A0A087XZ99_POEFO Loading...

Myelin regulatory factor

Constitutes a precursor of the transcription factor. Mediates the autocatalytic cleavage that releases the Myelin regulatory factor, N-terminal component that specifically activates transcription of central nervous system (CNS) myelin genes. Membrane-bound part that has no transcription factor activity and remains attached to the endoplasmic reticulum membrane following cleavage.

AlphaFold DB , UniProt , Accession A0A087XZ99, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,025 aa.

						>A0A087XZ99_POEFO|A0A087XZ99
MDVVDETEALQRFFEGHDITSSLEPANIDTSILEEYISKEDDSTDICFSEVHSTPGPNYSSPQAGVSSAGGLVCGVSPPIRLRQGAPPAGPPSCQNAYPQGPSLGLRHGYPCLGQQQQQQHHQQQQAHVKPEHRGHYAPGTLPESPPDSSSEPYSPQQVNDPQMIRTMTPENMCQMTPTPPLPPHGHYPGMHRDMYLKPEPMISQYHIGPATSGGGEMQQTQMLHQLLQHPQGQDSIPVHQAKKRKHSESPNSTLNSQILTGIIKQEPGLMQDADNTYLDPNYQCIKWQPHQQNKWTPLYDANGKDLPMPTYRVDADKGFNFSLADDAFVCQKKNHFQVTVYIGMLGDPKYIKTNEGLQPIDCFYLKLHGVKVEAMNQSISVEQSQSDRSKRPFKPVLVTLPPEQVTKVTVGRLHFSETTANNMRKKGKPNPDQRYFMLVVALHAQSHSQSYTVAAHVSERIIVRASNPGQFESDNEVLWQRGQLPDSVYHHGRVGISTDRPDEALVVHGNVKVMGSLVHPSDIRAKENVQEVNTTDNLKRISQMRLVHYQYKPEFAATVGIENTAETGVIAQEVQQILPEAVKEGGDVVCANGETIPNLLVVNKERIFMENVGAVKELCKLTDNLETRIDELERWSRKLAKLRRLDSMKSTVSGSTVSQSGSYFSRTGSGPLKKRTVKPGSKSSPLDQGCISQRFMQGIILALLIVMAFSVISMSVLYVLTLHHRGAITEKDGHVSSCVLYISWMPIFTATITVCPPVCTWSRAALESSHKNPLTSVSTTPAPACCSTTAVNNQSATTLTLSSNQSTSGLSIPVPTPGTIVKKAKSRQMDKDGHSRNRLSHTSAPMYFAKSKRPVSPDAEGVGTTNRLPPGQQPAPRRQRSLHAKVTATAPSLRSVHIVETNQEITSQSCESAESCSYTLSLRGQKNHSIPQITLHMMSRNSVWVKQCGATKGRLCPNHTESELYSGQSTSTKGTHHLWSVPVSSFQDVTYHFRVSHSGEVSCATEEKIPLHSDYHFLIQSSCV
					

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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	33.2	Very low	45	Very low	237 Å²	237	121.5 Å²	121.5	100%	1.167	65%	0.653	S	S	*	*				0	95.4	0	-84.3	172.1	156.1	0	0	105.4
2	D	33.9	Very low	45.3	Very low	160 Å²	160	122.2 Å²	122.2	86%	0.856	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-85.4	130	166.9	-59.9	-77.5	0	0	0	106.2	V4	D2-V4 PolarHBondContact O-N 2.68Å
3	V	38.8	Very low	45.3	Very low	142 Å²	142	123.1 Å²	123.1	86%	0.861	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-80.6	119.6	177.3	179.6	0	0	0	0	106.9
4	V	43.6	Very low	45.2	Very low	80 Å²	80	122.4 Å²	122.4	49%	0.485	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-71	130.9	172.2	167.3	0	0	0	0	108.1	D2 E8	D2-V4 PolarHBondContact O-N 2.68Å; V4-E8 HydrophobicContact CG1-CB 4.12Å
5	D	54.8	Low	45	Very low	98 Å²	98	123.6 Å²	123.6	52%	0.524	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-68.1	141	178.9	-171.8	72.2	0	0	0	110.8	T7 E8 A9	D5-T7 PolarHBondContact O-N 3.08Å; D5-T7 WeakPolarHBondContact OD2-CB 3.45Å; D5-T7 WeakPolarHBondContact OD2-CG2 3.29Å; D5-T7 PolarHBondContact OD2-N 2.84Å; D5-T7 PolarHBondContact OD2-OG1 3.08Å; D5-E8 WeakPolarHBondContact O-CA 3.11Å; D5-E8 WeakPolarHBondContact O-CB 3.36Å; D5-E8 PolarHBondContact O-N 3.08Å; D5-A9 PolarHBondContact O-N 2.67Å
6	E	53.3	Low	44.6	Very low	169 Å²	169	119.4 Å²	119.4	79%	0.79	63%	0.625	S	S	*	*	H	α-helix	trans	-63.2	-28.7	-173	-63.5	-177.2	178.3	0	0	112	E8 A9 L10	E6-E8 VanDerWaalsContact C-N 3.31Å; E6-E8 PolarHBondContact O-N 3.16Å; E6-A9 PolarHBondContact O-N 2.79Å; E6-L10 PolarHBondContact O-N 2.84Å
7	T	48.2	Very low	44.2	Very low	100 Å²	100	119.9 Å²	119.9	61%	0.613	62%	0.623	S	S	*	*	H	α-helix	trans	-65.6	-33.4	172.8	72.1	0	0	0	0	112.5	D5 L10 Q11	D5-T7 PolarHBondContact O-N 3.08Å; D5-T7 WeakPolarHBondContact OD2-CB 3.45Å; D5-T7 WeakPolarHBondContact OD2-CG2 3.29Å; D5-T7 PolarHBondContact OD2-N 2.84Å; D5-T7 PolarHBondContact OD2-OG1 3.08Å; T7-L10 PolarHBondContact O-N 2.87Å; T7-Q11 WeakPolarHBondContact O-CB 3.3Å; T7-Q11 PolarHBondContact O-N 2.92Å
8	E	49.3	Very low	43.6	Very low	88 Å²	88	122.8 Å²	122.8	41%	0.411	64%	0.64	S	S	.	*	H	α-helix	trans	-75.6	-27.2	178.1	-149.2	-163.2	-170.5	0	0	111.6	V4 D5 E6 R12	V4-E8 HydrophobicContact CG1-CB 4.12Å; D5-E8 WeakPolarHBondContact O-CA 3.11Å; D5-E8 WeakPolarHBondContact O-CB 3.36Å; D5-E8 PolarHBondContact O-N 3.08Å; E6-E8 VanDerWaalsContact C-N 3.31Å; E6-E8 PolarHBondContact O-N 3.16Å; E8-R12 WeakPolarHBondContact O-CB 3.45Å; E8-R12 VanDerWaalsContact O-CG 3.24Å; E8-R12 WeakPolarHBondContact O-CG 3.48Å; E8-R12 PolarHBondContact O-N 2.9Å; E8-R12 IonicContact OE1-CZ 2.68Å; E8-R12 IonicContact OE1-NH1 3.87Å; E8-R12 IonicContact OE1-NH2 2.6Å; E8-R12 PolarHBondContact OE1-NH2 2.93Å; E8-R12 IonicContact OE2-CZ 2.63Å; E8-R12 IonicContact OE2-NH1 3.97Å; E8-R12 PolarHBondContact OE2-NH1 3.44Å; E8-R12 IonicContact OE2-NH2 3.83Å; E8-R12 PolarHBondContact OE2-NH2 2.9Å
9	A	50.7	Low	43.8	Very low	54 Å²	54	121.9 Å²	121.9	45%	0.446	64%	0.635	S	S	.	*	H	α-helix	trans	-71	-45.8	169.3	0	0	0	0	0	111.4	D5 E6 Q11 R12 F13	D5-A9 PolarHBondContact O-N 2.67Å; E6-A9 PolarHBondContact O-N 2.79Å; A9-Q11 PolarHBondContact O-N 3.01Å; A9-R12 PolarHBondContact O-N 3.23Å; A9-F13 PolarHBondContact O-N 3.36Å; A9-F13 VanDerWaalsContact O-N 3.09Å
10	L	45.1	Very low	43.6	Very low	98 Å²	98	119.6 Å²	119.6	51%	0.513	63%	0.626	S	S	.	*	H	α-helix	trans	-64.4	-40.1	177.9	-140.2	82.3	0	0	0	112	E6 T7 F13 F14	E6-L10 PolarHBondContact O-N 2.84Å; T7-L10 PolarHBondContact O-N 2.87Å; L10-F13 WeakPolarHBondContact O-CB 3.33Å; L10-F13 PolarHBondContact O-N 2.72Å; L10-F14 HydrophobicContact CD2-CE2 4.49Å; L10-F14 HydrophobicContact CG-CE2 4.35Å; L10-F14 WeakPolarHBondContact O-CD2 3.25Å; L10-F14 PolarHBondContact O-N 3.49Å
11	Q	44.3	Very low	43.1	Very low	111 Å²	111	118.5 Å²	118.5	52%	0.519	63%	0.628	S	S	.	*	H	α-helix	trans	-67.2	-39.5	177.2	-174.2	156.9	-14.9	0	0	112	T7 A9 F13 F14 E15	T7-Q11 WeakPolarHBondContact O-CB 3.3Å; T7-Q11 PolarHBondContact O-N 2.92Å; A9-Q11 PolarHBondContact O-N 3.01Å; Q11-F13 VanDerWaalsContact C-N 3.28Å; Q11-F13 PolarHBondContact O-N 3.2Å; Q11-F14 PolarHBondContact O-N 3.05Å; Q11-E15 HydrophobicContact CG-CG 4.07Å; Q11-E15 PolarHBondContact NE2-OE1 2.75Å; Q11-E15 WeakPolarHBondContact O-CB 3.37Å; Q11-E15 WeakPolarHBondContact O-CG 3.47Å; Q11-E15 PolarHBondContact O-N 3.1Å
12	R	48.9	Very low	43	Very low	129 Å²	129	111.4 Å²	111.4	49%	0.487	60%	0.602	S	S	.	*	H	α-helix	trans	-62.2	-32.3	172.5	-77	175.5	179.8	116	8.2	113.4	E8 A9 G16	E8-R12 WeakPolarHBondContact O-CB 3.45Å; E8-R12 VanDerWaalsContact O-CG 3.24Å; E8-R12 WeakPolarHBondContact O-CG 3.48Å; E8-R12 PolarHBondContact O-N 2.9Å; E8-R12 IonicContact OE1-CZ 2.68Å; E8-R12 IonicContact OE1-NH1 3.87Å; E8-R12 IonicContact OE1-NH2 2.6Å; E8-R12 PolarHBondContact OE1-NH2 2.93Å; E8-R12 IonicContact OE2-CZ 2.63Å; E8-R12 IonicContact OE2-NH1 3.97Å; E8-R12 PolarHBondContact OE2-NH1 3.44Å; E8-R12 IonicContact OE2-NH2 3.83Å; E8-R12 PolarHBondContact OE2-NH2 2.9Å; A9-R12 PolarHBondContact O-N 3.23Å; R12-G16 PolarHBondContact O-N 3.32Å
13	F	45.3	Very low	43.3	Very low	134 Å²	134	110 Å²	110	59%	0.588	59%	0.594	S	S	*	*	H	α-helix	trans	-63.9	-41	175.6	-176.4	-97.6	0	0	0	112.2	A9 L10 Q11 H17	A9-F13 PolarHBondContact O-N 3.36Å; A9-F13 VanDerWaalsContact O-N 3.09Å; L10-F13 WeakPolarHBondContact O-CB 3.33Å; L10-F13 PolarHBondContact O-N 2.72Å; Q11-F13 VanDerWaalsContact C-N 3.28Å; Q11-F13 PolarHBondContact O-N 3.2Å; F13-H17 PolarHBondContact O-ND1 3.34Å
14	F	43.7	Very low	42.8	Very low	113 Å²	113	110.6 Å²	110.6	50%	0.496	59%	0.587	S	S	.	*	H	α-helix	trans	-86.2	-29.1	179.8	-71.8	-68.4	0	0	0	114.7	L10 Q11 G16 V616	L10-F14 HydrophobicContact CD2-CE2 4.49Å; L10-F14 HydrophobicContact CG-CE2 4.35Å; L10-F14 WeakPolarHBondContact O-CD2 3.25Å; L10-F14 PolarHBondContact O-N 3.49Å; Q11-F14 PolarHBondContact O-N 3.05Å; F14-G16 VanDerWaalsContact C-N 3.31Å; F14-V616 HydrophobicContact CZ-CG1 4.22Å
15	E	42.4	Very low	42.6	Very low	141 Å²	141	111.7 Å²	111.7	66%	0.659	60%	0.596	S	S	*	*	H	α-helix	trans	-77.1	-16.1	174	-71.9	-178.3	167.5	0	0	113.2	Q11	Q11-E15 HydrophobicContact CG-CG 4.07Å; Q11-E15 PolarHBondContact NE2-OE1 2.75Å; Q11-E15 WeakPolarHBondContact O-CB 3.37Å; Q11-E15 WeakPolarHBondContact O-CG 3.47Å; Q11-E15 PolarHBondContact O-N 3.1Å
16	G	37.9	Very low	41.6	Very low	57 Å²	57	110.9 Å²	110.9	59%	0.588	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-3.7	-173.2	0	0	0	0	0	117.4	R12 F14	R12-G16 PolarHBondContact O-N 3.32Å; F14-G16 VanDerWaalsContact C-N 3.31Å
17	H	38.6	Very low	41	Very low	128 Å²	128	110.6 Å²	110.6	59%	0.593	61%	0.607	S	S	*	*			trans	-128.5	116.1	-170.9	-72.9	95.3	0	0	0	113.7	F13 I19	F13-H17 PolarHBondContact O-ND1 3.34Å; H17-I19 WeakPolarHBondContact O-CG1 3.25Å; H17-I19 PolarHBondContact O-N 2.95Å
18	D	32.9	Very low	40.7	Very low	172 Å²	172	113 Å²	113	92%	0.92	61%	0.614	S	S	*	*			trans	-73.8	107.7	165.2	-102.3	-43.1	0	0	0	110	T20	D18-T20 PolarHBondContact O-N 3.46Å
19	I	47.7	Very low	40.1	Very low	106 Å²	106	114.5 Å²	114.5	54%	0.544	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.3	63	-161.8	-39.5	-179.3	0	0	0	112.7	H17 F609	H17-I19 WeakPolarHBondContact O-CG1 3.25Å; H17-I19 PolarHBondContact O-N 2.95Å; I19-F609 HydrophobicContact CG2-CD1 4.35Å; I19-F609 HydrophobicContact CG2-CE1 3.38Å; I19-F609 HydrophobicContact CG2-CZ 3.5Å; I19-F609 VanDerWaalsContact CG2-CZ 3.5Å
20	T	40	Very low	39.9	Very low	74 Å²	74	115.1 Å²	115.1	45%	0.454	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-161.8	34.5	165.2	-2.8	0	0	0	0	115.8	D18	D18-T20 PolarHBondContact O-N 3.46Å
21	S	32.3	Very low	39.9	Very low	97 Å²	97	113 Å²	113	68%	0.678	62%	0.617	S	S	*	*			trans	-153.3	79.5	169.5	-87.5	0	0	0	0	115.5
22	S	32	Very low	40.2	Very low	88 Å²	88	113.4 Å²	113.4	62%	0.615	62%	0.621	S	S	*	*			trans	-156.7	132.6	137.2	-172.6	0	0	0	0	110.9	E24	S22-E24 PolarHBondContact OG-N 3.03Å; S22-E24 PolarHBondContact OG-O 3.43Å; S22-E24 VanDerWaalsContact OG-O 3.05Å
23	L	38.9	Very low	39.9	Very low	131 Å²	131	112.8 Å²	112.8	69%	0.686	63%	0.627	S	S	*	*			trans	-130.5	36.4	164.5	-80.6	-176.7	0	0	0	111.7	K605	L23-K605 HydrophobicContact CD2-CB 4Å; L23-K605 HydrophobicContact CD2-CD 3.58Å; L23-K605 HydrophobicContact CD2-CG 4.41Å
24	E	30.1	Very low	40.2	Very low	154 Å²	154	111.4 Å²	111.4	72%	0.72	62%	0.622	S	S	*	*	S	Bend	trans	-128.2	145.6	156.6	-77.6	-160.9	125.4	0	0	110.5	S22 A26	S22-E24 PolarHBondContact OG-N 3.03Å; S22-E24 PolarHBondContact OG-O 3.43Å; S22-E24 VanDerWaalsContact OG-O 3.05Å; E24-A26 PolarHBondContact O-N 2.97Å
25	P	39.2	Very low	40.4	Very low	104 Å²	104	111.1 Å²	111.1	68%	0.675	62%	0.623	S	S	*	*			trans	-77.6	74.3	175.2	33.8	-34.9	0	0	0	110.6
26	A	33.9	Very low	40.4	Very low	80 Å²	80	112.8 Å²	112.8	66%	0.661	62%	0.624	S	S	*	*			trans	-61	138.2	162	0	0	0	0	0	109.1	E24 I28	E24-A26 PolarHBondContact O-N 2.97Å; A26-I28 PolarHBondContact O-N 2.81Å; A26-I28 VanDerWaalsContact O-N 3.14Å
27	N	39	Very low	41.1	Very low	164 Å²	164	115.6 Å²	115.6	88%	0.877	62%	0.624	S	S	*	*			trans	-53.6	120.4	-173.7	-67.3	-39.1	0	0	0	111.5	D29	N27-D29 PolarHBondContact O-N 2.89Å
28	I	42.4	Very low	41.3	Very low	150 Å²	150	114.1 Å²	114.1	77%	0.769	63%	0.628	S	S	*	*			trans	-67.9	115.4	166.5	-63.5	171.3	0	0	0	106.4	A26 T30	A26-I28 PolarHBondContact O-N 2.81Å; A26-I28 VanDerWaalsContact O-N 3.14Å; I28-T30 PolarHBondContact O-N 3.47Å; I28-T30 VanDerWaalsContact O-N 3.08Å
29	D	37.7	Very low	41.7	Very low	119 Å²	119	112.5 Å²	112.5	64%	0.636	61%	0.613	S	S	*	*			trans	-76.2	97.2	179.8	-167.2	-14.1	0	0	0	109.8	N27 S31	N27-D29 PolarHBondContact O-N 2.89Å; D29-S31 VanDerWaalsContact CG-OG 3.29Å; D29-S31 PolarHBondContact O-N 2.88Å; D29-S31 WeakPolarHBondContact OD1-CB 3.5Å; D29-S31 PolarHBondContact OD1-N 2.81Å; D29-S31 PolarHBondContact OD1-OG 2.82Å
30	T	45.7	Very low	41.5	Very low	68 Å²	68	115.8 Å²	115.8	42%	0.417	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-6.8	178.3	49	0	0	0	0	113	I28 I32 L33 E34	I28-T30 PolarHBondContact O-N 3.47Å; I28-T30 VanDerWaalsContact O-N 3.08Å; T30-I32 VanDerWaalsContact C-N 3.26Å; T30-I32 PolarHBondContact O-N 2.83Å; T30-I32 VanDerWaalsContact O-N 3.16Å; T30-L33 WeakPolarHBondContact O-CA 3.36Å; T30-L33 WeakPolarHBondContact O-CB 3.29Å; T30-L33 PolarHBondContact O-N 2.98Å; T30-E34 WeakPolarHBondContact CB-OE1 3.42Å; T30-E34 PolarHBondContact O-N 3.37Å; T30-E34 PolarHBondContact OG1-OE1 2.84Å
31	S	45.4	Very low	41.4	Very low	54 Å²	54	119.5 Å²	119.5	38%	0.378	64%	0.643	S	S	.	*	H	α-helix	trans	-59.3	-31.7	-173.5	64.5	0	0	0	0	114.1	D29 E35	D29-S31 VanDerWaalsContact CG-OG 3.29Å; D29-S31 PolarHBondContact O-N 2.88Å; D29-S31 WeakPolarHBondContact OD1-CB 3.5Å; D29-S31 PolarHBondContact OD1-N 2.81Å; D29-S31 PolarHBondContact OD1-OG 2.82Å; S31-E35 WeakPolarHBondContact O-CB 3.28Å; S31-E35 PolarHBondContact O-N 2.9Å
32	I	50.6	Low	41.4	Very low	119 Å²	119	122.5 Å²	122.5	61%	0.61	65%	0.652	S	S	*	*	H	α-helix	trans	-70.7	-35.6	175.9	-65	175.9	0	0	0	111.4	T30 Y36	T30-I32 VanDerWaalsContact C-N 3.26Å; T30-I32 PolarHBondContact O-N 2.83Å; T30-I32 VanDerWaalsContact O-N 3.16Å; I32-Y36 PolarHBondContact O-N 2.84Å
33	L	43	Very low	41.4	Very low	115 Å²	115	123.5 Å²	123.5	60%	0.602	66%	0.659	S	S	*	*	H	α-helix	trans	-75.4	-39.6	176.8	-164	71.6	0	0	0	110.7	T30 Y36 I37	T30-L33 WeakPolarHBondContact O-CA 3.36Å; T30-L33 WeakPolarHBondContact O-CB 3.29Å; T30-L33 PolarHBondContact O-N 2.98Å; L33-Y36 PolarHBondContact O-N 3.31Å; L33-I37 HydrophobicContact CG-CD1 4.16Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.45Å; L33-I37 PolarHBondContact O-N 3.12Å
34	E	50.6	Low	41	Very low	105 Å²	105	123.6 Å²	123.6	49%	0.491	67%	0.665	S	S	.	*	H	α-helix	trans	-66.2	-36	172.9	-70.8	170.6	-145.6	0	0	111.8	T30 Y36 I37 S38	T30-E34 WeakPolarHBondContact CB-OE1 3.42Å; T30-E34 PolarHBondContact O-N 3.37Å; T30-E34 PolarHBondContact OG1-OE1 2.84Å; E34-Y36 VanDerWaalsContact C-N 3.33Å; E34-I37 PolarHBondContact O-N 2.83Å; E34-S38 WeakPolarHBondContact O-CB 3.41Å; E34-S38 PolarHBondContact O-N 2.88Å; E34-S38 PolarHBondContact O-OG 2.91Å
35	E	47.7	Very low	41.1	Very low	107 Å²	107	123 Å²	123	50%	0.5	67%	0.667	S	S	.	*	H	α-helix	trans	-68.6	-30.7	173.9	-175	179.8	178	0	0	111.9	S31 K39	S31-E35 WeakPolarHBondContact O-CB 3.28Å; S31-E35 PolarHBondContact O-N 2.9Å; E35-K39 VanDerWaalsContact CD-NZ 3.32Å; E35-K39 HydrophobicContact CG-CD 4.41Å; E35-K39 VanDerWaalsContact O-CD 3.29Å; E35-K39 WeakPolarHBondContact O-CD 3.33Å; E35-K39 VanDerWaalsContact O-CG 3.23Å; E35-K39 WeakPolarHBondContact O-CG 3.37Å; E35-K39 WeakPolarHBondContact OE1-CE 3.49Å; E35-K39 IonicContact OE1-NZ 3.73Å; E35-K39 PolarHBondContact OE1-NZ 2.92Å
36	Y	43.8	Very low	40.6	Very low	176 Å²	176	125.9 Å²	125.9	69%	0.69	68%	0.675	S	S	*	*	H	α-helix	trans	-72.8	-48.7	171.1	-106.2	-89	0	0	0	112	I32 L33 E34 S38 K39	I32-Y36 PolarHBondContact O-N 2.84Å; L33-Y36 PolarHBondContact O-N 3.31Å; E34-Y36 VanDerWaalsContact C-N 3.33Å; Y36-S38 VanDerWaalsContact C-N 3.25Å; Y36-S38 PolarHBondContact O-N 2.66Å; Y36-K39 PolarHBondContact O-N 2.82Å; Y36-K39 VanDerWaalsContact O-N 3.07Å
37	I	51.4	Low	40.3	Very low	116 Å²	116	126.5 Å²	126.5	60%	0.595	67%	0.673	S	S	*	*	H	α-helix	trans	-61.3	-35.9	178	-68	164.9	0	0	0	111	L33 E34 K39	L33-I37 HydrophobicContact CG-CD1 4.16Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.45Å; L33-I37 PolarHBondContact O-N 3.12Å; E34-I37 PolarHBondContact O-N 2.83Å; I37-K39 PolarHBondContact O-N 2.96Å
38	S	42.3	Very low	39.5	Very low	97 Å²	97	128.6 Å²	128.6	68%	0.678	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	3.6	177.2	-54.6	0	0	0	0	114.6	E34 Y36	E34-S38 WeakPolarHBondContact O-CB 3.41Å; E34-S38 PolarHBondContact O-N 2.88Å; E34-S38 PolarHBondContact O-OG 2.91Å; Y36-S38 VanDerWaalsContact C-N 3.25Å; Y36-S38 PolarHBondContact O-N 2.66Å
39	K	41.4	Very low	38.8	Very low	139 Å²	139	125.7 Å²	125.7	60%	0.604	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-8.7	-177.7	-81.4	175.4	-171.3	168.5	0	115.5	E35 Y36 I37	E35-K39 VanDerWaalsContact CD-NZ 3.32Å; E35-K39 HydrophobicContact CG-CD 4.41Å; E35-K39 VanDerWaalsContact O-CD 3.29Å; E35-K39 WeakPolarHBondContact O-CD 3.33Å; E35-K39 VanDerWaalsContact O-CG 3.23Å; E35-K39 WeakPolarHBondContact O-CG 3.37Å; E35-K39 WeakPolarHBondContact OE1-CE 3.49Å; E35-K39 IonicContact OE1-NZ 3.73Å; E35-K39 PolarHBondContact OE1-NZ 2.92Å; Y36-K39 PolarHBondContact O-N 2.82Å; Y36-K39 VanDerWaalsContact O-N 3.07Å; I37-K39 PolarHBondContact O-N 2.96Å
40	E	43.6	Very low	38.3	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.813	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-22.3	176.3	-65.6	-135.7	110.7	0	0	113.7	D42	E40-D42 PolarHBondContact O-N 3.28Å
41	D	39.7	Very low	37.4	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	69%	0.686	S	S	*	*	S	Bend	trans	-96.6	37.8	-165.4	-143.2	2.6	0	0	0	114.7
42	D	31.1	Very low	36.5	Very low	161 Å²	161	135.8 Å²	135.8	86%	0.861	71%	0.707	S	S	*	*			trans	-146.3	58.8	174.3	-155.3	2.9	0	0	0	113.3	E40	E40-D42 PolarHBondContact O-N 3.28Å
43	S	31.7	Very low	35.4	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	71%	0.713	S	S	*	*			trans	-149.5	34.8	167.8	62.1	0	0	0	0	115.6
44	T	31.2	Very low	34.5	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	72%	0.722	S	S	*	*			trans	-123.4	92.7	168.6	58.4	0	0	0	0	113.4
45	D	31.6	Very low	34	Very low	141 Å²	141	136.4 Å²	136.4	75%	0.754	74%	0.735	S	S	*	*			trans	-151	114.3	155.4	-156.2	-17	0	0	0	113.3	C47	D45-C47 PolarHBondContact OD1-N 3.17Å
46	I	28.8	Very low	32.9	Very low	166 Å²	166	134.9 Å²	134.9	85%	0.851	75%	0.748	S	S	*	*			trans	-138.8	76.9	153.2	-53.1	-177.2	0	0	0	108.6
47	C	27.4	Very low	32.8	Very low	93 Å²	93	132 Å²	132	63%	0.628	75%	0.751	S	S	*	*			trans	62	130.6	143.1	-63.2	0	0	0	0	120.1	D45	D45-C47 PolarHBondContact OD1-N 3.17Å
48	F	23.7	Very low	31.6	Very low	208 Å²	208	133.8 Å²	133.8	91%	0.912	76%	0.762	S	S	*	*				-152.7	164.7	105	-105.3	-69.4	0	0	0	111.9
49	S	26.1	Very low	30.9	Very low	89 Å²	89	140 Å²	140	62%	0.622	77%	0.772	S	S	*	*			trans	-79.5	172.5	-152.5	-44.6	0	0	0	0	118.7
50	E	27.1	Very low	30	Very low	176 Å²	176	138.8 Å²	138.8	82%	0.822	78%	0.781	S	S	*	*			trans	78.8	145.2	143	-92	175.9	123	0	0	119
51	V	27.6	Very low	29.1	Very low	99 Å²	99	136 Å²	136	60%	0.6	78%	0.78	S	S	*	*			cis	-149.8	137.4	1.1	-148.8	0	0	0	0	111.2
52	H	27.1	Very low	29.3	Very low	177 Å²	177	133.1 Å²	133.1	82%	0.819	77%	0.77	S	S	*	*			trans	59.8	155.8	156.1	-69.2	3.6	0	0	0	119.5
53	S	25.8	Very low	29.2	Very low	107 Å²	107	134.2 Å²	134.2	75%	0.748	77%	0.77	S	S	*	*			cis	-152.6	171.6	1.3	-118.8	0	0	0	0	112.5
54	T	24.1	Very low	29.1	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	77%	0.772	S	S	*	*			trans	-100.4	-170	-171	59.4	0	0	0	0	112.6
55	P	40.3	Very low	28.8	Very low	116 Å²	116	130.4 Å²	130.4	75%	0.753	77%	0.765	S	S	*	*			cis	-147.6	133	5.8	37.7	-14.1	0	0	0	120.7
56	G	26.1	Very low	28.6	Very low	76 Å²	76	130.6 Å²	130.6	78%	0.784	77%	0.771	S	S	*	*			trans	55.9	-168.4	137.6	0	0	0	0	0	122.1
57	P	41.5	Very low	28.6	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	77%	0.766	S	S	*	*			cis	-135.3	170	-9.3	42.3	-26.5	0	0	0	116.8
58	N	25	Very low	28.7	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	77%	0.772	S	S	*	*			trans	64.4	108.4	151.9	-65	-0.7	0	0	0	122.4
59	Y	27.5	Very low	28.9	Very low	229 Å²	229	123.8 Å²	123.8	90%	0.898	77%	0.772	S	S	*	*			trans	-75	170.1	136.8	-110.7	-93.9	0	0	0	111.3
60	S	23.6	Very low	28.8	Very low	113 Å²	113	123.3 Å²	123.3	79%	0.79	78%	0.781	S	S	*	*			trans	-140.1	140.3	154.8	-74.2	0	0	0	0	111
61	S	24.3	Very low	28.8	Very low	115 Å²	115	118.5 Å²	118.5	80%	0.804	78%	0.778	S	S	*	*			trans	-104.1	-158.4	-179.6	-151.1	0	0	0	0	107.8
62	P	44.4	Very low	28.8	Very low	92 Å²	92	121.7 Å²	121.7	60%	0.597	79%	0.791	S	S	*	*			cis	-146.6	178	-2.1	45.5	-26.6	0	0	0	118.3
63	Q	28.5	Very low	28.8	Very low	183 Å²	183	119.3 Å²	119.3	86%	0.855	79%	0.789	S	S	*	*			trans	51	175	134.8	-72.7	165.8	-44.3	0	0	121.5
64	A	29.2	Very low	28.8	Very low	98 Å²	98	120 Å²	120	81%	0.81	79%	0.792	S	S	*	*			cis	-174.1	171.9	-35.2	0	0	0	0	0	107.9
65	G	25.3	Very low	29	Very low	64 Å²	64	117 Å²	117	66%	0.66	79%	0.787	S	S	*	*			cis	157.8	165.5	-8.7	0	0	0	0	0	113.6
66	V	27.2	Very low	28.2	Very low	145 Å²	145	118.2 Å²	118.2	88%	0.879	79%	0.792	S	S	*	*			trans	75.4	146.2	162	-153.4	0	0	0	0	120.5
67	S	27.8	Very low	28.1	Very low	108 Å²	108	120 Å²	120	76%	0.755	79%	0.793	S	S	*	*			trans	117.7	149.9	149.3	-51.9	0	0	0	0	117.3
68	S	29.7	Very low	29.1	Very low	107 Å²	107	120 Å²	120	75%	0.748	79%	0.792	S	S	*	*			cis	-176.7	146.8	-23.7	56.3	0	0	0	0	113.7
69	A	28.7	Very low	29.9	Very low	109 Å²	109	118.4 Å²	118.4	90%	0.901	79%	0.79	S	S	*	*			trans	65.6	161.6	161.1	0	0	0	0	0	119.8
70	G	24.9	Very low	29.9	Very low	79 Å²	79	114.7 Å²	114.7	81%	0.814	78%	0.784	S	S	*	*			cis	166	147.4	-13.1	0	0	0	0	0	115.9
71	G	26.6	Very low	30	Very low	75 Å²	75	119.6 Å²	119.6	77%	0.773	79%	0.786	S	S	*	*			trans	87.5	158.7	170.8	0	0	0	0	0	117.4
72	L	26.7	Very low	30.1	Very low	165 Å²	165	119.7 Å²	119.7	86%	0.864	78%	0.776	S	S	*	*			cis	-160.8	146	-6.1	-142.7	93.3	0	0	0	112
73	V	27.3	Very low	29.3	Very low	128 Å²	128	125 Å²	125	78%	0.776	78%	0.784	S	S	*	*			trans	26.5	138.1	148.8	172.2	0	0	0	0	120.7
74	C	26.2	Very low	29.3	Very low	120 Å²	120	123.4 Å²	123.4	81%	0.811	78%	0.777	S	S	*	*			cis	-140.9	-141.5	20.1	-147.7	0	0	0	0	111.7
75	G	27.3	Very low	29.2	Very low	66 Å²	66	122.2 Å²	122.2	68%	0.68	78%	0.775	S	S	*	*			cis	135	155.7	2.8	0	0	0	0	0	112.1
76	V	25.5	Very low	29.2	Very low	143 Å²	143	124 Å²	124	87%	0.867	78%	0.783	S	S	*	*			cis	-155.8	175.3	-7.5	-168.1	0	0	0	0	108.5
77	S	23.8	Very low	30.3	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	78%	0.779	S	S	*	*			trans	-116.4	-148.3	-164.6	-53.2	0	0	0	0	118.1
78	P	60.6	Low	31.6	Very low	113 Å²	113	123.7 Å²	123.7	73%	0.734	78%	0.781	S	S	*	*				-117.7	-172.2	-118.8	41.7	-22.9	0	0	0	116.1
79	P	43.1	Very low	31.5	Very low	120 Å²	120	123.6 Å²	123.6	78%	0.779	79%	0.787	S	S	*	*				-162.5	149.5	97.6	40.7	-19	0	0	0	121.9
80	I	27.6	Very low	31.5	Very low	151 Å²	151	121.9 Å²	121.9	77%	0.774	78%	0.78	S	S	*	*			trans	4.7	148.1	142.6	-17.4	176	0	0	0	124.7
81	R	26	Very low	32.6	Very low	217 Å²	217	124 Å²	124	82%	0.819	78%	0.78	S	S	*	*			trans	111.2	156.2	143.5	-70.1	-147.4	175.4	-141	-2.6	119.5
82	L	26.5	Very low	33.6	Very low	116 Å²	116	126.3 Å²	126.3	61%	0.607	78%	0.781	S	S	*	*			cis	-178	142.5	-36	-136.7	167.2	0	0	0	111.3
83	R	27.4	Very low	33.7	Very low	204 Å²	204	123.4 Å²	123.4	77%	0.77	77%	0.774	S	S	*	*			trans	71.8	167.9	154	-109.6	175.8	-179.5	-153.5	12.2	118.2
84	Q	28.5	Very low	33.6	Very low	149 Å²	149	123 Å²	123	70%	0.696	78%	0.776	S	S	*	*			cis	-165.8	152.1	-5	-160.5	164.4	-11.2	0	0	114.6
85	G	25.9	Very low	33.6	Very low	74 Å²	74	125.7 Å²	125.7	76%	0.763	78%	0.776	S	S	*	*			trans	84.8	168.5	146.3	0	0	0	0	0	120.9
86	A	27	Very low	33.6	Very low	100 Å²	100	129.7 Å²	129.7	83%	0.826	78%	0.782	S	S	*	*			cis	-168.8	157.6	-19.7	0	0	0	0	0	113.6
87	P	48.9	Very low	33.5	Very low	123 Å²	123	127.6 Å²	127.6	80%	0.799	78%	0.78	S	S	*	*			trans	-107.2	-161.6	177	44.4	-37.3	0	0	0	113
88	P	55.8	Low	33.8	Very low	124 Å²	124	132.8 Å²	132.8	81%	0.805	78%	0.783	S	S	*	*			cis	-143.7	-149.5	4.1	46.3	-24	0	0	0	116.5
89	A	27.4	Very low	33	Very low	106 Å²	106	133.3 Å²	133.3	88%	0.876	79%	0.787	S	S	*	*			trans	108.5	144.3	161.5	0	0	0	0	0	118.6
90	G	28.1	Very low	32.2	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	79%	0.793	S	S	*	*			cis	-173.6	166.4	-5.6	0	0	0	0	0	114.4
91	P	49.4	Very low	32.2	Very low	125 Å²	125	133 Å²	133	81%	0.812	79%	0.791	S	S	*	*			trans	-110.4	175.7	-168.8	43.1	-36.4	0	0	0	116
92	P	47.4	Very low	32.9	Very low	123 Å²	123	128.2 Å²	128.2	80%	0.799	79%	0.788	S	S	*	*				-155	-151.1	96.9	41.2	-20.5	0	0	0	114.3
93	S	29.1	Very low	32.9	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	79%	0.791	S	S	*	*				-154.2	151.1	-86.6	64.1	0	0	0	0	114.9
94	C	24.5	Very low	33	Very low	120 Å²	120	126 Å²	126	81%	0.811	80%	0.799	S	S	*	*			trans	32.6	131.8	152.1	-56.1	0	0	0	0	124.7
95	Q	25.9	Very low	32.9	Very low	177 Å²	177	121.9 Å²	121.9	83%	0.827	80%	0.796	S	S	*	*				179.2	136	112.6	-97.9	-177.1	35.2	0	0	115.4
96	N	26.7	Very low	33	Very low	149 Å²	149	125.7 Å²	125.7	80%	0.797	80%	0.798	S	S	*	*			trans	35.7	151.6	134.2	-60.1	-9.4	0	0	0	122.6
97	A	24.9	Very low	33	Very low	99 Å²	99	129.8 Å²	129.8	82%	0.818	79%	0.792	S	S	*	*			cis	-156.9	176	7.1	0	0	0	0	0	113.4
98	Y	28.9	Very low	32.1	Very low	223 Å²	223	131.8 Å²	131.8	88%	0.875	79%	0.791	S	S	*	*			trans	-87.5	159.4	167.6	-90.8	-84	0	0	0	113
99	P	43.5	Very low	30.7	Very low	124 Å²	124	129.5 Å²	129.5	81%	0.805	79%	0.789	S	S	*	*				-147.4	-155.1	104.5	40.1	-22.1	0	0	0	115.4
100	Q	27.6	Very low	30.7	Very low	193 Å²	193	135.5 Å²	135.5	90%	0.902	79%	0.791	S	S	*	*			trans	-91.1	175.7	-164.6	-62.5	172.7	-24.6	0	0	115.4
101	G	26.1	Very low	31.5	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	79%	0.786	S	S	*	*			trans	-77.9	-162.2	177	0	0	0	0	0	115.2
102	P	41.6	Very low	30.3	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	78%	0.784	S	S	*	*			cis	-147.9	177.3	30.8	41.8	-20.7	0	0	0	119.2
103	S	27.1	Very low	29.5	Very low	98 Å²	98	138 Å²	138	69%	0.685	79%	0.786	S	S	*	*			trans	62.6	140.1	140.6	67.4	0	0	0	0	126.4
104	L	28.8	Very low	29.4	Very low	176 Å²	176	135.6 Å²	135.6	92%	0.921	78%	0.778	S	S	*	*			trans	96.3	138.7	136.4	-86	166.1	0	0	0	124.5
105	G	26.6	Very low	29.6	Very low	62 Å²	62	138.2 Å²	138.2	64%	0.639	78%	0.778	S	S	*	*			trans	116.6	143.5	164.1	0	0	0	0	0	115.3
106	L	28.2	Very low	29.7	Very low	154 Å²	154	137 Å²	137	81%	0.806	77%	0.772	S	S	*	*			cis	-171.5	179.5	-11.1	-139.7	69	0	0	0	107.1
107	R	25.6	Very low	29.8	Very low	186 Å²	186	139.1 Å²	139.1	70%	0.702	78%	0.777	S	S	*	*			cis	-161.7	96.2	1.8	-167.4	-175.3	-172.5	-82.2	0.4	114.8
108	H	31.5	Very low	29.9	Very low	166 Å²	166	143.3 Å²	143.3	77%	0.769	78%	0.78	S	S	*	*			trans	72.9	152.3	147.6	-58.1	12.8	0	0	0	122.7
109	G	25.1	Very low	29.9	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	78%	0.78	S	S	*	*			trans	168	117.4	163.9	0	0	0	0	0	113.9
110	Y	27.8	Very low	29.1	Very low	232 Å²	232	144.7 Å²	144.7	91%	0.91	78%	0.784	S	S	*	*			trans	-147.5	176.1	-170.5	-99.3	-50.3	0	0	0	109.6
111	P	44.3	Very low	29.1	Very low	99 Å²	99	143.3 Å²	143.3	64%	0.643	78%	0.777	S	S	*	*			cis	-140.5	-177.4	-30.3	41.4	-24.6	0	0	0	114.8
112	C	24.9	Very low	29.1	Very low	115 Å²	115	146.6 Å²	146.6	78%	0.777	77%	0.773	S	S	*	*			trans	62.1	159.4	150.8	-66.8	0	0	0	0	119.7
113	L	31.7	Very low	28.4	Very low	158 Å²	158	148 Å²	148	83%	0.827	77%	0.77	S	S	*	*			cis	-146.1	-160.7	-9.6	-141.1	74	0	0	0	106.7
114	G	26.6	Very low	28.4	Very low	54 Å²	54	150.2 Å²	150.2	56%	0.557	77%	0.769	S	S	*	*			cis	168.1	126.7	-5.6	0	0	0	0	0	114.8
115	Q	29.3	Very low	28.3	Very low	175 Å²	175	148.1 Å²	148.1	82%	0.818	76%	0.755	S	S	*	*			trans	57	178.4	159.4	-74.7	-174	-58.7	0	0	120
116	Q	27.8	Very low	28.2	Very low	151 Å²	151	153 Å²	153	71%	0.706	76%	0.76	S	S	*	*				-176.7	117.5	-55.1	173.6	-180	0.8	0	0	110.5
117	Q	28.3	Very low	28.2	Very low	193 Å²	193	150.2 Å²	150.2	90%	0.902	76%	0.76	S	S	*	*			trans	174.3	166.1	139.4	-101.3	176	7.6	0	0	112.8
118	Q	26.9	Very low	28.1	Very low	188 Å²	188	149.9 Å²	149.9	88%	0.879	77%	0.766	S	S	*	*			trans	-139.1	145.3	170.4	-65.3	176.7	-82	0	0	108.8
119	Q	28.3	Very low	27.8	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	76%	0.762	S	S	*	*			trans	170.4	128	130.4	-96.8	177.4	15.8	0	0	110.3
120	Q	27.6	Very low	27.8	Very low	190 Å²	190	151.5 Å²	151.5	89%	0.888	76%	0.759	S	S	*	*				-177.8	-169.5	109.4	-94.8	-164.7	0.3	0	0	110.9
121	H	27	Very low	28.4	Very low	163 Å²	163	145.4 Å²	145.4	76%	0.755	75%	0.747	S	S	*	*			trans	-126.4	161.9	-144.5	-114.7	-32.1	0	0	0	112.8
122	H	27.3	Very low	27.6	Very low	140 Å²	140	147.3 Å²	147.3	65%	0.648	75%	0.748	S	S	*	*			trans	67	155.2	149	-79.6	68.9	0	0	0	117.4
123	Q	26.4	Very low	27.8	Very low	147 Å²	147	149.6 Å²	149.6	69%	0.687	75%	0.747	S	S	*	*			cis	-151.9	-158.1	-21.7	-141	-178.3	18.3	0	0	110.2
124	Q	26.2	Very low	27.7	Very low	144 Å²	144	151.2 Å²	151.2	67%	0.673	74%	0.742	S	S	*	*			trans	-54.2	172.5	173.4	-61	166.7	-2.3	0	0	113.7
125	Q	26.4	Very low	27.8	Very low	133 Å²	133	152 Å²	152	62%	0.621	75%	0.75	S	S	*	*			cis	-165.6	173.3	26.9	-143.6	167.1	88.9	0	0	110.9
126	Q	26.2	Very low	27.8	Very low	163 Å²	163	150.9 Å²	150.9	76%	0.762	74%	0.744	S	S	*	*			trans	34.8	127.5	155	-72.6	158.5	17	0	0	121.1
127	A	27.3	Very low	27.8	Very low	96 Å²	96	155 Å²	155	79%	0.793	76%	0.755	S	S	*	*				95.6	152.7	51.7	0	0	0	0	0	115.3
128	H	23.4	Very low	27.7	Very low	179 Å²	179	150.1 Å²	150.1	83%	0.829	75%	0.747	S	S	*	*			trans	93.4	104.6	167.5	-120	-106.5	0	0	0	122.5
129	V	25.4	Very low	28	Very low	114 Å²	114	147.3 Å²	147.3	69%	0.691	75%	0.746	S	S	*	*				52.8	128.2	129.3	-173.1	0	0	0	0	123.8
130	K	24.9	Very low	28.1	Very low	162 Å²	162	141.5 Å²	141.5	70%	0.704	74%	0.735	S	S	*	*			trans	-3.8	168	140.6	-104.8	-163.7	177.9	-157	0	120.6	E132	K130-E132 WeakPolarHBondContact CE-OE1 3.45Å; K130-E132 IonicContact NZ-OE1 2.84Å; K130-E132 PolarHBondContact NZ-OE1 3.43Å
131	P	40.4	Very low	28.1	Very low	103 Å²	103	138.6 Å²	138.6	67%	0.669	73%	0.731	S	S	*	*			cis	-143.2	164.5	7.2	40.3	-20	0	0	0	120.3
132	E	27	Very low	28.3	Very low	139 Å²	139	138 Å²	138	65%	0.65	73%	0.732	S	S	*	*			trans	28.9	128	138.4	-64.1	159.2	-149.2	0	0	124.9	K130	K130-E132 WeakPolarHBondContact CE-OE1 3.45Å; K130-E132 IonicContact NZ-OE1 2.84Å; K130-E132 PolarHBondContact NZ-OE1 3.43Å
133	H	30.3	Very low	29	Very low	163 Å²	163	137.1 Å²	137.1	76%	0.755	74%	0.739	S	S	*	*			trans	-163.4	162.9	131.8	-109	54.5	0	0	0	110.2
134	R	29.1	Very low	29	Very low	192 Å²	192	138.1 Å²	138.1	73%	0.725	74%	0.744	S	S	*	*			cis	-179.2	121	-35.3	173.9	176.2	176.2	-168.9	-3.6	109.9
135	G	27.6	Very low	29.1	Very low	70 Å²	70	136.3 Å²	136.3	72%	0.722	75%	0.747	S	S	*	*			trans	174.3	76.7	180	0	0	0	0	0	114.2
136	H	30.5	Very low	30.4	Very low	153 Å²	153	135.5 Å²	135.5	71%	0.708	75%	0.753	S	S	*	*				76.9	96.3	96.8	-74.7	50.5	0	0	0	116.1
137	Y	27.4	Very low	30.9	Very low	238 Å²	238	133.6 Å²	133.6	93%	0.933	76%	0.755	S	S	*	*				-163.1	173.9	123.2	-106.8	-66.7	0	0	0	111.4
138	A	27.2	Very low	30.8	Very low	89 Å²	89	136.3 Å²	136.3	74%	0.736	76%	0.756	S	S	*	*			trans	-37.2	160.5	-170	0	0	0	0	0	120.6
139	P	33.2	Very low	31	Very low	130 Å²	130	133.2 Å²	133.2	84%	0.844	76%	0.755	S	S	*	*			trans	-130.4	177.1	-137.9	43.3	-29	0	0	0	117.7
140	G	29.5	Very low	30.9	Very low	63 Å²	63	133 Å²	133	65%	0.649	76%	0.759	S	S	*	*			trans	96.1	80.9	164.2	0	0	0	0	0	115.6
141	T	28	Very low	31.1	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	76%	0.763	S	S	*	*			cis	86.7	126.2	34.7	71.1	0	0	0	0	117.3
142	L	31.3	Very low	30.5	Very low	150 Å²	150	134 Å²	134	79%	0.785	77%	0.769	S	S	*	*			trans	80	132.8	169.8	-60.6	178.6	0	0	0	118.9
143	P	42.2	Very low	31.3	Very low	123 Å²	123	132.2 Å²	132.2	80%	0.799	77%	0.77	S	S	*	*			trans	-102.5	116.7	165.3	35.1	-25.3	0	0	0	111.6
144	E	25.1	Very low	31.1	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	77%	0.774	S	S	*	*			trans	-153.6	119	179.4	-151.4	155.8	-169.4	0	0	114.6
145	S	28.4	Very low	30.9	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	78%	0.775	S	S	*	*			trans	70.3	-174.4	157.7	-50	0	0	0	0	118.3
146	P	54.3	Low	32.3	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	78%	0.775	S	S	*	*				-126.7	-166.4	-99.6	41.2	-21.5	0	0	0	113.3
147	P	37.2	Very low	32	Very low	124 Å²	124	133.7 Å²	133.7	81%	0.805	78%	0.781	S	S	*	*				-155.3	-174.8	84.8	42.2	-21.7	0	0	0	116.8
148	D	25.2	Very low	32	Very low	152 Å²	152	130.9 Å²	130.9	81%	0.813	78%	0.776	S	S	*	*			trans	-81.2	175.2	175.7	-70.7	-77.5	0	0	0	116.2
149	S	25.9	Very low	32	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	78%	0.781	S	S	*	*			trans	73.5	124.8	156.2	-147.2	0	0	0	0	116.1
150	S	24.5	Very low	31.6	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	78%	0.779	S	S	*	*				177.4	172.3	56.2	48.2	0	0	0	0	108
151	S	29.4	Very low	31.4	Very low	113 Å²	113	137 Å²	137	79%	0.79	78%	0.779	S	S	*	*			cis	-155.4	171.9	-3.1	50.9	0	0	0	0	110.1
152	E	27.5	Very low	32	Very low	173 Å²	173	135.4 Å²	135.4	81%	0.808	77%	0.771	S	S	*	*			trans	-72.3	-167.2	158.8	-50	-166.8	113.9	0	0	111
153	P	43.9	Very low	32	Very low	102 Å²	102	135.7 Å²	135.7	66%	0.662	77%	0.768	S	S	*	*			cis	-141.5	-167.2	-0.2	24.6	3.9	0	0	0	117
154	Y	25.5	Very low	31.3	Very low	216 Å²	216	137.3 Å²	137.3	85%	0.847	77%	0.767	S	S	*	*			trans	103.8	139.1	158.1	-81.4	-88.3	0	0	0	121.7
155	S	25.2	Very low	31.6	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	77%	0.766	S	S	*	*			trans	-141.2	-171.3	162.4	-47.4	0	0	0	0	105.6
156	P	56.3	Low	31.5	Very low	113 Å²	113	142.4 Å²	142.4	73%	0.734	77%	0.772	S	S	*	*			cis	-128.7	-178.9	-23.1	41.2	-26.4	0	0	0	112.6
157	Q	25.4	Very low	30.1	Very low	175 Å²	175	142.1 Å²	142.1	82%	0.818	77%	0.769	S	S	*	*			trans	174.5	131.6	144.6	-94.9	159.1	32.3	0	0	107.5
158	Q	27.4	Very low	29.6	Very low	179 Å²	179	144.3 Å²	144.3	84%	0.836	77%	0.77	S	S	*	*				70.4	120.1	63.5	-74.8	-166.6	-21.1	0	0	115.6
159	V	26.2	Very low	30	Very low	138 Å²	138	143 Å²	143	84%	0.836	77%	0.768	S	S	*	*				161.3	157.5	128.6	161.3	0	0	0	0	111.8
160	N	25.3	Very low	30.9	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	76%	0.758	S	S	*	*			trans	-62.5	160.6	-159.1	-54.2	-29.6	0	0	0	121.8
161	D	25.3	Very low	31.1	Very low	119 Å²	119	144.7 Å²	144.7	64%	0.636	76%	0.759	S	S	*	*			trans	-39	174.9	140.6	-121.2	-28.7	0	0	0	115.1
162	P	41.1	Very low	31.1	Very low	97 Å²	97	145.4 Å²	145.4	63%	0.63	75%	0.754	S	S	*	*			cis	-150	-168.9	4.1	43.9	-22.3	0	0	0	119.6
163	Q	31.3	Very low	31	Very low	156 Å²	156	144.8 Å²	144.8	73%	0.729	75%	0.753	S	S	*	*			trans	97.4	113.3	140.3	-85.9	-177.5	29.6	0	0	124.9
164	M	27.5	Very low	30.2	Very low	156 Å²	156	146 Å²	146	77%	0.768	76%	0.762	S	S	*	*				77.5	163.8	127.4	-83.1	-155.3	-70.9	0	0	125.1
165	I	31.3	Very low	30.4	Very low	150 Å²	150	143 Å²	143	77%	0.769	76%	0.756	S	S	*	*			trans	81.2	105.6	170.8	-53.8	-170.5	0	0	0	113.8
166	R	24.9	Very low	30.4	Very low	231 Å²	231	146 Å²	146	87%	0.872	76%	0.76	S	S	*	*				67.6	123.3	66.4	-152	-175.6	-168.8	161.6	2	110.9
167	T	26.8	Very low	29	Very low	110 Å²	110	146.8 Å²	146.8	68%	0.675	76%	0.763	S	S	*	*				170.6	140.4	88.1	-62	0	0	0	0	110.5
168	M	24.7	Very low	29.7	Very low	170 Å²	170	144.5 Å²	144.5	84%	0.837	76%	0.764	S	S	*	*			trans	24.9	148.6	154.3	-48.4	-65.2	-82.2	0	0	124.5
169	T	34.6	Very low	29.8	Very low	124 Å²	124	142.4 Å²	142.4	76%	0.761	76%	0.763	S	S	*	*			trans	-73.6	-172.8	157.6	53.1	0	0	0	0	111.8
170	P	44.3	Very low	30.9	Very low	92 Å²	92	141.3 Å²	141.3	60%	0.597	76%	0.759	S	S	*	*			cis	-145.2	-162.2	10.4	45.5	-24.1	0	0	0	116.9
171	E	28.3	Very low	31.9	Very low	167 Å²	167	139.8 Å²	139.8	78%	0.78	76%	0.757	S	S	*	*			trans	69.9	154	151.6	-76.6	177.9	-120.4	0	0	120.3
172	N	30.4	Very low	32.3	Very low	129 Å²	129	142.1 Å²	142.1	69%	0.69	77%	0.769	S	S	*	*			cis	-159.4	159.2	-26.2	-134.4	-24	0	0	0	112.3
173	M	24.9	Very low	32.4	Very low	159 Å²	159	142.9 Å²	142.9	78%	0.783	77%	0.774	S	S	*	*			trans	36.9	126.5	159.2	-71.6	178.3	57.3	0	0	123.8
174	C	27.6	Very low	33	Very low	127 Å²	127	141.1 Å²	141.1	86%	0.858	78%	0.776	S	S	*	*			trans	-161	159.1	130.3	-128.9	0	0	0	0	115.5
175	Q	29.4	Very low	33.3	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	78%	0.783	S	S	*	*			trans	-75.1	178.5	-164.9	-51.2	165.1	-10.4	0	0	114.8
176	M	24.6	Very low	32.9	Very low	168 Å²	168	139.2 Å²	139.2	83%	0.828	78%	0.78	S	S	*	*			cis	-148.5	175	18.8	-77.9	-170.2	172.3	0	0	113.5
177	T	28.5	Very low	33	Very low	130 Å²	130	137 Å²	137	80%	0.798	78%	0.779	S	S	*	*			trans	-116.2	166.1	171.8	53.8	0	0	0	0	112.7
178	P	39.8	Very low	33.3	Very low	127 Å²	127	142.1 Å²	142.1	83%	0.825	79%	0.788	S	S	*	*				-152.1	169.9	102.9	38.4	-20	0	0	0	118.2
179	T	29.8	Very low	33.8	Very low	135 Å²	135	140.2 Å²	140.2	83%	0.828	79%	0.788	S	S	*	*			trans	-101.4	-169.1	174.2	50.9	0	0	0	0	111.2
180	P	49.3	Very low	33.5	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	78%	0.784	S	S	*	*			cis	-143.1	-154.3	23.6	47.5	-24.6	0	0	0	114.3
181	P	46.2	Very low	32.7	Very low	120 Å²	120	142.2 Å²	142.2	78%	0.779	80%	0.801	S	S	*	*			cis	-132.5	-175	-6.1	40.5	-20.5	0	0	0	117.9
182	L	32.9	Very low	32.6	Very low	168 Å²	168	142.8 Å²	142.8	88%	0.88	80%	0.803	S	S	*	*			trans	-114.2	-162.7	-177.9	-78.7	165.1	0	0	0	110.6
183	P	43.3	Very low	32.6	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	81%	0.808	S	S	*	*			cis	-142.1	-148.4	7.2	48.1	-26.8	0	0	0	113.5
184	P	42.9	Very low	32.8	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	81%	0.805	S	S	*	*			cis	-131.4	-170	-16.6	38.9	-19	0	0	0	116
185	H	35.3	Very low	32.7	Very low	198 Å²	198	146.9 Å²	146.9	92%	0.917	80%	0.8	S	S	*	*			trans	-118.8	177.2	-177.6	-82.7	-90	0	0	0	114.9
186	G	22.5	Very low	32.7	Very low	67 Å²	67	149.5 Å²	149.5	69%	0.691	81%	0.805	S	S	*	*			trans	-152.4	167.1	169.1	0	0	0	0	0	114
187	H	27.6	Very low	33	Very low	186 Å²	186	148.8 Å²	148.8	86%	0.861	80%	0.804	S	S	*	*			trans	-133.6	169.4	-165.2	-77.4	-87.3	0	0	0	116.8
188	Y	31.6	Very low	32.8	Very low	217 Å²	217	152.4 Å²	152.4	85%	0.851	81%	0.808	S	S	*	*			trans	-33.4	163.2	164.8	-79.8	-84.3	0	0	0	118.1
189	P	36	Very low	32.4	Very low	129 Å²	129	151 Å²	151	84%	0.838	80%	0.8	S	S	*	*			cis	-146	-150.9	45.5	42.7	-19.8	0	0	0	116.6
190	G	28.1	Very low	32.3	Very low	66 Å²	66	152.8 Å²	152.8	68%	0.68	80%	0.798	S	S	*	*			trans	-152.1	-148.6	-175.1	0	0	0	0	0	116.1
191	M	27.3	Very low	32.1	Very low	193 Å²	193	151.4 Å²	151.4	95%	0.951	79%	0.79	S	S	*	*			trans	92.9	120.1	-175.8	-60.5	-70.2	-174.8	0	0	117.8
192	H	25.9	Very low	31	Very low	179 Å²	179	153.6 Å²	153.6	83%	0.829	79%	0.791	S	S	*	*				-168	172.1	113.1	-148.4	-96.4	0	0	0	112
193	R	31.1	Very low	30.6	Very low	212 Å²	212	152.8 Å²	152.8	80%	0.8	79%	0.786	S	S	*	*			trans	-104.6	149.8	175.4	-158.9	-173.1	-161.9	174.4	2.8	110
194	D	29.1	Very low	29.7	Very low	133 Å²	133	152.5 Å²	152.5	71%	0.711	79%	0.787	S	S	*	*				158.5	128.7	127	-76	-21.4	0	0	0	116.4
195	M	25.8	Very low	28.7	Very low	155 Å²	155	153.7 Å²	153.7	76%	0.764	78%	0.782	S	S	*	*			trans	36.4	115.1	138.2	-163	175.4	75.7	0	0	122.6
196	Y	30	Very low	28.3	Very low	209 Å²	209	153.7 Å²	153.7	82%	0.82	78%	0.776	S	S	*	*				-167.4	162.3	118.4	-126.9	-94.7	0	0	0	113.2
197	L	30.8	Very low	28.3	Very low	153 Å²	153	158 Å²	158	80%	0.801	78%	0.778	S	S	*	*			trans	-105.5	149.8	173.6	-64.1	88.4	0	0	0	112.3
198	K	23.7	Very low	28.2	Very low	205 Å²	205	156.3 Å²	156.3	89%	0.891	77%	0.773	S	S	*	*				-165.4	158.7	128.6	-111.8	-156.4	170.9	-167.2	0	113.5
199	P	32.1	Very low	28.1	Very low	99 Å²	99	149.2 Å²	149.2	64%	0.643	77%	0.766	S	S	*	*			trans	-117.9	-171.5	-174.5	44.3	-34.2	0	0	0	114.9
200	E	26	Very low	28.1	Very low	171 Å²	171	149.8 Å²	149.8	80%	0.799	77%	0.77	S	S	*	*			trans	77.6	164.7	152.2	-79.9	-159.9	103.3	0	0	120.1
201	P	45	Very low	28.1	Very low	87 Å²	87	151.2 Å²	151.2	57%	0.565	78%	0.775	S	S	*	*				-143.1	-146.4	-59.2	41.8	-20.9	0	0	0	113.2
202	M	23.7	Very low	28.1	Very low	165 Å²	165	149 Å²	149	81%	0.813	77%	0.773	S	S	*	*			trans	84.1	130.2	168.3	-45.8	-168.5	-174.7	0	0	116.9
203	I	25.5	Very low	28.1	Very low	151 Å²	151	146.7 Å²	146.7	77%	0.774	78%	0.777	S	S	*	*			cis	105.1	136.7	20.4	-66.7	167.6	0	0	0	113.8
204	S	23.7	Very low	27.8	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	78%	0.779	S	S	*	*			trans	116	150.6	164.2	-167.7	0	0	0	0	115.9
205	Q	22.2	Very low	27.5	Very low	143 Å²	143	138.2 Å²	138.2	67%	0.668	79%	0.786	S	S	*	*				-179.9	120.1	-55.4	-104.9	-175.9	-78.2	0	0	110.6
206	Y	25.8	Very low	27.4	Very low	198 Å²	198	134 Å²	134	78%	0.776	78%	0.782	S	S	*	*			trans	54.2	-177.1	156	-57.1	-69	0	0	0	119.2
207	H	23.2	Very low	27.1	Very low	158 Å²	158	132.8 Å²	132.8	73%	0.731	78%	0.784	S	S	*	*			cis	-143.1	146.5	8.7	-119.3	11.1	0	0	0	108.9
208	I	26.4	Very low	26.9	Very low	151 Å²	151	133.2 Å²	133.2	77%	0.774	78%	0.784	S	S	*	*				69.6	125.3	78.7	-58.3	-171.9	0	0	0	117.9
209	G	28	Very low	27	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	78%	0.781	S	S	*	*			trans	122.1	155.7	147.7	0	0	0	0	0	117.1
210	P	37.5	Very low	26.7	Very low	140 Å²	140	134.7 Å²	134.7	91%	0.909	79%	0.786	S	S	*	*			cis	-125.5	-165.8	-0.3	43	-27.7	0	0	0	114
211	A	27.1	Very low	26.7	Very low	96 Å²	96	132.2 Å²	132.2	79%	0.793	78%	0.782	S	S	*	*			trans	-134.5	172	179.1	0	0	0	0	0	113
212	T	26.9	Very low	25.8	Very low	147 Å²	147	137.3 Å²	137.3	90%	0.902	80%	0.799	S	S	*	*			trans	-125.9	161.4	167.5	49	0	0	0	0	110.5
213	S	26.4	Very low	26	Very low	131 Å²	131	138.2 Å²	138.2	92%	0.916	80%	0.803	S	S	*	*			trans	-141.6	161.1	-156.2	53.4	0	0	0	0	116.2
214	G	24	Very low	26	Very low	82 Å²	82	138.1 Å²	138.1	85%	0.845	80%	0.804	S	S	*	*			trans	137.7	135.4	171.6	0	0	0	0	0	112
215	G	23.4	Very low	26.2	Very low	84 Å²	84	141.2 Å²	141.2	87%	0.866	81%	0.806	S	S	*	*			cis	167.4	139.5	-6.9	0	0	0	0	0	111.4
216	G	24.1	Very low	26.3	Very low	66 Å²	66	143.1 Å²	143.1	68%	0.68	82%	0.815	S	S	*	*			trans	109.2	100.2	-173.4	0	0	0	0	0	111.7
217	E	23.5	Very low	26.2	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	81%	0.814	S	S	*	*				75.5	109.2	86.7	-73	-174.5	139.2	0	0	112.9
218	M	27.5	Very low	26.2	Very low	163 Å²	163	140.1 Å²	140.1	80%	0.803	82%	0.816	S	S	*	*				71.8	142.9	92	-102.2	-172.7	167.8	0	0	113.5
219	Q	26	Very low	26.2	Very low	174 Å²	174	142.1 Å²	142.1	81%	0.813	82%	0.822	S	S	*	*			cis	-147	-170	20.8	-154	169.5	-0.3	0	0	113.2
220	Q	25.1	Very low	26.1	Very low	161 Å²	161	147.7 Å²	147.7	75%	0.752	83%	0.829	S	S	*	*			trans	-108.2	156.5	-155.6	-172.6	-175.4	1.5	0	0	113.6
221	T	26.2	Very low	25.7	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.724	83%	0.826	S	S	*	*			trans	61.7	128.6	158.1	32.7	0	0	0	0	121.4
222	Q	26.4	Very low	25.5	Very low	195 Å²	195	151.9 Å²	151.9	91%	0.911	83%	0.831	S	S	*	*				-158.9	152.9	122.3	-109.7	172.3	27.2	0	0	111.1
223	M	27.1	Very low	25.4	Very low	184 Å²	184	148.3 Å²	148.3	91%	0.906	82%	0.823	S	S	*	*			trans	-135.8	153.5	172.7	-82.8	-147	-58.6	0	0	111.1
224	L	25.8	Very low	25.2	Very low	149 Å²	149	150.2 Å²	150.2	78%	0.78	82%	0.818	S	S	*	*			trans	64.8	93.5	153	-160	84.4	0	0	0	118.4
225	H	26.7	Very low	25.1	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.806	81%	0.81	S	S	*	*				-164.7	160.9	117.6	-99.1	73.2	0	0	0	106.1
226	Q	25.2	Very low	25.1	Very low	183 Å²	183	154.2 Å²	154.2	86%	0.855	81%	0.81	S	S	*	*			cis	-149.9	160	28.8	-171.5	169.9	-0.5	0	0	110.7
227	L	23.7	Very low	25.1	Very low	148 Å²	148	158.9 Å²	158.9	78%	0.775	82%	0.817	S	S	*	*			trans	-128.9	165.4	-179.5	-141.6	162.2	0	0	0	109.9
228	L	23.8	Very low	25.4	Very low	145 Å²	145	155.3 Å²	155.3	76%	0.759	81%	0.81	S	S	*	*			trans	78.2	104.1	-177.2	-66.5	94.2	0	0	0	117.9
229	Q	26.1	Very low	25.2	Very low	193 Å²	193	152.5 Å²	152.5	90%	0.902	80%	0.802	S	S	*	*				-159.8	137.2	110	-103.8	149.4	103.8	0	0	111.7
230	H	26.4	Very low	25.1	Very low	185 Å²	185	153.8 Å²	153.8	86%	0.856	81%	0.807	S	S	*	*			trans	-99.8	157.6	164.4	-84.9	-25.8	0	0	0	109.3
231	P	29.2	Very low	25.1	Very low	129 Å²	129	154.4 Å²	154.4	84%	0.838	81%	0.81	S	S	*	*				-128.2	173	108.1	2.2	19.5	0	0	0	114.9
232	Q	22.9	Very low	25.1	Very low	195 Å²	195	153.3 Å²	153.3	91%	0.911	81%	0.814	S	S	*	*			trans	-75.1	160.5	172.2	-57.6	159.2	-62.2	0	0	110.6
233	G	23.4	Very low	25.1	Very low	71 Å²	71	154.2 Å²	154.2	73%	0.732	81%	0.814	S	S	*	*			cis	-157.3	-140.3	1.3	0	0	0	0	0	110
234	Q	23.2	Very low	25.1	Very low	171 Å²	171	155.3 Å²	155.3	80%	0.799	81%	0.814	S	S	*	*			cis	-160.1	158.4	-0.5	-122.8	-174.5	-85.4	0	0	110.7
235	D	21.6	Very low	25.5	Very low	129 Å²	129	160 Å²	160	69%	0.69	82%	0.821	S	S	*	*			trans	18	107.9	155.4	-46.5	-38.6	0	0	0	121.4
236	S	22.7	Very low	25.5	Very low	122 Å²	122	160.5 Å²	160.5	85%	0.853	82%	0.821	S	S	*	*				174.4	140.7	93	44.6	0	0	0	0	114.3
237	I	23.6	Very low	25.4	Very low	163 Å²	163	159.8 Å²	159.8	84%	0.836	82%	0.817	S	S	*	*			trans	-102.9	157.1	172.1	-22.4	168.8	0	0	0	105.1
238	P	31.3	Very low	25.5	Very low	109 Å²	109	158.4 Å²	158.4	71%	0.708	82%	0.82	S	S	*	*			cis	-162.1	-174.7	44.5	47.4	-24.2	0	0	0	120.8
239	V	22.4	Very low	25.5	Very low	104 Å²	104	160.4 Å²	160.4	63%	0.63	83%	0.826	S	S	*	*			trans	66.9	119.8	158.3	-175.4	0	0	0	0	119.1	Q241	V239-Q241 HydrophobicContact CG1-CG 3.65Å
240	H	24.6	Very low	25.6	Very low	201 Å²	201	155.8 Å²	155.8	93%	0.931	82%	0.815	S	S	*	*			trans	-116.6	130.5	139.6	-96.3	-68	0	0	0	110.5
241	Q	25	Very low	25.8	Very low	174 Å²	174	153.1 Å²	153.1	81%	0.813	81%	0.814	S	S	*	*			trans	-92.8	162.1	178.2	-74.6	-171.1	-9.4	0	0	113.3	V239	V239-Q241 HydrophobicContact CG1-CG 3.65Å
242	A	26.4	Very low	25.6	Very low	96 Å²	96	154.5 Å²	154.5	79%	0.793	81%	0.814	S	S	*	*			trans	-43.3	143.7	-179.5	0	0	0	0	0	116.8	K244	A242-K244 PolarHBondContact O-N 2.91Å
243	K	27.1	Very low	25.8	Very low	213 Å²	213	150.4 Å²	150.4	93%	0.926	81%	0.807	S	S	*	*			trans	-49	125.6	168.4	-78.6	171.1	173.3	166.5	0	112.1
244	K	26.3	Very low	26	Very low	207 Å²	207	154 Å²	154	90%	0.9	82%	0.815	S	S	*	*			trans	-118	134.8	151.6	-95.7	-179.7	177.3	171	0	109.9	A242	A242-K244 PolarHBondContact O-N 2.91Å
245	R	33	Very low	26.4	Very low	248 Å²	248	152.9 Å²	152.9	94%	0.936	81%	0.814	S	S	*	*			trans	-69.2	125.7	177.9	-63.5	170.6	173.3	147.5	-4.2	110.5
246	K	26.9	Very low	26.7	Very low	185 Å²	185	153.8 Å²	153.8	80%	0.804	82%	0.819	S	S	*	*			trans	-177.9	150.4	138.2	-109.6	172.5	-177.7	-172	0	114.1
247	H	24.4	Very low	26.8	Very low	167 Å²	167	153.1 Å²	153.1	77%	0.773	81%	0.814	S	S	*	*			trans	53.1	136.4	164.2	-70.7	-79.3	0	0	0	120.2
248	S	25.2	Very low	27.1	Very low	119 Å²	119	154.2 Å²	154.2	83%	0.832	82%	0.816	S	S	*	*			trans	-89	99	167.3	54.7	0	0	0	0	109.7
249	E	24.6	Very low	27	Very low	187 Å²	187	157.1 Å²	157.1	87%	0.874	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.4	125.7	165.5	-67.1	-172.3	142.2	0	0	109.2
250	S	28	Very low	27.2	Very low	97 Å²	97	160.1 Å²	160.1	68%	0.678	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-76.6	137.8	167.6	50.1	0	0	0	0	109.5	N252	S250-N252 PolarHBondContact O-N 2.9Å
251	P	30.4	Very low	27.3	Very low	129 Å²	129	158 Å²	158	84%	0.838	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-62.3	136.1	-179.7	25.8	-34.1	0	0	0	111.4
252	N	25.3	Very low	27.4	Very low	158 Å²	158	153.3 Å²	153.3	85%	0.845	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-76.9	154.9	176.2	-79.2	-40.5	0	0	0	111.8	S250	S250-N252 PolarHBondContact O-N 2.9Å
253	S	26.6	Very low	27.5	Very low	109 Å²	109	156.5 Å²	156.5	76%	0.762	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-78	135.3	-176.1	55	0	0	0	0	114.1
254	T	27.7	Very low	27.6	Very low	146 Å²	146	153.9 Å²	153.9	90%	0.896	83%	0.832	S	S	*	*			trans	-135	138.9	147.5	27.3	0	0	0	0	108.5
255	L	30.8	Very low	27.5	Very low	148 Å²	148	153.3 Å²	153.3	78%	0.775	83%	0.829	S	S	*	*			trans	-106.9	150.4	-164.5	-93.8	161.3	0	0	0	113.6
256	N	28.7	Very low	27.2	Very low	148 Å²	148	149.6 Å²	149.6	79%	0.791	82%	0.822	S	S	*	*			trans	41.2	112.6	150.2	-67.8	-11.1	0	0	0	120
257	S	25.8	Very low	27	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	82%	0.822	S	S	*	*				-144.3	160.2	123.2	64.3	0	0	0	0	109.9
258	Q	28.1	Very low	27.5	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	82%	0.821	S	S	*	*			trans	82.9	50.5	178.3	-48.8	-175.8	21.1	0	0	119.2
259	I	29.1	Very low	27.3	Very low	170 Å²	170	144.2 Å²	144.2	87%	0.872	82%	0.816	S	S	*	*			trans	-133.6	86.6	147	-54.9	-180	0	0	0	109.5
260	L	27.1	Very low	27.7	Very low	167 Å²	167	143.3 Å²	143.3	87%	0.874	82%	0.817	S	S	*	*			trans	-163.5	57.6	161.5	-154.8	73.9	0	0	0	116.2
261	T	28	Very low	27.6	Very low	156 Å²	156	147.1 Å²	147.1	96%	0.957	83%	0.826	S	S	*	*			trans	-162.3	143.6	149.7	5.5	0	0	0	0	111.9
262	G	26.8	Very low	27.5	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	83%	0.825	S	S	*	*			trans	116.3	119.7	172	0	0	0	0	0	114.2
263	I	28	Very low	27.5	Very low	162 Å²	162	149.6 Å²	149.6	83%	0.831	83%	0.827	S	S	*	*			trans	-134.2	157	175.3	-49	178.6	0	0	0	107.5
264	I	29.4	Very low	27.7	Very low	159 Å²	159	148.1 Å²	148.1	82%	0.815	82%	0.821	S	S	*	*			trans	77.8	121.8	177.1	-43.8	173	0	0	0	110.8
265	K	24.4	Very low	27.8	Very low	195 Å²	195	148.3 Å²	148.3	85%	0.848	82%	0.816	S	S	*	*			cis	-154.4	163.1	42.3	-153.2	172.9	-179.8	-178.2	0	112.6
266	Q	25.6	Very low	27.7	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	81%	0.814	S	S	*	*			trans	-86.5	138.8	167	-64.4	170.3	-85.2	0	0	111.6
267	E	23.9	Very low	27.6	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	81%	0.812	S	S	*	*				175.9	163.1	120.7	-92.6	-58.6	91.2	0	0	110.1
268	P	34	Very low	27.9	Very low	116 Å²	116	152.7 Å²	152.7	75%	0.753	82%	0.821	S	S	*	*			trans	-93.7	151.5	-153.9	35.3	-37.9	0	0	0	116.2
269	G	21.6	Very low	28	Very low	72 Å²	72	149.3 Å²	149.3	74%	0.742	81%	0.808	S	S	*	*			trans	-157	151.6	167	0	0	0	0	0	111.1	M271	G269-M271 PolarHBondContact O-N 3.39Å
270	L	32.9	Very low	28.1	Very low	168 Å²	168	144.9 Å²	144.9	88%	0.88	79%	0.786	S	S	*	*			trans	-68.5	122.7	175.3	-82.4	68	0	0	0	109.8
271	M	25.4	Very low	28.6	Very low	178 Å²	178	142.9 Å²	142.9	88%	0.877	78%	0.783	S	S	*	*			trans	-126.8	139.9	150.3	-81.2	-75.9	95.9	0	0	108.6	G269	G269-M271 PolarHBondContact O-N 3.39Å
272	Q	28.5	Very low	29.3	Very low	176 Å²	176	142.1 Å²	142.1	82%	0.822	77%	0.773	S	S	*	*			trans	-117	105.2	-174.6	176.3	176.7	-2.7	0	0	106.2	A274	Q272-A274 VanDerWaalsContact C-N 3.33Å; Q272-A274 PolarHBondContact O-N 2.82Å
273	D	24.6	Very low	30.6	Very low	163 Å²	163	146.7 Å²	146.7	87%	0.872	77%	0.768	S	S	*	*			trans	-66.4	89.9	-175.5	-69.3	-30.9	0	0	0	110.9	D275	D273-D275 VanDerWaalsContact C-N 3.29Å; D273-D275 PolarHBondContact O-N 3.24Å
274	A	31.5	Very low	33	Very low	78 Å²	78	142.5 Å²	142.5	65%	0.645	75%	0.745	S	S	*	*			trans	-91.9	44.7	-172.2	0	0	0	0	0	112.7	Q272	Q272-A274 VanDerWaalsContact C-N 3.33Å; Q272-A274 PolarHBondContact O-N 2.82Å
275	D	28.8	Very low	35.7	Very low	149 Å²	149	139 Å²	139	80%	0.797	73%	0.734	S	S	*	*			trans	-135.3	75.1	176.5	-102.8	-42	0	0	0	111.3	D273	D273-D275 VanDerWaalsContact C-N 3.29Å; D273-D275 PolarHBondContact O-N 3.24Å
276	N	28.7	Very low	39.1	Very low	134 Å²	134	130.4 Å²	130.4	72%	0.717	70%	0.697	S	S	*	*			trans	-153.3	26.5	165.7	-108.2	-85.7	0	0	0	111.9	Y278	N276-Y278 PolarHBondContact O-N 3.36Å
277	T	27.3	Very low	42.3	Very low	124 Å²	124	128.8 Å²	128.8	76%	0.761	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	34.3	-166	-36.7	0	0	0	0	113.7
278	Y	31.4	Very low	45.8	Very low	238 Å²	238	122.8 Å²	122.8	93%	0.933	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	23.3	178.1	-105.4	-80.3	0	0	0	113.6	N276	N276-Y278 PolarHBondContact O-N 3.36Å
279	L	31.5	Very low	48.8	Very low	115 Å²	115	123.9 Å²	123.9	60%	0.602	65%	0.652	S	S	*	*	S	Bend	trans	-91.7	130	161.2	-64.2	177.5	0	0	0	109.4
280	D	31.5	Very low	52.4	Low	77 Å²	77	123.7 Å²	123.7	41%	0.412	64%	0.638	S	S	.	*			trans	-51.7	128.5	169.2	166.4	0.6	0	0	0	109.7	N282 Y283	D280-N282 PolarHBondContact O-N 3.3Å; D280-N282 WeakPolarHBondContact OD1-CB 3.19Å; D280-N282 PolarHBondContact OD1-N 2.88Å; D280-N282 PolarHBondContact OD1-ND2 2.97Å; D280-Y283 HydrophobicContact CB-CD2 3.88Å; D280-Y283 PolarHBondContact O-N 3.24Å; D280-Y283 WeakPolarHBondContact OD2-CD2 3.45Å; D280-Y283 WeakPolarHBondContact OD2-CE2 3.3Å
281	P	37.1	Very low	55.3	Low	125 Å²	125	117.1 Å²	117.1	81%	0.812	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-22.8	-178.2	-29.6	36	0	0	0	115.3	Y283	P281-Y283 VanDerWaalsContact C-N 3.3Å; P281-Y283 PolarHBondContact O-N 2.82Å
282	N	42.3	Very low	58.5	Low	140 Å²	140	112.9 Å²	112.9	75%	0.749	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-14.2	178.1	-60.7	-71	0	0	0	114	D280 Q284	D280-N282 PolarHBondContact O-N 3.3Å; D280-N282 WeakPolarHBondContact OD1-CB 3.19Å; D280-N282 PolarHBondContact OD1-N 2.88Å; D280-N282 PolarHBondContact OD1-ND2 2.97Å; N282-Q284 PolarHBondContact O-N 2.65Å
283	Y	53.7	Low	61.6	Low	172 Å²	172	110.1 Å²	110.1	68%	0.675	57%	0.568	S	S	*	*			trans	-102	52.5	-174.3	-76.6	-88.2	0	0	0	113.8	D280 P281 C285	D280-Y283 HydrophobicContact CB-CD2 3.88Å; D280-Y283 PolarHBondContact O-N 3.24Å; D280-Y283 WeakPolarHBondContact OD2-CD2 3.45Å; D280-Y283 WeakPolarHBondContact OD2-CE2 3.3Å; P281-Y283 VanDerWaalsContact C-N 3.3Å; P281-Y283 PolarHBondContact O-N 2.82Å; Y283-C285 PolarHBondContact O-N 3.24Å
284	Q	78.3	Confident	64.9	Low	75 Å²	75	109.3 Å²	109.3	35%	0.35	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-69.6	116.3	172.7	-165.5	177.9	-32.3	0	0	111.2	N282 F322 F329	N282-Q284 PolarHBondContact O-N 2.65Å; Q284-F322 HydrophobicContact CB-CB 4.17Å; Q284-F322 HydrophobicContact CG-CB 4.5Å; Q284-F322 HydrophobicContact CG-CG 4.48Å; Q284-F322 VanDerWaalsContact NE2-CE2 3.26Å; Q284-F329 HydrophobicContact CB-CZ 4.38Å; Q284-F329 HydrophobicContact CG-CE2 4.44Å; Q284-F329 HydrophobicContact CG-CZ 3.96Å; Q284-F329 WeakPolarHBondContact O-CE1 3.46Å; Q284-F329 VanDerWaalsContact O-CZ 3.31Å; Q284-F329 WeakPolarHBondContact O-CZ 3.22Å
285	C	87.6	Confident	67.8	Low	86 Å²	86	111.7 Å²	111.7	58%	0.581	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-93.6	155.4	176	63.4	0	0	0	0	112.4	Y283 K287 F329	Y283-C285 PolarHBondContact O-N 3.24Å; C285-K287 PolarHBondContact O-N 2.85Å; C285-F329 WeakPolarHBondContact O-CZ 3.35Å
286	I	94.3	Very high	70.9	Confident	13 Å²	13	106.1 Å²	106.1	7%	0.067	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-65.9	127.2	175.7	-74.8	-178.1	0	0	0	110.2	W288 A316 F320 F329 E460 I462	I286-W288 HydrophobicContact CG2-CD2 4.45Å; I286-W288 HydrophobicContact CG2-CZ2 4.13Å; I286-W288 VanDerWaalsContact O-CD1 3.23Å; I286-W288 PolarHBondContact O-NE1 3.43Å; I286-A316 HydrophobicContact CB-CB 4.11Å; I286-A316 HydrophobicContact CD1-CB 4.15Å; I286-A316 HydrophobicContact CG1-CB 4.49Å; I286-F320 HydrophobicContact CD1-CB 3.69Å; I286-F320 HydrophobicContact CD1-CD1 3.6Å; I286-F320 HydrophobicContact CD1-CD2 3.66Å; I286-F320 HydrophobicContact CD1-CE1 4.11Å; I286-F320 HydrophobicContact CD1-CE2 4.14Å; I286-F320 HydrophobicContact CD1-CG 3.37Å; I286-F320 HydrophobicContact CD1-CZ 4.35Å; I286-F320 HydrophobicContact CG1-CB 4.38Å; I286-F329 HydrophobicContact CD1-CB 4.27Å; I286-F329 HydrophobicContact CD1-CD1 4.14Å; I286-F329 HydrophobicContact CD1-CG 4.05Å; I286-F329 HydrophobicContact CG1-CB 4.29Å; I286-F329 HydrophobicContact CG1-CD1 3.59Å; I286-F329 HydrophobicContact CG1-CD2 3.72Å; I286-F329 HydrophobicContact CG1-CE1 3.75Å; I286-F329 HydrophobicContact CG1-CE2 3.87Å; I286-F329 HydrophobicContact CG1-CG 3.56Å; I286-F329 HydrophobicContact CG1-CZ 3.89Å; I286-E460 HydrophobicContact CG2-CG 4.49Å; I286-I462 HydrophobicContact CD1-CD1 4.19Å; I286-I462 HydrophobicContact CD1-CG1 4.32Å
287	K	94.6	Very high	74	Confident	137 Å²	137	100.7 Å²	100.7	60%	0.596	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-85.7	149.2	172.9	-61.1	171.9	-176.8	174.2	0	110.6	C285 S459 E460	C285-K287 PolarHBondContact O-N 2.85Å; K287-S459 WeakPolarHBondContact O-CA 3.36Å; K287-E460 WeakPolarHBondContact CB-OE1 3.4Å; K287-E460 PolarHBondContact N-OE1 2.55Å; K287-E460 PolarHBondContact O-N 2.94Å; K287-E460 VanDerWaalsContact O-N 3.08Å
288	W	97.2	Very high	77.2	Confident	43 Å²	43	96.6 Å²	96.6	16%	0.163	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.6	-174.5	-62.9	88.7	0	0	0	111.1	I286 V314 A316 L439 V441 H457 V458	I286-W288 HydrophobicContact CG2-CD2 4.45Å; I286-W288 HydrophobicContact CG2-CZ2 4.13Å; I286-W288 VanDerWaalsContact O-CD1 3.23Å; I286-W288 PolarHBondContact O-NE1 3.43Å; W288-V314 HydrophobicContact CD2-CB 3.98Å; W288-V314 HydrophobicContact CD2-CG1 3.91Å; W288-V314 HydrophobicContact CE3-CB 4.21Å; W288-V314 HydrophobicContact CE3-CG1 3.99Å; W288-V314 HydrophobicContact CG-CB 4.33Å; W288-V314 HydrophobicContact CH2-CG1 3.63Å; W288-V314 HydrophobicContact CZ2-CB 4.44Å; W288-V314 HydrophobicContact CZ2-CG1 3.52Å; W288-V314 HydrophobicContact CZ3-CG1 3.86Å; W288-V314 PolarHBondContact NE1-O 3.43Å; W288-A316 HydrophobicContact CZ2-CB 4.14Å; W288-L439 HydrophobicContact CH2-CB 4.34Å; W288-L439 HydrophobicContact CH2-CD2 4.11Å; W288-L439 HydrophobicContact CH2-CG 4.22Å; W288-L439 WeakPolarHBondContact CZ3-O 3.42Å; W288-V441 HydrophobicContact CH2-CG2 3.69Å; W288-V441 HydrophobicContact CZ3-CB 4.33Å; W288-V441 HydrophobicContact CZ3-CG2 3.67Å; W288-H457 HydrophobicContact CB-CB 4.46Å; W288-H457 HydrophobicContact CE3-CB 4.16Å; W288-V458 WeakPolarHBondContact CA-O 3.34Å
289	Q	96.1	Very high	80.2	Confident	139 Å²	139	85.5 Å²	85.5	65%	0.65	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.4	178.1	-63.3	-178.4	-1.9	0	0	111.1	H291 H457 V458	Q289-H291 PolarHBondContact O-N 3.49Å; Q289-H457 CarbonylContact O-C 3.57Å; Q289-H457 VanDerWaalsContact O-CA 3.27Å; Q289-H457 WeakPolarHBondContact O-CA 3.28Å; Q289-V458 HydrophobicContact CB-CG1 4.5Å; Q289-V458 PolarHBondContact N-O 3.25Å; Q289-V458 PolarHBondContact O-N 2.87Å
290	P	96.8	Very high	83.3	Confident	68 Å²	68	81 Å²	81	44%	0.442	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	127.7	173.1	-27.3	36.4	0	0	0	112.7	Q293 W296	P290-Q293 HydrophobicContact CB-CB 4.42Å; P290-W296 HydrophobicContact CB-CH2 3.92Å; P290-W296 HydrophobicContact CB-CZ2 3.9Å
291	H	95.3	Very high	86.3	Confident	29 Å²	29	78.3 Å²	78.3	13%	0.134	39%	0.392	C	S	.	.			trans	-105.2	118	-177.1	-168.6	71.3	0	0	0	111.8	Q289 Q293 W296 A456 V458	Q289-H291 PolarHBondContact O-N 3.49Å; H291-Q293 VanDerWaalsContact C-N 3.34Å; H291-Q293 PolarHBondContact O-N 2.86Å; H291-W296 PolarHBondContact O-NE1 3.03Å; H291-A456 HydrophobicContact CB-CB 4.13Å; H291-A456 PolarHBondContact N-O 3.4Å; H291-V458 HydrophobicContact CB-CB 3.9Å; H291-V458 HydrophobicContact CB-CG1 3.93Å
292	Q	92.4	Very high	89	Confident	90 Å²	90	75.5 Å²	75.5	42%	0.421	38%	0.379	S	S	.	.	S	Bend	trans	52.2	46.4	178.5	-59.3	-177.2	60.1	0	0	113.2	N294 K295 W296	Q292-N294 PolarHBondContact O-N 2.84Å; Q292-N294 VanDerWaalsContact O-N 3.14Å; Q292-K295 HydrophobicContact CB-CD 4.4Å; Q292-K295 PolarHBondContact O-N 3.44Å; Q292-W296 VanDerWaalsContact O-CD1 3.27Å
293	Q	93.2	Very high	91.4	Very high	117 Å²	117	75.5 Å²	75.5	55%	0.547	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-57.7	-28.1	-176	-168.3	172.3	4.1	0	0	113.9	P290 H291 K295 W296	P290-Q293 HydrophobicContact CB-CB 4.42Å; H291-Q293 VanDerWaalsContact C-N 3.34Å; H291-Q293 PolarHBondContact O-N 2.86Å; Q293-K295 PolarHBondContact O-N 2.89Å; Q293-K295 VanDerWaalsContact O-N 3.16Å; Q293-W296 HydrophobicContact CB-CD2 4.31Å; Q293-W296 HydrophobicContact CB-CH2 4.49Å; Q293-W296 HydrophobicContact CB-CZ2 4.05Å; Q293-W296 HydrophobicContact CG-CD2 3.94Å; Q293-W296 HydrophobicContact CG-CE3 3.94Å; Q293-W296 HydrophobicContact CG-CH2 4.07Å; Q293-W296 HydrophobicContact CG-CZ2 4.08Å; Q293-W296 HydrophobicContact CG-CZ3 4.03Å; Q293-W296 WeakPolarHBondContact O-CB 3.28Å; Q293-W296 PolarHBondContact O-N 2.87Å; Q293-W296 VanDerWaalsContact O-N 3.16Å
294	N	92.8	Very high	93.1	Very high	146 Å²	146	69 Å²	69	78%	0.781	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-68.6	-2.7	172.1	67.9	-37.8	0	0	0	115	Q292	Q292-N294 PolarHBondContact O-N 2.84Å; Q292-N294 VanDerWaalsContact O-N 3.14Å
295	K	92.4	Very high	93.8	Very high	128 Å²	128	72.3 Å²	72.3	56%	0.557	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-117.6	10.2	173.1	-57.3	-175.9	-174.3	170.9	0	112.7	Q292 Q293	Q292-K295 HydrophobicContact CB-CD 4.4Å; Q292-K295 PolarHBondContact O-N 3.44Å; Q293-K295 PolarHBondContact O-N 2.89Å; Q293-K295 VanDerWaalsContact O-N 3.16Å
296	W	94.8	Very high	94.1	Very high	32 Å²	32	71.7 Å²	71.7	12%	0.121	37%	0.369	C	S	.	.			trans	-76.9	138.3	175.2	-66.7	10.3	0	0	0	109.4	P290 H291 Q292 Q293 M309 T453 V454 A455 A456	P290-W296 HydrophobicContact CB-CH2 3.92Å; P290-W296 HydrophobicContact CB-CZ2 3.9Å; H291-W296 PolarHBondContact O-NE1 3.03Å; Q292-W296 VanDerWaalsContact O-CD1 3.27Å; Q293-W296 HydrophobicContact CB-CD2 4.31Å; Q293-W296 HydrophobicContact CB-CH2 4.49Å; Q293-W296 HydrophobicContact CB-CZ2 4.05Å; Q293-W296 HydrophobicContact CG-CD2 3.94Å; Q293-W296 HydrophobicContact CG-CE3 3.94Å; Q293-W296 HydrophobicContact CG-CH2 4.07Å; Q293-W296 HydrophobicContact CG-CZ2 4.08Å; Q293-W296 HydrophobicContact CG-CZ3 4.03Å; Q293-W296 WeakPolarHBondContact O-CB 3.28Å; Q293-W296 PolarHBondContact O-N 2.87Å; Q293-W296 VanDerWaalsContact O-N 3.16Å; W296-M309 HydrophobicContact CB-CE 4.22Å; W296-M309 HydrophobicContact CE3-CE 4.06Å; W296-M309 HydrophobicContact CE3-CG 4.32Å; W296-M309 HydrophobicContact CE3-SD 3.8Å; W296-M309 HydrophobicContact CZ3-CG 4.4Å; W296-M309 HydrophobicContact CZ3-SD 4.41Å; W296-T453 CarbonylContact C-O 3.53Å; W296-T453 WeakPolarHBondContact CA-O 3.45Å; W296-V454 WeakPolarHBondContact CB-O 3.37Å; W296-A455 HydrophobicContact CE3-CB 4.2Å; W296-A455 HydrophobicContact CZ3-CB 4.16Å; W296-A456 WeakPolarHBondContact CZ2-O 3.42Å
297	T	94.6	Very high	94	Very high	20 Å²	20	72 Å²	72	12%	0.123	37%	0.37	C	S	.	.			trans	-107.5	120.2	-169	-43.8	0	0	0	0	108.6	I352 K353 T453	T297-I352 HydrophobicContact CG2-CD1 3.87Å; T297-I352 HydrophobicContact CG2-CG1 3.48Å; T297-I352 VanDerWaalsContact CG2-CG1 3.48Å; T297-K353 WeakPolarHBondContact CG2-O 3.37Å; T297-T453 PolarHBondContact N-O 3.28Å; T297-T453 PolarHBondContact OG1-O 2.83Å
298	P	93.4	Very high	94	Very high	38 Å²	38	69 Å²	69	25%	0.247	37%	0.365	C	S	.	.			trans	-70.9	149.7	-174.4	27	-32.5	0	0	0	112.3	Y300 D306 K353	P298-Y300 HydrophobicContact CB-CE2 4.07Å; P298-Y300 HydrophobicContact CG-CE2 4.07Å; P298-D306 WeakPolarHBondContact CB-OD1 3.31Å; P298-K353 HydrophobicContact CG-CB 4.04Å; P298-K353 HydrophobicContact CG-CD 3.98Å; P298-K353 PolarHBondContact O-N 3.23Å
299	L	95.2	Very high	93.7	Very high	5 Å²	5	71 Å²	71	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	147.8	180	-57.9	-179.6	0	0	0	110.1	L307 M345 P349 I352 I361 F364 V454	L299-L307 HydrophobicContact CB-CB 4.39Å; L299-L307 HydrophobicContact CB-CD1 4.33Å; L299-L307 WeakPolarHBondContact O-CB 3.3Å; L299-L307 PolarHBondContact O-N 3.37Å; L299-M345 HydrophobicContact CD1-CE 3.73Å; L299-M345 HydrophobicContact CD1-SD 3.82Å; L299-P349 HydrophobicContact CB-CB 4.08Å; L299-P349 HydrophobicContact CD1-CB 3.98Å; L299-P349 HydrophobicContact CD1-CG 4.45Å; L299-P349 HydrophobicContact CG-CB 4.49Å; L299-I352 HydrophobicContact CD2-CD1 4.2Å; L299-I361 HydrophobicContact CD2-CD1 3.76Å; L299-F364 HydrophobicContact CD1-CE1 4.09Å; L299-F364 HydrophobicContact CD1-CZ 4.21Å; L299-F364 HydrophobicContact CD2-CE1 4.14Å; L299-F364 HydrophobicContact CD2-CZ 4.45Å; L299-V454 HydrophobicContact CD1-CG1 3.85Å; L299-V454 HydrophobicContact CD2-CG1 4.25Å; L299-V454 HydrophobicContact CD2-CG2 3.9Å; L299-V454 HydrophobicContact CG-CG1 4.01Å
300	Y	95.1	Very high	93.5	Very high	20 Å²	20	64.8 Å²	64.8	8%	0.078	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.6	-174.1	-82.6	-113.7	0	0	0	110.4	P298 G304 K305 D306 K350 Y351 K353 L358	P298-Y300 HydrophobicContact CB-CE2 4.07Å; P298-Y300 HydrophobicContact CG-CE2 4.07Å; Y300-G304 WeakPolarHBondContact CD1-O 3.15Å; Y300-K305 VanDerWaalsContact CA-O 3.28Å; Y300-K305 WeakPolarHBondContact CA-O 3.15Å; Y300-D306 HydrophobicContact CE1-CB 3.98Å; Y300-D306 HydrophobicContact CE2-CB 4.03Å; Y300-D306 VanDerWaalsContact CE2-CG 3.4Å; Y300-D306 WeakPolarHBondContact CE2-OD1 3.48Å; Y300-D306 WeakPolarHBondContact CE2-OD2 3.48Å; Y300-D306 PolarHBondContact OH-OD2 2.84Å; Y300-K350 PolarHBondContact O-N 2.81Å; Y300-Y351 PolarHBondContact N-O 2.74Å; Y300-Y351 PolarHBondContact O-N 3.35Å; Y300-K353 HydrophobicContact CD2-CB 4.05Å; Y300-K353 HydrophobicContact CE2-CB 3.8Å; Y300-K353 HydrophobicContact CE2-CD 3.78Å; Y300-K353 HydrophobicContact CE2-CG 4.29Å; Y300-K353 PolarHBondContact OH-NZ 3.14Å; Y300-L358 HydrophobicContact CD1-CD1 4.08Å; Y300-L358 HydrophobicContact CD1-CD2 3.66Å; Y300-L358 HydrophobicContact CD2-CD2 3.87Å; Y300-L358 HydrophobicContact CE1-CD2 4.15Å; Y300-L358 HydrophobicContact CE2-CD2 4.4Å; Y300-L358 HydrophobicContact CG-CD2 3.53Å
301	D	94.6	Very high	93.5	Very high	22 Å²	22	65.5 Å²	65.5	12%	0.118	35%	0.352	C	S	.	.			trans	-78.7	177.8	-179.7	81.2	-9.3	0	0	0	112.9	N303 G304 K305 L307 Y351	D301-N303 PolarHBondContact O-N 2.78Å; D301-N303 VanDerWaalsContact O-N 3.08Å; D301-N303 VanDerWaalsContact OD1-CA 3.29Å; D301-N303 WeakPolarHBondContact OD1-CA 3.47Å; D301-N303 VanDerWaalsContact OD1-CB 3.3Å; D301-N303 WeakPolarHBondContact OD1-CB 3.44Å; D301-N303 PolarHBondContact OD1-N 3.39Å; D301-N303 PolarHBondContact OD2-ND2 3.48Å; D301-G304 PolarHBondContact O-N 2.87Å; D301-G304 VanDerWaalsContact O-N 3.08Å; D301-G304 PolarHBondContact OD1-N 2.6Å; D301-G304 VanDerWaalsContact OD1-N 3.08Å; D301-K305 PolarHBondContact N-O 3.45Å; D301-K305 WeakPolarHBondContact OD1-CB 3.16Å; D301-K305 PolarHBondContact OD1-N 2.84Å; D301-L307 HydrophobicContact CB-CD1 4.36Å; D301-L307 HydrophobicContact CB-CD2 3.97Å; D301-L307 HydrophobicContact CB-CG 4.22Å; D301-Y351 WeakPolarHBondContact O-CD2 3.04Å
302	A	93.9	Very high	93.6	Very high	65 Å²	65	65.2 Å²	65.2	54%	0.537	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.5	176.4	0	0	0	0	0	114.6	K350	A302-K350 HydrophobicContact CB-CG 3.9Å
303	N	93	Very high	93.8	Very high	140 Å²	140	67.3 Å²	67.3	75%	0.749	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-0.7	-179.2	-48.8	-72.9	0	0	0	112.4	D301 K305	D301-N303 PolarHBondContact O-N 2.78Å; D301-N303 VanDerWaalsContact O-N 3.08Å; D301-N303 VanDerWaalsContact OD1-CA 3.29Å; D301-N303 WeakPolarHBondContact OD1-CA 3.47Å; D301-N303 VanDerWaalsContact OD1-CB 3.3Å; D301-N303 WeakPolarHBondContact OD1-CB 3.44Å; D301-N303 PolarHBondContact OD1-N 3.39Å; D301-N303 PolarHBondContact OD2-ND2 3.48Å; N303-K305 VanDerWaalsContact C-N 3.34Å
304	G	89.5	Confident	94	Very high	36 Å²	36	62 Å²	62	37%	0.371	33%	0.33	S	S	.	.	S	Bend	trans	74.5	21.8	-173.4	0	0	0	0	0	113.8	Y300 D301	Y300-G304 WeakPolarHBondContact CD1-O 3.15Å; D301-G304 PolarHBondContact O-N 2.87Å; D301-G304 VanDerWaalsContact O-N 3.08Å; D301-G304 PolarHBondContact OD1-N 2.6Å; D301-G304 VanDerWaalsContact OD1-N 3.08Å
305	K	93.3	Very high	94.1	Very high	145 Å²	145	56.9 Å²	56.9	63%	0.63	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-91.8	138.7	174.3	-173.9	-172.1	171	-169.7	0	110.7	Y300 D301 N303	Y300-K305 VanDerWaalsContact CA-O 3.28Å; Y300-K305 WeakPolarHBondContact CA-O 3.15Å; D301-K305 PolarHBondContact N-O 3.45Å; D301-K305 WeakPolarHBondContact OD1-CB 3.16Å; D301-K305 PolarHBondContact OD1-N 2.84Å; N303-K305 VanDerWaalsContact C-N 3.34Å
306	D	92.9	Very high	94.3	Very high	72 Å²	72	52 Å²	52	39%	0.385	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-63.1	133.4	174.6	-146.2	-34.8	0	0	0	110.8	P298 Y300	P298-D306 WeakPolarHBondContact CB-OD1 3.31Å; Y300-D306 HydrophobicContact CE1-CB 3.98Å; Y300-D306 HydrophobicContact CE2-CB 4.03Å; Y300-D306 VanDerWaalsContact CE2-CG 3.4Å; Y300-D306 WeakPolarHBondContact CE2-OD1 3.48Å; Y300-D306 WeakPolarHBondContact CE2-OD2 3.48Å; Y300-D306 PolarHBondContact OH-OD2 2.84Å
307	L	94	Very high	94	Very high	20 Å²	20	53.5 Å²	53.5	11%	0.105	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-97.4	146.7	179.6	-70.6	177	0	0	0	111.4	L299 D301 M309 P349	L299-L307 HydrophobicContact CB-CB 4.39Å; L299-L307 HydrophobicContact CB-CD1 4.33Å; L299-L307 WeakPolarHBondContact O-CB 3.3Å; L299-L307 PolarHBondContact O-N 3.37Å; D301-L307 HydrophobicContact CB-CD1 4.36Å; D301-L307 HydrophobicContact CB-CD2 3.97Å; D301-L307 HydrophobicContact CB-CG 4.22Å; L307-M309 PolarHBondContact O-N 2.9Å; L307-P349 HydrophobicContact CD1-CB 3.85Å
308	P	93.3	Very high	93.8	Very high	75 Å²	75	58.9 Å²	58.9	49%	0.487	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-55.3	138.5	170.7	-22.3	33.5	0	0	0	111.3	L346	P308-L346 HydrophobicContact CB-CB 4.25Å; P308-L346 HydrophobicContact CB-CD1 3.97Å; P308-L346 HydrophobicContact CG-CB 4.25Å; P308-L346 HydrophobicContact CG-CD1 4.43Å
309	M	90.6	Very high	93.7	Very high	85 Å²	85	58.4 Å²	58.4	42%	0.419	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-55.3	125.5	176.5	-174.1	64.8	65.8	0	0	109.9	W296 L307 T311 V454	W296-M309 HydrophobicContact CB-CE 4.22Å; W296-M309 HydrophobicContact CE3-CE 4.06Å; W296-M309 HydrophobicContact CE3-CG 4.32Å; W296-M309 HydrophobicContact CE3-SD 3.8Å; W296-M309 HydrophobicContact CZ3-CG 4.4Å; W296-M309 HydrophobicContact CZ3-SD 4.41Å; L307-M309 PolarHBondContact O-N 2.9Å; M309-T311 PolarHBondContact O-N 2.76Å; M309-V454 VanDerWaalsContact SD-O 3.41Å
310	P	93.6	Very high	93.6	Very high	7 Å²	7	59.3 Å²	59.3	5%	0.045	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-60.6	139.1	-176.1	22.3	-34.1	0	0	0	111.8	Y312 G344 M345 V454	P310-Y312 PolarHBondContact O-N 3.12Å; P310-G344 CarbonylContact C-O 3.48Å; P310-G344 WeakPolarHBondContact CA-O 3.36Å; P310-G344 WeakPolarHBondContact CB-O 3.42Å; P310-M345 HydrophobicContact CB-CE 4.02Å; P310-M345 HydrophobicContact CB-SD 4.13Å; P310-M345 HydrophobicContact CG-CE 4.18Å; P310-V454 HydrophobicContact CG-CG1 3.86Å
311	T	95.5	Very high	93.3	Very high	84 Å²	84	64 Å²	64	52%	0.515	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	120.2	178.2	63.9	0	0	0	0	109.1	M309 I343 G344	M309-T311 PolarHBondContact O-N 2.76Å; T311-I343 WeakPolarHBondContact O-CA 3.35Å; T311-G344 PolarHBondContact N-O 3.27Å; T311-G344 PolarHBondContact O-N 2.69Å; T311-G344 VanDerWaalsContact OG1-CA 3.31Å; T311-G344 WeakPolarHBondContact OG1-CA 3.02Å; T311-G344 PolarHBondContact OG1-N 2.78Å
312	Y	97.3	Very high	93.1	Very high	23 Å²	23	65.2 Å²	65.2	9%	0.09	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.1	-169.9	-166.8	-102.8	0	0	0	110.5	P310 V314 V341 I343 L366 V441 L443 A455 H457	P310-Y312 PolarHBondContact O-N 3.12Å; Y312-V314 HydrophobicContact CD1-CG2 4.13Å; Y312-V314 HydrophobicContact CE1-CG2 3.59Å; Y312-V341 HydrophobicContact CD2-CG1 4.19Å; Y312-V341 HydrophobicContact CE2-CG1 3.57Å; Y312-I343 HydrophobicContact CD2-CG1 4.03Å; Y312-I343 HydrophobicContact CE2-CD1 4.19Å; Y312-I343 HydrophobicContact CE2-CG1 4Å; Y312-L366 WeakPolarHBondContact OH-CD1 3.47Å; Y312-V441 PolarHBondContact OH-O 2.82Å; Y312-V441 VanDerWaalsContact OH-O 3.12Å; Y312-L443 HydrophobicContact CD2-CB 4.48Å; Y312-L443 HydrophobicContact CE2-CB 3.77Å; Y312-L443 PolarHBondContact OH-N 3.47Å; Y312-A455 HydrophobicContact CD1-CB 4.16Å; Y312-A455 HydrophobicContact CD2-CB 3.97Å; Y312-A455 HydrophobicContact CE2-CB 4.44Å; Y312-A455 HydrophobicContact CG-CB 3.8Å; Y312-H457 AromaticContact CD1-CE1 3.99Å; Y312-H457 AromaticContact CD1-CG 3.98Å; Y312-H457 AromaticContact CD1-ND1 3.71Å; Y312-H457 HydrophobicContact CE1-CB 4.27Å
313	R	96.9	Very high	92.7	Very high	133 Å²	133	62.9 Å²	62.9	50%	0.502	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134	-179.4	-178.6	176.4	173	-70.4	-17.3	110	D315 V341 Y342	R313-D315 IonicContact CZ-OD1 3.22Å; R313-D315 VanDerWaalsContact CZ-OD1 3.22Å; R313-D315 IonicContact CZ-OD2 3.43Å; R313-D315 VanDerWaalsContact NH1-CG 3.31Å; R313-D315 IonicContact NH1-OD1 3.27Å; R313-D315 PolarHBondContact NH1-OD1 2.93Å; R313-D315 IonicContact NH1-OD2 2.69Å; R313-D315 PolarHBondContact NH1-OD2 3.24Å; R313-D315 IonicContact NH2-OD1 2.7Å; R313-D315 PolarHBondContact NH2-OD1 3.42Å; R313-D315 IonicContact NH2-OD2 3.32Å; R313-D315 PolarHBondContact NH2-OD2 3.4Å; R313-V341 CarbonylContact O-C 3.59Å; R313-V341 WeakPolarHBondContact O-CA 3.44Å; R313-Y342 PolarHBondContact N-O 3.32Å; R313-Y342 PolarHBondContact O-N 3.23Å
314	V	97.9	Very high	92.2	Very high	6 Å²	6	62.7 Å²	62.7	4%	0.036	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.8	-177	-174.9	0	0	0	0	109.6	W288 Y312 V339 V341 V441 H457	W288-V314 HydrophobicContact CD2-CB 3.98Å; W288-V314 HydrophobicContact CD2-CG1 3.91Å; W288-V314 HydrophobicContact CE3-CB 4.21Å; W288-V314 HydrophobicContact CE3-CG1 3.99Å; W288-V314 HydrophobicContact CG-CB 4.33Å; W288-V314 HydrophobicContact CH2-CG1 3.63Å; W288-V314 HydrophobicContact CZ2-CB 4.44Å; W288-V314 HydrophobicContact CZ2-CG1 3.52Å; W288-V314 HydrophobicContact CZ3-CG1 3.86Å; W288-V314 PolarHBondContact NE1-O 3.43Å; Y312-V314 HydrophobicContact CD1-CG2 4.13Å; Y312-V314 HydrophobicContact CE1-CG2 3.59Å; V314-V339 HydrophobicContact CG1-CG1 3.64Å; V314-V341 HydrophobicContact CG1-CG2 4.36Å; V314-V341 HydrophobicContact CG2-CG1 4.27Å; V314-V341 HydrophobicContact CG2-CG2 4.31Å; V314-V441 HydrophobicContact CG1-CB 4.14Å; V314-V441 HydrophobicContact CG1-CG1 4.1Å; V314-V441 HydrophobicContact CG1-CG2 4.07Å; V314-V441 HydrophobicContact CG2-CB 4.27Å; V314-V441 HydrophobicContact CG2-CG1 4.11Å; V314-H457 HydrophobicContact CG2-CB 4.01Å
315	D	95.3	Very high	91.7	Very high	38 Å²	38	63.1 Å²	63.1	20%	0.203	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.3	174.5	-72.4	-31.4	0	0	0	110.3	R313 V339 T340 Y342	R313-D315 IonicContact CZ-OD1 3.22Å; R313-D315 VanDerWaalsContact CZ-OD1 3.22Å; R313-D315 IonicContact CZ-OD2 3.43Å; R313-D315 VanDerWaalsContact NH1-CG 3.31Å; R313-D315 IonicContact NH1-OD1 3.27Å; R313-D315 PolarHBondContact NH1-OD1 2.93Å; R313-D315 IonicContact NH1-OD2 2.69Å; R313-D315 PolarHBondContact NH1-OD2 3.24Å; R313-D315 IonicContact NH2-OD1 2.7Å; R313-D315 PolarHBondContact NH2-OD1 3.42Å; R313-D315 IonicContact NH2-OD2 3.32Å; R313-D315 PolarHBondContact NH2-OD2 3.4Å; D315-V339 CarbonylContact O-C 3.55Å; D315-V339 VanDerWaalsContact O-CA 3.31Å; D315-V339 WeakPolarHBondContact O-CA 3.36Å; D315-V339 WeakPolarHBondContact O-CG1 3.26Å; D315-T340 PolarHBondContact N-O 3.48Å; D315-T340 PolarHBondContact O-N 2.73Å; D315-Y342 VanDerWaalsContact OD2-CE2 3.3Å; D315-Y342 WeakPolarHBondContact OD2-CE2 3.26Å
316	A	95.1	Very high	91.4	Very high	27 Å²	27	56.7 Å²	56.7	22%	0.223	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	82.6	168.5	0	0	0	0	0	109.8	I286 W288 K318 F320 Q338	I286-A316 HydrophobicContact CB-CB 4.11Å; I286-A316 HydrophobicContact CD1-CB 4.15Å; I286-A316 HydrophobicContact CG1-CB 4.49Å; W288-A316 HydrophobicContact CZ2-CB 4.14Å; A316-K318 VanDerWaalsContact C-N 3.26Å; A316-K318 PolarHBondContact O-N 3.38Å; A316-F320 HydrophobicContact CB-CD2 3.87Å; A316-F320 HydrophobicContact CB-CE2 3.92Å; A316-Q338 CarbonylContact C-O 3.52Å
317	D	88.4	Confident	91.2	Very high	63 Å²	63	57.8 Å²	57.8	34%	0.337	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	-36	-169.8	-50.5	-54.3	0	0	0	113.8	Q338 T340	D317-Q338 HydrophobicContact CB-CB 4.4Å; D317-Q338 HydrophobicContact CB-CG 4.32Å; D317-Q338 PolarHBondContact N-O 2.04Å; D317-Q338 VanDerWaalsContact N-O 3.14Å; D317-Q338 WeakPolarHBondContact OD2-CG 3.37Å; D317-Q338 PolarHBondContact OD2-NE2 2.98Å; D317-T340 PolarHBondContact OD1-OG1 2.9Å; D317-T340 WeakPolarHBondContact OD2-CB 3.47Å; D317-T340 PolarHBondContact OD2-OG1 3.35Å
318	K	91.9	Very high	91.2	Very high	132 Å²	132	56.9 Å²	56.9	57%	0.574	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.7	153.6	-169.7	-61.7	-175.1	-179.2	176.1	0	112.3	A316 F337 Q338	A316-K318 VanDerWaalsContact C-N 3.26Å; A316-K318 PolarHBondContact O-N 3.38Å; K318-F337 CarbonylContact O-C 3.03Å; K318-F337 WeakPolarHBondContact O-CA 3.47Å; K318-F337 VanDerWaalsContact O-CB 3.24Å; K318-F337 WeakPolarHBondContact O-CB 3.48Å; K318-Q338 HydrophobicContact CB-CB 4.22Å; K318-Q338 PolarHBondContact O-N 3.32Å
319	G	90	Very high	91.3	Very high	28 Å²	28	53.4 Å²	53.4	29%	0.289	28%	0.284	S	S	.	.	S	Bend	trans	102.1	-0.7	165.2	0	0	0	0	0	116	C331	G319-C331 WeakPolarHBondContact O-CB 3.12Å
320	F	92.8	Very high	91.4	Very high	25 Å²	25	50 Å²	50	11%	0.11	27%	0.267	C	S	.	.			trans	-122	144.9	175.7	-52.5	-88.1	0	0	0	109.3	I286 A316 F329 C331 F337 F416 L439 I462	I286-F320 HydrophobicContact CD1-CB 3.69Å; I286-F320 HydrophobicContact CD1-CD1 3.6Å; I286-F320 HydrophobicContact CD1-CD2 3.66Å; I286-F320 HydrophobicContact CD1-CE1 4.11Å; I286-F320 HydrophobicContact CD1-CE2 4.14Å; I286-F320 HydrophobicContact CD1-CG 3.37Å; I286-F320 HydrophobicContact CD1-CZ 4.35Å; I286-F320 HydrophobicContact CG1-CB 4.38Å; A316-F320 HydrophobicContact CB-CD2 3.87Å; A316-F320 HydrophobicContact CB-CE2 3.92Å; F320-F329 HydrophobicContact CB-CD1 4Å; F320-C331 HydrophobicContact CD1-CB 3.64Å; F320-C331 HydrophobicContact CE1-CB 3.95Å; F320-C331 HydrophobicContact CG-CB 4.44Å; F320-F337 HydrophobicContact CD2-CB 4.18Å; F320-F337 HydrophobicContact CE1-CG 4.49Å; F320-F337 HydrophobicContact CE2-CB 3.49Å; F320-F337 VanDerWaalsContact CE2-CB 3.49Å; F320-F337 AromaticContact CE2-CD2 3.87Å; F320-F337 HydrophobicContact CE2-CD2 3.87Å; F320-F337 AromaticContact CE2-CG 3.79Å; F320-F337 HydrophobicContact CE2-CG 3.79Å; F320-F337 HydrophobicContact CZ-CB 3.72Å; F320-F337 AromaticContact CZ-CD1 3.99Å; F320-F337 HydrophobicContact CZ-CD1 3.99Å; F320-F337 AromaticContact CZ-CD2 3.72Å; F320-F337 HydrophobicContact CZ-CD2 3.72Å; F320-F337 HydrophobicContact CZ-CE2 4.28Å; F320-F337 AromaticContact CZ-CG 3.56Å; F320-F337 HydrophobicContact CZ-CG 3.56Å; F320-F416 HydrophobicContact CE1-CE2 4.11Å; F320-F416 HydrophobicContact CZ-CE2 4.49Å; F320-L439 HydrophobicContact CZ-CD2 4.3Å; F320-I462 HydrophobicContact CD1-CD1 4.31Å; F320-I462 HydrophobicContact CD1-CG1 4.45Å; F320-I462 HydrophobicContact CD1-CG2 4.18Å; F320-I462 HydrophobicContact CE1-CD1 3.79Å; F320-I462 HydrophobicContact CE1-CG1 4.36Å; F320-I462 HydrophobicContact CE1-CG2 4.08Å; F320-I462 HydrophobicContact CZ-CD1 4.45Å
321	N	90.5	Very high	91.4	Very high	117 Å²	117	49.9 Å²	49.9	63%	0.626	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.6	170.7	-47.5	-89.3	0	0	0	107.5	F329 V330	N321-F329 CarbonylContact O-C 3.51Å; N321-F329 WeakPolarHBondContact O-CA 3.45Å; N321-V330 PolarHBondContact N-O 3.19Å; N321-V330 PolarHBondContact O-N 3.45Å
322	F	88.8	Confident	91.2	Very high	48 Å²	48	47.1 Å²	47.1	21%	0.211	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	143	171.9	-165.7	-106.9	0	0	0	110.1	Q284 L324 F329	Q284-F322 HydrophobicContact CB-CB 4.17Å; Q284-F322 HydrophobicContact CG-CB 4.5Å; Q284-F322 HydrophobicContact CG-CG 4.48Å; Q284-F322 VanDerWaalsContact NE2-CE2 3.26Å; F322-L324 HydrophobicContact CD1-CD2 4.22Å; F322-L324 HydrophobicContact CE1-CD2 4.13Å; F322-F329 HydrophobicContact CB-CD1 4.3Å; F322-F329 HydrophobicContact CB-CE1 3.97Å; F322-F329 HydrophobicContact CB-CZ 4.12Å; F322-F329 HydrophobicContact CD2-CD1 4.49Å; F322-F329 AromaticContact CD2-CD2 3.75Å; F322-F329 HydrophobicContact CD2-CD2 3.75Å; F322-F329 HydrophobicContact CD2-CE1 4.45Å; F322-F329 AromaticContact CD2-CE2 3.7Å; F322-F329 HydrophobicContact CD2-CE2 3.7Å; F322-F329 HydrophobicContact CD2-CG 4.17Å; F322-F329 HydrophobicContact CD2-CZ 4.07Å; F322-F329 HydrophobicContact CE2-CD2 4.38Å; F322-F329 HydrophobicContact CE2-CE2 4.4Å
323	S	86.1	Confident	91	Very high	16 Å²	16	49 Å²	49	11%	0.112	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	105.9	174.1	-170.2	0	0	0	0	109.8	A325 D326 D327 A328	S323-A325 PolarHBondContact O-N 3.38Å; S323-D326 CarbonylContact O-C 3.55Å; S323-D326 PolarHBondContact O-N 3.26Å; S323-D327 PolarHBondContact O-N 2.82Å; S323-A328 PolarHBondContact N-O 3.04Å
324	L	82.4	Confident	90.7	Very high	136 Å²	136	49.8 Å²	49.8	71%	0.712	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.3	176.6	-64.4	170.2	0	0	0	111.9	F322 D326	F322-L324 HydrophobicContact CD1-CD2 4.22Å; F322-L324 HydrophobicContact CE1-CD2 4.13Å; L324-D326 VanDerWaalsContact C-N 3.28Å; L324-D326 PolarHBondContact O-N 2.88Å
325	A	80.4	Confident	90.4	Very high	46 Å²	46	53.3 Å²	53.3	38%	0.38	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.2	-178.4	0	0	0	0	0	114.3	S323 P430	S323-A325 PolarHBondContact O-N 3.38Å; A325-P430 WeakPolarHBondContact O-CG 3.37Å
326	D	85.6	Confident	90.3	Very high	9 Å²	9	55.7 Å²	55.7	5%	0.048	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	0.6	179.6	-66.9	-88.2	0	0	0	112.8	S323 L324 A328 R425 P430 I463 R465	S323-D326 CarbonylContact O-C 3.55Å; S323-D326 PolarHBondContact O-N 3.26Å; L324-D326 VanDerWaalsContact C-N 3.28Å; L324-D326 PolarHBondContact O-N 2.88Å; D326-A328 PolarHBondContact O-N 2.78Å; D326-R425 IonicContact OD1-NH2 2.74Å; D326-R425 IonicContact OD2-CZ 3.14Å; D326-R425 IonicContact OD2-NH1 3.16Å; D326-R425 IonicContact OD2-NH2 3.71Å; D326-R425 PolarHBondContact OD2-NH2 2.85Å; D326-P430 HydrophobicContact CB-CG 4.48Å; D326-I463 HydrophobicContact CB-CD1 3.87Å; D326-R465 IonicContact OD1-NH2 3.62Å; D326-R465 PolarHBondContact OD1-NH2 2.79Å; D326-R465 VanDerWaalsContact OD1-NH2 3.16Å; D326-R465 IonicContact OD2-CZ 3.67Å; D326-R465 IonicContact OD2-NH1 3.35Å; D326-R465 IonicContact OD2-NH2 3.83Å; D326-R465 PolarHBondContact OD2-NH2 2.87Å
327	D	90	Very high	90.4	Very high	96 Å²	96	54.6 Å²	54.6	51%	0.513	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	37.2	-178.5	-170	25.2	0	0	0	113.3	S323 R461	S323-D327 PolarHBondContact O-N 2.82Å; D327-R461 VanDerWaalsContact O-CZ 3.23Å; D327-R461 PolarHBondContact O-NE 3.4Å; D327-R461 PolarHBondContact O-NH2 2.84Å; D327-R461 IonicContact OD1-NH2 3.16Å; D327-R461 IonicContact OD2-CZ 3.29Å; D327-R461 IonicContact OD2-NH2 2.62Å; D327-R461 PolarHBondContact OD2-NH2 2.95Å
328	A	93.1	Very high	90.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	159.5	-172.8	0	0	0	0	0	112.6	S323 D326 Y436 R461 I463	S323-A328 PolarHBondContact N-O 3.04Å; D326-A328 PolarHBondContact O-N 2.78Å; A328-Y436 HydrophobicContact CB-CD1 4.35Å; A328-Y436 HydrophobicContact CB-CE1 3.87Å; A328-R461 HydrophobicContact CB-CG 4.1Å; A328-I463 HydrophobicContact CB-CD1 4.01Å; A328-I463 HydrophobicContact CB-CG1 4.1Å
329	F	94.4	Very high	91.1	Very high	3 Å²	3	47.4 Å²	47.4	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.5	167.3	-82.6	-84.4	0	0	0	111	Q284 C285 I286 F320 N321 F322 E460 R461 I462 I463	Q284-F329 HydrophobicContact CB-CZ 4.38Å; Q284-F329 HydrophobicContact CG-CE2 4.44Å; Q284-F329 HydrophobicContact CG-CZ 3.96Å; Q284-F329 WeakPolarHBondContact O-CE1 3.46Å; Q284-F329 VanDerWaalsContact O-CZ 3.31Å; Q284-F329 WeakPolarHBondContact O-CZ 3.22Å; C285-F329 WeakPolarHBondContact O-CZ 3.35Å; I286-F329 HydrophobicContact CD1-CB 4.27Å; I286-F329 HydrophobicContact CD1-CD1 4.14Å; I286-F329 HydrophobicContact CD1-CG 4.05Å; I286-F329 HydrophobicContact CG1-CB 4.29Å; I286-F329 HydrophobicContact CG1-CD1 3.59Å; I286-F329 HydrophobicContact CG1-CD2 3.72Å; I286-F329 HydrophobicContact CG1-CE1 3.75Å; I286-F329 HydrophobicContact CG1-CE2 3.87Å; I286-F329 HydrophobicContact CG1-CG 3.56Å; I286-F329 HydrophobicContact CG1-CZ 3.89Å; F320-F329 HydrophobicContact CB-CD1 4Å; N321-F329 CarbonylContact O-C 3.51Å; N321-F329 WeakPolarHBondContact O-CA 3.45Å; F322-F329 HydrophobicContact CB-CD1 4.3Å; F322-F329 HydrophobicContact CB-CE1 3.97Å; F322-F329 HydrophobicContact CB-CZ 4.12Å; F322-F329 HydrophobicContact CD2-CD1 4.49Å; F322-F329 AromaticContact CD2-CD2 3.75Å; F322-F329 HydrophobicContact CD2-CD2 3.75Å; F322-F329 HydrophobicContact CD2-CE1 4.45Å; F322-F329 AromaticContact CD2-CE2 3.7Å; F322-F329 HydrophobicContact CD2-CE2 3.7Å; F322-F329 HydrophobicContact CD2-CG 4.17Å; F322-F329 HydrophobicContact CD2-CZ 4.07Å; F322-F329 HydrophobicContact CE2-CD2 4.38Å; F322-F329 HydrophobicContact CE2-CE2 4.4Å; F329-E460 VanDerWaalsContact CD2-CD 3.5Å; F329-E460 HydrophobicContact CD2-CG 3.83Å; F329-E460 VanDerWaalsContact CE2-CD 3.43Å; F329-E460 HydrophobicContact CE2-CG 4.22Å; F329-E460 VanDerWaalsContact CE2-OE1 3.28Å; F329-E460 WeakPolarHBondContact CE2-OE1 3.45Å; F329-R461 PolarHBondContact N-O 2.82Å; F329-I462 HydrophobicContact CB-CG1 4.27Å; F329-I462 CarbonylContact O-C 3.58Å; F329-I462 WeakPolarHBondContact O-CA 3.39Å; F329-I463 PolarHBondContact O-N 3.34Å
330	V	93.2	Very high	91.5	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.073	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.6	178.2	-171.9	0	0	0	0	109.3	N321 I463 R465	N321-V330 PolarHBondContact N-O 3.19Å; N321-V330 PolarHBondContact O-N 3.45Å; V330-I463 WeakPolarHBondContact CA-O 3.39Å; V330-I463 HydrophobicContact CG2-CB 4.3Å; V330-R465 HydrophobicContact CG1-CG 4.03Å
331	C	93.9	Very high	91.7	Very high	5 Å²	5	45 Å²	45	3%	0.034	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	165.9	166.7	69.1	0	0	0	0	110.7	G319 F320 I463 V464 R465	G319-C331 WeakPolarHBondContact O-CB 3.12Å; F320-C331 HydrophobicContact CD1-CB 3.64Å; F320-C331 HydrophobicContact CE1-CB 3.95Å; F320-C331 HydrophobicContact CG-CB 4.44Å; C331-I463 PolarHBondContact N-O 2.82Å; C331-V464 WeakPolarHBondContact O-CA 3.18Å; C331-R465 PolarHBondContact O-N 3.3Å
332	Q	91.1	Very high	92.1	Very high	27 Å²	27	42.3 Å²	42.3	13%	0.126	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.4	177.7	-57.1	-179.2	43.1	0	0	110.8	K334 N335 R465 S467 N468	Q332-K334 PolarHBondContact O-N 3.32Å; Q332-K334 VanDerWaalsContact O-N 3.08Å; Q332-N335 HydrophobicContact CB-CB 4.16Å; Q332-N335 PolarHBondContact NE2-ND2 2.94Å; Q332-N335 PolarHBondContact O-N 2.84Å; Q332-N335 VanDerWaalsContact O-N 3.14Å; Q332-R465 CarbonylContact C-O 3.48Å; Q332-R465 WeakPolarHBondContact CA-O 3.29Å; Q332-S467 PolarHBondContact OE1-O 3.2Å; Q332-N468 PolarHBondContact NE2-OD1 3.43Å; Q332-N468 PolarHBondContact OE1-OD1 2.81Å; Q332-N468 VanDerWaalsContact OE1-OD1 3.11Å
333	K	93.7	Very high	92.5	Very high	62 Å²	62	40 Å²	40	27%	0.27	20%	0.202	S	C	.	.	S	Bend	trans	-60.1	-22.7	177.2	-153.2	-145.5	-178.3	-175.6	0	114.2	K391 H415 F416 S417 T419 V464 R465	K333-K391 PolarHBondContact O-NZ 2.7Å; K333-K391 VanDerWaalsContact O-NZ 3.08Å; K333-H415 PolarHBondContact O-ND1 2.85Å; K333-F416 WeakPolarHBondContact CE-O 3.21Å; K333-F416 WeakPolarHBondContact CG-O 3.48Å; K333-S417 WeakPolarHBondContact CE-O 3.39Å; K333-S417 PolarHBondContact NZ-O 2.91Å; K333-T419 HydrophobicContact CB-CG2 4.04Å; K333-T419 HydrophobicContact CD-CG2 4.2Å; K333-T419 HydrophobicContact CG-CG2 4.3Å; K333-V464 HydrophobicContact CB-CG1 4.09Å; K333-V464 HydrophobicContact CG-CG1 4.38Å; K333-R465 PolarHBondContact N-O 2.97Å
334	K	90.1	Very high	93	Very high	149 Å²	149	39.4 Å²	39.4	65%	0.648	20%	0.199	S	C	*	.	S	Bend	trans	-84	-37.3	178	-68.5	-177.1	179.1	178.3	0	112.9	Q332 H415 A466	Q332-K334 PolarHBondContact O-N 3.32Å; Q332-K334 VanDerWaalsContact O-N 3.08Å; K334-H415 PolarHBondContact O-CE1 2.87Å; K334-H415 VanDerWaalsContact O-CE1 3.31Å; K334-A466 VanDerWaalsContact CE-O 3.25Å; K334-A466 WeakPolarHBondContact CE-O 3.46Å
335	N	91.8	Very high	93.6	Very high	80 Å²	80	33 Å²	33	43%	0.428	17%	0.165	S	C	.	.	S	Bend	trans	-81	155.3	177.8	-64.6	-1.8	0	0	0	109.3	Q332 H415	Q332-N335 HydrophobicContact CB-CB 4.16Å; Q332-N335 PolarHBondContact NE2-ND2 2.94Å; Q332-N335 PolarHBondContact O-N 2.84Å; Q332-N335 VanDerWaalsContact O-N 3.14Å; N335-H415 PolarHBondContact O-CE1 2.95Å; N335-H415 PolarHBondContact O-ND1 3.03Å
336	H	94.1	Very high	94.2	Very high	89 Å²	89	34 Å²	34	41%	0.412	16%	0.164	S	C	.	.			trans	-93.5	148.5	174.8	64.4	-96.4	0	0	0	111.2	L414	H336-L414 CarbonylContact C-O 3.58Å; H336-L414 WeakPolarHBondContact CA-O 3.37Å
337	F	96.6	Very high	94.5	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	169.5	162.8	64.9	-95.6	0	0	0	111.3	K318 F320 V339 V382 R413 L414 F416 L439	K318-F337 CarbonylContact O-C 3.03Å; K318-F337 WeakPolarHBondContact O-CA 3.47Å; K318-F337 VanDerWaalsContact O-CB 3.24Å; K318-F337 WeakPolarHBondContact O-CB 3.48Å; F320-F337 HydrophobicContact CD2-CB 4.18Å; F320-F337 HydrophobicContact CE1-CG 4.49Å; F320-F337 HydrophobicContact CE2-CB 3.49Å; F320-F337 VanDerWaalsContact CE2-CB 3.49Å; F320-F337 AromaticContact CE2-CD2 3.87Å; F320-F337 HydrophobicContact CE2-CD2 3.87Å; F320-F337 AromaticContact CE2-CG 3.79Å; F320-F337 HydrophobicContact CE2-CG 3.79Å; F320-F337 HydrophobicContact CZ-CB 3.72Å; F320-F337 AromaticContact CZ-CD1 3.99Å; F320-F337 HydrophobicContact CZ-CD1 3.99Å; F320-F337 AromaticContact CZ-CD2 3.72Å; F320-F337 HydrophobicContact CZ-CD2 3.72Å; F320-F337 HydrophobicContact CZ-CE2 4.28Å; F320-F337 AromaticContact CZ-CG 3.56Å; F320-F337 HydrophobicContact CZ-CG 3.56Å; F337-V339 HydrophobicContact CD2-CG2 4.07Å; F337-V339 HydrophobicContact CE2-CG2 4.11Å; F337-V382 HydrophobicContact CZ-CG1 4.22Å; F337-V382 HydrophobicContact CZ-CG2 4.46Å; F337-R413 PolarHBondContact O-N 3.36Å; F337-L414 HydrophobicContact CD1-CB 4.28Å; F337-L414 VanDerWaalsContact CD1-O 3.31Å; F337-L414 WeakPolarHBondContact CD1-O 3.41Å; F337-L414 HydrophobicContact CD2-CB 3.72Å; F337-L414 HydrophobicContact CD2-CD1 4.15Å; F337-L414 HydrophobicContact CE1-CB 4.07Å; F337-L414 HydrophobicContact CE2-CB 3.47Å; F337-L414 VanDerWaalsContact CE2-CB 3.47Å; F337-L414 HydrophobicContact CE2-CD1 3.66Å; F337-L414 HydrophobicContact CE2-CG 4.23Å; F337-L414 HydrophobicContact CG-CB 4.12Å; F337-L414 HydrophobicContact CZ-CB 3.66Å; F337-L414 HydrophobicContact CZ-CD1 4.41Å; F337-L414 PolarHBondContact N-O 2.88Å; F337-L414 PolarHBondContact O-N 2.96Å; F337-F416 HydrophobicContact CD1-CD2 4.38Å; F337-F416 HydrophobicContact CD1-CE2 4.21Å; F337-F416 AromaticContact CE1-CD2 3.67Å; F337-F416 HydrophobicContact CE1-CD2 3.67Å; F337-F416 AromaticContact CE1-CE2 3.59Å; F337-F416 HydrophobicContact CE1-CE2 3.59Å; F337-F416 HydrophobicContact CE1-CG 4.32Å; F337-F416 HydrophobicContact CE1-CZ 4.18Å; F337-F416 HydrophobicContact CZ-CD2 4.44Å; F337-F416 HydrophobicContact CZ-CE2 4.11Å; F337-F416 HydrophobicContact CZ-CZ 4.24Å; F337-L439 HydrophobicContact CD2-CD2 4.31Å; F337-L439 HydrophobicContact CE2-CD2 3.61Å; F337-L439 HydrophobicContact CZ-CD1 4.43Å; F337-L439 HydrophobicContact CZ-CD2 4.11Å
338	Q	97.4	Very high	94.7	Very high	44 Å²	44	33 Å²	33	21%	0.206	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.4	176.3	-177	178	-65.5	0	0	109.1	A316 D317 K318 T410 V411	A316-Q338 CarbonylContact C-O 3.52Å; D317-Q338 HydrophobicContact CB-CB 4.4Å; D317-Q338 HydrophobicContact CB-CG 4.32Å; D317-Q338 PolarHBondContact N-O 2.04Å; D317-Q338 VanDerWaalsContact N-O 3.14Å; D317-Q338 WeakPolarHBondContact OD2-CG 3.37Å; D317-Q338 PolarHBondContact OD2-NE2 2.98Å; K318-Q338 HydrophobicContact CB-CB 4.22Å; K318-Q338 PolarHBondContact O-N 3.32Å; Q338-T410 HydrophobicContact CG-CG2 3.84Å; Q338-T410 VanDerWaalsContact NE2-CG2 3.35Å; Q338-V411 WeakPolarHBondContact CA-O 3.42Å
339	V	97.6	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.9	174.2	177.7	0	0	0	0	108.7	V314 D315 F337 V341 L368 V411 L414 L439 V441	V314-V339 HydrophobicContact CG1-CG1 3.64Å; D315-V339 CarbonylContact O-C 3.55Å; D315-V339 VanDerWaalsContact O-CA 3.31Å; D315-V339 WeakPolarHBondContact O-CA 3.36Å; D315-V339 WeakPolarHBondContact O-CG1 3.26Å; F337-V339 HydrophobicContact CD2-CG2 4.07Å; F337-V339 HydrophobicContact CE2-CG2 4.11Å; V339-V341 HydrophobicContact CG1-CG2 4.06Å; V339-L368 HydrophobicContact CB-CD2 3.95Å; V339-L368 HydrophobicContact CG1-CD2 4.14Å; V339-L368 HydrophobicContact CG2-CD2 3.91Å; V339-V411 PolarHBondContact N-O 3.49Å; V339-V411 PolarHBondContact O-N 2.87Å; V339-L414 HydrophobicContact CG2-CD1 4.47Å; V339-L439 HydrophobicContact CG2-CD2 3.87Å; V339-V441 HydrophobicContact CG1-CG1 4.37Å; V339-V441 HydrophobicContact CG1-CG2 4.21Å
340	T	97.8	Very high	94.8	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.5	168.2	-73.4	0	0	0	0	109.3	D315 D317 Y342 K408 V409 T410	D315-T340 PolarHBondContact N-O 3.48Å; D315-T340 PolarHBondContact O-N 2.73Å; D317-T340 PolarHBondContact OD1-OG1 2.9Å; D317-T340 WeakPolarHBondContact OD2-CB 3.47Å; D317-T340 PolarHBondContact OD2-OG1 3.35Å; T340-Y342 HydrophobicContact CG2-CD2 4.13Å; T340-Y342 HydrophobicContact CG2-CE1 4.49Å; T340-Y342 HydrophobicContact CG2-CE2 3.45Å; T340-Y342 VanDerWaalsContact CG2-CE2 3.45Å; T340-K408 HydrophobicContact CG2-CD 4.37Å; T340-K408 HydrophobicContact CG2-CG 3.98Å; T340-V409 WeakPolarHBondContact CA-O 3.46Å; T340-T410 WeakPolarHBondContact OG1-CB 3.13Å; T340-T410 WeakPolarHBondContact OG1-CG2 3.46Å; T340-T410 PolarHBondContact OG1-OG1 3.32Å
341	V	98.1	Very high	94.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.1	177.4	-171.7	0	0	0	0	109.3	Y312 R313 V314 V339 I343 L366 K408 V409 V441	Y312-V341 HydrophobicContact CD2-CG1 4.19Å; Y312-V341 HydrophobicContact CE2-CG1 3.57Å; R313-V341 CarbonylContact O-C 3.59Å; R313-V341 WeakPolarHBondContact O-CA 3.44Å; V314-V341 HydrophobicContact CG1-CG2 4.36Å; V314-V341 HydrophobicContact CG2-CG1 4.27Å; V314-V341 HydrophobicContact CG2-CG2 4.31Å; V339-V341 HydrophobicContact CG1-CG2 4.06Å; V341-I343 HydrophobicContact CG1-CD1 4.14Å; V341-I343 HydrophobicContact CG1-CG1 3.73Å; V341-L366 HydrophobicContact CB-CD2 4.25Å; V341-L366 HydrophobicContact CG1-CD1 4.34Å; V341-L366 HydrophobicContact CG2-CD1 4.14Å; V341-L366 HydrophobicContact CG2-CD2 3.84Å; V341-K408 WeakPolarHBondContact O-CA 3.46Å; V341-V409 PolarHBondContact N-O 3.23Å; V341-V409 PolarHBondContact O-N 3.14Å; V341-V441 HydrophobicContact CG2-CG1 3.63Å
342	Y	97.9	Very high	94.9	Very high	60 Å²	60	41 Å²	41	24%	0.235	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.9	172.9	-56.8	-99.8	0	0	0	107.9	R313 D315 T340 V406 T407 K408	R313-Y342 PolarHBondContact N-O 3.32Å; R313-Y342 PolarHBondContact O-N 3.23Å; D315-Y342 VanDerWaalsContact OD2-CE2 3.3Å; D315-Y342 WeakPolarHBondContact OD2-CE2 3.26Å; T340-Y342 HydrophobicContact CG2-CD2 4.13Å; T340-Y342 HydrophobicContact CG2-CE1 4.49Å; T340-Y342 HydrophobicContact CG2-CE2 3.45Å; T340-Y342 VanDerWaalsContact CG2-CE2 3.45Å; Y342-V406 HydrophobicContact CD1-CG1 4.49Å; Y342-T407 WeakPolarHBondContact CA-O 3.32Å; Y342-K408 HydrophobicContact CD1-CB 4.24Å; Y342-K408 HydrophobicContact CD1-CD 4.42Å; Y342-K408 HydrophobicContact CD1-CG 4.2Å; Y342-K408 HydrophobicContact CE1-CB 4.32Å; Y342-K408 HydrophobicContact CE1-CD 3.67Å; Y342-K408 HydrophobicContact CE1-CG 3.89Å; Y342-K408 PolarHBondContact OH-NZ 2.7Å
343	I	97.9	Very high	94.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	100.6	-174.7	-49.4	177	0	0	0	108	T311 Y312 V341 L401 V406 T407 L443	T311-I343 WeakPolarHBondContact O-CA 3.35Å; Y312-I343 HydrophobicContact CD2-CG1 4.03Å; Y312-I343 HydrophobicContact CE2-CD1 4.19Å; Y312-I343 HydrophobicContact CE2-CG1 4Å; V341-I343 HydrophobicContact CG1-CD1 4.14Å; V341-I343 HydrophobicContact CG1-CG1 3.73Å; I343-L401 HydrophobicContact CB-CD2 3.98Å; I343-L401 HydrophobicContact CD1-CD2 4.1Å; I343-L401 HydrophobicContact CG2-CD1 3.95Å; I343-L401 HydrophobicContact CG2-CD2 3.79Å; I343-V406 CarbonylContact O-C 3.57Å; I343-V406 WeakPolarHBondContact O-CA 3.5Å; I343-T407 PolarHBondContact N-O 3.16Å; I343-T407 PolarHBondContact O-N 3.27Å; I343-L443 HydrophobicContact CD1-CD1 4.21Å; I343-L443 HydrophobicContact CD1-CD2 4.39Å; I343-L443 HydrophobicContact CG2-CD2 3.86Å
344	G	96.5	Very high	94.7	Very high	4 Å²	4	42.4 Å²	42.4	4%	0.041	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	112.6	174	0	0	0	0	0	110.7	P310 T311 Q405	P310-G344 CarbonylContact C-O 3.48Å; P310-G344 WeakPolarHBondContact CA-O 3.36Å; P310-G344 WeakPolarHBondContact CB-O 3.42Å; T311-G344 PolarHBondContact N-O 3.27Å; T311-G344 PolarHBondContact O-N 2.69Å; T311-G344 VanDerWaalsContact OG1-CA 3.31Å; T311-G344 WeakPolarHBondContact OG1-CA 3.02Å; T311-G344 PolarHBondContact OG1-N 2.78Å; G344-Q405 WeakPolarHBondContact CA-O 3.05Å
345	M	94.4	Very high	94.5	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	130	176.4	-168.2	59	65.5	0	0	110.2	L299 P310 P349 F364 L401 E404 Q405	L299-M345 HydrophobicContact CD1-CE 3.73Å; L299-M345 HydrophobicContact CD1-SD 3.82Å; P310-M345 HydrophobicContact CB-CE 4.02Å; P310-M345 HydrophobicContact CB-SD 4.13Å; P310-M345 HydrophobicContact CG-CE 4.18Å; M345-P349 HydrophobicContact CE-CG 4.2Å; M345-P349 HydrophobicContact CG-CG 4.04Å; M345-P349 HydrophobicContact SD-CB 4.5Å; M345-P349 HydrophobicContact SD-CG 3.87Å; M345-F364 HydrophobicContact CE-CZ 4.38Å; M345-L401 HydrophobicContact CE-CB 4.22Å; M345-L401 HydrophobicContact CE-CD1 3.59Å; M345-E404 VanDerWaalsContact O-CA 3.29Å; M345-E404 WeakPolarHBondContact O-CA 3.46Å; M345-E404 PolarHBondContact O-N 3.27Å; M345-Q405 PolarHBondContact N-O 3.35Å; M345-Q405 PolarHBondContact O-N 2.85Å
346	L	92.3	Very high	94.1	Very high	68 Å²	68	47 Å²	47	36%	0.356	23%	0.229	S	C	.	.			trans	-111.5	126.8	175.7	-61.7	175.9	0	0	0	108.1	P308 E404	P308-L346 HydrophobicContact CB-CB 4.25Å; P308-L346 HydrophobicContact CB-CD1 3.97Å; P308-L346 HydrophobicContact CG-CB 4.25Å; P308-L346 HydrophobicContact CG-CD1 4.43Å; L346-E404 WeakPolarHBondContact CD2-OE2 3.4Å
347	G	92.4	Very high	93.9	Very high	18 Å²	18	44.4 Å²	44.4	19%	0.186	23%	0.226	C	C	.	.	S	Bend	trans	69.9	-177.3	-164.6	0	0	0	0	0	114.3	P349 P403 E404	G347-P349 WeakPolarHBondContact O-CD 3.44Å; G347-P403 WeakPolarHBondContact O-CA 3.42Å; G347-P403 VanDerWaalsContact O-CB 3.25Å; G347-P403 WeakPolarHBondContact O-CB 3.43Å; G347-E404 WeakPolarHBondContact CA-OE1 3.32Å; G347-E404 PolarHBondContact N-OE1 3Å
348	D	94.3	Very high	93.6	Very high	66 Å²	66	48 Å²	48	35%	0.353	25%	0.245	S	C	.	.			trans	-110.8	98.2	-178.3	-176.9	9.1	0	0	0	110.4	K350 P403	D348-K350 VanDerWaalsContact CG-CE 3.5Å; D348-K350 PolarHBondContact O-N 3.16Å; D348-K350 WeakPolarHBondContact OD1-CE 3.44Å; D348-K350 IonicContact OD1-NZ 2.67Å; D348-K350 PolarHBondContact OD1-NZ 2.82Å; D348-K350 WeakPolarHBondContact OD2-CE 3.37Å; D348-K350 IonicContact OD2-NZ 2.68Å; D348-K350 PolarHBondContact OD2-NZ 3.12Å; D348-P403 HydrophobicContact CB-CB 3.99Å; D348-P403 HydrophobicContact CB-CG 4.34Å
349	P	95	Very high	93.5	Very high	12 Å²	12	47.1 Å²	47.1	8%	0.078	24%	0.241	C	C	.	.			trans	-73.5	119.6	-173.2	29.9	-35.9	0	0	0	111.8	L299 L307 M345 G347 I361 F364	L299-P349 HydrophobicContact CB-CB 4.08Å; L299-P349 HydrophobicContact CD1-CB 3.98Å; L299-P349 HydrophobicContact CD1-CG 4.45Å; L299-P349 HydrophobicContact CG-CB 4.49Å; L307-P349 HydrophobicContact CD1-CB 3.85Å; M345-P349 HydrophobicContact CE-CG 4.2Å; M345-P349 HydrophobicContact CG-CG 4.04Å; M345-P349 HydrophobicContact SD-CB 4.5Å; M345-P349 HydrophobicContact SD-CG 3.87Å; G347-P349 WeakPolarHBondContact O-CD 3.44Å; P349-I361 HydrophobicContact CB-CD1 4.2Å; P349-F364 HydrophobicContact CB-CZ 4.11Å; P349-F364 HydrophobicContact CG-CE2 4.04Å; P349-F364 HydrophobicContact CG-CZ 3.76Å
350	K	94.9	Very high	93.4	Very high	84 Å²	84	50 Å²	50	37%	0.365	26%	0.26	S	S	.	.			trans	-110.6	-33	176	-60.7	-49	-176.4	-151.8	0	113.5	Y300 A302 D348 P360 I361	Y300-K350 PolarHBondContact O-N 2.81Å; A302-K350 HydrophobicContact CB-CG 3.9Å; D348-K350 VanDerWaalsContact CG-CE 3.5Å; D348-K350 PolarHBondContact O-N 3.16Å; D348-K350 WeakPolarHBondContact OD1-CE 3.44Å; D348-K350 IonicContact OD1-NZ 2.67Å; D348-K350 PolarHBondContact OD1-NZ 2.82Å; D348-K350 WeakPolarHBondContact OD2-CE 3.37Å; D348-K350 IonicContact OD2-NZ 2.68Å; D348-K350 PolarHBondContact OD2-NZ 3.12Å; K350-P360 WeakPolarHBondContact O-CA 3.36Å; K350-I361 PolarHBondContact O-N 2.75Å
351	Y	94.9	Very high	93.3	Very high	90 Å²	90	51.2 Å²	51.2	35%	0.353	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.3	-175.3	-53.7	-79.4	0	0	0	112	Y300 D301 Q359 P360 I361	Y300-Y351 PolarHBondContact N-O 2.74Å; Y300-Y351 PolarHBondContact O-N 3.35Å; D301-Y351 WeakPolarHBondContact O-CD2 3.04Å; Y351-Q359 CarbonylContact C-O 3.56Å; Y351-Q359 WeakPolarHBondContact CA-O 3.42Å; Y351-P360 HydrophobicContact CD1-CB 4.3Å; Y351-P360 HydrophobicContact CE1-CB 4.33Å; Y351-I361 WeakPolarHBondContact O-CD1 3.4Å
352	I	94.4	Very high	93.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.6	173.5	-172.6	153.6	0	0	0	110.2	T297 L299 T354 Q359 I361 A445 Y452 V454	T297-I352 HydrophobicContact CG2-CD1 3.87Å; T297-I352 HydrophobicContact CG2-CG1 3.48Å; T297-I352 VanDerWaalsContact CG2-CG1 3.48Å; L299-I352 HydrophobicContact CD2-CD1 4.2Å; I352-T354 HydrophobicContact CG2-CG2 4.35Å; I352-T354 PolarHBondContact O-N 3.19Å; I352-Q359 HydrophobicContact CG2-CB 4.43Å; I352-Q359 PolarHBondContact N-O 2.88Å; I352-Q359 PolarHBondContact O-N 3.19Å; I352-I361 HydrophobicContact CB-CD1 4.19Å; I352-I361 HydrophobicContact CB-CG1 3.91Å; I352-I361 HydrophobicContact CG2-CG1 4.05Å; I352-A445 HydrophobicContact CD1-CB 3.63Å; I352-Y452 HydrophobicContact CD1-CD2 4.28Å; I352-Y452 HydrophobicContact CD1-CG 4.24Å; I352-Y452 HydrophobicContact CG2-CD2 4.29Å; I352-V454 HydrophobicContact CD1-CG2 4.4Å
353	K	91.2	Very high	92.9	Very high	103 Å²	103	54.5 Å²	54.5	45%	0.448	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	96.8	-174.3	-169.8	-175.6	-162.7	161.6	0	111.7	T297 P298 Y300 L358	T297-K353 WeakPolarHBondContact CG2-O 3.37Å; P298-K353 HydrophobicContact CG-CB 4.04Å; P298-K353 HydrophobicContact CG-CD 3.98Å; P298-K353 PolarHBondContact O-N 3.23Å; Y300-K353 HydrophobicContact CD2-CB 4.05Å; Y300-K353 HydrophobicContact CE2-CB 3.8Å; Y300-K353 HydrophobicContact CE2-CD 3.78Å; Y300-K353 HydrophobicContact CE2-CG 4.29Å; Y300-K353 PolarHBondContact OH-NZ 3.14Å; K353-L358 HydrophobicContact CB-CD2 4.05Å; K353-L358 HydrophobicContact CG-CD2 4.35Å
354	T	88.8	Confident	92.9	Very high	16 Å²	16	55.2 Å²	55.2	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	172.7	175.5	74.3	0	0	0	0	111.4	I352 E356 G357 Q359 Y452	I352-T354 HydrophobicContact CG2-CG2 4.35Å; I352-T354 PolarHBondContact O-N 3.19Å; T354-E356 PolarHBondContact O-N 3.17Å; T354-E356 PolarHBondContact OG1-N 2.89Å; T354-E356 VanDerWaalsContact OG1-N 3.12Å; T354-G357 PolarHBondContact N-O 2.89Å; T354-G357 PolarHBondContact O-N 3.02Å; T354-G357 VanDerWaalsContact O-N 3.12Å; T354-G357 PolarHBondContact OG1-N 2.87Å; T354-G357 PolarHBondContact OG1-O 3.04Å; T354-Q359 HydrophobicContact CG2-CB 4.36Å; T354-Q359 HydrophobicContact CG2-CG 3.91Å; T354-Y452 HydrophobicContact CG2-CD2 4.31Å; T354-Y452 HydrophobicContact CG2-CE1 4.01Å; T354-Y452 HydrophobicContact CG2-CE2 3.7Å
355	N	85.4	Confident	92.9	Very high	179 Å²	179	58.6 Å²	58.6	96%	0.957	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-19	170.4	-65.1	-7.9	0	0	0	112.9
356	E	84.9	Confident	93	Very high	147 Å²	147	58.5 Å²	58.5	69%	0.687	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.4	178.8	-62.5	166.7	-170	0	0	111.9	T354 Q359	T354-E356 PolarHBondContact O-N 3.17Å; T354-E356 PolarHBondContact OG1-N 2.89Å; T354-E356 VanDerWaalsContact OG1-N 3.12Å; E356-Q359 PolarHBondContact OE2-NE2 3.05Å
357	G	88.3	Confident	93.2	Very high	34 Å²	34	59.4 Å²	59.4	35%	0.351	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	112.1	-164.2	-176.8	0	0	0	0	0	113.4	T354 Q359	T354-G357 PolarHBondContact N-O 2.89Å; T354-G357 PolarHBondContact O-N 3.02Å; T354-G357 VanDerWaalsContact O-N 3.12Å; T354-G357 PolarHBondContact OG1-N 2.87Å; T354-G357 PolarHBondContact OG1-O 3.04Å; G357-Q359 PolarHBondContact O-N 2.98Å
358	L	91.9	Very high	93.4	Very high	81 Å²	81	58.9 Å²	58.9	42%	0.424	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.5	174.4	-66.9	178.9	0	0	0	109.8	Y300 K353	Y300-L358 HydrophobicContact CD1-CD1 4.08Å; Y300-L358 HydrophobicContact CD1-CD2 3.66Å; Y300-L358 HydrophobicContact CD2-CD2 3.87Å; Y300-L358 HydrophobicContact CE1-CD2 4.15Å; Y300-L358 HydrophobicContact CE2-CD2 4.4Å; Y300-L358 HydrophobicContact CG-CD2 3.53Å; K353-L358 HydrophobicContact CB-CD2 4.05Å; K353-L358 HydrophobicContact CG-CD2 4.35Å
359	Q	94.2	Very high	93.5	Very high	24 Å²	24	57.7 Å²	57.7	11%	0.112	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.5	174.1	-59.1	-177	-8.6	0	0	110.3	Y351 I352 T354 E356 G357 S447	Y351-Q359 CarbonylContact C-O 3.56Å; Y351-Q359 WeakPolarHBondContact CA-O 3.42Å; I352-Q359 HydrophobicContact CG2-CB 4.43Å; I352-Q359 PolarHBondContact N-O 2.88Å; I352-Q359 PolarHBondContact O-N 3.19Å; T354-Q359 HydrophobicContact CG2-CB 4.36Å; T354-Q359 HydrophobicContact CG2-CG 3.91Å; E356-Q359 PolarHBondContact OE2-NE2 3.05Å; G357-Q359 PolarHBondContact O-N 2.98Å; Q359-S447 WeakPolarHBondContact CB-OG 3.39Å; Q359-S447 PolarHBondContact OE1-OG 3.47Å
360	P	95	Very high	93.6	Very high	60 Å²	60	57.1 Å²	57.1	39%	0.39	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	145.7	175.9	27	-36.1	0	0	0	112.1	K350 Y351 S447	K350-P360 WeakPolarHBondContact O-CA 3.36Å; Y351-P360 HydrophobicContact CD1-CB 4.3Å; Y351-P360 HydrophobicContact CE1-CB 4.33Å; P360-S447 VanDerWaalsContact O-CB 3.25Å; P360-S447 WeakPolarHBondContact O-CB 3.47Å; P360-S447 PolarHBondContact O-OG 3.33Å
361	I	95.4	Very high	93.7	Very high	28 Å²	28	53.4 Å²	53.4	14%	0.144	27%	0.271	C	S	.	.			trans	-91.9	120.3	174.7	-60.9	166.2	0	0	0	109	L299 P349 K350 Y351 I352 F364 A445	L299-I361 HydrophobicContact CD2-CD1 3.76Å; P349-I361 HydrophobicContact CB-CD1 4.2Å; K350-I361 PolarHBondContact O-N 2.75Å; Y351-I361 WeakPolarHBondContact O-CD1 3.4Å; I352-I361 HydrophobicContact CB-CD1 4.19Å; I352-I361 HydrophobicContact CB-CG1 3.91Å; I352-I361 HydrophobicContact CG2-CG1 4.05Å; I361-F364 HydrophobicContact CD1-CZ 4.03Å; I361-F364 HydrophobicContact CG2-CD2 4.47Å; I361-F364 HydrophobicContact CG2-CE1 4.47Å; I361-F364 HydrophobicContact CG2-CE2 4.07Å; I361-F364 HydrophobicContact CG2-CZ 4.07Å; I361-A445 HydrophobicContact CG2-CB 4.18Å
362	D	94.6	Very high	93.8	Very high	99 Å²	99	50.8 Å²	50.8	53%	0.529	26%	0.262	S	S	.	.			trans	-76.9	-43.9	175.3	-59	-58.6	0	0	0	111.3	Q446 S447 H448	D362-Q446 PolarHBondContact N-O 2.79Å; D362-S447 WeakPolarHBondContact OD2-CA 3.46Å; D362-H448 PolarHBondContact OD2-N 3.15Å
363	C	94.6	Very high	93.9	Very high	30 Å²	30	53.2 Å²	53.2	20%	0.203	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	169.7	-176.9	52.3	0	0	0	0	112.8	Y365 L398 Q446	C363-Y365 WeakPolarHBondContact SG-CE2 3.47Å; C363-L398 HydrophobicContact CB-CD1 3.59Å; C363-Q446 PolarHBondContact O-N 2.79Å
364	F	96.7	Very high	94	Very high	16 Å²	16	52.2 Å²	52.2	7%	0.07	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	145.1	173.8	-64.4	-87.7	0	0	0	112	L299 M345 P349 I361 V399 L401 L443 H444 A445 V454	L299-F364 HydrophobicContact CD1-CE1 4.09Å; L299-F364 HydrophobicContact CD1-CZ 4.21Å; L299-F364 HydrophobicContact CD2-CE1 4.14Å; L299-F364 HydrophobicContact CD2-CZ 4.45Å; M345-F364 HydrophobicContact CE-CZ 4.38Å; P349-F364 HydrophobicContact CB-CZ 4.11Å; P349-F364 HydrophobicContact CG-CE2 4.04Å; P349-F364 HydrophobicContact CG-CZ 3.76Å; I361-F364 HydrophobicContact CD1-CZ 4.03Å; I361-F364 HydrophobicContact CG2-CD2 4.47Å; I361-F364 HydrophobicContact CG2-CE1 4.47Å; I361-F364 HydrophobicContact CG2-CE2 4.07Å; I361-F364 HydrophobicContact CG2-CZ 4.07Å; F364-V399 HydrophobicContact CB-CG2 3.75Å; F364-V399 PolarHBondContact O-N 2.88Å; F364-L401 HydrophobicContact CB-CD1 4.09Å; F364-L401 HydrophobicContact CB-CG 4.49Å; F364-L401 HydrophobicContact CD1-CD1 3.95Å; F364-L401 HydrophobicContact CD2-CB 4.41Å; F364-L401 HydrophobicContact CD2-CD1 3.94Å; F364-L401 HydrophobicContact CD2-CG 4.25Å; F364-L401 HydrophobicContact CE1-CD1 4.33Å; F364-L401 HydrophobicContact CE2-CD1 4.33Å; F364-L401 HydrophobicContact CG-CD1 3.74Å; F364-L401 HydrophobicContact CG-CG 4.37Å; F364-L443 HydrophobicContact CB-CD1 4.04Å; F364-L443 HydrophobicContact CD1-CD1 4.21Å; F364-H444 CarbonylContact C-O 3.57Å; F364-H444 VanDerWaalsContact CA-O 3.3Å; F364-H444 WeakPolarHBondContact CA-O 3.41Å; F364-A445 HydrophobicContact CD1-CB 3.83Å; F364-A445 HydrophobicContact CE1-CB 3.76Å; F364-V454 HydrophobicContact CE1-CG2 4.34Å
365	Y	96.6	Very high	94.2	Very high	74 Å²	74	52.4 Å²	52.4	29%	0.29	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.3	178.7	-71.3	-75.4	0	0	0	112.2	C363 P396 V397 L398 H444 Q446	C363-Y365 WeakPolarHBondContact SG-CE2 3.47Å; Y365-P396 HydrophobicContact CD1-CB 4.03Å; Y365-P396 HydrophobicContact CG-CB 4.23Å; Y365-V397 CarbonylContact C-O 3.58Å; Y365-V397 WeakPolarHBondContact CA-O 3.38Å; Y365-L398 HydrophobicContact CD1-CB 4.37Å; Y365-L398 HydrophobicContact CD1-CD1 4.43Å; Y365-L398 HydrophobicContact CE1-CB 4.07Å; Y365-L398 HydrophobicContact CE1-CD1 3.87Å; Y365-H444 PolarHBondContact N-O 2.77Å; Y365-H444 PolarHBondContact O-N 3.08Å; Y365-Q446 HydrophobicContact CD2-CB 4.19Å; Y365-Q446 HydrophobicContact CE2-CB 3.97Å; Y365-Q446 HydrophobicContact CE2-CG 4.36Å
366	L	97.1	Very high	94.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	115	167.6	-172.2	68.4	0	0	0	110.1	Y312 V341 L368 P396 V397 V399 V409 V411 V441	Y312-L366 WeakPolarHBondContact OH-CD1 3.47Å; V341-L366 HydrophobicContact CB-CD2 4.25Å; V341-L366 HydrophobicContact CG1-CD1 4.34Å; V341-L366 HydrophobicContact CG2-CD1 4.14Å; V341-L366 HydrophobicContact CG2-CD2 3.84Å; L366-L368 HydrophobicContact CD2-CD1 4.19Å; L366-L368 HydrophobicContact CG-CD1 3.97Å; L366-P396 WeakPolarHBondContact O-CA 3.46Å; L366-V397 PolarHBondContact N-O 2.91Å; L366-V397 PolarHBondContact O-N 2.81Å; L366-V399 HydrophobicContact CB-CG1 4.01Å; L366-V409 HydrophobicContact CD2-CB 4.19Å; L366-V409 HydrophobicContact CD2-CG1 3.77Å; L366-V411 HydrophobicContact CD2-CG2 4.06Å; L366-V441 HydrophobicContact CD1-CG1 4.09Å
367	K	96.1	Very high	94.7	Very high	86 Å²	86	49.4 Å²	49.4	37%	0.374	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.1	-177.3	-177	179.5	177.4	-177.1	0	110.6	P396 A442	K367-P396 HydrophobicContact CB-CB 4.38Å; K367-P396 HydrophobicContact CB-CG 4.42Å; K367-P396 HydrophobicContact CG-CG 4.31Å; K367-A442 PolarHBondContact N-O 2.93Å; K367-A442 PolarHBondContact O-N 3.47Å
368	L	97.1	Very high	95	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.5	176.2	-68.7	89.5	0	0	0	109.7	V339 L366 F394 V411 L414 V440 V441	V339-L368 HydrophobicContact CB-CD2 3.95Å; V339-L368 HydrophobicContact CG1-CD2 4.14Å; V339-L368 HydrophobicContact CG2-CD2 3.91Å; L366-L368 HydrophobicContact CD2-CD1 4.19Å; L366-L368 HydrophobicContact CG-CD1 3.97Å; L368-F394 HydrophobicContact CB-CD1 4.16Å; L368-F394 HydrophobicContact CB-CE1 3.87Å; L368-F394 HydrophobicContact CD1-CE1 3.61Å; L368-F394 HydrophobicContact CD1-CZ 3.65Å; L368-F394 HydrophobicContact CG-CE1 4.35Å; L368-V411 HydrophobicContact CD1-CG2 4.47Å; L368-L414 HydrophobicContact CD2-CD1 3.83Å; L368-V440 WeakPolarHBondContact CA-O 3.44Å; L368-V441 HydrophobicContact CD2-CG1 4.34Å; L368-V441 HydrophobicContact CD2-CG2 3.88Å; L368-V441 HydrophobicContact CG-CB 4.47Å; L368-V441 HydrophobicContact CG-CG1 4.12Å; L368-V441 HydrophobicContact CG-CG2 4.06Å
369	H	96.6	Very high	95.1	Very high	42 Å²	42	52.4 Å²	52.4	19%	0.194	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	150.5	175.1	62.2	-63.2	0	0	0	110.2	V440	H369-V440 PolarHBondContact N-O 3.41Å; H369-V440 PolarHBondContact O-N 2.99Å
370	G	97.1	Very high	95.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	162.6	167.7	0	0	0	0	0	111.3	S379 I380 M438	G370-S379 CarbonylContact O-C 3.49Å; G370-S379 VanDerWaalsContact O-CA 3.24Å; G370-S379 WeakPolarHBondContact O-CA 3.49Å; G370-I380 PolarHBondContact N-O 3.39Å; G370-I380 PolarHBondContact O-N 2.83Å; G370-M438 CarbonylContact C-O 3.53Å; G370-M438 VanDerWaalsContact CA-O 3.24Å; G370-M438 WeakPolarHBondContact CA-O 3.21Å
371	V	97.1	Very high	95.2	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.4	164.5	-64.9	0	0	0	0	109.6	Q378 F437 M438 V440	V371-Q378 WeakPolarHBondContact CA-O 3.31Å; V371-F437 CarbonylContact O-C 3.56Å; V371-F437 VanDerWaalsContact O-CA 3.23Å; V371-F437 WeakPolarHBondContact O-CA 3.29Å; V371-M438 HydrophobicContact CG2-CB 4.12Å; V371-M438 HydrophobicContact CG2-CE 3.88Å; V371-M438 PolarHBondContact N-O 3.27Å; V371-M438 PolarHBondContact O-N 3.25Å; V371-V440 HydrophobicContact CG1-CG2 3.99Å; V371-V440 HydrophobicContact CG2-CG2 3.94Å
372	K	97.4	Very high	95.3	Very high	34 Å²	34	50.4 Å²	50.4	15%	0.148	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	132.4	175.8	-61.3	-177.8	-173.3	170.7	0	110	E374 A375 M376 Q378 I380 E418 F437	K372-E374 VanDerWaalsContact C-N 3.34Å; K372-E374 PolarHBondContact O-N 2.79Å; K372-A375 HydrophobicContact CB-CB 4.29Å; K372-A375 CarbonylContact O-C 3.56Å; K372-A375 PolarHBondContact O-N 2.92Å; K372-A375 VanDerWaalsContact O-N 3.15Å; K372-M376 VanDerWaalsContact O-CA 3.31Å; K372-M376 WeakPolarHBondContact O-CA 3.42Å; K372-M376 PolarHBondContact O-N 2.97Å; K372-M376 VanDerWaalsContact O-N 3.09Å; K372-Q378 HydrophobicContact CD-CB 4.02Å; K372-Q378 HydrophobicContact CG-CB 4.3Å; K372-Q378 PolarHBondContact N-O 2.86Å; K372-Q378 VanDerWaalsContact N-O 3.15Å; K372-I380 HydrophobicContact CD-CD1 4.17Å; K372-I380 HydrophobicContact CG-CD1 3.75Å; K372-I380 HydrophobicContact CG-CG1 4.27Å; K372-E418 WeakPolarHBondContact CE-OE2 3.34Å; K372-E418 IonicContact NZ-OE2 3.22Å; K372-E418 PolarHBondContact NZ-OE2 3.09Å; K372-F437 HydrophobicContact CG-CD1 4.09Å; K372-F437 HydrophobicContact CG-CE1 3.97Å
373	V	96.1	Very high	95.4	Very high	51 Å²	51	47.7 Å²	47.7	31%	0.309	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-39.1	-179.6	171.1	0	0	0	0	111.2	A375 Y436 M438	V373-A375 PolarHBondContact O-N 3.42Å; V373-Y436 WeakPolarHBondContact CG2-O 3.24Å; V373-Y436 PolarHBondContact N-O 3.48Å; V373-M438 HydrophobicContact CG2-CE 4.14Å; V373-M438 HydrophobicContact CG2-CG 3.66Å; V373-M438 HydrophobicContact CG2-SD 4.04Å
374	E	93.4	Very high	95.5	Very high	83 Å²	83	48.5 Å²	48.5	39%	0.388	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-12	175.4	70.5	-80.8	-173.5	0	0	114.5	K372	K372-E374 VanDerWaalsContact C-N 3.34Å; K372-E374 PolarHBondContact O-N 2.79Å
375	A	93.4	Very high	95.5	Very high	20 Å²	20	48.4 Å²	48.4	17%	0.165	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	73.9	-175.9	0	0	0	0	0	110.2	K372 V373 N377 Q378	K372-A375 HydrophobicContact CB-CB 4.29Å; K372-A375 CarbonylContact O-C 3.56Å; K372-A375 PolarHBondContact O-N 2.92Å; K372-A375 VanDerWaalsContact O-N 3.15Å; V373-A375 PolarHBondContact O-N 3.42Å; A375-N377 PolarHBondContact O-N 2.75Å; A375-Q378 HydrophobicContact CB-CB 4.36Å; A375-Q378 HydrophobicContact CB-CG 4.03Å; A375-Q378 WeakPolarHBondContact O-CB 3.18Å; A375-Q378 PolarHBondContact O-N 3.41Å
376	M	90.3	Very high	95.3	Very high	116 Å²	116	47.4 Å²	47.4	57%	0.571	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	-12.5	-172.2	-61.3	-175.3	-173.5	0	0	114.6	K372 M438	K372-M376 VanDerWaalsContact O-CA 3.31Å; K372-M376 WeakPolarHBondContact O-CA 3.42Å; K372-M376 PolarHBondContact O-N 2.97Å; K372-M376 VanDerWaalsContact O-N 3.09Å; M376-M438 HydrophobicContact CE-CE 4.08Å; M376-M438 HydrophobicContact CG-CE 4.46Å; M376-M438 HydrophobicContact SD-CE 4.35Å
377	N	90.5	Very high	95	Very high	147 Å²	147	53.2 Å²	53.2	79%	0.786	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	-11	170.9	62.9	-19.3	0	0	0	113.9	A375	A375-N377 PolarHBondContact O-N 2.75Å
378	Q	94.2	Very high	94.8	Very high	96 Å²	96	54 Å²	54	45%	0.449	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	108.8	174.5	-64	-171.6	22.2	0	0	110.6	V371 K372 A375	V371-Q378 WeakPolarHBondContact CA-O 3.31Å; K372-Q378 HydrophobicContact CD-CB 4.02Å; K372-Q378 HydrophobicContact CG-CB 4.3Å; K372-Q378 PolarHBondContact N-O 2.86Å; K372-Q378 VanDerWaalsContact N-O 3.15Å; A375-Q378 HydrophobicContact CB-CB 4.36Å; A375-Q378 HydrophobicContact CB-CG 4.03Å; A375-Q378 WeakPolarHBondContact O-CB 3.18Å; A375-Q378 PolarHBondContact O-N 3.41Å
379	S	93.9	Very high	94.4	Very high	81 Å²	81	64.5 Å²	64.5	57%	0.566	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	131.2	174.5	59.6	0	0	0	0	112.4	G370	G370-S379 CarbonylContact O-C 3.49Å; G370-S379 VanDerWaalsContact O-CA 3.24Å; G370-S379 WeakPolarHBondContact O-CA 3.49Å
380	I	96.4	Very high	94.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.4	165.6	-49.8	-61.6	0	0	0	108.6	G370 K372 F416 E418 F437	G370-I380 PolarHBondContact N-O 3.39Å; G370-I380 PolarHBondContact O-N 2.83Å; K372-I380 HydrophobicContact CD-CD1 4.17Å; K372-I380 HydrophobicContact CG-CD1 3.75Å; K372-I380 HydrophobicContact CG-CG1 4.27Å; I380-F416 HydrophobicContact CG2-CB 4.36Å; I380-F416 HydrophobicContact CG2-CD1 4.11Å; I380-E418 HydrophobicContact CD1-CB 4.19Å; I380-E418 HydrophobicContact CD1-CG 4.33Å; I380-E418 HydrophobicContact CG2-CB 4.08Å; I380-F437 HydrophobicContact CD1-CD1 4.18Å; I380-F437 HydrophobicContact CD1-CE1 3.67Å; I380-F437 HydrophobicContact CD1-CE2 4.12Å; I380-F437 HydrophobicContact CD1-CZ 3.64Å; I380-F437 HydrophobicContact CG1-CD1 3.9Å; I380-F437 HydrophobicContact CG1-CD2 3.94Å; I380-F437 HydrophobicContact CG1-CE1 3.89Å; I380-F437 HydrophobicContact CG1-CE2 3.93Å; I380-F437 HydrophobicContact CG1-CG 3.95Å; I380-F437 HydrophobicContact CG1-CZ 3.9Å; I380-F437 HydrophobicContact CG2-CD2 4.4Å; I380-F437 HydrophobicContact CG2-CE2 4.1Å
381	S	95.1	Very high	94.1	Very high	66 Å²	66	68.1 Å²	68.1	46%	0.462	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-70.9	144.6	172.9	49.5	0	0	0	0	111.8	S417	S381-S417 PolarHBondContact N-OG 3.27Å; S381-S417 VanDerWaalsContact O-CB 3.27Å; S381-S417 WeakPolarHBondContact O-CB 3.16Å; S381-S417 PolarHBondContact O-N 2.91Å; S381-S417 PolarHBondContact O-OG 2.89Å; S381-S417 VanDerWaalsContact OG-CB 3.22Å; S381-S417 WeakPolarHBondContact OG-CB 3.02Å; S381-S417 PolarHBondContact OG-OG 2.83Å
382	V	97.3	Very high	94	Very high	5 Å²	5	75.3 Å²	75.3	3%	0.03	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.9	169.8	174.9	0	0	0	0	108.1	F337 F394 L414 H415 L439	F337-V382 HydrophobicContact CZ-CG1 4.22Å; F337-V382 HydrophobicContact CZ-CG2 4.46Å; V382-F394 HydrophobicContact CB-CB 4.08Å; V382-F394 HydrophobicContact CG1-CB 4.03Å; V382-F394 HydrophobicContact CG1-CG 4.44Å; V382-F394 VanDerWaalsContact O-CB 3.26Å; V382-F394 WeakPolarHBondContact O-CB 3.31Å; V382-F394 PolarHBondContact O-N 2.7Å; V382-L414 HydrophobicContact CG1-CB 4Å; V382-L414 HydrophobicContact CG1-CD1 4.48Å; V382-L414 HydrophobicContact CG1-CD2 3.82Å; V382-L414 HydrophobicContact CG1-CG 4.32Å; V382-H415 CarbonylContact C-O 3.57Å; V382-H415 WeakPolarHBondContact CA-O 3.19Å; V382-H415 WeakPolarHBondContact CG1-O 3.24Å; V382-L439 HydrophobicContact CG2-CD1 4.26Å
383	E	96.3	Very high	93.9	Very high	41 Å²	41	78.7 Å²	78.7	19%	0.192	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143.5	174	-54	171.1	144.1	0	0	108.5	K391 R392 L414 H415	E383-K391 HydrophobicContact CB-CB 4.37Å; E383-K391 HydrophobicContact CB-CD 4.1Å; E383-K391 WeakPolarHBondContact OE2-CD 3.5Å; E383-K391 IonicContact OE2-NZ 2.8Å; E383-K391 PolarHBondContact OE2-NZ 3.08Å; E383-R392 CarbonylContact C-O 3.53Å; E383-R392 WeakPolarHBondContact CA-O 3.33Å; E383-L414 CarbonylContact O-C 3.55Å; E383-L414 WeakPolarHBondContact O-CA 3.36Å; E383-H415 HydrophobicContact CB-CB 4.38Å; E383-H415 PolarHBondContact N-O 2.79Å; E383-H415 PolarHBondContact O-N 2.92Å
384	Q	96.8	Very high	93.9	Very high	47 Å²	47	77.5 Å²	77.5	22%	0.22	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.6	168.5	-166.3	178.8	49.9	0	0	110.3	R392 F394 G412 R413 L414	Q384-R392 PolarHBondContact N-O 3.18Å; Q384-R392 PolarHBondContact O-N 2.8Å; Q384-F394 HydrophobicContact CB-CD2 4.44Å; Q384-G412 PolarHBondContact NE2-O 3.42Å; Q384-R413 CarbonylContact C-O 3.55Å; Q384-R413 WeakPolarHBondContact CA-O 3.07Å; Q384-R413 HydrophobicContact CG-CB 4.2Å; Q384-L414 HydrophobicContact CB-CD2 4.14Å; Q384-L414 HydrophobicContact CG-CD2 4.14Å
385	S	95.8	Very high	93.8	Very high	15 Å²	15	81.8 Å²	81.8	11%	0.105	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.6	173.3	51.8	0	0	0	0	112	S390 R413 H415	S385-S390 CarbonylContact C-O 3.56Å; S385-S390 VanDerWaalsContact CA-O 3.28Å; S385-S390 WeakPolarHBondContact CA-O 3.32Å; S385-R413 PolarHBondContact N-O 2.86Å; S385-R413 WeakPolarHBondContact O-CB 3.46Å; S385-R413 WeakPolarHBondContact O-CD 3.27Å; S385-R413 PolarHBondContact O-NE 2.95Å; S385-R413 PolarHBondContact OG-O 3.37Å; S385-H415 VanDerWaalsContact CB-NE2 3.35Å; S385-H415 WeakPolarHBondContact CB-NE2 3.24Å; S385-H415 PolarHBondContact OG-NE2 3.14Å
386	Q	93.6	Very high	93.9	Very high	53 Å²	53	83.8 Å²	83.8	25%	0.248	43%	0.431	C	S	.	.			trans	-102.4	177.1	176.6	-53.7	-52.5	-32.3	0	0	111	D388 R389 S390	Q386-D388 WeakPolarHBondContact CB-OD1 3.35Å; Q386-D388 PolarHBondContact O-N 3.05Å; Q386-R389 WeakPolarHBondContact O-CA 3.31Å; Q386-R389 PolarHBondContact O-N 2.87Å; Q386-S390 PolarHBondContact N-O 3.34Å
387	S	90.9	Very high	94.1	Very high	122 Å²	122	80.7 Å²	80.7	85%	0.853	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.6	-177.2	43.6	0	0	0	0	113.8	R389	S387-R389 PolarHBondContact O-N 3.29Å
388	D	92.2	Very high	94.4	Very high	103 Å²	103	78.8 Å²	78.8	55%	0.551	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	2.6	172.5	64.2	-0.1	0	0	0	113.7	Q386 S390	Q386-D388 WeakPolarHBondContact CB-OD1 3.35Å; Q386-D388 PolarHBondContact O-N 3.05Å; D388-S390 VanDerWaalsContact CG-OG 3.24Å; D388-S390 PolarHBondContact O-N 3.44Å; D388-S390 WeakPolarHBondContact OD1-CA 3.27Å; D388-S390 WeakPolarHBondContact OD1-CB 3.29Å; D388-S390 PolarHBondContact OD1-N 3.14Å; D388-S390 PolarHBondContact OD1-OG 3.31Å; D388-S390 PolarHBondContact OD2-OG 3.38Å; D388-S390 VanDerWaalsContact OD2-OG 3.1Å
389	R	88.4	Confident	94.4	Very high	226 Å²	226	74.6 Å²	74.6	85%	0.853	39%	0.389	S	S	*	.	S	Bend	trans	64.9	4.1	-171.1	-48.8	178.1	179.8	-175	-0.9	114.9	Q386 S387	Q386-R389 WeakPolarHBondContact O-CA 3.31Å; Q386-R389 PolarHBondContact O-N 2.87Å; S387-R389 PolarHBondContact O-N 3.29Å
390	S	93.4	Very high	94.4	Very high	38 Å²	38	76.3 Å²	76.3	27%	0.266	40%	0.396	S	S	.	.			trans	-62.5	144	169.2	73.9	0	0	0	0	109.6	S385 Q386 D388	S385-S390 CarbonylContact C-O 3.56Å; S385-S390 VanDerWaalsContact CA-O 3.28Å; S385-S390 WeakPolarHBondContact CA-O 3.32Å; Q386-S390 PolarHBondContact N-O 3.34Å; D388-S390 VanDerWaalsContact CG-OG 3.24Å; D388-S390 PolarHBondContact O-N 3.44Å; D388-S390 WeakPolarHBondContact OD1-CA 3.27Å; D388-S390 WeakPolarHBondContact OD1-CB 3.29Å; D388-S390 PolarHBondContact OD1-N 3.14Å; D388-S390 PolarHBondContact OD1-OG 3.31Å; D388-S390 PolarHBondContact OD2-OG 3.38Å; D388-S390 VanDerWaalsContact OD2-OG 3.1Å
391	K	94.1	Very high	94.4	Very high	80 Å²	80	77 Å²	77	35%	0.348	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137	173.4	-70.1	-162.4	176	-174.5	0	109.6	K333 E383 H415	K333-K391 PolarHBondContact O-NZ 2.7Å; K333-K391 VanDerWaalsContact O-NZ 3.08Å; E383-K391 HydrophobicContact CB-CB 4.37Å; E383-K391 HydrophobicContact CB-CD 4.1Å; E383-K391 WeakPolarHBondContact OE2-CD 3.5Å; E383-K391 IonicContact OE2-NZ 2.8Å; E383-K391 PolarHBondContact OE2-NZ 3.08Å; K391-H415 VanDerWaalsContact CE-CG 3.48Å; K391-H415 VanDerWaalsContact NZ-CB 3.31Å; K391-H415 VanDerWaalsContact NZ-CG 3.26Å; K391-H415 PolarHBondContact NZ-ND1 2.79Å
392	R	94.4	Very high	94.3	Very high	157 Å²	157	75.8 Å²	75.8	59%	0.592	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.3	174.4	-58.2	-175.3	-175.5	-158.9	-1.2	109	E383 Q384 F394	E383-R392 CarbonylContact C-O 3.53Å; E383-R392 WeakPolarHBondContact CA-O 3.33Å; Q384-R392 PolarHBondContact N-O 3.18Å; Q384-R392 PolarHBondContact O-N 2.8Å; R392-F394 PolarHBondContact O-N 2.8Å
393	P	95.4	Very high	94.2	Very high	106 Å²	106	78.1 Å²	78.1	69%	0.688	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.2	132.2	171.3	-25.1	34.7	0	0	0	110.6	K395	P393-K395 PolarHBondContact O-N 2.85Å
394	F	95.7	Very high	94	Very high	26 Å²	26	82.4 Å²	82.4	11%	0.114	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-66.6	118	176.5	178.2	-102.4	0	0	0	109.3	L368 V382 Q384 R392 V397 V411 L414	L368-F394 HydrophobicContact CB-CD1 4.16Å; L368-F394 HydrophobicContact CB-CE1 3.87Å; L368-F394 HydrophobicContact CD1-CE1 3.61Å; L368-F394 HydrophobicContact CD1-CZ 3.65Å; L368-F394 HydrophobicContact CG-CE1 4.35Å; V382-F394 HydrophobicContact CB-CB 4.08Å; V382-F394 HydrophobicContact CG1-CB 4.03Å; V382-F394 HydrophobicContact CG1-CG 4.44Å; V382-F394 VanDerWaalsContact O-CB 3.26Å; V382-F394 WeakPolarHBondContact O-CB 3.31Å; V382-F394 PolarHBondContact O-N 2.7Å; Q384-F394 HydrophobicContact CB-CD2 4.44Å; R392-F394 PolarHBondContact O-N 2.8Å; F394-V397 HydrophobicContact CE2-CG2 3.73Å; F394-V397 HydrophobicContact CZ-CG2 3.63Å; F394-V411 HydrophobicContact CD2-CG1 4.4Å; F394-V411 HydrophobicContact CE2-CG1 3.53Å; F394-V411 HydrophobicContact CZ-CG1 4.01Å; F394-L414 HydrophobicContact CD2-CD2 3.74Å; F394-L414 HydrophobicContact CE2-CD2 4.18Å; F394-L414 HydrophobicContact CG-CD2 4.28Å
395	K	92.7	Very high	93.8	Very high	172 Å²	172	85.6 Å²	85.6	75%	0.748	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-89.6	147.1	170.5	-65.8	-169.7	175.9	-170.4	0	109.1	P393 V397	P393-K395 PolarHBondContact O-N 2.85Å; K395-V397 PolarHBondContact O-N 2.83Å
396	P	93.9	Very high	93.9	Very high	63 Å²	63	89.5 Å²	89.5	41%	0.409	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-53.3	135	174.3	-23.7	33.5	0	0	0	111.2	Y365 L366 K367	Y365-P396 HydrophobicContact CD1-CB 4.03Å; Y365-P396 HydrophobicContact CG-CB 4.23Å; L366-P396 WeakPolarHBondContact O-CA 3.46Å; K367-P396 HydrophobicContact CB-CB 4.38Å; K367-P396 HydrophobicContact CB-CG 4.42Å; K367-P396 HydrophobicContact CG-CG 4.31Å
397	V	95	Very high	94	Very high	51 Å²	51	88.2 Å²	88.2	31%	0.309	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.8	-177.6	169.9	0	0	0	0	108.7	Y365 L366 F394 K395 V399	Y365-V397 CarbonylContact C-O 3.58Å; Y365-V397 WeakPolarHBondContact CA-O 3.38Å; L366-V397 PolarHBondContact N-O 2.91Å; L366-V397 PolarHBondContact O-N 2.81Å; F394-V397 HydrophobicContact CE2-CG2 3.73Å; F394-V397 HydrophobicContact CZ-CG2 3.63Å; K395-V397 PolarHBondContact O-N 2.83Å; V397-V399 HydrophobicContact CG1-CG1 4.24Å; V397-V399 PolarHBondContact O-N 2.91Å
398	L	95.9	Very high	94.4	Very high	106 Å²	106	88.2 Å²	88.2	56%	0.555	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	128.8	171.1	-175.7	72.4	0	0	0	109.2	C363 Y365	C363-L398 HydrophobicContact CB-CD1 3.59Å; Y365-L398 HydrophobicContact CD1-CB 4.37Å; Y365-L398 HydrophobicContact CD1-CD1 4.43Å; Y365-L398 HydrophobicContact CE1-CB 4.07Å; Y365-L398 HydrophobicContact CE1-CD1 3.87Å
399	V	95.7	Very high	94.6	Very high	9 Å²	9	84.3 Å²	84.3	6%	0.055	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.3	-179.9	-66.4	0	0	0	0	110.9	F364 L366 V397 L401 V409 L443	F364-V399 HydrophobicContact CB-CG2 3.75Å; F364-V399 PolarHBondContact O-N 2.88Å; L366-V399 HydrophobicContact CB-CG1 4.01Å; V397-V399 HydrophobicContact CG1-CG1 4.24Å; V397-V399 PolarHBondContact O-N 2.91Å; V399-L401 HydrophobicContact CG2-CD2 4.41Å; V399-L401 HydrophobicContact CG2-CG 4.44Å; V399-V409 HydrophobicContact CG1-CG1 4.04Å; V399-V409 HydrophobicContact CG1-CG2 3.85Å; V399-L443 HydrophobicContact CG2-CD1 3.95Å
400	T	94.3	Very high	95	Very high	117 Å²	117	76.8 Å²	76.8	72%	0.718	40%	0.403	S	S	*	.			trans	-89.1	124.8	173.2	-51.9	0	0	0	0	108.6	P402 T407	T400-P402 WeakPolarHBondContact O-CD 3.22Å; T400-T407 PolarHBondContact O-OG1 2.85Å
401	L	95	Very high	95.2	Very high	15 Å²	15	75.4 Å²	75.4	8%	0.079	39%	0.392	C	S	.	.			trans	-116.7	88.1	-178.2	-58.7	-178.8	0	0	0	109.5	I343 M345 F364 V399 T407 L443	I343-L401 HydrophobicContact CB-CD2 3.98Å; I343-L401 HydrophobicContact CD1-CD2 4.1Å; I343-L401 HydrophobicContact CG2-CD1 3.95Å; I343-L401 HydrophobicContact CG2-CD2 3.79Å; M345-L401 HydrophobicContact CE-CB 4.22Å; M345-L401 HydrophobicContact CE-CD1 3.59Å; F364-L401 HydrophobicContact CB-CD1 4.09Å; F364-L401 HydrophobicContact CB-CG 4.49Å; F364-L401 HydrophobicContact CD1-CD1 3.95Å; F364-L401 HydrophobicContact CD2-CB 4.41Å; F364-L401 HydrophobicContact CD2-CD1 3.94Å; F364-L401 HydrophobicContact CD2-CG 4.25Å; F364-L401 HydrophobicContact CE1-CD1 4.33Å; F364-L401 HydrophobicContact CE2-CD1 4.33Å; F364-L401 HydrophobicContact CG-CD1 3.74Å; F364-L401 HydrophobicContact CG-CG 4.37Å; V399-L401 HydrophobicContact CG2-CD2 4.41Å; V399-L401 HydrophobicContact CG2-CG 4.44Å; L401-T407 HydrophobicContact CD2-CG2 4.15Å; L401-L443 HydrophobicContact CD1-CD1 4.12Å; L401-L443 HydrophobicContact CD1-CD2 4Å
402	P	94.4	Very high	95.3	Very high	39 Å²	39	72.4 Å²	72.4	25%	0.253	38%	0.384	S	S	.	.			trans	-64.8	149.6	174.4	25.6	-32.4	0	0	0	111.6	T400 Q405	T400-P402 WeakPolarHBondContact O-CD 3.22Å; P402-Q405 HydrophobicContact CB-CB 4.49Å; P402-Q405 HydrophobicContact CG-CB 3.99Å; P402-Q405 HydrophobicContact CG-CG 4.5Å
403	P	93.7	Very high	95.3	Very high	55 Å²	55	70.4 Å²	70.4	36%	0.357	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	150.6	179.7	28.8	-36.1	0	0	0	112.4	G347 D348 Q405	G347-P403 WeakPolarHBondContact O-CA 3.42Å; G347-P403 VanDerWaalsContact O-CB 3.25Å; G347-P403 WeakPolarHBondContact O-CB 3.43Å; D348-P403 HydrophobicContact CB-CB 3.99Å; D348-P403 HydrophobicContact CB-CG 4.34Å; P403-Q405 PolarHBondContact O-N 2.94Å
404	E	92.9	Very high	95.4	Very high	130 Å²	130	65.4 Å²	65.4	61%	0.607	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	30	179.8	-53.4	-54.6	149.4	0	0	114.5	M345 L346 G347	M345-E404 VanDerWaalsContact O-CA 3.29Å; M345-E404 WeakPolarHBondContact O-CA 3.46Å; M345-E404 PolarHBondContact O-N 3.27Å; L346-E404 WeakPolarHBondContact CD2-OE2 3.4Å; G347-E404 WeakPolarHBondContact CA-OE1 3.32Å; G347-E404 PolarHBondContact N-OE1 3Å
405	Q	92.6	Very high	95.5	Very high	114 Å²	114	64.4 Å²	64.4	53%	0.533	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	149.7	-173.4	-75.5	177.7	54.5	0	0	113.1	G344 M345 P402 P403	G344-Q405 WeakPolarHBondContact CA-O 3.05Å; M345-Q405 PolarHBondContact N-O 3.35Å; M345-Q405 PolarHBondContact O-N 2.85Å; P402-Q405 HydrophobicContact CB-CB 4.49Å; P402-Q405 HydrophobicContact CG-CB 3.99Å; P402-Q405 HydrophobicContact CG-CG 4.5Å; P403-Q405 PolarHBondContact O-N 2.94Å
406	V	96.8	Very high	95.7	Very high	97 Å²	97	56.3 Å²	56.3	59%	0.588	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	104.9	174.3	-175.7	0	0	0	0	110.2	Y342 I343	Y342-V406 HydrophobicContact CD1-CG1 4.49Å; I343-V406 CarbonylContact O-C 3.57Å; I343-V406 WeakPolarHBondContact O-CA 3.5Å
407	T	97.2	Very high	95.8	Very high	27 Å²	27	54.4 Å²	54.4	17%	0.166	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.4	175	-54.7	0	0	0	0	110	Y342 I343 T400 L401 V409	Y342-T407 WeakPolarHBondContact CA-O 3.32Å; I343-T407 PolarHBondContact N-O 3.16Å; I343-T407 PolarHBondContact O-N 3.27Å; T400-T407 PolarHBondContact O-OG1 2.85Å; L401-T407 HydrophobicContact CD2-CG2 4.15Å; T407-V409 HydrophobicContact CG2-CG2 3.89Å
408	K	97.8	Very high	95.8	Very high	122 Å²	122	55.5 Å²	55.5	53%	0.53	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.7	172.5	179.9	176.2	177.3	146.5	0	110.5	T340 V341 Y342	T340-K408 HydrophobicContact CG2-CD 4.37Å; T340-K408 HydrophobicContact CG2-CG 3.98Å; V341-K408 WeakPolarHBondContact O-CA 3.46Å; Y342-K408 HydrophobicContact CD1-CB 4.24Å; Y342-K408 HydrophobicContact CD1-CD 4.42Å; Y342-K408 HydrophobicContact CD1-CG 4.2Å; Y342-K408 HydrophobicContact CE1-CB 4.32Å; Y342-K408 HydrophobicContact CE1-CD 3.67Å; Y342-K408 HydrophobicContact CE1-CG 3.89Å; Y342-K408 PolarHBondContact OH-NZ 2.7Å
409	V	97.4	Very high	95.8	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	109.5	-179	-172.5	0	0	0	0	109.7	T340 V341 L366 V399 T407 V411	T340-V409 WeakPolarHBondContact CA-O 3.46Å; V341-V409 PolarHBondContact N-O 3.23Å; V341-V409 PolarHBondContact O-N 3.14Å; L366-V409 HydrophobicContact CD2-CB 4.19Å; L366-V409 HydrophobicContact CD2-CG1 3.77Å; V399-V409 HydrophobicContact CG1-CG1 4.04Å; V399-V409 HydrophobicContact CG1-CG2 3.85Å; T407-V409 HydrophobicContact CG2-CG2 3.89Å; V409-V411 HydrophobicContact CG1-CG2 4.21Å
410	T	97.3	Very high	95.8	Very high	68 Å²	68	53 Å²	53	42%	0.417	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.2	178.3	-62.1	0	0	0	0	110.6	Q338 T340	Q338-T410 HydrophobicContact CG-CG2 3.84Å; Q338-T410 VanDerWaalsContact NE2-CG2 3.35Å; T340-T410 WeakPolarHBondContact OG1-CB 3.13Å; T340-T410 WeakPolarHBondContact OG1-CG2 3.46Å; T340-T410 PolarHBondContact OG1-OG1 3.32Å
411	V	96.7	Very high	95.8	Very high	8 Å²	8	49.9 Å²	49.9	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	100.8	-179.4	-167.9	0	0	0	0	109.5	Q338 V339 L366 L368 F394 V409 L414	Q338-V411 WeakPolarHBondContact CA-O 3.42Å; V339-V411 PolarHBondContact N-O 3.49Å; V339-V411 PolarHBondContact O-N 2.87Å; L366-V411 HydrophobicContact CD2-CG2 4.06Å; L368-V411 HydrophobicContact CD1-CG2 4.47Å; F394-V411 HydrophobicContact CD2-CG1 4.4Å; F394-V411 HydrophobicContact CE2-CG1 3.53Å; F394-V411 HydrophobicContact CZ-CG1 4.01Å; V409-V411 HydrophobicContact CG1-CG2 4.21Å; V411-L414 HydrophobicContact CB-CD1 4.2Å; V411-L414 HydrophobicContact CG1-CD1 3.84Å; V411-L414 HydrophobicContact CG1-CD2 3.82Å; V411-L414 HydrophobicContact CG1-CG 4.06Å; V411-L414 WeakPolarHBondContact O-CD1 3.36Å
412	G	95.9	Very high	95.8	Very high	17 Å²	17	52.5 Å²	52.5	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	178.7	178.6	0	0	0	0	0	114.5	Q384 L414	Q384-G412 PolarHBondContact NE2-O 3.42Å; G412-L414 VanDerWaalsContact C-N 3.28Å; G412-L414 PolarHBondContact O-N 2.88Å
413	R	95.4	Very high	95.6	Very high	116 Å²	116	52.2 Å²	52.2	44%	0.438	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.2	28.8	178.6	-57.6	-164.9	-58.7	-97.3	1.9	114.5	F337 Q384 S385 H415	F337-R413 PolarHBondContact O-N 3.36Å; Q384-R413 CarbonylContact C-O 3.55Å; Q384-R413 WeakPolarHBondContact CA-O 3.07Å; Q384-R413 HydrophobicContact CG-CB 4.2Å; S385-R413 PolarHBondContact N-O 2.86Å; S385-R413 WeakPolarHBondContact O-CB 3.46Å; S385-R413 WeakPolarHBondContact O-CD 3.27Å; S385-R413 PolarHBondContact O-NE 2.95Å; S385-R413 PolarHBondContact OG-O 3.37Å; R413-H415 PolarHBondContact O-CD2 2.87Å
414	L	97.3	Very high	95.2	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	149.1	-176.8	-61.1	179.7	0	0	0	112.8	H336 F337 V339 L368 V382 E383 Q384 F394 V411 G412	H336-L414 CarbonylContact C-O 3.58Å; H336-L414 WeakPolarHBondContact CA-O 3.37Å; F337-L414 HydrophobicContact CD1-CB 4.28Å; F337-L414 VanDerWaalsContact CD1-O 3.31Å; F337-L414 WeakPolarHBondContact CD1-O 3.41Å; F337-L414 HydrophobicContact CD2-CB 3.72Å; F337-L414 HydrophobicContact CD2-CD1 4.15Å; F337-L414 HydrophobicContact CE1-CB 4.07Å; F337-L414 HydrophobicContact CE2-CB 3.47Å; F337-L414 VanDerWaalsContact CE2-CB 3.47Å; F337-L414 HydrophobicContact CE2-CD1 3.66Å; F337-L414 HydrophobicContact CE2-CG 4.23Å; F337-L414 HydrophobicContact CG-CB 4.12Å; F337-L414 HydrophobicContact CZ-CB 3.66Å; F337-L414 HydrophobicContact CZ-CD1 4.41Å; F337-L414 PolarHBondContact N-O 2.88Å; F337-L414 PolarHBondContact O-N 2.96Å; V339-L414 HydrophobicContact CG2-CD1 4.47Å; L368-L414 HydrophobicContact CD2-CD1 3.83Å; V382-L414 HydrophobicContact CG1-CB 4Å; V382-L414 HydrophobicContact CG1-CD1 4.48Å; V382-L414 HydrophobicContact CG1-CD2 3.82Å; V382-L414 HydrophobicContact CG1-CG 4.32Å; E383-L414 CarbonylContact O-C 3.55Å; E383-L414 WeakPolarHBondContact O-CA 3.36Å; Q384-L414 HydrophobicContact CB-CD2 4.14Å; Q384-L414 HydrophobicContact CG-CD2 4.14Å; F394-L414 HydrophobicContact CD2-CD2 3.74Å; F394-L414 HydrophobicContact CE2-CD2 4.18Å; F394-L414 HydrophobicContact CG-CD2 4.28Å; V411-L414 HydrophobicContact CB-CD1 4.2Å; V411-L414 HydrophobicContact CG1-CD1 3.84Å; V411-L414 HydrophobicContact CG1-CD2 3.82Å; V411-L414 HydrophobicContact CG1-CG 4.06Å; V411-L414 WeakPolarHBondContact O-CD1 3.36Å; G412-L414 VanDerWaalsContact C-N 3.28Å; G412-L414 PolarHBondContact O-N 2.88Å
415	H	96.6	Very high	94.8	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.028	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	152.8	175.7	-50.7	-102.4	0	0	0	110.2	K333 K334 N335 V382 E383 S385 K391 R413	K333-H415 PolarHBondContact O-ND1 2.85Å; K334-H415 PolarHBondContact O-CE1 2.87Å; K334-H415 VanDerWaalsContact O-CE1 3.31Å; N335-H415 PolarHBondContact O-CE1 2.95Å; N335-H415 PolarHBondContact O-ND1 3.03Å; V382-H415 CarbonylContact C-O 3.57Å; V382-H415 WeakPolarHBondContact CA-O 3.19Å; V382-H415 WeakPolarHBondContact CG1-O 3.24Å; E383-H415 HydrophobicContact CB-CB 4.38Å; E383-H415 PolarHBondContact N-O 2.79Å; E383-H415 PolarHBondContact O-N 2.92Å; S385-H415 VanDerWaalsContact CB-NE2 3.35Å; S385-H415 WeakPolarHBondContact CB-NE2 3.24Å; S385-H415 PolarHBondContact OG-NE2 3.14Å; K391-H415 VanDerWaalsContact CE-CG 3.48Å; K391-H415 VanDerWaalsContact NZ-CB 3.31Å; K391-H415 VanDerWaalsContact NZ-CG 3.26Å; K391-H415 PolarHBondContact NZ-ND1 2.79Å; R413-H415 PolarHBondContact O-CD2 2.87Å
416	F	97.2	Very high	94.5	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.009	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	141.2	165.6	-65.7	-83.3	0	0	0	110.8	F320 K333 F337 I380 E418 F437 L439 I462 V464	F320-F416 HydrophobicContact CE1-CE2 4.11Å; F320-F416 HydrophobicContact CZ-CE2 4.49Å; K333-F416 WeakPolarHBondContact CE-O 3.21Å; K333-F416 WeakPolarHBondContact CG-O 3.48Å; F337-F416 HydrophobicContact CD1-CD2 4.38Å; F337-F416 HydrophobicContact CD1-CE2 4.21Å; F337-F416 AromaticContact CE1-CD2 3.67Å; F337-F416 HydrophobicContact CE1-CD2 3.67Å; F337-F416 AromaticContact CE1-CE2 3.59Å; F337-F416 HydrophobicContact CE1-CE2 3.59Å; F337-F416 HydrophobicContact CE1-CG 4.32Å; F337-F416 HydrophobicContact CE1-CZ 4.18Å; F337-F416 HydrophobicContact CZ-CD2 4.44Å; F337-F416 HydrophobicContact CZ-CE2 4.11Å; F337-F416 HydrophobicContact CZ-CZ 4.24Å; I380-F416 HydrophobicContact CG2-CB 4.36Å; I380-F416 HydrophobicContact CG2-CD1 4.11Å; F416-E418 VanDerWaalsContact C-N 3.35Å; F416-F437 HydrophobicContact CD1-CD2 4.04Å; F416-F437 HydrophobicContact CE1-CD2 4.42Å; F416-F437 HydrophobicContact CG-CD2 4.32Å; F416-L439 HydrophobicContact CE1-CD1 4.2Å; F416-L439 HydrophobicContact CZ-CB 4.29Å; F416-L439 HydrophobicContact CZ-CD1 4.32Å; F416-I462 HydrophobicContact CE2-CG2 4.42Å; F416-I462 HydrophobicContact CZ-CD1 4.41Å; F416-V464 HydrophobicContact CB-CG1 4.14Å; F416-V464 HydrophobicContact CB-CG2 4.36Å; F416-V464 HydrophobicContact CD2-CG1 4.19Å; F416-V464 HydrophobicContact CD2-CG2 3.59Å; F416-V464 HydrophobicContact CE2-CG2 4.01Å; F416-V464 HydrophobicContact CG-CG2 3.97Å
417	S	95.8	Very high	93.7	Very high	22 Å²	22	55.5 Å²	55.5	15%	0.154	28%	0.279	C	S	.	.	S	Bend	trans	-77.4	-17.4	176.8	66.4	0	0	0	0	114.1	K333 S381	K333-S417 WeakPolarHBondContact CE-O 3.39Å; K333-S417 PolarHBondContact NZ-O 2.91Å; S381-S417 PolarHBondContact N-OG 3.27Å; S381-S417 VanDerWaalsContact O-CB 3.27Å; S381-S417 WeakPolarHBondContact O-CB 3.16Å; S381-S417 PolarHBondContact O-N 2.91Å; S381-S417 PolarHBondContact O-OG 2.89Å; S381-S417 VanDerWaalsContact OG-CB 3.22Å; S381-S417 WeakPolarHBondContact OG-CB 3.02Å; S381-S417 PolarHBondContact OG-OG 2.83Å
418	E	95.2	Very high	92.6	Very high	75 Å²	75	56 Å²	56	35%	0.35	29%	0.289	S	S	.	.	S	Bend	trans	-115.7	164.8	174	-72.4	177.7	-133.1	0	0	111	K372 I380 F416 F437	K372-E418 WeakPolarHBondContact CE-OE2 3.34Å; K372-E418 IonicContact NZ-OE2 3.22Å; K372-E418 PolarHBondContact NZ-OE2 3.09Å; I380-E418 HydrophobicContact CD1-CB 4.19Å; I380-E418 HydrophobicContact CD1-CG 4.33Å; I380-E418 HydrophobicContact CG2-CB 4.08Å; F416-E418 VanDerWaalsContact C-N 3.35Å; E418-F437 HydrophobicContact CB-CE2 4.08Å; E418-F437 HydrophobicContact CB-CZ 3.85Å
419	T	96.1	Very high	91.8	Very high	59 Å²	59	57.7 Å²	57.7	36%	0.362	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-103	148.7	161.4	47.7	0	0	0	0	109.1	K333 V464 A466	K333-T419 HydrophobicContact CB-CG2 4.04Å; K333-T419 HydrophobicContact CD-CG2 4.2Å; K333-T419 HydrophobicContact CG-CG2 4.3Å; T419-V464 WeakPolarHBondContact CA-O 3.19Å; T419-V464 VanDerWaalsContact CB-O 3.28Å; T419-V464 WeakPolarHBondContact CB-O 3.18Å; T419-A466 HydrophobicContact CG2-CB 4.12Å
420	T	96.4	Very high	91.3	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.018	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-59.8	140.7	170.2	41.9	0	0	0	0	110.7	N423 R435 F437 V464	T420-N423 WeakPolarHBondContact CB-OD1 3.41Å; T420-N423 PolarHBondContact O-ND2 2.04Å; T420-N423 PolarHBondContact O-OD1 3.37Å; T420-N423 VanDerWaalsContact O-OD1 3.14Å; T420-N423 PolarHBondContact OG1-ND2 2.84Å; T420-N423 PolarHBondContact OG1-OD1 3.33Å; T420-R435 VanDerWaalsContact CB-O 3.3Å; T420-R435 WeakPolarHBondContact CB-O 3.48Å; T420-R435 WeakPolarHBondContact CG2-O 3.03Å; T420-F437 HydrophobicContact CG2-CB 4.5Å; T420-F437 HydrophobicContact CG2-CD1 3.72Å; T420-F437 HydrophobicContact CG2-CD2 3.96Å; T420-F437 HydrophobicContact CG2-CE1 3.8Å; T420-F437 HydrophobicContact CG2-CE2 4.04Å; T420-F437 HydrophobicContact CG2-CG 3.78Å; T420-F437 HydrophobicContact CG2-CZ 3.96Å; T420-V464 HydrophobicContact CG2-CB 4.36Å; T420-V464 HydrophobicContact CG2-CG2 4.25Å; T420-V464 PolarHBondContact N-O 2.82Å; T420-V464 PolarHBondContact OG1-N 2.95Å; T420-V464 PolarHBondContact OG1-O 2.85Å
421	A	94.9	Very high	91	Very high	51 Å²	51	56 Å²	56	42%	0.421	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	161	175.7	0	0	0	0	0	111.3	N423 Q434 R435	A421-N423 PolarHBondContact O-N 3.05Å; A421-Q434 PolarHBondContact O-NE2 2.86Å; A421-R435 HydrophobicContact CB-CB 4.15Å; A421-R435 HydrophobicContact CB-CG 3.87Å; A421-R435 PolarHBondContact O-N 2.94Å
422	N	94	Very high	90.9	Very high	71 Å²	71	61.2 Å²	61.2	38%	0.38	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	10	173	-65.8	-23.3	0	0	0	117.2	M424 N431 D433 Q434	N422-M424 PolarHBondContact O-N 3.39Å; N422-N431 WeakPolarHBondContact CB-ND2 3.16Å; N422-N431 WeakPolarHBondContact O-CB 3.05Å; N422-N431 PolarHBondContact O-ND2 2.84Å; N422-D433 HydrophobicContact CB-CB 4.43Å; N422-D433 VanDerWaalsContact CB-O 3.31Å; N422-D433 WeakPolarHBondContact CB-O 3.36Å; N422-D433 VanDerWaalsContact ND2-CB 3.35Å; N422-D433 WeakPolarHBondContact ND2-CB 3.23Å; N422-D433 PolarHBondContact ND2-O 3.39Å; N422-Q434 PolarHBondContact O-OE1 3.02Å
423	N	91.4	Very high	90.8	Very high	33 Å²	33	64 Å²	64	18%	0.176	33%	0.332	C	S	.	.			trans	-48.6	-10.7	177.4	-71.3	-7.9	0	0	0	118.4	T420 A421 Q434 I463 V464	T420-N423 WeakPolarHBondContact CB-OD1 3.41Å; T420-N423 PolarHBondContact O-ND2 2.04Å; T420-N423 PolarHBondContact O-OD1 3.37Å; T420-N423 VanDerWaalsContact O-OD1 3.14Å; T420-N423 PolarHBondContact OG1-ND2 2.84Å; T420-N423 PolarHBondContact OG1-OD1 3.33Å; A421-N423 PolarHBondContact O-N 3.05Å; N423-Q434 VanDerWaalsContact CA-OE1 3.31Å; N423-Q434 PolarHBondContact OD1-NE2 2.86Å; N423-I463 WeakPolarHBondContact OD1-CG2 3.45Å; N423-V464 PolarHBondContact ND2-O 3.44Å
424	M	85	Confident	90.9	Very high	114 Å²	114	58.9 Å²	58.9	56%	0.562	31%	0.313	S	S	*	.	S	Bend	trans	-83.8	124.2	-179.2	-173.8	62.7	71.6	0	0	110.8	N422 N431 F472	N422-M424 PolarHBondContact O-N 3.39Å; M424-N431 PolarHBondContact O-ND2 2.68Å; M424-F472 HydrophobicContact CE-CE1 3.67Å; M424-F472 HydrophobicContact CE-CZ 3.98Å; M424-F472 HydrophobicContact SD-CD1 4.15Å; M424-F472 HydrophobicContact SD-CE1 3.8Å
425	R	84.6	Confident	90.9	Very high	37 Å²	37	63.5 Å²	63.5	14%	0.14	33%	0.33	C	S	.	.			trans	-56.3	143.9	175.9	-71.2	179.8	179.2	-65.5	-16.2	111.5	D326 G428 K429 F472	D326-R425 IonicContact OD1-NH2 2.74Å; D326-R425 IonicContact OD2-CZ 3.14Å; D326-R425 IonicContact OD2-NH1 3.16Å; D326-R425 IonicContact OD2-NH2 3.71Å; D326-R425 PolarHBondContact OD2-NH2 2.85Å; R425-G428 WeakPolarHBondContact CD-O 3.39Å; R425-G428 PolarHBondContact NH1-O 2.91Å; R425-K429 CarbonylContact C-O 3.55Å; R425-K429 VanDerWaalsContact CA-O 3.31Å; R425-K429 WeakPolarHBondContact CA-O 3.36Å; R425-K429 WeakPolarHBondContact CB-O 3.38Å; R425-F472 WeakPolarHBondContact CD-O 3.46Å; R425-F472 PolarHBondContact NE-O 2.89Å
426	K	84.6	Confident	90.9	Very high	96 Å²	96	65.3 Å²	65.3	42%	0.417	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-114.1	112.6	174	-75.4	176.9	178.2	165.8	0	108.9	G428 K429 N431 D433	K426-G428 PolarHBondContact O-N 3.14Å; K426-K429 PolarHBondContact N-O 3.32Å; K426-K429 PolarHBondContact O-N 3.11Å; K426-N431 WeakPolarHBondContact CD-OD1 2.98Å; K426-N431 WeakPolarHBondContact CE-OD1 3.47Å; K426-N431 PolarHBondContact NZ-OD1 2.81Å; K426-D433 IonicContact NZ-OD2 3.05Å; K426-D433 PolarHBondContact NZ-OD2 2.8Å
427	K	80.9	Confident	91	Very high	217 Å²	217	65.4 Å²	65.4	94%	0.943	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	49.4	-175.6	-53.9	-178	179.4	-175.7	0	112.5	K429	K427-K429 PolarHBondContact O-N 2.79Å
428	G	74.2	Confident	91.1	Very high	37 Å²	37	65.6 Å²	65.6	38%	0.381	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	-28.4	-178.1	0	0	0	0	0	115.6	R425 K426	R425-G428 WeakPolarHBondContact CD-O 3.39Å; R425-G428 PolarHBondContact NH1-O 2.91Å; K426-G428 PolarHBondContact O-N 3.14Å
429	K	81.4	Confident	91.2	Very high	158 Å²	158	62.1 Å²	62.1	69%	0.687	32%	0.32	S	S	*	.	B	Isolated β-bridge	trans	-76.7	158.8	176.3	-60.9	-165	177	-167	0	111.8	R425 K426 K427	R425-K429 CarbonylContact C-O 3.55Å; R425-K429 VanDerWaalsContact CA-O 3.31Å; R425-K429 WeakPolarHBondContact CA-O 3.36Å; R425-K429 WeakPolarHBondContact CB-O 3.38Å; K426-K429 PolarHBondContact N-O 3.32Å; K426-K429 PolarHBondContact O-N 3.11Å; K427-K429 PolarHBondContact O-N 2.79Å
430	P	86.7	Confident	91.3	Very high	43 Å²	43	59.4 Å²	59.4	28%	0.279	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-50.8	156	167.2	-26.8	35.8	0	0	0	111.8	A325 D326 P432	A325-P430 WeakPolarHBondContact O-CG 3.37Å; D326-P430 HydrophobicContact CB-CG 4.48Å; P430-P432 WeakPolarHBondContact O-CD 3.25Å
431	N	91.3	Very high	91.4	Very high	12 Å²	12	59.2 Å²	59.2	6%	0.064	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-72.3	125.2	175.7	-164	-26.4	0	0	0	109.6	N422 M424 K426 D433 Q434	N422-N431 WeakPolarHBondContact CB-ND2 3.16Å; N422-N431 WeakPolarHBondContact O-CB 3.05Å; N422-N431 PolarHBondContact O-ND2 2.84Å; M424-N431 PolarHBondContact O-ND2 2.68Å; K426-N431 WeakPolarHBondContact CD-OD1 2.98Å; K426-N431 WeakPolarHBondContact CE-OD1 3.47Å; K426-N431 PolarHBondContact NZ-OD1 2.81Å; N431-D433 PolarHBondContact O-N 3.08Å; N431-D433 VanDerWaalsContact O-N 3.09Å; N431-D433 PolarHBondContact OD1-N 2.86Å; N431-D433 VanDerWaalsContact OD1-N 3.11Å; N431-D433 PolarHBondContact OD1-OD2 3.31Å; N431-Q434 HydrophobicContact CB-CB 4.45Å; N431-Q434 WeakPolarHBondContact O-CB 3.4Å; N431-Q434 PolarHBondContact O-N 2.96Å
432	P	93.3	Very high	91.5	Very high	116 Å²	116	57 Å²	57	75%	0.753	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.5	174.8	-25.7	36.9	0	0	0	113.2	P430	P430-P432 WeakPolarHBondContact O-CD 3.25Å
433	D	95.7	Very high	91.6	Very high	75 Å²	75	53.6 Å²	53.6	40%	0.401	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	13.2	177.4	-48	-70	0	0	0	113.3	N422 K426 N431 R435	N422-D433 HydrophobicContact CB-CB 4.43Å; N422-D433 VanDerWaalsContact CB-O 3.31Å; N422-D433 WeakPolarHBondContact CB-O 3.36Å; N422-D433 VanDerWaalsContact ND2-CB 3.35Å; N422-D433 WeakPolarHBondContact ND2-CB 3.23Å; N422-D433 PolarHBondContact ND2-O 3.39Å; K426-D433 IonicContact NZ-OD2 3.05Å; K426-D433 PolarHBondContact NZ-OD2 2.8Å; N431-D433 PolarHBondContact O-N 3.08Å; N431-D433 VanDerWaalsContact O-N 3.09Å; N431-D433 PolarHBondContact OD1-N 2.86Å; N431-D433 VanDerWaalsContact OD1-N 3.11Å; N431-D433 PolarHBondContact OD1-OD2 3.31Å; D433-R435 PolarHBondContact O-N 2.79Å
434	Q	96.1	Very high	91.9	Very high	9 Å²	9	53 Å²	53	4%	0.042	26%	0.262	C	S	.	.			trans	-50.4	131	-178.5	-179.6	60.8	52.3	0	0	111.1	A421 N422 N423 N431 Y436 I463	A421-Q434 PolarHBondContact O-NE2 2.86Å; N422-Q434 PolarHBondContact O-OE1 3.02Å; N423-Q434 VanDerWaalsContact CA-OE1 3.31Å; N423-Q434 PolarHBondContact OD1-NE2 2.86Å; N431-Q434 HydrophobicContact CB-CB 4.45Å; N431-Q434 WeakPolarHBondContact O-CB 3.4Å; N431-Q434 PolarHBondContact O-N 2.96Å; Q434-Y436 HydrophobicContact CB-CE2 4.15Å; Q434-Y436 HydrophobicContact CG-CE1 3.83Å; Q434-Y436 HydrophobicContact CG-CE2 3.93Å; Q434-Y436 VanDerWaalsContact CG-CZ 3.49Å; Q434-Y436 WeakPolarHBondContact CG-OH 3.39Å; Q434-Y436 VanDerWaalsContact O-CE2 3.24Å; Q434-Y436 WeakPolarHBondContact O-CE2 3.31Å; Q434-I463 HydrophobicContact CG-CD1 4Å; Q434-I463 HydrophobicContact CG-CG1 4.36Å
435	R	96.8	Very high	92.4	Very high	97 Å²	97	47.5 Å²	47.5	37%	0.366	24%	0.235	S	C	.	.			trans	-99.8	156.5	174	-58.8	-49	-172.6	-175.7	-3.3	111	T420 A421 D433	T420-R435 VanDerWaalsContact CB-O 3.3Å; T420-R435 WeakPolarHBondContact CB-O 3.48Å; T420-R435 WeakPolarHBondContact CG2-O 3.03Å; A421-R435 HydrophobicContact CB-CB 4.15Å; A421-R435 HydrophobicContact CB-CG 3.87Å; A421-R435 PolarHBondContact O-N 2.94Å; D433-R435 PolarHBondContact O-N 2.79Å
436	Y	97.9	Very high	92.9	Very high	44 Å²	44	47.4 Å²	47.4	17%	0.173	24%	0.236	C	C	.	.			trans	-137.2	146.6	-173.3	-56.1	-90.3	0	0	0	109.5	A328 V373 Q434 R461 I462 I463	A328-Y436 HydrophobicContact CB-CD1 4.35Å; A328-Y436 HydrophobicContact CB-CE1 3.87Å; V373-Y436 WeakPolarHBondContact CG2-O 3.24Å; V373-Y436 PolarHBondContact N-O 3.48Å; Q434-Y436 HydrophobicContact CB-CE2 4.15Å; Q434-Y436 HydrophobicContact CG-CE1 3.83Å; Q434-Y436 HydrophobicContact CG-CE2 3.93Å; Q434-Y436 VanDerWaalsContact CG-CZ 3.49Å; Q434-Y436 WeakPolarHBondContact CG-OH 3.39Å; Q434-Y436 VanDerWaalsContact O-CE2 3.24Å; Q434-Y436 WeakPolarHBondContact O-CE2 3.31Å; Y436-R461 HydrophobicContact CD1-CB 3.85Å; Y436-R461 HydrophobicContact CD1-CG 4.06Å; Y436-R461 HydrophobicContact CE1-CG 4.34Å; Y436-R461 HydrophobicContact CG-CB 4Å; Y436-I462 WeakPolarHBondContact CA-O 3.31Å; Y436-I463 HydrophobicContact CD1-CD1 4.45Å; Y436-I463 HydrophobicContact CD1-CG1 3.71Å; Y436-I463 HydrophobicContact CE1-CD1 3.9Å; Y436-I463 HydrophobicContact CE1-CG1 3.67Å
437	F	98.1	Very high	93.3	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	158.8	163.9	-56.1	-22.6	0	0	0	109.3	V371 K372 I380 F416 E418 T420 I462 V464	V371-F437 CarbonylContact O-C 3.56Å; V371-F437 VanDerWaalsContact O-CA 3.23Å; V371-F437 WeakPolarHBondContact O-CA 3.29Å; K372-F437 HydrophobicContact CG-CD1 4.09Å; K372-F437 HydrophobicContact CG-CE1 3.97Å; I380-F437 HydrophobicContact CD1-CD1 4.18Å; I380-F437 HydrophobicContact CD1-CE1 3.67Å; I380-F437 HydrophobicContact CD1-CE2 4.12Å; I380-F437 HydrophobicContact CD1-CZ 3.64Å; I380-F437 HydrophobicContact CG1-CD1 3.9Å; I380-F437 HydrophobicContact CG1-CD2 3.94Å; I380-F437 HydrophobicContact CG1-CE1 3.89Å; I380-F437 HydrophobicContact CG1-CE2 3.93Å; I380-F437 HydrophobicContact CG1-CG 3.95Å; I380-F437 HydrophobicContact CG1-CZ 3.9Å; I380-F437 HydrophobicContact CG2-CD2 4.4Å; I380-F437 HydrophobicContact CG2-CE2 4.1Å; F416-F437 HydrophobicContact CD1-CD2 4.04Å; F416-F437 HydrophobicContact CE1-CD2 4.42Å; F416-F437 HydrophobicContact CG-CD2 4.32Å; E418-F437 HydrophobicContact CB-CE2 4.08Å; E418-F437 HydrophobicContact CB-CZ 3.85Å; T420-F437 HydrophobicContact CG2-CB 4.5Å; T420-F437 HydrophobicContact CG2-CD1 3.72Å; T420-F437 HydrophobicContact CG2-CD2 3.96Å; T420-F437 HydrophobicContact CG2-CE1 3.8Å; T420-F437 HydrophobicContact CG2-CE2 4.04Å; T420-F437 HydrophobicContact CG2-CG 3.78Å; T420-F437 HydrophobicContact CG2-CZ 3.96Å; F437-I462 PolarHBondContact N-O 2.87Å; F437-I462 PolarHBondContact O-N 3.5Å; F437-V464 HydrophobicContact CD2-CB 4.4Å; F437-V464 HydrophobicContact CD2-CG2 3.5Å; F437-V464 HydrophobicContact CE2-CB 4.31Å; F437-V464 HydrophobicContact CE2-CG2 3.89Å; F437-V464 HydrophobicContact CG-CG2 4.43Å
438	M	97.9	Very high	93.5	Very high	27 Å²	27	38.5 Å²	38.5	13%	0.133	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.6	159	-59.9	173.6	-60.5	0	0	107.9	G370 V371 V373 M376 V458 S459	G370-M438 CarbonylContact C-O 3.53Å; G370-M438 VanDerWaalsContact CA-O 3.24Å; G370-M438 WeakPolarHBondContact CA-O 3.21Å; V371-M438 HydrophobicContact CG2-CB 4.12Å; V371-M438 HydrophobicContact CG2-CE 3.88Å; V371-M438 PolarHBondContact N-O 3.27Å; V371-M438 PolarHBondContact O-N 3.25Å; V373-M438 HydrophobicContact CG2-CE 4.14Å; V373-M438 HydrophobicContact CG2-CG 3.66Å; V373-M438 HydrophobicContact CG2-SD 4.04Å; M376-M438 HydrophobicContact CE-CE 4.08Å; M376-M438 HydrophobicContact CG-CE 4.46Å; M376-M438 HydrophobicContact SD-CE 4.35Å; M438-V458 HydrophobicContact CB-CG2 3.47Å; M438-V458 VanDerWaalsContact CB-CG2 3.47Å; M438-V458 HydrophobicContact CE-CG2 4.11Å; M438-V458 HydrophobicContact CG-CG2 4.25Å; M438-V458 HydrophobicContact SD-CG2 3.99Å; M438-S459 WeakPolarHBondContact CG-O 3.47Å
439	L	98.2	Very high	94.1	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.5	176.3	-176.9	56.2	0	0	0	109	W288 F320 F337 V339 V382 F416 V441 V458 S459 I462	W288-L439 HydrophobicContact CH2-CB 4.34Å; W288-L439 HydrophobicContact CH2-CD2 4.11Å; W288-L439 HydrophobicContact CH2-CG 4.22Å; W288-L439 WeakPolarHBondContact CZ3-O 3.42Å; F320-L439 HydrophobicContact CZ-CD2 4.3Å; F337-L439 HydrophobicContact CD2-CD2 4.31Å; F337-L439 HydrophobicContact CE2-CD2 3.61Å; F337-L439 HydrophobicContact CZ-CD1 4.43Å; F337-L439 HydrophobicContact CZ-CD2 4.11Å; V339-L439 HydrophobicContact CG2-CD2 3.87Å; V382-L439 HydrophobicContact CG2-CD1 4.26Å; F416-L439 HydrophobicContact CE1-CD1 4.2Å; F416-L439 HydrophobicContact CZ-CB 4.29Å; F416-L439 HydrophobicContact CZ-CD1 4.32Å; L439-V441 HydrophobicContact CG-CG2 4.1Å; L439-V458 WeakPolarHBondContact O-CA 3.45Å; L439-S459 PolarHBondContact N-OG 3.27Å; L439-S459 PolarHBondContact O-N 3.22Å; L439-I462 HydrophobicContact CB-CD1 4.18Å
440	V	97.8	Very high	94.6	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125	174.5	-178.1	0	0	0	0	109.1	L368 H369 V371 H457 V458	L368-V440 WeakPolarHBondContact CA-O 3.44Å; H369-V440 PolarHBondContact N-O 3.41Å; H369-V440 PolarHBondContact O-N 2.99Å; V371-V440 HydrophobicContact CG1-CG2 3.99Å; V371-V440 HydrophobicContact CG2-CG2 3.94Å; V440-H457 WeakPolarHBondContact CA-O 3.29Å; V440-V458 HydrophobicContact CG2-CB 4.2Å; V440-V458 HydrophobicContact CG2-CG2 3.87Å
441	V	97.9	Very high	94.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	110.2	-179.2	-176.9	0	0	0	0	106.9	W288 Y312 V314 V339 V341 L366 L368 L439 A456 H457	W288-V441 HydrophobicContact CH2-CG2 3.69Å; W288-V441 HydrophobicContact CZ3-CB 4.33Å; W288-V441 HydrophobicContact CZ3-CG2 3.67Å; Y312-V441 PolarHBondContact OH-O 2.82Å; Y312-V441 VanDerWaalsContact OH-O 3.12Å; V314-V441 HydrophobicContact CG1-CB 4.14Å; V314-V441 HydrophobicContact CG1-CG1 4.1Å; V314-V441 HydrophobicContact CG1-CG2 4.07Å; V314-V441 HydrophobicContact CG2-CB 4.27Å; V314-V441 HydrophobicContact CG2-CG1 4.11Å; V339-V441 HydrophobicContact CG1-CG1 4.37Å; V339-V441 HydrophobicContact CG1-CG2 4.21Å; V341-V441 HydrophobicContact CG2-CG1 3.63Å; L366-V441 HydrophobicContact CD1-CG1 4.09Å; L368-V441 HydrophobicContact CD2-CG1 4.34Å; L368-V441 HydrophobicContact CD2-CG2 3.88Å; L368-V441 HydrophobicContact CG-CB 4.47Å; L368-V441 HydrophobicContact CG-CG1 4.12Å; L368-V441 HydrophobicContact CG-CG2 4.06Å; L439-V441 HydrophobicContact CG-CG2 4.1Å; V441-A456 WeakPolarHBondContact O-CA 3.32Å; V441-H457 PolarHBondContact N-O 2.93Å; V441-H457 PolarHBondContact O-N 2.91Å
442	A	97.2	Very high	95.1	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.2	-168.7	0	0	0	0	0	112.2	K367 A455 A456	K367-A442 PolarHBondContact N-O 2.93Å; K367-A442 PolarHBondContact O-N 3.47Å; A442-A455 CarbonylContact C-O 3.59Å; A442-A455 WeakPolarHBondContact CA-O 3.31Å; A442-A456 HydrophobicContact CB-CB 3.69Å
443	L	97.6	Very high	95.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121.1	163.7	177.4	62.4	0	0	0	109.2	Y312 I343 F364 V399 L401 V454 A455	Y312-L443 HydrophobicContact CD2-CB 4.48Å; Y312-L443 HydrophobicContact CE2-CB 3.77Å; Y312-L443 PolarHBondContact OH-N 3.47Å; I343-L443 HydrophobicContact CD1-CD1 4.21Å; I343-L443 HydrophobicContact CD1-CD2 4.39Å; I343-L443 HydrophobicContact CG2-CD2 3.86Å; F364-L443 HydrophobicContact CB-CD1 4.04Å; F364-L443 HydrophobicContact CD1-CD1 4.21Å; V399-L443 HydrophobicContact CG2-CD1 3.95Å; L401-L443 HydrophobicContact CD1-CD1 4.12Å; L401-L443 HydrophobicContact CD1-CD2 4Å; L443-V454 HydrophobicContact CD2-CB 4.24Å; L443-V454 HydrophobicContact CD2-CG1 4.2Å; L443-V454 HydrophobicContact CG-CB 4.18Å; L443-V454 PolarHBondContact O-N 2.91Å; L443-A455 PolarHBondContact N-O 3.26Å; L443-A455 PolarHBondContact O-N 3.39Å
444	H	96.1	Very high	95.2	Very high	20 Å²	20	33.3 Å²	33.3	9%	0.093	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	148.3	170.4	-71.7	-91.2	0	0	0	110.8	F364 Y365 Y452 T453	F364-H444 CarbonylContact C-O 3.57Å; F364-H444 VanDerWaalsContact CA-O 3.3Å; F364-H444 WeakPolarHBondContact CA-O 3.41Å; Y365-H444 PolarHBondContact N-O 2.77Å; Y365-H444 PolarHBondContact O-N 3.08Å; H444-Y452 CarbonylContact C-O 3.55Å; H444-Y452 WeakPolarHBondContact CA-O 3.48Å; H444-Y452 PolarHBondContact ND1-O 2.89Å; H444-T453 PolarHBondContact CE1-OG1 2.92Å; H444-T453 VanDerWaalsContact CE1-OG1 3.24Å
445	A	95.6	Very high	95.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.1	161.2	0	0	0	0	0	108.8	I352 I361 F364 Y452 V454	I352-A445 HydrophobicContact CD1-CB 3.63Å; I361-A445 HydrophobicContact CG2-CB 4.18Å; F364-A445 HydrophobicContact CD1-CB 3.83Å; F364-A445 HydrophobicContact CE1-CB 3.76Å; A445-Y452 PolarHBondContact N-O 2.88Å; A445-Y452 PolarHBondContact O-N 3.05Å; A445-V454 HydrophobicContact CB-CG2 3.68Å
446	Q	94.8	Very high	95.2	Very high	35 Å²	35	28.4 Å²	28.4	16%	0.164	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.4	174	-171.5	69.2	21.8	0	0	109.3	D362 C363 Y365 H448 S449 Q450 S451	D362-Q446 PolarHBondContact N-O 2.79Å; C363-Q446 PolarHBondContact O-N 2.79Å; Y365-Q446 HydrophobicContact CD2-CB 4.19Å; Y365-Q446 HydrophobicContact CE2-CB 3.97Å; Y365-Q446 HydrophobicContact CE2-CG 4.36Å; Q446-H448 PolarHBondContact NE2-O 3.09Å; Q446-S449 VanDerWaalsContact NE2-C 3.28Å; Q446-S449 PolarHBondContact NE2-O 2.81Å; Q446-Q450 PolarHBondContact NE2-O 2.9Å; Q446-Q450 PolarHBondContact OE1-O 2.91Å; Q446-S451 PolarHBondContact OE1-OG 2.86Å
447	S	93.2	Very high	95.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	120.8	166	160	0	0	0	0	107.9	Q359 P360 D362 S449 Q450	Q359-S447 WeakPolarHBondContact CB-OG 3.39Å; Q359-S447 PolarHBondContact OE1-OG 3.47Å; P360-S447 VanDerWaalsContact O-CB 3.25Å; P360-S447 WeakPolarHBondContact O-CB 3.47Å; P360-S447 PolarHBondContact O-OG 3.33Å; D362-S447 WeakPolarHBondContact OD2-CA 3.46Å; S447-S449 PolarHBondContact O-N 2.98Å; S447-Q450 PolarHBondContact N-O 2.92Å; S447-Q450 PolarHBondContact O-N 3.08Å; S447-Q450 VanDerWaalsContact O-O 3.07Å
448	H	86.9	Confident	95.2	Very high	125 Å²	125	28.1 Å²	28.1	58%	0.579	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	-121.2	-175.7	-54.3	72.8	0	0	0	110.4	D362 Q446	D362-H448 PolarHBondContact OD2-N 3.15Å; Q446-H448 PolarHBondContact NE2-O 3.09Å
449	S	86.1	Confident	95.2	Very high	111 Å²	111	27 Å²	27	78%	0.776	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.3	177.2	56.4	0	0	0	0	114.5	Q446 S447	Q446-S449 VanDerWaalsContact NE2-C 3.28Å; Q446-S449 PolarHBondContact NE2-O 2.81Å; S447-S449 PolarHBondContact O-N 2.98Å
450	Q	91.4	Very high	95.1	Very high	85 Å²	85	29.4 Å²	29.4	40%	0.397	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	151.2	-172.3	-63.4	-168	52.3	0	0	113	Q446 S447 Y452	Q446-Q450 PolarHBondContact NE2-O 2.9Å; Q446-Q450 PolarHBondContact OE1-O 2.91Å; S447-Q450 PolarHBondContact N-O 2.92Å; S447-Q450 PolarHBondContact O-N 3.08Å; S447-Q450 VanDerWaalsContact O-O 3.07Å; Q450-Y452 HydrophobicContact CB-CE1 4.41Å; Q450-Y452 HydrophobicContact CB-CE2 3.7Å; Q450-Y452 VanDerWaalsContact CB-OH 3.29Å; Q450-Y452 WeakPolarHBondContact CB-OH 3.36Å; Q450-Y452 PolarHBondContact OE1-OH 3.15Å
451	S	93.4	Very high	95.1	Very high	61 Å²	61	33.9 Å²	33.9	43%	0.427	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	114.6	-173.5	-146.5	0	0	0	0	110.6	Q446	Q446-S451 PolarHBondContact OE1-OG 2.86Å
452	Y	94.6	Very high	95	Very high	36 Å²	36	33.9 Å²	33.9	14%	0.141	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.1	-170	-58.6	-77.5	0	0	0	110.6	I352 T354 H444 A445 Q450 V454	I352-Y452 HydrophobicContact CD1-CD2 4.28Å; I352-Y452 HydrophobicContact CD1-CG 4.24Å; I352-Y452 HydrophobicContact CG2-CD2 4.29Å; T354-Y452 HydrophobicContact CG2-CD2 4.31Å; T354-Y452 HydrophobicContact CG2-CE1 4.01Å; T354-Y452 HydrophobicContact CG2-CE2 3.7Å; H444-Y452 CarbonylContact C-O 3.55Å; H444-Y452 WeakPolarHBondContact CA-O 3.48Å; H444-Y452 PolarHBondContact ND1-O 2.89Å; A445-Y452 PolarHBondContact N-O 2.88Å; A445-Y452 PolarHBondContact O-N 3.05Å; Q450-Y452 HydrophobicContact CB-CE1 4.41Å; Q450-Y452 HydrophobicContact CB-CE2 3.7Å; Q450-Y452 VanDerWaalsContact CB-OH 3.29Å; Q450-Y452 WeakPolarHBondContact CB-OH 3.36Å; Q450-Y452 PolarHBondContact OE1-OH 3.15Å; Y452-V454 PolarHBondContact O-N 3.25Å
453	T	95.7	Very high	95	Very high	39 Å²	39	33.7 Å²	33.7	24%	0.239	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.3	178.4	-52.1	0	0	0	0	109.7	W296 T297 H444 A456	W296-T453 CarbonylContact C-O 3.53Å; W296-T453 WeakPolarHBondContact CA-O 3.45Å; T297-T453 PolarHBondContact N-O 3.28Å; T297-T453 PolarHBondContact OG1-O 2.83Å; H444-T453 PolarHBondContact CE1-OG1 2.92Å; H444-T453 VanDerWaalsContact CE1-OG1 3.24Å; T453-A456 HydrophobicContact CG2-CB 3.98Å
454	V	95.7	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-50.1	174.7	179.2	0	0	0	0	110.2	W296 L299 M309 P310 I352 F364 L443 A445 Y452	W296-V454 WeakPolarHBondContact CB-O 3.37Å; L299-V454 HydrophobicContact CD1-CG1 3.85Å; L299-V454 HydrophobicContact CD2-CG1 4.25Å; L299-V454 HydrophobicContact CD2-CG2 3.9Å; L299-V454 HydrophobicContact CG-CG1 4.01Å; M309-V454 VanDerWaalsContact SD-O 3.41Å; P310-V454 HydrophobicContact CG-CG1 3.86Å; I352-V454 HydrophobicContact CD1-CG2 4.4Å; F364-V454 HydrophobicContact CE1-CG2 4.34Å; L443-V454 HydrophobicContact CD2-CB 4.24Å; L443-V454 HydrophobicContact CD2-CG1 4.2Å; L443-V454 HydrophobicContact CG-CB 4.18Å; L443-V454 PolarHBondContact O-N 2.91Å; A445-V454 HydrophobicContact CB-CG2 3.68Å; Y452-V454 PolarHBondContact O-N 3.25Å
455	A	96.9	Very high	94.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	144.7	176.1	0	0	0	0	0	109.5	W296 Y312 A442 L443	W296-A455 HydrophobicContact CE3-CB 4.2Å; W296-A455 HydrophobicContact CZ3-CB 4.16Å; Y312-A455 HydrophobicContact CD1-CB 4.16Å; Y312-A455 HydrophobicContact CD2-CB 3.97Å; Y312-A455 HydrophobicContact CE2-CB 4.44Å; Y312-A455 HydrophobicContact CG-CB 3.8Å; A442-A455 CarbonylContact C-O 3.59Å; A442-A455 WeakPolarHBondContact CA-O 3.31Å; L443-A455 PolarHBondContact N-O 3.26Å; L443-A455 PolarHBondContact O-N 3.39Å
456	A	97.3	Very high	94.3	Very high	3 Å²	3	36 Å²	36	3%	0.025	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	142	175.7	0	0	0	0	0	111.5	H291 W296 V441 A442 T453	H291-A456 HydrophobicContact CB-CB 4.13Å; H291-A456 PolarHBondContact N-O 3.4Å; W296-A456 WeakPolarHBondContact CZ2-O 3.42Å; V441-A456 WeakPolarHBondContact O-CA 3.32Å; A442-A456 HydrophobicContact CB-CB 3.69Å; T453-A456 HydrophobicContact CG2-CB 3.98Å
457	H	97.9	Very high	93.2	Very high	29 Å²	29	35.2 Å²	35.2	13%	0.134	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.8	171.7	-79.2	23.3	0	0	0	110.6	W288 Q289 Y312 V314 V440 V441	W288-H457 HydrophobicContact CB-CB 4.46Å; W288-H457 HydrophobicContact CE3-CB 4.16Å; Q289-H457 CarbonylContact O-C 3.57Å; Q289-H457 VanDerWaalsContact O-CA 3.27Å; Q289-H457 WeakPolarHBondContact O-CA 3.28Å; Y312-H457 AromaticContact CD1-CE1 3.99Å; Y312-H457 AromaticContact CD1-CG 3.98Å; Y312-H457 AromaticContact CD1-ND1 3.71Å; Y312-H457 HydrophobicContact CE1-CB 4.27Å; V314-H457 HydrophobicContact CG2-CB 4.01Å; V440-H457 WeakPolarHBondContact CA-O 3.29Å; V441-H457 PolarHBondContact N-O 2.93Å; V441-H457 PolarHBondContact O-N 2.91Å
458	V	97.8	Very high	91.5	Very high	13 Å²	13	40 Å²	40	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.7	176.8	62.8	0	0	0	0	109.6	W288 Q289 H291 M438 L439 V440	W288-V458 WeakPolarHBondContact CA-O 3.34Å; Q289-V458 HydrophobicContact CB-CG1 4.5Å; Q289-V458 PolarHBondContact N-O 3.25Å; Q289-V458 PolarHBondContact O-N 2.87Å; H291-V458 HydrophobicContact CB-CB 3.9Å; H291-V458 HydrophobicContact CB-CG1 3.93Å; M438-V458 HydrophobicContact CB-CG2 3.47Å; M438-V458 VanDerWaalsContact CB-CG2 3.47Å; M438-V458 HydrophobicContact CE-CG2 4.11Å; M438-V458 HydrophobicContact CG-CG2 4.25Å; M438-V458 HydrophobicContact SD-CG2 3.99Å; L439-V458 WeakPolarHBondContact O-CA 3.45Å; V440-V458 HydrophobicContact CG2-CB 4.2Å; V440-V458 HydrophobicContact CG2-CG2 3.87Å
459	S	97.9	Very high	89.9	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	166.8	175.5	73.3	0	0	0	0	112.1	K287 M438 L439 I462	K287-S459 WeakPolarHBondContact O-CA 3.36Å; M438-S459 WeakPolarHBondContact CG-O 3.47Å; L439-S459 PolarHBondContact N-OG 3.27Å; L439-S459 PolarHBondContact O-N 3.22Å; S459-I462 VanDerWaalsContact OG-CD1 3.29Å; S459-I462 WeakPolarHBondContact OG-CD1 3.23Å
460	E	96.1	Very high	88.1	Confident	50 Å²	50	34.3 Å²	34.3	23%	0.234	21%	0.205	C	C	.	.	S	Bend	trans	-64.1	-178.5	157.9	70.9	-169.9	106.1	0	0	113.2	I286 K287 F329	I286-E460 HydrophobicContact CG2-CG 4.49Å; K287-E460 WeakPolarHBondContact CB-OE1 3.4Å; K287-E460 PolarHBondContact N-OE1 2.55Å; K287-E460 PolarHBondContact O-N 2.94Å; K287-E460 VanDerWaalsContact O-N 3.08Å; F329-E460 VanDerWaalsContact CD2-CD 3.5Å; F329-E460 HydrophobicContact CD2-CG 3.83Å; F329-E460 VanDerWaalsContact CE2-CD 3.43Å; F329-E460 HydrophobicContact CE2-CG 4.22Å; F329-E460 VanDerWaalsContact CE2-OE1 3.28Å; F329-E460 WeakPolarHBondContact CE2-OE1 3.45Å
461	R	96.6	Very high	85.9	Confident	96 Å²	96	36.7 Å²	36.7	36%	0.362	22%	0.216	S	C	.	.			trans	-68.8	129.4	-173.6	65.8	-179.7	177.9	-152.1	-11.4	113	D327 A328 F329 Y436	D327-R461 VanDerWaalsContact O-CZ 3.23Å; D327-R461 PolarHBondContact O-NE 3.4Å; D327-R461 PolarHBondContact O-NH2 2.84Å; D327-R461 IonicContact OD1-NH2 3.16Å; D327-R461 IonicContact OD2-CZ 3.29Å; D327-R461 IonicContact OD2-NH2 2.62Å; D327-R461 PolarHBondContact OD2-NH2 2.95Å; A328-R461 HydrophobicContact CB-CG 4.1Å; F329-R461 PolarHBondContact N-O 2.82Å; Y436-R461 HydrophobicContact CD1-CB 3.85Å; Y436-R461 HydrophobicContact CD1-CG 4.06Å; Y436-R461 HydrophobicContact CE1-CG 4.34Å; Y436-R461 HydrophobicContact CG-CB 4Å
462	I	97.2	Very high	83.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132	-179.2	-61.9	159.6	0	0	0	110.4	I286 F320 F329 F416 Y436 F437 L439 S459 V464	I286-I462 HydrophobicContact CD1-CD1 4.19Å; I286-I462 HydrophobicContact CD1-CG1 4.32Å; F320-I462 HydrophobicContact CD1-CD1 4.31Å; F320-I462 HydrophobicContact CD1-CG1 4.45Å; F320-I462 HydrophobicContact CD1-CG2 4.18Å; F320-I462 HydrophobicContact CE1-CD1 3.79Å; F320-I462 HydrophobicContact CE1-CG1 4.36Å; F320-I462 HydrophobicContact CE1-CG2 4.08Å; F320-I462 HydrophobicContact CZ-CD1 4.45Å; F329-I462 HydrophobicContact CB-CG1 4.27Å; F329-I462 CarbonylContact O-C 3.58Å; F329-I462 WeakPolarHBondContact O-CA 3.39Å; F416-I462 HydrophobicContact CE2-CG2 4.42Å; F416-I462 HydrophobicContact CZ-CD1 4.41Å; Y436-I462 WeakPolarHBondContact CA-O 3.31Å; F437-I462 PolarHBondContact N-O 2.87Å; F437-I462 PolarHBondContact O-N 3.5Å; L439-I462 HydrophobicContact CB-CD1 4.18Å; S459-I462 VanDerWaalsContact OG-CD1 3.29Å; S459-I462 WeakPolarHBondContact OG-CD1 3.23Å; I462-V464 HydrophobicContact CG2-CG2 4.19Å
463	I	96.3	Very high	81.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.7	165.9	-57.6	179.3	0	0	0	108.7	D326 A328 F329 V330 C331 N423 Q434 Y436 R465	D326-I463 HydrophobicContact CB-CD1 3.87Å; A328-I463 HydrophobicContact CB-CD1 4.01Å; A328-I463 HydrophobicContact CB-CG1 4.1Å; F329-I463 PolarHBondContact O-N 3.34Å; V330-I463 WeakPolarHBondContact CA-O 3.39Å; V330-I463 HydrophobicContact CG2-CB 4.3Å; C331-I463 PolarHBondContact N-O 2.82Å; N423-I463 WeakPolarHBondContact OD1-CG2 3.45Å; Q434-I463 HydrophobicContact CG-CD1 4Å; Q434-I463 HydrophobicContact CG-CG1 4.36Å; Y436-I463 HydrophobicContact CD1-CD1 4.45Å; Y436-I463 HydrophobicContact CD1-CG1 3.71Å; Y436-I463 HydrophobicContact CE1-CD1 3.9Å; Y436-I463 HydrophobicContact CE1-CG1 3.67Å; I463-R465 HydrophobicContact CG2-CG 3.99Å
464	V	96	Very high	79.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	101.4	177.9	-172	0	0	0	0	109.9	C331 K333 F416 T419 T420 N423 F437 I462	C331-V464 WeakPolarHBondContact O-CA 3.18Å; K333-V464 HydrophobicContact CB-CG1 4.09Å; K333-V464 HydrophobicContact CG-CG1 4.38Å; F416-V464 HydrophobicContact CB-CG1 4.14Å; F416-V464 HydrophobicContact CB-CG2 4.36Å; F416-V464 HydrophobicContact CD2-CG1 4.19Å; F416-V464 HydrophobicContact CD2-CG2 3.59Å; F416-V464 HydrophobicContact CE2-CG2 4.01Å; F416-V464 HydrophobicContact CG-CG2 3.97Å; T419-V464 WeakPolarHBondContact CA-O 3.19Å; T419-V464 VanDerWaalsContact CB-O 3.28Å; T419-V464 WeakPolarHBondContact CB-O 3.18Å; T420-V464 HydrophobicContact CG2-CB 4.36Å; T420-V464 HydrophobicContact CG2-CG2 4.25Å; T420-V464 PolarHBondContact N-O 2.82Å; T420-V464 PolarHBondContact OG1-N 2.95Å; T420-V464 PolarHBondContact OG1-O 2.85Å; N423-V464 PolarHBondContact ND2-O 3.44Å; F437-V464 HydrophobicContact CD2-CB 4.4Å; F437-V464 HydrophobicContact CD2-CG2 3.5Å; F437-V464 HydrophobicContact CE2-CB 4.31Å; F437-V464 HydrophobicContact CE2-CG2 3.89Å; F437-V464 HydrophobicContact CG-CG2 4.43Å; I462-V464 HydrophobicContact CG2-CG2 4.19Å
465	R	92.3	Very high	76.8	Confident	9 Å²	9	46.7 Å²	46.7	3%	0.034	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	155.2	-179	-65.8	-176	173.7	147.4	3.5	112.3	D326 V330 C331 Q332 K333 I463 E473	D326-R465 IonicContact OD1-NH2 3.62Å; D326-R465 PolarHBondContact OD1-NH2 2.79Å; D326-R465 VanDerWaalsContact OD1-NH2 3.16Å; D326-R465 IonicContact OD2-CZ 3.67Å; D326-R465 IonicContact OD2-NH1 3.35Å; D326-R465 IonicContact OD2-NH2 3.83Å; D326-R465 PolarHBondContact OD2-NH2 2.87Å; V330-R465 HydrophobicContact CG1-CG 4.03Å; C331-R465 PolarHBondContact O-N 3.3Å; Q332-R465 CarbonylContact C-O 3.48Å; Q332-R465 WeakPolarHBondContact CA-O 3.29Å; K333-R465 PolarHBondContact N-O 2.97Å; I463-R465 HydrophobicContact CG2-CG 3.99Å; R465-E473 IonicContact NH1-OE1 3.24Å; R465-E473 PolarHBondContact NH1-OE1 3.01Å; R465-E473 VanDerWaalsContact NH1-OE1 3.14Å
466	A	87	Confident	74.3	Confident	58 Å²	58	52.9 Å²	52.9	48%	0.479	30%	0.298	S	S	.	.	S	Bend	trans	-86.8	-21.1	-176.5	0	0	0	0	0	114.6	K334 T419	K334-A466 VanDerWaalsContact CE-O 3.25Å; K334-A466 WeakPolarHBondContact CE-O 3.46Å; T419-A466 HydrophobicContact CG2-CB 4.12Å
467	S	71.9	Confident	72.3	Confident	19 Å²	19	60.7 Å²	60.7	13%	0.133	33%	0.334	C	S	.	.	S	Bend	trans	-133.9	176.9	-173.4	56	0	0	0	0	111.2	Q332 Q471 F472	Q332-S467 PolarHBondContact OE1-O 3.2Å; S467-Q471 PolarHBondContact OG-OE1 2.96Å; S467-F472 WeakPolarHBondContact OG-CE2 3.45Å
468	N	57.2	Low	70.1	Confident	101 Å²	101	62.2 Å²	62.2	54%	0.54	35%	0.345	S	S	.	.			trans	-62	147.4	177.5	-98	-26	0	0	0	111.9	Q332 G470 Q471	Q332-N468 PolarHBondContact NE2-OD1 3.43Å; Q332-N468 PolarHBondContact OE1-OD1 2.81Å; Q332-N468 VanDerWaalsContact OE1-OD1 3.11Å; N468-G470 PolarHBondContact O-N 2.66Å; N468-Q471 PolarHBondContact O-N 2.62Å
469	P	51.9	Low	68.6	Low	44 Å²	44	67.4 Å²	67.4	29%	0.286	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-54	-47.6	179.4	15.2	-28.4	0	0	0	113.1	Q471 F472 E473	P469-Q471 PolarHBondContact O-N 2.77Å; P469-F472 PolarHBondContact O-N 2.83Å; P469-E473 VanDerWaalsContact CB-CD 3.41Å; P469-E473 WeakPolarHBondContact CB-OE1 3.43Å; P469-E473 WeakPolarHBondContact CB-OE2 3.42Å; P469-E473 PolarHBondContact O-N 2.93Å
470	G	48.8	Very low	67.6	Low	73 Å²	73	73.2 Å²	73.2	75%	0.753	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-65.7	22.1	177.1	0	0	0	0	0	116.7	N468	N468-G470 PolarHBondContact O-N 2.66Å
471	Q	46.2	Very low	66.7	Low	135 Å²	135	75.6 Å²	75.6	63%	0.631	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-111.1	-13	162.7	-165.7	173.3	15.8	0	0	112.5	S467 N468 P469	S467-Q471 PolarHBondContact OG-OE1 2.96Å; N468-Q471 PolarHBondContact O-N 2.62Å; P469-Q471 PolarHBondContact O-N 2.77Å
472	F	49.1	Very low	66.1	Low	73 Å²	73	79.3 Å²	79.3	32%	0.32	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.9	-4.8	-178	-65.9	-65	0	0	0	114.5	M424 R425 S467 P469 S474	M424-F472 HydrophobicContact CE-CE1 3.67Å; M424-F472 HydrophobicContact CE-CZ 3.98Å; M424-F472 HydrophobicContact SD-CD1 4.15Å; M424-F472 HydrophobicContact SD-CE1 3.8Å; R425-F472 WeakPolarHBondContact CD-O 3.46Å; R425-F472 PolarHBondContact NE-O 2.89Å; S467-F472 WeakPolarHBondContact OG-CE2 3.45Å; P469-F472 PolarHBondContact O-N 2.83Å; F472-S474 PolarHBondContact O-N 2.84Å
473	E	49.4	Very low	65.2	Low	82 Å²	82	80.2 Å²	80.2	38%	0.383	43%	0.427	S	S	.	.			trans	-83.6	88.2	158.7	-82.2	144.3	-135.2	0	0	108.7	R465 P469 D475	R465-E473 IonicContact NH1-OE1 3.24Å; R465-E473 PolarHBondContact NH1-OE1 3.01Å; R465-E473 VanDerWaalsContact NH1-OE1 3.14Å; P469-E473 VanDerWaalsContact CB-CD 3.41Å; P469-E473 WeakPolarHBondContact CB-OE1 3.43Å; P469-E473 WeakPolarHBondContact CB-OE2 3.42Å; P469-E473 PolarHBondContact O-N 2.93Å; E473-D475 PolarHBondContact O-N 3.03Å
474	S	42.8	Very low	64.6	Low	64 Å²	64	90.1 Å²	90.1	45%	0.448	47%	0.473	S	S	.	.			trans	-77.7	93	168.9	56.4	0	0	0	0	109.6	F472 N476	F472-S474 PolarHBondContact O-N 2.84Å; S474-N476 VanDerWaalsContact C-N 3.28Å; S474-N476 PolarHBondContact O-N 2.88Å
475	D	46	Very low	64.2	Low	126 Å²	126	96.1 Å²	96.1	67%	0.674	51%	0.505	S	S	*	.	S	Bend	trans	49.3	27.4	142.2	-64.2	-18.6	0	0	0	119.5	E473 E477 V478	E473-D475 PolarHBondContact O-N 3.03Å; D475-E477 VanDerWaalsContact C-N 3.33Å; D475-V478 HydrophobicContact CB-CB 4.42Å; D475-V478 HydrophobicContact CB-CG2 3.52Å; D475-V478 PolarHBondContact O-N 2.81Å
476	N	45.8	Very low	63.5	Low	131 Å²	131	100 Å²	100	70%	0.701	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-1.8	176.3	-75	-23.6	0	0	0	114.3	S474	S474-N476 VanDerWaalsContact C-N 3.28Å; S474-N476 PolarHBondContact O-N 2.88Å
477	E	53.5	Low	63.4	Low	167 Å²	167	104.4 Å²	104.4	78%	0.78	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	8.3	164.9	-74.9	-174.1	167.9	0	0	112.4	D475 L479	D475-E477 VanDerWaalsContact C-N 3.33Å; E477-L479 PolarHBondContact O-N 3.24Å
478	V	52.4	Low	64.1	Low	61 Å²	61	105.1 Å²	105.1	37%	0.37	55%	0.551	S	S	.	*			trans	-78.1	93.2	174.1	-166.6	0	0	0	0	109	D475 W480	D475-V478 HydrophobicContact CB-CB 4.42Å; D475-V478 HydrophobicContact CB-CG2 3.52Å; D475-V478 PolarHBondContact O-N 2.81Å; V478-W480 HydrophobicContact CG1-CB 4.36Å; V478-W480 WeakPolarHBondContact CG1-O 3.43Å; V478-W480 PolarHBondContact O-N 2.94Å
479	L	66.1	Low	65.5	Low	121 Å²	121	104.5 Å²	104.5	63%	0.634	55%	0.551	S	S	*	*	S	Bend	trans	-44.4	-30.7	167.9	-68.2	162.1	0	0	0	112.5	E477 H491	E477-L479 PolarHBondContact O-N 3.24Å; L479-H491 PolarHBondContact O-CD2 2.76Å
480	W	77.7	Confident	67.1	Low	128 Å²	128	106.8 Å²	106.8	49%	0.485	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.8	88.3	-176.2	-72.2	98.3	0	0	0	112.3	V478 V489 Y490 H491 V495	V478-W480 HydrophobicContact CG1-CB 4.36Å; V478-W480 WeakPolarHBondContact CG1-O 3.43Å; V478-W480 PolarHBondContact O-N 2.94Å; W480-V489 HydrophobicContact CB-CG1 3.73Å; W480-V489 HydrophobicContact CE3-CG1 4.33Å; W480-V489 WeakPolarHBondContact O-CG1 3.39Å; W480-Y490 CarbonylContact C-O 3.59Å; W480-Y490 WeakPolarHBondContact CA-O 3.1Å; W480-H491 HydrophobicContact CD2-CB 4.02Å; W480-H491 HydrophobicContact CE3-CB 3.85Å; W480-H491 HydrophobicContact CH2-CB 3.72Å; W480-H491 HydrophobicContact CZ2-CB 3.89Å; W480-H491 HydrophobicContact CZ3-CB 3.71Å; W480-V495 HydrophobicContact CH2-CG2 4.39Å; W480-V495 HydrophobicContact CZ2-CG1 4.33Å; W480-V495 HydrophobicContact CZ2-CG2 4Å
481	Q	77.6	Confident	68.8	Low	99 Å²	99	105.5 Å²	105.5	46%	0.463	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	154.6	-177.9	-62.4	177.4	10.5	0	0	111.4	G483 V489 Y490	Q481-G483 PolarHBondContact O-N 3.14Å; Q481-V489 CarbonylContact O-C 3.48Å; Q481-V489 VanDerWaalsContact O-CA 3.25Å; Q481-V489 WeakPolarHBondContact O-CA 3.48Å; Q481-V489 VanDerWaalsContact O-CG1 3.29Å; Q481-V489 WeakPolarHBondContact O-CG1 3.4Å; Q481-Y490 HydrophobicContact CB-CD1 4.13Å; Q481-Y490 HydrophobicContact CB-CE1 3.63Å; Q481-Y490 PolarHBondContact N-O 3.31Å; Q481-Y490 WeakPolarHBondContact O-CD1 3.37Å; Q481-Y490 PolarHBondContact O-N 3Å; Q481-Y490 PolarHBondContact OE1-OH 3.38Å
482	R	82	Confident	70.4	Confident	175 Å²	175	105.3 Å²	105.3	66%	0.66	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	129	170.7	-159.4	-178.4	-162.7	113.2	-0.5	109.6	P486 D487 S488 Y490	R482-P486 PolarHBondContact NE-O 3.04Å; R482-P486 PolarHBondContact NH2-O 2.88Å; R482-D487 IonicContact NH2-OD1 2.65Å; R482-S488 WeakPolarHBondContact CG-O 3.28Å; R482-Y490 WeakPolarHBondContact O-CE1 3.49Å
483	G	80.1	Confident	72	Confident	19 Å²	19	104.8 Å²	104.8	20%	0.196	54%	0.543	C	S	.	.			trans	-78.4	-176.1	179.7	0	0	0	0	0	113.1	Q481 L485 S488	Q481-G483 PolarHBondContact O-N 3.14Å; G483-L485 VanDerWaalsContact C-N 3.32Å; G483-L485 PolarHBondContact O-N 3.01Å; G483-S488 VanDerWaalsContact C-OG 3.25Å; G483-S488 WeakPolarHBondContact CA-OG 3.35Å; G483-S488 PolarHBondContact N-O 3.19Å
484	Q	82.4	Confident	73.9	Confident	207 Å²	207	108.2 Å²	108.2	97%	0.967	55%	0.553	S	S	*	*	S	Bend	trans	-72.8	-22.4	-177.6	-62.9	-176.1	6.1	0	0	113.7
485	L	88.9	Confident	76.1	Confident	127 Å²	127	106.3 Å²	106.3	67%	0.665	54%	0.538	S	S	*	.	S	Bend	trans	-87.6	144.7	174.5	-64.8	170.2	0	0	0	110	G483 D487 S488	G483-L485 VanDerWaalsContact C-N 3.32Å; G483-L485 PolarHBondContact O-N 3.01Å; L485-D487 VanDerWaalsContact C-N 3.28Å; L485-D487 PolarHBondContact O-N 3.46Å; L485-D487 VanDerWaalsContact O-N 3.08Å; L485-S488 PolarHBondContact N-OG 3.46Å; L485-S488 VanDerWaalsContact N-OG 3.15Å; L485-S488 PolarHBondContact O-N 2.93Å; L485-S488 PolarHBondContact O-OG 2.89Å
486	P	76.7	Confident	78.2	Confident	91 Å²	91	101.9 Å²	101.9	59%	0.591	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-46	-173.9	-32.1	36.4	0	0	0	114.5	R482	R482-P486 PolarHBondContact NE-O 3.04Å; R482-P486 PolarHBondContact NH2-O 2.88Å
487	D	85	Confident	80.2	Confident	150 Å²	150	99.6 Å²	99.6	80%	0.802	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	22.1	-174.6	-55	-52.9	0	0	0	113.4	R482 L485	R482-D487 IonicContact NH2-OD1 2.65Å; L485-D487 VanDerWaalsContact C-N 3.28Å; L485-D487 PolarHBondContact O-N 3.46Å; L485-D487 VanDerWaalsContact O-N 3.08Å
488	S	86.1	Confident	81.5	Confident	33 Å²	33	96.6 Å²	96.6	23%	0.231	51%	0.506	C	S	.	.			trans	-94.2	144.8	176.5	64.7	0	0	0	0	113.1	R482 G483 L485	R482-S488 WeakPolarHBondContact CG-O 3.28Å; G483-S488 VanDerWaalsContact C-OG 3.25Å; G483-S488 WeakPolarHBondContact CA-OG 3.35Å; G483-S488 PolarHBondContact N-O 3.19Å; L485-S488 PolarHBondContact N-OG 3.46Å; L485-S488 VanDerWaalsContact N-OG 3.15Å; L485-S488 PolarHBondContact O-N 2.93Å; L485-S488 PolarHBondContact O-OG 2.89Å
489	V	87.1	Confident	82.8	Confident	88 Å²	88	94.9 Å²	94.9	53%	0.533	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.1	172.3	-171.7	0	0	0	0	107.7	W480 Q481	W480-V489 HydrophobicContact CB-CG1 3.73Å; W480-V489 HydrophobicContact CE3-CG1 4.33Å; W480-V489 WeakPolarHBondContact O-CG1 3.39Å; Q481-V489 CarbonylContact O-C 3.48Å; Q481-V489 VanDerWaalsContact O-CA 3.25Å; Q481-V489 WeakPolarHBondContact O-CA 3.48Å; Q481-V489 VanDerWaalsContact O-CG1 3.29Å; Q481-V489 WeakPolarHBondContact O-CG1 3.4Å
490	Y	84.6	Confident	83.4	Confident	92 Å²	92	96.1 Å²	96.1	36%	0.361	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152.1	-171	77.7	-60	0	0	0	113.2	W480 Q481 R482 H492	W480-Y490 CarbonylContact C-O 3.59Å; W480-Y490 WeakPolarHBondContact CA-O 3.1Å; Q481-Y490 HydrophobicContact CB-CD1 4.13Å; Q481-Y490 HydrophobicContact CB-CE1 3.63Å; Q481-Y490 PolarHBondContact N-O 3.31Å; Q481-Y490 WeakPolarHBondContact O-CD1 3.37Å; Q481-Y490 PolarHBondContact O-N 3Å; Q481-Y490 PolarHBondContact OE1-OH 3.38Å; R482-Y490 WeakPolarHBondContact O-CE1 3.49Å; Y490-H492 AromaticContact CE2-CE1 3.26Å; Y490-H492 WeakPolarHBondContact CE2-CE1 3.45Å; Y490-H492 AromaticContact CE2-ND1 3.76Å; Y490-H492 AromaticContact CE2-NE2 3.64Å; Y490-H492 AromaticContact CZ-CE1 3.63Å; Y490-H492 PolarHBondContact OH-CE1 2.92Å
491	H	85.6	Confident	83.5	Confident	46 Å²	46	99.6 Å²	99.6	21%	0.213	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	145.9	177.2	-173.3	-91.5	0	0	0	110.2	L479 W480 G493 V495	L479-H491 PolarHBondContact O-CD2 2.76Å; W480-H491 HydrophobicContact CD2-CB 4.02Å; W480-H491 HydrophobicContact CE3-CB 3.85Å; W480-H491 HydrophobicContact CH2-CB 3.72Å; W480-H491 HydrophobicContact CZ2-CB 3.89Å; W480-H491 HydrophobicContact CZ3-CB 3.71Å; H491-G493 PolarHBondContact ND1-O 3.42Å; H491-V495 HydrophobicContact CB-CG2 4.06Å; H491-V495 WeakPolarHBondContact ND1-CG2 3.36Å
492	H	79.3	Confident	83.9	Confident	132 Å²	132	95.8 Å²	95.8	61%	0.611	50%	0.5	S	S	*	.	S	Bend	trans	-104.4	115.8	171.4	-78.9	112.6	0	0	0	110.2	Y490	Y490-H492 AromaticContact CE2-CE1 3.26Å; Y490-H492 WeakPolarHBondContact CE2-CE1 3.45Å; Y490-H492 AromaticContact CE2-ND1 3.76Å; Y490-H492 AromaticContact CE2-NE2 3.64Å; Y490-H492 AromaticContact CZ-CE1 3.63Å; Y490-H492 PolarHBondContact OH-CE1 2.92Å
493	G	84	Confident	83.8	Confident	62 Å²	62	92.6 Å²	92.6	64%	0.639	50%	0.496	S	S	*	.	S	Bend	trans	98.8	179.9	-178.3	0	0	0	0	0	113.2	H491	H491-G493 PolarHBondContact ND1-O 3.42Å
494	R	87.9	Confident	84.1	Confident	154 Å²	154	97.9 Å²	97.9	58%	0.581	52%	0.516	S	S	*	.			trans	-69.4	142.6	-174.2	-58.4	-166.5	-62.3	-98.1	7.2	112	P502 D503 E504 A505	R494-P502 HydrophobicContact CB-CB 4.13Å; R494-P502 HydrophobicContact CB-CG 3.88Å; R494-P502 PolarHBondContact NE-O 3.16Å; R494-P502 PolarHBondContact NH2-O 2.86Å; R494-D503 WeakPolarHBondContact CD-O 3.39Å; R494-D503 PolarHBondContact NE-O 3.2Å; R494-E504 WeakPolarHBondContact CB-O 3.43Å; R494-E504 VanDerWaalsContact CD-O 3.27Å; R494-E504 WeakPolarHBondContact CD-O 3.13Å; R494-E504 WeakPolarHBondContact CG-O 3.36Å; R494-A505 WeakPolarHBondContact CA-O 3.4Å
495	V	90.4	Very high	84.4	Confident	24 Å²	24	91.3 Å²	91.3	15%	0.145	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.9	179.5	178.5	0	0	0	0	109.7	W480 H491 I497 A505 L506 V507	W480-V495 HydrophobicContact CH2-CG2 4.39Å; W480-V495 HydrophobicContact CZ2-CG1 4.33Å; W480-V495 HydrophobicContact CZ2-CG2 4Å; H491-V495 HydrophobicContact CB-CG2 4.06Å; H491-V495 WeakPolarHBondContact ND1-CG2 3.36Å; V495-I497 HydrophobicContact CG1-CG1 4.33Å; V495-A505 PolarHBondContact N-O 3.37Å; V495-L506 HydrophobicContact CB-CD1 3.87Å; V495-L506 HydrophobicContact CG1-CD1 3.78Å; V495-L506 WeakPolarHBondContact O-CA 3.35Å; V495-V507 PolarHBondContact O-N 3.37Å
496	G	88.8	Confident	84.5	Confident	32 Å²	32	90.5 Å²	90.5	33%	0.33	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.5	170.3	0	0	0	0	0	111	T499	G496-T499 CarbonylContact C-O 3.59Å; G496-T499 WeakPolarHBondContact CA-O 3.45Å
497	I	88.3	Confident	85	Confident	84 Å²	84	87.2 Å²	87.2	43%	0.431	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.5	169.2	-56.5	-176.2	0	0	0	107.2	V495 T499 L506 V507 V508 H509	V495-I497 HydrophobicContact CG1-CG1 4.33Å; I497-T499 PolarHBondContact O-N 2.91Å; I497-T499 VanDerWaalsContact O-N 3.15Å; I497-L506 HydrophobicContact CD1-CD1 4.21Å; I497-L506 HydrophobicContact CG1-CD1 4.38Å; I497-V507 PolarHBondContact N-O 3.21Å; I497-V508 HydrophobicContact CB-CB 4.36Å; I497-V508 HydrophobicContact CB-CG1 4.05Å; I497-V508 HydrophobicContact CB-CG2 4.11Å; I497-V508 HydrophobicContact CD1-CG2 4.05Å; I497-V508 HydrophobicContact CG1-CG2 4.32Å; I497-V508 HydrophobicContact CG2-CG1 4.08Å; I497-H509 PolarHBondContact O-N 2.78Å
498	S	81.8	Confident	85.2	Confident	103 Å²	103	82.3 Å²	82.3	72%	0.72	45%	0.446	S	S	*	.	S	Bend	trans	59.8	12.7	-171.5	-55.2	0	0	0	0	115.4	H509	S498-H509 VanDerWaalsContact CB-O 3.28Å; S498-H509 WeakPolarHBondContact CB-O 3.29Å
499	T	78.7	Confident	84.9	Confident	25 Å²	25	84.1 Å²	84.1	15%	0.153	45%	0.451	C	S	.	.			trans	-139.1	139.8	174.5	179.7	0	0	0	0	110.5	G496 I497 R501 V507	G496-T499 CarbonylContact C-O 3.59Å; G496-T499 WeakPolarHBondContact CA-O 3.45Å; I497-T499 PolarHBondContact O-N 2.91Å; I497-T499 VanDerWaalsContact O-N 3.15Å; T499-R501 PolarHBondContact OG1-N 3.14Å; T499-V507 HydrophobicContact CG2-CB 4.13Å; T499-V507 HydrophobicContact CG2-CG1 3.93Å
500	D	79	Confident	84.4	Confident	147 Å²	147	81.5 Å²	81.5	79%	0.786	44%	0.441	S	S	*	.	S	Bend	trans	-92.6	-6.5	175.6	68.1	-40.5	0	0	0	112.7	P502	D500-P502 VanDerWaalsContact C-CD 3.41Å; D500-P502 WeakPolarHBondContact O-CD 3.43Å
501	R	80.3	Confident	84.1	Confident	202 Å²	202	83.5 Å²	83.5	76%	0.762	46%	0.458	S	S	*	.			trans	-126.6	59.2	-175.7	-60.2	176.9	71.8	84.2	-0.6	112.3	T499 D503	T499-R501 PolarHBondContact OG1-N 3.14Å; R501-D503 PolarHBondContact O-N 2.74Å
502	P	85.3	Confident	84.1	Confident	19 Å²	19	86.1 Å²	86.1	12%	0.123	48%	0.477	C	S	.	.			trans	-62	131.1	172.2	28.7	-35.3	0	0	0	110.2	R494 D500 V507	R494-P502 HydrophobicContact CB-CB 4.13Å; R494-P502 HydrophobicContact CB-CG 3.88Å; R494-P502 PolarHBondContact NE-O 3.16Å; R494-P502 PolarHBondContact NH2-O 2.86Å; D500-P502 VanDerWaalsContact C-CD 3.41Å; D500-P502 WeakPolarHBondContact O-CD 3.43Å; P502-V507 HydrophobicContact CB-CB 3.93Å; P502-V507 HydrophobicContact CB-CG2 3.61Å
503	D	79.6	Confident	84.5	Confident	108 Å²	108	87.8 Å²	87.8	58%	0.578	48%	0.483	S	S	*	.	S	Bend	trans	-86.4	-46.6	170.4	57.9	-21.3	0	0	0	110.9	R494 R501 V507	R494-D503 WeakPolarHBondContact CD-O 3.39Å; R494-D503 PolarHBondContact NE-O 3.2Å; R501-D503 PolarHBondContact O-N 2.74Å; D503-V507 VanDerWaalsContact OD1-CG2 3.24Å; D503-V507 WeakPolarHBondContact OD1-CG2 3.21Å
504	E	86.9	Confident	84.6	Confident	129 Å²	129	89 Å²	89	60%	0.603	48%	0.478	S	S	*	.	S	Bend	trans	-92	169.6	178	-81.8	-68.1	-178.4	0	0	114.3	R494 L506 V507	R494-E504 WeakPolarHBondContact CB-O 3.43Å; R494-E504 VanDerWaalsContact CD-O 3.27Å; R494-E504 WeakPolarHBondContact CD-O 3.13Å; R494-E504 WeakPolarHBondContact CG-O 3.36Å; E504-L506 VanDerWaalsContact C-N 3.25Å; E504-L506 PolarHBondContact O-N 3.36Å; E504-V507 HydrophobicContact CB-CG2 3.98Å
505	A	88.8	Confident	84.4	Confident	69 Å²	69	90.1 Å²	90.1	57%	0.57	49%	0.492	S	S	*	.	S	Bend	trans	-56.3	-35	-176.3	0	0	0	0	0	114.3	R494 V495	R494-A505 WeakPolarHBondContact CA-O 3.4Å; V495-A505 PolarHBondContact N-O 3.37Å
506	L	91.3	Very high	84.3	Confident	110 Å²	110	91.7 Å²	91.7	58%	0.576	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	124.3	171.2	172.4	63.3	0	0	0	108.4	V495 I497 E504 V508	V495-L506 HydrophobicContact CB-CD1 3.87Å; V495-L506 HydrophobicContact CG1-CD1 3.78Å; V495-L506 WeakPolarHBondContact O-CA 3.35Å; I497-L506 HydrophobicContact CD1-CD1 4.21Å; I497-L506 HydrophobicContact CG1-CD1 4.38Å; E504-L506 VanDerWaalsContact C-N 3.25Å; E504-L506 PolarHBondContact O-N 3.36Å; L506-V508 HydrophobicContact CD1-CG2 4.38Å; L506-V508 HydrophobicContact CG-CG2 4.47Å
507	V	87.1	Confident	84.1	Confident	22 Å²	22	94.6 Å²	94.6	13%	0.133	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.2	179.1	-173.9	0	0	0	0	109.1	V495 I497 T499 P502 D503 E504	V495-V507 PolarHBondContact O-N 3.37Å; I497-V507 PolarHBondContact N-O 3.21Å; T499-V507 HydrophobicContact CG2-CB 4.13Å; T499-V507 HydrophobicContact CG2-CG1 3.93Å; P502-V507 HydrophobicContact CB-CB 3.93Å; P502-V507 HydrophobicContact CB-CG2 3.61Å; D503-V507 VanDerWaalsContact OD1-CG2 3.24Å; D503-V507 WeakPolarHBondContact OD1-CG2 3.21Å; E504-V507 HydrophobicContact CB-CG2 3.98Å
508	V	88.4	Confident	84.1	Confident	48 Å²	48	96 Å²	96	29%	0.291	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	113.5	-179.6	-171.9	0	0	0	0	109.6	I497 L506 G510 V512	I497-V508 HydrophobicContact CB-CB 4.36Å; I497-V508 HydrophobicContact CB-CG1 4.05Å; I497-V508 HydrophobicContact CB-CG2 4.11Å; I497-V508 HydrophobicContact CD1-CG2 4.05Å; I497-V508 HydrophobicContact CG1-CG2 4.32Å; I497-V508 HydrophobicContact CG2-CG1 4.08Å; L506-V508 HydrophobicContact CD1-CG2 4.38Å; L506-V508 HydrophobicContact CG-CG2 4.47Å; V508-G510 WeakPolarHBondContact CG1-O 3.45Å; V508-G510 PolarHBondContact O-N 2.89Å; V508-V512 HydrophobicContact CB-CG2 3.86Å; V508-V512 HydrophobicContact CG1-CG2 3.79Å; V508-V512 HydrophobicContact CG2-CG2 3.82Å
509	H	79.5	Confident	84.3	Confident	71 Å²	71	96.3 Å²	96.3	33%	0.329	53%	0.533	S	S	.	.	S	Bend	trans	-84.8	83.8	168.3	-76.4	-146.7	0	0	0	108.5	I497 S498	I497-H509 PolarHBondContact O-N 2.78Å; S498-H509 VanDerWaalsContact CB-O 3.28Å; S498-H509 WeakPolarHBondContact CB-O 3.29Å
510	G	76.7	Confident	84.8	Confident	32 Å²	32	98.7 Å²	98.7	33%	0.33	54%	0.542	S	S	.	.	S	Bend	trans	140.6	-177.5	179.4	0	0	0	0	0	113.8	V508 V512	V508-G510 WeakPolarHBondContact CG1-O 3.45Å; V508-G510 PolarHBondContact O-N 2.89Å; G510-V512 PolarHBondContact O-N 2.87Å
511	N	78.8	Confident	85.3	Confident	135 Å²	135	97.4 Å²	97.4	72%	0.722	54%	0.542	S	S	*	.			trans	-74.1	125.2	-169.1	-62	-28.2	0	0	0	113.3
512	V	85.8	Confident	85.8	Confident	101 Å²	101	91.8 Å²	91.8	61%	0.612	53%	0.534	S	S	*	.			trans	-96.2	108.7	173.2	-179.5	0	0	0	0	109.9	V508 G510 V514	V508-V512 HydrophobicContact CB-CG2 3.86Å; V508-V512 HydrophobicContact CG1-CG2 3.79Å; V508-V512 HydrophobicContact CG2-CG2 3.82Å; G510-V512 PolarHBondContact O-N 2.87Å; V512-V514 HydrophobicContact CG1-CG2 4.01Å; V512-V514 PolarHBondContact O-N 2.66Å
513	K	87.5	Confident	86.3	Confident	166 Å²	166	94.1 Å²	94.1	72%	0.722	55%	0.545	S	S	*	.			trans	-86.7	102.2	172.9	-176.5	169.7	-179.1	167.1	0	111	M515	K513-M515 HydrophobicContact CG-CG 4.49Å
514	V	85.9	Confident	87	Confident	89 Å²	89	94.9 Å²	94.9	54%	0.539	55%	0.548	S	S	.	.			trans	-85.8	138.8	170.2	-160.6	0	0	0	0	109.3	V512 G516	V512-V514 HydrophobicContact CG1-CG2 4.01Å; V512-V514 PolarHBondContact O-N 2.66Å; V514-G516 VanDerWaalsContact CG1-O 3.25Å; V514-G516 WeakPolarHBondContact CG1-O 3.44Å
515	M	83.9	Confident	87.5	Confident	177 Å²	177	98.9 Å²	98.9	87%	0.872	56%	0.557	S	S	*	*	S	Bend	trans	-117.2	13.2	176.4	-72.3	-174.7	57.9	0	0	113.3	K513	K513-M515 HydrophobicContact CG-CG 4.49Å
516	G	89.1	Confident	87.7	Confident	56 Å²	56	99.7 Å²	99.7	58%	0.577	56%	0.564	S	S	*	*	S	Bend	trans	-145.1	-156.6	170.8	0	0	0	0	0	108.3	V514	V514-G516 VanDerWaalsContact CG1-O 3.25Å; V514-G516 WeakPolarHBondContact CG1-O 3.44Å
517	S	83.9	Confident	88	Confident	94 Å²	94	100 Å²	100	66%	0.657	56%	0.561	S	S	*	*			trans	-92.2	146.4	177.2	49.7	0	0	0	0	113.2
518	L	87.1	Confident	88.3	Confident	112 Å²	112	106.6 Å²	106.6	59%	0.586	59%	0.59	S	S	*	*			trans	-80.6	134.1	154.7	-173.6	61.3	0	0	0	107.5	H520	L518-H520 WeakPolarHBondContact CD2-NE2 3.45Å; L518-H520 WeakPolarHBondContact CG-NE2 3.3Å
519	V	87.1	Confident	88.6	Confident	111 Å²	111	110.3 Å²	110.3	67%	0.673	61%	0.609	S	S	*	*			trans	-108.8	122.2	-171.1	-179.5	0	0	0	0	110.5	P521	V519-P521 WeakPolarHBondContact O-CD 3.49Å
520	H	88.4	Confident	89.3	Confident	74 Å²	74	111.5 Å²	111.5	34%	0.343	62%	0.62	S	S	.	*			trans	-114.5	95.5	-178.2	-60.3	-120.2	0	0	0	109.4	L518 S522 E606	L518-H520 WeakPolarHBondContact CD2-NE2 3.45Å; L518-H520 WeakPolarHBondContact CG-NE2 3.3Å; H520-S522 PolarHBondContact O-N 3.14Å; H520-E606 IonicContact CE1-OE1 3.01Å; H520-E606 PolarHBondContact CE1-OE1 3.28Å; H520-E606 IonicContact ND1-OE1 2.96Å
521	P	90.2	Very high	90.1	Very high	121 Å²	121	117.9 Å²	117.9	79%	0.786	64%	0.642	S	S	*	*			trans	-63.9	124.9	-173.8	-23.8	35.2	0	0	0	113.1	V519	V519-P521 WeakPolarHBondContact O-CD 3.49Å
522	S	90.9	Very high	90.8	Very high	84 Å²	84	119 Å²	119	59%	0.587	64%	0.642	S	S	*	*			trans	-131.3	11	-169.7	67.2	0	0	0	0	115.2	H520 K527	H520-S522 PolarHBondContact O-N 3.14Å; S522-K527 VanDerWaalsContact O-CE 3.22Å; S522-K527 WeakPolarHBondContact O-CE 3.4Å; S522-K527 PolarHBondContact O-NZ 2.87Å
523	D	95.6	Very high	91.1	Very high	67 Å²	67	118.3 Å²	118.3	36%	0.358	64%	0.638	S	S	.	*			trans	-55.6	136.9	179.5	-168.9	-45.3	0	0	0	112.4	R525 A526	D523-R525 PolarHBondContact O-N 3.04Å; D523-R525 VanDerWaalsContact OD1-CB 3.3Å; D523-R525 WeakPolarHBondContact OD1-CB 3.44Å; D523-R525 VanDerWaalsContact OD1-CG 3.29Å; D523-R525 WeakPolarHBondContact OD1-CG 3.49Å; D523-R525 PolarHBondContact OD1-N 3.19Å; D523-R525 IonicContact OD1-NE 2.73Å; D523-R525 PolarHBondContact OD1-NE 2.88Å; D523-R525 VanDerWaalsContact OD1-NE 3.13Å; D523-R525 IonicContact OD2-CZ 3.21Å; D523-R525 VanDerWaalsContact OD2-CZ 3.25Å; D523-R525 IonicContact OD2-NE 3.55Å; D523-R525 PolarHBondContact OD2-NE 2.67Å; D523-R525 IonicContact OD2-NH2 3.79Å; D523-R525 PolarHBondContact OD2-NH2 2.88Å; D523-A526 PolarHBondContact O-N 3.33Å
524	I	94.1	Very high	91.4	Very high	124 Å²	124	114 Å²	114	64%	0.636	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-60.4	-27.3	178.8	-166.4	168.1	0	0	0	113.1	A526 K527	I524-A526 PolarHBondContact O-N 2.82Å; I524-K527 PolarHBondContact O-N 2.95Å; I524-K527 VanDerWaalsContact O-N 3.08Å
525	R	96.4	Very high	91.9	Very high	213 Å²	213	110.5 Å²	110.5	80%	0.804	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-69.4	-14	176.2	-59.3	175	-63.6	149.8	-0.4	113.4	D523	D523-R525 PolarHBondContact O-N 3.04Å; D523-R525 VanDerWaalsContact OD1-CB 3.3Å; D523-R525 WeakPolarHBondContact OD1-CB 3.44Å; D523-R525 VanDerWaalsContact OD1-CG 3.29Å; D523-R525 WeakPolarHBondContact OD1-CG 3.49Å; D523-R525 PolarHBondContact OD1-N 3.19Å; D523-R525 IonicContact OD1-NE 2.73Å; D523-R525 PolarHBondContact OD1-NE 2.88Å; D523-R525 VanDerWaalsContact OD1-NE 3.13Å; D523-R525 IonicContact OD2-CZ 3.21Å; D523-R525 VanDerWaalsContact OD2-CZ 3.25Å; D523-R525 IonicContact OD2-NE 3.55Å; D523-R525 PolarHBondContact OD2-NE 2.67Å; D523-R525 IonicContact OD2-NH2 3.79Å; D523-R525 PolarHBondContact OD2-NH2 2.88Å
526	A	94.7	Very high	92.4	Very high	87 Å²	87	105.4 Å²	105.4	72%	0.719	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-101.4	9.8	173.4	0	0	0	0	0	112.5	D523 I524	D523-A526 PolarHBondContact O-N 3.33Å; I524-A526 PolarHBondContact O-N 2.82Å
527	K	96.1	Very high	92.7	Very high	115 Å²	115	106 Å²	106	50%	0.5	57%	0.571	S	S	.	*			trans	-124.3	139.7	-176	-68	171.1	171.4	169.2	0	111	S522 I524 V530	S522-K527 VanDerWaalsContact O-CE 3.22Å; S522-K527 WeakPolarHBondContact O-CE 3.4Å; S522-K527 PolarHBondContact O-NZ 2.87Å; I524-K527 PolarHBondContact O-N 2.95Å; I524-K527 VanDerWaalsContact O-N 3.08Å; K527-V530 HydrophobicContact CB-CG2 3.73Å
528	E	94	Very high	93.3	Very high	162 Å²	162	101.8 Å²	101.8	76%	0.757	54%	0.541	S	S	*	.			trans	-121.2	166.8	169.5	56.7	171	-148.6	0	0	110	V530	E528-V530 PolarHBondContact O-N 3.4Å; E528-V530 VanDerWaalsContact O-N 3.07Å
529	N	93.9	Very high	93.7	Very high	126 Å²	126	98 Å²	98	67%	0.674	52%	0.522	S	S	*	.	S	Bend	trans	54.3	29.3	175.7	-57.3	-58.7	0	0	0	115	Q531	N529-Q531 PolarHBondContact O-N 2.85Å
530	V	95.2	Very high	94.1	Very high	95 Å²	95	98.6 Å²	98.6	58%	0.576	52%	0.515	S	S	*	.			trans	-64.2	124.1	-178.2	-176.6	0	0	0	0	110.9	K527 E528	K527-V530 HydrophobicContact CB-CG2 3.73Å; E528-V530 PolarHBondContact O-N 3.4Å; E528-V530 VanDerWaalsContact O-N 3.07Å
531	Q	94.4	Very high	94.4	Very high	167 Å²	167	97.8 Å²	97.8	78%	0.78	51%	0.509	S	S	*	.			trans	-135.1	150.9	178.5	-64.9	174.6	39.2	0	0	109.4	N529	N529-Q531 PolarHBondContact O-N 2.85Å
532	E	92.4	Very high	94.6	Very high	157 Å²	157	93.5 Å²	93.5	73%	0.734	48%	0.479	S	S	*	.			trans	-80.2	142.6	173.3	-172.7	166.7	-162	0	0	110.9	K617	E532-K617 IonicContact OE1-NZ 2.7Å; E532-K617 PolarHBondContact OE1-NZ 3.23Å
533	V	92.4	Very high	94.8	Very high	87 Å²	87	93.9 Å²	93.9	53%	0.527	48%	0.482	S	S	.	.			trans	-92.2	142.6	-176.4	-174.5	0	0	0	0	110.3	T535	V533-T535 PolarHBondContact O-N 2.91Å; V533-T535 VanDerWaalsContact O-N 3.09Å
534	N	94.4	Very high	94.8	Very high	75 Å²	75	96.2 Å²	96.2	40%	0.401	49%	0.49	S	S	.	.			trans	-71.2	103.6	176.9	-176.5	12	0	0	0	111.8	T536 D537 N538	N534-T536 PolarHBondContact O-N 3.18Å; N534-T536 VanDerWaalsContact OD1-CB 3.29Å; N534-T536 WeakPolarHBondContact OD1-CB 3.38Å; N534-T536 PolarHBondContact OD1-N 3.26Å; N534-T536 VanDerWaalsContact OD1-N 3.1Å; N534-T536 PolarHBondContact OD1-OG1 3.36Å; N534-D537 HydrophobicContact CB-CB 4.32Å; N534-D537 PolarHBondContact ND2-OD2 2.81Å; N534-D537 PolarHBondContact O-N 2.65Å; N534-N538 PolarHBondContact O-N 3.37Å; N534-N538 VanDerWaalsContact O-N 3.09Å; N534-N538 PolarHBondContact O-OD1 2.92Å; N534-N538 VanDerWaalsContact O-OD1 3.13Å
535	T	95.4	Very high	94.8	Very high	17 Å²	17	91.6 Å²	91.6	10%	0.104	47%	0.467	C	S	.	.	H	α-helix	trans	-56.2	-32	177.3	50.7	0	0	0	0	113.1	V533 D537 N538 L539 G614 K617 E618	V533-T535 PolarHBondContact O-N 2.91Å; V533-T535 VanDerWaalsContact O-N 3.09Å; T535-D537 PolarHBondContact O-N 3.5Å; T535-N538 WeakPolarHBondContact CA-OD1 3.04Å; T535-N538 WeakPolarHBondContact O-CB 3.32Å; T535-N538 PolarHBondContact O-N 2.79Å; T535-L539 PolarHBondContact O-N 3.01Å; T535-G614 WeakPolarHBondContact CB-O 3.26Å; T535-K617 HydrophobicContact CG2-CB 4.15Å; T535-K617 HydrophobicContact CG2-CD 3.78Å; T535-K617 HydrophobicContact CG2-CG 3.97Å; T535-E618 WeakPolarHBondContact CB-OE2 3.25Å; T535-E618 PolarHBondContact OG1-OE2 3.22Å
536	T	95.6	Very high	94.7	Very high	70 Å²	70	87.7 Å²	87.7	43%	0.429	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-41.3	174.3	-30.4	0	0	0	0	112.3	N534 K540	N534-T536 PolarHBondContact O-N 3.18Å; N534-T536 VanDerWaalsContact OD1-CB 3.29Å; N534-T536 WeakPolarHBondContact OD1-CB 3.38Å; N534-T536 PolarHBondContact OD1-N 3.26Å; N534-T536 VanDerWaalsContact OD1-N 3.1Å; N534-T536 PolarHBondContact OD1-OG1 3.36Å; T536-K540 WeakPolarHBondContact O-CB 3.34Å; T536-K540 PolarHBondContact O-N 3.11Å
537	D	94.8	Very high	94.7	Very high	68 Å²	68	89.9 Å²	89.9	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-76.4	-31.7	178.2	-69.8	-40.2	0	0	0	111.5	N534 T535 K540 R541	N534-D537 HydrophobicContact CB-CB 4.32Å; N534-D537 PolarHBondContact ND2-OD2 2.81Å; N534-D537 PolarHBondContact O-N 2.65Å; T535-D537 PolarHBondContact O-N 3.5Å; D537-K540 PolarHBondContact O-N 2.96Å; D537-R541 PolarHBondContact O-N 2.95Å
538	N	95.3	Very high	94.7	Very high	6 Å²	6	85.2 Å²	85.2	3%	0.032	43%	0.432	C	S	.	.	H	α-helix	trans	-59.3	-52.4	170	-60.9	126.4	0	0	0	110.4	N534 T535 K540 R541 I542 E611	N534-N538 PolarHBondContact O-N 3.37Å; N534-N538 VanDerWaalsContact O-N 3.09Å; N534-N538 PolarHBondContact O-OD1 2.92Å; N534-N538 VanDerWaalsContact O-OD1 3.13Å; T535-N538 WeakPolarHBondContact CA-OD1 3.04Å; T535-N538 WeakPolarHBondContact O-CB 3.32Å; T535-N538 PolarHBondContact O-N 2.79Å; N538-K540 VanDerWaalsContact C-N 3.3Å; N538-K540 PolarHBondContact O-N 3.31Å; N538-R541 PolarHBondContact ND2-NH2 3.15Å; N538-R541 PolarHBondContact O-N 3.09Å; N538-I542 WeakPolarHBondContact O-CG1 3.23Å; N538-I542 PolarHBondContact O-N 3.2Å; N538-E611 PolarHBondContact ND2-OE1 3.42Å; N538-E611 PolarHBondContact ND2-OE2 3.3Å
539	L	95.8	Very high	94.7	Very high	33 Å²	33	84 Å²	84	17%	0.173	43%	0.426	C	S	.	.	H	α-helix	trans	-58.8	-40.7	177.9	179.7	57.6	0	0	0	112.1	T535 S543 A615 E618 L619 L622	T535-L539 PolarHBondContact O-N 3.01Å; L539-S543 VanDerWaalsContact O-CB 3.32Å; L539-S543 WeakPolarHBondContact O-CB 3.37Å; L539-S543 PolarHBondContact O-N 2.93Å; L539-S543 PolarHBondContact O-OG 2.66Å; L539-A615 HydrophobicContact CB-CB 4.12Å; L539-A615 HydrophobicContact CD1-CB 4.06Å; L539-E618 HydrophobicContact CB-CB 4.11Å; L539-E618 HydrophobicContact CB-CG 4.3Å; L539-E618 HydrophobicContact CD2-CB 4.02Å; L539-E618 HydrophobicContact CD2-CG 3.78Å; L539-L619 HydrophobicContact CD1-CD1 4.02Å; L539-L619 HydrophobicContact CD1-CD2 3.95Å; L539-L619 HydrophobicContact CD1-CG 3.83Å; L539-L619 HydrophobicContact CD2-CD2 3.85Å; L539-L619 HydrophobicContact CD2-CG 4.12Å; L539-L622 HydrophobicContact CD2-CD1 4.16Å
540	K	96.3	Very high	94.7	Very high	122 Å²	122	81 Å²	81	53%	0.53	41%	0.406	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176	-175.1	-179.1	174.1	-172.6	0	112.8	T536 D537 N538 S543 Q544	T536-K540 WeakPolarHBondContact O-CB 3.34Å; T536-K540 PolarHBondContact O-N 3.11Å; D537-K540 PolarHBondContact O-N 2.96Å; N538-K540 VanDerWaalsContact C-N 3.3Å; N538-K540 PolarHBondContact O-N 3.31Å; K540-S543 PolarHBondContact O-OG 3.05Å; K540-Q544 VanDerWaalsContact O-CG 3.25Å; K540-Q544 WeakPolarHBondContact O-CG 3.37Å; K540-Q544 PolarHBondContact O-N 2.68Å
541	R	95.1	Very high	94.6	Very high	58 Å²	58	83.4 Å²	83.4	22%	0.219	41%	0.41	C	S	.	.	H	α-helix	trans	-66.5	-45.8	176.1	-77.9	-172.2	-67.6	-89.5	1.4	111.8	D537 N538 Q544 M545 I578 E611	D537-R541 PolarHBondContact O-N 2.95Å; N538-R541 PolarHBondContact ND2-NH2 3.15Å; N538-R541 PolarHBondContact O-N 3.09Å; R541-Q544 PolarHBondContact O-N 2.59Å; R541-M545 PolarHBondContact O-N 3.2Å; R541-I578 HydrophobicContact CB-CG2 3.74Å; R541-I578 WeakPolarHBondContact CD-O 3.24Å; R541-I578 HydrophobicContact CG-CG2 3.94Å; R541-I578 VanDerWaalsContact O-CG2 3.31Å; R541-I578 WeakPolarHBondContact O-CG2 3.43Å; R541-E611 IonicContact CZ-OE2 3.46Å; R541-E611 VanDerWaalsContact CZ-OE2 3.22Å; R541-E611 IonicContact NE-OE2 3.55Å; R541-E611 PolarHBondContact NE-OE2 3.14Å; R541-E611 IonicContact NH2-OE1 3.58Å; R541-E611 IonicContact NH2-OE2 2.82Å; R541-E611 PolarHBondContact NH2-OE2 3.49Å
542	I	94.9	Very high	94.5	Very high	31 Å²	31	78.2 Å²	78.2	16%	0.159	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-42.5	-178.9	-67.7	-50.5	0	0	0	112.1	N538 Q544 M545 I608 E611 N612 A615	N538-I542 WeakPolarHBondContact O-CG1 3.23Å; N538-I542 PolarHBondContact O-N 3.2Å; I542-Q544 PolarHBondContact O-N 3.03Å; I542-M545 HydrophobicContact CD1-CE 4.38Å; I542-M545 WeakPolarHBondContact O-CB 3.38Å; I542-M545 PolarHBondContact O-N 3.35Å; I542-I608 HydrophobicContact CD1-CG2 4.28Å; I542-E611 HydrophobicContact CD1-CB 3.74Å; I542-E611 HydrophobicContact CG1-CB 4Å; I542-N612 WeakPolarHBondContact CD1-OD1 3.16Å; I542-N612 VanDerWaalsContact CG1-OD1 3.3Å; I542-N612 WeakPolarHBondContact CG1-OD1 3.41Å; I542-N612 WeakPolarHBondContact CG2-OD1 3.23Å; I542-A615 HydrophobicContact CB-CB 4.03Å; I542-A615 HydrophobicContact CG1-CB 4.04Å; I542-A615 HydrophobicContact CG2-CB 4.28Å
543	S	93.7	Very high	94.4	Very high	91 Å²	91	75.7 Å²	75.7	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-67.7	-15	176	55.3	0	0	0	0	114.4	L539 K540	L539-S543 VanDerWaalsContact O-CB 3.32Å; L539-S543 WeakPolarHBondContact O-CB 3.37Å; L539-S543 PolarHBondContact O-N 2.93Å; L539-S543 PolarHBondContact O-OG 2.66Å; K540-S543 PolarHBondContact O-OG 3.05Å
544	Q	95.1	Very high	94.3	Very high	116 Å²	116	76 Å²	76	54%	0.542	38%	0.375	S	S	.	.	H	α-helix	trans	-89.8	-13.2	170.4	-71.3	177.4	-27.2	0	0	113	K540 R541 I542 I578	K540-Q544 VanDerWaalsContact O-CG 3.25Å; K540-Q544 WeakPolarHBondContact O-CG 3.37Å; K540-Q544 PolarHBondContact O-N 2.68Å; R541-Q544 PolarHBondContact O-N 2.59Å; I542-Q544 PolarHBondContact O-N 3.03Å; Q544-I578 HydrophobicContact CB-CD1 4.19Å; Q544-I578 WeakPolarHBondContact O-CD1 3.45Å
545	M	94.4	Very high	94.1	Very high	28 Å²	28	74.4 Å²	74.4	14%	0.138	37%	0.365	C	S	.	.			trans	-83.6	121.1	-173.6	-165.8	171.9	-66.4	0	0	111.5	R541 I542 V570 V575 I578 L579 I608	R541-M545 PolarHBondContact O-N 3.2Å; I542-M545 HydrophobicContact CD1-CE 4.38Å; I542-M545 WeakPolarHBondContact O-CB 3.38Å; I542-M545 PolarHBondContact O-N 3.35Å; M545-V570 HydrophobicContact CG-CG1 4.11Å; M545-V570 HydrophobicContact SD-CG1 4.09Å; M545-V575 HydrophobicContact CE-CG1 4.09Å; M545-V575 HydrophobicContact CE-CG2 4.31Å; M545-V575 HydrophobicContact CG-CG2 4.43Å; M545-V575 HydrophobicContact SD-CG2 4.08Å; M545-I578 HydrophobicContact CB-CD1 4.33Å; M545-I578 HydrophobicContact CE-CG2 4.35Å; M545-L579 HydrophobicContact CE-CB 4.4Å; M545-L579 HydrophobicContact CE-CD2 4.29Å; M545-I608 HydrophobicContact CE-CD1 4.42Å; M545-I608 HydrophobicContact CE-CG1 4.36Å; M545-I608 HydrophobicContact CE-CG2 4.43Å; M545-I608 HydrophobicContact SD-CD1 3.97Å; M545-I608 HydrophobicContact SD-CG1 4.33Å; M545-I608 HydrophobicContact SD-CG2 3.8Å
546	R	94.9	Very high	93.7	Very high	130 Å²	130	74.7 Å²	74.7	49%	0.491	36%	0.364	S	S	.	.			trans	-87.2	115.6	-175.7	-168.4	174	70.4	105	-6.2	111.6	V548 E574	R546-V548 HydrophobicContact CG-CG1 4.38Å; R546-V548 VanDerWaalsContact CZ-CG1 3.45Å; R546-V548 VanDerWaalsContact NH1-CG1 3.27Å; R546-E574 IonicContact CZ-OE1 3.61Å; R546-E574 IonicContact CZ-OE2 3.5Å; R546-E574 IonicContact NE-OE1 3.87Å; R546-E574 IonicContact NE-OE2 2.66Å; R546-E574 PolarHBondContact NE-OE2 2.91Å; R546-E574 IonicContact NH2-OE1 2.74Å; R546-E574 PolarHBondContact NH2-OE1 3.05Å; R546-E574 IonicContact NH2-OE2 3.68Å; R546-E574 PolarHBondContact NH2-OE2 2.99Å
547	L	94.2	Very high	93.3	Very high	133 Å²	133	71.5 Å²	71.5	70%	0.696	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	139.9	165.5	-70.5	172	0	0	0	110.4	G569 V570	L547-G569 CarbonylContact C-O 3.49Å; L547-G569 WeakPolarHBondContact CA-O 3.32Å; L547-V570 HydrophobicContact CD2-CG1 3.97Å
548	V	95.8	Very high	92.7	Very high	17 Å²	17	71.9 Å²	71.9	10%	0.103	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	138.2	-178.7	-74.9	0	0	0	0	110.8	R546 Y550 T568 G569 I571	R546-V548 HydrophobicContact CG-CG1 4.38Å; R546-V548 VanDerWaalsContact CZ-CG1 3.45Å; R546-V548 VanDerWaalsContact NH1-CG1 3.27Å; V548-Y550 HydrophobicContact CG2-CD1 3.93Å; V548-Y550 HydrophobicContact CG2-CE1 4.46Å; V548-T568 CarbonylContact O-C 3.59Å; V548-T568 WeakPolarHBondContact O-CA 3.23Å; V548-G569 WeakPolarHBondContact CG2-O 3.48Å; V548-G569 PolarHBondContact N-O 3.32Å; V548-G569 PolarHBondContact O-N 2.95Å; V548-I571 HydrophobicContact CG1-CD1 4.38Å; V548-I571 HydrophobicContact CG1-CG1 4.34Å; V548-I571 HydrophobicContact CG2-CD1 4.49Å; V548-I571 HydrophobicContact CG2-CG1 3.75Å
549	H	95.7	Very high	92	Very high	138 Å²	138	73.7 Å²	73.7	64%	0.639	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.3	160.5	-171	66	0	0	0	108.5	E567 T568	H549-E567 PolarHBondContact ND1-O 2.74Å; H549-T568 PolarHBondContact ND1-OG1 3.26Å
550	Y	93.2	Very high	91.1	Very high	63 Å²	63	74 Å²	74	25%	0.247	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	162.3	-175.8	60.7	-92	0	0	0	111.8	V548 Y552 A566 E567	V548-Y550 HydrophobicContact CG2-CD1 3.93Å; V548-Y550 HydrophobicContact CG2-CE1 4.46Å; Y550-Y552 HydrophobicContact CE2-CD1 4.47Å; Y550-Y552 HydrophobicContact CE2-CD2 4.24Å; Y550-Y552 HydrophobicContact CE2-CE1 4.01Å; Y550-Y552 AromaticContact CE2-CE2 3.76Å; Y550-Y552 HydrophobicContact CE2-CE2 3.76Å; Y550-Y552 AromaticContact CE2-CZ 3.65Å; Y550-Y552 PolarHBondContact OH-OH 3.48Å; Y550-A566 WeakPolarHBondContact O-CA 3.28Å; Y550-E567 HydrophobicContact CE1-CB 4.41Å; Y550-E567 HydrophobicContact CE2-CB 3.97Å; Y550-E567 PolarHBondContact N-O 2.95Å; Y550-E567 PolarHBondContact O-N 3.36Å; Y550-E567 PolarHBondContact OH-OE1 3.08Å; Y550-E567 PolarHBondContact OH-OE2 3.22Å
551	Q	93.9	Very high	90	Very high	144 Å²	144	69.9 Å²	69.9	67%	0.673	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.1	172.9	-165.9	172.6	21.9	0	0	110.2	T565	Q551-T565 CarbonylContact C-O 3.52Å; Q551-T565 VanDerWaalsContact CA-O 3.25Å; Q551-T565 WeakPolarHBondContact CA-O 3.32Å; Q551-T565 PolarHBondContact NE2-OG1 3.34Å
552	Y	91.4	Very high	89.4	Confident	58 Å²	58	69.6 Å²	69.6	23%	0.227	37%	0.367	C	S	.	.			trans	-62.9	135.5	172.9	-72.4	-73.4	0	0	0	111.1	Y550 F556 I562 T565 E567	Y550-Y552 HydrophobicContact CE2-CD1 4.47Å; Y550-Y552 HydrophobicContact CE2-CD2 4.24Å; Y550-Y552 HydrophobicContact CE2-CE1 4.01Å; Y550-Y552 AromaticContact CE2-CE2 3.76Å; Y550-Y552 HydrophobicContact CE2-CE2 3.76Å; Y550-Y552 AromaticContact CE2-CZ 3.65Å; Y550-Y552 PolarHBondContact OH-OH 3.48Å; Y552-F556 AromaticContact CD1-CD1 3.88Å; Y552-F556 HydrophobicContact CD1-CD1 3.88Å; Y552-F556 AromaticContact CD1-CE1 3.84Å; Y552-F556 HydrophobicContact CD1-CE1 3.84Å; Y552-F556 HydrophobicContact CE1-CE1 4.01Å; Y552-I562 HydrophobicContact CD1-CD1 4.28Å; Y552-I562 HydrophobicContact CD2-CD1 4.04Å; Y552-I562 HydrophobicContact CD2-CG2 4.01Å; Y552-I562 HydrophobicContact CE1-CD1 4.12Å; Y552-I562 HydrophobicContact CE2-CD1 3.86Å; Y552-I562 HydrophobicContact CE2-CG2 4.39Å; Y552-I562 HydrophobicContact CG-CD1 4.24Å; Y552-T565 WeakPolarHBondContact CD2-O 3.47Å; Y552-T565 PolarHBondContact N-O 2.89Å; Y552-E567 HydrophobicContact CE2-CB 4.32Å; Y552-E567 PolarHBondContact OH-OE2 3.42Å
553	K	91.1	Very high	88.4	Confident	105 Å²	105	76.4 Å²	76.4	46%	0.457	40%	0.398	S	S	.	.			trans	-50.3	126.9	166.7	-91	170.6	150.5	-97.8	0	109.9	E555 F556 A557 E595	K553-E555 VanDerWaalsContact C-N 3.28Å; K553-E555 HydrophobicContact CB-CG 4.24Å; K553-E555 WeakPolarHBondContact CB-OE1 3.44Å; K553-E555 VanDerWaalsContact CD-OE1 3.32Å; K553-E555 WeakPolarHBondContact CD-OE1 3.46Å; K553-E555 WeakPolarHBondContact CE-OE1 3.48Å; K553-E555 VanDerWaalsContact CG-OE1 3.23Å; K553-E555 WeakPolarHBondContact CG-OE1 3.32Å; K553-E555 IonicContact NZ-OE1 2.7Å; K553-E555 PolarHBondContact NZ-OE1 2.87Å; K553-E555 PolarHBondContact O-N 2.84Å; K553-F556 HydrophobicContact CB-CB 4.02Å; K553-F556 WeakPolarHBondContact O-CB 3.04Å; K553-F556 PolarHBondContact O-N 3.18Å; K553-A557 PolarHBondContact O-N 3.41Å; K553-E595 IonicContact NZ-OE2 3.27Å; K553-E595 PolarHBondContact NZ-OE2 2.83Å
554	P	89.7	Confident	87.7	Confident	93 Å²	93	77.2 Å²	77.2	60%	0.604	40%	0.395	S	S	*	.	H	α-helix	trans	-62.9	-33.7	-176.7	23.8	-32.8	0	0	0	112.9	F556 A558	P554-F556 VanDerWaalsContact C-N 3.26Å; P554-F556 PolarHBondContact O-N 2.8Å; P554-A558 VanDerWaalsContact O-CB 3.29Å; P554-A558 WeakPolarHBondContact O-CB 3.25Å; P554-A558 PolarHBondContact O-N 2.79Å
555	E	89.1	Confident	87.1	Confident	42 Å²	42	73.5 Å²	73.5	20%	0.196	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-27.2	173.6	62	-86.6	-163.1	0	0	113.7	K553 C591 A592 N593	K553-E555 VanDerWaalsContact C-N 3.28Å; K553-E555 HydrophobicContact CB-CG 4.24Å; K553-E555 WeakPolarHBondContact CB-OE1 3.44Å; K553-E555 VanDerWaalsContact CD-OE1 3.32Å; K553-E555 WeakPolarHBondContact CD-OE1 3.46Å; K553-E555 WeakPolarHBondContact CE-OE1 3.48Å; K553-E555 VanDerWaalsContact CG-OE1 3.23Å; K553-E555 WeakPolarHBondContact CG-OE1 3.32Å; K553-E555 IonicContact NZ-OE1 2.7Å; K553-E555 PolarHBondContact NZ-OE1 2.87Å; K553-E555 PolarHBondContact O-N 2.84Å; E555-C591 HydrophobicContact CB-CB 4.23Å; E555-C591 HydrophobicContact CG-CB 4.16Å; E555-C591 WeakPolarHBondContact O-CB 3.46Å; E555-A592 PolarHBondContact O-N 2.77Å; E555-N593 HydrophobicContact CB-CB 4.12Å
556	F	87.8	Confident	86.9	Confident	22 Å²	22	73.7 Å²	73.7	10%	0.096	39%	0.387	C	S	.	.	H	α-helix	trans	-85.8	-50.4	175.2	173.1	-98.1	0	0	0	110.4	Y552 K553 P554 A558 T559 V560 I562 V589 I597 L600	Y552-F556 AromaticContact CD1-CD1 3.88Å; Y552-F556 HydrophobicContact CD1-CD1 3.88Å; Y552-F556 AromaticContact CD1-CE1 3.84Å; Y552-F556 HydrophobicContact CD1-CE1 3.84Å; Y552-F556 HydrophobicContact CE1-CE1 4.01Å; K553-F556 HydrophobicContact CB-CB 4.02Å; K553-F556 WeakPolarHBondContact O-CB 3.04Å; K553-F556 PolarHBondContact O-N 3.18Å; P554-F556 VanDerWaalsContact C-N 3.26Å; P554-F556 PolarHBondContact O-N 2.8Å; F556-A558 PolarHBondContact O-N 2.94Å; F556-T559 WeakPolarHBondContact O-CA 3.46Å; F556-T559 WeakPolarHBondContact O-CB 3.43Å; F556-T559 PolarHBondContact O-N 2.84Å; F556-V560 HydrophobicContact CD1-CG2 4.04Å; F556-V560 HydrophobicContact CE1-CG1 4.43Å; F556-V560 HydrophobicContact CE1-CG2 3.68Å; F556-V560 HydrophobicContact CE2-CG1 4.02Å; F556-V560 HydrophobicContact CZ-CG1 3.91Å; F556-V560 HydrophobicContact CZ-CG2 4.01Å; F556-V560 WeakPolarHBondContact O-CG2 3.49Å; F556-V560 PolarHBondContact O-N 2.86Å; F556-V560 VanDerWaalsContact O-N 3.14Å; F556-I562 HydrophobicContact CE1-CD1 4.38Å; F556-V589 HydrophobicContact CD2-CG1 4.23Å; F556-V589 HydrophobicContact CE2-CG1 3.99Å; F556-I597 HydrophobicContact CD2-CD1 3.81Å; F556-I597 HydrophobicContact CE2-CD1 4.37Å; F556-L600 HydrophobicContact CE2-CD2 3.84Å; F556-L600 HydrophobicContact CZ-CD2 3.95Å
557	A	86.8	Confident	86.7	Confident	4 Å²	4	69.5 Å²	69.5	3%	0.033	37%	0.372	C	S	.	.	H	α-helix	trans	-54.3	-39.1	179.9	0	0	0	0	0	112.3	K553 T559 V560 G561 I562 T565	K553-A557 PolarHBondContact O-N 3.41Å; A557-T559 VanDerWaalsContact C-N 3.35Å; A557-T559 PolarHBondContact O-N 2.04Å; A557-V560 PolarHBondContact O-N 2.77Å; A557-G561 PolarHBondContact O-N 2.64Å; A557-I562 HydrophobicContact CB-CB 4.05Å; A557-I562 HydrophobicContact CB-CG2 4.37Å; A557-I562 PolarHBondContact O-N 3.14Å; A557-T565 HydrophobicContact CB-CG2 4.01Å
558	A	82.2	Confident	86.7	Confident	75 Å²	75	66.9 Å²	66.9	62%	0.62	36%	0.362	S	S	*	.	H	α-helix	trans	-66.8	-27.6	175.3	0	0	0	0	0	114.6	P554 F556 A592	P554-A558 VanDerWaalsContact O-CB 3.29Å; P554-A558 WeakPolarHBondContact O-CB 3.25Å; P554-A558 PolarHBondContact O-N 2.79Å; F556-A558 PolarHBondContact O-N 2.94Å; A558-A592 HydrophobicContact CB-CB 4.24Å
559	T	80.6	Confident	86.6	Confident	45 Å²	45	66.5 Å²	66.5	28%	0.276	36%	0.362	S	S	.	.	H	α-helix	trans	-76.6	-43.6	174.3	-73.3	0	0	0	0	111.6	F556 A557 V589 V590 C591 A592	F556-T559 WeakPolarHBondContact O-CA 3.46Å; F556-T559 WeakPolarHBondContact O-CB 3.43Å; F556-T559 PolarHBondContact O-N 2.84Å; A557-T559 VanDerWaalsContact C-N 3.35Å; A557-T559 PolarHBondContact O-N 2.04Å; T559-V589 HydrophobicContact CG2-CG1 4.06Å; T559-V590 WeakPolarHBondContact CG2-O 3.36Å; T559-V590 PolarHBondContact OG1-O 2.95Å; T559-V590 VanDerWaalsContact OG1-O 3.11Å; T559-C591 WeakPolarHBondContact OG1-CA 3.34Å; T559-A592 PolarHBondContact OG1-N 3.16Å; T559-A592 VanDerWaalsContact OG1-N 3.14Å
560	V	77.1	Confident	86.5	Confident	39 Å²	39	61.4 Å²	61.4	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-91.1	-5.8	-174.4	-64	0	0	0	0	114.4	F556 A557 I562	F556-V560 HydrophobicContact CD1-CG2 4.04Å; F556-V560 HydrophobicContact CE1-CG1 4.43Å; F556-V560 HydrophobicContact CE1-CG2 3.68Å; F556-V560 HydrophobicContact CE2-CG1 4.02Å; F556-V560 HydrophobicContact CZ-CG1 3.91Å; F556-V560 HydrophobicContact CZ-CG2 4.01Å; F556-V560 WeakPolarHBondContact O-CG2 3.49Å; F556-V560 PolarHBondContact O-N 2.86Å; F556-V560 VanDerWaalsContact O-N 3.14Å; A557-V560 PolarHBondContact O-N 2.77Å; V560-I562 HydrophobicContact CG2-CB 4.42Å; V560-I562 HydrophobicContact CG2-CD1 3.51Å; V560-I562 HydrophobicContact CG2-CG1 3.75Å
561	G	73.4	Confident	86.6	Confident	35 Å²	35	61.3 Å²	61.3	36%	0.361	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	25.2	175.5	0	0	0	0	0	114.9	A557	A557-G561 PolarHBondContact O-N 2.64Å
562	I	82.2	Confident	86.7	Confident	53 Å²	53	55 Å²	55	27%	0.272	32%	0.316	S	S	.	.			trans	-82	115.3	178.7	-69.4	170.5	0	0	0	109.7	Y552 F556 A557 V560 N564	Y552-I562 HydrophobicContact CD1-CD1 4.28Å; Y552-I562 HydrophobicContact CD2-CD1 4.04Å; Y552-I562 HydrophobicContact CD2-CG2 4.01Å; Y552-I562 HydrophobicContact CE1-CD1 4.12Å; Y552-I562 HydrophobicContact CE2-CD1 3.86Å; Y552-I562 HydrophobicContact CE2-CG2 4.39Å; Y552-I562 HydrophobicContact CG-CD1 4.24Å; F556-I562 HydrophobicContact CE1-CD1 4.38Å; A557-I562 HydrophobicContact CB-CB 4.05Å; A557-I562 HydrophobicContact CB-CG2 4.37Å; A557-I562 PolarHBondContact O-N 3.14Å; V560-I562 HydrophobicContact CG2-CB 4.42Å; V560-I562 HydrophobicContact CG2-CD1 3.51Å; V560-I562 HydrophobicContact CG2-CG1 3.75Å; I562-N564 WeakPolarHBondContact CG2-O 3.45Å
563	E	74.2	Confident	86.9	Confident	173 Å²	173	57.1 Å²	57.1	81%	0.808	33%	0.328	S	S	*	.	S	Bend	trans	-82.1	-46.7	179.4	-64.1	-171.5	168.1	0	0	112.8
564	N	78.5	Confident	87.1	Confident	109 Å²	109	54.9 Å²	54.9	58%	0.583	32%	0.319	S	S	*	.			trans	-88.8	114.8	172.3	176.6	22.5	0	0	0	110	I562 A566	I562-N564 WeakPolarHBondContact CG2-O 3.45Å; N564-A566 PolarHBondContact ND2-O 3.24Å; N564-A566 PolarHBondContact OD1-N 3.37Å; N564-A566 VanDerWaalsContact OD1-N 3.09Å
565	T	83.1	Confident	87.4	Confident	37 Å²	37	50.5 Å²	50.5	23%	0.227	29%	0.291	C	S	.	.			trans	-78.9	-16.8	-178.7	49.9	0	0	0	0	114.3	Q551 Y552 A557	Q551-T565 CarbonylContact C-O 3.52Å; Q551-T565 VanDerWaalsContact CA-O 3.25Å; Q551-T565 WeakPolarHBondContact CA-O 3.32Å; Q551-T565 PolarHBondContact NE2-OG1 3.34Å; Y552-T565 WeakPolarHBondContact CD2-O 3.47Å; Y552-T565 PolarHBondContact N-O 2.89Å; A557-T565 HydrophobicContact CB-CG2 4.01Å
566	A	90.5	Very high	87.7	Confident	33 Å²	33	52.2 Å²	52.2	27%	0.273	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.9	-176.4	0	0	0	0	0	112.1	Y550 N564	Y550-A566 WeakPolarHBondContact O-CA 3.28Å; N564-A566 PolarHBondContact ND2-O 3.24Å; N564-A566 PolarHBondContact OD1-N 3.37Å; N564-A566 VanDerWaalsContact OD1-N 3.09Å
567	E	90.4	Very high	88.1	Confident	41 Å²	41	58.9 Å²	58.9	19%	0.192	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.3	-179.7	-168.2	-174.7	144.4	0	0	110.2	H549 Y550 Y552 K605	H549-E567 PolarHBondContact ND1-O 2.74Å; Y550-E567 HydrophobicContact CE1-CB 4.41Å; Y550-E567 HydrophobicContact CE2-CB 3.97Å; Y550-E567 PolarHBondContact N-O 2.95Å; Y550-E567 PolarHBondContact O-N 3.36Å; Y550-E567 PolarHBondContact OH-OE1 3.08Å; Y550-E567 PolarHBondContact OH-OE2 3.22Å; Y552-E567 HydrophobicContact CE2-CB 4.32Å; Y552-E567 PolarHBondContact OH-OE2 3.42Å; E567-K605 IonicContact OE1-NZ 2.7Å; E567-K605 PolarHBondContact OE1-NZ 3.24Å
568	T	93.3	Very high	88.5	Confident	78 Å²	78	60.4 Å²	60.4	48%	0.479	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128	166.5	-60	0	0	0	0	109.1	V548 H549	V548-T568 CarbonylContact O-C 3.59Å; V548-T568 WeakPolarHBondContact O-CA 3.23Å; H549-T568 PolarHBondContact ND1-OG1 3.26Å
569	G	93.6	Very high	89.1	Confident	10 Å²	10	56.9 Å²	56.9	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	-140.1	-174.3	0	0	0	0	0	112.6	L547 V548	L547-G569 CarbonylContact C-O 3.49Å; L547-G569 WeakPolarHBondContact CA-O 3.32Å; V548-G569 WeakPolarHBondContact CG2-O 3.48Å; V548-G569 PolarHBondContact N-O 3.32Å; V548-G569 PolarHBondContact O-N 2.95Å
570	V	95.1	Very high	89.7	Confident	31 Å²	31	58.4 Å²	58.4	19%	0.188	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.6	-172.8	-67.4	0	0	0	0	111.3	M545 L547 V575 V603 I608	M545-V570 HydrophobicContact CG-CG1 4.11Å; M545-V570 HydrophobicContact SD-CG1 4.09Å; L547-V570 HydrophobicContact CD2-CG1 3.97Å; V570-V575 HydrophobicContact CB-CG2 3.72Å; V570-V575 HydrophobicContact CG1-CG2 4.5Å; V570-V575 HydrophobicContact CG2-CG2 3.63Å; V570-V603 HydrophobicContact CG2-CG1 4.21Å; V570-I608 HydrophobicContact CG2-CD1 4.01Å
571	I	95.1	Very high	90.3	Very high	60 Å²	60	61.4 Å²	61.4	31%	0.308	33%	0.33	S	S	.	.			trans	-85	122.5	176.5	-57.3	-166.8	0	0	0	109.7	V548 Q573 E574 V575	V548-I571 HydrophobicContact CG1-CD1 4.38Å; V548-I571 HydrophobicContact CG1-CG1 4.34Å; V548-I571 HydrophobicContact CG2-CD1 4.49Å; V548-I571 HydrophobicContact CG2-CG1 3.75Å; I571-Q573 VanDerWaalsContact C-N 3.29Å; I571-Q573 HydrophobicContact CG2-CB 4.4Å; I571-Q573 PolarHBondContact O-N 2.68Å; I571-E574 HydrophobicContact CB-CB 4.25Å; I571-E574 HydrophobicContact CB-CG 4.09Å; I571-E574 HydrophobicContact CG2-CG 4.24Å; I571-E574 PolarHBondContact O-N 3.31Å; I571-V575 WeakPolarHBondContact O-CG2 3.15Å; I571-V575 PolarHBondContact O-N 2.83Å
572	A	94.9	Very high	91.3	Very high	11 Å²	11	59.7 Å²	59.7	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-55	-41.3	-175.3	0	0	0	0	0	113.4	E574 V575 Q576 V583 L601 V603	A572-E574 VanDerWaalsContact C-N 3.29Å; A572-E574 PolarHBondContact O-N 3.29Å; A572-V575 PolarHBondContact O-N 2.6Å; A572-Q576 WeakPolarHBondContact O-CB 3.49Å; A572-Q576 PolarHBondContact O-N 2.95Å; A572-V583 HydrophobicContact CB-CG1 4.34Å; A572-L601 HydrophobicContact CB-CB 3.63Å; A572-L601 HydrophobicContact CB-CD1 4.39Å; A572-V603 HydrophobicContact CB-CG2 3.54Å
573	Q	95.9	Very high	91.9	Very high	103 Å²	103	57.8 Å²	57.8	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-68.9	-23.6	178.7	-64.1	76.7	8.3	0	0	113.5	I571 Q577 L601	I571-Q573 VanDerWaalsContact C-N 3.29Å; I571-Q573 HydrophobicContact CG2-CB 4.4Å; I571-Q573 PolarHBondContact O-N 2.68Å; Q573-Q577 PolarHBondContact O-NE2 3.37Å; Q573-L601 HydrophobicContact CG-CD1 3.93Å
574	E	95.7	Very high	92.7	Very high	59 Å²	59	56.7 Å²	56.7	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-83.9	-43.5	174	-66.3	179	-165.1	0	0	110.2	R546 I571 A572 Q576 Q577	R546-E574 IonicContact CZ-OE1 3.61Å; R546-E574 IonicContact CZ-OE2 3.5Å; R546-E574 IonicContact NE-OE1 3.87Å; R546-E574 IonicContact NE-OE2 2.66Å; R546-E574 PolarHBondContact NE-OE2 2.91Å; R546-E574 IonicContact NH2-OE1 2.74Å; R546-E574 PolarHBondContact NH2-OE1 3.05Å; R546-E574 IonicContact NH2-OE2 3.68Å; R546-E574 PolarHBondContact NH2-OE2 2.99Å; I571-E574 HydrophobicContact CB-CB 4.25Å; I571-E574 HydrophobicContact CB-CG 4.09Å; I571-E574 HydrophobicContact CG2-CG 4.24Å; I571-E574 PolarHBondContact O-N 3.31Å; A572-E574 VanDerWaalsContact C-N 3.29Å; A572-E574 PolarHBondContact O-N 3.29Å; E574-Q576 VanDerWaalsContact C-N 3.27Å; E574-Q576 PolarHBondContact O-N 2.65Å; E574-Q577 PolarHBondContact O-N 3.33Å
575	V	95.8	Very high	93.2	Very high	1 Å²	1	58 Å²	58	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-56.7	-42.2	172.1	178.3	0	0	0	0	110.9	M545 V570 I571 A572 Q577 I578 L579 A582 V583 V603 I608	M545-V575 HydrophobicContact CE-CG1 4.09Å; M545-V575 HydrophobicContact CE-CG2 4.31Å; M545-V575 HydrophobicContact CG-CG2 4.43Å; M545-V575 HydrophobicContact SD-CG2 4.08Å; V570-V575 HydrophobicContact CB-CG2 3.72Å; V570-V575 HydrophobicContact CG1-CG2 4.5Å; V570-V575 HydrophobicContact CG2-CG2 3.63Å; I571-V575 WeakPolarHBondContact O-CG2 3.15Å; I571-V575 PolarHBondContact O-N 2.83Å; A572-V575 PolarHBondContact O-N 2.6Å; V575-Q577 PolarHBondContact O-N 3.08Å; V575-Q577 VanDerWaalsContact O-N 3.14Å; V575-I578 PolarHBondContact O-N 3.14Å; V575-L579 HydrophobicContact CG1-CB 4.47Å; V575-L579 CarbonylContact O-C 3.46Å; V575-L579 PolarHBondContact O-N 2.85Å; V575-A582 HydrophobicContact CG1-CB 4.17Å; V575-V583 HydrophobicContact CB-CG2 3.91Å; V575-V583 HydrophobicContact CG1-CG2 3.64Å; V575-V603 HydrophobicContact CG1-CG1 4.46Å; V575-I608 HydrophobicContact CG1-CD1 4.02Å; V575-I608 HydrophobicContact CG2-CD1 4.24Å
576	Q	95.5	Very high	93.1	Very high	77 Å²	77	58 Å²	58	36%	0.36	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-23.3	-178.3	-164.1	176.5	33.3	0	0	113.6	A572 E574 P580 V583	A572-Q576 WeakPolarHBondContact O-CB 3.49Å; A572-Q576 PolarHBondContact O-N 2.95Å; E574-Q576 VanDerWaalsContact C-N 3.27Å; E574-Q576 PolarHBondContact O-N 2.65Å; Q576-P580 WeakPolarHBondContact O-CA 2.91Å; Q576-P580 WeakPolarHBondContact O-CG 3.18Å; Q576-V583 HydrophobicContact CB-CB 4.17Å; Q576-V583 HydrophobicContact CB-CG1 4.34Å; Q576-V583 HydrophobicContact CB-CG2 3.96Å; Q576-V583 HydrophobicContact CG-CB 4.23Å; Q576-V583 HydrophobicContact CG-CG1 4.46Å
577	Q	95.8	Very high	92.7	Very high	163 Å²	163	57.7 Å²	57.7	76%	0.762	31%	0.306	S	S	*	.	H	α-helix	trans	-83.2	-23.4	176.1	-66.2	171.8	49.1	0	0	112.9	Q573 E574 V575	Q573-Q577 PolarHBondContact O-NE2 3.37Å; E574-Q577 PolarHBondContact O-N 3.33Å; V575-Q577 PolarHBondContact O-N 3.08Å; V575-Q577 VanDerWaalsContact O-N 3.14Å
578	I	94.8	Very high	92.4	Very high	36 Å²	36	60.7 Å²	60.7	19%	0.185	32%	0.323	C	S	.	.	H	α-helix	trans	-100.2	-39.3	-174	-61.6	168.8	0	0	0	111.1	R541 Q544 M545 V575	R541-I578 HydrophobicContact CB-CG2 3.74Å; R541-I578 WeakPolarHBondContact CD-O 3.24Å; R541-I578 HydrophobicContact CG-CG2 3.94Å; R541-I578 VanDerWaalsContact O-CG2 3.31Å; R541-I578 WeakPolarHBondContact O-CG2 3.43Å; Q544-I578 HydrophobicContact CB-CD1 4.19Å; Q544-I578 WeakPolarHBondContact O-CD1 3.45Å; M545-I578 HydrophobicContact CB-CD1 4.33Å; M545-I578 HydrophobicContact CE-CG2 4.35Å; V575-I578 PolarHBondContact O-N 3.14Å
579	L	94.9	Very high	91.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.308	C	S	.	.			trans	-147.9	71.5	-171.3	-173.8	71.2	0	0	0	108.8	M545 V575 E581 A582 R607 I608 E611	M545-L579 HydrophobicContact CE-CB 4.4Å; M545-L579 HydrophobicContact CE-CD2 4.29Å; V575-L579 HydrophobicContact CG1-CB 4.47Å; V575-L579 CarbonylContact O-C 3.46Å; V575-L579 PolarHBondContact O-N 2.85Å; L579-E581 PolarHBondContact O-N 2.93Å; L579-E581 VanDerWaalsContact O-N 3.14Å; L579-A582 HydrophobicContact CB-CB 4.43Å; L579-A582 HydrophobicContact CD2-CB 3.48Å; L579-A582 VanDerWaalsContact CD2-CB 3.48Å; L579-A582 HydrophobicContact CG-CB 3.73Å; L579-A582 PolarHBondContact O-N 2.83Å; L579-A582 VanDerWaalsContact O-N 3.07Å; L579-R607 HydrophobicContact CD2-CG 4.37Å; L579-I608 HydrophobicContact CD2-CG1 4.08Å; L579-E611 HydrophobicContact CD1-CG 3.87Å; L579-E611 HydrophobicContact CD2-CG 3.73Å; L579-E611 HydrophobicContact CG-CG 4.48Å
580	P	93.8	Very high	91.5	Very high	78 Å²	78	61.9 Å²	61.9	51%	0.506	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-54.3	-36.6	-171.6	-23	30.6	0	0	0	113.7	Q576 A582 V583	Q576-P580 WeakPolarHBondContact O-CA 2.91Å; Q576-P580 WeakPolarHBondContact O-CG 3.18Å; P580-A582 PolarHBondContact O-N 2.9Å; P580-V583 PolarHBondContact O-N 3.47Å; P580-V583 VanDerWaalsContact O-N 3.11Å
581	E	90.9	Very high	91	Very high	101 Å²	101	60.6 Å²	60.6	47%	0.472	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-76.2	-5.4	-175.9	75.2	-85.9	-144.7	0	0	114.6	L579 V583 R607	L579-E581 PolarHBondContact O-N 2.93Å; L579-E581 VanDerWaalsContact O-N 3.14Å; E581-V583 VanDerWaalsContact C-N 3.34Å; E581-R607 IonicContact OE1-CZ 3.86Å; E581-R607 VanDerWaalsContact OE1-CZ 3.24Å; E581-R607 IonicContact OE1-NH1 2.75Å; E581-R607 PolarHBondContact OE1-NH1 3.05Å; E581-R607 VanDerWaalsContact OE1-NH1 3.16Å; E581-R607 IonicContact OE1-NH2 2.92Å; E581-R607 PolarHBondContact OE1-NH2 3.38Å
582	A	94.2	Very high	90.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-87.9	1	167.8	0	0	0	0	0	113.1	V575 L579 P580 V603 N604 R607 I608	V575-A582 HydrophobicContact CG1-CB 4.17Å; L579-A582 HydrophobicContact CB-CB 4.43Å; L579-A582 HydrophobicContact CD2-CB 3.48Å; L579-A582 VanDerWaalsContact CD2-CB 3.48Å; L579-A582 HydrophobicContact CG-CB 3.73Å; L579-A582 PolarHBondContact O-N 2.83Å; L579-A582 VanDerWaalsContact O-N 3.07Å; P580-A582 PolarHBondContact O-N 2.9Å; A582-V603 CarbonylContact O-C 3.58Å; A582-V603 WeakPolarHBondContact O-CA 3.1Å; A582-N604 PolarHBondContact O-N 3.07Å; A582-R607 HydrophobicContact CB-CB 4.13Å; A582-R607 HydrophobicContact CB-CG 4.04Å; A582-I608 HydrophobicContact CB-CG1 4.14Å
583	V	94.5	Very high	89.8	Confident	13 Å²	13	64.6 Å²	64.6	8%	0.079	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	136.6	-178.6	-171.1	0	0	0	0	110.4	A572 V575 Q576 P580 E581 L601 V602	A572-V583 HydrophobicContact CB-CG1 4.34Å; V575-V583 HydrophobicContact CB-CG2 3.91Å; V575-V583 HydrophobicContact CG1-CG2 3.64Å; Q576-V583 HydrophobicContact CB-CB 4.17Å; Q576-V583 HydrophobicContact CB-CG1 4.34Å; Q576-V583 HydrophobicContact CB-CG2 3.96Å; Q576-V583 HydrophobicContact CG-CB 4.23Å; Q576-V583 HydrophobicContact CG-CG1 4.46Å; P580-V583 PolarHBondContact O-N 3.47Å; P580-V583 VanDerWaalsContact O-N 3.11Å; E581-V583 VanDerWaalsContact C-N 3.34Å; V583-L601 HydrophobicContact CG1-CB 3.88Å; V583-L601 HydrophobicContact CG1-CD1 4.13Å; V583-L601 HydrophobicContact CG1-CD2 4.29Å; V583-L601 HydrophobicContact CG1-CG 4.33Å; V583-V602 WeakPolarHBondContact CA-O 3.05Å
584	K	91.3	Very high	89.2	Confident	150 Å²	150	62.3 Å²	62.3	65%	0.652	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.4	176.7	-68	-175.6	177.3	-177.9	0	110.9	L601 V602	K584-L601 CarbonylContact O-C 3.59Å; K584-L601 WeakPolarHBondContact O-CA 3.41Å; K584-V602 PolarHBondContact N-O 2.8Å; K584-V602 PolarHBondContact O-N 3.5Å
585	E	89	Confident	88.9	Confident	137 Å²	137	64.3 Å²	64.3	64%	0.64	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.3	169.6	-68.2	168.2	-170.4	0	0	109.6	L601	E585-L601 HydrophobicContact CG-CD2 3.76Å
586	G	79.3	Confident	88.5	Confident	35 Å²	35	67.8 Å²	67.8	36%	0.361	39%	0.386	S	S	.	.			trans	-101.3	14.2	176.7	0	0	0	0	0	114	L600	G586-L600 WeakPolarHBondContact CA-O 3.35Å; G586-L600 PolarHBondContact N-O 3.32Å
587	G	82.8	Confident	88.2	Confident	28 Å²	28	66.6 Å²	66.6	29%	0.289	38%	0.382	S	S	.	.			trans	73.6	-165.7	179.9	0	0	0	0	0	115	N599 L600	G587-N599 PolarHBondContact O-N 2.85Å; G587-L600 PolarHBondContact O-N 2.91Å
588	D	84.4	Confident	87.9	Confident	103 Å²	103	63 Å²	63	55%	0.551	37%	0.373	S	S	*	.			trans	-89.8	127.5	-172.1	-68.6	-0	0	0	0	112	T596 I597 P598 N599	D588-T596 HydrophobicContact CB-CG2 3.91Å; D588-I597 WeakPolarHBondContact CA-O 3.33Å; D588-P598 WeakPolarHBondContact OD1-CA 3.29Å; D588-N599 PolarHBondContact OD1-N 3.09Å
589	V	82.6	Confident	87.6	Confident	26 Å²	26	65.7 Å²	65.7	16%	0.158	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121	178.8	179.4	0	0	0	0	111.2	F556 T559 T596 I597 L600	F556-V589 HydrophobicContact CD2-CG1 4.23Å; F556-V589 HydrophobicContact CE2-CG1 3.99Å; T559-V589 HydrophobicContact CG2-CG1 4.06Å; V589-T596 WeakPolarHBondContact O-CA 3.35Å; V589-I597 PolarHBondContact N-O 2.88Å; V589-I597 PolarHBondContact O-N 2.63Å; V589-L600 HydrophobicContact CB-CD2 4.45Å; V589-L600 HydrophobicContact CG2-CB 4.24Å; V589-L600 HydrophobicContact CG2-CD2 3.68Å
590	V	84.4	Confident	87.3	Confident	87 Å²	87	68 Å²	68	53%	0.527	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.2	176.1	-173.7	0	0	0	0	110	T559 T596	T559-V590 WeakPolarHBondContact CG2-O 3.36Å; T559-V590 PolarHBondContact OG1-O 2.95Å; T559-V590 VanDerWaalsContact OG1-O 3.11Å; V590-T596 HydrophobicContact CG2-CG2 4.34Å
591	C	85.3	Confident	87.3	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.034	38%	0.383	C	S	.	.			trans	-73.9	160	179	-64.1	0	0	0	0	111.7	E555 T559 N593 G594 E595	E555-C591 HydrophobicContact CB-CB 4.23Å; E555-C591 HydrophobicContact CG-CB 4.16Å; E555-C591 WeakPolarHBondContact O-CB 3.46Å; T559-C591 WeakPolarHBondContact OG1-CA 3.34Å; C591-N593 WeakPolarHBondContact CB-OD1 3.31Å; C591-N593 PolarHBondContact O-N 2.94Å; C591-G594 PolarHBondContact O-N 3.4Å; C591-E595 WeakPolarHBondContact CB-O 3.17Å; C591-E595 PolarHBondContact N-O 3.08Å
592	A	81	Confident	87.3	Confident	73 Å²	73	64.6 Å²	64.6	60%	0.603	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.2	-175	0	0	0	0	0	114.7	E555 A558 T559	E555-A592 PolarHBondContact O-N 2.77Å; A558-A592 HydrophobicContact CB-CB 4.24Å; T559-A592 PolarHBondContact OG1-N 3.16Å; T559-A592 VanDerWaalsContact OG1-N 3.14Å
593	N	84.6	Confident	87.3	Confident	81 Å²	81	66.1 Å²	66.1	43%	0.433	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.2	172.2	64.1	-11.2	0	0	0	113.8	E555 C591 E595	E555-N593 HydrophobicContact CB-CB 4.12Å; C591-N593 WeakPolarHBondContact CB-OD1 3.31Å; C591-N593 PolarHBondContact O-N 2.94Å; N593-E595 WeakPolarHBondContact ND2-CG 3.31Å; N593-E595 PolarHBondContact ND2-OE2 3.36Å; N593-E595 WeakPolarHBondContact OD1-CB 3.5Å; N593-E595 PolarHBondContact OD1-N 3.25Å
594	G	83.3	Confident	87.2	Confident	56 Å²	56	68.7 Å²	68.7	58%	0.577	41%	0.405	S	S	*	.	S	Bend	trans	89.8	2.6	-174.7	0	0	0	0	0	115.2	C591	C591-G594 PolarHBondContact O-N 3.4Å
595	E	88.9	Confident	87.1	Confident	100 Å²	100	65.5 Å²	65.5	47%	0.467	39%	0.392	S	S	.	.			trans	-77.3	129.7	170.8	-67.2	179.2	153.4	0	0	110.4	K553 C591 N593	K553-E595 IonicContact NZ-OE2 3.27Å; K553-E595 PolarHBondContact NZ-OE2 2.83Å; C591-E595 WeakPolarHBondContact CB-O 3.17Å; C591-E595 PolarHBondContact N-O 3.08Å; N593-E595 WeakPolarHBondContact ND2-CG 3.31Å; N593-E595 PolarHBondContact ND2-OE2 3.36Å; N593-E595 WeakPolarHBondContact OD1-CB 3.5Å; N593-E595 PolarHBondContact OD1-N 3.25Å
596	T	87.8	Confident	87.2	Confident	74 Å²	74	63.9 Å²	63.9	45%	0.454	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.1	171.2	-52	0	0	0	0	110.2	D588 V589 V590 P598	D588-T596 HydrophobicContact CB-CG2 3.91Å; V589-T596 WeakPolarHBondContact O-CA 3.35Å; V590-T596 HydrophobicContact CG2-CG2 4.34Å; T596-P598 WeakPolarHBondContact O-CD 3.35Å
597	I	89.3	Confident	87.9	Confident	53 Å²	53	65.9 Å²	65.9	27%	0.272	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	107.9	164.2	-57.7	176.4	0	0	0	106.9	F556 D588 V589 L600	F556-I597 HydrophobicContact CD2-CD1 3.81Å; F556-I597 HydrophobicContact CE2-CD1 4.37Å; D588-I597 WeakPolarHBondContact CA-O 3.33Å; V589-I597 PolarHBondContact N-O 2.88Å; V589-I597 PolarHBondContact O-N 2.63Å; I597-L600 HydrophobicContact CG2-CD1 4.14Å
598	P	89.2	Confident	88.5	Confident	88 Å²	88	65.3 Å²	65.3	57%	0.571	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	146	179.9	32.1	-34.9	0	0	0	111.4	D588 T596 L600	D588-P598 WeakPolarHBondContact OD1-CA 3.29Å; T596-P598 WeakPolarHBondContact O-CD 3.35Å; P598-L600 PolarHBondContact O-N 3.03Å
599	N	87.5	Confident	88.9	Confident	92 Å²	92	64.9 Å²	64.9	49%	0.492	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	44	55.6	176.7	-64.5	-23.1	0	0	0	113.8	G587 D588 L601	G587-N599 PolarHBondContact O-N 2.85Å; D588-N599 PolarHBondContact OD1-N 3.09Å; N599-L601 PolarHBondContact O-N 2.93Å
600	L	90.4	Very high	89.5	Confident	47 Å²	47	69.2 Å²	69.2	25%	0.246	38%	0.384	C	S	.	.			trans	-57.1	121.6	178.2	-179.9	68.2	0	0	0	110.4	F556 G586 G587 V589 I597 P598	F556-L600 HydrophobicContact CE2-CD2 3.84Å; F556-L600 HydrophobicContact CZ-CD2 3.95Å; G586-L600 WeakPolarHBondContact CA-O 3.35Å; G586-L600 PolarHBondContact N-O 3.32Å; G587-L600 PolarHBondContact O-N 2.91Å; V589-L600 HydrophobicContact CB-CD2 4.45Å; V589-L600 HydrophobicContact CG2-CB 4.24Å; V589-L600 HydrophobicContact CG2-CD2 3.68Å; I597-L600 HydrophobicContact CG2-CD1 4.14Å; P598-L600 PolarHBondContact O-N 3.03Å
601	L	93.2	Very high	90	Very high	30 Å²	30	65.3 Å²	65.3	16%	0.157	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.4	179.1	-62.4	-176.1	0	0	0	111.4	A572 Q573 V583 K584 E585 N599	A572-L601 HydrophobicContact CB-CB 3.63Å; A572-L601 HydrophobicContact CB-CD1 4.39Å; Q573-L601 HydrophobicContact CG-CD1 3.93Å; V583-L601 HydrophobicContact CG1-CB 3.88Å; V583-L601 HydrophobicContact CG1-CD1 4.13Å; V583-L601 HydrophobicContact CG1-CD2 4.29Å; V583-L601 HydrophobicContact CG1-CG 4.33Å; K584-L601 CarbonylContact O-C 3.59Å; K584-L601 WeakPolarHBondContact O-CA 3.41Å; E585-L601 HydrophobicContact CG-CD2 3.76Å; N599-L601 PolarHBondContact O-N 2.93Å
602	V	91.2	Very high	90.5	Very high	79 Å²	79	67.9 Å²	67.9	48%	0.479	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.4	178.8	-177.3	0	0	0	0	109.4	V583 K584	V583-V602 WeakPolarHBondContact CA-O 3.05Å; K584-V602 PolarHBondContact N-O 2.8Å; K584-V602 PolarHBondContact O-N 3.5Å
603	V	93.9	Very high	91.2	Very high	31 Å²	31	67.5 Å²	67.5	19%	0.188	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.4	-177.4	-178	0	0	0	0	110.7	V570 A572 V575 A582 K605 I608	V570-V603 HydrophobicContact CG2-CG1 4.21Å; A572-V603 HydrophobicContact CB-CG2 3.54Å; V575-V603 HydrophobicContact CG1-CG1 4.46Å; A582-V603 CarbonylContact O-C 3.58Å; A582-V603 WeakPolarHBondContact O-CA 3.1Å; V603-K605 PolarHBondContact O-N 3.09Å; V603-I608 HydrophobicContact CG1-CD1 3.43Å; V603-I608 VanDerWaalsContact CG1-CD1 3.43Å; V603-I608 HydrophobicContact CG1-CG1 4.46Å
604	N	91.3	Very high	91.7	Very high	67 Å²	67	64.1 Å²	64.1	36%	0.358	35%	0.347	S	S	.	.			trans	-74.1	91.9	169	-176.7	-10.8	0	0	0	110.1	A582 E606 R607 I608	A582-N604 PolarHBondContact O-N 3.07Å; N604-E606 PolarHBondContact O-N 3.29Å; N604-E606 WeakPolarHBondContact OD1-CB 3.43Å; N604-E606 PolarHBondContact OD1-N 2.7Å; N604-R607 HydrophobicContact CB-CB 4.34Å; N604-R607 PolarHBondContact O-N 3.11Å; N604-R607 PolarHBondContact OD1-N 2.87Å; N604-R607 VanDerWaalsContact OD1-N 3.15Å; N604-I608 PolarHBondContact O-N 2.6Å
605	K	90.7	Very high	92.3	Very high	84 Å²	84	61.6 Å²	61.6	37%	0.365	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-30.5	177.3	-67.3	-177.6	175.3	-178.7	0	112.5	L23 E567 V603 I608 F609	L23-K605 HydrophobicContact CD2-CB 4Å; L23-K605 HydrophobicContact CD2-CD 3.58Å; L23-K605 HydrophobicContact CD2-CG 4.41Å; E567-K605 IonicContact OE1-NZ 2.7Å; E567-K605 PolarHBondContact OE1-NZ 3.24Å; V603-K605 PolarHBondContact O-N 3.09Å; K605-I608 PolarHBondContact O-N 2.94Å; K605-F609 PolarHBondContact O-N 2.82Å
606	E	90.7	Very high	92.7	Very high	103 Å²	103	59.9 Å²	59.9	48%	0.481	32%	0.317	S	S	.	.	H	α-helix	trans	-65.3	-40.2	175.2	-59.2	-180	179	0	0	112.4	H520 N604 F609 M610	H520-E606 IonicContact CE1-OE1 3.01Å; H520-E606 PolarHBondContact CE1-OE1 3.28Å; H520-E606 IonicContact ND1-OE1 2.96Å; N604-E606 PolarHBondContact O-N 3.29Å; N604-E606 WeakPolarHBondContact OD1-CB 3.43Å; N604-E606 PolarHBondContact OD1-N 2.7Å; E606-F609 WeakPolarHBondContact O-CB 3.46Å; E606-F609 PolarHBondContact O-N 2.9Å; E606-M610 PolarHBondContact O-N 2.85Å
607	R	93.4	Very high	93	Very high	77 Å²	77	61.3 Å²	61.3	29%	0.291	32%	0.318	S	S	.	.	H	α-helix	trans	-66.8	-39.8	178.8	179.1	55.2	-166.9	-84.4	-6.2	111.4	L579 E581 A582 N604 F609 M610 E611	L579-R607 HydrophobicContact CD2-CG 4.37Å; E581-R607 IonicContact OE1-CZ 3.86Å; E581-R607 VanDerWaalsContact OE1-CZ 3.24Å; E581-R607 IonicContact OE1-NH1 2.75Å; E581-R607 PolarHBondContact OE1-NH1 3.05Å; E581-R607 VanDerWaalsContact OE1-NH1 3.16Å; E581-R607 IonicContact OE1-NH2 2.92Å; E581-R607 PolarHBondContact OE1-NH2 3.38Å; A582-R607 HydrophobicContact CB-CB 4.13Å; A582-R607 HydrophobicContact CB-CG 4.04Å; N604-R607 HydrophobicContact CB-CB 4.34Å; N604-R607 PolarHBondContact O-N 3.11Å; N604-R607 PolarHBondContact OD1-N 2.87Å; N604-R607 VanDerWaalsContact OD1-N 3.15Å; R607-F609 VanDerWaalsContact C-N 3.31Å; R607-F609 PolarHBondContact O-N 3.31Å; R607-M610 PolarHBondContact O-N 2.7Å; R607-E611 IonicContact CZ-OE1 3.67Å; R607-E611 VanDerWaalsContact CZ-OE1 3.29Å; R607-E611 IonicContact NE-OE1 2.62Å; R607-E611 PolarHBondContact NE-OE1 3.21Å; R607-E611 IonicContact NH2-OE1 2.74Å; R607-E611 PolarHBondContact NH2-OE1 2.92Å; R607-E611 WeakPolarHBondContact O-CG 3.35Å; R607-E611 PolarHBondContact O-N 3.19Å; R607-E611 VanDerWaalsContact O-N 3.1Å
608	I	94.6	Very high	93.4	Very high	16 Å²	16	59.2 Å²	59.2	8%	0.082	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-41.5	173.1	-60.8	175.7	0	0	0	110.3	I542 M545 V570 V575 L579 A582 V603 N604 K605 M610 E611 N612	I542-I608 HydrophobicContact CD1-CG2 4.28Å; M545-I608 HydrophobicContact CE-CD1 4.42Å; M545-I608 HydrophobicContact CE-CG1 4.36Å; M545-I608 HydrophobicContact CE-CG2 4.43Å; M545-I608 HydrophobicContact SD-CD1 3.97Å; M545-I608 HydrophobicContact SD-CG1 4.33Å; M545-I608 HydrophobicContact SD-CG2 3.8Å; V570-I608 HydrophobicContact CG2-CD1 4.01Å; V575-I608 HydrophobicContact CG1-CD1 4.02Å; V575-I608 HydrophobicContact CG2-CD1 4.24Å; L579-I608 HydrophobicContact CD2-CG1 4.08Å; A582-I608 HydrophobicContact CB-CG1 4.14Å; V603-I608 HydrophobicContact CG1-CD1 3.43Å; V603-I608 VanDerWaalsContact CG1-CD1 3.43Å; V603-I608 HydrophobicContact CG1-CG1 4.46Å; N604-I608 PolarHBondContact O-N 2.6Å; K605-I608 PolarHBondContact O-N 2.94Å; I608-M610 PolarHBondContact O-N 3.47Å; I608-E611 WeakPolarHBondContact O-CB 3.35Å; I608-E611 PolarHBondContact O-N 2.8Å; I608-N612 PolarHBondContact O-N 3.21Å
609	F	94.6	Very high	93.6	Very high	94 Å²	94	59.1 Å²	59.1	41%	0.412	30%	0.301	S	S	.	.	H	α-helix	trans	-59.2	-43.8	175.8	-177.1	-83.6	0	0	0	112.4	I19 K605 E606 R607 E611 N612 V613	I19-F609 HydrophobicContact CG2-CD1 4.35Å; I19-F609 HydrophobicContact CG2-CE1 3.38Å; I19-F609 HydrophobicContact CG2-CZ 3.5Å; I19-F609 VanDerWaalsContact CG2-CZ 3.5Å; K605-F609 PolarHBondContact O-N 2.82Å; E606-F609 WeakPolarHBondContact O-CB 3.46Å; E606-F609 PolarHBondContact O-N 2.9Å; R607-F609 VanDerWaalsContact C-N 3.31Å; R607-F609 PolarHBondContact O-N 3.31Å; F609-E611 VanDerWaalsContact C-N 3.33Å; F609-E611 PolarHBondContact O-N 2.83Å; F609-N612 WeakPolarHBondContact O-CA 3.5Å; F609-N612 WeakPolarHBondContact O-CB 3.18Å; F609-N612 PolarHBondContact O-N 2.94Å; F609-N612 VanDerWaalsContact O-N 3.1Å; F609-V613 HydrophobicContact CD1-CG2 4.04Å; F609-V613 HydrophobicContact CE1-CG2 3.5Å; F609-V613 VanDerWaalsContact CE1-CG2 3.5Å; F609-V613 HydrophobicContact CZ-CG2 4.06Å; F609-V613 PolarHBondContact O-N 3.39Å
610	M	94.3	Very high	93.9	Very high	116 Å²	116	56.7 Å²	56.7	57%	0.571	29%	0.29	S	S	*	.	H	α-helix	trans	-67.4	-31	177.1	-67.6	-57	-60.6	0	0	113.3	E606 R607 I608 G614	E606-M610 PolarHBondContact O-N 2.85Å; R607-M610 PolarHBondContact O-N 2.7Å; I608-M610 PolarHBondContact O-N 3.47Å; M610-G614 PolarHBondContact O-N 2.83Å
611	E	94.9	Very high	94.1	Very high	5 Å²	5	59.5 Å²	59.5	2%	0.023	30%	0.301	C	S	.	.	H	α-helix	trans	-67.3	-38.8	168.7	-63.1	-75.6	136.7	0	0	111.5	N538 R541 I542 L579 R607 I608 F609 V613 G614 A615	N538-E611 PolarHBondContact ND2-OE1 3.42Å; N538-E611 PolarHBondContact ND2-OE2 3.3Å; R541-E611 IonicContact CZ-OE2 3.46Å; R541-E611 VanDerWaalsContact CZ-OE2 3.22Å; R541-E611 IonicContact NE-OE2 3.55Å; R541-E611 PolarHBondContact NE-OE2 3.14Å; R541-E611 IonicContact NH2-OE1 3.58Å; R541-E611 IonicContact NH2-OE2 2.82Å; R541-E611 PolarHBondContact NH2-OE2 3.49Å; I542-E611 HydrophobicContact CD1-CB 3.74Å; I542-E611 HydrophobicContact CG1-CB 4Å; L579-E611 HydrophobicContact CD1-CG 3.87Å; L579-E611 HydrophobicContact CD2-CG 3.73Å; L579-E611 HydrophobicContact CG-CG 4.48Å; R607-E611 IonicContact CZ-OE1 3.67Å; R607-E611 VanDerWaalsContact CZ-OE1 3.29Å; R607-E611 IonicContact NE-OE1 2.62Å; R607-E611 PolarHBondContact NE-OE1 3.21Å; R607-E611 IonicContact NH2-OE1 2.74Å; R607-E611 PolarHBondContact NH2-OE1 2.92Å; R607-E611 WeakPolarHBondContact O-CG 3.35Å; R607-E611 PolarHBondContact O-N 3.19Å; R607-E611 VanDerWaalsContact O-N 3.1Å; I608-E611 WeakPolarHBondContact O-CB 3.35Å; I608-E611 PolarHBondContact O-N 2.8Å; F609-E611 VanDerWaalsContact C-N 3.33Å; F609-E611 PolarHBondContact O-N 2.83Å; E611-V613 PolarHBondContact O-N 2.76Å; E611-G614 PolarHBondContact O-N 3.24Å; E611-A615 WeakPolarHBondContact O-CB 3.29Å; E611-A615 PolarHBondContact O-N 3.46Å
612	N	94.8	Very high	94.1	Very high	60 Å²	60	62 Å²	62	32%	0.321	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-41.7	173.6	-71.5	-26	0	0	0	111.8	I542 I608 F609 G614 A615 V616	I542-N612 WeakPolarHBondContact CD1-OD1 3.16Å; I542-N612 VanDerWaalsContact CG1-OD1 3.3Å; I542-N612 WeakPolarHBondContact CG1-OD1 3.41Å; I542-N612 WeakPolarHBondContact CG2-OD1 3.23Å; I608-N612 PolarHBondContact O-N 3.21Å; F609-N612 WeakPolarHBondContact O-CA 3.5Å; F609-N612 WeakPolarHBondContact O-CB 3.18Å; F609-N612 PolarHBondContact O-N 2.94Å; F609-N612 VanDerWaalsContact O-N 3.1Å; N612-G614 VanDerWaalsContact C-N 3.32Å; N612-G614 PolarHBondContact O-N 3.18Å; N612-A615 WeakPolarHBondContact O-CB 3.17Å; N612-A615 PolarHBondContact O-N 2.87Å; N612-V616 WeakPolarHBondContact O-CG2 3.49Å; N612-V616 PolarHBondContact O-N 2.9Å
613	V	96.3	Very high	94.2	Very high	65 Å²	65	62.2 Å²	62.2	39%	0.394	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-42.2	174.5	174.5	0	0	0	0	111.1	F609 E611 V616 K617	F609-V613 HydrophobicContact CD1-CG2 4.04Å; F609-V613 HydrophobicContact CE1-CG2 3.5Å; F609-V613 VanDerWaalsContact CE1-CG2 3.5Å; F609-V613 HydrophobicContact CZ-CG2 4.06Å; F609-V613 PolarHBondContact O-N 3.39Å; E611-V613 PolarHBondContact O-N 2.76Å; V613-V616 PolarHBondContact O-N 3.08Å; V613-K617 WeakPolarHBondContact O-CB 3.44Å; V613-K617 PolarHBondContact O-N 2.8Å
614	G	95.6	Very high	94.1	Very high	9 Å²	9	65 Å²	65	9%	0.093	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-38.6	173.6	0	0	0	0	0	113.4	T535 M610 E611 N612 E618	T535-G614 WeakPolarHBondContact CB-O 3.26Å; M610-G614 PolarHBondContact O-N 2.83Å; E611-G614 PolarHBondContact O-N 3.24Å; N612-G614 VanDerWaalsContact C-N 3.32Å; N612-G614 PolarHBondContact O-N 3.18Å; G614-E618 PolarHBondContact O-N 3.4Å
615	A	96.2	Very high	94.2	Very high	4 Å²	4	65.9 Å²	65.9	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-67	-44.4	176.4	0	0	0	0	0	112.5	L539 I542 E611 N612 K617 E618 L619	L539-A615 HydrophobicContact CB-CB 4.12Å; L539-A615 HydrophobicContact CD1-CB 4.06Å; I542-A615 HydrophobicContact CB-CB 4.03Å; I542-A615 HydrophobicContact CG1-CB 4.04Å; I542-A615 HydrophobicContact CG2-CB 4.28Å; E611-A615 WeakPolarHBondContact O-CB 3.29Å; E611-A615 PolarHBondContact O-N 3.46Å; N612-A615 WeakPolarHBondContact O-CB 3.17Å; N612-A615 PolarHBondContact O-N 2.87Å; A615-K617 VanDerWaalsContact C-N 3.35Å; A615-K617 PolarHBondContact O-N 3.15Å; A615-E618 PolarHBondContact O-N 2.75Å; A615-L619 WeakPolarHBondContact O-CG 3.45Å; A615-L619 PolarHBondContact O-N 3.05Å
616	V	96.4	Very high	94.3	Very high	63 Å²	63	66.5 Å²	66.5	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-40.9	175.7	171.3	0	0	0	0	110.9	F14 N612 V613 E618 L619 C620	F14-V616 HydrophobicContact CZ-CG1 4.22Å; N612-V616 WeakPolarHBondContact O-CG2 3.49Å; N612-V616 PolarHBondContact O-N 2.9Å; V613-V616 PolarHBondContact O-N 3.08Å; V616-E618 VanDerWaalsContact C-N 3.28Å; V616-E618 PolarHBondContact O-N 2.97Å; V616-L619 PolarHBondContact O-N 2.93Å; V616-L619 VanDerWaalsContact O-N 3.1Å; V616-C620 PolarHBondContact O-N 3Å; V616-C620 PolarHBondContact O-SG 3.47Å; V616-C620 VanDerWaalsContact O-SG 3.35Å
617	K	95.6	Very high	94.4	Very high	105 Å²	105	67.1 Å²	67.1	46%	0.457	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-35.8	174.3	179.8	175.6	164.8	-173.7	0	112.8	E532 T535 V613 A615 K621	E532-K617 IonicContact OE1-NZ 2.7Å; E532-K617 PolarHBondContact OE1-NZ 3.23Å; T535-K617 HydrophobicContact CG2-CB 4.15Å; T535-K617 HydrophobicContact CG2-CD 3.78Å; T535-K617 HydrophobicContact CG2-CG 3.97Å; V613-K617 WeakPolarHBondContact O-CB 3.44Å; V613-K617 PolarHBondContact O-N 2.8Å; A615-K617 VanDerWaalsContact C-N 3.35Å; A615-K617 PolarHBondContact O-N 3.15Å; K617-K621 WeakPolarHBondContact O-CB 3.14Å; K617-K621 PolarHBondContact O-N 3.05Å
618	E	96.1	Very high	94.4	Very high	9 Å²	9	67.3 Å²	67.3	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-70.6	-40.7	172.3	-167.7	61	-157.2	0	0	112.1	T535 L539 G614 A615 V616 K621 L622	T535-E618 WeakPolarHBondContact CB-OE2 3.25Å; T535-E618 PolarHBondContact OG1-OE2 3.22Å; L539-E618 HydrophobicContact CB-CB 4.11Å; L539-E618 HydrophobicContact CB-CG 4.3Å; L539-E618 HydrophobicContact CD2-CB 4.02Å; L539-E618 HydrophobicContact CD2-CG 3.78Å; G614-E618 PolarHBondContact O-N 3.4Å; A615-E618 PolarHBondContact O-N 2.75Å; V616-E618 VanDerWaalsContact C-N 3.28Å; V616-E618 PolarHBondContact O-N 2.97Å; E618-K621 PolarHBondContact O-N 3.02Å; E618-K621 IonicContact OE1-NZ 3.92Å; E618-K621 PolarHBondContact OE1-NZ 2.98Å; E618-K621 IonicContact OE2-NZ 3.74Å; E618-K621 PolarHBondContact OE2-NZ 2.89Å; E618-L622 HydrophobicContact CG-CD1 4.28Å; E618-L622 WeakPolarHBondContact O-CG 3.45Å; E618-L622 PolarHBondContact O-N 3.4Å
619	L	94.4	Very high	94.3	Very high	86 Å²	86	73.2 Å²	73.2	45%	0.45	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-45.2	178	-71.1	170.9	0	0	0	111.9	L539 A615 V616 K621 L622 T623	L539-L619 HydrophobicContact CD1-CD1 4.02Å; L539-L619 HydrophobicContact CD1-CD2 3.95Å; L539-L619 HydrophobicContact CD1-CG 3.83Å; L539-L619 HydrophobicContact CD2-CD2 3.85Å; L539-L619 HydrophobicContact CD2-CG 4.12Å; A615-L619 WeakPolarHBondContact O-CG 3.45Å; A615-L619 PolarHBondContact O-N 3.05Å; V616-L619 PolarHBondContact O-N 2.93Å; V616-L619 VanDerWaalsContact O-N 3.1Å; L619-K621 PolarHBondContact O-N 2.81Å; L619-L622 PolarHBondContact O-N 3.46Å; L619-L622 VanDerWaalsContact O-N 3.16Å; L619-T623 PolarHBondContact O-N 3.41Å; L619-T623 PolarHBondContact O-OG1 3.36Å; L619-T623 VanDerWaalsContact O-OG1 3.11Å
620	C	94.1	Very high	94.2	Very high	40 Å²	40	73.6 Å²	73.6	27%	0.27	38%	0.38	S	S	.	.	H	α-helix	trans	-56.3	-51.9	173	-61.8	0	0	0	0	110.9	V616 L622 T623 D624	V616-C620 PolarHBondContact O-N 3Å; V616-C620 PolarHBondContact O-SG 3.47Å; V616-C620 VanDerWaalsContact O-SG 3.35Å; C620-L622 PolarHBondContact O-N 3.05Å; C620-L622 VanDerWaalsContact O-N 3.12Å; C620-T623 CarbonylContact O-C 3.53Å; C620-T623 WeakPolarHBondContact O-CA 3.29Å; C620-T623 WeakPolarHBondContact O-CB 3.42Å; C620-T623 PolarHBondContact O-N 3.18Å; C620-D624 PolarHBondContact O-N 3.15Å; C620-D624 VanDerWaalsContact O-OD1 3.04Å
621	K	94.3	Very high	94.1	Very high	107 Å²	107	70.2 Å²	70.2	47%	0.465	36%	0.364	S	S	.	.	H	α-helix	trans	-56.1	-30.2	176.8	163.3	171.6	163	-98.9	0	114.2	K617 E618 L619 N625	K617-K621 WeakPolarHBondContact O-CB 3.14Å; K617-K621 PolarHBondContact O-N 3.05Å; E618-K621 PolarHBondContact O-N 3.02Å; E618-K621 IonicContact OE1-NZ 3.92Å; E618-K621 PolarHBondContact OE1-NZ 2.98Å; E618-K621 IonicContact OE2-NZ 3.74Å; E618-K621 PolarHBondContact OE2-NZ 2.89Å; L619-K621 PolarHBondContact O-N 2.81Å; K621-N625 PolarHBondContact O-N 3.36Å
622	L	93.4	Very high	94	Very high	81 Å²	81	75.3 Å²	75.3	42%	0.424	39%	0.388	S	S	.	.	H	α-helix	trans	-78.2	-39	172.6	-70.1	170.7	0	0	0	112	L539 E618 L619 C620 N625 L626	L539-L622 HydrophobicContact CD2-CD1 4.16Å; E618-L622 HydrophobicContact CG-CD1 4.28Å; E618-L622 WeakPolarHBondContact O-CG 3.45Å; E618-L622 PolarHBondContact O-N 3.4Å; L619-L622 PolarHBondContact O-N 3.46Å; L619-L622 VanDerWaalsContact O-N 3.16Å; C620-L622 PolarHBondContact O-N 3.05Å; C620-L622 VanDerWaalsContact O-N 3.12Å; L622-N625 PolarHBondContact O-N 3.27Å; L622-L626 WeakPolarHBondContact O-CG 3.38Å; L622-L626 PolarHBondContact O-N 2.97Å; L622-L626 VanDerWaalsContact O-N 3.1Å
623	T	93.3	Very high	93.8	Very high	85 Å²	85	78.1 Å²	78.1	52%	0.521	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-49.8	173	-58.5	0	0	0	0	111.3	L619 C620 N625 L626 E627	L619-T623 PolarHBondContact O-N 3.41Å; L619-T623 PolarHBondContact O-OG1 3.36Å; L619-T623 VanDerWaalsContact O-OG1 3.11Å; C620-T623 CarbonylContact O-C 3.53Å; C620-T623 WeakPolarHBondContact O-CA 3.29Å; C620-T623 WeakPolarHBondContact O-CB 3.42Å; C620-T623 PolarHBondContact O-N 3.18Å; T623-N625 PolarHBondContact O-N 3.31Å; T623-L626 CarbonylContact O-C 3.47Å; T623-L626 WeakPolarHBondContact O-CA 3.35Å; T623-L626 WeakPolarHBondContact O-CB 3.18Å; T623-L626 PolarHBondContact O-N 3.21Å; T623-E627 PolarHBondContact O-N 3.49Å
624	D	92	Very high	93.5	Very high	88 Å²	88	79.5 Å²	79.5	47%	0.471	40%	0.404	S	S	.	.	H	α-helix	trans	-53.7	-38.8	175.8	-52.2	-17.4	0	0	0	111.3	C620 T628	C620-D624 PolarHBondContact O-N 3.15Å; C620-D624 VanDerWaalsContact O-OD1 3.04Å; D624-T628 WeakPolarHBondContact O-CB 3.11Å; D624-T628 VanDerWaalsContact O-CG2 3.31Å; D624-T628 WeakPolarHBondContact O-CG2 3.43Å; D624-T628 PolarHBondContact O-N 3.09Å; D624-T628 PolarHBondContact O-OG1 3.31Å
625	N	93.2	Very high	93.2	Very high	86 Å²	86	85.3 Å²	85.3	46%	0.46	42%	0.424	S	S	.	.	H	α-helix	trans	-70.6	-32.4	177.5	-169.3	-100.3	0	0	0	113.1	K621 L622 T623 T628 R629	K621-N625 PolarHBondContact O-N 3.36Å; L622-N625 PolarHBondContact O-N 3.27Å; T623-N625 PolarHBondContact O-N 3.31Å; N625-T628 PolarHBondContact O-OG1 3.29Å; N625-R629 WeakPolarHBondContact O-CB 3.48Å; N625-R629 VanDerWaalsContact O-CD 3.24Å; N625-R629 WeakPolarHBondContact O-CD 3.39Å; N625-R629 WeakPolarHBondContact O-CG 3.34Å; N625-R629 PolarHBondContact O-N 3.33Å
626	L	93.2	Very high	92.6	Very high	97 Å²	97	92.7 Å²	92.7	51%	0.508	45%	0.451	S	S	.	.	H	α-helix	trans	-76.4	-44.7	175	-69.1	170.9	0	0	0	110.9	L622 T623 R629 I630	L622-L626 WeakPolarHBondContact O-CG 3.38Å; L622-L626 PolarHBondContact O-N 2.97Å; L622-L626 VanDerWaalsContact O-N 3.1Å; T623-L626 CarbonylContact O-C 3.47Å; T623-L626 WeakPolarHBondContact O-CA 3.35Å; T623-L626 WeakPolarHBondContact O-CB 3.18Å; T623-L626 PolarHBondContact O-N 3.21Å; L626-R629 CarbonylContact O-C 3.59Å; L626-R629 PolarHBondContact O-N 3.49Å; L626-I630 VanDerWaalsContact O-CG1 3.26Å; L626-I630 WeakPolarHBondContact O-CG1 3.28Å; L626-I630 PolarHBondContact O-N 2.72Å
627	E	92.5	Very high	92	Very high	117 Å²	117	93.2 Å²	93.2	55%	0.547	46%	0.457	S	S	.	.	H	α-helix	trans	-59.8	-51.8	177.8	-167.7	-150.3	142.2	0	0	111.4	T623 R629 I630 D631	T623-E627 PolarHBondContact O-N 3.49Å; E627-R629 PolarHBondContact O-N 2.73Å; E627-I630 CarbonylContact O-C 3.59Å; E627-I630 WeakPolarHBondContact O-CA 3.24Å; E627-I630 WeakPolarHBondContact O-CB 3.02Å; E627-I630 PolarHBondContact O-N 3.25Å; E627-D631 PolarHBondContact O-N 3.37Å
628	T	92.4	Very high	91.6	Very high	81 Å²	81	93.8 Å²	93.8	50%	0.497	46%	0.457	S	S	.	.	H	α-helix	trans	-58.2	-34.2	177	48.5	0	0	0	0	112.6	D624 N625 E632	D624-T628 WeakPolarHBondContact O-CB 3.11Å; D624-T628 VanDerWaalsContact O-CG2 3.31Å; D624-T628 WeakPolarHBondContact O-CG2 3.43Å; D624-T628 PolarHBondContact O-N 3.09Å; D624-T628 PolarHBondContact O-OG1 3.31Å; N625-T628 PolarHBondContact O-OG1 3.29Å; T628-E632 WeakPolarHBondContact O-CB 3.47Å; T628-E632 WeakPolarHBondContact O-CG 3.39Å; T628-E632 PolarHBondContact O-N 3.18Å
629	R	93.1	Very high	91	Very high	139 Å²	139	98.2 Å²	98.2	53%	0.525	48%	0.476	S	S	.	.	H	α-helix	trans	-74	-35.7	173.6	-73.5	173.3	62.5	-155.6	-5.7	113	N625 L626 E627 L633	N625-R629 WeakPolarHBondContact O-CB 3.48Å; N625-R629 VanDerWaalsContact O-CD 3.24Å; N625-R629 WeakPolarHBondContact O-CD 3.39Å; N625-R629 WeakPolarHBondContact O-CG 3.34Å; N625-R629 PolarHBondContact O-N 3.33Å; L626-R629 CarbonylContact O-C 3.59Å; L626-R629 PolarHBondContact O-N 3.49Å; E627-R629 PolarHBondContact O-N 2.73Å; R629-L633 WeakPolarHBondContact O-CB 3.46Å; R629-L633 WeakPolarHBondContact O-CD1 3.32Å; R629-L633 WeakPolarHBondContact O-CG 3.19Å; R629-L633 PolarHBondContact O-N 3.19Å
630	I	91.8	Very high	90.3	Very high	102 Å²	102	98.6 Å²	98.6	52%	0.523	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-49.9	173.6	-71.4	161.4	0	0	0	109.5	L626 E627 E632 L633 E634	L626-I630 VanDerWaalsContact O-CG1 3.26Å; L626-I630 WeakPolarHBondContact O-CG1 3.28Å; L626-I630 PolarHBondContact O-N 2.72Å; E627-I630 CarbonylContact O-C 3.59Å; E627-I630 WeakPolarHBondContact O-CA 3.24Å; E627-I630 WeakPolarHBondContact O-CB 3.02Å; E627-I630 PolarHBondContact O-N 3.25Å; I630-E632 PolarHBondContact O-N 2.98Å; I630-L633 CarbonylContact O-C 3.53Å; I630-L633 WeakPolarHBondContact O-CA 3.25Å; I630-L633 WeakPolarHBondContact O-CB 3.21Å; I630-L633 PolarHBondContact O-N 3.26Å; I630-L633 VanDerWaalsContact O-N 3.08Å; I630-E634 HydrophobicContact CG2-CG 4.49Å; I630-E634 WeakPolarHBondContact O-CG 3.27Å; I630-E634 PolarHBondContact O-N 2.92Å
631	D	92	Very high	89.4	Confident	46 Å²	46	99.2 Å²	99.2	25%	0.246	49%	0.486	C	S	.	.	H	α-helix	trans	-65.3	-36.7	178.5	-174.2	12.1	0	0	0	111.5	E627 E634 R635 R638	E627-D631 PolarHBondContact O-N 3.37Å; D631-E634 PolarHBondContact O-N 2.78Å; D631-R635 VanDerWaalsContact O-CB 3.32Å; D631-R635 WeakPolarHBondContact O-CB 3.47Å; D631-R635 WeakPolarHBondContact O-CD 3.49Å; D631-R635 WeakPolarHBondContact O-CG 3.42Å; D631-R635 PolarHBondContact O-N 3.1Å; D631-R635 IonicContact OD1-CZ 2.66Å; D631-R635 IonicContact OD1-NE 3.13Å; D631-R635 PolarHBondContact OD1-NE 3.22Å; D631-R635 IonicContact OD1-NH2 3.03Å; D631-R635 IonicContact OD2-CZ 2.89Å; D631-R635 IonicContact OD2-NE 3.25Å; D631-R635 PolarHBondContact OD2-NE 3.23Å; D631-R635 IonicContact OD2-NH2 2.61Å; D631-R635 PolarHBondContact OD2-NH2 3Å; D631-R638 IonicContact OD1-NH2 3.28Å; D631-R638 PolarHBondContact OD1-NH2 2.97Å
632	E	92.6	Very high	88.5	Confident	112 Å²	112	101.1 Å²	101.1	52%	0.523	49%	0.494	S	S	.	.	H	α-helix	trans	-57.6	-49.9	166.6	-82.6	-163.3	171.8	0	0	112.7	T628 I630 E634 R635 W636	T628-E632 WeakPolarHBondContact O-CB 3.47Å; T628-E632 WeakPolarHBondContact O-CG 3.39Å; T628-E632 PolarHBondContact O-N 3.18Å; I630-E632 PolarHBondContact O-N 2.98Å; E632-E634 VanDerWaalsContact C-N 3.32Å; E632-E634 PolarHBondContact O-N 3.07Å; E632-R635 WeakPolarHBondContact O-CB 3.42Å; E632-R635 PolarHBondContact O-N 3.34Å; E632-R635 VanDerWaalsContact O-N 3.16Å; E632-W636 PolarHBondContact O-N 3.14Å
633	L	90.6	Very high	87.3	Confident	118 Å²	118	102.2 Å²	102.2	62%	0.618	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-39.2	177.7	-74.2	167.2	0	0	0	111.8	R629 I630 W636 S637	R629-L633 WeakPolarHBondContact O-CB 3.46Å; R629-L633 WeakPolarHBondContact O-CD1 3.32Å; R629-L633 WeakPolarHBondContact O-CG 3.19Å; R629-L633 PolarHBondContact O-N 3.19Å; I630-L633 CarbonylContact O-C 3.53Å; I630-L633 WeakPolarHBondContact O-CA 3.25Å; I630-L633 WeakPolarHBondContact O-CB 3.21Å; I630-L633 PolarHBondContact O-N 3.26Å; I630-L633 VanDerWaalsContact O-N 3.08Å; L633-W636 PolarHBondContact O-N 2.8Å; L633-S637 WeakPolarHBondContact O-CB 3.41Å; L633-S637 PolarHBondContact O-N 2.91Å
634	E	90.5	Very high	85.8	Confident	94 Å²	94	106.9 Å²	106.9	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-42.2	172.3	-71.8	-153.5	152.8	0	0	112.2	I630 D631 E632 W636 S637 R638	I630-E634 HydrophobicContact CG2-CG 4.49Å; I630-E634 WeakPolarHBondContact O-CG 3.27Å; I630-E634 PolarHBondContact O-N 2.92Å; D631-E634 PolarHBondContact O-N 2.78Å; E632-E634 VanDerWaalsContact C-N 3.32Å; E632-E634 PolarHBondContact O-N 3.07Å; E634-W636 PolarHBondContact O-N 3.28Å; E634-S637 PolarHBondContact O-N 3.1Å; E634-R638 VanDerWaalsContact O-CB 3.22Å; E634-R638 WeakPolarHBondContact O-CB 3.48Å; E634-R638 WeakPolarHBondContact O-CG 3.43Å; E634-R638 PolarHBondContact O-N 3.43Å; E634-R638 PolarHBondContact O-NE 3.31Å; E634-R638 VanDerWaalsContact O-NE 3.17Å; E634-R638 IonicContact OE2-CZ 2.94Å; E634-R638 IonicContact OE2-NE 2.6Å; E634-R638 IonicContact OE2-NH1 3.02Å; E634-R638 PolarHBondContact OE2-NH1 3.14Å; E634-R638 IonicContact OE2-NH2 3.03Å; E634-R638 PolarHBondContact OE2-NH2 3.11Å
635	R	89.8	Confident	84.2	Confident	132 Å²	132	112.1 Å²	112.1	50%	0.498	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-36.6	175.9	-70.1	157.1	-173.7	-163.9	-3.2	110	D631 E632 K639	D631-R635 VanDerWaalsContact O-CB 3.32Å; D631-R635 WeakPolarHBondContact O-CB 3.47Å; D631-R635 WeakPolarHBondContact O-CD 3.49Å; D631-R635 WeakPolarHBondContact O-CG 3.42Å; D631-R635 PolarHBondContact O-N 3.1Å; D631-R635 IonicContact OD1-CZ 2.66Å; D631-R635 IonicContact OD1-NE 3.13Å; D631-R635 PolarHBondContact OD1-NE 3.22Å; D631-R635 IonicContact OD1-NH2 3.03Å; D631-R635 IonicContact OD2-CZ 2.89Å; D631-R635 IonicContact OD2-NE 3.25Å; D631-R635 PolarHBondContact OD2-NE 3.23Å; D631-R635 IonicContact OD2-NH2 2.61Å; D631-R635 PolarHBondContact OD2-NH2 3Å; E632-R635 WeakPolarHBondContact O-CB 3.42Å; E632-R635 PolarHBondContact O-N 3.34Å; E632-R635 VanDerWaalsContact O-N 3.16Å; R635-K639 WeakPolarHBondContact O-CD 3.35Å; R635-K639 WeakPolarHBondContact O-CG 3.39Å; R635-K639 PolarHBondContact O-N 3.45Å; R635-K639 VanDerWaalsContact O-N 3.08Å
636	W	83.4	Confident	82.4	Confident	158 Å²	158	113.4 Å²	113.4	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-70.6	-42.9	172.2	-72.2	117.2	0	0	0	112.8	E632 L633 E634 K639 L640	E632-W636 PolarHBondContact O-N 3.14Å; L633-W636 PolarHBondContact O-N 2.8Å; E634-W636 PolarHBondContact O-N 3.28Å; W636-K639 HydrophobicContact CD2-CD 4.32Å; W636-K639 HydrophobicContact CE3-CD 3.62Å; W636-K639 HydrophobicContact CZ3-CD 3.82Å; W636-K639 WeakPolarHBondContact O-CB 3.48Å; W636-K639 PolarHBondContact O-N 2.9Å; W636-L640 WeakPolarHBondContact O-CB 3.17Å; W636-L640 PolarHBondContact O-N 3.2Å
637	S	84.9	Confident	80.3	Confident	75 Å²	75	115.6 Å²	115.6	52%	0.524	54%	0.54	S	S	.	.	H	α-helix	trans	-59.2	-47.9	173.5	-177.4	0	0	0	0	111.6	L633 E634 K639 L640 A641	L633-S637 WeakPolarHBondContact O-CB 3.41Å; L633-S637 PolarHBondContact O-N 2.91Å; E634-S637 PolarHBondContact O-N 3.1Å; S637-K639 VanDerWaalsContact C-N 3.3Å; S637-K639 PolarHBondContact O-N 3.43Å; S637-L640 PolarHBondContact O-N 3.49Å; S637-L640 VanDerWaalsContact O-N 3.12Å; S637-A641 WeakPolarHBondContact O-CB 3.46Å; S637-A641 PolarHBondContact O-N 3.22Å
638	R	85.4	Confident	78.2	Confident	117 Å²	117	114 Å²	114	44%	0.442	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-31.3	175.6	-70.7	176.8	-75.8	-155	3.9	112.4	D631 E634 K642	D631-R638 IonicContact OD1-NH2 3.28Å; D631-R638 PolarHBondContact OD1-NH2 2.97Å; E634-R638 VanDerWaalsContact O-CB 3.22Å; E634-R638 WeakPolarHBondContact O-CB 3.48Å; E634-R638 WeakPolarHBondContact O-CG 3.43Å; E634-R638 PolarHBondContact O-N 3.43Å; E634-R638 PolarHBondContact O-NE 3.31Å; E634-R638 VanDerWaalsContact O-NE 3.17Å; E634-R638 IonicContact OE2-CZ 2.94Å; E634-R638 IonicContact OE2-NE 2.6Å; E634-R638 IonicContact OE2-NH1 3.02Å; E634-R638 PolarHBondContact OE2-NH1 3.14Å; E634-R638 IonicContact OE2-NH2 3.03Å; E634-R638 PolarHBondContact OE2-NH2 3.11Å; R638-K642 WeakPolarHBondContact O-CD 3.34Å; R638-K642 VanDerWaalsContact O-CG 3.3Å; R638-K642 WeakPolarHBondContact O-CG 3.5Å; R638-K642 PolarHBondContact O-N 3.29Å
639	K	84.6	Confident	76	Confident	102 Å²	102	117.6 Å²	117.6	44%	0.443	55%	0.554	S	S	.	*	H	α-helix	trans	-71.5	-46.3	169.6	-73.2	162.7	-174.2	169.8	0	111.7	R635 W636 S637 A641 K642 L643	R635-K639 WeakPolarHBondContact O-CD 3.35Å; R635-K639 WeakPolarHBondContact O-CG 3.39Å; R635-K639 PolarHBondContact O-N 3.45Å; R635-K639 VanDerWaalsContact O-N 3.08Å; W636-K639 HydrophobicContact CD2-CD 4.32Å; W636-K639 HydrophobicContact CE3-CD 3.62Å; W636-K639 HydrophobicContact CZ3-CD 3.82Å; W636-K639 WeakPolarHBondContact O-CB 3.48Å; W636-K639 PolarHBondContact O-N 2.9Å; S637-K639 VanDerWaalsContact C-N 3.3Å; S637-K639 PolarHBondContact O-N 3.43Å; K639-A641 PolarHBondContact O-N 3.18Å; K639-K642 WeakPolarHBondContact O-CB 3.43Å; K639-K642 PolarHBondContact O-N 3.01Å; K639-K642 VanDerWaalsContact O-N 3.17Å; K639-L643 PolarHBondContact O-N 2.9Å
640	L	79.1	Confident	73.7	Confident	93 Å²	93	120.5 Å²	120.5	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-65.3	-38	-179.1	-171.8	65.7	0	0	0	112.2	W636 S637 K642 L643 R644	W636-L640 WeakPolarHBondContact O-CB 3.17Å; W636-L640 PolarHBondContact O-N 3.2Å; S637-L640 PolarHBondContact O-N 3.49Å; S637-L640 VanDerWaalsContact O-N 3.12Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 2.85Å; L640-L643 PolarHBondContact O-N 2.98Å; L640-R644 PolarHBondContact O-N 3.32Å
641	A	75.7	Confident	71.2	Confident	53 Å²	53	120.6 Å²	120.6	44%	0.438	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-35.7	173	0	0	0	0	0	112.5	S637 K639 R645	S637-A641 WeakPolarHBondContact O-CB 3.46Å; S637-A641 PolarHBondContact O-N 3.22Å; K639-A641 PolarHBondContact O-N 3.18Å; A641-R645 PolarHBondContact O-N 3.45Å; A641-R645 VanDerWaalsContact O-N 3.1Å
642	K	75.1	Confident	68.5	Low	148 Å²	148	124.9 Å²	124.9	64%	0.643	61%	0.608	S	S	*	*	H	α-helix	trans	-67.5	-39.8	172.5	-74.4	171.5	-177.9	179.2	0	111.9	R638 K639 L640 R645 L646	R638-K642 WeakPolarHBondContact O-CD 3.34Å; R638-K642 VanDerWaalsContact O-CG 3.3Å; R638-K642 WeakPolarHBondContact O-CG 3.5Å; R638-K642 PolarHBondContact O-N 3.29Å; K639-K642 WeakPolarHBondContact O-CB 3.43Å; K639-K642 PolarHBondContact O-N 3.01Å; K639-K642 VanDerWaalsContact O-N 3.17Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 2.85Å; K642-R645 PolarHBondContact O-N 3.34Å; K642-L646 PolarHBondContact O-N 2.87Å
643	L	67.3	Low	65.9	Low	104 Å²	104	125.7 Å²	125.7	55%	0.545	62%	0.621	S	S	.	*	H	α-helix	trans	-63.3	-46.4	173.3	-68	171.2	0	0	0	111.6	K639 L640 R645 L646 D647	K639-L643 PolarHBondContact O-N 2.9Å; L640-L643 PolarHBondContact O-N 2.98Å; L643-R645 PolarHBondContact O-N 3.44Å; L643-L646 WeakPolarHBondContact O-CB 3.26Å; L643-L646 PolarHBondContact O-N 3.23Å; L643-D647 PolarHBondContact O-N 3.32Å
644	R	63.2	Low	63.4	Low	183 Å²	183	125.9 Å²	125.9	69%	0.691	63%	0.632	S	S	*	*	H	α-helix	trans	-58.8	-29.4	174.4	-76.4	179.9	170.8	170.5	-2.7	113.8	L640	L640-R644 PolarHBondContact O-N 3.32Å
645	R	57.7	Low	60.8	Low	197 Å²	197	124.8 Å²	124.8	74%	0.743	65%	0.646	S	S	*	*	H	α-helix	trans	-73	-26.7	171.8	-80.7	-171.5	174	-170.3	-0.3	113.3	A641 K642 L643 S648	A641-R645 PolarHBondContact O-N 3.45Å; A641-R645 VanDerWaalsContact O-N 3.1Å; K642-R645 PolarHBondContact O-N 3.34Å; L643-R645 PolarHBondContact O-N 3.44Å; R645-S648 PolarHBondContact O-N 2.9Å; R645-S648 PolarHBondContact O-OG 3.22Å
646	L	56.6	Low	58	Low	113 Å²	113	123.4 Å²	123.4	59%	0.592	66%	0.657	S	S	*	*	H	α-helix	trans	-75.3	-34.4	177.3	-67.9	168.9	0	0	0	112.3	K642 L643 S648 M649	K642-L646 PolarHBondContact O-N 2.87Å; L643-L646 WeakPolarHBondContact O-CB 3.26Å; L643-L646 PolarHBondContact O-N 3.23Å; L646-S648 PolarHBondContact O-N 3.24Å; L646-S648 VanDerWaalsContact O-N 3.15Å; L646-M649 PolarHBondContact O-N 2.76Å; L646-M649 VanDerWaalsContact O-N 3.12Å
647	D	48.5	Very low	55.8	Low	144 Å²	144	122.1 Å²	122.1	77%	0.77	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-17.1	172.6	-73.2	-40.2	0	0	0	113.6	L643	L643-D647 PolarHBondContact O-N 3.32Å
648	S	47.3	Very low	53.7	Low	83 Å²	83	125 Å²	125	58%	0.58	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-6.1	175	72.9	0	0	0	0	115	R645 L646 K650	R645-S648 PolarHBondContact O-N 2.9Å; R645-S648 PolarHBondContact O-OG 3.22Å; L646-S648 PolarHBondContact O-N 3.24Å; L646-S648 VanDerWaalsContact O-N 3.15Å; S648-K650 PolarHBondContact O-N 3.24Å
649	M	46.1	Very low	51.5	Low	157 Å²	157	124 Å²	124	77%	0.773	69%	0.692	S	S	*	*			trans	-80.6	59.1	-178.4	-66.2	-157.1	73.5	0	0	113.6	L646	L646-M649 PolarHBondContact O-N 2.76Å; L646-M649 VanDerWaalsContact O-N 3.12Å
650	K	46.2	Very low	49.4	Very low	199 Å²	199	128.1 Å²	128.1	87%	0.865	71%	0.712	S	S	*	*			trans	-141.4	43.3	174.3	-152.9	-175.7	175.7	179.7	0	115.5	S648	S648-K650 PolarHBondContact O-N 3.24Å
651	S	38.7	Very low	47.2	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	73%	0.725	S	S	*	*	S	Bend	trans	-161.2	136.8	160.6	50.1	0	0	0	0	115.2
652	T	34.9	Very low	45.1	Very low	136 Å²	136	129.3 Å²	129.3	83%	0.834	74%	0.735	S	S	*	*			trans	68	95.3	145.6	-44.7	0	0	0	0	121.2
653	V	38.5	Very low	43.5	Very low	129 Å²	129	126.1 Å²	126.1	78%	0.782	73%	0.732	S	S	*	*			trans	-26.8	132	144.2	174.9	0	0	0	0	116.4
654	S	39	Very low	42.2	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	75%	0.745	S	S	*	*			trans	160.4	163.1	134.8	-75.8	0	0	0	0	113.8
655	G	33.9	Very low	40.6	Very low	72 Å²	72	132 Å²	132	74%	0.742	75%	0.754	S	S	*	*			trans	108.4	55.7	139.8	0	0	0	0	0	121.7
656	S	31.8	Very low	39.9	Very low	102 Å²	102	126.6 Å²	126.6	71%	0.713	75%	0.746	S	S	*	*			trans	-0.7	136.6	146.7	50.9	0	0	0	0	123.4
657	T	37.6	Very low	39.2	Very low	131 Å²	131	131.4 Å²	131.4	80%	0.804	76%	0.757	S	S	*	*			trans	88.5	148.6	133.6	54.6	0	0	0	0	124.8
658	V	40	Very low	38.7	Very low	135 Å²	135	130.7 Å²	130.7	82%	0.818	76%	0.757	S	S	*	*			trans	79	148	165.7	-161.4	0	0	0	0	117.7
659	S	39.2	Very low	37.9	Very low	97 Å²	97	130.3 Å²	130.3	68%	0.678	77%	0.767	S	S	*	*				-178.1	140.8	-70.6	-86.7	0	0	0	0	113.3
660	Q	41.1	Very low	37.4	Very low	188 Å²	188	129 Å²	129	88%	0.879	77%	0.773	S	S	*	*			trans	67.9	150.5	165.7	-60	178.4	22.9	0	0	117.2
661	S	33.9	Very low	37	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	77%	0.766	S	S	*	*			cis	-140.2	-172.6	-1.2	-138.8	0	0	0	0	109.4
662	G	31	Very low	37.3	Very low	64 Å²	64	123.4 Å²	123.4	66%	0.66	77%	0.767	S	S	*	*			cis	-162	-178.6	10	0	0	0	0	0	110.3
663	S	41.5	Very low	37.1	Very low	81 Å²	81	124 Å²	124	57%	0.566	77%	0.765	S	S	*	*			cis	93.2	116.8	21.2	79	0	0	0	0	115.5
664	Y	38.6	Very low	36.9	Very low	213 Å²	213	126.3 Å²	126.3	84%	0.835	76%	0.764	S	S	*	*			cis	-176.2	138.8	-12.3	24.5	-147.6	0	0	0	112.7
665	F	30.6	Very low	36.5	Very low	198 Å²	198	129.2 Å²	129.2	87%	0.868	76%	0.762	S	S	*	*			trans	-151.2	106.1	155.4	-157.2	-102.9	0	0	0	116.6
666	S	42.8	Very low	36.4	Very low	83 Å²	83	136.5 Å²	136.5	58%	0.58	77%	0.767	S	S	*	*				10.8	159.3	129	-68.5	0	0	0	0	123.1
667	R	42.8	Very low	36.3	Very low	215 Å²	215	136.7 Å²	136.7	81%	0.811	76%	0.763	S	S	*	*			cis	178.1	153.5	-26.4	-126.9	-175.2	175.7	-165.3	0.4	110.6
668	T	36.6	Very low	36.1	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	76%	0.763	S	S	*	*			trans	56.2	147.2	152.1	51	0	0	0	0	121.4
669	G	32.1	Very low	36	Very low	75 Å²	75	139.4 Å²	139.4	77%	0.773	76%	0.764	S	S	*	*			cis	117.4	117.7	-13.3	0	0	0	0	0	117.2
670	S	35.5	Very low	36.4	Very low	130 Å²	130	140.6 Å²	140.6	91%	0.909	77%	0.769	S	S	*	*			trans	-162.9	142.8	165.3	55.2	0	0	0	0	113.8
671	G	36.3	Very low	35.8	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	76%	0.76	S	S	*	*			trans	-97.4	-144.7	179.2	0	0	0	0	0	114.4
672	P	45.7	Very low	35.7	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	76%	0.764	S	S	*	*			cis	-151.1	-173.4	23.3	42.4	-20.4	0	0	0	119.6
673	L	31.2	Very low	35.6	Very low	149 Å²	149	142 Å²	142	78%	0.78	78%	0.775	S	S	*	*			trans	72.6	109.1	144.9	-92.5	158.4	0	0	0	121
674	K	32.9	Very low	35	Very low	177 Å²	177	143.1 Å²	143.1	77%	0.77	78%	0.783	S	S	*	*				-179.6	144.2	81	-96.8	165.8	-176.2	166.4	0	116.3
675	K	31.1	Very low	34.6	Very low	183 Å²	183	138.2 Å²	138.2	80%	0.796	78%	0.779	S	S	*	*			trans	60.6	116.7	142	-72.8	-173.8	174.8	-176.5	0	123.9
676	R	31.8	Very low	35.1	Very low	225 Å²	225	134.8 Å²	134.8	85%	0.849	78%	0.777	S	S	*	*				59.5	149.7	119.7	-77.1	-163.5	161.9	-173.8	-2.8	120.4
677	T	31	Very low	34.9	Very low	105 Å²	105	138 Å²	138	64%	0.644	79%	0.787	S	S	*	*			cis	-167.1	156.5	9.1	3.5	0	0	0	0	113.5
678	V	32.2	Very low	34.4	Very low	133 Å²	133	135.5 Å²	135.5	81%	0.806	79%	0.79	S	S	*	*			trans	66.8	145.7	142.1	156.1	0	0	0	0	119.4
679	K	37.8	Very low	34.4	Very low	191 Å²	191	138 Å²	138	83%	0.83	79%	0.792	S	S	*	*			cis	-168.4	-161.2	-23.6	-135	-166.5	175.8	-175.5	0	108.2
680	P	47.9	Very low	34.5	Very low	122 Å²	122	138 Å²	138	79%	0.792	79%	0.792	S	S	*	*			trans	-133.6	-178.3	-138.4	43.8	-22.8	0	0	0	118.9
681	G	28.9	Very low	34.9	Very low	67 Å²	67	138 Å²	138	69%	0.691	79%	0.791	S	S	*	*			trans	-173.9	123.2	158.2	0	0	0	0	0	110.2
682	S	30.9	Very low	35.6	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	80%	0.795	S	S	*	*				75.8	124.8	64.2	-163.8	0	0	0	0	111.8
683	K	28.9	Very low	36.1	Very low	204 Å²	204	140.1 Å²	140.1	89%	0.887	78%	0.783	S	S	*	*			cis	-135.9	-168.4	34.9	-65	173.6	179.7	177	0	113.9
684	S	29.5	Very low	37.3	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	78%	0.783	S	S	*	*			trans	-140.1	159.7	-167.7	57.3	0	0	0	0	115.9
685	S	30.1	Very low	38.6	Very low	110 Å²	110	142 Å²	142	77%	0.769	78%	0.782	S	S	*	*			trans	66.7	162.5	154.3	70.2	0	0	0	0	119.3
686	P	41.7	Very low	40.3	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	78%	0.775	S	S	*	*			cis	-126.6	-173.3	4.5	42.2	-26.2	0	0	0	116.4
687	L	38	Very low	42.2	Very low	151 Å²	151	135.4 Å²	135.4	79%	0.791	76%	0.764	S	S	*	*			trans	-66.3	151.3	175	179	76	0	0	0	113.4
688	D	32.8	Very low	43.7	Very low	163 Å²	163	136.4 Å²	136.4	87%	0.872	76%	0.761	S	S	*	*			trans	-155.6	162.6	137.5	-136.4	-27.4	0	0	0	113.2
689	Q	36.1	Very low	45.9	Very low	179 Å²	179	132 Å²	132	84%	0.836	74%	0.743	S	S	*	*			trans	-133.7	120.4	-171	175.8	153.3	-39.3	0	0	113.5
690	G	35.2	Very low	48.1	Very low	75 Å²	75	126.7 Å²	126.7	77%	0.773	72%	0.723	S	S	*	*			trans	-167.5	126.8	178.1	0	0	0	0	0	116.8
691	C	42.5	Very low	49.7	Very low	130 Å²	130	125.3 Å²	125.3	88%	0.878	71%	0.708	S	S	*	*			trans	2.7	122.5	164.6	-56.6	0	0	0	0	120.3	S693	C691-S693 PolarHBondContact O-N 2.7Å
692	I	51.2	Low	52.3	Low	160 Å²	160	127.2 Å²	127.2	82%	0.821	70%	0.701	S	S	*	*			trans	-65.5	129.6	167.2	-64.8	175.8	0	0	0	110.4	F696	I692-F696 HydrophobicContact CG2-CB 4.26Å
693	S	56.7	Low	54.8	Low	72 Å²	72	124.1 Å²	124.1	50%	0.503	68%	0.683	S	S	.	*			trans	-77.3	158.8	-171	77.6	0	0	0	0	115.5	C691 R695 F696	C691-S693 PolarHBondContact O-N 2.7Å; S693-R695 PolarHBondContact O-N 3.18Å; S693-F696 PolarHBondContact O-N 2.96Å; S693-F696 VanDerWaalsContact O-N 3.14Å
694	Q	55.3	Low	57.6	Low	165 Å²	165	119.5 Å²	119.5	77%	0.771	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-39.2	-21.9	170.1	-173.6	173.5	-10.1	0	0	116.5	F696 M697 Q698	Q694-F696 VanDerWaalsContact C-N 3.32Å; Q694-F696 PolarHBondContact O-N 3.34Å; Q694-M697 PolarHBondContact O-N 3.44Å; Q694-Q698 PolarHBondContact O-N 2.84Å
695	R	61.1	Low	60.4	Low	199 Å²	199	119.4 Å²	119.4	75%	0.751	66%	0.658	S	S	*	*	H	α-helix	trans	-66	-28.6	178.3	-62.1	-172.3	179.5	-152.7	-1	113.6	S693 Q698 G699	S693-R695 PolarHBondContact O-N 3.18Å; R695-Q698 PolarHBondContact O-N 2.7Å; R695-G699 PolarHBondContact O-N 3.16Å
696	F	67.7	Low	63.1	Low	145 Å²	145	118.2 Å²	118.2	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-68	-40	179.6	-158	-98.8	0	0	0	111.8	I692 S693 Q694 G699 I700	I692-F696 HydrophobicContact CG2-CB 4.26Å; S693-F696 PolarHBondContact O-N 2.96Å; S693-F696 VanDerWaalsContact O-N 3.14Å; Q694-F696 VanDerWaalsContact C-N 3.32Å; Q694-F696 PolarHBondContact O-N 3.34Å; F696-G699 PolarHBondContact O-N 2.99Å; F696-I700 HydrophobicContact CD1-CD1 3.88Å; F696-I700 HydrophobicContact CE1-CD1 3.89Å; F696-I700 PolarHBondContact O-N 3.5Å; F696-I700 VanDerWaalsContact O-N 3.11Å
697	M	71.1	Confident	65.5	Low	126 Å²	126	116.8 Å²	116.8	62%	0.621	63%	0.631	S	S	*	*	H	α-helix	trans	-64	-41	173.6	-72.4	-67.7	-73.3	0	0	112.1	Q694 G699 I700 I701	Q694-M697 PolarHBondContact O-N 3.44Å; M697-G699 VanDerWaalsContact C-N 3.31Å; M697-G699 PolarHBondContact O-N 3.06Å; M697-I700 PolarHBondContact O-N 2.87Å; M697-I701 WeakPolarHBondContact O-CG1 3.45Å; M697-I701 PolarHBondContact O-N 3.2Å
698	Q	62.2	Low	67.9	Low	125 Å²	125	115.4 Å²	115.4	58%	0.584	62%	0.622	S	S	*	*	H	α-helix	trans	-62.7	-37.1	173.6	-74.6	-175.7	-66	0	0	112.3	Q694 R695 I701 L702	Q694-Q698 PolarHBondContact O-N 2.84Å; R695-Q698 PolarHBondContact O-N 2.7Å; Q698-I701 PolarHBondContact O-N 3.48Å; Q698-L702 WeakPolarHBondContact O-CB 3.24Å; Q698-L702 PolarHBondContact O-N 2.75Å
699	G	77.9	Confident	70.4	Confident	42 Å²	42	110.1 Å²	110.1	43%	0.433	60%	0.601	S	S	.	*	H	α-helix	trans	-61	-44.2	174	0	0	0	0	0	113	R695 F696 M697 L702 A703	R695-G699 PolarHBondContact O-N 3.16Å; F696-G699 PolarHBondContact O-N 2.99Å; M697-G699 VanDerWaalsContact C-N 3.31Å; M697-G699 PolarHBondContact O-N 3.06Å; G699-L702 PolarHBondContact O-N 3.19Å; G699-A703 WeakPolarHBondContact O-CB 3.34Å; G699-A703 PolarHBondContact O-N 3.41Å
700	I	84.3	Confident	72.6	Confident	79 Å²	79	108.3 Å²	108.3	41%	0.405	59%	0.591	S	S	.	*	H	α-helix	trans	-65.1	-43.8	176.9	-66.1	168.1	0	0	0	111.3	F696 M697 A703 L704	F696-I700 HydrophobicContact CD1-CD1 3.88Å; F696-I700 HydrophobicContact CE1-CD1 3.89Å; F696-I700 PolarHBondContact O-N 3.5Å; F696-I700 VanDerWaalsContact O-N 3.11Å; M697-I700 PolarHBondContact O-N 2.87Å; I700-A703 PolarHBondContact O-N 3.18Å; I700-L704 HydrophobicContact CG2-CD1 4.07Å; I700-L704 WeakPolarHBondContact O-CG 3.31Å; I700-L704 PolarHBondContact O-N 2.7Å
701	I	82.2	Confident	75.1	Confident	92 Å²	92	107.5 Å²	107.5	47%	0.472	57%	0.573	S	S	.	*	H	α-helix	trans	-63.8	-42.7	177.9	-67	165.1	0	0	0	110.8	M697 Q698 L704 L705	M697-I701 WeakPolarHBondContact O-CG1 3.45Å; M697-I701 PolarHBondContact O-N 3.2Å; Q698-I701 PolarHBondContact O-N 3.48Å; I701-L704 PolarHBondContact O-N 2.95Å; I701-L705 HydrophobicContact CG2-CD1 4.14Å; I701-L705 WeakPolarHBondContact O-CG 3.37Å; I701-L705 PolarHBondContact O-N 3.05Å
702	L	83.7	Confident	77.2	Confident	107 Å²	107	105.5 Å²	105.5	56%	0.56	56%	0.557	S	S	*	*	H	α-helix	trans	-63.8	-42.1	176.3	-177.6	61.6	0	0	0	111.8	Q698 G699 L705 I706	Q698-L702 WeakPolarHBondContact O-CB 3.24Å; Q698-L702 PolarHBondContact O-N 2.75Å; G699-L702 PolarHBondContact O-N 3.19Å; L702-L705 PolarHBondContact O-N 3.11Å; L702-I706 HydrophobicContact CD1-CD1 4.37Å; L702-I706 HydrophobicContact CG-CD1 4.09Å; L702-I706 VanDerWaalsContact O-CG1 3.31Å; L702-I706 WeakPolarHBondContact O-CG1 3.46Å; L702-I706 PolarHBondContact O-N 2.92Å
703	A	83.3	Confident	78.8	Confident	53 Å²	53	102.7 Å²	102.7	44%	0.438	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-42.9	175.4	0	0	0	0	0	112.2	G699 I700 I706 V707	G699-A703 WeakPolarHBondContact O-CB 3.34Å; G699-A703 PolarHBondContact O-N 3.41Å; I700-A703 PolarHBondContact O-N 3.18Å; A703-I706 PolarHBondContact O-N 3.17Å; A703-V707 WeakPolarHBondContact O-CG2 3.32Å; A703-V707 PolarHBondContact O-N 2.82Å
704	L	86.9	Confident	80.3	Confident	107 Å²	107	102.3 Å²	102.3	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-63.6	-40.5	175.6	-75.5	167.9	0	0	0	112.4	I700 I701 V707 M708	I700-L704 HydrophobicContact CG2-CD1 4.07Å; I700-L704 WeakPolarHBondContact O-CG 3.31Å; I700-L704 PolarHBondContact O-N 2.7Å; I701-L704 PolarHBondContact O-N 2.95Å; L704-V707 PolarHBondContact O-N 2.92Å; L704-M708 WeakPolarHBondContact O-CG 3.41Å; L704-M708 PolarHBondContact O-N 2.9Å
705	L	88.3	Confident	81.8	Confident	102 Å²	102	101 Å²	101	53%	0.534	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-38.4	174.9	-72.8	170.5	0	0	0	112.3	I701 L702 M708 A709	I701-L705 HydrophobicContact CG2-CD1 4.14Å; I701-L705 WeakPolarHBondContact O-CG 3.37Å; I701-L705 PolarHBondContact O-N 3.05Å; L702-L705 PolarHBondContact O-N 3.11Å; L705-M708 PolarHBondContact O-N 3.12Å; L705-A709 WeakPolarHBondContact O-CB 3.1Å; L705-A709 PolarHBondContact O-N 2.9Å
706	I	87.9	Confident	82.9	Confident	85 Å²	85	94.6 Å²	94.6	44%	0.436	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-45.3	173.9	-69.8	164.8	0	0	0	110.5	L702 A703 M708 A709 F710	L702-I706 HydrophobicContact CD1-CD1 4.37Å; L702-I706 HydrophobicContact CG-CD1 4.09Å; L702-I706 VanDerWaalsContact O-CG1 3.31Å; L702-I706 WeakPolarHBondContact O-CG1 3.46Å; L702-I706 PolarHBondContact O-N 2.92Å; A703-I706 PolarHBondContact O-N 3.17Å; I706-M708 PolarHBondContact O-N 2.8Å; I706-A709 PolarHBondContact O-N 3.16Å; I706-F710 HydrophobicContact CG2-CD2 3.82Å; I706-F710 HydrophobicContact CG2-CE2 3.95Å; I706-F710 WeakPolarHBondContact O-CD2 3.2Å; I706-F710 PolarHBondContact O-N 3.48Å
707	V	90.8	Very high	83.7	Confident	96 Å²	96	91.5 Å²	91.5	58%	0.582	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-39.9	176.8	171.1	0	0	0	0	111.7	A703 L704 F710 S711	A703-V707 WeakPolarHBondContact O-CG2 3.32Å; A703-V707 PolarHBondContact O-N 2.82Å; L704-V707 PolarHBondContact O-N 2.92Å; V707-F710 PolarHBondContact O-N 3.1Å; V707-S711 PolarHBondContact O-N 3.34Å; V707-S711 PolarHBondContact O-OG 3.2Å
708	M	88	Confident	84.2	Confident	121 Å²	121	89.8 Å²	89.8	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-41.1	172.9	-79	-174.2	63.2	0	0	112.7	L704 L705 I706 S711 V712	L704-M708 WeakPolarHBondContact O-CG 3.41Å; L704-M708 PolarHBondContact O-N 2.9Å; L705-M708 PolarHBondContact O-N 3.12Å; I706-M708 PolarHBondContact O-N 2.8Å; M708-S711 PolarHBondContact O-N 3.2Å; M708-S711 PolarHBondContact O-OG 2.96Å; M708-S711 VanDerWaalsContact O-OG 3.05Å; M708-V712 WeakPolarHBondContact O-CG2 3.3Å; M708-V712 PolarHBondContact O-N 2.92Å
709	A	85.6	Confident	85.1	Confident	52 Å²	52	91.5 Å²	91.5	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175.7	0	0	0	0	0	111	L705 I706 S711 V712 I713	L705-A709 WeakPolarHBondContact O-CB 3.1Å; L705-A709 PolarHBondContact O-N 2.9Å; I706-A709 PolarHBondContact O-N 3.16Å; A709-S711 PolarHBondContact O-N 3.02Å; A709-V712 PolarHBondContact O-N 2.58Å; A709-I713 WeakPolarHBondContact O-CB 3.33Å; A709-I713 WeakPolarHBondContact O-CD1 3.48Å; A709-I713 VanDerWaalsContact O-CG1 3.23Å; A709-I713 WeakPolarHBondContact O-CG1 3.49Å; A709-I713 PolarHBondContact O-N 3.03Å
710	F	83.4	Confident	85.1	Confident	141 Å²	141	94.1 Å²	94.1	62%	0.618	52%	0.516	S	S	*	.	H	α-helix	trans	-64.1	-37.2	175.3	-89.3	-73.7	0	0	0	113.3	I706 V707 I713 S714	I706-F710 HydrophobicContact CG2-CD2 3.82Å; I706-F710 HydrophobicContact CG2-CE2 3.95Å; I706-F710 WeakPolarHBondContact O-CD2 3.2Å; I706-F710 PolarHBondContact O-N 3.48Å; V707-F710 PolarHBondContact O-N 3.1Å; F710-I713 PolarHBondContact O-N 3.12Å; F710-S714 WeakPolarHBondContact O-CB 3.39Å; F710-S714 PolarHBondContact O-N 3.13Å
711	S	86.6	Confident	84.7	Confident	59 Å²	59	95.4 Å²	95.4	41%	0.413	52%	0.523	S	S	.	.	H	α-helix	trans	-70.3	-37.3	177.6	71.6	0	0	0	0	112.5	V707 M708 A709 S714 M715	V707-S711 PolarHBondContact O-N 3.34Å; V707-S711 PolarHBondContact O-OG 3.2Å; M708-S711 PolarHBondContact O-N 3.2Å; M708-S711 PolarHBondContact O-OG 2.96Å; M708-S711 VanDerWaalsContact O-OG 3.05Å; A709-S711 PolarHBondContact O-N 3.02Å; S711-S714 PolarHBondContact O-N 3.35Å; S711-M715 WeakPolarHBondContact O-CB 3.37Å; S711-M715 WeakPolarHBondContact O-CG 3.32Å; S711-M715 PolarHBondContact O-N 3.5Å
712	V	86.5	Confident	84.4	Confident	88 Å²	88	94.9 Å²	94.9	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-67.2	-41.7	173.2	172.5	0	0	0	0	111.5	M708 A709 S716	M708-V712 WeakPolarHBondContact O-CG2 3.3Å; M708-V712 PolarHBondContact O-N 2.92Å; A709-V712 PolarHBondContact O-N 2.58Å; V712-S716 WeakPolarHBondContact O-CB 3.39Å; V712-S716 PolarHBondContact O-N 3.41Å; V712-S716 PolarHBondContact O-OG 2.9Å
713	I	85.2	Confident	83.9	Confident	100 Å²	100	94.6 Å²	94.6	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-63.4	-45.8	174.3	-68.9	164.4	0	0	0	110.4	A709 F710 S716 V717	A709-I713 WeakPolarHBondContact O-CB 3.33Å; A709-I713 WeakPolarHBondContact O-CD1 3.48Å; A709-I713 VanDerWaalsContact O-CG1 3.23Å; A709-I713 WeakPolarHBondContact O-CG1 3.49Å; A709-I713 PolarHBondContact O-N 3.03Å; F710-I713 PolarHBondContact O-N 3.12Å; I713-S716 WeakPolarHBondContact O-CB 3.35Å; I713-S716 PolarHBondContact O-N 2.97Å; I713-S716 VanDerWaalsContact O-N 3.17Å; I713-V717 HydrophobicContact CG2-CG2 4.48Å; I713-V717 WeakPolarHBondContact O-CG2 3.47Å; I713-V717 PolarHBondContact O-N 3.42Å
714	S	87.4	Confident	83.1	Confident	65 Å²	65	99 Å²	99	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-60.3	-47.1	177.8	-176.5	0	0	0	0	112.1	F710 S711 S716 V717 L718	F710-S714 WeakPolarHBondContact O-CB 3.39Å; F710-S714 PolarHBondContact O-N 3.13Å; S711-S714 PolarHBondContact O-N 3.35Å; S714-S716 VanDerWaalsContact C-N 3.32Å; S714-S716 PolarHBondContact O-N 3.32Å; S714-V717 PolarHBondContact O-N 2.91Å; S714-L718 WeakPolarHBondContact O-CB 3.47Å; S714-L718 PolarHBondContact O-N 2.72Å
715	M	88.6	Confident	81.9	Confident	136 Å²	136	100.1 Å²	100.1	67%	0.67	54%	0.537	S	S	*	.	H	α-helix	trans	-62	-37.1	173.8	-77.1	-67.4	-174.5	0	0	112.6	S711 Y719	S711-M715 WeakPolarHBondContact O-CB 3.37Å; S711-M715 WeakPolarHBondContact O-CG 3.32Å; S711-M715 PolarHBondContact O-N 3.5Å; M715-Y719 VanDerWaalsContact O-CB 3.26Å; M715-Y719 WeakPolarHBondContact O-CB 3.44Å; M715-Y719 PolarHBondContact O-N 3.49Å
716	S	83.3	Confident	80.5	Confident	65 Å²	65	104.8 Å²	104.8	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-67.4	-42.2	176.7	-57.8	0	0	0	0	111.9	V712 I713 S714 Y719 V720	V712-S716 WeakPolarHBondContact O-CB 3.39Å; V712-S716 PolarHBondContact O-N 3.41Å; V712-S716 PolarHBondContact O-OG 2.9Å; I713-S716 WeakPolarHBondContact O-CB 3.35Å; I713-S716 PolarHBondContact O-N 2.97Å; I713-S716 VanDerWaalsContact O-N 3.17Å; S714-S716 VanDerWaalsContact C-N 3.32Å; S714-S716 PolarHBondContact O-N 3.32Å; S716-Y719 PolarHBondContact O-N 3Å; S716-V720 WeakPolarHBondContact O-CG2 3.35Å; S716-V720 PolarHBondContact O-N 2.95Å
717	V	84.7	Confident	79.1	Confident	80 Å²	80	102.8 Å²	102.8	49%	0.485	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-43.7	175	171.6	0	0	0	0	110.8	I713 S714 Y719 V720 L721	I713-V717 HydrophobicContact CG2-CG2 4.48Å; I713-V717 WeakPolarHBondContact O-CG2 3.47Å; I713-V717 PolarHBondContact O-N 3.42Å; S714-V717 PolarHBondContact O-N 2.91Å; V717-Y719 VanDerWaalsContact C-N 3.32Å; V717-Y719 PolarHBondContact O-N 2.75Å; V717-V720 PolarHBondContact O-N 3.32Å; V717-L721 HydrophobicContact CG1-CD1 3.92Å; V717-L721 HydrophobicContact CG1-CG 4.4Å; V717-L721 WeakPolarHBondContact O-CB 3.42Å; V717-L721 VanDerWaalsContact O-CG 3.31Å; V717-L721 WeakPolarHBondContact O-CG 3.25Å; V717-L721 PolarHBondContact O-N 2.74Å
718	L	80.9	Confident	77.3	Confident	90 Å²	90	101.4 Å²	101.4	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-39.6	173.3	-84.3	162.5	0	0	0	112.1	S714 T722	S714-L718 WeakPolarHBondContact O-CB 3.47Å; S714-L718 PolarHBondContact O-N 2.72Å; L718-T722 VanDerWaalsContact O-CB 3.25Å; L718-T722 WeakPolarHBondContact O-CB 3.12Å; L718-T722 PolarHBondContact O-N 2.62Å; L718-T722 PolarHBondContact O-OG1 2.86Å
719	Y	80.9	Confident	75.7	Confident	162 Å²	162	101.4 Å²	101.4	64%	0.635	55%	0.547	S	S	*	.	H	α-helix	trans	-66	-43.4	176.7	-174.6	-103.7	0	0	0	112	M715 S716 V717 T722 L723	M715-Y719 VanDerWaalsContact O-CB 3.26Å; M715-Y719 WeakPolarHBondContact O-CB 3.44Å; M715-Y719 PolarHBondContact O-N 3.49Å; S716-Y719 PolarHBondContact O-N 3Å; V717-Y719 VanDerWaalsContact C-N 3.32Å; V717-Y719 PolarHBondContact O-N 2.75Å; Y719-T722 PolarHBondContact O-N 3.21Å; Y719-L723 HydrophobicContact CD1-CD1 4.11Å; Y719-L723 HydrophobicContact CD2-CD1 4.45Å; Y719-L723 HydrophobicContact CE1-CD1 3.63Å; Y719-L723 HydrophobicContact CE2-CD1 4.01Å; Y719-L723 HydrophobicContact CG-CD1 4.49Å; Y719-L723 PolarHBondContact O-N 3.13Å
720	V	79.4	Confident	74	Confident	96 Å²	96	104.4 Å²	104.4	58%	0.582	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-44.7	174.8	170.7	0	0	0	0	111.6	S716 V717 T722 L723 H724	S716-V720 WeakPolarHBondContact O-CG2 3.35Å; S716-V720 PolarHBondContact O-N 2.95Å; V717-V720 PolarHBondContact O-N 3.32Å; V720-T722 VanDerWaalsContact C-N 3.31Å; V720-T722 PolarHBondContact O-N 2.6Å; V720-L723 PolarHBondContact O-N 3.34Å; V720-H724 WeakPolarHBondContact O-CB 3.45Å; V720-H724 PolarHBondContact O-N 3.1Å
721	L	75.7	Confident	72	Confident	106 Å²	106	106.4 Å²	106.4	56%	0.555	57%	0.572	S	S	*	*	H	α-helix	trans	-62.1	-38.5	174.4	-72.8	171.1	0	0	0	111.8	V717 H724 H725	V717-L721 HydrophobicContact CG1-CD1 3.92Å; V717-L721 HydrophobicContact CG1-CG 4.4Å; V717-L721 WeakPolarHBondContact O-CB 3.42Å; V717-L721 VanDerWaalsContact O-CG 3.31Å; V717-L721 WeakPolarHBondContact O-CG 3.25Å; V717-L721 PolarHBondContact O-N 2.74Å; L721-H724 PolarHBondContact O-N 3.09Å; L721-H725 WeakPolarHBondContact O-CB 3.42Å; L721-H725 PolarHBondContact O-N 3.42Å
722	T	76.1	Confident	69.9	Low	82 Å²	82	113 Å²	113	50%	0.503	59%	0.593	S	S	.	*	H	α-helix	trans	-68.3	-38.9	176.3	-57.8	0	0	0	0	111.6	L718 Y719 V720 R726	L718-T722 VanDerWaalsContact O-CB 3.25Å; L718-T722 WeakPolarHBondContact O-CB 3.12Å; L718-T722 PolarHBondContact O-N 2.62Å; L718-T722 PolarHBondContact O-OG1 2.86Å; Y719-T722 PolarHBondContact O-N 3.21Å; V720-T722 VanDerWaalsContact C-N 3.31Å; V720-T722 PolarHBondContact O-N 2.6Å; T722-R726 WeakPolarHBondContact O-CB 3.46Å; T722-R726 PolarHBondContact O-N 3.37Å
723	L	72.5	Confident	67.5	Low	100 Å²	100	117 Å²	117	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-61.7	-46.2	171.2	-111.4	81.8	0	0	0	111.3	Y719 V720 H725 R726 G727	Y719-L723 HydrophobicContact CD1-CD1 4.11Å; Y719-L723 HydrophobicContact CD2-CD1 4.45Å; Y719-L723 HydrophobicContact CE1-CD1 3.63Å; Y719-L723 HydrophobicContact CE2-CD1 4.01Å; Y719-L723 HydrophobicContact CG-CD1 4.49Å; Y719-L723 PolarHBondContact O-N 3.13Å; V720-L723 PolarHBondContact O-N 3.34Å; L723-H725 PolarHBondContact O-N 3.09Å; L723-R726 PolarHBondContact O-N 3.22Å; L723-G727 PolarHBondContact O-N 2.77Å
724	H	66.3	Low	65	Low	146 Å²	146	115.5 Å²	115.5	68%	0.676	62%	0.621	S	S	*	*	H	α-helix	trans	-65.1	-39.8	179.9	-162.5	-65.9	0	0	0	111.8	V720 L721 G727 A728	V720-H724 WeakPolarHBondContact O-CB 3.45Å; V720-H724 PolarHBondContact O-N 3.1Å; L721-H724 PolarHBondContact O-N 3.09Å; H724-G727 PolarHBondContact O-N 3.35Å; H724-A728 WeakPolarHBondContact O-CB 3.48Å; H724-A728 PolarHBondContact O-N 2.79Å
725	H	62.7	Low	62.3	Low	131 Å²	131	121.3 Å²	121.3	61%	0.606	64%	0.64	S	S	*	*	H	α-helix	trans	-66	-38.8	174	-167.5	57.1	0	0	0	111.6	L721 L723 A728 I729	L721-H725 WeakPolarHBondContact O-CB 3.42Å; L721-H725 PolarHBondContact O-N 3.42Å; L723-H725 PolarHBondContact O-N 3.09Å; H725-A728 PolarHBondContact O-N 3.08Å; H725-I729 WeakPolarHBondContact O-CD1 3.47Å; H725-I729 WeakPolarHBondContact O-CG1 3.47Å; H725-I729 PolarHBondContact O-N 3.43Å
726	R	57.9	Low	59.9	Low	199 Å²	199	120.6 Å²	120.6	75%	0.751	64%	0.643	S	S	*	*	H	α-helix	trans	-72	-25.4	177.5	-164.7	166.7	-175.7	143.8	-0.7	113.6	T722 L723	T722-R726 WeakPolarHBondContact O-CB 3.46Å; T722-R726 PolarHBondContact O-N 3.37Å; L723-R726 PolarHBondContact O-N 3.22Å
727	G	58.7	Low	57.4	Low	43 Å²	43	122.7 Å²	122.7	44%	0.443	66%	0.658	S	S	.	*	H	α-helix	trans	-76.2	-39.5	167.8	0	0	0	0	0	113.1	L723 H724 I729 T730	L723-G727 PolarHBondContact O-N 2.77Å; H724-G727 PolarHBondContact O-N 3.35Å; G727-I729 PolarHBondContact O-N 2.99Å; G727-I729 VanDerWaalsContact O-N 3.13Å; G727-T730 PolarHBondContact O-N 2.83Å; G727-T730 VanDerWaalsContact O-N 3.12Å; G727-T730 PolarHBondContact O-OG1 2.94Å
728	A	54.1	Low	55.2	Low	67 Å²	67	124 Å²	124	55%	0.554	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-5.5	-179.8	0	0	0	0	0	115	H724 H725	H724-A728 WeakPolarHBondContact O-CB 3.48Å; H724-A728 PolarHBondContact O-N 2.79Å; H725-A728 PolarHBondContact O-N 3.08Å
729	I	52.5	Low	52.9	Low	121 Å²	121	125.6 Å²	125.6	62%	0.621	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-14.1	174.6	-69	163	0	0	0	111.5	H725 G727	H725-I729 WeakPolarHBondContact O-CD1 3.47Å; H725-I729 WeakPolarHBondContact O-CG1 3.47Å; H725-I729 PolarHBondContact O-N 3.43Å; G727-I729 PolarHBondContact O-N 2.99Å; G727-I729 VanDerWaalsContact O-N 3.13Å
730	T	50	Low	50.8	Low	116 Å²	116	124.3 Å²	124.3	71%	0.712	70%	0.697	S	S	*	*	S	Bend	trans	-111.5	29.7	-174.9	46.4	0	0	0	0	114.9	G727	G727-T730 PolarHBondContact O-N 2.83Å; G727-T730 VanDerWaalsContact O-N 3.12Å; G727-T730 PolarHBondContact O-OG1 2.94Å
731	E	43.1	Very low	48.4	Very low	183 Å²	183	127.3 Å²	127.3	86%	0.855	71%	0.708	S	S	*	*			trans	-154.2	129.6	157.9	-129.9	171.6	-164	0	0	111
732	K	40.8	Very low	46.1	Very low	196 Å²	196	132.3 Å²	132.3	85%	0.852	72%	0.721	S	S	*	*			trans	-156.2	89.3	-178.8	-173.2	-174.5	179.5	-176.6	0	111.4
733	D	36.3	Very low	43.9	Very low	174 Å²	174	135.4 Å²	135.4	93%	0.93	73%	0.734	S	S	*	*			trans	-176.8	129.1	152.1	-92.3	-25.8	0	0	0	108.8
734	G	32.5	Very low	41.8	Very low	68 Å²	68	135 Å²	135	70%	0.701	74%	0.739	S	S	*	*			trans	156.5	159.1	-179.3	0	0	0	0	0	115.6
735	H	32.5	Very low	40.1	Very low	187 Å²	187	139 Å²	139	87%	0.866	75%	0.748	S	S	*	*			trans	-159.1	142.8	-161.7	-98.9	34.3	0	0	0	112.1
736	V	37.1	Very low	38.8	Very low	121 Å²	121	140.5 Å²	140.5	73%	0.733	76%	0.758	S	S	*	*			cis	-153.2	142.4	-22.7	-169.9	0	0	0	0	107.1
737	S	31.3	Very low	37.9	Very low	109 Å²	109	136 Å²	136	76%	0.762	75%	0.754	S	S	*	*			trans	-164.7	138.7	150.6	-168.7	0	0	0	0	112.5
738	S	38.7	Very low	36.6	Very low	108 Å²	108	140.9 Å²	140.9	76%	0.755	77%	0.769	S	S	*	*			trans	-106	87.9	178.8	-66.5	0	0	0	0	112.1	V740	S738-V740 PolarHBondContact O-N 3.46Å
739	C	31.2	Very low	35.6	Very low	123 Å²	123	146.6 Å²	146.6	83%	0.831	78%	0.781	S	S	*	*			trans	-80.7	88.5	162.1	-81.4	0	0	0	0	110.2	L741	C739-L741 PolarHBondContact O-N 3.22Å
740	V	37	Very low	34.6	Very low	135 Å²	135	147.7 Å²	147.7	82%	0.818	79%	0.794	S	S	*	*			trans	-73.6	118	162.3	177.9	0	0	0	0	108	S738	S738-V740 PolarHBondContact O-N 3.46Å
741	L	28.9	Very low	33.5	Very low	158 Å²	158	146.7 Å²	146.7	83%	0.827	80%	0.797	S	S	*	*			trans	-122	134.9	166.7	-111.4	173	0	0	0	110.5	C739	C739-L741 PolarHBondContact O-N 3.22Å
742	Y	28.7	Very low	32.9	Very low	211 Å²	211	144.8 Å²	144.8	83%	0.827	80%	0.798	S	S	*	*			trans	-60.9	138.1	-175.6	-119.1	-114.8	0	0	0	112
743	I	29.3	Very low	32.4	Very low	148 Å²	148	142.8 Å²	142.8	76%	0.759	80%	0.795	S	S	*	*			trans	-112	101.4	157.7	-60.8	-178.2	0	0	0	107.4
744	S	28.2	Very low	31.9	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	79%	0.793	S	S	*	*			trans	-72.2	137.8	172.2	-176.6	0	0	0	0	110.3
745	W	30.6	Very low	31.8	Very low	230 Å²	230	143.5 Å²	143.5	87%	0.871	79%	0.792	S	S	*	*			trans	-109.7	102	165.5	-93.3	56.6	0	0	0	109.6
746	M	34.8	Very low	31.9	Very low	163 Å²	163	140.1 Å²	140.1	80%	0.803	79%	0.788	S	S	*	*			trans	-126.9	146.9	155.1	-79.6	-67.1	146.9	0	0	107.9
747	P	39	Very low	31.8	Very low	104 Å²	104	140.2 Å²	140.2	68%	0.675	79%	0.791	S	S	*	*	S	Bend	trans	-77.5	130.3	-163.6	28.7	-34.7	0	0	0	113.2
748	I	33	Very low	32.5	Very low	146 Å²	146	140.2 Å²	140.2	75%	0.749	79%	0.789	S	S	*	*			trans	71.4	122.9	153.5	-53.7	164.9	0	0	0	113.9
749	F	31.8	Very low	32.1	Very low	186 Å²	186	141.9 Å²	141.9	82%	0.816	79%	0.794	S	S	*	*			cis	-146.8	162.9	11.3	-112	-49.4	0	0	0	110.7
750	T	32.7	Very low	32	Very low	144 Å²	144	141.2 Å²	141.2	88%	0.883	79%	0.79	S	S	*	*			trans	67	143.6	169.2	59.8	0	0	0	0	119
751	A	26.3	Very low	31.6	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	79%	0.787	S	S	*	*			trans	-152.5	154.8	177.5	0	0	0	0	0	110.8
752	T	29.6	Very low	31.5	Very low	143 Å²	143	143.9 Å²	143.9	88%	0.877	79%	0.788	S	S	*	*			trans	-140	147.9	175.7	37.3	0	0	0	0	110.6
753	I	30.1	Very low	31.3	Very low	154 Å²	154	138.2 Å²	138.2	79%	0.79	78%	0.779	S	S	*	*			trans	-137.7	137.8	-172.9	-62	174.9	0	0	0	109.7	V755	I753-V755 HydrophobicContact CG2-CG2 3.95Å
754	T	27.6	Very low	31.2	Very low	144 Å²	144	142.4 Å²	142.4	88%	0.883	79%	0.786	S	S	*	*			trans	-146.5	143.3	173.7	-33.6	0	0	0	0	109.9
755	V	30.4	Very low	31.1	Very low	113 Å²	113	142.5 Å²	142.5	69%	0.685	79%	0.791	S	S	*	*			trans	-147	139	-162.2	176.7	0	0	0	0	114.2	I753	I753-V755 HydrophobicContact CG2-CG2 3.95Å
756	C	32.9	Very low	30.9	Very low	116 Å²	116	136 Å²	136	78%	0.784	79%	0.787	S	S	*	*			trans	67.8	160.9	162	-80.9	0	0	0	0	118.6
757	P	35.3	Very low	30.5	Very low	123 Å²	123	135.2 Å²	135.2	80%	0.799	79%	0.785	S	S	*	*			cis	-135.9	-178	33.2	38.6	-17	0	0	0	119
758	P	47.5	Very low	29.8	Very low	109 Å²	109	138 Å²	138	71%	0.708	79%	0.789	S	S	*	*			trans	-127.3	176	-165.1	43.9	-30.6	0	0	0	117.9
759	V	30.2	Very low	29.4	Very low	143 Å²	143	136.1 Å²	136.1	87%	0.867	79%	0.789	S	S	*	*			trans	-147.6	158.9	165.4	-170.7	0	0	0	0	110.6
760	C	27.6	Very low	29.1	Very low	110 Å²	110	131.2 Å²	131.2	74%	0.743	78%	0.778	S	S	*	*			trans	-114.4	-158.9	-172.7	-61.6	0	0	0	0	113.3
761	T	29.2	Very low	28.8	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	77%	0.772	S	S	*	*			cis	-172.6	164	23.9	-23.7	0	0	0	0	114.2
762	W	26.5	Very low	28.8	Very low	226 Å²	226	136.8 Å²	136.8	86%	0.856	78%	0.775	S	S	*	*			trans	85.9	94.6	141	-144.6	-90	0	0	0	124.5
763	S	25.9	Very low	28.7	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	77%	0.768	S	S	*	*				73.6	131.9	124.1	-59.1	0	0	0	0	128.3
764	R	26.1	Very low	29.1	Very low	237 Å²	237	134.9 Å²	134.9	89%	0.894	77%	0.767	S	S	*	*				82.7	104.4	122.9	-174.7	-177.8	-89.7	-175.7	-5.1	123.2
765	A	25.7	Very low	29.1	Very low	92 Å²	92	134.4 Å²	134.4	76%	0.76	76%	0.758	S	S	*	*			trans	72.4	154.4	130.1	0	0	0	0	0	123.9
766	A	27	Very low	28.8	Very low	95 Å²	95	134.4 Å²	134.4	79%	0.785	76%	0.759	S	S	*	*			trans	68.1	156.8	170.7	0	0	0	0	0	115.4
767	L	27.1	Very low	28.4	Very low	145 Å²	145	133.5 Å²	133.5	76%	0.759	75%	0.754	S	S	*	*			cis	-147.1	-165.7	-10.7	-157.5	57.6	0	0	0	108.4
768	E	22.7	Very low	27.9	Very low	163 Å²	163	133.6 Å²	133.6	76%	0.762	75%	0.752	S	S	*	*			trans	-19.6	127	152.7	-73.4	168.9	113.2	0	0	115.2
769	S	25	Very low	26.8	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	76%	0.755	S	S	*	*				94	122.3	66.7	-168.5	0	0	0	0	113.6
770	S	25.9	Very low	26.5	Very low	83 Å²	83	131.7 Å²	131.7	58%	0.58	74%	0.743	S	S	*	*			trans	89.3	141.2	150.6	-149	0	0	0	0	120.8
771	H	26.4	Very low	26.4	Very low	165 Å²	165	132.4 Å²	132.4	76%	0.764	74%	0.744	S	S	*	*			trans	67	139.3	165	-58.5	-42.4	0	0	0	116.9
772	K	26.7	Very low	26.8	Very low	191 Å²	191	132.3 Å²	132.3	83%	0.83	75%	0.746	S	S	*	*			cis	-149.2	147.2	15	-120.7	146	-171.7	173.9	0	112.1
773	N	27.6	Very low	27.1	Very low	139 Å²	139	125.7 Å²	125.7	74%	0.743	74%	0.739	S	S	*	*			trans	-62.2	157	157.2	-110.3	-4.7	0	0	0	109.9
774	P	38.5	Very low	28.2	Very low	118 Å²	118	127.1 Å²	127.1	77%	0.766	75%	0.747	S	S	*	*				-148.6	149.1	62.7	36.7	-15.8	0	0	0	119.5
775	L	27.1	Very low	28.3	Very low	133 Å²	133	120 Å²	120	70%	0.696	74%	0.739	S	S	*	*				38.3	127.5	124.9	-114.4	73	0	0	0	121.5
776	T	24.8	Very low	28.2	Very low	114 Å²	114	121.3 Å²	121.3	70%	0.699	74%	0.741	S	S	*	*				41.7	149.5	128.5	57.4	0	0	0	0	122.2
777	S	24.3	Very low	28	Very low	97 Å²	97	122.1 Å²	122.1	68%	0.678	74%	0.739	S	S	*	*			cis	-178	-162.6	-10.3	55.4	0	0	0	0	107.6
778	V	24.4	Very low	28	Very low	125 Å²	125	120.2 Å²	120.2	76%	0.758	74%	0.738	S	S	*	*			trans	71.2	106.9	172.1	-172.8	0	0	0	0	113.5
779	S	24.5	Very low	28.3	Very low	109 Å²	109	118 Å²	118	76%	0.762	74%	0.736	S	S	*	*				97.1	160.1	55.7	176.3	0	0	0	0	113.3
780	T	23.8	Very low	28.4	Very low	102 Å²	102	119.3 Å²	119.3	63%	0.626	74%	0.739	S	S	*	*			trans	111.9	87.8	144.6	-50.4	0	0	0	0	119.8
781	T	24.9	Very low	28.6	Very low	125 Å²	125	119.2 Å²	119.2	77%	0.767	74%	0.743	S	S	*	*			trans	69	-172.2	144.7	65.5	0	0	0	0	118
782	P	39	Very low	28.8	Very low	120 Å²	120	118 Å²	118	78%	0.779	75%	0.747	S	S	*	*				-126.2	-171.5	-74.2	38.7	-23.3	0	0	0	115
783	A	32.8	Very low	29	Very low	87 Å²	87	115 Å²	115	72%	0.719	74%	0.741	S	S	*	*			trans	-60	171	172.3	0	0	0	0	0	113.6
784	P	47.7	Very low	29.3	Very low	123 Å²	123	113.7 Å²	113.7	80%	0.799	73%	0.734	S	S	*	*			cis	-154.5	-175.9	31.1	43.8	-21.2	0	0	0	120.8
785	A	28.4	Very low	29.1	Very low	88 Å²	88	116 Å²	116	73%	0.727	73%	0.734	S	S	*	*			trans	106.8	140.7	135.6	0	0	0	0	0	122.9
786	C	23.3	Very low	29.2	Very low	119 Å²	119	114.5 Å²	114.5	80%	0.804	74%	0.735	S	S	*	*			trans	95.6	113.4	149.5	-72.1	0	0	0	0	123.6
787	C	24.2	Very low	29.5	Very low	111 Å²	111	112.8 Å²	112.8	75%	0.75	73%	0.732	S	S	*	*			trans	86.3	103.8	134.8	-63.7	0	0	0	0	123.6
788	S	25.9	Very low	29.6	Very low	105 Å²	105	113.9 Å²	113.9	73%	0.734	74%	0.735	S	S	*	*				78.8	143	125.5	-54	0	0	0	0	119.9
789	T	28.7	Very low	29.6	Very low	117 Å²	117	113.4 Å²	113.4	72%	0.718	73%	0.732	S	S	*	*			cis	-157.6	151.8	6.9	-8.4	0	0	0	0	113.3
790	T	28.2	Very low	29.4	Very low	134 Å²	134	115 Å²	115	82%	0.822	73%	0.732	S	S	*	*			trans	59.6	150.7	156.5	49.1	0	0	0	0	121.1
791	A	30.2	Very low	29.3	Very low	81 Å²	81	115.6 Å²	115.6	67%	0.669	74%	0.735	S	S	*	*			cis	-175.7	179.9	-22.9	0	0	0	0	0	110
792	V	30.5	Very low	29.2	Very low	140 Å²	140	116.9 Å²	116.9	85%	0.848	74%	0.736	S	S	*	*			trans	75.8	120.4	165	-175.5	0	0	0	0	115.2
793	N	30.6	Very low	28.4	Very low	128 Å²	128	115.7 Å²	115.7	68%	0.684	73%	0.731	S	S	*	*			cis	-160.1	144.5	-7.6	-160.9	34.7	0	0	0	112.5
794	N	33.8	Very low	28.1	Very low	112 Å²	112	116 Å²	116	60%	0.599	73%	0.728	S	S	*	*			trans	25.7	148.1	148.5	-63.7	-5.1	0	0	0	122.4
795	Q	33.3	Very low	27.4	Very low	167 Å²	167	116.8 Å²	116.8	78%	0.78	73%	0.726	S	S	*	*			cis	-175.6	169.9	-3.8	-109.1	162	1.3	0	0	106.3
796	S	31.1	Very low	27.3	Very low	101 Å²	101	121.3 Å²	121.3	71%	0.706	73%	0.732	S	S	*	*			cis	-150.6	176.8	-6.1	61.8	0	0	0	0	107
797	A	29.7	Very low	27.4	Very low	78 Å²	78	120.4 Å²	120.4	65%	0.645	73%	0.727	S	S	*	*			cis	74.5	138	24.7	0	0	0	0	0	114.5
798	T	26.9	Very low	27.5	Very low	119 Å²	119	121.1 Å²	121.1	73%	0.73	73%	0.728	S	S	*	*			cis	-162.4	155.5	2.3	-14.7	0	0	0	0	112.4
799	T	24.2	Very low	27.5	Very low	115 Å²	115	122 Å²	122	71%	0.706	73%	0.734	S	S	*	*			trans	35	141.3	145.1	46.4	0	0	0	0	125.8
800	L	21.4	Very low	27.3	Very low	143 Å²	143	119.5 Å²	119.5	75%	0.749	73%	0.731	S	S	*	*			trans	86.9	113.4	134	-74.7	165.3	0	0	0	123.2
801	T	21.1	Very low	27.2	Very low	114 Å²	114	121.2 Å²	121.2	70%	0.699	74%	0.735	S	S	*	*			trans	76	147.2	131.4	51.2	0	0	0	0	124.9
802	L	22.6	Very low	26.8	Very low	152 Å²	152	121.2 Å²	121.2	80%	0.796	73%	0.73	S	S	*	*			trans	66	119.5	167.4	-87.3	68.7	0	0	0	115.8
803	S	22.8	Very low	26.5	Very low	96 Å²	96	122.1 Å²	122.1	67%	0.671	73%	0.728	S	S	*	*				67.8	143.6	70	92.2	0	0	0	0	112.9
804	S	26.2	Very low	26.6	Very low	94 Å²	94	121.2 Å²	121.2	66%	0.657	73%	0.729	S	S	*	*			cis	-164.9	163.6	-1.4	-134	0	0	0	0	105.6
805	N	31.9	Very low	26.4	Very low	139 Å²	139	122.3 Å²	122.3	74%	0.743	74%	0.74	S	S	*	*			cis	-172	157.7	37.8	-98.5	-34.5	0	0	0	108.1
806	Q	26.7	Very low	26.3	Very low	182 Å²	182	119.8 Å²	119.8	85%	0.85	74%	0.738	S	S	*	*				-178.5	132.4	117.2	-103.2	172.8	77.4	0	0	113.2
807	S	25.8	Very low	26	Very low	101 Å²	101	121.3 Å²	121.3	71%	0.706	74%	0.743	S	S	*	*			trans	52.9	135.3	155.2	54.1	0	0	0	0	120.7
808	T	26.2	Very low	26.7	Very low	126 Å²	126	123.1 Å²	123.1	77%	0.773	75%	0.748	S	S	*	*			cis	-165.8	152	-6.5	11.7	0	0	0	0	109.8
809	S	26.1	Very low	26.6	Very low	122 Å²	122	120.8 Å²	120.8	85%	0.853	75%	0.748	S	S	*	*			trans	39.4	129.8	147.7	-46.7	0	0	0	0	121.6
810	G	24.8	Very low	26.7	Very low	65 Å²	65	121.2 Å²	121.2	67%	0.67	75%	0.75	S	S	*	*			cis	136	117.3	-8.5	0	0	0	0	0	114.9
811	L	24.8	Very low	26.9	Very low	171 Å²	171	121.7 Å²	121.7	90%	0.895	75%	0.752	S	S	*	*			trans	66.4	159.2	163.5	-81.7	74.9	0	0	0	117.4
812	S	23.7	Very low	27.2	Very low	81 Å²	81	121.4 Å²	121.4	57%	0.566	75%	0.75	S	S	*	*			cis	-175.8	141.4	-20	53.2	0	0	0	0	112.9
813	I	24.1	Very low	27.5	Very low	159 Å²	159	123 Å²	123	82%	0.815	75%	0.75	S	S	*	*			trans	64.8	171.3	148	-61.6	163.5	0	0	0	115
814	P	31.1	Very low	27.6	Very low	108 Å²	108	127.5 Å²	127.5	70%	0.701	76%	0.758	S	S	*	*			cis	-109.8	-168.7	-44.3	37.7	-22.7	0	0	0	113
815	V	31.1	Very low	27.6	Very low	136 Å²	136	126.9 Å²	126.9	82%	0.824	76%	0.759	S	S	*	*			trans	-82.2	142.9	156.2	173.3	0	0	0	0	110.7
816	P	31	Very low	27.3	Very low	113 Å²	113	129 Å²	129	73%	0.734	76%	0.761	S	S	*	*			trans	-142.8	156.8	138.1	36.8	-22.2	0	0	0	116.8
817	T	23.6	Very low	27.2	Very low	133 Å²	133	125.4 Å²	125.4	82%	0.816	76%	0.756	S	S	*	*			trans	-77.5	-169.2	164	12.2	0	0	0	0	111.9
818	P	45.5	Very low	27.4	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	76%	0.757	S	S	*	*			cis	-134.9	173.7	-25.5	32	-12.7	0	0	0	115.1
819	G	24.2	Very low	27.4	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	75%	0.748	S	S	*	*			trans	75.8	177.7	155.2	0	0	0	0	0	117.2
820	T	25.9	Very low	27.4	Very low	125 Å²	125	130.3 Å²	130.3	77%	0.767	74%	0.739	S	S	*	*			cis	-163.8	156.8	-13	-7.2	0	0	0	0	110.7
821	I	27.2	Very low	27.5	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	74%	0.739	S	S	*	*			trans	69.8	150.2	151	-68.6	163.3	0	0	0	117.9
822	V	25.4	Very low	27.6	Very low	109 Å²	109	132.5 Å²	132.5	66%	0.661	73%	0.729	S	S	*	*			cis	-164.5	168.1	-30.7	160.7	0	0	0	0	104.7
823	K	30	Very low	27.7	Very low	185 Å²	185	135.5 Å²	135.5	80%	0.804	74%	0.739	S	S	*	*			trans	109.2	139.4	157.7	-59	168.4	-168.4	164.2	0	114.2
824	K	24.9	Very low	27.8	Very low	191 Å²	191	131.6 Å²	131.6	83%	0.83	74%	0.737	S	S	*	*			cis	-161	170.1	-14.9	-126.3	-177.3	179	-175.2	0	111.7
825	A	25	Very low	27.6	Very low	81 Å²	81	136 Å²	136	67%	0.669	75%	0.748	S	S	*	*			trans	3.3	130.2	149.3	0	0	0	0	0	119.3
826	K	26.3	Very low	27.5	Very low	182 Å²	182	134.5 Å²	134.5	79%	0.791	74%	0.744	S	S	*	*				81.9	101.6	54.4	179.2	-164	175.7	-179.9	0	114.4
827	S	25.7	Very low	27.3	Very low	107 Å²	107	141 Å²	141	75%	0.748	75%	0.753	S	S	*	*			trans	-156.6	130.5	148.9	-125	0	0	0	0	106.3
828	R	29.2	Very low	27.4	Very low	192 Å²	192	141.6 Å²	141.6	73%	0.725	75%	0.752	S	S	*	*				70.8	143.1	56.8	-72.4	179.6	156.4	-151.4	7.5	112.3
829	Q	26.6	Very low	26.4	Very low	125 Å²	125	146.2 Å²	146.2	58%	0.584	75%	0.754	S	S	*	*			cis	-159.6	173.3	11.5	-137.7	168.9	-99.7	0	0	112.8
830	M	26.1	Very low	26.7	Very low	135 Å²	135	149.7 Å²	149.7	67%	0.665	76%	0.755	S	S	*	*			trans	69.2	151.2	156.6	-67.7	159.2	69.6	0	0	115.9
831	D	26.2	Very low	26.7	Very low	125 Å²	125	147.1 Å²	147.1	67%	0.668	74%	0.743	S	S	*	*			cis	-157.8	173.5	-9.6	-109.2	-7.6	0	0	0	105.7
832	K	27.7	Very low	26.7	Very low	158 Å²	158	147.5 Å²	147.5	69%	0.687	74%	0.741	S	S	*	*			cis	165.2	128.4	-22.4	171.6	-176.6	173.2	-171.6	0	104.8
833	D	24.7	Very low	26.6	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	74%	0.742	S	S	*	*			trans	39.1	120.4	159.2	-46.9	-32.1	0	0	0	120.9
834	G	26.4	Very low	26.4	Very low	76 Å²	76	144 Å²	144	78%	0.784	74%	0.74	S	S	*	*			trans	-140.4	28.1	-173.7	0	0	0	0	0	117.8
835	H	27.4	Very low	26.5	Very low	202 Å²	202	139.6 Å²	139.6	94%	0.935	74%	0.739	S	S	*	*			trans	62	163.3	168	-80.1	-58.4	0	0	0	121.1
836	S	28.9	Very low	27.9	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	74%	0.742	S	S	*	*			trans	-117.6	144.3	-175.7	53.6	0	0	0	0	112.5
837	R	26.4	Very low	28	Very low	249 Å²	249	139.4 Å²	139.4	94%	0.94	74%	0.739	S	S	*	*			trans	-170.3	103.2	155.5	-103.1	161.8	-174.6	-178.7	1.2	105.8
838	N	25.4	Very low	28.1	Very low	146 Å²	146	141.2 Å²	141.2	78%	0.781	73%	0.73	S	S	*	*				69.2	100.4	53.6	-142.9	10.9	0	0	0	113.3
839	R	23.9	Very low	28.2	Very low	214 Å²	214	140 Å²	140	81%	0.808	73%	0.731	S	S	*	*			trans	73.9	128.5	135.7	-165.8	-171.7	-144.9	-116.6	7.6	120.2
840	L	31	Very low	28.3	Very low	141 Å²	141	137.7 Å²	137.7	74%	0.738	73%	0.732	S	S	*	*				173.6	110.5	126.9	-91.5	161.5	0	0	0	108.5
841	S	26.9	Very low	28.3	Very low	72 Å²	72	141.5 Å²	141.5	50%	0.503	75%	0.745	S	S	.	*				77.5	150.8	102	60.9	0	0	0	0	113.7
842	H	26	Very low	28.6	Very low	160 Å²	160	140.1 Å²	140.1	74%	0.741	75%	0.745	S	S	*	*			cis	-142	153.1	32	-70.5	-88.1	0	0	0	109.7
843	T	24.9	Very low	28.8	Very low	113 Å²	113	141.9 Å²	141.9	69%	0.693	75%	0.753	S	S	*	*				60.4	127.7	51.2	66.8	0	0	0	0	115.9
844	S	25.1	Very low	29	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	76%	0.759	S	S	*	*			cis	179.5	122.6	-30.7	38	0	0	0	0	111.8
845	A	25.9	Very low	30.2	Very low	99 Å²	99	147.8 Å²	147.8	82%	0.818	75%	0.754	S	S	*	*			trans	62.5	-157.6	150.2	0	0	0	0	0	117.2
846	P	55.2	Low	30	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	75%	0.753	S	S	*	*				-133.2	-154	-89.4	43.1	-26.5	0	0	0	113.6
847	M	28.9	Very low	30	Very low	146 Å²	146	145.2 Å²	145.2	72%	0.719	75%	0.753	S	S	*	*			trans	126.6	159	156.8	-73.3	-56.7	-159.8	0	0	113.8
848	Y	28.3	Very low	31.1	Very low	146 Å²	146	138.1 Å²	138.1	57%	0.573	74%	0.739	S	S	*	*			cis	-135.1	-176.9	4.8	-91.4	-46.3	0	0	0	107.8
849	F	30.6	Very low	31.1	Very low	167 Å²	167	138.3 Å²	138.3	73%	0.732	74%	0.74	S	S	*	*			cis	-169.7	179.1	-11	-107.3	-24.7	0	0	0	105.6
850	A	29.3	Very low	31.3	Very low	75 Å²	75	132 Å²	132	62%	0.62	73%	0.734	S	S	*	*			cis	-174.3	150.1	-28.7	0	0	0	0	0	109.5
851	K	25.3	Very low	31	Very low	216 Å²	216	134.9 Å²	134.9	94%	0.939	74%	0.743	S	S	*	*			trans	-175.4	156.1	144.8	-103.7	164	-173	-177.7	0	111.6
852	S	33.1	Very low	30.9	Very low	96 Å²	96	134.5 Å²	134.5	67%	0.671	75%	0.751	S	S	*	*			trans	-164.1	163.1	-173	78.8	0	0	0	0	115.3
853	K	32.2	Very low	31	Very low	194 Å²	194	134.1 Å²	134.1	84%	0.843	76%	0.759	S	S	*	*			trans	71.2	150	157.7	-67.6	172.6	-178.6	177.5	0	117.5
854	R	27.2	Very low	31.1	Very low	238 Å²	238	131.7 Å²	131.7	90%	0.898	76%	0.757	S	S	*	*			cis	-161	-168.8	-19.7	-119.8	-153.3	170.8	-178.1	-1.4	109.8
855	P	52.6	Low	31.2	Very low	106 Å²	106	132.6 Å²	132.6	69%	0.688	76%	0.758	S	S	*	*			trans	-120.2	177.8	-150	46.6	-36.7	0	0	0	118
856	V	22.9	Very low	31.3	Very low	150 Å²	150	133.1 Å²	133.1	91%	0.909	75%	0.751	S	S	*	*			trans	-147.2	158.8	166.4	-179.4	0	0	0	0	111.5
857	S	29.2	Very low	30	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	75%	0.748	S	S	*	*			trans	-152	168.6	167.8	56.4	0	0	0	0	108.1
858	P	49.1	Very low	30	Very low	100 Å²	100	136.9 Å²	136.9	65%	0.649	75%	0.752	S	S	*	*			cis	-139.1	-141.4	18.1	38.3	-13	0	0	0	113.9
859	D	24.7	Very low	30	Very low	150 Å²	150	137.7 Å²	137.7	80%	0.802	77%	0.766	S	S	*	*			trans	70.4	157.5	163.6	-56.6	-26.8	0	0	0	119.3
860	A	28.3	Very low	30.7	Very low	82 Å²	82	135 Å²	135	68%	0.678	77%	0.765	S	S	*	*			cis	-166.5	167.3	-31.1	0	0	0	0	0	109.7
861	E	24.8	Very low	31.1	Very low	201 Å²	201	137.8 Å²	137.8	94%	0.939	78%	0.777	S	S	*	*			trans	63.6	154.8	173.2	-52.5	-169.8	155.8	0	0	117.2
862	G	26.2	Very low	31.2	Very low	64 Å²	64	131 Å²	131	66%	0.66	77%	0.767	S	S	*	*			cis	172.8	153.2	-10.1	0	0	0	0	0	112.3
863	V	27.8	Very low	31	Very low	151 Å²	151	136.2 Å²	136.2	92%	0.915	78%	0.781	S	S	*	*			trans	67.1	140.9	173.8	-167.2	0	0	0	0	113.3
864	G	25.7	Very low	30.9	Very low	62 Å²	62	135.8 Å²	135.8	64%	0.639	78%	0.782	S	S	*	*			cis	103.9	142.6	32.9	0	0	0	0	0	109.1
865	T	27.8	Very low	31.2	Very low	126 Å²	126	130 Å²	130	77%	0.773	78%	0.775	S	S	*	*			cis	-161.7	134.2	3.5	15.9	0	0	0	0	111.1
866	T	28.5	Very low	30	Very low	111 Å²	111	129.5 Å²	129.5	68%	0.681	78%	0.781	S	S	*	*			trans	32.3	154.9	137.3	57.7	0	0	0	0	124.5
867	N	28.4	Very low	30.8	Very low	124 Å²	124	128.5 Å²	128.5	66%	0.663	78%	0.777	S	S	*	*			trans	88.1	148	163.2	-50.9	-71.8	0	0	0	117.6
868	R	27.4	Very low	30.5	Very low	213 Å²	213	135.2 Å²	135.2	80%	0.804	79%	0.786	S	S	*	*			cis	-157.9	125.1	-18.8	-111.6	172.5	-163.5	-143.9	0.6	110.8
869	L	28.7	Very low	29.7	Very low	163 Å²	163	141.8 Å²	141.8	85%	0.853	80%	0.798	S	S	*	*			trans	45.8	138.3	133.8	-69.2	166.5	0	0	0	123.9
870	P	45.3	Very low	29.9	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	80%	0.803	S	S	*	*			trans	-101.5	-179.3	179	43.7	-38.3	0	0	0	114.1
871	P	38.8	Very low	29.8	Very low	134 Å²	134	151.3 Å²	151.3	87%	0.87	81%	0.814	S	S	*	*				-137.3	-160.9	106.1	40.1	-29	0	0	0	112.5
872	G	27.5	Very low	30.1	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	80%	0.803	S	S	*	*			trans	152.2	2.2	152.9	0	0	0	0	0	125
873	Q	27.9	Very low	30.3	Very low	206 Å²	206	151.9 Å²	151.9	96%	0.963	82%	0.815	S	S	*	*			trans	62.1	176.9	168.3	-74.8	-177.9	-18.1	0	0	120
874	Q	30.5	Very low	30.6	Very low	186 Å²	186	153.6 Å²	153.6	87%	0.869	81%	0.813	S	S	*	*			trans	-99.1	172.8	-164.8	-88.3	-179.7	-1.7	0	0	112.2
875	P	32.3	Very low	30.8	Very low	115 Å²	115	154.5 Å²	154.5	75%	0.747	82%	0.815	S	S	*	*			cis	-151.7	168.2	35.3	43.6	-22.4	0	0	0	121.6
876	A	27.9	Very low	31.1	Very low	97 Å²	97	158.6 Å²	158.6	80%	0.802	82%	0.822	S	S	*	*			trans	66.4	151.9	147.6	0	0	0	0	0	121.1
877	P	39.3	Very low	31.2	Very low	128 Å²	128	159.2 Å²	159.2	83%	0.831	83%	0.825	S	S	*	*			trans	-107.2	153.8	-159.2	39.4	-33.8	0	0	0	116
878	R	24.1	Very low	31.6	Very low	244 Å²	244	159.3 Å²	159.3	92%	0.921	83%	0.83	S	S	*	*			trans	-150.4	125.2	162.9	-143.8	171.5	-170.3	172.4	2.4	113.9
879	R	32	Very low	32.5	Very low	238 Å²	238	153 Å²	153	90%	0.898	82%	0.824	S	S	*	*			trans	4	122.9	165.5	-65.8	176.9	170.2	-178.2	-4.2	119.6
880	Q	28.4	Very low	33.9	Very low	192 Å²	192	150.8 Å²	150.8	90%	0.897	82%	0.817	S	S	*	*				-138.7	119.8	127.3	-66.9	-164.7	-5.7	0	0	107
881	R	27.2	Very low	34.9	Very low	240 Å²	240	147.1 Å²	147.1	91%	0.906	80%	0.796	S	S	*	*				89.9	114.3	59	-166.7	177.5	-162.7	173.6	5.9	110.8
882	S	30.6	Very low	36.7	Very low	102 Å²	102	141 Å²	141	71%	0.713	76%	0.756	S	S	*	*			trans	-75.8	157.1	-178.1	47.1	0	0	0	0	113
883	L	31	Very low	39.2	Very low	175 Å²	175	141.2 Å²	141.2	92%	0.916	75%	0.746	S	S	*	*			trans	-105.3	121.4	165.4	-71.5	171.3	0	0	0	109
884	H	32.7	Very low	41.7	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.866	71%	0.705	S	S	*	*			trans	-78.7	121	170.5	-100.5	-69.3	0	0	0	110.1
885	A	30.6	Very low	44.1	Very low	82 Å²	82	131.5 Å²	131.5	68%	0.678	69%	0.694	S	S	*	*			trans	-92	128.2	155.1	0	0	0	0	0	108.5	V887	A885-V887 PolarHBondContact O-N 3.19Å; A885-V887 VanDerWaalsContact O-N 3.16Å
886	K	33.1	Very low	46.4	Very low	212 Å²	212	127 Å²	127	92%	0.922	67%	0.665	S	S	*	*			trans	-87.8	80.7	-174.1	-167.4	178.7	-176.8	-178.5	0	110.6
887	V	31.4	Very low	49.1	Very low	124 Å²	124	122.5 Å²	122.5	75%	0.752	63%	0.628	S	S	*	*			trans	-80.7	127.4	174.4	-179.9	0	0	0	0	109.7	A885 A889	A885-V887 PolarHBondContact O-N 3.19Å; A885-V887 VanDerWaalsContact O-N 3.16Å; V887-A889 PolarHBondContact O-N 3.33Å
888	T	36.8	Very low	51.3	Low	126 Å²	126	118.5 Å²	118.5	77%	0.773	60%	0.598	S	S	*	*			trans	-67.7	117.5	170	-19.6	0	0	0	0	108.8	T890	T888-T890 PolarHBondContact O-N 3.1Å
889	A	45.5	Very low	54.1	Low	80 Å²	80	106.9 Å²	106.9	66%	0.661	55%	0.554	S	S	*	*			trans	-73.7	98.9	-177.1	0	0	0	0	0	111	V887 L1012	V887-A889 PolarHBondContact O-N 3.33Å; A889-L1012 HydrophobicContact CB-CD2 4.46Å
890	T	59.3	Low	56.5	Low	116 Å²	116	99.2 Å²	99.2	71%	0.712	53%	0.534	S	S	*	.			trans	-75	133.9	168.1	51.4	0	0	0	0	110.2	T888	T888-T890 PolarHBondContact O-N 3.1Å
891	A	65.1	Low	59	Low	33 Å²	33	93.7 Å²	93.7	27%	0.273	51%	0.508	S	S	.	.			trans	-61.7	146.4	177.6	0	0	0	0	0	112.3	S893 S1014	A891-S893 PolarHBondContact O-N 3.35Å; A891-S1014 WeakPolarHBondContact CB-OG 3.26Å
892	P	77.6	Confident	61	Low	5 Å²	5	83.6 Å²	83.6	3%	0.032	47%	0.473	C	S	.	.			trans	-80.5	102.3	-170.6	28.1	-31.1	0	0	0	113.2	V944 V996	P892-V944 HydrophobicContact CB-CG1 3.74Å; P892-V996 HydrophobicContact CB-CG1 4.29Å; P892-V996 HydrophobicContact CG-CG1 4.35Å; P892-V996 WeakPolarHBondContact CG-O 3.46Å; P892-V996 WeakPolarHBondContact O-CG1 3.5Å
893	S	78.9	Confident	62.9	Low	78 Å²	78	85.1 Å²	85.1	55%	0.545	47%	0.473	S	S	.	.			trans	-87.5	141.5	-179.1	58.4	0	0	0	0	115.2	A891 Y1016	A891-S893 PolarHBondContact O-N 3.35Å; S893-Y1016 WeakPolarHBondContact CA-OH 3.38Å
894	L	81.1	Confident	65	Low	18 Å²	18	81.2 Å²	81.2	9%	0.094	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	143	161.2	-62	178.2	0	0	0	110.4	V897 M938 M939 V996 Y1016	L894-V897 HydrophobicContact CD1-CG2 3.98Å; L894-M938 HydrophobicContact CD1-CB 4.07Å; L894-M938 HydrophobicContact CD1-CG 4.25Å; L894-M938 HydrophobicContact CD1-SD 4.16Å; L894-M938 HydrophobicContact CD2-CB 4.14Å; L894-M939 CarbonylContact C-O 3.43Å; L894-V996 HydrophobicContact CD1-CG2 4.33Å; L894-V996 HydrophobicContact CD2-CG2 4.33Å; L894-V996 HydrophobicContact CG-CG2 4.22Å; L894-Y1016 HydrophobicContact CB-CE1 4.2Å; L894-Y1016 HydrophobicContact CD1-CD1 4.01Å; L894-Y1016 HydrophobicContact CD1-CD2 4.1Å; L894-Y1016 HydrophobicContact CD1-CE1 3.99Å; L894-Y1016 HydrophobicContact CD1-CE2 4.05Å; L894-Y1016 HydrophobicContact CD1-CG 4.06Å; L894-Y1016 HydrophobicContact CG-CD2 4.46Å; L894-Y1016 HydrophobicContact CG-CE1 4.22Å; L894-Y1016 HydrophobicContact CG-CE2 3.94Å; L894-Y1016 PolarHBondContact N-OH 3.01Å
895	R	81.5	Confident	67.1	Low	170 Å²	170	77.1 Å²	77.1	64%	0.642	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	-41	179.3	175.2	-178.3	174.3	174.8	-1.5	112.3	M939 R941	R895-M939 PolarHBondContact N-O 2.91Å; R895-R941 HydrophobicContact CB-CG 4.34Å
896	S	80.7	Confident	69.2	Low	20 Å²	20	74.1 Å²	74.1	14%	0.14	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	154	-179.3	51.1	0	0	0	0	109.2	M939	S896-M939 PolarHBondContact N-O 3.44Å; S896-M939 PolarHBondContact O-N 3.44Å
897	V	83.9	Confident	70.3	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.018	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.3	173.5	-171.2	0	0	0	0	108.4	L894 I906 L936 H937 M938 F1018	L894-V897 HydrophobicContact CD1-CG2 3.98Å; V897-I906 HydrophobicContact CB-CB 4.38Å; V897-I906 HydrophobicContact CB-CD1 4.05Å; V897-I906 HydrophobicContact CB-CG1 4.43Å; V897-I906 HydrophobicContact CG1-CD1 3.81Å; V897-I906 WeakPolarHBondContact O-CB 3.4Å; V897-I906 WeakPolarHBondContact O-CG1 3.46Å; V897-I906 PolarHBondContact O-N 2.69Å; V897-L936 HydrophobicContact CG1-CB 4.47Å; V897-L936 HydrophobicContact CG1-CD2 4.48Å; V897-H937 CarbonylContact C-O 3.47Å; V897-H937 VanDerWaalsContact CA-O 3.32Å; V897-H937 WeakPolarHBondContact CA-O 3.48Å; V897-M938 HydrophobicContact CG1-CG 3.81Å; V897-M938 HydrophobicContact CG2-CB 4.31Å; V897-M938 HydrophobicContact CG2-CG 4.11Å; V897-F1018 HydrophobicContact CB-CE1 4.3Å; V897-F1018 HydrophobicContact CG1-CE1 3.85Å; V897-F1018 HydrophobicContact CG1-CZ 4.14Å; V897-F1018 HydrophobicContact CG2-CE1 4.28Å; V897-F1018 HydrophobicContact CG2-CZ 4.15Å
898	H	85.6	Confident	71.4	Confident	43 Å²	43	67.2 Å²	67.2	20%	0.199	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.4	179.5	-64.7	66.5	0	0	0	110.3	Q904 E905 H937	H898-Q904 CarbonylContact C-O 3.59Å; H898-Q904 VanDerWaalsContact CA-O 3.31Å; H898-Q904 WeakPolarHBondContact CA-O 3.4Å; H898-E905 IonicContact CE1-OE1 2.8Å; H898-E905 PolarHBondContact CE1-OE1 3Å; H898-E905 IonicContact NE2-OE1 3.87Å; H898-H937 HydrophobicContact CB-CB 4.45Å; H898-H937 PolarHBondContact N-O 2.84Å; H898-H937 PolarHBondContact O-N 3.28Å
899	I	83.1	Confident	71.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.4	162.9	-61.7	169.3	0	0	0	107.8	E901 T902 N903 Q904 L921 I934 L936	I899-E901 WeakPolarHBondContact CG2-OE2 3.33Å; I899-T902 WeakPolarHBondContact CB-OG1 3.37Å; I899-T902 HydrophobicContact CG2-CG2 4.4Å; I899-T902 WeakPolarHBondContact CG2-OG1 3.29Å; I899-N903 WeakPolarHBondContact O-CA 3.5Å; I899-N903 PolarHBondContact O-N 3.1Å; I899-Q904 PolarHBondContact N-O 3.28Å; I899-Q904 PolarHBondContact O-N 3.12Å; I899-L921 HydrophobicContact CD1-CD1 4.15Å; I899-L921 HydrophobicContact CD1-CD2 4.02Å; I899-I934 HydrophobicContact CD1-CD1 4Å; I899-I934 HydrophobicContact CG1-CD1 4.22Å; I899-I934 HydrophobicContact CG2-CB 4.08Å; I899-I934 HydrophobicContact CG2-CD1 4.49Å; I899-L936 HydrophobicContact CG1-CD2 4.19Å
900	V	83.5	Confident	72.1	Confident	78 Å²	78	69.3 Å²	69.3	47%	0.473	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-42.2	-175.5	178.5	0	0	0	0	111.8	N903 T935 H937 L979	V900-N903 PolarHBondContact O-N 2.76Å; V900-T935 HydrophobicContact CG2-CG2 4.05Å; V900-T935 WeakPolarHBondContact CG2-O 3.21Å; V900-T935 PolarHBondContact N-O 2.71Å; V900-H937 HydrophobicContact CG2-CB 3.97Å; V900-L979 HydrophobicContact CG2-CD2 4.07Å
901	E	79.7	Confident	72	Confident	75 Å²	75	66 Å²	66	35%	0.35	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-33.1	-172.3	-61.5	74.9	-167.5	0	0	112.7	I899 I934 T935	I899-E901 WeakPolarHBondContact CG2-OE2 3.33Å; E901-I934 WeakPolarHBondContact OE2-CA 3.32Å; E901-T935 WeakPolarHBondContact OE1-CB 3.4Å; E901-T935 PolarHBondContact OE1-N 3.03Å; E901-T935 PolarHBondContact OE1-OG1 3.5Å; E901-T935 PolarHBondContact OE2-N 3.13Å
902	T	70	Confident	71.2	Confident	29 Å²	29	74.2 Å²	74.2	18%	0.178	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-6	176.8	61.8	0	0	0	0	113.2	I899 Q904	I899-T902 WeakPolarHBondContact CB-OG1 3.37Å; I899-T902 HydrophobicContact CG2-CG2 4.4Å; I899-T902 WeakPolarHBondContact CG2-OG1 3.29Å; T902-Q904 PolarHBondContact O-N 3.34Å; T902-Q904 VanDerWaalsContact OG1-CB 3.29Å; T902-Q904 WeakPolarHBondContact OG1-CB 3.41Å
903	N	70.6	Confident	70.2	Confident	134 Å²	134	76.8 Å²	76.8	72%	0.717	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	36.7	-170.8	-165.8	51.3	0	0	0	113.4	I899 V900	I899-N903 WeakPolarHBondContact O-CA 3.5Å; I899-N903 PolarHBondContact O-N 3.1Å; V900-N903 PolarHBondContact O-N 2.76Å
904	Q	74.3	Confident	69	Low	92 Å²	92	77.4 Å²	77.4	43%	0.43	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.6	-174.8	-176.1	175.8	-2.7	0	0	110.7	H898 I899 T902	H898-Q904 CarbonylContact C-O 3.59Å; H898-Q904 VanDerWaalsContact CA-O 3.31Å; H898-Q904 WeakPolarHBondContact CA-O 3.4Å; I899-Q904 PolarHBondContact N-O 3.28Å; I899-Q904 PolarHBondContact O-N 3.12Å; T902-Q904 PolarHBondContact O-N 3.34Å; T902-Q904 VanDerWaalsContact OG1-CB 3.29Å; T902-Q904 WeakPolarHBondContact OG1-CB 3.41Å
905	E	76.1	Confident	68	Low	101 Å²	101	82.1 Å²	82.1	47%	0.472	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132	170.4	-173.6	166	-145.7	0	0	110.6	H898 T907	H898-E905 IonicContact CE1-OE1 2.8Å; H898-E905 PolarHBondContact CE1-OE1 3Å; H898-E905 IonicContact NE2-OE1 3.87Å; E905-T907 HydrophobicContact CG-CG2 4.28Å; E905-T907 PolarHBondContact O-N 2.82Å
906	I	75	Confident	67.5	Low	19 Å²	19	76.1 Å²	76.1	10%	0.097	43%	0.426	C	S	.	.			trans	-87.2	89	174.8	-50.2	-178.1	0	0	0	107.5	V897 Y919 L921 L936 F1018	V897-I906 HydrophobicContact CB-CB 4.38Å; V897-I906 HydrophobicContact CB-CD1 4.05Å; V897-I906 HydrophobicContact CB-CG1 4.43Å; V897-I906 HydrophobicContact CG1-CD1 3.81Å; V897-I906 WeakPolarHBondContact O-CB 3.4Å; V897-I906 WeakPolarHBondContact O-CG1 3.46Å; V897-I906 PolarHBondContact O-N 2.69Å; I906-Y919 HydrophobicContact CG2-CD1 3.78Å; I906-Y919 HydrophobicContact CG2-CD2 4.36Å; I906-Y919 HydrophobicContact CG2-CE1 4.38Å; I906-Y919 HydrophobicContact CG2-CG 3.76Å; I906-L921 HydrophobicContact CD1-CD1 3.9Å; I906-L921 HydrophobicContact CD1-CD2 3.79Å; I906-L921 HydrophobicContact CD1-CG 4.35Å; I906-L921 HydrophobicContact CG1-CD2 3.9Å; I906-L921 HydrophobicContact CG2-CD2 4.47Å; I906-L936 HydrophobicContact CD1-CD2 4.29Å; I906-F1018 HydrophobicContact CD1-CD1 4.07Å; I906-F1018 HydrophobicContact CD1-CE1 3.95Å
907	T	56.5	Low	67.3	Low	95 Å²	95	75.9 Å²	75.9	58%	0.583	42%	0.424	S	S	*	.			trans	-70.6	132.5	-176.7	47	0	0	0	0	111.8	E905 Q909	E905-T907 HydrophobicContact CG-CG2 4.28Å; E905-T907 PolarHBondContact O-N 2.82Å; T907-Q909 VanDerWaalsContact C-N 3.32Å; T907-Q909 PolarHBondContact O-N 2.94Å
908	S	55	Low	67	Low	97 Å²	97	78.8 Å²	78.8	68%	0.678	44%	0.444	S	S	*	.			trans	-82.2	63.1	-164.1	63.4	0	0	0	0	114
909	Q	47.5	Very low	66.6	Low	187 Å²	187	77.6 Å²	77.6	87%	0.874	44%	0.438	S	S	*	.			trans	-92.5	-2.2	177.8	-69.2	-168.4	-17.5	0	0	114.7	T907	T907-Q909 VanDerWaalsContact C-N 3.32Å; T907-Q909 PolarHBondContact O-N 2.94Å
910	S	49	Very low	66.1	Low	62 Å²	62	81.7 Å²	81.7	43%	0.434	46%	0.463	S	S	.	.			trans	-138.7	55.7	-174	63.7	0	0	0	0	114.9	S918	S910-S918 VanDerWaalsContact O-O 3.12Å; S910-S918 PolarHBondContact OG-O 2.83Å
911	C	57.7	Low	65.7	Low	48 Å²	48	78.4 Å²	78.4	32%	0.324	44%	0.443	S	S	.	.			trans	-115.1	99.7	159.1	-59.1	0	0	0	0	108.6	S913 C917	C911-S913 VanDerWaalsContact C-N 3.26Å; C911-S913 PolarHBondContact O-N 3.17Å; C911-C917 HydrophobicContact CB-CB 4.18Å; C911-C917 WeakPolarHBondContact CB-SG 3.34Å; C911-C917 WeakPolarHBondContact SG-CB 3.38Å; C911-C917 CovalentContact SG-SG 2.04Å; C911-C917 PolarHBondContact SG-SG 2.89Å
912	E	49	Very low	65.1	Low	205 Å²	205	77.8 Å²	77.8	96%	0.958	45%	0.447	S	S	*	.			trans	-79.5	-9.5	-179.2	-61.2	-174.8	141.1	0	0	112.8
913	S	54.7	Low	65	Low	59 Å²	59	78.6 Å²	78.6	41%	0.413	45%	0.45	S	S	.	.	S	Bend	trans	-131.3	163.2	176.7	86.3	0	0	0	0	111.7	C911 E915 S916	C911-S913 VanDerWaalsContact C-N 3.26Å; C911-S913 PolarHBondContact O-N 3.17Å; S913-E915 VanDerWaalsContact C-N 3.35Å; S913-E915 PolarHBondContact OG-N 2.78Å; S913-S916 PolarHBondContact OG-N 2.98Å; S913-S916 PolarHBondContact OG-O 2.6Å
914	A	54.6	Low	64.2	Low	91 Å²	91	82.1 Å²	82.1	75%	0.752	45%	0.453	S	S	*	.	S	Bend	trans	-85.7	-5.9	173.8	0	0	0	0	0	113.8
915	E	59.8	Low	63.2	Low	117 Å²	117	81.2 Å²	81.2	55%	0.547	47%	0.468	S	S	.	.	S	Bend	trans	-112.3	-33	-169	-62.6	180	170.9	0	0	112.1	S913 P1011 S1014 D1015	S913-E915 VanDerWaalsContact C-N 3.35Å; S913-E915 PolarHBondContact OG-N 2.78Å; E915-P1011 HydrophobicContact CG-CG 4.31Å; E915-P1011 WeakPolarHBondContact OE1-CG 3.23Å; E915-S1014 WeakPolarHBondContact O-CA 3.38Å; E915-D1015 PolarHBondContact O-N 3.41Å
916	S	71.6	Confident	61.9	Low	43 Å²	43	82.3 Å²	82.3	30%	0.301	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.4	172.9	-175	0	0	0	0	112.5	S913 D1015	S913-S916 PolarHBondContact OG-N 2.98Å; S913-S916 PolarHBondContact OG-O 2.6Å; S916-D1015 WeakPolarHBondContact CA-O 3.35Å
917	C	75.9	Confident	60.5	Low	15 Å²	15	91.2 Å²	91.2	10%	0.101	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.4	178.1	-89.5	0	0	0	0	110.6	C911 Y919 D1015 Y1016 H1017	C911-C917 HydrophobicContact CB-CB 4.18Å; C911-C917 WeakPolarHBondContact CB-SG 3.34Å; C911-C917 WeakPolarHBondContact SG-CB 3.38Å; C911-C917 CovalentContact SG-SG 2.04Å; C911-C917 PolarHBondContact SG-SG 2.89Å; C917-Y919 HydrophobicContact CB-CE2 4.35Å; C917-D1015 PolarHBondContact N-O 3.45Å; C917-Y1016 HydrophobicContact CB-CD1 3.46Å; C917-Y1016 VanDerWaalsContact CB-CD1 3.46Å; C917-Y1016 HydrophobicContact CB-CE1 3.55Å; C917-Y1016 HydrophobicContact CB-CG 4.36Å; C917-Y1016 WeakPolarHBondContact O-CA 3.42Å; C917-H1017 PolarHBondContact O-N 3.02Å
918	S	78	Confident	59.8	Low	64 Å²	64	92.5 Å²	92.5	45%	0.448	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.8	178.9	-69.2	0	0	0	0	111.6	S910 H1017	S910-S918 VanDerWaalsContact O-O 3.12Å; S910-S918 PolarHBondContact OG-O 2.83Å; S918-H1017 WeakPolarHBondContact CA-O 3.36Å
919	Y	76.4	Confident	59.4	Low	19 Å²	19	96.2 Å²	96.2	8%	0.075	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.9	-179.4	-52.1	-64.5	0	0	0	111.1	I906 C917 Y1016 H1017 F1018 L1019	I906-Y919 HydrophobicContact CG2-CD1 3.78Å; I906-Y919 HydrophobicContact CG2-CD2 4.36Å; I906-Y919 HydrophobicContact CG2-CE1 4.38Å; I906-Y919 HydrophobicContact CG2-CG 3.76Å; C917-Y919 HydrophobicContact CB-CE2 4.35Å; Y919-Y1016 AromaticContact CE2-CD1 3.86Å; Y919-Y1016 HydrophobicContact CE2-CD1 3.86Å; Y919-Y1016 HydrophobicContact CE2-CE1 4.39Å; Y919-H1017 PolarHBondContact N-O 3.38Å; Y919-F1018 AromaticContact CD2-CD1 3.73Å; Y919-F1018 HydrophobicContact CD2-CD1 3.73Å; Y919-F1018 AromaticContact CD2-CE1 3.37Å; Y919-F1018 HydrophobicContact CD2-CE1 3.37Å; Y919-F1018 AromaticContact CD2-CZ 3.91Å; Y919-F1018 HydrophobicContact CD2-CZ 3.91Å; Y919-F1018 AromaticContact CE2-CE1 3.88Å; Y919-F1018 HydrophobicContact CE2-CE1 3.88Å; Y919-F1018 HydrophobicContact CE2-CZ 4.06Å; Y919-F1018 HydrophobicContact CG-CD1 4.44Å; Y919-F1018 HydrophobicContact CG-CE1 4.36Å; Y919-L1019 PolarHBondContact O-N 2.61Å
920	T	74.1	Confident	59.8	Low	86 Å²	86	92.5 Å²	92.5	53%	0.528	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.3	175.7	-56.7	0	0	0	0	110.4	L1019	T920-L1019 CarbonylContact C-O 3.56Å; T920-L1019 WeakPolarHBondContact CA-O 3.36Å; T920-L1019 HydrophobicContact CG2-CD2 4.12Å; T920-L1019 HydrophobicContact CG2-CG 4.28Å
921	L	73.9	Confident	60.5	Low	8 Å²	8	92.3 Å²	92.3	4%	0.042	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	93.8	-171.6	-66.8	170.4	0	0	0	110.6	I899 I906 L936 F1018 L1019 I1020 Q1021	I899-L921 HydrophobicContact CD1-CD1 4.15Å; I899-L921 HydrophobicContact CD1-CD2 4.02Å; I906-L921 HydrophobicContact CD1-CD1 3.9Å; I906-L921 HydrophobicContact CD1-CD2 3.79Å; I906-L921 HydrophobicContact CD1-CG 4.35Å; I906-L921 HydrophobicContact CG1-CD2 3.9Å; I906-L921 HydrophobicContact CG2-CD2 4.47Å; L921-L936 HydrophobicContact CD1-CD2 4.3Å; L921-F1018 HydrophobicContact CD1-CB 4.47Å; L921-F1018 HydrophobicContact CD1-CD1 4.29Å; L921-L1019 PolarHBondContact N-O 2.74Å; L921-I1020 HydrophobicContact CB-CG1 4.43Å; L921-I1020 HydrophobicContact CB-CG2 4.47Å; L921-I1020 HydrophobicContact CD1-CG1 4.1Å; L921-Q1021 PolarHBondContact O-N 3.48Å
922	S	68	Low	61	Low	62 Å²	62	93.6 Å²	93.6	43%	0.434	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	109.3	179.2	-48.7	0	0	0	0	111.7	R924 Q1021	S922-R924 PolarHBondContact O-N 3.22Å; S922-Q1021 PolarHBondContact OG-OE1 3.14Å
923	L	68	Low	62.6	Low	47 Å²	47	88.7 Å²	88.7	25%	0.246	49%	0.494	C	S	.	.			trans	-76.7	28.8	-179	-62	-179.3	0	0	0	114.2	G925 I934 V984 I1020 Q1021	L923-G925 PolarHBondContact O-N 3.08Å; L923-I934 HydrophobicContact CD1-CG2 4.37Å; L923-V984 HydrophobicContact CD1-CG1 3.75Å; L923-I1020 HydrophobicContact CD1-CG2 3.99Å; L923-I1020 HydrophobicContact CG-CG2 4.19Å; L923-Q1021 PolarHBondContact N-O 3.42Å
924	R	54	Low	63.9	Low	208 Å²	208	85.9 Å²	85.9	79%	0.785	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	100	-178.1	-69.6	-173.3	179.5	-170.1	1.4	111.4	S922	S922-R924 PolarHBondContact O-N 3.22Å
925	G	52.2	Low	65.5	Low	72 Å²	72	82.4 Å²	82.4	74%	0.742	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	148.9	-14.9	156.9	0	0	0	0	0	118	L923 K927	L923-G925 PolarHBondContact O-N 3.08Å; G925-K927 PolarHBondContact O-N 3.03Å
926	Q	49.7	Very low	66.8	Low	124 Å²	124	76.8 Å²	76.8	58%	0.579	42%	0.418	S	S	*	.			trans	-77.8	119.3	179	-66.6	-150.3	1.9	0	0	111.2	N928	Q926-N928 PolarHBondContact O-N 2.82Å
927	K	45.3	Very low	67.7	Low	206 Å²	206	76.9 Å²	76.9	90%	0.896	41%	0.413	S	S	*	.			trans	-86.5	14.6	-168.2	-136.1	176	-174.1	179.7	0	114.5	G925	G925-K927 PolarHBondContact O-N 3.03Å
928	N	41.5	Very low	68.3	Low	123 Å²	123	76.2 Å²	76.2	66%	0.658	41%	0.408	S	S	*	.	S	Bend	trans	-115.4	121.7	-175.6	-68.7	-9.5	0	0	0	110.1	Q926	Q926-N928 PolarHBondContact O-N 2.82Å
929	H	46.1	Very low	68.7	Low	175 Å²	175	75 Å²	75	81%	0.81	40%	0.397	S	S	*	.	S	Bend	trans	20.7	100.2	159.2	-61.3	-86.4	0	0	0	118	I931	H929-I931 PolarHBondContact O-N 3.26Å; H929-I931 VanDerWaalsContact O-N 3.14Å
930	S	56.1	Low	69.3	Low	109 Å²	109	74.6 Å²	74.6	76%	0.762	40%	0.396	S	S	*	.			trans	15.2	84.7	150.9	58.2	0	0	0	0	116.3	P932	S930-P932 VanDerWaalsContact O-CD 3.29Å; S930-P932 WeakPolarHBondContact O-CD 3.49Å
931	I	64.2	Low	69.6	Low	57 Å²	57	80.1 Å²	80.1	29%	0.292	41%	0.407	S	S	.	.			trans	-71.8	115.1	172.3	-63.1	174.5	0	0	0	108.1	H929 Q933 I934	H929-I931 PolarHBondContact O-N 3.26Å; H929-I931 VanDerWaalsContact O-N 3.14Å; I931-Q933 WeakPolarHBondContact CG2-O 3.21Å; I931-I934 HydrophobicContact CG2-CG2 4.01Å
932	P	68.7	Low	70	Confident	75 Å²	75	84.6 Å²	84.6	49%	0.487	43%	0.432	S	S	.	.			trans	-77.5	-30.6	-176.1	30	-32.9	0	0	0	112.5	S930 P983 V984 S985	S930-P932 VanDerWaalsContact O-CD 3.29Å; S930-P932 WeakPolarHBondContact O-CD 3.49Å; P932-P983 WeakPolarHBondContact O-CA 3.49Å; P932-V984 PolarHBondContact O-N 2.87Å; P932-S985 PolarHBondContact O-N 2.88Å
933	Q	81	Confident	70.9	Confident	102 Å²	102	84.7 Å²	84.7	48%	0.477	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.4	-176.7	64.3	-174	-15.6	0	0	110.8	I931 V982	I931-Q933 WeakPolarHBondContact CG2-O 3.21Å; Q933-V982 CarbonylContact C-O 3.58Å; Q933-V982 VanDerWaalsContact CA-O 3.32Å; Q933-V982 WeakPolarHBondContact CA-O 3.45Å
934	I	83.6	Confident	72	Confident	1 Å²	1	82.5 Å²	82.5	1%	0.005	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.8	170.8	71.5	173.9	0	0	0	109.9	I899 E901 L923 I931 L936 S981 V982 V984 I1020	I899-I934 HydrophobicContact CD1-CD1 4Å; I899-I934 HydrophobicContact CG1-CD1 4.22Å; I899-I934 HydrophobicContact CG2-CB 4.08Å; I899-I934 HydrophobicContact CG2-CD1 4.49Å; E901-I934 WeakPolarHBondContact OE2-CA 3.32Å; L923-I934 HydrophobicContact CD1-CG2 4.37Å; I931-I934 HydrophobicContact CG2-CG2 4.01Å; I934-L936 HydrophobicContact CD1-CD2 4.5Å; I934-S981 CarbonylContact O-C 3.54Å; I934-S981 WeakPolarHBondContact O-CA 3.44Å; I934-V982 HydrophobicContact CG1-CG2 3.85Å; I934-V982 PolarHBondContact N-O 3.44Å; I934-V982 WeakPolarHBondContact O-CG2 3.45Å; I934-V982 PolarHBondContact O-N 2.66Å; I934-V984 HydrophobicContact CB-CG2 4.41Å; I934-V984 HydrophobicContact CD1-CG2 4.23Å; I934-V984 HydrophobicContact CG1-CG2 3.84Å; I934-V984 HydrophobicContact CG2-CG2 4.03Å; I934-I1020 HydrophobicContact CD1-CD1 3.65Å; I934-I1020 HydrophobicContact CD1-CG1 4.16Å; I934-I1020 HydrophobicContact CD1-CG2 4.21Å; I934-I1020 HydrophobicContact CG1-CD1 4.14Å
935	T	88.3	Confident	73.6	Confident	17 Å²	17	75.7 Å²	75.7	10%	0.104	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	111.7	-178.6	-53.1	0	0	0	0	110	V900 E901 H937 L979 W980 S981	V900-T935 HydrophobicContact CG2-CG2 4.05Å; V900-T935 WeakPolarHBondContact CG2-O 3.21Å; V900-T935 PolarHBondContact N-O 2.71Å; E901-T935 WeakPolarHBondContact OE1-CB 3.4Å; E901-T935 PolarHBondContact OE1-N 3.03Å; E901-T935 PolarHBondContact OE1-OG1 3.5Å; E901-T935 PolarHBondContact OE2-N 3.13Å; T935-H937 PolarHBondContact O-N 3.31Å; T935-L979 HydrophobicContact CG2-CB 4.3Å; T935-L979 HydrophobicContact CG2-CD2 3.94Å; T935-W980 WeakPolarHBondContact CA-O 3.4Å; T935-S981 PolarHBondContact OG1-OG 3.23Å
936	L	87.3	Confident	75.4	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	109.4	173.5	-62.3	173.8	0	0	0	109.1	V897 I899 I906 L921 I934 M938 W980 V982 F994 F1018	V897-L936 HydrophobicContact CG1-CB 4.47Å; V897-L936 HydrophobicContact CG1-CD2 4.48Å; I899-L936 HydrophobicContact CG1-CD2 4.19Å; I906-L936 HydrophobicContact CD1-CD2 4.29Å; L921-L936 HydrophobicContact CD1-CD2 4.3Å; I934-L936 HydrophobicContact CD1-CD2 4.5Å; L936-M938 HydrophobicContact CB-CE 3.82Å; L936-M938 HydrophobicContact CD1-CE 3.87Å; L936-W980 HydrophobicContact CB-CB 4.36Å; L936-W980 PolarHBondContact N-O 3.34Å; L936-W980 PolarHBondContact O-N 2.86Å; L936-V982 HydrophobicContact CD1-CG2 4.08Å; L936-V982 HydrophobicContact CG-CG2 4.22Å; L936-F994 HydrophobicContact CD1-CE2 3.92Å; L936-F994 HydrophobicContact CD1-CZ 4.32Å; L936-F1018 HydrophobicContact CD1-CB 4.32Å; L936-F1018 HydrophobicContact CD1-CD1 4.21Å; L936-F1018 HydrophobicContact CD1-CD2 4.07Å; L936-F1018 HydrophobicContact CD1-CE2 4.45Å; L936-F1018 HydrophobicContact CD1-CG 3.95Å; L936-F1018 HydrophobicContact CD2-CD1 4.31Å
937	H	89.1	Confident	77.2	Confident	45 Å²	45	68.3 Å²	68.3	21%	0.208	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	98	169.8	-176.5	-148.3	0	0	0	109.7	V897 H898 V900 T935 H977 H978 L979	V897-H937 CarbonylContact C-O 3.47Å; V897-H937 VanDerWaalsContact CA-O 3.32Å; V897-H937 WeakPolarHBondContact CA-O 3.48Å; H898-H937 HydrophobicContact CB-CB 4.45Å; H898-H937 PolarHBondContact N-O 2.84Å; H898-H937 PolarHBondContact O-N 3.28Å; V900-H937 HydrophobicContact CG2-CB 3.97Å; T935-H937 PolarHBondContact O-N 3.31Å; H937-H977 AromaticContact CE1-ND1 3.65Å; H937-H977 AromaticContact NE2-CG 3.91Å; H937-H977 AromaticContact NE2-ND1 3.27Å; H937-H977 PolarHBondContact NE2-ND1 3.48Å; H937-H978 CarbonylContact C-O 3.57Å; H937-H978 WeakPolarHBondContact CA-O 3.31Å; H937-L979 HydrophobicContact CB-CD2 3.7Å
938	M	89.3	Confident	79.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.2	178.8	-53.3	172.5	-164.9	0	0	109.7	L894 V897 L936 V946 H977 H978 W980 F994 F1018	L894-M938 HydrophobicContact CD1-CB 4.07Å; L894-M938 HydrophobicContact CD1-CG 4.25Å; L894-M938 HydrophobicContact CD1-SD 4.16Å; L894-M938 HydrophobicContact CD2-CB 4.14Å; V897-M938 HydrophobicContact CG1-CG 3.81Å; V897-M938 HydrophobicContact CG2-CB 4.31Å; V897-M938 HydrophobicContact CG2-CG 4.11Å; L936-M938 HydrophobicContact CB-CE 3.82Å; L936-M938 HydrophobicContact CD1-CE 3.87Å; M938-V946 HydrophobicContact SD-CG1 3.97Å; M938-H977 CarbonylContact O-C 3.56Å; M938-H977 WeakPolarHBondContact O-CA 3.25Å; M938-H978 HydrophobicContact CB-CB 4.33Å; M938-H978 PolarHBondContact N-O 3.36Å; M938-H978 PolarHBondContact O-N 3.08Å; M938-W980 HydrophobicContact CE-CB 4.27Å; M938-W980 HydrophobicContact CE-CG 4.29Å; M938-F994 HydrophobicContact CE-CD1 4.03Å; M938-F994 HydrophobicContact CE-CD2 3.68Å; M938-F994 HydrophobicContact CE-CE1 4.04Å; M938-F994 HydrophobicContact CE-CE2 3.66Å; M938-F994 HydrophobicContact CE-CG 3.85Å; M938-F994 HydrophobicContact CE-CZ 3.85Å; M938-F1018 HydrophobicContact CE-CE2 3.78Å; M938-F1018 HydrophobicContact CE-CZ 4.07Å
939	M	86.9	Confident	81.3	Confident	40 Å²	40	56.5 Å²	56.5	20%	0.197	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.5	-179.7	-66.9	-178.2	44	0	0	110.9	L894 R895 S896 T976 H977	L894-M939 CarbonylContact C-O 3.43Å; R895-M939 PolarHBondContact N-O 2.91Å; S896-M939 PolarHBondContact N-O 3.44Å; S896-M939 PolarHBondContact O-N 3.44Å; M939-T976 WeakPolarHBondContact CA-O 3.47Å; M939-H977 WeakPolarHBondContact CG-ND1 3.46Å
940	S	87.8	Confident	83.1	Confident	10 Å²	10	49.6 Å²	49.6	7%	0.07	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	168.7	176.1	67.7	0	0	0	0	111.5	N942 T976	S940-N942 PolarHBondContact OG-O 3.21Å; S940-T976 PolarHBondContact N-O 3.41Å; S940-T976 WeakPolarHBondContact OG-CA 3.47Å
941	R	80.8	Confident	84.5	Confident	201 Å²	201	46.5 Å²	46.5	76%	0.758	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	-37.3	173.4	-66.1	-173.6	-176.5	-173.9	2.4	113	R895	R895-R941 HydrophobicContact CB-CG 4.34Å
942	N	83.3	Confident	85.3	Confident	103 Å²	103	48.6 Å²	48.6	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	160.3	-177.2	-64.9	-18.2	0	0	0	109.5	S940 V944	S940-N942 PolarHBondContact OG-O 3.21Å; N942-V944 PolarHBondContact O-N 3.43Å
943	S	86.7	Confident	86	Confident	63 Å²	63	49.3 Å²	49.3	44%	0.441	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	122.8	172.5	-173.5	0	0	0	0	110.3	G975 H998	S943-G975 VanDerWaalsContact CA-O 3.26Å; S943-G975 WeakPolarHBondContact CA-O 3.29Å; S943-H998 PolarHBondContact O-ND1 2.89Å
944	V	90.2	Very high	85.7	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.1	178.3	-63.6	0	0	0	0	109.8	P892 N942 V946 K974 G975 H978 V996 S997	P892-V944 HydrophobicContact CB-CG1 3.74Å; N942-V944 PolarHBondContact O-N 3.43Å; V944-V946 HydrophobicContact CG2-CG2 4.14Å; V944-K974 WeakPolarHBondContact O-CA 3.44Å; V944-G975 PolarHBondContact N-O 2.69Å; V944-G975 PolarHBondContact O-N 2.83Å; V944-H978 PolarHBondContact O-CE1 3.07Å; V944-V996 HydrophobicContact CB-CG1 3.89Å; V944-V996 HydrophobicContact CG1-CG1 4.21Å; V944-V996 HydrophobicContact CG2-CG1 3.87Å; V944-S997 WeakPolarHBondContact CA-O 3.41Å
945	W	88.6	Confident	85.4	Confident	64 Å²	64	54.6 Å²	54.6	24%	0.242	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.1	163.5	-63.4	87.5	0	0	0	108.5	T973 K974 V996 S997	W945-T973 CarbonylContact C-O 3.59Å; W945-T973 VanDerWaalsContact CA-O 3.31Å; W945-T973 WeakPolarHBondContact CA-O 3.3Å; W945-K974 HydrophobicContact CD2-CB 3.88Å; W945-K974 HydrophobicContact CD2-CD 4.24Å; W945-K974 HydrophobicContact CD2-CG 3.89Å; W945-K974 HydrophobicContact CE3-CB 3.71Å; W945-K974 HydrophobicContact CE3-CG 4.24Å; W945-K974 HydrophobicContact CG-CG 4.32Å; W945-K974 HydrophobicContact CH2-CB 4.25Å; W945-K974 HydrophobicContact CH2-CD 4.1Å; W945-K974 HydrophobicContact CZ2-CB 4.4Å; W945-K974 HydrophobicContact CZ2-CD 3.64Å; W945-K974 HydrophobicContact CZ2-CG 4.21Å; W945-K974 HydrophobicContact CZ3-CB 3.9Å; W945-V996 CarbonylContact O-C 3.55Å; W945-V996 WeakPolarHBondContact O-CA 3.15Å; W945-S997 PolarHBondContact N-O 3.47Å; W945-S997 PolarHBondContact O-N 3.44Å
946	V	88.4	Confident	84.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.5	172.6	-178.1	0	0	0	0	107.9	M938 V944 S972 T973 H978 F994 R995 V996	M938-V946 HydrophobicContact SD-CG1 3.97Å; V944-V946 HydrophobicContact CG2-CG2 4.14Å; V946-S972 CarbonylContact O-C 3.55Å; V946-S972 WeakPolarHBondContact O-CA 3.22Å; V946-T973 PolarHBondContact N-O 2.9Å; V946-T973 PolarHBondContact O-N 3.43Å; V946-T973 PolarHBondContact O-OG1 3.21Å; V946-H978 HydrophobicContact CG2-CB 4.3Å; V946-H978 WeakPolarHBondContact CG2-ND1 3.41Å; V946-F994 HydrophobicContact CG1-CB 4.24Å; V946-F994 HydrophobicContact CG1-CD1 4.19Å; V946-R995 WeakPolarHBondContact CA-O 3.37Å; V946-V996 HydrophobicContact CG1-CG2 4.36Å; V946-V996 HydrophobicContact CG2-CG1 4.28Å; V946-V996 HydrophobicContact CG2-CG2 4.06Å
947	K	88.1	Confident	84	Confident	41 Å²	41	57 Å²	57	18%	0.178	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	123.7	-175.9	-177.2	176.4	178.6	174.8	0	109.3	C949 S970 F994 R995 V1002	K947-C949 PolarHBondContact O-N 2.87Å; K947-S970 WeakPolarHBondContact CE-OG 3.31Å; K947-F994 CarbonylContact O-C 3.56Å; K947-F994 WeakPolarHBondContact O-CA 3.37Å; K947-R995 PolarHBondContact N-O 2.92Å; K947-R995 PolarHBondContact O-N 3.27Å; K947-V1002 PolarHBondContact NZ-O 3.3Å
948	Q	88.6	Confident	82.6	Confident	49 Å²	49	60.3 Å²	60.3	23%	0.229	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.5	168.6	-169.3	178	-29.4	0	0	108.6	S970 W980 F994	Q948-S970 WeakPolarHBondContact O-CB 3.06Å; Q948-W980 HydrophobicContact CB-CE3 4.48Å; Q948-W980 HydrophobicContact CB-CH2 3.92Å; Q948-W980 HydrophobicContact CB-CZ3 3.81Å; Q948-F994 HydrophobicContact CB-CD1 3.8Å; Q948-F994 HydrophobicContact CB-CE1 3.65Å; Q948-F994 HydrophobicContact CG-CD1 4.21Å; Q948-F994 HydrophobicContact CG-CE1 3.86Å; Q948-F994 HydrophobicContact CG-CZ 4.28Å
949	C	84.1	Confident	81.1	Confident	33 Å²	33	67 Å²	67	22%	0.223	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-19.6	-178.4	-78.2	0	0	0	0	113.3	K947 H993 R995 C1004	K947-C949 PolarHBondContact O-N 2.87Å; C949-H993 WeakPolarHBondContact CB-ND1 3.4Å; C949-H993 PolarHBondContact N-O 2.95Å; C949-R995 VanDerWaalsContact SG-CB 3.6Å; C949-C1004 WeakPolarHBondContact CA-SG 3.48Å; C949-C1004 HydrophobicContact CB-CB 3.55Å; C949-C1004 WeakPolarHBondContact CB-SG 3.35Å; C949-C1004 WeakPolarHBondContact SG-CB 3.21Å; C949-C1004 CovalentContact SG-SG 2.04Å; C949-C1004 PolarHBondContact SG-SG 2.95Å
950	G	84.3	Confident	79.7	Confident	29 Å²	29	69.1 Å²	69.1	30%	0.299	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	171.3	174.1	0	0	0	0	0	113.6	H993	G950-H993 PolarHBondContact N-O 3.05Å; G950-H993 PolarHBondContact O-N 3.5Å
951	A	85.1	Confident	78.2	Confident	44 Å²	44	74.1 Å²	74.1	36%	0.364	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	114.6	168.9	0	0	0	0	0	108.8	T991 Y992	A951-T991 CarbonylContact C-O 3.47Å; A951-T991 WeakPolarHBondContact CA-O 3.48Å; A951-Y992 HydrophobicContact CB-CD1 3.67Å; A951-Y992 HydrophobicContact CB-CE1 3.57Å
952	T	82.4	Confident	76.7	Confident	101 Å²	101	71 Å²	71	62%	0.62	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.5	175.2	-51.7	0	0	0	0	108.3	V990 T991	T952-V990 WeakPolarHBondContact O-CA 3.38Å; T952-T991 PolarHBondContact N-O 2.72Å; T952-T991 PolarHBondContact O-N 2.91Å
953	K	82.5	Confident	74.9	Confident	91 Å²	91	70.7 Å²	70.7	40%	0.396	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.8	176.6	-63.9	169.5	175.4	-178.1	0	109.5	L965 F987	K953-L965 PolarHBondContact NZ-O 3.36Å; K953-F987 HydrophobicContact CB-CD1 4.14Å; K953-F987 HydrophobicContact CB-CE1 3.92Å; K953-F987 HydrophobicContact CB-CZ 4.16Å; K953-F987 HydrophobicContact CD-CE1 4.17Å; K953-F987 HydrophobicContact CD-CE2 4.05Å; K953-F987 HydrophobicContact CD-CZ 3.64Å; K953-F987 HydrophobicContact CG-CE1 4.31Å; K953-F987 HydrophobicContact CG-CE2 4.14Å; K953-F987 HydrophobicContact CG-CZ 4.03Å
954	G	75.7	Confident	72.7	Confident	30 Å²	30	76.4 Å²	76.4	31%	0.309	41%	0.413	S	S	.	.			trans	-93.7	-137.4	173.9	0	0	0	0	0	112.2	D989	G954-D989 VanDerWaalsContact CA-O 3.23Å; G954-D989 WeakPolarHBondContact CA-O 3.19Å; G954-D989 WeakPolarHBondContact CA-OD1 3.19Å; G954-D989 PolarHBondContact N-O 3.27Å
955	R	75.5	Confident	70.3	Confident	184 Å²	184	79.5 Å²	79.5	69%	0.694	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-80.6	122.7	-173.8	-67.9	-176.4	175.8	-165.8	-2.2	112.5	F987 Q988 D989	R955-F987 CarbonylContact O-C 3.59Å; R955-F987 WeakPolarHBondContact O-CA 3.45Å; R955-Q988 HydrophobicContact CB-CB 4.26Å; R955-Q988 HydrophobicContact CB-CG 4.27Å; R955-Q988 PolarHBondContact O-N 3.42Å; R955-D989 PolarHBondContact N-OD1 2.86Å
956	L	74.4	Confident	67.7	Low	63 Å²	63	87.1 Å²	87.1	33%	0.33	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-59.2	143.1	175.2	-165.3	72.6	0	0	0	111.8	H960 S986 F987	L956-H960 WeakPolarHBondContact CD2-O 3.22Å; L956-S986 WeakPolarHBondContact CD1-O 3.44Å; L956-F987 HydrophobicContact CB-CD1 4.22Å; L956-F987 HydrophobicContact CB-CE1 4.19Å; L956-F987 HydrophobicContact CD1-CD1 3.95Å; L956-F987 HydrophobicContact CD1-CE1 3.46Å; L956-F987 VanDerWaalsContact CD1-CE1 3.46Å; L956-F987 HydrophobicContact CD1-CE2 4.37Å; L956-F987 HydrophobicContact CD1-CZ 3.68Å; L956-F987 HydrophobicContact CG-CE1 4.44Å
957	C	73.4	Confident	65.5	Low	5 Å²	5	92.4 Å²	92.4	3%	0.034	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-78	143.3	175.9	-77.4	0	0	0	0	112.1	N959 H960 S986 C1024	C957-N959 PolarHBondContact O-N 3.2Å; C957-H960 PolarHBondContact O-N 2.88Å; C957-H960 VanDerWaalsContact O-N 3.09Å; C957-S986 PolarHBondContact N-O 3.17Å; C957-C1024 WeakPolarHBondContact CA-SG 3.4Å; C957-C1024 HydrophobicContact CB-CB 3.79Å; C957-C1024 WeakPolarHBondContact CB-SG 3.33Å; C957-C1024 WeakPolarHBondContact SG-CB 3.22Å; C957-C1024 CovalentContact SG-SG 2.04Å; C957-C1024 PolarHBondContact SG-SG 3.46Å
958	P	59.5	Low	63.1	Low	113 Å²	113	93.7 Å²	93.7	73%	0.734	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.1	-164.2	-25.7	35.7	0	0	0	117.8
959	N	57.5	Low	60.8	Low	140 Å²	140	99.7 Å²	99.7	75%	0.749	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	5.1	-178.1	-67.9	-38.2	0	0	0	113.5	C957	C957-N959 PolarHBondContact O-N 3.2Å
960	H	57.2	Low	59.3	Low	85 Å²	85	101 Å²	101	39%	0.394	56%	0.56	S	S	.	*			trans	-106.4	129.1	179.6	-72.3	-89.5	0	0	0	110.9	L956 C957	L956-H960 WeakPolarHBondContact CD2-O 3.22Å; C957-H960 PolarHBondContact O-N 2.88Å; C957-H960 VanDerWaalsContact O-N 3.09Å
961	T	55.6	Low	58.3	Low	115 Å²	115	104 Å²	104	71%	0.706	57%	0.572	S	S	*	*			trans	-79.9	150.9	165.5	45	0	0	0	0	110.4	S963	T961-S963 PolarHBondContact O-N 3.16Å
962	E	50.9	Low	58	Low	135 Å²	135	104.2 Å²	104.2	63%	0.631	57%	0.571	S	S	*	*	S	Bend	trans	-77.3	-1.9	-171.5	-163.3	164.2	-158.9	0	0	114.9
963	S	43.9	Very low	58	Low	98 Å²	98	101.6 Å²	101.6	69%	0.685	55%	0.554	S	S	*	*			trans	-60.4	148.8	167.9	-56	0	0	0	0	111.6	T961	T961-S963 PolarHBondContact O-N 3.16Å
964	E	41.3	Very low	58.2	Low	183 Å²	183	103.6 Å²	103.6	86%	0.855	56%	0.563	S	S	*	*	S	Bend	trans	61.5	71.2	-170.9	-58.3	-174.2	-177.1	0	0	114.1
965	L	39.5	Very low	58.8	Low	66 Å²	66	103 Å²	103	35%	0.346	56%	0.557	S	S	.	*				-172.4	89.5	129.8	-101.3	154.9	0	0	0	113.7	K953 P983	K953-L965 PolarHBondContact NZ-O 3.36Å; L965-P983 HydrophobicContact CD1-CB 3.56Å; L965-P983 HydrophobicContact CD1-CG 3.3Å; L965-P983 HydrophobicContact CD2-CG 3.53Å; L965-P983 HydrophobicContact CG-CG 4Å
966	Y	34.4	Very low	59.3	Low	225 Å²	225	97 Å²	97	88%	0.882	54%	0.541	S	S	*	.			trans	-86.2	143.5	162.8	-105.7	-87.8	0	0	0	111.1	G968	Y966-G968 PolarHBondContact O-N 2.89Å; Y966-G968 VanDerWaalsContact O-N 3.08Å
967	S	41.9	Very low	60	Low	111 Å²	111	99 Å²	99	78%	0.776	55%	0.548	S	S	*	.			trans	-73.6	95.9	177.2	47.6	0	0	0	0	111
968	G	37.9	Very low	60.7	Low	68 Å²	68	98.9 Å²	98.9	70%	0.701	55%	0.548	S	S	*	.			trans	-57.3	148.3	172.3	0	0	0	0	0	112.6	Y966	Y966-G968 PolarHBondContact O-N 2.89Å; Y966-G968 VanDerWaalsContact O-N 3.08Å
969	Q	40.8	Very low	62.1	Low	174 Å²	174	98.8 Å²	98.8	81%	0.813	54%	0.54	S	S	*	.			trans	-48.1	139.4	-177.3	-69.6	169.1	-32.5	0	0	113	T971	Q969-T971 PolarHBondContact O-N 3.15Å
970	S	51.8	Low	63.5	Low	62 Å²	62	93 Å²	93	43%	0.434	51%	0.508	S	S	.	.			trans	-65	93.5	-171.2	62.2	0	0	0	0	113.7	K947 Q948 S972	K947-S970 WeakPolarHBondContact CE-OG 3.31Å; Q948-S970 WeakPolarHBondContact O-CB 3.06Å; S970-S972 PolarHBondContact O-N 3.12Å; S970-S972 VanDerWaalsContact O-N 3.08Å
971	T	63.9	Low	64.9	Low	90 Å²	90	92.1 Å²	92.1	55%	0.552	51%	0.511	S	S	*	.			trans	-76.1	86.7	179.3	40.3	0	0	0	0	112.3	Q969 T973 W980	Q969-T971 PolarHBondContact O-N 3.15Å; T971-T973 PolarHBondContact O-N 3.3Å; T971-T973 VanDerWaalsContact O-N 3.14Å; T971-W980 WeakPolarHBondContact O-CH2 3.24Å; T971-W980 WeakPolarHBondContact O-CZ2 3.32Å
972	S	77.3	Confident	66.3	Low	49 Å²	49	86.7 Å²	86.7	34%	0.343	48%	0.478	S	S	.	.			trans	-62.2	116.6	176.7	60.3	0	0	0	0	111.9	V946 S970	V946-S972 CarbonylContact O-C 3.55Å; V946-S972 WeakPolarHBondContact O-CA 3.22Å; S970-S972 PolarHBondContact O-N 3.12Å; S970-S972 VanDerWaalsContact O-N 3.08Å
973	T	83.8	Confident	67.8	Low	46 Å²	46	81.8 Å²	81.8	28%	0.282	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.1	177.9	52.2	0	0	0	0	110.6	W945 V946 T971 H978 W980	W945-T973 CarbonylContact C-O 3.59Å; W945-T973 VanDerWaalsContact CA-O 3.31Å; W945-T973 WeakPolarHBondContact CA-O 3.3Å; V946-T973 PolarHBondContact N-O 2.9Å; V946-T973 PolarHBondContact O-N 3.43Å; V946-T973 PolarHBondContact O-OG1 3.21Å; T971-T973 PolarHBondContact O-N 3.3Å; T971-T973 VanDerWaalsContact O-N 3.14Å; T973-H978 PolarHBondContact O-CE1 2.96Å; T973-H978 PolarHBondContact O-ND1 3.29Å; T973-H978 PolarHBondContact OG1-ND1 3.29Å; T973-W980 HydrophobicContact CG2-CZ2 4.14Å; T973-W980 PolarHBondContact OG1-NE1 3.03Å
974	K	87.1	Confident	69.2	Low	133 Å²	133	77.3 Å²	77.3	58%	0.578	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.9	178.4	-166.7	-170	-171.5	174.8	0	111.3	V944 W945	V944-K974 WeakPolarHBondContact O-CA 3.44Å; W945-K974 HydrophobicContact CD2-CB 3.88Å; W945-K974 HydrophobicContact CD2-CD 4.24Å; W945-K974 HydrophobicContact CD2-CG 3.89Å; W945-K974 HydrophobicContact CE3-CB 3.71Å; W945-K974 HydrophobicContact CE3-CG 4.24Å; W945-K974 HydrophobicContact CG-CG 4.32Å; W945-K974 HydrophobicContact CH2-CB 4.25Å; W945-K974 HydrophobicContact CH2-CD 4.1Å; W945-K974 HydrophobicContact CZ2-CB 4.4Å; W945-K974 HydrophobicContact CZ2-CD 3.64Å; W945-K974 HydrophobicContact CZ2-CG 4.21Å; W945-K974 HydrophobicContact CZ3-CB 3.9Å
975	G	86.7	Confident	70.1	Confident	18 Å²	18	70.4 Å²	70.4	19%	0.186	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-162.8	179.9	0	0	0	0	0	113.7	S943 V944 H978	S943-G975 VanDerWaalsContact CA-O 3.26Å; S943-G975 WeakPolarHBondContact CA-O 3.29Å; V944-G975 PolarHBondContact N-O 2.69Å; V944-G975 PolarHBondContact O-N 2.83Å; G975-H978 PolarHBondContact N-CE1 3.34Å; G975-H978 VanDerWaalsContact N-CE1 3.34Å; G975-H978 PolarHBondContact O-NE2 3.17Å
976	T	86.3	Confident	71.4	Confident	57 Å²	57	68.3 Å²	68.3	35%	0.35	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-5.6	162.8	50.2	0	0	0	0	112.6	M939 S940	M939-T976 WeakPolarHBondContact CA-O 3.47Å; S940-T976 PolarHBondContact N-O 3.41Å; S940-T976 WeakPolarHBondContact OG-CA 3.47Å
977	H	88.6	Confident	73.1	Confident	105 Å²	105	58.3 Å²	58.3	49%	0.486	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.3	175.3	-64.4	-98.5	0	0	0	107.3	H937 M938 M939	H937-H977 AromaticContact CE1-ND1 3.65Å; H937-H977 AromaticContact NE2-CG 3.91Å; H937-H977 AromaticContact NE2-ND1 3.27Å; H937-H977 PolarHBondContact NE2-ND1 3.48Å; M938-H977 CarbonylContact O-C 3.56Å; M938-H977 WeakPolarHBondContact O-CA 3.25Å; M939-H977 WeakPolarHBondContact CG-ND1 3.46Å
978	H	88.8	Confident	74.7	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.019	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.5	-178.8	-53.8	-104	0	0	0	107.7	H937 M938 V944 V946 T973 G975	H937-H978 CarbonylContact C-O 3.57Å; H937-H978 WeakPolarHBondContact CA-O 3.31Å; M938-H978 HydrophobicContact CB-CB 4.33Å; M938-H978 PolarHBondContact N-O 3.36Å; M938-H978 PolarHBondContact O-N 3.08Å; V944-H978 PolarHBondContact O-CE1 3.07Å; V946-H978 HydrophobicContact CG2-CB 4.3Å; V946-H978 WeakPolarHBondContact CG2-ND1 3.41Å; T973-H978 PolarHBondContact O-CE1 2.96Å; T973-H978 PolarHBondContact O-ND1 3.29Å; T973-H978 PolarHBondContact OG1-ND1 3.29Å; G975-H978 PolarHBondContact N-CE1 3.34Å; G975-H978 VanDerWaalsContact N-CE1 3.34Å; G975-H978 PolarHBondContact O-NE2 3.17Å
979	L	89.8	Confident	76.8	Confident	111 Å²	111	56.3 Å²	56.3	58%	0.581	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.1	-179.2	-74.7	162.9	0	0	0	107.9	V900 T935 H937	V900-L979 HydrophobicContact CG2-CD2 4.07Å; T935-L979 HydrophobicContact CG2-CB 4.3Å; T935-L979 HydrophobicContact CG2-CD2 3.94Å; H937-L979 HydrophobicContact CB-CD2 3.7Å
980	W	87.1	Confident	79	Confident	18 Å²	18	48.2 Å²	48.2	7%	0.068	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	98.1	-174.3	-77.6	100	0	0	0	110.2	T935 L936 M938 Q948 T971 T973 V982 F994	T935-W980 WeakPolarHBondContact CA-O 3.4Å; L936-W980 HydrophobicContact CB-CB 4.36Å; L936-W980 PolarHBondContact N-O 3.34Å; L936-W980 PolarHBondContact O-N 2.86Å; M938-W980 HydrophobicContact CE-CB 4.27Å; M938-W980 HydrophobicContact CE-CG 4.29Å; Q948-W980 HydrophobicContact CB-CE3 4.48Å; Q948-W980 HydrophobicContact CB-CH2 3.92Å; Q948-W980 HydrophobicContact CB-CZ3 3.81Å; T971-W980 WeakPolarHBondContact O-CH2 3.24Å; T971-W980 WeakPolarHBondContact O-CZ2 3.32Å; T973-W980 HydrophobicContact CG2-CZ2 4.14Å; T973-W980 PolarHBondContact OG1-NE1 3.03Å; W980-V982 PolarHBondContact O-N 2.85Å; W980-F994 HydrophobicContact CB-CE1 4.09Å; W980-F994 HydrophobicContact CB-CZ 4.13Å; W980-F994 HydrophobicContact CD2-CD1 4.2Å; W980-F994 AromaticContact CD2-CE1 3.48Å; W980-F994 HydrophobicContact CD2-CE1 3.48Å; W980-F994 VanDerWaalsContact CD2-CE1 3.48Å; W980-F994 HydrophobicContact CD2-CZ 4.35Å; W980-F994 AromaticContact CE2-CE1 3.89Å; W980-F994 AromaticContact CE3-CE1 3.68Å; W980-F994 HydrophobicContact CE3-CE1 3.68Å; W980-F994 HydrophobicContact CE3-CZ 4.47Å; W980-F994 HydrophobicContact CG-CD1 4.42Å; W980-F994 AromaticContact CG-CE1 3.68Å; W980-F994 HydrophobicContact CG-CE1 3.68Å; W980-F994 HydrophobicContact CG-CZ 4.23Å; W980-F994 HydrophobicContact CZ2-CD1 4.48Å; W980-F994 HydrophobicContact CZ2-CE1 4.42Å; W980-F994 HydrophobicContact CZ3-CE1 4.22Å
981	S	86.9	Confident	80.6	Confident	66 Å²	66	47 Å²	47	46%	0.462	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116.3	172.2	-55.8	0	0	0	0	109.6	I934 T935	I934-S981 CarbonylContact O-C 3.54Å; I934-S981 WeakPolarHBondContact O-CA 3.44Å; T935-S981 PolarHBondContact OG1-OG 3.23Å
982	V	84.4	Confident	81.8	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	132	-177.5	-67	0	0	0	0	110.4	Q933 I934 L936 W980 Y992 F994 I1020	Q933-V982 CarbonylContact C-O 3.58Å; Q933-V982 VanDerWaalsContact CA-O 3.32Å; Q933-V982 WeakPolarHBondContact CA-O 3.45Å; I934-V982 HydrophobicContact CG1-CG2 3.85Å; I934-V982 PolarHBondContact N-O 3.44Å; I934-V982 WeakPolarHBondContact O-CG2 3.45Å; I934-V982 PolarHBondContact O-N 2.66Å; L936-V982 HydrophobicContact CD1-CG2 4.08Å; L936-V982 HydrophobicContact CG-CG2 4.22Å; W980-V982 PolarHBondContact O-N 2.85Å; V982-Y992 HydrophobicContact CB-CD1 4.19Å; V982-Y992 HydrophobicContact CB-CD2 4.04Å; V982-Y992 HydrophobicContact CB-CE1 3.96Å; V982-Y992 HydrophobicContact CB-CE2 3.78Å; V982-Y992 HydrophobicContact CB-CG 4.24Å; V982-Y992 HydrophobicContact CG1-CD1 3.88Å; V982-Y992 HydrophobicContact CG1-CD2 4.38Å; V982-Y992 HydrophobicContact CG1-CE1 4.01Å; V982-Y992 HydrophobicContact CG1-CE2 4.48Å; V982-Y992 HydrophobicContact CG1-CG 4.08Å; V982-Y992 HydrophobicContact CG2-CD2 4.12Å; V982-Y992 HydrophobicContact CG2-CE2 4.09Å; V982-F994 HydrophobicContact CG1-CZ 3.96Å; V982-I1020 HydrophobicContact CG2-CD1 3.87Å
983	P	81.2	Confident	82.4	Confident	32 Å²	32	42.7 Å²	42.7	21%	0.208	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	150.4	-178.3	26.2	-30.9	0	0	0	113.2	P932 L965 Y992	P932-P983 WeakPolarHBondContact O-CA 3.49Å; L965-P983 HydrophobicContact CD1-CB 3.56Å; L965-P983 HydrophobicContact CD1-CG 3.3Å; L965-P983 HydrophobicContact CD2-CG 3.53Å; L965-P983 HydrophobicContact CG-CG 4Å; P983-Y992 VanDerWaalsContact CD-OH 3.26Å; P983-Y992 WeakPolarHBondContact CD-OH 3.41Å; P983-Y992 WeakPolarHBondContact CG-OH 3.39Å; P983-Y992 PolarHBondContact O-OH 3.49Å
984	V	74.1	Confident	82.6	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	22%	0.219	C	C	.	.			trans	-139.1	-27.4	-171.1	-169.4	0	0	0	0	114	L923 P932 I934 S986 I1020	L923-V984 HydrophobicContact CD1-CG1 3.75Å; P932-V984 PolarHBondContact O-N 2.87Å; I934-V984 HydrophobicContact CB-CG2 4.41Å; I934-V984 HydrophobicContact CD1-CG2 4.23Å; I934-V984 HydrophobicContact CG1-CG2 3.84Å; I934-V984 HydrophobicContact CG2-CG2 4.03Å; V984-S986 VanDerWaalsContact C-N 3.33Å; V984-S986 PolarHBondContact O-N 3.32Å; V984-I1020 HydrophobicContact CG1-CB 4.38Å; V984-I1020 HydrophobicContact CG1-CG2 3.51Å; V984-I1020 HydrophobicContact CG2-CD1 3.96Å; V984-I1020 HydrophobicContact CG2-CG2 4.11Å
985	S	60	Low	82.7	Confident	39 Å²	39	34.9 Å²	34.9	27%	0.273	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.8	-166.5	46.7	0	0	0	0	116.3	P932	P932-S985 PolarHBondContact O-N 2.88Å
986	S	67.4	Low	82.8	Confident	21 Å²	21	34 Å²	34	15%	0.147	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-15.4	-166.8	-47	0	0	0	0	114.6	L956 C957 V984	L956-S986 WeakPolarHBondContact CD1-O 3.44Å; C957-S986 PolarHBondContact N-O 3.17Å; V984-S986 VanDerWaalsContact C-N 3.33Å; V984-S986 PolarHBondContact O-N 3.32Å
987	F	70.6	Confident	82.8	Confident	15 Å²	15	31.5 Å²	31.5	7%	0.066	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-131.9	147.1	-173.1	-57.1	-91.9	0	0	0	111.8	K953 R955 L956 D989 V990 S1022	K953-F987 HydrophobicContact CB-CD1 4.14Å; K953-F987 HydrophobicContact CB-CE1 3.92Å; K953-F987 HydrophobicContact CB-CZ 4.16Å; K953-F987 HydrophobicContact CD-CE1 4.17Å; K953-F987 HydrophobicContact CD-CE2 4.05Å; K953-F987 HydrophobicContact CD-CZ 3.64Å; K953-F987 HydrophobicContact CG-CE1 4.31Å; K953-F987 HydrophobicContact CG-CE2 4.14Å; K953-F987 HydrophobicContact CG-CZ 4.03Å; R955-F987 CarbonylContact O-C 3.59Å; R955-F987 WeakPolarHBondContact O-CA 3.45Å; L956-F987 HydrophobicContact CB-CD1 4.22Å; L956-F987 HydrophobicContact CB-CE1 4.19Å; L956-F987 HydrophobicContact CD1-CD1 3.95Å; L956-F987 HydrophobicContact CD1-CE1 3.46Å; L956-F987 VanDerWaalsContact CD1-CE1 3.46Å; L956-F987 HydrophobicContact CD1-CE2 4.37Å; L956-F987 HydrophobicContact CD1-CZ 3.68Å; L956-F987 HydrophobicContact CG-CE1 4.44Å; F987-D989 PolarHBondContact O-N 2.9Å; F987-V990 HydrophobicContact CB-CG2 3.66Å; F987-V990 HydrophobicContact CD2-CG2 4.03Å; F987-V990 HydrophobicContact CG-CG2 4.11Å; F987-S1022 WeakPolarHBondContact O-CB 3.31Å; F987-S1022 PolarHBondContact O-OG 2.84Å
988	Q	75.4	Confident	82.5	Confident	78 Å²	78	30.9 Å²	30.9	36%	0.364	17%	0.167	S	C	.	.	S	Bend	trans	-60.1	-35.1	173.1	-68.2	177.1	11.9	0	0	111.8	R955 Q1021 S1022 C1024	R955-Q988 HydrophobicContact CB-CB 4.26Å; R955-Q988 HydrophobicContact CB-CG 4.27Å; R955-Q988 PolarHBondContact O-N 3.42Å; Q988-Q1021 CarbonylContact O-C 3.55Å; Q988-Q1021 WeakPolarHBondContact O-CA 3.45Å; Q988-S1022 PolarHBondContact O-N 2.92Å; Q988-C1024 WeakPolarHBondContact CG-SG 3.32Å
989	D	81.6	Confident	81.9	Confident	59 Å²	59	33.2 Å²	33.2	32%	0.316	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	134.9	-176.3	52.7	-36.8	0	0	0	110.8	G954 R955 F987 L1019 I1020	G954-D989 VanDerWaalsContact CA-O 3.23Å; G954-D989 WeakPolarHBondContact CA-O 3.19Å; G954-D989 WeakPolarHBondContact CA-OD1 3.19Å; G954-D989 PolarHBondContact N-O 3.27Å; R955-D989 PolarHBondContact N-OD1 2.86Å; F987-D989 PolarHBondContact O-N 2.9Å; D989-L1019 HydrophobicContact CB-CD1 4.15Å; D989-I1020 WeakPolarHBondContact CA-O 3.37Å
990	V	86.1	Confident	80.8	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.024	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.2	172.3	-169.9	0	0	0	0	109.5	T952 F987 Y992 I1020	T952-V990 WeakPolarHBondContact O-CA 3.38Å; F987-V990 HydrophobicContact CB-CG2 3.66Å; F987-V990 HydrophobicContact CD2-CG2 4.03Å; F987-V990 HydrophobicContact CG-CG2 4.11Å; V990-Y992 HydrophobicContact CB-CE2 3.96Å; V990-Y992 HydrophobicContact CG1-CD2 3.99Å; V990-Y992 HydrophobicContact CG1-CE1 4.43Å; V990-Y992 HydrophobicContact CG1-CE2 3.42Å; V990-Y992 VanDerWaalsContact CG1-CE2 3.42Å; V990-I1020 PolarHBondContact N-O 3.46Å; V990-I1020 PolarHBondContact O-N 2.85Å
991	T	86.8	Confident	79.5	Confident	38 Å²	38	37 Å²	37	23%	0.233	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.7	175.3	-55.5	0	0	0	0	110.7	A951 T952 H1017 F1018 L1019	A951-T991 CarbonylContact C-O 3.47Å; A951-T991 WeakPolarHBondContact CA-O 3.48Å; T952-T991 PolarHBondContact N-O 2.72Å; T952-T991 PolarHBondContact O-N 2.91Å; T991-H1017 HydrophobicContact CG2-CB 4.15Å; T991-F1018 WeakPolarHBondContact CA-O 3.44Å; T991-L1019 WeakPolarHBondContact OG1-CD1 3.3Å
992	Y	88.4	Confident	78.3	Confident	14 Å²	14	34.7 Å²	34.7	6%	0.055	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.2	173.6	-70.7	-83.7	0	0	0	111.2	A951 V982 P983 V990 H1017 F1018 I1020	A951-Y992 HydrophobicContact CB-CD1 3.67Å; A951-Y992 HydrophobicContact CB-CE1 3.57Å; V982-Y992 HydrophobicContact CB-CD1 4.19Å; V982-Y992 HydrophobicContact CB-CD2 4.04Å; V982-Y992 HydrophobicContact CB-CE1 3.96Å; V982-Y992 HydrophobicContact CB-CE2 3.78Å; V982-Y992 HydrophobicContact CB-CG 4.24Å; V982-Y992 HydrophobicContact CG1-CD1 3.88Å; V982-Y992 HydrophobicContact CG1-CD2 4.38Å; V982-Y992 HydrophobicContact CG1-CE1 4.01Å; V982-Y992 HydrophobicContact CG1-CE2 4.48Å; V982-Y992 HydrophobicContact CG1-CG 4.08Å; V982-Y992 HydrophobicContact CG2-CD2 4.12Å; V982-Y992 HydrophobicContact CG2-CE2 4.09Å; P983-Y992 VanDerWaalsContact CD-OH 3.26Å; P983-Y992 WeakPolarHBondContact CD-OH 3.41Å; P983-Y992 WeakPolarHBondContact CG-OH 3.39Å; P983-Y992 PolarHBondContact O-OH 3.49Å; V990-Y992 HydrophobicContact CB-CE2 3.96Å; V990-Y992 HydrophobicContact CG1-CD2 3.99Å; V990-Y992 HydrophobicContact CG1-CE1 4.43Å; V990-Y992 HydrophobicContact CG1-CE2 3.42Å; V990-Y992 VanDerWaalsContact CG1-CE2 3.42Å; Y992-H1017 CarbonylContact O-C 3.56Å; Y992-H1017 WeakPolarHBondContact O-CA 3.46Å; Y992-F1018 PolarHBondContact N-O 3.43Å; Y992-F1018 PolarHBondContact O-N 3.01Å; Y992-I1020 HydrophobicContact CD2-CD1 3.71Å; Y992-I1020 HydrophobicContact CE2-CD1 3.87Å
993	H	89.3	Confident	77.5	Confident	34 Å²	34	38 Å²	38	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.4	177.6	170.4	-144.4	0	0	0	110.5	C949 G950 D1015 Y1016 H1017	C949-H993 WeakPolarHBondContact CB-ND1 3.4Å; C949-H993 PolarHBondContact N-O 2.95Å; G950-H993 PolarHBondContact N-O 3.05Å; G950-H993 PolarHBondContact O-N 3.5Å; H993-D1015 IonicContact CD2-OD1 3.25Å; H993-D1015 IonicContact CE1-OD1 2.72Å; H993-D1015 IonicContact NE2-OD1 3.41Å; H993-D1015 PolarHBondContact NE2-OD1 3.23Å; H993-D1015 IonicContact NE2-OD2 3.44Å; H993-Y1016 WeakPolarHBondContact CA-O 3.37Å; H993-H1017 AromaticContact CD2-CE1 3.31Å; H993-H1017 PolarHBondContact CD2-CE1 3.49Å; H993-H1017 AromaticContact CD2-ND1 3.76Å; H993-H1017 AromaticContact CD2-NE2 3.85Å; H993-H1017 AromaticContact CG-CE1 3.55Å; H993-H1017 AromaticContact CG-ND1 3.82Å; H993-H1017 AromaticContact NE2-CE1 3.9Å
994	F	89.3	Confident	77.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.3	173.9	-60.8	-91.1	0	0	0	110.7	L936 M938 V946 K947 Q948 W980 V982 Y1016 F1018	L936-F994 HydrophobicContact CD1-CE2 3.92Å; L936-F994 HydrophobicContact CD1-CZ 4.32Å; M938-F994 HydrophobicContact CE-CD1 4.03Å; M938-F994 HydrophobicContact CE-CD2 3.68Å; M938-F994 HydrophobicContact CE-CE1 4.04Å; M938-F994 HydrophobicContact CE-CE2 3.66Å; M938-F994 HydrophobicContact CE-CG 3.85Å; M938-F994 HydrophobicContact CE-CZ 3.85Å; V946-F994 HydrophobicContact CG1-CB 4.24Å; V946-F994 HydrophobicContact CG1-CD1 4.19Å; K947-F994 CarbonylContact O-C 3.56Å; K947-F994 WeakPolarHBondContact O-CA 3.37Å; Q948-F994 HydrophobicContact CB-CD1 3.8Å; Q948-F994 HydrophobicContact CB-CE1 3.65Å; Q948-F994 HydrophobicContact CG-CD1 4.21Å; Q948-F994 HydrophobicContact CG-CE1 3.86Å; Q948-F994 HydrophobicContact CG-CZ 4.28Å; W980-F994 HydrophobicContact CB-CE1 4.09Å; W980-F994 HydrophobicContact CB-CZ 4.13Å; W980-F994 HydrophobicContact CD2-CD1 4.2Å; W980-F994 AromaticContact CD2-CE1 3.48Å; W980-F994 HydrophobicContact CD2-CE1 3.48Å; W980-F994 VanDerWaalsContact CD2-CE1 3.48Å; W980-F994 HydrophobicContact CD2-CZ 4.35Å; W980-F994 AromaticContact CE2-CE1 3.89Å; W980-F994 AromaticContact CE3-CE1 3.68Å; W980-F994 HydrophobicContact CE3-CE1 3.68Å; W980-F994 HydrophobicContact CE3-CZ 4.47Å; W980-F994 HydrophobicContact CG-CD1 4.42Å; W980-F994 AromaticContact CG-CE1 3.68Å; W980-F994 HydrophobicContact CG-CE1 3.68Å; W980-F994 HydrophobicContact CG-CZ 4.23Å; W980-F994 HydrophobicContact CZ2-CD1 4.48Å; W980-F994 HydrophobicContact CZ2-CE1 4.42Å; W980-F994 HydrophobicContact CZ3-CE1 4.22Å; V982-F994 HydrophobicContact CG1-CZ 3.96Å; F994-Y1016 PolarHBondContact N-O 3.49Å; F994-Y1016 PolarHBondContact O-N 3.33Å; F994-F1018 AromaticContact CD2-CD2 3.64Å; F994-F1018 HydrophobicContact CD2-CD2 3.64Å; F994-F1018 AromaticContact CD2-CE2 3.7Å; F994-F1018 HydrophobicContact CD2-CE2 3.7Å; F994-F1018 AromaticContact CE2-CD2 3.88Å; F994-F1018 HydrophobicContact CE2-CD2 3.88Å; F994-F1018 HydrophobicContact CE2-CE2 4.2Å
995	R	88.7	Confident	76.7	Confident	15 Å²	15	41.1 Å²	41.1	6%	0.057	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133	171.2	-173.5	161.9	-76.3	-175.3	-13.7	109.8	V946 K947 C949 V1002 S1003 A1005 H1013 D1015	V946-R995 WeakPolarHBondContact CA-O 3.37Å; K947-R995 PolarHBondContact N-O 2.92Å; K947-R995 PolarHBondContact O-N 3.27Å; C949-R995 VanDerWaalsContact SG-CB 3.6Å; R995-V1002 VanDerWaalsContact CD-CG1 3.49Å; R995-V1002 HydrophobicContact CG-CG1 4.08Å; R995-S1003 PolarHBondContact NH1-O 2.98Å; R995-A1005 PolarHBondContact NH1-O 3.01Å; R995-H1013 HydrophobicContact CG-CB 3.86Å; R995-H1013 PolarHBondContact NE-CD2 2.95Å; R995-H1013 PolarHBondContact NH2-NE2 3.45Å; R995-D1015 WeakPolarHBondContact CA-OD1 3.4Å; R995-D1015 VanDerWaalsContact CB-OD1 3.23Å; R995-D1015 WeakPolarHBondContact CB-OD1 3.26Å; R995-D1015 VanDerWaalsContact CG-OD1 3.32Å; R995-D1015 WeakPolarHBondContact CG-OD1 3.4Å; R995-D1015 IonicContact CZ-OD1 3.72Å; R995-D1015 IonicContact CZ-OD2 3.45Å; R995-D1015 IonicContact NE-OD1 2.86Å; R995-D1015 PolarHBondContact NE-OD1 3.44Å; R995-D1015 IonicContact NE-OD2 3.27Å; R995-D1015 PolarHBondContact NE-OD2 2.94Å; R995-D1015 IonicContact NH2-OD1 3.7Å; R995-D1015 IonicContact NH2-OD2 2.75Å; R995-D1015 PolarHBondContact NH2-OD2 2.91Å
996	V	87.7	Confident	76.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.9	179	-174.1	0	0	0	0	109.1	P892 L894 V944 W945 V946 H1013 S1014 Y1016	P892-V996 HydrophobicContact CB-CG1 4.29Å; P892-V996 HydrophobicContact CG-CG1 4.35Å; P892-V996 WeakPolarHBondContact CG-O 3.46Å; P892-V996 WeakPolarHBondContact O-CG1 3.5Å; L894-V996 HydrophobicContact CD1-CG2 4.33Å; L894-V996 HydrophobicContact CD2-CG2 4.33Å; L894-V996 HydrophobicContact CG-CG2 4.22Å; V944-V996 HydrophobicContact CB-CG1 3.89Å; V944-V996 HydrophobicContact CG1-CG1 4.21Å; V944-V996 HydrophobicContact CG2-CG1 3.87Å; W945-V996 CarbonylContact O-C 3.55Å; W945-V996 WeakPolarHBondContact O-CA 3.15Å; V946-V996 HydrophobicContact CG1-CG2 4.36Å; V946-V996 HydrophobicContact CG2-CG1 4.28Å; V946-V996 HydrophobicContact CG2-CG2 4.06Å; V996-H1013 CarbonylContact O-C 3.6Å; V996-H1013 WeakPolarHBondContact O-CA 3.46Å; V996-H1013 VanDerWaalsContact O-CB 3.29Å; V996-H1013 WeakPolarHBondContact O-CB 3.5Å; V996-S1014 PolarHBondContact N-O 2.92Å; V996-S1014 PolarHBondContact O-N 3.23Å; V996-Y1016 HydrophobicContact CB-CD2 4.27Å; V996-Y1016 HydrophobicContact CB-CE2 4.05Å; V996-Y1016 HydrophobicContact CG2-CD2 3.48Å; V996-Y1016 VanDerWaalsContact CG2-CD2 3.48Å; V996-Y1016 HydrophobicContact CG2-CE2 3.6Å
997	S	87.4	Confident	75.8	Confident	4 Å²	4	53.4 Å²	53.4	3%	0.028	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	162.3	-173.2	58.6	0	0	0	0	112.9	V944 W945 S999 V1002	V944-S997 WeakPolarHBondContact CA-O 3.41Å; W945-S997 PolarHBondContact N-O 3.47Å; W945-S997 PolarHBondContact O-N 3.44Å; S997-S999 PolarHBondContact OG-O 2.94Å; S997-V1002 VanDerWaalsContact CB-CG2 3.49Å
998	H	82.3	Confident	74.8	Confident	91 Å²	91	58.5 Å²	58.5	42%	0.421	32%	0.324	S	S	.	.	S	Bend	trans	-90.4	-22.2	169.8	-81.2	-49.7	0	0	0	113.8	S943	S943-H998 PolarHBondContact O-ND1 2.89Å
999	S	76.6	Confident	73.5	Confident	53 Å²	53	65.2 Å²	65.2	37%	0.371	35%	0.352	S	S	.	.	S	Bend	trans	-98.4	153.2	170.9	-171.3	0	0	0	0	111.8	S997 E1001	S997-S999 PolarHBondContact OG-O 2.94Å; S999-E1001 PolarHBondContact OG-N 3.34Å; S999-E1001 PolarHBondContact OG-OE2 2.97Å
1000	G	66	Low	72.3	Confident	31 Å²	31	68.2 Å²	68.2	32%	0.32	37%	0.366	S	S	.	.	S	Bend	trans	-82.3	-14.8	174.5	0	0	0	0	0	113.9	V1002	G1000-V1002 VanDerWaalsContact C-N 3.25Å; G1000-V1002 PolarHBondContact O-N 3.36Å
1001	E	59.3	Low	70.8	Confident	179 Å²	179	70.3 Å²	70.3	84%	0.836	38%	0.38	S	S	*	.			trans	-79.7	-2.1	-174.8	-66.1	167	134.9	0	0	113.8	S999 S1003	S999-E1001 PolarHBondContact OG-N 3.34Å; S999-E1001 PolarHBondContact OG-OE2 2.97Å; E1001-S1003 PolarHBondContact O-N 3.34Å
1002	V	62.2	Low	70.1	Confident	16 Å²	16	73.3 Å²	73.3	10%	0.097	39%	0.394	C	S	.	.			trans	-66.3	119.4	-170.7	175.7	0	0	0	0	111.9	K947 R995 S997 G1000 H1013	K947-V1002 PolarHBondContact NZ-O 3.3Å; R995-V1002 VanDerWaalsContact CD-CG1 3.49Å; R995-V1002 HydrophobicContact CG-CG1 4.08Å; S997-V1002 VanDerWaalsContact CB-CG2 3.49Å; G1000-V1002 VanDerWaalsContact C-N 3.25Å; G1000-V1002 PolarHBondContact O-N 3.36Å; V1002-H1013 HydrophobicContact CG1-CB 4.39Å
1003	S	66.8	Low	69.7	Low	70 Å²	70	73.7 Å²	73.7	49%	0.49	40%	0.396	S	S	.	.			trans	-74.8	157.6	173.2	-168.7	0	0	0	0	111.6	R995 E1001 A1005	R995-S1003 PolarHBondContact NH1-O 2.98Å; E1001-S1003 PolarHBondContact O-N 3.34Å; S1003-A1005 VanDerWaalsContact C-N 3.33Å; S1003-A1005 WeakPolarHBondContact OG-CB 3.36Å; S1003-A1005 PolarHBondContact OG-N 3.43Å; S1003-A1005 VanDerWaalsContact OG-N 3.14Å
1004	C	74.1	Confident	69.5	Low	41 Å²	41	72.3 Å²	72.3	28%	0.277	39%	0.391	S	S	.	.	S	Bend	trans	-87.9	-6.8	167.7	-63.1	0	0	0	0	112.2	C949	C949-C1004 WeakPolarHBondContact CA-SG 3.48Å; C949-C1004 HydrophobicContact CB-CB 3.55Å; C949-C1004 WeakPolarHBondContact CB-SG 3.35Å; C949-C1004 WeakPolarHBondContact SG-CB 3.21Å; C949-C1004 CovalentContact SG-SG 2.04Å; C949-C1004 PolarHBondContact SG-SG 2.95Å
1005	A	64.6	Low	69.3	Low	61 Å²	61	73.3 Å²	73.3	50%	0.504	40%	0.396	S	S	.	.	S	Bend	trans	-62.9	156.8	166	0	0	0	0	0	111.1	R995 S1003	R995-A1005 PolarHBondContact NH1-O 3.01Å; S1003-A1005 VanDerWaalsContact C-N 3.33Å; S1003-A1005 WeakPolarHBondContact OG-CB 3.36Å; S1003-A1005 PolarHBondContact OG-N 3.43Å; S1003-A1005 VanDerWaalsContact OG-N 3.14Å
1006	T	57.9	Low	69.2	Low	129 Å²	129	73 Å²	73	79%	0.791	40%	0.395	S	S	*	.	S	Bend	trans	-96.9	7.6	-166.7	13.4	0	0	0	0	115.1
1007	E	51.2	Low	69.1	Low	190 Å²	190	75.3 Å²	75.3	89%	0.888	41%	0.406	S	S	*	.			trans	-103.5	67.3	-170.7	-60.8	-153.3	144.1	0	0	115
1008	E	49.2	Very low	69.1	Low	122 Å²	122	75.1 Å²	75.1	57%	0.57	40%	0.404	S	S	*	.			trans	-129.2	127.9	159.5	-73.6	-165	139.6	0	0	110.9	I1010	E1008-I1010 PolarHBondContact O-N 3.34Å
1009	K	48.5	Very low	69.3	Low	218 Å²	218	72.9 Å²	72.9	95%	0.948	40%	0.395	S	S	*	.	S	Bend	trans	-75.9	2.9	-175.6	-86.8	179.9	175.2	170.7	0	115.3
1010	I	55	Low	69.6	Low	122 Å²	122	70.4 Å²	70.4	63%	0.626	38%	0.378	S	S	*	.	S	Bend	trans	-145.2	118.4	177	-53.9	178.5	0	0	0	108.2	E1008 L1012	E1008-I1010 PolarHBondContact O-N 3.34Å; I1010-L1012 HydrophobicContact CG2-CD1 4.3Å; I1010-L1012 PolarHBondContact O-N 3.31Å
1011	P	55.9	Low	70.3	Confident	49 Å²	49	72.2 Å²	72.2	32%	0.318	38%	0.378	S	S	.	.			trans	-75.5	97.1	-178.6	28.3	-32.5	0	0	0	112	E915 H1013	E915-P1011 HydrophobicContact CG-CG 4.31Å; E915-P1011 WeakPolarHBondContact OE1-CG 3.23Å; P1011-H1013 PolarHBondContact O-N 3.11Å
1012	L	72.1	Confident	71.1	Confident	100 Å²	100	64.9 Å²	64.9	52%	0.524	35%	0.346	S	S	.	.			trans	-84.5	16	162.8	-76.9	109.3	0	0	0	112.9	A889 I1010	A889-L1012 HydrophobicContact CB-CD2 4.46Å; I1010-L1012 HydrophobicContact CG2-CD1 4.3Å; I1010-L1012 PolarHBondContact O-N 3.31Å
1013	H	79.8	Confident	71.2	Confident	22 Å²	22	67.5 Å²	67.5	10%	0.102	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	161.1	-179.2	58.2	-98	0	0	0	110.9	R995 V996 V1002 P1011 D1015	R995-H1013 HydrophobicContact CG-CB 3.86Å; R995-H1013 PolarHBondContact NE-CD2 2.95Å; R995-H1013 PolarHBondContact NH2-NE2 3.45Å; V996-H1013 CarbonylContact O-C 3.6Å; V996-H1013 WeakPolarHBondContact O-CA 3.46Å; V996-H1013 VanDerWaalsContact O-CB 3.29Å; V996-H1013 WeakPolarHBondContact O-CB 3.5Å; V1002-H1013 HydrophobicContact CG1-CB 4.39Å; P1011-H1013 PolarHBondContact O-N 3.11Å; H1013-D1015 IonicContact CD2-OD2 3.78Å; H1013-D1015 IonicContact NE2-OD2 3.93Å
1014	S	84.3	Confident	71.2	Confident	5 Å²	5	66.3 Å²	66.3	4%	0.035	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.6	170.8	-63.7	0	0	0	0	109.1	A891 E915 V996	A891-S1014 WeakPolarHBondContact CB-OG 3.26Å; E915-S1014 WeakPolarHBondContact O-CA 3.38Å; V996-S1014 PolarHBondContact N-O 2.92Å; V996-S1014 PolarHBondContact O-N 3.23Å
1015	D	86	Confident	70.4	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.112	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.2	-178.6	-78.8	-44.6	0	0	0	112	E915 S916 C917 H993 R995 H1013	E915-D1015 PolarHBondContact O-N 3.41Å; S916-D1015 WeakPolarHBondContact CA-O 3.35Å; C917-D1015 PolarHBondContact N-O 3.45Å; H993-D1015 IonicContact CD2-OD1 3.25Å; H993-D1015 IonicContact CE1-OD1 2.72Å; H993-D1015 IonicContact NE2-OD1 3.41Å; H993-D1015 PolarHBondContact NE2-OD1 3.23Å; H993-D1015 IonicContact NE2-OD2 3.44Å; R995-D1015 WeakPolarHBondContact CA-OD1 3.4Å; R995-D1015 VanDerWaalsContact CB-OD1 3.23Å; R995-D1015 WeakPolarHBondContact CB-OD1 3.26Å; R995-D1015 VanDerWaalsContact CG-OD1 3.32Å; R995-D1015 WeakPolarHBondContact CG-OD1 3.4Å; R995-D1015 IonicContact CZ-OD1 3.72Å; R995-D1015 IonicContact CZ-OD2 3.45Å; R995-D1015 IonicContact NE-OD1 2.86Å; R995-D1015 PolarHBondContact NE-OD1 3.44Å; R995-D1015 IonicContact NE-OD2 3.27Å; R995-D1015 PolarHBondContact NE-OD2 2.94Å; R995-D1015 IonicContact NH2-OD1 3.7Å; R995-D1015 IonicContact NH2-OD2 2.75Å; R995-D1015 PolarHBondContact NH2-OD2 2.91Å; H1013-D1015 IonicContact CD2-OD2 3.78Å; H1013-D1015 IonicContact NE2-OD2 3.93Å
1016	Y	86.4	Confident	70.6	Confident	8 Å²	8	73.7 Å²	73.7	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.7	-174.3	-71.4	-88.8	0	0	0	110.7	S893 L894 C917 Y919 H993 F994 V996	S893-Y1016 WeakPolarHBondContact CA-OH 3.38Å; L894-Y1016 HydrophobicContact CB-CE1 4.2Å; L894-Y1016 HydrophobicContact CD1-CD1 4.01Å; L894-Y1016 HydrophobicContact CD1-CD2 4.1Å; L894-Y1016 HydrophobicContact CD1-CE1 3.99Å; L894-Y1016 HydrophobicContact CD1-CE2 4.05Å; L894-Y1016 HydrophobicContact CD1-CG 4.06Å; L894-Y1016 HydrophobicContact CG-CD2 4.46Å; L894-Y1016 HydrophobicContact CG-CE1 4.22Å; L894-Y1016 HydrophobicContact CG-CE2 3.94Å; L894-Y1016 PolarHBondContact N-OH 3.01Å; C917-Y1016 HydrophobicContact CB-CD1 3.46Å; C917-Y1016 VanDerWaalsContact CB-CD1 3.46Å; C917-Y1016 HydrophobicContact CB-CE1 3.55Å; C917-Y1016 HydrophobicContact CB-CG 4.36Å; C917-Y1016 WeakPolarHBondContact O-CA 3.42Å; Y919-Y1016 AromaticContact CE2-CD1 3.86Å; Y919-Y1016 HydrophobicContact CE2-CD1 3.86Å; Y919-Y1016 HydrophobicContact CE2-CE1 4.39Å; H993-Y1016 WeakPolarHBondContact CA-O 3.37Å; F994-Y1016 PolarHBondContact N-O 3.49Å; F994-Y1016 PolarHBondContact O-N 3.33Å; V996-Y1016 HydrophobicContact CB-CD2 4.27Å; V996-Y1016 HydrophobicContact CB-CE2 4.05Å; V996-Y1016 HydrophobicContact CG2-CD2 3.48Å; V996-Y1016 VanDerWaalsContact CG2-CD2 3.48Å; V996-Y1016 HydrophobicContact CG2-CE2 3.6Å
1017	H	86.3	Confident	71.3	Confident	50 Å²	50	70.8 Å²	70.8	23%	0.231	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.2	-179	-56.4	-87.5	0	0	0	110.5	C917 S918 Y919 T991 Y992 H993	C917-H1017 PolarHBondContact O-N 3.02Å; S918-H1017 WeakPolarHBondContact CA-O 3.36Å; Y919-H1017 PolarHBondContact N-O 3.38Å; T991-H1017 HydrophobicContact CG2-CB 4.15Å; Y992-H1017 CarbonylContact O-C 3.56Å; Y992-H1017 WeakPolarHBondContact O-CA 3.46Å; H993-H1017 AromaticContact CD2-CE1 3.31Å; H993-H1017 PolarHBondContact CD2-CE1 3.49Å; H993-H1017 AromaticContact CD2-ND1 3.76Å; H993-H1017 AromaticContact CD2-NE2 3.85Å; H993-H1017 AromaticContact CG-CE1 3.55Å; H993-H1017 AromaticContact CG-ND1 3.82Å; H993-H1017 AromaticContact NE2-CE1 3.9Å
1018	F	86.9	Confident	72.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	98.8	178.1	-59.7	-93.9	0	0	0	109.3	V897 I906 Y919 L921 L936 M938 T991 Y992 F994 I1020	V897-F1018 HydrophobicContact CB-CE1 4.3Å; V897-F1018 HydrophobicContact CG1-CE1 3.85Å; V897-F1018 HydrophobicContact CG1-CZ 4.14Å; V897-F1018 HydrophobicContact CG2-CE1 4.28Å; V897-F1018 HydrophobicContact CG2-CZ 4.15Å; I906-F1018 HydrophobicContact CD1-CD1 4.07Å; I906-F1018 HydrophobicContact CD1-CE1 3.95Å; Y919-F1018 AromaticContact CD2-CD1 3.73Å; Y919-F1018 HydrophobicContact CD2-CD1 3.73Å; Y919-F1018 AromaticContact CD2-CE1 3.37Å; Y919-F1018 HydrophobicContact CD2-CE1 3.37Å; Y919-F1018 AromaticContact CD2-CZ 3.91Å; Y919-F1018 HydrophobicContact CD2-CZ 3.91Å; Y919-F1018 AromaticContact CE2-CE1 3.88Å; Y919-F1018 HydrophobicContact CE2-CE1 3.88Å; Y919-F1018 HydrophobicContact CE2-CZ 4.06Å; Y919-F1018 HydrophobicContact CG-CD1 4.44Å; Y919-F1018 HydrophobicContact CG-CE1 4.36Å; L921-F1018 HydrophobicContact CD1-CB 4.47Å; L921-F1018 HydrophobicContact CD1-CD1 4.29Å; L936-F1018 HydrophobicContact CD1-CB 4.32Å; L936-F1018 HydrophobicContact CD1-CD1 4.21Å; L936-F1018 HydrophobicContact CD1-CD2 4.07Å; L936-F1018 HydrophobicContact CD1-CE2 4.45Å; L936-F1018 HydrophobicContact CD1-CG 3.95Å; L936-F1018 HydrophobicContact CD2-CD1 4.31Å; M938-F1018 HydrophobicContact CE-CE2 3.78Å; M938-F1018 HydrophobicContact CE-CZ 4.07Å; T991-F1018 WeakPolarHBondContact CA-O 3.44Å; Y992-F1018 PolarHBondContact N-O 3.43Å; Y992-F1018 PolarHBondContact O-N 3.01Å; F994-F1018 AromaticContact CD2-CD2 3.64Å; F994-F1018 HydrophobicContact CD2-CD2 3.64Å; F994-F1018 AromaticContact CD2-CE2 3.7Å; F994-F1018 HydrophobicContact CD2-CE2 3.7Å; F994-F1018 AromaticContact CE2-CD2 3.88Å; F994-F1018 HydrophobicContact CE2-CD2 3.88Å; F994-F1018 HydrophobicContact CE2-CE2 4.2Å; F1018-I1020 PolarHBondContact O-N 3.43Å
1019	L	85.4	Confident	73.8	Confident	44 Å²	44	60.8 Å²	60.8	23%	0.23	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	105.2	172.2	169.2	59.3	0	0	0	108.9	Y919 T920 L921 D989 T991 Q1021	Y919-L1019 PolarHBondContact O-N 2.61Å; T920-L1019 CarbonylContact C-O 3.56Å; T920-L1019 WeakPolarHBondContact CA-O 3.36Å; T920-L1019 HydrophobicContact CG2-CD2 4.12Å; T920-L1019 HydrophobicContact CG2-CG 4.28Å; L921-L1019 PolarHBondContact N-O 2.74Å; D989-L1019 HydrophobicContact CB-CD1 4.15Å; T991-L1019 WeakPolarHBondContact OG1-CD1 3.3Å; L1019-Q1021 HydrophobicContact CD1-CG 4.44Å; L1019-Q1021 HydrophobicContact CG-CG 4.34Å
1020	I	84.6	Confident	75.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.5	176.9	-49.4	163.7	0	0	0	108.3	L921 L923 I934 V982 V984 D989 V990 Y992 F1018	L921-I1020 HydrophobicContact CB-CG1 4.43Å; L921-I1020 HydrophobicContact CB-CG2 4.47Å; L921-I1020 HydrophobicContact CD1-CG1 4.1Å; L923-I1020 HydrophobicContact CD1-CG2 3.99Å; L923-I1020 HydrophobicContact CG-CG2 4.19Å; I934-I1020 HydrophobicContact CD1-CD1 3.65Å; I934-I1020 HydrophobicContact CD1-CG1 4.16Å; I934-I1020 HydrophobicContact CD1-CG2 4.21Å; I934-I1020 HydrophobicContact CG1-CD1 4.14Å; V982-I1020 HydrophobicContact CG2-CD1 3.87Å; V984-I1020 HydrophobicContact CG1-CB 4.38Å; V984-I1020 HydrophobicContact CG1-CG2 3.51Å; V984-I1020 HydrophobicContact CG2-CD1 3.96Å; V984-I1020 HydrophobicContact CG2-CG2 4.11Å; D989-I1020 WeakPolarHBondContact CA-O 3.37Å; V990-I1020 PolarHBondContact N-O 3.46Å; V990-I1020 PolarHBondContact O-N 2.85Å; Y992-I1020 HydrophobicContact CD2-CD1 3.71Å; Y992-I1020 HydrophobicContact CE2-CD1 3.87Å; F1018-I1020 PolarHBondContact O-N 3.43Å
1021	Q	80.5	Confident	76.7	Confident	69 Å²	69	46.2 Å²	46.2	32%	0.322	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.9	177.5	-66.2	175.4	-19.1	0	0	109.7	L921 S922 L923 Q988 L1019	L921-Q1021 PolarHBondContact O-N 3.48Å; S922-Q1021 PolarHBondContact OG-OE1 3.14Å; L923-Q1021 PolarHBondContact N-O 3.42Å; Q988-Q1021 CarbonylContact O-C 3.55Å; Q988-Q1021 WeakPolarHBondContact O-CA 3.45Å; L1019-Q1021 HydrophobicContact CD1-CG 4.44Å; L1019-Q1021 HydrophobicContact CG-CG 4.34Å
1022	S	74.4	Confident	78.2	Confident	24 Å²	24	46 Å²	46	17%	0.168	26%	0.263	C	S	.	.			trans	-94.2	175.2	174.2	86.6	0	0	0	0	111.1	F987 Q988	F987-S1022 WeakPolarHBondContact O-CB 3.31Å; F987-S1022 PolarHBondContact O-OG 2.84Å; Q988-S1022 PolarHBondContact O-N 2.92Å
1023	S	65.9	Low	78.7	Confident	71 Å²	71	41.8 Å²	41.8	50%	0.497	24%	0.243	S	C	.	.			trans	-122.6	112.9	162.8	55.9	0	0	0	0	108.5
1024	C	65.1	Low	78.6	Confident	46 Å²	46	43.5 Å²	43.5	31%	0.311	25%	0.254	S	S	.	.			trans	-57.9	140.5	165.7	-45.4	0	0	0	0	109.4	C957 Q988	C957-C1024 WeakPolarHBondContact CA-SG 3.4Å; C957-C1024 HydrophobicContact CB-CB 3.79Å; C957-C1024 WeakPolarHBondContact CB-SG 3.33Å; C957-C1024 WeakPolarHBondContact SG-CB 3.22Å; C957-C1024 CovalentContact SG-SG 2.04Å; C957-C1024 PolarHBondContact SG-SG 3.46Å; Q988-C1024 WeakPolarHBondContact CG-SG 3.32Å
1025	V	57.4	Low	78.1	Confident	183 Å²	183	47 Å²	47	100%	1.109	27%	0.274	S	S	*	.			trans	-123	0	176.8	-177.1	0	0	0	0	108.8

Retrieved 1,025 of 1,025 residues in 308.8 ms (Link to these results)

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