A0A087XCI4_POEFO Loading...

phosphatidate phosphatase

AlphaFold DB , UniProt , Accession A0A087XCI4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 981 aa.

						>A0A087XCI4_POEFO|A0A087XCI4
MNIVGQLAETVFVTVKELYRGLNPATLTGGIDVIVVRQPDGSYQCSPFHVRFGKLGVLRSKEKIVDIEVNGESVDLHMKLGDNGEAFFVEEEENMEVPAHLCTSPIPLEVPEDTDVIAEGSGARKKKRRRRHVRYDTQQRDETNSSSEERDKEEPSTKDSDAAQRESPSSTLLLTSKSVYYSMSEEPDEELGATQDRDTHPLSDEELPENRADSPKIDSELLDEAPDLSEPQMQWNWGGFPTPCDPENAPGELKATSHFFPIERQDSFDLGDEVTPSEIIGCVKPQPTADSVCLDSSAQQTSSSSPKNFDDELSSHDVFMSCVSSTEVDSEFTVEEKEEKESSSEKIGTCFNKSQEGAEKVSSVAEGVSENGTLSKTEELIKKMAECTLQESGQDSGGPKDPQQESVSTEQRESDSPSSEQRELDSTPSAPDGGLVPSAGGEDDDTILGATDESPESSAAATTAAQAADADTGSDVAKSSEASSKLEQQDEKKSKQIHPGGSSDIYLEDLNTLDPEVAELYFPKTEAEGALTQFAEQGLGSHSPQLVDIGAVDSGTEYLSDSSYVMDVSMSLCGKVGDTSQITKEKFTEHLVTYQDFINNPGIIEDPSLVICINSNYYNWGVAAPMILSVTAFQKNLPTSTVEKLVKDKMSKKPGRWWFSWRRREMDNNKQQQLKEEQLASVSSPVQATLDNTEAVGLRQKAPSLSSETMSMSFSHMYRKSLRLTSKEIDSLNLREGANKVVFSVTSQYQGTCRCEAAIYLWNWNDRVIISDIDGTITKSDALGHILPQFGKDWTHKGIAKLYHKIHKNGYKFLYCSARAIGMATITKDYLKWVNDQGTVLPKGPVLLAPSSLFSALHREVIEKKPEVFKIACLSDVRDLFGSHKQPFYAAFGNRTNDVFAYKKVGVSESKIFTVNPKGELIQEMNKGNKSSYNHLTGLVEHFFPVVSAETNNAAILVCPEYSSFSYWKDPLPELDMSILT
					

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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	36.2	Very low	37.6	Very low	210 Å²	210	104.4 Å²	104.4	100%	1.034	58%	0.579	S	S	*	*				0	136.8	0	-69.2	131.4	71.4	0	0	108.7	I3	M1-I3 VanDerWaalsContact C-N 3.29Å; M1-I3 HydrophobicContact CB-CD1 4.35Å; M1-I3 HydrophobicContact CB-CG1 4.42Å; M1-I3 HydrophobicContact CE-CD1 4.14Å; M1-I3 PolarHBondContact O-N 3.22Å
2	N	40.5	Very low	37.8	Very low	124 Å²	124	108.2 Å²	108.2	66%	0.663	59%	0.586	S	S	*	*			trans	-91.6	28.2	-166.8	-139.4	11.3	0	0	0	114.6	V4 G5 Q6	N2-V4 PolarHBondContact O-N 3.15Å; N2-G5 PolarHBondContact O-N 2.95Å; N2-Q6 PolarHBondContact O-N 3.04Å
3	I	36.9	Very low	38	Very low	104 Å²	104	105.2 Å²	105.2	53%	0.533	57%	0.573	S	S	.	*	H	α-helix	trans	-66	-37.6	-168.2	-65.4	170.1	0	0	0	112.2	M1 L7	M1-I3 VanDerWaalsContact C-N 3.29Å; M1-I3 HydrophobicContact CB-CD1 4.35Å; M1-I3 HydrophobicContact CB-CG1 4.42Å; M1-I3 HydrophobicContact CE-CD1 4.14Å; M1-I3 PolarHBondContact O-N 3.22Å; I3-L7 VanDerWaalsContact O-CB 3.22Å; I3-L7 WeakPolarHBondContact O-CB 3.46Å; I3-L7 PolarHBondContact O-N 3.17Å
4	V	36.6	Very low	38.1	Very low	126 Å²	126	102.1 Å²	102.1	76%	0.764	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-39.6	175.5	-176.7	0	0	0	0	111	N2 L7 A8	N2-V4 PolarHBondContact O-N 3.15Å; V4-L7 PolarHBondContact O-N 3.14Å; V4-A8 VanDerWaalsContact O-CB 3.29Å; V4-A8 WeakPolarHBondContact O-CB 3.45Å; V4-A8 PolarHBondContact O-N 2.93Å
5	G	36.3	Very low	38.2	Very low	32 Å²	32	96.5 Å²	96.5	33%	0.33	53%	0.53	S	S	.	.	H	α-helix	trans	-61.4	-52.5	173.8	0	0	0	0	0	111.5	N2 L7 A8 E9	N2-G5 PolarHBondContact O-N 2.95Å; G5-L7 VanDerWaalsContact C-N 3.34Å; G5-L7 PolarHBondContact O-N 3.41Å; G5-A8 PolarHBondContact O-N 2.64Å; G5-E9 WeakPolarHBondContact O-CB 3.27Å; G5-E9 PolarHBondContact O-N 3.09Å
6	Q	35.9	Very low	38.2	Very low	115 Å²	115	97.9 Å²	97.9	54%	0.537	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-34	177.6	-72.8	-178.5	-54.3	0	0	113.1	N2 T10	N2-Q6 PolarHBondContact O-N 3.04Å; Q6-T10 WeakPolarHBondContact O-CB 3.21Å; Q6-T10 PolarHBondContact O-N 2.99Å; Q6-T10 PolarHBondContact O-OG1 3.45Å
7	L	36.5	Very low	38.3	Very low	114 Å²	114	98.4 Å²	98.4	60%	0.597	53%	0.527	S	S	*	.	H	α-helix	trans	-72.1	-41	176.2	-169	70.2	0	0	0	111.4	I3 V4 G5 V11	I3-L7 VanDerWaalsContact O-CB 3.22Å; I3-L7 WeakPolarHBondContact O-CB 3.46Å; I3-L7 PolarHBondContact O-N 3.17Å; V4-L7 PolarHBondContact O-N 3.14Å; G5-L7 VanDerWaalsContact C-N 3.34Å; G5-L7 PolarHBondContact O-N 3.41Å; L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.39Å; L7-V11 VanDerWaalsContact O-CG2 3.29Å; L7-V11 WeakPolarHBondContact O-CG2 3.19Å; L7-V11 PolarHBondContact O-N 2.97Å
8	A	38.1	Very low	38.5	Very low	60 Å²	60	96.9 Å²	96.9	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-43.7	173.8	0	0	0	0	0	111.4	V4 G5 V11 F12	V4-A8 VanDerWaalsContact O-CB 3.29Å; V4-A8 WeakPolarHBondContact O-CB 3.45Å; V4-A8 PolarHBondContact O-N 2.93Å; G5-A8 PolarHBondContact O-N 2.64Å; A8-V11 PolarHBondContact O-N 3.27Å; A8-F12 VanDerWaalsContact O-CB 3.28Å; A8-F12 WeakPolarHBondContact O-CB 3.42Å; A8-F12 PolarHBondContact O-N 3.36Å
9	E	37	Very low	38.6	Very low	130 Å²	130	96.3 Å²	96.3	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-64.9	-44.2	176.4	-174.1	169.6	-139.4	0	0	111.5	G5 F12 V13	G5-E9 WeakPolarHBondContact O-CB 3.27Å; G5-E9 PolarHBondContact O-N 3.09Å; E9-F12 PolarHBondContact O-N 2.9Å; E9-V13 WeakPolarHBondContact O-CB 3.27Å; E9-V13 VanDerWaalsContact O-CG2 3.26Å; E9-V13 WeakPolarHBondContact O-CG2 3.44Å; E9-V13 PolarHBondContact O-N 3.09Å
10	T	38.8	Very low	38.8	Very low	79 Å²	79	101.4 Å²	101.4	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-48.1	174.1	-58.1	0	0	0	0	110.7	Q6 F12 V13 T14	Q6-T10 WeakPolarHBondContact O-CB 3.21Å; Q6-T10 PolarHBondContact O-N 2.99Å; Q6-T10 PolarHBondContact O-OG1 3.45Å; T10-F12 VanDerWaalsContact C-N 3.34Å; T10-F12 PolarHBondContact O-N 3.31Å; T10-V13 PolarHBondContact O-N 3.21Å; T10-T14 WeakPolarHBondContact O-CB 3.35Å; T10-T14 PolarHBondContact O-N 3.04Å; T10-T14 PolarHBondContact O-OG1 2.88Å
11	V	41.3	Very low	38.7	Very low	54 Å²	54	99.7 Å²	99.7	33%	0.327	53%	0.528	S	S	.	.	H	α-helix	trans	-58.5	-45.4	175.5	160.6	0	0	0	0	111.2	L7 A8 V13 T14 V15 F790	L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.39Å; L7-V11 VanDerWaalsContact O-CG2 3.29Å; L7-V11 WeakPolarHBondContact O-CG2 3.19Å; L7-V11 PolarHBondContact O-N 2.97Å; A8-V11 PolarHBondContact O-N 3.27Å; V11-V13 VanDerWaalsContact C-N 3.34Å; V11-V13 PolarHBondContact O-N 2.98Å; V11-T14 PolarHBondContact O-N 3.2Å; V11-V15 HydrophobicContact CG1-CG2 4.48Å; V11-V15 WeakPolarHBondContact O-CB 3.42Å; V11-V15 VanDerWaalsContact O-CG2 3.22Å; V11-V15 WeakPolarHBondContact O-CG2 3.41Å; V11-V15 PolarHBondContact O-N 3.49Å; V11-F790 HydrophobicContact CG1-CE1 3.91Å; V11-F790 HydrophobicContact CG1-CZ 3.63Å; V11-F790 HydrophobicContact CG2-CE1 4.23Å; V11-F790 HydrophobicContact CG2-CZ 4.4Å
12	F	39.3	Very low	39.2	Very low	150 Å²	150	92.8 Å²	92.8	66%	0.658	50%	0.495	S	S	*	.	H	α-helix	trans	-67.5	-34.8	-179.9	-154.7	-93.4	0	0	0	112	A8 E9 T10 K16	A8-F12 VanDerWaalsContact O-CB 3.28Å; A8-F12 WeakPolarHBondContact O-CB 3.42Å; A8-F12 PolarHBondContact O-N 3.36Å; E9-F12 PolarHBondContact O-N 2.9Å; T10-F12 VanDerWaalsContact C-N 3.34Å; T10-F12 PolarHBondContact O-N 3.31Å; F12-K16 WeakPolarHBondContact O-CB 3.4Å; F12-K16 PolarHBondContact O-N 3.17Å
13	V	40.6	Very low	39.8	Very low	69 Å²	69	90.1 Å²	90.1	42%	0.418	48%	0.481	S	S	.	.	H	α-helix	trans	-67.4	-50.3	171.9	168.4	0	0	0	0	110.9	E9 T10 V11 V15 K16 E17	E9-V13 WeakPolarHBondContact O-CB 3.27Å; E9-V13 VanDerWaalsContact O-CG2 3.26Å; E9-V13 WeakPolarHBondContact O-CG2 3.44Å; E9-V13 PolarHBondContact O-N 3.09Å; T10-V13 PolarHBondContact O-N 3.21Å; V11-V13 VanDerWaalsContact C-N 3.34Å; V11-V13 PolarHBondContact O-N 2.98Å; V13-V15 VanDerWaalsContact C-N 3.3Å; V13-V15 PolarHBondContact O-N 3.38Å; V13-K16 CarbonylContact O-C 3.6Å; V13-K16 WeakPolarHBondContact O-CA 3.45Å; V13-K16 WeakPolarHBondContact O-CB 3.2Å; V13-K16 PolarHBondContact O-N 3.09Å; V13-E17 HydrophobicContact CG1-CG 4.44Å; V13-E17 WeakPolarHBondContact O-CG 3.45Å; V13-E17 PolarHBondContact O-N 3.02Å
14	T	39.9	Very low	40.5	Very low	63 Å²	63	87.1 Å²	87.1	39%	0.387	47%	0.468	S	S	.	.	H	α-helix	trans	-59	-41.2	177.9	-55.5	0	0	0	0	111.6	T10 V11 E17 L18	T10-T14 WeakPolarHBondContact O-CB 3.35Å; T10-T14 PolarHBondContact O-N 3.04Å; T10-T14 PolarHBondContact O-OG1 2.88Å; V11-T14 PolarHBondContact O-N 3.2Å; T14-E17 PolarHBondContact O-N 2.82Å; T14-L18 WeakPolarHBondContact O-CB 3.32Å; T14-L18 PolarHBondContact O-N 3.3Å
15	V	39.5	Very low	41.1	Very low	18 Å²	18	81.1 Å²	81.1	11%	0.109	43%	0.432	C	S	.	.	H	α-helix	trans	-63	-45	173.6	165.8	0	0	0	0	111.6	V11 V13 E17 L18 Y19 I786 F790	V11-V15 HydrophobicContact CG1-CG2 4.48Å; V11-V15 WeakPolarHBondContact O-CB 3.42Å; V11-V15 VanDerWaalsContact O-CG2 3.22Å; V11-V15 WeakPolarHBondContact O-CG2 3.41Å; V11-V15 PolarHBondContact O-N 3.49Å; V13-V15 VanDerWaalsContact C-N 3.3Å; V13-V15 PolarHBondContact O-N 3.38Å; V15-E17 VanDerWaalsContact C-N 3.3Å; V15-E17 PolarHBondContact O-N 2.95Å; V15-L18 WeakPolarHBondContact O-CB 3.36Å; V15-L18 PolarHBondContact O-N 2.87Å; V15-Y19 PolarHBondContact O-N 2.82Å; V15-I786 HydrophobicContact CG1-CD1 3.7Å; V15-I786 HydrophobicContact CG1-CG1 3.82Å; V15-I786 HydrophobicContact CG1-CG2 4.09Å; V15-I786 HydrophobicContact CG2-CG2 3.57Å; V15-F790 HydrophobicContact CG2-CE2 4.12Å; V15-F790 HydrophobicContact CG2-CZ 4.42Å
16	K	37.9	Very low	42.1	Very low	119 Å²	119	82.1 Å²	82.1	52%	0.517	43%	0.432	S	S	.	.	H	α-helix	trans	-66.5	-30	178.3	-176.1	177.3	-178.7	179.9	0	112.4	F12 V13 R20	F12-K16 WeakPolarHBondContact O-CB 3.4Å; F12-K16 PolarHBondContact O-N 3.17Å; V13-K16 CarbonylContact O-C 3.6Å; V13-K16 WeakPolarHBondContact O-CA 3.45Å; V13-K16 WeakPolarHBondContact O-CB 3.2Å; V13-K16 PolarHBondContact O-N 3.09Å; K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 VanDerWaalsContact O-CG 3.27Å; K16-R20 WeakPolarHBondContact O-CG 3.26Å; K16-R20 PolarHBondContact O-N 3.36Å
17	E	40.3	Very low	43.7	Very low	105 Å²	105	78.6 Å²	78.6	49%	0.491	42%	0.416	S	S	.	.	H	α-helix	trans	-76.6	-40.7	172	-72.6	-171.4	126.5	0	0	112.1	V13 T14 V15 Y19 R20 G21	V13-E17 HydrophobicContact CG1-CG 4.44Å; V13-E17 WeakPolarHBondContact O-CG 3.45Å; V13-E17 PolarHBondContact O-N 3.02Å; T14-E17 PolarHBondContact O-N 2.82Å; V15-E17 VanDerWaalsContact C-N 3.3Å; V15-E17 PolarHBondContact O-N 2.95Å; E17-Y19 VanDerWaalsContact C-N 3.28Å; E17-Y19 PolarHBondContact O-N 2.76Å; E17-R20 CarbonylContact O-C 3.13Å; E17-R20 PolarHBondContact O-N 2.94Å; E17-R20 VanDerWaalsContact O-N 3.07Å; E17-G21 PolarHBondContact O-N 2.81Å
18	L	40.8	Very low	46	Very low	73 Å²	73	74.9 Å²	74.9	38%	0.382	40%	0.398	S	S	.	.	H	α-helix	trans	-56.1	-45.7	171.9	-138.6	83	0	0	0	110.9	T14 V15 G21 L22	T14-L18 WeakPolarHBondContact O-CB 3.32Å; T14-L18 PolarHBondContact O-N 3.3Å; V15-L18 WeakPolarHBondContact O-CB 3.36Å; V15-L18 PolarHBondContact O-N 2.87Å; L18-G21 PolarHBondContact O-N 2.88Å; L18-L22 WeakPolarHBondContact O-CB 3.12Å; L18-L22 WeakPolarHBondContact O-CG 3.39Å; L18-L22 PolarHBondContact O-N 2.92Å
19	Y	42.1	Very low	48.4	Very low	85 Å²	85	72 Å²	72	33%	0.333	38%	0.375	S	S	.	.	H	α-helix	trans	-72.3	-22.5	176.5	-101.5	-82.2	0	0	0	114.6	V15 E17 H785	V15-Y19 PolarHBondContact O-N 2.82Å; E17-Y19 VanDerWaalsContact C-N 3.28Å; E17-Y19 PolarHBondContact O-N 2.76Å; Y19-H785 HydrophobicContact CE2-CB 4.17Å; Y19-H785 WeakPolarHBondContact CE2-O 3.44Å; Y19-H785 WeakPolarHBondContact OH-CB 3.21Å; Y19-H785 PolarHBondContact OH-O 2.68Å
20	R	41.7	Very low	51	Low	197 Å²	197	65.9 Å²	65.9	74%	0.743	35%	0.347	S	S	*	.	H	α-helix	trans	-83.2	-28.2	172.3	-83.3	179.6	161.6	-150	-7	113.1	K16 E17	K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 VanDerWaalsContact O-CG 3.27Å; K16-R20 WeakPolarHBondContact O-CG 3.26Å; K16-R20 PolarHBondContact O-N 3.36Å; E17-R20 CarbonylContact O-C 3.13Å; E17-R20 PolarHBondContact O-N 2.94Å; E17-R20 VanDerWaalsContact O-N 3.07Å
21	G	37.7	Very low	53.6	Low	66 Å²	66	62.3 Å²	62.3	68%	0.68	33%	0.325	S	S	*	.	H	α-helix	trans	-75.1	-37.6	172	0	0	0	0	0	113	E17 L18 N23	E17-G21 PolarHBondContact O-N 2.81Å; L18-G21 PolarHBondContact O-N 2.88Å; G21-N23 PolarHBondContact O-N 2.98Å
22	L	46.1	Very low	56.3	Low	66 Å²	66	60 Å²	60	35%	0.346	31%	0.311	S	S	.	.			trans	-85.6	83.9	-179.9	-69.5	169.4	0	0	0	112.2	L18 P24 L27	L18-L22 WeakPolarHBondContact O-CB 3.12Å; L18-L22 WeakPolarHBondContact O-CG 3.39Å; L18-L22 PolarHBondContact O-N 2.92Å; L22-P24 WeakPolarHBondContact O-CD 3.46Å; L22-L27 HydrophobicContact CD2-CD2 4.13Å
23	N	52.6	Low	59.1	Low	68 Å²	68	53 Å²	53	36%	0.364	28%	0.28	S	S	.	.			trans	-65.4	116	163.9	179.1	-6.2	0	0	0	109.5	G21 A25 T26	G21-N23 PolarHBondContact O-N 2.98Å; N23-A25 PolarHBondContact O-N 3.09Å; N23-A25 VanDerWaalsContact O-N 3.09Å; N23-A25 VanDerWaalsContact OD1-CB 3.28Å; N23-A25 WeakPolarHBondContact OD1-CB 3.46Å; N23-A25 PolarHBondContact OD1-N 3.12Å; N23-T26 PolarHBondContact O-N 3.44Å; N23-T26 PolarHBondContact O-OG1 3.1Å
24	P	51.7	Low	61.8	Low	40 Å²	40	49.7 Å²	49.7	26%	0.26	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.2	-25.9	-178.4	-23.5	35.4	0	0	0	112.9	L22 T26 L27 S852	L22-P24 WeakPolarHBondContact O-CD 3.46Å; P24-T26 VanDerWaalsContact C-N 3.25Å; P24-T26 PolarHBondContact O-N 2.78Å; P24-L27 PolarHBondContact O-N 2.62Å; P24-S852 CarbonylContact C-O 3.58Å; P24-S852 VanDerWaalsContact O-CB 3.27Å; P24-S852 WeakPolarHBondContact O-CB 3.49Å; P24-S852 PolarHBondContact O-OG 3.31Å
25	A	48.1	Very low	64.6	Low	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-72.9	-15.7	179.6	0	0	0	0	0	114.2	N23 R51 S852 F854	N23-A25 PolarHBondContact O-N 3.09Å; N23-A25 VanDerWaalsContact O-N 3.09Å; N23-A25 VanDerWaalsContact OD1-CB 3.28Å; N23-A25 WeakPolarHBondContact OD1-CB 3.46Å; N23-A25 PolarHBondContact OD1-N 3.12Å; A25-R51 PolarHBondContact O-NH2 3.01Å; A25-R51 VanDerWaalsContact O-NH2 3.09Å; A25-S852 VanDerWaalsContact CA-O 3.23Å; A25-S852 WeakPolarHBondContact CA-O 3.48Å; A25-S852 WeakPolarHBondContact CB-O 3.41Å; A25-S852 PolarHBondContact N-O 3.45Å; A25-F854 HydrophobicContact CB-CD2 3.48Å; A25-F854 VanDerWaalsContact CB-CD2 3.48Å; A25-F854 HydrophobicContact CB-CE2 3.26Å; A25-F854 HydrophobicContact CB-CG 4.32Å; A25-F854 HydrophobicContact CB-CZ 3.94Å
26	T	57.4	Low	67.3	Low	53 Å²	53	45.9 Å²	45.9	33%	0.325	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-96.4	0.1	172.8	47.2	0	0	0	0	114	N23 P24 G53 L55	N23-T26 PolarHBondContact O-N 3.44Å; N23-T26 PolarHBondContact O-OG1 3.1Å; P24-T26 VanDerWaalsContact C-N 3.25Å; P24-T26 PolarHBondContact O-N 2.78Å; T26-G53 VanDerWaalsContact O-CA 3.31Å; T26-G53 WeakPolarHBondContact O-CA 3.31Å; T26-L55 HydrophobicContact CG2-CB 4.26Å
27	L	71	Confident	70.1	Confident	41 Å²	41	45.6 Å²	45.6	22%	0.215	23%	0.232	C	C	.	.			trans	-88	144.2	175.9	-64	176.7	0	0	0	112	L22 P24 G822 M823	L22-L27 HydrophobicContact CD2-CD2 4.13Å; P24-L27 PolarHBondContact O-N 2.62Å; L27-G822 WeakPolarHBondContact CD1-O 3.23Å; L27-M823 HydrophobicContact CD1-SD 4.19Å
28	T	84.5	Confident	72.7	Confident	36 Å²	36	41.6 Å²	41.6	22%	0.221	21%	0.214	C	C	.	.			trans	-90.8	138.4	170.4	-65.8	0	0	0	0	108.9	R51 F52 G53 C755	T28-R51 CarbonylContact C-O 3.49Å; T28-R51 VanDerWaalsContact CA-O 3.27Å; T28-R51 WeakPolarHBondContact CA-O 3.47Å; T28-R51 WeakPolarHBondContact CG2-O 3.43Å; T28-F52 HydrophobicContact CG2-CD1 3.98Å; T28-F52 HydrophobicContact CG2-CE1 4.43Å; T28-G53 PolarHBondContact OG1-N 3.28Å; T28-C755 HydrophobicContact CG2-CB 3.56Å
29	G	88	Confident	75.1	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	154.3	-178.7	0	0	0	0	0	113.3	R51 C755 I821	G29-R51 PolarHBondContact N-O 2.87Å; G29-R51 PolarHBondContact O-N 2.78Å; G29-C755 VanDerWaalsContact CA-SG 3.57Å; G29-I821 WeakPolarHBondContact O-CD1 3.34Å
30	G	91.9	Very high	77.5	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.7	179.9	0	0	0	0	0	110.9	H49 C755 K828	G30-H49 WeakPolarHBondContact CA-O 3.37Å; G30-C755 PolarHBondContact N-SG 2.79Å; G30-C755 VanDerWaalsContact N-SG 3.39Å; G30-K828 PolarHBondContact O-NZ 2.73Å
31	I	93.6	Very high	79.8	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-78.2	148.2	172.6	-51.8	-169.7	0	0	0	108.4	H49 I821 V846 L847 L848 P850	I31-H49 HydrophobicContact CB-CB 4.09Å; I31-H49 HydrophobicContact CD1-CB 3.66Å; I31-H49 HydrophobicContact CG1-CB 3.77Å; I31-H49 PolarHBondContact N-O 2.99Å; I31-I821 HydrophobicContact CD1-CD1 4.47Å; I31-I821 HydrophobicContact CG1-CD1 3.9Å; I31-I821 HydrophobicContact CG1-CG1 3.95Å; I31-V846 WeakPolarHBondContact CG2-O 3.36Å; I31-L847 HydrophobicContact CG2-CD2 4.23Å; I31-L848 HydrophobicContact CD1-CB 4.16Å; I31-L848 WeakPolarHBondContact CD1-O 3.45Å; I31-L848 HydrophobicContact CG1-CB 4.29Å; I31-P850 HydrophobicContact CD1-CB 4.13Å
32	D	97.3	Very high	82.6	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.032	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-72.1	139.6	173.4	-61.9	-39.1	0	0	0	110.7	A758 Y760 K828 P845 V846	D32-A758 CarbonylContact C-O 3.59Å; D32-A758 WeakPolarHBondContact CA-O 3.18Å; D32-A758 WeakPolarHBondContact CB-O 3.45Å; D32-A758 PolarHBondContact OD1-N 3.33Å; D32-Y760 HydrophobicContact CB-CD2 4.34Å; D32-Y760 HydrophobicContact CB-CE2 4.18Å; D32-K828 VanDerWaalsContact CG-NZ 3.32Å; D32-K828 VanDerWaalsContact OD1-CE 3.32Å; D32-K828 WeakPolarHBondContact OD1-CE 3.29Å; D32-K828 IonicContact OD1-NZ 3.56Å; D32-K828 PolarHBondContact OD1-NZ 2.82Å; D32-K828 VanDerWaalsContact OD2-CE 3.24Å; D32-K828 WeakPolarHBondContact OD2-CE 3.29Å; D32-K828 IonicContact OD2-NZ 2.65Å; D32-P845 HydrophobicContact CB-CB 3.8Å; D32-V846 PolarHBondContact OD2-N 3.19Å
33	V	97.6	Very high	85	Confident	2 Å²	2	34 Å²	34	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	141.5	-178.9	178.1	0	0	0	0	109.5	V35 C45 S46 F48 A758 I759 Y760	V33-V35 HydrophobicContact CG1-CG2 4.26Å; V33-C45 HydrophobicContact CG1-CB 4.32Å; V33-S46 WeakPolarHBondContact CA-OG 3.26Å; V33-F48 HydrophobicContact CG1-CD2 4.23Å; V33-F48 HydrophobicContact CG1-CE2 3.81Å; V33-F48 HydrophobicContact CG1-CZ 4.01Å; V33-F48 HydrophobicContact CG2-CD1 3.87Å; V33-F48 HydrophobicContact CG2-CD2 4.13Å; V33-F48 HydrophobicContact CG2-CE1 4.05Å; V33-F48 HydrophobicContact CG2-CE2 4.3Å; V33-F48 HydrophobicContact CG2-CG 3.91Å; V33-F48 HydrophobicContact CG2-CZ 4.26Å; V33-A758 PolarHBondContact N-O 3.3Å; V33-I759 HydrophobicContact CB-CG1 4.31Å; V33-I759 HydrophobicContact CB-CG2 4.33Å; V33-I759 HydrophobicContact CG1-CG2 4.32Å; V33-I759 WeakPolarHBondContact O-CA 3.37Å; V33-Y760 PolarHBondContact O-N 3.3Å
34	I	98.2	Very high	87	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128	173.3	-50.3	-176.5	0	0	0	107.6	V36 C45 S46 W762 L814 P845 V877 L880	I34-V36 HydrophobicContact CG2-CG2 4.18Å; I34-C45 CarbonylContact O-C 3.58Å; I34-C45 VanDerWaalsContact O-CA 3.26Å; I34-C45 WeakPolarHBondContact O-CA 3.4Å; I34-S46 PolarHBondContact N-OG 3.06Å; I34-S46 PolarHBondContact O-N 2.91Å; I34-W762 HydrophobicContact CD1-CH2 4.43Å; I34-W762 HydrophobicContact CD1-CZ3 4.04Å; I34-W762 HydrophobicContact CG2-CD2 4.23Å; I34-W762 HydrophobicContact CG2-CE3 3.52Å; I34-W762 HydrophobicContact CG2-CZ3 3.84Å; I34-L814 HydrophobicContact CD1-CD1 3.65Å; I34-P845 HydrophobicContact CD1-CB 4.21Å; I34-P845 HydrophobicContact CD1-CG 3.74Å; I34-P845 HydrophobicContact CG1-CB 3.94Å; I34-P845 HydrophobicContact CG1-CG 3.79Å; I34-V877 HydrophobicContact CD1-CG1 3.76Å; I34-V877 HydrophobicContact CD1-CG2 3.93Å; I34-L880 HydrophobicContact CB-CD1 4.22Å; I34-L880 HydrophobicContact CG2-CD1 4.32Å
35	V	98.1	Very high	89.2	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.7	173.7	177.8	0	0	0	0	107.6	V33 Y43 Q44 C45 I729 L734 I759 Y760 L761 W762	V33-V35 HydrophobicContact CG1-CG2 4.26Å; V35-Y43 HydrophobicContact CG1-CD1 4.03Å; V35-Y43 HydrophobicContact CG1-CG 4.35Å; V35-Q44 CarbonylContact C-O 3.56Å; V35-Q44 WeakPolarHBondContact CA-O 3.37Å; V35-C45 HydrophobicContact CG2-CB 3.95Å; V35-I729 HydrophobicContact CG1-CG2 3.63Å; V35-I729 HydrophobicContact CG2-CG2 4.43Å; V35-L734 HydrophobicContact CB-CD1 4.28Å; V35-L734 HydrophobicContact CG1-CD1 4.26Å; V35-L734 HydrophobicContact CG2-CD1 3.93Å; V35-I759 HydrophobicContact CG2-CG2 3.59Å; V35-Y760 PolarHBondContact N-O 2.96Å; V35-L761 HydrophobicContact CB-CD1 4.12Å; V35-L761 HydrophobicContact CG1-CD1 3.68Å; V35-L761 WeakPolarHBondContact O-CA 3.4Å; V35-W762 PolarHBondContact O-N 3.22Å
36	V	97.3	Very high	91.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.9	178.7	-175.3	0	0	0	0	109.2	I34 Q38 Q44 W762 W764 L880 F881	I34-V36 HydrophobicContact CG2-CG2 4.18Å; V36-Q38 PolarHBondContact O-NE2 3.22Å; V36-Q44 PolarHBondContact N-O 3.46Å; V36-Q44 PolarHBondContact O-N 2.82Å; V36-Q44 VanDerWaalsContact O-N 3.09Å; V36-W762 WeakPolarHBondContact CA-O 3.36Å; V36-W764 HydrophobicContact CG1-CB 4.28Å; V36-L880 HydrophobicContact CB-CB 4.18Å; V36-L880 WeakPolarHBondContact CB-O 3.37Å; V36-L880 HydrophobicContact CG2-CB 3.68Å; V36-L880 HydrophobicContact CG2-CD1 4.31Å; V36-F881 HydrophobicContact CG1-CD1 3.94Å; V36-F881 HydrophobicContact CG1-CE1 4.17Å; V36-F881 HydrophobicContact CG1-CG 4.17Å; V36-F881 HydrophobicContact CG2-CD2 4.03Å; V36-F881 HydrophobicContact CG2-CE1 4.29Å; V36-F881 HydrophobicContact CG2-CE2 3.76Å; V36-F881 HydrophobicContact CG2-CG 4.42Å; V36-F881 HydrophobicContact CG2-CZ 3.91Å
37	R	95.8	Very high	93.2	Very high	113 Å²	113	30.3 Å²	30.3	43%	0.426	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.5	171.6	-169.8	-179.7	-173	-153.4	1	110	Y43 L761 W762 W764	R37-Y43 HydrophobicContact CB-CD1 3.94Å; R37-Y43 HydrophobicContact CB-CE1 3.98Å; R37-Y43 HydrophobicContact CG-CD1 4.02Å; R37-Y43 HydrophobicContact CG-CE1 3.73Å; R37-L761 HydrophobicContact CB-CD1 4.37Å; R37-W762 PolarHBondContact N-O 3.4Å; R37-W764 WeakPolarHBondContact O-CB 3.39Å; R37-W764 PolarHBondContact O-N 2.87Å
38	Q	94.7	Very high	94.3	Very high	21 Å²	21	28.5 Å²	28.5	10%	0.098	16%	0.155	C	C	.	.			trans	-82.7	166	-176.5	-54.7	-55	-60.6	0	0	111.8	V36 D40 G41 S42 Q44 L880	V36-Q38 PolarHBondContact O-NE2 3.22Å; Q38-D40 VanDerWaalsContact CB-OD1 3.27Å; Q38-D40 WeakPolarHBondContact CB-OD1 3.33Å; Q38-D40 PolarHBondContact O-N 2.89Å; Q38-G41 PolarHBondContact O-N 2.82Å; Q38-G41 VanDerWaalsContact O-N 3.09Å; Q38-S42 WeakPolarHBondContact CB-O 3.31Å; Q38-S42 WeakPolarHBondContact CB-OG 3.46Å; Q38-S42 WeakPolarHBondContact CG-O 2.94Å; Q38-S42 WeakPolarHBondContact CG-OG 3.48Å; Q38-S42 PolarHBondContact N-O 2.93Å; Q38-Q44 HydrophobicContact CG-CG 4.22Å; Q38-L880 PolarHBondContact NE2-O 3.38Å
39	P	91.3	Very high	94.6	Very high	94 Å²	94	27.9 Å²	27.9	61%	0.61	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.3	178.4	-22.5	31.7	0	0	0	115	G41 W764	P39-G41 VanDerWaalsContact C-N 3.26Å; P39-W764 HydrophobicContact CB-CD2 4.49Å; P39-W764 HydrophobicContact CG-CD2 3.58Å; P39-W764 HydrophobicContact CG-CE3 3.61Å; P39-W764 HydrophobicContact CG-CG 3.95Å; P39-W764 HydrophobicContact CG-CZ2 4.5Å; P39-W764 HydrophobicContact CG-CZ3 4.12Å
40	D	92	Very high	94.8	Very high	129 Å²	129	28.2 Å²	28.2	69%	0.69	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	0.3	178.9	65.2	-3.8	0	0	0	113.2	Q38 S42	Q38-D40 VanDerWaalsContact CB-OD1 3.27Å; Q38-D40 WeakPolarHBondContact CB-OD1 3.33Å; Q38-D40 PolarHBondContact O-N 2.89Å; D40-S42 VanDerWaalsContact C-N 3.34Å; D40-S42 VanDerWaalsContact OD1-CB 3.27Å; D40-S42 WeakPolarHBondContact OD1-CB 3.34Å; D40-S42 PolarHBondContact OD1-N 3.31Å; D40-S42 PolarHBondContact OD1-OG 2.94Å; D40-S42 PolarHBondContact OD2-OG 2.89Å
41	G	91.8	Very high	94.6	Very high	28 Å²	28	29.4 Å²	29.4	29%	0.289	16%	0.156	S	C	.	.	S	Bend	trans	86.7	-4.9	-176.8	0	0	0	0	0	114.9	Q38 P39	Q38-G41 PolarHBondContact O-N 2.82Å; Q38-G41 VanDerWaalsContact O-N 3.09Å; P39-G41 VanDerWaalsContact C-N 3.26Å
42	S	95.2	Very high	94.2	Very high	36 Å²	36	29.3 Å²	29.3	25%	0.252	16%	0.155	S	C	.	.			trans	-70.4	167.6	173.2	70.5	0	0	0	0	112.1	Q38 D40 S726	Q38-S42 WeakPolarHBondContact CB-O 3.31Å; Q38-S42 WeakPolarHBondContact CB-OG 3.46Å; Q38-S42 WeakPolarHBondContact CG-O 2.94Å; Q38-S42 WeakPolarHBondContact CG-OG 3.48Å; Q38-S42 PolarHBondContact N-O 2.93Å; D40-S42 VanDerWaalsContact C-N 3.34Å; D40-S42 VanDerWaalsContact OD1-CB 3.27Å; D40-S42 WeakPolarHBondContact OD1-CB 3.34Å; D40-S42 PolarHBondContact OD1-N 3.31Å; D40-S42 PolarHBondContact OD1-OG 2.94Å; D40-S42 PolarHBondContact OD2-OG 2.89Å; S42-S726 WeakPolarHBondContact CA-OG 3.33Å
43	Y	96.5	Very high	93.2	Very high	40 Å²	40	29 Å²	29	16%	0.157	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.5	178	-50.4	-84.5	0	0	0	111.8	V35 R37 S726 I729 D730 L761	V35-Y43 HydrophobicContact CG1-CD1 4.03Å; V35-Y43 HydrophobicContact CG1-CG 4.35Å; R37-Y43 HydrophobicContact CB-CD1 3.94Å; R37-Y43 HydrophobicContact CB-CE1 3.98Å; R37-Y43 HydrophobicContact CG-CD1 4.02Å; R37-Y43 HydrophobicContact CG-CE1 3.73Å; Y43-S726 PolarHBondContact N-OG 3.22Å; Y43-I729 HydrophobicContact CD1-CG2 4.24Å; Y43-I729 HydrophobicContact CD2-CB 4.27Å; Y43-I729 HydrophobicContact CD2-CG2 3.94Å; Y43-I729 HydrophobicContact CG-CB 4.35Å; Y43-I729 HydrophobicContact CG-CG2 3.68Å; Y43-D730 HydrophobicContact CD2-CB 4.41Å; Y43-D730 HydrophobicContact CE2-CB 3.82Å; Y43-D730 WeakPolarHBondContact CE2-OD1 3.48Å; Y43-D730 PolarHBondContact OH-OD1 2.83Å; Y43-L761 HydrophobicContact CD1-CD1 4.1Å; Y43-L761 HydrophobicContact CE1-CD1 4.12Å
44	Q	95.8	Very high	91.6	Very high	75 Å²	75	32.8 Å²	32.8	35%	0.35	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.5	165.4	-61.6	-166.7	73	0	0	109.2	V35 V36 Q38 L880	V35-Q44 CarbonylContact C-O 3.56Å; V35-Q44 WeakPolarHBondContact CA-O 3.37Å; V36-Q44 PolarHBondContact N-O 3.46Å; V36-Q44 PolarHBondContact O-N 2.82Å; V36-Q44 VanDerWaalsContact O-N 3.09Å; Q38-Q44 HydrophobicContact CG-CG 4.22Å; Q44-L880 HydrophobicContact CB-CB 4.5Å; Q44-L880 HydrophobicContact CB-CD2 3.97Å; Q44-L880 PolarHBondContact NE2-O 3.19Å
45	C	96.6	Very high	89.8	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.034	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.9	176.6	78.7	0	0	0	0	113.9	V33 I34 V35 F48 R723 L724 I729 L880	V33-C45 HydrophobicContact CG1-CB 4.32Å; I34-C45 CarbonylContact O-C 3.58Å; I34-C45 VanDerWaalsContact O-CA 3.26Å; I34-C45 WeakPolarHBondContact O-CA 3.4Å; V35-C45 HydrophobicContact CG2-CB 3.95Å; C45-F48 HydrophobicContact CB-CE2 4.5Å; C45-R723 WeakPolarHBondContact O-CD 3.3Å; C45-R723 PolarHBondContact O-NH1 2.88Å; C45-L724 PolarHBondContact SG-N 3.3Å; C45-I729 HydrophobicContact CB-CD1 3.79Å; C45-L880 WeakPolarHBondContact O-CD2 3.15Å
46	S	95.7	Very high	87.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.014	21%	0.213	C	C	.	.			trans	-67.7	168.2	162.4	75.1	0	0	0	0	110.6	V33 I34	V33-S46 WeakPolarHBondContact CA-OG 3.26Å; I34-S46 PolarHBondContact N-OG 3.06Å; I34-S46 PolarHBondContact O-N 2.91Å
47	P	93.4	Very high	85.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.215	C	C	.	.			trans	-69.6	138.3	180	-17.4	31.4	0	0	0	113.4	H49 W237 L722	P47-H49 VanDerWaalsContact C-N 3.28Å; P47-H49 PolarHBondContact O-N 3.08Å; P47-W237 VanDerWaalsContact CD-CD1 3.45Å; P47-W237 HydrophobicContact CG-CG 4.28Å; P47-L722 CarbonylContact C-O 3.56Å; P47-L722 VanDerWaalsContact CA-O 3.26Å; P47-L722 WeakPolarHBondContact CA-O 3.39Å; P47-L722 HydrophobicContact CB-CB 4.08Å
48	F	94.3	Very high	83.9	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.018	22%	0.218	C	C	.	.			trans	-76.9	73.5	169.9	-76.3	-107.8	0	0	0	110.4	V33 C45 V50 M78 F88 L722 L724 F743 I759	V33-F48 HydrophobicContact CG1-CD2 4.23Å; V33-F48 HydrophobicContact CG1-CE2 3.81Å; V33-F48 HydrophobicContact CG1-CZ 4.01Å; V33-F48 HydrophobicContact CG2-CD1 3.87Å; V33-F48 HydrophobicContact CG2-CD2 4.13Å; V33-F48 HydrophobicContact CG2-CE1 4.05Å; V33-F48 HydrophobicContact CG2-CE2 4.3Å; V33-F48 HydrophobicContact CG2-CG 3.91Å; V33-F48 HydrophobicContact CG2-CZ 4.26Å; C45-F48 HydrophobicContact CB-CE2 4.5Å; F48-V50 PolarHBondContact O-N 2.87Å; F48-V50 VanDerWaalsContact O-N 3.11Å; F48-M78 HydrophobicContact CB-CE 4.06Å; F48-F88 HydrophobicContact CB-CE2 3.79Å; F48-F88 HydrophobicContact CB-CZ 4.4Å; F48-F88 HydrophobicContact CD1-CE2 4.11Å; F48-F88 AromaticContact CD1-CZ 4Å; F48-F88 HydrophobicContact CD1-CZ 4Å; F48-F88 AromaticContact CD2-CE2 3.78Å; F48-F88 HydrophobicContact CD2-CE2 3.78Å; F48-F88 HydrophobicContact CD2-CZ 4.37Å; F48-F88 HydrophobicContact CE1-CZ 4.34Å; F48-F88 HydrophobicContact CE2-CE2 4.37Å; F48-F88 AromaticContact CG-CE2 3.63Å; F48-F88 HydrophobicContact CG-CE2 3.63Å; F48-F88 HydrophobicContact CG-CZ 4.02Å; F48-L722 PolarHBondContact N-O 2.93Å; F48-L724 HydrophobicContact CE1-CD1 4.44Å; F48-L724 HydrophobicContact CE2-CB 4.49Å; F48-L724 HydrophobicContact CE2-CD1 3.93Å; F48-L724 HydrophobicContact CE2-CG 3.99Å; F48-L724 HydrophobicContact CZ-CD1 3.71Å; F48-L724 HydrophobicContact CZ-CG 4.27Å; F48-F743 HydrophobicContact CD1-CE1 4.23Å; F48-F743 HydrophobicContact CD1-CZ 4.01Å; F48-F743 HydrophobicContact CE1-CZ 4.43Å; F48-I759 HydrophobicContact CE1-CD1 4.07Å; F48-I759 HydrophobicContact CZ-CD1 4.26Å
49	H	91.8	Very high	82.2	Confident	23 Å²	23	47.3 Å²	47.3	11%	0.106	25%	0.247	C	C	.	.			trans	-76.1	97.7	172.4	-71.2	-52.5	0	0	0	110.5	G30 I31 P47 W237 I821 P850	G30-H49 WeakPolarHBondContact CA-O 3.37Å; I31-H49 HydrophobicContact CB-CB 4.09Å; I31-H49 HydrophobicContact CD1-CB 3.66Å; I31-H49 HydrophobicContact CG1-CB 3.77Å; I31-H49 PolarHBondContact N-O 2.99Å; P47-H49 VanDerWaalsContact C-N 3.28Å; P47-H49 PolarHBondContact O-N 3.08Å; H49-W237 AromaticContact CD2-CZ2 3.98Å; H49-I821 HydrophobicContact CB-CD1 4.3Å; H49-I821 WeakPolarHBondContact O-CD1 2.85Å; H49-P850 HydrophobicContact CB-CB 4.26Å
50	V	91.6	Very high	80.7	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.2	177.8	179.6	0	0	0	0	109.8	F48 F52 M78 A86 F743	F48-V50 PolarHBondContact O-N 2.87Å; F48-V50 VanDerWaalsContact O-N 3.11Å; V50-F52 HydrophobicContact CG1-CE2 3.88Å; V50-F52 HydrophobicContact CG1-CZ 4.44Å; V50-M78 HydrophobicContact CG2-SD 4.46Å; V50-A86 HydrophobicContact CB-CB 4.17Å; V50-A86 HydrophobicContact CG1-CB 4.26Å; V50-A86 PolarHBondContact O-N 3Å; V50-F743 HydrophobicContact CG1-CB 4.06Å; V50-F743 HydrophobicContact CG1-CD1 4.4Å; V50-F743 HydrophobicContact CG1-CD2 3.94Å; V50-F743 HydrophobicContact CG1-CG 3.87Å; V50-F743 HydrophobicContact CG2-CD1 4.15Å; V50-F743 HydrophobicContact CG2-CD2 3.76Å; V50-F743 HydrophobicContact CG2-CE1 3.92Å; V50-F743 HydrophobicContact CG2-CE2 3.49Å; V50-F743 VanDerWaalsContact CG2-CE2 3.49Å; V50-F743 HydrophobicContact CG2-CG 4.09Å; V50-F743 HydrophobicContact CG2-CZ 3.58Å
51	R	87.4	Confident	79.1	Confident	27 Å²	27	43.9 Å²	43.9	10%	0.102	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	135	179.7	-178.4	176.9	173.2	138.7	-5.5	112.2	A25 T28 G29 G84 I821	A25-R51 PolarHBondContact O-NH2 3.01Å; A25-R51 VanDerWaalsContact O-NH2 3.09Å; T28-R51 CarbonylContact C-O 3.49Å; T28-R51 VanDerWaalsContact CA-O 3.27Å; T28-R51 WeakPolarHBondContact CA-O 3.47Å; T28-R51 WeakPolarHBondContact CG2-O 3.43Å; G29-R51 PolarHBondContact N-O 2.87Å; G29-R51 PolarHBondContact O-N 2.78Å; R51-G84 CarbonylContact C-O 3.58Å; R51-G84 VanDerWaalsContact CA-O 3.3Å; R51-G84 WeakPolarHBondContact CA-O 3.03Å; R51-G84 WeakPolarHBondContact CG-O 3.43Å; R51-I821 HydrophobicContact CB-CD1 4.19Å
52	F	86.5	Confident	77.7	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	23%	0.226	C	C	.	.			trans	-102.1	135.8	169.8	-63.5	-94.4	0	0	0	110.5	T28 V50 V57 V65 L80 G84 F743 V745 C753 C755	T28-F52 HydrophobicContact CG2-CD1 3.98Å; T28-F52 HydrophobicContact CG2-CE1 4.43Å; V50-F52 HydrophobicContact CG1-CE2 3.88Å; V50-F52 HydrophobicContact CG1-CZ 4.44Å; F52-V57 HydrophobicContact CB-CG2 3.89Å; F52-V57 HydrophobicContact CG-CG2 4.47Å; F52-V65 HydrophobicContact CE2-CG1 3.69Å; F52-V65 HydrophobicContact CE2-CG2 4.23Å; F52-V65 HydrophobicContact CZ-CG1 3.82Å; F52-L80 HydrophobicContact CB-CD1 4.28Å; F52-L80 HydrophobicContact CD2-CD1 3.66Å; F52-L80 HydrophobicContact CE2-CD1 4.49Å; F52-L80 HydrophobicContact CG-CD1 4.33Å; F52-G84 PolarHBondContact N-O 3.12Å; F52-F743 HydrophobicContact CE2-CB 4.38Å; F52-F743 HydrophobicContact CZ-CB 3.81Å; F52-V745 HydrophobicContact CD1-CB 4.35Å; F52-V745 HydrophobicContact CD1-CG2 4.1Å; F52-V745 HydrophobicContact CD2-CG2 3.91Å; F52-V745 HydrophobicContact CE1-CB 4.23Å; F52-V745 HydrophobicContact CE1-CG2 3.88Å; F52-V745 HydrophobicContact CE2-CG2 3.68Å; F52-V745 HydrophobicContact CG-CG2 4.12Å; F52-V745 HydrophobicContact CZ-CB 4.47Å; F52-V745 HydrophobicContact CZ-CG2 3.66Å; F52-C753 HydrophobicContact CD1-CB 4.14Å; F52-C755 HydrophobicContact CE1-CB 4.05Å; F52-C755 HydrophobicContact CZ-CB 4.15Å
53	G	76.1	Confident	77	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.01	22%	0.223	C	C	.	.			trans	-67.1	135.4	179.7	0	0	0	0	0	112.4	T26 T28 L55 G56 V57	T26-G53 VanDerWaalsContact O-CA 3.31Å; T26-G53 WeakPolarHBondContact O-CA 3.31Å; T28-G53 PolarHBondContact OG1-N 3.28Å; G53-L55 PolarHBondContact O-N 3.37Å; G53-G56 PolarHBondContact O-N 2.73Å; G53-V57 PolarHBondContact O-N 3.02Å
54	K	64.4	Low	76.6	Confident	80 Å²	80	47.6 Å²	47.6	35%	0.348	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.6	-178.9	-71.7	-167.2	171.5	-170.2	0	114.8	D82 N83	K54-D82 WeakPolarHBondContact CE-O 3.49Å; K54-D82 PolarHBondContact NZ-O 2.81Å; K54-N83 VanDerWaalsContact CE-C 3.5Å; K54-N83 WeakPolarHBondContact CE-O 3.28Å
55	L	58.7	Low	76.4	Confident	125 Å²	125	44 Å²	44	65%	0.654	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-25.5	173.5	-168.6	63.4	0	0	0	112.7	T26 G53 Q750	T26-L55 HydrophobicContact CG2-CB 4.26Å; G53-L55 PolarHBondContact O-N 3.37Å; L55-Q750 PolarHBondContact O-NE2 3.14Å
56	G	54.8	Low	76.3	Confident	25 Å²	25	46.5 Å²	46.5	26%	0.258	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-17	176.7	0	0	0	0	0	114.6	G53 Q750	G53-G56 PolarHBondContact O-N 2.73Å; G56-Q750 PolarHBondContact O-OE1 3.18Å
57	V	59	Low	76.3	Confident	7 Å²	7	46.7 Å²	46.7	4%	0.042	22%	0.224	C	C	.	.			trans	-132.2	76.3	176.1	-163.8	0	0	0	0	112	F52 G53 R59 K63 L80 V745 C753	F52-V57 HydrophobicContact CB-CG2 3.89Å; F52-V57 HydrophobicContact CG-CG2 4.47Å; G53-V57 PolarHBondContact O-N 3.02Å; V57-R59 PolarHBondContact O-N 3.27Å; V57-K63 HydrophobicContact CG1-CD 3.64Å; V57-L80 HydrophobicContact CB-CD2 4.15Å; V57-L80 HydrophobicContact CG1-CD2 3.67Å; V57-L80 HydrophobicContact CG2-CD2 4.28Å; V57-V745 HydrophobicContact CG1-CG1 3.94Å; V57-V745 HydrophobicContact CG2-CB 4.37Å; V57-V745 HydrophobicContact CG2-CG1 4.02Å; V57-C753 HydrophobicContact CG2-CB 4.43Å
58	L	54.7	Low	76.5	Confident	94 Å²	94	48.9 Å²	48.9	49%	0.492	23%	0.234	S	C	.	.	S	Bend	trans	-58.6	130.9	164.3	-68.8	173.3	0	0	0	109.9	K63 Q750	L58-K63 PolarHBondContact O-NZ 2.76Å; L58-Q750 HydrophobicContact CD1-CG 4.42Å
59	R	57.8	Low	76.6	Confident	189 Å²	189	49 Å²	49	71%	0.713	23%	0.234	S	C	*	.	S	Bend	trans	53.9	82.2	-166.4	-54.1	179.5	-174.3	165.1	3.7	110.5	V57 K63	V57-R59 PolarHBondContact O-N 3.27Å; R59-K63 WeakPolarHBondContact O-CD 3.36Å; R59-K63 WeakPolarHBondContact O-CE 3.49Å; R59-K63 PolarHBondContact O-NZ 2.64Å
60	S	60.3	Low	76.8	Confident	17 Å²	17	50.6 Å²	50.6	12%	0.119	24%	0.244	C	C	.	.			trans	-79	-18.6	178.2	60.5	0	0	0	0	113.9	E62 K63 G81	S60-E62 PolarHBondContact O-N 2.82Å; S60-E62 VanDerWaalsContact O-N 3.1Å; S60-K63 PolarHBondContact O-N 2.88Å; S60-G81 VanDerWaalsContact CB-O 3.3Å; S60-G81 WeakPolarHBondContact CB-O 3.47Å; S60-G81 PolarHBondContact OG-O 2.81Å
61	K	58.6	Low	76.9	Confident	135 Å²	135	53.3 Å²	53.3	59%	0.587	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	115.4	-178.3	-86	-172.7	-177.1	-61	0	112.6	K63 D82	K61-K63 PolarHBondContact O-N 2.7Å; K61-K63 VanDerWaalsContact O-N 3.14Å; K61-D82 WeakPolarHBondContact CE-OD1 3.24Å; K61-D82 WeakPolarHBondContact CG-OD1 3.39Å; K61-D82 IonicContact NZ-OD1 3.04Å; K61-D82 PolarHBondContact NZ-OD1 3.02Å; K61-D82 IonicContact NZ-OD2 2.89Å; K61-D82 PolarHBondContact NZ-OD2 2.85Å
62	E	62.7	Low	77.2	Confident	95 Å²	95	58 Å²	58	44%	0.444	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	22.8	165.1	-47.5	-165.7	90.6	0	0	115.2	S60 K79 L80 S104	S60-E62 PolarHBondContact O-N 2.82Å; S60-E62 VanDerWaalsContact O-N 3.1Å; E62-K79 WeakPolarHBondContact OE1-CE 3.47Å; E62-K79 IonicContact OE1-NZ 3.02Å; E62-K79 PolarHBondContact OE1-NZ 2.81Å; E62-L80 PolarHBondContact N-O 2.84Å; E62-S104 PolarHBondContact OE1-OG 2.84Å
63	K	79.9	Confident	77.5	Confident	43 Å²	43	63 Å²	63	19%	0.187	33%	0.332	C	S	.	.			trans	-70	143.6	166.3	-76.3	175.9	175.4	161	0	110.5	V57 L58 R59 S60 K61 L80 V745 S747	V57-K63 HydrophobicContact CG1-CD 3.64Å; L58-K63 PolarHBondContact O-NZ 2.76Å; R59-K63 WeakPolarHBondContact O-CD 3.36Å; R59-K63 WeakPolarHBondContact O-CE 3.49Å; R59-K63 PolarHBondContact O-NZ 2.64Å; S60-K63 PolarHBondContact O-N 2.88Å; K61-K63 PolarHBondContact O-N 2.7Å; K61-K63 VanDerWaalsContact O-N 3.14Å; K63-L80 HydrophobicContact CB-CB 4.26Å; K63-L80 HydrophobicContact CB-CD2 4.39Å; K63-L80 WeakPolarHBondContact O-CB 3.37Å; K63-L80 PolarHBondContact O-N 3.31Å; K63-V745 HydrophobicContact CB-CG1 4.2Å; K63-V745 HydrophobicContact CD-CG1 3.97Å; K63-S747 PolarHBondContact NZ-OG 2.85Å
64	I	88.3	Confident	78.4	Confident	43 Å²	43	64.1 Å²	64.1	22%	0.221	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	147.5	170.9	-59.4	178.9	0	0	0	108.6	H77 I106	I64-H77 HydrophobicContact CG2-CB 3.96Å; I64-I106 HydrophobicContact CD1-CG2 3.77Å; I64-I106 HydrophobicContact CG1-CG2 4.01Å
65	V	92.4	Very high	79.6	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.5	170.2	-171.1	0	0	0	0	107.2	F52 M78 L80 A86 F743 S744 V745	F52-V65 HydrophobicContact CE2-CG1 3.69Å; F52-V65 HydrophobicContact CE2-CG2 4.23Å; F52-V65 HydrophobicContact CZ-CG1 3.82Å; V65-M78 HydrophobicContact CB-CB 3.84Å; V65-M78 HydrophobicContact CB-CG 4.33Å; V65-M78 HydrophobicContact CG2-CB 4.06Å; V65-M78 PolarHBondContact N-O 3.48Å; V65-M78 PolarHBondContact O-N 2.86Å; V65-L80 HydrophobicContact CG2-CB 4.19Å; V65-L80 HydrophobicContact CG2-CD1 4.39Å; V65-A86 HydrophobicContact CG2-CB 3.94Å; V65-F743 HydrophobicContact CG1-CB 3.89Å; V65-S744 CarbonylContact C-O 3.52Å; V65-S744 VanDerWaalsContact CA-O 3.24Å; V65-S744 WeakPolarHBondContact CA-O 3.48Å; V65-S744 WeakPolarHBondContact CG1-O 3.3Å; V65-V745 HydrophobicContact CB-CG2 4.16Å; V65-V745 HydrophobicContact CG1-CG2 4.08Å; V65-V745 HydrophobicContact CG2-CG2 3.73Å
66	D	93.8	Very high	81.1	Confident	57 Å²	57	62.6 Å²	62.6	31%	0.305	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	150.8	177.1	-13.7	-74.1	0	0	0	109.6	F743 S744	D66-F743 WeakPolarHBondContact O-CA 3.42Å; D66-S744 WeakPolarHBondContact CB-OG 3.34Å; D66-S744 PolarHBondContact N-O 2.94Å; D66-S744 PolarHBondContact O-N 3.14Å; D66-S744 WeakPolarHBondContact OD2-CB 3.44Å; D66-S744 PolarHBondContact OD2-OG 2.89Å
67	I	96	Very high	82.8	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.5	-176.9	-49.1	-179.1	0	0	0	110.2	V69 V74 L76 M78 F88 V741 F743	I67-V69 HydrophobicContact CG2-CG2 4.11Å; I67-V74 HydrophobicContact CB-CG2 3.69Å; I67-V74 HydrophobicContact CG2-CG2 3.82Å; I67-V74 PolarHBondContact O-N 3.35Å; I67-L76 HydrophobicContact CD1-CB 4.47Å; I67-L76 WeakPolarHBondContact CD1-O 3.44Å; I67-L76 WeakPolarHBondContact CG1-O 3.4Å; I67-M78 HydrophobicContact CD1-CG 3.88Å; I67-M78 HydrophobicContact CG1-CG 4.4Å; I67-F88 HydrophobicContact CD1-CE1 3.83Å; I67-F88 HydrophobicContact CD1-CZ 4.26Å; I67-V741 HydrophobicContact CG2-CG2 3.7Å; I67-F743 HydrophobicContact CD1-CD1 4.43Å; I67-F743 HydrophobicContact CD1-CE1 4.24Å; I67-F743 HydrophobicContact CG1-CD1 4.02Å; I67-F743 HydrophobicContact CG1-CE1 4.26Å; I67-F743 HydrophobicContact CG2-CD1 4.36Å; I67-F743 HydrophobicContact CG2-CE1 4.18Å
68	E	96.4	Very high	84.4	Confident	47 Å²	47	64.5 Å²	64.5	22%	0.22	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.6	169.6	-59.4	166.7	-161.7	0	0	108.9	E72 V741 V742 R754	E68-E72 CarbonylContact C-O 3.51Å; E68-E72 WeakPolarHBondContact CA-O 3.46Å; E68-V741 CarbonylContact O-C 3.57Å; E68-V741 WeakPolarHBondContact O-CA 3.02Å; E68-V742 HydrophobicContact CB-CB 4.24Å; E68-V742 PolarHBondContact N-O 3.09Å; E68-V742 PolarHBondContact O-N 2.84Å; E68-R754 IonicContact OE1-CZ 3.27Å; E68-R754 IonicContact OE1-NE 3.84Å; E68-R754 IonicContact OE1-NH2 3.77Å; E68-R754 PolarHBondContact OE1-NH2 2.81Å; E68-R754 IonicContact OE2-NH2 3.56Å
69	V	97.3	Very high	86.1	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.5	174	178.6	0	0	0	0	109.4	I67 G71 E72 V74 L732 L734 K740 V741 I759	I67-V69 HydrophobicContact CG2-CG2 4.11Å; V69-G71 PolarHBondContact O-N 3.47Å; V69-E72 PolarHBondContact N-O 2.95Å; V69-E72 PolarHBondContact O-N 3.16Å; V69-V74 HydrophobicContact CB-CG1 4.17Å; V69-V74 HydrophobicContact CG2-CG1 4.14Å; V69-V74 HydrophobicContact CG2-CG2 4.48Å; V69-L732 HydrophobicContact CG2-CD2 4.12Å; V69-L734 HydrophobicContact CG1-CD2 4.07Å; V69-K740 WeakPolarHBondContact CA-O 3.1Å; V69-V741 HydrophobicContact CG2-CB 4.47Å; V69-V741 HydrophobicContact CG2-CG2 4.08Å; V69-I759 HydrophobicContact CG2-CD1 4.37Å
70	N	95.8	Very high	87.5	Confident	57 Å²	57	51.4 Å²	51.4	31%	0.305	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	10.9	-174.7	-65	-41.4	0	0	0	115.8	N739 K740	N70-N739 PolarHBondContact ND2-OD1 2.97Å; N70-N739 VanDerWaalsContact OD1-CA 3.3Å; N70-N739 WeakPolarHBondContact OD1-CA 3.32Å; N70-N739 WeakPolarHBondContact OD1-CB 3.36Å; N70-K740 PolarHBondContact N-O 3.05Å; N70-K740 PolarHBondContact OD1-N 3.39Å
71	G	93.7	Very high	88.5	Confident	64 Å²	64	51 Å²	51	66%	0.66	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.4	-0.1	-175.4	0	0	0	0	0	114.4	V69	V69-G71 PolarHBondContact O-N 3.47Å
72	E	95	Very high	89.3	Confident	126 Å²	126	48.4 Å²	48.4	59%	0.589	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.9	177.7	-65.9	165.3	-144.3	0	0	109.2	E68 V69	E68-E72 CarbonylContact C-O 3.51Å; E68-E72 WeakPolarHBondContact CA-O 3.46Å; V69-E72 PolarHBondContact N-O 2.95Å; V69-E72 PolarHBondContact O-N 3.16Å
73	S	92.8	Very high	89.8	Confident	107 Å²	107	47.5 Å²	47.5	75%	0.748	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	128.5	177	53.1	0	0	0	0	110.6
74	V	93.4	Very high	89.9	Confident	24 Å²	24	45.6 Å²	45.6	15%	0.145	26%	0.262	C	S	.	.			trans	-99.1	149.2	177.8	-62.1	0	0	0	0	111.3	I67 V69 L76 L732	I67-V74 HydrophobicContact CB-CG2 3.69Å; I67-V74 HydrophobicContact CG2-CG2 3.82Å; I67-V74 PolarHBondContact O-N 3.35Å; V69-V74 HydrophobicContact CB-CG1 4.17Å; V69-V74 HydrophobicContact CG2-CG1 4.14Å; V69-V74 HydrophobicContact CG2-CG2 4.48Å; V74-L76 HydrophobicContact CG2-CB 4.16Å; V74-L76 PolarHBondContact O-N 3.36Å; V74-L732 HydrophobicContact CB-CD2 4.09Å; V74-L732 HydrophobicContact CG1-CD2 3.89Å; V74-L732 HydrophobicContact CG2-CD2 3.84Å
75	D	90.4	Very high	89.7	Confident	151 Å²	151	46 Å²	46	81%	0.807	26%	0.263	S	S	*	.	S	Bend	trans	-79.5	51.5	176.7	-166	20.3	0	0	0	111.6	H77	D75-H77 IonicContact OD1-CE1 3.61Å
76	L	90.9	Very high	89.6	Confident	22 Å²	22	46.1 Å²	46.1	12%	0.115	26%	0.264	C	S	.	.			trans	-141.6	129.9	178.8	-69.5	174.5	0	0	0	108.7	I67 V74 L724 E728 L732	I67-L76 HydrophobicContact CD1-CB 4.47Å; I67-L76 WeakPolarHBondContact CD1-O 3.44Å; I67-L76 WeakPolarHBondContact CG1-O 3.4Å; V74-L76 HydrophobicContact CG2-CB 4.16Å; V74-L76 PolarHBondContact O-N 3.36Å; L76-L724 HydrophobicContact CD1-CD1 4.24Å; L76-L724 HydrophobicContact CD1-CD2 4.44Å; L76-E728 HydrophobicContact CD1-CB 3.9Å; L76-E728 HydrophobicContact CD2-CB 4.26Å; L76-E728 HydrophobicContact CD2-CG 3.98Å; L76-L732 HydrophobicContact CD1-CD2 3.79Å; L76-L732 HydrophobicContact CD1-CG 4.45Å
77	H	90	Very high	89.5	Confident	71 Å²	71	43.8 Å²	43.8	33%	0.329	25%	0.251	S	S	.	.			trans	-130.3	137.6	-168.4	-63	89.5	0	0	0	110	I64 D75 I106	I64-H77 HydrophobicContact CG2-CB 3.96Å; D75-H77 IonicContact OD1-CE1 3.61Å; H77-I106 HydrophobicContact CB-CD1 4.11Å
78	M	92.8	Very high	89.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	158.4	170.1	-34	-179.9	76.1	0	0	110	F48 V50 V65 I67 A86 F87 F88 F743	F48-M78 HydrophobicContact CB-CE 4.06Å; V50-M78 HydrophobicContact CG2-SD 4.46Å; V65-M78 HydrophobicContact CB-CB 3.84Å; V65-M78 HydrophobicContact CB-CG 4.33Å; V65-M78 HydrophobicContact CG2-CB 4.06Å; V65-M78 PolarHBondContact N-O 3.48Å; V65-M78 PolarHBondContact O-N 2.86Å; I67-M78 HydrophobicContact CD1-CG 3.88Å; I67-M78 HydrophobicContact CG1-CG 4.4Å; M78-A86 HydrophobicContact CB-CB 4.11Å; M78-A86 HydrophobicContact CE-CB 4.02Å; M78-A86 HydrophobicContact SD-CB 3.8Å; M78-F87 CarbonylContact C-O 3.45Å; M78-F87 WeakPolarHBondContact CA-O 3.48Å; M78-F87 WeakPolarHBondContact CB-O 3.5Å; M78-F88 HydrophobicContact CE-CD2 4.19Å; M78-F88 HydrophobicContact CE-CE1 4.28Å; M78-F88 HydrophobicContact CE-CE2 3.87Å; M78-F88 HydrophobicContact CE-CZ 3.91Å; M78-F88 HydrophobicContact CG-CD1 4.02Å; M78-F88 HydrophobicContact CG-CE1 3.66Å; M78-F88 HydrophobicContact CG-CZ 4.14Å; M78-F88 HydrophobicContact SD-CE1 4.45Å; M78-F88 HydrophobicContact SD-CZ 4.34Å; M78-F743 HydrophobicContact SD-CD1 3.79Å; M78-F743 HydrophobicContact SD-CE1 3.83Å
79	K	90.2	Very high	89	Confident	6 Å²	6	43 Å²	43	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.1	170.8	-173.9	166.8	-173.5	166.7	0	110	E62 A86 F87 V89 S104 P105	E62-K79 WeakPolarHBondContact OE1-CE 3.47Å; E62-K79 IonicContact OE1-NZ 3.02Å; E62-K79 PolarHBondContact OE1-NZ 2.81Å; K79-A86 WeakPolarHBondContact O-CA 3.2Å; K79-F87 HydrophobicContact CB-CD2 4.16Å; K79-F87 HydrophobicContact CB-CE2 3.67Å; K79-F87 HydrophobicContact CB-CZ 4.06Å; K79-F87 HydrophobicContact CD-CE2 4.12Å; K79-F87 HydrophobicContact CD-CZ 4.32Å; K79-F87 HydrophobicContact CG-CE2 4Å; K79-F87 HydrophobicContact CG-CZ 4.01Å; K79-F87 PolarHBondContact N-O 3.01Å; K79-F87 PolarHBondContact O-N 2.79Å; K79-V89 HydrophobicContact CB-CG2 3.76Å; K79-V89 HydrophobicContact CD-CG2 4.1Å; K79-S104 PolarHBondContact NZ-O 3.03Å; K79-S104 PolarHBondContact NZ-OG 2.71Å; K79-P105 PolarHBondContact NZ-O 3.26Å
80	L	87.3	Confident	88.3	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.2	178.6	-165.8	72.6	0	0	0	111.8	F52 V57 E62 K63 V65 V745	F52-L80 HydrophobicContact CB-CD1 4.28Å; F52-L80 HydrophobicContact CD2-CD1 3.66Å; F52-L80 HydrophobicContact CE2-CD1 4.49Å; F52-L80 HydrophobicContact CG-CD1 4.33Å; V57-L80 HydrophobicContact CB-CD2 4.15Å; V57-L80 HydrophobicContact CG1-CD2 3.67Å; V57-L80 HydrophobicContact CG2-CD2 4.28Å; E62-L80 PolarHBondContact N-O 2.84Å; K63-L80 HydrophobicContact CB-CB 4.26Å; K63-L80 HydrophobicContact CB-CD2 4.39Å; K63-L80 WeakPolarHBondContact O-CB 3.37Å; K63-L80 PolarHBondContact O-N 3.31Å; V65-L80 HydrophobicContact CG2-CB 4.19Å; V65-L80 HydrophobicContact CG2-CD1 4.39Å; L80-V745 HydrophobicContact CD2-CG1 4.25Å; L80-V745 HydrophobicContact CD2-CG2 4.44Å
81	G	81.6	Confident	87.4	Confident	9 Å²	9	47.2 Å²	47.2	9%	0.093	27%	0.266	C	S	.	.			trans	-90.4	174.3	179.1	0	0	0	0	0	115.5	S60 N83 G84 E85	S60-G81 VanDerWaalsContact CB-O 3.3Å; S60-G81 WeakPolarHBondContact CB-O 3.47Å; S60-G81 PolarHBondContact OG-O 2.81Å; G81-N83 PolarHBondContact O-N 2.89Å; G81-G84 PolarHBondContact O-N 3.09Å; G81-G84 VanDerWaalsContact O-N 3.15Å; G81-E85 VanDerWaalsContact CA-OE2 3.24Å; G81-E85 WeakPolarHBondContact CA-OE2 3.49Å; G81-E85 PolarHBondContact N-O 2.85Å
82	D	74.7	Confident	86.2	Confident	81 Å²	81	45.7 Å²	45.7	43%	0.433	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.5	179.3	-80.6	-1.4	0	0	0	113.5	K54 K61	K54-D82 WeakPolarHBondContact CE-O 3.49Å; K54-D82 PolarHBondContact NZ-O 2.81Å; K61-D82 WeakPolarHBondContact CE-OD1 3.24Å; K61-D82 WeakPolarHBondContact CG-OD1 3.39Å; K61-D82 IonicContact NZ-OD1 3.04Å; K61-D82 PolarHBondContact NZ-OD1 3.02Å; K61-D82 IonicContact NZ-OD2 2.89Å; K61-D82 PolarHBondContact NZ-OD2 2.85Å
83	N	73.5	Confident	84.5	Confident	76 Å²	76	46.2 Å²	46.2	41%	0.406	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-6.6	175.8	-52.5	-65.4	0	0	0	113.7	K54 G81 E85	K54-N83 VanDerWaalsContact CE-C 3.5Å; K54-N83 WeakPolarHBondContact CE-O 3.28Å; G81-N83 PolarHBondContact O-N 2.89Å; N83-E85 WeakPolarHBondContact CA-OE2 3.39Å; N83-E85 WeakPolarHBondContact CB-OE1 3.2Å; N83-E85 VanDerWaalsContact CB-OE2 3.27Å; N83-E85 WeakPolarHBondContact CB-OE2 3.26Å; N83-E85 PolarHBondContact N-OE2 3.02Å; N83-E85 PolarHBondContact ND2-OE1 3.31Å
84	G	81	Confident	82.5	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	24%	0.243	C	C	.	.	S	Bend	trans	86.8	8.1	-172.1	0	0	0	0	0	113.2	R51 F52 G81	R51-G84 CarbonylContact C-O 3.58Å; R51-G84 VanDerWaalsContact CA-O 3.3Å; R51-G84 WeakPolarHBondContact CA-O 3.03Å; R51-G84 WeakPolarHBondContact CG-O 3.43Å; F52-G84 PolarHBondContact N-O 3.12Å; G81-G84 PolarHBondContact O-N 3.09Å; G81-G84 VanDerWaalsContact O-N 3.15Å
85	E	85.4	Confident	80.7	Confident	52 Å²	52	52.3 Å²	52.3	24%	0.243	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.9	168.6	69.9	-78.5	-115.5	0	0	110.7	G81 N83 F87	G81-E85 VanDerWaalsContact CA-OE2 3.24Å; G81-E85 WeakPolarHBondContact CA-OE2 3.49Å; G81-E85 PolarHBondContact N-O 2.85Å; N83-E85 WeakPolarHBondContact CA-OE2 3.39Å; N83-E85 WeakPolarHBondContact CB-OE1 3.2Å; N83-E85 VanDerWaalsContact CB-OE2 3.27Å; N83-E85 WeakPolarHBondContact CB-OE2 3.26Å; N83-E85 PolarHBondContact N-OE2 3.02Å; N83-E85 PolarHBondContact ND2-OE1 3.31Å; E85-F87 HydrophobicContact CG-CD1 4.27Å
86	A	90.2	Very high	79	Confident	2 Å²	2	53.9 Å²	53.9	2%	0.017	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	141.8	170.3	0	0	0	0	0	110.2	V50 V65 M78 K79	V50-A86 HydrophobicContact CB-CB 4.17Å; V50-A86 HydrophobicContact CG1-CB 4.26Å; V50-A86 PolarHBondContact O-N 3Å; V65-A86 HydrophobicContact CG2-CB 3.94Å; M78-A86 HydrophobicContact CB-CB 4.11Å; M78-A86 HydrophobicContact CE-CB 4.02Å; M78-A86 HydrophobicContact SD-CB 3.8Å; K79-A86 WeakPolarHBondContact O-CA 3.2Å
87	F	91.7	Very high	77.4	Confident	9 Å²	9	53.4 Å²	53.4	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.4	179.2	52.6	-96.9	0	0	0	111.5	M78 K79 E85 V89 T103 K720 S721 L722	M78-F87 CarbonylContact C-O 3.45Å; M78-F87 WeakPolarHBondContact CA-O 3.48Å; M78-F87 WeakPolarHBondContact CB-O 3.5Å; K79-F87 HydrophobicContact CB-CD2 4.16Å; K79-F87 HydrophobicContact CB-CE2 3.67Å; K79-F87 HydrophobicContact CB-CZ 4.06Å; K79-F87 HydrophobicContact CD-CE2 4.12Å; K79-F87 HydrophobicContact CD-CZ 4.32Å; K79-F87 HydrophobicContact CG-CE2 4Å; K79-F87 HydrophobicContact CG-CZ 4.01Å; K79-F87 PolarHBondContact N-O 3.01Å; K79-F87 PolarHBondContact O-N 2.79Å; E85-F87 HydrophobicContact CG-CD1 4.27Å; F87-V89 HydrophobicContact CD2-CG2 4.14Å; F87-V89 HydrophobicContact CE2-CG2 4.03Å; F87-T103 HydrophobicContact CE2-CG2 4.4Å; F87-K720 HydrophobicContact CB-CB 4.35Å; F87-K720 HydrophobicContact CD1-CD 4.41Å; F87-K720 HydrophobicContact CD1-CG 4.36Å; F87-K720 HydrophobicContact CD2-CB 4.01Å; F87-K720 HydrophobicContact CD2-CD 4.46Å; F87-K720 HydrophobicContact CD2-CG 3.6Å; F87-K720 HydrophobicContact CE1-CD 4.33Å; F87-K720 HydrophobicContact CE1-CG 4.43Å; F87-K720 HydrophobicContact CE2-CD 4.38Å; F87-K720 HydrophobicContact CE2-CG 3.67Å; F87-K720 HydrophobicContact CG-CB 4.17Å; F87-K720 HydrophobicContact CG-CD 4.47Å; F87-K720 HydrophobicContact CG-CG 3.96Å; F87-K720 HydrophobicContact CZ-CD 4.31Å; F87-K720 HydrophobicContact CZ-CG 4.1Å; F87-S721 CarbonylContact C-O 3.57Å; F87-S721 WeakPolarHBondContact CB-O 3.5Å; F87-L722 HydrophobicContact CB-CD2 4Å
88	F	92.3	Very high	76.4	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	157.4	168.1	-59.6	-69.9	0	0	0	110.4	F48 I67 M78 S721 L724	F48-F88 HydrophobicContact CB-CE2 3.79Å; F48-F88 HydrophobicContact CB-CZ 4.4Å; F48-F88 HydrophobicContact CD1-CE2 4.11Å; F48-F88 AromaticContact CD1-CZ 4Å; F48-F88 HydrophobicContact CD1-CZ 4Å; F48-F88 AromaticContact CD2-CE2 3.78Å; F48-F88 HydrophobicContact CD2-CE2 3.78Å; F48-F88 HydrophobicContact CD2-CZ 4.37Å; F48-F88 HydrophobicContact CE1-CZ 4.34Å; F48-F88 HydrophobicContact CE2-CE2 4.37Å; F48-F88 AromaticContact CG-CE2 3.63Å; F48-F88 HydrophobicContact CG-CE2 3.63Å; F48-F88 HydrophobicContact CG-CZ 4.02Å; I67-F88 HydrophobicContact CD1-CE1 3.83Å; I67-F88 HydrophobicContact CD1-CZ 4.26Å; M78-F88 HydrophobicContact CE-CD2 4.19Å; M78-F88 HydrophobicContact CE-CE1 4.28Å; M78-F88 HydrophobicContact CE-CE2 3.87Å; M78-F88 HydrophobicContact CE-CZ 3.91Å; M78-F88 HydrophobicContact CG-CD1 4.02Å; M78-F88 HydrophobicContact CG-CE1 3.66Å; M78-F88 HydrophobicContact CG-CZ 4.14Å; M78-F88 HydrophobicContact SD-CE1 4.45Å; M78-F88 HydrophobicContact SD-CZ 4.34Å; F88-S721 PolarHBondContact N-O 2.84Å; F88-S721 PolarHBondContact O-N 3.24Å; F88-L724 HydrophobicContact CD1-CD2 3.81Å; F88-L724 HydrophobicContact CD2-CD2 3.88Å; F88-L724 HydrophobicContact CD2-CG 4.31Å; F88-L724 HydrophobicContact CE1-CD2 3.61Å; F88-L724 HydrophobicContact CE1-CG 4.34Å; F88-L724 HydrophobicContact CE2-CD1 4.49Å; F88-L724 HydrophobicContact CE2-CD2 3.69Å; F88-L724 HydrophobicContact CE2-CG 3.76Å; F88-L724 HydrophobicContact CG-CD2 3.95Å; F88-L724 HydrophobicContact CZ-CD1 4.1Å; F88-L724 HydrophobicContact CZ-CD2 3.56Å; F88-L724 HydrophobicContact CZ-CG 3.78Å
89	V	88.3	Confident	74.7	Confident	30 Å²	30	57.8 Å²	57.8	18%	0.182	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	105.8	-177.4	176.3	0	0	0	0	107.7	K79 F87 T103 I106 Y718	K79-V89 HydrophobicContact CB-CG2 3.76Å; K79-V89 HydrophobicContact CD-CG2 4.1Å; F87-V89 HydrophobicContact CD2-CG2 4.14Å; F87-V89 HydrophobicContact CE2-CG2 4.03Å; V89-T103 HydrophobicContact CG1-CG2 3.92Å; V89-T103 HydrophobicContact CG2-CG2 4.18Å; V89-I106 HydrophobicContact CB-CD1 4.3Å; V89-I106 HydrophobicContact CB-CG1 4.03Å; V89-I106 HydrophobicContact CG2-CD1 4.44Å; V89-I106 HydrophobicContact CG2-CG1 3.95Å; V89-Y718 HydrophobicContact CG1-CD1 3.65Å; V89-Y718 HydrophobicContact CG1-CG 4.29Å
90	E	82.5	Confident	73.2	Confident	36 Å²	36	62 Å²	62	17%	0.168	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139.7	178.4	-68.2	176.1	-163.2	0	0	110.2	Y718 R719 S721	E90-Y718 CarbonylContact O-C 3.37Å; E90-Y718 WeakPolarHBondContact O-CA 3.27Å; E90-R719 HydrophobicContact CB-CG 3.85Å; E90-R719 PolarHBondContact N-O 2.85Å; E90-R719 PolarHBondContact O-N 2.85Å; E90-R719 IonicContact OE2-CZ 3.81Å; E90-R719 IonicContact OE2-NE 2.63Å; E90-R719 PolarHBondContact OE2-NE 2.65Å; E90-R719 IonicContact OE2-NH2 2.78Å; E90-R719 PolarHBondContact OE2-NH2 3.49Å; E90-S721 VanDerWaalsContact CD-CB 3.42Å; E90-S721 WeakPolarHBondContact OE1-CB 3.33Å; E90-S721 PolarHBondContact OE1-OG 2.88Å
91	E	77.8	Confident	72.3	Confident	113 Å²	113	64 Å²	64	53%	0.528	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130	171.5	-74.5	-179.7	-179.8	0	0	111	H716 Y718	E91-H716 IonicContact OE2-CD2 2.66Å; E91-Y718 HydrophobicContact CG-CD1 3.57Å; E91-Y718 HydrophobicContact CG-CE1 3.29Å; E91-Y718 HydrophobicContact CG-CG 4.46Å; E91-Y718 WeakPolarHBondContact OE1-CE1 3.49Å; E91-Y718 PolarHBondContact OE1-OH 2.93Å; E91-Y718 VanDerWaalsContact OE1-OH 3.09Å
92	E	69.3	Low	71.6	Confident	32 Å²	32	65.7 Å²	65.7	15%	0.15	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.9	164.8	-74.1	-161	103.2	0	0	110.8	M717 R719	E92-M717 PolarHBondContact N-O 2.65Å; E92-M717 PolarHBondContact O-N 3.45Å; E92-R719 IonicContact OE1-CZ 2.68Å; E92-R719 IonicContact OE1-NH1 3.8Å; E92-R719 PolarHBondContact OE1-NH1 3.21Å; E92-R719 WeakPolarHBondContact OE2-CD 3.4Å; E92-R719 IonicContact OE2-CZ 2.69Å; E92-R719 IonicContact OE2-NE 2.69Å; E92-R719 IonicContact OE2-NH1 3.8Å; E92-R719 PolarHBondContact OE2-NH1 3.49Å
93	E	57.9	Low	71.6	Confident	137 Å²	137	63.2 Å²	63.2	64%	0.64	34%	0.337	S	S	*	.	S	Bend	trans	-84.1	-21	178.4	-62.3	-175.5	143.3	0	0	113.3
94	N	51.2	Low	71.6	Confident	132 Å²	132	62 Å²	62	71%	0.706	33%	0.334	S	S	*	.	S	Bend	trans	-148.1	30.7	-160.9	-74.3	-75.4	0	0	0	116
95	M	55.8	Low	71.3	Confident	127 Å²	127	64.7 Å²	64.7	63%	0.626	35%	0.351	S	S	*	.			trans	-140.5	146.8	174.7	-141.1	176	-61.2	0	0	114.2	V97	M95-V97 PolarHBondContact O-N 3.38Å
96	E	55.6	Low	70.6	Confident	184 Å²	184	64.5 Å²	64.5	86%	0.86	35%	0.352	S	S	*	.			trans	-78.5	82.2	-179.7	-171.3	168.1	-161	0	0	110.5	P98	E96-P98 WeakPolarHBondContact O-CD 3.46Å
97	V	56.3	Low	69.2	Low	12 Å²	12	67.5 Å²	67.5	7%	0.073	37%	0.371	C	S	.	.			trans	-61.2	125.9	-176.4	-175.9	0	0	0	0	111	M95 A99 L101 C102 M717 R719	M95-V97 PolarHBondContact O-N 3.38Å; V97-A99 PolarHBondContact O-N 3.42Å; V97-L101 HydrophobicContact CG1-CB 3.78Å; V97-C102 PolarHBondContact O-SG 3.14Å; V97-C102 VanDerWaalsContact O-SG 3.38Å; V97-M717 HydrophobicContact CB-CE 3.84Å; V97-M717 HydrophobicContact CG2-CB 4.22Å; V97-M717 HydrophobicContact CG2-CE 4.06Å; V97-R719 HydrophobicContact CG1-CB 3.85Å; V97-R719 HydrophobicContact CG2-CB 4.38Å
98	P	68.1	Low	67.4	Low	69 Å²	69	74.4 Å²	74.4	45%	0.448	41%	0.407	S	S	.	.			trans	-56.2	134	175.3	-28.2	35.4	0	0	0	112.6	E96 H100 L101 C102	E96-P98 WeakPolarHBondContact O-CD 3.46Å; P98-H100 PolarHBondContact O-N 2.86Å; P98-L101 HydrophobicContact CG-CD1 4.43Å; P98-L101 WeakPolarHBondContact O-CA 3.43Å; P98-L101 WeakPolarHBondContact O-CB 3.47Å; P98-L101 PolarHBondContact O-N 3.01Å; P98-C102 PolarHBondContact O-N 3.16Å
99	A	57.5	Low	65	Low	95 Å²	95	82.9 Å²	82.9	79%	0.785	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.2	-168.9	0	0	0	0	0	116.2	V97	V97-A99 PolarHBondContact O-N 3.42Å
100	H	59.6	Low	62.6	Low	94 Å²	94	87.1 Å²	87.1	44%	0.435	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-25.8	174.9	67.4	-91.1	0	0	0	113.5	P98 K720	P98-H100 PolarHBondContact O-N 2.86Å; H100-K720 PolarHBondContact O-NZ 3.29Å
101	L	67.1	Low	60.5	Low	43 Å²	43	90.3 Å²	90.3	23%	0.225	50%	0.497	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-21.3	174.1	-61.3	-177.8	0	0	0	112.7	V97 P98 F240 R719 K720	V97-L101 HydrophobicContact CG1-CB 3.78Å; P98-L101 HydrophobicContact CG-CD1 4.43Å; P98-L101 WeakPolarHBondContact O-CA 3.43Å; P98-L101 WeakPolarHBondContact O-CB 3.47Å; P98-L101 PolarHBondContact O-N 3.01Å; L101-F240 HydrophobicContact CD2-CD2 3.46Å; L101-F240 VanDerWaalsContact CD2-CD2 3.46Å; L101-F240 HydrophobicContact CD2-CE2 3.82Å; L101-F240 HydrophobicContact CD2-CG 4.45Å; L101-R719 CarbonylContact O-C 3.6Å; L101-R719 WeakPolarHBondContact O-CA 3.3Å; L101-K720 VanDerWaalsContact O-CG 3.28Å; L101-K720 WeakPolarHBondContact O-CG 3.43Å; L101-K720 PolarHBondContact O-N 3.01Å
102	C	67.7	Low	58.4	Low	45 Å²	45	94.3 Å²	94.3	30%	0.304	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	140.8	177.1	-62.8	0	0	0	0	112.5	V97 P98 Y718 K720	V97-C102 PolarHBondContact O-SG 3.14Å; V97-C102 VanDerWaalsContact O-SG 3.38Å; P98-C102 PolarHBondContact O-N 3.16Å; C102-Y718 WeakPolarHBondContact CA-O 3.49Å; C102-K720 VanDerWaalsContact O-CE 3.24Å; C102-K720 WeakPolarHBondContact O-CE 3.39Å; C102-K720 PolarHBondContact O-NZ 2.93Å
103	T	74.8	Confident	57	Low	30 Å²	30	100.1 Å²	100.1	18%	0.184	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	168.1	170.3	-178.9	0	0	0	0	109.9	F87 V89 Y718 K720	F87-T103 HydrophobicContact CE2-CG2 4.4Å; V89-T103 HydrophobicContact CG1-CG2 3.92Å; V89-T103 HydrophobicContact CG2-CG2 4.18Å; T103-Y718 PolarHBondContact N-O 3.24Å; T103-Y718 WeakPolarHBondContact O-CB 3.3Å; T103-K720 HydrophobicContact CG2-CG 4.26Å
104	S	73.4	Confident	56.1	Low	50 Å²	50	99.5 Å²	99.5	35%	0.35	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-85.4	158.9	158.9	36.5	0	0	0	0	110.1	E62 K79	E62-S104 PolarHBondContact OE1-OG 2.84Å; K79-S104 PolarHBondContact NZ-O 3.03Å; K79-S104 PolarHBondContact NZ-OG 2.71Å
105	P	73.8	Confident	55.5	Low	58 Å²	58	101.2 Å²	101.2	38%	0.377	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-54.5	168	175.5	17.5	-30.4	0	0	0	114.3	K79 Y718	K79-P105 PolarHBondContact NZ-O 3.26Å; P105-Y718 HydrophobicContact CB-CD1 4.15Å; P105-Y718 HydrophobicContact CB-CE1 3.6Å; P105-Y718 HydrophobicContact CB-CE2 4.23Å; P105-Y718 HydrophobicContact CG-CE1 4.4Å; P105-Y718 HydrophobicContact CG-CE2 4.16Å
106	I	72.3	Confident	54.5	Low	49 Å²	49	101.4 Å²	101.4	25%	0.251	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-69.1	131	164.5	-60.5	-179.3	0	0	0	108.1	I64 H77 V89 L108	I64-I106 HydrophobicContact CD1-CG2 3.77Å; I64-I106 HydrophobicContact CG1-CG2 4.01Å; H77-I106 HydrophobicContact CB-CD1 4.11Å; V89-I106 HydrophobicContact CB-CD1 4.3Å; V89-I106 HydrophobicContact CB-CG1 4.03Å; V89-I106 HydrophobicContact CG2-CD1 4.44Å; V89-I106 HydrophobicContact CG2-CG1 3.95Å; I106-L108 PolarHBondContact O-N 3.28Å; I106-L108 VanDerWaalsContact O-N 3.09Å
107	P	60.1	Low	53.5	Low	64 Å²	64	100 Å²	100	42%	0.416	57%	0.567	S	S	.	*			trans	-64.6	109.7	175.1	-20.3	33.1	0	0	0	110.7	E109	P107-E109 PolarHBondContact O-N 3.02Å
108	L	54.9	Low	52.2	Low	155 Å²	155	104.1 Å²	104.1	81%	0.812	60%	0.603	S	S	*	*			trans	-69.8	118	171.7	-65.7	173.1	0	0	0	109.2	I106 V110	I106-L108 PolarHBondContact O-N 3.28Å; I106-L108 VanDerWaalsContact O-N 3.09Å; L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 PolarHBondContact O-N 3.16Å
109	E	41.5	Very low	50.3	Low	185 Å²	185	110 Å²	110	86%	0.864	62%	0.624	S	S	*	*			trans	-71.7	88.6	168.9	-67.2	-158.5	162.2	0	0	109.3	P107 P111	P107-E109 PolarHBondContact O-N 3.02Å; E109-P111 WeakPolarHBondContact O-CD 3.45Å
110	V	36.8	Very low	48.9	Very low	120 Å²	120	109.1 Å²	109.1	73%	0.727	62%	0.624	S	S	*	*			trans	-65.3	123.5	171.9	-177.8	0	0	0	0	108.4	L108 E112	L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 PolarHBondContact O-N 3.16Å; V110-E112 PolarHBondContact O-N 3.29Å
111	P	39.1	Very low	47.4	Very low	103 Å²	103	110.9 Å²	110.9	67%	0.669	65%	0.647	S	S	*	*			trans	-59.5	131.5	173.8	-23.4	34.4	0	0	0	111	E109 D113	E109-P111 WeakPolarHBondContact O-CD 3.45Å; P111-D113 VanDerWaalsContact C-N 3.26Å; P111-D113 PolarHBondContact O-N 3.23Å
112	E	33.8	Very low	45.6	Very low	197 Å²	197	112.4 Å²	112.4	92%	0.921	67%	0.673	S	S	*	*			trans	-72.2	82.3	171.4	-72.3	-164.3	146.2	0	0	110.2	V110	V110-E112 PolarHBondContact O-N 3.29Å
113	D	38.6	Very low	43.9	Very low	153 Å²	153	114.2 Å²	114.2	82%	0.818	69%	0.692	S	S	*	*			trans	-61.8	134.4	174.9	-105.6	-34	0	0	0	111.3	P111 D115	P111-D113 VanDerWaalsContact C-N 3.26Å; P111-D113 PolarHBondContact O-N 3.23Å; D113-D115 PolarHBondContact O-N 3.08Å; D113-D115 VanDerWaalsContact O-N 3.14Å
114	T	40.2	Very low	42	Very low	124 Å²	124	124.6 Å²	124.6	76%	0.761	73%	0.727	S	S	*	*			trans	-83	96.8	-167.3	51.8	0	0	0	0	112.8
115	D	38	Very low	40.1	Very low	169 Å²	169	130.6 Å²	130.6	90%	0.904	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-72.9	125.3	177.9	-127	-12.5	0	0	0	112.5	D113	D113-D115 PolarHBondContact O-N 3.08Å; D113-D115 VanDerWaalsContact O-N 3.14Å
116	V	35.3	Very low	38.3	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-101.9	142.1	-172.6	-179.5	0	0	0	0	111.8
117	I	34.8	Very low	36.6	Very low	154 Å²	154	142.3 Å²	142.3	79%	0.79	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	136	-166.1	-59.1	163	0	0	0	114.6	E119	I117-E119 HydrophobicContact CG2-CG 4.32Å
118	A	28.4	Very low	35.3	Very low	100 Å²	100	148.5 Å²	148.5	83%	0.826	81%	0.805	S	S	*	*			trans	-131.3	143.4	151.7	0	0	0	0	0	110.8
119	E	29	Very low	34.3	Very low	192 Å²	192	149.5 Å²	149.5	90%	0.897	80%	0.798	S	S	*	*			trans	-102.7	147	-165.1	-70.4	-160.8	130.7	0	0	116.7	I117	I117-E119 HydrophobicContact CG2-CG 4.32Å
120	G	28.1	Very low	33.8	Very low	76 Å²	76	152 Å²	152	78%	0.784	80%	0.8	S	S	*	*			trans	120.5	145.6	135.7	0	0	0	0	0	117.5
121	S	28.6	Very low	33.4	Very low	131 Å²	131	154.2 Å²	154.2	92%	0.916	80%	0.795	S	S	*	*			cis	-166.4	160.4	-8.3	67	0	0	0	0	111.9
122	G	27.4	Very low	32.9	Very low	76 Å²	76	156.1 Å²	156.1	78%	0.784	80%	0.795	S	S	*	*			trans	128.4	67.9	165.4	0	0	0	0	0	117.7
123	A	32.3	Very low	32.6	Very low	83 Å²	83	152.2 Å²	152.2	69%	0.686	78%	0.784	S	S	*	*				86.5	90.4	59.9	0	0	0	0	0	118
124	R	35.4	Very low	32	Very low	247 Å²	247	156.5 Å²	156.5	93%	0.932	79%	0.789	S	S	*	*			trans	-158.8	99.9	148.7	-97	167.2	-165	-161.6	3.6	108.3
125	K	34.4	Very low	31.2	Very low	176 Å²	176	160.5 Å²	160.5	77%	0.765	79%	0.791	S	S	*	*				61	126.4	71	-65.4	177.2	-178.4	166.4	0	113.6
126	K	36.2	Very low	30.6	Very low	177 Å²	177	160.1 Å²	160.1	77%	0.77	79%	0.789	S	S	*	*			cis	-174.6	170.2	-9.1	-140	166.8	-175.9	162.8	0	111.8
127	K	36.2	Very low	30.2	Very low	176 Å²	176	158.9 Å²	158.9	77%	0.765	78%	0.782	S	S	*	*			trans	80.8	147.9	147	-91	175.1	-179.1	174.9	0	118.9
128	R	32.3	Very low	29.9	Very low	194 Å²	194	160.1 Å²	160.1	73%	0.732	79%	0.785	S	S	*	*			cis	-161.5	114	-0.6	-163.9	167.3	76.1	162.4	0.9	118.6
129	R	33.4	Very low	29.8	Very low	177 Å²	177	163.8 Å²	163.8	67%	0.668	79%	0.785	S	S	*	*			trans	36.7	138.6	130.4	-44.9	169.6	77.1	176.2	12.2	123.9
130	R	31.2	Very low	30	Very low	236 Å²	236	165.3 Å²	165.3	89%	0.891	78%	0.782	S	S	*	*				-173.9	131.8	118.1	-95.3	159.2	176.3	-173.5	-3.3	107.6
131	R	29.7	Very low	29.9	Very low	167 Å²	167	169.2 Å²	169.2	63%	0.63	79%	0.785	S	S	*	*			cis	71.9	133.9	46.3	-68.6	-139.7	-64.7	-171.2	4.7	114
132	H	28.3	Very low	30	Very low	143 Å²	143	171.3 Å²	171.3	66%	0.662	78%	0.78	S	S	*	*			cis	-128.8	166.8	12.8	-76.3	97.2	0	0	0	110.8
133	V	26.9	Very low	30	Very low	115 Å²	115	173.8 Å²	173.8	70%	0.697	78%	0.781	S	S	*	*			cis	86.3	115.3	27.2	177.7	0	0	0	0	116.5
134	R	25.8	Very low	29.7	Very low	244 Å²	244	177.2 Å²	177.2	92%	0.921	79%	0.787	S	S	*	*				-165.8	158.5	121.8	-104.4	178.7	-171.9	164.8	2.8	113.1
135	Y	23.7	Very low	29.3	Very low	207 Å²	207	170 Å²	170	81%	0.812	78%	0.775	S	S	*	*			trans	-106.1	168.3	177.9	-95.5	-113.4	0	0	0	109.7
136	D	25.7	Very low	28.9	Very low	161 Å²	161	166.4 Å²	166.4	86%	0.861	77%	0.772	S	S	*	*				-157.7	176.1	111.6	-131	-37.9	0	0	0	114
137	T	26.1	Very low	28.7	Very low	105 Å²	105	162 Å²	162	64%	0.644	76%	0.764	S	S	*	*			trans	-137.8	139.2	-162.3	-43.2	0	0	0	0	112.9
138	Q	28.8	Very low	28.4	Very low	179 Å²	179	161.7 Å²	161.7	84%	0.836	77%	0.765	S	S	*	*			trans	177.6	160.6	160.5	-101.4	155.7	20	0	0	108.5
139	Q	27.2	Very low	28.3	Very low	177 Å²	177	159.5 Å²	159.5	83%	0.827	76%	0.763	S	S	*	*			cis	-162	174.4	-35.1	-171.1	158.4	-3.7	0	0	106.7
140	R	31.3	Very low	28	Very low	224 Å²	224	161.1 Å²	161.1	85%	0.845	77%	0.769	S	S	*	*			trans	-64.7	148.2	173.2	-75	-173.2	175.4	-166.2	-1.9	111.7
141	D	27.8	Very low	27.8	Very low	158 Å²	158	156.3 Å²	156.3	85%	0.845	76%	0.761	S	S	*	*				-171	-174.3	110	-87.9	-13.3	0	0	0	110.6
142	E	29.7	Very low	27.8	Very low	175 Å²	175	156.2 Å²	156.2	82%	0.818	77%	0.765	S	S	*	*			trans	-94.1	-179.4	-159.9	-59.6	-166.2	157.6	0	0	116.3
143	T	28.6	Very low	27.7	Very low	129 Å²	129	156.6 Å²	156.6	79%	0.791	77%	0.767	S	S	*	*			trans	86	108	160.4	69.1	0	0	0	0	119.7
144	N	25.6	Very low	27.9	Very low	154 Å²	154	158.8 Å²	158.8	82%	0.824	77%	0.77	S	S	*	*				69.9	144.3	121.6	-151.6	29.9	0	0	0	122.1
145	S	26.3	Very low	28.5	Very low	96 Å²	96	152.2 Å²	152.2	67%	0.671	76%	0.759	S	S	*	*			trans	87.2	115.4	145.3	-131.2	0	0	0	0	122.2
146	S	26.6	Very low	28.6	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	75%	0.751	S	S	*	*				85.8	113.3	127.3	-138.5	0	0	0	0	123.1
147	S	30.7	Very low	28.7	Very low	84 Å²	84	144.3 Å²	144.3	59%	0.587	74%	0.742	S	S	*	*				67.1	128.1	119.5	70.8	0	0	0	0	123.7
148	E	30.6	Very low	28.9	Very low	170 Å²	170	148 Å²	148	79%	0.794	75%	0.749	S	S	*	*				75.2	114.6	125.8	-71.7	-179.7	177.4	0	0	119.4
149	E	29.9	Very low	28.8	Very low	148 Å²	148	146.5 Å²	146.5	69%	0.692	75%	0.747	S	S	*	*				92.9	96	75	-82.3	-77.6	125.7	0	0	114.1
150	R	27.1	Very low	28.8	Very low	211 Å²	211	142.3 Å²	142.3	80%	0.796	74%	0.737	S	S	*	*				173.6	131.5	123	-101.8	161.1	-82.6	-147.5	-13.6	115.9
151	D	27.4	Very low	28.6	Very low	134 Å²	134	138.4 Å²	138.4	72%	0.717	73%	0.733	S	S	*	*				10.3	145.1	120.5	-63.7	-12.1	0	0	0	118.3
152	K	29.9	Very low	28.6	Very low	166 Å²	166	135.5 Å²	135.5	72%	0.722	73%	0.731	S	S	*	*				-176.7	171.1	60.5	-136.7	148.8	171.7	-68.1	0	114
153	E	26.4	Very low	28.4	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	73%	0.734	S	S	*	*			trans	73.9	92.5	150	-83.3	149.9	-130.7	0	0	122.2
154	E	31.1	Very low	28.3	Very low	160 Å²	160	133.6 Å²	133.6	75%	0.748	73%	0.731	S	S	*	*			trans	-48.2	154.7	130.4	-97.5	-79.5	156.8	0	0	111.8	S156	E154-S156 PolarHBondContact OE2-N 3.01Å
155	P	37.6	Very low	28.4	Very low	107 Å²	107	135.8 Å²	135.8	70%	0.695	73%	0.728	S	S	*	*				-159.1	136.2	83.1	38.8	-16.6	0	0	0	120
156	S	26.2	Very low	28.2	Very low	92 Å²	92	139.3 Å²	139.3	64%	0.643	73%	0.734	S	S	*	*			trans	67.8	174.6	133.4	81.5	0	0	0	0	119.6	E154	E154-S156 PolarHBondContact OE2-N 3.01Å
157	T	28.5	Very low	28	Very low	110 Å²	110	140 Å²	140	68%	0.675	74%	0.739	S	S	*	*			cis	-149.5	147.6	-2.3	40.6	0	0	0	0	110.8
158	K	29.7	Very low	28.2	Very low	182 Å²	182	141.3 Å²	141.3	79%	0.791	75%	0.745	S	S	*	*			trans	55.4	171	139.4	-64.3	-173.3	177.6	-175	0	119.5
159	D	25.7	Very low	27.8	Very low	148 Å²	148	138.1 Å²	138.1	79%	0.791	74%	0.742	S	S	*	*			cis	-143	-164.5	19.6	-111.7	-36.7	0	0	0	113.3
160	S	28.7	Very low	27.5	Very low	88 Å²	88	135.9 Å²	135.9	62%	0.615	74%	0.742	S	S	*	*			trans	-118.5	-179.2	-156.4	57.2	0	0	0	0	118.4
161	D	27.2	Very low	27.3	Very low	142 Å²	142	131.5 Å²	131.5	76%	0.759	74%	0.739	S	S	*	*			trans	92.9	109.4	147.5	-69.5	-56.3	0	0	0	124.4
162	A	26.9	Very low	27.2	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	74%	0.743	S	S	*	*				61	116.5	119.6	0	0	0	0	0	123.4
163	A	25.8	Very low	26.9	Very low	107 Å²	107	131.1 Å²	131.1	88%	0.884	74%	0.744	S	S	*	*			trans	-151.3	160.4	141.2	0	0	0	0	0	110.4
164	Q	27.2	Very low	26.8	Very low	158 Å²	158	130.9 Å²	130.9	74%	0.738	75%	0.746	S	S	*	*			trans	-105.9	160.2	-173.3	-61.7	-173.8	-7.3	0	0	114.4
165	R	26.1	Very low	26.4	Very low	200 Å²	200	129.6 Å²	129.6	76%	0.755	75%	0.75	S	S	*	*				114.1	151.6	118.9	-126.4	179.9	-122.1	-138	1.9	120
166	E	22.5	Very low	26	Very low	169 Å²	169	130 Å²	130	79%	0.79	76%	0.755	S	S	*	*			trans	85.1	137.1	164.7	-49.3	-86.7	124.3	0	0	118.4
167	S	22.7	Very low	26	Very low	117 Å²	117	135 Å²	135	82%	0.818	77%	0.765	S	S	*	*			trans	-103.3	-159	178.7	-34.3	0	0	0	0	109
168	P	34.8	Very low	25.8	Very low	111 Å²	111	134.5 Å²	134.5	72%	0.721	77%	0.766	S	S	*	*			cis	-143.2	-170.6	11.8	45.3	-24.5	0	0	0	117
169	S	22.2	Very low	25.6	Very low	103 Å²	103	132 Å²	132	72%	0.72	77%	0.766	S	S	*	*			trans	45.8	120.2	145.4	-61.3	0	0	0	0	121.2
170	S	24.5	Very low	25.5	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	77%	0.766	S	S	*	*			cis	93.9	138.6	45	76.2	0	0	0	0	115.9
171	T	22.8	Very low	25.2	Very low	120 Å²	120	139.8 Å²	139.8	74%	0.736	77%	0.773	S	S	*	*			trans	130.6	117.9	141	-58.8	0	0	0	0	117.1
172	L	24.3	Very low	25.2	Very low	150 Å²	150	136.8 Å²	136.8	79%	0.785	76%	0.764	S	S	*	*			trans	-3.9	151.5	146.7	-48.3	172.2	0	0	0	119.2
173	L	24.9	Very low	25.1	Very low	142 Å²	142	138.4 Å²	138.4	74%	0.743	76%	0.756	S	S	*	*				-175.9	163.4	65.9	-86.6	174.3	0	0	0	114
174	L	24.1	Very low	25.2	Very low	145 Å²	145	137 Å²	137	76%	0.759	74%	0.74	S	S	*	*			trans	61.8	136	150.8	-98.8	70.8	0	0	0	120.1
175	T	22.9	Very low	25.2	Very low	134 Å²	134	138 Å²	138	82%	0.822	75%	0.745	S	S	*	*				-161.9	172.8	57.8	31.6	0	0	0	0	113.4
176	S	29	Very low	25.4	Very low	115 Å²	115	136 Å²	136	80%	0.804	74%	0.744	S	S	*	*			trans	-135.3	164.4	-170.8	-35.7	0	0	0	0	114.9
177	K	25.3	Very low	26	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	75%	0.745	S	S	*	*			trans	-179.4	126.2	155.8	-96.9	157.6	179.9	-176.4	0	108.8
178	S	25	Very low	26.2	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	74%	0.743	S	S	*	*				74.4	139.4	61.7	78.8	0	0	0	0	114
179	V	25.6	Very low	25.9	Very low	129 Å²	129	139.5 Å²	139.5	78%	0.782	75%	0.753	S	S	*	*			cis	-163.3	139.2	7.2	112.4	0	0	0	0	106.6
180	Y	22.5	Very low	26.5	Very low	203 Å²	203	143 Å²	143	80%	0.796	76%	0.758	S	S	*	*				80.9	123.5	65	-146.1	-75.6	0	0	0	116
181	Y	22	Very low	26.8	Very low	197 Å²	197	146.5 Å²	146.5	77%	0.773	77%	0.768	S	S	*	*			trans	-162.2	155.5	149.4	-147.7	-104.3	0	0	0	113.1	M183	Y181-M183 HydrophobicContact CE1-CE 3.84Å; Y181-M183 VanDerWaalsContact OH-CE 3.32Å; Y181-M183 WeakPolarHBondContact OH-CE 3.45Å
182	S	28.4	Very low	27	Very low	80 Å²	80	143.9 Å²	143.9	56%	0.559	77%	0.765	S	S	*	*			trans	-162.7	164.3	-176.9	-165.8	0	0	0	0	112
183	M	24.1	Very low	27.2	Very low	131 Å²	131	140.8 Å²	140.8	65%	0.645	76%	0.761	S	S	*	*			trans	-147.3	152.3	164.3	-75.6	-74	133.1	0	0	107.3	Y181	Y181-M183 HydrophobicContact CE1-CE 3.84Å; Y181-M183 VanDerWaalsContact OH-CE 3.32Å; Y181-M183 WeakPolarHBondContact OH-CE 3.45Å
184	S	28.8	Very low	27.4	Very low	78 Å²	78	140.9 Å²	140.9	55%	0.545	77%	0.768	S	S	.	*			cis	97.6	134.6	19.4	-59.7	0	0	0	0	113.8
185	E	27.6	Very low	27.6	Very low	178 Å²	178	142.1 Å²	142.1	83%	0.832	77%	0.77	S	S	*	*			cis	-159.2	-179.7	-0.3	-121.8	143.1	-123.1	0	0	113.7
186	E	29.8	Very low	27.9	Very low	157 Å²	157	142.2 Å²	142.2	73%	0.734	77%	0.765	S	S	*	*			trans	-71.8	-173.5	-172.2	-66.2	-66	150	0	0	118.1
187	P	35	Very low	27.9	Very low	125 Å²	125	146.2 Å²	146.2	81%	0.812	76%	0.762	S	S	*	*				-149.5	161	81.7	38.8	-18.7	0	0	0	119.8
188	D	27.6	Very low	28.1	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	75%	0.751	S	S	*	*			trans	-85.5	177.4	-177.8	-53.6	-95.9	0	0	0	118.4
189	E	27.5	Very low	28.2	Very low	201 Å²	201	144 Å²	144	94%	0.939	76%	0.757	S	S	*	*				-171.3	154.3	114.7	-105.7	-173.4	-168.5	0	0	115.8
190	E	34.3	Very low	28.4	Very low	176 Å²	176	145.8 Å²	145.8	82%	0.822	76%	0.757	S	S	*	*			trans	-153.6	152.9	179.7	-167.2	-124.4	146.4	0	0	111.9
191	L	31.3	Very low	29.2	Very low	174 Å²	174	141.8 Å²	141.8	91%	0.911	76%	0.756	S	S	*	*			trans	-176.9	150	161.4	-106.2	173.2	0	0	0	113.4
192	G	27	Very low	29.6	Very low	65 Å²	65	139.8 Å²	139.8	67%	0.67	76%	0.757	S	S	*	*			trans	-167.4	-61	177.3	0	0	0	0	0	125.2
193	A	28.4	Very low	29.5	Very low	86 Å²	86	141.3 Å²	141.3	71%	0.711	77%	0.768	S	S	*	*			trans	63	138.7	170.8	0	0	0	0	0	125.5
194	T	29.3	Very low	29.7	Very low	143 Å²	143	141.9 Å²	141.9	88%	0.877	77%	0.774	S	S	*	*			trans	84.9	152.7	142.3	41.6	0	0	0	0	125.8
195	Q	27.4	Very low	29.6	Very low	172 Å²	172	147 Å²	147	80%	0.804	79%	0.789	S	S	*	*			trans	-94.8	-175.7	-178.5	-56.6	170.3	-111.5	0	0	112.4
196	D	31	Very low	29.6	Very low	135 Å²	135	147.3 Å²	147.3	72%	0.722	79%	0.791	S	S	*	*			cis	-168.3	179.6	21.3	-149.3	-3.8	0	0	0	114.4
197	R	28.4	Very low	29.7	Very low	199 Å²	199	147.7 Å²	147.7	75%	0.751	80%	0.797	S	S	*	*			trans	110.9	121.4	152.7	-55.9	-156.9	72.8	146.7	7.9	123.2
198	D	28.9	Very low	29.8	Very low	113 Å²	113	147 Å²	147	60%	0.604	79%	0.792	S	S	*	*			trans	43.5	140.7	132.6	-42.5	-29	0	0	0	122.1
199	T	27.4	Very low	29.7	Very low	137 Å²	137	147.6 Å²	147.6	84%	0.84	79%	0.79	S	S	*	*				-172	157.9	54.9	-45.5	0	0	0	0	112.8
200	H	29.9	Very low	29.7	Very low	167 Å²	167	144 Å²	144	77%	0.773	78%	0.778	S	S	*	*			trans	-97.8	165.5	175.2	-102.1	-79.3	0	0	0	115
201	P	39.5	Very low	29.3	Very low	119 Å²	119	147.3 Å²	147.3	77%	0.773	78%	0.783	S	S	*	*				-141.3	-173.4	114.3	38.3	-24	0	0	0	115
202	L	30.5	Very low	29.1	Very low	154 Å²	154	143.7 Å²	143.7	81%	0.806	78%	0.778	S	S	*	*			trans	-123.7	155.1	-177.3	-71.1	86.4	0	0	0	113.5
203	S	25.1	Very low	29.1	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	79%	0.787	S	S	*	*			trans	168.4	159	147.2	54.5	0	0	0	0	109
204	D	28.6	Very low	29.3	Very low	143 Å²	143	149.6 Å²	149.6	77%	0.765	79%	0.791	S	S	*	*			cis	167.8	126.4	-35	-101.2	-12.9	0	0	0	105.5
205	E	28.1	Very low	29.8	Very low	185 Å²	185	148.3 Å²	148.3	86%	0.864	79%	0.785	S	S	*	*			trans	49.9	153.1	154.9	-88.8	-179.1	138	0	0	126.9
206	E	26.6	Very low	29.7	Very low	185 Å²	185	148.9 Å²	148.9	86%	0.864	79%	0.785	S	S	*	*			trans	76.5	147.5	158.8	-70.9	-172.3	145.7	0	0	124
207	L	31.1	Very low	29.6	Very low	166 Å²	166	149.2 Å²	149.2	87%	0.869	79%	0.785	S	S	*	*			trans	-103.8	-179.9	178.7	-78.1	166.2	0	0	0	108.9
208	P	37.2	Very low	29.5	Very low	109 Å²	109	146.6 Å²	146.6	71%	0.708	79%	0.786	S	S	*	*			cis	-148	-163.2	20.1	43.8	-21.3	0	0	0	117.5
209	E	25.5	Very low	29.7	Very low	158 Å²	158	146.3 Å²	146.3	74%	0.738	79%	0.793	S	S	*	*			trans	84.6	118.2	148.9	-79.7	-158.3	133.4	0	0	123.6
210	N	27.5	Very low	29.8	Very low	127 Å²	127	149 Å²	149	68%	0.679	80%	0.796	S	S	*	*			trans	69.6	102.5	131.5	-60.3	-22.5	0	0	0	121.4
211	R	27.1	Very low	29.7	Very low	245 Å²	245	149.4 Å²	149.4	93%	0.925	80%	0.803	S	S	*	*				-158.5	122.7	119.2	-114.6	169.4	-170.1	166	5.9	115.2
212	A	27.4	Very low	29.3	Very low	97 Å²	97	151.3 Å²	151.3	80%	0.802	81%	0.806	S	S	*	*			trans	65.6	111.2	158.3	0	0	0	0	0	118.8
213	D	26	Very low	29.4	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	81%	0.807	S	S	*	*			trans	-74.9	163.3	172.9	-55.2	-90.2	0	0	0	114.6
214	S	32.8	Very low	29.5	Very low	111 Å²	111	155.4 Å²	155.4	78%	0.776	81%	0.813	S	S	*	*			trans	-83	174.5	174.7	-46.8	0	0	0	0	112.3
215	P	38.9	Very low	29.5	Very low	117 Å²	117	153.1 Å²	153.1	76%	0.76	81%	0.814	S	S	*	*				-149.9	145.8	83.4	37.6	-19.1	0	0	0	117.7
216	K	27	Very low	29.9	Very low	183 Å²	183	150 Å²	150	80%	0.796	81%	0.81	S	S	*	*			trans	47.4	127	136.2	-64.2	-169.1	175.7	-175.7	0	120.5
217	I	27.4	Very low	29.9	Very low	142 Å²	142	149.1 Å²	149.1	73%	0.728	81%	0.812	S	S	*	*				68	127.5	66.4	-64	170.1	0	0	0	109.9
218	D	27.7	Very low	30	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	81%	0.808	S	S	*	*			cis	-152.4	-174.1	31.7	-140	-32.2	0	0	0	114.9
219	S	31.7	Very low	30.1	Very low	108 Å²	108	149 Å²	149	76%	0.755	82%	0.815	S	S	*	*			trans	103.4	69.1	154.4	-44.5	0	0	0	0	120.8
220	E	30	Very low	30.4	Very low	193 Å²	193	150.1 Å²	150.1	90%	0.902	82%	0.82	S	S	*	*			trans	-138.1	133.7	133	-80.8	-164.7	164.9	0	0	108.8
221	L	28.1	Very low	30.7	Very low	176 Å²	176	149.1 Å²	149.1	92%	0.921	82%	0.82	S	S	*	*			trans	-149.1	108.9	165.3	-158.7	87.3	0	0	0	109.9
222	L	31.2	Very low	31.4	Very low	158 Å²	158	144.6 Å²	144.6	83%	0.827	81%	0.81	S	S	*	*			trans	-109.2	161.9	165.1	-88.8	166.2	0	0	0	109	E224	L222-E224 PolarHBondContact O-N 3.38Å
223	D	32.3	Very low	32.5	Very low	158 Å²	158	142.7 Å²	142.7	85%	0.845	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-53.7	123.4	-166.9	-51.6	-89.4	0	0	0	115
224	E	27.1	Very low	33.4	Very low	194 Å²	194	139.2 Å²	139.2	91%	0.907	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-93.9	134.9	155.4	-84.7	-162.2	124.7	0	0	110.3	L222	L222-E224 PolarHBondContact O-N 3.38Å
225	A	29.1	Very low	34.4	Very low	95 Å²	95	136.4 Å²	136.4	79%	0.785	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-87.3	142.2	177.6	0	0	0	0	0	111.4
226	P	36.7	Very low	35.3	Very low	120 Å²	120	134.7 Å²	134.7	78%	0.779	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-73.7	138.4	175.7	30.6	-34.3	0	0	0	111.8
227	D	26.8	Very low	36.6	Very low	167 Å²	167	127.1 Å²	127.1	89%	0.893	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-66.7	149.9	-176.4	-144.2	-17.3	0	0	0	113.1
228	L	33.5	Very low	37.8	Very low	150 Å²	150	121.3 Å²	121.3	79%	0.785	66%	0.661	S	S	*	*			trans	-116.1	106.9	-172.4	-78.6	174.3	0	0	0	112.8
229	S	38.1	Very low	38.9	Very low	123 Å²	123	116.2 Å²	116.2	86%	0.86	64%	0.643	S	S	*	*			trans	-151	30	163.5	63.9	0	0	0	0	115.9
230	E	31.2	Very low	39.6	Very low	180 Å²	180	114.7 Å²	114.7	84%	0.841	62%	0.623	S	S	*	*	S	Bend	trans	-104.9	140	162.9	-71.6	-162.3	146.1	0	0	111.3	Q232	E230-Q232 PolarHBondContact O-N 2.84Å
231	P	35.6	Very low	40.3	Very low	107 Å²	107	108.1 Å²	108.1	70%	0.695	60%	0.597	S	S	*	*			trans	-71.8	95.7	177.9	29.5	-34	0	0	0	110.4	M233	P231-M233 PolarHBondContact O-N 3.41Å
232	Q	40	Very low	40.9	Very low	150 Å²	150	102 Å²	102	70%	0.701	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-58.8	131.1	174.6	-174.8	171.6	-47.6	0	0	109.9	E230 C244	E230-Q232 PolarHBondContact O-N 2.84Å; Q232-C244 WeakPolarHBondContact O-CB 3.24Å; Q232-C244 PolarHBondContact O-N 3.24Å; Q232-C244 VanDerWaalsContact O-N 3.14Å; Q232-C244 PolarHBondContact O-SG 2.83Å
233	M	50.6	Low	41.2	Very low	56 Å²	56	98.7 Å²	98.7	28%	0.276	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98	126.4	-178.4	-157.5	167.4	67.5	0	0	110.2	P231 W235 P241 T242 L857	P231-M233 PolarHBondContact O-N 3.41Å; M233-W235 HydrophobicContact CE-CH2 3.81Å; M233-W235 HydrophobicContact CE-CZ2 3.18Å; M233-W235 PolarHBondContact O-NE1 2.67Å; M233-P241 HydrophobicContact CE-CB 3.83Å; M233-P241 HydrophobicContact CG-CB 4.17Å; M233-P241 HydrophobicContact SD-CB 3.99Å; M233-T242 WeakPolarHBondContact CG-O 3.47Å; M233-L857 HydrophobicContact CE-CD2 3.48Å; M233-L857 VanDerWaalsContact CE-CD2 3.48Å; M233-L857 HydrophobicContact SD-CD2 4.09Å
234	Q	46.2	Very low	41.6	Very low	91 Å²	91	93.7 Å²	93.7	43%	0.425	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	134.5	180	-179.2	168.8	-19.4	0	0	111.2	N236 T242	Q234-N236 PolarHBondContact NE2-ND2 2.97Å; Q234-N236 PolarHBondContact NE2-OD1 3.18Å; Q234-T242 PolarHBondContact N-O 2.89Å; Q234-T242 PolarHBondContact O-N 3.11Å
235	W	54.3	Low	42	Very low	53 Å²	53	91.1 Å²	91.1	20%	0.201	53%	0.525	C	S	.	.			trans	-115.3	93.7	-178.7	-66.2	88.7	0	0	0	110.3	M233 P241 H858 V861 A872	M233-W235 HydrophobicContact CE-CH2 3.81Å; M233-W235 HydrophobicContact CE-CZ2 3.18Å; M233-W235 PolarHBondContact O-NE1 2.67Å; W235-P241 HydrophobicContact CE3-CB 4.26Å; W235-P241 HydrophobicContact CE3-CG 3.88Å; W235-P241 HydrophobicContact CH2-CB 4.35Å; W235-P241 HydrophobicContact CH2-CG 3.93Å; W235-P241 HydrophobicContact CZ3-CB 4.15Å; W235-P241 HydrophobicContact CZ3-CG 3.48Å; W235-P241 VanDerWaalsContact CZ3-CG 3.48Å; W235-H858 HydrophobicContact CH2-CB 4.16Å; W235-H858 AromaticContact CH2-CD2 3.48Å; W235-H858 VanDerWaalsContact CH2-CD2 3.48Å; W235-H858 WeakPolarHBondContact CH2-CD2 3.46Å; W235-H858 AromaticContact CH2-CG 3.61Å; W235-H858 AromaticContact CH2-ND1 3.98Å; W235-H858 AromaticContact CH2-NE2 3.82Å; W235-H858 AromaticContact CZ3-CD2 3.54Å; W235-H858 AromaticContact CZ3-CE1 3.91Å; W235-H858 AromaticContact CZ3-NE2 3.45Å; W235-H858 WeakPolarHBondContact CZ3-NE2 3.32Å; W235-V861 HydrophobicContact CZ2-CB 3.95Å; W235-V861 HydrophobicContact CZ2-CG1 3.9Å; W235-V861 HydrophobicContact CZ2-CG2 4.22Å; W235-A872 WeakPolarHBondContact O-CB 3.47Å
236	N	55.8	Low	42.3	Very low	81 Å²	81	92.9 Å²	92.9	43%	0.433	53%	0.528	S	S	.	.			trans	-91.1	129.9	171.8	-62.3	-27.6	0	0	0	108.8	Q234 G238 G239	Q234-N236 PolarHBondContact NE2-ND2 2.97Å; Q234-N236 PolarHBondContact NE2-OD1 3.18Å; N236-G238 PolarHBondContact O-N 2.92Å; N236-G239 PolarHBondContact O-N 3.34Å
237	W	55.8	Low	42.5	Very low	24 Å²	24	95.1 Å²	95.1	9%	0.091	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	130.3	178	-164.3	-119	0	0	0	110.4	P47 H49 G239 R723 L848 P850 F869 C873 D876	P47-W237 VanDerWaalsContact CD-CD1 3.45Å; P47-W237 HydrophobicContact CG-CG 4.28Å; H49-W237 AromaticContact CD2-CZ2 3.98Å; W237-G239 PolarHBondContact O-N 2.85Å; W237-R723 PolarHBondContact O-NH2 2.85Å; W237-L848 WeakPolarHBondContact CH2-O 3.5Å; W237-P850 HydrophobicContact CH2-CG 4.13Å; W237-P850 HydrophobicContact CZ3-CG 4.04Å; W237-F869 AromaticContact CH2-CE2 3.57Å; W237-F869 HydrophobicContact CH2-CE2 3.57Å; W237-F869 HydrophobicContact CH2-CZ 4.04Å; W237-F869 AromaticContact CZ3-CD2 3.94Å; W237-F869 HydrophobicContact CZ3-CD2 3.94Å; W237-F869 AromaticContact CZ3-CE2 3.41Å; W237-F869 HydrophobicContact CZ3-CE2 3.41Å; W237-F869 VanDerWaalsContact CZ3-CE2 3.41Å; W237-F869 HydrophobicContact CZ3-CZ 4.25Å; W237-C873 HydrophobicContact CD2-CB 4.06Å; W237-C873 VanDerWaalsContact CE2-SG 3.56Å; W237-C873 HydrophobicContact CE3-CB 3.94Å; W237-C873 HydrophobicContact CH2-CB 4.13Å; W237-C873 VanDerWaalsContact CH2-SG 3.53Å; W237-C873 HydrophobicContact CZ2-CB 4.29Å; W237-C873 WeakPolarHBondContact CZ2-SG 3.35Å; W237-C873 HydrophobicContact CZ3-CB 3.98Å; W237-D876 HydrophobicContact CB-CB 3.57Å; W237-D876 HydrophobicContact CG-CB 3.93Å
238	G	51.8	Low	42.6	Very low	19 Å²	19	95.1 Å²	95.1	20%	0.196	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	0.4	-171.2	0	0	0	0	0	115.7	N236	N236-G238 PolarHBondContact O-N 2.92Å
239	G	50.1	Low	42.4	Very low	38 Å²	38	92.4 Å²	92.4	39%	0.392	53%	0.527	S	S	.	.	S	Bend	trans	-94.5	162	167.4	0	0	0	0	0	111.5	N236 W237	N236-G239 PolarHBondContact O-N 3.34Å; W237-G239 PolarHBondContact O-N 2.85Å
240	F	48.3	Very low	42.1	Very low	76 Å²	76	93 Å²	93	33%	0.333	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-78.3	147.2	162.5	-69.4	-92.3	0	0	0	109.2	L101 T242	L101-F240 HydrophobicContact CD2-CD2 3.46Å; L101-F240 VanDerWaalsContact CD2-CD2 3.46Å; L101-F240 HydrophobicContact CD2-CE2 3.82Å; L101-F240 HydrophobicContact CD2-CG 4.45Å; F240-T242 PolarHBondContact O-N 2.84Å
241	P	44.3	Very low	42	Very low	54 Å²	54	87.8 Å²	87.8	35%	0.351	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.3	-179	-19.8	32.8	0	0	0	111.1	M233 W235	M233-P241 HydrophobicContact CE-CB 3.83Å; M233-P241 HydrophobicContact CG-CB 4.17Å; M233-P241 HydrophobicContact SD-CB 3.99Å; W235-P241 HydrophobicContact CE3-CB 4.26Å; W235-P241 HydrophobicContact CE3-CG 3.88Å; W235-P241 HydrophobicContact CH2-CB 4.35Å; W235-P241 HydrophobicContact CH2-CG 3.93Å; W235-P241 HydrophobicContact CZ3-CB 4.15Å; W235-P241 HydrophobicContact CZ3-CG 3.48Å; W235-P241 VanDerWaalsContact CZ3-CG 3.48Å
242	T	40.8	Very low	41.6	Very low	47 Å²	47	91.4 Å²	91.4	29%	0.288	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.9	-179.1	43.5	0	0	0	0	110.7	M233 Q234 F240	M233-T242 WeakPolarHBondContact CG-O 3.47Å; Q234-T242 PolarHBondContact N-O 2.89Å; Q234-T242 PolarHBondContact O-N 3.11Å; F240-T242 PolarHBondContact O-N 2.84Å
243	P	37.8	Very low	41	Very low	89 Å²	89	92.9 Å²	92.9	58%	0.578	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	144.8	165.2	31.3	-33.6	0	0	0	109.1
244	C	39.5	Very low	39.9	Very low	54 Å²	54	99.2 Å²	99.2	37%	0.365	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-80	123.3	170	-66.2	0	0	0	0	110.4	Q232	Q232-C244 WeakPolarHBondContact O-CB 3.24Å; Q232-C244 PolarHBondContact O-N 3.24Å; Q232-C244 VanDerWaalsContact O-N 3.14Å; Q232-C244 PolarHBondContact O-SG 2.83Å
245	D	35	Very low	39.1	Very low	140 Å²	140	99.4 Å²	99.4	75%	0.749	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-76.5	141.5	161.6	-69.1	-53.3	0	0	0	109.7	E247	D245-E247 PolarHBondContact O-N 2.75Å
246	P	36.9	Very low	37.9	Very low	131 Å²	131	103.5 Å²	103.5	85%	0.851	62%	0.616	S	S	*	*	S	Bend	trans	-78.6	2.7	-172.2	31.5	-36.4	0	0	0	114.9
247	E	39.1	Very low	36.5	Very low	167 Å²	167	104.9 Å²	104.9	78%	0.78	63%	0.632	S	S	*	*			trans	-117.7	97.4	-176.4	-65.2	-167.2	146	0	0	111.9	D245	D245-E247 PolarHBondContact O-N 2.75Å
248	N	30.5	Very low	35.4	Very low	167 Å²	167	112 Å²	112	89%	0.893	67%	0.666	S	S	*	*			trans	172.5	82.6	139.2	-95.3	-62.3	0	0	0	110.9
249	A	27.8	Very low	34.1	Very low	94 Å²	94	120.8 Å²	120.8	78%	0.777	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-94.7	126.1	168.5	0	0	0	0	0	110.3	G251	A249-G251 PolarHBondContact O-N 3.24Å
250	P	33.1	Very low	33.2	Very low	135 Å²	135	128.2 Å²	128.2	88%	0.877	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.8	172	28.2	-32.3	0	0	0	110
251	G	28.5	Very low	32.2	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-73.8	166.1	-169.1	0	0	0	0	0	116.3	A249	A249-G251 PolarHBondContact O-N 3.24Å
252	E	27.7	Very low	31.5	Very low	183 Å²	183	135 Å²	135	86%	0.855	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-59.5	137.6	-175.9	-61	174.6	99.4	0	0	114.7	K254	E252-K254 PolarHBondContact O-N 2.83Å
253	L	28	Very low	30.8	Very low	180 Å²	180	140.1 Å²	140.1	94%	0.942	78%	0.784	S	S	*	*			trans	-79.9	103.8	164.9	-81.5	167.6	0	0	0	111	A255	L253-A255 PolarHBondContact O-N 2.88Å
254	K	26.5	Very low	30.2	Very low	190 Å²	190	144.7 Å²	144.7	83%	0.826	79%	0.79	S	S	*	*			trans	-71	122.1	167	-75.5	-179.9	177.1	172.3	0	110.8	E252	E252-K254 PolarHBondContact O-N 2.83Å
255	A	29.1	Very low	29.9	Very low	95 Å²	95	150.7 Å²	150.7	79%	0.785	81%	0.812	S	S	*	*			trans	-83.2	133.9	173.3	0	0	0	0	0	112	L253	L253-A255 PolarHBondContact O-N 2.88Å
256	T	29.1	Very low	29.5	Very low	138 Å²	138	151.9 Å²	151.9	85%	0.847	82%	0.818	S	S	*	*			trans	-160.9	127.3	154	16.3	0	0	0	0	113
257	S	27.4	Very low	29.4	Very low	110 Å²	110	150.4 Å²	150.4	77%	0.769	81%	0.811	S	S	*	*			trans	50.7	133	149.2	-160	0	0	0	0	122.3
258	H	32.2	Very low	29	Very low	175 Å²	175	151.5 Å²	151.5	81%	0.81	81%	0.814	S	S	*	*			trans	-60.6	155.6	160.6	-52.2	-94.7	0	0	0	113.2
259	F	24.1	Very low	29.2	Very low	202 Å²	202	149.9 Å²	149.9	89%	0.886	81%	0.805	S	S	*	*				-169.9	141.8	116.5	-111	-75.4	0	0	0	111.4
260	F	31.5	Very low	29.9	Very low	195 Å²	195	152 Å²	152	86%	0.855	80%	0.803	S	S	*	*			trans	-103	145	169.4	-86.6	-82.6	0	0	0	110.9
261	P	27.7	Very low	29.7	Very low	122 Å²	122	148.2 Å²	148.2	79%	0.792	79%	0.788	S	S	*	*			trans	-122.6	159.8	145.5	36.1	-26.3	0	0	0	112.4
262	I	29.1	Very low	30	Very low	150 Å²	150	151.4 Å²	151.4	77%	0.769	79%	0.789	S	S	*	*			trans	-118.9	135	-177.8	-65.6	160.3	0	0	0	108
263	E	25.6	Very low	30.3	Very low	154 Å²	154	150.9 Å²	150.9	72%	0.72	79%	0.786	S	S	*	*			trans	-165.3	129.3	132.1	-111.6	-173.9	148	0	0	118.1
264	R	25.8	Very low	30.7	Very low	186 Å²	186	147 Å²	147	70%	0.702	77%	0.77	S	S	*	*			trans	31.2	111.9	137.7	-67.7	174.8	179.8	94	11.8	122.3
265	Q	33	Very low	31	Very low	179 Å²	179	143.5 Å²	143.5	84%	0.836	76%	0.764	S	S	*	*				31.9	125.1	110.2	-69	-179.1	-44.6	0	0	121.2
266	D	27.5	Very low	31.7	Very low	165 Å²	165	144.1 Å²	144.1	88%	0.882	76%	0.76	S	S	*	*				-162.5	148	124.9	-96.9	-31.2	0	0	0	106.8
267	S	34.2	Very low	31.8	Very low	100 Å²	100	142.6 Å²	142.6	70%	0.699	76%	0.755	S	S	*	*			cis	-160.1	171.5	-12.1	58.5	0	0	0	0	111
268	F	31.2	Very low	32.1	Very low	191 Å²	191	146 Å²	146	84%	0.838	76%	0.759	S	S	*	*			trans	-27.6	163.9	169.5	-71.1	-102.3	0	0	0	118.7
269	D	35.2	Very low	32.3	Very low	132 Å²	132	144.9 Å²	144.9	71%	0.706	76%	0.757	S	S	*	*			cis	-157.2	173.9	32.7	-113.5	-25.3	0	0	0	108.1
270	L	40.5	Very low	32.5	Very low	139 Å²	139	143.1 Å²	143.1	73%	0.728	76%	0.756	S	S	*	*			cis	-172.2	155.3	-10	-178.4	65	0	0	0	105.3	D272	L270-D272 WeakPolarHBondContact CD1-OD2 3.41Å
271	G	29.2	Very low	32.4	Very low	55 Å²	55	136.9 Å²	136.9	57%	0.567	75%	0.746	S	S	*	*			cis	-161.2	168.1	-0.8	0	0	0	0	0	109.3
272	D	35.5	Very low	32.4	Very low	139 Å²	139	137.4 Å²	137.4	74%	0.743	75%	0.751	S	S	*	*				92.7	134.4	77.5	-71.1	4.5	0	0	0	111.7	L270	L270-D272 WeakPolarHBondContact CD1-OD2 3.41Å
273	E	34.8	Very low	32.4	Very low	171 Å²	171	137.2 Å²	137.2	80%	0.799	76%	0.757	S	S	*	*			cis	-157.5	164.3	-7.9	-97.5	-154.2	116.4	0	0	108.8
274	V	34.5	Very low	32.9	Very low	100 Å²	100	138 Å²	138	61%	0.606	76%	0.758	S	S	*	*			cis	-170.2	146.4	-37.3	78.1	0	0	0	0	110.8
275	T	33.1	Very low	33.1	Very low	116 Å²	116	134.6 Å²	134.6	71%	0.712	76%	0.759	S	S	*	*			trans	63.5	173.8	161.3	69.1	0	0	0	0	120.9
276	P	44.2	Very low	32.9	Very low	107 Å²	107	134.3 Å²	134.3	70%	0.695	76%	0.758	S	S	*	*			cis	-112.8	161.8	-19.9	7.7	17.1	0	0	0	112.4
277	S	31	Very low	34.1	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	75%	0.751	S	S	*	*				63.5	146.1	62.8	-49.9	0	0	0	0	113.5
278	E	33.4	Very low	33.8	Very low	183 Å²	183	134 Å²	134	86%	0.855	76%	0.761	S	S	*	*			cis	-155.1	-178.2	26.9	-159	160.2	-143.4	0	0	114.4
279	I	36.5	Very low	33.6	Very low	151 Å²	151	128.5 Å²	128.5	77%	0.774	75%	0.75	S	S	*	*			trans	-74.5	150.8	-178.1	-61.5	154.1	0	0	0	112.5
280	I	29.3	Very low	33.3	Very low	165 Å²	165	129.9 Å²	129.9	85%	0.846	76%	0.757	S	S	*	*			trans	-129	136.1	161.6	-63.5	-178.3	0	0	0	110.8
281	G	28.8	Very low	32.7	Very low	64 Å²	64	128 Å²	128	66%	0.66	76%	0.756	S	S	*	*			trans	-114.4	170.4	169.6	0	0	0	0	0	112.6
282	C	28.5	Very low	32.6	Very low	133 Å²	133	131.4 Å²	131.4	90%	0.899	77%	0.765	S	S	*	*			trans	-68.7	127.6	-170.7	-55.6	0	0	0	0	115.2
283	V	28	Very low	32.2	Very low	145 Å²	145	129.8 Å²	129.8	88%	0.879	76%	0.764	S	S	*	*			trans	-143.8	146.1	146.1	175.8	0	0	0	0	110.1
284	K	36	Very low	32	Very low	171 Å²	171	128.3 Å²	128.3	74%	0.743	76%	0.761	S	S	*	*			trans	-89.3	144.6	-178.2	167.2	-172	175.8	-176.5	0	113.1
285	P	31.2	Very low	31.6	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	76%	0.764	S	S	*	*			trans	-108.6	163.6	161	36.6	-29.1	0	0	0	114.3
286	Q	28.4	Very low	31.6	Very low	173 Å²	173	128.6 Å²	128.6	81%	0.808	76%	0.762	S	S	*	*			trans	-120	165.6	160.1	-114.4	-171.1	-84	0	0	108.6
287	P	53.2	Low	31.2	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	77%	0.768	S	S	*	*			trans	-90	156.5	-161.3	35.6	-37.4	0	0	0	115.1
288	T	27.4	Very low	31.3	Very low	148 Å²	148	128.3 Å²	128.3	91%	0.908	77%	0.768	S	S	*	*			trans	-141.7	154.5	154.7	-53.1	0	0	0	0	108.1
289	A	26.9	Very low	31.5	Very low	74 Å²	74	127.6 Å²	127.6	61%	0.612	77%	0.765	S	S	*	*			trans	-108.8	-179.1	-168.3	0	0	0	0	0	114.4
290	D	28.3	Very low	31.4	Very low	161 Å²	161	127.9 Å²	127.9	86%	0.861	76%	0.762	S	S	*	*			trans	70.1	153.5	167.6	-46.3	-43.3	0	0	0	115.5
291	S	28.2	Very low	31.3	Very low	100 Å²	100	125.5 Å²	125.5	70%	0.699	76%	0.756	S	S	*	*			cis	-159	146.7	15.4	71.1	0	0	0	0	114.7
292	V	28.1	Very low	31.4	Very low	126 Å²	126	127.2 Å²	127.2	76%	0.764	76%	0.758	S	S	*	*				68.6	113.7	126.2	168.6	0	0	0	0	121.7
293	C	25.7	Very low	31.4	Very low	106 Å²	106	126 Å²	126	72%	0.716	75%	0.751	S	S	*	*			trans	69.7	162	138.9	-69.1	0	0	0	0	121.2
294	L	31.1	Very low	31.4	Very low	140 Å²	140	124.1 Å²	124.1	73%	0.733	74%	0.744	S	S	*	*			cis	-158.4	163.4	-6.2	-118.3	164	0	0	0	112.5
295	D	26.7	Very low	31.2	Very low	127 Å²	127	121.9 Å²	121.9	68%	0.679	75%	0.75	S	S	*	*			trans	57.5	109.1	151.7	-87.8	-31	0	0	0	125.3
296	S	33.7	Very low	32.3	Very low	95 Å²	95	122.1 Å²	122.1	66%	0.664	75%	0.752	S	S	*	*				47	119.7	102.4	-45.4	0	0	0	0	122.4
297	S	35	Very low	32.3	Very low	118 Å²	118	123.2 Å²	123.2	83%	0.825	75%	0.754	S	S	*	*				155.1	151.5	108.2	-71.8	0	0	0	0	116.9
298	A	33.7	Very low	31.1	Very low	88 Å²	88	124.2 Å²	124.2	73%	0.727	75%	0.753	S	S	*	*			trans	62.5	122.3	160	0	0	0	0	0	118.6
299	Q	35.9	Very low	31.1	Very low	169 Å²	169	125.7 Å²	125.7	79%	0.79	75%	0.747	S	S	*	*				65.2	138.8	69.3	-66	-167.4	15.5	0	0	113.8
300	Q	34.6	Very low	31.1	Very low	156 Å²	156	128.2 Å²	128.2	73%	0.729	75%	0.75	S	S	*	*			cis	-163.7	-179	30.5	-142.8	169.5	71.2	0	0	114.2
301	T	27.8	Very low	31.1	Very low	115 Å²	115	127.4 Å²	127.4	71%	0.706	75%	0.746	S	S	*	*			trans	77.6	99.3	153.8	45.6	0	0	0	0	124.4
302	S	30.8	Very low	31.2	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	75%	0.75	S	S	*	*				69.6	108.6	119.7	67.7	0	0	0	0	124.9
303	S	28.3	Very low	31.3	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	75%	0.749	S	S	*	*				38.9	143.1	122.7	62.2	0	0	0	0	122.6
304	S	29.6	Very low	31.2	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	75%	0.75	S	S	*	*			cis	-178.4	137.1	-3.1	47.9	0	0	0	0	113
305	S	31.4	Very low	31	Very low	123 Å²	123	130.5 Å²	130.5	86%	0.86	76%	0.755	S	S	*	*			trans	179.2	153.2	144.4	-82.1	0	0	0	0	111
306	P	53.4	Low	31.1	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	76%	0.761	S	S	*	*			trans	-110.9	156	-164.5	39.6	-33.4	0	0	0	116.1
307	K	29.2	Very low	30.7	Very low	196 Å²	196	134 Å²	134	85%	0.852	76%	0.761	S	S	*	*			trans	-171.5	126	141.8	-109.5	167	-175.6	-179.7	0	113.7
308	N	27.6	Very low	30.6	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	76%	0.757	S	S	*	*			trans	57	134.2	145.4	-66.1	28.1	0	0	0	123.6
309	F	26.5	Very low	30.2	Very low	179 Å²	179	139.5 Å²	139.5	79%	0.785	76%	0.764	S	S	*	*			trans	85.8	146.5	144.5	-83.3	-58.9	0	0	0	121.9
310	D	27.6	Very low	29.8	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	76%	0.76	S	S	*	*			trans	68.5	93.7	160	-48.5	-20.1	0	0	0	120.3
311	D	28.7	Very low	29.4	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	76%	0.755	S	S	*	*				63	147.2	114.5	-81.3	-40.6	0	0	0	124.8
312	E	29.2	Very low	29.2	Very low	166 Å²	166	135.1 Å²	135.1	78%	0.776	76%	0.758	S	S	*	*			trans	50.1	151.1	148.2	-68.4	-151.7	103.4	0	0	123.2
313	L	30.7	Very low	29	Very low	144 Å²	144	136.2 Å²	136.2	75%	0.754	76%	0.76	S	S	*	*			cis	-164.1	128.2	-35.2	-164	135.1	0	0	0	107.5
314	S	23.5	Very low	29	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	76%	0.758	S	S	*	*			trans	-165.2	121.8	161.7	-164.3	0	0	0	0	111.8
315	S	26.7	Very low	28.8	Very low	120 Å²	120	136 Å²	136	84%	0.839	76%	0.759	S	S	*	*			trans	-129.7	119.6	164.6	-73.7	0	0	0	0	108
316	H	28.4	Very low	28.5	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.806	75%	0.749	S	S	*	*			trans	-91.4	173.2	172.4	-115.9	-62.1	0	0	0	111.7
317	D	26.6	Very low	27.3	Very low	123 Å²	123	138 Å²	138	66%	0.658	75%	0.751	S	S	*	*			trans	-60.5	142.9	-164.8	-57.1	-95.5	0	0	0	117.3
318	V	32.3	Very low	27.3	Very low	121 Å²	121	135 Å²	135	73%	0.733	75%	0.75	S	S	*	*				34.6	120	125.6	-171.1	0	0	0	0	118.3
319	F	24.8	Very low	27.2	Very low	200 Å²	200	136 Å²	136	88%	0.877	75%	0.754	S	S	*	*			trans	-144.2	162.8	131.2	-137.7	-95.3	0	0	0	113.6
320	M	27.6	Very low	27.3	Very low	146 Å²	146	132.3 Å²	132.3	72%	0.719	75%	0.751	S	S	*	*			trans	-79	145.2	-165.3	-72.1	176.3	50.6	0	0	116.4
321	S	26.7	Very low	27.3	Very low	89 Å²	89	134.3 Å²	134.3	62%	0.622	76%	0.757	S	S	*	*			trans	39.5	134.8	138.3	71.4	0	0	0	0	121.8
322	C	23.9	Very low	27.2	Very low	112 Å²	112	136 Å²	136	76%	0.757	76%	0.757	S	S	*	*				-172.4	123.1	102.7	-103.5	0	0	0	0	115.4
323	V	26	Very low	27	Very low	125 Å²	125	133.1 Å²	133.1	76%	0.758	75%	0.751	S	S	*	*				56.1	99.7	128.3	-174.2	0	0	0	0	120.5
324	S	28	Very low	26.9	Very low	100 Å²	100	132.7 Å²	132.7	70%	0.699	75%	0.754	S	S	*	*			trans	54.6	129.5	138.7	71.7	0	0	0	0	124.2
325	S	26.5	Very low	27.1	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	76%	0.761	S	S	*	*				-172.5	112.8	125	-95.3	0	0	0	0	108.5
326	T	25.6	Very low	27.4	Very low	106 Å²	106	138.4 Å²	138.4	65%	0.65	76%	0.756	S	S	*	*				74.5	112.4	75.7	61.1	0	0	0	0	115.9
327	E	28.3	Very low	27.3	Very low	177 Å²	177	139.1 Å²	139.1	83%	0.827	76%	0.757	S	S	*	*			trans	66.8	134.4	148.5	-60.7	163.8	-166.9	0	0	117.4
328	V	28.2	Very low	27.4	Very low	135 Å²	135	139.6 Å²	139.6	82%	0.818	76%	0.755	S	S	*	*				-155.3	170.9	57.4	-76.5	0	0	0	0	113.6
329	D	25.3	Very low	27.3	Very low	151 Å²	151	140.6 Å²	140.6	81%	0.807	75%	0.752	S	S	*	*			trans	-80.3	162.8	-169	-49.8	-93.7	0	0	0	117.5
330	S	28.7	Very low	27.5	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	74%	0.736	S	S	*	*				170.7	125.3	111.5	-95.2	0	0	0	0	113.7
331	E	28.2	Very low	27.6	Very low	171 Å²	171	137.4 Å²	137.4	80%	0.799	74%	0.736	S	S	*	*				37.6	145.1	124.8	-82.5	-177.4	125.5	0	0	121.9
332	F	26	Very low	27.6	Very low	178 Å²	178	137.9 Å²	137.9	78%	0.781	74%	0.739	S	S	*	*			cis	-158.6	-168.9	14.6	-169.6	-131.1	0	0	0	111.7
333	T	25.9	Very low	28	Very low	106 Å²	106	137.3 Å²	137.3	65%	0.65	74%	0.736	S	S	*	*			trans	69.4	98.8	168.1	56.8	0	0	0	0	119.1
334	V	28.6	Very low	28.1	Very low	135 Å²	135	135.9 Å²	135.9	82%	0.818	73%	0.732	S	S	*	*			trans	-111.7	135.3	132.4	174.1	0	0	0	0	106
335	E	26.7	Very low	28.3	Very low	190 Å²	190	138.8 Å²	138.8	89%	0.888	74%	0.735	S	S	*	*			trans	-103	125.3	163.2	-77.9	-161.4	141.6	0	0	109.1
336	E	32.9	Very low	28.4	Very low	156 Å²	156	143 Å²	143	73%	0.729	74%	0.739	S	S	*	*			trans	-94.1	154.2	168	-66.7	-178.5	107.1	0	0	110.9
337	K	25.5	Very low	28.6	Very low	190 Å²	190	145.5 Å²	145.5	83%	0.826	75%	0.747	S	S	*	*			trans	-154	124.7	140.1	-121.4	151.8	-174.8	149.9	0	109.8
338	E	29.1	Very low	28.5	Very low	132 Å²	132	140.4 Å²	140.4	62%	0.617	74%	0.742	S	S	*	*			cis	64	146.7	45.6	-56.5	-171.3	130.1	0	0	112.6
339	E	30.1	Very low	28.4	Very low	142 Å²	142	140.1 Å²	140.1	66%	0.664	74%	0.741	S	S	*	*			cis	-152.7	-165.4	0.8	-126.9	-173	147.7	0	0	106.4
340	K	30.4	Very low	28.5	Very low	128 Å²	128	137.9 Å²	137.9	56%	0.557	74%	0.735	S	S	*	*			cis	-166.3	174.3	7.5	-129.1	165.6	-176.7	-113	0	106.5
341	E	29.3	Very low	28.3	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	74%	0.738	S	S	*	*			cis	-161.7	-172.5	-10.2	-143.5	166.5	176.5	0	0	105
342	S	27	Very low	28.4	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	73%	0.734	S	S	*	*			cis	-159.3	-178.1	0.2	70.4	0	0	0	0	106.6
343	S	31.4	Very low	28.5	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	74%	0.738	S	S	*	*			cis	-158.1	-172.1	1.6	66.3	0	0	0	0	106.8
344	S	28.2	Very low	28.7	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	74%	0.74	S	S	*	*			cis	-154.9	159	0.1	9.6	0	0	0	0	111.1
345	E	32.2	Very low	28.8	Very low	161 Å²	161	141.9 Å²	141.9	75%	0.752	74%	0.739	S	S	*	*			trans	5.3	128.3	150.7	-45.9	-175.9	140.5	0	0	121
346	K	29.6	Very low	29.1	Very low	196 Å²	196	141 Å²	141	85%	0.852	73%	0.734	S	S	*	*				-168.6	131.7	94.4	-102.5	163.4	-172.2	165.8	0	116.9
347	I	28.5	Very low	28.7	Very low	160 Å²	160	136.6 Å²	136.6	82%	0.821	73%	0.732	S	S	*	*			trans	-51.4	148.2	175.9	-61.4	154.2	0	0	0	115
348	G	25.8	Very low	28.9	Very low	70 Å²	70	132.4 Å²	132.4	72%	0.722	73%	0.732	S	S	*	*			trans	-168.6	133.7	164.6	0	0	0	0	0	115.3
349	T	26.6	Very low	29	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	74%	0.737	S	S	*	*			trans	-156.3	165.3	-167.2	54.8	0	0	0	0	110.8
350	C	27	Very low	29.1	Very low	103 Å²	103	133.8 Å²	133.8	70%	0.696	74%	0.736	S	S	*	*			cis	-163.8	173.9	-1.6	-127	0	0	0	0	112.7
351	F	26.4	Very low	29.1	Very low	173 Å²	173	133.7 Å²	133.7	76%	0.759	75%	0.746	S	S	*	*			trans	70.1	129.6	153.7	-91.5	-127.4	0	0	0	122.3
352	N	29	Very low	28.9	Very low	137 Å²	137	131.4 Å²	131.4	73%	0.733	75%	0.747	S	S	*	*			trans	37.3	144.7	134.2	-57.1	-14	0	0	0	121.3
353	K	27.9	Very low	29.1	Very low	199 Å²	199	131.9 Å²	131.9	87%	0.865	75%	0.75	S	S	*	*				-173.2	160.3	57	-169.2	175.7	176.5	-172.3	0	115.4
354	S	31.6	Very low	28.8	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	76%	0.76	S	S	*	*			trans	-42.9	157.6	178.2	-35	0	0	0	0	122.9
355	Q	30	Very low	28.9	Very low	171 Å²	171	133.8 Å²	133.8	80%	0.799	76%	0.762	S	S	*	*				158.2	162.1	120.9	-85.7	-171.2	-89.1	0	0	112.4
356	E	31.9	Very low	28.7	Very low	170 Å²	170	135.7 Å²	135.7	79%	0.794	77%	0.771	S	S	*	*			cis	-176.6	156.5	-31.1	-175.6	161.6	-147.7	0	0	111.5
357	G	25.1	Very low	28.6	Very low	65 Å²	65	129.7 Å²	129.7	67%	0.67	76%	0.764	S	S	*	*			trans	113.1	125	171.4	0	0	0	0	0	115.1
358	A	30.5	Very low	28.5	Very low	101 Å²	101	128.7 Å²	128.7	84%	0.835	77%	0.766	S	S	*	*			cis	82.2	134.4	20.7	0	0	0	0	0	114.2
359	E	30.5	Very low	28.6	Very low	154 Å²	154	129.6 Å²	129.6	72%	0.72	76%	0.761	S	S	*	*			cis	-150.4	-168.1	7.5	-70.7	-156	101.3	0	0	110.7
360	K	31.7	Very low	28.8	Very low	150 Å²	150	131 Å²	131	65%	0.652	76%	0.759	S	S	*	*			cis	-162.7	129.8	-0.9	-130.6	176.9	178	74.6	0	108
361	V	31.4	Very low	28.8	Very low	125 Å²	125	133.8 Å²	133.8	76%	0.758	77%	0.766	S	S	*	*				86.6	147.6	100.4	162.8	0	0	0	0	120.7
362	S	25.5	Very low	28.8	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	76%	0.762	S	S	*	*			trans	86.1	134.4	169.2	72.1	0	0	0	0	118.1
363	S	29.3	Very low	28.7	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	77%	0.766	S	S	*	*			cis	111.3	120.9	-1.5	79.3	0	0	0	0	117.5
364	V	26.3	Very low	28.8	Very low	151 Å²	151	126.1 Å²	126.1	92%	0.915	76%	0.762	S	S	*	*			trans	169.7	167.6	142.9	151.3	0	0	0	0	108.6
365	A	29.5	Very low	28.7	Very low	85 Å²	85	126 Å²	126	70%	0.702	76%	0.762	S	S	*	*			trans	-136.5	-173.9	-157.3	0	0	0	0	0	116.1
366	E	28.4	Very low	28.7	Very low	201 Å²	201	127.5 Å²	127.5	94%	0.939	77%	0.766	S	S	*	*			trans	74.5	148.7	166.7	-56	-171.8	134.6	0	0	119.1
367	G	27.1	Very low	28.5	Very low	70 Å²	70	124 Å²	124	72%	0.722	76%	0.756	S	S	*	*			trans	162.4	17.6	163	0	0	0	0	0	127.1
368	V	27.6	Very low	28.8	Very low	140 Å²	140	128.2 Å²	128.2	85%	0.848	76%	0.758	S	S	*	*			trans	61.3	143.9	147.1	175.7	0	0	0	0	122.9
369	S	27.3	Very low	28.6	Very low	89 Å²	89	132.3 Å²	132.3	62%	0.622	76%	0.76	S	S	*	*			trans	69.7	112.6	157.4	-78.3	0	0	0	0	124.4
370	E	29.9	Very low	28.5	Very low	159 Å²	159	130.2 Å²	130.2	74%	0.743	75%	0.753	S	S	*	*				52.3	148.9	109.7	-63.1	176	127.3	0	0	124.4
371	N	28.4	Very low	28.5	Very low	160 Å²	160	129.4 Å²	129.4	86%	0.856	76%	0.755	S	S	*	*			trans	71.6	139.8	171.3	-50	-62.9	0	0	0	115.3
372	G	26.3	Very low	28.3	Very low	65 Å²	65	132 Å²	132	67%	0.67	76%	0.756	S	S	*	*			cis	141.8	114.1	3.2	0	0	0	0	0	111.1
373	T	27.3	Very low	28.3	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	76%	0.76	S	S	*	*			trans	65.6	95.7	152.3	-49.1	0	0	0	0	119.4
374	L	29.5	Very low	28.3	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	77%	0.766	S	S	*	*				49.8	114.5	111	-152.1	173.5	0	0	0	118.6
375	S	29.8	Very low	28.4	Very low	96 Å²	96	136.3 Å²	136.3	67%	0.671	76%	0.757	S	S	*	*				163.4	134.2	127.2	50.4	0	0	0	0	115.8
376	K	28.3	Very low	28.3	Very low	202 Å²	202	141.2 Å²	141.2	88%	0.878	77%	0.766	S	S	*	*			trans	165.3	112.4	148.1	-94.4	171.4	178.9	179	0	107.3
377	T	29.8	Very low	28.2	Very low	97 Å²	97	137.3 Å²	137.3	60%	0.595	76%	0.759	S	S	*	*			cis	55.6	132.9	14.2	72.9	0	0	0	0	114.1
378	E	31	Very low	28.1	Very low	153 Å²	153	140.7 Å²	140.7	72%	0.715	77%	0.766	S	S	*	*			cis	-117.2	-171.2	-1	-97.2	113.2	139.4	0	0	109.1	L380	E378-L380 HydrophobicContact CG-CD1 4.16Å
379	E	26.6	Very low	28.2	Very low	186 Å²	186	141.4 Å²	141.4	87%	0.869	76%	0.764	S	S	*	*			cis	-167.5	161.5	33.8	-166	172.8	-165.5	0	0	110.3
380	L	28.3	Very low	28.2	Very low	111 Å²	111	144.7 Å²	144.7	58%	0.581	77%	0.769	S	S	*	*			cis	176.3	113.4	-36.2	-169.1	118	0	0	0	106.2	E378	E378-L380 HydrophobicContact CG-CD1 4.16Å
381	I	31.1	Very low	28.1	Very low	132 Å²	132	144.5 Å²	144.5	68%	0.677	77%	0.769	S	S	*	*			trans	51.6	119.8	144.5	-62.6	171.4	0	0	0	120.7
382	K	27.9	Very low	28	Very low	181 Å²	181	142.9 Å²	142.9	79%	0.787	77%	0.77	S	S	*	*				168	155.8	114.3	-115.3	142.4	-171.5	169	0	111
383	K	25	Very low	28	Very low	185 Å²	185	143.6 Å²	143.6	80%	0.804	78%	0.777	S	S	*	*			cis	-135.3	172.6	12	-54.4	177	-179.9	176.4	0	108.6
384	M	27.9	Very low	28.1	Very low	179 Å²	179	146.6 Å²	146.6	88%	0.882	78%	0.782	S	S	*	*			cis	53.1	134	47.6	-80.6	177	169.1	0	0	114.6
385	A	30	Very low	28	Very low	89 Å²	89	146.5 Å²	146.5	74%	0.736	78%	0.782	S	S	*	*			cis	-140.1	-154	-13.7	0	0	0	0	0	106.1
386	E	27.5	Very low	27.9	Very low	188 Å²	188	147 Å²	147	88%	0.879	79%	0.785	S	S	*	*			cis	-170.5	171.4	28.6	-159.6	152.8	-132.1	0	0	109.9
387	C	25.5	Very low	27.8	Very low	118 Å²	118	141.1 Å²	141.1	80%	0.797	78%	0.783	S	S	*	*			trans	-100.3	163.3	179	-57.9	0	0	0	0	112.9
388	T	25.5	Very low	27.6	Very low	142 Å²	142	140.1 Å²	140.1	87%	0.871	79%	0.791	S	S	*	*			trans	-153.2	150.1	154.3	-65.8	0	0	0	0	109.9
389	L	28.9	Very low	28.3	Very low	155 Å²	155	138.3 Å²	138.3	81%	0.812	79%	0.793	S	S	*	*			trans	-124.7	179	-177.4	-89.8	169.3	0	0	0	111.6
390	Q	27.9	Very low	28.4	Very low	157 Å²	157	138.8 Å²	138.8	73%	0.734	79%	0.792	S	S	*	*			trans	87.1	113	159.7	-72.8	176.4	-83.8	0	0	120.8
391	E	27.9	Very low	28.6	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	80%	0.803	S	S	*	*				103.3	133.8	115.7	-82.6	177.4	-152.5	0	0	124.1
392	S	26.6	Very low	29	Very low	126 Å²	126	139.9 Å²	139.9	88%	0.881	81%	0.806	S	S	*	*			trans	80.6	140.6	150.7	77.7	0	0	0	0	119.6
393	G	26.7	Very low	29	Very low	79 Å²	79	138.6 Å²	138.6	81%	0.814	80%	0.803	S	S	*	*			trans	139.3	96.8	174.9	0	0	0	0	0	113.1
394	Q	28.3	Very low	29.1	Very low	196 Å²	196	136.4 Å²	136.4	92%	0.916	80%	0.795	S	S	*	*			trans	-101	158.2	167	-67.8	-179.2	-90.8	0	0	110.9
395	D	27.4	Very low	29.1	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	79%	0.788	S	S	*	*			trans	108.8	136.2	135	-153.7	21.6	0	0	0	120.2
396	S	27	Very low	28.8	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	78%	0.784	S	S	*	*			trans	54	133.5	155.1	72.8	0	0	0	0	122.4
397	G	27.1	Very low	28.7	Very low	80 Å²	80	132.3 Å²	132.3	83%	0.825	78%	0.777	S	S	*	*			trans	117.6	102.5	140.5	0	0	0	0	0	118.1
398	G	25.4	Very low	28.6	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	77%	0.774	S	S	*	*			trans	-97.9	-159.4	145.8	0	0	0	0	0	110.3
399	P	45.6	Very low	28.7	Very low	116 Å²	116	130 Å²	130	75%	0.753	76%	0.764	S	S	*	*			cis	-132	-179.2	-8.3	39.1	-22.5	0	0	0	113.2
400	K	28.7	Very low	28.6	Very low	195 Å²	195	129.7 Å²	129.7	85%	0.848	76%	0.758	S	S	*	*			trans	151.2	119.4	135.2	-84	164.6	-176.7	-178.3	0	113.5
401	D	32.9	Very low	28.5	Very low	153 Å²	153	129.6 Å²	129.6	82%	0.818	76%	0.758	S	S	*	*			trans	-86.4	174.3	143.7	-61.8	-65	0	0	0	109.4
402	P	39.1	Very low	28.6	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	76%	0.759	S	S	*	*				-145.7	143	86.9	37.3	-20.5	0	0	0	116.7
403	Q	27.9	Very low	28.6	Very low	155 Å²	155	133.2 Å²	133.2	72%	0.724	75%	0.752	S	S	*	*			trans	59.2	134.2	135.6	-65.1	-169.4	-81.5	0	0	122.9
404	Q	27.6	Very low	28.7	Very low	138 Å²	138	133.8 Å²	133.8	65%	0.645	74%	0.744	S	S	*	*				34.1	146.8	120.5	-62.3	163.8	-87.5	0	0	119.8
405	E	27.1	Very low	28.5	Very low	156 Å²	156	131.1 Å²	131.1	73%	0.729	74%	0.736	S	S	*	*			cis	-156.9	171.7	10.6	-131.8	159.4	-147.2	0	0	115
406	S	24.3	Very low	28.5	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	74%	0.735	S	S	*	*			trans	-35.6	171.4	172.1	55.5	0	0	0	0	122.8
407	V	24.7	Very low	29.1	Very low	121 Å²	121	129.4 Å²	129.4	73%	0.733	73%	0.733	S	S	*	*			trans	106.3	118.4	153.5	-175.7	0	0	0	0	117
408	S	24.7	Very low	29	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	73%	0.728	S	S	*	*			trans	21	164.5	133.7	-41.6	0	0	0	0	121.6
409	T	26.6	Very low	29.1	Very low	108 Å²	108	132.4 Å²	132.4	66%	0.663	73%	0.729	S	S	*	*			cis	-168.6	156.1	35.8	-25.4	0	0	0	0	113
410	E	27.2	Very low	28.3	Very low	149 Å²	149	135.8 Å²	135.8	70%	0.696	74%	0.735	S	S	*	*			trans	64.2	165	150.9	-82.2	-180	115.9	0	0	119.5
411	Q	26.3	Very low	28.3	Very low	154 Å²	154	135.3 Å²	135.3	72%	0.72	74%	0.736	S	S	*	*			cis	-147	-178.2	5.8	-137.7	160.9	45.1	0	0	114.1
412	R	29	Very low	28.1	Very low	203 Å²	203	139.3 Å²	139.3	77%	0.766	74%	0.739	S	S	*	*			trans	-58.3	168.5	179.1	-64.9	159.4	177.3	-108.3	10.5	115.4
413	E	28.2	Very low	27.5	Very low	156 Å²	156	142 Å²	142	73%	0.729	74%	0.742	S	S	*	*			cis	-150.9	-151.5	-6.3	-114.5	161.8	-112.4	0	0	107.3
414	S	26.8	Very low	27.7	Very low	91 Å²	91	141.8 Å²	141.8	64%	0.636	75%	0.745	S	S	*	*			cis	-158.8	-170.7	12.3	66.4	0	0	0	0	112.4
415	D	25.7	Very low	27.6	Very low	139 Å²	139	142.5 Å²	142.5	74%	0.743	75%	0.753	S	S	*	*			trans	56.1	87.7	154.1	-61.5	-54	0	0	0	123.1
416	S	25.8	Very low	27.7	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	75%	0.754	S	S	*	*				32.5	153.3	107.8	-51.9	0	0	0	0	121.7
417	P	39.8	Very low	28	Very low	108 Å²	108	142 Å²	142	70%	0.701	76%	0.762	S	S	*	*			cis	-146.5	170.6	20.3	43	-23.4	0	0	0	119.7
418	S	25.4	Very low	29.2	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	76%	0.761	S	S	*	*			trans	79.4	155.3	141.8	73.2	0	0	0	0	123.3
419	S	28.5	Very low	29.4	Very low	113 Å²	113	142.4 Å²	142.4	79%	0.79	77%	0.767	S	S	*	*			trans	71.4	147.5	168.8	70.7	0	0	0	0	117.7
420	E	28.8	Very low	29.7	Very low	187 Å²	187	141.8 Å²	141.8	87%	0.874	77%	0.773	S	S	*	*			cis	-156.9	-147.1	-32.7	-152.7	162.2	-151.6	0	0	110.5
421	Q	27.7	Very low	30.7	Very low	186 Å²	186	139.8 Å²	139.8	87%	0.869	77%	0.773	S	S	*	*			trans	-85.7	171.6	-167.1	-67.5	178	-31.6	0	0	115.4
422	R	28.4	Very low	30.9	Very low	237 Å²	237	140.2 Å²	140.2	89%	0.894	78%	0.78	S	S	*	*			trans	-74.3	141.9	170.2	-59.6	172.8	176.9	165.6	-1.9	111
423	E	27.8	Very low	30.9	Very low	169 Å²	169	134.3 Å²	134.3	79%	0.79	78%	0.782	S	S	*	*				-179.1	148.7	107.9	-99.9	-172.1	177.8	0	0	115
424	L	31.1	Very low	30.8	Very low	150 Å²	150	130.2 Å²	130.2	79%	0.785	78%	0.782	S	S	*	*			trans	50	115.1	146.8	-63.3	169.2	0	0	0	123.7
425	D	26.2	Very low	30.9	Very low	153 Å²	153	133.8 Å²	133.8	82%	0.818	79%	0.793	S	S	*	*			trans	82.7	159	130.3	-155.3	24	0	0	0	121.6
426	S	28.3	Very low	31.2	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	79%	0.794	S	S	*	*			trans	79.6	134	171.9	-65	0	0	0	0	120.4
427	T	30.3	Very low	32.5	Very low	134 Å²	134	133 Å²	133	82%	0.822	79%	0.79	S	S	*	*			trans	-103.3	-178.7	171.7	63.1	0	0	0	0	109.9
428	P	50	Low	32	Very low	111 Å²	111	133.2 Å²	133.2	72%	0.721	80%	0.795	S	S	*	*			cis	-134.2	-177.4	-9.4	39.1	-21.8	0	0	0	114.9
429	S	29.5	Very low	32.4	Very low	121 Å²	121	133 Å²	133	85%	0.846	80%	0.799	S	S	*	*			trans	130.6	156.5	145	-54.8	0	0	0	0	117.2
430	A	32.4	Very low	32.4	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	80%	0.803	S	S	*	*			trans	-124	-169.1	-179.2	0	0	0	0	0	110.1
431	P	49.6	Very low	32.4	Very low	108 Å²	108	126 Å²	126	70%	0.701	79%	0.794	S	S	*	*			cis	-140	-165.3	3.2	45.1	-25.2	0	0	0	116.5
432	D	30.2	Very low	32.5	Very low	163 Å²	163	125.7 Å²	125.7	87%	0.872	79%	0.793	S	S	*	*			trans	60.6	157.2	168.7	-66.6	-25.6	0	0	0	118.8
433	G	28.5	Very low	32.8	Very low	78 Å²	78	121.9 Å²	121.9	80%	0.804	79%	0.79	S	S	*	*			cis	135.4	135.9	-3.6	0	0	0	0	0	112.4
434	G	26.3	Very low	33	Very low	70 Å²	70	121.6 Å²	121.6	72%	0.722	79%	0.794	S	S	*	*			cis	175.9	-173	-3.7	0	0	0	0	0	112
435	L	28.7	Very low	33	Very low	166 Å²	166	120.7 Å²	120.7	87%	0.869	79%	0.79	S	S	*	*			trans	77.2	142	176	-54.5	162.7	0	0	0	116.6
436	V	30.9	Very low	33.2	Very low	127 Å²	127	118.6 Å²	118.6	77%	0.77	78%	0.783	S	S	*	*			cis	90.2	139.2	25	174.8	0	0	0	0	113.3
437	P	54.9	Low	33.2	Very low	106 Å²	106	120.3 Å²	120.3	69%	0.688	78%	0.783	S	S	*	*			cis	-139.8	-165.8	-7.3	39.6	-18.2	0	0	0	117.7
438	S	29.6	Very low	33.1	Very low	114 Å²	114	122 Å²	122	80%	0.797	79%	0.786	S	S	*	*			trans	83.6	153.8	141.2	-72.4	0	0	0	0	122.6
439	A	33.1	Very low	31.9	Very low	98 Å²	98	120 Å²	120	81%	0.81	79%	0.785	S	S	*	*			cis	-173.7	162.3	-18.9	0	0	0	0	0	113.2
440	G	27.5	Very low	31.8	Very low	85 Å²	85	118.8 Å²	118.8	88%	0.876	78%	0.782	S	S	*	*			trans	85.4	152.1	161.2	0	0	0	0	0	117.4
441	G	28.6	Very low	31.6	Very low	68 Å²	68	120.3 Å²	120.3	70%	0.701	78%	0.782	S	S	*	*			cis	169.4	166.3	-6.3	0	0	0	0	0	113
442	E	31	Very low	30.5	Very low	181 Å²	181	122.1 Å²	122.1	85%	0.846	79%	0.786	S	S	*	*			trans	60	96.8	155.8	-63.2	155.3	-154.1	0	0	118
443	D	33.8	Very low	30.3	Very low	156 Å²	156	123 Å²	123	83%	0.834	79%	0.785	S	S	*	*				100.8	176.5	100.2	-68	-41.1	0	0	0	111.5
444	D	32.8	Very low	30.4	Very low	163 Å²	163	124.6 Å²	124.6	87%	0.872	78%	0.784	S	S	*	*			cis	-153.8	-163.6	28.7	-165.7	6.6	0	0	0	112.3
445	D	31.8	Very low	31.3	Very low	131 Å²	131	127 Å²	127	70%	0.701	79%	0.787	S	S	*	*			trans	-93.4	149.8	-151.7	-145.1	-7.6	0	0	0	121.9
446	T	29.4	Very low	31.3	Very low	109 Å²	109	127.7 Å²	127.7	67%	0.669	79%	0.785	S	S	*	*			trans	57.3	149.3	144.8	25.1	0	0	0	0	131.2
447	I	28.5	Very low	31.2	Very low	142 Å²	142	126.6 Å²	126.6	73%	0.728	78%	0.783	S	S	*	*			trans	110.9	110.2	130.9	-91.3	171.6	0	0	0	124.1
448	L	27.8	Very low	30.1	Very low	170 Å²	170	127 Å²	127	89%	0.89	79%	0.789	S	S	*	*			trans	55.8	141.4	140.9	-58.8	171.2	0	0	0	126.6
449	G	24.9	Very low	30.1	Very low	69 Å²	69	126 Å²	126	71%	0.711	79%	0.788	S	S	*	*			trans	123.5	116	155.3	0	0	0	0	0	113.8
450	A	28.1	Very low	29.9	Very low	95 Å²	95	126.2 Å²	126.2	79%	0.785	79%	0.79	S	S	*	*				68.2	130	52	0	0	0	0	0	113.7
451	T	27.5	Very low	30	Very low	127 Å²	127	126.1 Å²	126.1	78%	0.779	78%	0.781	S	S	*	*			cis	-165.9	161	-1	12.8	0	0	0	0	110.7
452	D	26	Very low	30	Very low	146 Å²	146	129.1 Å²	129.1	78%	0.781	79%	0.785	S	S	*	*			trans	80.7	151.5	144.7	-95.1	-46.1	0	0	0	126.4
453	E	27	Very low	30	Very low	182 Å²	182	126.7 Å²	126.7	85%	0.85	78%	0.783	S	S	*	*			trans	59.5	144.3	157.5	-67.5	-165.9	131	0	0	124.6
454	S	29.3	Very low	29.8	Very low	112 Å²	112	123.4 Å²	123.4	78%	0.783	78%	0.778	S	S	*	*			trans	-123.9	160.5	163	-58	0	0	0	0	108
455	P	45.1	Very low	29.7	Very low	121 Å²	121	119.9 Å²	119.9	79%	0.786	77%	0.771	S	S	*	*				-157.8	163.6	95.4	38.7	-18.6	0	0	0	118.7
456	E	29.3	Very low	29.6	Very low	179 Å²	179	122.3 Å²	122.3	84%	0.836	78%	0.778	S	S	*	*			trans	39	107.2	142.6	-60.5	-167.4	143.6	0	0	125.1
457	S	30.3	Very low	29.6	Very low	104 Å²	104	121.1 Å²	121.1	73%	0.727	78%	0.779	S	S	*	*				82.3	136.9	115.5	86.6	0	0	0	0	125.3
458	S	30.5	Very low	29.7	Very low	114 Å²	114	117.8 Å²	117.8	80%	0.797	77%	0.773	S	S	*	*			trans	102.8	127.3	136.9	80.9	0	0	0	0	123.7
459	A	29.8	Very low	29.7	Very low	94 Å²	94	116.8 Å²	116.8	78%	0.777	77%	0.768	S	S	*	*			trans	73.5	97.3	138.2	0	0	0	0	0	125.3
460	A	28.4	Very low	30	Very low	103 Å²	103	117.4 Å²	117.4	85%	0.851	77%	0.767	S	S	*	*				62.4	135.9	117	0	0	0	0	0	125
461	A	30.7	Very low	29.9	Very low	83 Å²	83	118.6 Å²	118.6	69%	0.686	76%	0.76	S	S	*	*				149.1	139.3	102.5	0	0	0	0	0	118.1
462	T	28.7	Very low	29.9	Very low	130 Å²	130	118 Å²	118	80%	0.798	76%	0.757	S	S	*	*			trans	63	160	152.2	40.3	0	0	0	0	120
463	T	30	Very low	30	Very low	131 Å²	131	114 Å²	114	80%	0.804	75%	0.749	S	S	*	*			cis	-168.6	172.1	3.3	17.6	0	0	0	0	108.1
464	A	29.5	Very low	30	Very low	87 Å²	87	110.5 Å²	110.5	72%	0.719	75%	0.745	S	S	*	*			cis	177.7	-179	-26.8	0	0	0	0	0	109.9
465	A	30.7	Very low	29.9	Very low	88 Å²	88	112.4 Å²	112.4	73%	0.727	75%	0.746	S	S	*	*			trans	75.9	154.3	162.9	0	0	0	0	0	118.9
466	Q	29.3	Very low	29.1	Very low	183 Å²	183	112.6 Å²	112.6	86%	0.855	75%	0.745	S	S	*	*			cis	-168.6	154.5	-9.4	-118.4	171.2	-7	0	0	113.2
467	A	30.3	Very low	28.9	Very low	83 Å²	83	108.2 Å²	108.2	69%	0.686	74%	0.74	S	S	*	*			trans	60.8	156.3	143.7	0	0	0	0	0	122.6
468	A	31.3	Very low	28.6	Very low	72 Å²	72	112.5 Å²	112.5	60%	0.595	75%	0.745	S	S	*	*			cis	-173.3	162.8	-24.3	0	0	0	0	0	112.9
469	D	27.3	Very low	28.3	Very low	149 Å²	149	111.9 Å²	111.9	80%	0.797	74%	0.741	S	S	*	*			trans	90	145.7	139.7	-127.7	-20.1	0	0	0	125.1
470	A	30	Very low	28.2	Very low	83 Å²	83	112 Å²	112	69%	0.686	74%	0.736	S	S	*	*			trans	78	91.4	148.2	0	0	0	0	0	125.5
471	D	26.3	Very low	28	Very low	120 Å²	120	115.8 Å²	115.8	64%	0.642	74%	0.736	S	S	*	*				92	151.7	107.9	-160	44.4	0	0	0	124.8
472	T	28.4	Very low	27.8	Very low	115 Å²	115	116.7 Å²	116.7	71%	0.706	74%	0.744	S	S	*	*			trans	56.3	125.8	159.9	27.8	0	0	0	0	124.5
473	G	26.7	Very low	27.7	Very low	60 Å²	60	115.9 Å²	115.9	62%	0.619	74%	0.743	S	S	*	*				132.5	81.6	115.9	0	0	0	0	0	121.9
474	S	28.4	Very low	27.6	Very low	109 Å²	109	115.1 Å²	115.1	76%	0.762	74%	0.743	S	S	*	*			trans	48.6	115.7	138.1	68.5	0	0	0	0	123.3
475	D	26.2	Very low	27.4	Very low	153 Å²	153	119.8 Å²	119.8	82%	0.818	75%	0.747	S	S	*	*				77.2	143.7	120.8	-89.6	-48.2	0	0	0	126.5
476	V	28	Very low	27.1	Very low	124 Å²	124	121.6 Å²	121.6	75%	0.752	74%	0.744	S	S	*	*			trans	74.8	88.6	146	176.8	0	0	0	0	120.8
477	A	25.6	Very low	26.9	Very low	88 Å²	88	119.9 Å²	119.9	73%	0.727	74%	0.736	S	S	*	*				71.3	136.3	116.8	0	0	0	0	0	124.8
478	K	24.1	Very low	26.7	Very low	193 Å²	193	123 Å²	123	84%	0.839	74%	0.737	S	S	*	*			trans	76.7	105.6	138.9	-86.4	-173.5	177.5	-177.3	0	122.1
479	S	24.6	Very low	26.4	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	75%	0.746	S	S	*	*				80.3	137.1	118.7	65.4	0	0	0	0	123.2
480	S	26.9	Very low	26.5	Very low	98 Å²	98	128 Å²	128	69%	0.685	75%	0.747	S	S	*	*			trans	77.2	122.9	141.5	49.9	0	0	0	0	122
481	E	25.3	Very low	26.4	Very low	182 Å²	182	131.9 Å²	131.9	85%	0.85	75%	0.752	S	S	*	*			trans	71.7	97.8	137.4	-63.2	-176.6	134.3	0	0	121.2
482	A	25.7	Very low	26.5	Very low	102 Å²	102	135.6 Å²	135.6	84%	0.843	76%	0.762	S	S	*	*				31.2	123.5	126.3	0	0	0	0	0	120.7
483	S	26.3	Very low	26.5	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	77%	0.772	S	S	*	*				160.5	154	102.9	-169.1	0	0	0	0	112.8
484	S	27.9	Very low	26.4	Very low	116 Å²	116	143.2 Å²	143.2	81%	0.811	78%	0.784	S	S	*	*			trans	66.7	164	173.7	78.6	0	0	0	0	118.5
485	K	26	Very low	26.6	Very low	184 Å²	184	147.8 Å²	147.8	80%	0.8	79%	0.79	S	S	*	*				-176.5	145.2	-56.8	174.2	176.2	-176.8	-175.1	0	108.5
486	L	25.4	Very low	26.6	Very low	126 Å²	126	149.8 Å²	149.8	66%	0.66	80%	0.795	S	S	*	*			trans	85.9	118.4	164.5	-124.3	75.7	0	0	0	118.4
487	E	23.5	Very low	26.9	Very low	148 Å²	148	150.2 Å²	150.2	69%	0.692	79%	0.792	S	S	*	*			trans	59.4	144.9	148.9	-70.4	174.6	98.6	0	0	120.1
488	Q	26.5	Very low	26.9	Very low	149 Å²	149	155 Å²	155	70%	0.696	80%	0.798	S	S	*	*			cis	-147.5	175.1	16.9	-131.9	151.9	48.1	0	0	112.4
489	Q	25.7	Very low	27.6	Very low	168 Å²	168	151.5 Å²	151.5	79%	0.785	80%	0.796	S	S	*	*			trans	-19.3	146.3	174.6	-69.8	151.2	-27.8	0	0	118.5
490	D	28.7	Very low	27.5	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	80%	0.801	S	S	*	*				-159.7	-177.6	61.7	-129.2	-31.2	0	0	0	116.3
491	E	27.5	Very low	27.5	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	80%	0.804	S	S	*	*			trans	-66.5	134.1	-168.2	-58.2	-173.4	108.5	0	0	118.6
492	K	28.7	Very low	28.4	Very low	198 Å²	198	146.6 Å²	146.6	86%	0.861	81%	0.805	S	S	*	*				-176	162.2	113.8	-100.5	155.8	-171.3	163	0	115.6
493	K	28.6	Very low	28.5	Very low	209 Å²	209	146.5 Å²	146.5	91%	0.909	80%	0.798	S	S	*	*			trans	-58.4	134.3	-173.1	-66	175.6	174.2	178.6	0	115.1
494	S	25.2	Very low	29.2	Very low	125 Å²	125	148.1 Å²	148.1	87%	0.874	80%	0.798	S	S	*	*			trans	-141.2	149.8	156.7	-71.8	0	0	0	0	110.6
495	K	32.2	Very low	29.6	Very low	205 Å²	205	146.6 Å²	146.6	89%	0.891	78%	0.78	S	S	*	*			trans	-90.3	142	172.2	-57.5	173.5	-178.6	174.9	0	110
496	Q	25.9	Very low	30.4	Very low	195 Å²	195	144.5 Å²	144.5	91%	0.911	77%	0.768	S	S	*	*			trans	-158.9	171	137.8	-133.9	167.6	-5.2	0	0	112.6
497	I	34.7	Very low	31	Very low	134 Å²	134	145.9 Å²	145.9	69%	0.687	78%	0.775	S	S	*	*			trans	-120.4	150.3	-161.2	-61.1	157.9	0	0	0	109.5
498	H	25.1	Very low	31.9	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.866	77%	0.773	S	S	*	*			trans	-128.8	153.5	157.4	-81.4	-41.4	0	0	0	112.2
499	P	40.1	Very low	32.6	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	76%	0.756	S	S	*	*			trans	-114.2	157.8	-148.5	39.7	-30.7	0	0	0	115
500	G	22.3	Very low	33.8	Very low	80 Å²	80	138 Å²	138	83%	0.825	74%	0.743	S	S	*	*			trans	169.2	133.2	162.1	0	0	0	0	0	114.8
501	G	26.2	Very low	34.7	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	74%	0.742	S	S	*	*			trans	98.7	100.8	160	0	0	0	0	0	117.4
502	S	44	Very low	35.6	Very low	126 Å²	126	135.6 Å²	135.6	88%	0.881	74%	0.74	S	S	*	*			trans	39.7	101.6	140.7	59.8	0	0	0	0	120.3
503	S	28.4	Very low	36.4	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	72%	0.715	S	S	*	*			trans	-148.5	119.7	135.3	58.3	0	0	0	0	109.3
504	D	39.8	Very low	37.3	Very low	147 Å²	147	124.5 Å²	124.5	79%	0.786	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-71.6	126.8	172.4	-74.3	-52	0	0	0	109.4	Y506	D504-Y506 HydrophobicContact CB-CE2 4.49Å
505	I	37.9	Very low	38.5	Very low	83 Å²	83	123.1 Å²	123.1	43%	0.426	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-101.2	123.3	-179	-58.5	-179.9	0	0	0	107.9	D509 L513	I505-D509 HydrophobicContact CG2-CB 3.73Å; I505-L513 HydrophobicContact CD1-CD1 4.25Å; I505-L513 HydrophobicContact CG2-CD1 4.09Å
506	Y	41.9	Very low	39.1	Very low	141 Å²	141	120.9 Å²	120.9	55%	0.553	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-87.4	162.9	-179.7	-71.8	-94.2	0	0	0	111.4	D504 E508 D509	D504-Y506 HydrophobicContact CB-CE2 4.49Å; Y506-E508 PolarHBondContact O-N 2.82Å; Y506-E508 VanDerWaalsContact O-N 3.13Å; Y506-D509 WeakPolarHBondContact CB-OD2 3.41Å; Y506-D509 PolarHBondContact N-OD2 2.91Å; Y506-D509 WeakPolarHBondContact O-CB 3.49Å; Y506-D509 PolarHBondContact O-N 2.6Å
507	L	37.7	Very low	40.2	Very low	154 Å²	154	114.9 Å²	114.9	81%	0.806	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-14.7	-178.7	-103.7	149	0	0	0	113.6	L510	L507-L510 HydrophobicContact CD2-CD1 3.82Å; L507-L510 HydrophobicContact CG-CD1 4.28Å
508	E	42.3	Very low	40.9	Very low	138 Å²	138	110 Å²	110	65%	0.645	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-25.6	171.5	51.4	-134.2	118.4	0	0	113.4	Y506	Y506-E508 PolarHBondContact O-N 2.82Å; Y506-E508 VanDerWaalsContact O-N 3.13Å
509	D	42.1	Very low	42	Very low	64 Å²	64	106.3 Å²	106.3	34%	0.342	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-81.5	-15.8	179.5	-53.8	-48.3	0	0	0	113.2	I505 Y506 N511 T512	I505-D509 HydrophobicContact CG2-CB 3.73Å; Y506-D509 WeakPolarHBondContact CB-OD2 3.41Å; Y506-D509 PolarHBondContact N-OD2 2.91Å; Y506-D509 WeakPolarHBondContact O-CB 3.49Å; Y506-D509 PolarHBondContact O-N 2.6Å; D509-N511 PolarHBondContact O-N 2.89Å; D509-T512 PolarHBondContact O-N 2.81Å; D509-T512 PolarHBondContact O-OG1 2.79Å
510	L	50.2	Low	42.3	Very low	98 Å²	98	107 Å²	107	51%	0.513	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-60.5	-20.3	-178.1	-91	165.2	0	0	0	114.1	L507 T512 L513	L507-L510 HydrophobicContact CD2-CD1 3.82Å; L507-L510 HydrophobicContact CG-CD1 4.28Å; L510-T512 VanDerWaalsContact C-N 3.34Å; L510-L513 HydrophobicContact CD2-CD1 4.26Å
511	N	48	Very low	43.1	Very low	153 Å²	153	111.7 Å²	111.7	82%	0.818	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-82.9	-7	176	-67.7	-28.3	0	0	0	113.7	D509	D509-N511 PolarHBondContact O-N 2.89Å
512	T	46.8	Very low	43.9	Very low	119 Å²	119	115.6 Å²	115.6	73%	0.73	61%	0.607	S	S	*	*	S	Bend	trans	-114.3	1	-178.6	61.6	0	0	0	0	113.7	D509 L510	D509-T512 PolarHBondContact O-N 2.81Å; D509-T512 PolarHBondContact O-OG1 2.79Å; L510-T512 VanDerWaalsContact C-N 3.34Å
513	L	45.4	Very low	43.5	Very low	62 Å²	62	115.5 Å²	115.5	33%	0.325	60%	0.604	S	S	.	*	S	Bend	trans	-84	132.3	176.6	-77.2	170.7	0	0	0	112.7	I505 L510	I505-L513 HydrophobicContact CD1-CD1 4.25Å; I505-L513 HydrophobicContact CG2-CD1 4.09Å; L510-L513 HydrophobicContact CD2-CD1 4.26Å
514	D	46.7	Very low	43.6	Very low	111 Å²	111	118.4 Å²	118.4	59%	0.594	60%	0.604	S	S	*	*			trans	-71.9	130.8	175.3	-161.9	15.6	0	0	0	110.5	E516 V517	D514-E516 VanDerWaalsContact C-N 3.32Å; D514-E516 PolarHBondContact O-N 2.79Å; D514-E516 VanDerWaalsContact O-N 3.13Å; D514-V517 HydrophobicContact CB-CG2 4.39Å; D514-V517 WeakPolarHBondContact O-CB 3.41Å; D514-V517 PolarHBondContact O-N 2.78Å
515	P	50.4	Low	43.3	Very low	96 Å²	96	117.8 Å²	117.8	62%	0.623	61%	0.605	S	S	*	*	H	α-helix	trans	-59.1	-31.3	-165.7	-30	37.5	0	0	0	116.4	V517 A518 E519	P515-V517 VanDerWaalsContact C-N 3.29Å; P515-V517 PolarHBondContact O-N 3.3Å; P515-A518 PolarHBondContact O-N 3.01Å; P515-E519 PolarHBondContact O-N 3.04Å
516	E	45.4	Very low	42.8	Very low	159 Å²	159	123.2 Å²	123.2	74%	0.743	63%	0.629	S	S	*	*	H	α-helix	trans	-64.4	-32.3	175.6	-75.6	-164	140.1	0	0	112.7	D514	D514-E516 VanDerWaalsContact C-N 3.32Å; D514-E516 PolarHBondContact O-N 2.79Å; D514-E516 VanDerWaalsContact O-N 3.13Å
517	V	48.1	Very low	42.2	Very low	68 Å²	68	120.8 Å²	120.8	41%	0.412	64%	0.638	S	S	.	*	H	α-helix	trans	-73.7	-34.4	-179.9	-176.2	0	0	0	0	110.6	D514 P515 L520	D514-V517 HydrophobicContact CB-CG2 4.39Å; D514-V517 WeakPolarHBondContact O-CB 3.41Å; D514-V517 PolarHBondContact O-N 2.78Å; P515-V517 VanDerWaalsContact C-N 3.29Å; P515-V517 PolarHBondContact O-N 3.3Å; V517-L520 PolarHBondContact O-N 3.25Å
518	A	51.2	Low	41.7	Very low	32 Å²	32	123.2 Å²	123.2	26%	0.264	65%	0.645	S	S	.	*	H	α-helix	trans	-64.5	-38.6	176.8	0	0	0	0	0	112.3	P515 L520 Y521 F522	P515-A518 PolarHBondContact O-N 3.01Å; A518-L520 PolarHBondContact O-N 3.14Å; A518-Y521 PolarHBondContact O-N 3.13Å; A518-F522 VanDerWaalsContact O-CD2 3.25Å; A518-F522 WeakPolarHBondContact O-CD2 3.15Å
519	E	47.8	Very low	41	Very low	109 Å²	109	120.4 Å²	120.4	51%	0.509	65%	0.653	S	S	.	*	H	α-helix	trans	-64.9	-23.6	-179.7	-71.8	-154.1	172.9	0	0	114.2	P515 Y521 F522 K524	P515-E519 PolarHBondContact O-N 3.04Å; E519-Y521 PolarHBondContact O-N 3.08Å; E519-F522 PolarHBondContact O-N 3.01Å; E519-K524 WeakPolarHBondContact OE2-CE 3.33Å; E519-K524 IonicContact OE2-NZ 2.86Å; E519-K524 PolarHBondContact OE2-NZ 2.9Å
520	L	45.3	Very low	40.1	Very low	137 Å²	137	121.8 Å²	121.8	72%	0.717	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-14.4	177.5	-76.9	165	0	0	0	113.9	V517 A518	V517-L520 PolarHBondContact O-N 3.25Å; A518-L520 PolarHBondContact O-N 3.14Å
521	Y	39.9	Very low	38.9	Very low	178 Å²	178	124.9 Å²	124.9	70%	0.698	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-3.6	179.8	-73	-86.2	0	0	0	114.3	A518 E519	A518-Y521 PolarHBondContact O-N 3.13Å; E519-Y521 PolarHBondContact O-N 3.08Å
522	F	42.8	Very low	37.9	Very low	153 Å²	153	122.9 Å²	122.9	67%	0.671	68%	0.683	S	S	*	*	S	Bend	trans	-110.9	114.8	178.8	-65.8	-72.2	0	0	0	111.5	A518 E519 K524	A518-F522 VanDerWaalsContact O-CD2 3.25Å; A518-F522 WeakPolarHBondContact O-CD2 3.15Å; E519-F522 PolarHBondContact O-N 3.01Å; F522-K524 PolarHBondContact O-N 2.87Å
523	P	34.6	Very low	36.9	Very low	124 Å²	124	125.5 Å²	125.5	81%	0.805	69%	0.688	S	S	*	*			trans	-62.9	120.8	-179.8	-23.4	34.1	0	0	0	112.6
524	K	31.6	Very low	35.9	Very low	160 Å²	160	129.9 Å²	129.9	70%	0.696	70%	0.704	S	S	*	*			trans	-85.3	112.6	172.1	-64.6	179	-178.6	178.5	0	109	E519 F522	E519-K524 WeakPolarHBondContact OE2-CE 3.33Å; E519-K524 IonicContact OE2-NZ 2.86Å; E519-K524 PolarHBondContact OE2-NZ 2.9Å; F522-K524 PolarHBondContact O-N 2.87Å
525	T	33.3	Very low	35	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	72%	0.715	S	S	*	*			trans	-86	112.1	177.4	47.4	0	0	0	0	111.2
526	E	28.6	Very low	33.8	Very low	197 Å²	197	132 Å²	132	92%	0.921	72%	0.719	S	S	*	*			trans	-79.7	115.9	169.4	-64.6	-174.5	145.3	0	0	110.6
527	A	28.4	Very low	32.9	Very low	90 Å²	90	130.3 Å²	130.3	74%	0.744	71%	0.711	S	S	*	*			trans	-158.7	58.4	172.7	0	0	0	0	0	112.6
528	E	27.5	Very low	31.9	Very low	205 Å²	205	130.5 Å²	130.5	96%	0.958	73%	0.728	S	S	*	*			trans	174.9	122.7	136.6	-100.6	175.6	-170.6	0	0	111
529	G	26.4	Very low	30.6	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	76%	0.76	S	S	*	*			trans	-139.8	104.7	168.2	0	0	0	0	0	109.6
530	A	24.3	Very low	29.5	Very low	94 Å²	94	136.3 Å²	136.3	78%	0.777	78%	0.776	S	S	*	*			trans	-175.4	68	160.8	0	0	0	0	0	113.5
531	L	25.1	Very low	28.8	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	77%	0.773	S	S	*	*	S	Bend	trans	-162.6	136.2	130.8	-129.9	72.6	0	0	0	112.1
532	T	26.7	Very low	28.1	Very low	111 Å²	111	134.2 Å²	134.2	68%	0.681	78%	0.779	S	S	*	*			trans	8.8	115	153.2	53.4	0	0	0	0	116.9
533	Q	26.5	Very low	27.4	Very low	175 Å²	175	132.3 Å²	132.3	82%	0.818	78%	0.784	S	S	*	*				48	145.7	58.5	-77.4	-172.3	-17	0	0	115.1
534	F	24.4	Very low	27.9	Very low	154 Å²	154	131.7 Å²	131.7	68%	0.675	78%	0.781	S	S	*	*			trans	69	129.2	-161.7	-57.7	-83.3	0	0	0	113.4
535	A	27.2	Very low	27.6	Very low	100 Å²	100	133.4 Å²	133.4	83%	0.826	79%	0.791	S	S	*	*			cis	-144.7	171.8	-2.5	0	0	0	0	0	112.3
536	E	24.3	Very low	27.5	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	79%	0.79	S	S	*	*			trans	-93.6	166.3	-167.6	-78.3	-170.6	80.1	0	0	116.3
537	Q	26.2	Very low	27.5	Very low	123 Å²	123	131.7 Å²	131.7	58%	0.575	79%	0.787	S	S	*	*			trans	69.8	150.6	145.7	-76.6	166.9	50.8	0	0	120.8
538	G	27	Very low	27.3	Very low	73 Å²	73	133.7 Å²	133.7	75%	0.753	79%	0.785	S	S	*	*			trans	92.5	77.3	167.9	0	0	0	0	0	115
539	L	24.7	Very low	27.3	Very low	182 Å²	182	131.3 Å²	131.3	95%	0.953	78%	0.777	S	S	*	*				54.4	94.7	62.3	-161.8	84.2	0	0	0	113.8
540	G	24.6	Very low	27.3	Very low	81 Å²	81	131 Å²	131	84%	0.835	77%	0.774	S	S	*	*			trans	-176.7	136.5	171.7	0	0	0	0	0	112.2
541	S	30.6	Very low	27.5	Very low	95 Å²	95	130.8 Å²	130.8	66%	0.664	77%	0.772	S	S	*	*			trans	-90.4	172.3	-178.1	46.8	0	0	0	0	113.7
542	H	25.5	Very low	27.7	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.815	77%	0.773	S	S	*	*			trans	106.5	101.7	160.7	-53.2	-65.8	0	0	0	117.6
543	S	27.2	Very low	27.7	Very low	112 Å²	112	131.2 Å²	131.2	78%	0.783	78%	0.776	S	S	*	*			trans	-61.1	152.6	143.1	-160.8	0	0	0	0	108.9
544	P	45.9	Very low	27.8	Very low	112 Å²	112	128.2 Å²	128.2	73%	0.727	77%	0.774	S	S	*	*			cis	-146.1	-158.8	30.2	44.5	-24.1	0	0	0	116.3
545	Q	24.8	Very low	28.4	Very low	195 Å²	195	124.2 Å²	124.2	91%	0.911	78%	0.777	S	S	*	*			trans	101.4	152.1	155	-144.9	163.6	17.3	0	0	116.7
546	L	32.1	Very low	28.8	Very low	155 Å²	155	126.1 Å²	126.1	81%	0.812	78%	0.778	S	S	*	*			trans	-140.8	115.8	-155.8	-175.4	164.3	0	0	0	110.6
547	V	27.8	Very low	28.9	Very low	140 Å²	140	127.2 Å²	127.2	85%	0.848	78%	0.783	S	S	*	*			trans	-169.7	160	163.9	-84.2	0	0	0	0	108.1
548	D	24	Very low	29.7	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	80%	0.8	S	S	*	*			cis	-164.5	141.1	-40	-173	30.4	0	0	0	107.8
549	I	28.7	Very low	29.7	Very low	155 Å²	155	137 Å²	137	80%	0.795	81%	0.806	S	S	*	*			trans	30.1	122.5	167.3	-69.4	159.7	0	0	0	121.3
550	G	25.5	Very low	30.5	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	80%	0.801	S	S	*	*			trans	125.2	138.6	130.5	0	0	0	0	0	117
551	A	28.4	Very low	30.7	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	79%	0.788	S	S	*	*			cis	-166.8	172.7	-10.7	0	0	0	0	0	109.4
552	V	30.4	Very low	31.2	Very low	143 Å²	143	135.8 Å²	135.8	87%	0.867	79%	0.791	S	S	*	*			trans	53.4	130.2	151.7	72.4	0	0	0	0	118.9
553	D	25.8	Very low	32.1	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	78%	0.777	S	S	*	*			cis	-170.3	132.6	-14.8	161.6	39.8	0	0	0	107.8
554	S	29.3	Very low	33.2	Very low	111 Å²	111	133.5 Å²	133.5	78%	0.776	77%	0.771	S	S	*	*			trans	175.1	117.9	152.5	-81.5	0	0	0	0	108.6
555	G	36	Very low	33.5	Very low	70 Å²	70	134.1 Å²	134.1	72%	0.722	77%	0.772	S	S	*	*			trans	-92.4	139.4	174.8	0	0	0	0	0	112.6
556	T	36.9	Very low	35.4	Very low	141 Å²	141	126.4 Å²	126.4	87%	0.865	74%	0.737	S	S	*	*				-174.3	82.9	121.9	-65.4	0	0	0	0	109.1
557	E	26.2	Very low	37.4	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	72%	0.723	S	S	*	*	S	Bend	trans	-155.2	159.9	173.1	46.1	-155.4	129.5	0	0	113.6
558	Y	41.9	Very low	40.2	Very low	235 Å²	235	119.8 Å²	119.8	92%	0.922	70%	0.7	S	S	*	*			trans	-63	134.7	-177.9	-86.8	-126.4	0	0	0	110.9
559	L	27.2	Very low	43.3	Very low	167 Å²	167	115.2 Å²	115.2	87%	0.874	68%	0.678	S	S	*	*			trans	-127.2	133.8	167.9	-72.6	177.3	0	0	0	111.5
560	S	42.1	Very low	46.2	Very low	121 Å²	121	110.3 Å²	110.3	85%	0.846	65%	0.652	S	S	*	*			trans	-66.1	139.1	178.4	-49.3	0	0	0	0	112.1
561	D	27.8	Very low	49.3	Very low	105 Å²	105	106.9 Å²	106.9	56%	0.561	62%	0.617	S	S	*	*			trans	-116.8	98.7	161	-166.6	-15.6	0	0	0	109.2	S563	D561-S563 VanDerWaalsContact C-N 3.29Å; D561-S563 PolarHBondContact O-N 2.78Å; D561-S563 WeakPolarHBondContact OD1-CB 3.35Å; D561-S563 PolarHBondContact OD1-N 2.88Å; D561-S563 PolarHBondContact OD1-OG 3.14Å
562	S	40.8	Very low	52.1	Low	106 Å²	106	105 Å²	105	74%	0.741	59%	0.594	S	S	*	*			trans	-92.2	24	-176.9	52	0	0	0	0	113.3	Y564	S562-Y564 PolarHBondContact O-N 3.44Å
563	S	45.3	Very low	54.5	Low	74 Å²	74	99.2 Å²	99.2	52%	0.517	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	0.6	-170.1	59.9	0	0	0	0	116.6	D561	D561-S563 VanDerWaalsContact C-N 3.29Å; D561-S563 PolarHBondContact O-N 2.78Å; D561-S563 WeakPolarHBondContact OD1-CB 3.35Å; D561-S563 PolarHBondContact OD1-N 2.88Å; D561-S563 PolarHBondContact OD1-OG 3.14Å
564	Y	50.2	Low	56.9	Low	166 Å²	166	93.2 Å²	93.2	65%	0.651	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-9.4	-173.9	-51.3	-63.6	0	0	0	115.5	S562 M566	S562-Y564 PolarHBondContact O-N 3.44Å; Y564-M566 PolarHBondContact O-N 2.98Å
565	V	53	Low	58.6	Low	126 Å²	126	96.8 Å²	96.8	76%	0.764	53%	0.532	S	S	*	.			trans	-79.5	90	178.9	-172	0	0	0	0	109.7	D567	V565-D567 PolarHBondContact O-N 2.94Å
566	M	63	Low	59.4	Low	33 Å²	33	100 Å²	100	16%	0.163	54%	0.538	C	S	.	.			trans	-71.6	110.2	169.2	-170.3	116.5	97.7	0	0	109.2	Y564 V568 I613 N614 V630 N636	Y564-M566 PolarHBondContact O-N 2.98Å; M566-V568 HydrophobicContact CB-CG2 4.35Å; M566-V568 HydrophobicContact CG-CG2 3.69Å; M566-V568 PolarHBondContact O-N 2.89Å; M566-I613 HydrophobicContact CE-CG2 3.88Å; M566-I613 HydrophobicContact CG-CG2 3.58Å; M566-I613 HydrophobicContact SD-CG2 3.39Å; M566-I613 WeakPolarHBondContact SD-CG2 3.49Å; M566-N614 PolarHBondContact SD-ND2 2.85Å; M566-N614 VanDerWaalsContact SD-ND2 3.39Å; M566-V630 HydrophobicContact CE-CB 4.16Å; M566-V630 HydrophobicContact CE-CG2 3.51Å; M566-V630 HydrophobicContact SD-CG2 4.38Å; M566-N636 PolarHBondContact SD-OD1 2.98Å; M566-N636 VanDerWaalsContact SD-OD1 3.35Å
567	D	74.1	Confident	60.3	Low	96 Å²	96	96.2 Å²	96.2	51%	0.513	53%	0.526	S	S	.	.			trans	-73.9	116.9	173.9	179.1	28.2	0	0	0	109.2	V565 I613 N614	V565-D567 PolarHBondContact O-N 2.94Å; D567-I613 WeakPolarHBondContact O-CA 3.37Å; D567-N614 PolarHBondContact N-OD1 2.86Å; D567-N614 PolarHBondContact O-N 2.86Å
568	V	87.3	Confident	61.8	Low	60 Å²	60	90.9 Å²	90.9	36%	0.364	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119.2	-174.9	-177.7	0	0	0	0	109.7	M566 I611 C612 I613 I627	M566-V568 HydrophobicContact CB-CG2 4.35Å; M566-V568 HydrophobicContact CG-CG2 3.69Å; M566-V568 PolarHBondContact O-N 2.89Å; V568-I611 HydrophobicContact CG1-CG2 3.75Å; V568-C612 WeakPolarHBondContact CA-O 3.36Å; V568-I613 HydrophobicContact CG2-CG1 4.35Å; V568-I613 HydrophobicContact CG2-CG2 4.44Å; V568-I627 HydrophobicContact CG1-CD1 3.85Å; V568-I627 HydrophobicContact CG1-CG1 4.42Å; V568-I627 HydrophobicContact CG2-CG1 4.42Å
569	S	88.9	Confident	62.6	Low	36 Å²	36	81.6 Å²	81.6	25%	0.252	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	160.5	174.1	47.3	0	0	0	0	110.3	I611 C612	S569-I611 CarbonylContact O-C 3.59Å; S569-I611 WeakPolarHBondContact O-CA 3.45Å; S569-I611 WeakPolarHBondContact O-CG2 3.24Å; S569-C612 PolarHBondContact N-O 2.93Å; S569-C612 PolarHBondContact O-N 3.1Å
570	M	90.5	Very high	64	Low	51 Å²	51	77.5 Å²	77.5	25%	0.251	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.5	-178	77.8	-173.5	80.1	0	0	113.4	L591 V592 F597 L609 V610 I611	M570-L591 WeakPolarHBondContact O-CD1 3.24Å; M570-V592 HydrophobicContact CG-CB 3.76Å; M570-V592 HydrophobicContact CG-CG1 4.37Å; M570-V592 HydrophobicContact CG-CG2 4.05Å; M570-V592 PolarHBondContact O-N 3.42Å; M570-F597 HydrophobicContact SD-CD2 4.35Å; M570-L609 HydrophobicContact CB-CD1 4Å; M570-L609 HydrophobicContact CG-CD1 4.17Å; M570-L609 HydrophobicContact SD-CD1 4.22Å; M570-V610 CarbonylContact C-O 3.56Å; M570-V610 VanDerWaalsContact CA-O 3.31Å; M570-V610 WeakPolarHBondContact CA-O 3.39Å; M570-I611 HydrophobicContact CB-CD1 3.53Å
571	S	90.6	Very high	64.7	Low	0 Å²	0	78.2 Å²	78.2	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143.5	-171	-179	0	0	0	0	111	C573 F587 H590 V610	S571-C573 PolarHBondContact O-N 2.74Å; S571-C573 WeakPolarHBondContact OG-CB 3.42Å; S571-F587 WeakPolarHBondContact CB-O 3.45Å; S571-F587 PolarHBondContact OG-O 2.88Å; S571-H590 CarbonylContact C-O 3.57Å; S571-H590 VanDerWaalsContact CA-O 3.25Å; S571-H590 WeakPolarHBondContact CA-O 3.05Å; S571-H590 VanDerWaalsContact OG-C 3.28Å; S571-H590 PolarHBondContact OG-O 3.4Å; S571-H590 VanDerWaalsContact OG-O 3.08Å; S571-V610 PolarHBondContact N-O 2.66Å; S571-V610 PolarHBondContact O-N 2.69Å
572	L	86.6	Confident	66.8	Low	51 Å²	51	74.4 Å²	74.4	27%	0.267	43%	0.426	S	S	.	.	S	Bend	trans	-89.5	35.9	176.6	-69	167.8	0	0	0	112.1	H590 V592 I603 D606 S608 L609	L572-H590 PolarHBondContact N-O 3.43Å; L572-V592 HydrophobicContact CD1-CG2 4.11Å; L572-V592 HydrophobicContact CG-CG2 3.87Å; L572-I603 HydrophobicContact CD1-CG1 4.43Å; L572-I603 HydrophobicContact CD2-CG2 4.27Å; L572-D606 HydrophobicContact CD2-CB 3.78Å; L572-S608 CarbonylContact C-O 3.57Å; L572-S608 WeakPolarHBondContact CD2-OG 3.29Å; L572-L609 HydrophobicContact CD2-CB 4.37Å; L572-L609 HydrophobicContact CD2-CD1 4.35Å
573	C	81.4	Confident	68.5	Low	22 Å²	22	72 Å²	72	15%	0.149	41%	0.406	C	S	.	.			trans	-89.5	-3.1	-175.5	70.3	0	0	0	0	114.6	S571 K586 H590	S571-C573 PolarHBondContact O-N 2.74Å; S571-C573 WeakPolarHBondContact OG-CB 3.42Å; C573-K586 VanDerWaalsContact CB-O 3.31Å; C573-K586 WeakPolarHBondContact CB-O 3.27Å; C573-H590 HydrophobicContact CB-CB 4.27Å
574	G	76.1	Confident	70.1	Confident	13 Å²	13	75.6 Å²	75.6	13%	0.134	41%	0.413	C	S	.	.			trans	-73	131.6	-175	0	0	0	0	0	113.2	S608	G574-S608 VanDerWaalsContact CA-O 3.23Å; G574-S608 WeakPolarHBondContact CA-O 3.39Å; G574-S608 PolarHBondContact N-O 2.97Å; G574-S608 VanDerWaalsContact O-CA 3.27Å; G574-S608 WeakPolarHBondContact O-CA 3.44Å; G574-S608 WeakPolarHBondContact O-CB 3.42Å
575	K	64.8	Low	71.5	Confident	186 Å²	186	74.5 Å²	74.5	81%	0.809	41%	0.414	S	S	*	.			trans	-114.4	139	167.9	-63.3	-168.6	179.8	-173.7	0	110.1	G577 D578	K575-G577 PolarHBondContact O-N 3.34Å; K575-D578 PolarHBondContact O-N 3.44Å
576	V	53.3	Low	72.7	Confident	139 Å²	139	73.8 Å²	73.8	84%	0.842	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	107	-171.7	179.6	0	0	0	0	110.8
577	G	55.9	Low	73.7	Confident	60 Å²	60	72.6 Å²	72.6	62%	0.619	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.8	-11.3	170.1	0	0	0	0	0	117.1	K575	K575-G577 PolarHBondContact O-N 3.34Å
578	D	57.3	Low	74.1	Confident	61 Å²	61	71.9 Å²	71.9	33%	0.326	39%	0.393	S	S	.	.			trans	-145.9	55.3	-174.1	-143.4	-4.2	0	0	0	117.5	K575 S580 Q581 K652	K575-D578 PolarHBondContact O-N 3.44Å; D578-S580 PolarHBondContact O-N 3.21Å; D578-S580 PolarHBondContact OD1-OG 3.29Å; D578-Q581 PolarHBondContact O-N 3.11Å; D578-Q581 PolarHBondContact OD2-NE2 2.92Å; D578-K652 WeakPolarHBondContact OD1-CE 3.45Å; D578-K652 IonicContact OD1-NZ 2.65Å; D578-K652 PolarHBondContact OD1-NZ 2.64Å; D578-K652 IonicContact OD2-NZ 3.82Å
579	T	58.2	Low	73.9	Confident	40 Å²	40	75.6 Å²	75.6	25%	0.245	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-56.2	-18.7	173.5	-33.2	0	0	0	0	113.8	Q581 I582 V610	T579-Q581 VanDerWaalsContact C-N 3.3Å; T579-Q581 PolarHBondContact O-N 3.14Å; T579-I582 HydrophobicContact CG2-CD1 3.81Å; T579-V610 HydrophobicContact CG2-CG2 4.42Å
580	S	57	Low	73.6	Confident	81 Å²	81	78.4 Å²	78.4	57%	0.566	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-79.4	0.1	-178.9	66.5	0	0	0	0	115.7	D578 K652	D578-S580 PolarHBondContact O-N 3.21Å; D578-S580 PolarHBondContact OD1-OG 3.29Å; S580-K652 VanDerWaalsContact OG-CE 3.27Å; S580-K652 WeakPolarHBondContact OG-CE 3.43Å; S580-K652 PolarHBondContact OG-NZ 3.11Å
581	Q	57	Low	73.5	Confident	136 Å²	136	79.7 Å²	79.7	64%	0.636	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-123.9	30.2	-178.8	-63.1	-159.2	78.9	0	0	113.3	D578 T579 T583	D578-Q581 PolarHBondContact O-N 3.11Å; D578-Q581 PolarHBondContact OD2-NE2 2.92Å; T579-Q581 VanDerWaalsContact C-N 3.3Å; T579-Q581 PolarHBondContact O-N 3.14Å; Q581-T583 PolarHBondContact O-N 2.99Å
582	I	72.3	Confident	73.3	Confident	25 Å²	25	80.6 Å²	80.6	13%	0.128	43%	0.429	C	S	.	.			trans	-83.3	114.4	178.1	-62.3	174.8	0	0	0	109.2	T579 F587 V610 Y617	T579-I582 HydrophobicContact CG2-CD1 3.81Å; I582-F587 HydrophobicContact CG2-CB 4.12Å; I582-V610 HydrophobicContact CD1-CB 4.2Å; I582-V610 HydrophobicContact CD1-CG1 3.67Å; I582-V610 HydrophobicContact CD1-CG2 3.56Å; I582-Y617 HydrophobicContact CB-CD2 4.33Å; I582-Y617 HydrophobicContact CB-CG 4.4Å; I582-Y617 HydrophobicContact CG2-CD1 4.3Å; I582-Y617 HydrophobicContact CG2-CD2 4.41Å; I582-Y617 HydrophobicContact CG2-CE1 4.43Å; I582-Y617 HydrophobicContact CG2-CG 4.29Å
583	T	76.3	Confident	73.4	Confident	55 Å²	55	81.4 Å²	81.4	34%	0.337	44%	0.436	S	S	.	.			trans	-80	149.4	169.8	65.1	0	0	0	0	110	Q581 E585 K586 F587	Q581-T583 PolarHBondContact O-N 2.99Å; T583-E585 WeakPolarHBondContact CB-OE2 3.49Å; T583-E585 PolarHBondContact O-N 3.33Å; T583-E585 PolarHBondContact OG1-OE2 3.19Å; T583-K586 PolarHBondContact O-N 3.25Å; T583-K586 VanDerWaalsContact O-N 3.14Å; T583-F587 PolarHBondContact O-N 3.25Å
584	K	78.9	Confident	73.4	Confident	151 Å²	151	89 Å²	89	66%	0.657	46%	0.463	S	S	*	.	H	α-helix	trans	-55.6	-36.2	179.7	-172.9	173.1	179.9	174.3	0	111.9	F587 T588 Y617	K584-F587 PolarHBondContact O-N 3.47Å; K584-T588 PolarHBondContact O-N 2.8Å; K584-T588 PolarHBondContact O-OG1 3.14Å; K584-T588 VanDerWaalsContact O-OG1 3.08Å; K584-Y617 WeakPolarHBondContact CA-OH 3.16Å
585	E	78.5	Confident	73.8	Confident	142 Å²	142	93.9 Å²	93.9	66%	0.664	48%	0.482	S	S	*	.	H	α-helix	trans	-59.2	-48	178	-55	121.4	174.4	0	0	112.2	T583 F587 T588 E589	T583-E585 WeakPolarHBondContact CB-OE2 3.49Å; T583-E585 PolarHBondContact O-N 3.33Å; T583-E585 PolarHBondContact OG1-OE2 3.19Å; E585-F587 VanDerWaalsContact C-N 3.31Å; E585-F587 PolarHBondContact O-N 2.87Å; E585-T588 WeakPolarHBondContact CA-OG1 3.49Å; E585-T588 PolarHBondContact O-N 3.32Å; E585-T588 PolarHBondContact O-OG1 3.2Å; E585-E589 WeakPolarHBondContact O-CB 3.5Å; E585-E589 PolarHBondContact O-N 2.95Å
586	K	78.2	Confident	74.8	Confident	112 Å²	112	88.5 Å²	88.5	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-67.1	-32.2	178.9	-71.2	174.5	-179.8	169.3	0	112.7	C573 T583	C573-K586 VanDerWaalsContact CB-O 3.31Å; C573-K586 WeakPolarHBondContact CB-O 3.27Å; T583-K586 PolarHBondContact O-N 3.25Å; T583-K586 VanDerWaalsContact O-N 3.14Å
587	F	85.3	Confident	76.2	Confident	7 Å²	7	85 Å²	85	3%	0.031	44%	0.436	C	S	.	.	H	α-helix	trans	-67	-42.8	173.6	-174.8	-87.7	0	0	0	111.2	S571 I582 T583 K584 E585 L591 V610 C612 Y617	S571-F587 WeakPolarHBondContact CB-O 3.45Å; S571-F587 PolarHBondContact OG-O 2.88Å; I582-F587 HydrophobicContact CG2-CB 4.12Å; T583-F587 PolarHBondContact O-N 3.25Å; K584-F587 PolarHBondContact O-N 3.47Å; E585-F587 VanDerWaalsContact C-N 3.31Å; E585-F587 PolarHBondContact O-N 2.87Å; F587-L591 HydrophobicContact CD1-CD1 4.22Å; F587-L591 HydrophobicContact CE1-CD1 3.66Å; F587-L591 HydrophobicContact CZ-CD1 4.38Å; F587-L591 PolarHBondContact O-N 2.88Å; F587-V610 HydrophobicContact CD2-CG1 4.16Å; F587-V610 HydrophobicContact CE2-CB 4.42Å; F587-V610 HydrophobicContact CE2-CG1 4.05Å; F587-C612 HydrophobicContact CE1-CB 3.87Å; F587-C612 HydrophobicContact CE2-CB 3.79Å; F587-C612 HydrophobicContact CZ-CB 3.38Å; F587-Y617 HydrophobicContact CB-CE1 3.91Å; F587-Y617 HydrophobicContact CD1-CE1 4.15Å; F587-Y617 AromaticContact CD2-CD1 3.6Å; F587-Y617 HydrophobicContact CD2-CD1 3.6Å; F587-Y617 AromaticContact CD2-CE1 3.48Å; F587-Y617 HydrophobicContact CD2-CE1 3.48Å; F587-Y617 VanDerWaalsContact CD2-CE1 3.48Å; F587-Y617 AromaticContact CE2-CD1 3.92Å; F587-Y617 HydrophobicContact CE2-CD1 3.92Å; F587-Y617 HydrophobicContact CE2-CE1 4.02Å; F587-Y617 HydrophobicContact CG-CD1 4.18Å; F587-Y617 AromaticContact CG-CE1 3.57Å; F587-Y617 HydrophobicContact CG-CE1 3.57Å
588	T	82.7	Confident	77.5	Confident	81 Å²	81	86.2 Å²	86.2	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-70.6	-28.6	175.6	46.2	0	0	0	0	114	K584 E585 H590	K584-T588 PolarHBondContact O-N 2.8Å; K584-T588 PolarHBondContact O-OG1 3.14Å; K584-T588 VanDerWaalsContact O-OG1 3.08Å; E585-T588 WeakPolarHBondContact CA-OG1 3.49Å; E585-T588 PolarHBondContact O-N 3.32Å; E585-T588 PolarHBondContact O-OG1 3.2Å; T588-H590 VanDerWaalsContact C-N 3.32Å; T588-H590 PolarHBondContact O-N 3.46Å
589	E	81.4	Confident	78.8	Confident	139 Å²	139	89.3 Å²	89.3	65%	0.65	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-32.5	178.5	-173.3	-174.9	-153.1	0	0	113.1	E585	E585-E589 WeakPolarHBondContact O-CB 3.5Å; E585-E589 PolarHBondContact O-N 2.95Å
590	H	82.3	Confident	79.9	Confident	94 Å²	94	91.5 Å²	91.5	44%	0.435	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	28.3	-177.4	-62.4	72.5	0	0	0	112.2	S571 L572 C573 T588 V592	S571-H590 CarbonylContact C-O 3.57Å; S571-H590 VanDerWaalsContact CA-O 3.25Å; S571-H590 WeakPolarHBondContact CA-O 3.05Å; S571-H590 VanDerWaalsContact OG-C 3.28Å; S571-H590 PolarHBondContact OG-O 3.4Å; S571-H590 VanDerWaalsContact OG-O 3.08Å; L572-H590 PolarHBondContact N-O 3.43Å; C573-H590 HydrophobicContact CB-CB 4.27Å; T588-H590 VanDerWaalsContact C-N 3.32Å; T588-H590 PolarHBondContact O-N 3.46Å; H590-V592 PolarHBondContact O-N 3.13Å
591	L	88.9	Confident	81.2	Confident	78 Å²	78	91.8 Å²	91.8	41%	0.408	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-63.1	125.2	-179.1	-171.4	78.1	0	0	0	110.6	M570 F587 T593	M570-L591 WeakPolarHBondContact O-CD1 3.24Å; F587-L591 HydrophobicContact CD1-CD1 4.22Å; F587-L591 HydrophobicContact CE1-CD1 3.66Å; F587-L591 HydrophobicContact CZ-CD1 4.38Å; F587-L591 PolarHBondContact O-N 2.88Å; L591-T593 PolarHBondContact O-N 3.4Å
592	V	87.4	Confident	82.4	Confident	19 Å²	19	87 Å²	87	12%	0.115	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-78.2	120.1	177.5	-177.7	0	0	0	0	108.8	M570 L572 H590 D596 F597 I603	M570-V592 HydrophobicContact CG-CB 3.76Å; M570-V592 HydrophobicContact CG-CG1 4.37Å; M570-V592 HydrophobicContact CG-CG2 4.05Å; M570-V592 PolarHBondContact O-N 3.42Å; L572-V592 HydrophobicContact CD1-CG2 4.11Å; L572-V592 HydrophobicContact CG-CG2 3.87Å; H590-V592 PolarHBondContact O-N 3.13Å; V592-D596 HydrophobicContact CG1-CB 3.99Å; V592-F597 HydrophobicContact CG1-CB 4.28Å; V592-I603 HydrophobicContact CG1-CD1 3.96Å; V592-I603 HydrophobicContact CG1-CG2 4.3Å; V592-I603 HydrophobicContact CG2-CG2 4.19Å
593	T	88.8	Confident	83	Confident	69 Å²	69	86.2 Å²	86.2	42%	0.423	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-82.7	165.7	172.9	77.4	0	0	0	0	111.2	L591 Q595 D596 F597	L591-T593 PolarHBondContact O-N 3.4Å; T593-Q595 PolarHBondContact O-N 3.23Å; T593-Q595 PolarHBondContact OG1-N 3.01Å; T593-D596 WeakPolarHBondContact CA-OD2 3.24Å; T593-D596 VanDerWaalsContact CB-OD2 3.23Å; T593-D596 WeakPolarHBondContact CB-OD2 3.35Å; T593-D596 WeakPolarHBondContact CG2-OD2 3.19Å; T593-D596 PolarHBondContact N-OD2 3.11Å; T593-D596 PolarHBondContact O-N 2.84Å; T593-D596 VanDerWaalsContact OG1-CG 3.26Å; T593-D596 PolarHBondContact OG1-N 3.05Å; T593-D596 PolarHBondContact OG1-OD2 3.27Å; T593-F597 PolarHBondContact O-N 2.86Å; T593-F597 VanDerWaalsContact O-N 3.12Å
594	Y	80.9	Confident	83.4	Confident	180 Å²	180	86.2 Å²	86.2	71%	0.706	43%	0.434	S	S	*	.	H	α-helix	trans	-58.9	-31.7	174.4	-179.4	-118.4	0	0	0	112.9	I598	Y594-I598 HydrophobicContact CD1-CD1 3.85Å; Y594-I598 HydrophobicContact CE1-CD1 3.45Å; Y594-I598 VanDerWaalsContact CE1-CD1 3.45Å; Y594-I598 HydrophobicContact CE1-CG1 4.43Å; Y594-I598 HydrophobicContact CE2-CD1 4.2Å; Y594-I598 HydrophobicContact CE2-CG1 4.34Å; Y594-I598 HydrophobicContact CG-CD1 4.38Å; Y594-I598 WeakPolarHBondContact O-CG1 3.28Å; Y594-I598 PolarHBondContact O-N 2.74Å; Y594-I598 VanDerWaalsContact O-N 3.1Å
595	Q	85.1	Confident	83.3	Confident	117 Å²	117	87.3 Å²	87.3	55%	0.547	44%	0.442	S	S	.	.	H	α-helix	trans	-71.3	-43	177.3	-64.4	-64.6	-10.1	0	0	111.5	T593 F597 I598 N599	T593-Q595 PolarHBondContact O-N 3.23Å; T593-Q595 PolarHBondContact OG1-N 3.01Å; Q595-F597 PolarHBondContact O-N 2.77Å; Q595-I598 PolarHBondContact O-N 3.28Å; Q595-N599 WeakPolarHBondContact O-CB 3.26Å; Q595-N599 PolarHBondContact O-N 3.12Å; Q595-N599 PolarHBondContact O-ND2 2.98Å; Q595-N599 VanDerWaalsContact O-ND2 3.1Å
596	D	84.7	Confident	83.5	Confident	72 Å²	72	83.6 Å²	83.6	39%	0.385	43%	0.426	S	S	.	.	H	α-helix	trans	-60	-39.1	176.2	-52.3	-52.4	0	0	0	111.2	V592 T593 N599 N600 I603	V592-D596 HydrophobicContact CG1-CB 3.99Å; T593-D596 WeakPolarHBondContact CA-OD2 3.24Å; T593-D596 VanDerWaalsContact CB-OD2 3.23Å; T593-D596 WeakPolarHBondContact CB-OD2 3.35Å; T593-D596 WeakPolarHBondContact CG2-OD2 3.19Å; T593-D596 PolarHBondContact N-OD2 3.11Å; T593-D596 PolarHBondContact O-N 2.84Å; T593-D596 VanDerWaalsContact OG1-CG 3.26Å; T593-D596 PolarHBondContact OG1-N 3.05Å; T593-D596 PolarHBondContact OG1-OD2 3.27Å; D596-N599 PolarHBondContact O-N 2.84Å; D596-N600 PolarHBondContact O-N 2.83Å; D596-I603 HydrophobicContact CB-CD1 4.4Å
597	F	83.5	Confident	83.4	Confident	65 Å²	65	83.5 Å²	83.5	29%	0.285	44%	0.437	S	S	.	.	H	α-helix	trans	-68.6	-37.1	177.4	-173.4	-90.6	0	0	0	113.6	M570 V592 T593 Q595 N600 P601 I604	M570-F597 HydrophobicContact SD-CD2 4.35Å; V592-F597 HydrophobicContact CG1-CB 4.28Å; T593-F597 PolarHBondContact O-N 2.86Å; T593-F597 VanDerWaalsContact O-N 3.12Å; Q595-F597 PolarHBondContact O-N 2.77Å; F597-N600 CarbonylContact O-C 3.57Å; F597-N600 VanDerWaalsContact O-C 3.31Å; F597-P601 WeakPolarHBondContact O-CA 3.34Å; F597-I604 HydrophobicContact CE2-CD1 3.9Å; F597-I604 HydrophobicContact CE2-CG1 3.82Å; F597-I604 HydrophobicContact CZ-CD1 3.92Å; F597-I604 HydrophobicContact CZ-CG1 4.35Å
598	I	82.6	Confident	83.2	Confident	86 Å²	86	84.3 Å²	84.3	44%	0.441	44%	0.444	S	S	.	.	H	α-helix	trans	-65.2	-45.7	171.5	-69.6	162	0	0	0	110.3	Y594 Q595 N600	Y594-I598 HydrophobicContact CD1-CD1 3.85Å; Y594-I598 HydrophobicContact CE1-CD1 3.45Å; Y594-I598 VanDerWaalsContact CE1-CD1 3.45Å; Y594-I598 HydrophobicContact CE1-CG1 4.43Å; Y594-I598 HydrophobicContact CE2-CD1 4.2Å; Y594-I598 HydrophobicContact CE2-CG1 4.34Å; Y594-I598 HydrophobicContact CG-CD1 4.38Å; Y594-I598 WeakPolarHBondContact O-CG1 3.28Å; Y594-I598 PolarHBondContact O-N 2.74Å; Y594-I598 VanDerWaalsContact O-N 3.1Å; Q595-I598 PolarHBondContact O-N 3.28Å; I598-N600 VanDerWaalsContact C-N 3.3Å; I598-N600 PolarHBondContact O-N 2.95Å
599	N	85.3	Confident	83.4	Confident	127 Å²	127	80.8 Å²	80.8	68%	0.679	42%	0.422	S	S	*	.	H	α-helix	trans	-69.4	-27.2	-176.3	-68.1	-29.8	0	0	0	112.6	Q595 D596	Q595-N599 WeakPolarHBondContact O-CB 3.26Å; Q595-N599 PolarHBondContact O-N 3.12Å; Q595-N599 PolarHBondContact O-ND2 2.98Å; Q595-N599 VanDerWaalsContact O-ND2 3.1Å; D596-N599 PolarHBondContact O-N 2.84Å
600	N	81.8	Confident	83.8	Confident	86 Å²	86	74.3 Å²	74.3	46%	0.46	39%	0.392	S	S	.	.			trans	-144.2	87	173.1	-176.2	8.6	0	0	0	112.2	D596 F597 I598 G602 I603	D596-N600 PolarHBondContact O-N 2.83Å; F597-N600 CarbonylContact O-C 3.57Å; F597-N600 VanDerWaalsContact O-C 3.31Å; I598-N600 VanDerWaalsContact C-N 3.3Å; I598-N600 PolarHBondContact O-N 2.95Å; N600-G602 PolarHBondContact O-N 3.04Å; N600-G602 VanDerWaalsContact O-N 3.13Å; N600-G602 WeakPolarHBondContact OD1-CA 3.43Å; N600-G602 PolarHBondContact OD1-N 3.11Å; N600-I603 HydrophobicContact CB-CD1 4.15Å; N600-I603 HydrophobicContact CB-CG1 4.16Å; N600-I603 WeakPolarHBondContact O-CB 3.43Å; N600-I603 WeakPolarHBondContact O-CD1 3.43Å; N600-I603 VanDerWaalsContact O-CG1 3.22Å; N600-I603 WeakPolarHBondContact O-CG1 3.43Å; N600-I603 PolarHBondContact O-N 3.01Å; N600-I603 VanDerWaalsContact O-N 3.16Å
601	P	83.1	Confident	84.2	Confident	86 Å²	86	70 Å²	70	56%	0.558	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-65.3	-14.2	174.2	26.9	-35	0	0	0	113.2	F597 I603	F597-P601 WeakPolarHBondContact O-CA 3.34Å; P601-I603 PolarHBondContact O-N 3.49Å
602	G	82.4	Confident	84.1	Confident	35 Å²	35	66.7 Å²	66.7	36%	0.361	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-67.3	-9.5	173.1	0	0	0	0	0	114.4	N600 I604 E605	N600-G602 PolarHBondContact O-N 3.04Å; N600-G602 VanDerWaalsContact O-N 3.13Å; N600-G602 WeakPolarHBondContact OD1-CA 3.43Å; N600-G602 PolarHBondContact OD1-N 3.11Å; G602-I604 PolarHBondContact O-N 3.32Å; G602-E605 PolarHBondContact O-N 2.82Å
603	I	85.3	Confident	84.1	Confident	9 Å²	9	65.8 Å²	65.8	5%	0.046	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-51.1	-29.7	172.7	-77.3	170.5	0	0	0	112.4	L572 V592 D596 N600 P601 E605 D606 L609	L572-I603 HydrophobicContact CD1-CG1 4.43Å; L572-I603 HydrophobicContact CD2-CG2 4.27Å; V592-I603 HydrophobicContact CG1-CD1 3.96Å; V592-I603 HydrophobicContact CG1-CG2 4.3Å; V592-I603 HydrophobicContact CG2-CG2 4.19Å; D596-I603 HydrophobicContact CB-CD1 4.4Å; N600-I603 HydrophobicContact CB-CD1 4.15Å; N600-I603 HydrophobicContact CB-CG1 4.16Å; N600-I603 WeakPolarHBondContact O-CB 3.43Å; N600-I603 WeakPolarHBondContact O-CD1 3.43Å; N600-I603 VanDerWaalsContact O-CG1 3.22Å; N600-I603 WeakPolarHBondContact O-CG1 3.43Å; N600-I603 PolarHBondContact O-N 3.01Å; N600-I603 VanDerWaalsContact O-N 3.16Å; P601-I603 PolarHBondContact O-N 3.49Å; I603-E605 PolarHBondContact O-N 2.86Å; I603-D606 WeakPolarHBondContact O-CB 3.35Å; I603-D606 PolarHBondContact O-N 3.33Å; I603-L609 HydrophobicContact CG2-CD1 4.13Å; I603-L609 WeakPolarHBondContact O-CD2 3.44Å
604	I	83.5	Confident	83.7	Confident	56 Å²	56	66 Å²	66	29%	0.287	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-59.5	-30.3	175.8	-64.7	-175.3	0	0	0	113	F597 G602 W620	F597-I604 HydrophobicContact CE2-CD1 3.9Å; F597-I604 HydrophobicContact CE2-CG1 3.82Å; F597-I604 HydrophobicContact CZ-CD1 3.92Å; F597-I604 HydrophobicContact CZ-CG1 4.35Å; G602-I604 PolarHBondContact O-N 3.32Å; I604-W620 HydrophobicContact CG2-CD2 4.19Å; I604-W620 VanDerWaalsContact CG2-CE2 3.49Å; I604-W620 HydrophobicContact CG2-CG 4.48Å; I604-W620 HydrophobicContact CG2-CZ2 3.73Å; I604-W620 VanDerWaalsContact CG2-NE1 3.32Å
605	E	78.4	Confident	83.7	Confident	173 Å²	173	61.9 Å²	61.9	81%	0.808	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-91.7	-4.1	-177.9	-54.5	-162.7	153.8	0	0	113.1	G602 I603	G602-E605 PolarHBondContact O-N 2.82Å; I603-E605 PolarHBondContact O-N 2.86Å
606	D	81.1	Confident	83.6	Confident	64 Å²	64	60.6 Å²	60.6	34%	0.342	34%	0.343	S	S	.	.			trans	-69.3	126	-177.2	-164.9	-56.2	0	0	0	111.6	L572 I603 S608 L609	L572-D606 HydrophobicContact CD2-CB 3.78Å; I603-D606 WeakPolarHBondContact O-CB 3.35Å; I603-D606 PolarHBondContact O-N 3.33Å; D606-S608 VanDerWaalsContact CG-OG 3.32Å; D606-S608 PolarHBondContact O-N 2.98Å; D606-S608 VanDerWaalsContact O-N 3.1Å; D606-S608 WeakPolarHBondContact OD1-CA 2.98Å; D606-S608 VanDerWaalsContact OD1-CB 3.25Å; D606-S608 WeakPolarHBondContact OD1-CB 3.43Å; D606-S608 PolarHBondContact OD1-N 3.38Å; D606-S608 PolarHBondContact OD1-OG 3.05Å; D606-L609 VanDerWaalsContact O-CB 3.32Å; D606-L609 WeakPolarHBondContact O-CB 3.24Å; D606-L609 PolarHBondContact O-N 3.47Å
607	P	77.4	Confident	83.8	Confident	110 Å²	110	60 Å²	60	71%	0.714	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.9	179.3	29.2	-36.8	0	0	0	114.4
608	S	80.4	Confident	83.9	Confident	24 Å²	24	58.5 Å²	58.5	17%	0.168	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-4.5	171.5	72.1	0	0	0	0	114.1	L572 G574 D606 V610	L572-S608 CarbonylContact C-O 3.57Å; L572-S608 WeakPolarHBondContact CD2-OG 3.29Å; G574-S608 VanDerWaalsContact CA-O 3.23Å; G574-S608 WeakPolarHBondContact CA-O 3.39Å; G574-S608 PolarHBondContact N-O 2.97Å; G574-S608 VanDerWaalsContact O-CA 3.27Å; G574-S608 WeakPolarHBondContact O-CA 3.44Å; G574-S608 WeakPolarHBondContact O-CB 3.42Å; D606-S608 VanDerWaalsContact CG-OG 3.32Å; D606-S608 PolarHBondContact O-N 2.98Å; D606-S608 VanDerWaalsContact O-N 3.1Å; D606-S608 WeakPolarHBondContact OD1-CA 2.98Å; D606-S608 VanDerWaalsContact OD1-CB 3.25Å; D606-S608 WeakPolarHBondContact OD1-CB 3.43Å; D606-S608 PolarHBondContact OD1-N 3.38Å; D606-S608 PolarHBondContact OD1-OG 3.05Å; S608-V610 PolarHBondContact O-N 2.78Å
609	L	87.9	Confident	84.2	Confident	8 Å²	8	56.4 Å²	56.4	4%	0.042	32%	0.318	C	S	.	.			trans	-67	122.3	-178.4	-175.4	63.6	0	0	0	112.5	M570 L572 I603 D606 I611 W620	M570-L609 HydrophobicContact CB-CD1 4Å; M570-L609 HydrophobicContact CG-CD1 4.17Å; M570-L609 HydrophobicContact SD-CD1 4.22Å; L572-L609 HydrophobicContact CD2-CB 4.37Å; L572-L609 HydrophobicContact CD2-CD1 4.35Å; I603-L609 HydrophobicContact CG2-CD1 4.13Å; I603-L609 WeakPolarHBondContact O-CD2 3.44Å; D606-L609 VanDerWaalsContact O-CB 3.32Å; D606-L609 WeakPolarHBondContact O-CB 3.24Å; D606-L609 PolarHBondContact O-N 3.47Å; L609-I611 HydrophobicContact CD1-CD1 4.09Å; L609-I611 HydrophobicContact CD2-CD1 4.01Å; L609-I611 HydrophobicContact CG-CD1 3.88Å; L609-W620 HydrophobicContact CD2-CB 4.44Å
610	V	88.6	Confident	84.3	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.7	175.6	178.7	0	0	0	0	108.6	M570 S571 T579 I582 F587 S608 Y617 Y618	M570-V610 CarbonylContact C-O 3.56Å; M570-V610 VanDerWaalsContact CA-O 3.31Å; M570-V610 WeakPolarHBondContact CA-O 3.39Å; S571-V610 PolarHBondContact N-O 2.66Å; S571-V610 PolarHBondContact O-N 2.69Å; T579-V610 HydrophobicContact CG2-CG2 4.42Å; I582-V610 HydrophobicContact CD1-CB 4.2Å; I582-V610 HydrophobicContact CD1-CG1 3.67Å; I582-V610 HydrophobicContact CD1-CG2 3.56Å; F587-V610 HydrophobicContact CD2-CG1 4.16Å; F587-V610 HydrophobicContact CE2-CB 4.42Å; F587-V610 HydrophobicContact CE2-CG1 4.05Å; S608-V610 PolarHBondContact O-N 2.78Å; V610-Y617 HydrophobicContact CG1-CD1 4.17Å; V610-Y617 HydrophobicContact CG1-CG 4.47Å; V610-Y618 WeakPolarHBondContact CA-O 3.29Å
611	I	90.9	Very high	84.4	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.9	174.5	-44.4	-55.7	0	0	0	108.3	V568 S569 M570 L609 I613 Y618 W620 A623 I627	V568-I611 HydrophobicContact CG1-CG2 3.75Å; S569-I611 CarbonylContact O-C 3.59Å; S569-I611 WeakPolarHBondContact O-CA 3.45Å; S569-I611 WeakPolarHBondContact O-CG2 3.24Å; M570-I611 HydrophobicContact CB-CD1 3.53Å; L609-I611 HydrophobicContact CD1-CD1 4.09Å; L609-I611 HydrophobicContact CD2-CD1 4.01Å; L609-I611 HydrophobicContact CG-CD1 3.88Å; I611-I613 HydrophobicContact CG2-CD1 4.28Å; I611-I613 HydrophobicContact CG2-CG1 3.8Å; I611-Y618 PolarHBondContact N-O 2.85Å; I611-Y618 PolarHBondContact O-N 2.9Å; I611-W620 HydrophobicContact CD1-CE3 4.01Å; I611-W620 HydrophobicContact CD1-CZ3 4.4Å; I611-W620 HydrophobicContact CG1-CE3 4.01Å; I611-A623 HydrophobicContact CB-CB 3.65Å; I611-A623 HydrophobicContact CG1-CB 3.5Å; I611-A623 HydrophobicContact CG2-CB 4.07Å; I611-I627 HydrophobicContact CG2-CD1 4.22Å
612	C	87.4	Confident	84.7	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.1	164.5	-173.5	0	0	0	0	108.3	V568 S569 F587 S615 N616 Y617	V568-C612 WeakPolarHBondContact CA-O 3.36Å; S569-C612 PolarHBondContact N-O 2.93Å; S569-C612 PolarHBondContact O-N 3.1Å; F587-C612 HydrophobicContact CE1-CB 3.87Å; F587-C612 HydrophobicContact CE2-CB 3.79Å; F587-C612 HydrophobicContact CZ-CB 3.38Å; C612-S615 VanDerWaalsContact SG-CA 3.6Å; C612-N616 CarbonylContact C-O 3.55Å; C612-N616 WeakPolarHBondContact CA-O 3.32Å; C612-Y617 HydrophobicContact CB-CD1 3.91Å; C612-Y617 HydrophobicContact CB-CE1 3.9Å
613	I	87.4	Confident	85	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.5	172.9	-55.2	-178.7	0	0	0	107.3	M566 D567 V568 I611 S615 N616 Y618 A623 M626 I627	M566-I613 HydrophobicContact CE-CG2 3.88Å; M566-I613 HydrophobicContact CG-CG2 3.58Å; M566-I613 HydrophobicContact SD-CG2 3.39Å; M566-I613 WeakPolarHBondContact SD-CG2 3.49Å; D567-I613 WeakPolarHBondContact O-CA 3.37Å; V568-I613 HydrophobicContact CG2-CG1 4.35Å; V568-I613 HydrophobicContact CG2-CG2 4.44Å; I611-I613 HydrophobicContact CG2-CD1 4.28Å; I611-I613 HydrophobicContact CG2-CG1 3.8Å; I613-S615 VanDerWaalsContact C-N 3.32Å; I613-S615 PolarHBondContact O-N 2.88Å; I613-N616 PolarHBondContact N-O 3.33Å; I613-N616 WeakPolarHBondContact O-CB 3.15Å; I613-N616 PolarHBondContact O-N 2.93Å; I613-Y618 HydrophobicContact CB-CD2 4.01Å; I613-Y618 HydrophobicContact CB-CE2 3.93Å; I613-Y618 HydrophobicContact CD1-CD2 4.22Å; I613-Y618 HydrophobicContact CG1-CD2 4.11Å; I613-A623 HydrophobicContact CD1-CB 3.94Å; I613-M626 HydrophobicContact CD1-CB 4.21Å; I613-M626 HydrophobicContact CD1-CE 4.26Å; I613-M626 HydrophobicContact CG2-CE 4.36Å; I613-I627 HydrophobicContact CD1-CD1 4.19Å; I613-I627 HydrophobicContact CD1-CG1 3.93Å
614	N	80.8	Confident	85.1	Confident	74 Å²	74	47.6 Å²	47.6	40%	0.396	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	51.5	179.7	-56.9	-25.1	0	0	0	112.4	M566 D567 N616	M566-N614 PolarHBondContact SD-ND2 2.85Å; M566-N614 VanDerWaalsContact SD-ND2 3.39Å; D567-N614 PolarHBondContact N-OD1 2.86Å; D567-N614 PolarHBondContact O-N 2.86Å; N614-N616 PolarHBondContact O-N 2.66Å; N614-N616 VanDerWaalsContact O-N 3.16Å; N614-N616 PolarHBondContact O-ND2 2.89Å
615	S	80.1	Confident	85.3	Confident	93 Å²	93	47.2 Å²	47.2	65%	0.65	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	10.3	-175.1	-62.1	0	0	0	0	117.3	C612 I613	C612-S615 VanDerWaalsContact SG-CA 3.6Å; I613-S615 VanDerWaalsContact C-N 3.32Å; I613-S615 PolarHBondContact O-N 2.88Å
616	N	83.9	Confident	85.5	Confident	90 Å²	90	39.7 Å²	39.7	48%	0.481	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.9	175.7	-70	-93.2	0	0	0	110.8	C612 I613 N614 Y618	C612-N616 CarbonylContact C-O 3.55Å; C612-N616 WeakPolarHBondContact CA-O 3.32Å; I613-N616 PolarHBondContact N-O 3.33Å; I613-N616 WeakPolarHBondContact O-CB 3.15Å; I613-N616 PolarHBondContact O-N 2.93Å; N614-N616 PolarHBondContact O-N 2.66Å; N614-N616 VanDerWaalsContact O-N 3.16Å; N614-N616 PolarHBondContact O-ND2 2.89Å; N616-Y618 HydrophobicContact CB-CD2 4.4Å; N616-Y618 HydrophobicContact CB-CE2 3.48Å; N616-Y618 VanDerWaalsContact CB-CE2 3.48Å; N616-Y618 WeakPolarHBondContact CB-OH 3.44Å; N616-Y618 VanDerWaalsContact O-CD2 3.26Å; N616-Y618 WeakPolarHBondContact O-CD2 3.5Å; N616-Y618 WeakPolarHBondContact O-CE2 3.4Å
617	Y	87	Confident	85.8	Confident	59 Å²	59	38.6 Å²	38.6	23%	0.231	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125	-176.4	-55.4	-73.3	0	0	0	112.1	I582 K584 F587 V610 C612	I582-Y617 HydrophobicContact CB-CD2 4.33Å; I582-Y617 HydrophobicContact CB-CG 4.4Å; I582-Y617 HydrophobicContact CG2-CD1 4.3Å; I582-Y617 HydrophobicContact CG2-CD2 4.41Å; I582-Y617 HydrophobicContact CG2-CE1 4.43Å; I582-Y617 HydrophobicContact CG2-CG 4.29Å; K584-Y617 WeakPolarHBondContact CA-OH 3.16Å; F587-Y617 HydrophobicContact CB-CE1 3.91Å; F587-Y617 HydrophobicContact CD1-CE1 4.15Å; F587-Y617 AromaticContact CD2-CD1 3.6Å; F587-Y617 HydrophobicContact CD2-CD1 3.6Å; F587-Y617 AromaticContact CD2-CE1 3.48Å; F587-Y617 HydrophobicContact CD2-CE1 3.48Å; F587-Y617 VanDerWaalsContact CD2-CE1 3.48Å; F587-Y617 AromaticContact CE2-CD1 3.92Å; F587-Y617 HydrophobicContact CE2-CD1 3.92Å; F587-Y617 HydrophobicContact CE2-CE1 4.02Å; F587-Y617 HydrophobicContact CG-CD1 4.18Å; F587-Y617 AromaticContact CG-CE1 3.57Å; F587-Y617 HydrophobicContact CG-CE1 3.57Å; V610-Y617 HydrophobicContact CG1-CD1 4.17Å; V610-Y617 HydrophobicContact CG1-CG 4.47Å; C612-Y617 HydrophobicContact CB-CD1 3.91Å; C612-Y617 HydrophobicContact CB-CE1 3.9Å
618	Y	87.3	Confident	86.2	Confident	34 Å²	34	38.6 Å²	38.6	13%	0.133	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	159.3	-179.7	-56.8	-83.8	0	0	0	111.5	V610 I611 I613 N616 V622 M626 V642 V646 M650	V610-Y618 WeakPolarHBondContact CA-O 3.29Å; I611-Y618 PolarHBondContact N-O 2.85Å; I611-Y618 PolarHBondContact O-N 2.9Å; I613-Y618 HydrophobicContact CB-CD2 4.01Å; I613-Y618 HydrophobicContact CB-CE2 3.93Å; I613-Y618 HydrophobicContact CD1-CD2 4.22Å; I613-Y618 HydrophobicContact CG1-CD2 4.11Å; N616-Y618 HydrophobicContact CB-CD2 4.4Å; N616-Y618 HydrophobicContact CB-CE2 3.48Å; N616-Y618 VanDerWaalsContact CB-CE2 3.48Å; N616-Y618 WeakPolarHBondContact CB-OH 3.44Å; N616-Y618 VanDerWaalsContact O-CD2 3.26Å; N616-Y618 WeakPolarHBondContact O-CD2 3.5Å; N616-Y618 WeakPolarHBondContact O-CE2 3.4Å; Y618-V622 HydrophobicContact CD1-CB 4.39Å; Y618-V622 HydrophobicContact CD1-CG1 3.72Å; Y618-V622 HydrophobicContact CE1-CG1 4.33Å; Y618-V622 HydrophobicContact CG-CG1 4.44Å; Y618-M626 HydrophobicContact CD1-SD 4.37Å; Y618-M626 HydrophobicContact CE1-CE 4.44Å; Y618-M626 HydrophobicContact CE1-SD 4.18Å; Y618-M626 HydrophobicContact CE2-CE 3.94Å; Y618-M626 HydrophobicContact CE2-SD 4.4Å; Y618-V642 HydrophobicContact CE1-CG1 4.27Å; Y618-V646 HydrophobicContact CD1-CG2 4.27Å; Y618-V646 HydrophobicContact CE1-CG2 4.08Å; Y618-M650 HydrophobicContact CD1-CE 4.01Å; Y618-M650 HydrophobicContact CG-CE 4.43Å
619	N	88.6	Confident	86.5	Confident	41 Å²	41	37.8 Å²	37.8	22%	0.219	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	161.4	165.9	68.4	18.4	0	0	0	109.4	G621 V622 A623 K649 M650	N619-G621 PolarHBondContact O-N 2.91Å; N619-G621 VanDerWaalsContact O-N 3.14Å; N619-G621 PolarHBondContact OD1-N 3.23Å; N619-V622 PolarHBondContact O-N 2.82Å; N619-V622 PolarHBondContact OD1-N 2.89Å; N619-A623 WeakPolarHBondContact O-CB 3.4Å; N619-A623 PolarHBondContact O-N 3.32Å; N619-K649 PolarHBondContact ND2-O 2.89Å; N619-K649 VanDerWaalsContact ND2-O 3.07Å; N619-M650 HydrophobicContact CB-CE 4.12Å; N619-M650 WeakPolarHBondContact OD1-CE 3.35Å
620	W	87.8	Confident	86.1	Confident	100 Å²	100	38.9 Å²	38.9	38%	0.379	22%	0.217	S	C	.	.	H	α-helix	trans	-52.9	-37.8	-178.9	-175.6	-124.1	0	0	0	113.4	I604 L609 I611 V622 A623 A624 I627	I604-W620 HydrophobicContact CG2-CD2 4.19Å; I604-W620 VanDerWaalsContact CG2-CE2 3.49Å; I604-W620 HydrophobicContact CG2-CG 4.48Å; I604-W620 HydrophobicContact CG2-CZ2 3.73Å; I604-W620 VanDerWaalsContact CG2-NE1 3.32Å; L609-W620 HydrophobicContact CD2-CB 4.44Å; I611-W620 HydrophobicContact CD1-CE3 4.01Å; I611-W620 HydrophobicContact CD1-CZ3 4.4Å; I611-W620 HydrophobicContact CG1-CE3 4.01Å; W620-V622 PolarHBondContact O-N 2.84Å; W620-A623 PolarHBondContact O-N 2.91Å; W620-A624 HydrophobicContact CD2-CB 3.99Å; W620-A624 HydrophobicContact CE3-CB 4.22Å; W620-A624 HydrophobicContact CH2-CB 4.07Å; W620-A624 HydrophobicContact CZ2-CB 3.82Å; W620-A624 HydrophobicContact CZ3-CB 4.26Å; W620-A624 VanDerWaalsContact O-CB 3.29Å; W620-A624 WeakPolarHBondContact O-CB 3.45Å; W620-A624 PolarHBondContact O-N 2.93Å; W620-I627 HydrophobicContact CZ3-CD1 4.48Å
621	G	83.6	Confident	85.5	Confident	32 Å²	32	43.3 Å²	43.3	33%	0.33	24%	0.243	S	C	.	.	H	α-helix	trans	-66.2	-14.7	179.9	0	0	0	0	0	116.3	N619	N619-G621 PolarHBondContact O-N 2.91Å; N619-G621 VanDerWaalsContact O-N 3.14Å; N619-G621 PolarHBondContact OD1-N 3.23Å
622	V	88.4	Confident	84.8	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-108.1	-38.2	170.9	177.1	0	0	0	0	111.1	Y618 N619 W620 P625 M626 L645 V646 K649 M650	Y618-V622 HydrophobicContact CD1-CB 4.39Å; Y618-V622 HydrophobicContact CD1-CG1 3.72Å; Y618-V622 HydrophobicContact CE1-CG1 4.33Å; Y618-V622 HydrophobicContact CG-CG1 4.44Å; N619-V622 PolarHBondContact O-N 2.82Å; N619-V622 PolarHBondContact OD1-N 2.89Å; W620-V622 PolarHBondContact O-N 2.84Å; V622-P625 WeakPolarHBondContact O-CD 3.27Å; V622-M626 HydrophobicContact CG1-SD 3.96Å; V622-M626 WeakPolarHBondContact O-CG 3.44Å; V622-L645 HydrophobicContact CG1-CB 4.19Å; V622-L645 HydrophobicContact CG2-CB 4.35Å; V622-V646 HydrophobicContact CG1-CG2 3.97Å; V622-K649 HydrophobicContact CG2-CB 3.7Å; V622-K649 HydrophobicContact CG2-CG 4.4Å; V622-M650 HydrophobicContact CB-CE 3.77Å; V622-M650 HydrophobicContact CG1-CE 4.36Å; V622-M650 HydrophobicContact CG2-CE 3.64Å; V622-M650 HydrophobicContact CG2-CG 4.14Å; V622-M650 HydrophobicContact CG2-SD 4.19Å
623	A	88.6	Confident	84.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-43.6	179.9	0	0	0	0	0	113	I611 I613 N619 W620 M626 I627	I611-A623 HydrophobicContact CB-CB 3.65Å; I611-A623 HydrophobicContact CG1-CB 3.5Å; I611-A623 HydrophobicContact CG2-CB 4.07Å; I613-A623 HydrophobicContact CD1-CB 3.94Å; N619-A623 WeakPolarHBondContact O-CB 3.4Å; N619-A623 PolarHBondContact O-N 3.32Å; W620-A623 PolarHBondContact O-N 2.91Å; A623-M626 WeakPolarHBondContact O-CB 3.45Å; A623-M626 PolarHBondContact O-N 3.48Å; A623-I627 HydrophobicContact CB-CD1 4.4Å; A623-I627 WeakPolarHBondContact O-CG1 3.24Å; A623-I627 PolarHBondContact O-N 2.83Å
624	A	88.3	Confident	84.2	Confident	27 Å²	27	59.6 Å²	59.6	22%	0.223	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-45.8	-177.1	0	0	0	0	0	112.9	W620 M626 I627 L628	W620-A624 HydrophobicContact CD2-CB 3.99Å; W620-A624 HydrophobicContact CE3-CB 4.22Å; W620-A624 HydrophobicContact CH2-CB 4.07Å; W620-A624 HydrophobicContact CZ2-CB 3.82Å; W620-A624 HydrophobicContact CZ3-CB 4.26Å; W620-A624 VanDerWaalsContact O-CB 3.29Å; W620-A624 WeakPolarHBondContact O-CB 3.45Å; W620-A624 PolarHBondContact O-N 2.93Å; A624-M626 VanDerWaalsContact C-N 3.3Å; A624-M626 PolarHBondContact O-N 3.01Å; A624-I627 PolarHBondContact O-N 3.35Å; A624-L628 WeakPolarHBondContact O-CB 3.33Å; A624-L628 PolarHBondContact O-N 3.3Å
625	P	86.4	Confident	84.3	Confident	48 Å²	48	63.4 Å²	63.4	31%	0.312	34%	0.34	S	S	.	.	H	α-helix	trans	-56	-36.2	169.3	-29.2	34.9	0	0	0	115.4	V622 S629 L637 L645	V622-P625 WeakPolarHBondContact O-CD 3.27Å; P625-S629 WeakPolarHBondContact O-CB 3.28Å; P625-S629 PolarHBondContact O-N 3.28Å; P625-L637 HydrophobicContact CB-CD1 4.11Å; P625-L645 HydrophobicContact CB-CD1 3.98Å
626	M	84.2	Confident	84.4	Confident	14 Å²	14	63.6 Å²	63.6	7%	0.069	33%	0.333	C	S	.	.	H	α-helix	trans	-73.9	-45.7	179.9	-67	170.2	61.8	0	0	111.9	I613 Y618 V622 A623 A624 L628 S629 V630 L637 V642	I613-M626 HydrophobicContact CD1-CB 4.21Å; I613-M626 HydrophobicContact CD1-CE 4.26Å; I613-M626 HydrophobicContact CG2-CE 4.36Å; Y618-M626 HydrophobicContact CD1-SD 4.37Å; Y618-M626 HydrophobicContact CE1-CE 4.44Å; Y618-M626 HydrophobicContact CE1-SD 4.18Å; Y618-M626 HydrophobicContact CE2-CE 3.94Å; Y618-M626 HydrophobicContact CE2-SD 4.4Å; V622-M626 HydrophobicContact CG1-SD 3.96Å; V622-M626 WeakPolarHBondContact O-CG 3.44Å; A623-M626 WeakPolarHBondContact O-CB 3.45Å; A623-M626 PolarHBondContact O-N 3.48Å; A624-M626 VanDerWaalsContact C-N 3.3Å; A624-M626 PolarHBondContact O-N 3.01Å; M626-L628 VanDerWaalsContact C-N 3.33Å; M626-S629 PolarHBondContact O-N 3.38Å; M626-S629 PolarHBondContact O-OG 3.14Å; M626-V630 PolarHBondContact O-N 3.36Å; M626-L637 HydrophobicContact CG-CD1 4.03Å; M626-V642 HydrophobicContact CE-CG1 4.18Å; M626-V642 HydrophobicContact CE-CG2 4.38Å; M626-V642 HydrophobicContact CG-CG2 4.22Å; M626-V642 HydrophobicContact SD-CG1 3.78Å; M626-V642 HydrophobicContact SD-CG2 4.21Å
627	I	86.4	Confident	84.4	Confident	42 Å²	42	61.4 Å²	61.4	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-41	175.8	-64.5	164.7	0	0	0	110	V568 I611 I613 W620 A623 A624 S629 V630 T631	V568-I627 HydrophobicContact CG1-CD1 3.85Å; V568-I627 HydrophobicContact CG1-CG1 4.42Å; V568-I627 HydrophobicContact CG2-CG1 4.42Å; I611-I627 HydrophobicContact CG2-CD1 4.22Å; I613-I627 HydrophobicContact CD1-CD1 4.19Å; I613-I627 HydrophobicContact CD1-CG1 3.93Å; W620-I627 HydrophobicContact CZ3-CD1 4.48Å; A623-I627 HydrophobicContact CB-CD1 4.4Å; A623-I627 WeakPolarHBondContact O-CG1 3.24Å; A623-I627 PolarHBondContact O-N 2.83Å; A624-I627 PolarHBondContact O-N 3.35Å; I627-S629 VanDerWaalsContact C-N 3.33Å; I627-S629 PolarHBondContact O-N 2.79Å; I627-V630 PolarHBondContact O-N 2.67Å; I627-T631 HydrophobicContact CG2-CG2 4.24Å; I627-T631 WeakPolarHBondContact O-CB 3.31Å; I627-T631 WeakPolarHBondContact O-CG2 3.43Å; I627-T631 PolarHBondContact O-N 3.11Å; I627-T631 PolarHBondContact O-OG1 3.29Å
628	L	85.2	Confident	84.6	Confident	109 Å²	109	62.2 Å²	62.2	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-64.5	-35.8	176.2	-172.9	62.4	0	0	0	111.9	A624 M626 T631 A632	A624-L628 WeakPolarHBondContact O-CB 3.33Å; A624-L628 PolarHBondContact O-N 3.3Å; M626-L628 VanDerWaalsContact C-N 3.33Å; L628-T631 WeakPolarHBondContact CA-OG1 3.45Å; L628-T631 PolarHBondContact O-OG1 2.98Å; L628-A632 HydrophobicContact CD1-CB 4.35Å; L628-A632 WeakPolarHBondContact O-CB 3.46Å; L628-A632 PolarHBondContact O-N 2.9Å
629	S	86.7	Confident	84.4	Confident	7 Å²	7	65.7 Å²	65.7	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-65.8	-42.8	178.1	84.8	0	0	0	0	112.2	P625 M626 I627 F633 K635 L637	P625-S629 WeakPolarHBondContact O-CB 3.28Å; P625-S629 PolarHBondContact O-N 3.28Å; M626-S629 PolarHBondContact O-N 3.38Å; M626-S629 PolarHBondContact O-OG 3.14Å; I627-S629 VanDerWaalsContact C-N 3.33Å; I627-S629 PolarHBondContact O-N 2.79Å; S629-F633 WeakPolarHBondContact O-CA 3.39Å; S629-F633 WeakPolarHBondContact O-CB 3.42Å; S629-F633 PolarHBondContact O-N 2.97Å; S629-K635 CarbonylContact C-O 3.59Å; S629-K635 WeakPolarHBondContact CB-O 3.33Å; S629-K635 PolarHBondContact OG-O 2.96Å; S629-L637 PolarHBondContact OG-N 2.83Å
630	V	80.9	Confident	84.3	Confident	32 Å²	32	67.6 Å²	67.6	19%	0.194	38%	0.375	C	S	.	.	H	α-helix	trans	-71	-43.2	177.4	175.1	0	0	0	0	111.2	M566 M626 I627 Q634 K635 N636	M566-V630 HydrophobicContact CE-CB 4.16Å; M566-V630 HydrophobicContact CE-CG2 3.51Å; M566-V630 HydrophobicContact SD-CG2 4.38Å; M626-V630 PolarHBondContact O-N 3.36Å; I627-V630 PolarHBondContact O-N 2.67Å; V630-Q634 WeakPolarHBondContact O-CA 3.49Å; V630-Q634 PolarHBondContact O-N 3.34Å; V630-K635 PolarHBondContact N-O 3.18Å; V630-N636 WeakPolarHBondContact CG2-OD1 3.19Å
631	T	75.2	Confident	84.2	Confident	95 Å²	95	65.6 Å²	65.6	58%	0.583	37%	0.374	S	S	*	.	H	α-helix	trans	-74.1	-25	-178.7	53.4	0	0	0	0	114.7	I627 L628	I627-T631 HydrophobicContact CG2-CG2 4.24Å; I627-T631 WeakPolarHBondContact O-CB 3.31Å; I627-T631 WeakPolarHBondContact O-CG2 3.43Å; I627-T631 PolarHBondContact O-N 3.11Å; I627-T631 PolarHBondContact O-OG1 3.29Å; L628-T631 WeakPolarHBondContact CA-OG1 3.45Å; L628-T631 PolarHBondContact O-OG1 2.98Å
632	A	76.6	Confident	84.4	Confident	58 Å²	58	65 Å²	65	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-99.1	-28.8	178.7	0	0	0	0	0	114.4	L628	L628-A632 HydrophobicContact CD1-CB 4.35Å; L628-A632 WeakPolarHBondContact O-CB 3.46Å; L628-A632 PolarHBondContact O-N 2.9Å
633	F	81.6	Confident	84.2	Confident	152 Å²	152	71.2 Å²	71.2	67%	0.667	39%	0.393	S	S	*	.	H	α-helix	trans	-127.3	3.3	-174.4	-51.3	-70.7	0	0	0	114.4	S629 K635	S629-F633 WeakPolarHBondContact O-CA 3.39Å; S629-F633 WeakPolarHBondContact O-CB 3.42Å; S629-F633 PolarHBondContact O-N 2.97Å; F633-K635 WeakPolarHBondContact O-CG 3.49Å; F633-K635 PolarHBondContact O-N 3.07Å; F633-K635 VanDerWaalsContact O-N 3.1Å
634	Q	81.4	Confident	84.1	Confident	145 Å²	145	77.5 Å²	77.5	68%	0.678	42%	0.421	S	S	*	.	S	Bend	trans	53.6	26.7	-175.1	-59.8	179.4	2.9	0	0	113.2	V630	V630-Q634 WeakPolarHBondContact O-CA 3.49Å; V630-Q634 PolarHBondContact O-N 3.34Å
635	K	81.6	Confident	84	Confident	154 Å²	154	78.1 Å²	78.1	67%	0.67	42%	0.42	S	S	*	.			trans	-138.2	133	-173.3	-73	172.5	-174.3	177.2	0	111.3	S629 V630 F633	S629-K635 CarbonylContact C-O 3.59Å; S629-K635 WeakPolarHBondContact CB-O 3.33Å; S629-K635 PolarHBondContact OG-O 2.96Å; V630-K635 PolarHBondContact N-O 3.18Å; F633-K635 WeakPolarHBondContact O-CG 3.49Å; F633-K635 PolarHBondContact O-N 3.07Å; F633-K635 VanDerWaalsContact O-N 3.1Å
636	N	82.6	Confident	83.8	Confident	96 Å²	96	78.1 Å²	78.1	51%	0.513	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-64.9	145.1	170.1	-76.4	-63.7	0	0	0	110.7	M566 V630	M566-N636 PolarHBondContact SD-OD1 2.98Å; M566-N636 VanDerWaalsContact SD-OD1 3.35Å; V630-N636 WeakPolarHBondContact CG2-OD1 3.19Å
637	L	84.4	Confident	83.7	Confident	44 Å²	44	84.6 Å²	84.6	23%	0.23	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-60	140	167.6	-69	-177.3	0	0	0	109.8	P625 M626 S629 T639 T641 V642 L645	P625-L637 HydrophobicContact CB-CD1 4.11Å; M626-L637 HydrophobicContact CG-CD1 4.03Å; S629-L637 PolarHBondContact OG-N 2.83Å; L637-T639 PolarHBondContact O-N 2.8Å; L637-T641 HydrophobicContact CD1-CG2 4.44Å; L637-V642 HydrophobicContact CB-CG2 3.74Å; L637-L645 HydrophobicContact CD1-CD1 3.61Å
638	P	90.2	Very high	83.4	Confident	77 Å²	77	87.3 Å²	87.3	50%	0.5	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-54.8	140.4	171.9	-24.8	34.1	0	0	0	111	S640 T641 V642	P638-S640 PolarHBondContact O-N 3.15Å; P638-T641 WeakPolarHBondContact O-CA 3.27Å; P638-T641 VanDerWaalsContact O-CB 3.28Å; P638-T641 WeakPolarHBondContact O-CB 3.19Å; P638-T641 PolarHBondContact O-N 2.85Å; P638-V642 PolarHBondContact O-N 2.87Å
639	T	83.8	Confident	83	Confident	107 Å²	107	86 Å²	86	66%	0.656	45%	0.452	S	S	*	.	H	α-helix	trans	-53.7	-40.1	-178.3	38.5	0	0	0	0	112.7	L637 T641 V642 E643	L637-T639 PolarHBondContact O-N 2.8Å; T639-T641 PolarHBondContact O-N 2.99Å; T639-V642 CarbonylContact O-C 3.31Å; T639-V642 PolarHBondContact O-N 2.82Å; T639-V642 VanDerWaalsContact O-N 3.09Å; T639-E643 WeakPolarHBondContact O-CB 3.38Å; T639-E643 WeakPolarHBondContact O-CG 3.37Å; T639-E643 PolarHBondContact O-N 2.79Å
640	S	85.6	Confident	82.2	Confident	81 Å²	81	87.9 Å²	87.9	57%	0.566	46%	0.46	S	S	*	.	H	α-helix	trans	-60.2	-26.2	173.6	58.8	0	0	0	0	114.6	P638 K644	P638-S640 PolarHBondContact O-N 3.15Å; S640-K644 WeakPolarHBondContact O-CB 3.42Å; S640-K644 PolarHBondContact O-N 3.22Å
641	T	87.1	Confident	80.9	Confident	57 Å²	57	90.3 Å²	90.3	35%	0.35	48%	0.478	S	S	.	.	H	α-helix	trans	-82.1	-39.8	173.6	-56.9	0	0	0	0	111	L637 P638 T639 K644 L645	L637-T641 HydrophobicContact CD1-CG2 4.44Å; P638-T641 WeakPolarHBondContact O-CA 3.27Å; P638-T641 VanDerWaalsContact O-CB 3.28Å; P638-T641 WeakPolarHBondContact O-CB 3.19Å; P638-T641 PolarHBondContact O-N 2.85Å; T639-T641 PolarHBondContact O-N 2.99Å; T641-K644 PolarHBondContact O-N 2.9Å; T641-L645 HydrophobicContact CG2-CD1 4.39Å; T641-L645 WeakPolarHBondContact O-CG 3.45Å; T641-L645 PolarHBondContact O-N 2.82Å
642	V	87.1	Confident	79.8	Confident	20 Å²	20	92.2 Å²	92.2	12%	0.121	48%	0.478	C	S	.	.	H	α-helix	trans	-63	-46.6	173.7	179.9	0	0	0	0	110.8	Y618 M626 L637 P638 T639 K644 L645 V646	Y618-V642 HydrophobicContact CE1-CG1 4.27Å; M626-V642 HydrophobicContact CE-CG1 4.18Å; M626-V642 HydrophobicContact CE-CG2 4.38Å; M626-V642 HydrophobicContact CG-CG2 4.22Å; M626-V642 HydrophobicContact SD-CG1 3.78Å; M626-V642 HydrophobicContact SD-CG2 4.21Å; L637-V642 HydrophobicContact CB-CG2 3.74Å; P638-V642 PolarHBondContact O-N 2.87Å; T639-V642 CarbonylContact O-C 3.31Å; T639-V642 PolarHBondContact O-N 2.82Å; T639-V642 VanDerWaalsContact O-N 3.09Å; V642-K644 VanDerWaalsContact C-N 3.29Å; V642-K644 PolarHBondContact O-N 2.98Å; V642-L645 PolarHBondContact O-N 3.15Å; V642-L645 VanDerWaalsContact O-N 3.14Å; V642-V646 HydrophobicContact CG1-CG2 4.33Å; V642-V646 WeakPolarHBondContact O-CB 3.11Å; V642-V646 WeakPolarHBondContact O-CG2 3.3Å; V642-V646 PolarHBondContact O-N 3.44Å
643	E	84.6	Confident	78.1	Confident	130 Å²	130	98.5 Å²	98.5	61%	0.607	50%	0.495	S	S	*	.	H	α-helix	trans	-57.2	-40.7	174.5	-74.8	169	-151.6	0	0	112.2	T639 K647	T639-E643 WeakPolarHBondContact O-CB 3.38Å; T639-E643 WeakPolarHBondContact O-CG 3.37Å; T639-E643 PolarHBondContact O-N 2.79Å; E643-K647 VanDerWaalsContact O-CB 3.27Å; E643-K647 WeakPolarHBondContact O-CB 3.35Å; E643-K647 PolarHBondContact O-N 2.94Å
644	K	86.2	Confident	76.4	Confident	133 Å²	133	98 Å²	98	58%	0.578	51%	0.507	S	S	*	.	H	α-helix	trans	-65.3	-46.3	174.3	-172.9	-176.8	175.6	-170.2	0	111.5	S640 T641 V642 V646 K647 D648	S640-K644 WeakPolarHBondContact O-CB 3.42Å; S640-K644 PolarHBondContact O-N 3.22Å; T641-K644 PolarHBondContact O-N 2.9Å; V642-K644 VanDerWaalsContact C-N 3.29Å; V642-K644 PolarHBondContact O-N 2.98Å; K644-V646 PolarHBondContact O-N 2.99Å; K644-K647 PolarHBondContact O-N 3.41Å; K644-D648 WeakPolarHBondContact CE-OD2 3.3Å; K644-D648 WeakPolarHBondContact O-CB 3.41Å; K644-D648 VanDerWaalsContact O-CG 3.24Å; K644-D648 PolarHBondContact O-N 2.82Å
645	L	85.6	Confident	74.2	Confident	39 Å²	39	94.1 Å²	94.1	20%	0.204	51%	0.506	C	S	.	.	H	α-helix	trans	-60.4	-45.1	176.5	-73.1	167.8	0	0	0	111.7	V622 P625 L637 T641 V642 K647 D648 K649	V622-L645 HydrophobicContact CG1-CB 4.19Å; V622-L645 HydrophobicContact CG2-CB 4.35Å; P625-L645 HydrophobicContact CB-CD1 3.98Å; L637-L645 HydrophobicContact CD1-CD1 3.61Å; T641-L645 HydrophobicContact CG2-CD1 4.39Å; T641-L645 WeakPolarHBondContact O-CG 3.45Å; T641-L645 PolarHBondContact O-N 2.82Å; V642-L645 PolarHBondContact O-N 3.15Å; V642-L645 VanDerWaalsContact O-N 3.14Å; L645-K647 PolarHBondContact O-N 2.88Å; L645-D648 PolarHBondContact O-N 2.65Å; L645-K649 VanDerWaalsContact O-CB 3.27Å; L645-K649 WeakPolarHBondContact O-CB 3.39Å; L645-K649 PolarHBondContact O-N 2.86Å
646	V	83.3	Confident	72.2	Confident	49 Å²	49	98.6 Å²	98.6	30%	0.297	52%	0.519	S	S	.	.	H	α-helix	trans	-57.7	-47.6	173.1	167.9	0	0	0	0	110.7	Y618 V622 V642 K644 D648 K649 M650	Y618-V646 HydrophobicContact CD1-CG2 4.27Å; Y618-V646 HydrophobicContact CE1-CG2 4.08Å; V622-V646 HydrophobicContact CG1-CG2 3.97Å; V642-V646 HydrophobicContact CG1-CG2 4.33Å; V642-V646 WeakPolarHBondContact O-CB 3.11Å; V642-V646 WeakPolarHBondContact O-CG2 3.3Å; V642-V646 PolarHBondContact O-N 3.44Å; K644-V646 PolarHBondContact O-N 2.99Å; V646-D648 PolarHBondContact O-N 2.67Å; V646-K649 PolarHBondContact O-N 3.45Å; V646-M650 HydrophobicContact CB-SD 4.18Å; V646-M650 HydrophobicContact CG1-CB 4.37Å; V646-M650 HydrophobicContact CG1-SD 3.85Å; V646-M650 HydrophobicContact CG2-SD 3.93Å; V646-M650 WeakPolarHBondContact O-CA 3.49Å; V646-M650 WeakPolarHBondContact O-CB 3.49Å; V646-M650 PolarHBondContact O-N 3.13Å
647	K	82.5	Confident	69.9	Low	149 Å²	149	103.6 Å²	103.6	65%	0.648	53%	0.53	S	S	*	.	H	α-helix	trans	-62.4	-42	178.5	-172.7	177.8	-178.3	178.5	0	112.7	E643 K644 L645 S651	E643-K647 VanDerWaalsContact O-CB 3.27Å; E643-K647 WeakPolarHBondContact O-CB 3.35Å; E643-K647 PolarHBondContact O-N 2.94Å; K644-K647 PolarHBondContact O-N 3.41Å; L645-K647 PolarHBondContact O-N 2.88Å; K647-S651 WeakPolarHBondContact O-CB 3.4Å; K647-S651 PolarHBondContact O-OG 3.27Å
648	D	78.9	Confident	67.4	Low	100 Å²	100	110.9 Å²	110.9	54%	0.535	56%	0.555	S	S	.	*	H	α-helix	trans	-81.4	-20	-175.9	-66	-10.5	0	0	0	113	K644 L645 V646	K644-D648 WeakPolarHBondContact CE-OD2 3.3Å; K644-D648 WeakPolarHBondContact O-CB 3.41Å; K644-D648 VanDerWaalsContact O-CG 3.24Å; K644-D648 PolarHBondContact O-N 2.82Å; L645-D648 PolarHBondContact O-N 2.65Å; V646-D648 PolarHBondContact O-N 2.67Å
649	K	76.3	Confident	64.4	Low	82 Å²	82	116.8 Å²	116.8	36%	0.357	57%	0.573	S	S	.	*	H	α-helix	trans	-124.3	-0.2	-176	-59.8	-68.5	-172.8	174.9	0	115.7	N619 V622 L645 V646 W658	N619-K649 PolarHBondContact ND2-O 2.89Å; N619-K649 VanDerWaalsContact ND2-O 3.07Å; V622-K649 HydrophobicContact CG2-CB 3.7Å; V622-K649 HydrophobicContact CG2-CG 4.4Å; L645-K649 VanDerWaalsContact O-CB 3.27Å; L645-K649 WeakPolarHBondContact O-CB 3.39Å; L645-K649 PolarHBondContact O-N 2.86Å; V646-K649 PolarHBondContact O-N 3.45Å; K649-W658 VanDerWaalsContact NZ-CZ2 3.32Å
650	M	69.8	Low	61.9	Low	46 Å²	46	114.6 Å²	114.6	23%	0.227	56%	0.563	C	S	.	*	H	α-helix	trans	-137.1	5.3	179	-54.5	174.6	161.8	0	0	114.8	Y618 N619 V622 V646 K652	Y618-M650 HydrophobicContact CD1-CE 4.01Å; Y618-M650 HydrophobicContact CG-CE 4.43Å; N619-M650 HydrophobicContact CB-CE 4.12Å; N619-M650 WeakPolarHBondContact OD1-CE 3.35Å; V622-M650 HydrophobicContact CB-CE 3.77Å; V622-M650 HydrophobicContact CG1-CE 4.36Å; V622-M650 HydrophobicContact CG2-CE 3.64Å; V622-M650 HydrophobicContact CG2-CG 4.14Å; V622-M650 HydrophobicContact CG2-SD 4.19Å; V646-M650 HydrophobicContact CB-SD 4.18Å; V646-M650 HydrophobicContact CG1-CB 4.37Å; V646-M650 HydrophobicContact CG1-SD 3.85Å; V646-M650 HydrophobicContact CG2-SD 3.93Å; V646-M650 WeakPolarHBondContact O-CA 3.49Å; V646-M650 WeakPolarHBondContact O-CB 3.49Å; V646-M650 PolarHBondContact O-N 3.13Å; M650-K652 PolarHBondContact O-N 2.8Å
651	S	55.3	Low	59.2	Low	82 Å²	82	123.7 Å²	123.7	57%	0.573	59%	0.585	S	S	*	*			trans	-68.1	135.4	-179.7	47.7	0	0	0	0	112.3	K647 K653	K647-S651 WeakPolarHBondContact O-CB 3.4Å; K647-S651 PolarHBondContact O-OG 3.27Å; S651-K653 VanDerWaalsContact C-N 3.29Å; S651-K653 PolarHBondContact O-N 3.41Å
652	K	52.1	Low	56.5	Low	136 Å²	136	132.2 Å²	132.2	59%	0.591	61%	0.61	S	S	*	*	S	Bend	trans	-75.3	64.5	-166.8	-57.4	-163.2	-176.4	-165.1	0	114.5	D578 S580 M650	D578-K652 WeakPolarHBondContact OD1-CE 3.45Å; D578-K652 IonicContact OD1-NZ 2.65Å; D578-K652 PolarHBondContact OD1-NZ 2.64Å; D578-K652 IonicContact OD2-NZ 3.82Å; S580-K652 VanDerWaalsContact OG-CE 3.27Å; S580-K652 WeakPolarHBondContact OG-CE 3.43Å; S580-K652 PolarHBondContact OG-NZ 3.11Å; M650-K652 PolarHBondContact O-N 2.8Å
653	K	39.2	Very low	53.7	Low	190 Å²	190	142.4 Å²	142.4	83%	0.826	65%	0.647	S	S	*	*			trans	-131.4	116.5	168.7	-73.1	-172.3	177	-178.4	0	110.8	S651 G655	S651-K653 VanDerWaalsContact C-N 3.29Å; S651-K653 PolarHBondContact O-N 3.41Å; K653-G655 PolarHBondContact O-N 3.01Å
654	P	46.8	Very low	51	Low	140 Å²	140	147.8 Å²	147.8	91%	0.909	66%	0.661	S	S	*	*			trans	-76.7	109.8	178.3	30.2	-32.8	0	0	0	110.6
655	G	35.4	Very low	48.3	Very low	65 Å²	65	150 Å²	150	67%	0.67	67%	0.674	S	S	*	*			trans	163.9	109.7	169.6	0	0	0	0	0	114.9	K653	K653-G655 PolarHBondContact O-N 3.01Å
656	R	39.2	Very low	45.4	Very low	247 Å²	247	155.7 Å²	155.7	93%	0.932	70%	0.701	S	S	*	*			trans	39.4	120	149.2	-49.5	179.6	-174	-150	-1.1	115.6
657	W	34.3	Very low	42.7	Very low	201 Å²	201	159.4 Å²	159.4	76%	0.761	72%	0.72	S	S	*	*				178	161.1	52.2	-156.3	-6.1	0	0	0	109.2	S660	W657-S660 WeakPolarHBondContact CZ2-OG 3.16Å; W657-S660 VanDerWaalsContact NE1-CB 3.34Å; W657-S660 PolarHBondContact NE1-OG 2.86Å
658	W	31.3	Very low	40.1	Very low	197 Å²	197	158 Å²	158	75%	0.746	72%	0.719	S	S	*	*	S	Bend	trans	-170.8	-13.7	133.9	59.3	-50.2	0	0	0	115.4	K649 S660	K649-W658 VanDerWaalsContact NZ-CZ2 3.32Å; W658-S660 PolarHBondContact O-N 3.39Å; W658-S660 VanDerWaalsContact O-N 3.11Å
659	F	27.9	Very low	37.7	Very low	201 Å²	201	159.6 Å²	159.6	88%	0.882	73%	0.728	S	S	*	*			trans	-73.1	99.8	163.5	-79	-64.6	0	0	0	111
660	S	30.7	Very low	35.5	Very low	62 Å²	62	164.7 Å²	164.7	43%	0.434	75%	0.75	S	S	.	*			trans	-160.8	36.5	164.7	61.3	0	0	0	0	114.4	W657 W658 R662	W657-S660 WeakPolarHBondContact CZ2-OG 3.16Å; W657-S660 VanDerWaalsContact NE1-CB 3.34Å; W657-S660 PolarHBondContact NE1-OG 2.86Å; W658-S660 PolarHBondContact O-N 3.39Å; W658-S660 VanDerWaalsContact O-N 3.11Å; S660-R662 PolarHBondContact O-N 2.81Å
661	W	29.2	Very low	33.5	Very low	272 Å²	272	170.2 Å²	170.2	100%	1.03	78%	0.775	S	S	*	*			trans	-92	41.1	164.6	-85.3	44.9	0	0	0	111.8
662	R	31.8	Very low	32.3	Very low	236 Å²	236	173.9 Å²	173.9	89%	0.891	78%	0.783	S	S	*	*	S	Bend	trans	-147	100.3	160.1	-144.5	176.3	-154	-146.6	4.6	110.4	S660	S660-R662 PolarHBondContact O-N 2.81Å
663	R	27.3	Very low	31	Very low	233 Å²	233	175 Å²	175	88%	0.879	79%	0.79	S	S	*	*			trans	41.1	108	161.5	-169.7	-175.9	-68.2	-143.7	0.6	117.6
664	R	27.8	Very low	30.5	Very low	243 Å²	243	172.8 Å²	172.8	92%	0.917	79%	0.787	S	S	*	*				-148	123.8	124.9	-147.7	170.5	-67.8	-156.7	-2.6	110.9
665	E	29.1	Very low	29.5	Very low	179 Å²	179	173.2 Å²	173.2	84%	0.836	78%	0.775	S	S	*	*			trans	-76.8	173.3	165.2	-158.5	142.2	-137.9	0	0	108.8
666	M	25.3	Very low	28.9	Very low	159 Å²	159	176.9 Å²	176.9	78%	0.783	77%	0.774	S	S	*	*			trans	-73.1	164.6	168.3	-87.6	-177	146.2	0	0	109.7
667	D	26.4	Very low	28.3	Very low	128 Å²	128	172 Å²	172	68%	0.684	76%	0.762	S	S	*	*			cis	-148.9	-168.4	34.1	-136.4	-57.8	0	0	0	115.7
668	N	28.4	Very low	27.9	Very low	120 Å²	120	168.8 Å²	168.8	64%	0.642	76%	0.755	S	S	*	*			trans	-66	167.8	167.2	-59.5	-90.3	0	0	0	110
669	N	27.6	Very low	27.6	Very low	133 Å²	133	166.8 Å²	166.8	71%	0.711	76%	0.758	S	S	*	*			cis	-154.2	-166.9	22.4	-150	-23.8	0	0	0	112.8
670	K	30.9	Very low	27.6	Very low	188 Å²	188	161 Å²	161	82%	0.817	75%	0.747	S	S	*	*			trans	-66.5	153.3	-179.7	-58.4	149.7	-176.7	169.5	0	113.6
671	Q	27.6	Very low	27.3	Very low	162 Å²	162	163 Å²	163	76%	0.757	76%	0.761	S	S	*	*			trans	-75	155.4	162.5	-70.5	-174.4	-23.4	0	0	113.2
672	Q	29.3	Very low	27.2	Very low	160 Å²	160	156.2 Å²	156.2	75%	0.748	75%	0.75	S	S	*	*			trans	70.7	142.8	163.7	-63.7	172.3	25.2	0	0	116.4
673	Q	25.2	Very low	26.9	Very low	158 Å²	158	149.7 Å²	149.7	74%	0.738	74%	0.74	S	S	*	*			cis	-156.2	134.4	15.6	-155.9	-177.3	16.3	0	0	112.8
674	L	29.4	Very low	26.7	Very low	144 Å²	144	143.9 Å²	143.9	75%	0.754	74%	0.736	S	S	*	*				150.6	125.1	128.9	-82.3	167.7	0	0	0	116.5
675	K	24.8	Very low	27.5	Very low	150 Å²	150	137.8 Å²	137.8	65%	0.652	73%	0.727	S	S	*	*			trans	63.3	115.7	148.1	-85.2	-169.3	171.1	-71.8	0	122.8
676	E	24.1	Very low	27.4	Very low	142 Å²	142	134.7 Å²	134.7	66%	0.664	72%	0.721	S	S	*	*				59.3	144.4	115.2	-70.7	169.8	-164.7	0	0	120.7
677	E	25.7	Very low	27.4	Very low	144 Å²	144	135.6 Å²	135.6	67%	0.673	72%	0.723	S	S	*	*			cis	-161.5	163.8	16.9	-132.1	-166.8	133.4	0	0	113.8
678	Q	25.6	Very low	27.3	Very low	133 Å²	133	133.6 Å²	133.6	62%	0.621	72%	0.724	S	S	*	*			trans	68.6	99.9	149.5	-60.4	-80.3	-16.9	0	0	123
679	L	26.3	Very low	27.2	Very low	155 Å²	155	134 Å²	134	81%	0.812	73%	0.731	S	S	*	*				81	135.3	114.8	-118.7	72.6	0	0	0	124.8
680	A	26.1	Very low	27.1	Very low	79 Å²	79	135.4 Å²	135.4	65%	0.653	74%	0.738	S	S	*	*			trans	92.1	81.6	134.1	0	0	0	0	0	123
681	S	25.3	Very low	26.8	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	73%	0.732	S	S	*	*				73.6	119.6	112.1	68.8	0	0	0	0	124.2
682	V	27.1	Very low	26.7	Very low	131 Å²	131	131.9 Å²	131.9	79%	0.794	73%	0.733	S	S	*	*				92.1	118.4	123.8	169.4	0	0	0	0	121.7
683	S	25.5	Very low	26.7	Very low	98 Å²	98	129.7 Å²	129.7	69%	0.685	73%	0.731	S	S	*	*			trans	55.6	113.4	151.8	70.2	0	0	0	0	123
684	S	22.8	Very low	26.9	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	74%	0.735	S	S	*	*				22	156.7	101	-56.5	0	0	0	0	120.9
685	P	44.1	Very low	27	Very low	115 Å²	115	127.8 Å²	127.8	75%	0.747	73%	0.732	S	S	*	*			cis	-141.6	-163.3	-11.3	26.4	0.7	0	0	0	114.8
686	V	26.9	Very low	27.2	Very low	115 Å²	115	126.9 Å²	126.9	70%	0.697	74%	0.74	S	S	*	*			trans	94.9	111.2	152.2	-177.9	0	0	0	0	120.8
687	Q	25.4	Very low	27.5	Very low	177 Å²	177	124 Å²	124	83%	0.827	75%	0.747	S	S	*	*			trans	44.2	120.4	138.5	-61.3	178.3	-52	0	0	124.5
688	A	25.8	Very low	27.7	Very low	87 Å²	87	124.4 Å²	124.4	72%	0.719	75%	0.753	S	S	*	*				77.3	139.5	116.6	0	0	0	0	0	124.3
689	T	25.3	Very low	27.9	Very low	127 Å²	127	128.5 Å²	128.5	78%	0.779	76%	0.763	S	S	*	*			trans	55.9	115.4	149.5	49.9	0	0	0	0	121.2
690	L	25.5	Very low	28.3	Very low	164 Å²	164	129.5 Å²	129.5	86%	0.859	76%	0.764	S	S	*	*				-174.4	161.9	108.5	-104.2	159.9	0	0	0	113.2
691	D	23.9	Very low	28.3	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	78%	0.776	S	S	*	*			trans	-84.1	155.9	-173.8	-48.1	-91.2	0	0	0	114.9
692	N	26.4	Very low	28.6	Very low	146 Å²	146	135 Å²	135	78%	0.781	78%	0.776	S	S	*	*				172.6	134.8	111.8	-89.7	-54.1	0	0	0	115.2
693	T	28.8	Very low	29.6	Very low	115 Å²	115	135 Å²	135	71%	0.706	78%	0.779	S	S	*	*				13.4	150.9	126	29.7	0	0	0	0	121.4
694	E	30.2	Very low	29.6	Very low	177 Å²	177	136 Å²	136	83%	0.827	79%	0.786	S	S	*	*			cis	-131.9	-173.2	-0	-48.7	-173.9	117.9	0	0	110.2
695	A	30.3	Very low	30.3	Very low	84 Å²	84	139.1 Å²	139.1	69%	0.694	79%	0.793	S	S	*	*				-174.1	134.4	60.4	0	0	0	0	0	116.1
696	V	31	Very low	29.7	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	79%	0.793	S	S	*	*			trans	65.1	111.6	137.5	-178.4	0	0	0	0	120.8
697	G	29.7	Very low	30.2	Very low	80 Å²	80	138.7 Å²	138.7	83%	0.825	80%	0.798	S	S	*	*			trans	-159.3	103.5	161.4	0	0	0	0	0	112.7
698	L	29.7	Very low	30.5	Very low	153 Å²	153	139.1 Å²	139.1	80%	0.801	80%	0.8	S	S	*	*			trans	-78.5	158.6	-178	-65.3	157.6	0	0	0	111.4
699	R	29.5	Very low	31.1	Very low	219 Å²	219	141.4 Å²	141.4	83%	0.826	81%	0.806	S	S	*	*			cis	-157.3	168.1	12.2	-142.7	166.2	-172.9	-114.3	1.5	112.1
700	Q	34	Very low	31.5	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	81%	0.807	S	S	*	*			trans	-83.6	159.1	-171.7	-49.9	131.9	-49.5	0	0	115.7
701	K	26.8	Very low	31.9	Very low	208 Å²	208	140.4 Å²	140.4	90%	0.904	80%	0.801	S	S	*	*			trans	-154.2	141.2	133.8	-150.4	179.5	-176	-173.3	0	112.4
702	A	30.8	Very low	32.3	Very low	89 Å²	89	140.6 Å²	140.6	74%	0.736	80%	0.799	S	S	*	*			trans	-157.5	176	173.7	0	0	0	0	0	108.5
703	P	48.2	Very low	32.8	Very low	131 Å²	131	138.9 Å²	138.9	85%	0.851	80%	0.799	S	S	*	*			cis	-118.7	178.5	-21.9	39.5	-27.2	0	0	0	111.7
704	S	27	Very low	33.4	Very low	120 Å²	120	139.9 Å²	139.9	84%	0.839	79%	0.793	S	S	*	*			trans	-154.4	138.2	159	55	0	0	0	0	112.2
705	L	37.6	Very low	34.6	Very low	176 Å²	176	136.1 Å²	136.1	92%	0.921	79%	0.787	S	S	*	*			trans	-78.7	131.2	-178.3	177.3	71.7	0	0	0	112
706	S	30.1	Very low	35.9	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	77%	0.773	S	S	*	*			trans	-147	123.9	159.1	53.1	0	0	0	0	109.3
707	S	38.5	Very low	37.8	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	75%	0.751	S	S	*	*			trans	-84.2	115.5	176.9	175.8	0	0	0	0	109.5
708	E	31.4	Very low	40.1	Very low	185 Å²	185	131.8 Å²	131.8	86%	0.864	72%	0.721	S	S	*	*			trans	-140.7	129.3	167.6	-127	164	-145.6	0	0	109.7	M710	E708-M710 PolarHBondContact O-N 3.2Å
709	T	37.9	Very low	42.7	Very low	136 Å²	136	128.4 Å²	128.4	83%	0.834	70%	0.698	S	S	*	*			trans	-80	100.2	-170.1	43.3	0	0	0	0	111.3	S711	T709-S711 PolarHBondContact O-N 3.39Å; T709-S711 VanDerWaalsContact O-N 3.15Å
710	M	33.8	Very low	45.3	Very low	166 Å²	166	120.5 Å²	120.5	82%	0.818	67%	0.669	S	S	*	*			trans	-72.8	99.2	155.4	-71.1	-168.1	75.9	0	0	108.5	E708 M712	E708-M710 PolarHBondContact O-N 3.2Å; M710-M712 HydrophobicContact CB-CE 4.32Å; M710-M712 PolarHBondContact O-N 2.95Å
711	S	33.4	Very low	48	Very low	103 Å²	103	113 Å²	113	72%	0.72	64%	0.636	S	S	*	*			trans	-58.9	116.3	164.4	52.5	0	0	0	0	108.7	T709 S713	T709-S711 PolarHBondContact O-N 3.39Å; T709-S711 VanDerWaalsContact O-N 3.15Å; S711-S713 PolarHBondContact O-N 3.33Å
712	M	32.9	Very low	51	Low	133 Å²	133	104.2 Å²	104.2	66%	0.655	60%	0.599	S	S	*	*			trans	-62.5	108.6	162	-68.2	-64.8	97.3	0	0	106.9	M710 F714	M710-M712 HydrophobicContact CB-CE 4.32Å; M710-M712 PolarHBondContact O-N 2.95Å; M712-F714 VanDerWaalsContact C-N 3.3Å; M712-F714 WeakPolarHBondContact O-CD2 3.33Å; M712-F714 PolarHBondContact O-N 3.33Å
713	S	37.7	Very low	54	Low	110 Å²	110	103.3 Å²	103.3	77%	0.769	58%	0.577	S	S	*	*			trans	-71.4	91.4	172.5	54.4	0	0	0	0	107.9	S711 S715	S711-S713 PolarHBondContact O-N 3.33Å; S713-S715 PolarHBondContact O-N 3.25Å
714	F	39.9	Very low	56.2	Low	136 Å²	136	97.7 Å²	97.7	60%	0.596	54%	0.539	S	S	*	.			trans	-52.7	112.9	165.9	-71.9	-89.3	0	0	0	107.6	M712 H716	M712-F714 VanDerWaalsContact C-N 3.3Å; M712-F714 WeakPolarHBondContact O-CD2 3.33Å; M712-F714 PolarHBondContact O-N 3.33Å; F714-H716 VanDerWaalsContact C-N 3.32Å; F714-H716 PolarHBondContact O-N 3.33Å; F714-H716 PolarHBondContact O-ND1 3.17Å
715	S	56.1	Low	59.5	Low	99 Å²	99	95.1 Å²	95.1	69%	0.692	52%	0.518	S	S	*	.			trans	-72.5	91.6	174.3	49.7	0	0	0	0	107.5	S713 M717	S713-S715 PolarHBondContact O-N 3.25Å; S715-M717 PolarHBondContact O-N 2.89Å; S715-M717 VanDerWaalsContact O-N 3.09Å
716	H	57.9	Low	62.2	Low	88 Å²	88	88.7 Å²	88.7	41%	0.407	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-58.1	116.5	179.6	-65.7	43.9	0	0	0	107.7	E91 F714 Y718	E91-H716 IonicContact OE2-CD2 2.66Å; F714-H716 VanDerWaalsContact C-N 3.32Å; F714-H716 PolarHBondContact O-N 3.33Å; F714-H716 PolarHBondContact O-ND1 3.17Å; H716-Y718 HydrophobicContact CB-CE2 3.97Å; H716-Y718 WeakPolarHBondContact O-CD2 3.36Å; H716-Y718 WeakPolarHBondContact O-CE2 3.49Å
717	M	71.4	Confident	65.3	Low	69 Å²	69	92.1 Å²	92.1	34%	0.34	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126	-178.9	-74	-174.4	62.5	0	0	108.5	E92 V97 S715	E92-M717 PolarHBondContact N-O 2.65Å; E92-M717 PolarHBondContact O-N 3.45Å; V97-M717 HydrophobicContact CB-CE 3.84Å; V97-M717 HydrophobicContact CG2-CB 4.22Å; V97-M717 HydrophobicContact CG2-CE 4.06Å; S715-M717 PolarHBondContact O-N 2.89Å; S715-M717 VanDerWaalsContact O-N 3.09Å
718	Y	77.6	Confident	68	Low	48 Å²	48	89 Å²	89	19%	0.188	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.7	-176.5	-61	-102	0	0	0	109.8	V89 E90 E91 C102 T103 P105 H716	V89-Y718 HydrophobicContact CG1-CD1 3.65Å; V89-Y718 HydrophobicContact CG1-CG 4.29Å; E90-Y718 CarbonylContact O-C 3.37Å; E90-Y718 WeakPolarHBondContact O-CA 3.27Å; E91-Y718 HydrophobicContact CG-CD1 3.57Å; E91-Y718 HydrophobicContact CG-CE1 3.29Å; E91-Y718 HydrophobicContact CG-CG 4.46Å; E91-Y718 WeakPolarHBondContact OE1-CE1 3.49Å; E91-Y718 PolarHBondContact OE1-OH 2.93Å; E91-Y718 VanDerWaalsContact OE1-OH 3.09Å; C102-Y718 WeakPolarHBondContact CA-O 3.49Å; T103-Y718 PolarHBondContact N-O 3.24Å; T103-Y718 WeakPolarHBondContact O-CB 3.3Å; P105-Y718 HydrophobicContact CB-CD1 4.15Å; P105-Y718 HydrophobicContact CB-CE1 3.6Å; P105-Y718 HydrophobicContact CB-CE2 4.23Å; P105-Y718 HydrophobicContact CG-CE1 4.4Å; P105-Y718 HydrophobicContact CG-CE2 4.16Å; H716-Y718 HydrophobicContact CB-CE2 3.97Å; H716-Y718 WeakPolarHBondContact O-CD2 3.36Å; H716-Y718 WeakPolarHBondContact O-CE2 3.49Å
719	R	83.1	Confident	71.1	Confident	82 Å²	82	80.4 Å²	80.4	31%	0.309	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.9	175	70.7	173.4	178	-147.6	-1.8	111.9	E90 E92 V97 L101	E90-R719 HydrophobicContact CB-CG 3.85Å; E90-R719 PolarHBondContact N-O 2.85Å; E90-R719 PolarHBondContact O-N 2.85Å; E90-R719 IonicContact OE2-CZ 3.81Å; E90-R719 IonicContact OE2-NE 2.63Å; E90-R719 PolarHBondContact OE2-NE 2.65Å; E90-R719 IonicContact OE2-NH2 2.78Å; E90-R719 PolarHBondContact OE2-NH2 3.49Å; E92-R719 IonicContact OE1-CZ 2.68Å; E92-R719 IonicContact OE1-NH1 3.8Å; E92-R719 PolarHBondContact OE1-NH1 3.21Å; E92-R719 WeakPolarHBondContact OE2-CD 3.4Å; E92-R719 IonicContact OE2-CZ 2.69Å; E92-R719 IonicContact OE2-NE 2.69Å; E92-R719 IonicContact OE2-NH1 3.8Å; E92-R719 PolarHBondContact OE2-NH1 3.49Å; V97-R719 HydrophobicContact CG1-CB 3.85Å; V97-R719 HydrophobicContact CG2-CB 4.38Å; L101-R719 CarbonylContact O-C 3.6Å; L101-R719 WeakPolarHBondContact O-CA 3.3Å
720	K	85.3	Confident	73.8	Confident	53 Å²	53	78.2 Å²	78.2	23%	0.23	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	130.1	167.8	-63.5	166.9	-167.5	156.2	0	109.3	F87 H100 L101 C102 T103	F87-K720 HydrophobicContact CB-CB 4.35Å; F87-K720 HydrophobicContact CD1-CD 4.41Å; F87-K720 HydrophobicContact CD1-CG 4.36Å; F87-K720 HydrophobicContact CD2-CB 4.01Å; F87-K720 HydrophobicContact CD2-CD 4.46Å; F87-K720 HydrophobicContact CD2-CG 3.6Å; F87-K720 HydrophobicContact CE1-CD 4.33Å; F87-K720 HydrophobicContact CE1-CG 4.43Å; F87-K720 HydrophobicContact CE2-CD 4.38Å; F87-K720 HydrophobicContact CE2-CG 3.67Å; F87-K720 HydrophobicContact CG-CB 4.17Å; F87-K720 HydrophobicContact CG-CD 4.47Å; F87-K720 HydrophobicContact CG-CG 3.96Å; F87-K720 HydrophobicContact CZ-CD 4.31Å; F87-K720 HydrophobicContact CZ-CG 4.1Å; H100-K720 PolarHBondContact O-NZ 3.29Å; L101-K720 VanDerWaalsContact O-CG 3.28Å; L101-K720 WeakPolarHBondContact O-CG 3.43Å; L101-K720 PolarHBondContact O-N 3.01Å; C102-K720 VanDerWaalsContact O-CE 3.24Å; C102-K720 WeakPolarHBondContact O-CE 3.39Å; C102-K720 PolarHBondContact O-NZ 2.93Å; T103-K720 HydrophobicContact CG2-CG 4.26Å
721	S	89.4	Confident	76.7	Confident	18 Å²	18	73.3 Å²	73.3	13%	0.126	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	154.1	170.4	-172.7	0	0	0	0	111.4	F87 F88 E90 R723	F87-S721 CarbonylContact C-O 3.57Å; F87-S721 WeakPolarHBondContact CB-O 3.5Å; F88-S721 PolarHBondContact N-O 2.84Å; F88-S721 PolarHBondContact O-N 3.24Å; E90-S721 VanDerWaalsContact CD-CB 3.42Å; E90-S721 WeakPolarHBondContact OE1-CB 3.33Å; E90-S721 PolarHBondContact OE1-OG 2.88Å; S721-R723 PolarHBondContact OG-N 3.44Å; S721-R723 PolarHBondContact OG-O 3.42Å
722	L	91.3	Very high	79.7	Confident	25 Å²	25	68.9 Å²	68.9	13%	0.131	36%	0.356	C	S	.	.	S	Bend	trans	-117.9	6.1	171.9	-63.5	-179.7	0	0	0	111.7	P47 F48 F87	P47-L722 CarbonylContact C-O 3.56Å; P47-L722 VanDerWaalsContact CA-O 3.26Å; P47-L722 WeakPolarHBondContact CA-O 3.39Å; P47-L722 HydrophobicContact CB-CB 4.08Å; F48-L722 PolarHBondContact N-O 2.93Å; F87-L722 HydrophobicContact CB-CD2 4Å
723	R	93.9	Very high	82.6	Confident	70 Å²	70	68.5 Å²	68.5	26%	0.264	36%	0.357	S	S	.	.	S	Bend	trans	-121.8	160.4	175.1	-63.2	-175.7	-157.5	-108.1	0.9	109.3	C45 W237 S721 D876	C45-R723 WeakPolarHBondContact O-CD 3.3Å; C45-R723 PolarHBondContact O-NH1 2.88Å; W237-R723 PolarHBondContact O-NH2 2.85Å; S721-R723 PolarHBondContact OG-N 3.44Å; S721-R723 PolarHBondContact OG-O 3.42Å; R723-D876 IonicContact CZ-OD1 2.76Å; R723-D876 IonicContact CZ-OD2 3.16Å; R723-D876 IonicContact NH1-OD1 2.7Å; R723-D876 PolarHBondContact NH1-OD1 3.23Å; R723-D876 IonicContact NH1-OD2 3.79Å; R723-D876 PolarHBondContact NH1-OD2 3.22Å; R723-D876 VanDerWaalsContact NH2-CG 3.27Å; R723-D876 IonicContact NH2-OD1 3.31Å; R723-D876 PolarHBondContact NH2-OD1 2.96Å; R723-D876 IonicContact NH2-OD2 3.48Å; R723-D876 PolarHBondContact NH2-OD2 3.05Å
724	L	94.5	Very high	85.4	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.063	33%	0.327	C	S	.	.			trans	-103.6	148.4	170.2	-71	178.3	0	0	0	108.9	C45 F48 L76 F88 E728 I729 L732	C45-L724 PolarHBondContact SG-N 3.3Å; F48-L724 HydrophobicContact CE1-CD1 4.44Å; F48-L724 HydrophobicContact CE2-CB 4.49Å; F48-L724 HydrophobicContact CE2-CD1 3.93Å; F48-L724 HydrophobicContact CE2-CG 3.99Å; F48-L724 HydrophobicContact CZ-CD1 3.71Å; F48-L724 HydrophobicContact CZ-CG 4.27Å; L76-L724 HydrophobicContact CD1-CD1 4.24Å; L76-L724 HydrophobicContact CD1-CD2 4.44Å; F88-L724 HydrophobicContact CD1-CD2 3.81Å; F88-L724 HydrophobicContact CD2-CD2 3.88Å; F88-L724 HydrophobicContact CD2-CG 4.31Å; F88-L724 HydrophobicContact CE1-CD2 3.61Å; F88-L724 HydrophobicContact CE1-CG 4.34Å; F88-L724 HydrophobicContact CE2-CD1 4.49Å; F88-L724 HydrophobicContact CE2-CD2 3.69Å; F88-L724 HydrophobicContact CE2-CG 3.76Å; F88-L724 HydrophobicContact CG-CD2 3.95Å; F88-L724 HydrophobicContact CZ-CD1 4.1Å; F88-L724 HydrophobicContact CZ-CD2 3.56Å; F88-L724 HydrophobicContact CZ-CG 3.78Å; L724-E728 HydrophobicContact CB-CB 4.06Å; L724-E728 HydrophobicContact CD1-CB 4.49Å; L724-E728 HydrophobicContact CD2-CB 4.01Å; L724-E728 HydrophobicContact CG-CB 4.42Å; L724-I729 HydrophobicContact CB-CD1 4.33Å; L724-I729 HydrophobicContact CB-CG1 3.69Å; L724-L732 HydrophobicContact CD1-CD1 3.91Å
725	T	94.8	Very high	88.1	Confident	66 Å²	66	65.6 Å²	65.6	41%	0.405	33%	0.327	S	S	.	.			trans	-69.9	159.9	169.6	68.5	0	0	0	0	110.8	K727 E728 I729	T725-K727 PolarHBondContact O-N 3.14Å; T725-E728 WeakPolarHBondContact CA-OE2 3.46Å; T725-E728 WeakPolarHBondContact CB-OE2 3.36Å; T725-E728 VanDerWaalsContact CG2-OE2 3.26Å; T725-E728 WeakPolarHBondContact CG2-OE2 3.5Å; T725-E728 PolarHBondContact N-OE2 3.28Å; T725-E728 PolarHBondContact O-N 3.18Å; T725-E728 VanDerWaalsContact O-N 3.1Å; T725-E728 PolarHBondContact OG1-OE2 3.08Å; T725-I729 WeakPolarHBondContact O-CG1 3.31Å; T725-I729 PolarHBondContact O-N 2.75Å
726	S	95.6	Very high	89.9	Confident	42 Å²	42	65.7 Å²	65.7	29%	0.294	32%	0.316	S	S	.	.	H	α-helix	trans	-57	-19.9	176.9	-176.2	0	0	0	0	114.4	S42 Y43 D730	S42-S726 WeakPolarHBondContact CA-OG 3.33Å; Y43-S726 PolarHBondContact N-OG 3.22Å; S726-D730 PolarHBondContact O-N 2.89Å
727	K	95	Very high	91.7	Very high	179 Å²	179	62.3 Å²	62.3	78%	0.778	31%	0.305	S	S	*	.	H	α-helix	trans	-82.3	-41	176.9	-66.8	-178.8	-179.8	176.8	0	112.1	T725 I729 D730 S731	T725-K727 PolarHBondContact O-N 3.14Å; K727-I729 VanDerWaalsContact C-N 3.33Å; K727-D730 PolarHBondContact O-N 3.36Å; K727-S731 PolarHBondContact O-N 2.82Å
728	E	95.1	Very high	92.9	Very high	50 Å²	50	61.6 Å²	61.6	23%	0.234	31%	0.31	C	S	.	.	H	α-helix	trans	-69.8	-33.3	176	-65.1	161.1	114.3	0	0	111.2	L76 L724 T725 S731 L732	L76-E728 HydrophobicContact CD1-CB 3.9Å; L76-E728 HydrophobicContact CD2-CB 4.26Å; L76-E728 HydrophobicContact CD2-CG 3.98Å; L724-E728 HydrophobicContact CB-CB 4.06Å; L724-E728 HydrophobicContact CD1-CB 4.49Å; L724-E728 HydrophobicContact CD2-CB 4.01Å; L724-E728 HydrophobicContact CG-CB 4.42Å; T725-E728 WeakPolarHBondContact CA-OE2 3.46Å; T725-E728 WeakPolarHBondContact CB-OE2 3.36Å; T725-E728 VanDerWaalsContact CG2-OE2 3.26Å; T725-E728 WeakPolarHBondContact CG2-OE2 3.5Å; T725-E728 PolarHBondContact N-OE2 3.28Å; T725-E728 PolarHBondContact O-N 3.18Å; T725-E728 VanDerWaalsContact O-N 3.1Å; T725-E728 PolarHBondContact OG1-OE2 3.08Å; E728-S731 PolarHBondContact O-N 3.16Å; E728-S731 PolarHBondContact O-OG 2.99Å; E728-L732 WeakPolarHBondContact O-CG 3.28Å; E728-L732 PolarHBondContact O-N 2.66Å
729	I	96.6	Very high	93.9	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-39.3	173	-64.7	166.2	0	0	0	111.4	V35 Y43 C45 L724 T725 K727 L732 L734	V35-I729 HydrophobicContact CG1-CG2 3.63Å; V35-I729 HydrophobicContact CG2-CG2 4.43Å; Y43-I729 HydrophobicContact CD1-CG2 4.24Å; Y43-I729 HydrophobicContact CD2-CB 4.27Å; Y43-I729 HydrophobicContact CD2-CG2 3.94Å; Y43-I729 HydrophobicContact CG-CB 4.35Å; Y43-I729 HydrophobicContact CG-CG2 3.68Å; C45-I729 HydrophobicContact CB-CD1 3.79Å; L724-I729 HydrophobicContact CB-CD1 4.33Å; L724-I729 HydrophobicContact CB-CG1 3.69Å; T725-I729 WeakPolarHBondContact O-CG1 3.31Å; T725-I729 PolarHBondContact O-N 2.75Å; K727-I729 VanDerWaalsContact C-N 3.33Å; I729-L732 WeakPolarHBondContact O-CB 3.44Å; I729-L732 PolarHBondContact O-N 3.26Å; I729-L734 HydrophobicContact CG2-CD1 4.02Å
730	D	95.1	Very high	94.6	Very high	91 Å²	91	60 Å²	60	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-67.1	-38.6	179.1	-159.5	56	0	0	0	111.4	Y43 S726 K727 L732 N733	Y43-D730 HydrophobicContact CD2-CB 4.41Å; Y43-D730 HydrophobicContact CE2-CB 3.82Å; Y43-D730 WeakPolarHBondContact CE2-OD1 3.48Å; Y43-D730 PolarHBondContact OH-OD1 2.83Å; S726-D730 PolarHBondContact O-N 2.89Å; K727-D730 PolarHBondContact O-N 3.36Å; D730-L732 PolarHBondContact O-N 3.46Å; D730-N733 PolarHBondContact O-N 3.48Å
731	S	94.9	Very high	95.2	Very high	63 Å²	63	57.5 Å²	57.5	44%	0.441	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-16.2	176.4	70.7	0	0	0	0	114.4	K727 E728 N733	K727-S731 PolarHBondContact O-N 2.82Å; E728-S731 PolarHBondContact O-N 3.16Å; E728-S731 PolarHBondContact O-OG 2.99Å; S731-N733 PolarHBondContact O-N 3.25Å; S731-N733 PolarHBondContact O-ND2 3.38Å
732	L	95	Very high	95.5	Very high	9 Å²	9	57.1 Å²	57.1	5%	0.047	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-9.5	170.1	-60.4	-177.4	0	0	0	113.9	V69 V74 L76 L724 E728 I729 D730 L734 I759	V69-L732 HydrophobicContact CG2-CD2 4.12Å; V74-L732 HydrophobicContact CB-CD2 4.09Å; V74-L732 HydrophobicContact CG1-CD2 3.89Å; V74-L732 HydrophobicContact CG2-CD2 3.84Å; L76-L732 HydrophobicContact CD1-CD2 3.79Å; L76-L732 HydrophobicContact CD1-CG 4.45Å; L724-L732 HydrophobicContact CD1-CD1 3.91Å; E728-L732 WeakPolarHBondContact O-CG 3.28Å; E728-L732 PolarHBondContact O-N 2.66Å; I729-L732 WeakPolarHBondContact O-CB 3.44Å; I729-L732 PolarHBondContact O-N 3.26Å; D730-L732 PolarHBondContact O-N 3.46Å; L732-L734 VanDerWaalsContact C-N 3.28Å; L732-L734 HydrophobicContact CB-CD2 3.92Å; L732-L734 HydrophobicContact CB-CG 3.87Å; L732-L734 HydrophobicContact CD1-CD1 4.45Å; L732-L734 HydrophobicContact CD1-CD2 4.34Å; L732-L734 PolarHBondContact O-N 2.82Å; L732-I759 HydrophobicContact CD1-CD1 4.12Å
733	N	94	Very high	95.7	Very high	126 Å²	126	56 Å²	56	67%	0.674	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.9	178.4	-71	-91.1	0	0	0	113.5	D730 S731	D730-N733 PolarHBondContact O-N 3.48Å; S731-N733 PolarHBondContact O-N 3.25Å; S731-N733 PolarHBondContact O-ND2 3.38Å
734	L	96.7	Very high	95.6	Very high	26 Å²	26	52.9 Å²	52.9	14%	0.136	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-64.6	138.5	-174.5	-61.9	176.2	0	0	0	112.6	V35 V69 I729 L732 N739 I759 L761	V35-L734 HydrophobicContact CB-CD1 4.28Å; V35-L734 HydrophobicContact CG1-CD1 4.26Å; V35-L734 HydrophobicContact CG2-CD1 3.93Å; V69-L734 HydrophobicContact CG1-CD2 4.07Å; I729-L734 HydrophobicContact CG2-CD1 4.02Å; L732-L734 VanDerWaalsContact C-N 3.28Å; L732-L734 HydrophobicContact CB-CD2 3.92Å; L732-L734 HydrophobicContact CB-CG 3.87Å; L732-L734 HydrophobicContact CD1-CD1 4.45Å; L732-L734 HydrophobicContact CD1-CD2 4.34Å; L732-L734 PolarHBondContact O-N 2.82Å; L734-N739 HydrophobicContact CD2-CB 4.1Å; L734-I759 HydrophobicContact CD1-CG2 3.81Å; L734-I759 HydrophobicContact CD2-CB 4.24Å; L734-I759 HydrophobicContact CD2-CD1 4.26Å; L734-I759 HydrophobicContact CD2-CG2 4.02Å; L734-L761 HydrophobicContact CB-CB 4.38Å; L734-L761 HydrophobicContact CB-CD2 4.08Å
735	R	96.3	Very high	95.4	Very high	158 Å²	158	52.4 Å²	52.4	60%	0.596	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-93.4	148.6	174.1	-54.1	178.8	-171.4	173	6.3	109.8	G737 N739 L761	R735-G737 PolarHBondContact O-N 3.12Å; R735-N739 PolarHBondContact N-OD1 3.04Å; R735-N739 PolarHBondContact O-ND2 3.35Å; R735-L761 WeakPolarHBondContact O-CB 3.48Å
736	E	95	Very high	95	Very high	102 Å²	102	53.3 Å²	53.3	48%	0.477	28%	0.279	S	S	.	.	S	Bend	trans	-54.2	132.3	176.6	178.1	63.9	-150.2	0	0	111.2	N763 K812	E736-N763 VanDerWaalsContact CD-ND2 3.31Å; E736-N763 PolarHBondContact OE1-ND2 3.16Å; E736-N763 PolarHBondContact OE2-ND2 2.91Å; E736-K812 IonicContact OE1-NZ 2.87Å; E736-K812 PolarHBondContact OE1-NZ 2.94Å
737	G	95.3	Very high	94.1	Very high	17 Å²	17	51.4 Å²	51.4	18%	0.175	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-142	-172.6	0	0	0	0	0	113.2	R735 N739 Y760 L761	R735-G737 PolarHBondContact O-N 3.12Å; G737-N739 PolarHBondContact O-ND2 3.41Å; G737-Y760 CarbonylContact O-C 3.5Å; G737-Y760 VanDerWaalsContact O-CA 3.31Å; G737-Y760 WeakPolarHBondContact O-CA 3.05Å; G737-L761 WeakPolarHBondContact CA-O 3.41Å; G737-L761 PolarHBondContact N-O 2.78Å; G737-L761 PolarHBondContact O-N 3.03Å
738	A	96.9	Very high	92.8	Very high	53 Å²	53	51.6 Å²	51.6	44%	0.438	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115	-165.4	0	0	0	0	0	113.3	Y760	A738-Y760 HydrophobicContact CB-CD1 3.91Å; A738-Y760 HydrophobicContact CB-CE1 3.52Å
739	N	98.1	Very high	91.5	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	141.2	169.3	-58.3	-90.2	0	0	0	109.1	N70 L734 R735 G737 A758 I759	N70-N739 PolarHBondContact ND2-OD1 2.97Å; N70-N739 VanDerWaalsContact OD1-CA 3.3Å; N70-N739 WeakPolarHBondContact OD1-CA 3.32Å; N70-N739 WeakPolarHBondContact OD1-CB 3.36Å; L734-N739 HydrophobicContact CD2-CB 4.1Å; R735-N739 PolarHBondContact N-OD1 3.04Å; R735-N739 PolarHBondContact O-ND2 3.35Å; G737-N739 PolarHBondContact O-ND2 3.41Å; N739-A758 CarbonylContact O-C 3.59Å; N739-A758 WeakPolarHBondContact O-CA 3.14Å; N739-A758 WeakPolarHBondContact O-CB 3.35Å; N739-I759 HydrophobicContact CB-CB 4.39Å; N739-I759 WeakPolarHBondContact CB-O 3.48Å; N739-I759 PolarHBondContact N-O 2.9Å; N739-I759 PolarHBondContact ND2-O 3.17Å; N739-I759 VanDerWaalsContact ND2-O 3.12Å; N739-I759 PolarHBondContact O-N 3.41Å
740	K	97.5	Very high	90.2	Very high	95 Å²	95	60 Å²	60	41%	0.413	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.5	172.2	176.1	169.4	169.2	164.3	0	109.2	V69 N70 V742 E756	V69-K740 WeakPolarHBondContact CA-O 3.1Å; N70-K740 PolarHBondContact N-O 3.05Å; N70-K740 PolarHBondContact OD1-N 3.39Å; K740-V742 HydrophobicContact CD-CG2 4.48Å; K740-V742 HydrophobicContact CG-CG2 4.39Å; K740-E756 VanDerWaalsContact CE-CD 3.42Å; K740-E756 WeakPolarHBondContact CE-OE1 3.41Å; K740-E756 VanDerWaalsContact CE-OE2 3.24Å; K740-E756 WeakPolarHBondContact CE-OE2 3.37Å; K740-E756 IonicContact NZ-OE1 2.67Å; K740-E756 PolarHBondContact NZ-OE1 3.19Å; K740-E756 IonicContact NZ-OE2 3.64Å; K740-E756 PolarHBondContact NZ-OE2 3.41Å
741	V	97.3	Very high	89.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.2	167.8	61.9	0	0	0	0	110.4	I67 E68 V69 F743 A757 I759	I67-V741 HydrophobicContact CG2-CG2 3.7Å; E68-V741 CarbonylContact O-C 3.57Å; E68-V741 WeakPolarHBondContact O-CA 3.02Å; V69-V741 HydrophobicContact CG2-CB 4.47Å; V69-V741 HydrophobicContact CG2-CG2 4.08Å; V741-F743 HydrophobicContact CB-CE2 4.35Å; V741-F743 HydrophobicContact CB-CZ 4.37Å; V741-F743 HydrophobicContact CG1-CE2 3.67Å; V741-F743 HydrophobicContact CG1-CZ 3.88Å; V741-F743 HydrophobicContact CG2-CD2 4.39Å; V741-F743 HydrophobicContact CG2-CE1 3.95Å; V741-F743 HydrophobicContact CG2-CE2 3.78Å; V741-F743 HydrophobicContact CG2-CZ 3.52Å; V741-A757 HydrophobicContact CG1-CB 3.92Å; V741-A757 WeakPolarHBondContact CG1-O 3.21Å; V741-A757 PolarHBondContact N-O 3.35Å; V741-A757 PolarHBondContact O-N 3.15Å; V741-A757 VanDerWaalsContact O-O 3.07Å; V741-I759 HydrophobicContact CB-CD1 3.99Å; V741-I759 HydrophobicContact CB-CG1 4.02Å; V741-I759 HydrophobicContact CG1-CD1 4.18Å; V741-I759 HydrophobicContact CG1-CG1 3.75Å; V741-I759 HydrophobicContact CG2-CD1 4.27Å
742	V	96.6	Very high	88.9	Confident	9 Å²	9	58.2 Å²	58.2	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.3	173	-172.5	0	0	0	0	108.3	E68 K740 R754 C755 E756	E68-V742 HydrophobicContact CB-CB 4.24Å; E68-V742 PolarHBondContact N-O 3.09Å; E68-V742 PolarHBondContact O-N 2.84Å; K740-V742 HydrophobicContact CD-CG2 4.48Å; K740-V742 HydrophobicContact CG-CG2 4.39Å; V742-R754 HydrophobicContact CG1-CB 4.16Å; V742-R754 HydrophobicContact CG1-CG 4.03Å; V742-C755 CarbonylContact C-O 3.53Å; V742-C755 WeakPolarHBondContact CA-O 3.37Å; V742-E756 HydrophobicContact CG2-CG 4.21Å
743	F	95	Very high	88.5	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.1	173.8	-53.6	-88.1	0	0	0	108.4	F48 V50 F52 V65 D66 I67 M78 V741 R754 C755 A757	F48-F743 HydrophobicContact CD1-CE1 4.23Å; F48-F743 HydrophobicContact CD1-CZ 4.01Å; F48-F743 HydrophobicContact CE1-CZ 4.43Å; V50-F743 HydrophobicContact CG1-CB 4.06Å; V50-F743 HydrophobicContact CG1-CD1 4.4Å; V50-F743 HydrophobicContact CG1-CD2 3.94Å; V50-F743 HydrophobicContact CG1-CG 3.87Å; V50-F743 HydrophobicContact CG2-CD1 4.15Å; V50-F743 HydrophobicContact CG2-CD2 3.76Å; V50-F743 HydrophobicContact CG2-CE1 3.92Å; V50-F743 HydrophobicContact CG2-CE2 3.49Å; V50-F743 VanDerWaalsContact CG2-CE2 3.49Å; V50-F743 HydrophobicContact CG2-CG 4.09Å; V50-F743 HydrophobicContact CG2-CZ 3.58Å; F52-F743 HydrophobicContact CE2-CB 4.38Å; F52-F743 HydrophobicContact CZ-CB 3.81Å; V65-F743 HydrophobicContact CG1-CB 3.89Å; D66-F743 WeakPolarHBondContact O-CA 3.42Å; I67-F743 HydrophobicContact CD1-CD1 4.43Å; I67-F743 HydrophobicContact CD1-CE1 4.24Å; I67-F743 HydrophobicContact CG1-CD1 4.02Å; I67-F743 HydrophobicContact CG1-CE1 4.26Å; I67-F743 HydrophobicContact CG2-CD1 4.36Å; I67-F743 HydrophobicContact CG2-CE1 4.18Å; M78-F743 HydrophobicContact SD-CD1 3.79Å; M78-F743 HydrophobicContact SD-CE1 3.83Å; V741-F743 HydrophobicContact CB-CE2 4.35Å; V741-F743 HydrophobicContact CB-CZ 4.37Å; V741-F743 HydrophobicContact CG1-CE2 3.67Å; V741-F743 HydrophobicContact CG1-CZ 3.88Å; V741-F743 HydrophobicContact CG2-CD2 4.39Å; V741-F743 HydrophobicContact CG2-CE1 3.95Å; V741-F743 HydrophobicContact CG2-CE2 3.78Å; V741-F743 HydrophobicContact CG2-CZ 3.52Å; F743-R754 CarbonylContact O-C 3.51Å; F743-R754 WeakPolarHBondContact O-CA 3.28Å; F743-C755 HydrophobicContact CB-CB 4.33Å; F743-C755 PolarHBondContact N-O 2.89Å; F743-C755 PolarHBondContact O-N 3.03Å; F743-A757 HydrophobicContact CE2-CB 4.38Å
744	S	92.9	Very high	88.3	Confident	5 Å²	5	60.1 Å²	60.1	4%	0.035	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.8	178.5	46.3	0	0	0	0	112.8	V65 D66 C753	V65-S744 CarbonylContact C-O 3.52Å; V65-S744 VanDerWaalsContact CA-O 3.24Å; V65-S744 WeakPolarHBondContact CA-O 3.48Å; V65-S744 WeakPolarHBondContact CG1-O 3.3Å; D66-S744 WeakPolarHBondContact CB-OG 3.34Å; D66-S744 PolarHBondContact N-O 2.94Å; D66-S744 PolarHBondContact O-N 3.14Å; D66-S744 WeakPolarHBondContact OD2-CB 3.44Å; D66-S744 PolarHBondContact OD2-OG 2.89Å; S744-C753 CarbonylContact C-O 3.59Å; S744-C753 WeakPolarHBondContact CA-O 3.38Å
745	V	89.9	Confident	88	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116	168.2	174.1	0	0	0	0	108.6	F52 V57 K63 V65 L80 T752 C753	F52-V745 HydrophobicContact CD1-CB 4.35Å; F52-V745 HydrophobicContact CD1-CG2 4.1Å; F52-V745 HydrophobicContact CD2-CG2 3.91Å; F52-V745 HydrophobicContact CE1-CB 4.23Å; F52-V745 HydrophobicContact CE1-CG2 3.88Å; F52-V745 HydrophobicContact CE2-CG2 3.68Å; F52-V745 HydrophobicContact CG-CG2 4.12Å; F52-V745 HydrophobicContact CZ-CB 4.47Å; F52-V745 HydrophobicContact CZ-CG2 3.66Å; V57-V745 HydrophobicContact CG1-CG1 3.94Å; V57-V745 HydrophobicContact CG2-CB 4.37Å; V57-V745 HydrophobicContact CG2-CG1 4.02Å; K63-V745 HydrophobicContact CB-CG1 4.2Å; K63-V745 HydrophobicContact CD-CG1 3.97Å; V65-V745 HydrophobicContact CB-CG2 4.16Å; V65-V745 HydrophobicContact CG1-CG2 4.08Å; V65-V745 HydrophobicContact CG2-CG2 3.73Å; L80-V745 HydrophobicContact CD2-CG1 4.25Å; L80-V745 HydrophobicContact CD2-CG2 4.44Å; V745-T752 WeakPolarHBondContact O-CA 3.47Å; V745-C753 PolarHBondContact N-O 3.05Å; V745-C753 PolarHBondContact O-N 3.08Å
746	T	85.3	Confident	87.8	Confident	86 Å²	86	56.6 Å²	56.6	53%	0.528	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	130.9	176.1	-61.6	0	0	0	0	111.2	T752	T746-T752 WeakPolarHBondContact OG1-CG2 3.11Å; T746-T752 PolarHBondContact OG1-OG1 3.42Å
747	S	76.9	Confident	87.9	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.014	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.9	-173.2	-171.3	0	0	0	0	110.5	K63 Y749 Q750 G751	K63-S747 PolarHBondContact NZ-OG 2.85Å; S747-Y749 PolarHBondContact O-N 3.44Å; S747-Q750 PolarHBondContact O-N 2.95Å; S747-G751 PolarHBondContact N-O 2.82Å; S747-G751 PolarHBondContact O-N 3.39Å
748	Q	69.3	Low	88	Confident	182 Å²	182	52.1 Å²	52.1	85%	0.85	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-30.5	-174	-67.2	177.6	-9.8	0	0	115.3
749	Y	67	Low	88	Confident	154 Å²	154	49.6 Å²	49.6	60%	0.604	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-5.5	-177.7	-59.4	-68.8	0	0	0	114.5	S747	S747-Y749 PolarHBondContact O-N 3.44Å
750	Q	68.2	Low	88	Confident	77 Å²	77	50.5 Å²	50.5	36%	0.36	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.5	-0.2	-167.3	-56.6	-171.8	-80	0	0	114.5	L55 G56 L58 S747	L55-Q750 PolarHBondContact O-NE2 3.14Å; G56-Q750 PolarHBondContact O-OE1 3.18Å; L58-Q750 HydrophobicContact CD1-CG 4.42Å; S747-Q750 PolarHBondContact O-N 2.95Å
751	G	79.1	Confident	88.1	Confident	42 Å²	42	46.6 Å²	46.6	43%	0.433	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	73.6	-156.7	-174.1	0	0	0	0	0	112.3	S747	S747-G751 PolarHBondContact N-O 2.82Å; S747-G751 PolarHBondContact O-N 3.39Å
752	T	85	Confident	88	Confident	74 Å²	74	46.9 Å²	46.9	45%	0.454	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	115.5	-178.4	-52	0	0	0	0	110.6	V745 T746 R754	V745-T752 WeakPolarHBondContact O-CA 3.47Å; T746-T752 WeakPolarHBondContact OG1-CG2 3.11Å; T746-T752 PolarHBondContact OG1-OG1 3.42Å; T752-R754 HydrophobicContact CG2-CG 4.35Å
753	C	86.1	Confident	87.9	Confident	27 Å²	27	48.3 Å²	48.3	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.7	168.2	-165.5	0	0	0	0	108.7	F52 V57 S744 V745	F52-C753 HydrophobicContact CD1-CB 4.14Å; V57-C753 HydrophobicContact CG2-CB 4.43Å; S744-C753 CarbonylContact C-O 3.59Å; S744-C753 WeakPolarHBondContact CA-O 3.38Å; V745-C753 PolarHBondContact N-O 3.05Å; V745-C753 PolarHBondContact O-N 3.08Å
754	R	89.9	Confident	87.8	Confident	147 Å²	147	52.1 Å²	52.1	56%	0.555	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.2	178.5	-83	179.3	163.3	166.8	-7.3	111.4	E68 V742 F743 T752	E68-R754 IonicContact OE1-CZ 3.27Å; E68-R754 IonicContact OE1-NE 3.84Å; E68-R754 IonicContact OE1-NH2 3.77Å; E68-R754 PolarHBondContact OE1-NH2 2.81Å; E68-R754 IonicContact OE2-NH2 3.56Å; V742-R754 HydrophobicContact CG1-CB 4.16Å; V742-R754 HydrophobicContact CG1-CG 4.03Å; F743-R754 CarbonylContact O-C 3.51Å; F743-R754 WeakPolarHBondContact O-CA 3.28Å; T752-R754 HydrophobicContact CG2-CG 4.35Å
755	C	89.9	Confident	87.8	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.034	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.1	177.1	-171.3	0	0	0	0	109.4	T28 G29 G30 F52 V742 F743	T28-C755 HydrophobicContact CG2-CB 3.56Å; G29-C755 VanDerWaalsContact CA-SG 3.57Å; G30-C755 PolarHBondContact N-SG 2.79Å; G30-C755 VanDerWaalsContact N-SG 3.39Å; F52-C755 HydrophobicContact CE1-CB 4.05Å; F52-C755 HydrophobicContact CZ-CB 4.15Å; V742-C755 CarbonylContact C-O 3.53Å; V742-C755 WeakPolarHBondContact CA-O 3.37Å; F743-C755 HydrophobicContact CB-CB 4.33Å; F743-C755 PolarHBondContact N-O 2.89Å; F743-C755 PolarHBondContact O-N 3.03Å
756	E	93.1	Very high	87.9	Confident	106 Å²	106	56.8 Å²	56.8	50%	0.495	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.6	-179.6	-53.5	-157.8	162.7	0	0	112.7	K740 V742	K740-E756 VanDerWaalsContact CE-CD 3.42Å; K740-E756 WeakPolarHBondContact CE-OE1 3.41Å; K740-E756 VanDerWaalsContact CE-OE2 3.24Å; K740-E756 WeakPolarHBondContact CE-OE2 3.37Å; K740-E756 IonicContact NZ-OE1 2.67Å; K740-E756 PolarHBondContact NZ-OE1 3.19Å; K740-E756 IonicContact NZ-OE2 3.64Å; K740-E756 PolarHBondContact NZ-OE2 3.41Å; V742-E756 HydrophobicContact CG2-CG 4.21Å
757	A	95.8	Very high	88.4	Confident	9 Å²	9	56.9 Å²	56.9	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	-175.8	169.2	0	0	0	0	0	110.4	V741 F743	V741-A757 HydrophobicContact CG1-CB 3.92Å; V741-A757 WeakPolarHBondContact CG1-O 3.21Å; V741-A757 PolarHBondContact N-O 3.35Å; V741-A757 PolarHBondContact O-N 3.15Å; V741-A757 VanDerWaalsContact O-O 3.07Å; F743-A757 HydrophobicContact CE2-CB 4.38Å
758	A	97.5	Very high	89.4	Confident	16 Å²	16	56.8 Å²	56.8	13%	0.132	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.2	170.9	0	0	0	0	0	111.8	D32 V33 N739 Y760	D32-A758 CarbonylContact C-O 3.59Å; D32-A758 WeakPolarHBondContact CA-O 3.18Å; D32-A758 WeakPolarHBondContact CB-O 3.45Å; D32-A758 PolarHBondContact OD1-N 3.33Å; V33-A758 PolarHBondContact N-O 3.3Å; N739-A758 CarbonylContact O-C 3.59Å; N739-A758 WeakPolarHBondContact O-CA 3.14Å; N739-A758 WeakPolarHBondContact O-CB 3.35Å; A758-Y760 HydrophobicContact CB-CD2 4.13Å; A758-Y760 HydrophobicContact CB-CE2 3.61Å
759	I	98.4	Very high	90.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.3	170.5	-52	177	0	0	0	107.2	V33 V35 F48 V69 L732 L734 N739 V741	V33-I759 HydrophobicContact CB-CG1 4.31Å; V33-I759 HydrophobicContact CB-CG2 4.33Å; V33-I759 HydrophobicContact CG1-CG2 4.32Å; V33-I759 WeakPolarHBondContact O-CA 3.37Å; V35-I759 HydrophobicContact CG2-CG2 3.59Å; F48-I759 HydrophobicContact CE1-CD1 4.07Å; F48-I759 HydrophobicContact CZ-CD1 4.26Å; V69-I759 HydrophobicContact CG2-CD1 4.37Å; L732-I759 HydrophobicContact CD1-CD1 4.12Å; L734-I759 HydrophobicContact CD1-CG2 3.81Å; L734-I759 HydrophobicContact CD2-CB 4.24Å; L734-I759 HydrophobicContact CD2-CD1 4.26Å; L734-I759 HydrophobicContact CD2-CG2 4.02Å; N739-I759 HydrophobicContact CB-CB 4.39Å; N739-I759 WeakPolarHBondContact CB-O 3.48Å; N739-I759 PolarHBondContact N-O 2.9Å; N739-I759 PolarHBondContact ND2-O 3.17Å; N739-I759 VanDerWaalsContact ND2-O 3.12Å; N739-I759 PolarHBondContact O-N 3.41Å; V741-I759 HydrophobicContact CB-CD1 3.99Å; V741-I759 HydrophobicContact CB-CG1 4.02Å; V741-I759 HydrophobicContact CG1-CD1 4.18Å; V741-I759 HydrophobicContact CG1-CG1 3.75Å; V741-I759 HydrophobicContact CG2-CD1 4.27Å
760	Y	98.4	Very high	92.3	Very high	22 Å²	22	40.8 Å²	40.8	9%	0.086	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	108.7	179.4	-74.2	-97.4	0	0	0	110.1	D32 V33 V35 G737 A738 A758 G844 P845	D32-Y760 HydrophobicContact CB-CD2 4.34Å; D32-Y760 HydrophobicContact CB-CE2 4.18Å; V33-Y760 PolarHBondContact O-N 3.3Å; V35-Y760 PolarHBondContact N-O 2.96Å; G737-Y760 CarbonylContact O-C 3.5Å; G737-Y760 VanDerWaalsContact O-CA 3.31Å; G737-Y760 WeakPolarHBondContact O-CA 3.05Å; A738-Y760 HydrophobicContact CB-CD1 3.91Å; A738-Y760 HydrophobicContact CB-CE1 3.52Å; A758-Y760 HydrophobicContact CB-CD2 4.13Å; A758-Y760 HydrophobicContact CB-CE2 3.61Å; Y760-G844 VanDerWaalsContact OH-C 3.23Å; Y760-G844 PolarHBondContact OH-N 3.16Å; Y760-G844 PolarHBondContact OH-O 2.93Å; Y760-G844 VanDerWaalsContact OH-O 3.05Å; Y760-P845 HydrophobicContact CD2-CB 3.59Å; Y760-P845 HydrophobicContact CD2-CG 4.06Å; Y760-P845 VanDerWaalsContact CE2-CA 3.44Å; Y760-P845 HydrophobicContact CE2-CB 3.84Å; Y760-P845 HydrophobicContact CE2-CG 4.45Å; Y760-P845 HydrophobicContact CG-CB 4.21Å; Y760-P845 HydrophobicContact CG-CG 4.17Å
761	L	97.9	Very high	93.7	Very high	13 Å²	13	37.1 Å²	37.1	7%	0.068	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	122.5	167.9	-178	62.7	0	0	0	109.1	V35 R37 Y43 L734 R735 G737	V35-L761 HydrophobicContact CB-CD1 4.12Å; V35-L761 HydrophobicContact CG1-CD1 3.68Å; V35-L761 WeakPolarHBondContact O-CA 3.4Å; R37-L761 HydrophobicContact CB-CD1 4.37Å; Y43-L761 HydrophobicContact CD1-CD1 4.1Å; Y43-L761 HydrophobicContact CE1-CD1 4.12Å; L734-L761 HydrophobicContact CB-CB 4.38Å; L734-L761 HydrophobicContact CB-CD2 4.08Å; R735-L761 WeakPolarHBondContact O-CB 3.48Å; G737-L761 WeakPolarHBondContact CA-O 3.41Å; G737-L761 PolarHBondContact N-O 2.78Å; G737-L761 PolarHBondContact O-N 3.03Å
762	W	96.8	Very high	94.4	Very high	6 Å²	6	35.4 Å²	35.4	2%	0.023	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	164.2	176.1	-70	-17.5	0	0	0	110	I34 V35 V36 R37 V768 K812 L814 P845 F881	I34-W762 HydrophobicContact CD1-CH2 4.43Å; I34-W762 HydrophobicContact CD1-CZ3 4.04Å; I34-W762 HydrophobicContact CG2-CD2 4.23Å; I34-W762 HydrophobicContact CG2-CE3 3.52Å; I34-W762 HydrophobicContact CG2-CZ3 3.84Å; V35-W762 PolarHBondContact O-N 3.22Å; V36-W762 WeakPolarHBondContact CA-O 3.36Å; R37-W762 PolarHBondContact N-O 3.4Å; W762-V768 HydrophobicContact CE3-CG2 4.26Å; W762-V768 HydrophobicContact CH2-CG1 4.38Å; W762-V768 HydrophobicContact CH2-CG2 4.41Å; W762-V768 HydrophobicContact CZ3-CG1 4.36Å; W762-V768 HydrophobicContact CZ3-CG2 3.84Å; W762-K812 HydrophobicContact CD2-CB 4.48Å; W762-K812 HydrophobicContact CD2-CG 4.34Å; W762-K812 HydrophobicContact CG-CG 4.48Å; W762-K812 HydrophobicContact CH2-CB 4.22Å; W762-K812 HydrophobicContact CZ2-CB 3.72Å; W762-K812 HydrophobicContact CZ2-CG 4.38Å; W762-L814 HydrophobicContact CH2-CB 4.46Å; W762-P845 HydrophobicContact CH2-CG 3.58Å; W762-P845 VanDerWaalsContact CZ2-CD 3.43Å; W762-P845 HydrophobicContact CZ2-CG 3.76Å; W762-P845 HydrophobicContact CZ3-CG 4.4Å; W762-F881 AromaticContact CE3-CZ 3.95Å; W762-F881 HydrophobicContact CE3-CZ 3.95Å; W762-F881 HydrophobicContact CZ3-CZ 4.48Å
763	N	93.9	Very high	94.7	Very high	39 Å²	39	31.9 Å²	31.9	21%	0.209	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	148.1	176.7	-67.9	-89.6	0	0	0	110.8	E736 N765 D766	E736-N763 VanDerWaalsContact CD-ND2 3.31Å; E736-N763 PolarHBondContact OE1-ND2 3.16Å; E736-N763 PolarHBondContact OE2-ND2 2.91Å; N763-N765 WeakPolarHBondContact CB-OD1 3.45Å; N763-N765 PolarHBondContact O-N 2.99Å; N763-D766 PolarHBondContact N-OD2 3.08Å; N763-D766 WeakPolarHBondContact O-CB 3.48Å; N763-D766 PolarHBondContact O-N 2.6Å
764	W	93.5	Very high	94.8	Very high	81 Å²	81	31.3 Å²	31.3	31%	0.307	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-15	176.3	69	-73.2	0	0	0	115.6	V36 R37 P39 K885	V36-W764 HydrophobicContact CG1-CB 4.28Å; R37-W764 WeakPolarHBondContact O-CB 3.39Å; R37-W764 PolarHBondContact O-N 2.87Å; P39-W764 HydrophobicContact CB-CD2 4.49Å; P39-W764 HydrophobicContact CG-CD2 3.58Å; P39-W764 HydrophobicContact CG-CE3 3.61Å; P39-W764 HydrophobicContact CG-CG 3.95Å; P39-W764 HydrophobicContact CG-CZ2 4.5Å; P39-W764 HydrophobicContact CG-CZ3 4.12Å; W764-K885 HydrophobicContact CE3-CD 4.34Å; W764-K885 VanDerWaalsContact CZ3-CE 3.45Å; W764-K885 VanDerWaalsContact O-CD 3.31Å; W764-K885 WeakPolarHBondContact O-CD 3.36Å; W764-K885 PolarHBondContact O-NZ 3.05Å
765	N	91.3	Very high	94.8	Very high	80 Å²	80	24.4 Å²	24.4	43%	0.428	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-3.8	178.2	66.5	-22.2	0	0	0	114.7	N763	N763-N765 WeakPolarHBondContact CB-OD1 3.45Å; N763-N765 PolarHBondContact O-N 2.99Å
766	D	93.7	Very high	94.9	Very high	24 Å²	24	24.2 Å²	24.2	13%	0.128	12%	0.115	C	C	.	.			trans	-63.3	146.9	177.6	-79.3	-47.9	0	0	0	112.5	N763 K812 F881	N763-D766 PolarHBondContact N-OD2 3.08Å; N763-D766 WeakPolarHBondContact O-CB 3.48Å; N763-D766 PolarHBondContact O-N 2.6Å; D766-K812 HydrophobicContact CB-CG 3.98Å; D766-K812 WeakPolarHBondContact OD1-CE 3.42Å; D766-K812 IonicContact OD1-NZ 2.56Å; D766-K812 PolarHBondContact OD1-NZ 2.87Å; D766-K812 WeakPolarHBondContact OD2-CE 3.27Å; D766-K812 IonicContact OD2-NZ 3.79Å; D766-K812 PolarHBondContact OD2-NZ 3.26Å; D766-F881 HydrophobicContact CB-CE1 4.38Å
767	R	94.7	Very high	94.8	Very high	89 Å²	89	19.1 Å²	19.1	34%	0.336	9%	0.092	S	C	.	.			trans	-106	124.2	176.3	-67.5	-174.9	177.8	178.2	-0.9	110.3	Y811 K812	R767-Y811 HydrophobicContact CB-CD1 3.57Å; R767-Y811 HydrophobicContact CB-CE1 3.75Å; R767-Y811 HydrophobicContact CG-CE1 4.41Å; R767-Y811 WeakPolarHBondContact O-CA 3.18Å; R767-K812 PolarHBondContact O-N 3.32Å
768	V	97.4	Very high	94.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.7	-171.5	-177.8	0	0	0	0	110.8	W762 K812 L814 F881 P887 F888 Y889	W762-V768 HydrophobicContact CE3-CG2 4.26Å; W762-V768 HydrophobicContact CH2-CG1 4.38Å; W762-V768 HydrophobicContact CH2-CG2 4.41Å; W762-V768 HydrophobicContact CZ3-CG1 4.36Å; W762-V768 HydrophobicContact CZ3-CG2 3.84Å; V768-K812 CarbonylContact C-O 3.54Å; V768-K812 WeakPolarHBondContact CA-O 3.36Å; V768-L814 HydrophobicContact CG1-CB 3.52Å; V768-L814 HydrophobicContact CG1-CD2 4.16Å; V768-L814 HydrophobicContact CG1-CG 4.49Å; V768-F881 HydrophobicContact CG2-CE1 4.49Å; V768-F881 HydrophobicContact CG2-CE2 4.46Å; V768-F881 HydrophobicContact CG2-CZ 3.81Å; V768-P887 HydrophobicContact CG2-CB 4.42Å; V768-P887 PolarHBondContact N-O 3.05Å; V768-F888 HydrophobicContact CB-CD1 3.97Å; V768-F888 HydrophobicContact CB-CE1 4.44Å; V768-F888 HydrophobicContact CG1-CD1 3.91Å; V768-F888 HydrophobicContact CG1-CE1 4.09Å; V768-F888 CarbonylContact O-C 3.59Å; V768-F888 WeakPolarHBondContact O-CA 3.22Å; V768-Y889 PolarHBondContact O-N 3.33Å
769	I	98.4	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.7	171.6	-52.6	-67.4	0	0	0	107.9	I806 Y811 K812 F813 L814 Y889 A890 F892 F944	I769-I806 HydrophobicContact CD1-CG2 4.01Å; I769-I806 HydrophobicContact CG1-CG2 3.8Å; I769-Y811 HydrophobicContact CD1-CD1 3.82Å; I769-Y811 HydrophobicContact CD1-CG 4.23Å; I769-Y811 HydrophobicContact CG1-CD1 4.26Å; I769-Y811 HydrophobicContact CG1-CG 4.34Å; I769-K812 PolarHBondContact N-O 2.95Å; I769-F813 HydrophobicContact CB-CD1 4.11Å; I769-F813 HydrophobicContact CB-CE1 3.93Å; I769-F813 HydrophobicContact CB-CE2 4.37Å; I769-F813 HydrophobicContact CB-CG 4.41Å; I769-F813 HydrophobicContact CB-CZ 4.07Å; I769-F813 HydrophobicContact CG1-CE2 4.26Å; I769-F813 HydrophobicContact CG1-CZ 4.2Å; I769-F813 HydrophobicContact CG2-CD1 4.13Å; I769-F813 HydrophobicContact CG2-CE1 3.6Å; I769-F813 HydrophobicContact CG2-CZ 3.93Å; I769-L814 PolarHBondContact O-N 3.33Å; I769-Y889 HydrophobicContact CD1-CD1 4.1Å; I769-A890 HydrophobicContact CD1-CB 3.88Å; I769-F892 HydrophobicContact CG2-CD2 3.88Å; I769-F892 HydrophobicContact CG2-CE2 3.78Å; I769-F944 HydrophobicContact CD1-CD1 3.95Å; I769-F944 HydrophobicContact CD1-CE1 3.87Å
770	I	98.4	Very high	92.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138	174.6	-54.2	160.6	0	0	0	109.1	L814 L874 F888 A890 A891 F892 Y902 V905 V907	I770-L814 CarbonylContact C-O 3.6Å; I770-L814 WeakPolarHBondContact CA-O 3.48Å; I770-L814 HydrophobicContact CG1-CD2 4.46Å; I770-L874 HydrophobicContact CD1-CD1 4.12Å; I770-L874 HydrophobicContact CD1-CD2 3.99Å; I770-L874 HydrophobicContact CG1-CD2 4.13Å; I770-L874 HydrophobicContact CG2-CD1 4.41Å; I770-L874 HydrophobicContact CG2-CD2 4.16Å; I770-F888 HydrophobicContact CD1-CB 4.02Å; I770-F888 HydrophobicContact CD1-CD1 3.67Å; I770-F888 HydrophobicContact CD1-CD2 3.99Å; I770-F888 HydrophobicContact CD1-CE1 4.08Å; I770-F888 HydrophobicContact CD1-CE2 4.34Å; I770-F888 HydrophobicContact CD1-CG 3.64Å; I770-F888 HydrophobicContact CD1-CZ 4.39Å; I770-F888 HydrophobicContact CG1-CD1 3.66Å; I770-F888 HydrophobicContact CG1-CE1 4.02Å; I770-F888 HydrophobicContact CG1-CG 4.14Å; I770-A890 PolarHBondContact N-O 3.49Å; I770-A891 HydrophobicContact CB-CB 3.98Å; I770-A891 HydrophobicContact CD1-CB 4.33Å; I770-A891 CarbonylContact O-C 3.53Å; I770-A891 WeakPolarHBondContact O-CA 3.41Å; I770-F892 PolarHBondContact O-N 2.69Å; I770-Y902 HydrophobicContact CB-CE1 4.3Å; I770-Y902 HydrophobicContact CD1-CD1 4.04Å; I770-Y902 HydrophobicContact CD1-CE1 4.41Å; I770-Y902 HydrophobicContact CG2-CD1 4.28Å; I770-Y902 HydrophobicContact CG2-CE1 3.56Å; I770-V905 HydrophobicContact CD1-CG2 4.44Å; I770-V907 HydrophobicContact CD1-CG2 4.11Å
771	S	97.8	Very high	90.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130	166.3	-174.4	0	0	0	0	109.4	Y803 L814 Y815 C816 F892	S771-Y803 PolarHBondContact OG-OH 3.12Å; S771-L814 PolarHBondContact N-O 3.41Å; S771-Y815 CarbonylContact O-C 3.55Å; S771-Y815 WeakPolarHBondContact O-CA 3.34Å; S771-C816 PolarHBondContact O-N 3.24Å; S771-F892 WeakPolarHBondContact CA-O 3.44Å
772	D	94.9	Very high	88.5	Confident	6 Å²	6	26.5 Å²	26.5	3%	0.032	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	160	153.5	-159.5	-15.2	0	0	0	109.5	D774 T776 I777 C816 K870 F892	D772-D774 PolarHBondContact OD1-N 3.36Å; D772-T776 WeakPolarHBondContact O-CB 3.32Å; D772-I777 WeakPolarHBondContact O-CG1 3.24Å; D772-C816 WeakPolarHBondContact CA-O 3.22Å; D772-K870 IonicContact OD2-NZ 3.45Å; D772-K870 PolarHBondContact OD2-NZ 3.27Å; D772-F892 PolarHBondContact N-O 3.48Å
773	I	91.9	Very high	86.3	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.			trans	-100.1	-47.9	174.1	-58.2	170.5	0	0	0	109.8	G775 I777 T778 C816 T827 Y830 L831 V846	I773-G775 PolarHBondContact O-N 2.79Å; I773-I777 HydrophobicContact CB-CD1 4.48Å; I773-I777 HydrophobicContact CG1-CD1 4.22Å; I773-I777 PolarHBondContact O-N 2.96Å; I773-T778 PolarHBondContact O-N 3.04Å; I773-T778 VanDerWaalsContact O-N 3.07Å; I773-C816 PolarHBondContact N-O 2.97Å; I773-C816 VanDerWaalsContact N-O 3.14Å; I773-T827 HydrophobicContact CD1-CG2 3.6Å; I773-Y830 HydrophobicContact CG2-CE1 4.45Å; I773-L831 HydrophobicContact CD1-CD1 3.9Å; I773-L831 HydrophobicContact CG1-CD1 4.43Å; I773-L831 HydrophobicContact CG1-CD2 4.41Å; I773-L831 HydrophobicContact CG2-CD2 4.3Å; I773-V846 HydrophobicContact CD1-CG1 3.89Å
774	D	88.2	Confident	84.3	Confident	14 Å²	14	27.2 Å²	27.2	8%	0.075	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	121.3	-170	-71.1	-66.1	0	0	0	110.5	D772 T776 S817 R819 N894	D772-D774 PolarHBondContact OD1-N 3.36Å; D774-T776 PolarHBondContact O-N 3.09Å; D774-S817 WeakPolarHBondContact OD2-CB 3.42Å; D774-S817 PolarHBondContact OD2-OG 3.49Å; D774-R819 IonicContact OD1-CZ 2.67Å; D774-R819 VanDerWaalsContact OD1-CZ 3.27Å; D774-R819 IonicContact OD1-NE 3.23Å; D774-R819 PolarHBondContact OD1-NE 3.47Å; D774-R819 IonicContact OD1-NH2 2.66Å; D774-R819 PolarHBondContact OD1-NH2 2.89Å; D774-R819 IonicContact OD2-CZ 3.18Å; D774-R819 IonicContact OD2-NE 2.73Å; D774-R819 PolarHBondContact OD2-NE 2.76Å; D774-R819 IonicContact OD2-NH2 2.79Å; D774-N894 PolarHBondContact O-ND2 3.02Å; D774-N894 PolarHBondContact O-OD1 3.22Å; D774-N894 VanDerWaalsContact O-OD1 3.13Å
775	G	88.1	Confident	82.3	Confident	3 Å²	3	27.2 Å²	27.2	3%	0.031	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	-5	-175.6	0	0	0	0	0	115.2	I773 T778 N894 V915	I773-G775 PolarHBondContact O-N 2.79Å; G775-T778 CarbonylContact C-O 3.59Å; G775-T778 WeakPolarHBondContact CA-O 3.37Å; G775-T778 PolarHBondContact N-O 3.09Å; G775-T778 PolarHBondContact N-OG1 2.96Å; G775-N894 VanDerWaalsContact O-CB 3.31Å; G775-N894 WeakPolarHBondContact O-CB 3.35Å; G775-V915 WeakPolarHBondContact O-CG1 3.37Å
776	T	92.6	Very high	80.5	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-49	178.8	-61.3	0	0	0	0	112.5	D772 D774 T778 H796 I799 F892 G893 N894 V915 Y933	D772-T776 WeakPolarHBondContact O-CB 3.32Å; D774-T776 PolarHBondContact O-N 3.09Å; T776-T778 PolarHBondContact N-O 3.07Å; T776-H796 PolarHBondContact O-CD2 3.35Å; T776-I799 WeakPolarHBondContact O-CD1 3.46Å; T776-F892 HydrophobicContact CG2-CB 4.04Å; T776-G893 VanDerWaalsContact OG1-CA 3.22Å; T776-G893 WeakPolarHBondContact OG1-CA 3.47Å; T776-N894 WeakPolarHBondContact OG1-CB 3.2Å; T776-N894 PolarHBondContact OG1-N 3.45Å; T776-N894 VanDerWaalsContact OG1-N 3.17Å; T776-N894 PolarHBondContact OG1-OD1 2.9Å; T776-V915 HydrophobicContact CG2-CG1 4.35Å; T776-Y933 PolarHBondContact O-OH 3.1Å
777	I	92.2	Very high	78.7	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-49.2	169.5	-59.7	176.6	0	0	0	108.5	D772 I773 T795 H796 I799 Y815 Y830 L831 L841	D772-I777 WeakPolarHBondContact O-CG1 3.24Å; I773-I777 HydrophobicContact CB-CD1 4.48Å; I773-I777 HydrophobicContact CG1-CD1 4.22Å; I773-I777 PolarHBondContact O-N 2.96Å; I777-T795 HydrophobicContact CG2-CG2 3.98Å; I777-T795 VanDerWaalsContact O-CA 3.29Å; I777-T795 WeakPolarHBondContact O-CA 3.43Å; I777-T795 WeakPolarHBondContact O-CG2 3.43Å; I777-H796 PolarHBondContact O-N 3.27Å; I777-I799 HydrophobicContact CB-CD1 4.27Å; I777-I799 HydrophobicContact CG1-CD1 3.85Å; I777-Y815 HydrophobicContact CD1-CD1 3.82Å; I777-Y815 HydrophobicContact CD1-CE1 3.82Å; I777-Y830 HydrophobicContact CG2-CE1 4.01Å; I777-L831 HydrophobicContact CD1-CD2 3.69Å; I777-L831 HydrophobicContact CG2-CD2 4.48Å; I777-L841 HydrophobicContact CD1-CD1 4.34Å; I777-L841 HydrophobicContact CG2-CD1 4.17Å
778	T	88.1	Confident	76.5	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.006	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-75.9	149.8	168.9	72.3	0	0	0	0	110.6	I773 G775 T776 S780 L787 W794 Y830	I773-T778 PolarHBondContact O-N 3.04Å; I773-T778 VanDerWaalsContact O-N 3.07Å; G775-T778 CarbonylContact C-O 3.59Å; G775-T778 WeakPolarHBondContact CA-O 3.37Å; G775-T778 PolarHBondContact N-O 3.09Å; G775-T778 PolarHBondContact N-OG1 2.96Å; T776-T778 PolarHBondContact N-O 3.07Å; T778-S780 PolarHBondContact O-N 2.97Å; T778-S780 PolarHBondContact OG1-O 2.69Å; T778-L787 HydrophobicContact CG2-CD1 3.99Å; T778-L787 HydrophobicContact CG2-CD2 3.86Å; T778-W794 CarbonylContact C-O 3.52Å; T778-Y830 HydrophobicContact CG2-CE1 3.86Å
779	K	83.4	Confident	74.1	Confident	64 Å²	64	29.5 Å²	29.5	28%	0.278	17%	0.166	S	C	.	.	S	Bend	trans	-71.3	-10.9	178.3	-75.8	162.8	178.3	147.7	0	115.1	D793 W794 T795 H796	K779-D793 PolarHBondContact NZ-O 3.31Å; K779-W794 WeakPolarHBondContact CB-O 3.26Å; K779-W794 VanDerWaalsContact CG-O 3.29Å; K779-W794 WeakPolarHBondContact CG-O 3.3Å; K779-W794 PolarHBondContact N-O 3.01Å; K779-T795 WeakPolarHBondContact CE-O 3.13Å; K779-T795 PolarHBondContact NZ-O 2.75Å; K779-H796 WeakPolarHBondContact CA-NE2 3.49Å
780	S	68.9	Low	71.6	Confident	33 Å²	33	33.4 Å²	33.4	23%	0.231	18%	0.183	C	C	.	.			trans	-160.2	149.5	174.6	63.1	0	0	0	0	112	T778 L783 G784	T778-S780 PolarHBondContact O-N 2.97Å; T778-S780 PolarHBondContact OG1-O 2.69Å; S780-L783 WeakPolarHBondContact OG-CB 3.47Å; S780-L783 WeakPolarHBondContact OG-CG 3.35Å; S780-G784 PolarHBondContact O-N 3.4Å; S780-G784 VanDerWaalsContact O-N 3.16Å
781	D	61.3	Low	69.3	Low	44 Å²	44	37.1 Å²	37.1	24%	0.235	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-45.6	178.7	-49.5	44.3	0	0	0	110.7	L783 G784 N894 R895	D781-L783 PolarHBondContact O-N 2.97Å; D781-G784 PolarHBondContact O-N 2.89Å; D781-N894 PolarHBondContact OD1-ND2 2.86Å; D781-N894 PolarHBondContact OD2-ND2 2.76Å; D781-R895 IonicContact OD2-CZ 3.58Å; D781-R895 VanDerWaalsContact OD2-CZ 3.23Å; D781-R895 IonicContact OD2-NE 2.74Å; D781-R895 PolarHBondContact OD2-NE 2.81Å; D781-R895 IonicContact OD2-NH2 2.69Å; D781-R895 PolarHBondContact OD2-NH2 2.99Å
782	A	52.9	Low	67.2	Low	72 Å²	72	44.5 Å²	44.5	60%	0.595	25%	0.254	S	S	*	.	H	α-helix	trans	-66.2	-38.8	-176.9	0	0	0	0	0	113.3
783	L	51.8	Low	65.7	Low	60 Å²	60	49.4 Å²	49.4	31%	0.314	28%	0.28	S	S	.	.	H	α-helix	trans	-82.1	-18.4	177.8	-58.1	-178.8	0	0	0	112.8	S780 D781 H785 I786 W794	S780-L783 WeakPolarHBondContact OG-CB 3.47Å; S780-L783 WeakPolarHBondContact OG-CG 3.35Å; D781-L783 PolarHBondContact O-N 2.97Å; L783-H785 PolarHBondContact O-N 2.9Å; L783-I786 HydrophobicContact CD2-CD1 3.9Å; L783-I786 PolarHBondContact O-N 3.4Å; L783-W794 HydrophobicContact CD1-CD2 4.2Å; L783-W794 HydrophobicContact CD1-CE3 3.64Å; L783-W794 HydrophobicContact CD1-CH2 3.59Å; L783-W794 HydrophobicContact CD1-CZ2 4.15Å; L783-W794 HydrophobicContact CD1-CZ3 3.31Å
784	G	50.3	Low	64.8	Low	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-52.3	-37.1	172.9	0	0	0	0	0	112.7	S780 D781 I786 R819	S780-G784 PolarHBondContact O-N 3.4Å; S780-G784 VanDerWaalsContact O-N 3.16Å; D781-G784 PolarHBondContact O-N 2.89Å; G784-I786 VanDerWaalsContact C-N 3.28Å; G784-I786 PolarHBondContact O-N 2.69Å; G784-R819 PolarHBondContact O-NH2 3.04Å
785	H	52.2	Low	64.7	Low	82 Å²	82	54 Å²	54	38%	0.38	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.5	176.3	-72	-60.9	0	0	0	114.9	Y19 L783	Y19-H785 HydrophobicContact CE2-CB 4.17Å; Y19-H785 WeakPolarHBondContact CE2-O 3.44Å; Y19-H785 WeakPolarHBondContact OH-CB 3.21Å; Y19-H785 PolarHBondContact OH-O 2.68Å; L783-H785 PolarHBondContact O-N 2.9Å
786	I	54.3	Low	64.8	Low	35 Å²	35	54.1 Å²	54.1	18%	0.179	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	6.8	-168.3	-47.6	165.4	0	0	0	111.6	V15 L783 G784 P788 Q789 F790	V15-I786 HydrophobicContact CG1-CD1 3.7Å; V15-I786 HydrophobicContact CG1-CG1 3.82Å; V15-I786 HydrophobicContact CG1-CG2 4.09Å; V15-I786 HydrophobicContact CG2-CG2 3.57Å; L783-I786 HydrophobicContact CD2-CD1 3.9Å; L783-I786 PolarHBondContact O-N 3.4Å; G784-I786 VanDerWaalsContact C-N 3.28Å; G784-I786 PolarHBondContact O-N 2.69Å; I786-P788 WeakPolarHBondContact O-CD 3.48Å; I786-P788 VanDerWaalsContact O-N 3.07Å; I786-Q789 PolarHBondContact O-N 2.97Å; I786-F790 HydrophobicContact CG2-CD2 3.85Å; I786-F790 HydrophobicContact CG2-CE2 3.68Å
787	L	54.3	Low	64.6	Low	25 Å²	25	62 Å²	62	13%	0.131	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-47.6	-36.5	-166.9	-116.1	42	0	0	0	118.5	T778 Q789 Y830	T778-L787 HydrophobicContact CG2-CD1 3.99Å; T778-L787 HydrophobicContact CG2-CD2 3.86Å; L787-Q789 VanDerWaalsContact C-N 3.34Å; L787-Q789 PolarHBondContact O-N 3Å; L787-Y830 HydrophobicContact CD1-CE2 4.47Å; L787-Y830 HydrophobicContact CD2-CD1 3.38Å; L787-Y830 HydrophobicContact CD2-CD2 3.55Å; L787-Y830 HydrophobicContact CD2-CE1 3.69Å; L787-Y830 HydrophobicContact CD2-CE2 3.86Å; L787-Y830 HydrophobicContact CD2-CG 3.29Å; L787-Y830 HydrophobicContact CG-CD1 4.39Å; L787-Y830 HydrophobicContact CG-CD2 3.64Å; L787-Y830 HydrophobicContact CG-CE2 3.91Å; L787-Y830 HydrophobicContact CG-CG 3.91Å
788	P	48.5	Very low	64.6	Low	88 Å²	88	62 Å²	62	57%	0.571	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.6	-174.6	-27.2	36.6	0	0	0	116.9	I786 I826	I786-P788 WeakPolarHBondContact O-CD 3.48Å; I786-P788 VanDerWaalsContact O-N 3.07Å; P788-I826 HydrophobicContact CG-CD1 4.49Å; P788-I826 HydrophobicContact CG-CG1 4.35Å; P788-I826 HydrophobicContact CG-CG2 3.67Å
789	Q	47.3	Very low	64.9	Low	92 Å²	92	62 Å²	62	43%	0.43	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-102.5	-12.7	-159.7	-74.9	-172.8	-31.8	0	0	116.6	I786 L787	I786-Q789 PolarHBondContact O-N 2.97Å; L787-Q789 VanDerWaalsContact C-N 3.34Å; L787-Q789 PolarHBondContact O-N 3Å
790	F	47.3	Very low	65.4	Low	82 Å²	82	59 Å²	59	36%	0.36	32%	0.319	S	S	.	.			trans	-113.7	2.8	-161.3	-75.2	-79.6	0	0	0	117.6	V11 V15 I786 K792	V11-F790 HydrophobicContact CG1-CE1 3.91Å; V11-F790 HydrophobicContact CG1-CZ 3.63Å; V11-F790 HydrophobicContact CG2-CE1 4.23Å; V11-F790 HydrophobicContact CG2-CZ 4.4Å; V15-F790 HydrophobicContact CG2-CE2 4.12Å; V15-F790 HydrophobicContact CG2-CZ 4.42Å; I786-F790 HydrophobicContact CG2-CD2 3.85Å; I786-F790 HydrophobicContact CG2-CE2 3.68Å; F790-K792 WeakPolarHBondContact O-CB 3.5Å; F790-K792 PolarHBondContact O-N 3.29Å
791	G	48.2	Very low	66.7	Low	78 Å²	78	61.9 Å²	61.9	80%	0.804	33%	0.328	S	S	*	.			trans	53.3	21	158.7	0	0	0	0	0	118.2
792	K	53.8	Low	68.4	Low	156 Å²	156	59.8 Å²	59.8	68%	0.678	32%	0.316	S	S	*	.	S	Bend	trans	-136.9	150.5	-171.9	-165.9	171	-173.5	174.5	0	109.2	F790 W794	F790-K792 WeakPolarHBondContact O-CB 3.5Å; F790-K792 PolarHBondContact O-N 3.29Å; K792-W794 VanDerWaalsContact C-N 3.29Å; K792-W794 PolarHBondContact O-N 3.36Å
793	D	63.2	Low	70.5	Confident	108 Å²	108	56.3 Å²	56.3	58%	0.578	29%	0.288	S	S	*	.			trans	-70.8	78.3	-170.3	-56.7	-38.1	0	0	0	113.2	K779 T795	K779-D793 PolarHBondContact NZ-O 3.31Å; D793-T795 PolarHBondContact O-N 3.3Å
794	W	73.9	Confident	72.6	Confident	94 Å²	94	56.4 Å²	56.4	36%	0.356	29%	0.287	S	S	.	.			trans	-71.2	-4.5	171.6	-66.2	109.2	0	0	0	113	T778 K779 L783 K792	T778-W794 CarbonylContact C-O 3.52Å; K779-W794 WeakPolarHBondContact CB-O 3.26Å; K779-W794 VanDerWaalsContact CG-O 3.29Å; K779-W794 WeakPolarHBondContact CG-O 3.3Å; K779-W794 PolarHBondContact N-O 3.01Å; L783-W794 HydrophobicContact CD1-CD2 4.2Å; L783-W794 HydrophobicContact CD1-CE3 3.64Å; L783-W794 HydrophobicContact CD1-CH2 3.59Å; L783-W794 HydrophobicContact CD1-CZ2 4.15Å; L783-W794 HydrophobicContact CD1-CZ3 3.31Å; K792-W794 VanDerWaalsContact C-N 3.29Å; K792-W794 PolarHBondContact O-N 3.36Å
795	T	86.8	Confident	74.8	Confident	16 Å²	16	59.8 Å²	59.8	10%	0.098	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-77	146.5	175	-42	0	0	0	0	112.1	I777 K779 D793 I799 Y830 V834	I777-T795 HydrophobicContact CG2-CG2 3.98Å; I777-T795 VanDerWaalsContact O-CA 3.29Å; I777-T795 WeakPolarHBondContact O-CA 3.43Å; I777-T795 WeakPolarHBondContact O-CG2 3.43Å; K779-T795 WeakPolarHBondContact CE-O 3.13Å; K779-T795 PolarHBondContact NZ-O 2.75Å; D793-T795 PolarHBondContact O-N 3.3Å; T795-I799 HydrophobicContact CG2-CG2 3.67Å; T795-Y830 PolarHBondContact OG1-OH 2.99Å; T795-V834 HydrophobicContact CG2-CG1 3.7Å; T795-V834 HydrophobicContact CG2-CG2 4.31Å
796	H	89.5	Confident	77	Confident	6 Å²	6	55.9 Å²	55.9	3%	0.028	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-64.1	136.3	167.6	-74.7	-80.2	0	0	0	112.5	T776 I777 K779 I799 N916 G919 Y933	T776-H796 PolarHBondContact O-CD2 3.35Å; I777-H796 PolarHBondContact O-N 3.27Å; K779-H796 WeakPolarHBondContact CA-NE2 3.49Å; H796-I799 WeakPolarHBondContact O-CG2 3.21Å; H796-N916 PolarHBondContact CE1-O 2.81Å; H796-N916 VanDerWaalsContact CE1-O 3.27Å; H796-G919 VanDerWaalsContact ND1-CA 3.33Å; H796-G919 WeakPolarHBondContact ND1-CA 3.27Å; H796-Y933 HydrophobicContact CB-CD2 3.85Å; H796-Y933 HydrophobicContact CB-CE2 3.51Å; H796-Y933 AromaticContact CG-CE2 3.91Å
797	K	89.4	Confident	79	Confident	166 Å²	166	57.9 Å²	57.9	72%	0.722	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	138.5	178.9	-67.3	-175.3	176.2	-178.4	0	111	I799	K797-I799 VanDerWaalsContact C-N 3.32Å; K797-I799 PolarHBondContact O-N 2.84Å
798	G	91.4	Very high	81	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.01	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	-10	178.3	0	0	0	0	0	115.4	K801 L802 D836 N934	G798-K801 WeakPolarHBondContact O-CB 3.42Å; G798-K801 PolarHBondContact O-N 3.32Å; G798-L802 PolarHBondContact O-N 3.38Å; G798-D836 VanDerWaalsContact CA-OD2 3.26Å; G798-D836 WeakPolarHBondContact CA-OD2 3.26Å; G798-D836 PolarHBondContact N-OD2 3.29Å; G798-N934 WeakPolarHBondContact CA-OD1 3.44Å
799	I	94.6	Very high	83.3	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-44.8	-174.7	-165.7	175.6	0	0	0	112.6	T776 I777 T795 H796 K797 K801 L802 Y803 Y933	T776-I799 WeakPolarHBondContact O-CD1 3.46Å; I777-I799 HydrophobicContact CB-CD1 4.27Å; I777-I799 HydrophobicContact CG1-CD1 3.85Å; T795-I799 HydrophobicContact CG2-CG2 3.67Å; H796-I799 WeakPolarHBondContact O-CG2 3.21Å; K797-I799 VanDerWaalsContact C-N 3.32Å; K797-I799 PolarHBondContact O-N 2.84Å; I799-K801 VanDerWaalsContact C-N 3.29Å; I799-K801 PolarHBondContact O-N 3Å; I799-L802 WeakPolarHBondContact O-CB 3.47Å; I799-L802 PolarHBondContact O-N 3.03Å; I799-Y803 HydrophobicContact CD1-CE1 4.39Å; I799-Y803 HydrophobicContact CD1-CE2 4.06Å; I799-Y803 HydrophobicContact CG1-CD1 4.16Å; I799-Y803 HydrophobicContact CG1-CD2 4.35Å; I799-Y803 HydrophobicContact CG1-CE1 3.86Å; I799-Y803 HydrophobicContact CG1-CE2 4.04Å; I799-Y803 HydrophobicContact CG1-CG 4.4Å; I799-Y803 PolarHBondContact O-N 2.85Å; I799-Y933 HydrophobicContact CB-CD1 4.18Å; I799-Y933 HydrophobicContact CB-CD2 4Å; I799-Y933 HydrophobicContact CB-CE1 4.26Å; I799-Y933 HydrophobicContact CB-CE2 4.06Å; I799-Y933 HydrophobicContact CB-CG 4.06Å; I799-Y933 HydrophobicContact CD1-CE1 3.89Å; I799-Y933 HydrophobicContact CD1-CE2 4.03Å; I799-Y933 WeakPolarHBondContact CD1-OH 3.27Å; I799-Y933 HydrophobicContact CG1-CD1 3.95Å; I799-Y933 HydrophobicContact CG1-CD2 4.43Å; I799-Y933 HydrophobicContact CG1-CE1 3.66Å; I799-Y933 HydrophobicContact CG1-CE2 4.14Å; I799-Y933 HydrophobicContact CG1-CG 4.34Å
800	A	94.6	Very high	85.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-36.3	178	0	0	0	0	0	111.4	Y803 H804 V834 D836 T839 L841	A800-Y803 PolarHBondContact O-N 2.8Å; A800-H804 WeakPolarHBondContact O-CB 3.37Å; A800-H804 PolarHBondContact O-N 2.63Å; A800-V834 HydrophobicContact CB-CG1 4.42Å; A800-D836 HydrophobicContact CB-CB 4.05Å; A800-T839 VanDerWaalsContact CB-O 3.3Å; A800-T839 WeakPolarHBondContact CB-O 3.39Å; A800-L841 HydrophobicContact CB-CD2 4.09Å; A800-L841 HydrophobicContact CB-CG 4.34Å
801	K	95.3	Very high	87.9	Confident	93 Å²	93	53.5 Å²	53.5	40%	0.404	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-39.9	173.9	-164.4	176.3	-175.1	168.6	0	112.7	G798 I799 K805 T937	G798-K801 WeakPolarHBondContact O-CB 3.42Å; G798-K801 PolarHBondContact O-N 3.32Å; I799-K801 VanDerWaalsContact C-N 3.29Å; I799-K801 PolarHBondContact O-N 3Å; K801-K805 PolarHBondContact O-N 2.56Å; K801-T937 HydrophobicContact CD-CG2 4.32Å; K801-T937 HydrophobicContact CG-CG2 4.06Å
802	L	96.6	Very high	90.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-54.6	172.6	179.3	65.1	0	0	0	111	G798 I799 H804 K805 I806 F892 Y933 L936 T937 V940	G798-L802 PolarHBondContact O-N 3.38Å; I799-L802 WeakPolarHBondContact O-CB 3.47Å; I799-L802 PolarHBondContact O-N 3.03Å; L802-H804 VanDerWaalsContact C-N 3.34Å; L802-H804 PolarHBondContact O-N 3.4Å; L802-K805 WeakPolarHBondContact O-CB 3.19Å; L802-K805 PolarHBondContact O-N 3.23Å; L802-K805 VanDerWaalsContact O-N 3.13Å; L802-I806 HydrophobicContact CD1-CD1 3.86Å; L802-I806 HydrophobicContact CD1-CG1 4.26Å; L802-I806 HydrophobicContact CD2-CD1 4.25Å; L802-I806 HydrophobicContact CG-CD1 3.73Å; L802-I806 HydrophobicContact CG-CG1 4.43Å; L802-I806 WeakPolarHBondContact O-CG1 3.43Å; L802-I806 PolarHBondContact O-N 3.32Å; L802-F892 HydrophobicContact CD2-CE1 3.94Å; L802-F892 HydrophobicContact CD2-CZ 3.91Å; L802-Y933 HydrophobicContact CD2-CD1 3.71Å; L802-Y933 HydrophobicContact CD2-CE1 4.38Å; L802-L936 HydrophobicContact CD1-CB 4.28Å; L802-L936 HydrophobicContact CD1-CD2 4.49Å; L802-L936 HydrophobicContact CD1-CG 3.98Å; L802-L936 HydrophobicContact CD2-CB 4.41Å; L802-L936 HydrophobicContact CD2-CD2 3.82Å; L802-L936 HydrophobicContact CD2-CG 4.16Å; L802-T937 WeakPolarHBondContact CA-OG1 3.42Å; L802-T937 WeakPolarHBondContact CB-OG1 3.27Å; L802-V940 HydrophobicContact CD1-CG2 3.58Å
803	Y	97.8	Very high	92.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-37.6	-172.4	-73.2	11.2	0	0	0	111.6	S771 I799 A800 K805 I806 H807 F813 Y815 L841 F892	S771-Y803 PolarHBondContact OG-OH 3.12Å; I799-Y803 HydrophobicContact CD1-CE1 4.39Å; I799-Y803 HydrophobicContact CD1-CE2 4.06Å; I799-Y803 HydrophobicContact CG1-CD1 4.16Å; I799-Y803 HydrophobicContact CG1-CD2 4.35Å; I799-Y803 HydrophobicContact CG1-CE1 3.86Å; I799-Y803 HydrophobicContact CG1-CE2 4.04Å; I799-Y803 HydrophobicContact CG1-CG 4.4Å; I799-Y803 PolarHBondContact O-N 2.85Å; A800-Y803 PolarHBondContact O-N 2.8Å; Y803-K805 PolarHBondContact O-N 3.25Å; Y803-I806 PolarHBondContact O-N 3.06Å; Y803-H807 VanDerWaalsContact O-CB 3.29Å; Y803-H807 WeakPolarHBondContact O-CB 3.5Å; Y803-H807 PolarHBondContact O-N 3.45Å; Y803-F813 AromaticContact CD1-CE1 3.73Å; Y803-F813 HydrophobicContact CD1-CE1 3.73Å; Y803-F813 AromaticContact CD1-CZ 3.95Å; Y803-F813 HydrophobicContact CD1-CZ 3.95Å; Y803-F813 AromaticContact CD2-CD1 3.85Å; Y803-F813 HydrophobicContact CD2-CD1 3.85Å; Y803-F813 AromaticContact CD2-CE1 3.39Å; Y803-F813 HydrophobicContact CD2-CE1 3.39Å; Y803-F813 HydrophobicContact CD2-CZ 4.16Å; Y803-F813 HydrophobicContact CE1-CE1 4.12Å; Y803-F813 HydrophobicContact CE2-CD1 4.24Å; Y803-F813 AromaticContact CE2-CE1 3.82Å; Y803-F813 HydrophobicContact CE2-CE1 3.82Å; Y803-F813 HydrophobicContact CG-CD1 4.22Å; Y803-F813 AromaticContact CG-CE1 3.36Å; Y803-F813 HydrophobicContact CG-CE1 3.36Å; Y803-F813 AromaticContact CG-CZ 3.67Å; Y803-F813 HydrophobicContact CG-CZ 3.67Å; Y803-F813 WeakPolarHBondContact O-CE2 3.23Å; Y803-Y815 HydrophobicContact CD2-CE1 4.38Å; Y803-Y815 HydrophobicContact CE2-CE1 4.32Å; Y803-L841 HydrophobicContact CD2-CD2 3.75Å; Y803-L841 HydrophobicContact CG-CD2 4.38Å; Y803-F892 HydrophobicContact CE1-CD1 4.31Å; Y803-F892 AromaticContact CE1-CD2 3.89Å; Y803-F892 HydrophobicContact CE1-CD2 3.89Å; Y803-F892 HydrophobicContact CE1-CE1 4.35Å; Y803-F892 AromaticContact CE1-CE2 3.92Å; Y803-F892 HydrophobicContact CE1-CE2 3.92Å; Y803-F892 HydrophobicContact CE1-CG 4.1Å; Y803-F892 HydrophobicContact CE1-CZ 4.16Å; Y803-F892 VanDerWaalsContact OH-CB 3.24Å; Y803-F892 WeakPolarHBondContact OH-CB 3.49Å; Y803-F892 WeakPolarHBondContact OH-CG 3.39Å
804	H	96.4	Very high	94	Very high	62 Å²	62	39.2 Å²	39.2	29%	0.287	18%	0.182	S	C	.	.	H	α-helix	trans	-63.1	-37.3	173.2	-176.4	64.1	0	0	0	113	A800 L802 K808 T839	A800-H804 WeakPolarHBondContact O-CB 3.37Å; A800-H804 PolarHBondContact O-N 2.63Å; L802-H804 VanDerWaalsContact C-N 3.34Å; L802-H804 PolarHBondContact O-N 3.4Å; H804-K808 WeakPolarHBondContact NE2-CE 3.2Å; H804-K808 WeakPolarHBondContact O-CG 3.42Å; H804-K808 PolarHBondContact O-N 2.76Å; H804-T839 HydrophobicContact CB-CG2 3.45Å; H804-T839 VanDerWaalsContact CB-CG2 3.45Å; H804-T839 VanDerWaalsContact CD2-CG2 3.49Å; H804-T839 WeakPolarHBondContact CD2-CG2 3.28Å
805	K	96.6	Very high	95.1	Very high	70 Å²	70	34.9 Å²	34.9	30%	0.304	17%	0.166	S	C	.	.	H	α-helix	trans	-65.1	-50.1	171.4	-86.3	-159.5	174.2	-163.9	0	111.8	K801 L802 Y803 H807 K808 N809 T937 V940	K801-K805 PolarHBondContact O-N 2.56Å; L802-K805 WeakPolarHBondContact O-CB 3.19Å; L802-K805 PolarHBondContact O-N 3.23Å; L802-K805 VanDerWaalsContact O-N 3.13Å; Y803-K805 PolarHBondContact O-N 3.25Å; K805-H807 VanDerWaalsContact C-N 3.25Å; K805-H807 PolarHBondContact O-N 2.85Å; K805-K808 WeakPolarHBondContact O-CB 3.2Å; K805-K808 PolarHBondContact O-N 2.82Å; K805-K808 VanDerWaalsContact O-N 3.08Å; K805-N809 PolarHBondContact O-N 2.87Å; K805-N809 VanDerWaalsContact O-N 3.13Å; K805-T937 HydrophobicContact CD-CG2 4.04Å; K805-T937 PolarHBondContact NZ-O 3.29Å; K805-V940 HydrophobicContact CB-CG1 4.14Å; K805-V940 HydrophobicContact CB-CG2 4.11Å; K805-V940 HydrophobicContact CD-CB 4.16Å; K805-V940 HydrophobicContact CD-CG2 3.82Å
806	I	97.7	Very high	95.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.6	-41.2	179.7	-65	170.4	0	0	0	110.4	I769 L802 Y803 N809 Y811 F813 F892 V940 F944	I769-I806 HydrophobicContact CD1-CG2 4.01Å; I769-I806 HydrophobicContact CG1-CG2 3.8Å; L802-I806 HydrophobicContact CD1-CD1 3.86Å; L802-I806 HydrophobicContact CD1-CG1 4.26Å; L802-I806 HydrophobicContact CD2-CD1 4.25Å; L802-I806 HydrophobicContact CG-CD1 3.73Å; L802-I806 HydrophobicContact CG-CG1 4.43Å; L802-I806 WeakPolarHBondContact O-CG1 3.43Å; L802-I806 PolarHBondContact O-N 3.32Å; Y803-I806 PolarHBondContact O-N 3.06Å; I806-N809 PolarHBondContact O-N 3.41Å; I806-N809 VanDerWaalsContact O-N 3.14Å; I806-Y811 HydrophobicContact CG2-CD2 4.13Å; I806-Y811 HydrophobicContact CG2-CG 4.05Å; I806-Y811 WeakPolarHBondContact O-CD2 3.39Å; I806-F813 HydrophobicContact CB-CE2 4.02Å; I806-F813 HydrophobicContact CB-CZ 3.93Å; I806-F813 HydrophobicContact CD1-CZ 4.46Å; I806-F813 HydrophobicContact CG2-CE2 3.84Å; I806-F813 HydrophobicContact CG2-CZ 3.86Å; I806-F892 HydrophobicContact CD1-CE2 4.36Å; I806-F892 HydrophobicContact CD1-CZ 4.24Å; I806-V940 HydrophobicContact CG1-CG1 4Å; I806-F944 HydrophobicContact CD1-CD1 4.11Å; I806-F944 HydrophobicContact CD1-CD2 3.79Å; I806-F944 HydrophobicContact CD1-CE1 3.93Å; I806-F944 HydrophobicContact CD1-CE2 3.61Å; I806-F944 HydrophobicContact CD1-CG 4.04Å; I806-F944 HydrophobicContact CD1-CZ 3.69Å; I806-F944 HydrophobicContact CG1-CB 4.23Å; I806-F944 HydrophobicContact CG1-CD1 4.18Å; I806-F944 HydrophobicContact CG1-CD2 3.77Å; I806-F944 HydrophobicContact CG1-CE2 4.14Å; I806-F944 HydrophobicContact CG1-CG 3.8Å; I806-F944 HydrophobicContact CG2-CB 4.33Å; I806-F944 HydrophobicContact CG2-CD1 3.88Å; I806-F944 HydrophobicContact CG2-CE1 4.43Å; I806-F944 HydrophobicContact CG2-CG 4.13Å
807	H	96.6	Very high	95.2	Very high	77 Å²	77	33.9 Å²	33.9	36%	0.356	16%	0.16	S	C	.	.	H	α-helix	trans	-64.2	-40	174.8	177.1	-95.6	0	0	0	113.1	Y803 K805 N809 G810 Y811 F813 P842	Y803-H807 VanDerWaalsContact O-CB 3.29Å; Y803-H807 WeakPolarHBondContact O-CB 3.5Å; Y803-H807 PolarHBondContact O-N 3.45Å; K805-H807 VanDerWaalsContact C-N 3.25Å; K805-H807 PolarHBondContact O-N 2.85Å; H807-N809 PolarHBondContact O-N 3.13Å; H807-G810 PolarHBondContact O-N 3.48Å; H807-Y811 WeakPolarHBondContact CA-O 3.38Å; H807-F813 HydrophobicContact CB-CD2 4.21Å; H807-F813 HydrophobicContact CB-CE2 4.07Å; H807-P842 HydrophobicContact CB-CB 3.62Å; H807-P842 HydrophobicContact CB-CG 4.04Å
808	K	95.8	Very high	94.8	Very high	147 Å²	147	28 Å²	28	64%	0.639	14%	0.143	S	C	*	.	H	α-helix	trans	-60.7	-26.6	172.6	-82.1	-178	172	-174.4	0	113.4	H804 K805 G810	H804-K808 WeakPolarHBondContact NE2-CE 3.2Å; H804-K808 WeakPolarHBondContact O-CG 3.42Å; H804-K808 PolarHBondContact O-N 2.76Å; K805-K808 WeakPolarHBondContact O-CB 3.2Å; K805-K808 PolarHBondContact O-N 2.82Å; K805-K808 VanDerWaalsContact O-N 3.08Å; K808-G810 PolarHBondContact O-N 3.05Å
809	N	95.9	Very high	94.3	Very high	15 Å²	15	28.4 Å²	28.4	8%	0.08	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	12.7	174.9	-72.3	15.8	0	0	0	113.1	K805 I806 H807 Y811 E941 F944 V946 V947	K805-N809 PolarHBondContact O-N 2.87Å; K805-N809 VanDerWaalsContact O-N 3.13Å; I806-N809 PolarHBondContact O-N 3.41Å; I806-N809 VanDerWaalsContact O-N 3.14Å; H807-N809 PolarHBondContact O-N 3.13Å; N809-Y811 HydrophobicContact CB-CD2 4.05Å; N809-Y811 HydrophobicContact CB-CE2 4.16Å; N809-E941 PolarHBondContact ND2-OE2 3.17Å; N809-F944 PolarHBondContact ND2-O 2.95Å; N809-V946 HydrophobicContact CB-CG2 4.23Å; N809-V946 WeakPolarHBondContact O-CA 3.39Å; N809-V947 PolarHBondContact O-N 2.96Å
810	G	94.3	Very high	93.7	Very high	34 Å²	34	29.2 Å²	29.2	35%	0.351	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	4.7	171.6	0	0	0	0	0	115.3	H807 K808	H807-G810 PolarHBondContact O-N 3.48Å; K808-G810 PolarHBondContact O-N 3.05Å
811	Y	97.3	Very high	93.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-86.1	132.9	-179.6	-66.5	-93.2	0	0	0	112	R767 I769 I806 H807 N809 Y889 F944 P945 V947	R767-Y811 HydrophobicContact CB-CD1 3.57Å; R767-Y811 HydrophobicContact CB-CE1 3.75Å; R767-Y811 HydrophobicContact CG-CE1 4.41Å; R767-Y811 WeakPolarHBondContact O-CA 3.18Å; I769-Y811 HydrophobicContact CD1-CD1 3.82Å; I769-Y811 HydrophobicContact CD1-CG 4.23Å; I769-Y811 HydrophobicContact CG1-CD1 4.26Å; I769-Y811 HydrophobicContact CG1-CG 4.34Å; I806-Y811 HydrophobicContact CG2-CD2 4.13Å; I806-Y811 HydrophobicContact CG2-CG 4.05Å; I806-Y811 WeakPolarHBondContact O-CD2 3.39Å; H807-Y811 WeakPolarHBondContact CA-O 3.38Å; N809-Y811 HydrophobicContact CB-CD2 4.05Å; N809-Y811 HydrophobicContact CB-CE2 4.16Å; Y811-Y889 HydrophobicContact CD1-CD1 4.22Å; Y811-Y889 HydrophobicContact CD1-CG 4.2Å; Y811-Y889 AromaticContact CE1-CD1 3.5Å; Y811-Y889 HydrophobicContact CE1-CD1 3.5Å; Y811-Y889 AromaticContact CE1-CD2 3.77Å; Y811-Y889 HydrophobicContact CE1-CD2 3.77Å; Y811-Y889 AromaticContact CE1-CE1 3.9Å; Y811-Y889 HydrophobicContact CE1-CE1 3.9Å; Y811-Y889 HydrophobicContact CE1-CE2 4.11Å; Y811-Y889 AromaticContact CE1-CG 3.45Å; Y811-Y889 HydrophobicContact CE1-CG 3.45Å; Y811-Y889 VanDerWaalsContact CE1-CG 3.45Å; Y811-Y889 VanDerWaalsContact OH-CZ 3.3Å; Y811-F944 HydrophobicContact CD2-CB 4.42Å; Y811-F944 HydrophobicContact CE2-CB 3.93Å; Y811-P945 WeakPolarHBondContact CE2-O 3.5Å; Y811-P945 PolarHBondContact OH-O 3.17Å; Y811-P945 VanDerWaalsContact OH-O 3.11Å; Y811-V947 HydrophobicContact CD1-CG2 4.46Å; Y811-V947 HydrophobicContact CD2-CG2 4.13Å; Y811-V947 HydrophobicContact CE1-CG2 4.11Å; Y811-V947 HydrophobicContact CE2-CG2 3.74Å; Y811-V947 HydrophobicContact CG-CG2 4.48Å
812	K	97.1	Very high	92.5	Very high	41 Å²	41	25.3 Å²	25.3	18%	0.178	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	148.6	172.9	-47.3	-71.8	-175.7	160.7	0	109.8	E736 W762 D766 R767 V768 I769	E736-K812 IonicContact OE1-NZ 2.87Å; E736-K812 PolarHBondContact OE1-NZ 2.94Å; W762-K812 HydrophobicContact CD2-CB 4.48Å; W762-K812 HydrophobicContact CD2-CG 4.34Å; W762-K812 HydrophobicContact CG-CG 4.48Å; W762-K812 HydrophobicContact CH2-CB 4.22Å; W762-K812 HydrophobicContact CZ2-CB 3.72Å; W762-K812 HydrophobicContact CZ2-CG 4.38Å; D766-K812 HydrophobicContact CB-CG 3.98Å; D766-K812 WeakPolarHBondContact OD1-CE 3.42Å; D766-K812 IonicContact OD1-NZ 2.56Å; D766-K812 PolarHBondContact OD1-NZ 2.87Å; D766-K812 WeakPolarHBondContact OD2-CE 3.27Å; D766-K812 IonicContact OD2-NZ 3.79Å; D766-K812 PolarHBondContact OD2-NZ 3.26Å; R767-K812 PolarHBondContact O-N 3.32Å; V768-K812 CarbonylContact C-O 3.54Å; V768-K812 WeakPolarHBondContact CA-O 3.36Å; I769-K812 PolarHBondContact N-O 2.95Å
813	F	98.1	Very high	91.7	Very high	1 Å²	1	26.3 Å²	26.3	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.8	175.5	-87.2	-99.4	0	0	0	111.7	I769 Y803 I806 H807 Y815 P842 G844 P845	I769-F813 HydrophobicContact CB-CD1 4.11Å; I769-F813 HydrophobicContact CB-CE1 3.93Å; I769-F813 HydrophobicContact CB-CE2 4.37Å; I769-F813 HydrophobicContact CB-CG 4.41Å; I769-F813 HydrophobicContact CB-CZ 4.07Å; I769-F813 HydrophobicContact CG1-CE2 4.26Å; I769-F813 HydrophobicContact CG1-CZ 4.2Å; I769-F813 HydrophobicContact CG2-CD1 4.13Å; I769-F813 HydrophobicContact CG2-CE1 3.6Å; I769-F813 HydrophobicContact CG2-CZ 3.93Å; Y803-F813 AromaticContact CD1-CE1 3.73Å; Y803-F813 HydrophobicContact CD1-CE1 3.73Å; Y803-F813 AromaticContact CD1-CZ 3.95Å; Y803-F813 HydrophobicContact CD1-CZ 3.95Å; Y803-F813 AromaticContact CD2-CD1 3.85Å; Y803-F813 HydrophobicContact CD2-CD1 3.85Å; Y803-F813 AromaticContact CD2-CE1 3.39Å; Y803-F813 HydrophobicContact CD2-CE1 3.39Å; Y803-F813 HydrophobicContact CD2-CZ 4.16Å; Y803-F813 HydrophobicContact CE1-CE1 4.12Å; Y803-F813 HydrophobicContact CE2-CD1 4.24Å; Y803-F813 AromaticContact CE2-CE1 3.82Å; Y803-F813 HydrophobicContact CE2-CE1 3.82Å; Y803-F813 HydrophobicContact CG-CD1 4.22Å; Y803-F813 AromaticContact CG-CE1 3.36Å; Y803-F813 HydrophobicContact CG-CE1 3.36Å; Y803-F813 AromaticContact CG-CZ 3.67Å; Y803-F813 HydrophobicContact CG-CZ 3.67Å; Y803-F813 WeakPolarHBondContact O-CE2 3.23Å; I806-F813 HydrophobicContact CB-CE2 4.02Å; I806-F813 HydrophobicContact CB-CZ 3.93Å; I806-F813 HydrophobicContact CD1-CZ 4.46Å; I806-F813 HydrophobicContact CG2-CE2 3.84Å; I806-F813 HydrophobicContact CG2-CZ 3.86Å; H807-F813 HydrophobicContact CB-CD2 4.21Å; H807-F813 HydrophobicContact CB-CE2 4.07Å; F813-Y815 HydrophobicContact CB-CE2 4.07Å; F813-Y815 HydrophobicContact CD1-CE1 4.4Å; F813-P842 HydrophobicContact CB-CG 4.22Å; F813-P842 HydrophobicContact CD1-CG 4.26Å; F813-P842 HydrophobicContact CD2-CB 4.16Å; F813-P842 HydrophobicContact CD2-CG 3.46Å; F813-P842 VanDerWaalsContact CD2-CG 3.46Å; F813-P842 HydrophobicContact CE2-CG 3.85Å; F813-P842 HydrophobicContact CG-CG 3.69Å; F813-P842 HydrophobicContact CZ-CG 4.41Å; F813-G844 VanDerWaalsContact O-CA 3.29Å; F813-G844 WeakPolarHBondContact O-CA 3.32Å; F813-P845 WeakPolarHBondContact O-CD 3.38Å
814	L	98.1	Very high	91.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	116.8	173.8	178.3	62.1	0	0	0	108.8	I34 W762 V768 I769 I770 S771 P845 L847 L874 V877 F888	I34-L814 HydrophobicContact CD1-CD1 3.65Å; W762-L814 HydrophobicContact CH2-CB 4.46Å; V768-L814 HydrophobicContact CG1-CB 3.52Å; V768-L814 HydrophobicContact CG1-CD2 4.16Å; V768-L814 HydrophobicContact CG1-CG 4.49Å; I769-L814 PolarHBondContact O-N 3.33Å; I770-L814 CarbonylContact C-O 3.6Å; I770-L814 WeakPolarHBondContact CA-O 3.48Å; I770-L814 HydrophobicContact CG1-CD2 4.46Å; S771-L814 PolarHBondContact N-O 3.41Å; L814-P845 HydrophobicContact CD1-CB 4.37Å; L814-P845 HydrophobicContact CD1-CG 3.73Å; L814-L847 HydrophobicContact CD1-CD1 3.74Å; L814-L847 HydrophobicContact CD1-CG 3.87Å; L814-L847 HydrophobicContact CD2-CD1 4.11Å; L814-L847 HydrophobicContact CG-CD1 4.17Å; L814-L874 HydrophobicContact CD2-CD2 3.8Å; L814-V877 HydrophobicContact CD2-CG1 3.96Å; L814-F888 HydrophobicContact CD2-CE1 3.75Å; L814-F888 HydrophobicContact CD2-CZ 4.38Å
815	Y	97.4	Very high	90.7	Very high	3 Å²	3	27 Å²	27	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.7	178.2	-59.2	-75.9	0	0	0	110	S771 I777 Y803 F813 L831 P842 P845 V846 L847	S771-Y815 CarbonylContact O-C 3.55Å; S771-Y815 WeakPolarHBondContact O-CA 3.34Å; I777-Y815 HydrophobicContact CD1-CD1 3.82Å; I777-Y815 HydrophobicContact CD1-CE1 3.82Å; Y803-Y815 HydrophobicContact CD2-CE1 4.38Å; Y803-Y815 HydrophobicContact CE2-CE1 4.32Å; F813-Y815 HydrophobicContact CB-CE2 4.07Å; F813-Y815 HydrophobicContact CD1-CE1 4.4Å; Y815-L831 HydrophobicContact CD1-CD1 4.34Å; Y815-L831 HydrophobicContact CD2-CD1 4.09Å; Y815-L831 HydrophobicContact CG-CD1 3.95Å; Y815-P842 WeakPolarHBondContact CE2-O 3.47Å; Y815-P842 WeakPolarHBondContact OH-CD 3.41Å; Y815-P842 PolarHBondContact OH-O 3.07Å; Y815-P845 PolarHBondContact N-O 3.29Å; Y815-V846 HydrophobicContact CD2-CG2 4.49Å; Y815-V846 WeakPolarHBondContact O-CA 3.34Å; Y815-L847 PolarHBondContact O-N 2.97Å
816	C	92.1	Very high	90	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.007	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.3	177.2	-171.8	0	0	0	0	109.7	S771 D772 I773 L847	S771-C816 PolarHBondContact O-N 3.24Å; D772-C816 WeakPolarHBondContact CA-O 3.22Å; I773-C816 PolarHBondContact N-O 2.97Å; I773-C816 VanDerWaalsContact N-O 3.14Å; C816-L847 CarbonylContact C-O 3.56Å; C816-L847 WeakPolarHBondContact CA-O 3.4Å
817	S	87.1	Confident	89.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	151.5	169.3	163.9	0	0	0	0	110.2	D774 R819 L847	D774-S817 WeakPolarHBondContact OD2-CB 3.42Å; D774-S817 PolarHBondContact OD2-OG 3.49Å; S817-R819 PolarHBondContact O-N 2.67Å; S817-R819 WeakPolarHBondContact OG-CB 3.45Å; S817-R819 VanDerWaalsContact OG-CD 3.26Å; S817-R819 WeakPolarHBondContact OG-CD 3.49Å; S817-R819 WeakPolarHBondContact OG-CG 3.41Å; S817-R819 PolarHBondContact OG-N 2.82Å; S817-R819 VanDerWaalsContact OG-N 3.08Å; S817-L847 PolarHBondContact N-O 3.36Å
818	A	80.9	Confident	89.2	Confident	43 Å²	43	23.7 Å²	23.7	36%	0.355	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-0.7	174	0	0	0	0	0	113.7
819	R	80.7	Confident	88.8	Confident	8 Å²	8	20 Å²	20	3%	0.03	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	142.7	176.8	-68.6	163.4	-168.4	-144.8	-0.5	111.7	D774 G784 S817 T827 L848 A849	D774-R819 IonicContact OD1-CZ 2.67Å; D774-R819 VanDerWaalsContact OD1-CZ 3.27Å; D774-R819 IonicContact OD1-NE 3.23Å; D774-R819 PolarHBondContact OD1-NE 3.47Å; D774-R819 IonicContact OD1-NH2 2.66Å; D774-R819 PolarHBondContact OD1-NH2 2.89Å; D774-R819 IonicContact OD2-CZ 3.18Å; D774-R819 IonicContact OD2-NE 2.73Å; D774-R819 PolarHBondContact OD2-NE 2.76Å; D774-R819 IonicContact OD2-NH2 2.79Å; G784-R819 PolarHBondContact O-NH2 3.04Å; S817-R819 PolarHBondContact O-N 2.67Å; S817-R819 WeakPolarHBondContact OG-CB 3.45Å; S817-R819 VanDerWaalsContact OG-CD 3.26Å; S817-R819 WeakPolarHBondContact OG-CD 3.49Å; S817-R819 WeakPolarHBondContact OG-CG 3.41Å; S817-R819 PolarHBondContact OG-N 2.82Å; S817-R819 VanDerWaalsContact OG-N 3.08Å; R819-T827 VanDerWaalsContact CD-OG1 3.3Å; R819-T827 WeakPolarHBondContact CD-OG1 3.31Å; R819-T827 PolarHBondContact NH1-OG1 3.29Å; R819-L848 HydrophobicContact CB-CD2 4.13Å; R819-A849 PolarHBondContact O-N 3.04Å
820	A	81.2	Confident	88.4	Confident	19 Å²	19	20.3 Å²	20.3	16%	0.157	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	147.4	174.4	0	0	0	0	0	113.3	G822 M823 A849 S851	A820-G822 PolarHBondContact O-N 3.05Å; A820-G822 VanDerWaalsContact O-N 3.08Å; A820-M823 WeakPolarHBondContact O-CB 3.44Å; A820-M823 PolarHBondContact O-N 3.26Å; A820-A849 CarbonylContact C-O 3.53Å; A820-S851 WeakPolarHBondContact CB-O 3.38Å
821	I	84.1	Confident	88.2	Confident	3 Å²	3	19.4 Å²	19.4	2%	0.015	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-48.5	-34.4	177.6	-171.6	173.6	0	0	0	114.4	G29 I31 H49 R51 M823 A824 A849 P850	G29-I821 WeakPolarHBondContact O-CD1 3.34Å; I31-I821 HydrophobicContact CD1-CD1 4.47Å; I31-I821 HydrophobicContact CG1-CD1 3.9Å; I31-I821 HydrophobicContact CG1-CG1 3.95Å; H49-I821 HydrophobicContact CB-CD1 4.3Å; H49-I821 WeakPolarHBondContact O-CD1 2.85Å; R51-I821 HydrophobicContact CB-CD1 4.19Å; I821-M823 PolarHBondContact O-N 2.95Å; I821-M823 VanDerWaalsContact O-N 3.11Å; I821-A824 WeakPolarHBondContact O-CB 3.5Å; I821-A824 PolarHBondContact O-N 3.09Å; I821-A849 PolarHBondContact N-O 3.04Å; I821-P850 WeakPolarHBondContact CG2-O 3.49Å
822	G	80.5	Confident	87.8	Confident	8 Å²	8	26.4 Å²	26.4	8%	0.082	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-61	-17.3	175.2	0	0	0	0	0	114.8	L27 A820 S852	L27-G822 WeakPolarHBondContact CD1-O 3.23Å; A820-G822 PolarHBondContact O-N 3.05Å; A820-G822 VanDerWaalsContact O-N 3.08Å; G822-S852 PolarHBondContact N-OG 2.9Å
823	M	79.7	Confident	87.3	Confident	20 Å²	20	31.4 Å²	31.4	10%	0.099	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-96.7	10.7	175.8	-60.2	-61.4	-67.3	0	0	113.1	L27 A820 I821 T825 I826 T827	L27-M823 HydrophobicContact CD1-SD 4.19Å; A820-M823 WeakPolarHBondContact O-CB 3.44Å; A820-M823 PolarHBondContact O-N 3.26Å; I821-M823 PolarHBondContact O-N 2.95Å; I821-M823 VanDerWaalsContact O-N 3.11Å; M823-T825 PolarHBondContact O-N 3.35Å; M823-I826 HydrophobicContact CE-CB 4.36Å; M823-I826 HydrophobicContact CE-CD1 3.63Å; M823-I826 HydrophobicContact CE-CG2 4.15Å; M823-I826 HydrophobicContact SD-CD1 4.24Å; M823-T827 WeakPolarHBondContact O-CB 3.05Å; M823-T827 PolarHBondContact O-N 2.75Å; M823-T827 PolarHBondContact O-OG1 2.85Å
824	A	87	Confident	86.8	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-51.5	-174.7	0	0	0	0	0	113	I821 I826 T827 K828 L848	I821-A824 WeakPolarHBondContact O-CB 3.5Å; I821-A824 PolarHBondContact O-N 3.09Å; A824-I826 PolarHBondContact O-N 2.87Å; A824-T827 PolarHBondContact O-N 2.78Å; A824-K828 WeakPolarHBondContact O-CB 3.21Å; A824-K828 VanDerWaalsContact O-CG 3.3Å; A824-K828 WeakPolarHBondContact O-CG 3Å; A824-K828 PolarHBondContact O-N 3.11Å; A824-L848 VanDerWaalsContact CA-CD1 3.49Å; A824-L848 HydrophobicContact CB-CD1 3.49Å; A824-L848 VanDerWaalsContact CB-CD1 3.49Å
825	T	86.1	Confident	86.2	Confident	76 Å²	76	35.8 Å²	35.8	47%	0.466	18%	0.183	S	C	.	.	H	α-helix	trans	-57.1	-54	-178.8	-46	0	0	0	0	111.3	M823 T827 K828 D829	M823-T825 PolarHBondContact O-N 3.35Å; T825-T827 VanDerWaalsContact C-N 3.27Å; T825-T827 PolarHBondContact O-N 3.02Å; T825-K828 PolarHBondContact O-N 2.64Å; T825-D829 WeakPolarHBondContact CG2-OD2 3.4Å; T825-D829 WeakPolarHBondContact O-CB 3.33Å; T825-D829 VanDerWaalsContact O-CG 3.27Å; T825-D829 PolarHBondContact O-N 2.79Å
826	I	82.8	Confident	85.6	Confident	56 Å²	56	37.5 Å²	37.5	29%	0.287	19%	0.192	S	C	.	.	H	α-helix	trans	-54.7	-41.9	177.4	-72	165.5	0	0	0	112.1	P788 M823 A824 Y830	P788-I826 HydrophobicContact CG-CD1 4.49Å; P788-I826 HydrophobicContact CG-CG1 4.35Å; P788-I826 HydrophobicContact CG-CG2 3.67Å; M823-I826 HydrophobicContact CE-CB 4.36Å; M823-I826 HydrophobicContact CE-CD1 3.63Å; M823-I826 HydrophobicContact CE-CG2 4.15Å; M823-I826 HydrophobicContact SD-CD1 4.24Å; A824-I826 PolarHBondContact O-N 2.87Å; I826-Y830 PolarHBondContact O-N 3.19Å; I826-Y830 VanDerWaalsContact O-N 3.09Å
827	T	86.6	Confident	85.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73.6	-42.2	-177.2	-54.1	0	0	0	0	111.5	I773 R819 M823 A824 T825 L831 V846 L848	I773-T827 HydrophobicContact CD1-CG2 3.6Å; R819-T827 VanDerWaalsContact CD-OG1 3.3Å; R819-T827 WeakPolarHBondContact CD-OG1 3.31Å; R819-T827 PolarHBondContact NH1-OG1 3.29Å; M823-T827 WeakPolarHBondContact O-CB 3.05Å; M823-T827 PolarHBondContact O-N 2.75Å; M823-T827 PolarHBondContact O-OG1 2.85Å; A824-T827 PolarHBondContact O-N 2.78Å; T825-T827 VanDerWaalsContact C-N 3.27Å; T825-T827 PolarHBondContact O-N 3.02Å; T827-L831 WeakPolarHBondContact O-CG 3.4Å; T827-L831 PolarHBondContact O-N 3.08Å; T827-V846 HydrophobicContact CG2-CG1 4.33Å; T827-L848 HydrophobicContact CG2-CD2 4.36Å
828	K	89.9	Confident	85.1	Confident	21 Å²	21	48.8 Å²	48.8	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-39.4	175	-68	173.3	-167.4	-177.3	0	111.7	G30 D32 A824 T825 L831 K832 V846	G30-K828 PolarHBondContact O-NZ 2.73Å; D32-K828 VanDerWaalsContact CG-NZ 3.32Å; D32-K828 VanDerWaalsContact OD1-CE 3.32Å; D32-K828 WeakPolarHBondContact OD1-CE 3.29Å; D32-K828 IonicContact OD1-NZ 3.56Å; D32-K828 PolarHBondContact OD1-NZ 2.82Å; D32-K828 VanDerWaalsContact OD2-CE 3.24Å; D32-K828 WeakPolarHBondContact OD2-CE 3.29Å; D32-K828 IonicContact OD2-NZ 2.65Å; A824-K828 WeakPolarHBondContact O-CB 3.21Å; A824-K828 VanDerWaalsContact O-CG 3.3Å; A824-K828 WeakPolarHBondContact O-CG 3Å; A824-K828 PolarHBondContact O-N 3.11Å; T825-K828 PolarHBondContact O-N 2.64Å; K828-L831 PolarHBondContact O-N 3.13Å; K828-K832 WeakPolarHBondContact O-CG 3.28Å; K828-K832 PolarHBondContact O-N 2.93Å; K828-V846 HydrophobicContact CG-CB 4.13Å; K828-V846 HydrophobicContact CG-CG2 3.9Å
829	D	87.7	Confident	85.5	Confident	71 Å²	71	48.1 Å²	48.1	38%	0.38	25%	0.254	S	S	.	.	H	α-helix	trans	-72.4	-34.4	-179	-69	-24.5	0	0	0	112.7	T825 K832 W833	T825-D829 WeakPolarHBondContact CG2-OD2 3.4Å; T825-D829 WeakPolarHBondContact O-CB 3.33Å; T825-D829 VanDerWaalsContact O-CG 3.27Å; T825-D829 PolarHBondContact O-N 2.79Å; D829-K832 PolarHBondContact O-N 3.25Å; D829-K832 WeakPolarHBondContact OD1-CE 3.43Å; D829-K832 IonicContact OD1-NZ 3.79Å; D829-K832 PolarHBondContact OD1-NZ 2.73Å; D829-W833 WeakPolarHBondContact O-CB 3.42Å; D829-W833 PolarHBondContact O-N 3.07Å
830	Y	87	Confident	86.2	Confident	20 Å²	20	51 Å²	51	8%	0.078	27%	0.272	C	S	.	.	H	α-helix	trans	-57.2	-48.6	167.4	167.8	-109.3	0	0	0	111.8	I773 I777 T778 L787 T795 I826 K832 W833 V834	I773-Y830 HydrophobicContact CG2-CE1 4.45Å; I777-Y830 HydrophobicContact CG2-CE1 4.01Å; T778-Y830 HydrophobicContact CG2-CE1 3.86Å; L787-Y830 HydrophobicContact CD1-CE2 4.47Å; L787-Y830 HydrophobicContact CD2-CD1 3.38Å; L787-Y830 HydrophobicContact CD2-CD2 3.55Å; L787-Y830 HydrophobicContact CD2-CE1 3.69Å; L787-Y830 HydrophobicContact CD2-CE2 3.86Å; L787-Y830 HydrophobicContact CD2-CG 3.29Å; L787-Y830 HydrophobicContact CG-CD1 4.39Å; L787-Y830 HydrophobicContact CG-CD2 3.64Å; L787-Y830 HydrophobicContact CG-CE2 3.91Å; L787-Y830 HydrophobicContact CG-CG 3.91Å; T795-Y830 PolarHBondContact OG1-OH 2.99Å; I826-Y830 PolarHBondContact O-N 3.19Å; I826-Y830 VanDerWaalsContact O-N 3.09Å; Y830-K832 VanDerWaalsContact C-N 3.26Å; Y830-K832 PolarHBondContact O-N 3.08Å; Y830-W833 WeakPolarHBondContact O-CA 3.35Å; Y830-W833 WeakPolarHBondContact O-CB 3.41Å; Y830-W833 PolarHBondContact O-N 3.2Å; Y830-V834 HydrophobicContact CD1-CG2 4.28Å; Y830-V834 HydrophobicContact CD2-CG2 4.05Å; Y830-V834 HydrophobicContact CE1-CG2 3.77Å; Y830-V834 HydrophobicContact CE2-CG2 3.49Å; Y830-V834 VanDerWaalsContact CE2-CG2 3.49Å; Y830-V834 HydrophobicContact CG-CG2 4.42Å; Y830-V834 WeakPolarHBondContact O-CG2 3.26Å; Y830-V834 PolarHBondContact O-N 2.69Å
831	L	90.4	Very high	86.8	Confident	15 Å²	15	50.8 Å²	50.8	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-32.2	180	-65	177.6	0	0	0	112.9	I773 I777 Y815 T827 K828 L841 V846	I773-L831 HydrophobicContact CD1-CD1 3.9Å; I773-L831 HydrophobicContact CG1-CD1 4.43Å; I773-L831 HydrophobicContact CG1-CD2 4.41Å; I773-L831 HydrophobicContact CG2-CD2 4.3Å; I777-L831 HydrophobicContact CD1-CD2 3.69Å; I777-L831 HydrophobicContact CG2-CD2 4.48Å; Y815-L831 HydrophobicContact CD1-CD1 4.34Å; Y815-L831 HydrophobicContact CD2-CD1 4.09Å; Y815-L831 HydrophobicContact CG-CD1 3.95Å; T827-L831 WeakPolarHBondContact O-CG 3.4Å; T827-L831 PolarHBondContact O-N 3.08Å; K828-L831 PolarHBondContact O-N 3.13Å; L831-L841 HydrophobicContact CB-CD1 4.44Å; L831-L841 HydrophobicContact CD2-CD1 3.71Å; L831-V846 HydrophobicContact CD1-CG2 3.7Å
832	K	89	Confident	87.4	Confident	147 Å²	147	51 Å²	51	64%	0.639	27%	0.27	S	S	*	.	H	α-helix	trans	-69.1	-32	171.8	-63.4	168	-160.8	167.7	0	112.7	K828 D829 Y830	K828-K832 WeakPolarHBondContact O-CG 3.28Å; K828-K832 PolarHBondContact O-N 2.93Å; D829-K832 PolarHBondContact O-N 3.25Å; D829-K832 WeakPolarHBondContact OD1-CE 3.43Å; D829-K832 IonicContact OD1-NZ 3.79Å; D829-K832 PolarHBondContact OD1-NZ 2.73Å; Y830-K832 VanDerWaalsContact C-N 3.26Å; Y830-K832 PolarHBondContact O-N 3.08Å
833	W	86.6	Confident	88.1	Confident	147 Å²	147	58.8 Å²	58.8	56%	0.557	30%	0.301	S	S	*	.	H	α-helix	trans	-82.1	-27.9	-177.9	-175.9	87.2	0	0	0	113.2	D829 Y830 N835	D829-W833 WeakPolarHBondContact O-CB 3.42Å; D829-W833 PolarHBondContact O-N 3.07Å; Y830-W833 WeakPolarHBondContact O-CA 3.35Å; Y830-W833 WeakPolarHBondContact O-CB 3.41Å; Y830-W833 PolarHBondContact O-N 3.2Å; W833-N835 PolarHBondContact O-N 2.69Å
834	V	87.3	Confident	88.9	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.018	30%	0.3	C	S	.	.			trans	-57.7	114.8	177.5	172.9	0	0	0	0	111	T795 A800 Y830 V840 L841	T795-V834 HydrophobicContact CG2-CG1 3.7Å; T795-V834 HydrophobicContact CG2-CG2 4.31Å; A800-V834 HydrophobicContact CB-CG1 4.42Å; Y830-V834 HydrophobicContact CD1-CG2 4.28Å; Y830-V834 HydrophobicContact CD2-CG2 4.05Å; Y830-V834 HydrophobicContact CE1-CG2 3.77Å; Y830-V834 HydrophobicContact CE2-CG2 3.49Å; Y830-V834 VanDerWaalsContact CE2-CG2 3.49Å; Y830-V834 HydrophobicContact CG-CG2 4.42Å; Y830-V834 WeakPolarHBondContact O-CG2 3.26Å; Y830-V834 PolarHBondContact O-N 2.69Å; V834-V840 WeakPolarHBondContact O-CA 3.26Å; V834-L841 HydrophobicContact CB-CD1 3.72Å; V834-L841 HydrophobicContact CB-CG 4.08Å; V834-L841 HydrophobicContact CG1-CD1 3.78Å; V834-L841 HydrophobicContact CG1-CG 3.8Å; V834-L841 HydrophobicContact CG2-CD1 4.12Å
835	N	86.1	Confident	89.4	Confident	90 Å²	90	58.1 Å²	58.1	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	118.5	-176.9	-178.4	-3.3	0	0	0	109.7	W833 G838 T839 V840	W833-N835 PolarHBondContact O-N 2.69Å; N835-G838 WeakPolarHBondContact OD1-CA 3.2Å; N835-G838 PolarHBondContact OD1-N 2.82Å; N835-T839 PolarHBondContact OD1-N 3.03Å; N835-V840 HydrophobicContact CB-CG1 4.23Å
836	D	84.1	Confident	89.8	Confident	39 Å²	39	54.7 Å²	54.7	21%	0.209	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	104.7	175.8	-167.8	-1.6	0	0	0	109.3	G798 A800 G838 T839	G798-D836 VanDerWaalsContact CA-OD2 3.26Å; G798-D836 WeakPolarHBondContact CA-OD2 3.26Å; G798-D836 PolarHBondContact N-OD2 3.29Å; A800-D836 HydrophobicContact CB-CB 4.05Å; D836-G838 VanDerWaalsContact C-N 3.28Å; D836-G838 PolarHBondContact O-N 3.36Å; D836-T839 PolarHBondContact N-O 3.29Å; D836-T839 WeakPolarHBondContact O-CA 3.31Å; D836-T839 VanDerWaalsContact O-CB 3.28Å; D836-T839 WeakPolarHBondContact O-CB 3.06Å; D836-T839 PolarHBondContact O-N 3.27Å; D836-T839 PolarHBondContact O-OG1 3.48Å
837	Q	83.4	Confident	90.3	Very high	174 Å²	174	52 Å²	52	81%	0.813	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	37.6	178.8	-58.4	179.9	-9.9	0	0	114.5
838	G	85.9	Confident	90.4	Very high	63 Å²	63	52 Å²	52	65%	0.649	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	-1.6	-175.9	0	0	0	0	0	114.2	N835 D836	N835-G838 WeakPolarHBondContact OD1-CA 3.2Å; N835-G838 PolarHBondContact OD1-N 2.82Å; D836-G838 VanDerWaalsContact C-N 3.28Å; D836-G838 PolarHBondContact O-N 3.36Å
839	T	90.4	Very high	90.1	Very high	30 Å²	30	51.2 Å²	51.2	18%	0.184	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	111.7	175.4	-48.3	0	0	0	0	110.4	A800 H804 N835 D836	A800-T839 VanDerWaalsContact CB-O 3.3Å; A800-T839 WeakPolarHBondContact CB-O 3.39Å; H804-T839 HydrophobicContact CB-CG2 3.45Å; H804-T839 VanDerWaalsContact CB-CG2 3.45Å; H804-T839 VanDerWaalsContact CD2-CG2 3.49Å; H804-T839 WeakPolarHBondContact CD2-CG2 3.28Å; N835-T839 PolarHBondContact OD1-N 3.03Å; D836-T839 PolarHBondContact N-O 3.29Å; D836-T839 WeakPolarHBondContact O-CA 3.31Å; D836-T839 VanDerWaalsContact O-CB 3.28Å; D836-T839 WeakPolarHBondContact O-CB 3.06Å; D836-T839 PolarHBondContact O-N 3.27Å; D836-T839 PolarHBondContact O-OG1 3.48Å
840	V	93.6	Very high	89.4	Confident	69 Å²	69	49.5 Å²	49.5	42%	0.418	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	162.2	175	-63.6	0	0	0	0	112.2	V834 N835	V834-V840 WeakPolarHBondContact O-CA 3.26Å; N835-V840 HydrophobicContact CB-CG1 4.23Å
841	L	95.2	Very high	88.5	Confident	13 Å²	13	49.5 Å²	49.5	7%	0.068	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-63.9	145.5	168.9	-71	172.3	0	0	0	111.3	I777 A800 Y803 L831 V834	I777-L841 HydrophobicContact CD1-CD1 4.34Å; I777-L841 HydrophobicContact CG2-CD1 4.17Å; A800-L841 HydrophobicContact CB-CD2 4.09Å; A800-L841 HydrophobicContact CB-CG 4.34Å; Y803-L841 HydrophobicContact CD2-CD2 3.75Å; Y803-L841 HydrophobicContact CG-CD2 4.38Å; L831-L841 HydrophobicContact CB-CD1 4.44Å; L831-L841 HydrophobicContact CD2-CD1 3.71Å; V834-L841 HydrophobicContact CB-CD1 3.72Å; V834-L841 HydrophobicContact CB-CG 4.08Å; V834-L841 HydrophobicContact CG1-CD1 3.78Å; V834-L841 HydrophobicContact CG1-CG 3.8Å; V834-L841 HydrophobicContact CG2-CD1 4.12Å
842	P	96.4	Very high	86.9	Confident	9 Å²	9	48.8 Å²	48.8	6%	0.058	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-67.7	147.4	173	28.9	-34	0	0	0	111.1	H807 F813 Y815	H807-P842 HydrophobicContact CB-CB 3.62Å; H807-P842 HydrophobicContact CB-CG 4.04Å; F813-P842 HydrophobicContact CB-CG 4.22Å; F813-P842 HydrophobicContact CD1-CG 4.26Å; F813-P842 HydrophobicContact CD2-CB 4.16Å; F813-P842 HydrophobicContact CD2-CG 3.46Å; F813-P842 VanDerWaalsContact CD2-CG 3.46Å; F813-P842 HydrophobicContact CE2-CG 3.85Å; F813-P842 HydrophobicContact CG-CG 3.69Å; F813-P842 HydrophobicContact CZ-CG 4.41Å; Y815-P842 WeakPolarHBondContact CE2-O 3.47Å; Y815-P842 WeakPolarHBondContact OH-CD 3.41Å; Y815-P842 PolarHBondContact OH-O 3.07Å
843	K	95	Very high	84.9	Confident	171 Å²	171	44.3 Å²	44.3	74%	0.743	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-67.2	140.5	176.1	-66.6	-177	179.8	179.4	0	110.6
844	G	96.9	Very high	82.7	Confident	6 Å²	6	44 Å²	44	6%	0.062	24%	0.239	C	C	.	.			trans	-167.6	155.9	176.4	0	0	0	0	0	111.3	Y760 F813	Y760-G844 VanDerWaalsContact OH-C 3.23Å; Y760-G844 PolarHBondContact OH-N 3.16Å; Y760-G844 PolarHBondContact OH-O 2.93Å; Y760-G844 VanDerWaalsContact OH-O 3.05Å; F813-G844 VanDerWaalsContact O-CA 3.29Å; F813-G844 WeakPolarHBondContact O-CA 3.32Å
845	P	97.3	Very high	80.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.			trans	-60.9	142.5	175.1	22.6	-31.3	0	0	0	111.5	D32 I34 Y760 W762 F813 L814 Y815	D32-P845 HydrophobicContact CB-CB 3.8Å; I34-P845 HydrophobicContact CD1-CB 4.21Å; I34-P845 HydrophobicContact CD1-CG 3.74Å; I34-P845 HydrophobicContact CG1-CB 3.94Å; I34-P845 HydrophobicContact CG1-CG 3.79Å; Y760-P845 HydrophobicContact CD2-CB 3.59Å; Y760-P845 HydrophobicContact CD2-CG 4.06Å; Y760-P845 VanDerWaalsContact CE2-CA 3.44Å; Y760-P845 HydrophobicContact CE2-CB 3.84Å; Y760-P845 HydrophobicContact CE2-CG 4.45Å; Y760-P845 HydrophobicContact CG-CB 4.21Å; Y760-P845 HydrophobicContact CG-CG 4.17Å; W762-P845 HydrophobicContact CH2-CG 3.58Å; W762-P845 VanDerWaalsContact CZ2-CD 3.43Å; W762-P845 HydrophobicContact CZ2-CG 3.76Å; W762-P845 HydrophobicContact CZ3-CG 4.4Å; F813-P845 WeakPolarHBondContact O-CD 3.38Å; L814-P845 HydrophobicContact CD1-CB 4.37Å; L814-P845 HydrophobicContact CD1-CG 3.73Å; Y815-P845 PolarHBondContact N-O 3.29Å
846	V	95.4	Very high	78.3	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.024	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.1	177.3	-174	0	0	0	0	110.3	I31 D32 I773 Y815 T827 K828 L831 L848	I31-V846 WeakPolarHBondContact CG2-O 3.36Å; D32-V846 PolarHBondContact OD2-N 3.19Å; I773-V846 HydrophobicContact CD1-CG1 3.89Å; Y815-V846 HydrophobicContact CD2-CG2 4.49Å; Y815-V846 WeakPolarHBondContact O-CA 3.34Å; T827-V846 HydrophobicContact CG2-CG1 4.33Å; K828-V846 HydrophobicContact CG-CB 4.13Å; K828-V846 HydrophobicContact CG-CG2 3.9Å; L831-V846 HydrophobicContact CD1-CG2 3.7Å; V846-L848 HydrophobicContact CG1-CD1 4.4Å; V846-L848 HydrophobicContact CG1-CD2 4.02Å; V846-L848 HydrophobicContact CG1-CG 4.07Å
847	L	92.1	Very high	76.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.5	174.4	-55.5	-179.8	0	0	0	110.7	I31 L814 Y815 C816 S817 V877	I31-L847 HydrophobicContact CG2-CD2 4.23Å; L814-L847 HydrophobicContact CD1-CD1 3.74Å; L814-L847 HydrophobicContact CD1-CG 3.87Å; L814-L847 HydrophobicContact CD2-CD1 4.11Å; L814-L847 HydrophobicContact CG-CD1 4.17Å; Y815-L847 PolarHBondContact O-N 2.97Å; C816-L847 CarbonylContact C-O 3.56Å; C816-L847 WeakPolarHBondContact CA-O 3.4Å; S817-L847 PolarHBondContact N-O 3.36Å; L847-V877 HydrophobicContact CD1-CG2 4.06Å
848	L	89.4	Confident	74.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	164.2	-170.1	-64.2	170.1	0	0	0	110.3	I31 W237 R819 A824 T827 V846 P850	I31-L848 HydrophobicContact CD1-CB 4.16Å; I31-L848 WeakPolarHBondContact CD1-O 3.45Å; I31-L848 HydrophobicContact CG1-CB 4.29Å; W237-L848 WeakPolarHBondContact CH2-O 3.5Å; R819-L848 HydrophobicContact CB-CD2 4.13Å; A824-L848 VanDerWaalsContact CA-CD1 3.49Å; A824-L848 HydrophobicContact CB-CD1 3.49Å; A824-L848 VanDerWaalsContact CB-CD1 3.49Å; T827-L848 HydrophobicContact CG2-CD2 4.36Å; V846-L848 HydrophobicContact CG1-CD1 4.4Å; V846-L848 HydrophobicContact CG1-CD2 4.02Å; V846-L848 HydrophobicContact CG1-CG 4.07Å; L848-P850 WeakPolarHBondContact O-CD 3.36Å
849	A	82.8	Confident	73.1	Confident	3 Å²	3	46.3 Å²	46.3	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	119.7	173.9	0	0	0	0	0	111	R819 A820 I821 S851 F869	R819-A849 PolarHBondContact O-N 3.04Å; A820-A849 CarbonylContact C-O 3.53Å; I821-A849 PolarHBondContact N-O 3.04Å; A849-S851 PolarHBondContact O-N 3.07Å; A849-F869 HydrophobicContact CB-CE2 4.07Å; A849-F869 HydrophobicContact CB-CZ 4.21Å
850	P	72.3	Confident	71.2	Confident	36 Å²	36	49.7 Å²	49.7	23%	0.234	26%	0.263	C	S	.	.	S	Bend	trans	-71.1	-16.2	-173.6	29.9	-35.5	0	0	0	112.4	I31 H49 W237 I821 L848	I31-P850 HydrophobicContact CD1-CB 4.13Å; H49-P850 HydrophobicContact CB-CB 4.26Å; W237-P850 HydrophobicContact CH2-CG 4.13Å; W237-P850 HydrophobicContact CZ3-CG 4.04Å; I821-P850 WeakPolarHBondContact CG2-O 3.49Å; L848-P850 WeakPolarHBondContact O-CD 3.36Å
851	S	68.1	Low	69.2	Low	19 Å²	19	48.1 Å²	48.1	13%	0.133	25%	0.253	C	S	.	.			trans	-76.8	120.8	170.1	60.3	0	0	0	0	111.9	A820 A849 L853 H858	A820-S851 WeakPolarHBondContact CB-O 3.38Å; A849-S851 PolarHBondContact O-N 3.07Å; S851-L853 PolarHBondContact O-N 2.68Å; S851-H858 WeakPolarHBondContact CB-CE1 3.46Å; S851-H858 WeakPolarHBondContact CB-NE2 3.12Å; S851-H858 PolarHBondContact OG-CE1 3.22Å; S851-H858 PolarHBondContact OG-ND1 3.4Å
852	S	57.1	Low	67.2	Low	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.			trans	-89.6	33.4	161.3	-120.4	0	0	0	0	112.4	P24 A25 G822	P24-S852 CarbonylContact C-O 3.58Å; P24-S852 VanDerWaalsContact O-CB 3.27Å; P24-S852 WeakPolarHBondContact O-CB 3.49Å; P24-S852 PolarHBondContact O-OG 3.31Å; A25-S852 VanDerWaalsContact CA-O 3.23Å; A25-S852 WeakPolarHBondContact CA-O 3.48Å; A25-S852 WeakPolarHBondContact CB-O 3.41Å; A25-S852 PolarHBondContact N-O 3.45Å; G822-S852 PolarHBondContact N-OG 2.9Å
853	L	47.6	Very low	65.1	Low	54 Å²	54	54.2 Å²	54.2	28%	0.283	28%	0.281	S	S	.	.	S	Bend	trans	49.4	107.5	-179.7	-65.8	179.5	0	0	0	117.4	S851 R859	S851-L853 PolarHBondContact O-N 2.68Å; L853-R859 HydrophobicContact CD1-CG 4.48Å; L853-R859 HydrophobicContact CD2-CB 3.8Å; L853-R859 HydrophobicContact CD2-CG 4.09Å
854	F	39.6	Very low	63.3	Low	141 Å²	141	52.9 Å²	52.9	62%	0.618	28%	0.275	S	S	*	.			trans	-146.6	-23.7	155.1	-103.9	-46	0	0	0	114.3	A25 A856	A25-F854 HydrophobicContact CB-CD2 3.48Å; A25-F854 VanDerWaalsContact CB-CD2 3.48Å; A25-F854 HydrophobicContact CB-CE2 3.26Å; A25-F854 HydrophobicContact CB-CG 4.32Å; A25-F854 HydrophobicContact CB-CZ 3.94Å; F854-A856 PolarHBondContact O-N 2.87Å
855	S	43.8	Very low	62	Low	82 Å²	82	58.2 Å²	58.2	57%	0.573	30%	0.297	S	S	*	.			trans	-79.8	112.5	167.3	-55	0	0	0	0	110.1	L857 H858 R859	S855-L857 PolarHBondContact O-N 3.43Å; S855-H858 WeakPolarHBondContact O-CB 3.4Å; S855-H858 PolarHBondContact O-N 3Å; S855-R859 PolarHBondContact O-N 2.87Å
856	A	38.6	Very low	60.6	Low	82 Å²	82	59.1 Å²	59.1	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-55.7	-37.8	-179.6	0	0	0	0	0	112.8	F854 H858 R859 E860	F854-A856 PolarHBondContact O-N 2.87Å; A856-H858 VanDerWaalsContact C-N 3.31Å; A856-H858 PolarHBondContact O-N 3.39Å; A856-R859 WeakPolarHBondContact O-CA 3.46Å; A856-R859 VanDerWaalsContact O-CB 3.26Å; A856-R859 WeakPolarHBondContact O-CB 3.49Å; A856-R859 PolarHBondContact O-N 2.74Å; A856-E860 PolarHBondContact O-N 3.47Å
857	L	44.5	Very low	59.8	Low	98 Å²	98	60 Å²	60	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-31	178.3	-160	150	0	0	0	112.9	M233 S855 R859 E860 V861	M233-L857 HydrophobicContact CE-CD2 3.48Å; M233-L857 VanDerWaalsContact CE-CD2 3.48Å; M233-L857 HydrophobicContact SD-CD2 4.09Å; S855-L857 PolarHBondContact O-N 3.43Å; L857-R859 VanDerWaalsContact C-N 3.34Å; L857-E860 PolarHBondContact O-N 2.84Å; L857-V861 HydrophobicContact CD2-CG2 4.2Å; L857-V861 WeakPolarHBondContact O-CG2 3.27Å; L857-V861 PolarHBondContact O-N 3.39Å
858	H	49.9	Very low	59.3	Low	32 Å²	32	62.3 Å²	62.3	15%	0.148	32%	0.321	C	S	.	.	H	α-helix	trans	-73.5	-28.4	173.6	-166.8	-43.2	0	0	0	111.8	W235 S851 S855 A856 I862	W235-H858 HydrophobicContact CH2-CB 4.16Å; W235-H858 AromaticContact CH2-CD2 3.48Å; W235-H858 VanDerWaalsContact CH2-CD2 3.48Å; W235-H858 WeakPolarHBondContact CH2-CD2 3.46Å; W235-H858 AromaticContact CH2-CG 3.61Å; W235-H858 AromaticContact CH2-ND1 3.98Å; W235-H858 AromaticContact CH2-NE2 3.82Å; W235-H858 AromaticContact CZ3-CD2 3.54Å; W235-H858 AromaticContact CZ3-CE1 3.91Å; W235-H858 AromaticContact CZ3-NE2 3.45Å; W235-H858 WeakPolarHBondContact CZ3-NE2 3.32Å; S851-H858 WeakPolarHBondContact CB-CE1 3.46Å; S851-H858 WeakPolarHBondContact CB-NE2 3.12Å; S851-H858 PolarHBondContact OG-CE1 3.22Å; S851-H858 PolarHBondContact OG-ND1 3.4Å; S855-H858 WeakPolarHBondContact O-CB 3.4Å; S855-H858 PolarHBondContact O-N 3Å; A856-H858 VanDerWaalsContact C-N 3.31Å; A856-H858 PolarHBondContact O-N 3.39Å; H858-I862 WeakPolarHBondContact CE1-CD1 3.33Å; H858-I862 PolarHBondContact O-N 2.79Å
859	R	49.6	Very low	58.8	Low	122 Å²	122	63 Å²	63	46%	0.46	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-52.7	168.4	-169.6	175.2	175.8	135.6	10	109.4	L853 S855 A856 L857 V861 I862 E863	L853-R859 HydrophobicContact CD1-CG 4.48Å; L853-R859 HydrophobicContact CD2-CB 3.8Å; L853-R859 HydrophobicContact CD2-CG 4.09Å; S855-R859 PolarHBondContact O-N 2.87Å; A856-R859 WeakPolarHBondContact O-CA 3.46Å; A856-R859 VanDerWaalsContact O-CB 3.26Å; A856-R859 WeakPolarHBondContact O-CB 3.49Å; A856-R859 PolarHBondContact O-N 2.74Å; L857-R859 VanDerWaalsContact C-N 3.34Å; R859-V861 VanDerWaalsContact C-N 3.34Å; R859-V861 PolarHBondContact O-N 3.45Å; R859-I862 PolarHBondContact O-N 3.07Å; R859-E863 HydrophobicContact CG-CB 4.42Å; R859-E863 VanDerWaalsContact CG-OE2 3.31Å; R859-E863 WeakPolarHBondContact CG-OE2 3.22Å; R859-E863 IonicContact CZ-OE1 2.74Å; R859-E863 IonicContact CZ-OE2 3.43Å; R859-E863 IonicContact NE-OE1 2.66Å; R859-E863 PolarHBondContact NE-OE1 3.33Å; R859-E863 IonicContact NE-OE2 3.36Å; R859-E863 PolarHBondContact NE-OE2 2.99Å; R859-E863 IonicContact NH2-OE1 2.87Å; R859-E863 PolarHBondContact NH2-OE1 2.8Å; R859-E863 IonicContact NH2-OE2 2.69Å; R859-E863 WeakPolarHBondContact O-CB 3.13Å; R859-E863 PolarHBondContact O-N 2.98Å
860	E	49.5	Very low	59	Low	101 Å²	101	63.1 Å²	63.1	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-56	-44.2	-178.6	-178	161	-154.7	0	0	113.1	A856 L857 K864	A856-E860 PolarHBondContact O-N 3.47Å; L857-E860 PolarHBondContact O-N 2.84Å; E860-K864 HydrophobicContact CG-CD 3.86Å; E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 VanDerWaalsContact O-CG 3.26Å; E860-K864 WeakPolarHBondContact O-CG 3.47Å; E860-K864 PolarHBondContact O-N 3.11Å; E860-K864 VanDerWaalsContact O-N 3.11Å; E860-K864 IonicContact OE1-NZ 2.69Å; E860-K864 PolarHBondContact OE1-NZ 2.9Å
861	V	52.9	Low	59.9	Low	36 Å²	36	62.2 Å²	62.2	22%	0.218	32%	0.316	C	S	.	.	H	α-helix	trans	-69.8	-46.4	179.3	177.1	0	0	0	0	112.7	W235 L857 R859 K865	W235-V861 HydrophobicContact CZ2-CB 3.95Å; W235-V861 HydrophobicContact CZ2-CG1 3.9Å; W235-V861 HydrophobicContact CZ2-CG2 4.22Å; L857-V861 HydrophobicContact CD2-CG2 4.2Å; L857-V861 WeakPolarHBondContact O-CG2 3.27Å; L857-V861 PolarHBondContact O-N 3.39Å; R859-V861 VanDerWaalsContact C-N 3.34Å; R859-V861 PolarHBondContact O-N 3.45Å; V861-K865 WeakPolarHBondContact O-CA 3.38Å; V861-K865 WeakPolarHBondContact O-CB 3.46Å; V861-K865 PolarHBondContact O-N 3.38Å
862	I	52.7	Low	60.8	Low	25 Å²	25	62.1 Å²	62.1	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-75.4	-34.8	-178.5	-67.7	-160.6	0	0	0	112.5	H858 R859 F869	H858-I862 WeakPolarHBondContact CE1-CD1 3.33Å; H858-I862 PolarHBondContact O-N 2.79Å; R859-I862 PolarHBondContact O-N 3.07Å; I862-F869 HydrophobicContact CD1-CB 4Å; I862-F869 HydrophobicContact CD1-CD2 3.66Å; I862-F869 HydrophobicContact CD1-CE2 4.47Å; I862-F869 HydrophobicContact CD1-CG 4.01Å; I862-F869 HydrophobicContact CG1-CB 4.28Å
863	E	52.5	Low	62.3	Low	126 Å²	126	62.1 Å²	62.1	59%	0.589	32%	0.317	S	S	*	.	H	α-helix	trans	-73.9	-27.4	179.7	-162.9	164.6	-133.3	0	0	111.9	R859	R859-E863 HydrophobicContact CG-CB 4.42Å; R859-E863 VanDerWaalsContact CG-OE2 3.31Å; R859-E863 WeakPolarHBondContact CG-OE2 3.22Å; R859-E863 IonicContact CZ-OE1 2.74Å; R859-E863 IonicContact CZ-OE2 3.43Å; R859-E863 IonicContact NE-OE1 2.66Å; R859-E863 PolarHBondContact NE-OE1 3.33Å; R859-E863 IonicContact NE-OE2 3.36Å; R859-E863 PolarHBondContact NE-OE2 2.99Å; R859-E863 IonicContact NH2-OE1 2.87Å; R859-E863 PolarHBondContact NH2-OE1 2.8Å; R859-E863 IonicContact NH2-OE2 2.69Å; R859-E863 WeakPolarHBondContact O-CB 3.13Å; R859-E863 PolarHBondContact O-N 2.98Å
864	K	57.4	Low	64.5	Low	142 Å²	142	59.6 Å²	59.6	62%	0.617	30%	0.304	S	S	*	.	H	α-helix	trans	-90.6	-28.9	171.6	-65.8	179.1	175	177.6	0	114.6	E860	E860-K864 HydrophobicContact CG-CD 3.86Å; E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 VanDerWaalsContact O-CG 3.26Å; E860-K864 WeakPolarHBondContact O-CG 3.47Å; E860-K864 PolarHBondContact O-N 3.11Å; E860-K864 VanDerWaalsContact O-N 3.11Å; E860-K864 IonicContact OE1-NZ 2.69Å; E860-K864 PolarHBondContact OE1-NZ 2.9Å
865	K	68.1	Low	67	Low	119 Å²	119	54 Å²	54	52%	0.517	28%	0.282	S	S	.	.			trans	-136.9	63.1	-172.4	-66.2	-172.2	179.8	177.9	0	113.5	V861 E867 V868	V861-K865 WeakPolarHBondContact O-CA 3.38Å; V861-K865 WeakPolarHBondContact O-CB 3.46Å; V861-K865 PolarHBondContact O-N 3.38Å; K865-E867 WeakPolarHBondContact CA-OE1 3.29Å; K865-E867 WeakPolarHBondContact CB-OE1 3.31Å; K865-E867 PolarHBondContact O-N 2.91Å; K865-V868 HydrophobicContact CB-CB 4.28Å; K865-V868 HydrophobicContact CB-CG2 3.9Å; K865-V868 HydrophobicContact CD-CG2 4.19Å; K865-V868 PolarHBondContact O-N 3.03Å; K865-V868 VanDerWaalsContact O-N 3.15Å
866	P	69.5	Low	69.3	Low	18 Å²	18	51.3 Å²	51.3	12%	0.117	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-25.9	-178.5	27.1	-35.8	0	0	0	113.6	F869 K870	P866-F869 WeakPolarHBondContact O-CB 3.49Å; P866-F869 PolarHBondContact O-N 3.28Å; P866-K870 PolarHBondContact O-N 3.46Å
867	E	78.6	Confident	72	Confident	23 Å²	23	47.4 Å²	47.4	11%	0.107	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-36.9	173.2	64.3	-59.2	141.2	0	0	112.9	K865 F869 K870 I871 N897 F900	K865-E867 WeakPolarHBondContact CA-OE1 3.29Å; K865-E867 WeakPolarHBondContact CB-OE1 3.31Å; K865-E867 PolarHBondContact O-N 2.91Å; E867-F869 VanDerWaalsContact C-N 3.28Å; E867-F869 PolarHBondContact O-N 3.48Å; E867-K870 PolarHBondContact O-N 2.74Å; E867-K870 VanDerWaalsContact O-N 3.17Å; E867-I871 HydrophobicContact CB-CD1 4.38Å; E867-I871 WeakPolarHBondContact O-CB 3.4Å; E867-I871 VanDerWaalsContact O-CD1 3.28Å; E867-I871 WeakPolarHBondContact O-CD1 3.49Å; E867-I871 WeakPolarHBondContact O-CG1 3.42Å; E867-I871 PolarHBondContact O-N 2.84Å; E867-N897 HydrophobicContact CB-CB 4.1Å; E867-N897 WeakPolarHBondContact CB-O 3.5Å; E867-N897 PolarHBondContact OE2-ND2 2.91Å; E867-F900 HydrophobicContact CB-CD1 4.43Å; E867-F900 HydrophobicContact CG-CD1 4.15Å
868	V	80.7	Confident	74.3	Confident	50 Å²	50	45.8 Å²	45.8	30%	0.303	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-42.1	177	174.7	0	0	0	0	110.4	K865 A872	K865-V868 HydrophobicContact CB-CB 4.28Å; K865-V868 HydrophobicContact CB-CG2 3.9Å; K865-V868 HydrophobicContact CD-CG2 4.19Å; K865-V868 PolarHBondContact O-N 3.03Å; K865-V868 VanDerWaalsContact O-N 3.15Å; V868-A872 PolarHBondContact O-N 2.81Å; V868-A872 VanDerWaalsContact O-N 3.07Å
869	F	79.1	Confident	76.4	Confident	15 Å²	15	47.4 Å²	47.4	7%	0.066	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-51	171.8	161.3	-93.6	0	0	0	111.9	W237 A849 I862 P866 E867 I871 A872 C873	W237-F869 AromaticContact CH2-CE2 3.57Å; W237-F869 HydrophobicContact CH2-CE2 3.57Å; W237-F869 HydrophobicContact CH2-CZ 4.04Å; W237-F869 AromaticContact CZ3-CD2 3.94Å; W237-F869 HydrophobicContact CZ3-CD2 3.94Å; W237-F869 AromaticContact CZ3-CE2 3.41Å; W237-F869 HydrophobicContact CZ3-CE2 3.41Å; W237-F869 VanDerWaalsContact CZ3-CE2 3.41Å; W237-F869 HydrophobicContact CZ3-CZ 4.25Å; A849-F869 HydrophobicContact CB-CE2 4.07Å; A849-F869 HydrophobicContact CB-CZ 4.21Å; I862-F869 HydrophobicContact CD1-CB 4Å; I862-F869 HydrophobicContact CD1-CD2 3.66Å; I862-F869 HydrophobicContact CD1-CE2 4.47Å; I862-F869 HydrophobicContact CD1-CG 4.01Å; I862-F869 HydrophobicContact CG1-CB 4.28Å; P866-F869 WeakPolarHBondContact O-CB 3.49Å; P866-F869 PolarHBondContact O-N 3.28Å; E867-F869 VanDerWaalsContact C-N 3.28Å; E867-F869 PolarHBondContact O-N 3.48Å; F869-I871 VanDerWaalsContact C-N 3.34Å; F869-I871 PolarHBondContact O-N 3.43Å; F869-A872 PolarHBondContact O-N 3.44Å; F869-C873 WeakPolarHBondContact O-CB 3.12Å; F869-C873 PolarHBondContact O-N 3.26Å
870	K	87.8	Confident	78.5	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.022	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-41	179.2	-71.7	-176.4	178.4	-179.3	0	112.2	D772 P866 E867 L874 D898 A901	D772-K870 IonicContact OD2-NZ 3.45Å; D772-K870 PolarHBondContact OD2-NZ 3.27Å; P866-K870 PolarHBondContact O-N 3.46Å; E867-K870 PolarHBondContact O-N 2.74Å; E867-K870 VanDerWaalsContact O-N 3.17Å; K870-L874 VanDerWaalsContact O-CB 3.24Å; K870-L874 WeakPolarHBondContact O-CB 3.36Å; K870-L874 VanDerWaalsContact O-CG 3.27Å; K870-L874 WeakPolarHBondContact O-CG 3.39Å; K870-L874 PolarHBondContact O-N 3.1Å; K870-D898 VanDerWaalsContact NZ-CG 3.28Å; K870-D898 IonicContact NZ-OD1 3.56Å; K870-D898 PolarHBondContact NZ-OD1 2.82Å; K870-D898 IonicContact NZ-OD2 3.52Å; K870-A901 HydrophobicContact CB-CB 3.98Å
871	I	90	Very high	80.6	Confident	16 Å²	16	37.2 Å²	37.2	8%	0.082	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-50.7	176.9	-70.9	156.7	0	0	0	110.6	E867 F869 S875 F900 A901 K904	E867-I871 HydrophobicContact CB-CD1 4.38Å; E867-I871 WeakPolarHBondContact O-CB 3.4Å; E867-I871 VanDerWaalsContact O-CD1 3.28Å; E867-I871 WeakPolarHBondContact O-CD1 3.49Å; E867-I871 WeakPolarHBondContact O-CG1 3.42Å; E867-I871 PolarHBondContact O-N 2.84Å; F869-I871 VanDerWaalsContact C-N 3.34Å; F869-I871 PolarHBondContact O-N 3.43Å; I871-S875 WeakPolarHBondContact O-CB 3.29Å; I871-S875 PolarHBondContact O-N 2.94Å; I871-S875 PolarHBondContact O-OG 3.37Å; I871-F900 HydrophobicContact CD1-CD1 3.99Å; I871-F900 HydrophobicContact CD1-CE1 3.72Å; I871-A901 HydrophobicContact CD1-CB 4.46Å; I871-A901 HydrophobicContact CG1-CB 3.73Å; I871-K904 HydrophobicContact CD1-CD 3.9Å; I871-K904 HydrophobicContact CG1-CB 4.45Å; I871-K904 HydrophobicContact CG1-CD 4.2Å; I871-K904 HydrophobicContact CG2-CD 3.92Å; I871-K904 HydrophobicContact CG2-CG 4.24Å
872	A	87.4	Confident	82.1	Confident	18 Å²	18	36.6 Å²	36.6	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-47.5	-179.6	0	0	0	0	0	111.5	W235 V868 F869 S875 D876	W235-A872 WeakPolarHBondContact O-CB 3.47Å; V868-A872 PolarHBondContact O-N 2.81Å; V868-A872 VanDerWaalsContact O-N 3.07Å; F869-A872 PolarHBondContact O-N 3.44Å; A872-S875 PolarHBondContact O-N 2.95Å; A872-D876 PolarHBondContact O-N 2.77Å; A872-D876 VanDerWaalsContact O-N 3.13Å
873	C	88.6	Confident	83	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-45.9	-179.6	-171.4	0	0	0	0	112.7	W237 F869 V877	W237-C873 HydrophobicContact CD2-CB 4.06Å; W237-C873 VanDerWaalsContact CE2-SG 3.56Å; W237-C873 HydrophobicContact CE3-CB 3.94Å; W237-C873 HydrophobicContact CH2-CB 4.13Å; W237-C873 VanDerWaalsContact CH2-SG 3.53Å; W237-C873 HydrophobicContact CZ2-CB 4.29Å; W237-C873 WeakPolarHBondContact CZ2-SG 3.35Å; W237-C873 HydrophobicContact CZ3-CB 3.98Å; F869-C873 WeakPolarHBondContact O-CB 3.12Å; F869-C873 PolarHBondContact O-N 3.26Å; C873-V877 PolarHBondContact O-N 3.21Å
874	L	93.6	Very high	83.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-77.6	-30.9	179.2	-67.7	168.6	0	0	0	112.8	I770 L814 K870 D876 V877 R878 F888 Y902 V905	I770-L874 HydrophobicContact CD1-CD1 4.12Å; I770-L874 HydrophobicContact CD1-CD2 3.99Å; I770-L874 HydrophobicContact CG1-CD2 4.13Å; I770-L874 HydrophobicContact CG2-CD1 4.41Å; I770-L874 HydrophobicContact CG2-CD2 4.16Å; L814-L874 HydrophobicContact CD2-CD2 3.8Å; K870-L874 VanDerWaalsContact O-CB 3.24Å; K870-L874 WeakPolarHBondContact O-CB 3.36Å; K870-L874 VanDerWaalsContact O-CG 3.27Å; K870-L874 WeakPolarHBondContact O-CG 3.39Å; K870-L874 PolarHBondContact O-N 3.1Å; L874-D876 VanDerWaalsContact C-N 3.34Å; L874-V877 PolarHBondContact O-N 2.8Å; L874-R878 PolarHBondContact O-N 3.31Å; L874-F888 HydrophobicContact CB-CE2 4.2Å; L874-F888 HydrophobicContact CB-CZ 4.23Å; L874-F888 HydrophobicContact CD2-CE1 4.43Å; L874-F888 HydrophobicContact CD2-CZ 4.08Å; L874-F888 VanDerWaalsContact O-CE2 3.24Å; L874-F888 WeakPolarHBondContact O-CE2 3.18Å; L874-F888 VanDerWaalsContact O-CZ 3.28Å; L874-F888 WeakPolarHBondContact O-CZ 3.49Å; L874-Y902 HydrophobicContact CD1-CD1 3.98Å; L874-Y902 HydrophobicContact CD1-CE1 3.95Å; L874-V905 HydrophobicContact CB-CB 4.4Å; L874-V905 HydrophobicContact CB-CG1 3.82Å; L874-V905 HydrophobicContact CB-CG2 4.16Å; L874-V905 HydrophobicContact CD1-CG2 4.49Å
875	S	92.9	Very high	84.5	Confident	23 Å²	23	40.4 Å²	40.4	16%	0.161	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-42.4	174	-63.2	0	0	0	0	111.2	I871 A872 V877 R878 D879	I871-S875 WeakPolarHBondContact O-CB 3.29Å; I871-S875 PolarHBondContact O-N 2.94Å; I871-S875 PolarHBondContact O-OG 3.37Å; A872-S875 PolarHBondContact O-N 2.95Å; S875-V877 PolarHBondContact O-N 2.93Å; S875-R878 WeakPolarHBondContact O-CB 3.26Å; S875-R878 PolarHBondContact O-N 2.9Å; S875-D879 PolarHBondContact O-N 2.63Å
876	D	91.3	Very high	85.4	Confident	27 Å²	27	41.6 Å²	41.6	14%	0.144	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-46.8	176.2	-165.8	76.2	0	0	0	112.1	W237 R723 A872 L874 R878 D879 L880	W237-D876 HydrophobicContact CB-CB 3.57Å; W237-D876 HydrophobicContact CG-CB 3.93Å; R723-D876 IonicContact CZ-OD1 2.76Å; R723-D876 IonicContact CZ-OD2 3.16Å; R723-D876 IonicContact NH1-OD1 2.7Å; R723-D876 PolarHBondContact NH1-OD1 3.23Å; R723-D876 IonicContact NH1-OD2 3.79Å; R723-D876 PolarHBondContact NH1-OD2 3.22Å; R723-D876 VanDerWaalsContact NH2-CG 3.27Å; R723-D876 IonicContact NH2-OD1 3.31Å; R723-D876 PolarHBondContact NH2-OD1 2.96Å; R723-D876 IonicContact NH2-OD2 3.48Å; R723-D876 PolarHBondContact NH2-OD2 3.05Å; A872-D876 PolarHBondContact O-N 2.77Å; A872-D876 VanDerWaalsContact O-N 3.13Å; L874-D876 VanDerWaalsContact C-N 3.34Å; D876-R878 VanDerWaalsContact C-N 3.29Å; D876-R878 PolarHBondContact O-N 3.22Å; D876-D879 PolarHBondContact O-N 2.81Å; D876-D879 VanDerWaalsContact O-N 3.08Å; D876-L880 WeakPolarHBondContact O-CG 3.28Å; D876-L880 PolarHBondContact O-N 3.39Å
877	V	94.6	Very high	86.6	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-31.4	177.9	174.7	0	0	0	0	112.2	I34 L814 L847 C873 L874 S875 F881 F888	I34-V877 HydrophobicContact CD1-CG1 3.76Å; I34-V877 HydrophobicContact CD1-CG2 3.93Å; L814-V877 HydrophobicContact CD2-CG1 3.96Å; L847-V877 HydrophobicContact CD1-CG2 4.06Å; C873-V877 PolarHBondContact O-N 3.21Å; L874-V877 PolarHBondContact O-N 2.8Å; S875-V877 PolarHBondContact O-N 2.93Å; V877-F881 HydrophobicContact CG1-CE2 4.49Å; V877-F881 WeakPolarHBondContact O-CD2 3.4Å; V877-F881 WeakPolarHBondContact O-CE2 3.28Å; V877-F888 HydrophobicContact CB-CZ 4.15Å; V877-F888 HydrophobicContact CG1-CE1 4.1Å; V877-F888 HydrophobicContact CG1-CZ 4.03Å
878	R	94.4	Very high	87.5	Confident	64 Å²	64	40.3 Å²	40.3	24%	0.242	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-47.6	169.3	173.3	-160.7	68.8	-145.7	-8.8	110.6	L874 S875 D876 L880 F881 P887 F888	L874-R878 PolarHBondContact O-N 3.31Å; S875-R878 WeakPolarHBondContact O-CB 3.26Å; S875-R878 PolarHBondContact O-N 2.9Å; D876-R878 VanDerWaalsContact C-N 3.29Å; D876-R878 PolarHBondContact O-N 3.22Å; R878-L880 VanDerWaalsContact C-N 3.26Å; R878-L880 PolarHBondContact O-N 3.14Å; R878-F881 PolarHBondContact O-N 2.91Å; R878-P887 HydrophobicContact CB-CG 4.47Å; R878-P887 HydrophobicContact CG-CG 4.49Å; R878-F888 HydrophobicContact CB-CD2 4.47Å; R878-F888 HydrophobicContact CB-CE2 3.8Å; R878-F888 HydrophobicContact CB-CZ 4.39Å
879	D	93.2	Very high	88.2	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.353	21%	0.207	S	C	.	.	H	α-helix	trans	-69.1	-23.9	-170.2	-64.1	-23	0	0	0	112.7	S875 D876 F881 G882	S875-D879 PolarHBondContact O-N 2.63Å; D876-D879 PolarHBondContact O-N 2.81Å; D876-D879 VanDerWaalsContact O-N 3.08Å; D879-F881 PolarHBondContact O-N 2.85Å; D879-F881 VanDerWaalsContact O-N 3.16Å; D879-G882 PolarHBondContact O-N 3.47Å
880	L	94.6	Very high	89.1	Confident	4 Å²	4	39 Å²	39	2%	0.021	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.5	168.3	-56.7	-178.6	0	0	0	114.2	I34 V36 Q38 Q44 C45 D876 R878 G882	I34-L880 HydrophobicContact CB-CD1 4.22Å; I34-L880 HydrophobicContact CG2-CD1 4.32Å; V36-L880 HydrophobicContact CB-CB 4.18Å; V36-L880 WeakPolarHBondContact CB-O 3.37Å; V36-L880 HydrophobicContact CG2-CB 3.68Å; V36-L880 HydrophobicContact CG2-CD1 4.31Å; Q38-L880 PolarHBondContact NE2-O 3.38Å; Q44-L880 HydrophobicContact CB-CB 4.5Å; Q44-L880 HydrophobicContact CB-CD2 3.97Å; Q44-L880 PolarHBondContact NE2-O 3.19Å; C45-L880 WeakPolarHBondContact O-CD2 3.15Å; D876-L880 WeakPolarHBondContact O-CG 3.28Å; D876-L880 PolarHBondContact O-N 3.39Å; R878-L880 VanDerWaalsContact C-N 3.26Å; R878-L880 PolarHBondContact O-N 3.14Å; L880-G882 VanDerWaalsContact C-N 3.33Å
881	F	93.1	Very high	89.6	Confident	5 Å²	5	38.7 Å²	38.7	2%	0.022	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	5.3	178.2	-66.5	-104.6	0	0	0	113.2	V36 W762 D766 V768 V877 R878 D879 K885 P887	V36-F881 HydrophobicContact CG1-CD1 3.94Å; V36-F881 HydrophobicContact CG1-CE1 4.17Å; V36-F881 HydrophobicContact CG1-CG 4.17Å; V36-F881 HydrophobicContact CG2-CD2 4.03Å; V36-F881 HydrophobicContact CG2-CE1 4.29Å; V36-F881 HydrophobicContact CG2-CE2 3.76Å; V36-F881 HydrophobicContact CG2-CG 4.42Å; V36-F881 HydrophobicContact CG2-CZ 3.91Å; W762-F881 AromaticContact CE3-CZ 3.95Å; W762-F881 HydrophobicContact CE3-CZ 3.95Å; W762-F881 HydrophobicContact CZ3-CZ 4.48Å; D766-F881 HydrophobicContact CB-CE1 4.38Å; V768-F881 HydrophobicContact CG2-CE1 4.49Å; V768-F881 HydrophobicContact CG2-CE2 4.46Å; V768-F881 HydrophobicContact CG2-CZ 3.81Å; V877-F881 HydrophobicContact CG1-CE2 4.49Å; V877-F881 WeakPolarHBondContact O-CD2 3.4Å; V877-F881 WeakPolarHBondContact O-CE2 3.28Å; R878-F881 PolarHBondContact O-N 2.91Å; D879-F881 PolarHBondContact O-N 2.85Å; D879-F881 VanDerWaalsContact O-N 3.16Å; F881-K885 HydrophobicContact CB-CB 4.3Å; F881-P887 HydrophobicContact CB-CB 4.13Å; F881-P887 HydrophobicContact CB-CG 4.08Å; F881-P887 HydrophobicContact CD1-CB 3.69Å; F881-P887 HydrophobicContact CD1-CG 4.42Å; F881-P887 HydrophobicContact CD2-CB 3.65Å; F881-P887 HydrophobicContact CD2-CG 3.55Å; F881-P887 HydrophobicContact CE1-CB 3.89Å; F881-P887 HydrophobicContact CE2-CB 3.85Å; F881-P887 HydrophobicContact CE2-CG 3.99Å; F881-P887 HydrophobicContact CG-CB 3.56Å; F881-P887 HydrophobicContact CG-CG 3.79Å; F881-P887 HydrophobicContact CZ-CB 3.96Å
882	G	84.3	Confident	90	Very high	22 Å²	22	38 Å²	38	23%	0.227	20%	0.199	C	C	.	.			trans	88.2	144	-180	0	0	0	0	0	113.4	D879 L880 H884 K885	D879-G882 PolarHBondContact O-N 3.47Å; L880-G882 VanDerWaalsContact C-N 3.33Å; G882-H884 PolarHBondContact O-N 2.88Å; G882-K885 PolarHBondContact O-N 3.34Å
883	S	72	Confident	90.4	Very high	110 Å²	110	37.2 Å²	37.2	77%	0.769	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-8.8	-165.1	-43.7	0	0	0	0	116.8
884	H	63.3	Low	90.6	Very high	195 Å²	195	38.6 Å²	38.6	90%	0.903	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.4	8.2	178.9	-60.4	-52.7	0	0	0	113.6	G882	G882-H884 PolarHBondContact O-N 2.88Å
885	K	77.7	Confident	90.4	Very high	68 Å²	68	43.8 Å²	43.8	30%	0.296	22%	0.22	S	C	.	.			trans	-110.7	148.4	-179.3	-76.4	-156.3	169.4	-165.1	0	114.3	W764 F881 G882	W764-K885 HydrophobicContact CE3-CD 4.34Å; W764-K885 VanDerWaalsContact CZ3-CE 3.45Å; W764-K885 VanDerWaalsContact O-CD 3.31Å; W764-K885 WeakPolarHBondContact O-CD 3.36Å; W764-K885 PolarHBondContact O-NZ 3.05Å; F881-K885 HydrophobicContact CB-CB 4.3Å; G882-K885 PolarHBondContact O-N 3.34Å
886	Q	87.6	Confident	90.3	Very high	145 Å²	145	48 Å²	48	68%	0.678	25%	0.245	S	C	*	.			trans	-112.8	94.5	163.9	-68.9	177.6	-10.6	0	0	107.7	F888	Q886-F888 VanDerWaalsContact C-N 3.35Å
887	P	94.2	Very high	90.2	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.039	25%	0.254	C	S	.	.			trans	-75.5	-26.6	180	30.6	-34.4	0	0	0	112.1	V768 R878 F881 Y889	V768-P887 HydrophobicContact CG2-CB 4.42Å; V768-P887 PolarHBondContact N-O 3.05Å; R878-P887 HydrophobicContact CB-CG 4.47Å; R878-P887 HydrophobicContact CG-CG 4.49Å; F881-P887 HydrophobicContact CB-CB 4.13Å; F881-P887 HydrophobicContact CB-CG 4.08Å; F881-P887 HydrophobicContact CD1-CB 3.69Å; F881-P887 HydrophobicContact CD1-CG 4.42Å; F881-P887 HydrophobicContact CD2-CB 3.65Å; F881-P887 HydrophobicContact CD2-CG 3.55Å; F881-P887 HydrophobicContact CE1-CB 3.89Å; F881-P887 HydrophobicContact CE2-CB 3.85Å; F881-P887 HydrophobicContact CE2-CG 3.99Å; F881-P887 HydrophobicContact CG-CB 3.56Å; F881-P887 HydrophobicContact CG-CG 3.79Å; F881-P887 HydrophobicContact CZ-CB 3.96Å; P887-Y889 PolarHBondContact O-N 2.86Å
888	F	97.1	Very high	90.1	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.035	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	108.9	179.6	-54.6	-49.3	0	0	0	111.1	V768 I770 L814 L874 V877 R878 Q886 V905 V907	V768-F888 HydrophobicContact CB-CD1 3.97Å; V768-F888 HydrophobicContact CB-CE1 4.44Å; V768-F888 HydrophobicContact CG1-CD1 3.91Å; V768-F888 HydrophobicContact CG1-CE1 4.09Å; V768-F888 CarbonylContact O-C 3.59Å; V768-F888 WeakPolarHBondContact O-CA 3.22Å; I770-F888 HydrophobicContact CD1-CB 4.02Å; I770-F888 HydrophobicContact CD1-CD1 3.67Å; I770-F888 HydrophobicContact CD1-CD2 3.99Å; I770-F888 HydrophobicContact CD1-CE1 4.08Å; I770-F888 HydrophobicContact CD1-CE2 4.34Å; I770-F888 HydrophobicContact CD1-CG 3.64Å; I770-F888 HydrophobicContact CD1-CZ 4.39Å; I770-F888 HydrophobicContact CG1-CD1 3.66Å; I770-F888 HydrophobicContact CG1-CE1 4.02Å; I770-F888 HydrophobicContact CG1-CG 4.14Å; L814-F888 HydrophobicContact CD2-CE1 3.75Å; L814-F888 HydrophobicContact CD2-CZ 4.38Å; L874-F888 HydrophobicContact CB-CE2 4.2Å; L874-F888 HydrophobicContact CB-CZ 4.23Å; L874-F888 HydrophobicContact CD2-CE1 4.43Å; L874-F888 HydrophobicContact CD2-CZ 4.08Å; L874-F888 VanDerWaalsContact O-CE2 3.24Å; L874-F888 WeakPolarHBondContact O-CE2 3.18Å; L874-F888 VanDerWaalsContact O-CZ 3.28Å; L874-F888 WeakPolarHBondContact O-CZ 3.49Å; V877-F888 HydrophobicContact CB-CZ 4.15Å; V877-F888 HydrophobicContact CG1-CE1 4.1Å; V877-F888 HydrophobicContact CG1-CZ 4.03Å; R878-F888 HydrophobicContact CB-CD2 4.47Å; R878-F888 HydrophobicContact CB-CE2 3.8Å; R878-F888 HydrophobicContact CB-CZ 4.39Å; Q886-F888 VanDerWaalsContact C-N 3.35Å; F888-V905 HydrophobicContact CD2-CB 4.15Å; F888-V905 HydrophobicContact CD2-CG2 3.72Å; F888-V905 HydrophobicContact CE2-CB 4.06Å; F888-V905 HydrophobicContact CE2-CG2 3.86Å; F888-V907 HydrophobicContact CB-CG2 3.7Å
889	Y	96.6	Very high	90.1	Very high	36 Å²	36	47.2 Å²	47.2	14%	0.141	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-36.9	-179.2	-176.7	-91.5	0	0	0	112.5	V768 I769 Y811 P887 K911 F943 F944	V768-Y889 PolarHBondContact O-N 3.33Å; I769-Y889 HydrophobicContact CD1-CD1 4.1Å; Y811-Y889 HydrophobicContact CD1-CD1 4.22Å; Y811-Y889 HydrophobicContact CD1-CG 4.2Å; Y811-Y889 AromaticContact CE1-CD1 3.5Å; Y811-Y889 HydrophobicContact CE1-CD1 3.5Å; Y811-Y889 AromaticContact CE1-CD2 3.77Å; Y811-Y889 HydrophobicContact CE1-CD2 3.77Å; Y811-Y889 AromaticContact CE1-CE1 3.9Å; Y811-Y889 HydrophobicContact CE1-CE1 3.9Å; Y811-Y889 HydrophobicContact CE1-CE2 4.11Å; Y811-Y889 AromaticContact CE1-CG 3.45Å; Y811-Y889 HydrophobicContact CE1-CG 3.45Å; Y811-Y889 VanDerWaalsContact CE1-CG 3.45Å; Y811-Y889 VanDerWaalsContact OH-CZ 3.3Å; P887-Y889 PolarHBondContact O-N 2.86Å; Y889-K911 HydrophobicContact CD1-CD 4.17Å; Y889-K911 HydrophobicContact CE1-CD 3.84Å; Y889-K911 VanDerWaalsContact CE2-NZ 3.3Å; Y889-K911 WeakPolarHBondContact O-CB 3.29Å; Y889-K911 WeakPolarHBondContact O-CD 3.39Å; Y889-K911 PolarHBondContact OH-NZ 3.27Å; Y889-K911 VanDerWaalsContact OH-NZ 3.14Å; Y889-F943 VanDerWaalsContact CE1-O 3.26Å; Y889-F943 WeakPolarHBondContact CE1-O 3.39Å; Y889-F943 PolarHBondContact OH-O 3.24Å; Y889-F944 AromaticContact CD1-CD1 3.98Å; Y889-F944 HydrophobicContact CD1-CD1 3.98Å; Y889-F944 HydrophobicContact CD1-CE1 4.29Å; Y889-F944 AromaticContact CE1-CD1 3.79Å; Y889-F944 HydrophobicContact CE1-CD1 3.79Å; Y889-F944 HydrophobicContact CE1-CE1 4.29Å
890	A	97.9	Very high	90.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	163.9	-178.1	0	0	0	0	0	111	I769 I770 K911 F944	I769-A890 HydrophobicContact CD1-CB 3.88Å; I770-A890 PolarHBondContact N-O 3.49Å; A890-K911 VanDerWaalsContact CA-O 3.28Å; A890-K911 WeakPolarHBondContact CA-O 3.49Å; A890-K911 HydrophobicContact CB-CB 3.89Å; A890-K911 WeakPolarHBondContact CB-O 3.47Å; A890-F944 HydrophobicContact CB-CE1 3.64Å; A890-F944 HydrophobicContact CB-CZ 4.32Å
891	A	98.1	Very high	90.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	143.3	176.5	0	0	0	0	0	112.9	I770 Y902 V907 K911 I912 F913	I770-A891 HydrophobicContact CB-CB 3.98Å; I770-A891 HydrophobicContact CD1-CB 4.33Å; I770-A891 CarbonylContact O-C 3.53Å; I770-A891 WeakPolarHBondContact O-CA 3.41Å; A891-Y902 HydrophobicContact CB-CD1 3.75Å; A891-Y902 HydrophobicContact CB-CD2 3.38Å; A891-Y902 HydrophobicContact CB-CE1 4.12Å; A891-Y902 HydrophobicContact CB-CE2 3.76Å; A891-Y902 HydrophobicContact CB-CG 3.38Å; A891-V907 HydrophobicContact CB-CG1 4.19Å; A891-V907 HydrophobicContact CB-CG2 4.34Å; A891-K911 PolarHBondContact N-O 3.19Å; A891-I912 WeakPolarHBondContact O-CA 3.49Å; A891-F913 PolarHBondContact O-N 3.25Å
892	F	97.8	Very high	90.3	Very high	1 Å²	1	49 Å²	49	0%	0.004	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.7	173	-64.2	-92	0	0	0	109.7	I769 I770 S771 D772 T776 L802 Y803 I806 Y902 F913 Y933 L936 F944	I769-F892 HydrophobicContact CG2-CD2 3.88Å; I769-F892 HydrophobicContact CG2-CE2 3.78Å; I770-F892 PolarHBondContact O-N 2.69Å; S771-F892 WeakPolarHBondContact CA-O 3.44Å; D772-F892 PolarHBondContact N-O 3.48Å; T776-F892 HydrophobicContact CG2-CB 4.04Å; L802-F892 HydrophobicContact CD2-CE1 3.94Å; L802-F892 HydrophobicContact CD2-CZ 3.91Å; Y803-F892 HydrophobicContact CE1-CD1 4.31Å; Y803-F892 AromaticContact CE1-CD2 3.89Å; Y803-F892 HydrophobicContact CE1-CD2 3.89Å; Y803-F892 HydrophobicContact CE1-CE1 4.35Å; Y803-F892 AromaticContact CE1-CE2 3.92Å; Y803-F892 HydrophobicContact CE1-CE2 3.92Å; Y803-F892 HydrophobicContact CE1-CG 4.1Å; Y803-F892 HydrophobicContact CE1-CZ 4.16Å; Y803-F892 VanDerWaalsContact OH-CB 3.24Å; Y803-F892 WeakPolarHBondContact OH-CB 3.49Å; Y803-F892 WeakPolarHBondContact OH-CG 3.39Å; I806-F892 HydrophobicContact CD1-CE2 4.36Å; I806-F892 HydrophobicContact CD1-CZ 4.24Å; F892-Y902 PolarHBondContact O-OH 3.06Å; F892-Y902 VanDerWaalsContact O-OH 3.14Å; F892-F913 WeakPolarHBondContact CA-O 3.34Å; F892-F913 HydrophobicContact CD1-CB 3.7Å; F892-F913 HydrophobicContact CD1-CD2 4.19Å; F892-F913 HydrophobicContact CD1-CG 4.24Å; F892-F913 HydrophobicContact CE1-CB 3.86Å; F892-F913 AromaticContact CE1-CD2 3.7Å; F892-F913 HydrophobicContact CE1-CD2 3.7Å; F892-F913 HydrophobicContact CE1-CE2 4.5Å; F892-F913 AromaticContact CE1-CG 3.9Å; F892-F913 HydrophobicContact CE1-CG 3.9Å; F892-F913 HydrophobicContact CE2-CD2 4.49Å; F892-F913 AromaticContact CZ-CD2 3.87Å; F892-F913 HydrophobicContact CZ-CD2 3.87Å; F892-F913 HydrophobicContact CZ-CE2 4.34Å; F892-Y933 HydrophobicContact CD1-CE1 4.22Å; F892-Y933 HydrophobicContact CE1-CE1 4.44Å; F892-L936 HydrophobicContact CE1-CD2 3.95Å; F892-L936 HydrophobicContact CZ-CD2 4.17Å; F892-F944 HydrophobicContact CE2-CZ 4.31Å; F892-F944 AromaticContact CZ-CZ 3.98Å; F892-F944 HydrophobicContact CZ-CZ 3.98Å
893	G	95.6	Very high	90.8	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	-172.1	176.3	0	0	0	0	0	111.9	T776 F913 T914 V915	T776-G893 VanDerWaalsContact OG1-CA 3.22Å; T776-G893 WeakPolarHBondContact OG1-CA 3.47Å; G893-F913 PolarHBondContact N-O 3.18Å; G893-T914 CarbonylContact O-C 3.6Å; G893-T914 VanDerWaalsContact O-CA 3.27Å; G893-T914 WeakPolarHBondContact O-CA 3.39Å; G893-V915 PolarHBondContact O-N 3.07Å
894	N	92.6	Very high	91.9	Very high	29 Å²	29	52.1 Å²	52.1	16%	0.155	24%	0.244	C	C	.	.	S	Bend	trans	-130.8	-16.6	-179.4	66.5	-48.3	0	0	0	113.7	D774 G775 T776 D781 D898 V915	D774-N894 PolarHBondContact O-ND2 3.02Å; D774-N894 PolarHBondContact O-OD1 3.22Å; D774-N894 VanDerWaalsContact O-OD1 3.13Å; G775-N894 VanDerWaalsContact O-CB 3.31Å; G775-N894 WeakPolarHBondContact O-CB 3.35Å; T776-N894 WeakPolarHBondContact OG1-CB 3.2Å; T776-N894 PolarHBondContact OG1-N 3.45Å; T776-N894 VanDerWaalsContact OG1-N 3.17Å; T776-N894 PolarHBondContact OG1-OD1 2.9Å; D781-N894 PolarHBondContact OD1-ND2 2.86Å; D781-N894 PolarHBondContact OD2-ND2 2.76Å; N894-D898 PolarHBondContact N-OD2 3.49Å; N894-D898 VanDerWaalsContact N-OD2 3.12Å; N894-D898 PolarHBondContact OD1-OD2 3.14Å; N894-V915 WeakPolarHBondContact CA-O 3.27Å; N894-V915 HydrophobicContact CB-CG1 4.29Å
895	R	90.3	Very high	93.3	Very high	109 Å²	109	43 Å²	43	41%	0.411	20%	0.202	S	C	.	.	S	Bend	trans	-110.9	150.2	-180	-52.6	177.4	175.6	-164.1	1.4	111.6	D781 N897 D898 V899	D781-R895 IonicContact OD2-CZ 3.58Å; D781-R895 VanDerWaalsContact OD2-CZ 3.23Å; D781-R895 IonicContact OD2-NE 2.74Å; D781-R895 PolarHBondContact OD2-NE 2.81Å; D781-R895 IonicContact OD2-NH2 2.69Å; D781-R895 PolarHBondContact OD2-NH2 2.99Å; R895-N897 HydrophobicContact CB-CB 4.38Å; R895-N897 PolarHBondContact O-N 3.13Å; R895-D898 WeakPolarHBondContact CA-OD2 3.47Å; R895-D898 WeakPolarHBondContact CB-OD2 3.27Å; R895-D898 PolarHBondContact N-OD2 2.92Å; R895-D898 WeakPolarHBondContact O-CB 3.47Å; R895-D898 PolarHBondContact O-N 3.42Å; R895-V899 PolarHBondContact O-N 2.78Å
896	T	90	Very high	94	Very high	113 Å²	113	40.9 Å²	40.9	69%	0.693	20%	0.199	S	C	*	.	H	α-helix	trans	-57.4	-33.9	168.8	44.1	0	0	0	0	112.5	D898 V899 F900	T896-D898 PolarHBondContact O-N 3.03Å; T896-V899 WeakPolarHBondContact O-CB 3.2Å; T896-V899 PolarHBondContact O-N 3.35Å; T896-F900 PolarHBondContact O-N 2.81Å
897	N	89.4	Confident	94.4	Very high	63 Å²	63	34.2 Å²	34.2	34%	0.337	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-32.3	174.3	-67.3	44.8	0	0	0	112.2	E867 R895 A901	E867-N897 HydrophobicContact CB-CB 4.1Å; E867-N897 WeakPolarHBondContact CB-O 3.5Å; E867-N897 PolarHBondContact OE2-ND2 2.91Å; R895-N897 HydrophobicContact CB-CB 4.38Å; R895-N897 PolarHBondContact O-N 3.13Å; N897-A901 PolarHBondContact O-N 3.35Å; N897-A901 VanDerWaalsContact O-N 3.12Å
898	D	92.3	Very high	94.5	Very high	2 Å²	2	37 Å²	37	1%	0.011	19%	0.188	C	C	.	.	H	α-helix	trans	-74	-44.8	177.3	-44.1	-32.7	0	0	0	110.3	K870 N894 R895 T896 F900 A901 Y902	K870-D898 VanDerWaalsContact NZ-CG 3.28Å; K870-D898 IonicContact NZ-OD1 3.56Å; K870-D898 PolarHBondContact NZ-OD1 2.82Å; K870-D898 IonicContact NZ-OD2 3.52Å; N894-D898 PolarHBondContact N-OD2 3.49Å; N894-D898 VanDerWaalsContact N-OD2 3.12Å; N894-D898 PolarHBondContact OD1-OD2 3.14Å; R895-D898 WeakPolarHBondContact CA-OD2 3.47Å; R895-D898 WeakPolarHBondContact CB-OD2 3.27Å; R895-D898 PolarHBondContact N-OD2 2.92Å; R895-D898 WeakPolarHBondContact O-CB 3.47Å; R895-D898 PolarHBondContact O-N 3.42Å; T896-D898 PolarHBondContact O-N 3.03Å; D898-F900 VanDerWaalsContact C-N 3.27Å; D898-F900 PolarHBondContact O-N 3.28Å; D898-A901 CarbonylContact O-C 3.58Å; D898-A901 WeakPolarHBondContact O-CA 3.34Å; D898-A901 WeakPolarHBondContact O-CB 3.38Å; D898-A901 PolarHBondContact O-N 3.47Å; D898-Y902 HydrophobicContact CB-CD2 4.27Å; D898-Y902 HydrophobicContact CB-CE2 3.59Å; D898-Y902 WeakPolarHBondContact O-CD2 3.32Å; D898-Y902 PolarHBondContact O-N 3.09Å
899	V	94.3	Very high	94.4	Very high	8 Å²	8	40.8 Å²	40.8	5%	0.048	21%	0.206	C	C	.	.	H	α-helix	trans	-54.4	-45.3	174.3	174.8	0	0	0	0	110.7	R895 T896 Y902 K903 I912 T914 E924	R895-V899 PolarHBondContact O-N 2.78Å; T896-V899 WeakPolarHBondContact O-CB 3.2Å; T896-V899 PolarHBondContact O-N 3.35Å; V899-Y902 PolarHBondContact O-N 3.32Å; V899-K903 WeakPolarHBondContact O-CG 3.43Å; V899-K903 PolarHBondContact O-N 3.34Å; V899-I912 HydrophobicContact CB-CG2 4.32Å; V899-I912 HydrophobicContact CG1-CG2 4.16Å; V899-I912 HydrophobicContact CG2-CG2 3.89Å; V899-T914 WeakPolarHBondContact CG2-OG1 3.33Å; V899-E924 HydrophobicContact CG1-CB 4.35Å; V899-E924 VanDerWaalsContact CG1-CD 3.41Å; V899-E924 HydrophobicContact CG1-CG 3.68Å
900	F	94.1	Very high	94.2	Very high	112 Å²	112	40.5 Å²	40.5	49%	0.491	21%	0.209	S	C	.	.	H	α-helix	trans	-60.3	-45	174.1	176.4	-107.2	0	0	0	112.4	E867 I871 T896 D898 K904	E867-F900 HydrophobicContact CB-CD1 4.43Å; E867-F900 HydrophobicContact CG-CD1 4.15Å; I871-F900 HydrophobicContact CD1-CD1 3.99Å; I871-F900 HydrophobicContact CD1-CE1 3.72Å; T896-F900 PolarHBondContact O-N 2.81Å; D898-F900 VanDerWaalsContact C-N 3.27Å; D898-F900 PolarHBondContact O-N 3.28Å; F900-K904 HydrophobicContact CZ-CD 4.5Å; F900-K904 WeakPolarHBondContact O-CB 3.34Å; F900-K904 PolarHBondContact O-N 3.17Å; F900-K904 VanDerWaalsContact O-N 3.08Å
901	A	93.9	Very high	94.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-44.5	176.4	0	0	0	0	0	112.4	K870 I871 N897 D898 K904 V905	K870-A901 HydrophobicContact CB-CB 3.98Å; I871-A901 HydrophobicContact CD1-CB 4.46Å; I871-A901 HydrophobicContact CG1-CB 3.73Å; N897-A901 PolarHBondContact O-N 3.35Å; N897-A901 VanDerWaalsContact O-N 3.12Å; D898-A901 CarbonylContact O-C 3.58Å; D898-A901 WeakPolarHBondContact O-CA 3.34Å; D898-A901 WeakPolarHBondContact O-CB 3.38Å; D898-A901 PolarHBondContact O-N 3.47Å; A901-K904 PolarHBondContact O-N 3.47Å; A901-V905 PolarHBondContact O-N 2.83Å; A901-V905 VanDerWaalsContact O-N 3.14Å
902	Y	96.4	Very high	94.1	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-42.9	-179.9	-56.9	-34.7	0	0	0	112.4	I770 L874 A891 F892 D898 V899 K904 V905 G906 V907 I912	I770-Y902 HydrophobicContact CB-CE1 4.3Å; I770-Y902 HydrophobicContact CD1-CD1 4.04Å; I770-Y902 HydrophobicContact CD1-CE1 4.41Å; I770-Y902 HydrophobicContact CG2-CD1 4.28Å; I770-Y902 HydrophobicContact CG2-CE1 3.56Å; L874-Y902 HydrophobicContact CD1-CD1 3.98Å; L874-Y902 HydrophobicContact CD1-CE1 3.95Å; A891-Y902 HydrophobicContact CB-CD1 3.75Å; A891-Y902 HydrophobicContact CB-CD2 3.38Å; A891-Y902 HydrophobicContact CB-CE1 4.12Å; A891-Y902 HydrophobicContact CB-CE2 3.76Å; A891-Y902 HydrophobicContact CB-CG 3.38Å; F892-Y902 PolarHBondContact O-OH 3.06Å; F892-Y902 VanDerWaalsContact O-OH 3.14Å; D898-Y902 HydrophobicContact CB-CD2 4.27Å; D898-Y902 HydrophobicContact CB-CE2 3.59Å; D898-Y902 WeakPolarHBondContact O-CD2 3.32Å; D898-Y902 PolarHBondContact O-N 3.09Å; V899-Y902 PolarHBondContact O-N 3.32Å; Y902-K904 VanDerWaalsContact C-N 3.33Å; Y902-K904 PolarHBondContact O-N 3.42Å; Y902-V905 WeakPolarHBondContact O-CG2 3.47Å; Y902-V905 PolarHBondContact O-N 3.4Å; Y902-G906 PolarHBondContact O-N 3.4Å; Y902-V907 WeakPolarHBondContact O-CB 3.4Å; Y902-V907 WeakPolarHBondContact O-CG2 3.22Å; Y902-V907 PolarHBondContact O-N 3.23Å; Y902-I912 HydrophobicContact CD2-CG2 4.08Å
903	K	95.5	Very high	94	Very high	71 Å²	71	43.5 Å²	43.5	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-58	-45.9	171.9	-70.7	-175.9	-168.8	-165.7	0	111.2	V899 V905 G906 E909 I912 E924	V899-K903 WeakPolarHBondContact O-CG 3.43Å; V899-K903 PolarHBondContact O-N 3.34Å; K903-V905 VanDerWaalsContact C-N 3.28Å; K903-V905 PolarHBondContact O-N 2.86Å; K903-G906 PolarHBondContact O-N 3.26Å; K903-E909 HydrophobicContact CD-CG 4.24Å; K903-E909 WeakPolarHBondContact CD-OE1 3.32Å; K903-E909 WeakPolarHBondContact CE-OE1 3.38Å; K903-E909 HydrophobicContact CG-CG 4.42Å; K903-E909 IonicContact NZ-OE1 2.93Å; K903-E909 PolarHBondContact NZ-OE1 3.25Å; K903-E909 IonicContact NZ-OE2 2.64Å; K903-I912 HydrophobicContact CG-CD1 3.56Å; K903-E924 WeakPolarHBondContact CE-OE1 3.25Å; K903-E924 IonicContact NZ-OE1 2.84Å; K903-E924 PolarHBondContact NZ-OE1 3.18Å
904	K	94.2	Very high	94	Very high	127 Å²	127	44.7 Å²	44.7	55%	0.552	23%	0.229	S	C	*	.	H	α-helix	trans	-67	-23.1	-177.1	-172	164	175.6	177.2	0	114.3	I871 F900 A901 Y902	I871-K904 HydrophobicContact CD1-CD 3.9Å; I871-K904 HydrophobicContact CG1-CB 4.45Å; I871-K904 HydrophobicContact CG1-CD 4.2Å; I871-K904 HydrophobicContact CG2-CD 3.92Å; I871-K904 HydrophobicContact CG2-CG 4.24Å; F900-K904 HydrophobicContact CZ-CD 4.5Å; F900-K904 WeakPolarHBondContact O-CB 3.34Å; F900-K904 PolarHBondContact O-N 3.17Å; F900-K904 VanDerWaalsContact O-N 3.08Å; A901-K904 PolarHBondContact O-N 3.47Å; Y902-K904 VanDerWaalsContact C-N 3.33Å; Y902-K904 PolarHBondContact O-N 3.42Å
905	V	93.3	Very high	94.1	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.018	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.2	171.7	-56.7	0	0	0	0	114.2	I770 L874 F888 A901 Y902 K903 V907	I770-V905 HydrophobicContact CD1-CG2 4.44Å; L874-V905 HydrophobicContact CB-CB 4.4Å; L874-V905 HydrophobicContact CB-CG1 3.82Å; L874-V905 HydrophobicContact CB-CG2 4.16Å; L874-V905 HydrophobicContact CD1-CG2 4.49Å; F888-V905 HydrophobicContact CD2-CB 4.15Å; F888-V905 HydrophobicContact CD2-CG2 3.72Å; F888-V905 HydrophobicContact CE2-CB 4.06Å; F888-V905 HydrophobicContact CE2-CG2 3.86Å; A901-V905 PolarHBondContact O-N 2.83Å; A901-V905 VanDerWaalsContact O-N 3.14Å; Y902-V905 WeakPolarHBondContact O-CG2 3.47Å; Y902-V905 PolarHBondContact O-N 3.4Å; K903-V905 VanDerWaalsContact C-N 3.28Å; K903-V905 PolarHBondContact O-N 2.86Å; V905-V907 HydrophobicContact CG2-CG2 4.37Å
906	G	93.3	Very high	94.2	Very high	24 Å²	24	40.2 Å²	40.2	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.4	10.6	169.9	0	0	0	0	0	116	Y902 K903 S908	Y902-G906 PolarHBondContact O-N 3.4Å; K903-G906 PolarHBondContact O-N 3.26Å; G906-S908 PolarHBondContact O-N 3.22Å
907	V	96.4	Very high	94.1	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.03	21%	0.211	C	C	.	.			trans	-74.4	126	175.5	-170	0	0	0	0	109.9	I770 F888 A891 Y902 V905 I912	I770-V907 HydrophobicContact CD1-CG2 4.11Å; F888-V907 HydrophobicContact CB-CG2 3.7Å; A891-V907 HydrophobicContact CB-CG1 4.19Å; A891-V907 HydrophobicContact CB-CG2 4.34Å; Y902-V907 WeakPolarHBondContact O-CB 3.4Å; Y902-V907 WeakPolarHBondContact O-CG2 3.22Å; Y902-V907 PolarHBondContact O-N 3.23Å; V905-V907 HydrophobicContact CG2-CG2 4.37Å; V907-I912 HydrophobicContact CB-CD1 4.24Å; V907-I912 HydrophobicContact CB-CG1 4.03Å; V907-I912 HydrophobicContact CG1-CD1 4.37Å; V907-I912 HydrophobicContact CG1-CG1 3.64Å
908	S	94.8	Very high	94	Very high	65 Å²	65	44.5 Å²	44.5	46%	0.455	23%	0.23	S	C	.	.			trans	-63.1	138.4	175.9	-179.6	0	0	0	0	111.7	G906 S910 K911 I912	G906-S908 PolarHBondContact O-N 3.22Å; S908-S910 PolarHBondContact O-N 3.02Å; S908-S910 VanDerWaalsContact O-N 3.11Å; S908-S910 PolarHBondContact OG-N 3.16Å; S908-S910 PolarHBondContact OG-OG 3.06Å; S908-K911 CarbonylContact O-C 3.47Å; S908-K911 WeakPolarHBondContact O-CA 3.41Å; S908-K911 PolarHBondContact O-N 3Å; S908-I912 PolarHBondContact O-N 3.13Å
909	E	94.5	Very high	93.9	Very high	86 Å²	86	45.1 Å²	45.1	40%	0.402	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-57.3	-27.3	177	-48.3	-162.1	162.2	0	0	113.4	K903 K911 E924 M925	K903-E909 HydrophobicContact CD-CG 4.24Å; K903-E909 WeakPolarHBondContact CD-OE1 3.32Å; K903-E909 WeakPolarHBondContact CE-OE1 3.38Å; K903-E909 HydrophobicContact CG-CG 4.42Å; K903-E909 IonicContact NZ-OE1 2.93Å; K903-E909 PolarHBondContact NZ-OE1 3.25Å; K903-E909 IonicContact NZ-OE2 2.64Å; E909-K911 PolarHBondContact O-N 3.1Å; E909-E924 HydrophobicContact CB-CG 4.11Å; E909-M925 HydrophobicContact CB-CB 4.3Å; E909-M925 PolarHBondContact O-N 3.37Å; E909-M925 VanDerWaalsContact O-N 3.16Å
910	S	93.8	Very high	93.8	Very high	31 Å²	31	47.3 Å²	47.3	22%	0.217	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-64.4	-13.4	172.8	64.8	0	0	0	0	113.7	S908 Q923	S908-S910 PolarHBondContact O-N 3.02Å; S908-S910 VanDerWaalsContact O-N 3.11Å; S908-S910 PolarHBondContact OG-N 3.16Å; S908-S910 PolarHBondContact OG-OG 3.06Å; S910-Q923 PolarHBondContact O-NE2 2.92Å
911	K	95.6	Very high	93.9	Very high	55 Å²	55	42 Å²	42	24%	0.239	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-132.7	14.6	-174.2	-60	178.4	-171.3	176.6	0	113	Y889 A890 A891 S908 E909	Y889-K911 HydrophobicContact CD1-CD 4.17Å; Y889-K911 HydrophobicContact CE1-CD 3.84Å; Y889-K911 VanDerWaalsContact CE2-NZ 3.3Å; Y889-K911 WeakPolarHBondContact O-CB 3.29Å; Y889-K911 WeakPolarHBondContact O-CD 3.39Å; Y889-K911 PolarHBondContact OH-NZ 3.27Å; Y889-K911 VanDerWaalsContact OH-NZ 3.14Å; A890-K911 VanDerWaalsContact CA-O 3.28Å; A890-K911 WeakPolarHBondContact CA-O 3.49Å; A890-K911 HydrophobicContact CB-CB 3.89Å; A890-K911 WeakPolarHBondContact CB-O 3.47Å; A891-K911 PolarHBondContact N-O 3.19Å; S908-K911 CarbonylContact O-C 3.47Å; S908-K911 WeakPolarHBondContact O-CA 3.41Å; S908-K911 PolarHBondContact O-N 3Å; E909-K911 PolarHBondContact O-N 3.1Å
912	I	97.4	Very high	93.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.7	165.9	-62	168.8	0	0	0	108	A891 V899 Y902 K903 V907 S908 E924	A891-I912 WeakPolarHBondContact O-CA 3.49Å; V899-I912 HydrophobicContact CB-CG2 4.32Å; V899-I912 HydrophobicContact CG1-CG2 4.16Å; V899-I912 HydrophobicContact CG2-CG2 3.89Å; Y902-I912 HydrophobicContact CD2-CG2 4.08Å; K903-I912 HydrophobicContact CG-CD1 3.56Å; V907-I912 HydrophobicContact CB-CD1 4.24Å; V907-I912 HydrophobicContact CB-CG1 4.03Å; V907-I912 HydrophobicContact CG1-CD1 4.37Å; V907-I912 HydrophobicContact CG1-CG1 3.64Å; S908-I912 PolarHBondContact O-N 3.13Å; I912-E924 HydrophobicContact CB-CB 3.92Å; I912-E924 HydrophobicContact CG2-CB 4.11Å; I912-E924 PolarHBondContact O-N 3.36Å
913	F	96.9	Very high	93.8	Very high	9 Å²	9	45.7 Å²	45.7	4%	0.039	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.2	178.5	-57.3	-85	0	0	0	109.9	A891 F892 G893 L921 I922 Q923 L936 F943 F944	A891-F913 PolarHBondContact O-N 3.25Å; F892-F913 WeakPolarHBondContact CA-O 3.34Å; F892-F913 HydrophobicContact CD1-CB 3.7Å; F892-F913 HydrophobicContact CD1-CD2 4.19Å; F892-F913 HydrophobicContact CD1-CG 4.24Å; F892-F913 HydrophobicContact CE1-CB 3.86Å; F892-F913 AromaticContact CE1-CD2 3.7Å; F892-F913 HydrophobicContact CE1-CD2 3.7Å; F892-F913 HydrophobicContact CE1-CE2 4.5Å; F892-F913 AromaticContact CE1-CG 3.9Å; F892-F913 HydrophobicContact CE1-CG 3.9Å; F892-F913 HydrophobicContact CE2-CD2 4.49Å; F892-F913 AromaticContact CZ-CD2 3.87Å; F892-F913 HydrophobicContact CZ-CD2 3.87Å; F892-F913 HydrophobicContact CZ-CE2 4.34Å; G893-F913 PolarHBondContact N-O 3.18Å; F913-L921 HydrophobicContact CB-CD2 4.39Å; F913-I922 CarbonylContact C-O 3.53Å; F913-I922 WeakPolarHBondContact CA-O 3.19Å; F913-Q923 HydrophobicContact CD1-CB 4.22Å; F913-Q923 HydrophobicContact CD1-CG 4.37Å; F913-Q923 HydrophobicContact CE1-CB 4.21Å; F913-Q923 HydrophobicContact CE1-CG 4.04Å; F913-L936 HydrophobicContact CD1-CD2 4.17Å; F913-L936 HydrophobicContact CE1-CD1 4.43Å; F913-L936 HydrophobicContact CE1-CD2 4Å; F913-L936 HydrophobicContact CE2-CD2 4.42Å; F913-L936 HydrophobicContact CG-CD2 4.46Å; F913-L936 HydrophobicContact CZ-CD1 4.42Å; F913-L936 HydrophobicContact CZ-CD2 4.13Å; F913-F943 HydrophobicContact CE1-CE1 4.5Å; F913-F943 AromaticContact CZ-CD1 3.93Å; F913-F943 HydrophobicContact CZ-CD1 3.93Å; F913-F943 HydrophobicContact CZ-CE1 4.15Å; F913-F944 AromaticContact CE2-CZ 3.98Å; F913-F944 HydrophobicContact CE2-CZ 3.98Å
914	T	95.8	Very high	93.7	Very high	26 Å²	26	43.2 Å²	43.2	16%	0.16	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.5	174.2	-50.9	0	0	0	0	109.2	G893 V899 I922	G893-T914 CarbonylContact O-C 3.6Å; G893-T914 VanDerWaalsContact O-CA 3.27Å; G893-T914 WeakPolarHBondContact O-CA 3.39Å; V899-T914 WeakPolarHBondContact CG2-OG1 3.33Å; T914-I922 PolarHBondContact N-O 3.39Å; T914-I922 PolarHBondContact O-N 3.26Å
915	V	94.9	Very high	93.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	147.1	171.6	77.4	0	0	0	0	110.6	G775 T776 G893 N894 E920 L921 Y933	G775-V915 WeakPolarHBondContact O-CG1 3.37Å; T776-V915 HydrophobicContact CG2-CG1 4.35Å; G893-V915 PolarHBondContact O-N 3.07Å; N894-V915 WeakPolarHBondContact CA-O 3.27Å; N894-V915 HydrophobicContact CB-CG1 4.29Å; V915-E920 WeakPolarHBondContact CA-O 3.47Å; V915-L921 HydrophobicContact CB-CD2 3.73Å; V915-L921 HydrophobicContact CG2-CD2 3.94Å; V915-Y933 HydrophobicContact CG2-CE2 3.83Å
916	N	91.9	Very high	93.3	Very high	42 Å²	42	45.6 Å²	45.6	23%	0.225	25%	0.247	C	C	.	.			trans	-105.7	167.8	169.8	76.1	14	0	0	0	111.9	H796 K918 G919 E920	H796-N916 PolarHBondContact CE1-O 2.81Å; H796-N916 VanDerWaalsContact CE1-O 3.27Å; N916-K918 PolarHBondContact O-N 2.95Å; N916-K918 WeakPolarHBondContact OD1-CB 3.26Å; N916-K918 PolarHBondContact OD1-N 2.94Å; N916-K918 VanDerWaalsContact OD1-N 3.08Å; N916-G919 WeakPolarHBondContact O-CA 3.12Å; N916-G919 PolarHBondContact O-N 3.06Å; N916-G919 PolarHBondContact OD1-N 2.81Å; N916-E920 PolarHBondContact N-O 3.04Å; N916-E920 VanDerWaalsContact N-O 3.08Å; N916-E920 PolarHBondContact ND2-OE2 3.5Å; N916-E920 PolarHBondContact OD1-N 2.92Å; N916-E920 VanDerWaalsContact OD1-N 3.13Å
917	P	87.3	Confident	92.9	Very high	99 Å²	99	50.7 Å²	50.7	64%	0.643	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.2	-178.4	-28.5	37.1	0	0	0	115.5	G919	P917-G919 VanDerWaalsContact C-N 3.28Å
918	K	88.3	Confident	92.2	Very high	166 Å²	166	54 Å²	54	72%	0.722	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.2	173.5	-61.9	-167.5	177.5	-168.3	0	112.7	N916 E920	N916-K918 PolarHBondContact O-N 2.95Å; N916-K918 WeakPolarHBondContact OD1-CB 3.26Å; N916-K918 PolarHBondContact OD1-N 2.94Å; N916-K918 VanDerWaalsContact OD1-N 3.08Å; K918-E920 HydrophobicContact CB-CG 4.32Å
919	G	88.9	Confident	91.8	Very high	15 Å²	15	56.2 Å²	56.2	16%	0.155	30%	0.304	C	S	.	.			trans	88.1	14.7	-176.9	0	0	0	0	0	114.4	H796 N916 P917	H796-G919 VanDerWaalsContact ND1-CA 3.33Å; H796-G919 WeakPolarHBondContact ND1-CA 3.27Å; N916-G919 WeakPolarHBondContact O-CA 3.12Å; N916-G919 PolarHBondContact O-N 3.06Å; N916-G919 PolarHBondContact OD1-N 2.81Å; P917-G919 VanDerWaalsContact C-N 3.28Å
920	E	93.4	Very high	91.7	Very high	55 Å²	55	58.3 Å²	58.3	26%	0.257	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.4	170.5	-52.7	174.2	126.9	0	0	108.5	V915 N916 K918 K930 S931	V915-E920 WeakPolarHBondContact CA-O 3.47Å; N916-E920 PolarHBondContact N-O 3.04Å; N916-E920 VanDerWaalsContact N-O 3.08Å; N916-E920 PolarHBondContact ND2-OE2 3.5Å; N916-E920 PolarHBondContact OD1-N 2.92Å; N916-E920 VanDerWaalsContact OD1-N 3.13Å; K918-E920 HydrophobicContact CB-CG 4.32Å; E920-K930 VanDerWaalsContact OE1-CD 3.32Å; E920-K930 WeakPolarHBondContact OE1-CD 3.25Å; E920-K930 IonicContact OE1-NZ 2.66Å; E920-K930 PolarHBondContact OE1-NZ 2.94Å; E920-K930 WeakPolarHBondContact OE2-CE 3.45Å; E920-K930 IonicContact OE2-NZ 2.65Å; E920-K930 PolarHBondContact OE2-NZ 3.39Å; E920-S931 CarbonylContact C-O 3.55Å; E920-S931 WeakPolarHBondContact CA-O 3.04Å
921	L	94.9	Very high	91.7	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.2	170.7	-76.1	179.8	0	0	0	110.2	F913 V915 K930 S931 Y933 L936	F913-L921 HydrophobicContact CB-CD2 4.39Å; V915-L921 HydrophobicContact CB-CD2 3.73Å; V915-L921 HydrophobicContact CG2-CD2 3.94Å; L921-K930 CarbonylContact O-C 3.55Å; L921-S931 PolarHBondContact N-O 3.1Å; L921-S931 PolarHBondContact O-N 3.22Å; L921-Y933 HydrophobicContact CD1-CD1 3.73Å; L921-Y933 HydrophobicContact CD1-CE1 4.05Å; L921-Y933 HydrophobicContact CD1-CG 4.21Å; L921-Y933 HydrophobicContact CD2-CD1 4.3Å; L921-Y933 HydrophobicContact CD2-CE1 3.82Å; L921-Y933 HydrophobicContact CG-CD1 4.27Å; L921-Y933 HydrophobicContact CG-CE1 4.29Å; L921-L936 HydrophobicContact CD1-CB 4.32Å; L921-L936 HydrophobicContact CD1-CD2 3.9Å
922	I	94.4	Very high	91.6	Very high	47 Å²	47	58.2 Å²	58.2	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.1	172	-57.5	175.6	0	0	0	107.5	F913 T914 K927	F913-I922 CarbonylContact C-O 3.53Å; F913-I922 WeakPolarHBondContact CA-O 3.19Å; T914-I922 PolarHBondContact N-O 3.39Å; T914-I922 PolarHBondContact O-N 3.26Å; I922-K927 HydrophobicContact CG2-CB 4.5Å
923	Q	94.5	Very high	91.5	Very high	30 Å²	30	58.3 Å²	58.3	14%	0.14	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.2	173.5	-174.3	-171	21.1	0	0	108.7	S910 F913 M925 N926 K927	S910-Q923 PolarHBondContact O-NE2 2.92Å; F913-Q923 HydrophobicContact CD1-CB 4.22Å; F913-Q923 HydrophobicContact CD1-CG 4.37Å; F913-Q923 HydrophobicContact CE1-CB 4.21Å; F913-Q923 HydrophobicContact CE1-CG 4.04Å; Q923-M925 VanDerWaalsContact C-N 3.3Å; Q923-M925 PolarHBondContact O-N 3.25Å; Q923-N926 HydrophobicContact CB-CB 4.45Å; Q923-N926 CarbonylContact O-C 2.96Å; Q923-N926 VanDerWaalsContact O-C 3.22Å; Q923-N926 PolarHBondContact O-N 3.42Å; Q923-N926 PolarHBondContact OE1-ND2 3.27Å; Q923-K927 PolarHBondContact O-N 2.66Å
924	E	93.8	Very high	91.4	Very high	20 Å²	20	62.1 Å²	62.1	9%	0.093	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.6	-37.6	-173.2	171.8	59.2	-173.7	0	0	113.1	V899 K903 E909 I912 N926 K927	V899-E924 HydrophobicContact CG1-CB 4.35Å; V899-E924 VanDerWaalsContact CG1-CD 3.41Å; V899-E924 HydrophobicContact CG1-CG 3.68Å; K903-E924 WeakPolarHBondContact CE-OE1 3.25Å; K903-E924 IonicContact NZ-OE1 2.84Å; K903-E924 PolarHBondContact NZ-OE1 3.18Å; E909-E924 HydrophobicContact CB-CG 4.11Å; I912-E924 HydrophobicContact CB-CB 3.92Å; I912-E924 HydrophobicContact CG2-CB 4.11Å; I912-E924 PolarHBondContact O-N 3.36Å; E924-N926 VanDerWaalsContact C-N 3.28Å; E924-N926 PolarHBondContact O-N 3.23Å; E924-K927 VanDerWaalsContact CD-CE 3.47Å; E924-K927 VanDerWaalsContact O-CE 3.28Å; E924-K927 WeakPolarHBondContact O-CE 3.41Å; E924-K927 WeakPolarHBondContact O-CG 3.44Å; E924-K927 WeakPolarHBondContact OE1-CE 3.38Å; E924-K927 IonicContact OE1-NZ 3.47Å; E924-K927 PolarHBondContact OE1-NZ 2.91Å; E924-K927 VanDerWaalsContact OE2-CE 3.23Å; E924-K927 WeakPolarHBondContact OE2-CE 3.37Å; E924-K927 IonicContact OE2-NZ 3.41Å; E924-K927 PolarHBondContact OE2-NZ 3.42Å
925	M	90.3	Very high	91.3	Very high	114 Å²	114	66.2 Å²	66.2	56%	0.562	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-64	-28.5	173.3	-177.6	178.6	-178.1	0	0	113.8	E909 Q923	E909-M925 HydrophobicContact CB-CB 4.3Å; E909-M925 PolarHBondContact O-N 3.37Å; E909-M925 VanDerWaalsContact O-N 3.16Å; Q923-M925 VanDerWaalsContact C-N 3.3Å; Q923-M925 PolarHBondContact O-N 3.25Å
926	N	88.6	Confident	91.3	Very high	66 Å²	66	66.3 Å²	66.3	35%	0.353	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-129.1	57.3	-169.2	-71.1	-50.8	0	0	0	111.2	Q923 E924 G928 N929	Q923-N926 HydrophobicContact CB-CB 4.45Å; Q923-N926 CarbonylContact O-C 2.96Å; Q923-N926 VanDerWaalsContact O-C 3.22Å; Q923-N926 PolarHBondContact O-N 3.42Å; Q923-N926 PolarHBondContact OE1-ND2 3.27Å; E924-N926 VanDerWaalsContact C-N 3.28Å; E924-N926 PolarHBondContact O-N 3.23Å; N926-G928 PolarHBondContact O-N 3.46Å; N926-N929 HydrophobicContact CB-CB 4.45Å; N926-N929 PolarHBondContact O-N 2.6Å
927	K	84.9	Confident	91.5	Very high	130 Å²	130	64.8 Å²	64.8	57%	0.565	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.7	-168.4	-51.9	-165.8	-171.1	-137.3	0	116.1	I922 Q923 E924	I922-K927 HydrophobicContact CG2-CB 4.5Å; Q923-K927 PolarHBondContact O-N 2.66Å; E924-K927 VanDerWaalsContact CD-CE 3.47Å; E924-K927 VanDerWaalsContact O-CE 3.28Å; E924-K927 WeakPolarHBondContact O-CE 3.41Å; E924-K927 WeakPolarHBondContact O-CG 3.44Å; E924-K927 WeakPolarHBondContact OE1-CE 3.38Å; E924-K927 IonicContact OE1-NZ 3.47Å; E924-K927 PolarHBondContact OE1-NZ 2.91Å; E924-K927 VanDerWaalsContact OE2-CE 3.23Å; E924-K927 WeakPolarHBondContact OE2-CE 3.37Å; E924-K927 IonicContact OE2-NZ 3.41Å; E924-K927 PolarHBondContact OE2-NZ 3.42Å
928	G	80.7	Confident	91.8	Very high	74 Å²	74	63 Å²	63	76%	0.763	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.3	174.5	0	0	0	0	0	114.8	N926	N926-G928 PolarHBondContact O-N 3.46Å
929	N	86.4	Confident	92.1	Very high	112 Å²	112	58.4 Å²	58.4	60%	0.599	33%	0.332	S	S	*	.			trans	-95.7	105.7	-173.8	-72.3	-17.5	0	0	0	111.4	N926	N926-N929 HydrophobicContact CB-CB 4.45Å; N926-N929 PolarHBondContact O-N 2.6Å
930	K	92.9	Very high	92.4	Very high	131 Å²	131	57.7 Å²	57.7	57%	0.57	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	142.5	170.1	-64.4	-172	175.6	-166.7	0	111.7	E920 L921	E920-K930 VanDerWaalsContact OE1-CD 3.32Å; E920-K930 WeakPolarHBondContact OE1-CD 3.25Å; E920-K930 IonicContact OE1-NZ 2.66Å; E920-K930 PolarHBondContact OE1-NZ 2.94Å; E920-K930 WeakPolarHBondContact OE2-CE 3.45Å; E920-K930 IonicContact OE2-NZ 2.65Å; E920-K930 PolarHBondContact OE2-NZ 3.39Å; L921-K930 CarbonylContact O-C 3.55Å
931	S	93.6	Very high	92.3	Very high	39 Å²	39	59.9 Å²	59.9	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	-169.5	-177.8	-174.7	0	0	0	0	109.7	E920 L921 H935	E920-S931 CarbonylContact C-O 3.55Å; E920-S931 WeakPolarHBondContact CA-O 3.04Å; L921-S931 PolarHBondContact N-O 3.1Å; L921-S931 PolarHBondContact O-N 3.22Å; S931-H935 PolarHBondContact OG-CD2 3.36Å
932	S	94.7	Very high	92.1	Very high	44 Å²	44	67.2 Å²	67.2	31%	0.308	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.1	172.3	65.2	0	0	0	0	111.1	N934 H935 L936	S932-N934 PolarHBondContact O-N 3.34Å; S932-N934 VanDerWaalsContact O-N 3.16Å; S932-H935 PolarHBondContact O-N 2.58Å; S932-H935 PolarHBondContact OG-N 2.76Å; S932-L936 PolarHBondContact O-N 3.26Å
933	Y	95.3	Very high	92	Very high	3 Å²	3	67.1 Å²	67.1	1%	0.012	37%	0.366	C	S	.	.	H	α-helix	trans	-51.7	-37.3	173.6	-70.6	-62.2	0	0	0	112.5	T776 H796 I799 L802 F892 V915 L921 T937	T776-Y933 PolarHBondContact O-OH 3.1Å; H796-Y933 HydrophobicContact CB-CD2 3.85Å; H796-Y933 HydrophobicContact CB-CE2 3.51Å; H796-Y933 AromaticContact CG-CE2 3.91Å; I799-Y933 HydrophobicContact CB-CD1 4.18Å; I799-Y933 HydrophobicContact CB-CD2 4Å; I799-Y933 HydrophobicContact CB-CE1 4.26Å; I799-Y933 HydrophobicContact CB-CE2 4.06Å; I799-Y933 HydrophobicContact CB-CG 4.06Å; I799-Y933 HydrophobicContact CD1-CE1 3.89Å; I799-Y933 HydrophobicContact CD1-CE2 4.03Å; I799-Y933 WeakPolarHBondContact CD1-OH 3.27Å; I799-Y933 HydrophobicContact CG1-CD1 3.95Å; I799-Y933 HydrophobicContact CG1-CD2 4.43Å; I799-Y933 HydrophobicContact CG1-CE1 3.66Å; I799-Y933 HydrophobicContact CG1-CE2 4.14Å; I799-Y933 HydrophobicContact CG1-CG 4.34Å; L802-Y933 HydrophobicContact CD2-CD1 3.71Å; L802-Y933 HydrophobicContact CD2-CE1 4.38Å; F892-Y933 HydrophobicContact CD1-CE1 4.22Å; F892-Y933 HydrophobicContact CE1-CE1 4.44Å; V915-Y933 HydrophobicContact CG2-CE2 3.83Å; L921-Y933 HydrophobicContact CD1-CD1 3.73Å; L921-Y933 HydrophobicContact CD1-CE1 4.05Å; L921-Y933 HydrophobicContact CD1-CG 4.21Å; L921-Y933 HydrophobicContact CD2-CD1 4.3Å; L921-Y933 HydrophobicContact CD2-CE1 3.82Å; L921-Y933 HydrophobicContact CG-CD1 4.27Å; L921-Y933 HydrophobicContact CG-CE1 4.29Å; Y933-T937 VanDerWaalsContact O-CB 3.3Å; Y933-T937 WeakPolarHBondContact O-CB 3.23Å; Y933-T937 PolarHBondContact O-N 2.86Å; Y933-T937 PolarHBondContact O-OG1 3.27Å
934	N	94.1	Very high	92	Very high	88 Å²	88	65.7 Å²	65.7	47%	0.471	36%	0.359	S	S	.	.	H	α-helix	trans	-71.1	-37	177.2	-75.9	-41.6	0	0	0	113.5	G798 S932 T937 G938	G798-N934 WeakPolarHBondContact CA-OD1 3.44Å; S932-N934 PolarHBondContact O-N 3.34Å; S932-N934 VanDerWaalsContact O-N 3.16Å; N934-T937 WeakPolarHBondContact O-CB 3.31Å; N934-T937 PolarHBondContact O-N 3.12Å; N934-G938 PolarHBondContact O-N 2.88Å
935	H	94.4	Very high	92	Very high	112 Å²	112	67.3 Å²	67.3	52%	0.519	37%	0.372	S	S	.	.	H	α-helix	trans	-68.9	-45.9	175.3	-175.1	80.1	0	0	0	110.9	S931 S932 T937 G938 L939	S931-H935 PolarHBondContact OG-CD2 3.36Å; S932-H935 PolarHBondContact O-N 2.58Å; S932-H935 PolarHBondContact OG-N 2.76Å; H935-T937 PolarHBondContact O-N 2.96Å; H935-G938 WeakPolarHBondContact O-CA 3.37Å; H935-G938 PolarHBondContact O-N 2.85Å; H935-L939 PolarHBondContact O-N 2.8Å
936	L	94.9	Very high	92.1	Very high	5 Å²	5	66.3 Å²	66.3	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-62.5	-30.7	174.5	-171	56.3	0	0	0	112.1	L802 F892 F913 L921 S932 G938 L939 V940 F943 F944	L802-L936 HydrophobicContact CD1-CB 4.28Å; L802-L936 HydrophobicContact CD1-CD2 4.49Å; L802-L936 HydrophobicContact CD1-CG 3.98Å; L802-L936 HydrophobicContact CD2-CB 4.41Å; L802-L936 HydrophobicContact CD2-CD2 3.82Å; L802-L936 HydrophobicContact CD2-CG 4.16Å; F892-L936 HydrophobicContact CE1-CD2 3.95Å; F892-L936 HydrophobicContact CZ-CD2 4.17Å; F913-L936 HydrophobicContact CD1-CD2 4.17Å; F913-L936 HydrophobicContact CE1-CD1 4.43Å; F913-L936 HydrophobicContact CE1-CD2 4Å; F913-L936 HydrophobicContact CE2-CD2 4.42Å; F913-L936 HydrophobicContact CG-CD2 4.46Å; F913-L936 HydrophobicContact CZ-CD1 4.42Å; F913-L936 HydrophobicContact CZ-CD2 4.13Å; L921-L936 HydrophobicContact CD1-CB 4.32Å; L921-L936 HydrophobicContact CD1-CD2 3.9Å; S932-L936 PolarHBondContact O-N 3.26Å; L936-G938 PolarHBondContact O-N 2.82Å; L936-L939 CarbonylContact O-C 3.22Å; L936-L939 PolarHBondContact O-N 2.83Å; L936-V940 WeakPolarHBondContact O-CG2 3.38Å; L936-V940 PolarHBondContact O-N 3.06Å; L936-V940 VanDerWaalsContact O-N 3.15Å; L936-F943 HydrophobicContact CD1-CB 4.4Å; L936-F943 HydrophobicContact CD1-CD2 3.96Å; L936-F943 HydrophobicContact CD1-CE2 4.38Å; L936-F943 HydrophobicContact CD1-CG 4.06Å; L936-F944 HydrophobicContact CD1-CE2 4.35Å; L936-F944 HydrophobicContact CD2-CE2 4.48Å; L936-F944 HydrophobicContact CG-CE2 4.46Å
937	T	95.5	Very high	92	Very high	10 Å²	10	65.3 Å²	65.3	6%	0.061	37%	0.368	C	S	.	.	H	α-helix	trans	-61.4	-26	171.4	-65.6	0	0	0	0	112.8	K801 L802 K805 Y933 N934 H935	K801-T937 HydrophobicContact CD-CG2 4.32Å; K801-T937 HydrophobicContact CG-CG2 4.06Å; L802-T937 WeakPolarHBondContact CA-OG1 3.42Å; L802-T937 WeakPolarHBondContact CB-OG1 3.27Å; K805-T937 HydrophobicContact CD-CG2 4.04Å; K805-T937 PolarHBondContact NZ-O 3.29Å; Y933-T937 VanDerWaalsContact O-CB 3.3Å; Y933-T937 WeakPolarHBondContact O-CB 3.23Å; Y933-T937 PolarHBondContact O-N 2.86Å; Y933-T937 PolarHBondContact O-OG1 3.27Å; N934-T937 WeakPolarHBondContact O-CB 3.31Å; N934-T937 PolarHBondContact O-N 3.12Å; H935-T937 PolarHBondContact O-N 2.96Å
938	G	94.4	Very high	90.8	Very high	60 Å²	60	61.7 Å²	61.7	62%	0.619	36%	0.359	S	S	*	.	H	α-helix	trans	-76.8	-27.9	171.2	0	0	0	0	0	113.7	N934 H935 L936	N934-G938 PolarHBondContact O-N 2.88Å; H935-G938 WeakPolarHBondContact O-CA 3.37Å; H935-G938 PolarHBondContact O-N 2.85Å; L936-G938 PolarHBondContact O-N 2.82Å
939	L	94	Very high	89.4	Confident	71 Å²	71	62.9 Å²	62.9	37%	0.372	36%	0.362	S	S	.	.	S	Bend	trans	-102.8	9.9	-174.4	-57.2	179	0	0	0	114.1	H935 L936 E941 H942 F943	H935-L939 PolarHBondContact O-N 2.8Å; L936-L939 CarbonylContact O-C 3.22Å; L936-L939 PolarHBondContact O-N 2.83Å; L939-E941 VanDerWaalsContact C-N 3.33Å; L939-E941 PolarHBondContact O-N 3.35Å; L939-H942 PolarHBondContact O-N 3.03Å; L939-F943 HydrophobicContact CB-CD2 3.89Å; L939-F943 HydrophobicContact CB-CE2 4.17Å; L939-F943 HydrophobicContact CD1-CE2 4.1Å; L939-F943 PolarHBondContact O-N 3.16Å; L939-F943 VanDerWaalsContact O-N 3.12Å
940	V	94.6	Very high	87.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-54.3	-45	-174.7	178.6	0	0	0	0	112.5	L802 K805 I806 L936 H942 F943 F944	L802-V940 HydrophobicContact CD1-CG2 3.58Å; K805-V940 HydrophobicContact CB-CG1 4.14Å; K805-V940 HydrophobicContact CB-CG2 4.11Å; K805-V940 HydrophobicContact CD-CB 4.16Å; K805-V940 HydrophobicContact CD-CG2 3.82Å; I806-V940 HydrophobicContact CG1-CG1 4Å; L936-V940 WeakPolarHBondContact O-CG2 3.38Å; L936-V940 PolarHBondContact O-N 3.06Å; L936-V940 VanDerWaalsContact O-N 3.15Å; V940-H942 PolarHBondContact O-N 2.86Å; V940-H942 VanDerWaalsContact O-N 3.11Å; V940-F943 PolarHBondContact O-N 2.93Å; V940-F944 HydrophobicContact CG1-CB 4.06Å; V940-F944 HydrophobicContact CG1-CD2 4.29Å; V940-F944 CarbonylContact O-C 3.54Å; V940-F944 WeakPolarHBondContact O-CA 3.48Å; V940-F944 PolarHBondContact O-N 3.29Å
941	E	92	Very high	84.8	Confident	100 Å²	100	63 Å²	63	47%	0.467	37%	0.365	S	S	.	.	H	α-helix	trans	-64.7	-20.8	-176.4	-41.8	-44.3	139.6	0	0	113.2	N809 L939	N809-E941 PolarHBondContact ND2-OE2 3.17Å; L939-E941 VanDerWaalsContact C-N 3.33Å; L939-E941 PolarHBondContact O-N 3.35Å
942	H	90.2	Very high	82.4	Confident	156 Å²	156	68 Å²	68	72%	0.722	39%	0.389	S	S	*	.	H	α-helix	trans	-88.4	-44.6	176.4	-175.7	68.3	0	0	0	112.2	L939 V940	L939-H942 PolarHBondContact O-N 3.03Å; V940-H942 PolarHBondContact O-N 2.86Å; V940-H942 VanDerWaalsContact O-N 3.11Å
943	F	91.6	Very high	79.7	Confident	44 Å²	44	71 Å²	71	19%	0.193	40%	0.401	C	S	.	.	H	α-helix	trans	-81.6	-29.2	-178.6	-82.1	-92	0	0	0	113.9	Y889 F913 L936 L939 V940	Y889-F943 VanDerWaalsContact CE1-O 3.26Å; Y889-F943 WeakPolarHBondContact CE1-O 3.39Å; Y889-F943 PolarHBondContact OH-O 3.24Å; F913-F943 HydrophobicContact CE1-CE1 4.5Å; F913-F943 AromaticContact CZ-CD1 3.93Å; F913-F943 HydrophobicContact CZ-CD1 3.93Å; F913-F943 HydrophobicContact CZ-CE1 4.15Å; L936-F943 HydrophobicContact CD1-CB 4.4Å; L936-F943 HydrophobicContact CD1-CD2 3.96Å; L936-F943 HydrophobicContact CD1-CE2 4.38Å; L936-F943 HydrophobicContact CD1-CG 4.06Å; L939-F943 HydrophobicContact CB-CD2 3.89Å; L939-F943 HydrophobicContact CB-CE2 4.17Å; L939-F943 HydrophobicContact CD1-CE2 4.1Å; L939-F943 PolarHBondContact O-N 3.16Å; L939-F943 VanDerWaalsContact O-N 3.12Å; V940-F943 PolarHBondContact O-N 2.93Å
944	F	95.1	Very high	77	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	43%	0.433	C	S	.	.	S	Bend	trans	-135.8	62	-173.9	-52.4	-87.7	0	0	0	110	I769 I806 N809 Y811 Y889 A890 F892 F913 L936 V940	I769-F944 HydrophobicContact CD1-CD1 3.95Å; I769-F944 HydrophobicContact CD1-CE1 3.87Å; I806-F944 HydrophobicContact CD1-CD1 4.11Å; I806-F944 HydrophobicContact CD1-CD2 3.79Å; I806-F944 HydrophobicContact CD1-CE1 3.93Å; I806-F944 HydrophobicContact CD1-CE2 3.61Å; I806-F944 HydrophobicContact CD1-CG 4.04Å; I806-F944 HydrophobicContact CD1-CZ 3.69Å; I806-F944 HydrophobicContact CG1-CB 4.23Å; I806-F944 HydrophobicContact CG1-CD1 4.18Å; I806-F944 HydrophobicContact CG1-CD2 3.77Å; I806-F944 HydrophobicContact CG1-CE2 4.14Å; I806-F944 HydrophobicContact CG1-CG 3.8Å; I806-F944 HydrophobicContact CG2-CB 4.33Å; I806-F944 HydrophobicContact CG2-CD1 3.88Å; I806-F944 HydrophobicContact CG2-CE1 4.43Å; I806-F944 HydrophobicContact CG2-CG 4.13Å; N809-F944 PolarHBondContact ND2-O 2.95Å; Y811-F944 HydrophobicContact CD2-CB 4.42Å; Y811-F944 HydrophobicContact CE2-CB 3.93Å; Y889-F944 AromaticContact CD1-CD1 3.98Å; Y889-F944 HydrophobicContact CD1-CD1 3.98Å; Y889-F944 HydrophobicContact CD1-CE1 4.29Å; Y889-F944 AromaticContact CE1-CD1 3.79Å; Y889-F944 HydrophobicContact CE1-CD1 3.79Å; Y889-F944 HydrophobicContact CE1-CE1 4.29Å; A890-F944 HydrophobicContact CB-CE1 3.64Å; A890-F944 HydrophobicContact CB-CZ 4.32Å; F892-F944 HydrophobicContact CE2-CZ 4.31Å; F892-F944 AromaticContact CZ-CZ 3.98Å; F892-F944 HydrophobicContact CZ-CZ 3.98Å; F913-F944 AromaticContact CE2-CZ 3.98Å; F913-F944 HydrophobicContact CE2-CZ 3.98Å; L936-F944 HydrophobicContact CD1-CE2 4.35Å; L936-F944 HydrophobicContact CD2-CE2 4.48Å; L936-F944 HydrophobicContact CG-CE2 4.46Å; V940-F944 HydrophobicContact CG1-CB 4.06Å; V940-F944 HydrophobicContact CG1-CD2 4.29Å; V940-F944 CarbonylContact O-C 3.54Å; V940-F944 WeakPolarHBondContact O-CA 3.48Å; V940-F944 PolarHBondContact O-N 3.29Å
945	P	94.1	Very high	74.5	Confident	55 Å²	55	73.5 Å²	73.5	36%	0.357	43%	0.434	S	S	.	.			trans	-61.3	146.1	-178.5	27.6	-36.4	0	0	0	111.8	Y811 V947	Y811-P945 WeakPolarHBondContact CE2-O 3.5Å; Y811-P945 PolarHBondContact OH-O 3.17Å; Y811-P945 VanDerWaalsContact OH-O 3.11Å; P945-V947 PolarHBondContact O-N 3.42Å
946	V	92	Very high	72	Confident	93 Å²	93	74.1 Å²	74.1	56%	0.564	44%	0.44	S	S	*	.			trans	-51.9	128.4	-175.1	-178	0	0	0	0	112.4	N809 S948	N809-V946 HydrophobicContact CB-CG2 4.23Å; N809-V946 WeakPolarHBondContact O-CA 3.39Å; V946-S948 PolarHBondContact O-N 3.13Å
947	V	85.8	Confident	69.6	Low	45 Å²	45	80.5 Å²	80.5	27%	0.273	47%	0.473	S	S	.	.			trans	-83.7	98.6	173.2	-173.9	0	0	0	0	109	N809 Y811 P945 A949	N809-V947 PolarHBondContact O-N 2.96Å; Y811-V947 HydrophobicContact CD1-CG2 4.46Å; Y811-V947 HydrophobicContact CD2-CG2 4.13Å; Y811-V947 HydrophobicContact CE1-CG2 4.11Å; Y811-V947 HydrophobicContact CE2-CG2 3.74Å; Y811-V947 HydrophobicContact CG-CG2 4.48Å; P945-V947 PolarHBondContact O-N 3.42Å; V947-A949 PolarHBondContact O-N 3.41Å
948	S	61.4	Low	67.1	Low	54 Å²	54	84.6 Å²	84.6	38%	0.378	50%	0.498	S	S	.	.			trans	-72.3	118.8	177.1	47.4	0	0	0	0	111.7	V946 E950 T951	V946-S948 PolarHBondContact O-N 3.13Å; S948-E950 PolarHBondContact O-N 3.35Å; S948-E950 VanDerWaalsContact O-N 3.12Å; S948-T951 WeakPolarHBondContact CB-OG1 3.44Å; S948-T951 PolarHBondContact O-N 3.37Å; S948-T951 WeakPolarHBondContact OG-CB 3.23Å; S948-T951 PolarHBondContact OG-OG1 2.61Å
949	A	51.3	Low	64.6	Low	99 Å²	99	84.1 Å²	84.1	82%	0.818	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.7	-172.7	0	0	0	0	0	115	V947	V947-A949 PolarHBondContact O-N 3.41Å
950	E	42.1	Very low	62.7	Low	189 Å²	189	84.8 Å²	84.8	88%	0.883	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.6	-172.3	-62.4	172.2	135.9	0	0	113.6	S948 N952	S948-E950 PolarHBondContact O-N 3.35Å; S948-E950 VanDerWaalsContact O-N 3.12Å; E950-N952 PolarHBondContact O-N 3.24Å; E950-N952 VanDerWaalsContact O-N 3.09Å
951	T	40.7	Very low	60.5	Low	56 Å²	56	91.1 Å²	91.1	34%	0.344	52%	0.523	S	S	.	.			trans	-90.6	80	-169.4	-45.8	0	0	0	0	112.2	S948 N953	S948-T951 WeakPolarHBondContact CB-OG1 3.44Å; S948-T951 PolarHBondContact O-N 3.37Å; S948-T951 WeakPolarHBondContact OG-CB 3.23Å; S948-T951 PolarHBondContact OG-OG1 2.61Å; T951-N953 HydrophobicContact CG2-CB 4.03Å; T951-N953 PolarHBondContact O-N 2.84Å
952	N	42.8	Very low	58.5	Low	145 Å²	145	93.9 Å²	93.9	78%	0.775	53%	0.53	S	S	*	.			trans	-73.9	43.2	167.7	-149.4	11.6	0	0	0	112.1	E950	E950-N952 PolarHBondContact O-N 3.24Å; E950-N952 VanDerWaalsContact O-N 3.09Å
953	N	37.1	Very low	57	Low	107 Å²	107	88.9 Å²	88.9	57%	0.572	51%	0.513	S	S	*	.	S	Bend	trans	-143.3	135.2	-179	-63.3	-82.8	0	0	0	108.7	T951 A955	T951-N953 HydrophobicContact CG2-CB 4.03Å; T951-N953 PolarHBondContact O-N 2.84Å; N953-A955 HydrophobicContact CB-CB 3.68Å; N953-A955 PolarHBondContact O-N 3.46Å
954	A	39.9	Very low	55.1	Low	82 Å²	82	91.8 Å²	91.8	68%	0.678	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	cis	55.9	7	48.7	0	0	0	0	0	115.1	V958	A954-V958 HydrophobicContact CB-CG2 4.32Å; A954-V958 WeakPolarHBondContact O-CB 3.25Å; A954-V958 WeakPolarHBondContact O-CG2 3.47Å
955	A	40.4	Very low	53.3	Low	60 Å²	60	98.9 Å²	98.9	50%	0.496	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.3	-51	-178.1	0	0	0	0	0	113.5	N953 L957	N953-A955 HydrophobicContact CB-CB 3.68Å; N953-A955 PolarHBondContact O-N 3.46Å; A955-L957 VanDerWaalsContact C-N 3.31Å; A955-L957 PolarHBondContact O-N 3.39Å
956	I	43.1	Very low	51.6	Low	126 Å²	126	98 Å²	98	65%	0.646	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-18.6	-173.2	-63.8	174.6	0	0	0	113
957	L	43.2	Very low	50.2	Low	138 Å²	138	100.4 Å²	100.4	72%	0.723	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	1	-177.9	-68	176.6	0	0	0	114.9	A955	A955-L957 VanDerWaalsContact C-N 3.31Å; A955-L957 PolarHBondContact O-N 3.39Å
958	V	43.3	Very low	49.6	Very low	96 Å²	96	108.2 Å²	108.2	58%	0.582	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-26.2	178.7	167.9	0	0	0	0	112.1	A954	A954-V958 HydrophobicContact CB-CG2 4.32Å; A954-V958 WeakPolarHBondContact O-CB 3.25Å; A954-V958 WeakPolarHBondContact O-CG2 3.47Å
959	C	42.8	Very low	49.9	Very low	51 Å²	51	111.4 Å²	111.4	35%	0.345	60%	0.597	S	S	.	*			trans	-128.4	86.6	175.2	-45	0	0	0	0	111	E961 Y962	C959-E961 PolarHBondContact O-N 2.93Å; C959-E961 VanDerWaalsContact O-N 3.08Å; C959-Y962 HydrophobicContact CB-CD2 3.47Å; C959-Y962 VanDerWaalsContact CB-CD2 3.47Å; C959-Y962 HydrophobicContact CB-CE2 4.04Å; C959-Y962 HydrophobicContact CB-CG 4.42Å; C959-Y962 PolarHBondContact O-N 3.33Å
960	P	53.5	Low	50.9	Low	85 Å²	85	114.1 Å²	114.1	55%	0.552	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-56.2	-23.5	175.7	-25.2	35.4	0	0	0	113.8	Y962 S963 S966	P960-Y962 PolarHBondContact O-N 2.96Å; P960-S963 PolarHBondContact O-N 3.08Å; P960-S966 WeakPolarHBondContact O-CB 3.46Å; P960-S966 PolarHBondContact O-OG 2.65Å
961	E	47.3	Very low	52.2	Low	132 Å²	132	110.8 Å²	110.8	62%	0.617	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-56.7	-26.7	171.7	-64.5	128.5	-125.3	0	0	114.2	C959 S966 Y967	C959-E961 PolarHBondContact O-N 2.93Å; C959-E961 VanDerWaalsContact O-N 3.08Å; E961-S966 VanDerWaalsContact C-CB 3.44Å; E961-S966 CarbonylContact O-C 3.53Å; E961-S966 WeakPolarHBondContact O-CB 3.31Å; E961-Y967 PolarHBondContact O-N 3.37Å
962	Y	50.2	Low	53.8	Low	159 Å²	159	115.9 Å²	115.9	62%	0.624	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-101.8	11.3	-176.9	-64.2	-101.3	0	0	0	112.9	C959 P960 Y967	C959-Y962 HydrophobicContact CB-CD2 3.47Å; C959-Y962 VanDerWaalsContact CB-CD2 3.47Å; C959-Y962 HydrophobicContact CB-CE2 4.04Å; C959-Y962 HydrophobicContact CB-CG 4.42Å; C959-Y962 PolarHBondContact O-N 3.33Å; P960-Y962 PolarHBondContact O-N 2.96Å; Y962-Y967 HydrophobicContact CD1-CD2 4.01Å; Y962-Y967 HydrophobicContact CD1-CE2 4.27Å
963	S	59.8	Low	55.4	Low	50 Å²	50	114.4 Å²	114.4	35%	0.35	62%	0.615	S	S	.	*	S	Bend	trans	-61.5	152.5	165.9	93.2	0	0	0	0	110.2	P960 F965 S966 Y967	P960-S963 PolarHBondContact O-N 3.08Å; S963-F965 PolarHBondContact O-N 2.71Å; S963-F965 PolarHBondContact OG-N 3.27Å; S963-S966 PolarHBondContact O-N 3.01Å; S963-S966 WeakPolarHBondContact OG-CB 3.33Å; S963-S966 PolarHBondContact OG-N 2.74Å; S963-S966 VanDerWaalsContact OG-N 3.14Å; S963-S966 PolarHBondContact OG-OG 2.82Å; S963-Y967 WeakPolarHBondContact O-CB 3.49Å; S963-Y967 PolarHBondContact O-N 2.77Å
964	S	52.3	Low	56.6	Low	106 Å²	106	118.6 Å²	118.6	74%	0.741	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-12.3	176.7	56.4	0	0	0	0	114.3	W968	S964-W968 VanDerWaalsContact O-CD1 3.26Å
965	F	57.1	Low	58	Low	148 Å²	148	122.2 Å²	122.2	65%	0.649	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-22.2	172.5	177.8	-104.6	0	0	0	113.2	S963 K969	S963-F965 PolarHBondContact O-N 2.71Å; S963-F965 PolarHBondContact OG-N 3.27Å; F965-K969 WeakPolarHBondContact O-CE 3.48Å
966	S	58.6	Low	59.3	Low	38 Å²	38	123.9 Å²	123.9	27%	0.266	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	-42.7	-177.1	-53.9	0	0	0	0	111.6	P960 E961 S963 W968 K969	P960-S966 WeakPolarHBondContact O-CB 3.46Å; P960-S966 PolarHBondContact O-OG 2.65Å; E961-S966 VanDerWaalsContact C-CB 3.44Å; E961-S966 CarbonylContact O-C 3.53Å; E961-S966 WeakPolarHBondContact O-CB 3.31Å; S963-S966 PolarHBondContact O-N 3.01Å; S963-S966 WeakPolarHBondContact OG-CB 3.33Å; S963-S966 PolarHBondContact OG-N 2.74Å; S963-S966 VanDerWaalsContact OG-N 3.14Å; S963-S966 PolarHBondContact OG-OG 2.82Å; S966-W968 PolarHBondContact O-N 3.45Å; S966-W968 VanDerWaalsContact O-N 3.16Å; S966-K969 PolarHBondContact O-N 2.92Å
967	Y	61.9	Low	60.4	Low	143 Å²	143	124.3 Å²	124.3	56%	0.561	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-24.7	-174.6	-175.3	-94.4	0	0	0	114.2	E961 Y962 S963	E961-Y967 PolarHBondContact O-N 3.37Å; Y962-Y967 HydrophobicContact CD1-CD2 4.01Å; Y962-Y967 HydrophobicContact CD1-CE2 4.27Å; S963-Y967 WeakPolarHBondContact O-CB 3.49Å; S963-Y967 PolarHBondContact O-N 2.77Å
968	W	73.2	Confident	61.5	Low	209 Å²	209	121.3 Å²	121.3	79%	0.792	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	13.7	177	-58.5	119.8	0	0	0	113.9	S964 S966	S964-W968 VanDerWaalsContact O-CD1 3.26Å; S966-W968 PolarHBondContact O-N 3.45Å; S966-W968 VanDerWaalsContact O-N 3.16Å
969	K	68	Low	62.5	Low	121 Å²	121	123.2 Å²	123.2	53%	0.526	64%	0.636	S	S	.	*	S	Bend	trans	-107.7	140	173.1	-69.5	-177.3	177.1	-179.2	0	110.3	F965 S966	F965-K969 WeakPolarHBondContact O-CE 3.48Å; S966-K969 PolarHBondContact O-N 2.92Å
970	D	71.8	Confident	62.9	Low	155 Å²	155	127.5 Å²	127.5	83%	0.829	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.3	167.3	-59.5	-61	0	0	0	109.6
971	P	70.3	Confident	62.5	Low	119 Å²	119	131.9 Å²	131.9	77%	0.773	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-62.7	148	176.8	26.8	-34.2	0	0	0	110.6
972	L	73.6	Confident	63.3	Low	163 Å²	163	131.9 Å²	131.9	85%	0.853	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-61.4	141.5	173.7	-65.6	176	0	0	0	109.8	E974	L972-E974 PolarHBondContact O-N 2.78Å
973	P	76.6	Confident	63.9	Low	115 Å²	115	130.4 Å²	130.4	75%	0.747	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.1	137.5	174.3	-24	33.7	0	0	0	111.2	L975	P973-L975 PolarHBondContact O-N 3.08Å
974	E	62.5	Low	64.2	Low	195 Å²	195	134.9 Å²	134.9	91%	0.911	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-60.2	124.6	173.7	-67.2	-174.3	142.3	0	0	109.7	L972 D976	L972-E974 PolarHBondContact O-N 2.78Å; E974-D976 PolarHBondContact O-N 3.23Å
975	L	67.8	Low	64.9	Low	158 Å²	158	136.6 Å²	136.6	83%	0.827	70%	0.703	S	S	*	*			trans	-75.2	109.4	174.4	-76.9	168	0	0	0	108.8	P973 M977	P973-L975 PolarHBondContact O-N 3.08Å; L975-M977 PolarHBondContact O-N 3.43Å
976	D	69.4	Low	65.4	Low	95 Å²	95	135.9 Å²	135.9	51%	0.508	71%	0.706	S	S	.	*			trans	-65.8	102.3	174.3	-174.5	-9.9	0	0	0	110.1	E974 S978 I979	E974-D976 PolarHBondContact O-N 3.23Å; D976-S978 PolarHBondContact O-N 3.2Å; D976-S978 VanDerWaalsContact O-N 3.14Å; D976-S978 VanDerWaalsContact OD1-CB 3.27Å; D976-S978 WeakPolarHBondContact OD1-CB 3.42Å; D976-S978 PolarHBondContact OD1-N 3.19Å; D976-S978 PolarHBondContact OD1-OG 3.14Å; D976-S978 PolarHBondContact OD2-OG 2.99Å; D976-I979 HydrophobicContact CB-CD1 3.95Å; D976-I979 HydrophobicContact CB-CG1 4.16Å; D976-I979 WeakPolarHBondContact O-CB 3.44Å; D976-I979 WeakPolarHBondContact O-CG1 3.36Å; D976-I979 PolarHBondContact O-N 3.01Å; D976-I979 VanDerWaalsContact O-N 3.11Å
977	M	66.4	Low	65.8	Low	135 Å²	135	142.4 Å²	142.4	67%	0.665	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-63.8	-14	-179.7	-68.5	-74.9	-74	0	0	113.2	L975 I979 L980	L975-M977 PolarHBondContact O-N 3.43Å; M977-I979 PolarHBondContact O-N 3.49Å; M977-L980 PolarHBondContact O-N 3.28Å; M977-L980 HydrophobicContact SD-CD1 4.25Å
978	S	65.5	Low	66.1	Low	74 Å²	74	142.4 Å²	142.4	52%	0.517	75%	0.748	S	S	.	*	G	3₁₀ helix	trans	-71.7	-7.6	173.3	74.2	0	0	0	0	113.7	D976 L980	D976-S978 PolarHBondContact O-N 3.2Å; D976-S978 VanDerWaalsContact O-N 3.14Å; D976-S978 VanDerWaalsContact OD1-CB 3.27Å; D976-S978 WeakPolarHBondContact OD1-CB 3.42Å; D976-S978 PolarHBondContact OD1-N 3.19Å; D976-S978 PolarHBondContact OD1-OG 3.14Å; D976-S978 PolarHBondContact OD2-OG 2.99Å; S978-L980 VanDerWaalsContact C-N 3.32Å
979	I	63.3	Low	65.5	Low	136 Å²	136	137.2 Å²	137.2	70%	0.697	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-85.9	-5.8	173.2	-50.2	176.5	0	0	0	111.4	D976 M977	D976-I979 HydrophobicContact CB-CD1 3.95Å; D976-I979 HydrophobicContact CB-CG1 4.16Å; D976-I979 WeakPolarHBondContact O-CB 3.44Å; D976-I979 WeakPolarHBondContact O-CG1 3.36Å; D976-I979 PolarHBondContact O-N 3.01Å; D976-I979 VanDerWaalsContact O-N 3.11Å; M977-I979 PolarHBondContact O-N 3.49Å
980	L	52.6	Low	65.3	Low	141 Å²	141	138.6 Å²	138.6	74%	0.738	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-112.1	17.2	-177.8	-68.8	173	0	0	0	114.1	M977 S978	M977-L980 PolarHBondContact O-N 3.28Å; M977-L980 HydrophobicContact SD-CD1 4.25Å; S978-L980 VanDerWaalsContact C-N 3.32Å
981	T	44.5	Very low	64.8	Low	177 Å²	177	137.1 Å²	137.1	100%	1.086	76%	0.757	S	S	*	*			trans	-136.3	0	177	57.8	0	0	0	0	112.2

Retrieved 981 of 981 residues in 457 ms (Link to these results)

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