident	54 Å²	54	59.9 Å²	59.9	25%	0.25	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-51.2	-178.3	-176	78.7	0	0	0	112.6	Y458 L518 I519 K524 E525 E526	Y458-H522 HydrophobicContact CD1-CB 3.99Å; Y458-H522 HydrophobicContact CD2-CB 4.35Å; Y458-H522 AromaticContact CD2-CD2 3.7Å; Y458-H522 AromaticContact CD2-CE1 3.59Å; Y458-H522 AromaticContact CD2-CG 3.62Å; Y458-H522 AromaticContact CD2-ND1 3.55Å; Y458-H522 AromaticContact CD2-NE2 3.68Å; Y458-H522 HydrophobicContact CE1-CB 4.14Å; Y458-H522 AromaticContact CE2-CG 4Å; Y458-H522 AromaticContact CE2-ND1 3.66Å; Y458-H522 HydrophobicContact CG-CB 4.09Å; Y458-H522 AromaticContact CG-CD2 3.62Å; Y458-H522 AromaticContact CG-CG 3.67Å; L518-H522 WeakPolarHBondContact O-CB 3.45Å; L518-H522 PolarHBondContact O-N 2.87Å; I519-H522 PolarHBondContact O-N 3.36Å; H522-K524 VanDerWaalsContact C-N 3.3Å; H522-K524 PolarHBondContact O-N 2.9Å; H522-E525 PolarHBondContact O-N 2.92Å; H522-E526 WeakPolarHBondContact O-CB 3.44Å; H522-E526 PolarHBondContact O-N 2.63Å
523	Y	85.6	Confident	82.9	Confident	9 Å²	9	61.6 Å²	61.6	4%	0.035	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-31.5	177.3	-66.8	-46.3	0	0	0	112.8	F438 M441 L457 I519 V521 Q527	F438-Y523 HydrophobicContact CD1-CE1 4.45Å; M441-Y523 HydrophobicContact CE-CD1 4.36Å; M441-Y523 HydrophobicContact CE-CE1 4.25Å; L457-Y523 WeakPolarHBondContact CD2-OH 3.06Å; I519-Y523 HydrophobicContact CG2-CD2 3.75Å; I519-Y523 HydrophobicContact CG2-CE2 3.37Å; I519-Y523 WeakPolarHBondContact O-CD2 3.41Å; I519-Y523 PolarHBondContact O-N 3.16Å; I519-Y523 VanDerWaalsContact O-N 3.11Å; V521-Y523 PolarHBondContact O-N 2.91Å; Y523-Q527 WeakPolarHBondContact O-CB 3.33Å; Y523-Q527 VanDerWaalsContact O-CG 3.23Å; Y523-Q527 WeakPolarHBondContact O-CG 3.37Å; Y523-Q527 PolarHBondContact O-N 3.11Å
524	K	85	Confident	80.8	Confident	138 Å²	138	62 Å²	62	60%	0.6	33%	0.331	S	S	*	.	H	α-helix	trans	-69	-44.6	175.2	-171.5	173.2	-177.3	174.8	0	111.3	A520 V521 H522 Q528	A520-K524 WeakPolarHBondContact O-CB 3.49Å; A520-K524 PolarHBondContact O-N 2.92Å; A520-K524 VanDerWaalsContact O-N 3.15Å; V521-K524 PolarHBondContact O-N 2.97Å; V521-K524 VanDerWaalsContact O-N 3.09Å; H522-K524 VanDerWaalsContact C-N 3.3Å; H522-K524 PolarHBondContact O-N 2.9Å; K524-Q528 WeakPolarHBondContact O-CB 3.31Å; K524-Q528 VanDerWaalsContact O-CG 3.31Å; K524-Q528 WeakPolarHBondContact O-CG 3.45Å; K524-Q528 PolarHBondContact O-N 2.94Å
525	E	86.4	Confident	78.7	Confident	95 Å²	95	61 Å²	61	44%	0.444	33%	0.33	S	S	.	.	H	α-helix	trans	-66.6	-36.8	176	-71.2	-157.5	125.3	0	0	112.5	V521 H522 Q528 T529	V521-E525 HydrophobicContact CG1-CG 4.18Å; V521-E525 PolarHBondContact O-N 2.97Å; H522-E525 PolarHBondContact O-N 2.92Å; E525-Q528 PolarHBondContact O-N 2.71Å; E525-T529 VanDerWaalsContact O-CB 3.28Å; E525-T529 WeakPolarHBondContact O-CB 3.25Å; E525-T529 PolarHBondContact O-N 2.88Å; E525-T529 PolarHBondContact O-OG1 3.37Å
526	E	78.9	Confident	76.6	Confident	44 Å²	44	63.2 Å²	63.2	21%	0.206	35%	0.347	C	S	.	.	H	α-helix	trans	-69	-43.9	175.9	-174.7	-172.9	-126.2	0	0	111.7	Y455 H522 Q528 T529 V530	Y455-E526 WeakPolarHBondContact CE2-OE1 3.37Å; Y455-E526 VanDerWaalsContact CZ-OE1 3.26Å; Y455-E526 PolarHBondContact OH-OE1 3.12Å; Y455-E526 PolarHBondContact OH-OE2 3.35Å; H522-E526 WeakPolarHBondContact O-CB 3.44Å; H522-E526 PolarHBondContact O-N 2.63Å; E526-Q528 VanDerWaalsContact C-N 3.32Å; E526-Q528 PolarHBondContact O-N 2.98Å; E526-T529 PolarHBondContact O-N 2.94Å; E526-V530 WeakPolarHBondContact O-CG2 3.36Å; E526-V530 PolarHBondContact O-N 2.79Å
527	Q	71.8	Confident	74.2	Confident	72 Å²	72	65.1 Å²	65.1	34%	0.336	36%	0.364	S	S	.	.	H	α-helix	trans	-60.3	-42.8	173.4	-75.5	-178.5	4	0	0	111.6	A440 Y523 A531	A440-Q527 PolarHBondContact O-NE2 2.83Å; Y523-Q527 WeakPolarHBondContact O-CB 3.33Å; Y523-Q527 VanDerWaalsContact O-CG 3.23Å; Y523-Q527 WeakPolarHBondContact O-CG 3.37Å; Y523-Q527 PolarHBondContact O-N 3.11Å; Q527-A531 WeakPolarHBondContact O-CB 3.35Å; Q527-A531 PolarHBondContact O-N 2.85Å
528	Q	74.7	Confident	71.8	Confident	88 Å²	88	66.2 Å²	66.2	41%	0.411	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-45.4	171.8	-75.8	178.7	-10.6	0	0	111.8	K524 E525 E526 V530 A531 E532	K524-Q528 WeakPolarHBondContact O-CB 3.31Å; K524-Q528 VanDerWaalsContact O-CG 3.31Å; K524-Q528 WeakPolarHBondContact O-CG 3.45Å; K524-Q528 PolarHBondContact O-N 2.94Å; E525-Q528 PolarHBondContact O-N 2.71Å; E526-Q528 VanDerWaalsContact C-N 3.32Å; E526-Q528 PolarHBondContact O-N 2.98Å; Q528-V530 VanDerWaalsContact C-N 3.33Å; Q528-V530 PolarHBondContact O-N 3.38Å; Q528-A531 CarbonylContact O-C 3.06Å; Q528-A531 PolarHBondContact O-N 3.43Å; Q528-A531 VanDerWaalsContact O-N 3.17Å; Q528-E532 WeakPolarHBondContact O-CB 3.46Å; Q528-E532 WeakPolarHBondContact O-CG 3.46Å; Q528-E532 PolarHBondContact O-N 3.13Å
529	T	74.4	Confident	69.5	Low	69 Å²	69	74.3 Å²	74.3	42%	0.423	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-36.2	-178.2	-59.3	0	0	0	0	112.1	E525 E526 A533	E525-T529 VanDerWaalsContact O-CB 3.28Å; E525-T529 WeakPolarHBondContact O-CB 3.25Å; E525-T529 PolarHBondContact O-N 2.88Å; E525-T529 PolarHBondContact O-OG1 3.37Å; E526-T529 PolarHBondContact O-N 2.94Å; T529-A533 WeakPolarHBondContact O-CB 3.14Å; T529-A533 PolarHBondContact O-N 3.4Å
530	V	64.4	Low	67.1	Low	55 Å²	55	77.3 Å²	77.3	33%	0.333	41%	0.414	S	S	.	.	H	α-helix	trans	-70.7	-41.5	173.1	172.7	0	0	0	0	111.3	E526 Q528 A533 L534	E526-V530 WeakPolarHBondContact O-CG2 3.36Å; E526-V530 PolarHBondContact O-N 2.79Å; Q528-V530 VanDerWaalsContact C-N 3.33Å; Q528-V530 PolarHBondContact O-N 3.38Å; V530-A533 PolarHBondContact O-N 3.06Å; V530-L534 HydrophobicContact CG1-CD1 4.14Å; V530-L534 WeakPolarHBondContact O-CG 3.37Å; V530-L534 PolarHBondContact O-N 2.84Å
531	A	59.3	Low	64.5	Low	50 Å²	50	78.8 Å²	78.8	41%	0.413	44%	0.435	S	S	.	.	H	α-helix	trans	-65.1	-40.3	175.3	0	0	0	0	0	112.4	Q527 Q528 S535	Q527-A531 WeakPolarHBondContact O-CB 3.35Å; Q527-A531 PolarHBondContact O-N 2.85Å; Q528-A531 CarbonylContact O-C 3.06Å; Q528-A531 PolarHBondContact O-N 3.43Å; Q528-A531 VanDerWaalsContact O-N 3.17Å; A531-S535 WeakPolarHBondContact O-CB 3.44Å; A531-S535 PolarHBondContact O-N 3.17Å; A531-S535 PolarHBondContact O-OG 2.94Å
532	E	66.3	Low	61.6	Low	93 Å²	93	80.1 Å²	80.1	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-65.1	-42.2	172.2	-75.9	176.4	-166.3	0	0	111.1	Q528 S535 S536 K1110	Q528-E532 WeakPolarHBondContact O-CB 3.46Å; Q528-E532 WeakPolarHBondContact O-CG 3.46Å; Q528-E532 PolarHBondContact O-N 3.13Å; E532-S535 PolarHBondContact O-N 3.03Å; E532-S536 VanDerWaalsContact O-CB 3.23Å; E532-S536 WeakPolarHBondContact O-CB 3.32Å; E532-S536 PolarHBondContact O-N 3.5Å; E532-S536 PolarHBondContact O-OG 2.83Å; E532-K1110 IonicContact OE1-NZ 3.2Å
533	A	57.2	Low	58.9	Low	37 Å²	37	82.6 Å²	82.6	31%	0.306	46%	0.463	S	S	.	.	H	α-helix	trans	-60.4	-50.9	176.3	0	0	0	0	0	111.1	T529 V530 S536 S537	T529-A533 WeakPolarHBondContact O-CB 3.14Å; T529-A533 PolarHBondContact O-N 3.4Å; V530-A533 PolarHBondContact O-N 3.06Å; A533-S536 PolarHBondContact O-N 3.43Å; A533-S536 PolarHBondContact O-OG 2.81Å; A533-S537 PolarHBondContact O-N 2.86Å; A533-S537 PolarHBondContact O-OG 2.88Å; A533-S537 VanDerWaalsContact O-OG 3.04Å
534	L	50.1	Low	56.7	Low	93 Å²	93	90.4 Å²	90.4	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-57.7	-51.2	173.5	-69.1	165.6	0	0	0	111.4	V530 S536 S537 F538	V530-L534 HydrophobicContact CG1-CD1 4.14Å; V530-L534 WeakPolarHBondContact O-CG 3.37Å; V530-L534 PolarHBondContact O-N 2.84Å; L534-S536 VanDerWaalsContact C-N 3.29Å; L534-S536 PolarHBondContact O-N 3.1Å; L534-S537 PolarHBondContact O-N 2.83Å; L534-F538 WeakPolarHBondContact O-CD2 3.38Å; L534-F538 PolarHBondContact O-N 3.37Å
535	S	53	Low	54.6	Low	64 Å²	64	89.7 Å²	89.7	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-29.5	-178.1	-58.8	0	0	0	0	113.7	A531 E532 R539	A531-S535 WeakPolarHBondContact O-CB 3.44Å; A531-S535 PolarHBondContact O-N 3.17Å; A531-S535 PolarHBondContact O-OG 2.94Å; E532-S535 PolarHBondContact O-N 3.03Å; S535-R539 VanDerWaalsContact O-CG 3.31Å; S535-R539 WeakPolarHBondContact O-CG 3.16Å; S535-R539 PolarHBondContact O-N 2.76Å
536	S	51.9	Low	52.4	Low	52 Å²	52	88.4 Å²	88.4	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-78.3	-42.4	175.5	60.7	0	0	0	0	111.5	E532 A533 L534 F538 R539 S540	E532-S536 VanDerWaalsContact O-CB 3.23Å; E532-S536 WeakPolarHBondContact O-CB 3.32Å; E532-S536 PolarHBondContact O-N 3.5Å; E532-S536 PolarHBondContact O-OG 2.83Å; A533-S536 PolarHBondContact O-N 3.43Å; A533-S536 PolarHBondContact O-OG 2.81Å; L534-S536 VanDerWaalsContact C-N 3.29Å; L534-S536 PolarHBondContact O-N 3.1Å; S536-F538 VanDerWaalsContact C-N 3.25Å; S536-F538 PolarHBondContact O-N 2.73Å; S536-R539 PolarHBondContact O-N 3.16Å; S536-S540 PolarHBondContact O-N 2.89Å; S536-S540 PolarHBondContact O-OG 3.15Å; S536-S540 VanDerWaalsContact O-OG 3.11Å
537	S	43.2	Very low	50.9	Low	62 Å²	62	91.7 Å²	91.7	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-59.1	-36	171.2	-58.4	0	0	0	0	112.4	A533 L534 R539	A533-S537 PolarHBondContact O-N 2.86Å; A533-S537 PolarHBondContact O-OG 2.88Å; A533-S537 VanDerWaalsContact O-OG 3.04Å; L534-S537 PolarHBondContact O-N 2.83Å; S537-R539 VanDerWaalsContact C-N 3.27Å; S537-R539 PolarHBondContact O-N 2.95Å
538	F	43.1	Very low	49.6	Very low	126 Å²	126	93.4 Å²	93.4	55%	0.553	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-18	171.8	-100.3	-80.4	0	0	0	114.5	L534 S536 L550	L534-F538 WeakPolarHBondContact O-CD2 3.38Å; L534-F538 PolarHBondContact O-N 3.37Å; S536-F538 VanDerWaalsContact C-N 3.25Å; S536-F538 PolarHBondContact O-N 2.73Å; F538-L550 HydrophobicContact CE1-CD1 4.14Å; F538-L550 HydrophobicContact CE1-CD2 4.1Å; F538-L550 HydrophobicContact CE2-CD2 3.96Å; F538-L550 HydrophobicContact CZ-CD1 4.47Å; F538-L550 HydrophobicContact CZ-CD2 3.64Å
539	R	47.2	Very low	48.2	Very low	224 Å²	224	92.4 Å²	92.4	85%	0.845	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-32.5	-177.7	-75.6	179.4	-176.7	-156.1	3.2	113.2	S535 S536 S537 G541	S535-R539 VanDerWaalsContact O-CG 3.31Å; S535-R539 WeakPolarHBondContact O-CG 3.16Å; S535-R539 PolarHBondContact O-N 2.76Å; S536-R539 PolarHBondContact O-N 3.16Å; S537-R539 VanDerWaalsContact C-N 3.27Å; S537-R539 PolarHBondContact O-N 2.95Å; R539-G541 PolarHBondContact O-N 2.91Å
540	S	42.4	Very low	46.8	Very low	63 Å²	63	91.9 Å²	91.9	44%	0.441	53%	0.527	S	S	.	.	S	Bend	trans	-78.8	89.3	166.5	56.3	0	0	0	0	108.8	S536 S542	S536-S540 PolarHBondContact O-N 2.89Å; S536-S540 PolarHBondContact O-OG 3.15Å; S536-S540 VanDerWaalsContact O-OG 3.11Å; S540-S542 PolarHBondContact O-N 3.24Å
541	G	37.4	Very low	46.4	Very low	87 Å²	87	92.7 Å²	92.7	90%	0.897	53%	0.532	S	S	*	.			trans	-68.9	51.3	178.3	0	0	0	0	0	114.1	R539	R539-G541 PolarHBondContact O-N 2.91Å
542	S	31.8	Very low	45.8	Very low	108 Å²	108	92.5 Å²	92.5	76%	0.755	52%	0.522	S	S	*	.			trans	-148.9	70.9	-179.9	-169.7	0	0	0	0	108.9	S540	S540-S542 PolarHBondContact O-N 3.24Å
543	L	34.2	Very low	45	Very low	106 Å²	106	92 Å²	92	56%	0.555	52%	0.522	S	S	*	.			trans	-161.4	117.9	168.7	-112.4	159.8	0	0	0	107.3	F545	L543-F545 HydrophobicContact CD2-CD2 4.03Å; L543-F545 HydrophobicContact CD2-CE2 4.23Å; L543-F545 PolarHBondContact O-N 2.78Å
544	D	38.2	Very low	45	Very low	172 Å²	172	95.5 Å²	95.5	92%	0.92	53%	0.532	S	S	*	.			trans	-73	56.5	168.1	-69.1	-55.7	0	0	0	110.9	S546	D544-S546 VanDerWaalsContact C-N 3.32Å; D544-S546 PolarHBondContact O-N 2.91Å
545	F	40.1	Very low	45.1	Very low	123 Å²	123	96.6 Å²	96.6	54%	0.539	54%	0.536	S	S	.	.			trans	-71.5	102.7	144.5	-90.2	-71.3	0	0	0	105.8	L543 T547 L549	L543-F545 HydrophobicContact CD2-CD2 4.03Å; L543-F545 HydrophobicContact CD2-CE2 4.23Å; L543-F545 PolarHBondContact O-N 2.78Å; F545-T547 PolarHBondContact O-N 2.88Å; F545-L549 HydrophobicContact CD1-CB 4.37Å; F545-L549 HydrophobicContact CD1-CD2 3.35Å; F545-L549 HydrophobicContact CD1-CG 4.47Å; F545-L549 HydrophobicContact CE1-CD2 3.52Å; F545-L549 HydrophobicContact CG-CD2 4.35Å
546	S	41.7	Very low	44.7	Very low	69 Å²	69	97.3 Å²	97.3	48%	0.483	53%	0.534	S	S	.	.			trans	-44.4	140.4	176.4	43.2	0	0	0	0	110.6	D544 E548 L549	D544-S546 VanDerWaalsContact C-N 3.32Å; D544-S546 PolarHBondContact O-N 2.91Å; S546-E548 PolarHBondContact O-N 3.2Å; S546-E548 VanDerWaalsContact O-N 3.08Å; S546-L549 PolarHBondContact O-N 2.72Å
547	T	47.6	Very low	44.8	Very low	113 Å²	113	102.5 Å²	102.5	69%	0.693	55%	0.546	S	S	*	.	H	α-helix	trans	-46.1	-42.1	177.3	40.7	0	0	0	0	111.3	F545 L549 L550 T551	F545-T547 PolarHBondContact O-N 2.88Å; T547-L549 VanDerWaalsContact C-N 3.3Å; T547-L549 PolarHBondContact O-N 2.85Å; T547-L549 VanDerWaalsContact O-N 3.12Å; T547-L550 WeakPolarHBondContact O-CA 3.48Å; T547-L550 PolarHBondContact O-N 3.15Å; T547-T551 PolarHBondContact O-N 2.88Å; T547-T551 PolarHBondContact O-OG1 2.94Å; T547-T551 VanDerWaalsContact O-OG1 3.11Å
548	E	44.3	Very low	45.8	Very low	108 Å²	108	104.3 Å²	104.3	51%	0.505	55%	0.551	S	S	.	*	H	α-helix	trans	-22.3	-57.2	158.4	-168.8	77.4	-125.7	0	0	115.5	S546 Q552	S546-E548 PolarHBondContact O-N 3.2Å; S546-E548 VanDerWaalsContact O-N 3.08Å; E548-Q552 VanDerWaalsContact O-CB 3.32Å; E548-Q552 WeakPolarHBondContact O-CB 3.45Å; E548-Q552 WeakPolarHBondContact O-CG 3.48Å; E548-Q552 PolarHBondContact O-N 2.75Å; E548-Q552 PolarHBondContact OE1-NE2 3.25Å
549	L	43.6	Very low	46.1	Very low	66 Å²	66	101.5 Å²	101.5	35%	0.346	54%	0.537	S	S	.	.	H	α-helix	trans	-75.8	-33.8	-176.8	-164.9	76.5	0	0	0	112.6	F545 S546 T547 Q552 L553	F545-L549 HydrophobicContact CD1-CB 4.37Å; F545-L549 HydrophobicContact CD1-CD2 3.35Å; F545-L549 HydrophobicContact CD1-CG 4.47Å; F545-L549 HydrophobicContact CE1-CD2 3.52Å; F545-L549 HydrophobicContact CG-CD2 4.35Å; S546-L549 PolarHBondContact O-N 2.72Å; T547-L549 VanDerWaalsContact C-N 3.3Å; T547-L549 PolarHBondContact O-N 2.85Å; T547-L549 VanDerWaalsContact O-N 3.12Å; L549-Q552 PolarHBondContact O-N 3.29Å; L549-L553 WeakPolarHBondContact O-CB 3.45Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.31Å
550	L	46.6	Very low	46.2	Very low	59 Å²	59	96.2 Å²	96.2	31%	0.309	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-46.4	173.2	-62.8	-176.2	0	0	0	109.8	F538 T547 Q552 L553 E554	F538-L550 HydrophobicContact CE1-CD1 4.14Å; F538-L550 HydrophobicContact CE1-CD2 4.1Å; F538-L550 HydrophobicContact CE2-CD2 3.96Å; F538-L550 HydrophobicContact CZ-CD1 4.47Å; F538-L550 HydrophobicContact CZ-CD2 3.64Å; T547-L550 WeakPolarHBondContact O-CA 3.48Å; T547-L550 PolarHBondContact O-N 3.15Å; L550-Q552 VanDerWaalsContact C-N 3.3Å; L550-Q552 PolarHBondContact O-N 2.9Å; L550-L553 PolarHBondContact O-N 2.78Å; L550-L553 VanDerWaalsContact O-N 3.13Å; L550-E554 WeakPolarHBondContact O-CB 3.25Å; L550-E554 WeakPolarHBondContact O-CG 3.19Å; L550-E554 PolarHBondContact O-N 2.82Å
551	T	55.3	Low	47.3	Very low	72 Å²	72	96.9 Å²	96.9	44%	0.442	51%	0.513	S	S	.	.	H	α-helix	trans	-59.6	-37.3	172.3	-52.6	0	0	0	0	111.9	T547 M555	T547-T551 PolarHBondContact O-N 2.88Å; T547-T551 PolarHBondContact O-OG1 2.94Å; T547-T551 VanDerWaalsContact O-OG1 3.11Å; T551-M555 HydrophobicContact CG2-CG 4.45Å; T551-M555 VanDerWaalsContact O-CB 3.24Å; T551-M555 WeakPolarHBondContact O-CB 3.4Å; T551-M555 VanDerWaalsContact O-CG 3.27Å; T551-M555 WeakPolarHBondContact O-CG 3.29Å; T551-M555 PolarHBondContact O-N 2.77Å
552	Q	47.5	Very low	48.4	Very low	45 Å²	45	95.2 Å²	95.2	21%	0.21	49%	0.488	C	S	.	.	H	α-helix	trans	-70.5	-35.4	174.2	-76.5	172.6	24.1	0	0	113	E548 L549 L550 M555 L556	E548-Q552 VanDerWaalsContact O-CB 3.32Å; E548-Q552 WeakPolarHBondContact O-CB 3.45Å; E548-Q552 WeakPolarHBondContact O-CG 3.48Å; E548-Q552 PolarHBondContact O-N 2.75Å; E548-Q552 PolarHBondContact OE1-NE2 3.25Å; L549-Q552 PolarHBondContact O-N 3.29Å; L550-Q552 VanDerWaalsContact C-N 3.3Å; L550-Q552 PolarHBondContact O-N 2.9Å; Q552-M555 HydrophobicContact CG-CE 4.36Å; Q552-L556 WeakPolarHBondContact O-CB 3.13Å; Q552-L556 VanDerWaalsContact O-CG 3.25Å; Q552-L556 WeakPolarHBondContact O-CG 3.3Å; Q552-L556 PolarHBondContact O-N 3.32Å
553	L	48.2	Very low	49.4	Very low	82 Å²	82	93.4 Å²	93.4	43%	0.429	47%	0.47	S	S	.	.	H	α-helix	trans	-71.4	-35.6	174.5	-74.6	170.9	0	0	0	112.1	L549 L550 R557	L549-L553 WeakPolarHBondContact O-CB 3.45Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.31Å; L550-L553 PolarHBondContact O-N 2.78Å; L550-L553 VanDerWaalsContact O-N 3.13Å; L553-R557 WeakPolarHBondContact O-CB 3.16Å; L553-R557 PolarHBondContact O-N 3.31Å
554	E	56.7	Low	50.5	Low	111 Å²	111	91.9 Å²	91.9	52%	0.519	46%	0.462	S	S	.	.	H	α-helix	trans	-73.6	-43.6	174.3	-70.1	179.6	142.9	0	0	111.1	L550 L556 R557 D558	L550-E554 WeakPolarHBondContact O-CB 3.25Å; L550-E554 WeakPolarHBondContact O-CG 3.19Å; L550-E554 PolarHBondContact O-N 2.82Å; E554-L556 VanDerWaalsContact C-N 3.34Å; E554-L556 PolarHBondContact O-N 2.82Å; E554-R557 CarbonylContact O-C 3.43Å; E554-R557 WeakPolarHBondContact O-CA 3.43Å; E554-R557 WeakPolarHBondContact O-CB 3.35Å; E554-R557 PolarHBondContact O-N 3.18Å; E554-D558 PolarHBondContact O-N 3.41Å
555	M	52.2	Low	51.9	Low	116 Å²	116	88.7 Å²	88.7	57%	0.571	44%	0.437	S	S	*	.	H	α-helix	trans	-60.1	-40.5	169.4	-77.4	-160.8	-59.1	0	0	112.3	T551 Q552 R557 D558 Y559	T551-M555 HydrophobicContact CG2-CG 4.45Å; T551-M555 VanDerWaalsContact O-CB 3.24Å; T551-M555 WeakPolarHBondContact O-CB 3.4Å; T551-M555 VanDerWaalsContact O-CG 3.27Å; T551-M555 WeakPolarHBondContact O-CG 3.29Å; T551-M555 PolarHBondContact O-N 2.77Å; Q552-M555 HydrophobicContact CG-CE 4.36Å; M555-R557 VanDerWaalsContact C-N 3.26Å; M555-R557 PolarHBondContact O-N 2.8Å; M555-D558 PolarHBondContact O-N 2.79Å; M555-Y559 WeakPolarHBondContact O-CA 3.25Å; M555-Y559 WeakPolarHBondContact O-CB 3.42Å; M555-Y559 PolarHBondContact O-N 3.46Å
556	L	46.6	Very low	52.9	Low	79 Å²	79	86.3 Å²	86.3	41%	0.414	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-34.3	173.8	-87.4	167.7	0	0	0	112	Q552 E554 R560 T747	Q552-L556 WeakPolarHBondContact O-CB 3.13Å; Q552-L556 VanDerWaalsContact O-CG 3.25Å; Q552-L556 WeakPolarHBondContact O-CG 3.3Å; Q552-L556 PolarHBondContact O-N 3.32Å; E554-L556 VanDerWaalsContact C-N 3.34Å; E554-L556 PolarHBondContact O-N 2.82Å; L556-R560 WeakPolarHBondContact O-CB 3.48Å; L556-R560 PolarHBondContact O-N 2.78Å; L556-T747 HydrophobicContact CD2-CG2 3.88Å; L556-T747 HydrophobicContact CG-CG2 4.2Å
557	R	53.1	Low	53.5	Low	161 Å²	161	88.5 Å²	88.5	61%	0.608	43%	0.43	S	S	*	.	H	α-helix	trans	-72.6	-47.5	176.4	-178.2	-179.1	177.9	164.8	1.1	111.8	L553 E554 M555 Y559 R560 E561	L553-R557 WeakPolarHBondContact O-CB 3.16Å; L553-R557 PolarHBondContact O-N 3.31Å; E554-R557 CarbonylContact O-C 3.43Å; E554-R557 WeakPolarHBondContact O-CA 3.43Å; E554-R557 WeakPolarHBondContact O-CB 3.35Å; E554-R557 PolarHBondContact O-N 3.18Å; M555-R557 VanDerWaalsContact C-N 3.26Å; M555-R557 PolarHBondContact O-N 2.8Å; R557-Y559 VanDerWaalsContact C-N 3.34Å; R557-R560 WeakPolarHBondContact O-CB 3.4Å; R557-R560 PolarHBondContact O-N 2.86Å; R557-E561 IonicContact NE-OE1 3.94Å; R557-E561 PolarHBondContact O-N 3.44Å
558	D	64.1	Low	54.2	Low	100 Å²	100	85.5 Å²	85.5	54%	0.535	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-36.9	178.4	-74.1	-8.3	0	0	0	111.5	E554 M555 E561 S562	E554-D558 PolarHBondContact O-N 3.41Å; M555-D558 PolarHBondContact O-N 2.79Å; D558-E561 PolarHBondContact O-N 2.84Å; D558-S562 VanDerWaalsContact O-CB 3.23Å; D558-S562 WeakPolarHBondContact O-CB 3.31Å; D558-S562 PolarHBondContact O-N 3.05Å
559	Y	49.2	Very low	55.2	Low	68 Å²	68	83.8 Å²	83.8	27%	0.267	41%	0.411	S	S	.	.	H	α-helix	trans	-64.9	-40.3	170.5	-174.8	-118.7	0	0	0	111.4	M555 R557 S562 L563	M555-Y559 WeakPolarHBondContact O-CA 3.25Å; M555-Y559 WeakPolarHBondContact O-CB 3.42Å; M555-Y559 PolarHBondContact O-N 3.46Å; R557-Y559 VanDerWaalsContact C-N 3.34Å; Y559-S562 PolarHBondContact O-N 3.49Å; Y559-L563 HydrophobicContact CD1-CD1 3.88Å; Y559-L563 HydrophobicContact CD1-CG 4.44Å; Y559-L563 HydrophobicContact CE1-CD1 3.53Å; Y559-L563 HydrophobicContact CE1-CG 4.2Å; Y559-L563 HydrophobicContact CE2-CD1 4.46Å; Y559-L563 HydrophobicContact CE2-CD2 4.44Å; Y559-L563 HydrophobicContact CE2-CG 4.26Å; Y559-L563 HydrophobicContact CG-CD1 4.48Å; Y559-L563 WeakPolarHBondContact O-CB 3.19Å; Y559-L563 VanDerWaalsContact O-CG 3.31Å; Y559-L563 WeakPolarHBondContact O-CG 3.3Å; Y559-L563 PolarHBondContact O-N 3.49Å
560	R	48.8	Very low	55.6	Low	113 Å²	113	85.7 Å²	85.7	43%	0.426	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-45.2	173.2	-177	-179.2	-179.8	-74.8	12.2	111.8	E442 L556 R557 S562 L563 D564	E442-R560 IonicContact OE1-CZ 3.9Å; E442-R560 IonicContact OE1-NH2 3.58Å; E442-R560 PolarHBondContact OE1-NH2 3.49Å; E442-R560 IonicContact OE2-CZ 3.25Å; E442-R560 IonicContact OE2-NE 2.71Å; E442-R560 PolarHBondContact OE2-NE 2.95Å; E442-R560 IonicContact OE2-NH2 2.97Å; E442-R560 PolarHBondContact OE2-NH2 2.95Å; L556-R560 WeakPolarHBondContact O-CB 3.48Å; L556-R560 PolarHBondContact O-N 2.78Å; R557-R560 WeakPolarHBondContact O-CB 3.4Å; R557-R560 PolarHBondContact O-N 2.86Å; R560-S562 VanDerWaalsContact C-N 3.31Å; R560-S562 PolarHBondContact O-N 3.37Å; R560-L563 PolarHBondContact O-N 3.47Å; R560-D564 IonicContact NH1-OD2 2.85Å; R560-D564 WeakPolarHBondContact O-CB 3.49Å; R560-D564 PolarHBondContact O-N 2.81Å
561	E	65.5	Low	56.1	Low	77 Å²	77	84.5 Å²	84.5	36%	0.36	42%	0.416	S	S	.	.	H	α-helix	trans	-66	-33.8	174.5	-70.1	-168.1	-164.3	0	0	112.4	R557 D558 D564 R565	R557-E561 IonicContact NE-OE1 3.94Å; R557-E561 PolarHBondContact O-N 3.44Å; D558-E561 PolarHBondContact O-N 2.84Å; E561-D564 PolarHBondContact O-N 3.13Å; E561-R565 VanDerWaalsContact O-CG 3.32Å; E561-R565 WeakPolarHBondContact O-CG 3.23Å; E561-R565 PolarHBondContact O-N 3.38Å; E561-R565 PolarHBondContact O-NE 2.99Å; E561-R565 IonicContact OE2-NH1 2.92Å; E561-R565 PolarHBondContact OE2-NH1 3.37Å
562	S	61.5	Low	56.6	Low	52 Å²	52	86.8 Å²	86.8	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-67.6	-44.6	173.8	-161.3	0	0	0	0	111.6	D558 Y559 R560 D564 R565 V566	D558-S562 VanDerWaalsContact O-CB 3.23Å; D558-S562 WeakPolarHBondContact O-CB 3.31Å; D558-S562 PolarHBondContact O-N 3.05Å; Y559-S562 PolarHBondContact O-N 3.49Å; R560-S562 VanDerWaalsContact C-N 3.31Å; R560-S562 PolarHBondContact O-N 3.37Å; S562-D564 PolarHBondContact O-N 3.03Å; S562-R565 WeakPolarHBondContact O-CB 3.23Å; S562-R565 PolarHBondContact O-N 3.31Å; S562-V566 WeakPolarHBondContact O-CG2 3.3Å; S562-V566 PolarHBondContact O-N 2.63Å
563	L	53.1	Low	57.1	Low	70 Å²	70	89.7 Å²	89.7	37%	0.366	43%	0.434	S	S	.	.	H	α-helix	trans	-62.2	-39.7	173	-76.4	176.6	0	0	0	111.8	Y559 R560 V566 R567	Y559-L563 HydrophobicContact CD1-CD1 3.88Å; Y559-L563 HydrophobicContact CD1-CG 4.44Å; Y559-L563 HydrophobicContact CE1-CD1 3.53Å; Y559-L563 HydrophobicContact CE1-CG 4.2Å; Y559-L563 HydrophobicContact CE2-CD1 4.46Å; Y559-L563 HydrophobicContact CE2-CD2 4.44Å; Y559-L563 HydrophobicContact CE2-CG 4.26Å; Y559-L563 HydrophobicContact CG-CD1 4.48Å; Y559-L563 WeakPolarHBondContact O-CB 3.19Å; Y559-L563 VanDerWaalsContact O-CG 3.31Å; Y559-L563 WeakPolarHBondContact O-CG 3.3Å; Y559-L563 PolarHBondContact O-N 3.49Å; R560-L563 PolarHBondContact O-N 3.47Å; L563-V566 PolarHBondContact O-N 2.86Å; L563-R567 WeakPolarHBondContact O-CB 3.41Å; L563-R567 PolarHBondContact O-N 2.97Å
564	D	56.4	Low	57.2	Low	74 Å²	74	87.9 Å²	87.9	40%	0.396	43%	0.431	S	S	.	.	H	α-helix	trans	-66.6	-36.3	175.2	-79.4	-32.4	0	0	0	111.7	R560 E561 S562 A568	R560-D564 IonicContact NH1-OD2 2.85Å; R560-D564 WeakPolarHBondContact O-CB 3.49Å; R560-D564 PolarHBondContact O-N 2.81Å; E561-D564 PolarHBondContact O-N 3.13Å; S562-D564 PolarHBondContact O-N 3.03Å; D564-A568 WeakPolarHBondContact O-CB 3.27Å; D564-A568 PolarHBondContact O-N 2.99Å
565	R	67.4	Low	57.5	Low	105 Å²	105	87.6 Å²	87.6	40%	0.396	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-50.4	171.3	-74.6	179.8	-72.1	-99.7	2.9	112.1	E561 S562 R567 A568 D569	E561-R565 VanDerWaalsContact O-CG 3.32Å; E561-R565 WeakPolarHBondContact O-CG 3.23Å; E561-R565 PolarHBondContact O-N 3.38Å; E561-R565 PolarHBondContact O-NE 2.99Å; E561-R565 IonicContact OE2-NH1 2.92Å; E561-R565 PolarHBondContact OE2-NH1 3.37Å; S562-R565 WeakPolarHBondContact O-CB 3.23Å; S562-R565 PolarHBondContact O-N 3.31Å; R565-R567 VanDerWaalsContact C-N 3.29Å; R565-R567 PolarHBondContact O-N 3.16Å; R565-A568 WeakPolarHBondContact O-CB 3.24Å; R565-A568 PolarHBondContact O-N 3.31Å; R565-D569 PolarHBondContact O-N 3.48Å; R565-D569 VanDerWaalsContact O-N 3.09Å
566	V	62.3	Low	57.8	Low	73 Å²	73	86.6 Å²	86.6	44%	0.442	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-37.5	176.7	171.5	0	0	0	0	111.2	S562 L563 D569 L570	S562-V566 WeakPolarHBondContact O-CG2 3.3Å; S562-V566 PolarHBondContact O-N 2.63Å; L563-V566 PolarHBondContact O-N 2.86Å; V566-D569 PolarHBondContact O-N 2.77Å; V566-L570 HydrophobicContact CG1-CD1 3.94Å; V566-L570 HydrophobicContact CG1-CG 4.32Å; V566-L570 WeakPolarHBondContact O-CB 3.48Å; V566-L570 VanDerWaalsContact O-CG 3.32Å; V566-L570 WeakPolarHBondContact O-CG 3.09Å; V566-L570 PolarHBondContact O-N 3.14Å
567	R	53.9	Low	58.2	Low	114 Å²	114	88.2 Å²	88.2	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-66.6	-35.4	176	-176.6	177.9	-174.1	164.9	3.9	112.3	F303 L563 R565 V571	F303-R567 VanDerWaalsContact CD1-NH2 3.3Å; L563-R567 WeakPolarHBondContact O-CB 3.41Å; L563-R567 PolarHBondContact O-N 2.97Å; R565-R567 VanDerWaalsContact C-N 3.29Å; R565-R567 PolarHBondContact O-N 3.16Å; R567-V571 WeakPolarHBondContact O-CB 3.21Å; R567-V571 VanDerWaalsContact O-CG2 3.25Å; R567-V571 WeakPolarHBondContact O-CG2 3.24Å; R567-V571 PolarHBondContact O-N 3.35Å
568	A	62.1	Low	58.5	Low	51 Å²	51	85.6 Å²	85.6	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-42.2	173.5	0	0	0	0	0	111.9	D564 R565 V571 E572	D564-A568 WeakPolarHBondContact O-CB 3.27Å; D564-A568 PolarHBondContact O-N 2.99Å; R565-A568 WeakPolarHBondContact O-CB 3.24Å; R565-A568 PolarHBondContact O-N 3.31Å; A568-V571 VanDerWaalsContact O-CB 3.29Å; A568-V571 WeakPolarHBondContact O-CB 3.35Å; A568-V571 PolarHBondContact O-N 3.15Å; A568-E572 PolarHBondContact O-N 2.77Å
569	D	64.3	Low	58.6	Low	72 Å²	72	84.4 Å²	84.4	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-67.4	-41.1	176	171.8	65.7	0	0	0	112.5	R565 V566 V571 E572 K573	R565-D569 PolarHBondContact O-N 3.48Å; R565-D569 VanDerWaalsContact O-N 3.09Å; V566-D569 PolarHBondContact O-N 2.77Å; D569-V571 VanDerWaalsContact C-N 3.31Å; D569-V571 PolarHBondContact O-N 3.29Å; D569-E572 PolarHBondContact O-N 3.02Å; D569-K573 WeakPolarHBondContact O-CB 3.02Å; D569-K573 WeakPolarHBondContact O-CG 3.47Å; D569-K573 PolarHBondContact O-N 3.34Å; D569-K573 WeakPolarHBondContact OD1-CE 3.49Å; D569-K573 IonicContact OD1-NZ 3.48Å; D569-K573 PolarHBondContact OD1-NZ 2.93Å; D569-K573 WeakPolarHBondContact OD2-CE 3.38Å; D569-K573 IonicContact OD2-NZ 3.45Å; D569-K573 PolarHBondContact OD2-NZ 2.95Å
570	L	52.7	Low	58.8	Low	105 Å²	105	87.6 Å²	87.6	55%	0.55	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-37.8	169.9	-74.6	171.2	0	0	0	112.1	V566 A574	V566-L570 HydrophobicContact CG1-CD1 3.94Å; V566-L570 HydrophobicContact CG1-CG 4.32Å; V566-L570 WeakPolarHBondContact O-CB 3.48Å; V566-L570 VanDerWaalsContact O-CG 3.32Å; V566-L570 WeakPolarHBondContact O-CG 3.09Å; V566-L570 PolarHBondContact O-N 3.14Å; L570-A574 PolarHBondContact O-N 3.41Å
571	V	58.3	Low	59.1	Low	34 Å²	34	87.3 Å²	87.3	21%	0.206	44%	0.438	C	S	.	.	H	α-helix	trans	-60.4	-48.4	173.1	145.1	0	0	0	0	110.6	Y305 R567 A568 D569 H575	Y305-V571 HydrophobicContact CD1-CB 4.28Å; Y305-V571 HydrophobicContact CD1-CG1 3.66Å; Y305-V571 HydrophobicContact CD1-CG2 4.08Å; Y305-V571 HydrophobicContact CD2-CG2 3.87Å; Y305-V571 HydrophobicContact CE1-CB 3.99Å; Y305-V571 HydrophobicContact CE1-CG1 3.63Å; Y305-V571 HydrophobicContact CE1-CG2 4.06Å; Y305-V571 WeakPolarHBondContact CE1-O 3.23Å; Y305-V571 HydrophobicContact CE2-CG2 3.87Å; Y305-V571 HydrophobicContact CG-CG1 4.31Å; Y305-V571 HydrophobicContact CG-CG2 3.96Å; Y305-V571 VanDerWaalsContact CZ-O 3.23Å; Y305-V571 WeakPolarHBondContact OH-CA 3.31Å; Y305-V571 PolarHBondContact OH-O 2.59Å; R567-V571 WeakPolarHBondContact O-CB 3.21Å; R567-V571 VanDerWaalsContact O-CG2 3.25Å; R567-V571 WeakPolarHBondContact O-CG2 3.24Å; R567-V571 PolarHBondContact O-N 3.35Å; A568-V571 VanDerWaalsContact O-CB 3.29Å; A568-V571 WeakPolarHBondContact O-CB 3.35Å; A568-V571 PolarHBondContact O-N 3.15Å; D569-V571 VanDerWaalsContact C-N 3.31Å; D569-V571 PolarHBondContact O-N 3.29Å; V571-H575 WeakPolarHBondContact O-CB 3.49Å; V571-H575 PolarHBondContact O-N 3.46Å
572	E	63.9	Low	58.7	Low	121 Å²	121	87.8 Å²	87.8	57%	0.565	44%	0.44	S	S	*	.	H	α-helix	trans	-65.6	-44.5	178.5	-167.1	168.2	157.4	0	0	111.7	A568 D569 H575 Q576	A568-E572 PolarHBondContact O-N 2.77Å; D569-E572 PolarHBondContact O-N 3.02Å; E572-H575 WeakPolarHBondContact O-CB 3.32Å; E572-H575 PolarHBondContact O-N 3.22Å; E572-H575 VanDerWaalsContact O-N 3.17Å; E572-Q576 PolarHBondContact O-N 3.41Å
573	K	58.2	Low	58.5	Low	105 Å²	105	90 Å²	90	46%	0.457	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-44.7	178.1	-76.3	166.8	178.4	163.3	0	113.1	D569 H575 Q576 L577	D569-K573 WeakPolarHBondContact O-CB 3.02Å; D569-K573 WeakPolarHBondContact O-CG 3.47Å; D569-K573 PolarHBondContact O-N 3.34Å; D569-K573 WeakPolarHBondContact OD1-CE 3.49Å; D569-K573 IonicContact OD1-NZ 3.48Å; D569-K573 PolarHBondContact OD1-NZ 2.93Å; D569-K573 WeakPolarHBondContact OD2-CE 3.38Å; D569-K573 IonicContact OD2-NZ 3.45Å; D569-K573 PolarHBondContact OD2-NZ 2.95Å; K573-H575 VanDerWaalsContact C-N 3.3Å; K573-H575 PolarHBondContact O-N 2.94Å; K573-Q576 PolarHBondContact O-N 3.47Å; K573-L577 WeakPolarHBondContact O-CG 3.39Å; K573-L577 PolarHBondContact O-N 3.47Å
574	A	51.4	Low	58.4	Low	44 Å²	44	94.5 Å²	94.5	36%	0.364	46%	0.46	S	S	.	.	H	α-helix	trans	-75.4	-18	177	0	0	0	0	0	113.1	Y305 L570 H578	Y305-A574 WeakPolarHBondContact OH-CB 3.46Å; L570-A574 PolarHBondContact O-N 3.41Å; A574-H578 WeakPolarHBondContact O-CB 3.34Å; A574-H578 PolarHBondContact O-N 2.85Å
575	H	62.2	Low	58.1	Low	105 Å²	105	94.7 Å²	94.7	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-69.7	-44.6	165	-170.2	33.9	0	0	0	111.3	Y305 V571 E572 K573 L577 H578 I579	Y305-H575 HydrophobicContact CE1-CB 4.21Å; Y305-H575 PolarHBondContact OH-N 2.75Å; V571-H575 WeakPolarHBondContact O-CB 3.49Å; V571-H575 PolarHBondContact O-N 3.46Å; E572-H575 WeakPolarHBondContact O-CB 3.32Å; E572-H575 PolarHBondContact O-N 3.22Å; E572-H575 VanDerWaalsContact O-N 3.17Å; K573-H575 VanDerWaalsContact C-N 3.3Å; K573-H575 PolarHBondContact O-N 2.94Å; H575-L577 VanDerWaalsContact C-N 3.33Å; H575-L577 PolarHBondContact O-N 3.26Å; H575-H578 PolarHBondContact O-N 3.36Å; H575-I579 WeakPolarHBondContact O-CG1 3.48Å; H575-I579 PolarHBondContact O-N 3Å
576	Q	59.1	Low	57.5	Low	95 Å²	95	96.4 Å²	96.4	44%	0.444	47%	0.468	S	S	.	.	H	α-helix	trans	-62.7	-38.1	173.7	-67.6	-172.7	17.9	0	0	112.3	E572 K573 I579 K580	E572-Q576 PolarHBondContact O-N 3.41Å; K573-Q576 PolarHBondContact O-N 3.47Å; Q576-I579 PolarHBondContact O-N 2.85Å; Q576-K580 WeakPolarHBondContact O-CB 3.41Å; Q576-K580 WeakPolarHBondContact O-CG 3.34Å; Q576-K580 PolarHBondContact O-N 2.74Å
577	L	55.3	Low	56.9	Low	114 Å²	114	96.5 Å²	96.5	60%	0.597	47%	0.468	S	S	*	.	H	α-helix	trans	-63.5	-44.1	173.2	-72.1	170.4	0	0	0	111.5	K573 H575 I579 K580 E581	K573-L577 WeakPolarHBondContact O-CG 3.39Å; K573-L577 PolarHBondContact O-N 3.47Å; H575-L577 VanDerWaalsContact C-N 3.33Å; H575-L577 PolarHBondContact O-N 3.26Å; L577-I579 VanDerWaalsContact C-N 3.34Å; L577-I579 PolarHBondContact O-N 2.84Å; L577-K580 CarbonylContact O-C 3.58Å; L577-K580 PolarHBondContact O-N 3.15Å; L577-K580 VanDerWaalsContact O-N 3.16Å; L577-E581 WeakPolarHBondContact O-CB 3.33Å; L577-E581 PolarHBondContact O-N 2.92Å
578	H	58.5	Low	56.5	Low	106 Å²	106	92.9 Å²	92.9	49%	0.491	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-37	177	-169.6	50.5	0	0	0	112.6	A574 H575 E581 E582	A574-H578 WeakPolarHBondContact O-CB 3.34Å; A574-H578 PolarHBondContact O-N 2.85Å; H575-H578 PolarHBondContact O-N 3.36Å; H578-E581 IonicContact ND1-OE2 2.67Å; H578-E581 PolarHBondContact ND1-OE2 2.7Å; H578-E581 PolarHBondContact O-N 3.09Å; H578-E582 WeakPolarHBondContact O-CB 3.06Å; H578-E582 PolarHBondContact O-N 3.19Å
579	I	65.7	Low	55.6	Low	74 Å²	74	95.3 Å²	95.3	38%	0.379	47%	0.469	S	S	.	.	H	α-helix	trans	-64.9	-40.1	172.4	-67.7	165.5	0	0	0	111.2	H575 Q576 L577 E582 L583	H575-I579 WeakPolarHBondContact O-CG1 3.48Å; H575-I579 PolarHBondContact O-N 3Å; Q576-I579 PolarHBondContact O-N 2.85Å; L577-I579 VanDerWaalsContact C-N 3.34Å; L577-I579 PolarHBondContact O-N 2.84Å; I579-E582 PolarHBondContact O-N 3.04Å; I579-L583 HydrophobicContact CG2-CD1 4.16Å; I579-L583 WeakPolarHBondContact O-CB 3.48Å; I579-L583 WeakPolarHBondContact O-CG 3.22Å; I579-L583 PolarHBondContact O-N 3.08Å
580	K	54	Low	55.1	Low	135 Å²	135	95 Å²	95	59%	0.587	47%	0.469	S	S	*	.	H	α-helix	trans	-67.3	-37.3	174.9	-76	177.6	177.5	-178.4	0	112.6	Q576 L577 Y584	Q576-K580 WeakPolarHBondContact O-CB 3.41Å; Q576-K580 WeakPolarHBondContact O-CG 3.34Å; Q576-K580 PolarHBondContact O-N 2.74Å; L577-K580 CarbonylContact O-C 3.58Å; L577-K580 PolarHBondContact O-N 3.15Å; L577-K580 VanDerWaalsContact O-N 3.16Å; K580-Y584 VanDerWaalsContact O-CB 3.31Å; K580-Y584 WeakPolarHBondContact O-CB 3.49Å; K580-Y584 PolarHBondContact O-N 3.06Å
581	E	54.3	Low	54.6	Low	108 Å²	108	95 Å²	95	51%	0.505	47%	0.468	S	S	.	.	H	α-helix	trans	-67.5	-42.7	174.7	-177.9	-177.4	-142.5	0	0	111	L577 H578 Y584 N585	L577-E581 WeakPolarHBondContact O-CB 3.33Å; L577-E581 PolarHBondContact O-N 2.92Å; H578-E581 IonicContact ND1-OE2 2.67Å; H578-E581 PolarHBondContact ND1-OE2 2.7Å; H578-E581 PolarHBondContact O-N 3.09Å; E581-Y584 PolarHBondContact O-N 2.96Å; E581-N585 WeakPolarHBondContact O-CB 3.48Å; E581-N585 PolarHBondContact O-N 3.16Å; E581-N585 PolarHBondContact O-ND2 3.29Å
582	E	57.8	Low	53.8	Low	87 Å²	87	95 Å²	95	41%	0.407	48%	0.476	S	S	.	.	H	α-helix	trans	-65.9	-39	174.8	-160.2	-171.6	178.9	0	0	111.7	H578 I579 R586	H578-E582 WeakPolarHBondContact O-CB 3.06Å; H578-E582 PolarHBondContact O-N 3.19Å; I579-E582 PolarHBondContact O-N 3.04Å; E582-R586 VanDerWaalsContact CD-NH2 3.3Å; E582-R586 WeakPolarHBondContact O-CB 3.39Å; E582-R586 VanDerWaalsContact O-CG 3.23Å; E582-R586 WeakPolarHBondContact O-CG 3.03Å; E582-R586 PolarHBondContact O-N 2.68Å; E582-R586 IonicContact OE1-CZ 3.5Å; E582-R586 IonicContact OE1-NE 2.66Å; E582-R586 PolarHBondContact OE1-NE 2.87Å; E582-R586 IonicContact OE1-NH2 2.69Å; E582-R586 PolarHBondContact OE1-NH2 3.31Å; E582-R586 IonicContact OE2-NH2 2.77Å
583	L	57.6	Low	52.9	Low	99 Å²	99	95.5 Å²	95.5	52%	0.518	48%	0.478	S	S	.	.	H	α-helix	trans	-62.8	-46.4	170.5	-80.6	165	0	0	0	111.9	I579 N585 R586 V587	I579-L583 HydrophobicContact CG2-CD1 4.16Å; I579-L583 WeakPolarHBondContact O-CB 3.48Å; I579-L583 WeakPolarHBondContact O-CG 3.22Å; I579-L583 PolarHBondContact O-N 3.08Å; L583-N585 PolarHBondContact O-N 3.48Å; L583-R586 PolarHBondContact O-N 2.92Å; L583-V587 WeakPolarHBondContact O-CB 3.39Å; L583-V587 VanDerWaalsContact O-CG2 3.28Å; L583-V587 WeakPolarHBondContact O-CG2 3.25Å; L583-V587 PolarHBondContact O-N 3.15Å
584	Y	50.9	Low	52.3	Low	164 Å²	164	96.5 Å²	96.5	64%	0.643	48%	0.484	S	S	*	.	H	α-helix	trans	-61.1	-43.8	178.3	-174.3	-93	0	0	0	111.5	K580 E581 V587 A588	K580-Y584 VanDerWaalsContact O-CB 3.31Å; K580-Y584 WeakPolarHBondContact O-CB 3.49Å; K580-Y584 PolarHBondContact O-N 3.06Å; E581-Y584 PolarHBondContact O-N 2.96Å; Y584-V587 PolarHBondContact O-N 3.44Å; Y584-A588 WeakPolarHBondContact O-CB 3.08Å; Y584-A588 PolarHBondContact O-N 3.05Å
585	N	49.2	Very low	51.9	Low	78 Å²	78	102 Å²	102	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-65.7	-43.3	177	-69.3	-26.9	0	0	0	111.7	E581 L583 V587 A588 D589	E581-N585 WeakPolarHBondContact O-CB 3.48Å; E581-N585 PolarHBondContact O-N 3.16Å; E581-N585 PolarHBondContact O-ND2 3.29Å; L583-N585 PolarHBondContact O-N 3.48Å; N585-V587 VanDerWaalsContact C-N 3.3Å; N585-V587 PolarHBondContact O-N 2.97Å; N585-A588 PolarHBondContact O-N 2.9Å; N585-D589 WeakPolarHBondContact O-CB 3.32Å; N585-D589 PolarHBondContact O-N 2.87Å
586	R	54.9	Low	50.7	Low	141 Å²	141	103.5 Å²	103.5	53%	0.532	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-34.3	173.8	-70.6	172.4	-172	-165	8.1	112.9	E582 L583 T590	E582-R586 VanDerWaalsContact CD-NH2 3.3Å; E582-R586 WeakPolarHBondContact O-CB 3.39Å; E582-R586 VanDerWaalsContact O-CG 3.23Å; E582-R586 WeakPolarHBondContact O-CG 3.03Å; E582-R586 PolarHBondContact O-N 2.68Å; E582-R586 IonicContact OE1-CZ 3.5Å; E582-R586 IonicContact OE1-NE 2.66Å; E582-R586 PolarHBondContact OE1-NE 2.87Å; E582-R586 IonicContact OE1-NH2 2.69Å; E582-R586 PolarHBondContact OE1-NH2 3.31Å; E582-R586 IonicContact OE2-NH2 2.77Å; L583-R586 PolarHBondContact O-N 2.92Å; R586-T590 WeakPolarHBondContact O-CB 3.4Å; R586-T590 WeakPolarHBondContact O-CG2 3.47Å; R586-T590 PolarHBondContact O-N 3.4Å; R586-T590 PolarHBondContact O-OG1 3.47Å
587	V	51.2	Low	49.8	Very low	74 Å²	74	105.5 Å²	105.5	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-72	-39	174.5	168.5	0	0	0	0	110.9	L583 Y584 N585 T590 M591	L583-V587 WeakPolarHBondContact O-CB 3.39Å; L583-V587 VanDerWaalsContact O-CG2 3.28Å; L583-V587 WeakPolarHBondContact O-CG2 3.25Å; L583-V587 PolarHBondContact O-N 3.15Å; Y584-V587 PolarHBondContact O-N 3.44Å; N585-V587 VanDerWaalsContact C-N 3.3Å; N585-V587 PolarHBondContact O-N 2.97Å; V587-T590 WeakPolarHBondContact CA-OG1 3.46Å; V587-T590 PolarHBondContact O-OG1 2.94Å; V587-M591 HydrophobicContact CG1-CE 3.93Å; V587-M591 HydrophobicContact CG1-SD 4.45Å; V587-M591 WeakPolarHBondContact O-CB 3.19Å; V587-M591 VanDerWaalsContact O-CG 3.29Å; V587-M591 WeakPolarHBondContact O-CG 3.19Å; V587-M591 PolarHBondContact O-N 3.22Å
588	A	44.3	Very low	49.2	Very low	39 Å²	39	105.2 Å²	105.2	32%	0.322	52%	0.515	S	S	.	.	H	α-helix	trans	-65.7	-42.8	172.8	0	0	0	0	0	112.2	Y584 N585 M591 G592	Y584-A588 WeakPolarHBondContact O-CB 3.08Å; Y584-A588 PolarHBondContact O-N 3.05Å; N585-A588 PolarHBondContact O-N 2.9Å; A588-M591 PolarHBondContact O-N 3.01Å; A588-G592 PolarHBondContact O-N 3.44Å
589	D	44.9	Very low	48.2	Very low	101 Å²	101	103 Å²	103	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-63.2	-44.5	175.5	-75.6	-29.7	0	0	0	111.4	N585 G592 Q593	N585-D589 WeakPolarHBondContact O-CB 3.32Å; N585-D589 PolarHBondContact O-N 2.87Å; D589-G592 PolarHBondContact O-N 3.46Å; D589-Q593 WeakPolarHBondContact O-CB 3.49Å; D589-Q593 VanDerWaalsContact O-CG 3.28Å; D589-Q593 WeakPolarHBondContact O-CG 3.29Å; D589-Q593 PolarHBondContact O-N 3.17Å
590	T	53.2	Low	47	Very low	65 Å²	65	103.3 Å²	103.3	40%	0.399	52%	0.52	S	S	.	.	H	α-helix	trans	-70.5	-34.1	176.9	46.1	0	0	0	0	112.6	R586 V587 H594	R586-T590 WeakPolarHBondContact O-CB 3.4Å; R586-T590 WeakPolarHBondContact O-CG2 3.47Å; R586-T590 PolarHBondContact O-N 3.4Å; R586-T590 PolarHBondContact O-OG1 3.47Å; V587-T590 WeakPolarHBondContact CA-OG1 3.46Å; V587-T590 PolarHBondContact O-OG1 2.94Å; T590-H594 PolarHBondContact O-N 3.25Å; T590-H594 PolarHBondContact O-ND1 3.25Å
591	M	42.2	Very low	46.4	Very low	105 Å²	105	100.6 Å²	100.6	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-39.7	169.3	-74.1	-171.8	-56.8	0	0	111.8	V587 A588 H594 F595	V587-M591 HydrophobicContact CG1-CE 3.93Å; V587-M591 HydrophobicContact CG1-SD 4.45Å; V587-M591 WeakPolarHBondContact O-CB 3.19Å; V587-M591 VanDerWaalsContact O-CG 3.29Å; V587-M591 WeakPolarHBondContact O-CG 3.19Å; V587-M591 PolarHBondContact O-N 3.22Å; A588-M591 PolarHBondContact O-N 3.01Å; M591-H594 PolarHBondContact O-N 2.96Å; M591-F595 WeakPolarHBondContact O-CB 3.5Å; M591-F595 PolarHBondContact O-N 3.45Å
592	G	40.9	Very low	45.7	Very low	36 Å²	36	98.3 Å²	98.3	37%	0.371	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-39.9	174.9	0	0	0	0	0	112.8	A588 D589 F595 M596	A588-G592 PolarHBondContact O-N 3.44Å; D589-G592 PolarHBondContact O-N 3.46Å; G592-F595 PolarHBondContact O-N 3.38Å; G592-M596 WeakPolarHBondContact O-CG 3.34Å; G592-M596 PolarHBondContact O-N 2.84Å
593	Q	45.5	Very low	44.7	Very low	131 Å²	131	97.1 Å²	97.1	61%	0.612	52%	0.516	S	S	*	.	H	α-helix	trans	-66	-42.7	173.2	-73.4	172.7	19.9	0	0	111.8	D589 M596 F597	D589-Q593 WeakPolarHBondContact O-CB 3.49Å; D589-Q593 VanDerWaalsContact O-CG 3.28Å; D589-Q593 WeakPolarHBondContact O-CG 3.29Å; D589-Q593 PolarHBondContact O-N 3.17Å; Q593-M596 PolarHBondContact O-N 3.2Å; Q593-F597 WeakPolarHBondContact O-CB 3.36Å; Q593-F597 PolarHBondContact O-N 2.67Å
594	H	45.5	Very low	43.6	Very low	126 Å²	126	98.2 Å²	98.2	58%	0.583	52%	0.522	S	S	*	.	H	α-helix	trans	-66.2	-37.4	173.8	-76	94.5	0	0	0	112.4	T590 M591 F597 L598	T590-H594 PolarHBondContact O-N 3.25Å; T590-H594 PolarHBondContact O-ND1 3.25Å; M591-H594 PolarHBondContact O-N 2.96Å; H594-F597 PolarHBondContact O-N 2.77Å; H594-L598 WeakPolarHBondContact O-CB 3.43Å; H594-L598 VanDerWaalsContact O-CG 3.32Å; H594-L598 WeakPolarHBondContact O-CG 3.41Å; H594-L598 PolarHBondContact O-N 2.69Å
595	F	42.6	Very low	43	Very low	158 Å²	158	98 Å²	98	69%	0.693	53%	0.527	S	S	*	.	H	α-helix	trans	-65.4	-39.2	173	-104	-85	0	0	0	112.3	M591 G592 A599	M591-F595 WeakPolarHBondContact O-CB 3.5Å; M591-F595 PolarHBondContact O-N 3.45Å; G592-F595 PolarHBondContact O-N 3.38Å; F595-A599 WeakPolarHBondContact O-CB 3.34Å; F595-A599 PolarHBondContact O-N 2.9Å
596	M	37	Very low	42.1	Very low	137 Å²	137	103 Å²	103	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-66.3	-40.9	171.8	-74.7	-124.5	-67.4	0	0	112.1	G592 Q593 A599 V600	G592-M596 WeakPolarHBondContact O-CG 3.34Å; G592-M596 PolarHBondContact O-N 2.84Å; Q593-M596 PolarHBondContact O-N 3.2Å; M596-A599 PolarHBondContact O-N 3.49Å; M596-V600 WeakPolarHBondContact O-CB 3.48Å; M596-V600 VanDerWaalsContact O-CG2 3.28Å; M596-V600 WeakPolarHBondContact O-CG2 3.08Å; M596-V600 PolarHBondContact O-N 3.48Å
597	F	40.2	Very low	40.9	Very low	138 Å²	138	105.7 Å²	105.7	61%	0.605	56%	0.561	S	S	*	*	H	α-helix	trans	-66	-42.4	178.3	-159.5	-104.1	0	0	0	111.6	Q593 H594 V600 L601	Q593-F597 WeakPolarHBondContact O-CB 3.36Å; Q593-F597 PolarHBondContact O-N 2.67Å; H594-F597 PolarHBondContact O-N 2.77Å; F597-V600 PolarHBondContact O-N 3.47Å; F597-L601 HydrophobicContact CD1-CD1 3.72Å; F597-L601 HydrophobicContact CD1-CG 4.38Å; F597-L601 HydrophobicContact CE1-CD1 3.73Å; F597-L601 HydrophobicContact CE1-CG 4.37Å; F597-L601 WeakPolarHBondContact O-CB 3.39Å; F597-L601 VanDerWaalsContact O-CG 3.31Å; F597-L601 WeakPolarHBondContact O-CG 3.5Å; F597-L601 PolarHBondContact O-N 3.44Å
598	L	43.5	Very low	39.9	Very low	108 Å²	108	110 Å²	110	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-65.8	-38.5	172.4	-73.6	168.4	0	0	0	112.3	H594 L601 A602	H594-L598 WeakPolarHBondContact O-CB 3.43Å; H594-L598 VanDerWaalsContact O-CG 3.32Å; H594-L598 WeakPolarHBondContact O-CG 3.41Å; H594-L598 PolarHBondContact O-N 2.69Å; L598-L601 PolarHBondContact O-N 3.2Å; L598-A602 VanDerWaalsContact O-CB 3.23Å; L598-A602 WeakPolarHBondContact O-CB 3.42Å; L598-A602 PolarHBondContact O-N 3.38Å
599	A	37.4	Very low	39.3	Very low	59 Å²	59	112.9 Å²	112.9	49%	0.488	60%	0.597	S	S	.	*	H	α-helix	trans	-66.7	-37.2	174.9	0	0	0	0	0	112.3	F595 M596 A603	F595-A599 WeakPolarHBondContact O-CB 3.34Å; F595-A599 PolarHBondContact O-N 2.9Å; M596-A599 PolarHBondContact O-N 3.49Å; A599-A603 WeakPolarHBondContact O-CB 3.4Å; A599-A603 PolarHBondContact O-N 3.02Å
600	V	41	Very low	38.6	Very low	80 Å²	80	114.2 Å²	114.2	49%	0.485	61%	0.608	S	S	.	*	H	α-helix	trans	-70.2	-41.2	174.5	168.7	0	0	0	0	111.3	M596 F597 A603 N604	M596-V600 WeakPolarHBondContact O-CB 3.48Å; M596-V600 VanDerWaalsContact O-CG2 3.28Å; M596-V600 WeakPolarHBondContact O-CG2 3.08Å; M596-V600 PolarHBondContact O-N 3.48Å; F597-V600 PolarHBondContact O-N 3.47Å; V600-A603 PolarHBondContact O-N 2.79Å; V600-N604 VanDerWaalsContact O-CB 3.3Å; V600-N604 WeakPolarHBondContact O-CB 3.37Å; V600-N604 PolarHBondContact O-N 2.83Å; V600-N604 PolarHBondContact O-ND2 3Å
601	L	39.8	Very low	37.5	Very low	79 Å²	79	118.5 Å²	118.5	41%	0.414	62%	0.624	S	S	.	*	H	α-helix	trans	-63.5	-43.3	173	-73.4	170.6	0	0	0	111.9	F597 L598 N604 H605	F597-L601 HydrophobicContact CD1-CD1 3.72Å; F597-L601 HydrophobicContact CD1-CG 4.38Å; F597-L601 HydrophobicContact CE1-CD1 3.73Å; F597-L601 HydrophobicContact CE1-CG 4.37Å; F597-L601 WeakPolarHBondContact O-CB 3.39Å; F597-L601 VanDerWaalsContact O-CG 3.31Å; F597-L601 WeakPolarHBondContact O-CG 3.5Å; F597-L601 PolarHBondContact O-N 3.44Å; L598-L601 PolarHBondContact O-N 3.2Å; L601-N604 PolarHBondContact O-N 3.16Å; L601-H605 PolarHBondContact O-N 3.14Å
602	A	39.9	Very low	36.8	Very low	60 Å²	60	122 Å²	122	50%	0.496	64%	0.636	S	S	.	*	H	α-helix	trans	-65.5	-37.3	175.7	0	0	0	0	0	112.6	L598	L598-A602 VanDerWaalsContact O-CB 3.23Å; L598-A602 WeakPolarHBondContact O-CB 3.42Å; L598-A602 PolarHBondContact O-N 3.38Å
603	A	36.2	Very low	36.3	Very low	62 Å²	62	127.1 Å²	127.1	51%	0.512	65%	0.653	S	S	.	*	H	α-helix	trans	-69.8	-34.7	174.9	0	0	0	0	0	112.8	A599 V600	A599-A603 WeakPolarHBondContact O-CB 3.4Å; A599-A603 PolarHBondContact O-N 3.02Å; V600-A603 PolarHBondContact O-N 2.79Å
604	N	36.3	Very low	35.5	Very low	122 Å²	122	128.9 Å²	128.9	65%	0.652	66%	0.662	S	S	*	*	H	α-helix	trans	-80.1	-20.2	178.9	-71.1	-15.3	0	0	0	113.2	V600 L601 F606	V600-N604 VanDerWaalsContact O-CB 3.3Å; V600-N604 WeakPolarHBondContact O-CB 3.37Å; V600-N604 PolarHBondContact O-N 2.83Å; V600-N604 PolarHBondContact O-ND2 3Å; L601-N604 PolarHBondContact O-N 3.16Å; N604-F606 VanDerWaalsContact C-N 3.27Å; N604-F606 PolarHBondContact O-N 2.95Å
605	H	37.3	Very low	34.8	Very low	158 Å²	158	128.9 Å²	128.9	73%	0.731	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-3.2	172.1	-97.5	-72.4	0	0	0	114.8	L601	L601-H605 PolarHBondContact O-N 3.14Å
606	F	29.5	Very low	34.3	Very low	185 Å²	185	126 Å²	126	81%	0.811	68%	0.677	S	S	*	*	S	Bend	trans	-121.4	60.8	-179.7	-89.2	-81	0	0	0	112.9	N604	N604-F606 VanDerWaalsContact C-N 3.27Å; N604-F606 PolarHBondContact O-N 2.95Å
607	K	29.9	Very low	33.7	Very low	197 Å²	197	126.7 Å²	126.7	86%	0.857	68%	0.678	S	S	*	*			trans	-157.9	78.6	169.4	-120.6	171.8	-172.5	178.1	0	114.5
608	D	30.8	Very low	33.3	Very low	165 Å²	165	126.3 Å²	126.3	88%	0.882	69%	0.689	S	S	*	*			trans	-142.5	134.5	149.9	-131.1	-19.8	0	0	0	109.2
609	P	31.1	Very low	32.4	Very low	99 Å²	99	129.1 Å²	129.1	64%	0.643	70%	0.697	S	S	*	*			trans	-111.9	174.3	-166.4	40.2	-33	0	0	0	115.8
610	T	30	Very low	31.9	Very low	128 Å²	128	131.9 Å²	131.9	79%	0.785	71%	0.71	S	S	*	*			trans	81.9	142.4	171	79.6	0	0	0	0	115.9
611	H	31.1	Very low	31.2	Very low	156 Å²	156	133.8 Å²	133.8	72%	0.722	72%	0.724	S	S	*	*			cis	-157.7	147.1	-8.5	-133.7	-57.6	0	0	0	112.6
612	K	27.7	Very low	30.5	Very low	177 Å²	177	134.7 Å²	134.7	77%	0.77	74%	0.735	S	S	*	*			trans	70.9	150.5	165.8	-50.2	168.5	-174.6	170.5	0	113.9
613	I	31	Very low	29.9	Very low	144 Å²	144	138.3 Å²	138.3	74%	0.738	75%	0.753	S	S	*	*			cis	-127.7	159.6	10.6	-92.2	99.4	0	0	0	111.9
614	Q	27.2	Very low	29.5	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	77%	0.768	S	S	*	*			trans	-11.2	143.4	160.5	-48.5	160	3	0	0	117.8
615	T	31.5	Very low	29	Very low	127 Å²	127	150 Å²	150	78%	0.779	78%	0.78	S	S	*	*				-163.8	160.9	55	41.1	0	0	0	0	113.7
616	A	32.1	Very low	28.2	Very low	98 Å²	98	153.7 Å²	153.7	81%	0.81	79%	0.788	S	S	*	*			trans	55	145.3	156.5	0	0	0	0	0	121.9
617	Q	24.6	Very low	28.4	Very low	150 Å²	150	149.8 Å²	149.8	70%	0.701	78%	0.781	S	S	*	*			trans	-132.9	167.1	171	-64.4	-150.6	-41.7	0	0	110.9	K619	Q617-K619 VanDerWaalsContact OE1-CG 3.28Å
618	P	31	Very low	28.1	Very low	130 Å²	130	149.2 Å²	149.2	84%	0.844	78%	0.779	S	S	*	*				-129.3	151.2	115.7	36.7	-31.4	0	0	0	113.8
619	K	23.8	Very low	27.8	Very low	167 Å²	167	146.2 Å²	146.2	73%	0.726	77%	0.767	S	S	*	*			trans	-105.1	144.4	179.8	-60.8	174.4	-177	170.9	0	111.8	Q617	Q617-K619 VanDerWaalsContact OE1-CG 3.28Å
620	P	27.2	Very low	27.5	Very low	118 Å²	118	152.1 Å²	152.1	77%	0.766	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-93.3	157.9	137	31.9	-28.8	0	0	0	111.3
621	P	27.8	Very low	27.2	Very low	120 Å²	120	150.4 Å²	150.4	78%	0.779	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-92.3	159.8	-158.6	35.1	-37.4	0	0	0	116
622	P	25.4	Very low	27	Very low	98 Å²	98	149.9 Å²	149.9	64%	0.636	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-87.3	142.8	177.1	34.4	-34.3	0	0	0	113.4	R624	P622-R624 PolarHBondContact O-N 3.34Å
623	P	27.3	Very low	26.7	Very low	136 Å²	136	151.6 Å²	151.6	88%	0.883	78%	0.778	S	S	*	*			trans	-76.6	104.5	169.7	30.7	-32.5	0	0	0	110.9
624	R	26.4	Very low	26.6	Very low	221 Å²	221	154.5 Å²	154.5	83%	0.834	79%	0.785	S	S	*	*			trans	-96.7	122.8	171.7	-75.3	-174.1	173.6	-169.9	-0.9	111.4	P622	P622-R624 PolarHBondContact O-N 3.34Å
625	K	26.2	Very low	26.4	Very low	207 Å²	207	157.1 Å²	157.1	90%	0.9	79%	0.788	S	S	*	*			trans	45.7	141.2	149.7	-60.6	-171.3	176.5	-173.9	0	120.5
626	R	21.4	Very low	26.2	Very low	236 Å²	236	163.4 Å²	163.4	89%	0.891	80%	0.798	S	S	*	*			trans	-61.6	179.7	165.9	-40.7	176.1	173.9	179.3	-3.6	111.3
627	P	33.7	Very low	25.9	Very low	104 Å²	104	162 Å²	162	68%	0.675	79%	0.793	S	S	*	*			cis	-144.8	-172.9	5.1	34	-9.6	0	0	0	117.9
628	F	22.8	Very low	26.1	Very low	184 Å²	184	160.8 Å²	160.8	81%	0.807	80%	0.795	S	S	*	*			trans	96.1	146.5	136.3	-111.6	-69	0	0	0	122.9
629	V	23.5	Very low	26.1	Very low	103 Å²	103	162.3 Å²	162.3	62%	0.624	80%	0.797	S	S	*	*			trans	70.4	121.9	159.7	-103	0	0	0	0	124.3
630	R	26	Very low	26.4	Very low	222 Å²	222	158 Å²	158	84%	0.838	80%	0.8	S	S	*	*			trans	62.2	116.1	132.6	-85.2	171.5	-176.3	155.8	1.8	122.1
631	S	23	Very low	26.5	Very low	92 Å²	92	160.1 Å²	160.1	64%	0.643	81%	0.805	S	S	*	*				33.5	144.5	113.3	69.2	0	0	0	0	119.7
632	I	27.8	Very low	26.9	Very low	145 Å²	145	159.6 Å²	159.6	74%	0.744	80%	0.801	S	S	*	*				-157.3	136.2	78.5	-89.9	158.8	0	0	0	112.3	K634	I632-K634 HydrophobicContact CG2-CB 4.32Å; I632-K634 VanDerWaalsContact CG2-N 3.34Å
633	F	21.4	Very low	27	Very low	214 Å²	214	160.5 Å²	160.5	94%	0.939	81%	0.809	S	S	*	*			trans	-94.9	104.1	152.8	-118.1	-71.7	0	0	0	108.1
634	K	27.4	Very low	27.1	Very low	204 Å²	204	158.3 Å²	158.3	89%	0.887	80%	0.797	S	S	*	*			trans	-162.9	150	149	-115.9	165.2	-172.9	174.8	0	111.9	I632	I632-K634 HydrophobicContact CG2-CB 4.32Å; I632-K634 VanDerWaalsContact CG2-N 3.34Å
635	R	23.2	Very low	27.1	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	79%	0.793	S	S	*	*			trans	-126.3	121.4	-164.8	168.5	-162.7	-170.8	-179.4	5.5	106.5
636	W	28	Very low	27.3	Very low	260 Å²	260	151.9 Å²	151.9	99%	0.985	79%	0.787	S	S	*	*			trans	178.2	150.2	148.4	-86.7	-3.8	0	0	0	107.6
637	G	26.1	Very low	27.7	Very low	68 Å²	68	146.2 Å²	146.2	70%	0.701	78%	0.775	S	S	*	*			trans	-164.3	163.3	172.1	0	0	0	0	0	109.6
638	T	29.8	Very low	27.3	Very low	124 Å²	124	147.1 Å²	147.1	76%	0.761	77%	0.774	S	S	*	*			trans	-160.3	128.9	161.3	25.6	0	0	0	0	109.9
639	N	29.6	Very low	27.4	Very low	162 Å²	162	148.2 Å²	148.2	87%	0.866	77%	0.774	S	S	*	*			trans	57.4	120	138.2	-48.2	-11.7	0	0	0	119.7
640	G	30	Very low	27.7	Very low	78 Å²	78	148.9 Å²	148.9	80%	0.804	78%	0.778	S	S	*	*			trans	172.2	65.6	170.1	0	0	0	0	0	115.8
641	N	29.5	Very low	28	Very low	161 Å²	161	144.4 Å²	144.4	86%	0.861	77%	0.771	S	S	*	*			trans	-75.7	172.3	166.4	-73	-10.4	0	0	0	110.3
642	P	36.1	Very low	28.2	Very low	109 Å²	109	144.6 Å²	144.6	71%	0.708	77%	0.772	S	S	*	*			cis	-144	-173.1	17	45.3	-26.6	0	0	0	117.3
643	C	28.7	Very low	28.4	Very low	117 Å²	117	141.1 Å²	141.1	79%	0.791	77%	0.765	S	S	*	*			trans	67.9	160	152.4	-72.4	0	0	0	0	119.9
644	S	28	Very low	28.8	Very low	90 Å²	90	141.1 Å²	141.1	63%	0.629	76%	0.761	S	S	*	*				179.4	132.2	-50.5	45.9	0	0	0	0	109.2
645	T	26.1	Very low	28.9	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	75%	0.746	S	S	*	*			trans	41.5	113.2	152.9	55	0	0	0	0	120.4
646	H	30.9	Very low	29.1	Very low	171 Å²	171	129.4 Å²	129.4	79%	0.792	74%	0.738	S	S	*	*				176.1	121.8	126.4	-105.1	-100	0	0	0	106.8
647	N	29.4	Very low	29.3	Very low	118 Å²	118	122.5 Å²	122.5	63%	0.631	73%	0.725	S	S	*	*				63.7	106	86.4	-79.4	67.6	0	0	0	115.4
648	D	26.1	Very low	29.6	Very low	123 Å²	123	125.1 Å²	125.1	66%	0.658	72%	0.723	S	S	*	*				80.3	124.3	121.1	-61.4	-20.6	0	0	0	123.7
649	Y	25.8	Very low	29.5	Very low	207 Å²	207	124.8 Å²	124.8	81%	0.812	72%	0.717	S	S	*	*				90.5	143.2	128.3	-91.8	-130.7	0	0	0	121.3
650	V	29.3	Very low	29.5	Very low	117 Å²	117	125.6 Å²	125.6	71%	0.709	71%	0.713	S	S	*	*			trans	71	126.7	147.5	162	0	0	0	0	116
651	N	32.6	Very low	29.5	Very low	128 Å²	128	129 Å²	129	68%	0.684	71%	0.708	S	S	*	*			cis	-136.2	156.8	5.6	-106	-25.9	0	0	0	108.5
652	S	27.5	Very low	29.6	Very low	96 Å²	96	125.9 Å²	125.9	67%	0.671	69%	0.694	S	S	*	*				62.4	143	54.2	115.8	0	0	0	0	113.3
653	A	30	Very low	29.3	Very low	72 Å²	72	129.3 Å²	129.3	60%	0.595	70%	0.698	S	S	*	*			cis	-148.9	176.5	-14.6	0	0	0	0	0	107
654	Y	31.7	Very low	29.5	Very low	214 Å²	214	128.4 Å²	128.4	84%	0.839	69%	0.685	S	S	*	*				166.9	155.1	84.3	-93.5	-95.4	0	0	0	106
655	S	29.2	Very low	29.6	Very low	83 Å²	83	133.4 Å²	133.4	58%	0.58	69%	0.69	S	S	*	*			cis	-178.5	155.2	-19.2	51.2	0	0	0	0	110.8
656	S	27.1	Very low	29.8	Very low	97 Å²	97	135.8 Å²	135.8	68%	0.678	69%	0.69	S	S	*	*			trans	44.4	137.5	142.2	64.8	0	0	0	0	120.5
657	T	32.6	Very low	29.8	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	69%	0.691	S	S	*	*				-167.6	159.3	70	36.5	0	0	0	0	110.5
658	N	30.6	Very low	29.6	Very low	123 Å²	123	136.6 Å²	136.6	66%	0.658	69%	0.691	S	S	*	*			cis	-154.2	150.2	8.6	-115.4	-22.5	0	0	0	111.4
659	N	29.2	Very low	30	Very low	116 Å²	116	137.9 Å²	137.9	62%	0.62	70%	0.697	S	S	*	*			trans	27	145.1	142.1	-50.4	-28.5	0	0	0	120.8
660	F	29.5	Very low	30.4	Very low	179 Å²	179	134.3 Å²	134.3	79%	0.785	69%	0.692	S	S	*	*			cis	-126.5	150.1	36	-89.1	-115.1	0	0	0	111.8
661	Q	28.7	Very low	30.6	Very low	151 Å²	151	133.2 Å²	133.2	71%	0.706	69%	0.69	S	S	*	*				60	139.1	69.6	-75.5	-163.7	30.6	0	0	113.3
662	V	31.9	Very low	30.8	Very low	94 Å²	94	131.5 Å²	131.5	57%	0.57	69%	0.687	S	S	*	*			cis	-164.9	148.9	16.3	96.8	0	0	0	0	113.7
663	K	30.5	Very low	30.8	Very low	182 Å²	182	135.4 Å²	135.4	79%	0.791	70%	0.695	S	S	*	*			trans	59.9	171.9	157.3	-61.7	170.1	-162.1	166.7	0	117.7
664	D	31.8	Very low	30.8	Very low	98 Å²	98	136.2 Å²	136.2	52%	0.524	70%	0.696	S	S	.	*			cis	-152.4	166.1	-12.3	-136.9	-18.8	0	0	0	112.1
665	R	31	Very low	30.8	Very low	195 Å²	195	132 Å²	132	74%	0.736	69%	0.692	S	S	*	*			trans	70.7	134.8	152.9	-71	155.7	-148	-136.9	0.3	118.3
666	K	30.7	Very low	30.8	Very low	171 Å²	171	132.3 Å²	132.3	74%	0.743	69%	0.694	S	S	*	*				68	133.8	56.5	-66.1	171.9	-175.1	169	0	111.1
667	R	30.3	Very low	30.8	Very low	215 Å²	215	134.3 Å²	134.3	81%	0.811	70%	0.697	S	S	*	*			cis	-160.5	137.9	13.7	-116.1	170.7	178.6	169.2	-4.9	107.4
668	S	26	Very low	30.7	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	71%	0.706	S	S	*	*				64.7	164.1	92.4	84.2	0	0	0	0	116.6
669	I	34.3	Very low	30.6	Very low	150 Å²	150	141.9 Å²	141.9	77%	0.769	72%	0.716	S	S	*	*			trans	87	123.5	-178.8	-56.3	161.8	0	0	0	111.6
670	N	33.4	Very low	31	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	72%	0.715	S	S	*	*			cis	-145.2	142.6	-7.7	-116.8	8.4	0	0	0	109.4
671	S	34.4	Very low	31	Very low	95 Å²	95	140.1 Å²	140.1	66%	0.664	71%	0.714	S	S	*	*				62.9	143.7	101.9	95.2	0	0	0	0	114.9
672	S	35.2	Very low	30.8	Very low	91 Å²	91	139.3 Å²	139.3	64%	0.636	71%	0.714	S	S	*	*			cis	-151.4	150.3	11.3	-16.5	0	0	0	0	107.9
673	Q	29.4	Very low	30.5	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	72%	0.723	S	S	*	*				47.7	139.5	86.6	-67.6	-175.6	-19.4	0	0	114.5
674	C	28.9	Very low	30.2	Very low	90 Å²	90	138.1 Å²	138.1	61%	0.608	72%	0.717	S	S	*	*			cis	-165.2	169	8.2	-126.2	0	0	0	0	112
675	T	32	Very low	30.1	Very low	126 Å²	126	140.2 Å²	140.2	77%	0.773	73%	0.728	S	S	*	*			trans	53.8	160.6	145.8	53.1	0	0	0	0	121.7
676	S	28.7	Very low	30.1	Very low	88 Å²	88	135.7 Å²	135.7	62%	0.615	72%	0.722	S	S	*	*			cis	-172.8	161.3	-34.9	57.9	0	0	0	0	107.8
677	N	27.6	Very low	30.1	Very low	139 Å²	139	134 Å²	134	74%	0.743	72%	0.721	S	S	*	*			trans	38.6	117.4	152	-54.9	-12	0	0	0	119.9
678	N	31.5	Very low	30.3	Very low	166 Å²	166	130.4 Å²	130.4	89%	0.888	72%	0.718	S	S	*	*				-166.8	143.2	105.9	-92.7	-23	0	0	0	114
679	R	26.5	Very low	30.5	Very low	233 Å²	233	130.3 Å²	130.3	88%	0.879	72%	0.718	S	S	*	*			trans	-108.3	-173	157.2	-71.4	-178.6	170.2	-177.1	-2.3	106.7
680	P	39.4	Very low	30.5	Very low	93 Å²	93	128.2 Å²	128.2	60%	0.604	72%	0.716	S	S	*	*			cis	-128	-166.8	-23.8	17.1	9	0	0	0	111.2
681	H	28.8	Very low	30.5	Very low	165 Å²	165	128.2 Å²	128.2	76%	0.764	72%	0.716	S	S	*	*			trans	66.4	162.5	151.8	-66.1	-42	0	0	0	117.8
682	L	24.6	Very low	30.4	Very low	133 Å²	133	130.6 Å²	130.6	70%	0.696	72%	0.721	S	S	*	*			cis	-169.3	162.8	-41.2	-121.1	177.7	0	0	0	105
683	N	25.2	Very low	30.1	Very low	141 Å²	141	132.7 Å²	132.7	75%	0.754	73%	0.725	S	S	*	*			trans	63.3	165	164	-76.5	4	0	0	0	117
684	V	25.4	Very low	30	Very low	111 Å²	111	130.4 Å²	130.4	67%	0.673	72%	0.718	S	S	*	*			cis	-163.3	141.9	-45	118.1	0	0	0	0	105
685	N	29.3	Very low	29.8	Very low	142 Å²	142	131 Å²	131	76%	0.759	72%	0.724	S	S	*	*			trans	159.2	145.9	154.9	-90.8	-4.5	0	0	0	110.9
686	T	29.5	Very low	29.4	Very low	100 Å²	100	133.8 Å²	133.8	61%	0.613	73%	0.725	S	S	*	*			cis	-166.6	172.6	-24.7	9.3	0	0	0	0	107.5
687	N	32.2	Very low	29.4	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	74%	0.738	S	S	*	*			trans	76.7	130.3	168.5	-50.3	-21.3	0	0	0	114.8
688	N	32.9	Very low	29.3	Very low	139 Å²	139	136 Å²	136	74%	0.743	74%	0.739	S	S	*	*			cis	-152.5	157	-0.8	-113.7	-6.9	0	0	0	113.1
689	S	31.6	Very low	29	Very low	90 Å²	90	136.3 Å²	136.3	63%	0.629	74%	0.735	S	S	*	*			trans	11	137.8	153.9	58.8	0	0	0	0	119.1
690	S	35	Very low	29	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	73%	0.726	S	S	*	*			cis	-154.9	137.1	32.8	23.3	0	0	0	0	110.6
691	D	32.2	Very low	28.5	Very low	131 Å²	131	134.9 Å²	134.9	70%	0.701	74%	0.738	S	S	*	*				71.9	139.5	74.2	-56.9	-50	0	0	0	113.1
692	L	32	Very low	28.4	Very low	146 Å²	146	131.9 Å²	131.9	76%	0.764	74%	0.735	S	S	*	*			cis	-163.1	166.5	-7.5	-107.3	171	0	0	0	106.2
693	N	30	Very low	28.6	Very low	134 Å²	134	132.9 Å²	132.9	72%	0.717	74%	0.74	S	S	*	*			cis	-148	-172.4	3.7	-167.1	9.7	0	0	0	109.7
694	N	26.9	Very low	28.6	Very low	131 Å²	131	129.7 Å²	129.7	70%	0.701	73%	0.729	S	S	*	*			trans	-111.6	152.4	-176.3	-65.9	-72.9	0	0	0	115.6
695	S	24.7	Very low	28.8	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	73%	0.729	S	S	*	*			trans	65.5	158.4	132.6	69.3	0	0	0	0	123.8
696	F	23.7	Very low	28.8	Very low	184 Å²	184	131.1 Å²	131.1	81%	0.807	72%	0.719	S	S	*	*			trans	67.9	103.5	161.9	-83.5	-79.4	0	0	0	119.8
697	C	28.1	Very low	28.6	Very low	132 Å²	132	130 Å²	130	89%	0.892	71%	0.713	S	S	*	*				-163.6	163.9	122.7	-95.9	0	0	0	0	109.9
698	D	25	Very low	28.3	Very low	143 Å²	143	127.5 Å²	127.5	77%	0.765	71%	0.706	S	S	*	*			trans	-97.7	169.2	-168.3	-73.1	-73	0	0	0	115.3
699	E	25.4	Very low	28.2	Very low	172 Å²	172	125.7 Å²	125.7	80%	0.804	70%	0.704	S	S	*	*			trans	71.3	134.1	147.8	-85.6	-176.2	175.5	0	0	123.8
700	T	28	Very low	28.2	Very low	110 Å²	110	133.1 Å²	133.1	68%	0.675	72%	0.718	S	S	*	*			trans	77.2	112.5	152.1	57.8	0	0	0	0	122.8
701	Q	28.7	Very low	28.1	Very low	186 Å²	186	134.5 Å²	134.5	87%	0.869	72%	0.722	S	S	*	*			trans	72.2	143.1	142	-58.9	-179.5	45.1	0	0	118
702	S	25.9	Very low	28	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	72%	0.721	S	S	*	*			cis	-148.9	145.6	11	59.1	0	0	0	0	114.6
703	I	28.2	Very low	28	Very low	154 Å²	154	129.6 Å²	129.6	79%	0.79	72%	0.72	S	S	*	*			trans	44.9	101.1	147.3	-54.5	175.7	0	0	0	119.2
704	S	26.5	Very low	28.2	Very low	75 Å²	75	128.7 Å²	128.7	52%	0.524	72%	0.724	S	S	.	*			trans	19.9	121.7	146.1	68.8	0	0	0	0	118.7
705	R	29.5	Very low	28.6	Very low	176 Å²	176	131.4 Å²	131.4	66%	0.664	73%	0.732	S	S	*	*			cis	-161.1	168.4	46.9	-75.7	-162.5	136	88.3	12.2	112.1
706	D	27.9	Very low	28.9	Very low	106 Å²	106	130.7 Å²	130.7	57%	0.567	74%	0.741	S	S	*	*			cis	-163.4	-164.7	-25.3	-83.5	-18.7	0	0	0	103.1
707	T	27.2	Very low	29.1	Very low	77 Å²	77	125.2 Å²	125.2	47%	0.472	74%	0.736	S	S	.	*			cis	-151.6	173.2	6.7	73.4	0	0	0	0	110.2
708	S	25.4	Very low	29.3	Very low	83 Å²	83	126.9 Å²	126.9	58%	0.58	74%	0.735	S	S	*	*			trans	75.4	99.7	152.5	74.1	0	0	0	0	122.6
709	S	31	Very low	29.5	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	73%	0.733	S	S	*	*				36.3	132.3	123	62.2	0	0	0	0	124.4
710	R	30.8	Very low	29.5	Very low	245 Å²	245	125.4 Å²	125.4	93%	0.925	74%	0.737	S	S	*	*			trans	-170.9	161.3	152.5	-106.2	159.8	-176.7	166.5	1.1	109.9
711	V	32.1	Very low	29.5	Very low	135 Å²	135	128 Å²	128	82%	0.818	75%	0.745	S	S	*	*			cis	-110.3	-111.7	-8.2	-166.1	0	0	0	0	109.7
712	G	30.3	Very low	29.3	Very low	67 Å²	67	124 Å²	124	69%	0.691	74%	0.738	S	S	*	*			cis	157.4	149.4	-12.3	0	0	0	0	0	112.5
713	C	32.8	Very low	29.6	Very low	108 Å²	108	125.1 Å²	125.1	73%	0.73	74%	0.743	S	S	*	*			cis	-151	130.4	-14.3	-80.3	0	0	0	0	112.9
714	S	33.3	Very low	29.7	Very low	114 Å²	114	123.3 Å²	123.3	80%	0.797	74%	0.741	S	S	*	*			trans	68.9	150.7	141.8	83.4	0	0	0	0	120.5
715	Q	35.7	Very low	29.7	Very low	189 Å²	189	125.5 Å²	125.5	88%	0.883	75%	0.751	S	S	*	*			cis	-144.5	154.8	-0.6	-70.1	-171.3	-11.8	0	0	112.4
716	G	30.5	Very low	29.5	Very low	86 Å²	86	124.4 Å²	124.4	89%	0.887	76%	0.759	S	S	*	*			trans	78.1	128.7	149.6	0	0	0	0	0	120.2
717	G	29.8	Very low	29.3	Very low	69 Å²	69	128.9 Å²	128.9	71%	0.711	78%	0.779	S	S	*	*			cis	179.1	136.8	-11.6	0	0	0	0	0	115.9
718	I	30.4	Very low	29.1	Very low	168 Å²	168	133.9 Å²	133.9	86%	0.862	79%	0.794	S	S	*	*			trans	60.1	126.8	137	-55	172.4	0	0	0	119.8
719	P	30.9	Very low	29.1	Very low	114 Å²	114	137.4 Å²	137.4	74%	0.74	80%	0.801	S	S	*	*			cis	-139.5	-174.2	-27.8	39.7	-19.6	0	0	0	114.1
720	L	24.9	Very low	28.7	Very low	169 Å²	169	138.7 Å²	138.7	89%	0.885	80%	0.804	S	S	*	*			trans	-106.8	152.1	168.4	-70.1	126.3	0	0	0	111.5
721	I	28.5	Very low	28.2	Very low	165 Å²	165	132.7 Å²	132.7	85%	0.846	79%	0.794	S	S	*	*			trans	-133	119.2	153.1	-60.8	-175.6	0	0	0	112
722	S	23.9	Very low	27.8	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	79%	0.79	S	S	*	*			trans	-126.4	-179.8	141.1	-58.8	0	0	0	0	104.2
723	P	31.5	Very low	27.4	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	79%	0.789	S	S	*	*			cis	-144.3	-118.2	27.3	35.7	-6.1	0	0	0	113.6
724	P	31.7	Very low	27	Very low	117 Å²	117	137.7 Å²	137.7	76%	0.76	79%	0.792	S	S	*	*			trans	-134.8	-128	-138.7	42.9	-16.7	0	0	0	114.6
725	T	25.4	Very low	26.5	Very low	120 Å²	120	136.1 Å²	136.1	74%	0.736	78%	0.781	S	S	*	*			trans	-84.3	169.4	-170.8	45.7	0	0	0	0	116.2
726	D	25	Very low	26	Very low	154 Å²	154	133.7 Å²	133.7	82%	0.824	77%	0.774	S	S	*	*			trans	76	103.6	164.2	-68.3	-11.8	0	0	0	120.2
727	M	23.3	Very low	25.8	Very low	199 Å²	199	139 Å²	139	98%	0.98	77%	0.768	S	S	*	*			trans	-146.9	162	137.9	-81.7	-151.3	179.5	0	0	110.5
728	K	24	Very low	25.6	Very low	182 Å²	182	143.7 Å²	143.7	79%	0.791	77%	0.769	S	S	*	*			trans	-129.2	155.8	175.1	-62.8	-178.1	178.2	177.4	0	111.8
729	H	24.7	Very low	25.3	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.727	76%	0.755	S	S	*	*			trans	77.8	118.1	156.5	-60.9	-65	0	0	0	120.8
730	V	22.4	Very low	25.1	Very low	129 Å²	129	138.6 Å²	138.6	78%	0.782	76%	0.76	S	S	*	*				72.2	134	128.6	173.8	0	0	0	0	116.2
731	V	21.4	Very low	25.2	Very low	118 Å²	118	139 Å²	139	72%	0.715	76%	0.757	S	S	*	*			cis	-137.5	-178.5	35.8	-167.3	0	0	0	0	112
732	H	23.9	Very low	25	Very low	157 Å²	157	134.4 Å²	134.4	73%	0.727	75%	0.75	S	S	*	*			trans	76	121.9	174.7	-72.8	-82	0	0	0	115.9
733	V	21.8	Very low	25	Very low	111 Å²	111	137.7 Å²	137.7	67%	0.673	76%	0.759	S	S	*	*			cis	70.9	84	9.5	-161.3	0	0	0	0	115.8
734	D	24.5	Very low	24.7	Very low	147 Å²	147	136.3 Å²	136.3	79%	0.786	75%	0.751	S	S	*	*			trans	-135.8	146.6	132.1	-76.4	-39.8	0	0	0	104.9
735	S	23.3	Very low	24.4	Very low	81 Å²	81	138.4 Å²	138.4	57%	0.566	75%	0.751	S	S	*	*			cis	50.9	90.6	7	60.4	0	0	0	0	114
736	D	24.3	Very low	24.3	Very low	138 Å²	138	137 Å²	137	74%	0.738	75%	0.746	S	S	*	*			cis	-160.9	171.7	41.7	-121.8	-38.5	0	0	0	117
737	W	25.6	Very low	24.3	Very low	199 Å²	199	133.1 Å²	133.1	75%	0.754	73%	0.728	S	S	*	*			trans	58.2	106.1	159.9	-62	7	0	0	0	119.6
738	F	27	Very low	24.4	Very low	167 Å²	167	131.6 Å²	131.6	73%	0.732	72%	0.72	S	S	*	*				-136.6	94.9	104.3	-132.7	-94.8	0	0	0	111.2
739	T	24.2	Very low	24.4	Very low	94 Å²	94	134.7 Å²	134.7	58%	0.577	73%	0.727	S	S	*	*			trans	-76	137.2	175.1	46.3	0	0	0	0	111.3
740	G	26.1	Very low	24.4	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	72%	0.719	S	S	*	*			trans	-149.8	63.8	174.2	0	0	0	0	0	111.2
741	Q	27.3	Very low	24.6	Very low	177 Å²	177	135.7 Å²	135.7	83%	0.827	72%	0.724	S	S	*	*			trans	-87	150.1	179.8	-79.8	-170.9	-41.7	0	0	112.7
742	G	24.1	Very low	25	Very low	69 Å²	69	136.1 Å²	136.1	71%	0.711	73%	0.729	S	S	*	*			trans	140.4	115.8	172.1	0	0	0	0	0	111
743	L	24.4	Very low	25.2	Very low	171 Å²	171	133.7 Å²	133.7	90%	0.895	73%	0.73	S	S	*	*	S	Bend	cis	-146	128.9	2.4	-77.1	156.7	0	0	0	109.3
744	C	25.4	Very low	25.5	Very low	94 Å²	94	133.3 Å²	133.3	64%	0.635	74%	0.738	S	S	*	*			trans	167.1	82.7	148	-92.2	0	0	0	0	110.7
745	E	24.4	Very low	25.7	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	74%	0.735	S	S	*	*			trans	-137.6	92.8	166.7	-166.2	167.1	-140.1	0	0	108.6
746	S	22.7	Very low	25.7	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	75%	0.754	S	S	*	*			trans	-151.2	37.9	-173.7	-59.2	0	0	0	0	113.2
747	T	24.6	Very low	25.8	Very low	73 Å²	73	139 Å²	139	45%	0.448	75%	0.747	S	S	.	*	S	Bend	trans	-160.8	165.6	156.3	-7.5	0	0	0	0	111	L556	L556-T747 HydrophobicContact CD2-CG2 3.88Å; L556-T747 HydrophobicContact CG-CG2 4.2Å
748	M	26.9	Very low	25.8	Very low	168 Å²	168	135.5 Å²	135.5	83%	0.828	75%	0.753	S	S	*	*			trans	73.3	56.1	175.9	-57.4	-64.3	-75.5	0	0	117.4
749	R	23.9	Very low	25.7	Very low	246 Å²	246	132 Å²	132	93%	0.928	75%	0.75	S	S	*	*			trans	-124.3	74.9	146.1	-80.9	-163	-177.5	-176.1	4.9	112
750	L	24	Very low	25.9	Very low	108 Å²	108	132.9 Å²	132.9	57%	0.565	76%	0.76	S	S	*	*			trans	-133.8	104.9	156.2	-82.9	-177.1	0	0	0	108.8
751	F	27.7	Very low	26	Very low	200 Å²	200	135.6 Å²	135.6	88%	0.877	76%	0.76	S	S	*	*			trans	179.4	102.9	147.2	-88.8	-53.1	0	0	0	109.4
752	P	29.5	Very low	25.9	Very low	127 Å²	127	131 Å²	131	83%	0.825	76%	0.76	S	S	*	*			trans	-73	151.7	170.5	30.8	-33.5	0	0	0	111.3
753	S	26.8	Very low	26	Very low	106 Å²	106	133 Å²	133	74%	0.741	76%	0.763	S	S	*	*			trans	-94.2	145.6	-162.7	-36.5	0	0	0	0	115.6
754	A	28.1	Very low	26.1	Very low	102 Å²	102	132.5 Å²	132.5	84%	0.843	76%	0.761	S	S	*	*			trans	-131.5	94.6	148.8	0	0	0	0	0	108
755	K	28.4	Very low	26.3	Very low	166 Å²	166	135.4 Å²	135.4	72%	0.722	77%	0.771	S	S	*	*				54.1	86	77.4	-68.5	-171	174.7	178.5	0	113.8	T757	K755-T757 HydrophobicContact CB-CG2 4.15Å; K755-T757 HydrophobicContact CD-CG2 4.12Å; K755-T757 HydrophobicContact CG-CG2 4.12Å
756	F	24	Very low	26.5	Very low	222 Å²	222	134.4 Å²	134.4	97%	0.974	77%	0.771	S	S	*	*			trans	-85.3	111.1	133.3	-105.5	-86.1	0	0	0	107.5
757	T	25.9	Very low	26.8	Very low	97 Å²	97	138 Å²	138	60%	0.595	78%	0.775	S	S	*	*			trans	-111.9	99.6	173.9	45.7	0	0	0	0	110.3	K755 S759	K755-T757 HydrophobicContact CB-CG2 4.15Å; K755-T757 HydrophobicContact CD-CG2 4.12Å; K755-T757 HydrophobicContact CG-CG2 4.12Å; T757-S759 PolarHBondContact O-N 2.96Å
758	S	25.6	Very low	26.8	Very low	126 Å²	126	144 Å²	144	88%	0.881	79%	0.791	S	S	*	*			trans	-76.4	96.6	151.4	52	0	0	0	0	107.5
759	S	26.6	Very low	26.7	Very low	93 Å²	93	146.1 Å²	146.1	65%	0.65	79%	0.789	S	S	*	*			trans	-95	113.5	-167.3	55.4	0	0	0	0	113.8	T757	T757-S759 PolarHBondContact O-N 2.96Å
760	S	28	Very low	26.8	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	78%	0.777	S	S	*	*			trans	-150.6	81.4	154.7	56.3	0	0	0	0	107
761	V	27.3	Very low	26.9	Very low	138 Å²	138	142.9 Å²	142.9	84%	0.836	79%	0.788	S	S	*	*				59	114.5	68.7	-173	0	0	0	0	111
762	G	26.4	Very low	26.7	Very low	81 Å²	81	138 Å²	138	84%	0.835	78%	0.779	S	S	*	*			trans	177.7	69	-176	0	0	0	0	0	111.3
763	S	25.3	Very low	26.5	Very low	109 Å²	109	138 Å²	138	76%	0.762	78%	0.781	S	S	*	*			trans	-137.4	124.1	164.1	-176.3	0	0	0	0	108
764	N	26.6	Very low	26.3	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	78%	0.78	S	S	*	*			trans	-146.5	110.8	176	-99.9	-7.8	0	0	0	107
765	N	29	Very low	26.3	Very low	156 Å²	156	140.3 Å²	140.3	83%	0.834	78%	0.781	S	S	*	*			trans	-123.9	143.5	160.6	-77.1	9.3	0	0	0	107
766	D	30	Very low	26.1	Very low	140 Å²	140	136.8 Å²	136.8	75%	0.749	78%	0.777	S	S	*	*			cis	-168.1	173.8	-25.7	-158.6	-14.5	0	0	0	105.8
767	K	27.2	Very low	26.1	Very low	165 Å²	165	136.9 Å²	136.9	72%	0.717	77%	0.772	S	S	*	*			trans	170.5	120.1	139.5	-98	165.8	-177.6	174.1	0	114.6
768	Y	24.5	Very low	26.1	Very low	200 Å²	200	137.2 Å²	137.2	78%	0.784	78%	0.779	S	S	*	*			trans	65.6	140.6	151	-58.6	-52.3	0	0	0	117.2
769	R	25.8	Very low	26.4	Very low	211 Å²	211	137 Å²	137	80%	0.796	77%	0.774	S	S	*	*			cis	-156.3	154	15.3	-134	176.3	-174.6	166.6	0.5	111.2
770	N	26.2	Very low	26.7	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	78%	0.783	S	S	*	*			trans	66.1	115.4	152.9	-68	3.2	0	0	0	122.7
771	M	25.1	Very low	26.6	Very low	160 Å²	160	142.6 Å²	142.6	79%	0.788	78%	0.781	S	S	*	*				65.3	99.8	122.4	-57.3	-173	78.7	0	0	121.3
772	S	23.7	Very low	26.4	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	78%	0.776	S	S	*	*				11.4	125.9	117.9	59.7	0	0	0	0	119.7
773	S	25.4	Very low	26.5	Very low	126 Å²	126	146.1 Å²	146.1	88%	0.881	76%	0.764	S	S	*	*				175.2	162.4	105	48.8	0	0	0	0	111
774	G	23.5	Very low	26.4	Very low	70 Å²	70	148.3 Å²	148.3	72%	0.722	76%	0.761	S	S	*	*			trans	-102	123.1	-170.5	0	0	0	0	0	114.9
775	H	27.8	Very low	26.4	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.866	76%	0.755	S	S	*	*			trans	-142.9	141.9	156.9	-87.4	22.6	0	0	0	106.2
776	C	23.7	Very low	26.3	Very low	92 Å²	92	144.5 Å²	144.5	62%	0.622	74%	0.744	S	S	*	*			cis	-157.6	172	-6.7	-110.2	0	0	0	0	110
777	Y	24.3	Very low	26.1	Very low	224 Å²	224	142.9 Å²	142.9	88%	0.878	74%	0.74	S	S	*	*			trans	64.6	101.8	167.8	-67.4	-68.9	0	0	0	120.4
778	S	26.8	Very low	26	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	74%	0.744	S	S	*	*			trans	-79.6	-176.6	136.6	67.7	0	0	0	0	109.4
779	P	31.1	Very low	26.4	Very low	121 Å²	121	139 Å²	139	79%	0.786	74%	0.739	S	S	*	*			cis	-132.8	-176.9	3.2	41.6	-23.9	0	0	0	115.1
780	Q	33	Very low	26.5	Very low	179 Å²	179	136.2 Å²	136.2	84%	0.836	74%	0.74	S	S	*	*			trans	-83.4	146.4	170.7	-64	-179.2	-19.5	0	0	112.4
781	I	26.2	Very low	26.7	Very low	146 Å²	146	134.7 Å²	134.7	75%	0.749	74%	0.739	S	S	*	*				167.4	145.6	114.4	-88	169.4	0	0	0	111.8
782	R	22.9	Very low	26.9	Very low	196 Å²	196	134 Å²	134	74%	0.74	74%	0.739	S	S	*	*			trans	80.4	169.8	168.7	-82.8	166.5	-168.6	-163.4	1.6	118.9
783	T	27.6	Very low	27.1	Very low	96 Å²	96	136.8 Å²	136.8	59%	0.589	74%	0.743	S	S	*	*			trans	-156.6	166.2	-137.9	43	0	0	0	0	113.3
784	F	23.4	Very low	27.3	Very low	155 Å²	155	135.6 Å²	135.6	68%	0.68	73%	0.731	S	S	*	*			trans	75.4	128.2	176.7	-63.6	-87.2	0	0	0	116.3
785	V	26.8	Very low	27.5	Very low	123 Å²	123	137.2 Å²	137.2	75%	0.745	72%	0.723	S	S	*	*			cis	103.9	117.5	4.8	-179	0	0	0	0	117.1
786	N	27.3	Very low	27.6	Very low	114 Å²	114	136.5 Å²	136.5	61%	0.61	72%	0.717	S	S	*	*			trans	-166	164.5	145.6	-161.9	9.3	0	0	0	112.9
787	T	25.5	Very low	28	Very low	107 Å²	107	137.4 Å²	137.4	66%	0.656	73%	0.725	S	S	*	*			trans	83.2	136.1	156.1	72.9	0	0	0	0	121.7
788	K	26	Very low	28.1	Very low	185 Å²	185	134 Å²	134	80%	0.804	72%	0.722	S	S	*	*			cis	-159.1	174.8	-11.7	-123.4	179.5	179.8	-175.6	0	113.4
789	S	31.4	Very low	28.6	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	72%	0.716	S	S	*	*			trans	63.2	148	172	66.1	0	0	0	0	118.8
790	D	28.2	Very low	28.5	Very low	154 Å²	154	136.6 Å²	136.6	82%	0.824	72%	0.717	S	S	*	*			cis	-163.6	146.9	-27.6	-90.4	-35.8	0	0	0	104.5
791	S	30.7	Very low	28.1	Very low	93 Å²	93	133 Å²	133	65%	0.65	71%	0.712	S	S	*	*			cis	-173.5	164	43.2	46.7	0	0	0	0	110.5
792	N	29.1	Very low	28.5	Very low	146 Å²	146	131.6 Å²	131.6	78%	0.781	71%	0.712	S	S	*	*			trans	55.6	136.2	154.1	-61.2	-16.2	0	0	0	120.5
793	M	27.3	Very low	28.5	Very low	156 Å²	156	132.9 Å²	132.9	77%	0.768	72%	0.716	S	S	*	*			cis	-161.2	143.1	-1.7	-134.7	177.7	167	0	0	111.5
794	T	29.9	Very low	28.3	Very low	102 Å²	102	134.3 Å²	134.3	63%	0.626	72%	0.719	S	S	*	*			trans	36.3	140.9	143.7	53.5	0	0	0	0	122.1
795	D	28.8	Very low	28.5	Very low	104 Å²	104	137.3 Å²	137.3	56%	0.556	73%	0.728	S	S	*	*			cis	-168.3	162.9	3.7	-122	-27.3	0	0	0	113.6
796	K	30.1	Very low	28.4	Very low	171 Å²	171	135.8 Å²	135.8	74%	0.743	72%	0.723	S	S	*	*			trans	32.5	144.9	143.6	-65	151.7	-164.5	149.2	0	121.7
797	S	30.7	Very low	28.3	Very low	112 Å²	112	136 Å²	136	78%	0.783	73%	0.733	S	S	*	*			cis	-170.3	150.9	-3	48.1	0	0	0	0	114.8
798	N	26.6	Very low	28.4	Very low	152 Å²	152	134.5 Å²	134.5	81%	0.813	74%	0.738	S	S	*	*			trans	-31.4	172.6	153.1	-92.5	-21.3	0	0	0	118.5
799	P	38.2	Very low	28.6	Very low	94 Å²	94	133.5 Å²	133.5	61%	0.61	74%	0.742	S	S	*	*			cis	-151.1	-165.9	-31.1	43.4	-23.9	0	0	0	116.3
800	K	28.7	Very low	28.4	Very low	187 Å²	187	135.4 Å²	135.4	81%	0.813	75%	0.745	S	S	*	*			trans	78.1	94.3	150.6	-71.4	172.2	-173.7	178.6	0	122.4
801	S	24.8	Very low	28.4	Very low	104 Å²	104	136 Å²	136	73%	0.727	75%	0.746	S	S	*	*				7	160.5	114.2	68.5	0	0	0	0	121.8
802	P	33.4	Very low	28.2	Very low	115 Å²	115	137 Å²	137	75%	0.747	75%	0.749	S	S	*	*				-140.7	-173.6	-63.2	39.4	-19.9	0	0	0	114.6
803	R	24.1	Very low	28	Very low	223 Å²	223	136.9 Å²	136.9	84%	0.842	75%	0.748	S	S	*	*			trans	93	131.5	147.6	-109.6	-173.5	-165.6	-169.6	4.9	122.4
804	I	24	Very low	28.1	Very low	126 Å²	126	136 Å²	136	65%	0.646	75%	0.746	S	S	*	*			trans	78.5	109.3	153.2	-43.1	148.2	0	0	0	118.8
805	Y	26.7	Very low	27.9	Very low	219 Å²	219	141.2 Å²	141.2	86%	0.859	75%	0.754	S	S	*	*				-168.9	176.3	104.4	-110.5	-72.7	0	0	0	113.3
806	S	24.7	Very low	27.9	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	76%	0.763	S	S	*	*			trans	-72.1	161.4	-154.9	48.7	0	0	0	0	120.6
807	S	25.8	Very low	27.8	Very low	118 Å²	118	145 Å²	145	83%	0.825	77%	0.772	S	S	*	*			trans	63.7	126.4	140	60.4	0	0	0	0	121.5
808	G	28.2	Very low	27.5	Very low	75 Å²	75	148.9 Å²	148.9	77%	0.773	78%	0.778	S	S	*	*			trans	177.3	144	165.2	0	0	0	0	0	111.2
809	N	30	Very low	27.7	Very low	164 Å²	164	150.3 Å²	150.3	88%	0.877	78%	0.779	S	S	*	*			trans	-94.1	167.6	-176.8	-88.5	-23.7	0	0	0	113.5
810	N	27	Very low	27.3	Very low	138 Å²	138	155.9 Å²	155.9	74%	0.738	79%	0.788	S	S	*	*			trans	-59	144	-176.5	-35.9	-83.3	0	0	0	114.1
811	I	27.8	Very low	27.2	Very low	166 Å²	166	154.3 Å²	154.3	85%	0.851	78%	0.782	S	S	*	*				-177.6	166.3	110.9	-93.3	165.9	0	0	0	110.9
812	T	26.8	Very low	27.4	Very low	115 Å²	115	155.4 Å²	155.4	71%	0.706	78%	0.784	S	S	*	*			trans	-69.9	157	-157.2	48.4	0	0	0	0	119.9
813	D	25.8	Very low	27	Very low	142 Å²	142	155.4 Å²	155.4	76%	0.759	78%	0.777	S	S	*	*			trans	66.5	127.3	145.7	-78.4	-38.5	0	0	0	122.6
814	L	27.7	Very low	27.2	Very low	139 Å²	139	150.7 Å²	150.7	73%	0.728	77%	0.773	S	S	*	*				-177.3	138.2	93.5	-89.9	174.2	0	0	0	114.1
815	R	27.4	Very low	27.1	Very low	210 Å²	210	152.4 Å²	152.4	79%	0.792	78%	0.778	S	S	*	*			trans	68.6	98.7	141.1	-73.5	174.9	-177	-173.5	2	123.2
816	S	27.3	Very low	27	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	77%	0.77	S	S	*	*				68.1	125.3	112.5	71.6	0	0	0	0	123
817	R	28	Very low	27	Very low	249 Å²	249	147.8 Å²	147.8	94%	0.94	77%	0.774	S	S	*	*				-163.9	137.3	109.3	-114.7	177.8	175.3	174.3	-1.3	112.7
818	E	25.9	Very low	26.9	Very low	192 Å²	192	147.1 Å²	147.1	90%	0.897	77%	0.769	S	S	*	*			trans	-115.3	151.6	173.7	-56.9	174.1	114.2	0	0	111.3
819	Q	29.6	Very low	26.8	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	77%	0.765	S	S	*	*			trans	-159.5	151.3	149.2	-70.8	-156.7	-7.2	0	0	108.6
820	R	29	Very low	26.7	Very low	212 Å²	212	153 Å²	153	80%	0.8	76%	0.762	S	S	*	*			cis	-173	160.3	-21.2	-103.6	-149.8	159.1	-175.1	-7.2	106.3
821	F	27.7	Very low	26.4	Very low	153 Å²	153	153.8 Å²	153.8	67%	0.671	77%	0.766	S	S	*	*			cis	-170.7	-164.1	-24.4	-158.6	-106.9	0	0	0	106.8	D823	F821-D823 WeakPolarHBondContact CE1-OD1 3.38Å
822	V	28.1	Very low	26.3	Very low	127 Å²	127	152.7 Å²	152.7	77%	0.77	76%	0.761	S	S	*	*			trans	76.2	118.9	165.5	-169.5	0	0	0	0	115.7
823	D	25.8	Very low	26.1	Very low	115 Å²	115	153.2 Å²	153.2	62%	0.615	76%	0.76	S	S	*	*			cis	-160.2	-157.8	-24.7	-126.4	82	0	0	0	105.5	F821	F821-D823 WeakPolarHBondContact CE1-OD1 3.38Å
824	V	27.6	Very low	26.2	Very low	125 Å²	125	157 Å²	157	76%	0.758	76%	0.763	S	S	*	*			cis	-151.1	175.7	10.5	79.7	0	0	0	0	110.2
825	Q	23.1	Very low	26	Very low	161 Å²	161	157.6 Å²	157.6	75%	0.752	77%	0.766	S	S	*	*			trans	-126.7	-179.8	177.2	-59.7	-166.6	59.6	0	0	110.9
826	T	24.9	Very low	26.4	Very low	112 Å²	112	152.4 Å²	152.4	69%	0.687	76%	0.76	S	S	*	*			cis	-159.1	151.1	18.3	-30.1	0	0	0	0	112.9
827	S	23.1	Very low	26.2	Very low	102 Å²	102	157.9 Å²	157.9	71%	0.713	77%	0.765	S	S	*	*			trans	73.6	149.1	146.6	77	0	0	0	0	123.1
828	S	25.1	Very low	26.1	Very low	103 Å²	103	156.4 Å²	156.4	72%	0.72	77%	0.765	S	S	*	*			trans	105.1	127	137.4	84.2	0	0	0	0	121.7
829	Q	25.4	Very low	26	Very low	150 Å²	150	155 Å²	155	70%	0.701	76%	0.759	S	S	*	*			trans	63.5	139.7	143	-71.8	-164	35.3	0	0	123.8
830	R	27	Very low	25.8	Very low	213 Å²	213	152.7 Å²	152.7	80%	0.804	75%	0.752	S	S	*	*			trans	71.8	106	155.4	-64.8	160.8	-157.4	-152	3.6	117.5
831	N	22.5	Very low	25.6	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	75%	0.753	S	S	*	*				51.8	134.5	80.8	-107.1	-17.6	0	0	0	116.3
832	L	24.3	Very low	25.5	Very low	143 Å²	143	151.5 Å²	151.5	75%	0.749	76%	0.758	S	S	*	*			trans	82.9	96	162.5	-60.3	167.7	0	0	0	120.2
833	N	23.5	Very low	25.3	Very low	126 Å²	126	156.5 Å²	156.5	67%	0.674	76%	0.763	S	S	*	*				53.4	104.7	118.6	-62	-16.7	0	0	0	120.9
834	R	26.9	Very low	25.2	Very low	220 Å²	220	159.9 Å²	159.9	83%	0.83	77%	0.772	S	S	*	*				-175	120.2	104.5	-92.9	150.4	-171.4	-147.4	2.5	109.1
835	L	23.6	Very low	25	Very low	152 Å²	152	162.4 Å²	162.4	80%	0.796	77%	0.773	S	S	*	*				90	144.7	61.2	-75.7	174.2	0	0	0	113.3
836	P	36.3	Very low	25.1	Very low	102 Å²	102	160.8 Å²	160.8	66%	0.662	77%	0.766	S	S	*	*			trans	-143	-145.9	-136	41	-17.8	0	0	0	113.7
837	R	23.8	Very low	25.1	Very low	222 Å²	222	163.3 Å²	163.3	84%	0.838	78%	0.775	S	S	*	*			trans	94.5	135.7	164	-59.1	176.7	171.1	165.7	-2.8	117.8
838	K	25.5	Very low	25.2	Very low	217 Å²	217	165.3 Å²	165.3	94%	0.943	77%	0.771	S	S	*	*				-127.4	115.4	124.8	-87.6	-171.2	175.1	178.4	0	110.1
839	Q	23.6	Very low	25.3	Very low	164 Å²	164	167.5 Å²	167.5	77%	0.766	77%	0.774	S	S	*	*			trans	-154.1	154	164.8	-112.6	-171.8	1.5	0	0	107.6
840	N	25.8	Very low	25.4	Very low	132 Å²	132	168 Å²	168	71%	0.706	78%	0.782	S	S	*	*			trans	70.2	91.9	168.2	-54.2	-20.1	0	0	0	118.4
841	F	23.7	Very low	25.3	Very low	189 Å²	189	164.6 Å²	164.6	83%	0.829	78%	0.779	S	S	*	*				-124.1	146.8	106.7	-94.3	-99.8	0	0	0	105.6
842	I	26.1	Very low	25.5	Very low	151 Å²	151	163.6 Å²	163.6	77%	0.774	77%	0.774	S	S	*	*			cis	-128.2	147.5	16	-62.3	171.4	0	0	0	110.2
843	R	24.1	Very low	25.5	Very low	233 Å²	233	164.1 Å²	164.1	88%	0.879	77%	0.77	S	S	*	*			trans	-138.4	131.4	156.8	-87.4	-168.7	179.2	-173.7	-1	109.9
844	K	23.8	Very low	25.6	Very low	186 Å²	186	162.4 Å²	162.4	81%	0.809	76%	0.761	S	S	*	*			trans	-158.7	152.9	155.8	-105.7	179.7	-179.8	-177.5	0	107.6
845	F	23.7	Very low	25.4	Very low	177 Å²	177	157.1 Å²	157.1	78%	0.776	75%	0.745	S	S	*	*	S	Bend	trans	67.5	52.1	-173.3	-66.5	-74.8	0	0	0	117.2	Y453	Y453-F845 HydrophobicContact CE1-CB 4.28Å
846	E	25.2	Very low	25.6	Very low	128 Å²	128	159.8 Å²	159.8	60%	0.598	75%	0.75	S	S	*	*			trans	-135.4	153.1	137.9	-81.6	-166.6	107.9	0	0	108.8
847	N	25	Very low	25	Very low	164 Å²	164	159.6 Å²	159.6	88%	0.877	75%	0.752	S	S	*	*			trans	96.9	79	-175.3	-65.2	-6	0	0	0	117.7
848	K	25.2	Very low	25.4	Very low	145 Å²	145	154.6 Å²	154.6	63%	0.63	75%	0.751	S	S	*	*	S	Bend		-133.6	153.6	129	-75.7	-167.6	175.2	174.7	0	108.6
849	N	26.2	Very low	25.6	Very low	148 Å²	148	150.7 Å²	150.7	79%	0.791	74%	0.74	S	S	*	*	S	Bend	trans	70	69.4	176.9	-53.6	2.8	0	0	0	116
850	N	27	Very low	25.9	Very low	160 Å²	160	152.3 Å²	152.3	86%	0.856	75%	0.747	S	S	*	*			trans	-160	70	137.7	-94.9	-38.2	0	0	0	109.7
851	L	25.3	Very low	25.9	Very low	143 Å²	143	150.8 Å²	150.8	75%	0.749	75%	0.747	S	S	*	*			trans	-94.6	137.9	148.8	-82.6	152.9	0	0	0	103.8	F853	L851-F853 HydrophobicContact CD2-CE2 4.47Å
852	D	26.3	Very low	26	Very low	133 Å²	133	148.9 Å²	148.9	71%	0.711	75%	0.751	S	S	*	*			cis	-147.6	172.8	25.3	-72.6	-54.2	0	0	0	109.4
853	F	24.9	Very low	25.9	Very low	154 Å²	154	145.1 Å²	145.1	68%	0.675	75%	0.749	S	S	*	*			cis	-156.9	161	-19.6	-136.9	-121.4	0	0	0	108.6	L851	L851-F853 HydrophobicContact CD2-CE2 4.47Å
854	L	25.2	Very low	25.9	Very low	91 Å²	91	143.6 Å²	143.6	48%	0.476	75%	0.749	S	S	.	*				173.9	-179.5	119.2	-95.4	169.4	0	0	0	111.3	F868	L854-F868 HydrophobicContact CB-CD1 3.26Å; L854-F868 HydrophobicContact CB-CD2 4.48Å; L854-F868 HydrophobicContact CB-CE1 3.26Å; L854-F868 HydrophobicContact CB-CE2 4.45Å; L854-F868 HydrophobicContact CB-CG 3.92Å; L854-F868 HydrophobicContact CB-CZ 3.88Å; L854-F868 HydrophobicContact CD1-CD1 4.14Å; L854-F868 HydrophobicContact CG-CD1 4.33Å
855	Q	24.1	Very low	26.1	Very low	108 Å²	108	139.3 Å²	139.3	51%	0.505	74%	0.742	S	S	.	*			trans	-99.5	153	-147.1	-53.1	134.7	-34.9	0	0	115.5	F868	Q855-F868 WeakPolarHBondContact O-CD2 3.45Å; Q855-F868 WeakPolarHBondContact O-CE2 3.31Å
856	K	26.9	Very low	26.2	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	74%	0.739	S	S	*	*			trans	-117.1	122.2	131.9	-82.4	-163.2	172.6	-173.1	0	109.6
857	S	24.8	Very low	26.4	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	74%	0.744	S	S	*	*			trans	-81.8	155.4	177.1	47.4	0	0	0	0	111.6
858	S	30.6	Very low	26.3	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	72%	0.722	S	S	*	*			trans	-142	76.2	158.5	64.3	0	0	0	0	109.4
859	N	30	Very low	26.3	Very low	135 Å²	135	133.2 Å²	133.2	72%	0.722	72%	0.721	S	S	*	*			trans	12.6	110	159.3	-53.4	-8.1	0	0	0	117.5
860	H	29.8	Very low	26.3	Very low	197 Å²	197	132.1 Å²	132.1	91%	0.912	72%	0.721	S	S	*	*				-108.4	162.5	116.5	-94.7	-93.6	0	0	0	108.7
861	S	25.8	Very low	26.3	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	72%	0.72	S	S	*	*	S	Bend	trans	-85.7	159.2	-152.5	49.2	0	0	0	0	116.3
862	V	25.4	Very low	26.3	Very low	150 Å²	150	132.9 Å²	132.9	91%	0.909	73%	0.725	S	S	*	*			trans	78.8	106.8	168.6	-166.1	0	0	0	0	115.5
863	G	24.8	Very low	26.3	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	73%	0.728	S	S	*	*			trans	144.5	93	167.8	0	0	0	0	0	116
864	F	24.5	Very low	26.3	Very low	202 Å²	202	130.7 Å²	130.7	89%	0.886	74%	0.737	S	S	*	*			trans	30.5	117.7	155.1	-75.6	-90.9	0	0	0	122.7
865	S	27	Very low	26.3	Very low	95 Å²	95	131 Å²	131	66%	0.664	75%	0.747	S	S	*	*			trans	57.8	118.6	138.5	61.1	0	0	0	0	122.9
866	N	27.1	Very low	26.4	Very low	131 Å²	131	137.2 Å²	137.2	70%	0.701	77%	0.767	S	S	*	*				43.2	145.9	120.9	-59	0.1	0	0	0	121
867	F	27.8	Very low	26.4	Very low	164 Å²	164	133.5 Å²	133.5	72%	0.719	75%	0.753	S	S	*	*			cis	-156.7	162.5	12.4	-122.6	-57.1	0	0	0	109.5
868	F	23.2	Very low	26.6	Very low	94 Å²	94	134.9 Å²	134.9	41%	0.412	76%	0.757	S	S	.	*			trans	-155.7	146.1	171.8	-166.5	40.8	0	0	0	114.9	L854 Q855	L854-F868 HydrophobicContact CB-CD1 3.26Å; L854-F868 HydrophobicContact CB-CD2 4.48Å; L854-F868 HydrophobicContact CB-CE1 3.26Å; L854-F868 HydrophobicContact CB-CE2 4.45Å; L854-F868 HydrophobicContact CB-CG 3.92Å; L854-F868 HydrophobicContact CB-CZ 3.88Å; L854-F868 HydrophobicContact CD1-CD1 4.14Å; L854-F868 HydrophobicContact CG-CD1 4.33Å; Q855-F868 WeakPolarHBondContact O-CD2 3.45Å; Q855-F868 WeakPolarHBondContact O-CE2 3.31Å
869	T	26.2	Very low	26.4	Very low	98 Å²	98	133.9 Å²	133.9	60%	0.601	74%	0.743	S	S	*	*			trans	54.4	123.8	166.7	48.5	0	0	0	0	121.1
870	P	25.5	Very low	26.3	Very low	124 Å²	124	133.8 Å²	133.8	81%	0.805	74%	0.742	S	S	*	*			trans	-96.4	146.9	153.4	36.5	-30.2	0	0	0	112.3
871	I	27.5	Very low	26.2	Very low	160 Å²	160	130.9 Å²	130.9	82%	0.821	73%	0.733	S	S	*	*			trans	-142	132.5	161.8	-67.1	-173.9	0	0	0	109.1
872	N	24	Very low	26.4	Very low	159 Å²	159	132.3 Å²	132.3	85%	0.85	73%	0.733	S	S	*	*			trans	-84.5	137.8	169.4	-83.4	-21.2	0	0	0	111.6
873	S	27.2	Very low	26.5	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	72%	0.72	S	S	*	*			trans	-155.2	109.1	141.7	59.7	0	0	0	0	109.5
874	C	24.9	Very low	26.5	Very low	128 Å²	128	135.4 Å²	135.4	87%	0.865	72%	0.717	S	S	*	*			trans	-63.9	143.7	171.7	-61.7	0	0	0	0	110.2
875	C	24.9	Very low	26.6	Very low	99 Å²	99	130.2 Å²	130.2	67%	0.669	71%	0.706	S	S	*	*			trans	-63.3	152.8	166.2	-55.4	0	0	0	0	110.3	E877	C875-E877 HydrophobicContact CB-CG 4.29Å
876	Y	27.4	Very low	26.5	Very low	238 Å²	238	133.4 Å²	133.4	93%	0.933	71%	0.711	S	S	*	*				-132.8	130.5	119.7	-119.2	-80.8	0	0	0	109
877	E	25.5	Very low	26.6	Very low	129 Å²	129	135.9 Å²	135.9	60%	0.603	72%	0.718	S	S	*	*			trans	-84	172.1	179.6	-50.2	174.5	95.2	0	0	108.7	C875 N879	C875-E877 HydrophobicContact CB-CG 4.29Å; E877-N879 PolarHBondContact OE1-ND2 3.21Å
878	T	29.8	Very low	26.7	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	72%	0.715	S	S	*	*				-156.8	139	64.9	37.5	0	0	0	0	108.5
879	N	27.1	Very low	26.9	Very low	97 Å²	97	131 Å²	131	52%	0.519	73%	0.725	S	S	.	*				59.5	126.1	62.4	-61.4	-22.4	0	0	0	111.3	E877	E877-N879 PolarHBondContact OE1-ND2 3.21Å
880	N	26.9	Very low	27	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	74%	0.738	S	S	*	*			cis	-160	-153	-6.4	-126.2	-16.6	0	0	0	109.8
881	D	27.8	Very low	27.3	Very low	135 Å²	135	138.8 Å²	138.8	72%	0.722	74%	0.735	S	S	*	*			trans	80	141.4	158	-62.9	-11	0	0	0	117.9
882	L	29.7	Very low	27.4	Very low	131 Å²	131	138.4 Å²	138.4	69%	0.686	73%	0.73	S	S	*	*			cis	-145.3	138.9	-12.8	-98.9	150.9	0	0	0	105.9
883	H	27.1	Very low	27.5	Very low	139 Å²	139	135.5 Å²	135.5	64%	0.644	72%	0.721	S	S	*	*				49.3	140	96.7	-71.2	-108.2	0	0	0	115.2
884	H	25.7	Very low	27.3	Very low	146 Å²	146	141 Å²	141	68%	0.676	72%	0.724	S	S	*	*			cis	-168.8	-170.4	6.5	-131.7	-0.1	0	0	0	112.9
885	S	25.6	Very low	27.4	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	72%	0.722	S	S	*	*			trans	72.3	150	142.4	67.3	0	0	0	0	120
886	E	25.4	Very low	27.5	Very low	162 Å²	162	142.6 Å²	142.6	76%	0.757	72%	0.721	S	S	*	*			cis	-162.7	162.2	-16.9	-118.3	159.3	-124.9	0	0	111.7
887	H	28.7	Very low	27.6	Very low	183 Å²	183	136.6 Å²	136.6	85%	0.847	70%	0.701	S	S	*	*			trans	-176.3	96.4	136.5	-98.9	-62.9	0	0	0	107.2
888	S	29.9	Very low	27.6	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	71%	0.71	S	S	*	*				81.9	125.1	82.2	70.2	0	0	0	0	113.4
889	G	28.3	Very low	27.5	Very low	59 Å²	59	136.8 Å²	136.8	61%	0.608	71%	0.707	S	S	*	*			cis	172	-161.7	-0.1	0	0	0	0	0	112.5
890	Y	28.9	Very low	27.6	Very low	222 Å²	222	139.2 Å²	139.2	87%	0.871	72%	0.718	S	S	*	*			trans	64.2	120.3	177.1	-57.8	-87.6	0	0	0	114.9
891	H	31.3	Very low	27.6	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.755	71%	0.709	S	S	*	*			cis	-134.5	165.3	48.3	-89.4	-93.7	0	0	0	115.8
892	H	28.9	Very low	27.8	Very low	152 Å²	152	134.7 Å²	134.7	70%	0.704	71%	0.71	S	S	*	*			trans	20.6	116.7	163.1	-60.1	-65	0	0	0	119.9
893	C	26.8	Very low	27.7	Very low	98 Å²	98	135 Å²	135	66%	0.662	71%	0.713	S	S	*	*				61.7	101.1	73.5	-66	0	0	0	0	112.5
894	R	23.5	Very low	27.8	Very low	230 Å²	230	134.1 Å²	134.1	87%	0.868	71%	0.713	S	S	*	*				81.4	169.2	92.5	-79.9	179.4	174.9	-174.8	-0.4	111.5
895	V	26.9	Very low	28	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	72%	0.72	S	S	*	*			trans	75	126.5	176.7	-173.6	0	0	0	0	110.2
896	I	27.2	Very low	28.2	Very low	125 Å²	125	139.8 Å²	139.8	64%	0.641	72%	0.723	S	S	*	*			cis	-158	166.5	5.4	-142.6	172.5	0	0	0	112.2
897	Q	27.8	Very low	28.3	Very low	111 Å²	111	142.4 Å²	142.4	52%	0.519	73%	0.726	S	S	.	*			trans	33.5	141.4	156.2	-69.1	146.4	9.7	0	0	122.4
898	P	27.2	Very low	28.1	Very low	120 Å²	120	140.2 Å²	140.2	78%	0.779	72%	0.721	S	S	*	*	S	Bend		-90	136.3	114.2	32.5	-30.9	0	0	0	111.6
899	I	27.7	Very low	27.9	Very low	141 Å²	141	142.6 Å²	142.6	72%	0.723	73%	0.726	S	S	*	*			trans	70.2	117.2	161.2	-52.5	161.6	0	0	0	118.3
900	I	27.4	Very low	27.9	Very low	148 Å²	148	145.2 Å²	145.2	76%	0.759	74%	0.735	S	S	*	*			trans	-124.9	131.4	139.8	-56.4	173.4	0	0	0	105.1
901	G	28.1	Very low	27.9	Very low	51 Å²	51	139.9 Å²	139.9	53%	0.526	73%	0.73	S	S	.	*			cis	-128.5	-162.9	-23.6	0	0	0	0	0	108.3
902	T	30.8	Very low	28	Very low	122 Å²	122	137.6 Å²	137.6	75%	0.748	73%	0.73	S	S	*	*			cis	-150.3	142.9	9.1	46.4	0	0	0	0	109.9
903	D	27.9	Very low	28.3	Very low	139 Å²	139	135.5 Å²	135.5	74%	0.743	73%	0.729	S	S	*	*			trans	62	161	156.3	-70.6	-52.4	0	0	0	119.8
904	N	30.4	Very low	28.2	Very low	120 Å²	120	139.4 Å²	139.4	64%	0.642	74%	0.735	S	S	*	*			cis	-164.5	160.6	-46.8	-138.1	-53.2	0	0	0	108.8
905	R	29.3	Very low	28.4	Very low	216 Å²	216	136.4 Å²	136.4	82%	0.815	73%	0.729	S	S	*	*			trans	67.5	133	165.5	-64	169.7	-175.5	-177.6	0.7	115.5
906	I	29.1	Very low	28.3	Very low	142 Å²	142	135.5 Å²	135.5	73%	0.728	72%	0.716	S	S	*	*			cis	101.3	118.9	41.1	-76.3	170.3	0	0	0	112.4
907	R	28.3	Very low	28.3	Very low	218 Å²	218	137.7 Å²	137.7	82%	0.823	72%	0.716	S	S	*	*			trans	69.9	119.1	159.7	-75	167.8	-173.9	-175.5	1.6	121.4
908	N	25	Very low	28.2	Very low	137 Å²	137	140.9 Å²	140.9	73%	0.733	72%	0.723	S	S	*	*				54.8	139.5	120.1	-57.5	20.8	0	0	0	123
909	N	25.5	Very low	28.2	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	71%	0.71	S	S	*	*			trans	85.1	143.7	153.7	-60.4	-8.4	0	0	0	119.3
910	S	28.3	Very low	28.3	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	70%	0.701	S	S	*	*			trans	61.5	143.7	175	55	0	0	0	0	117.4
911	S	27.4	Very low	28.4	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	70%	0.702	S	S	*	*			cis	-161.5	161.2	-14.8	-90.6	0	0	0	0	110
912	P	35.4	Very low	28.5	Very low	116 Å²	116	137.2 Å²	137.2	75%	0.753	70%	0.704	S	S	*	*			trans	-81.9	-171.7	167.8	40.2	-39.1	0	0	0	110.9
913	P	34.7	Very low	28.4	Very low	107 Å²	107	134.5 Å²	134.5	70%	0.695	70%	0.7	S	S	*	*			cis	-146.6	174.2	11	46.1	-26.9	0	0	0	119.3
914	F	24.3	Very low	28.8	Very low	180 Å²	180	133.7 Å²	133.7	79%	0.789	70%	0.702	S	S	*	*			trans	44.5	167.1	138.2	-86.5	-108.1	0	0	0	126
915	F	26.9	Very low	28.7	Very low	168 Å²	168	134.3 Å²	134.3	74%	0.737	71%	0.711	S	S	*	*			trans	73.9	143.5	163.1	-73	-85	0	0	0	118
916	E	26.1	Very low	28.5	Very low	116 Å²	116	129.2 Å²	129.2	54%	0.542	70%	0.703	S	S	.	*			cis	-166.3	166.8	-20.4	-133.4	-165.2	169.4	0	0	114.4
917	R	26	Very low	28.4	Very low	170 Å²	170	130.6 Å²	130.6	64%	0.642	70%	0.704	S	S	*	*			trans	55.6	122.6	145.8	-78.3	178.2	-162.5	171.6	27.8	125.6
918	R	26.1	Very low	28.3	Very low	179 Å²	179	127.9 Å²	127.9	68%	0.675	70%	0.699	S	S	*	*				96.1	135.5	116.6	-81	178.3	-178	-159.6	-0.2	124.6
919	R	28.3	Very low	28.3	Very low	129 Å²	129	125.8 Å²	125.8	49%	0.487	69%	0.691	S	S	.	*			trans	84.8	90.2	137	-77.4	-179.8	178.4	-162.6	-5.4	123.3	I958	R919-I958 PolarHBondContact NH2-O 2.78Å
920	S	28.4	Very low	28.3	Very low	79 Å²	79	129.1 Å²	129.1	55%	0.552	69%	0.693	S	S	*	*				38.1	126.9	111.2	61.9	0	0	0	0	123.3	M957	S920-M957 VanDerWaalsContact O-CE 3.29Å; S920-M957 WeakPolarHBondContact O-CE 3.37Å
921	A	30	Very low	28.2	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	70%	0.698	S	S	*	*			trans	-158.3	172	144.7	0	0	0	0	0	112
922	S	29.4	Very low	28.2	Very low	81 Å²	81	134.6 Å²	134.6	57%	0.566	70%	0.697	S	S	*	*			trans	-80.3	168.5	-167.9	52.4	0	0	0	0	117.4
923	G	30.1	Very low	27.9	Very low	65 Å²	65	137.8 Å²	137.8	67%	0.67	70%	0.699	S	S	*	*			trans	-80.2	-156.8	160.1	0	0	0	0	0	112.9
924	P	36.4	Very low	27.5	Very low	122 Å²	122	138.9 Å²	138.9	79%	0.792	70%	0.704	S	S	*	*			cis	-144	-167.1	22.5	44.9	-25.5	0	0	0	116.8
925	V	27.9	Very low	27.6	Very low	134 Å²	134	134.7 Å²	134.7	81%	0.812	70%	0.697	S	S	*	*			trans	72.1	138.8	160.6	178.4	0	0	0	0	119.4
926	T	25.7	Very low	27.6	Very low	108 Å²	108	132.1 Å²	132.1	66%	0.663	69%	0.691	S	S	*	*			trans	-81.7	142.4	173.9	44.2	0	0	0	0	111.3
927	F	25.9	Very low	27.7	Very low	171 Å²	171	134.1 Å²	134.1	75%	0.75	70%	0.7	S	S	*	*				-176.4	138.8	88.1	-114.8	-98.1	0	0	0	113
928	F	25.9	Very low	27.7	Very low	162 Å²	162	132.2 Å²	132.2	71%	0.711	70%	0.702	S	S	*	*			trans	64.6	109.6	136.5	-93.9	-132.6	0	0	0	124.6
929	T	25.7	Very low	27.8	Very low	92 Å²	92	131.8 Å²	131.8	56%	0.564	71%	0.705	S	S	*	*				95.9	146.8	112.2	53.7	0	0	0	0	124.9
930	R	24.9	Very low	27.8	Very low	216 Å²	216	131.8 Å²	131.8	82%	0.815	72%	0.715	S	S	*	*			trans	62.2	133.7	139.5	-77.8	164.3	176.2	174.1	-2.1	118.8
931	Y	26	Very low	27.8	Very low	233 Å²	233	134.7 Å²	134.7	91%	0.914	72%	0.724	S	S	*	*			trans	-147.4	110.8	139	-101.7	-68.5	0	0	0	113.9
932	S	27.4	Very low	27.8	Very low	106 Å²	106	135.2 Å²	135.2	74%	0.741	72%	0.718	S	S	*	*			trans	-167.8	135.7	131.3	61.1	0	0	0	0	109.3
933	K	28.9	Very low	27.7	Very low	182 Å²	182	138.1 Å²	138.1	79%	0.791	73%	0.727	S	S	*	*			cis	-158.2	164.4	-7.2	-122.8	172	-174.4	178.9	0	110.5
934	T	26.3	Very low	27.6	Very low	130 Å²	130	143.2 Å²	143.2	80%	0.798	73%	0.734	S	S	*	*			trans	65.4	141.8	166.5	46.9	0	0	0	0	118
935	S	27.1	Very low	27.3	Very low	93 Å²	93	142.2 Å²	142.2	65%	0.65	73%	0.73	S	S	*	*			cis	-145.6	156.7	8.7	-126.1	0	0	0	0	114.2
936	D	27.7	Very low	27.3	Very low	113 Å²	113	143.3 Å²	143.3	60%	0.604	73%	0.73	S	S	*	*			trans	49.3	116.4	149.7	-61.3	-63.7	0	0	0	120.9
937	Q	27.8	Very low	27.5	Very low	158 Å²	158	146.3 Å²	146.3	74%	0.738	73%	0.734	S	S	*	*				71.8	143.5	98.3	-67.2	-173.8	66.6	0	0	115.1
938	L	25.3	Very low	27.8	Very low	130 Å²	130	144.1 Å²	144.1	68%	0.681	73%	0.73	S	S	*	*			cis	-171.4	155	-16.9	-112.6	170.6	0	0	0	106.6
939	K	27.9	Very low	28	Very low	170 Å²	170	139.4 Å²	139.4	74%	0.739	73%	0.727	S	S	*	*			trans	71.1	146.4	152.1	-77.9	172.9	179.2	177.8	0	122
940	N	29.4	Very low	28.2	Very low	129 Å²	129	145.5 Å²	145.5	69%	0.69	74%	0.74	S	S	*	*			trans	75.3	123.3	148.7	-66.8	12.4	0	0	0	116.8
941	N	27.7	Very low	28.5	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	73%	0.734	S	S	*	*				69.2	131.4	75.4	-66	25.2	0	0	0	111.2
942	T	30.4	Very low	28.6	Very low	105 Å²	105	136.2 Å²	136.2	64%	0.644	72%	0.722	S	S	*	*			cis	-165.7	158.1	14.2	9.4	0	0	0	0	109.4
943	D	27.4	Very low	28.7	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	72%	0.722	S	S	*	*			trans	44.9	151.9	143.7	-40.8	-28.5	0	0	0	120.8
944	E	28.5	Very low	28.5	Very low	172 Å²	172	136.4 Å²	136.4	80%	0.804	72%	0.717	S	S	*	*			cis	-160.1	171	3.6	-142.5	179.9	-162.3	0	0	110.3
945	S	30.2	Very low	28.4	Very low	101 Å²	101	135.6 Å²	135.6	71%	0.706	71%	0.708	S	S	*	*			trans	69.1	148.3	165.3	81.2	0	0	0	0	118.1
946	L	28.2	Very low	28.3	Very low	156 Å²	156	136.8 Å²	136.8	82%	0.817	71%	0.714	S	S	*	*			cis	-168.5	164.2	-15.7	-127.6	64	0	0	0	105.7
947	F	29.8	Very low	28.2	Very low	171 Å²	171	137 Å²	137	75%	0.75	71%	0.713	S	S	*	*			cis	-159.6	153.7	-6.3	-163.8	-126	0	0	0	110.8
948	D	30.5	Very low	28.1	Very low	125 Å²	125	135.6 Å²	135.6	67%	0.668	71%	0.71	S	S	*	*			trans	58.2	154	164.2	-136	-27.5	0	0	0	120.4
949	G	30.9	Very low	28.2	Very low	63 Å²	63	134.4 Å²	134.4	65%	0.649	71%	0.711	S	S	*	*			trans	176	-41.2	178	0	0	0	0	0	120.5
950	R	31	Very low	28.1	Very low	221 Å²	221	133.3 Å²	133.3	83%	0.834	71%	0.713	S	S	*	*			trans	64.3	157.2	179.4	-56.3	179.4	177	-160.7	-1.5	116.8
951	L	30	Very low	28.4	Very low	130 Å²	130	132 Å²	132	68%	0.681	71%	0.712	S	S	*	*			cis	-157.9	126.3	-21.1	-110.4	167.9	0	0	0	110.1
952	N	29.4	Very low	28.4	Very low	124 Å²	124	130.5 Å²	130.5	66%	0.663	71%	0.712	S	S	*	*			trans	32.7	127	140.9	-66.3	41.1	0	0	0	121.5
953	E	29	Very low	28.4	Very low	160 Å²	160	133.9 Å²	133.9	75%	0.748	72%	0.723	S	S	*	*				75.5	153.1	61.4	-75.1	-162.9	142.1	0	0	115.1
954	L	24.1	Very low	28.6	Very low	132 Å²	132	133 Å²	133	69%	0.691	73%	0.725	S	S	*	*			cis	-171.8	168.1	-37	-127.4	172.7	0	0	0	108.1
955	L	25.2	Very low	28.8	Very low	113 Å²	113	132.1 Å²	132.1	59%	0.592	73%	0.725	S	S	*	*			trans	67.2	148.1	158.1	-91.7	155.1	0	0	0	121
956	C	23.3	Very low	29	Very low	118 Å²	118	132.6 Å²	132.6	80%	0.797	73%	0.725	S	S	*	*			trans	-117.4	135.8	167.4	-50.8	0	0	0	0	110.1
957	M	25.9	Very low	29	Very low	117 Å²	117	131.3 Å²	131.3	58%	0.576	72%	0.724	S	S	*	*			trans	-158.7	163.2	144.7	-122.1	-175.3	-75	0	0	112.8	S920	S920-M957 VanDerWaalsContact O-CE 3.29Å; S920-M957 WeakPolarHBondContact O-CE 3.37Å
958	I	26.3	Very low	29.1	Very low	129 Å²	129	129.2 Å²	129.2	66%	0.662	73%	0.731	S	S	*	*			trans	-108.7	133.6	-158.3	-62.6	158.8	0	0	0	112.3	R919	R919-I958 PolarHBondContact NH2-O 2.78Å
959	C	28.4	Very low	29	Very low	105 Å²	105	126.5 Å²	126.5	71%	0.709	73%	0.732	S	S	*	*			trans	-168	128.4	134.3	-106.5	0	0	0	0	114.2
960	D	25.1	Very low	28.9	Very low	146 Å²	146	129 Å²	129	78%	0.781	74%	0.739	S	S	*	*			trans	-53.1	170.2	153.9	-91.9	-64	0	0	0	113.6
961	P	34.6	Very low	28.9	Very low	103 Å²	103	124 Å²	124	67%	0.669	73%	0.733	S	S	*	*			cis	-140.6	177.5	18.3	36.6	-15.7	0	0	0	118.5
962	S	28.2	Very low	28.9	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	74%	0.736	S	S	*	*			trans	72	129.8	143.5	54.5	0	0	0	0	122.3
963	M	31.7	Very low	29	Very low	175 Å²	175	126.2 Å²	126.2	86%	0.862	74%	0.735	S	S	*	*			trans	-56.1	157.8	164.2	-87.2	-171.5	179.2	0	0	113.8
964	P	31	Very low	29.1	Very low	124 Å²	124	127.3 Å²	127.3	81%	0.805	74%	0.738	S	S	*	*				-148.6	174.7	50.8	42.1	-21.8	0	0	0	120
965	L	31.2	Very low	29.2	Very low	154 Å²	154	126.3 Å²	126.3	81%	0.806	74%	0.742	S	S	*	*			trans	-68.3	159	164	-61.2	159.6	0	0	0	110.9
966	P	34.7	Very low	29.4	Very low	110 Å²	110	124.8 Å²	124.8	71%	0.714	75%	0.753	S	S	*	*				-158.9	140.6	91.8	40.2	-19.6	0	0	0	119.8
967	T	28	Very low	29.6	Very low	130 Å²	130	130.5 Å²	130.5	80%	0.798	76%	0.758	S	S	*	*			trans	43	139.9	131.2	70.5	0	0	0	0	124.9
968	S	33	Very low	29.6	Very low	126 Å²	126	129.3 Å²	129.3	88%	0.881	76%	0.761	S	S	*	*				-180	153.9	107.1	45.4	0	0	0	0	110.9
969	G	29.2	Very low	29.6	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	77%	0.77	S	S	*	*			cis	-136.2	-173.3	-9.7	0	0	0	0	0	110.5
970	C	27.5	Very low	29.4	Very low	116 Å²	116	129.9 Å²	129.9	78%	0.784	77%	0.765	S	S	*	*			cis	-148.4	146.8	19.1	-92.8	0	0	0	0	113.5
971	T	30.4	Very low	29.3	Very low	116 Å²	116	129.4 Å²	129.4	71%	0.712	77%	0.767	S	S	*	*			trans	53.8	136.1	143.1	60.9	0	0	0	0	121.3
972	Q	31.7	Very low	29	Very low	160 Å²	160	129.8 Å²	129.8	75%	0.748	77%	0.768	S	S	*	*			cis	-164.5	148.9	1.2	-116.4	175.6	5	0	0	111.8
973	H	31.2	Very low	29	Very low	141 Å²	141	131.1 Å²	131.1	65%	0.653	77%	0.771	S	S	*	*			trans	32.6	154.1	140.9	-65.6	-41	0	0	0	123.6
974	F	29.9	Very low	29.4	Very low	182 Å²	182	127.7 Å²	127.7	80%	0.798	76%	0.762	S	S	*	*			cis	-152.7	-174.2	-0.7	-123.1	-49.9	0	0	0	111
975	S	26.2	Very low	29.4	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	76%	0.761	S	S	*	*			trans	-100.6	154.4	-167.2	55.8	0	0	0	0	116.3
976	G	29.2	Very low	29.1	Very low	81 Å²	81	126.1 Å²	126.1	84%	0.835	76%	0.759	S	S	*	*			trans	-161.6	147.6	168.5	0	0	0	0	0	114.5
977	R	28.3	Very low	28.7	Very low	239 Å²	239	124.9 Å²	124.9	90%	0.902	76%	0.758	S	S	*	*			trans	-103.3	147.4	-171.1	-65.4	174.9	164.6	175.1	-5.3	114.8
978	S	25.1	Very low	28.5	Very low	91 Å²	91	124.1 Å²	124.1	64%	0.636	76%	0.757	S	S	*	*			trans	58.9	143.7	132.3	69.9	0	0	0	0	123.8
979	L	27.1	Very low	28.1	Very low	163 Å²	163	127.7 Å²	127.7	85%	0.853	76%	0.757	S	S	*	*			trans	70.7	154.2	159.6	-61.5	155.9	0	0	0	116.7
980	S	24	Very low	27.9	Very low	84 Å²	84	128.7 Å²	128.7	59%	0.587	75%	0.753	S	S	*	*			cis	-174.2	149.3	-36.4	52.4	0	0	0	0	109.8
981	T	23.8	Very low	27.8	Very low	136 Å²	136	127.9 Å²	127.9	83%	0.834	75%	0.749	S	S	*	*			trans	68.9	156.9	178.3	75.1	0	0	0	0	114.1
982	T	28.3	Very low	27.7	Very low	111 Å²	111	128.8 Å²	128.8	68%	0.681	75%	0.749	S	S	*	*			cis	-144.2	131.8	24.2	50.9	0	0	0	0	115.8
983	T	27	Very low	27.5	Very low	135 Å²	135	128.3 Å²	128.3	83%	0.828	75%	0.75	S	S	*	*			trans	61.5	155.4	142	50.7	0	0	0	0	124.8
984	P	40.1	Very low	27.1	Very low	104 Å²	104	127 Å²	127	68%	0.675	75%	0.752	S	S	*	*			trans	-114.1	-172.6	-172.9	45	-33.2	0	0	0	114.6
985	P	31.1	Very low	26.8	Very low	120 Å²	120	126.7 Å²	126.7	78%	0.779	75%	0.753	S	S	*	*				-137	167.4	97.3	31.7	-15.4	0	0	0	113.4
986	T	26	Very low	26.8	Very low	124 Å²	124	125.7 Å²	125.7	76%	0.761	75%	0.746	S	S	*	*			cis	104.4	125	18.8	-49.1	0	0	0	0	114.9
987	A	25.2	Very low	26.6	Very low	84 Å²	84	126.5 Å²	126.5	69%	0.694	74%	0.739	S	S	*	*			trans	84.2	106.5	158.1	0	0	0	0	0	123.8
988	C	23.3	Very low	26.5	Very low	114 Å²	114	123.9 Å²	123.9	77%	0.77	73%	0.731	S	S	*	*				77.1	156	118.1	-60.1	0	0	0	0	125.1
989	F	26.4	Very low	26.4	Very low	202 Å²	202	127.8 Å²	127.8	89%	0.886	74%	0.736	S	S	*	*			trans	78.2	173.2	168.1	-67.2	-71.4	0	0	0	119.6
990	S	23.9	Very low	26.4	Very low	89 Å²	89	127.1 Å²	127.1	62%	0.622	73%	0.733	S	S	*	*				-151.1	163.5	-128.9	55.8	0	0	0	0	116.3
991	S	26.7	Very low	26.5	Very low	99 Å²	99	130.9 Å²	130.9	69%	0.692	74%	0.739	S	S	*	*			trans	61.1	148.8	156.6	51	0	0	0	0	117.9
992	D	26.8	Very low	27	Very low	135 Å²	135	130.2 Å²	130.2	72%	0.722	74%	0.736	S	S	*	*			cis	-168.4	153.8	-15.3	-112.1	-43.6	0	0	0	107.7
993	I	27.1	Very low	27	Very low	149 Å²	149	130.9 Å²	130.9	76%	0.764	74%	0.74	S	S	*	*			trans	66.6	138.8	153.8	-68	165	0	0	0	115.7
994	T	23.3	Very low	27.1	Very low	114 Å²	114	128 Å²	128	70%	0.699	74%	0.737	S	S	*	*			cis	-150.1	171.3	12.7	-8.3	0	0	0	0	111.6
995	E	24.8	Very low	26.6	Very low	176 Å²	176	130.4 Å²	130.4	82%	0.822	75%	0.745	S	S	*	*			trans	11.7	149.4	145.6	-70.3	170.5	-178	0	0	122.6
996	S	25.9	Very low	26.6	Very low	90 Å²	90	129.5 Å²	129.5	63%	0.629	74%	0.741	S	S	*	*			cis	-173	136.5	-12.7	53.6	0	0	0	0	113.2
997	S	24.7	Very low	26.8	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	74%	0.74	S	S	*	*			trans	58.4	150.1	158.7	53.2	0	0	0	0	118.8
998	Y	25.3	Very low	27.1	Very low	185 Å²	185	131.7 Å²	131.7	73%	0.725	75%	0.746	S	S	*	*				-161.7	140.3	52.3	-103.7	-98.5	0	0	0	112.7
999	F	24.7	Very low	27.4	Very low	173 Å²	173	132.9 Å²	132.9	76%	0.759	74%	0.74	S	S	*	*			trans	65.8	158.6	143.5	-76.2	-162.8	0	0	0	119.6
1000	L	26.3	Very low	27.3	Very low	149 Å²	149	130 Å²	130	78%	0.78	73%	0.734	S	S	*	*			cis	-149	168.2	0.5	-129	170.7	0	0	0	112.2
1001	K	26.1	Very low	27.5	Very low	163 Å²	163	131.5 Å²	131.5	71%	0.709	74%	0.739	S	S	*	*			trans	-85.6	173.2	166	-58.5	178.4	-179.7	177.3	0	111	T1003	K1001-T1003 HydrophobicContact CB-CG2 4.37Å
1002	P	33.4	Very low	27.4	Very low	121 Å²	121	133.9 Å²	133.9	79%	0.786	74%	0.743	S	S	*	*				-130.6	126.1	93.8	6.7	15.6	0	0	0	112.4
1003	T	29.1	Very low	27.3	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	75%	0.747	S	S	*	*				80.5	127.6	71.5	59.1	0	0	0	0	116.2	K1001	K1001-T1003 HydrophobicContact CB-CG2 4.37Å
1004	G	29.1	Very low	27.2	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	75%	0.747	S	S	*	*			trans	-158.1	63.9	177.9	0	0	0	0	0	114
1005	N	30.1	Very low	27.2	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	75%	0.749	S	S	*	*			trans	66.5	146.5	161.6	-65	-4.3	0	0	0	122.9
1006	S	31.5	Very low	27.4	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	75%	0.75	S	S	*	*			trans	51.5	109.2	169.2	44.5	0	0	0	0	117.6
1007	T	29.3	Very low	27.5	Very low	119 Å²	119	137.9 Å²	137.9	73%	0.73	76%	0.757	S	S	*	*			cis	63.1	135.1	35.8	87.1	0	0	0	0	113.3
1008	V	31.2	Very low	27.6	Very low	135 Å²	135	137.6 Å²	137.6	82%	0.818	75%	0.747	S	S	*	*			cis	-145.7	148.2	22.7	174.6	0	0	0	0	109
1009	E	29.3	Very low	27.9	Very low	140 Å²	140	137.3 Å²	137.3	65%	0.654	76%	0.757	S	S	*	*			cis	-166	178.3	-33.1	-111.8	-63.4	7.1	0	0	108.4
1010	N	26	Very low	28	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	75%	0.748	S	S	*	*			trans	-95	-167.7	170.4	-67.6	-97.5	0	0	0	111.3
1011	V	28	Very low	28	Very low	120 Å²	120	130.3 Å²	130.3	73%	0.727	75%	0.746	S	S	*	*				-169.7	124.6	72.3	159.6	0	0	0	0	112.4
1012	L	24.6	Very low	28.2	Very low	149 Å²	149	131.1 Å²	131.1	78%	0.78	75%	0.75	S	S	*	*			trans	40.3	116.8	141.3	-54.2	176.3	0	0	0	124.4
1013	L	24.7	Very low	27.8	Very low	154 Å²	154	130.3 Å²	130.3	81%	0.806	75%	0.746	S	S	*	*				15.8	129.3	126	-88.3	87.2	0	0	0	123
1014	S	23.8	Very low	27.7	Very low	108 Å²	108	131 Å²	131	76%	0.755	74%	0.739	S	S	*	*				87.9	127.6	126	70.4	0	0	0	0	123.8
1015	A	23.8	Very low	27.5	Very low	91 Å²	91	138.4 Å²	138.4	75%	0.752	74%	0.744	S	S	*	*			trans	64.8	105	155.2	0	0	0	0	0	119
1016	F	28.4	Very low	27.2	Very low	191 Å²	191	134.4 Å²	134.4	84%	0.838	74%	0.739	S	S	*	*				-146.7	169.9	73.1	-124.7	-98.7	0	0	0	114.8
1017	R	27.4	Very low	26.9	Very low	203 Å²	203	135.5 Å²	135.5	77%	0.766	74%	0.741	S	S	*	*			trans	-95.8	176.5	176.8	-60	178.5	168.9	159.3	-3	110.5
1018	L	28.7	Very low	27	Very low	92 Å²	92	138.6 Å²	138.6	48%	0.482	75%	0.748	S	S	.	*			cis	-168.8	140.7	23.2	-150.7	166.4	0	0	0	110.9	F341 A1020	F341-L1018 HydrophobicContact CB-CD1 4.27Å; F341-L1018 HydrophobicContact CD1-CD1 3.47Å; F341-L1018 VanDerWaalsContact CD1-CD1 3.47Å; F341-L1018 HydrophobicContact CE1-CD1 3.98Å; F341-L1018 HydrophobicContact CE1-CD2 4.44Å; F341-L1018 HydrophobicContact CG-CD1 3.95Å; L1018-A1020 HydrophobicContact CD2-CB 4.3Å
1019	L	30	Very low	26.9	Very low	178 Å²	178	138.3 Å²	138.3	93%	0.932	75%	0.749	S	S	*	*			trans	-152.7	159.9	137.9	-107.5	176.2	0	0	0	109.9
1020	A	27.8	Very low	26.6	Very low	68 Å²	68	138.8 Å²	138.8	56%	0.562	76%	0.755	S	S	*	*			trans	-114.5	162.7	-143.4	0	0	0	0	0	117.7	L1018	L1018-A1020 HydrophobicContact CD2-CB 4.3Å
1021	S	25.7	Very low	26.7	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	75%	0.752	S	S	*	*			trans	71.9	147.9	161.8	-61.9	0	0	0	0	116.7
1022	F	30.1	Very low	26.6	Very low	181 Å²	181	139.6 Å²	139.6	79%	0.794	75%	0.754	S	S	*	*			cis	-129.2	163.8	26.8	-98.2	-98.6	0	0	0	115.8
1023	C	25	Very low	26.7	Very low	103 Å²	103	139.8 Å²	139.8	70%	0.696	76%	0.756	S	S	*	*			trans	-151.4	125.9	160.9	-83.5	0	0	0	0	108.5
1024	F	27.2	Very low	26.9	Very low	140 Å²	140	136.2 Å²	136.2	61%	0.614	76%	0.757	S	S	*	*			trans	-135.2	173	169.8	-122.8	-102.9	0	0	0	112.5	K311	K311-F1024 HydrophobicContact CD-CE1 3.81Å; K311-F1024 HydrophobicContact CD-CZ 4.23Å; K311-F1024 HydrophobicContact CG-CE1 4.5Å
1025	W	25	Very low	27.1	Very low	229 Å²	229	140.1 Å²	140.1	87%	0.867	76%	0.76	S	S	*	*			trans	-149.6	104.5	-156.6	-161	64.7	0	0	0	112.3
1026	G	23.6	Very low	27.4	Very low	71 Å²	71	140.3 Å²	140.3	73%	0.732	76%	0.762	S	S	*	*			trans	70.6	145.7	159.7	0	0	0	0	0	118.6
1027	V	26	Very low	27.3	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	75%	0.754	S	S	*	*			trans	165.3	134	133.1	153.2	0	0	0	0	109.3
1028	E	29.7	Very low	27.5	Very low	184 Å²	184	131.8 Å²	131.8	86%	0.86	75%	0.747	S	S	*	*			trans	-70.1	151.1	169	-61.4	154.3	120.4	0	0	110.8
1029	P	30	Very low	27.5	Very low	129 Å²	129	131.2 Å²	131.2	84%	0.838	74%	0.744	S	S	*	*			trans	-130.5	155.8	135.1	36.9	-28.3	0	0	0	112.6
1030	D	23.8	Very low	27.3	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	73%	0.729	S	S	*	*			trans	-123.6	156.5	-179.7	-156.8	-0.5	0	0	0	108.4
1031	I	27.7	Very low	27.7	Very low	135 Å²	135	127.4 Å²	127.4	69%	0.692	72%	0.717	S	S	*	*			trans	79.7	97.8	168.3	-52.1	167.8	0	0	0	118.5
1032	D	25.9	Very low	27.7	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	71%	0.712	S	S	*	*				59.5	131	123.1	-51.5	-20.5	0	0	0	126.1
1033	D	27.2	Very low	27.7	Very low	152 Å²	152	130.1 Å²	130.1	81%	0.813	72%	0.716	S	S	*	*			trans	58.3	119.1	140.4	-86.7	-6.3	0	0	0	123.4
1034	G	28.4	Very low	27.9	Very low	80 Å²	80	128.6 Å²	128.6	83%	0.825	71%	0.706	S	S	*	*			trans	-171.3	76.6	170.5	0	0	0	0	0	113.1
1035	K	27.5	Very low	28	Very low	189 Å²	189	128.6 Å²	128.6	82%	0.822	72%	0.718	S	S	*	*			trans	-68.1	140.7	-172.7	-60.5	161.3	-175.5	159.8	0	113.9
1036	A	30	Very low	28.8	Very low	96 Å²	96	123.3 Å²	123.3	79%	0.793	71%	0.713	S	S	*	*				-169.1	135	121.8	0	0	0	0	0	111.9
1037	N	27.3	Very low	28.9	Very low	126 Å²	126	131.2 Å²	131.2	67%	0.674	72%	0.721	S	S	*	*			trans	-107	142.8	171.5	-70.5	-24.4	0	0	0	110.7	I1040	N1037-I1040 HydrophobicContact CB-CD1 4.42Å
1038	S	30.1	Very low	29.1	Very low	88 Å²	88	130.6 Å²	130.6	62%	0.615	72%	0.722	S	S	*	*				-133.5	127.5	125.8	61.1	0	0	0	0	105.8	Q1065	S1038-Q1065 PolarHBondContact O-NE2 3.38Å
1039	L	28.8	Very low	28.7	Very low	80 Å²	80	131 Å²	131	42%	0.419	72%	0.721	S	S	.	*			cis	-149.1	158.6	50	-81.9	169.8	0	0	0	107.8	Q1065 S1066	L1039-Q1065 HydrophobicContact CB-CB 3.71Å; L1039-Q1065 HydrophobicContact CB-CG 3.82Å; L1039-Q1065 VanDerWaalsContact O-CA 3.23Å; L1039-Q1065 WeakPolarHBondContact O-CA 3.41Å; L1039-Q1065 PolarHBondContact O-N 3.47Å; L1039-S1066 CarbonylContact C-O 3.5Å; L1039-S1066 WeakPolarHBondContact CA-O 3.49Å; L1039-S1066 WeakPolarHBondContact CB-O 3.37Å; L1039-S1066 WeakPolarHBondContact CD2-O 3.28Å
1040	I	26.6	Very low	28.7	Very low	118 Å²	118	132.4 Å²	132.4	61%	0.605	72%	0.716	S	S	*	*			trans	-133.5	-73.9	-174.3	-48.5	176.5	0	0	0	120.1	N1037 S1066	N1037-I1040 HydrophobicContact CB-CD1 4.42Å; I1040-S1066 VanDerWaalsContact N-C 3.28Å; I1040-S1066 VanDerWaalsContact N-N 3.18Å; I1040-S1066 PolarHBondContact N-O 2.84Å; I1040-S1066 WeakPolarHBondContact O-CB 3.38Å
1041	P	35.5	Very low	28.9	Very low	49 Å²	49	131.3 Å²	131.3	32%	0.318	71%	0.71	S	S	.	*			trans	-98.5	172.8	-155.3	-5.9	29.9	0	0	0	115.6	S1066 S1067	P1041-S1066 CarbonylContact O-C 3.59Å; P1041-S1066 WeakPolarHBondContact O-CB 3.4Å; P1041-S1067 VanDerWaalsContact CD-C 3.46Å; P1041-S1067 PolarHBondContact O-N 2.79Å
1042	L	26.9	Very low	28.8	Very low	124 Å²	124	135.1 Å²	135.1	65%	0.649	72%	0.722	S	S	*	*			cis	-151.5	-174.3	18.4	-104.2	158.5	0	0	0	108.4
1043	Y	28.5	Very low	28.8	Very low	221 Å²	221	131.5 Å²	131.5	87%	0.867	72%	0.719	S	S	*	*			cis	-111.2	139.7	7.9	-75.5	-103.5	0	0	0	109.9
1044	S	30.3	Very low	28.9	Very low	71 Å²	71	133.5 Å²	133.5	50%	0.497	72%	0.72	S	S	.	*			cis	79.9	133.5	44.3	74.8	0	0	0	0	115.5
1045	T	30	Very low	28.7	Very low	139 Å²	139	136.7 Å²	136.7	85%	0.853	72%	0.717	S	S	*	*			cis	-164.4	168.7	-0.5	10.6	0	0	0	0	111.2
1046	P	40	Very low	28.7	Very low	119 Å²	119	133.1 Å²	133.1	77%	0.773	72%	0.716	S	S	*	*			trans	-120.5	-174.1	-160.2	45	-36.9	0	0	0	117.2
1047	R	27.5	Very low	28.4	Very low	237 Å²	237	139.3 Å²	139.3	89%	0.894	72%	0.721	S	S	*	*			trans	-156.6	154.2	156.6	-109.4	175.5	-166.6	-155.4	2.8	115.6
1048	S	28.5	Very low	28.8	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	72%	0.722	S	S	*	*			trans	65.6	122.3	160.1	41	0	0	0	0	123.8
1049	F	22.4	Very low	28.6	Very low	193 Å²	193	140.8 Å²	140.8	85%	0.846	73%	0.732	S	S	*	*			trans	-22.9	140.8	156.5	-61.4	-104.8	0	0	0	117.2
1050	H	28.9	Very low	28.5	Very low	159 Å²	159	141 Å²	141	74%	0.736	75%	0.745	S	S	*	*				-168.6	171.9	66	-120.1	-78	0	0	0	113.6
1051	N	29.4	Very low	28.4	Very low	126 Å²	126	145.6 Å²	145.6	67%	0.674	76%	0.756	S	S	*	*			trans	25.9	105.6	159.7	-58.7	-0.8	0	0	0	119.6
1052	F	25.4	Very low	27.9	Very low	214 Å²	214	148.3 Å²	148.3	94%	0.939	78%	0.775	S	S	*	*				63.9	114.3	82.6	-86.1	-76.8	0	0	0	116.8
1053	G	25.8	Very low	28	Very low	69 Å²	69	149.3 Å²	149.3	71%	0.711	79%	0.787	S	S	*	*			trans	167.7	37.9	170.5	0	0	0	0	0	120.7
1054	K	28.4	Very low	28	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	78%	0.78	S	S	*	*			trans	-171.1	131.4	164.7	-98.7	137.5	-172.4	-178.8	0	108.3
1055	I	26	Very low	27.8	Very low	147 Å²	147	147.6 Å²	147.6	75%	0.754	78%	0.782	S	S	*	*				96.2	122.3	57.5	-75.6	172.9	0	0	0	112.7
1056	S	26.9	Very low	27.8	Very low	115 Å²	115	144 Å²	144	80%	0.804	76%	0.763	S	S	*	*			trans	75.2	132.4	161.6	-64	0	0	0	0	123.4
1057	Y	22.3	Very low	27.3	Very low	226 Å²	226	142.2 Å²	142.2	89%	0.886	75%	0.754	S	S	*	*			trans	-87.5	-175.3	159.6	-75.3	-94.6	0	0	0	110.3
1058	P	36.1	Very low	27.4	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	74%	0.741	S	S	*	*			cis	-135.7	155.2	-18.4	18.4	6.7	0	0	0	117.6
1059	V	26.7	Very low	27.3	Very low	138 Å²	138	136 Å²	136	84%	0.836	73%	0.732	S	S	*	*			trans	76.6	99	134.1	176	0	0	0	0	123
1060	A	25.9	Very low	27.6	Very low	83 Å²	83	137 Å²	137	69%	0.686	73%	0.731	S	S	*	*				103	149.2	117.4	0	0	0	0	0	126.2
1061	Y	25.1	Very low	27.6	Very low	216 Å²	216	134.2 Å²	134.2	85%	0.847	73%	0.73	S	S	*	*			trans	102.2	96	157.8	-80.5	-77.8	0	0	0	124.2
1062	C	24.7	Very low	27.5	Very low	106 Å²	106	137.5 Å²	137.5	72%	0.716	74%	0.738	S	S	*	*			trans	45.9	130.5	136.1	-63.1	0	0	0	0	126.5
1063	T	30.2	Very low	27.6	Very low	144 Å²	144	135.7 Å²	135.7	88%	0.883	73%	0.733	S	S	*	*				-170.7	-168.9	127.5	16.7	0	0	0	0	112.8
1064	L	27.1	Very low	27.7	Very low	140 Å²	140	141 Å²	141	73%	0.733	74%	0.736	S	S	*	*			trans	-140.8	162.9	-158.3	-60.5	111.8	0	0	0	117.7
1065	Q	27.1	Very low	27.8	Very low	116 Å²	116	138.2 Å²	138.2	54%	0.542	73%	0.731	S	S	.	*			trans	97	120.9	151.3	-53.6	-149.3	-41.3	0	0	124.3	S1038 L1039	S1038-Q1065 PolarHBondContact O-NE2 3.38Å; L1039-Q1065 HydrophobicContact CB-CB 3.71Å; L1039-Q1065 HydrophobicContact CB-CG 3.82Å; L1039-Q1065 VanDerWaalsContact O-CA 3.23Å; L1039-Q1065 WeakPolarHBondContact O-CA 3.41Å; L1039-Q1065 PolarHBondContact O-N 3.47Å
1066	S	28.7	Very low	27.9	Very low	65 Å²	65	135.5 Å²	135.5	46%	0.455	73%	0.73	S	S	.	*			trans	-171.2	-154.7	152.5	-72	0	0	0	0	113.2	L1039 I1040 P1041	L1039-S1066 CarbonylContact C-O 3.5Å; L1039-S1066 WeakPolarHBondContact CA-O 3.49Å; L1039-S1066 WeakPolarHBondContact CB-O 3.37Å; L1039-S1066 WeakPolarHBondContact CD2-O 3.28Å; I1040-S1066 VanDerWaalsContact N-C 3.28Å; I1040-S1066 VanDerWaalsContact N-N 3.18Å; I1040-S1066 PolarHBondContact N-O 2.84Å; I1040-S1066 WeakPolarHBondContact O-CB 3.38Å; P1041-S1066 CarbonylContact O-C 3.59Å; P1041-S1066 WeakPolarHBondContact O-CB 3.4Å
1067	S	29.9	Very low	27.9	Very low	81 Å²	81	135.6 Å²	135.6	57%	0.566	73%	0.725	S	S	*	*			trans	-142.7	122.9	-163.2	61.9	0	0	0	0	121.5	P1041	P1041-S1067 VanDerWaalsContact CD-C 3.46Å; P1041-S1067 PolarHBondContact O-N 2.79Å
1068	Q	30.4	Very low	28.2	Very low	133 Å²	133	135.4 Å²	135.4	62%	0.621	72%	0.723	S	S	*	*			trans	62.6	168.1	158.1	-69.6	-143.7	35.6	0	0	118.3
1069	S	26.8	Very low	27.8	Very low	85 Å²	85	136.8 Å²	136.8	59%	0.594	73%	0.725	S	S	*	*			cis	-162	-163	-24.6	-91.4	0	0	0	0	108.2
1070	Y	28.4	Very low	27.9	Very low	212 Å²	212	134.2 Å²	134.2	83%	0.831	72%	0.718	S	S	*	*			cis	-150	-109	9.1	-145.9	-66.2	0	0	0	112.9
1071	S	27.8	Very low	27.9	Very low	101 Å²	101	136 Å²	136	71%	0.706	72%	0.721	S	S	*	*			trans	-148.5	172.3	-174.4	61	0	0	0	0	114.5
1072	K	29	Very low	28	Very low	195 Å²	195	132.9 Å²	132.9	85%	0.848	72%	0.718	S	S	*	*			cis	171.3	159.1	-33	-161.9	170.9	-172.2	177	0	108.3
1073	Q	27.6	Very low	28.1	Very low	177 Å²	177	132.6 Å²	132.6	83%	0.827	72%	0.718	S	S	*	*			trans	80.5	137.9	177.9	-59.1	-169.9	0.8	0	0	115.7
1074	K	27.9	Very low	28.1	Very low	181 Å²	181	131 Å²	131	79%	0.787	71%	0.712	S	S	*	*			cis	82.5	139.6	45.7	-75.1	-162.7	173.1	-172.9	0	113.4
1075	N	29	Very low	28	Very low	135 Å²	135	132.2 Å²	132.2	72%	0.722	72%	0.718	S	S	*	*			cis	-165.2	157.8	-0.3	-125.9	26	0	0	0	113.2
1076	A	28.6	Very low	28.1	Very low	90 Å²	90	133 Å²	133	74%	0.744	73%	0.726	S	S	*	*			trans	63.1	171.7	157.7	0	0	0	0	0	118
1077	V	26	Very low	28.2	Very low	116 Å²	116	138.2 Å²	138.2	70%	0.703	74%	0.741	S	S	*	*			cis	-158.4	143.3	28.4	171.4	0	0	0	0	111.7
1078	R	28.7	Very low	28.1	Very low	222 Å²	222	137.4 Å²	137.4	84%	0.838	75%	0.745	S	S	*	*				166.1	124	122.9	-117.1	123.9	-165.9	-152.6	3.6	118
1079	N	28.9	Very low	28.2	Very low	137 Å²	137	139 Å²	139	73%	0.733	75%	0.752	S	S	*	*				65.9	129.7	127	-68	26.2	0	0	0	127.3
1080	A	28.6	Very low	28.3	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	76%	0.761	S	S	*	*				91.5	97.8	124.5	0	0	0	0	0	123.9
1081	T	26.5	Very low	28.1	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	76%	0.761	S	S	*	*				34.2	123.3	124.6	57	0	0	0	0	122.2
1082	N	26.8	Very low	28.1	Very low	150 Å²	150	140 Å²	140	80%	0.802	76%	0.759	S	S	*	*				-179.1	160.4	99	-104.2	-21.2	0	0	0	117.1
1083	S	27	Very low	28	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	75%	0.748	S	S	*	*			trans	63.9	136	147.7	57.9	0	0	0	0	124.2
1084	S	29.4	Very low	28	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	74%	0.74	S	S	*	*			trans	65.8	119.8	152.3	-53.6	0	0	0	0	118
1085	L	25.6	Very low	27.9	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	74%	0.735	S	S	*	*			cis	72.1	155.3	21	-109.7	177.9	0	0	0	115.9
1086	L	29.2	Very low	27.9	Very low	132 Å²	132	133.8 Å²	133.8	69%	0.691	73%	0.733	S	S	*	*			trans	80.1	127.6	-169.3	-50.1	-177.7	0	0	0	114.8
1087	F	30	Very low	27.9	Very low	176 Å²	176	134.8 Å²	134.8	77%	0.772	73%	0.729	S	S	*	*			cis	-137.5	158.6	-15.2	-82.3	-82.6	0	0	0	107.6
1088	G	28.3	Very low	28.1	Very low	63 Å²	63	137 Å²	137	65%	0.649	74%	0.736	S	S	*	*			cis	136.3	150.3	-3	0	0	0	0	0	112.7
1089	Q	33	Very low	28.2	Very low	166 Å²	166	131.9 Å²	131.9	78%	0.776	74%	0.735	S	S	*	*			trans	79.2	128.2	169.6	-57.4	-173.6	-1.3	0	0	118.6
1090	N	27.7	Very low	28.2	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	73%	0.73	S	S	*	*			cis	-157.8	152.1	-18.8	-126.6	17.1	0	0	0	113.2
1091	E	24.7	Very low	28.1	Very low	178 Å²	178	132.2 Å²	132.2	83%	0.832	74%	0.739	S	S	*	*			trans	-73.9	173.3	155.4	-54.8	170.2	133.3	0	0	107.9
1092	S	26.5	Very low	28.2	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	74%	0.737	S	S	*	*			cis	-160.9	-166.5	29	58.4	0	0	0	0	109.1
1093	D	27.5	Very low	28.1	Very low	115 Å²	115	130 Å²	130	62%	0.615	74%	0.735	S	S	*	*			cis	-166.4	175.2	20.9	-137.1	-37.8	0	0	0	115.7
1094	F	27.3	Very low	27.9	Very low	149 Å²	149	130.9 Å²	130.9	65%	0.654	74%	0.74	S	S	*	*			trans	67.8	98.7	155.4	-70.8	-59.9	0	0	0	122.2
1095	Q	26.9	Very low	28.1	Very low	146 Å²	146	130.9 Å²	130.9	68%	0.682	74%	0.737	S	S	*	*				73.9	152	128.8	-79.6	169.3	9.9	0	0	119.4
1096	H	28.9	Very low	28	Very low	147 Å²	147	131.3 Å²	131.3	68%	0.681	74%	0.739	S	S	*	*			cis	-145.6	140.8	10	-133.5	-71.6	0	0	0	111.9
1097	V	29.4	Very low	27.7	Very low	111 Å²	111	128.4 Å²	128.4	67%	0.673	74%	0.74	S	S	*	*			trans	66.3	116.9	152.3	159.9	0	0	0	0	121.4
1098	L	28.9	Very low	27.6	Very low	162 Å²	162	129.7 Å²	129.7	85%	0.848	75%	0.746	S	S	*	*			trans	26.1	137.7	134.9	-49.1	168.2	0	0	0	119.9
1099	S	30.6	Very low	27.3	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	76%	0.756	S	S	*	*			cis	-147.8	153	6.4	55.2	0	0	0	0	109.4
1100	G	29.3	Very low	27	Very low	60 Å²	60	135.4 Å²	135.4	62%	0.619	74%	0.744	S	S	*	*				108.8	99.5	67.2	0	0	0	0	0	108.9
1101	N	25.9	Very low	26.8	Very low	166 Å²	166	138.5 Å²	138.5	89%	0.888	75%	0.746	S	S	*	*				56.1	131.2	90.7	-68.9	-19.6	0	0	0	113.7
1102	S	29.4	Very low	26.8	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	74%	0.737	S	S	*	*			cis	-166.8	140	10.9	49.8	0	0	0	0	114.2
1103	V	24.1	Very low	26.6	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	74%	0.738	S	S	*	*				39.5	107.4	120.3	-173.3	0	0	0	0	120.5
1104	C	23.4	Very low	26.5	Very low	119 Å²	119	140 Å²	140	80%	0.804	75%	0.746	S	S	*	*			trans	61.1	175.9	142.7	-62	0	0	0	0	119.8
1105	P	32.9	Very low	26.4	Very low	109 Å²	109	139.2 Å²	139.2	71%	0.708	75%	0.748	S	S	*	*			cis	-127.8	173.1	-5.6	40.9	-25.2	0	0	0	116.6
1106	I	23.9	Very low	26.4	Very low	175 Å²	175	141.2 Å²	141.2	90%	0.897	76%	0.757	S	S	*	*			trans	16.9	116.4	147.8	-52.6	168.1	0	0	0	118.4
1107	G	24	Very low	26.4	Very low	70 Å²	70	140.9 Å²	140.9	72%	0.722	76%	0.76	S	S	*	*			trans	171.9	89.1	160.7	0	0	0	0	0	120.4
1108	K	26.3	Very low	26.4	Very low	203 Å²	203	142.2 Å²	142.2	88%	0.883	77%	0.769	S	S	*	*			trans	56.2	120.2	151.2	-63	175	-178.9	171.9	0	120.9
1109	R	23.1	Very low	26.6	Very low	229 Å²	229	144.6 Å²	144.6	86%	0.864	77%	0.767	S	S	*	*			trans	83.2	139	138.7	-76.3	-177.8	169.8	175.2	-3	122.5
1110	K	26.1	Very low	26.6	Very low	121 Å²	121	150.5 Å²	150.5	53%	0.526	77%	0.771	S	S	.	*			trans	66.9	112.1	151.4	-73	-171.2	173.4	-169.5	0	119.2	E532	E532-K1110 IonicContact OE1-NZ 3.2Å
1111	Y	22.8	Very low	26.5	Very low	211 Å²	211	154.2 Å²	154.2	83%	0.827	78%	0.775	S	S	*	*			trans	-57.8	135.4	165.8	-73.7	-90.4	0	0	0	113.7	F1113	Y1111-F1113 HydrophobicContact CD1-CD2 4.44Å; Y1111-F1113 HydrophobicContact CD1-CE2 4.21Å; Y1111-F1113 HydrophobicContact CE1-CE2 4.4Å
1112	K	25.1	Very low	26.6	Very low	148 Å²	148	153.9 Å²	153.9	64%	0.643	77%	0.768	S	S	*	*			trans	-149.2	87.3	148.7	-141.6	172.5	-173	177.3	0	111.6	S1114	K1112-S1114 PolarHBondContact O-N 3.28Å
1113	F	23.6	Very low	26.6	Very low	159 Å²	159	153.4 Å²	153.4	70%	0.697	77%	0.765	S	S	*	*			trans	-48.3	132	169.2	-87.3	-87.3	0	0	0	112	Y1111	Y1111-F1113 HydrophobicContact CD1-CD2 4.44Å; Y1111-F1113 HydrophobicContact CD1-CE2 4.21Å; Y1111-F1113 HydrophobicContact CE1-CE2 4.4Å
1114	S	23.9	Very low	26.8	Very low	112 Å²	112	152 Å²	152	78%	0.783	77%	0.767	S	S	*	*			trans	-141.7	120.2	164.6	-175.1	0	0	0	0	109.6	K1112	K1112-S1114 PolarHBondContact O-N 3.28Å
1115	I	26.6	Very low	27.1	Very low	134 Å²	134	151.7 Å²	151.7	69%	0.687	76%	0.757	S	S	*	*			trans	-148.1	108.7	164	-56.8	-179.6	0	0	0	108.6
1116	Q	27.3	Very low	27.1	Very low	188 Å²	188	156.2 Å²	156.2	88%	0.879	76%	0.76	S	S	*	*			trans	-147.9	122.3	135.5	-64.8	-160.4	-27.2	0	0	105.8
1117	N	28.1	Very low	27.3	Very low	139 Å²	139	158.3 Å²	158.3	74%	0.743	76%	0.757	S	S	*	*			cis	89.2	101.2	45.1	-82.7	-5.4	0	0	0	115.3
1118	T	30.3	Very low	27.6	Very low	140 Å²	140	166.3 Å²	166.3	86%	0.859	77%	0.765	S	S	*	*			trans	-145.8	149.5	152.8	46.4	0	0	0	0	107.9
1119	R	31.9	Very low	27.7	Very low	212 Å²	212	164.2 Å²	164.2	80%	0.8	76%	0.764	S	S	*	*			cis	155.4	148.8	-26.1	-109.2	-168.8	172.4	-169.6	1.1	106.8
1120	R	29.8	Very low	28	Very low	240 Å²	240	162.7 Å²	162.7	91%	0.906	76%	0.759	S	S	*	*			trans	100.5	157.4	-174.2	-74.5	-179.6	162.5	158.1	-4.9	113.5
1121	I	28.3	Very low	28.2	Very low	137 Å²	137	162.6 Å²	162.6	70%	0.703	76%	0.759	S	S	*	*			cis	-170.9	158.6	-37.2	-126.3	-172.5	0	0	0	107.8
1122	Q	28.6	Very low	28.5	Very low	159 Å²	159	161 Å²	161	74%	0.743	75%	0.753	S	S	*	*			cis	-149.3	-62	-7.2	-164.6	177.1	-101.5	0	0	115.3
1123	S	28.4	Very low	28.6	Very low	91 Å²	91	160.4 Å²	160.4	64%	0.636	76%	0.756	S	S	*	*			trans	-174.1	159.2	-151.1	55.5	0	0	0	0	112.3
1124	A	28.1	Very low	29	Very low	97 Å²	97	158.5 Å²	158.5	80%	0.802	76%	0.758	S	S	*	*			cis	-143.3	-155.2	4.4	0	0	0	0	0	108.7
1125	D	31	Very low	29.2	Very low	111 Å²	111	157.5 Å²	157.5	59%	0.594	75%	0.751	S	S	*	*			cis	-158	168.9	2.7	-177.9	20.5	0	0	0	108.5
1126	R	32	Very low	29.2	Very low	204 Å²	204	158.5 Å²	158.5	77%	0.77	76%	0.757	S	S	*	*			trans	68.2	145.3	165.1	-70.8	155.9	-152.2	-149.5	5	119.4
1127	R	28.9	Very low	29.3	Very low	219 Å²	219	159 Å²	159	83%	0.826	76%	0.756	S	S	*	*			cis	-169.8	162	-28.7	-122	179.3	-160.6	-166.4	1.7	109.7
1128	R	30	Very low	29	Very low	239 Å²	239	158 Å²	158	90%	0.902	76%	0.759	S	S	*	*			trans	74.3	109.2	-179.6	-54.7	178.5	177.7	172.4	-0.1	113
1129	N	28.5	Very low	29.2	Very low	158 Å²	158	156.4 Å²	156.4	85%	0.845	75%	0.751	S	S	*	*			cis	79.6	102.6	33.5	-73.6	-8.3	0	0	0	117.6
1130	Y	28.2	Very low	29	Very low	198 Å²	198	151.9 Å²	151.9	78%	0.776	75%	0.746	S	S	*	*				-173	155.3	126.9	-107.6	-147.5	0	0	0	106
1131	K	30.1	Very low	28.7	Very low	118 Å²	118	145 Å²	145	51%	0.513	73%	0.734	S	S	.	*	S	Bend	cis	-167.1	131.7	-26.2	-105.3	-177.4	178.2	169.3	0	103.6
1132	Y	29.8	Very low	28.6	Very low	178 Å²	178	143.9 Å²	143.9	70%	0.698	73%	0.734	S	S	*	*			cis	-141.4	141.2	-2.9	-87.6	-61.3	0	0	0	107
1133	N	28.3	Very low	28.5	Very low	135 Å²	135	142.5 Å²	142.5	72%	0.722	73%	0.731	S	S	*	*				51.3	135.5	87.7	-72	13.3	0	0	0	115.9
1134	T	30	Very low	28.3	Very low	120 Å²	120	146 Å²	146	74%	0.736	74%	0.739	S	S	*	*			cis	-177.2	160.6	-12.5	23.2	0	0	0	0	107.1
1135	S	29.5	Very low	28.2	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	74%	0.736	S	S	*	*			cis	-165.4	169.1	-15.8	55.5	0	0	0	0	109.3
1136	L	27.1	Very low	27.8	Very low	154 Å²	154	146.9 Å²	146.9	81%	0.806	75%	0.747	S	S	*	*			trans	-67	167.2	170.8	-54.4	79.8	0	0	0	112.2
1137	K	27.5	Very low	27.5	Very low	199 Å²	199	143.8 Å²	143.8	87%	0.865	75%	0.745	S	S	*	*				-177.7	125.8	108.7	-96.9	169.4	-177.3	177.6	0	115.2
1138	C	23.4	Very low	27.4	Very low	119 Å²	119	137.9 Å²	137.9	80%	0.804	74%	0.737	S	S	*	*			trans	-80.3	149.9	130	-160.9	0	0	0	0	105.5
1139	P	33.5	Very low	27.2	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	74%	0.736	S	S	*	*			cis	-139.3	-152.8	47	40.5	-16.6	0	0	0	112.7
1140	V	28.1	Very low	27	Very low	116 Å²	116	134.4 Å²	134.4	70%	0.703	74%	0.736	S	S	*	*				-151.6	148	59.3	168.9	0	0	0	0	111
1141	C	23.1	Very low	27.3	Very low	95 Å²	95	129.1 Å²	129.1	64%	0.642	73%	0.726	S	S	*	*			trans	-122.8	137.5	149.9	-73.7	0	0	0	0	109.1
1142	V	26	Very low	27.3	Very low	115 Å²	115	132.7 Å²	132.7	70%	0.697	74%	0.737	S	S	*	*			trans	59.9	110.2	169.6	-169.7	0	0	0	0	117.6	M1144	V1142-M1144 HydrophobicContact CG1-CG 4.23Å
1143	N	26.4	Very low	27	Very low	129 Å²	129	130.5 Å²	130.5	69%	0.69	73%	0.733	S	S	*	*				-140.3	124.4	120.4	-101.2	6.6	0	0	0	105.6
1144	M	25	Very low	27.1	Very low	165 Å²	165	132.2 Å²	132.2	81%	0.813	73%	0.734	S	S	*	*				82	130.9	70.5	-69	-91.6	-81.1	0	0	111.6	V1142	V1142-M1144 HydrophobicContact CG1-CG 4.23Å
1145	G	26.5	Very low	27	Very low	70 Å²	70	135.9 Å²	135.9	72%	0.722	74%	0.74	S	S	*	*			trans	169.3	59	-177.2	0	0	0	0	0	117.1
1146	L	23	Very low	27.2	Very low	157 Å²	157	137.3 Å²	137.3	82%	0.822	75%	0.747	S	S	*	*				-138	145.5	124.3	-70.6	-175.8	0	0	0	105.2
1147	D	25.8	Very low	27.1	Very low	138 Å²	138	136 Å²	136	74%	0.738	74%	0.741	S	S	*	*	S	Bend	cis	-108.6	148.2	15.1	-62.6	-59.2	0	0	0	115.9
1148	S	25.5	Very low	27.4	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	73%	0.734	S	S	*	*			trans	28.7	112	133.6	-51.1	0	0	0	0	120.8
1149	V	26.8	Very low	27.7	Very low	146 Å²	146	135.2 Å²	135.2	89%	0.885	73%	0.728	S	S	*	*				-177.7	143.3	110	149	0	0	0	0	110.6
1150	H	23.5	Very low	27.3	Very low	179 Å²	179	136 Å²	136	83%	0.829	73%	0.731	S	S	*	*			trans	-149.5	171.2	178.2	-125.8	-18.7	0	0	0	106.8
1151	P	35.1	Very low	27.3	Very low	87 Å²	87	137.4 Å²	137.4	57%	0.565	73%	0.73	S	S	*	*			cis	-130.6	-140	-10.3	41.9	-24.3	0	0	0	112.7
1152	Y	28.4	Very low	27.5	Very low	193 Å²	193	141.5 Å²	141.5	76%	0.757	74%	0.737	S	S	*	*			trans	79.1	135.3	177.8	-65	-83	0	0	0	117.8
1153	E	24.8	Very low	27.5	Very low	131 Å²	131	139.3 Å²	139.3	61%	0.612	74%	0.738	S	S	*	*			cis	-168.5	176.7	-21.9	-138.5	-173.4	-158.1	0	0	114
1154	K	29.3	Very low	27.7	Very low	172 Å²	172	140.7 Å²	140.7	75%	0.748	75%	0.745	S	S	*	*			trans	79.9	103.3	155.5	-75.2	179.2	172.7	76.6	0	121.5
1155	F	27.9	Very low	28.4	Very low	197 Å²	197	137.4 Å²	137.4	86%	0.864	74%	0.736	S	S	*	*			trans	-72	159.5	138.6	-84.5	-102.6	0	0	0	111
1156	P	35.1	Very low	28.4	Very low	120 Å²	120	143.5 Å²	143.5	78%	0.779	75%	0.746	S	S	*	*				-145.7	177.5	106.1	34.9	-18.3	0	0	0	113.8
1157	D	25.5	Very low	28.6	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	74%	0.742	S	S	*	*			cis	-168.3	-159.2	-37.9	-157.6	-98.1	0	0	0	108.3
1158	H	33.4	Very low	29.2	Very low	153 Å²	153	139.6 Å²	139.6	71%	0.708	74%	0.74	S	S	*	*			trans	72.4	132.9	174.7	-62.4	-83.7	0	0	0	119.2
1159	Q	29.5	Very low	29.5	Very low	149 Å²	149	143.4 Å²	143.4	70%	0.696	74%	0.744	S	S	*	*			cis	-164.4	164.6	-25.9	-126.8	172.4	-3.4	0	0	110.8
1160	V	25.3	Very low	29.8	Very low	123 Å²	123	143.1 Å²	143.1	75%	0.745	74%	0.737	S	S	*	*			trans	-11.4	145	167.3	-118.1	0	0	0	0	118.2
1161	E	27	Very low	30.2	Very low	145 Å²	145	137.3 Å²	137.3	68%	0.678	73%	0.726	S	S	*	*			cis	-129.2	172.2	13.1	-39.5	-170	90.1	0	0	110.9
1162	F	28.4	Very low	30	Very low	181 Å²	181	140 Å²	140	79%	0.794	73%	0.733	S	S	*	*			cis	-141.4	177.2	12	-97.8	-62.6	0	0	0	108.9
1163	G	25.5	Very low	30.2	Very low	69 Å²	69	137.4 Å²	137.4	71%	0.711	73%	0.731	S	S	*	*			cis	164.5	77.4	1.9	0	0	0	0	0	110.4
1164	D	30.4	Very low	30.5	Very low	158 Å²	158	136.2 Å²	136.2	85%	0.845	74%	0.744	S	S	*	*			trans	-156.2	161.4	-173.5	-140.5	-4.1	0	0	0	106.3
1165	P	39.3	Very low	30.4	Very low	97 Å²	97	131.3 Å²	131.3	63%	0.63	74%	0.742	S	S	*	*			cis	-131.2	171	-7.1	42.3	-27.5	0	0	0	114.7
1166	H	27.8	Very low	30.4	Very low	198 Å²	198	128 Å²	128	92%	0.917	74%	0.743	S	S	*	*			trans	-164.5	175.5	158.6	-99.3	-61.2	0	0	0	113.7
1167	S	25.8	Very low	30	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	74%	0.738	S	S	*	*			trans	-137.3	-165.7	-168	56.9	0	0	0	0	113
1168	P	39.4	Very low	30.1	Very low	105 Å²	105	131 Å²	131	68%	0.682	75%	0.749	S	S	*	*				-129.5	158.1	-75.6	39.4	-24.1	0	0	0	117.4
1169	F	31.8	Very low	29.8	Very low	175 Å²	175	135.5 Å²	135.5	77%	0.768	76%	0.76	S	S	*	*			trans	50.5	114.3	149.4	-105.7	-81.9	0	0	0	123.8
1170	L	31.6	Very low	29.8	Very low	140 Å²	140	134 Å²	134	73%	0.733	76%	0.764	S	S	*	*				-164.3	153.6	124.1	-143.7	86.7	0	0	0	113.7	M1172	L1170-M1172 HydrophobicContact CD1-SD 4.25Å; L1170-M1172 HydrophobicContact CD2-SD 4.1Å; L1170-M1172 HydrophobicContact CG-SD 3.89Å
1171	G	32.9	Very low	29.8	Very low	57 Å²	57	133.2 Å²	133.2	59%	0.588	76%	0.755	S	S	*	*			trans	119.8	116.8	178.4	0	0	0	0	0	113.3
1172	M	32	Very low	30	Very low	144 Å²	144	132.2 Å²	132.2	71%	0.709	76%	0.761	S	S	*	*			cis	82.8	133.7	-2.7	-52.7	168.1	56.9	0	0	117.3	L1170	L1170-M1172 HydrophobicContact CD1-SD 4.25Å; L1170-M1172 HydrophobicContact CD2-SD 4.1Å; L1170-M1172 HydrophobicContact CG-SD 3.89Å
1173	L	32.1	Very low	29.9	Very low	139 Å²	139	128.8 Å²	128.8	73%	0.728	76%	0.76	S	S	*	*			cis	-166.6	149.2	-7.7	-119.7	-176.5	0	0	0	115.2
1174	A	30.4	Very low	30.2	Very low	106 Å²	106	130.5 Å²	130.5	88%	0.876	76%	0.758	S	S	*	*	S	Bend		164.1	123.8	123.5	0	0	0	0	0	110.5
1175	G	27	Very low	30	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	76%	0.757	S	S	*	*	S	Bend	cis	-155.6	177.7	-16.2	0	0	0	0	0	107.1
1176	S	28.3	Very low	29.2	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	77%	0.766	S	S	*	*	S	Bend	cis	-159.3	143.2	2.1	52.7	0	0	0	0	108.6
1177	G	26.2	Very low	29	Very low	64 Å²	64	133.3 Å²	133.3	66%	0.66	76%	0.762	S	S	*	*			cis	180	154.8	-8.3	0	0	0	0	0	112.8
1178	R	27.5	Very low	28.9	Very low	244 Å²	244	135.2 Å²	135.2	92%	0.921	76%	0.759	S	S	*	*			trans	63.1	87	163.1	-52.6	-178.4	-169.8	-121.2	0.9	117.9
1179	R	27.2	Very low	28.2	Very low	248 Å²	248	138 Å²	138	94%	0.936	77%	0.767	S	S	*	*	P	Polyproline II helix		-78.1	135	119.9	-67.8	-175.9	-178.6	-175.2	1.1	107.5
1180	P	30.4	Very low	27.8	Very low	119 Å²	119	135.5 Å²	135.5	77%	0.773	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-99.7	153.3	169	34.9	-29.7	0	0	0	112.6
1181	N	25.2	Very low	27.5	Very low	105 Å²	105	137.3 Å²	137.3	56%	0.561	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-85.3	162.1	-178.7	-57.6	-19	0	0	0	112.6
1182	P	31.7	Very low	27.3	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-98.7	119	152	34	-25.2	0	0	0	111.3
1183	S	25.3	Very low	27	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	77%	0.771	S	S	*	*			trans	-165.8	155.9	164.3	-83.7	0	0	0	0	109.8
1184	P	32.8	Very low	26.7	Very low	104 Å²	104	141 Å²	141	68%	0.675	78%	0.775	S	S	*	*				-124.3	173	-129.2	43.4	-35	0	0	0	117.5
1185	N	24.6	Very low	26.6	Very low	154 Å²	154	141 Å²	141	82%	0.824	77%	0.766	S	S	*	*			trans	61.9	121.1	150.9	-62.5	-10	0	0	0	121
1186	M	22.9	Very low	26.4	Very low	167 Å²	167	145.1 Å²	145.1	82%	0.823	77%	0.77	S	S	*	*				-152.2	155.1	113.1	-134.9	-177.5	179.2	0	0	112
1187	K	25	Very low	26.2	Very low	191 Å²	191	146.6 Å²	146.6	83%	0.83	77%	0.766	S	S	*	*			trans	72.3	95.4	-158.7	-58.5	-171	175.8	-174.3	0	112
1188	E	21.8	Very low	26.4	Very low	147 Å²	147	148.7 Å²	148.7	69%	0.687	77%	0.769	S	S	*	*				53.2	84.4	50.5	-47.8	-175	116.5	0	0	112.7
1189	I	26.6	Very low	27.1	Very low	163 Å²	163	142.6 Å²	142.6	84%	0.836	76%	0.76	S	S	*	*				-121.8	113.7	127.8	-71	-175	0	0	0	105.4
1190	N	21.9	Very low	26.9	Very low	124 Å²	124	139.2 Å²	139.2	66%	0.663	76%	0.755	S	S	*	*			trans	-72.6	172.3	163.6	-86.7	-49.5	0	0	0	109.3
1191	H	26.2	Very low	26.7	Very low	178 Å²	178	142.4 Å²	142.4	82%	0.824	76%	0.76	S	S	*	*			trans	75.3	130	-171.5	-39.2	-69.3	0	0	0	112.2
1192	S	27.4	Very low	26.6	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	77%	0.774	S	S	*	*			cis	-158.6	151.4	2	54.7	0	0	0	0	113.7
1193	N	26.5	Very low	26.2	Very low	135 Å²	135	148 Å²	148	72%	0.722	78%	0.777	S	S	*	*			trans	61.5	124.4	137.1	-69.4	0.7	0	0	0	122.5
1194	F	26.1	Very low	26.2	Very low	185 Å²	185	146.3 Å²	146.3	81%	0.811	77%	0.765	S	S	*	*			trans	86.1	145	134.6	-83.7	-119.3	0	0	0	118.9
1195	P	28.4	Very low	25.9	Very low	105 Å²	105	146.2 Å²	146.2	68%	0.682	77%	0.768	S	S	*	*				-145	-167.6	-123.2	41.5	-19.8	0	0	0	116
1196	I	22.4	Very low	25.8	Very low	155 Å²	155	144 Å²	144	80%	0.795	76%	0.756	S	S	*	*			trans	-39.5	132.8	153.1	-54.4	156.7	0	0	0	112
1197	I	24	Very low	26	Very low	158 Å²	158	144.9 Å²	144.9	81%	0.81	76%	0.755	S	S	*	*			trans	-170.4	153.5	136.6	-103	157.4	0	0	0	110.1
1198	P	31.3	Very low	26	Very low	109 Å²	109	142.6 Å²	142.6	71%	0.708	75%	0.75	S	S	*	*			trans	-112.5	-170.1	-147.7	45.6	-35.9	0	0	0	113.2
1199	P	40.6	Very low	26.3	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	76%	0.755	S	S	*	*			trans	-93.7	154.7	-160	37	-35.1	0	0	0	115.3
1200	H	24.5	Very low	26.3	Very low	177 Å²	177	141.8 Å²	141.8	82%	0.819	75%	0.747	S	S	*	*			trans	-162.9	174.3	134.8	-123.7	-93.3	0	0	0	111.8
1201	E	24.4	Very low	26.5	Very low	187 Å²	187	144.8 Å²	144.8	87%	0.874	75%	0.75	S	S	*	*			trans	76.9	164.5	171.2	-57	-152.8	136.9	0	0	119.4
1202	M	24.9	Very low	26.6	Very low	176 Å²	176	144.6 Å²	144.6	87%	0.867	75%	0.747	S	S	*	*			trans	-107.2	157.5	-157.6	-59.2	156	58.2	0	0	111.9
1203	I	23.4	Very low	26.7	Very low	169 Å²	169	143.5 Å²	143.5	87%	0.867	74%	0.737	S	S	*	*			trans	170.2	154.4	131.6	-91.5	157.7	0	0	0	112.2
1204	S	25.3	Very low	26.9	Very low	75 Å²	75	143.8 Å²	143.8	52%	0.524	73%	0.733	S	S	.	*			trans	75.9	123.2	168.2	179	0	0	0	0	117.7	D1206	S1204-D1206 VanDerWaalsContact C-N 3.33Å; S1204-D1206 PolarHBondContact OG-N 2.9Å; S1204-D1206 PolarHBondContact OG-OD2 2.93Å
1205	S	24.9	Very low	27.2	Very low	103 Å²	103	142 Å²	142	72%	0.72	73%	0.728	S	S	*	*	S	Bend	trans	-82.9	-2.4	175.4	33.8	0	0	0	0	114	K1207	S1205-K1207 PolarHBondContact O-N 3.29Å
1206	D	23.9	Very low	27.4	Very low	108 Å²	108	142.9 Å²	142.9	58%	0.578	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	29.5	-144	-40.9	-52.6	0	0	0	113.1	S1204	S1204-D1206 VanDerWaalsContact C-N 3.33Å; S1204-D1206 PolarHBondContact OG-N 2.9Å; S1204-D1206 PolarHBondContact OG-OD2 2.93Å
1207	K	25.6	Very low	27.8	Very low	184 Å²	184	140.4 Å²	140.4	80%	0.8	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	15.4	-173.7	-71.4	-172.7	177.6	174.3	0	116	S1205	S1205-K1207 PolarHBondContact O-N 3.29Å
1208	I	26.9	Very low	28.3	Very low	143 Å²	143	137.5 Å²	137.5	73%	0.733	69%	0.694	S	S	*	*	S	Bend	trans	-97.7	-29.8	175	-66.8	-179.8	0	0	0	112.8	N1210	I1208-N1210 PolarHBondContact O-N 3.31Å
1209	E	26.2	Very low	28.3	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-21.3	-178.7	-70.7	-168.6	120.7	0	0	115.1	T1213	E1209-T1213 PolarHBondContact O-OG1 2.83Å; E1209-T1213 VanDerWaalsContact O-OG1 3.05Å
1210	N	27.2	Very low	27.9	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	5.3	-172.9	-81.7	-47.3	0	0	0	115.7	I1208	I1208-N1210 PolarHBondContact O-N 3.31Å
1211	Y	27.3	Very low	28.4	Very low	187 Å²	187	134.5 Å²	134.5	73%	0.733	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-24.8	174.8	-145.5	-99.4	0	0	0	113.7
1212	F	28.2	Very low	28.9	Very low	175 Å²	175	128.7 Å²	128.7	77%	0.768	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-29.7	178.6	-88.1	-86.9	0	0	0	113.9
1213	T	29.4	Very low	29.3	Very low	75 Å²	75	123.5 Å²	123.5	46%	0.46	61%	0.609	S	S	.	*	H	α-helix	trans	-74.9	-21.8	-177.6	42.5	0	0	0	0	114.1	E1209 N1217	E1209-T1213 PolarHBondContact O-OG1 2.83Å; E1209-T1213 VanDerWaalsContact O-OG1 3.05Å; T1213-N1217 PolarHBondContact O-ND2 2.74Å
1214	H	30.8	Very low	29.7	Very low	141 Å²	141	123.5 Å²	123.5	65%	0.653	60%	0.603	S	S	*	*	H	α-helix	trans	-90.2	-21.6	-172.6	-145.7	-57	0	0	0	114.9
1215	Q	32.3	Very low	30.2	Very low	148 Å²	148	125.6 Å²	125.6	69%	0.692	60%	0.604	S	S	*	*	H	α-helix	trans	-84	-31.2	173	-73	-166.1	-10.7	0	0	113	N1217 F1219	Q1215-N1217 PolarHBondContact O-N 2.98Å; Q1215-F1219 WeakPolarHBondContact O-CB 3.4Å; Q1215-F1219 PolarHBondContact O-N 2.84Å; Q1215-F1219 VanDerWaalsContact O-N 3.16Å
1216	H	31.6	Very low	30.5	Very low	123 Å²	123	126.3 Å²	126.3	57%	0.569	59%	0.594	S	S	*	*	H	α-helix	trans	-67.7	-36.8	-178	-158	85.2	0	0	0	112.6	L1220	H1216-L1220 WeakPolarHBondContact O-CG 3.38Å; H1216-L1220 PolarHBondContact O-N 3.06Å; H1216-L1220 VanDerWaalsContact O-N 3.14Å
1217	N	31.2	Very low	30.9	Very low	102 Å²	102	127.7 Å²	127.7	55%	0.545	60%	0.6	S	S	.	*	H	α-helix	trans	-75.8	-34.3	-179.9	-75.6	-63.1	0	0	0	113.6	T1213 Q1215 L1220 K1221	T1213-N1217 PolarHBondContact O-ND2 2.74Å; Q1215-N1217 PolarHBondContact O-N 2.98Å; N1217-L1220 PolarHBondContact O-N 3.47Å; N1217-K1221 PolarHBondContact O-N 2.93Å
1218	E	34.4	Very low	31	Very low	98 Å²	98	122 Å²	122	46%	0.458	59%	0.594	S	S	.	*	H	α-helix	trans	-67.7	-41.9	172.8	-73.5	-70.5	103.6	0	0	111	L1220 K1221 D1222	E1218-L1220 VanDerWaalsContact C-N 3.32Å; E1218-L1220 PolarHBondContact O-N 3.48Å; E1218-K1221 WeakPolarHBondContact O-CB 3.23Å; E1218-K1221 PolarHBondContact O-N 2.8Å; E1218-K1221 IonicContact OE1-NZ 2.84Å; E1218-K1221 PolarHBondContact OE1-NZ 3.01Å; E1218-D1222 WeakPolarHBondContact O-CB 3.28Å; E1218-D1222 PolarHBondContact O-N 3.45Å
1219	F	31.6	Very low	31.1	Very low	128 Å²	128	121.3 Å²	121.3	56%	0.561	59%	0.587	S	S	*	*	H	α-helix	trans	-61.4	-38	175.1	-170.3	-114.4	0	0	0	112.7	Q1215 D1222 I1223	Q1215-F1219 WeakPolarHBondContact O-CB 3.4Å; Q1215-F1219 PolarHBondContact O-N 2.84Å; Q1215-F1219 VanDerWaalsContact O-N 3.16Å; F1219-D1222 PolarHBondContact O-N 3.28Å; F1219-I1223 HydrophobicContact CD1-CD1 3.85Å; F1219-I1223 HydrophobicContact CE1-CD1 3.53Å; F1219-I1223 HydrophobicContact CE2-CD1 4.43Å; F1219-I1223 HydrophobicContact CG-CD1 4.44Å; F1219-I1223 HydrophobicContact CZ-CD1 3.85Å; F1219-I1223 WeakPolarHBondContact O-CG1 3.46Å; F1219-I1223 PolarHBondContact O-N 3.35Å
1220	L	31.6	Very low	31.1	Very low	78 Å²	78	120.6 Å²	120.6	41%	0.408	58%	0.584	S	S	.	*	H	α-helix	trans	-75	-26.2	175.7	-74.6	172.4	0	0	0	114.1	H1216 N1217 E1218 K1224	H1216-L1220 WeakPolarHBondContact O-CG 3.38Å; H1216-L1220 PolarHBondContact O-N 3.06Å; H1216-L1220 VanDerWaalsContact O-N 3.14Å; N1217-L1220 PolarHBondContact O-N 3.47Å; E1218-L1220 VanDerWaalsContact C-N 3.32Å; E1218-L1220 PolarHBondContact O-N 3.48Å; L1220-K1224 WeakPolarHBondContact O-CB 3.14Å; L1220-K1224 WeakPolarHBondContact O-CG 3.43Å; L1220-K1224 PolarHBondContact O-N 2.88Å
1221	K	35.1	Very low	31.1	Very low	131 Å²	131	123.4 Å²	123.4	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-68	-49.4	165.5	-79	-175.8	-168.6	157.6	0	111	N1217 E1218 I1223 K1224 Q1225	N1217-K1221 PolarHBondContact O-N 2.93Å; E1218-K1221 WeakPolarHBondContact O-CB 3.23Å; E1218-K1221 PolarHBondContact O-N 2.8Å; E1218-K1221 IonicContact OE1-NZ 2.84Å; E1218-K1221 PolarHBondContact OE1-NZ 3.01Å; K1221-I1223 VanDerWaalsContact C-N 3.3Å; K1221-I1223 PolarHBondContact O-N 3.24Å; K1221-K1224 CarbonylContact O-C 3.55Å; K1221-K1224 WeakPolarHBondContact O-CA 3.47Å; K1221-K1224 PolarHBondContact O-N 3.41Å; K1221-Q1225 WeakPolarHBondContact O-CB 3.44Å; K1221-Q1225 PolarHBondContact O-N 2.79Å
1222	D	34.9	Very low	31	Very low	65 Å²	65	123.2 Å²	123.2	35%	0.348	60%	0.599	S	S	.	*	H	α-helix	trans	-60.7	-38.9	-176.4	-170.5	46.2	0	0	0	111.7	E1218 F1219 Q1225 K1226	E1218-D1222 WeakPolarHBondContact O-CB 3.28Å; E1218-D1222 PolarHBondContact O-N 3.45Å; F1219-D1222 PolarHBondContact O-N 3.28Å; D1222-Q1225 PolarHBondContact O-N 2.83Å; D1222-K1226 WeakPolarHBondContact O-CB 3.32Å; D1222-K1226 WeakPolarHBondContact O-CG 3.5Å; D1222-K1226 PolarHBondContact O-N 3.22Å; D1222-K1226 WeakPolarHBondContact OD1-CE 3.45Å; D1222-K1226 IonicContact OD1-NZ 3.56Å; D1222-K1226 PolarHBondContact OD1-NZ 2.83Å; D1222-K1226 IonicContact OD2-NZ 3.84Å; D1222-K1226 PolarHBondContact OD2-NZ 3.31Å
1223	I	33.9	Very low	30.9	Very low	68 Å²	68	120.1 Å²	120.1	35%	0.349	60%	0.598	S	S	.	*	H	α-helix	trans	-64.6	-44.7	170.4	-72.5	170.9	0	0	0	112	F1219 K1221 Q1225 K1226 I1227	F1219-I1223 HydrophobicContact CD1-CD1 3.85Å; F1219-I1223 HydrophobicContact CE1-CD1 3.53Å; F1219-I1223 HydrophobicContact CE2-CD1 4.43Å; F1219-I1223 HydrophobicContact CG-CD1 4.44Å; F1219-I1223 HydrophobicContact CZ-CD1 3.85Å; F1219-I1223 WeakPolarHBondContact O-CG1 3.46Å; F1219-I1223 PolarHBondContact O-N 3.35Å; K1221-I1223 VanDerWaalsContact C-N 3.3Å; K1221-I1223 PolarHBondContact O-N 3.24Å; I1223-Q1225 VanDerWaalsContact C-N 3.31Å; I1223-Q1225 PolarHBondContact O-N 3.35Å; I1223-K1226 PolarHBondContact O-N 3.33Å; I1223-I1227 HydrophobicContact CG2-CD1 3.83Å; I1223-I1227 WeakPolarHBondContact O-CB 3.5Å; I1223-I1227 VanDerWaalsContact O-CG1 3.29Å; I1223-I1227 WeakPolarHBondContact O-CG1 3.38Å; I1223-I1227 PolarHBondContact O-N 2.84Å
1224	K	32.2	Very low	30.7	Very low	168 Å²	168	124.4 Å²	124.4	73%	0.73	61%	0.61	S	S	*	*	H	α-helix	trans	-67.1	-31.4	178.2	-78.2	-178.8	176.3	-178.1	0	112.9	L1220 K1221	L1220-K1224 WeakPolarHBondContact O-CB 3.14Å; L1220-K1224 WeakPolarHBondContact O-CG 3.43Å; L1220-K1224 PolarHBondContact O-N 2.88Å; K1221-K1224 CarbonylContact O-C 3.55Å; K1221-K1224 WeakPolarHBondContact O-CA 3.47Å; K1221-K1224 PolarHBondContact O-N 3.41Å
1225	Q	34.6	Very low	30.5	Very low	120 Å²	120	126.3 Å²	126.3	56%	0.561	62%	0.619	S	S	*	*	H	α-helix	trans	-74.1	-44.9	175.8	-171.1	165.4	-14.3	0	0	111.1	K1221 D1222 I1223 I1227 G1228 E1229	K1221-Q1225 WeakPolarHBondContact O-CB 3.44Å; K1221-Q1225 PolarHBondContact O-N 2.79Å; D1222-Q1225 PolarHBondContact O-N 2.83Å; I1223-Q1225 VanDerWaalsContact C-N 3.31Å; I1223-Q1225 PolarHBondContact O-N 3.35Å; Q1225-I1227 VanDerWaalsContact C-N 3.28Å; Q1225-I1227 PolarHBondContact O-N 3.39Å; Q1225-G1228 WeakPolarHBondContact O-CA 3.35Å; Q1225-G1228 PolarHBondContact O-N 2.89Å; Q1225-E1229 PolarHBondContact NE2-OE1 2.78Å; Q1225-E1229 PolarHBondContact O-N 3.33Å
1226	K	31.7	Very low	30.3	Very low	117 Å²	117	126.1 Å²	126.1	51%	0.509	63%	0.628	S	S	.	*	H	α-helix	trans	-68	-23	178	-75	164.9	177.1	159.7	0	114.3	D1222 I1223 G1228	D1222-K1226 WeakPolarHBondContact O-CB 3.32Å; D1222-K1226 WeakPolarHBondContact O-CG 3.5Å; D1222-K1226 PolarHBondContact O-N 3.22Å; D1222-K1226 WeakPolarHBondContact OD1-CE 3.45Å; D1222-K1226 IonicContact OD1-NZ 3.56Å; D1222-K1226 PolarHBondContact OD1-NZ 2.83Å; D1222-K1226 IonicContact OD2-NZ 3.84Å; D1222-K1226 PolarHBondContact OD2-NZ 3.31Å; I1223-K1226 PolarHBondContact O-N 3.33Å; K1226-G1228 VanDerWaalsContact C-N 3.28Å
1227	I	31.5	Very low	30.2	Very low	138 Å²	138	130 Å²	130	71%	0.708	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-18.3	168.9	-71.1	169.5	0	0	0	112	I1223 Q1225	I1223-I1227 HydrophobicContact CG2-CD1 3.83Å; I1223-I1227 WeakPolarHBondContact O-CB 3.5Å; I1223-I1227 VanDerWaalsContact O-CG1 3.29Å; I1223-I1227 WeakPolarHBondContact O-CG1 3.38Å; I1223-I1227 PolarHBondContact O-N 2.84Å; Q1225-I1227 VanDerWaalsContact C-N 3.28Å; Q1225-I1227 PolarHBondContact O-N 3.39Å
1228	G	29.3	Very low	29.9	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-15.5	175	0	0	0	0	0	115.6	Q1225 K1226	Q1225-G1228 WeakPolarHBondContact O-CA 3.35Å; Q1225-G1228 PolarHBondContact O-N 2.89Å; K1226-G1228 VanDerWaalsContact C-N 3.28Å
1229	E	28.4	Very low	29.5	Very low	128 Å²	128	132.7 Å²	132.7	60%	0.598	67%	0.667	S	S	*	*	S	Bend	trans	-106.3	4	-166	-70.8	175.8	178.6	0	0	114.9	Q1225 Q1231	Q1225-E1229 PolarHBondContact NE2-OE1 2.78Å; Q1225-E1229 PolarHBondContact O-N 3.33Å; E1229-Q1231 VanDerWaalsContact C-N 3.32Å; E1229-Q1231 PolarHBondContact O-N 2.97Å
1230	Q	26.7	Very low	29.5	Very low	155 Å²	155	134.1 Å²	134.1	72%	0.724	68%	0.681	S	S	*	*			trans	-90.6	39.5	176.8	-65.9	-157.8	-9.4	0	0	114.9
1231	Q	25.5	Very low	29.4	Very low	182 Å²	182	137 Å²	137	85%	0.85	70%	0.697	S	S	*	*	S	Bend	trans	-125.1	54.9	165.8	-76.5	-160.1	-6	0	0	113.1	E1229	E1229-Q1231 VanDerWaalsContact C-N 3.32Å; E1229-Q1231 PolarHBondContact O-N 2.97Å
1232	Q	25.7	Very low	29.1	Very low	183 Å²	183	137 Å²	137	86%	0.855	70%	0.703	S	S	*	*	S	Bend	trans	-160.2	144	153.9	-114.5	152	72.4	0	0	115.1
1233	C	26.7	Very low	28.8	Very low	110 Å²	110	139.9 Å²	139.9	74%	0.743	72%	0.718	S	S	*	*			trans	53.2	85.7	153.1	-62.4	0	0	0	0	120.2
1234	K	25.6	Very low	28.5	Very low	166 Å²	166	142.6 Å²	142.6	72%	0.722	73%	0.734	S	S	*	*			trans	-83.6	103	142.4	-87.4	-171	175.8	179.6	0	110.1
1235	H	26.9	Very low	28.4	Very low	181 Å²	181	141.9 Å²	141.9	84%	0.838	74%	0.738	S	S	*	*			trans	-143	104.7	163.7	-98.1	-29.8	0	0	0	111.2
1236	T	27.4	Very low	28.2	Very low	144 Å²	144	140.1 Å²	140.1	88%	0.883	74%	0.739	S	S	*	*			trans	-134.7	116.5	163.3	43.7	0	0	0	0	108.1
1237	K	29.7	Very low	28.2	Very low	203 Å²	203	142.4 Å²	142.4	88%	0.883	75%	0.751	S	S	*	*			trans	-86.8	146.3	169.5	-73.5	-175.5	175.8	-178.2	0	109.5
1238	L	25.5	Very low	28	Very low	161 Å²	161	143.3 Å²	143.3	84%	0.843	75%	0.752	S	S	*	*			trans	-75	151.6	155.4	-74.8	160	0	0	0	109.2
1239	S	25.9	Very low	27.8	Very low	96 Å²	96	150.2 Å²	150.2	67%	0.671	76%	0.76	S	S	*	*			trans	59.1	130.9	167.4	37.5	0	0	0	0	116.2
1240	D	29.9	Very low	27.8	Very low	159 Å²	159	149.7 Å²	149.7	85%	0.85	77%	0.765	S	S	*	*			cis	-148.3	172.7	20.2	-87.1	-49.3	0	0	0	113
1241	N	30.9	Very low	27.8	Very low	139 Å²	139	150.6 Å²	150.6	74%	0.743	77%	0.77	S	S	*	*			trans	-76.3	139.8	171	-93.5	-50.4	0	0	0	112.5
1242	N	27.6	Very low	27.8	Very low	129 Å²	129	147.2 Å²	147.2	69%	0.69	77%	0.765	S	S	*	*			trans	44.3	118.9	139.9	-58	-19.2	0	0	0	118
1243	N	29.8	Very low	27.9	Very low	126 Å²	126	142.8 Å²	142.8	67%	0.674	75%	0.754	S	S	*	*			cis	-172.5	153.1	44.8	-105.6	-22.3	0	0	0	113.4
1244	N	27.9	Very low	28.1	Very low	126 Å²	126	145.9 Å²	145.9	67%	0.674	76%	0.763	S	S	*	*			trans	61.6	136.8	144.4	-60.5	-15.1	0	0	0	122.5
1245	N	30.3	Very low	28.4	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	77%	0.767	S	S	*	*			trans	70.8	146.7	156.6	-56	-10.4	0	0	0	118.1
1246	S	28.9	Very low	28.3	Very low	84 Å²	84	141.4 Å²	141.4	59%	0.587	76%	0.761	S	S	*	*			cis	-175	133.9	-24.5	52.1	0	0	0	0	109.7
1247	H	31.2	Very low	28.5	Very low	164 Å²	164	140 Å²	140	76%	0.759	75%	0.748	S	S	*	*			trans	62.3	168.9	168.8	-53.2	-64.2	0	0	0	115.8
1248	Q	29	Very low	28.4	Very low	157 Å²	157	136.9 Å²	136.9	73%	0.734	74%	0.741	S	S	*	*			cis	-159.3	136.9	-31.6	-108.4	171.6	-36.1	0	0	109.9
1249	Y	24.2	Very low	28.5	Very low	210 Å²	210	137.8 Å²	137.8	82%	0.824	74%	0.741	S	S	*	*			trans	54.6	162	143.6	-89.1	-97.4	0	0	0	124.9
1250	T	28.8	Very low	28.4	Very low	116 Å²	116	140 Å²	140	71%	0.712	74%	0.742	S	S	*	*			trans	67.7	132.6	172	49.7	0	0	0	0	117.2
1251	Q	27	Very low	28.1	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	74%	0.736	S	S	*	*			cis	75.5	139.6	43.1	-69.8	-173.5	-30.1	0	0	113.8
1252	C	25.2	Very low	27.8	Very low	110 Å²	110	140.1 Å²	140.1	74%	0.743	74%	0.736	S	S	*	*			cis	-151.6	-177.5	-0.9	-138.8	0	0	0	0	114
1253	S	28.2	Very low	27.8	Very low	91 Å²	91	140 Å²	140	64%	0.636	74%	0.74	S	S	*	*			trans	-68.9	167.3	-179.5	53.8	0	0	0	0	117.1
1254	L	30.5	Very low	27.7	Very low	175 Å²	175	139.6 Å²	139.6	92%	0.916	74%	0.742	S	S	*	*			trans	-125.8	-174.8	149.3	-70.7	177.6	0	0	0	110.1
1255	C	30.9	Very low	27.6	Very low	120 Å²	120	141.9 Å²	141.9	81%	0.811	75%	0.746	S	S	*	*			trans	-130.8	169.4	-155.8	-69.5	0	0	0	0	113
1256	N	26.4	Very low	27.5	Very low	133 Å²	133	140 Å²	140	71%	0.711	74%	0.735	S	S	*	*			cis	175.9	178.3	-24.7	-161.7	44.4	0	0	0	106.8
1257	D	31.6	Very low	27.5	Very low	115 Å²	115	144.2 Å²	144.2	62%	0.615	75%	0.746	S	S	*	*			trans	73.2	102	155.2	-65.3	-56.6	0	0	0	124.1
1258	N	27	Very low	27.3	Very low	137 Å²	137	141.9 Å²	141.9	73%	0.733	75%	0.748	S	S	*	*				49.7	115.9	113.6	-62.6	-50.4	0	0	0	122.7
1259	Q	27.5	Very low	27	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	76%	0.757	S	S	*	*				171.6	154.4	97.6	-90	-153.1	1.9	0	0	115.8
1260	M	24.5	Very low	27.1	Very low	142 Å²	142	135.2 Å²	135.2	70%	0.7	76%	0.755	S	S	*	*			trans	60.3	103.8	151.3	-67.8	-65.9	-79.1	0	0	123.3
1261	E	22.1	Very low	26.9	Very low	156 Å²	156	139.3 Å²	139.3	73%	0.729	76%	0.763	S	S	*	*				81.9	155	122.4	-121.8	-175.2	177	0	0	124.2
1262	I	25	Very low	27	Very low	144 Å²	144	138.1 Å²	138.1	74%	0.738	76%	0.762	S	S	*	*			trans	83.4	112	157.4	-69	171.6	0	0	0	120.2
1263	V	27	Very low	27	Very low	126 Å²	126	138.7 Å²	138.7	76%	0.764	76%	0.757	S	S	*	*			trans	91.2	103.4	145.8	165.1	0	0	0	0	122.2
1264	V	27.8	Very low	26.8	Very low	119 Å²	119	141.5 Å²	141.5	72%	0.721	77%	0.765	S	S	*	*			trans	64.6	90.4	132.7	-171.2	0	0	0	0	120.2
1265	K	26.4	Very low	26.5	Very low	174 Å²	174	137 Å²	137	76%	0.757	75%	0.753	S	S	*	*				46.2	126.4	113.3	-72.6	-164.5	174.3	-173.4	0	122.1
1266	N	28.2	Very low	26.2	Very low	111 Å²	111	140 Å²	140	59%	0.594	75%	0.752	S	S	*	*				68.6	147	126.9	-60.5	38.1	0	0	0	119.6
1267	E	28.8	Very low	26.2	Very low	173 Å²	173	142 Å²	142	81%	0.808	76%	0.757	S	S	*	*			cis	-158.2	146.5	-18.1	-116.8	157.2	174.4	0	0	107.6
1268	S	27.3	Very low	25.7	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	77%	0.766	S	S	*	*			trans	-114.3	135.5	-177.7	57	0	0	0	0	112.5
1269	T	23.5	Very low	26.1	Very low	151 Å²	151	140.9 Å²	140.9	93%	0.926	77%	0.765	S	S	*	*			trans	-83.7	125	168	50.6	0	0	0	0	109.1
1270	G	26.4	Very low	26	Very low	75 Å²	75	140.5 Å²	140.5	77%	0.773	76%	0.763	S	S	*	*			trans	-156.1	98.7	-171.2	0	0	0	0	0	114.1
1271	K	24.4	Very low	26	Very low	202 Å²	202	141 Å²	141	88%	0.878	77%	0.768	S	S	*	*			trans	-61.9	155.6	175.8	-53.8	161.1	-177.2	171.4	0	112
1272	L	27.6	Very low	26.2	Very low	151 Å²	151	139.3 Å²	139.3	79%	0.791	77%	0.773	S	S	*	*				-177.8	129.2	116.3	-96.5	162.3	0	0	0	114.9
1273	N	25	Very low	26.1	Very low	121 Å²	121	138.3 Å²	138.3	65%	0.647	77%	0.773	S	S	*	*			trans	31.1	133.7	144.1	-61.2	1.5	0	0	0	123.8
1274	N	24.2	Very low	25.9	Very low	151 Å²	151	142.7 Å²	142.7	81%	0.807	78%	0.778	S	S	*	*			trans	58.8	133.4	138.8	-52.9	-11	0	0	0	118.3
1275	A	25.7	Very low	25.7	Very low	79 Å²	79	143.8 Å²	143.8	65%	0.653	78%	0.778	S	S	*	*			cis	-167.9	-178.7	31.1	0	0	0	0	0	113.3
1276	F	24.6	Very low	25.7	Very low	183 Å²	183	142.3 Å²	142.3	80%	0.803	78%	0.779	S	S	*	*			trans	72.9	130.6	157.9	-69	-64.9	0	0	0	122.8
1277	H	24.9	Very low	25.6	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.815	79%	0.794	S	S	*	*			trans	49.9	138.3	145.2	-70.9	-60.5	0	0	0	124.9
1278	C	21.8	Very low	25.4	Very low	117 Å²	117	144.8 Å²	144.8	79%	0.791	79%	0.788	S	S	*	*			trans	-73.9	177.4	158	-123	0	0	0	0	111.3
1279	P	35.4	Very low	25.5	Very low	111 Å²	111	147.1 Å²	147.1	72%	0.721	79%	0.786	S	S	*	*			cis	-137	-173.1	2.9	39.7	-19.6	0	0	0	116
1280	H	24.8	Very low	25.8	Very low	173 Å²	173	147.2 Å²	147.2	80%	0.801	78%	0.781	S	S	*	*			trans	-4.1	147.1	161.2	-99.6	-85.6	0	0	0	122.6
1281	L	24.3	Very low	25.8	Very low	152 Å²	152	146.7 Å²	146.7	80%	0.796	78%	0.776	S	S	*	*			trans	92.5	93.2	147.2	-158.2	78.4	0	0	0	118.4
1282	S	26.3	Very low	26.1	Very low	120 Å²	120	143.4 Å²	143.4	84%	0.839	77%	0.773	S	S	*	*			trans	-134	145.8	141.4	57.5	0	0	0	0	109.9
1283	V	23.9	Very low	26.1	Very low	123 Å²	123	146.9 Å²	146.9	75%	0.745	78%	0.776	S	S	*	*			trans	-97.5	151	177.3	165.4	0	0	0	0	108.6
1284	Y	22.7	Very low	26.4	Very low	218 Å²	218	147.6 Å²	147.6	86%	0.855	78%	0.779	S	S	*	*			trans	5.5	119.1	153	-116.8	-100.6	0	0	0	116.2
1285	I	24.7	Very low	26.6	Very low	143 Å²	143	148.4 Å²	148.4	73%	0.733	78%	0.776	S	S	*	*				-175.7	141.8	112.9	-98.4	166.1	0	0	0	112.6
1286	D	25.5	Very low	26.7	Very low	143 Å²	143	150.1 Å²	150.1	77%	0.765	77%	0.774	S	S	*	*			trans	50.4	124.2	161.1	-61.5	-4.1	0	0	0	124.1
1287	Y	26.2	Very low	26.9	Very low	234 Å²	234	149.9 Å²	149.9	92%	0.918	78%	0.779	S	S	*	*			trans	-57.6	129.5	144.6	-107.3	-110.5	0	0	0	111.1
1288	C	25.1	Very low	26.9	Very low	101 Å²	101	148.2 Å²	148.2	68%	0.682	78%	0.776	S	S	*	*			trans	-39.4	143.8	146.8	-70.9	0	0	0	0	111.2
1289	Q	28	Very low	27	Very low	166 Å²	166	148.4 Å²	148.4	78%	0.776	77%	0.773	S	S	*	*			cis	-163.4	166.1	36.9	-105.6	137.4	20.9	0	0	107.2
1290	N	30.6	Very low	26.6	Very low	152 Å²	152	147.1 Å²	147.1	81%	0.813	77%	0.772	S	S	*	*			cis	-154.7	-178.3	26.9	-107.4	-39.2	0	0	0	110.4
1291	G	27.3	Very low	26.6	Very low	65 Å²	65	144.2 Å²	144.2	67%	0.67	77%	0.767	S	S	*	*			trans	-73.8	-174.3	170.6	0	0	0	0	0	114.5
1292	T	30.5	Very low	26.8	Very low	132 Å²	132	144 Å²	144	81%	0.81	77%	0.765	S	S	*	*			cis	-157	147.4	17.3	53.2	0	0	0	0	114.5
1293	R	27.9	Very low	26.8	Very low	225 Å²	225	144.9 Å²	144.9	85%	0.849	75%	0.754	S	S	*	*			trans	54	138.5	145.9	-77.1	-175.1	174.3	173.3	-1.3	122.5
1294	N	30.2	Very low	27	Very low	135 Å²	135	144.7 Å²	144.7	72%	0.722	75%	0.753	S	S	*	*			trans	76.8	97.5	147.2	-65.5	5.5	0	0	0	121.1
1295	K	28.9	Very low	27.2	Very low	168 Å²	168	141.2 Å²	141.2	73%	0.73	76%	0.755	S	S	*	*				54.4	117.2	111.5	-78.5	-177.7	149.5	-85.1	0	121.4
1296	D	26.7	Very low	27.3	Very low	116 Å²	116	139.3 Å²	139.3	62%	0.62	75%	0.746	S	S	*	*				77.7	133.3	125.5	-50.1	-20.5	0	0	0	121
1297	I	28.7	Very low	27.4	Very low	178 Å²	178	137.6 Å²	137.6	91%	0.913	74%	0.742	S	S	*	*			trans	86.7	164.4	157.6	-61.9	154.3	0	0	0	117
1298	D	25.6	Very low	27.4	Very low	141 Å²	141	136 Å²	136	75%	0.754	74%	0.736	S	S	*	*			trans	-132.4	160.8	-133.3	-144.7	-9.8	0	0	0	114.3
1299	V	24.7	Very low	27.5	Very low	120 Å²	120	137.3 Å²	137.3	73%	0.727	74%	0.735	S	S	*	*			trans	67.5	126.5	154.3	170	0	0	0	0	122.5
1300	A	26.3	Very low	27.5	Very low	85 Å²	85	133.6 Å²	133.6	70%	0.702	73%	0.725	S	S	*	*			trans	74.4	153	147.9	0	0	0	0	0	122.9
1301	T	25.4	Very low	27.2	Very low	112 Å²	112	131.6 Å²	131.6	69%	0.687	72%	0.723	S	S	*	*			cis	-167	175.1	-23.6	-76.4	0	0	0	0	108.5
1302	I	28.1	Very low	27	Very low	148 Å²	148	133.4 Å²	133.4	76%	0.759	73%	0.725	S	S	*	*			trans	89.4	102.6	167.4	-51.2	178.5	0	0	0	112.9
1303	K	25.2	Very low	26.7	Very low	138 Å²	138	132.1 Å²	132.1	60%	0.6	72%	0.721	S	S	*	*				67.8	126	53.3	-59	-179.2	177.8	173.3	0	112.4
1304	T	28.5	Very low	26.6	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.724	72%	0.717	S	S	*	*				-149.7	169	59.9	42.2	0	0	0	0	110	L1306	T1304-L1306 HydrophobicContact CG2-CD1 4Å; T1304-L1306 HydrophobicContact CG2-CG 4.35Å
1305	T	27.9	Very low	26.4	Very low	146 Å²	146	129.6 Å²	129.6	90%	0.896	72%	0.719	S	S	*	*	S	Bend	cis	-113.2	130.1	35	-34	0	0	0	0	115.5
1306	L	25.8	Very low	26.1	Very low	103 Å²	103	125.6 Å²	125.6	54%	0.539	72%	0.717	S	S	.	*			trans	-75.3	-179.7	176.2	-74.5	159.4	0	0	0	112.2	T1304	T1304-L1306 HydrophobicContact CG2-CD1 4Å; T1304-L1306 HydrophobicContact CG2-CG 4.35Å
1307	P	29.2	Very low	26.1	Very low	106 Å²	106	129.3 Å²	129.3	69%	0.688	73%	0.731	S	S	*	*			cis	-125.7	176.9	3.4	43	-28	0	0	0	114.1
1308	Y	25.7	Very low	26	Very low	201 Å²	201	130.2 Å²	130.2	79%	0.788	72%	0.723	S	S	*	*			cis	-144.5	126.4	22.3	-135	-82.2	0	0	0	112.8
1309	I	27.4	Very low	25.9	Very low	129 Å²	129	134.5 Å²	134.5	66%	0.662	73%	0.728	S	S	*	*			trans	28.5	125.7	154.1	-49.4	-176.2	0	0	0	121.8
1310	P	26.8	Very low	25.9	Very low	87 Å²	87	133.4 Å²	133.4	57%	0.565	73%	0.726	S	S	*	*			trans	-114	175.1	170	41.6	-32.6	0	0	0	115.5
1311	S	24	Very low	26	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	73%	0.731	S	S	*	*			trans	64.6	148.3	158.5	45.3	0	0	0	0	118.9
1312	S	23.8	Very low	26	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	73%	0.729	S	S	*	*			cis	-168.5	164.2	-4.4	44.8	0	0	0	0	112.9
1313	S	23.3	Very low	26	Very low	105 Å²	105	140 Å²	140	73%	0.734	73%	0.728	S	S	*	*			trans	81.9	160.2	155	84	0	0	0	0	120.3
1314	H	26.8	Very low	26.2	Very low	164 Å²	164	138 Å²	138	76%	0.759	73%	0.732	S	S	*	*			trans	70.1	128.7	171.9	-84.8	-91.5	0	0	0	121.7
1315	L	25	Very low	26.2	Very low	144 Å²	144	140.8 Å²	140.8	75%	0.754	73%	0.734	S	S	*	*			trans	44	106.6	140.1	-65.8	168.6	0	0	0	121.1
1316	A	22.8	Very low	26.1	Very low	84 Å²	84	140.7 Å²	140.7	69%	0.694	72%	0.723	S	S	*	*				67.2	154.5	122.1	0	0	0	0	0	121.4
1317	Q	28.2	Very low	26.1	Very low	194 Å²	194	142.8 Å²	142.8	91%	0.907	73%	0.734	S	S	*	*			trans	68.1	154.6	172.7	-49	-176.9	8.8	0	0	115.7
1318	R	25.3	Very low	26	Very low	197 Å²	197	145.7 Å²	145.7	74%	0.743	74%	0.738	S	S	*	*			cis	169.1	99.9	-47.2	172.1	-174.8	-167.1	-179.3	5.2	106.7
1319	W	23.5	Very low	26	Very low	230 Å²	230	145.6 Å²	145.6	87%	0.871	74%	0.742	S	S	*	*			trans	61.5	150.6	165.6	-51.4	-23.4	0	0	0	115.5
1320	S	25.8	Very low	26	Very low	97 Å²	97	147 Å²	147	68%	0.678	75%	0.751	S	S	*	*			cis	-166.8	154.1	36.2	52.2	0	0	0	0	113.5
1321	F	27.7	Very low	25.9	Very low	186 Å²	186	150.3 Å²	150.3	82%	0.816	76%	0.762	S	S	*	*			trans	66.8	149	145.5	-78.8	-135.3	0	0	0	118.1
1322	E	25.8	Very low	25.9	Very low	139 Å²	139	150.3 Å²	150.3	65%	0.65	76%	0.761	S	S	*	*			cis	-153	170.2	-1	-136.4	-176	136.7	0	0	113.7
1323	H	27.4	Very low	26	Very low	159 Å²	159	150.9 Å²	150.9	74%	0.736	77%	0.765	S	S	*	*			trans	14.2	136.5	161.2	-74.8	115.9	0	0	0	121.2
1324	S	29.4	Very low	26.1	Very low	97 Å²	97	151.5 Å²	151.5	68%	0.678	77%	0.769	S	S	*	*			cis	-166.2	156.9	47.3	51	0	0	0	0	114.7
1325	K	27.9	Very low	25.9	Very low	175 Å²	175	153.1 Å²	153.1	76%	0.761	77%	0.774	S	S	*	*			trans	46.3	136.9	147.4	-66.7	169.9	168.1	-99.1	0	120
1326	E	26.9	Very low	25.8	Very low	144 Å²	144	151.9 Å²	151.9	67%	0.673	78%	0.776	S	S	*	*			cis	-158.7	160.2	6.1	-128.5	158.5	-134.2	0	0	112.2
1327	L	26.4	Very low	26.1	Very low	148 Å²	148	153.7 Å²	153.7	78%	0.775	78%	0.784	S	S	*	*			trans	53.4	98.6	162.5	-105.5	63.4	0	0	0	121.7
1328	H	27.2	Very low	25.8	Very low	166 Å²	166	151.7 Å²	151.7	77%	0.769	77%	0.772	S	S	*	*			trans	51.3	98.9	134.7	-73.8	-92.2	0	0	0	120.4
1329	K	25.6	Very low	25.7	Very low	200 Å²	200	149.7 Å²	149.7	87%	0.87	78%	0.776	S	S	*	*			trans	-102.5	154.8	139.2	-65.5	176.7	179.1	176.4	0	108.6
1330	D	26.7	Very low	25.9	Very low	157 Å²	157	144 Å²	144	84%	0.84	77%	0.771	S	S	*	*			trans	-159.4	165.4	139.2	-128	-29.9	0	0	0	113
1331	I	25.4	Very low	25.8	Very low	158 Å²	158	144.1 Å²	144.1	81%	0.81	77%	0.77	S	S	*	*			trans	105	83.6	-175.3	-58.6	165.5	0	0	0	113.5
1332	C	23.1	Very low	25.6	Very low	110 Å²	110	146.1 Å²	146.1	74%	0.743	77%	0.773	S	S	*	*				172.6	155.1	116.6	-104.1	0	0	0	0	112.9
1333	S	26.3	Very low	25.8	Very low	115 Å²	115	149.5 Å²	149.5	80%	0.804	79%	0.785	S	S	*	*			trans	71.6	146.6	175.6	86.1	0	0	0	0	115.8
1334	S	24.7	Very low	25.8	Very low	117 Å²	117	149.9 Å²	149.9	82%	0.818	79%	0.792	S	S	*	*			cis	-158.6	-174.6	-6.9	-125.7	0	0	0	0	113.6
1335	F	22.4	Very low	25.5	Very low	199 Å²	199	150.2 Å²	150.2	87%	0.873	79%	0.794	S	S	*	*			trans	-67.7	174.7	-176.2	-107.1	-114.5	0	0	0	116.9
1336	C	22.9	Very low	25.5	Very low	118 Å²	118	149.3 Å²	149.3	80%	0.797	80%	0.796	S	S	*	*			trans	81	142.7	174.6	-60.4	0	0	0	0	115.6
1337	S	28.5	Very low	25.4	Very low	121 Å²	121	149.7 Å²	149.7	85%	0.846	80%	0.803	S	S	*	*			cis	-137	176.9	22.9	-65.1	0	0	0	0	115.1
1338	F	23.4	Very low	25.3	Very low	153 Å²	153	148 Å²	148	67%	0.671	80%	0.802	S	S	*	*			trans	-92	165.8	-175.8	-103.6	-119.4	0	0	0	115.1
1339	L	22.7	Very low	25.3	Very low	155 Å²	155	148.9 Å²	148.9	81%	0.812	81%	0.806	S	S	*	*			trans	50.6	106	150	-76.8	162.6	0	0	0	121.6
1340	S	27.5	Very low	25.2	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	80%	0.796	S	S	*	*				-175.3	123.7	121	-161.5	0	0	0	0	107.8
1341	C	23.4	Very low	25.2	Very low	98 Å²	98	142.1 Å²	142.1	66%	0.662	80%	0.797	S	S	*	*				74.8	112.8	57.6	-147.5	0	0	0	0	115
1342	R	24.5	Very low	25.1	Very low	229 Å²	229	142.6 Å²	142.6	86%	0.864	80%	0.797	S	S	*	*			trans	52.8	103.7	160	-63.7	174	175.9	178.7	-0.3	119.6
1343	K	29	Very low	25.2	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	80%	0.803	S	S	*	*				178.8	158.8	98.4	-99.6	179.9	179.3	-179.1	0	112.2
1344	L	27.1	Very low	25.1	Very low	167 Å²	167	144.4 Å²	144.4	87%	0.874	80%	0.796	S	S	*	*			trans	-77.1	157	161.1	-84.5	151.7	0	0	0	110.2
1345	S	23.3	Very low	25.2	Very low	105 Å²	105	146 Å²	146	73%	0.734	80%	0.796	S	S	*	*			trans	-27.7	137.6	-179.5	54.1	0	0	0	0	118.2
1346	I	27.5	Very low	25.3	Very low	155 Å²	155	141.2 Å²	141.2	80%	0.795	79%	0.786	S	S	*	*				-155.8	129.1	115	-98.4	153.1	0	0	0	109.1
1347	D	26.6	Very low	25.4	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	79%	0.786	S	S	*	*			trans	38.8	148.7	156.3	-54.4	-34	0	0	0	125.1
1348	C	24.1	Very low	25.4	Very low	112 Å²	112	148.4 Å²	148.4	76%	0.757	79%	0.788	S	S	*	*			trans	-71.4	160.4	-179.1	-63.5	0	0	0	0	114.7
1349	Q	25.8	Very low	25.7	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.864	79%	0.788	S	S	*	*			trans	59.2	104.7	148.6	-71.1	172.4	-4.7	0	0	117.4
1350	S	25	Very low	26	Very low	94 Å²	94	144.9 Å²	144.9	66%	0.657	79%	0.789	S	S	*	*				80.6	85.2	71.8	179.5	0	0	0	0	113.8	M1352	S1350-M1352 PolarHBondContact O-N 3.46Å
1351	S	25.1	Very low	25.9	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	79%	0.785	S	S	*	*			trans	-82.1	96.8	158.4	56.4	0	0	0	0	110.4
1352	M	23.7	Very low	26.2	Very low	168 Å²	168	148.6 Å²	148.6	83%	0.828	79%	0.786	S	S	*	*			trans	-88.6	121.9	163.9	-72.9	-175.3	68.9	0	0	109.5	S1350	S1350-M1352 PolarHBondContact O-N 3.46Å
1353	I	24.9	Very low	26.5	Very low	167 Å²	167	145.6 Å²	145.6	86%	0.856	78%	0.782	S	S	*	*			trans	-144	117.5	163.1	-57.5	-178.8	0	0	0	108.8
1354	S	24.9	Very low	26.4	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	77%	0.774	S	S	*	*			trans	176.7	107.7	137.8	176.7	0	0	0	0	111.1
1355	D	26.5	Very low	26.5	Very low	152 Å²	152	138.9 Å²	138.9	81%	0.813	77%	0.769	S	S	*	*			trans	-158.2	120	140.5	-91.6	-39	0	0	0	105.7
1356	C	25.4	Very low	26.7	Very low	97 Å²	97	138 Å²	138	66%	0.655	76%	0.764	S	S	*	*				76	131.4	65	-68.7	0	0	0	0	113.6
1357	L	25.3	Very low	26.6	Very low	153 Å²	153	138.6 Å²	138.6	80%	0.801	76%	0.763	S	S	*	*			cis	-172.3	133.1	-22.2	-130	175.4	0	0	0	109.2
1358	R	27.6	Very low	26.6	Very low	238 Å²	238	135.8 Å²	135.8	90%	0.898	76%	0.755	S	S	*	*			trans	160.3	142.8	162	-93.1	161.9	-159.1	-142.1	6.9	108.9
1359	S	29.2	Very low	26.6	Very low	95 Å²	95	137.8 Å²	137.8	66%	0.664	76%	0.763	S	S	*	*			cis	-172.2	138.7	-13.5	50.1	0	0	0	0	110.7
1360	V	29.3	Very low	26.6	Very low	138 Å²	138	132.4 Å²	132.4	84%	0.836	76%	0.757	S	S	*	*			trans	67.5	128.9	152.3	174.5	0	0	0	0	116.2
1361	D	27	Very low	27.3	Very low	128 Å²	128	133.7 Å²	133.7	68%	0.684	76%	0.764	S	S	*	*			cis	-156.4	172.6	10.5	-150.1	-4.3	0	0	0	114.2
1362	K	28.5	Very low	27.3	Very low	159 Å²	159	133.3 Å²	133.3	69%	0.691	76%	0.761	S	S	*	*			trans	81.9	117.1	149.4	-83.5	169.5	-170.6	179	0	124.6
1363	H	30	Very low	27.5	Very low	167 Å²	167	132.3 Å²	132.3	77%	0.773	76%	0.757	S	S	*	*			trans	94.8	124.6	141.5	-76.2	-64.5	0	0	0	123.3
1364	S	28.7	Very low	27.5	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	75%	0.754	S	S	*	*			trans	65.1	101.4	163	24.8	0	0	0	0	117.6
1365	V	28.5	Very low	27.5	Very low	129 Å²	129	138.3 Å²	138.3	78%	0.782	76%	0.762	S	S	*	*				74.5	110.3	73.7	171.6	0	0	0	0	111.3
1366	S	26.4	Very low	27.5	Very low	88 Å²	88	138.3 Å²	138.3	62%	0.615	76%	0.762	S	S	*	*			cis	82.2	147.3	35.8	98.6	0	0	0	0	113.8
1367	E	26.4	Very low	27.5	Very low	167 Å²	167	138.2 Å²	138.2	78%	0.78	76%	0.762	S	S	*	*			cis	-163.7	162	-3.3	-131.9	162.8	168.4	0	0	113.9
1368	S	25.5	Very low	27.6	Very low	92 Å²	92	137.2 Å²	137.2	64%	0.643	76%	0.763	S	S	*	*			trans	32.3	125.1	142.1	76.9	0	0	0	0	122.6
1369	V	25.5	Very low	27.6	Very low	154 Å²	154	130.5 Å²	130.5	93%	0.933	75%	0.752	S	S	*	*				73.2	131.3	89.7	175.3	0	0	0	0	116.8
1370	G	25.3	Very low	27.5	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	75%	0.751	S	S	*	*			trans	154.7	128.8	164.3	0	0	0	0	0	114.6
1371	P	40.8	Very low	27.5	Very low	122 Å²	122	131.3 Å²	131.3	79%	0.792	74%	0.735	S	S	*	*			trans	-119.9	160.9	-171.9	41	-32.1	0	0	0	116.4
1372	S	23.4	Very low	27.4	Very low	112 Å²	112	128.2 Å²	128.2	78%	0.783	72%	0.723	S	S	*	*			trans	-173.7	134.9	146.9	-86	0	0	0	0	115.9
1373	I	27.6	Very low	27.4	Very low	147 Å²	147	128 Å²	128	75%	0.754	72%	0.724	S	S	*	*			trans	65.8	116.9	135.4	-59.4	172.9	0	0	0	122
1374	E	25.8	Very low	27.2	Very low	169 Å²	169	124.4 Å²	124.4	79%	0.79	72%	0.718	S	S	*	*			trans	47.6	107	143.3	-58.5	-170	137.5	0	0	125.8
1375	R	25.9	Very low	27.6	Very low	221 Å²	221	128 Å²	128	83%	0.834	73%	0.728	S	S	*	*				30	121.2	128.6	-60.9	178.1	177.6	168.4	-0.3	121.4
1376	N	25.8	Very low	27.4	Very low	151 Å²	151	127 Å²	127	81%	0.807	72%	0.722	S	S	*	*				-174.4	146.8	100.1	-98.5	-23.5	0	0	0	116.2
1377	S	26	Very low	27.4	Very low	96 Å²	96	126.2 Å²	126.2	67%	0.671	72%	0.717	S	S	*	*			trans	35.2	105.6	154.7	59.6	0	0	0	0	123.2
1378	T	26.6	Very low	27.4	Very low	132 Å²	132	124.6 Å²	124.6	81%	0.81	71%	0.711	S	S	*	*				35.7	143.6	122.7	56.2	0	0	0	0	122.8
1379	S	28.5	Very low	27.3	Very low	97 Å²	97	123.3 Å²	123.3	68%	0.678	70%	0.697	S	S	*	*			cis	174.9	132.9	-23.1	46.2	0	0	0	0	109.7
1380	Q	26.2	Very low	27.8	Very low	135 Å²	135	120 Å²	120	63%	0.631	68%	0.678	S	S	*	*			trans	-144.6	167.4	173	-66.9	-160.4	-70.7	0	0	112.1	N1389	Q1380-N1389 HydrophobicContact CB-CB 4.43Å; Q1380-N1389 VanDerWaalsContact CB-OD1 3.26Å; Q1380-N1389 WeakPolarHBondContact CB-OD1 3.49Å; Q1380-N1389 PolarHBondContact NE2-ND2 2.88Å; Q1380-N1389 VanDerWaalsContact OE1-CG 3.31Å; Q1380-N1389 PolarHBondContact OE1-ND2 2.85Å; Q1380-N1389 PolarHBondContact OE1-OD1 3.28Å
1381	F	28.5	Very low	27.7	Very low	115 Å²	115	122.2 Å²	122.2	50%	0.504	68%	0.677	S	S	.	*			trans	-151.5	109.2	-142.3	-151.5	-80.4	0	0	0	115.6	M1388 N1389 V1391	F1381-M1388 CarbonylContact C-O 3.58Å; F1381-M1388 VanDerWaalsContact O-O 3.13Å; F1381-N1389 CarbonylContact O-C 3.54Å; F1381-N1389 VanDerWaalsContact O-O 3.11Å; F1381-V1391 VanDerWaalsContact CB-N 3.3Å
1382	S	26.1	Very low	27	Very low	63 Å²	63	118.8 Å²	118.8	44%	0.441	66%	0.664	S	S	.	*			trans	65.5	134.3	159.4	83.2	0	0	0	0	121.8	M1388	S1382-M1388 CarbonylContact C-O 3.52Å; S1382-M1388 WeakPolarHBondContact CA-O 3.29Å; S1382-M1388 PolarHBondContact N-O 3.32Å
1383	H	29.1	Very low	27.1	Very low	153 Å²	153	122.1 Å²	122.1	71%	0.708	67%	0.669	S	S	*	*			cis	-156.2	129.9	33.1	-107.6	-70.1	0	0	0	115.2	V1386 S1387	H1383-V1386 CarbonylContact C-O 3.54Å; H1383-S1387 PolarHBondContact N-O 2.89Å
1384	S	24.8	Very low	27.1	Very low	92 Å²	92	120 Å²	120	64%	0.643	67%	0.668	S	S	*	*	S	Bend	trans	48.8	133.7	146.8	60.2	0	0	0	0	121.8	V1386	S1384-V1386 PolarHBondContact N-O 3.48Å
1385	L	36.3	Very low	27.3	Very low	181 Å²	181	122.3 Å²	122.3	95%	0.948	67%	0.669	S	S	*	*	S	Bend	cis	-81.8	21.4	-9.4	-61.6	171.2	0	0	0	111.5
1386	V	25	Very low	27.5	Very low	109 Å²	109	118 Å²	118	66%	0.661	66%	0.662	S	S	*	*	S	Bend	trans	-172.6	154.7	-133.3	150.7	0	0	0	0	105.5	H1383 S1384	H1383-V1386 CarbonylContact C-O 3.54Å; S1384-V1386 PolarHBondContact N-O 3.48Å
1387	S	26.8	Very low	27.6	Very low	71 Å²	71	115.7 Å²	115.7	50%	0.497	66%	0.664	S	S	.	*			trans	67.4	122	157.1	-166.8	0	0	0	0	121	H1383	H1383-S1387 PolarHBondContact N-O 2.89Å
1388	M	26.7	Very low	27.6	Very low	132 Å²	132	120.7 Å²	120.7	65%	0.65	67%	0.67	S	S	*	*			trans	57.8	147.5	131.4	-63.5	-178	-174.1	0	0	124.1	F1381 S1382	F1381-M1388 CarbonylContact C-O 3.58Å; F1381-M1388 VanDerWaalsContact O-O 3.13Å; S1382-M1388 CarbonylContact C-O 3.52Å; S1382-M1388 WeakPolarHBondContact CA-O 3.29Å; S1382-M1388 PolarHBondContact N-O 3.32Å
1389	N	23	Very low	27.6	Very low	66 Å²	66	120.6 Å²	120.6	35%	0.353	66%	0.664	S	S	.	*			trans	37.2	138.8	131.1	-45.7	13.3	0	0	0	124.4	Q1380 F1381	Q1380-N1389 HydrophobicContact CB-CB 4.43Å; Q1380-N1389 VanDerWaalsContact CB-OD1 3.26Å; Q1380-N1389 WeakPolarHBondContact CB-OD1 3.49Å; Q1380-N1389 PolarHBondContact NE2-ND2 2.88Å; Q1380-N1389 VanDerWaalsContact OE1-CG 3.31Å; Q1380-N1389 PolarHBondContact OE1-ND2 2.85Å; Q1380-N1389 PolarHBondContact OE1-OD1 3.28Å; F1381-N1389 CarbonylContact O-C 3.54Å; F1381-N1389 VanDerWaalsContact O-O 3.11Å
1390	P	35.7	Very low	27.5	Very low	84 Å²	84	125 Å²	125	55%	0.545	67%	0.671	S	S	.	*			cis	-148.4	137	-30.2	37.5	-16.3	0	0	0	118.2
1391	V	23.4	Very low	27.6	Very low	119 Å²	119	122.7 Å²	122.7	72%	0.721	67%	0.674	S	S	*	*			trans	66.3	143.2	161.9	-179.4	0	0	0	0	118.7	F1381	F1381-V1391 VanDerWaalsContact CB-N 3.3Å
1392	G	26.1	Very low	27.5	Very low	50 Å²	50	123 Å²	123	52%	0.515	69%	0.686	S	S	.	*			trans	119.8	120.6	141.7	0	0	0	0	0	122.6
1393	M	24.5	Very low	27.7	Very low	181 Å²	181	127.6 Å²	127.6	89%	0.892	70%	0.7	S	S	*	*			trans	44	103.6	135.5	-60.8	179.7	68.5	0	0	124.8
1394	S	29.4	Very low	27.6	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	70%	0.703	S	S	*	*				54.2	123.6	121.3	75.8	0	0	0	0	125.8
1395	R	28.9	Very low	28	Very low	218 Å²	218	125.3 Å²	125.3	82%	0.823	70%	0.699	S	S	*	*				128.4	113.9	110	-157	165.2	-169.3	164.3	6.2	121.9
1396	D	29.5	Very low	27.7	Very low	129 Å²	129	126.8 Å²	126.8	69%	0.69	70%	0.698	S	S	*	*			trans	53.1	121.2	144.3	-53	-12.4	0	0	0	127
1397	A	27.7	Very low	28.2	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	71%	0.71	S	S	*	*			trans	-167.7	168	146	0	0	0	0	0	112.2
1398	Y	26.2	Very low	28.1	Very low	202 Å²	202	133 Å²	133	79%	0.792	72%	0.722	S	S	*	*			cis	-164	85.9	-48.5	-169.8	-115.7	0	0	0	114.3
1399	L	27.9	Very low	28	Very low	129 Å²	129	136 Å²	136	68%	0.675	73%	0.725	S	S	*	*			trans	66.9	-176.6	163	-43.3	179.6	0	0	0	116.4
1400	K	26.4	Very low	28.2	Very low	191 Å²	191	139.6 Å²	139.6	83%	0.83	75%	0.75	S	S	*	*			cis	-161.4	149.8	4	-149.9	170.1	-177.2	177.8	0	114
1401	A	28.2	Very low	27.7	Very low	85 Å²	85	141 Å²	141	70%	0.702	75%	0.752	S	S	*	*			trans	83.7	-154.9	152	0	0	0	0	0	123.8
1402	T	26.5	Very low	27.9	Very low	121 Å²	121	143 Å²	143	74%	0.742	75%	0.748	S	S	*	*				-160.6	176.3	-125.8	59.2	0	0	0	0	114.2
1403	Q	28.9	Very low	28.2	Very low	160 Å²	160	146.6 Å²	146.6	75%	0.748	75%	0.751	S	S	*	*			cis	-164.5	176.4	6.4	-139.6	176.2	-100.2	0	0	112.6
1404	D	28.7	Very low	28.5	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	75%	0.745	S	S	*	*			trans	66.7	169.4	161.8	-87.6	77.5	0	0	0	119.4
1405	G	32.3	Very low	28.4	Very low	54 Å²	54	143.8 Å²	143.8	56%	0.557	75%	0.746	S	S	*	*			cis	-156	-151.2	8.3	0	0	0	0	0	114.6
1406	F	29.9	Very low	28.4	Very low	212 Å²	212	139.3 Å²	139.3	93%	0.93	74%	0.735	S	S	*	*			trans	-149.3	145.5	-164.9	-101.7	-91.7	0	0	0	119
1407	L	35.5	Very low	28.3	Very low	173 Å²	173	139.6 Å²	139.6	91%	0.906	74%	0.736	S	S	*	*			trans	-163.6	-179.6	154.4	-111.9	168.6	0	0	0	112.5
1408	N	24.6	Very low	28.4	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	73%	0.726	S	S	*	*			trans	-151.8	149.8	-149.9	-147.4	-8.7	0	0	0	119.7
1409	R	24	Very low	28.5	Very low	193 Å²	193	139.4 Å²	139.4	73%	0.728	72%	0.722	S	S	*	*			trans	59	130	162.1	-57.8	-166.8	-177.4	-163.1	0.7	123.8
1410	T	27.3	Very low	28.5	Very low	143 Å²	143	142 Å²	142	88%	0.877	73%	0.728	S	S	*	*				-168.8	-173.8	114.7	20.5	0	0	0	0	111.5
1411	I	25.2	Very low	28.6	Very low	113 Å²	113	137.3 Å²	137.3	58%	0.579	72%	0.718	S	S	*	*			trans	-138.4	161.9	-133.7	-26.8	175.3	0	0	0	114.6
1412	Y	28.6	Very low	28.5	Very low	161 Å²	161	143.3 Å²	143.3	63%	0.631	72%	0.724	S	S	*	*			trans	125.3	148.7	141.1	-81.4	-66.3	0	0	0	117.1	E1416	Y1412-E1416 HydrophobicContact CE1-CG 4.28Å; Y1412-E1416 VanDerWaalsContact CE1-OE1 3.24Å; Y1412-E1416 WeakPolarHBondContact CE1-OE1 3.41Å; Y1412-E1416 PolarHBondContact OH-OE1 2.85Å
1413	E	31.5	Very low	28.4	Very low	125 Å²	125	141.5 Å²	141.5	58%	0.584	72%	0.717	S	S	*	*				-152.6	-147.4	-95.2	-126.1	84.2	-13.2	0	0	106.4
1414	P	31.1	Very low	28.3	Very low	117 Å²	117	138.7 Å²	138.7	76%	0.76	72%	0.715	S	S	*	*	S	Bend		-137.7	142.1	90.7	36.5	-24.1	0	0	0	114.7
1415	S	26.3	Very low	28.2	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	72%	0.72	S	S	*	*	S	Bend	trans	53.1	80.3	178.4	51.2	0	0	0	0	116.1
1416	E	29.1	Very low	27.9	Very low	124 Å²	124	144.2 Å²	144.2	58%	0.579	72%	0.724	S	S	*	*				28.1	130	119	-61.2	169	158.9	0	0	117.2	Y1412	Y1412-E1416 HydrophobicContact CE1-CG 4.28Å; Y1412-E1416 VanDerWaalsContact CE1-OE1 3.24Å; Y1412-E1416 WeakPolarHBondContact CE1-OE1 3.41Å; Y1412-E1416 PolarHBondContact OH-OE1 2.85Å
1417	D	28.3	Very low	27.8	Very low	135 Å²	135	140.6 Å²	140.6	72%	0.722	71%	0.714	S	S	*	*			cis	-155.6	152.3	31.9	-131.6	-15.4	0	0	0	117.8
1418	H	30.1	Very low	27.3	Very low	140 Å²	140	140.3 Å²	140.3	65%	0.648	71%	0.708	S	S	*	*			trans	22.7	95.6	160.7	-79.8	-64.3	0	0	0	124.5
1419	K	27.2	Very low	27.4	Very low	161 Å²	161	139.7 Å²	139.7	70%	0.7	71%	0.709	S	S	*	*				36.4	117.8	117.1	-85.7	159.1	176.4	158	0	120.2
1420	F	29.1	Very low	27.6	Very low	184 Å²	184	135.1 Å²	135.1	81%	0.807	71%	0.707	S	S	*	*				70	161.7	87.4	-83.5	-77.6	0	0	0	114.3
1421	C	28.4	Very low	27.6	Very low	92 Å²	92	137 Å²	137	62%	0.622	71%	0.706	S	S	*	*			cis	-140.8	157.9	4.1	-136.3	0	0	0	0	107.8
1422	Y	24.9	Very low	27.8	Very low	211 Å²	211	136.5 Å²	136.5	83%	0.827	71%	0.713	S	S	*	*			cis	69.9	167.3	23.3	-120.7	-94.9	0	0	0	116.3
1423	S	25	Very low	27.8	Very low	84 Å²	84	135.9 Å²	135.9	59%	0.587	72%	0.72	S	S	*	*	S	Bend	trans	-122.7	161.3	-177	57.6	0	0	0	0	112.6
1424	S	26.3	Very low	27.7	Very low	101 Å²	101	135 Å²	135	71%	0.706	73%	0.728	S	S	*	*			trans	85.2	165.5	168.1	-46.6	0	0	0	0	117.6
1425	Y	26.9	Very low	27.4	Very low	222 Å²	222	138.1 Å²	138.1	87%	0.871	73%	0.73	S	S	*	*			trans	72.3	105.7	-165.4	-63.1	-82.6	0	0	0	114.6
1426	S	27.2	Very low	27.4	Very low	92 Å²	92	139 Å²	139	64%	0.643	72%	0.722	S	S	*	*			cis	85.8	115.2	29	89.7	0	0	0	0	116.4
1427	N	27.6	Very low	27.1	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	73%	0.732	S	S	*	*				-163.9	139.2	124.8	-109.2	-19.8	0	0	0	111.5
1428	Q	24.9	Very low	26.8	Very low	168 Å²	168	141.2 Å²	141.2	79%	0.785	73%	0.73	S	S	*	*			trans	49.2	127.4	147	-56.9	171.3	10.9	0	0	118.5
1429	T	26.2	Very low	26.6	Very low	124 Å²	124	140.8 Å²	140.8	76%	0.761	73%	0.732	S	S	*	*			cis	-140.1	168.6	29.5	42.4	0	0	0	0	114
1430	S	28.1	Very low	26.5	Very low	98 Å²	98	138.6 Å²	138.6	69%	0.685	73%	0.728	S	S	*	*			trans	49.4	96.7	169.2	50.4	0	0	0	0	117.3
1431	Q	28.3	Very low	26.3	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	72%	0.722	S	S	*	*				94.4	125.4	65.4	-86.3	-176.2	-39.1	0	0	114.5
1432	S	28.4	Very low	26.2	Very low	102 Å²	102	139 Å²	139	71%	0.713	73%	0.727	S	S	*	*			trans	62.1	138.8	154.2	53.6	0	0	0	0	121.2
1433	D	29.6	Very low	26.3	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	73%	0.726	S	S	*	*			cis	-164.4	163.8	-23.4	-124.7	-49.6	0	0	0	115
1434	S	28.8	Very low	26.5	Very low	108 Å²	108	135.4 Å²	135.4	76%	0.755	73%	0.733	S	S	*	*			trans	69.7	172	151.3	80.1	0	0	0	0	120.3
1435	F	25.8	Very low	26.8	Very low	181 Å²	181	138.5 Å²	138.5	79%	0.794	74%	0.741	S	S	*	*			trans	-160.8	148.5	-154	-140.9	-125.3	0	0	0	111.4
1436	Q	25.5	Very low	26.7	Very low	128 Å²	128	135 Å²	135	60%	0.598	74%	0.737	S	S	*	*			trans	67.3	132	154.5	-87.4	-174.3	48.1	0	0	122.7
1437	R	22.5	Very low	26.8	Very low	210 Å²	210	134.3 Å²	134.3	79%	0.792	73%	0.732	S	S	*	*			trans	91.8	127.1	131.8	-80.1	180	-172.4	-152.2	-1.3	122.1
1438	S	22.9	Very low	26.8	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	73%	0.73	S	S	*	*			trans	75.1	119.8	134.3	58.7	0	0	0	0	121.3
1439	N	24.4	Very low	27.2	Very low	130 Å²	130	132.4 Å²	132.4	70%	0.695	73%	0.732	S	S	*	*			trans	87.1	113	130.4	-76	54.7	0	0	0	120.2
1440	D	25.6	Very low	27.3	Very low	116 Å²	116	135.4 Å²	135.4	62%	0.62	73%	0.731	S	S	*	*				93.9	117.3	117	-68.9	-4	0	0	0	120.8
1441	N	25.6	Very low	27.7	Very low	125 Å²	125	135 Å²	135	67%	0.668	73%	0.726	S	S	*	*			trans	74.2	150.9	133.8	-68.1	-39.6	0	0	0	117.2
1442	Q	25.5	Very low	27.6	Very low	158 Å²	158	132.8 Å²	132.8	74%	0.738	72%	0.72	S	S	*	*			cis	-152.5	-176.6	2.4	-133.9	159.9	46.5	0	0	111.6
1443	S	27.2	Very low	27.3	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	72%	0.72	S	S	*	*			trans	72.4	132.3	178.8	78.8	0	0	0	0	115.1
1444	S	30.3	Very low	27.2	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	72%	0.72	S	S	*	*			cis	-147.3	135.7	-8.7	56.6	0	0	0	0	112.6
1445	L	30.7	Very low	27	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	73%	0.725	S	S	*	*			trans	57.5	97.6	159.3	-68.3	165.4	0	0	0	116.5	S1447	L1445-S1447 PolarHBondContact O-N 3.46Å
1446	N	26.6	Very low	26.9	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	72%	0.722	S	S	*	*			trans	-29.6	123.7	150	-61.4	-11.9	0	0	0	111.3
1447	S	28.2	Very low	26.9	Very low	78 Å²	78	136.7 Å²	136.7	55%	0.545	73%	0.734	S	S	.	*				67.3	111.3	59.2	83.5	0	0	0	0	113.1	L1445	L1445-S1447 PolarHBondContact O-N 3.46Å
1448	D	28.2	Very low	27.1	Very low	126 Å²	126	132.2 Å²	132.2	67%	0.674	73%	0.725	S	S	*	*				61	175.5	118.4	-48.4	-34.7	0	0	0	117.5	Y1450	D1448-Y1450 HydrophobicContact CB-CD2 4.19Å
1449	V	32.9	Very low	27.2	Very low	137 Å²	137	135.1 Å²	135.1	83%	0.83	73%	0.728	S	S	*	*			cis	-146.2	145.7	15.5	175.8	0	0	0	0	106.6
1450	Y	28	Very low	27.3	Very low	188 Å²	188	134.8 Å²	134.8	74%	0.737	73%	0.727	S	S	*	*			cis	-168.2	163.3	-28.5	-144.5	-108.5	0	0	0	104.6	D1448	D1448-Y1450 HydrophobicContact CB-CD2 4.19Å
1451	P	35.8	Very low	27.4	Very low	89 Å²	89	135.9 Å²	135.9	58%	0.578	73%	0.732	S	S	*	*			trans	-122.7	-149.4	-160.9	35.6	-16.8	0	0	0	113.4
1452	N	26.7	Very low	27.4	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	73%	0.732	S	S	*	*			trans	77.6	134.3	155.6	-67.1	2.3	0	0	0	117.1
1453	I	23.1	Very low	27.6	Very low	141 Å²	141	135.9 Å²	135.9	72%	0.723	74%	0.736	S	S	*	*			cis	66.1	105.2	11.9	-77.1	176	0	0	0	115.7
1454	H	27	Very low	27.7	Very low	167 Å²	167	134.8 Å²	134.8	77%	0.773	73%	0.728	S	S	*	*			trans	59.8	143.2	150.4	-72.8	-120.2	0	0	0	120.8
1455	A	25.3	Very low	27.7	Very low	105 Å²	105	137.9 Å²	137.9	87%	0.868	73%	0.731	S	S	*	*			trans	-138.5	110.1	145.3	0	0	0	0	0	109.3
1456	L	23.9	Very low	27.6	Very low	140 Å²	140	135.7 Å²	135.7	73%	0.733	73%	0.729	S	S	*	*			trans	-141.4	114.9	161.4	-101.7	178.4	0	0	0	105.3
1457	F	25.4	Very low	27.7	Very low	195 Å²	195	132.3 Å²	132.3	86%	0.855	73%	0.73	S	S	*	*			trans	-169.5	121.3	150.2	-88.1	-76.2	0	0	0	103.8
1458	I	25.9	Very low	27.8	Very low	117 Å²	117	134 Å²	134	60%	0.6	74%	0.741	S	S	*	*				78.6	105	58.2	-69.4	172.4	0	0	0	111.8
1459	E	24.6	Very low	27.6	Very low	156 Å²	156	136.7 Å²	136.7	73%	0.729	75%	0.75	S	S	*	*			trans	71.9	152.4	143	-71.4	172.4	-134.5	0	0	119.5
1460	N	26.2	Very low	27.2	Very low	123 Å²	123	140 Å²	140	66%	0.658	75%	0.754	S	S	*	*			cis	-152.9	-169.8	6.5	-129.7	-25.7	0	0	0	114.4
1461	D	27.7	Very low	27	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	76%	0.757	S	S	*	*			trans	82.6	103.4	163.7	-62.6	-25.1	0	0	0	117.5
1462	S	26.6	Very low	26.5	Very low	94 Å²	94	140 Å²	140	66%	0.657	76%	0.764	S	S	*	*				94.1	141.2	72.5	87	0	0	0	0	111.9
1463	K	28.6	Very low	26.5	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	77%	0.767	S	S	*	*			cis	-134.9	-178.4	7.8	-60	169.9	-173.6	169.2	0	107.5
1464	S	29.4	Very low	26.8	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	77%	0.765	S	S	*	*			cis	-170	169.3	34.1	45.5	0	0	0	0	112.1
1465	E	29.8	Very low	26.9	Very low	169 Å²	169	141.5 Å²	141.5	79%	0.79	77%	0.765	S	S	*	*			trans	53.3	97.9	151.7	-75.4	153.6	-138.9	0	0	118.3
1466	S	29.7	Very low	27	Very low	119 Å²	119	140.2 Å²	140.2	83%	0.832	75%	0.754	S	S	*	*				83.8	141.1	88.9	71.8	0	0	0	0	114.4
1467	G	27.9	Very low	27.2	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	76%	0.755	S	S	*	*			cis	-136.6	-162.3	9.7	0	0	0	0	0	114.3
1468	S	30.4	Very low	27.2	Very low	112 Å²	112	139.3 Å²	139.3	78%	0.783	75%	0.754	S	S	*	*			trans	-88.9	151	-165.4	53.5	0	0	0	0	115.9
1469	E	24	Very low	27.2	Very low	184 Å²	184	138.8 Å²	138.8	86%	0.86	76%	0.761	S	S	*	*			trans	-2.9	123.6	150.3	-58.9	170.8	144.8	0	0	117.6
1470	F	25.8	Very low	27.4	Very low	207 Å²	207	138.7 Å²	138.7	91%	0.908	77%	0.765	S	S	*	*			trans	-152.5	148	145.9	-124.9	-85.1	0	0	0	110.2
1471	E	23.4	Very low	27.4	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	78%	0.775	S	S	*	*			trans	-92.2	176.4	171.7	-62.9	-178.2	118.5	0	0	111.5
1472	S	24.7	Very low	27.6	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	77%	0.77	S	S	*	*			trans	77.4	179.7	165.5	78.8	0	0	0	0	118
1473	Y	27.9	Very low	27.7	Very low	204 Å²	204	142.7 Å²	142.7	80%	0.8	77%	0.77	S	S	*	*			trans	67.5	117	-152.9	-62.6	-96	0	0	0	112.4
1474	D	29.4	Very low	27.7	Very low	127 Å²	127	141.2 Å²	141.2	68%	0.679	76%	0.764	S	S	*	*			cis	-149.7	158.8	3.8	-92.1	-38.6	0	0	0	114.1
1475	D	28.7	Very low	27.5	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	77%	0.765	S	S	*	*			trans	14.2	128.6	145.5	-69	-6.5	0	0	0	120.2
1476	A	27	Very low	27.4	Very low	78 Å²	78	141.6 Å²	141.6	65%	0.645	76%	0.762	S	S	*	*				96.5	162.7	54.3	0	0	0	0	0	113.7
1477	N	28.4	Very low	27.3	Very low	141 Å²	141	143.8 Å²	143.8	75%	0.754	76%	0.758	S	S	*	*			trans	71.1	121.4	-174.8	-51.3	-33.3	0	0	0	113.8
1478	E	24.4	Very low	27.2	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	75%	0.753	S	S	*	*				76.3	145.4	63.6	-72	-159.7	143.8	0	0	114.1
1479	S	26.7	Very low	26.7	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	75%	0.749	S	S	*	*			trans	58.3	127.4	-179.4	36.3	0	0	0	0	115.8
1480	D	29.5	Very low	26.8	Very low	154 Å²	154	140.6 Å²	140.6	82%	0.824	74%	0.744	S	S	*	*			cis	-147.3	138.4	26.1	-93.2	-32.3	0	0	0	113.7
1481	Y	24.5	Very low	26.7	Very low	219 Å²	219	136.1 Å²	136.1	86%	0.859	74%	0.739	S	S	*	*			trans	-70.4	151.5	141.9	-92.9	-99.3	0	0	0	107.2
1482	P	31.9	Very low	27.4	Very low	98 Å²	98	132.6 Å²	132.6	64%	0.636	73%	0.73	S	S	*	*				-163.5	-174.4	56.5	45.6	-23.8	0	0	0	119.5
1483	N	29.6	Very low	27.5	Very low	122 Å²	122	136 Å²	136	65%	0.652	73%	0.733	S	S	*	*			trans	88.5	117.9	137	-75.4	-14.5	0	0	0	123.6
1484	F	28	Very low	27.6	Very low	159 Å²	159	135.1 Å²	135.1	70%	0.697	74%	0.735	S	S	*	*			trans	59	127.5	139.5	-70.6	-107.8	0	0	0	119.7
1485	I	26	Very low	27.5	Very low	133 Å²	133	134 Å²	134	68%	0.682	74%	0.738	S	S	*	*			cis	79.3	138.7	48.7	-65.6	166.2	0	0	0	112.5
1486	L	28.5	Very low	27.7	Very low	137 Å²	137	135 Å²	135	72%	0.717	74%	0.738	S	S	*	*			trans	71.9	111.9	-177.6	-68.3	157.5	0	0	0	113.5
1487	H	26.5	Very low	27.6	Very low	164 Å²	164	142.1 Å²	142.1	76%	0.759	75%	0.748	S	S	*	*				84.3	150.2	70.6	-90.9	-134.3	0	0	0	113.3
1488	S	25.4	Very low	27.7	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	75%	0.745	S	S	*	*			trans	58.5	117.4	161.2	42	0	0	0	0	116.6
1489	S	21.3	Very low	28	Very low	100 Å²	100	140 Å²	140	70%	0.699	74%	0.743	S	S	*	*				53.8	134	69.8	81.8	0	0	0	0	114.8
1490	S	25.3	Very low	28.2	Very low	109 Å²	109	140.2 Å²	140.2	76%	0.762	74%	0.736	S	S	*	*			trans	61.9	120.1	168.7	51.2	0	0	0	0	118.1
1491	S	22.9	Very low	28.2	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	73%	0.73	S	S	*	*			cis	113.2	-164.6	31.7	71.4	0	0	0	0	112.2
1492	P	39.5	Very low	28.4	Very low	99 Å²	99	139.6 Å²	139.6	64%	0.643	73%	0.726	S	S	*	*				-122.8	-170.2	-115.9	36.2	-16.1	0	0	0	113.8
1493	K	26.2	Very low	28.1	Very low	174 Å²	174	139.8 Å²	139.8	76%	0.757	73%	0.73	S	S	*	*				172.5	168.3	119.9	-92.9	156.9	-172.2	171.2	0	115.8
1494	H	30.1	Very low	28.3	Very low	184 Å²	184	139.6 Å²	139.6	85%	0.852	74%	0.735	S	S	*	*			trans	76.5	111.7	175.8	-56.8	-83.7	0	0	0	114.3
1495	S	27.5	Very low	28.1	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	74%	0.739	S	S	*	*	S	Bend	cis	-148.8	163.2	6.5	71.7	0	0	0	0	110.4
1496	Q	32.2	Very low	28.2	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	75%	0.748	S	S	*	*			cis	-159.8	136.6	7.4	-145.1	-179.1	81.1	0	0	111.6
1497	R	25.7	Very low	27.9	Very low	228 Å²	228	140.5 Å²	140.5	86%	0.86	75%	0.748	S	S	*	*			trans	68	160.3	154.9	-89.6	-178.7	175.8	-175.9	-1.6	119.6
1498	P	30.5	Very low	27.8	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	75%	0.748	S	S	*	*				-140.7	-167.6	-122.5	36.9	-12.9	0	0	0	117.9
1499	Q	30.4	Very low	27.8	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	75%	0.749	S	S	*	*			trans	88.4	144.2	164.3	-56.5	-161.8	5.1	0	0	117.3
1500	N	30.3	Very low	27.8	Very low	112 Å²	112	141.6 Å²	141.6	60%	0.599	74%	0.744	S	S	*	*			cis	-160.3	144.3	-10.5	-109.3	-2	0	0	0	113.9
1501	F	29.4	Very low	28	Very low	162 Å²	162	143.3 Å²	143.3	71%	0.711	74%	0.744	S	S	*	*			trans	67	118.8	136.1	-80	-126.9	0	0	0	125.2
1502	Y	28.9	Very low	28.2	Very low	197 Å²	197	142.6 Å²	142.6	77%	0.773	74%	0.739	S	S	*	*				79.8	147.3	124	-89.6	-107	0	0	0	126.4
1503	S	26.8	Very low	27.7	Very low	103 Å²	103	145.1 Å²	145.1	72%	0.72	75%	0.747	S	S	*	*			trans	80.5	127.4	144.6	-67.1	0	0	0	0	123.6
1504	P	34	Very low	27.7	Very low	117 Å²	117	146.1 Å²	146.1	76%	0.76	75%	0.752	S	S	*	*			trans	-110.9	156.8	153.5	38.2	-29.6	0	0	0	114.3
1505	S	23.3	Very low	27.8	Very low	112 Å²	112	143 Å²	143	78%	0.783	75%	0.747	S	S	*	*			trans	59.5	103	158.3	58.4	0	0	0	0	121.4
1506	K	27.1	Very low	28.2	Very low	199 Å²	199	143.1 Å²	143.1	87%	0.865	75%	0.746	S	S	*	*			trans	171.2	140.5	147.6	-96.3	164.7	-176.7	-176.3	0	106.1
1507	I	23.3	Very low	28.1	Very low	138 Å²	138	142.7 Å²	142.7	71%	0.708	74%	0.744	S	S	*	*			cis	73.8	113.8	32.1	-59	-178.5	0	0	0	113.8
1508	H	24.7	Very low	28.4	Very low	165 Å²	165	137.5 Å²	137.5	76%	0.764	73%	0.733	S	S	*	*			trans	66	154.1	170.4	-65.3	-36.4	0	0	0	116.2
1509	L	23.8	Very low	28.5	Very low	137 Å²	137	139.3 Å²	139.3	72%	0.717	74%	0.737	S	S	*	*			cis	-158.6	156.9	-12.4	-116.3	164.1	0	0	0	110.4
1510	S	22.8	Very low	28.4	Very low	84 Å²	84	138.2 Å²	138.2	59%	0.587	74%	0.737	S	S	*	*			trans	53.9	-178.4	143.1	73.2	0	0	0	0	122.3
1511	D	28.8	Very low	28.2	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	74%	0.743	S	S	*	*			trans	65.5	134.5	166.8	-46.2	-9	0	0	0	116.1
1512	S	26.2	Very low	28.1	Very low	97 Å²	97	136 Å²	136	68%	0.678	72%	0.722	S	S	*	*			cis	-171.5	161.4	-18.4	60.1	0	0	0	0	102.8
1513	D	30.5	Very low	28	Very low	152 Å²	152	135.6 Å²	135.6	81%	0.813	72%	0.721	S	S	*	*				-145.2	176.2	50.5	-75.7	-43	0	0	0	114
1514	K	26.1	Very low	28.1	Very low	196 Å²	196	134.8 Å²	134.8	85%	0.852	71%	0.708	S	S	*	*			trans	-100	-164.8	176.8	-49.3	170.4	179.4	172.2	0	109.8
1515	P	32.2	Very low	27.8	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	70%	0.703	S	S	*	*				-107.4	-156.8	-58.9	36.5	-19.8	0	0	0	108.1
1516	P	34.7	Very low	27.9	Very low	109 Å²	109	134.3 Å²	134.3	71%	0.708	69%	0.69	S	S	*	*			cis	-132.1	-154.9	-1.6	43.1	-20.9	0	0	0	112
1517	E	31.4	Very low	27.9	Very low	156 Å²	156	129 Å²	129	73%	0.729	67%	0.674	S	S	*	*			cis	-154.6	163	-1.9	-146	-179.1	-86.4	0	0	112.3
1518	N	32.1	Very low	28	Very low	118 Å²	118	125.9 Å²	125.9	63%	0.631	66%	0.658	S	S	*	*			trans	28.7	129.7	147.7	-73.5	-15.9	0	0	0	124.8
1519	N	32.4	Very low	28	Very low	147 Å²	147	124 Å²	124	79%	0.786	65%	0.653	S	S	*	*			trans	93.8	150.2	138.5	-63.4	-7.7	0	0	0	121.4
1520	D	27	Very low	28.3	Very low	140 Å²	140	126 Å²	126	75%	0.749	66%	0.658	S	S	*	*			trans	-99.4	177.7	-162.5	-68.2	-68.1	0	0	0	115.3
1521	Y	27.6	Very low	28.4	Very low	188 Å²	188	126.7 Å²	126.7	74%	0.737	66%	0.659	S	S	*	*			trans	84	86.2	164.4	-59.3	-79.8	0	0	0	119.3
1522	S	26.5	Very low	28.4	Very low	38 Å²	38	125.2 Å²	125.2	27%	0.266	66%	0.659	S	S	.	*				48.1	110.2	121.2	63.8	0	0	0	0	121.5	S1551 V1552	S1522-S1551 WeakPolarHBondContact CB-O 3.31Å; S1522-V1552 WeakPolarHBondContact CB-O 3.44Å; S1522-V1552 VanDerWaalsContact OG-C 3.28Å; S1522-V1552 PolarHBondContact OG-O 3.45Å
1523	Y	27.2	Very low	28.9	Very low	190 Å²	190	131.8 Å²	131.8	75%	0.745	67%	0.669	S	S	*	*			trans	-133	167.1	142.1	-107.1	-96.6	0	0	0	107.2	L1549 S1550 S1551	Y1523-L1549 CarbonylContact C-O 2.77Å; Y1523-L1549 CarbonylContact O-C 2.82Å; Y1523-S1550 VanDerWaalsContact C-C 3.43Å; Y1523-S1550 CarbonylContact O-C 3.51Å; Y1523-S1550 WeakPolarHBondContact O-CA 3.32Å; Y1523-S1550 PolarHBondContact O-N 3Å; Y1523-S1551 PolarHBondContact O-N 3.4Å
1524	N	29.1	Very low	28.9	Very low	86 Å²	86	130.8 Å²	130.8	46%	0.46	66%	0.663	S	S	.	*	B	Isolated β-bridge	cis	158.9	-126.3	28.2	-85	89.6	0	0	0	105.1	E1548 L1549 S1550 S1551	N1524-E1548 CarbonylContact C-O 3.59Å; N1524-E1548 VanDerWaalsContact C-O 3.24Å; N1524-E1548 WeakPolarHBondContact CA-O 3.41Å; N1524-L1549 VanDerWaalsContact N-C 3.28Å; N1524-S1550 VanDerWaalsContact N-C 3.28Å; N1524-S1550 VanDerWaalsContact O-CA 3.28Å; N1524-S1550 WeakPolarHBondContact O-CA 3.23Å; N1524-S1550 VanDerWaalsContact O-CB 3.24Å; N1524-S1550 WeakPolarHBondContact O-CB 3.33Å; N1524-S1550 PolarHBondContact O-N 2.88Å; N1524-S1551 PolarHBondContact O-N 3.39Å; N1524-S1551 VanDerWaalsContact O-N 3.14Å; N1524-S1551 WeakPolarHBondContact OD1-CA 3.3Å
1525	L	26.1	Very low	29.2	Very low	125 Å²	125	128.4 Å²	128.4	65%	0.654	66%	0.66	S	S	*	*			trans	-161.1	137.3	159.1	-135	177.5	0	0	0	114	E1548 L1549	L1525-E1548 VanDerWaalsContact C-C 3.47Å; L1525-E1548 PolarHBondContact N-O 2.84Å; L1525-E1548 CarbonylContact O-C 3.38Å; L1525-E1548 VanDerWaalsContact O-CA 3.3Å; L1525-E1548 WeakPolarHBondContact O-CA 3.44Å; L1525-E1548 WeakPolarHBondContact O-CB 3.37Å; L1525-E1548 WeakPolarHBondContact O-CG 3.43Å; L1525-L1549 VanDerWaalsContact C-CA 3.49Å
1526	N	25.7	Very low	29.2	Very low	93 Å²	93	130.8 Å²	130.8	50%	0.497	67%	0.666	S	S	.	*			trans	117.2	-125.7	161.9	-156.9	43	0	0	0	120.9	E1548 L1549	N1526-E1548 HydrophobicContact CB-CB 4.03Å; N1526-E1548 VanDerWaalsContact CB-CD 3.47Å; N1526-E1548 HydrophobicContact CB-CG 3.99Å; N1526-E1548 VanDerWaalsContact CB-OE1 3.3Å; N1526-E1548 WeakPolarHBondContact CB-OE1 3.29Å; N1526-E1548 PolarHBondContact ND2-OE1 3.33Å; N1526-L1549 VanDerWaalsContact O-CD1 3.29Å; N1526-L1549 WeakPolarHBondContact O-CD1 3.17Å; N1526-L1549 VanDerWaalsContact O-CG 3.26Å; N1526-L1549 WeakPolarHBondContact O-CG 3.21Å
1527	V	27.1	Very low	29	Very low	88 Å²	88	130.9 Å²	130.9	53%	0.533	66%	0.661	S	S	.	*			trans	-105.2	-158.3	-162.2	-143.1	0	0	0	0	116	E1548	V1527-E1548 VanDerWaalsContact CA-OE2 3.3Å; V1527-E1548 WeakPolarHBondContact CA-OE2 3.28Å; V1527-E1548 WeakPolarHBondContact CB-OE2 3.41Å; V1527-E1548 WeakPolarHBondContact CG2-OE2 3.38Å; V1527-E1548 PolarHBondContact N-OE2 2.89Å
1528	N	25.7	Very low	28.9	Very low	72 Å²	72	133.4 Å²	133.4	39%	0.385	66%	0.664	S	S	.	*				-146.6	-128.6	89.2	-158.1	1.6	0	0	0	117.1	E1547	N1528-E1547 PolarHBondContact ND2-OE2 3.38Å
1529	I	24.9	Very low	28.5	Very low	125 Å²	125	134 Å²	134	64%	0.641	67%	0.671	S	S	*	*			trans	-142.6	147.6	-144.2	-82.2	173.4	0	0	0	118.7	T1531	I1529-T1531 HydrophobicContact CG2-CG2 3.74Å
1530	H	31	Very low	28.3	Very low	181 Å²	181	133 Å²	133	84%	0.838	67%	0.671	S	S	*	*			trans	-173.9	105.1	145.8	-99.5	-52	0	0	0	109.5
1531	T	24.7	Very low	28.3	Very low	97 Å²	97	133 Å²	133	60%	0.595	67%	0.67	S	S	*	*				66.5	117.5	68.9	69.4	0	0	0	0	116.9	I1529	I1529-T1531 HydrophobicContact CG2-CG2 3.74Å
1532	C	28.7	Very low	28.3	Very low	115 Å²	115	130.3 Å²	130.3	78%	0.777	67%	0.673	S	S	*	*				162.1	156.4	119	-88	0	0	0	0	112.5
1533	R	36.1	Very low	28.6	Very low	234 Å²	234	133.7 Å²	133.7	88%	0.883	69%	0.694	S	S	*	*			trans	79.2	128.6	175.5	-65.5	-174.9	173.8	161.9	0.5	118.3
1534	D	30.9	Very low	28.6	Very low	132 Å²	132	131.5 Å²	131.5	71%	0.706	69%	0.694	S	S	*	*				179.5	161.8	-51.8	-83.7	-34.4	0	0	0	106.8
1535	D	32	Very low	28.6	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	71%	0.71	S	S	*	*			trans	65	73.7	162.6	-59.5	-28.2	0	0	0	120.7
1536	D	32.8	Very low	28.8	Very low	167 Å²	167	134 Å²	134	89%	0.893	71%	0.709	S	S	*	*	S	Bend	trans	-162.5	98.9	144	-177.8	26.4	0	0	0	110.8
1537	D	31.2	Very low	29	Very low	112 Å²	112	135.4 Å²	135.4	60%	0.599	71%	0.713	S	S	*	*	S	Bend	cis	-140.1	163.1	-22	179.5	29.3	0	0	0	107.4
1538	R	28.8	Very low	29.1	Very low	209 Å²	209	134.1 Å²	134.1	79%	0.789	70%	0.701	S	S	*	*			trans	59.6	73	164.3	-79.6	160.1	-157.9	-100.1	-13	118.2
1539	V	24	Very low	29.2	Very low	129 Å²	129	136.2 Å²	136.2	78%	0.782	71%	0.711	S	S	*	*			trans	-37.1	127.3	152.3	173.1	0	0	0	0	114.5
1540	T	27.7	Very low	29.4	Very low	128 Å²	128	133.4 Å²	133.4	79%	0.785	70%	0.703	S	S	*	*			trans	-161.9	148.3	147.1	36.2	0	0	0	0	110.3
1541	L	27	Very low	29.3	Very low	140 Å²	140	127.7 Å²	127.7	73%	0.733	68%	0.683	S	S	*	*			cis	-164.2	145.8	-30.2	-122.5	179.3	0	0	0	108.9
1542	V	27	Very low	29.4	Very low	131 Å²	131	127.4 Å²	127.4	79%	0.794	68%	0.681	S	S	*	*			trans	71.6	142.2	169.5	-175.8	0	0	0	0	116.4
1543	P	33	Very low	29.5	Very low	109 Å²	109	128 Å²	128	71%	0.708	68%	0.675	S	S	*	*			trans	-125.2	-176.3	-154	44.1	-30.2	0	0	0	116.2
1544	I	28.4	Very low	29.3	Very low	144 Å²	144	125 Å²	125	74%	0.738	67%	0.672	S	S	*	*			trans	176.9	135.9	137.3	-95.8	160.4	0	0	0	115.6
1545	E	28.4	Very low	29.6	Very low	172 Å²	172	123.7 Å²	123.7	80%	0.804	67%	0.67	S	S	*	*			trans	66.4	171	151.1	-74	162.7	-146.6	0	0	126.6
1546	S	29.3	Very low	29.4	Very low	90 Å²	90	127.2 Å²	127.2	63%	0.629	67%	0.674	S	S	*	*			trans	-177.3	-170.6	-134.4	57.8	0	0	0	0	115.8
1547	E	29.8	Very low	29.3	Very low	124 Å²	124	123.8 Å²	123.8	58%	0.579	66%	0.663	S	S	*	*			trans	81.8	140.4	154.3	-81.8	-62.5	-7.6	0	0	123.7	N1528	N1528-E1547 PolarHBondContact ND2-OE2 3.38Å
1548	E	30	Very low	29.3	Very low	61 Å²	61	125 Å²	125	29%	0.285	67%	0.67	S	S	.	*			trans	-141.9	-97.8	-137	-72.1	-174.8	131.8	0	0	120.5	N1524 L1525 N1526 V1527	N1524-E1548 CarbonylContact C-O 3.59Å; N1524-E1548 VanDerWaalsContact C-O 3.24Å; N1524-E1548 WeakPolarHBondContact CA-O 3.41Å; L1525-E1548 VanDerWaalsContact C-C 3.47Å; L1525-E1548 PolarHBondContact N-O 2.84Å; L1525-E1548 CarbonylContact O-C 3.38Å; L1525-E1548 VanDerWaalsContact O-CA 3.3Å; L1525-E1548 WeakPolarHBondContact O-CA 3.44Å; L1525-E1548 WeakPolarHBondContact O-CB 3.37Å; L1525-E1548 WeakPolarHBondContact O-CG 3.43Å; N1526-E1548 HydrophobicContact CB-CB 4.03Å; N1526-E1548 VanDerWaalsContact CB-CD 3.47Å; N1526-E1548 HydrophobicContact CB-CG 3.99Å; N1526-E1548 VanDerWaalsContact CB-OE1 3.3Å; N1526-E1548 WeakPolarHBondContact CB-OE1 3.29Å; N1526-E1548 PolarHBondContact ND2-OE1 3.33Å; V1527-E1548 VanDerWaalsContact CA-OE2 3.3Å; V1527-E1548 WeakPolarHBondContact CA-OE2 3.28Å; V1527-E1548 WeakPolarHBondContact CB-OE2 3.41Å; V1527-E1548 WeakPolarHBondContact CG2-OE2 3.38Å; V1527-E1548 PolarHBondContact N-OE2 2.89Å
1549	L	27.8	Very low	29.3	Very low	115 Å²	115	121.8 Å²	121.8	60%	0.602	67%	0.668	S	S	*	*			trans	-71.5	121.2	-137.6	-153.2	177.4	0	0	0	127.3	Y1523 N1524 L1525 N1526	Y1523-L1549 CarbonylContact C-O 2.77Å; Y1523-L1549 CarbonylContact O-C 2.82Å; N1524-L1549 VanDerWaalsContact N-C 3.28Å; L1525-L1549 VanDerWaalsContact C-CA 3.49Å; N1526-L1549 VanDerWaalsContact O-CD1 3.29Å; N1526-L1549 WeakPolarHBondContact O-CD1 3.17Å; N1526-L1549 VanDerWaalsContact O-CG 3.26Å; N1526-L1549 WeakPolarHBondContact O-CG 3.21Å
1550	S	28.5	Very low	29.7	Very low	67 Å²	67	120 Å²	120	47%	0.469	67%	0.667	S	S	.	*	B	Isolated β-bridge	trans	101.6	44.2	139	155.6	0	0	0	0	129.4	Y1523 N1524	Y1523-S1550 VanDerWaalsContact C-C 3.43Å; Y1523-S1550 CarbonylContact O-C 3.51Å; Y1523-S1550 WeakPolarHBondContact O-CA 3.32Å; Y1523-S1550 PolarHBondContact O-N 3Å; N1524-S1550 VanDerWaalsContact N-C 3.28Å; N1524-S1550 VanDerWaalsContact O-CA 3.28Å; N1524-S1550 WeakPolarHBondContact O-CA 3.23Å; N1524-S1550 VanDerWaalsContact O-CB 3.24Å; N1524-S1550 WeakPolarHBondContact O-CB 3.33Å; N1524-S1550 PolarHBondContact O-N 2.88Å
1551	S	28.7	Very low	29.8	Very low	60 Å²	60	116.7 Å²	116.7	42%	0.42	66%	0.658	S	S	.	*			trans	68.2	154.8	167.2	73.3	0	0	0	0	125.9	S1522 Y1523 N1524	S1522-S1551 WeakPolarHBondContact CB-O 3.31Å; Y1523-S1551 PolarHBondContact O-N 3.4Å; N1524-S1551 PolarHBondContact O-N 3.39Å; N1524-S1551 VanDerWaalsContact O-N 3.14Å; N1524-S1551 WeakPolarHBondContact OD1-CA 3.3Å
1552	V	28.4	Very low	29.9	Very low	92 Å²	92	119.6 Å²	119.6	56%	0.558	67%	0.665	S	S	*	*			trans	95.6	69.4	156.8	-154.7	0	0	0	0	123.8	S1522	S1522-V1552 WeakPolarHBondContact CB-O 3.44Å; S1522-V1552 VanDerWaalsContact OG-C 3.28Å; S1522-V1552 PolarHBondContact OG-O 3.45Å
1553	I	30.4	Very low	30	Very low	127 Å²	127	121.3 Å²	121.3	65%	0.651	66%	0.664	S	S	*	*			trans	78.6	104.1	146	-51.3	173.2	0	0	0	120.1
1554	Q	31.9	Very low	29.9	Very low	172 Å²	172	123.6 Å²	123.6	80%	0.804	67%	0.666	S	S	*	*				33.1	144.7	129.9	-84	-169.7	-5.5	0	0	122.1
1555	P	35.6	Very low	30.1	Very low	104 Å²	104	121.6 Å²	121.6	68%	0.675	66%	0.66	S	S	*	*				-158.2	177.4	56	45.2	-24.9	0	0	0	121.3
1556	Y	28.1	Very low	30	Very low	218 Å²	218	121.1 Å²	121.1	86%	0.855	66%	0.662	S	S	*	*			trans	81.2	151.6	152.6	-86.6	-69.1	0	0	0	123.9
1557	S	30.8	Very low	29.8	Very low	95 Å²	95	120 Å²	120	66%	0.664	66%	0.659	S	S	*	*			trans	64	107.6	165.4	48.5	0	0	0	0	120.9
1558	D	31.7	Very low	29.5	Very low	139 Å²	139	121.9 Å²	121.9	74%	0.743	67%	0.668	S	S	*	*				48.3	148	106.5	-66.8	-61.3	0	0	0	122
1559	N	29.8	Very low	29.2	Very low	140 Å²	140	126.8 Å²	126.8	75%	0.749	68%	0.684	S	S	*	*			cis	-172.1	138.4	-26.7	-141.9	-47.4	0	0	0	109.2
1560	A	31.6	Very low	29.1	Very low	93 Å²	93	129.5 Å²	129.5	77%	0.769	69%	0.688	S	S	*	*			trans	58.4	156.7	175.5	0	0	0	0	0	117.2
1561	G	29.4	Very low	29.2	Very low	58 Å²	58	133.9 Å²	133.9	60%	0.598	71%	0.706	S	S	*	*			cis	122.7	163.1	-2.8	0	0	0	0	0	113.6
1562	K	28.6	Very low	29.2	Very low	200 Å²	200	134.1 Å²	134.1	87%	0.87	72%	0.718	S	S	*	*			trans	75.8	154.6	-161.1	-45.2	157.9	-171.6	169.6	0	110.1
1563	E	29.2	Very low	29.3	Very low	168 Å²	168	137.7 Å²	137.7	79%	0.785	73%	0.734	S	S	*	*			cis	-120.9	170.2	18.3	-80	171.4	151.4	0	0	112.1
1564	E	32.4	Very low	29.2	Very low	156 Å²	156	136.5 Å²	136.5	73%	0.729	74%	0.737	S	S	*	*			cis	-143.7	129.8	17.7	-146.7	165.2	-163.3	0	0	112.3
1565	T	31.9	Very low	29.1	Very low	102 Å²	102	134.4 Å²	134.4	63%	0.626	74%	0.736	S	S	*	*			trans	48.6	137.2	143	64.1	0	0	0	0	122.1
1566	L	25.7	Very low	28.5	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	74%	0.738	S	S	*	*				62.9	144.3	50.7	-57.4	161.5	0	0	0	112.3
1567	A	24.9	Very low	28.5	Very low	67 Å²	67	133.2 Å²	133.2	55%	0.554	74%	0.738	S	S	*	*			cis	-164	145.8	-16.2	0	0	0	0	0	108.9
1568	E	24	Very low	28.2	Very low	164 Å²	164	137.4 Å²	137.4	77%	0.766	75%	0.749	S	S	*	*			trans	65.7	164.1	148.2	-63.1	176.7	-179.7	0	0	116.6
1569	Y	24.6	Very low	27.8	Very low	163 Å²	163	135.1 Å²	135.1	64%	0.639	75%	0.749	S	S	*	*			cis	-150.9	143.1	-8.2	-132.1	-155.5	0	0	0	112.2
1570	Y	25.7	Very low	27.7	Very low	173 Å²	173	134 Å²	134	68%	0.678	75%	0.747	S	S	*	*			trans	76.1	158.1	139.9	-90.3	-131.1	0	0	0	123.7
1571	N	30.5	Very low	27.6	Very low	158 Å²	158	139 Å²	139	85%	0.845	75%	0.751	S	S	*	*			trans	69.8	128.2	170.6	-57	-29.4	0	0	0	117.4
1572	G	28.3	Very low	27.6	Very low	66 Å²	66	146.6 Å²	146.6	68%	0.68	76%	0.762	S	S	*	*			cis	173.8	179.1	-5.8	0	0	0	0	0	114.1
1573	N	31.2	Very low	27.7	Very low	167 Å²	167	142.8 Å²	142.8	89%	0.893	76%	0.756	S	S	*	*			trans	62.3	112.5	168.5	-67	-10.4	0	0	0	119.9
1574	S	27.7	Very low	27.7	Very low	101 Å²	101	142 Å²	142	71%	0.706	76%	0.756	S	S	*	*			trans	-47.8	142.9	151.9	52.3	0	0	0	0	114.5
1575	T	28.5	Very low	27.8	Very low	129 Å²	129	141.8 Å²	141.8	79%	0.791	75%	0.754	S	S	*	*				-176.5	155.3	117.3	23	0	0	0	0	113.8
1576	S	23.5	Very low	27.9	Very low	101 Å²	101	146.2 Å²	146.2	71%	0.706	76%	0.76	S	S	*	*			trans	4.9	149.2	146.4	-47.6	0	0	0	0	121.6
1577	K	29.4	Very low	28.2	Very low	196 Å²	196	143.2 Å²	143.2	85%	0.852	75%	0.752	S	S	*	*			trans	83.4	119.2	178.5	-52.5	160.6	-173.7	171.3	0	111.9
1578	M	22.8	Very low	28.8	Very low	183 Å²	183	148.7 Å²	148.7	90%	0.901	77%	0.766	S	S	*	*			cis	66.2	98.1	24.3	-155.8	-174.8	-167.9	0	0	114.4
1579	A	25.1	Very low	29.2	Very low	90 Å²	90	145.2 Å²	145.2	74%	0.744	77%	0.765	S	S	*	*			trans	67	168.5	166.4	0	0	0	0	0	114.9
1580	V	27.1	Very low	29.4	Very low	118 Å²	118	146.5 Å²	146.5	72%	0.715	78%	0.779	S	S	*	*			cis	-139.8	134.3	15	-179.8	0	0	0	0	112.1
1581	K	29.7	Very low	29.5	Very low	196 Å²	196	148.8 Å²	148.8	85%	0.852	79%	0.787	S	S	*	*	S	Bend	trans	-144.6	72.4	141.7	-136.5	174	-171.6	178.1	0	112.8
1582	R	29.9	Very low	29.3	Very low	219 Å²	219	150.3 Å²	150.3	83%	0.826	79%	0.789	S	S	*	*			trans	71.1	115.4	165.6	-55.9	173.7	-179.3	170.2	-1.6	114.8
1583	V	29.8	Very low	29.3	Very low	120 Å²	120	158.1 Å²	158.1	73%	0.727	80%	0.798	S	S	*	*				75.8	121.5	55.7	176.7	0	0	0	0	110.2
1584	L	29.8	Very low	29.3	Very low	152 Å²	152	158.9 Å²	158.9	80%	0.796	80%	0.796	S	S	*	*			cis	-126.4	156.7	27.1	-66.1	83.2	0	0	0	116.3
1585	H	33.4	Very low	29.3	Very low	150 Å²	150	165.6 Å²	165.6	69%	0.694	81%	0.806	S	S	*	*			trans	47.7	139	148.8	-92.2	-152.6	0	0	0	122.6
1586	R	33.5	Very low	29.8	Very low	196 Å²	196	164.9 Å²	164.9	74%	0.74	80%	0.803	S	S	*	*			cis	-165.8	135.4	-11.8	-140.6	-174.8	-148.4	-167	5.1	111.7
1587	S	34	Very low	30	Very low	98 Å²	98	164.4 Å²	164.4	69%	0.685	81%	0.805	S	S	*	*			trans	54	141.7	152.2	49.7	0	0	0	0	123.6
1588	Q	35.9	Very low	29.9	Very low	183 Å²	183	164 Å²	164	86%	0.855	80%	0.804	S	S	*	*			cis	-173.2	150.8	-21.2	-147.2	162.7	-17.4	0	0	114.3
1589	A	32.9	Very low	30.1	Very low	90 Å²	90	161 Å²	161	74%	0.744	79%	0.791	S	S	*	*			trans	65.8	147.3	155	0	0	0	0	0	121.8
1590	M	28.9	Very low	30.1	Very low	190 Å²	190	162.2 Å²	162.2	94%	0.936	79%	0.789	S	S	*	*			cis	-159.3	-174.2	-17.8	-121.8	179.5	178.7	0	0	112.8
1591	R	27.7	Very low	30.2	Very low	221 Å²	221	162.6 Å²	162.6	83%	0.834	79%	0.786	S	S	*	*			trans	-140.3	171.5	-174.2	-63.9	174.2	170.3	172.8	-4.5	112.5
1592	E	27.1	Very low	30.2	Very low	190 Å²	190	160.6 Å²	160.6	89%	0.888	78%	0.778	S	S	*	*				-177.7	-158.2	115.8	-97.6	-179	-164.2	0	0	118
1593	R	28.3	Very low	30	Very low	230 Å²	230	159.1 Å²	159.1	87%	0.868	77%	0.773	S	S	*	*			trans	-140.1	176.7	-143.4	-83.3	178.6	165.3	-179.4	-5.5	117.5
1594	H	30.2	Very low	29.9	Very low	183 Å²	183	159.1 Å²	159.1	85%	0.847	77%	0.769	S	S	*	*			trans	-48.7	162.2	177.1	-60.3	-106.2	0	0	0	120.6
1595	R	27.3	Very low	29.7	Very low	243 Å²	243	162.5 Å²	162.5	92%	0.917	77%	0.771	S	S	*	*				122.3	142.4	129.6	-149.2	172.9	-163.6	-177.6	4.5	116.1
1596	P	39.5	Very low	29.5	Very low	114 Å²	114	160.3 Å²	160.3	74%	0.74	77%	0.772	S	S	*	*			trans	-118.3	170.1	-172.4	42.6	-33.5	0	0	0	117
1597	A	28	Very low	29.9	Very low	91 Å²	91	158.4 Å²	158.4	75%	0.752	78%	0.776	S	S	*	*			trans	66.5	149.3	171.7	0	0	0	0	0	115.9
1598	F	27.2	Very low	29.6	Very low	188 Å²	188	159.1 Å²	159.1	83%	0.825	78%	0.778	S	S	*	*			cis	-163.6	174	7.3	-127.8	-164.3	0	0	0	107.7
1599	L	26	Very low	29.4	Very low	120 Å²	120	155.4 Å²	155.4	63%	0.628	77%	0.773	S	S	*	*			cis	-163.2	167.1	-4.2	-142.5	-174.4	0	0	0	108.1
1600	T	26.2	Very low	29.2	Very low	115 Å²	115	156.5 Å²	156.5	71%	0.706	77%	0.774	S	S	*	*			trans	66.9	154.6	165.2	20.4	0	0	0	0	117.5
1601	L	28	Very low	29.2	Very low	125 Å²	125	153.1 Å²	153.1	65%	0.654	76%	0.763	S	S	*	*			cis	-147	156	15.3	-122.4	-178	0	0	0	111.4
1602	F	30.2	Very low	29.2	Very low	155 Å²	155	148.6 Å²	148.6	68%	0.68	76%	0.756	S	S	*	*			trans	62.7	143.8	158.4	-72.5	-37.4	0	0	0	120.5
1603	R	26.5	Very low	29.2	Very low	188 Å²	188	143.6 Å²	143.6	71%	0.709	74%	0.741	S	S	*	*			cis	-165.3	162	-17.5	-153.9	176.9	-174.1	155.1	0.1	110.4
1604	N	27	Very low	29	Very low	120 Å²	120	139.7 Å²	139.7	64%	0.642	74%	0.738	S	S	*	*			trans	72.7	134.4	153.2	-76.3	-20.5	0	0	0	120
1605	R	26.8	Very low	28.8	Very low	222 Å²	222	136 Å²	136	84%	0.838	73%	0.731	S	S	*	*			trans	61.6	97.9	143.4	-65.5	178.7	-176.3	-153.3	-2	116.7
1606	S	29.2	Very low	28.7	Very low	104 Å²	104	128.7 Å²	128.7	73%	0.727	72%	0.718	S	S	*	*				92.4	143.7	58.3	69.9	0	0	0	0	113.4
1607	L	40.2	Very low	27.9	Very low	157 Å²	157	128.6 Å²	128.6	82%	0.822	72%	0.719	S	S	*	*			trans	-28.3	142.4	143	-69.4	162.1	0	0	0	111.5
1608	P	28.7	Very low	27.8	Very low	112 Å²	112	131 Å²	131	73%	0.727	72%	0.718	S	S	*	*				-140	-166.9	66.7	42.3	-26.9	0	0	0	115
1609	S	30.5	Very low	27.7	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	71%	0.713	S	S	*	*			trans	69.7	124.9	177.2	66	0	0	0	0	116.1
1610	C	30.4	Very low	27.6	Very low	113 Å²	113	128.3 Å²	128.3	76%	0.764	72%	0.715	S	S	*	*			cis	-157.9	149.2	-6	-113.3	0	0	0	0	111.2
1611	V	27.8	Very low	27.5	Very low	119 Å²	119	128.2 Å²	128.2	72%	0.721	72%	0.718	S	S	*	*				46.1	126	130	172.4	0	0	0	0	117.6
1612	D	28.5	Very low	27.3	Very low	126 Å²	126	126.9 Å²	126.9	67%	0.674	72%	0.719	S	S	*	*			cis	-153.1	168.2	-4.3	-115.2	-27.2	0	0	0	108
1613	S	26	Very low	27	Very low	84 Å²	84	128.3 Å²	128.3	59%	0.587	73%	0.725	S	S	*	*				49.3	137.3	75.5	-37.4	0	0	0	0	114.7
1614	D	25	Very low	26.9	Very low	149 Å²	149	125.9 Å²	125.9	80%	0.797	73%	0.726	S	S	*	*			trans	69.5	144.3	159.6	-66.2	-23.5	0	0	0	119.2
1615	C	25.8	Very low	27.1	Very low	104 Å²	104	127.6 Å²	127.6	70%	0.703	73%	0.734	S	S	*	*			cis	-161.6	-170.4	-18.7	-131.1	0	0	0	0	111
1616	S	24.5	Very low	27.1	Very low	91 Å²	91	122 Å²	122	64%	0.636	73%	0.728	S	S	*	*			trans	14.1	128.3	144.2	72.8	0	0	0	0	121
1617	C	24.1	Very low	27.3	Very low	112 Å²	112	122.2 Å²	122.2	76%	0.757	73%	0.726	S	S	*	*				68.6	143.9	117	-63	0	0	0	0	123
1618	L	24.7	Very low	26.8	Very low	140 Å²	140	119 Å²	119	73%	0.733	72%	0.717	S	S	*	*			trans	73.7	138.9	143	-68.7	161.4	0	0	0	120.5
1619	E	25.5	Very low	26.9	Very low	157 Å²	157	119.8 Å²	119.8	73%	0.734	72%	0.716	S	S	*	*			trans	52.7	108.2	135.6	-64.3	174.3	165.3	0	0	118.7
1620	S	23.8	Very low	27	Very low	96 Å²	96	121.2 Å²	121.2	67%	0.671	72%	0.715	S	S	*	*				71.9	135.3	65.5	84.3	0	0	0	0	115.2
1621	C	23.2	Very low	27	Very low	112 Å²	112	120 Å²	120	76%	0.757	71%	0.708	S	S	*	*			trans	64	116.3	172.5	-70.8	0	0	0	0	115.5
1622	S	24.6	Very low	27.2	Very low	97 Å²	97	120.1 Å²	120.1	68%	0.678	71%	0.708	S	S	*	*				60	105.7	78.4	-52.9	0	0	0	0	113.2
1623	F	25	Very low	27.3	Very low	186 Å²	186	120.3 Å²	120.3	82%	0.816	71%	0.709	S	S	*	*				179.8	163.8	107.7	-101.8	-68.5	0	0	0	111.5
1624	L	24.2	Very low	27.4	Very low	136 Å²	136	124.6 Å²	124.6	71%	0.712	72%	0.72	S	S	*	*			trans	42.6	128.9	150	-68.6	155.6	0	0	0	118.2
1625	L	29.9	Very low	27.6	Very low	157 Å²	157	122.8 Å²	122.8	82%	0.822	71%	0.714	S	S	*	*				-148.2	127.2	56.3	-83.4	163.5	0	0	0	113.6
1626	C	27.5	Very low	27.6	Very low	105 Å²	105	122.6 Å²	122.6	71%	0.709	71%	0.714	S	S	*	*			trans	-65.6	154.1	133	-68.1	0	0	0	0	107.8
1627	P	34.3	Very low	27.8	Very low	107 Å²	107	127 Å²	127	70%	0.695	72%	0.724	S	S	*	*			cis	-151.2	-159.9	47.7	40.4	-17.8	0	0	0	115.3
1628	S	28.8	Very low	28	Very low	90 Å²	90	130.8 Å²	130.8	63%	0.629	73%	0.728	S	S	*	*			trans	71.7	136.4	145.5	59.2	0	0	0	0	119.2
1629	D	30.6	Very low	28.8	Very low	129 Å²	129	129.2 Å²	129.2	69%	0.69	73%	0.727	S	S	*	*			cis	-165.9	156.4	-8.7	-114.9	-7.4	0	0	0	111.1
1630	N	33.1	Very low	29.1	Very low	135 Å²	135	129.4 Å²	129.4	72%	0.722	73%	0.727	S	S	*	*			trans	57.1	150.6	144.1	-63.1	-32.2	0	0	0	120.3
1631	S	29.5	Very low	29.3	Very low	89 Å²	89	132.8 Å²	132.8	62%	0.622	73%	0.732	S	S	*	*			cis	178.6	168.4	-14.6	53.2	0	0	0	0	108
1632	V	32.7	Very low	29.6	Very low	121 Å²	121	131.7 Å²	131.7	73%	0.733	73%	0.731	S	S	*	*			trans	68.5	139.8	151.1	156.8	0	0	0	0	116.8
1633	D	30.7	Very low	29.8	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	74%	0.74	S	S	*	*			cis	-150.3	142.1	-23.9	-88.8	-23.7	0	0	0	104.5
1634	E	27.4	Very low	30.1	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	73%	0.727	S	S	*	*				68.7	150.3	78.2	-146.7	178.8	-114.2	0	0	116.2
1635	V	29.9	Very low	30.3	Very low	111 Å²	111	128.5 Å²	128.5	67%	0.673	72%	0.723	S	S	*	*			trans	87.4	101.8	163.6	-168.4	0	0	0	0	119.4
1636	S	26.3	Very low	30.5	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	72%	0.724	S	S	*	*			trans	73.1	164.6	143.9	80.5	0	0	0	0	119
1637	E	28.9	Very low	30.4	Very low	183 Å²	183	130.4 Å²	130.4	86%	0.855	73%	0.726	S	S	*	*			cis	-148	161.1	-3.3	-148.2	159.8	-136.2	0	0	111.9
1638	F	28.6	Very low	30.6	Very low	193 Å²	193	130.4 Å²	130.4	85%	0.846	73%	0.727	S	S	*	*			trans	-99.3	151.3	173.6	-107.6	-88	0	0	0	110.5
1639	P	40.8	Very low	30.9	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	74%	0.738	S	S	*	*				-151.1	153.8	107.2	36.3	-18.8	0	0	0	117.6
1640	H	30.7	Very low	30.8	Very low	160 Å²	160	129.4 Å²	129.4	74%	0.741	74%	0.741	S	S	*	*				20.6	152.1	130	-58.9	-62.5	0	0	0	121.7
1641	Q	28.6	Very low	30.9	Very low	167 Å²	167	128.3 Å²	128.3	78%	0.78	74%	0.741	S	S	*	*			cis	-168.5	162.8	12.2	-130.6	163.1	8.8	0	0	112.1
1642	A	29	Very low	31	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	75%	0.751	S	S	*	*			trans	58.3	163	147.6	0	0	0	0	0	118.8
1643	E	28.6	Very low	30.9	Very low	184 Å²	184	133 Å²	133	86%	0.86	75%	0.751	S	S	*	*			cis	-162.3	171	-25.7	-119.3	-157.3	-80.2	0	0	107.8
1644	S	31.8	Very low	30.9	Very low	79 Å²	79	131.4 Å²	131.4	55%	0.552	75%	0.749	S	S	*	*			cis	-154.2	-171.8	2	68.7	0	0	0	0	110.8
1645	S	29.4	Very low	31.1	Very low	90 Å²	90	130.4 Å²	130.4	63%	0.629	75%	0.749	S	S	*	*			trans	22.7	138.2	146.6	77.6	0	0	0	0	121.6
1646	K	32.6	Very low	31	Very low	194 Å²	194	133.1 Å²	133.1	84%	0.843	75%	0.754	S	S	*	*			cis	-156.9	154	45.7	-72.9	175	-179.6	170.2	0	114.9
1647	S	25.4	Very low	31.3	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	75%	0.752	S	S	*	*			trans	-70.1	175.9	162.4	55.9	0	0	0	0	112.6
1648	P	39.7	Very low	31.5	Very low	108 Å²	108	129.5 Å²	129.5	70%	0.701	74%	0.744	S	S	*	*			cis	-151.6	-175.2	31.9	44.5	-22.5	0	0	0	119.4
1649	S	33.8	Very low	31.6	Very low	125 Å²	125	129.3 Å²	129.3	87%	0.874	74%	0.743	S	S	*	*			trans	73.9	142.4	165.2	70.8	0	0	0	0	117.4
1650	G	29.3	Very low	31.3	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	77%	0.766	S	S	*	*			cis	-160.6	167	-10.1	0	0	0	0	0	112.5
1651	P	36.3	Very low	31.4	Very low	112 Å²	112	133.9 Å²	133.9	73%	0.727	77%	0.767	S	S	*	*			trans	-119	-160.7	-159.5	35	-16.7	0	0	0	115
1652	F	30.7	Very low	31.5	Very low	191 Å²	191	132.1 Å²	132.1	84%	0.838	77%	0.766	S	S	*	*			trans	83.4	149.7	177.2	-66.7	-95.4	0	0	0	117.2
1653	V	31.1	Very low	31.7	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	77%	0.768	S	S	*	*			cis	-169.5	163.1	-35.5	105.6	0	0	0	0	111.1
1654	S	29.9	Very low	31.8	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	76%	0.763	S	S	*	*			trans	72.7	138.8	157.3	64.4	0	0	0	0	124.2
1655	L	30.9	Very low	31.8	Very low	154 Å²	154	134.9 Å²	134.9	81%	0.806	78%	0.776	S	S	*	*			trans	64.7	108.3	132.9	-68.4	168	0	0	0	123.3
1656	H	29.8	Very low	32	Very low	168 Å²	168	137.9 Å²	137.9	78%	0.778	79%	0.786	S	S	*	*				61.1	119.3	112	-118.6	-115.6	0	0	0	121.9
1657	S	31.5	Very low	32	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	78%	0.782	S	S	*	*				104	124.5	121.9	74.9	0	0	0	0	122.9
1658	T	32.4	Very low	32.5	Very low	114 Å²	114	135.9 Å²	135.9	70%	0.699	78%	0.784	S	S	*	*			trans	71.4	131.8	142	21.4	0	0	0	0	123.1
1659	F	30.8	Very low	31.9	Very low	189 Å²	189	138.3 Å²	138.3	83%	0.829	79%	0.791	S	S	*	*			trans	61.6	144.6	167.7	-68.3	-75.1	0	0	0	115.7
1660	I	36	Very low	31.7	Very low	228 Å²	228	139.5 Å²	139.5	100%	1.169	78%	0.783	S	S	*	*			cis	-99	0	16.7	-64.2	169.6	0	0	0	112.5

Retrieved 1,660 of 1,660 residues in 664 ms (Link to these results)

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