A0A077Z0U3_TRITR Loading...

FERM M and FERM N and FERM C domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077Z0U3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,057 aa.

						>A0A077Z0U3_TRITR|A0A077Z0U3
MSMPYEGLATAGSTSLSKSMTIIGKCHPTSTHSRRFCSSSGSFVGPVFVSRTTNYPLTAGMKYIDVQLLTGQHLYVAVDVRCKVGDIFECVCSHIGAQDALLFGLCVRIENEYRFLEPTQKLAKCTPKNWAKSGGLGTDMHGQPSVILYLRVYTYIDVVRLIRCPVSLAHYYMQLRENVRSQWQELLVREERCYEVAALALQADFGDYGDLLTENSAYFCPELYFPAWVVNSRGQDFLRRHTPVIHQDLVGMDAHEARYRFCEDVSSGCCAVNAHIYRLMRNKGDPGESVLLAVAPAGIQLFENHADNLRFPVASFPWAQIGKLSFDRRKFLLVSTDGQKLTFFTSNDQKARYLLRFCRMFHQNLMRLHEEGRKNAGQYCGDVIATTLDSTIVPTGSNDKVNGNCCDKNLAIQANSVGQRVSLVSDASSNTTSGIVSDKQRAHDDSENDNEGDLELESAGDNSNRHPLVHSDSARSDVSYASKGASADSKENADSPTPDGGRSGFLDGANSLESDPGDVGKPNTFRAVRFCQHYPILPSALTTLEQKLRNCQLTQQASPREPCSSSDIKLRSMLSNAEAPVSPFYQHRLALNLKASAATSLSSVEPMISKIGLLYTLPSSTAVPSVSFAETQSASLLNLQSTVSTPSSSSLFTSKPQQLPNYDEAVMRQHGKRWTTITCIDPSVLSQMSDSLEGQLHQAQSEPGLGVGHVGMLTPQQPVVYQNHESVTQNRSSSSSSYITNGSPSTEQGCSYAPAGYSLYGSSYVNSGCRTAFANSSSIDQLLHNNALVSRTHSLQESKYHYRSAAEMLGAIPNRFAVYGNNCSCASSCGTYSLSSSELASSKRIHREGQTAYCDACHEEHCSVEALDLDRVKSIIQRQAADLPLIRALCSDHTIQSSTKYCSVSELYQQEKKCCLKMANKMPATRTTSTVTFAHGCSTIPGCCDSINSTVLSSPTGRPLSWHESFVQRQIELSNGNDMPIRSKVLSRGAEAQFPGSATVPVTSSSSPSSSDLFYELLTPPPPPPYSTSCHFSSTPLTSSCSGANSAAQVVMQNAVR
					

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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	24.3	Very low	26.5	Very low	234 Å²	234	137.9 Å²	137.9	100%	1.153	80%	0.803	S	S	*	*				0	135.8	0	-67.2	163	178.4	0	0	108.2
2	S	23.1	Very low	26.5	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	80%	0.802	S	S	*	*			trans	-104.5	119.5	176.4	-59	0	0	0	0	108.3
3	M	26.9	Very low	26.4	Very low	156 Å²	156	131.2 Å²	131.2	77%	0.768	80%	0.8	S	S	*	*			trans	-79.5	127.7	169.9	-78.2	-173.8	165.3	0	0	109.5
4	P	28	Very low	26.4	Very low	105 Å²	105	131 Å²	131	68%	0.682	80%	0.799	S	S	*	*			trans	-73.7	130.2	172.1	30.4	-32.1	0	0	0	109.4	E6	P4-E6 PolarHBondContact O-N 2.77Å
5	Y	29.9	Very low	26.4	Very low	188 Å²	188	127.9 Å²	127.9	74%	0.737	79%	0.785	S	S	*	*	S	Bend	trans	-94.6	41.6	165.8	-143.8	-82.7	0	0	0	109.8
6	E	24.7	Very low	26.7	Very low	178 Å²	178	126.5 Å²	126.5	83%	0.832	77%	0.771	S	S	*	*			trans	-134.8	101.4	-178.3	-69.2	-175.9	174.9	0	0	107.1	P4	P4-E6 PolarHBondContact O-N 2.77Å
7	G	26	Very low	26.8	Very low	76 Å²	76	126 Å²	126	78%	0.784	77%	0.774	S	S	*	*			trans	179.8	17	-170.8	0	0	0	0	0	117.4
8	L	29.1	Very low	27.1	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	78%	0.778	S	S	*	*	S	Bend	trans	-157.6	51.4	176.2	-114.4	162.3	0	0	0	112.2
9	A	25.8	Very low	27.2	Very low	79 Å²	79	125.3 Å²	125.3	65%	0.653	75%	0.754	S	S	*	*	S	Bend	trans	-126	1.7	-177.2	0	0	0	0	0	115
10	T	25.4	Very low	27.3	Very low	142 Å²	142	124.5 Å²	124.5	87%	0.871	74%	0.743	S	S	*	*	S	Bend	trans	-146.1	60.5	-176.2	53.9	0	0	0	0	113.3
11	A	28.6	Very low	27.5	Very low	96 Å²	96	122.9 Å²	122.9	79%	0.793	73%	0.734	S	S	*	*	S	Bend	trans	-155.8	139.6	164	0	0	0	0	0	110.6
12	G	26.8	Very low	27.8	Very low	77 Å²	77	118.5 Å²	118.5	79%	0.794	71%	0.714	S	S	*	*			trans	59.8	93.1	165.2	0	0	0	0	0	116.9
13	S	24.9	Very low	28.4	Very low	111 Å²	111	117.2 Å²	117.2	78%	0.776	70%	0.698	S	S	*	*			trans	-67.2	145.4	164.1	55.5	0	0	0	0	111.9
14	T	25.9	Very low	28.6	Very low	129 Å²	129	111.6 Å²	111.6	79%	0.791	68%	0.68	S	S	*	*	S	Bend	trans	97.1	154.9	171.8	75.5	0	0	0	0	118.2	L16	T14-L16 PolarHBondContact O-N 3.07Å
15	S	26.9	Very low	28.7	Very low	84 Å²	84	116.1 Å²	116.1	59%	0.587	69%	0.689	S	S	*	*	S	Bend	trans	68.7	-42.5	174.2	87.5	0	0	0	0	122	S17	S15-S17 VanDerWaalsContact C-N 3.25Å; S15-S17 PolarHBondContact O-N 3.44Å
16	L	30.4	Very low	28.7	Very low	106 Å²	106	111 Å²	111	56%	0.555	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	8.2	-160.4	-87.5	168.6	0	0	0	119.2	T14 K18 A217	T14-L16 PolarHBondContact O-N 3.07Å; L16-K18 PolarHBondContact O-N 3.49Å; L16-A217 HydrophobicContact CD1-CB 3.98Å; L16-A217 HydrophobicContact CD2-CB 4Å
17	S	28.9	Very low	28.8	Very low	118 Å²	118	110.9 Å²	110.9	83%	0.825	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	15.3	-179.2	62.5	0	0	0	0	115.7	S15	S15-S17 VanDerWaalsContact C-N 3.25Å; S15-S17 PolarHBondContact O-N 3.44Å
18	K	31.6	Very low	29.1	Very low	193 Å²	193	110.4 Å²	110.4	84%	0.839	66%	0.662	S	S	*	*	S	Bend	trans	-123.5	-13.3	-169.3	-76.9	-173.1	174.7	-178.4	0	117.7	L16	L16-K18 PolarHBondContact O-N 3.49Å
19	S	29	Very low	29.2	Very low	46 Å²	46	109.5 Å²	109.5	32%	0.322	66%	0.663	S	S	.	*	S	Bend	trans	-99.6	-7	-176.1	51.5	0	0	0	0	115.2	T21	S19-T21 PolarHBondContact O-N 3.28Å
20	M	29.6	Very low	29.4	Very low	108 Å²	108	108.8 Å²	108.8	53%	0.532	65%	0.654	S	S	.	*	S	Bend	trans	-80.5	96.7	169.1	-163.3	179.1	-170.3	0	0	108.8	I22	M20-I22 PolarHBondContact O-N 3.31Å
21	T	32.5	Very low	29.9	Very low	92 Å²	92	107.7 Å²	107.7	56%	0.564	65%	0.647	S	S	*	*			trans	-52.6	121.2	-172.2	-63.9	0	0	0	0	112.2	S19 I23	S19-T21 PolarHBondContact O-N 3.28Å; T21-I23 VanDerWaalsContact C-N 3.3Å; T21-I23 PolarHBondContact O-N 3.34Å
22	I	30.2	Very low	30.4	Very low	142 Å²	142	111 Å²	111	73%	0.728	65%	0.646	S	S	*	*			trans	-76.4	80.3	-176.2	-53.2	177.6	0	0	0	110.3	M20 G24	M20-I22 PolarHBondContact O-N 3.31Å; I22-G24 PolarHBondContact O-N 3.42Å
23	I	36.3	Very low	30.9	Very low	76 Å²	76	108.7 Å²	108.7	39%	0.39	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	115.2	165.1	-56.3	174.2	0	0	0	107.2	T21 V166 A169	T21-I23 VanDerWaalsContact C-N 3.3Å; T21-I23 PolarHBondContact O-N 3.34Å; I23-V166 HydrophobicContact CG2-CG2 4.48Å; I23-A169 HydrophobicContact CD1-CB 3.69Å
24	G	30.4	Very low	31.3	Very low	38 Å²	38	114 Å²	114	39%	0.392	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	128.3	21.7	172.2	0	0	0	0	0	118.4	I22 C26	I22-G24 PolarHBondContact O-N 3.42Å; G24-C26 PolarHBondContact O-N 3.01Å
25	K	28.8	Very low	32.1	Very low	200 Å²	200	112.2 Å²	112.2	87%	0.87	60%	0.599	S	S	*	*			trans	-75.7	48.8	157.8	-82.7	-170.6	177.9	176.2	0	111.9	H27	K25-H27 PolarHBondContact O-N 2.66Å
26	C	30.2	Very low	32.8	Very low	80 Å²	80	112.7 Å²	112.7	54%	0.541	59%	0.591	S	S	.	*			trans	-77.8	115.1	175.1	-59.2	0	0	0	0	108.7	G24 P28	G24-C26 PolarHBondContact O-N 3.01Å; C26-P28 WeakPolarHBondContact O-CD 3.24Å
27	H	27.9	Very low	33.2	Very low	175 Å²	175	110.6 Å²	110.6	81%	0.81	58%	0.584	S	S	*	*			trans	-67.4	121.5	170	-123.7	-75.9	0	0	0	108.2	K25 T29	K25-H27 PolarHBondContact O-N 2.66Å; H27-T29 PolarHBondContact O-N 3.39Å; H27-T29 VanDerWaalsContact O-N 3.09Å
28	P	31.7	Very low	33.5	Very low	66 Å²	66	109.4 Å²	109.4	43%	0.429	58%	0.576	S	S	.	*			trans	-75.3	108	-176.8	29.4	-33.7	0	0	0	109.9	C26 S30 S33	C26-P28 WeakPolarHBondContact O-CD 3.24Å; P28-S30 VanDerWaalsContact C-N 3.31Å; P28-S33 VanDerWaalsContact CB-CB 3.5Å
29	T	31	Very low	34	Very low	141 Å²	141	106.1 Å²	106.1	87%	0.865	58%	0.577	S	S	*	*			trans	-80.5	-9.1	-179.9	46.8	0	0	0	0	113.6	H27	H27-T29 PolarHBondContact O-N 3.39Å; H27-T29 VanDerWaalsContact O-N 3.09Å
30	S	31	Very low	34.6	Very low	65 Å²	65	109.3 Å²	109.3	46%	0.455	60%	0.6	S	S	.	*	S	Bend	trans	-77.2	128	171.3	179.5	0	0	0	0	111.5	P28 H32 S33	P28-S30 VanDerWaalsContact C-N 3.31Å; S30-H32 PolarHBondContact O-N 2.94Å; S30-H32 VanDerWaalsContact O-N 3.16Å; S30-H32 PolarHBondContact OG-N 2.85Å; S30-S33 WeakPolarHBondContact O-CB 3.4Å; S30-S33 PolarHBondContact O-N 2.92Å; S30-S33 PolarHBondContact O-OG 3.22Å
31	T	34.9	Very low	35	Very low	118 Å²	118	106 Å²	106	72%	0.724	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-62.3	-20.1	177	46	0	0	0	0	113.5	S33	T31-S33 VanDerWaalsContact C-N 3.3Å; T31-S33 PolarHBondContact O-N 3.11Å
32	H	38.4	Very low	35.5	Very low	166 Å²	166	107.3 Å²	107.3	77%	0.769	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-73.6	-14.6	173.9	-93.6	-107.1	0	0	0	114.3	S30 R34	S30-H32 PolarHBondContact O-N 2.94Å; S30-H32 VanDerWaalsContact O-N 3.16Å; S30-H32 PolarHBondContact OG-N 2.85Å; H32-R34 VanDerWaalsContact C-N 3.32Å; H32-R34 PolarHBondContact O-N 2.88Å
33	S	39.3	Very low	36.6	Very low	29 Å²	29	103.4 Å²	103.4	20%	0.203	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-84.3	12.1	-170.2	-60.4	0	0	0	0	115.5	P28 S30 T31 R35 F36	P28-S33 VanDerWaalsContact CB-CB 3.5Å; S30-S33 WeakPolarHBondContact O-CB 3.4Å; S30-S33 PolarHBondContact O-N 2.92Å; S30-S33 PolarHBondContact O-OG 3.22Å; T31-S33 VanDerWaalsContact C-N 3.3Å; T31-S33 PolarHBondContact O-N 3.11Å; S33-R35 PolarHBondContact O-N 3.17Å; S33-F36 WeakPolarHBondContact O-CD2 3.38Å
34	R	32.9	Very low	37.5	Very low	223 Å²	223	106.5 Å²	106.5	84%	0.842	61%	0.606	S	S	*	*			trans	-72	26.6	176.3	-57.3	-163.8	-160.5	-152.4	6.8	114.5	H32 F36	H32-R34 VanDerWaalsContact C-N 3.32Å; H32-R34 PolarHBondContact O-N 2.88Å; R34-F36 VanDerWaalsContact C-N 3.32Å; R34-F36 PolarHBondContact O-N 2.95Å
35	R	41.6	Very low	39.3	Very low	90 Å²	90	105.2 Å²	105.2	34%	0.34	59%	0.593	S	S	.	*			trans	-92.7	35.1	178.9	-83.9	-154.6	-87.7	161.3	-8.8	113.8	S33 F43 V47	S33-R35 PolarHBondContact O-N 3.17Å; R35-F43 HydrophobicContact CB-CE1 4.46Å; R35-F43 HydrophobicContact CB-CZ 3.68Å; R35-F43 HydrophobicContact CG-CE1 4.01Å; R35-F43 HydrophobicContact CG-CZ 3.64Å; R35-V47 PolarHBondContact NH1-O 2.83Å
36	F	42.3	Very low	42	Very low	94 Å²	94	98.6 Å²	98.6	41%	0.412	57%	0.57	S	S	.	*	S	Bend	trans	-108.2	147.4	174.1	-71.4	-94.6	0	0	0	111.1	S33 R34 S38 H94	S33-F36 WeakPolarHBondContact O-CD2 3.38Å; R34-F36 VanDerWaalsContact C-N 3.32Å; R34-F36 PolarHBondContact O-N 2.95Å; F36-S38 PolarHBondContact O-N 3.46Å; F36-H94 AromaticContact CE1-CE1 3.98Å; F36-H94 AromaticContact CE1-ND1 3.44Å; F36-H94 WeakPolarHBondContact CE1-ND1 3.17Å
37	C	38.7	Very low	44.9	Very low	62 Å²	62	94.8 Å²	94.8	42%	0.419	54%	0.544	S	S	.	.			trans	-68.6	88.5	-178.7	-68.9	0	0	0	0	112.9	V49	C37-V49 PolarHBondContact SG-O 3.08Å
38	S	34.4	Very low	48	Very low	94 Å²	94	87 Å²	87	66%	0.657	51%	0.508	S	S	*	.			trans	-70.3	129	148.4	-61.6	0	0	0	0	108.2	F36 S40 G41	F36-S38 PolarHBondContact O-N 3.46Å; S38-S40 PolarHBondContact O-N 3.5Å; S38-G41 PolarHBondContact O-N 3.2Å
39	S	42.4	Very low	51	Low	123 Å²	123	84.6 Å²	84.6	86%	0.86	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	28.8	-164.5	54.9	0	0	0	0	115.9
40	S	42.1	Very low	53.8	Low	114 Å²	114	78.3 Å²	78.3	80%	0.797	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.6	4.3	-172.4	52	0	0	0	0	114.6	S38	S38-S40 PolarHBondContact O-N 3.5Å
41	G	37.4	Very low	56.5	Low	37 Å²	37	86.4 Å²	86.4	38%	0.381	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-99.3	132.9	-177.7	0	0	0	0	0	113.7	S38 F43	S38-G41 PolarHBondContact O-N 3.2Å; G41-F43 PolarHBondContact O-N 2.77Å
42	S	44.6	Very low	59	Low	120 Å²	120	83.3 Å²	83.3	84%	0.839	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63.2	123.2	164.2	-177.8	0	0	0	0	109.5
43	F	52.7	Low	61.4	Low	61 Å²	61	76 Å²	76	27%	0.268	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-96	116.6	-169.1	-154.1	-77.8	0	0	0	111.8	R35 G41 F48	R35-F43 HydrophobicContact CB-CE1 4.46Å; R35-F43 HydrophobicContact CB-CZ 3.68Å; R35-F43 HydrophobicContact CG-CE1 4.01Å; R35-F43 HydrophobicContact CG-CZ 3.64Å; G41-F43 PolarHBondContact O-N 2.77Å; F43-F48 HydrophobicContact CD1-CB 4.09Å; F43-F48 AromaticContact CD1-CD1 3.59Å; F43-F48 HydrophobicContact CD1-CD1 3.59Å; F43-F48 HydrophobicContact CD1-CE1 4.18Å; F43-F48 AromaticContact CD1-CG 3.96Å; F43-F48 HydrophobicContact CD1-CG 3.96Å; F43-F48 HydrophobicContact CD2-CG 4.49Å; F43-F48 HydrophobicContact CE1-CB 3.38Å; F43-F48 AromaticContact CE1-CD1 3.77Å; F43-F48 HydrophobicContact CE1-CD1 3.77Å; F43-F48 AromaticContact CE1-CG 3.78Å; F43-F48 HydrophobicContact CE1-CG 3.78Å; F43-F48 HydrophobicContact CE2-CB 4.02Å; F43-F48 HydrophobicContact CE2-CG 4.29Å; F43-F48 HydrophobicContact CG-CD1 4.12Å; F43-F48 HydrophobicContact CG-CE1 4.4Å; F43-F48 HydrophobicContact CG-CG 4.32Å; F43-F48 HydrophobicContact CZ-CB 3.31Å; F43-F48 HydrophobicContact CZ-CD1 4.37Å; F43-F48 AromaticContact CZ-CG 3.92Å; F43-F48 HydrophobicContact CZ-CG 3.92Å
44	V	55.3	Low	63.5	Low	140 Å²	140	81.2 Å²	81.2	85%	0.848	45%	0.448	S	S	*	.			trans	-98.3	-0.3	-167.6	-163.7	0	0	0	0	113.3
45	G	68.2	Low	65.9	Low	12 Å²	12	75.3 Å²	75.3	12%	0.124	43%	0.427	C	S	.	.			trans	-91.5	146.2	178.1	0	0	0	0	0	113.8	V47	G45-V47 PolarHBondContact O-N 2.99Å
46	P	84.6	Confident	67.9	Low	60 Å²	60	75.9 Å²	75.9	39%	0.39	44%	0.443	S	S	.	.	S	Bend	trans	-72.9	-10.8	176.9	31.9	-36.9	0	0	0	113.8	D79	P46-D79 HydrophobicContact CB-CB 4.16Å; P46-D79 WeakPolarHBondContact O-CB 3.34Å; P46-D79 PolarHBondContact O-N 3.25Å
47	V	92.6	Very high	70	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	134.7	-179.4	177.9	0	0	0	0	109.9	R35 G45 V76 A77 V78 C82 D86 I87 C90	R35-V47 PolarHBondContact NH1-O 2.83Å; G45-V47 PolarHBondContact O-N 2.99Å; V47-V76 HydrophobicContact CG1-CG1 3.59Å; V47-A77 VanDerWaalsContact CA-O 3.3Å; V47-A77 WeakPolarHBondContact CA-O 3.35Å; V47-V78 HydrophobicContact CB-CG1 4.36Å; V47-V78 HydrophobicContact CG1-CG1 3.86Å; V47-V78 HydrophobicContact CG2-CG1 3.98Å; V47-C82 HydrophobicContact CG2-CB 4.03Å; V47-D86 HydrophobicContact CG2-CB 3.8Å; V47-I87 HydrophobicContact CG2-CG1 4.35Å; V47-C90 HydrophobicContact CG1-CB 3.68Å
48	F	92.6	Very high	72.3	Confident	11 Å²	11	74.6 Å²	74.6	5%	0.048	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	155.1	173	64.5	-87.3	0	0	0	114.6	F43 L57 V76 A77	F43-F48 HydrophobicContact CD1-CB 4.09Å; F43-F48 AromaticContact CD1-CD1 3.59Å; F43-F48 HydrophobicContact CD1-CD1 3.59Å; F43-F48 HydrophobicContact CD1-CE1 4.18Å; F43-F48 AromaticContact CD1-CG 3.96Å; F43-F48 HydrophobicContact CD1-CG 3.96Å; F43-F48 HydrophobicContact CD2-CG 4.49Å; F43-F48 HydrophobicContact CE1-CB 3.38Å; F43-F48 AromaticContact CE1-CD1 3.77Å; F43-F48 HydrophobicContact CE1-CD1 3.77Å; F43-F48 AromaticContact CE1-CG 3.78Å; F43-F48 HydrophobicContact CE1-CG 3.78Å; F43-F48 HydrophobicContact CE2-CB 4.02Å; F43-F48 HydrophobicContact CE2-CG 4.29Å; F43-F48 HydrophobicContact CG-CD1 4.12Å; F43-F48 HydrophobicContact CG-CE1 4.4Å; F43-F48 HydrophobicContact CG-CG 4.32Å; F43-F48 HydrophobicContact CZ-CB 3.31Å; F43-F48 HydrophobicContact CZ-CD1 4.37Å; F43-F48 AromaticContact CZ-CG 3.92Å; F43-F48 HydrophobicContact CZ-CG 3.92Å; F48-L57 HydrophobicContact CZ-CD2 3.89Å; F48-V76 CarbonylContact O-C 3.55Å; F48-V76 WeakPolarHBondContact O-CA 3.4Å; F48-V76 VanDerWaalsContact O-CG1 3.31Å; F48-V76 WeakPolarHBondContact O-CG1 3.49Å; F48-A77 HydrophobicContact CD1-CB 3.78Å; F48-A77 HydrophobicContact CD2-CB 3.89Å; F48-A77 HydrophobicContact CE1-CB 3.44Å; F48-A77 VanDerWaalsContact CE1-CB 3.44Å; F48-A77 HydrophobicContact CE2-CB 3.56Å; F48-A77 HydrophobicContact CG-CB 4Å; F48-A77 HydrophobicContact CZ-CB 3.33Å; F48-A77 PolarHBondContact N-O 2.98Å; F48-A77 PolarHBondContact O-N 3.28Å
49	V	93.3	Very high	74.7	Confident	17 Å²	17	75.4 Å²	75.4	10%	0.103	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	134.8	174.2	171.8	0	0	0	0	111.1	C37 L74 H94	C37-V49 PolarHBondContact SG-O 3.08Å; V49-L74 HydrophobicContact CG1-CD1 3.56Å; V49-L74 HydrophobicContact CG1-CG 4.29Å; V49-L74 HydrophobicContact CG2-CD1 4.32Å; V49-L74 HydrophobicContact CG2-CD2 4.16Å; V49-L74 HydrophobicContact CG2-CG 4.33Å; V49-H94 HydrophobicContact CG2-CB 4.09Å
50	S	91.4	Very high	76.8	Confident	9 Å²	9	71.4 Å²	71.4	6%	0.063	43%	0.43	C	S	.	.			trans	-116	151.5	171.9	-172.7	0	0	0	0	111.2	T52 Y75	S50-T52 WeakPolarHBondContact CB-O 3.49Å; S50-T52 PolarHBondContact OG-N 3.17Å; S50-T52 PolarHBondContact OG-O 3.38Å; S50-Y75 PolarHBondContact N-O 3.48Å
51	R	86.4	Confident	79.2	Confident	234 Å²	234	67.1 Å²	67.1	88%	0.883	40%	0.397	S	S	*	.	S	Bend	trans	-85.2	-16.6	173	-62.7	-172.9	-175	-179.7	3.1	113.5
52	T	88.1	Confident	81.9	Confident	54 Å²	54	65.8 Å²	65.8	33%	0.331	38%	0.381	S	S	.	.			trans	-148.9	164.8	179.5	69.6	0	0	0	0	110.7	S50 N54	S50-T52 WeakPolarHBondContact CB-O 3.49Å; S50-T52 PolarHBondContact OG-N 3.17Å; S50-T52 PolarHBondContact OG-O 3.38Å; T52-N54 VanDerWaalsContact C-N 3.29Å; T52-N54 PolarHBondContact OG1-N 2.96Å
53	T	88.8	Confident	84.3	Confident	12 Å²	12	60 Å²	60	7%	0.074	34%	0.341	C	S	.	.	S	Bend	trans	-87	7.4	170.4	46	0	0	0	0	113.7	Y63 Y75 T138 G142 P144	T53-Y63 HydrophobicContact CG2-CD1 4.44Å; T53-Y63 HydrophobicContact CG2-CD2 3.99Å; T53-Y63 HydrophobicContact CG2-CG 3.92Å; T53-Y63 WeakPolarHBondContact O-CE2 3.43Å; T53-Y75 HydrophobicContact CG2-CD1 4.39Å; T53-Y75 HydrophobicContact CG2-CD2 4.35Å; T53-Y75 HydrophobicContact CG2-CG 4.26Å; T53-T138 HydrophobicContact CG2-CG2 3.98Å; T53-G142 VanDerWaalsContact CB-O 3.3Å; T53-G142 WeakPolarHBondContact CB-O 3.35Å; T53-G142 WeakPolarHBondContact CG2-O 3.44Å; T53-G142 PolarHBondContact OG1-O 3.32Å; T53-P144 HydrophobicContact CG2-CG 3.81Å
54	N	83.5	Confident	86.3	Confident	138 Å²	138	57.1 Å²	57.1	74%	0.738	33%	0.328	S	S	*	.			trans	-95.6	-2.2	-173.2	-66.4	-8.3	0	0	0	114.4	T52	T52-N54 VanDerWaalsContact C-N 3.29Å; T52-N54 PolarHBondContact OG1-N 2.96Å
55	Y	82.8	Confident	88.3	Confident	99 Å²	99	50.7 Å²	50.7	39%	0.388	29%	0.289	S	S	.	.	S	Bend	trans	-82.6	137.5	-178	-177	-84.5	0	0	0	110.5	L57 Y63	Y55-L57 PolarHBondContact O-N 3.41Å; Y55-L57 VanDerWaalsContact O-N 3.15Å; Y55-Y63 WeakPolarHBondContact CB-OH 3.24Å; Y55-Y63 PolarHBondContact N-OH 2.74Å; Y55-Y63 PolarHBondContact O-OH 3.02Å
56	P	83.7	Confident	89.6	Confident	103 Å²	103	50.1 Å²	50.1	67%	0.669	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-66	116.1	-178.3	26.2	-34.4	0	0	0	111.2
57	L	87.4	Confident	90.2	Very high	29 Å²	29	48.6 Å²	48.6	15%	0.152	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-88.6	147.8	176.2	-64.3	-173.9	0	0	0	111.6	F48 Y55 M61 Y63 A77 L136	F48-L57 HydrophobicContact CZ-CD2 3.89Å; Y55-L57 PolarHBondContact O-N 3.41Å; Y55-L57 VanDerWaalsContact O-N 3.15Å; L57-M61 HydrophobicContact CB-CB 3.86Å; L57-M61 HydrophobicContact CD1-CB 4.15Å; L57-M61 HydrophobicContact CG-CB 4.43Å; L57-Y63 HydrophobicContact CD1-CD1 4.3Å; L57-Y63 HydrophobicContact CD1-CD2 3.72Å; L57-Y63 HydrophobicContact CD1-CE1 4.17Å; L57-Y63 HydrophobicContact CD1-CE2 3.56Å; L57-Y63 HydrophobicContact CD1-CG 4.08Å; L57-Y63 HydrophobicContact CD2-CE1 4.13Å; L57-Y63 HydrophobicContact CD2-CE2 4.28Å; L57-Y63 HydrophobicContact CG-CD2 4.44Å; L57-Y63 HydrophobicContact CG-CE1 4.45Å; L57-Y63 HydrophobicContact CG-CE2 3.78Å; L57-A77 HydrophobicContact CD2-CB 3.77Å; L57-L136 HydrophobicContact CB-CD2 3.87Å; L57-L136 HydrophobicContact CD1-CD2 4.14Å; L57-L136 HydrophobicContact CG-CD2 4.08Å
58	T	85.9	Confident	90.4	Very high	100 Å²	100	48.9 Å²	48.9	61%	0.613	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-71.3	159.4	174.1	51.5	0	0	0	0	111.7	G60 M61	T58-G60 PolarHBondContact O-N 3.37Å; T58-M61 WeakPolarHBondContact O-CB 3.35Å; T58-M61 PolarHBondContact O-N 3.43Å; T58-M61 VanDerWaalsContact OG1-CG 3.31Å; T58-M61 WeakPolarHBondContact OG1-CG 3.39Å
59	A	84.5	Confident	90.5	Very high	111 Å²	111	49 Å²	49	92%	0.917	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	125.9	-179.3	0	0	0	0	0	111.7
60	G	87.6	Confident	90.5	Very high	39 Å²	39	50.1 Å²	50.1	40%	0.402	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-6.6	-175.4	0	0	0	0	0	115.1	T58 V80	T58-G60 PolarHBondContact O-N 3.37Å; G60-V80 WeakPolarHBondContact O-CG1 3.49Å; G60-V80 PolarHBondContact O-N 3.07Å
61	M	92.5	Very high	90.5	Very high	23 Å²	23	51.2 Å²	51.2	11%	0.113	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	149.1	170.6	-69.3	-84.6	-174.5	0	0	111.9	L57 T58 V78 D79	L57-M61 HydrophobicContact CB-CB 3.86Å; L57-M61 HydrophobicContact CD1-CB 4.15Å; L57-M61 HydrophobicContact CG-CB 4.43Å; T58-M61 WeakPolarHBondContact O-CB 3.35Å; T58-M61 PolarHBondContact O-N 3.43Å; T58-M61 VanDerWaalsContact OG1-CG 3.31Å; T58-M61 WeakPolarHBondContact OG1-CG 3.39Å; M61-V78 CarbonylContact C-O 3.6Å; M61-V78 WeakPolarHBondContact CA-O 3.5Å; M61-D79 HydrophobicContact CE-CB 4.18Å; M61-D79 HydrophobicContact SD-CB 4.06Å; M61-D79 PolarHBondContact SD-N 3.16Å
62	K	93.4	Very high	90.8	Very high	9 Å²	9	45.5 Å²	45.5	4%	0.039	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	160.2	174.7	-70	-179.9	-175.2	-85.6	0	111.2	V78 V80 W130 S133 G135 L136	K62-V78 PolarHBondContact N-O 3.47Å; K62-V78 VanDerWaalsContact O-CA 3.29Å; K62-V78 WeakPolarHBondContact O-CA 3.44Å; K62-V78 PolarHBondContact O-N 3.18Å; K62-V80 HydrophobicContact CD-CG1 3.66Å; K62-V80 HydrophobicContact CG-CG1 4.02Å; K62-W130 HydrophobicContact CB-CH2 3.59Å; K62-W130 HydrophobicContact CB-CZ2 3.54Å; K62-W130 HydrophobicContact CB-CZ3 4.47Å; K62-W130 HydrophobicContact CD-CD2 3.99Å; K62-W130 HydrophobicContact CD-CE3 4.01Å; K62-W130 HydrophobicContact CD-CH2 3.79Å; K62-W130 HydrophobicContact CD-CZ2 3.74Å; K62-W130 HydrophobicContact CD-CZ3 3.92Å; K62-W130 WeakPolarHBondContact CD-O 3.38Å; K62-W130 WeakPolarHBondContact CE-O 3.33Å; K62-W130 HydrophobicContact CG-CH2 4.28Å; K62-W130 HydrophobicContact CG-CZ2 4.26Å; K62-W130 PolarHBondContact NZ-O 3.49Å; K62-W130 VanDerWaalsContact NZ-O 3.1Å; K62-S133 PolarHBondContact NZ-O 3.18Å; K62-S133 PolarHBondContact NZ-OG 3.04Å; K62-G135 PolarHBondContact NZ-O 3.05Å; K62-L136 CarbonylContact C-O 3.57Å; K62-L136 WeakPolarHBondContact CA-O 3.38Å
63	Y	94.6	Very high	91.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.6	167.8	-69.8	-66.2	0	0	0	111.9	T53 Y55 L57 V76 A77 L136 T138	T53-Y63 HydrophobicContact CG2-CD1 4.44Å; T53-Y63 HydrophobicContact CG2-CD2 3.99Å; T53-Y63 HydrophobicContact CG2-CG 3.92Å; T53-Y63 WeakPolarHBondContact O-CE2 3.43Å; Y55-Y63 WeakPolarHBondContact CB-OH 3.24Å; Y55-Y63 PolarHBondContact N-OH 2.74Å; Y55-Y63 PolarHBondContact O-OH 3.02Å; L57-Y63 HydrophobicContact CD1-CD1 4.3Å; L57-Y63 HydrophobicContact CD1-CD2 3.72Å; L57-Y63 HydrophobicContact CD1-CE1 4.17Å; L57-Y63 HydrophobicContact CD1-CE2 3.56Å; L57-Y63 HydrophobicContact CD1-CG 4.08Å; L57-Y63 HydrophobicContact CD2-CE1 4.13Å; L57-Y63 HydrophobicContact CD2-CE2 4.28Å; L57-Y63 HydrophobicContact CG-CD2 4.44Å; L57-Y63 HydrophobicContact CG-CE1 4.45Å; L57-Y63 HydrophobicContact CG-CE2 3.78Å; Y63-V76 WeakPolarHBondContact CA-O 3.48Å; Y63-A77 HydrophobicContact CD1-CB 4.22Å; Y63-A77 HydrophobicContact CE1-CB 3.95Å; Y63-L136 HydrophobicContact CD2-CB 4.14Å; Y63-L136 HydrophobicContact CE2-CD1 4.45Å; Y63-L136 PolarHBondContact N-O 3.09Å; Y63-T138 HydrophobicContact CD2-CG2 4.39Å
64	I	95.5	Very high	91.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	162.8	158.7	63.4	170	0	0	0	109	V66 Y75 V76 V78 I87 L122 W130 V146 L148	I64-V66 HydrophobicContact CD1-CG2 4.23Å; I64-Y75 WeakPolarHBondContact O-CA 3.48Å; I64-V76 HydrophobicContact CD1-CB 4.46Å; I64-V76 HydrophobicContact CG1-CB 3.96Å; I64-V76 PolarHBondContact N-O 2.95Å; I64-V76 PolarHBondContact O-N 3.19Å; I64-V78 HydrophobicContact CB-CG2 4.3Å; I64-V78 HydrophobicContact CD1-CG1 4.22Å; I64-V78 HydrophobicContact CD1-CG2 3.99Å; I64-V78 HydrophobicContact CG1-CG1 4.32Å; I64-V78 HydrophobicContact CG1-CG2 3.83Å; I64-V78 HydrophobicContact CG2-CG2 3.61Å; I64-I87 HydrophobicContact CD1-CD1 3.85Å; I64-I87 HydrophobicContact CD1-CG2 3.89Å; I64-L122 HydrophobicContact CG2-CD2 4.26Å; I64-W130 HydrophobicContact CG2-CH2 3.79Å; I64-W130 HydrophobicContact CG2-CZ2 3.68Å; I64-V146 HydrophobicContact CB-CB 4.4Å; I64-V146 HydrophobicContact CB-CG1 4.2Å; I64-V146 HydrophobicContact CG2-CB 3.91Å; I64-V146 HydrophobicContact CG2-CG1 3.74Å; I64-L148 HydrophobicContact CD1-CD1 3.9Å; I64-L148 HydrophobicContact CD1-CG 4.44Å
65	D	96.1	Very high	92	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.027	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	143.2	168.8	177.3	33.3	0	0	0	109.6	H73 L74 Y75 P144 V146 I147 L148	D65-H73 WeakPolarHBondContact OD1-CB 3.48Å; D65-H73 IonicContact OD1-CG 2.82Å; D65-H73 IonicContact OD1-ND1 2.74Å; D65-H73 IonicContact OD2-CE1 3.92Å; D65-H73 IonicContact OD2-CG 3.03Å; D65-H73 IonicContact OD2-ND1 2.8Å; D65-H73 PolarHBondContact OD2-ND1 3.32Å; D65-L74 PolarHBondContact OD1-N 3.44Å; D65-Y75 HydrophobicContact CB-CD1 4.34Å; D65-P144 HydrophobicContact CB-CB 4.04Å; D65-P144 HydrophobicContact CB-CG 4.01Å; D65-V146 PolarHBondContact N-O 3.17Å; D65-I147 HydrophobicContact CB-CG1 4.2Å; D65-I147 WeakPolarHBondContact O-CA 3.36Å; D65-L148 PolarHBondContact O-N 2.64Å
66	V	97.4	Very high	92.6	Very high	0 Å²	0	38 Å²	38	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	105.9	172.8	-175.3	0	0	0	0	108.2	I64 L68 L74 V76 I87 V91 L105 L148	I64-V66 HydrophobicContact CD1-CG2 4.23Å; V66-L68 HydrophobicContact CG1-CD2 4.47Å; V66-L68 PolarHBondContact O-N 3.42Å; V66-L74 HydrophobicContact CB-CB 4.4Å; V66-L74 PolarHBondContact N-O 3.04Å; V66-L74 WeakPolarHBondContact O-CB 3.18Å; V66-L74 PolarHBondContact O-N 3.32Å; V66-V76 HydrophobicContact CG2-CG2 3.78Å; V66-I87 HydrophobicContact CG2-CG2 4.44Å; V66-V91 HydrophobicContact CB-CG2 4.39Å; V66-V91 HydrophobicContact CG1-CG1 4.35Å; V66-V91 HydrophobicContact CG1-CG2 4.08Å; V66-V91 HydrophobicContact CG2-CG2 4.17Å; V66-L105 HydrophobicContact CG1-CD2 3.88Å; V66-L148 CarbonylContact C-O 3.55Å; V66-L148 WeakPolarHBondContact CA-O 3.44Å; V66-L148 HydrophobicContact CG2-CB 4.39Å
67	Q	96.9	Very high	93.1	Very high	28 Å²	28	33.1 Å²	33.1	13%	0.131	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.1	173.2	-167.3	-177.8	59.3	0	0	109.7	Q72 H73 L148 Y149 L150	Q67-Q72 WeakPolarHBondContact CA-O 3.29Å; Q67-H73 PolarHBondContact NE2-NE2 3.08Å; Q67-L148 PolarHBondContact N-O 3.38Å; Q67-Y149 HydrophobicContact CB-CD1 3.88Å; Q67-Y149 HydrophobicContact CB-CE1 4.26Å; Q67-L150 PolarHBondContact O-N 2.54Å
68	L	96.5	Very high	93.4	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.031	20%	0.196	C	C	.	.			trans	-83.5	167.9	179.3	-59.5	-179.2	0	0	0	111.9	V66 T70 G71 Q72 L74 V91 I95 L150	V66-L68 HydrophobicContact CG1-CD2 4.47Å; V66-L68 PolarHBondContact O-N 3.42Å; L68-T70 WeakPolarHBondContact CB-OG1 3.28Å; L68-T70 PolarHBondContact O-N 3.43Å; L68-G71 WeakPolarHBondContact O-CA 3.43Å; L68-G71 PolarHBondContact O-N 3.12Å; L68-Q72 HydrophobicContact CD1-CB 4.49Å; L68-Q72 PolarHBondContact N-O 3.32Å; L68-L74 HydrophobicContact CD1-CB 4.27Å; L68-L74 HydrophobicContact CD1-CD2 4.4Å; L68-L74 HydrophobicContact CD2-CB 4.38Å; L68-L74 HydrophobicContact CD2-CD2 4.13Å; L68-L74 HydrophobicContact CG-CB 4.18Å; L68-V91 HydrophobicContact CD2-CG1 3.84Å; L68-I95 HydrophobicContact CD1-CG2 3.98Å; L68-I95 HydrophobicContact CD2-CG2 4.2Å; L68-L150 HydrophobicContact CD2-CB 4.41Å; L68-L150 HydrophobicContact CD2-CD2 4Å
69	L	94.8	Very high	93.8	Very high	14 Å²	14	27.6 Å²	27.6	7%	0.073	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.5	174.5	-73.7	161.5	0	0	0	113.4	G71 F103 L150 H170 M173 Q174	L69-G71 PolarHBondContact O-N 2.79Å; L69-F103 HydrophobicContact CD1-CD1 3.97Å; L69-F103 HydrophobicContact CD1-CE1 3.75Å; L69-L150 HydrophobicContact CD1-CG 4.44Å; L69-L150 WeakPolarHBondContact CG-O 3.25Å; L69-H170 HydrophobicContact CD1-CB 3.84Å; L69-M173 HydrophobicContact CB-CB 4.41Å; L69-M173 HydrophobicContact CB-CE 4.16Å; L69-Q174 HydrophobicContact CD2-CB 3.87Å; L69-Q174 HydrophobicContact CD2-CG 4.44Å; L69-Q174 VanDerWaalsContact CD2-OE1 3.28Å
70	T	92.2	Very high	94.1	Very high	39 Å²	39	23.5 Å²	23.5	24%	0.239	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.7	168.1	55.1	0	0	0	0	113.8	L68 Q72 M173	L68-T70 WeakPolarHBondContact CB-OG1 3.28Å; L68-T70 PolarHBondContact O-N 3.43Å; T70-Q72 PolarHBondContact O-N 2.88Å; T70-Q72 WeakPolarHBondContact OG1-CB 3.49Å; T70-Q72 WeakPolarHBondContact OG1-CG 3.49Å; T70-Q72 PolarHBondContact OG1-N 3.05Å; T70-Q72 PolarHBondContact OG1-OE1 3.5Å; T70-M173 HydrophobicContact CG2-CE 3.68Å; T70-M173 HydrophobicContact CG2-SD 3.81Å
71	G	91.6	Very high	94.2	Very high	33 Å²	33	30.4 Å²	30.4	34%	0.34	15%	0.148	S	C	.	.	S	Bend	trans	75.7	-8.3	-168.9	0	0	0	0	0	114.3	L68 L69 H73	L68-G71 WeakPolarHBondContact O-CA 3.43Å; L68-G71 PolarHBondContact O-N 3.12Å; L69-G71 PolarHBondContact O-N 2.79Å; G71-H73 PolarHBondContact O-CD2 3.05Å
72	Q	93.5	Very high	94.2	Very high	113 Å²	113	29.6 Å²	29.6	53%	0.528	14%	0.144	S	C	.	.			trans	-70.1	145.1	179.9	-64	172	-8.1	0	0	111.6	Q67 L68 T70	Q67-Q72 WeakPolarHBondContact CA-O 3.29Å; L68-Q72 HydrophobicContact CD1-CB 4.49Å; L68-Q72 PolarHBondContact N-O 3.32Å; T70-Q72 PolarHBondContact O-N 2.88Å; T70-Q72 WeakPolarHBondContact OG1-CB 3.49Å; T70-Q72 WeakPolarHBondContact OG1-CG 3.49Å; T70-Q72 PolarHBondContact OG1-N 3.05Å; T70-Q72 PolarHBondContact OG1-OE1 3.5Å
73	H	94.2	Very high	94.2	Very high	98 Å²	98	34.1 Å²	34.1	45%	0.454	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.5	178.9	-72.6	-100.5	0	0	0	110	D65 Q67 G71	D65-H73 WeakPolarHBondContact OD1-CB 3.48Å; D65-H73 IonicContact OD1-CG 2.82Å; D65-H73 IonicContact OD1-ND1 2.74Å; D65-H73 IonicContact OD2-CE1 3.92Å; D65-H73 IonicContact OD2-CG 3.03Å; D65-H73 IonicContact OD2-ND1 2.8Å; D65-H73 PolarHBondContact OD2-ND1 3.32Å; Q67-H73 PolarHBondContact NE2-NE2 3.08Å; G71-H73 PolarHBondContact O-CD2 3.05Å
74	L	95.1	Very high	94.3	Very high	14 Å²	14	34.3 Å²	34.3	7%	0.073	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	103.9	-176.3	-174.6	67.3	0	0	0	109.9	V49 D65 V66 L68 V76 V91 H94	V49-L74 HydrophobicContact CG1-CD1 3.56Å; V49-L74 HydrophobicContact CG1-CG 4.29Å; V49-L74 HydrophobicContact CG2-CD1 4.32Å; V49-L74 HydrophobicContact CG2-CD2 4.16Å; V49-L74 HydrophobicContact CG2-CG 4.33Å; D65-L74 PolarHBondContact OD1-N 3.44Å; V66-L74 HydrophobicContact CB-CB 4.4Å; V66-L74 PolarHBondContact N-O 3.04Å; V66-L74 WeakPolarHBondContact O-CB 3.18Å; V66-L74 PolarHBondContact O-N 3.32Å; L68-L74 HydrophobicContact CD1-CB 4.27Å; L68-L74 HydrophobicContact CD1-CD2 4.4Å; L68-L74 HydrophobicContact CD2-CB 4.38Å; L68-L74 HydrophobicContact CD2-CD2 4.13Å; L68-L74 HydrophobicContact CG-CB 4.18Å; L74-V76 HydrophobicContact CG-CG2 4.38Å; L74-V76 PolarHBondContact O-N 3.48Å; L74-V91 HydrophobicContact CD2-CG1 4.42Å; L74-V91 HydrophobicContact CD2-CG2 4.29Å; L74-H94 WeakPolarHBondContact CD1-NE2 3.15Å; L74-H94 HydrophobicContact CD2-CB 4.39Å
75	Y	95.2	Very high	94.2	Very high	34 Å²	34	34.6 Å²	34.6	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.1	176.8	-56	-43	0	0	0	111.2	S50 T53 I64 D65 Q143 P144	S50-Y75 PolarHBondContact N-O 3.48Å; T53-Y75 HydrophobicContact CG2-CD1 4.39Å; T53-Y75 HydrophobicContact CG2-CD2 4.35Å; T53-Y75 HydrophobicContact CG2-CG 4.26Å; I64-Y75 WeakPolarHBondContact O-CA 3.48Å; D65-Y75 HydrophobicContact CB-CD1 4.34Å; Y75-Q143 PolarHBondContact OH-NE2 3.02Å; Y75-Q143 PolarHBondContact OH-OE1 3.34Å; Y75-P144 HydrophobicContact CD1-CG 3.74Å; Y75-P144 HydrophobicContact CE1-CG 3.99Å
76	V	95.3	Very high	94.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.6	179.7	-168.2	0	0	0	0	109.7	V47 F48 Y63 I64 V66 L74 V78 V91	V47-V76 HydrophobicContact CG1-CG1 3.59Å; F48-V76 CarbonylContact O-C 3.55Å; F48-V76 WeakPolarHBondContact O-CA 3.4Å; F48-V76 VanDerWaalsContact O-CG1 3.31Å; F48-V76 WeakPolarHBondContact O-CG1 3.49Å; Y63-V76 WeakPolarHBondContact CA-O 3.48Å; I64-V76 HydrophobicContact CD1-CB 4.46Å; I64-V76 HydrophobicContact CG1-CB 3.96Å; I64-V76 PolarHBondContact N-O 2.95Å; I64-V76 PolarHBondContact O-N 3.19Å; V66-V76 HydrophobicContact CG2-CG2 3.78Å; L74-V76 HydrophobicContact CG-CG2 4.38Å; L74-V76 PolarHBondContact O-N 3.48Å; V76-V78 HydrophobicContact CB-CG1 4.4Å; V76-V78 HydrophobicContact CG1-CG1 3.78Å; V76-V91 HydrophobicContact CG2-CG2 4.43Å
77	A	94.9	Very high	94.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	124.6	170.5	0	0	0	0	0	110.3	V47 F48 L57 Y63	V47-A77 VanDerWaalsContact CA-O 3.3Å; V47-A77 WeakPolarHBondContact CA-O 3.35Å; F48-A77 HydrophobicContact CD1-CB 3.78Å; F48-A77 HydrophobicContact CD2-CB 3.89Å; F48-A77 HydrophobicContact CE1-CB 3.44Å; F48-A77 VanDerWaalsContact CE1-CB 3.44Å; F48-A77 HydrophobicContact CE2-CB 3.56Å; F48-A77 HydrophobicContact CG-CB 4Å; F48-A77 HydrophobicContact CZ-CB 3.33Å; F48-A77 PolarHBondContact N-O 2.98Å; F48-A77 PolarHBondContact O-N 3.28Å; L57-A77 HydrophobicContact CD2-CB 3.77Å; Y63-A77 HydrophobicContact CD1-CB 4.22Å; Y63-A77 HydrophobicContact CE1-CB 3.95Å
78	V	94.7	Very high	94.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	110.6	-164.5	-37.1	0	0	0	0	122.2	V47 M61 K62 I64 V76 V80 I87 L122 W130	V47-V78 HydrophobicContact CB-CG1 4.36Å; V47-V78 HydrophobicContact CG1-CG1 3.86Å; V47-V78 HydrophobicContact CG2-CG1 3.98Å; M61-V78 CarbonylContact C-O 3.6Å; M61-V78 WeakPolarHBondContact CA-O 3.5Å; K62-V78 PolarHBondContact N-O 3.47Å; K62-V78 VanDerWaalsContact O-CA 3.29Å; K62-V78 WeakPolarHBondContact O-CA 3.44Å; K62-V78 PolarHBondContact O-N 3.18Å; I64-V78 HydrophobicContact CB-CG2 4.3Å; I64-V78 HydrophobicContact CD1-CG1 4.22Å; I64-V78 HydrophobicContact CD1-CG2 3.99Å; I64-V78 HydrophobicContact CG1-CG1 4.32Å; I64-V78 HydrophobicContact CG1-CG2 3.83Å; I64-V78 HydrophobicContact CG2-CG2 3.61Å; V76-V78 HydrophobicContact CB-CG1 4.4Å; V76-V78 HydrophobicContact CG1-CG1 3.78Å; V78-V80 PolarHBondContact O-N 3.37Å; V78-I87 HydrophobicContact CG1-CD1 4.32Å; V78-I87 HydrophobicContact CG1-CG1 4.08Å; V78-L122 HydrophobicContact CB-CD2 4.05Å; V78-L122 HydrophobicContact CG2-CD2 3.23Å; V78-W130 HydrophobicContact CG2-CH2 4.27Å
79	D	93.1	Very high	94	Very high	14 Å²	14	41.7 Å²	41.7	8%	0.075	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.2	163.4	-172.2	-55.7	0	0	0	108.9	P46 M61 R81 C82	P46-D79 HydrophobicContact CB-CB 4.16Å; P46-D79 WeakPolarHBondContact O-CB 3.34Å; P46-D79 PolarHBondContact O-N 3.25Å; M61-D79 HydrophobicContact CE-CB 4.18Å; M61-D79 HydrophobicContact SD-CB 4.06Å; M61-D79 PolarHBondContact SD-N 3.16Å; D79-R81 PolarHBondContact O-N 2.86Å; D79-R81 WeakPolarHBondContact OD1-CA 3.21Å; D79-R81 WeakPolarHBondContact OD1-CB 3.28Å; D79-R81 VanDerWaalsContact OD1-CG 3.24Å; D79-R81 WeakPolarHBondContact OD1-CG 3.33Å; D79-R81 IonicContact OD1-CZ 2.66Å; D79-R81 PolarHBondContact OD1-N 2.82Å; D79-R81 IonicContact OD1-NE 2.76Å; D79-R81 PolarHBondContact OD1-NE 3.35Å; D79-R81 IonicContact OD1-NH2 3.26Å; D79-R81 IonicContact OD2-CZ 2.84Å; D79-R81 IonicContact OD2-NE 3.03Å; D79-R81 PolarHBondContact OD2-NE 2.69Å; D79-R81 IonicContact OD2-NH2 3.85Å; D79-R81 PolarHBondContact OD2-NH2 3.45Å; D79-C82 VanDerWaalsContact O-CB 3.26Å; D79-C82 WeakPolarHBondContact O-CB 3.43Å; D79-C82 PolarHBondContact O-N 2.9Å; D79-C82 PolarHBondContact O-SG 3.37Å; D79-C82 VanDerWaalsContact O-SG 3.39Å
80	V	91.2	Very high	94	Very high	25 Å²	25	41.5 Å²	41.5	15%	0.152	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-13.7	-178.1	-64.3	0	0	0	0	114.3	G60 K62 V78 W130 A131	G60-V80 WeakPolarHBondContact O-CG1 3.49Å; G60-V80 PolarHBondContact O-N 3.07Å; K62-V80 HydrophobicContact CD-CG1 3.66Å; K62-V80 HydrophobicContact CG-CG1 4.02Å; V78-V80 PolarHBondContact O-N 3.37Å; V80-W130 HydrophobicContact CG1-CZ3 4.07Å; V80-A131 HydrophobicContact CB-CB 4.02Å; V80-A131 HydrophobicContact CG1-CB 4.14Å
81	R	89.6	Confident	94.2	Very high	184 Å²	184	39.7 Å²	39.7	69%	0.694	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-11.3	176.5	-53.5	170.6	-69.9	177.8	-0.6	113.2	D79	D79-R81 PolarHBondContact O-N 2.86Å; D79-R81 WeakPolarHBondContact OD1-CA 3.21Å; D79-R81 WeakPolarHBondContact OD1-CB 3.28Å; D79-R81 VanDerWaalsContact OD1-CG 3.24Å; D79-R81 WeakPolarHBondContact OD1-CG 3.33Å; D79-R81 IonicContact OD1-CZ 2.66Å; D79-R81 PolarHBondContact OD1-N 2.82Å; D79-R81 IonicContact OD1-NE 2.76Å; D79-R81 PolarHBondContact OD1-NE 3.35Å; D79-R81 IonicContact OD1-NH2 3.26Å; D79-R81 IonicContact OD2-CZ 2.84Å; D79-R81 IonicContact OD2-NE 3.03Å; D79-R81 PolarHBondContact OD2-NE 2.69Å; D79-R81 IonicContact OD2-NH2 3.85Å; D79-R81 PolarHBondContact OD2-NH2 3.45Å
82	C	91.6	Very high	94.4	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.034	18%	0.178	C	C	.	.			trans	-62.5	159.8	-175.9	88.1	0	0	0	0	112.2	V47 D79 D86 K121 L122	V47-C82 HydrophobicContact CG2-CB 4.03Å; D79-C82 VanDerWaalsContact O-CB 3.26Å; D79-C82 WeakPolarHBondContact O-CB 3.43Å; D79-C82 PolarHBondContact O-N 2.9Å; D79-C82 PolarHBondContact O-SG 3.37Å; D79-C82 VanDerWaalsContact O-SG 3.39Å; C82-D86 WeakPolarHBondContact CA-OD2 3.14Å; C82-D86 HydrophobicContact CB-CB 4.42Å; C82-D86 WeakPolarHBondContact CB-OD2 3.28Å; C82-K121 WeakPolarHBondContact O-CA 3.44Å; C82-L122 PolarHBondContact O-N 3.39Å
83	K	94.6	Very high	94.4	Very high	105 Å²	105	36.9 Å²	36.9	46%	0.457	18%	0.178	S	C	.	.	B	Isolated β-bridge	trans	-90.4	164.4	169.1	-57.2	170	-176.4	165.5	0	110.1	G85 D86 P118 Q120	K83-G85 VanDerWaalsContact C-N 3.28Å; K83-G85 PolarHBondContact O-N 3.27Å; K83-D86 PolarHBondContact N-OD2 3.09Å; K83-D86 PolarHBondContact O-N 2.9Å; K83-P118 WeakPolarHBondContact CB-O 3.33Å; K83-Q120 CarbonylContact C-O 3.58Å; K83-Q120 VanDerWaalsContact CA-O 3.25Å; K83-Q120 WeakPolarHBondContact CA-O 3.21Å
84	V	95.7	Very high	94.3	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-66.4	-31.4	172.2	175.1	0	0	0	0	111.5	I87 F88 L105 L116 E117 Q120	V84-I87 WeakPolarHBondContact O-CB 3.31Å; V84-I87 PolarHBondContact O-N 2.79Å; V84-I87 VanDerWaalsContact O-N 3.17Å; V84-F88 WeakPolarHBondContact O-CB 3.25Å; V84-F88 PolarHBondContact O-N 3.33Å; V84-L105 HydrophobicContact CG1-CB 4.03Å; V84-L105 HydrophobicContact CG1-CD1 4.06Å; V84-L116 HydrophobicContact CB-CB 4.42Å; V84-L116 HydrophobicContact CG1-CB 3.85Å; V84-L116 HydrophobicContact CG1-CD1 4.26Å; V84-L116 HydrophobicContact CG2-CB 4.05Å; V84-L116 HydrophobicContact CG2-CD1 3.93Å; V84-E117 WeakPolarHBondContact CB-O 3.29Å; V84-Q120 HydrophobicContact CG2-CB 4.4Å; V84-Q120 PolarHBondContact N-O 2.87Å
85	G	94.9	Very high	94.3	Very high	7 Å²	7	35.6 Å²	35.6	7%	0.072	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-48.1	174	0	0	0	0	0	112.5	K83 I87 F88 E89 P118	K83-G85 VanDerWaalsContact C-N 3.28Å; K83-G85 PolarHBondContact O-N 3.27Å; G85-I87 PolarHBondContact O-N 3.41Å; G85-I87 VanDerWaalsContact O-N 3.09Å; G85-F88 PolarHBondContact O-N 3.28Å; G85-E89 WeakPolarHBondContact O-CG 3.47Å; G85-E89 PolarHBondContact O-N 2.76Å; G85-P118 WeakPolarHBondContact CA-O 3.48Å; G85-P118 PolarHBondContact N-O 2.95Å
86	D	95.1	Very high	94.2	Very high	44 Å²	44	35 Å²	35	24%	0.235	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-30.5	177.7	-41.1	-18.5	0	0	0	112.7	V47 C82 K83 C90	V47-D86 HydrophobicContact CG2-CB 3.8Å; C82-D86 WeakPolarHBondContact CA-OD2 3.14Å; C82-D86 HydrophobicContact CB-CB 4.42Å; C82-D86 WeakPolarHBondContact CB-OD2 3.28Å; K83-D86 PolarHBondContact N-OD2 3.09Å; K83-D86 PolarHBondContact O-N 2.9Å; D86-C90 WeakPolarHBondContact O-CB 3.38Å
87	I	96	Very high	94.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-80.7	-48.1	176.5	-50.2	171.5	0	0	0	110.5	V47 I64 V66 V78 V84 G85 E89 C90 V91 L105 L122 L148	V47-I87 HydrophobicContact CG2-CG1 4.35Å; I64-I87 HydrophobicContact CD1-CD1 3.85Å; I64-I87 HydrophobicContact CD1-CG2 3.89Å; V66-I87 HydrophobicContact CG2-CG2 4.44Å; V78-I87 HydrophobicContact CG1-CD1 4.32Å; V78-I87 HydrophobicContact CG1-CG1 4.08Å; V84-I87 WeakPolarHBondContact O-CB 3.31Å; V84-I87 PolarHBondContact O-N 2.79Å; V84-I87 VanDerWaalsContact O-N 3.17Å; G85-I87 PolarHBondContact O-N 3.41Å; G85-I87 VanDerWaalsContact O-N 3.09Å; I87-E89 PolarHBondContact O-N 2.77Å; I87-C90 WeakPolarHBondContact O-CB 3.35Å; I87-C90 PolarHBondContact O-N 3.4Å; I87-C90 VanDerWaalsContact O-N 3.12Å; I87-V91 HydrophobicContact CG2-CG2 4.36Å; I87-V91 VanDerWaalsContact O-CG2 3.32Å; I87-V91 WeakPolarHBondContact O-CG2 3.38Å; I87-V91 PolarHBondContact O-N 2.77Å; I87-L105 HydrophobicContact CB-CD1 3.88Å; I87-L105 HydrophobicContact CG2-CD1 3.69Å; I87-L122 HydrophobicContact CD1-CB 4.49Å; I87-L122 HydrophobicContact CD1-CD1 3.92Å; I87-L122 HydrophobicContact CD1-CD2 4.18Å; I87-L122 HydrophobicContact CD1-CG 4.42Å; I87-L148 HydrophobicContact CD1-CD1 4.4Å
88	F	96.3	Very high	93.8	Very high	27 Å²	27	42.9 Å²	42.9	12%	0.118	22%	0.216	C	C	.	.	H	α-helix	trans	-59.3	-46.6	179.7	177.7	-117.1	0	0	0	111.8	V84 G85 C90 V91 C92 A100 F103 L105 L150	V84-F88 WeakPolarHBondContact O-CB 3.25Å; V84-F88 PolarHBondContact O-N 3.33Å; G85-F88 PolarHBondContact O-N 3.28Å; F88-C90 VanDerWaalsContact C-N 3.3Å; F88-C90 PolarHBondContact O-N 2.62Å; F88-V91 PolarHBondContact O-N 3.42Å; F88-V91 VanDerWaalsContact O-N 3.16Å; F88-C92 WeakPolarHBondContact CE2-SG 3.43Å; F88-C92 WeakPolarHBondContact O-CB 3.49Å; F88-C92 PolarHBondContact O-N 3.18Å; F88-A100 HydrophobicContact CE1-CB 4.31Å; F88-A100 WeakPolarHBondContact CZ-O 3.46Å; F88-F103 HydrophobicContact CE2-CB 3.77Å; F88-F103 HydrophobicContact CZ-CB 3.9Å; F88-F103 WeakPolarHBondContact CZ-O 3.41Å; F88-L105 HydrophobicContact CB-CD1 3.97Å; F88-L105 HydrophobicContact CB-CG 4.12Å; F88-L105 HydrophobicContact CD2-CG 4.06Å; F88-L150 HydrophobicContact CD2-CD1 4.33Å; F88-L150 HydrophobicContact CE2-CD1 4.05Å
89	E	95	Very high	93.4	Very high	116 Å²	116	44.2 Å²	44.2	54%	0.542	22%	0.223	S	C	.	.	H	α-helix	trans	-57.3	-42.3	173	-72.2	173.2	-158.4	0	0	112	G85 I87 S93	G85-E89 WeakPolarHBondContact O-CG 3.47Å; G85-E89 PolarHBondContact O-N 2.76Å; I87-E89 PolarHBondContact O-N 2.77Å; E89-S93 WeakPolarHBondContact O-CB 3.17Å; E89-S93 PolarHBondContact O-N 2.85Å; E89-S93 PolarHBondContact O-OG 3.06Å
90	C	94.9	Very high	93.1	Very high	11 Å²	11	46.1 Å²	46.1	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-36.5	178	-168.6	0	0	0	0	112.3	V47 D86 I87 F88 H94	V47-C90 HydrophobicContact CG1-CB 3.68Å; D86-C90 WeakPolarHBondContact O-CB 3.38Å; I87-C90 WeakPolarHBondContact O-CB 3.35Å; I87-C90 PolarHBondContact O-N 3.4Å; I87-C90 VanDerWaalsContact O-N 3.12Å; F88-C90 VanDerWaalsContact C-N 3.3Å; F88-C90 PolarHBondContact O-N 2.62Å; C90-H94 WeakPolarHBondContact O-CB 3.49Å; C90-H94 PolarHBondContact O-N 2.92Å; C90-H94 VanDerWaalsContact O-N 3.1Å
91	V	95.8	Very high	93.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-72.6	-48.7	177.7	172.3	0	0	0	0	110.8	V66 L68 L74 V76 I87 F88 S93 H94 I95 L150	V66-V91 HydrophobicContact CB-CG2 4.39Å; V66-V91 HydrophobicContact CG1-CG1 4.35Å; V66-V91 HydrophobicContact CG1-CG2 4.08Å; V66-V91 HydrophobicContact CG2-CG2 4.17Å; L68-V91 HydrophobicContact CD2-CG1 3.84Å; L74-V91 HydrophobicContact CD2-CG1 4.42Å; L74-V91 HydrophobicContact CD2-CG2 4.29Å; V76-V91 HydrophobicContact CG2-CG2 4.43Å; I87-V91 HydrophobicContact CG2-CG2 4.36Å; I87-V91 VanDerWaalsContact O-CG2 3.32Å; I87-V91 WeakPolarHBondContact O-CG2 3.38Å; I87-V91 PolarHBondContact O-N 2.77Å; F88-V91 PolarHBondContact O-N 3.42Å; F88-V91 VanDerWaalsContact O-N 3.16Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 3.49Å; V91-H94 WeakPolarHBondContact O-CB 3.33Å; V91-H94 PolarHBondContact O-N 3.29Å; V91-I95 PolarHBondContact O-N 3.39Å; V91-L150 HydrophobicContact CG1-CD1 4.39Å; V91-L150 HydrophobicContact CG1-CD2 4.13Å
92	C	94.9	Very high	93.3	Very high	12 Å²	12	38 Å²	38	8%	0.081	21%	0.21	C	C	.	.	H	α-helix	trans	-59.7	-42.2	175.6	-72.4	0	0	0	0	111.9	F88 H94 I95 G96 A97	F88-C92 WeakPolarHBondContact CE2-SG 3.43Å; F88-C92 WeakPolarHBondContact O-CB 3.49Å; F88-C92 PolarHBondContact O-N 3.18Å; C92-H94 VanDerWaalsContact C-N 3.26Å; C92-H94 PolarHBondContact O-N 3.38Å; C92-I95 WeakPolarHBondContact O-CG1 3.49Å; C92-I95 PolarHBondContact O-N 2.8Å; C92-G96 PolarHBondContact O-N 3.33Å; C92-A97 PolarHBondContact O-N 3.5Å
93	S	93.9	Very high	93.6	Very high	75 Å²	75	38.1 Å²	38.1	52%	0.524	21%	0.21	S	C	.	.	H	α-helix	trans	-64.4	-27.4	173.7	-59.9	0	0	0	0	113.5	E89 V91	E89-S93 WeakPolarHBondContact O-CB 3.17Å; E89-S93 PolarHBondContact O-N 2.85Å; E89-S93 PolarHBondContact O-OG 3.06Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 3.49Å
94	H	93.3	Very high	93.7	Very high	67 Å²	67	33.4 Å²	33.4	31%	0.31	19%	0.191	S	C	.	.	H	α-helix	trans	-76.8	-43.8	177.7	-177.6	81	0	0	0	112.1	F36 V49 L74 C90 V91 C92	F36-H94 AromaticContact CE1-CE1 3.98Å; F36-H94 AromaticContact CE1-ND1 3.44Å; F36-H94 WeakPolarHBondContact CE1-ND1 3.17Å; V49-H94 HydrophobicContact CG2-CB 4.09Å; L74-H94 WeakPolarHBondContact CD1-NE2 3.15Å; L74-H94 HydrophobicContact CD2-CB 4.39Å; C90-H94 WeakPolarHBondContact O-CB 3.49Å; C90-H94 PolarHBondContact O-N 2.92Å; C90-H94 VanDerWaalsContact O-N 3.1Å; V91-H94 WeakPolarHBondContact O-CB 3.33Å; V91-H94 PolarHBondContact O-N 3.29Å; C92-H94 VanDerWaalsContact C-N 3.26Å; C92-H94 PolarHBondContact O-N 3.38Å
95	I	93.7	Very high	93.8	Very high	18 Å²	18	33.5 Å²	33.5	9%	0.092	19%	0.191	C	C	.	.	H	α-helix	trans	-81.2	-21.3	179.3	65.2	179.1	0	0	0	113.2	L68 V91 C92 A97 L150 V166	L68-I95 HydrophobicContact CD1-CG2 3.98Å; L68-I95 HydrophobicContact CD2-CG2 4.2Å; V91-I95 PolarHBondContact O-N 3.39Å; C92-I95 WeakPolarHBondContact O-CG1 3.49Å; C92-I95 PolarHBondContact O-N 2.8Å; I95-A97 HydrophobicContact CD1-CB 3.7Å; I95-A97 HydrophobicContact CG1-CB 3.81Å; I95-L150 HydrophobicContact CD1-CD2 3.7Å; I95-V166 WeakPolarHBondContact O-CG1 3.44Å
96	G	93.6	Very high	93.8	Very high	23 Å²	23	33.1 Å²	33.1	24%	0.237	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	16.2	-177.8	0	0	0	0	0	115	C92	C92-G96 PolarHBondContact O-N 3.33Å
97	A	92.4	Very high	93.8	Very high	12 Å²	12	31.9 Å²	31.9	10%	0.099	18%	0.182	C	C	.	.			trans	-79.3	134.4	178.6	0	0	0	0	0	111.1	C92 I95 F103 V166	C92-A97 PolarHBondContact O-N 3.5Å; I95-A97 HydrophobicContact CD1-CB 3.7Å; I95-A97 HydrophobicContact CG1-CB 3.81Å; A97-F103 HydrophobicContact CB-CE2 4.28Å; A97-V166 HydrophobicContact CB-CG1 4.26Å
98	Q	89.5	Confident	93.7	Very high	153 Å²	153	38.1 Å²	38.1	72%	0.715	21%	0.206	S	C	*	.			trans	-109.1	-32.3	-171.7	-59.5	177.1	18.7	0	0	112.9	A100 C164	Q98-A100 PolarHBondContact O-N 3.08Å; Q98-C164 HydrophobicContact CB-CB 4.11Å; Q98-C164 HydrophobicContact CG-CB 4.34Å
99	D	86.2	Confident	93.4	Very high	28 Å²	28	38.9 Å²	38.9	15%	0.15	21%	0.21	C	C	.	.			trans	-77.7	67.2	-176.1	-44.5	-110.2	0	0	0	110.9	L101 L102 R163 C164 S167	D99-L101 PolarHBondContact O-N 2.97Å; D99-L102 HydrophobicContact CB-CB 4.49Å; D99-L102 HydrophobicContact CB-CD1 3.61Å; D99-L102 HydrophobicContact CB-CG 3.9Å; D99-L102 WeakPolarHBondContact O-CB 3.31Å; D99-L102 PolarHBondContact O-N 3.37Å; D99-R163 PolarHBondContact OD1-N 3.23Å; D99-R163 VanDerWaalsContact OD1-N 3.12Å; D99-C164 WeakPolarHBondContact OD2-CB 3.37Å; D99-C164 PolarHBondContact OD2-N 3.16Å; D99-S167 WeakPolarHBondContact OD2-CB 3.38Å; D99-S167 PolarHBondContact OD2-OG 2.93Å
100	A	86	Confident	93	Very high	54 Å²	54	37.8 Å²	37.8	45%	0.446	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-58.9	-23.3	-168.9	0	0	0	0	0	114.9	F88 Q98 L102	F88-A100 HydrophobicContact CE1-CB 4.31Å; F88-A100 WeakPolarHBondContact CZ-O 3.46Å; Q98-A100 PolarHBondContact O-N 3.08Å; A100-L102 VanDerWaalsContact C-N 3.29Å; A100-L102 PolarHBondContact O-N 3.4Å
101	L	92	Very high	92.5	Very high	38 Å²	38	42.4 Å²	42.4	20%	0.199	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-70.2	-22.7	174.8	-64.3	178.6	0	0	0	113.4	D99 F103 R367 L368	D99-L101 PolarHBondContact O-N 2.97Å; L101-F103 VanDerWaalsContact C-N 3.35Å; L101-R367 HydrophobicContact CD1-CB 3.87Å; L101-L368 HydrophobicContact CB-CD1 4.22Å; L101-L368 HydrophobicContact CB-CD2 4.02Å; L101-L368 HydrophobicContact CB-CG 4.11Å; L101-L368 HydrophobicContact CD1-CD2 4.09Å; L101-L368 HydrophobicContact CD1-CG 4Å
102	L	94.5	Very high	92.3	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-77.9	-16.1	180	-61.9	-177.3	0	0	0	113.4	D99 A100 V152 Y153 I156 I162 L368	D99-L102 HydrophobicContact CB-CB 4.49Å; D99-L102 HydrophobicContact CB-CD1 3.61Å; D99-L102 HydrophobicContact CB-CG 3.9Å; D99-L102 WeakPolarHBondContact O-CB 3.31Å; D99-L102 PolarHBondContact O-N 3.37Å; A100-L102 VanDerWaalsContact C-N 3.29Å; A100-L102 PolarHBondContact O-N 3.4Å; L102-V152 CarbonylContact O-C 3.56Å; L102-V152 VanDerWaalsContact O-CA 3.22Å; L102-V152 WeakPolarHBondContact O-CA 3.28Å; L102-V152 WeakPolarHBondContact O-CG1 3.45Å; L102-Y153 PolarHBondContact O-N 3.01Å; L102-I156 HydrophobicContact CD2-CD1 4.42Å; L102-I156 HydrophobicContact CD2-CG2 4.33Å; L102-I162 HydrophobicContact CD1-CB 4.23Å; L102-I162 HydrophobicContact CD1-CD1 3.99Å; L102-I162 HydrophobicContact CD1-CG1 3.73Å; L102-I162 HydrophobicContact CD1-CG2 3.81Å; L102-L368 HydrophobicContact CD2-CD1 3.78Å; L102-L368 HydrophobicContact CD2-CD2 4.2Å
103	F	96.6	Very high	92.3	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	162.5	-170.8	-59.4	-71.7	0	0	0	112.9	L69 F88 A97 L101 L150 R151 V152 Y153 H170	L69-F103 HydrophobicContact CD1-CD1 3.97Å; L69-F103 HydrophobicContact CD1-CE1 3.75Å; F88-F103 HydrophobicContact CE2-CB 3.77Å; F88-F103 HydrophobicContact CZ-CB 3.9Å; F88-F103 WeakPolarHBondContact CZ-O 3.41Å; A97-F103 HydrophobicContact CB-CE2 4.28Å; L101-F103 VanDerWaalsContact C-N 3.35Å; F103-L150 HydrophobicContact CB-CD1 4.16Å; F103-R151 WeakPolarHBondContact CA-O 3.41Å; F103-V152 HydrophobicContact CD1-CG2 4.27Å; F103-V152 HydrophobicContact CE1-CG2 3.95Å; F103-Y153 WeakPolarHBondContact O-CB 3.39Å; F103-H170 HydrophobicContact CE1-CB 3.71Å; F103-H170 HydrophobicContact CZ-CB 3.65Å
104	G	96.8	Very high	92.3	Very high	7 Å²	7	42.8 Å²	42.8	7%	0.072	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	161.7	172.2	0	0	0	0	0	112.8	R151	G104-R151 PolarHBondContact N-O 2.89Å; G104-R151 PolarHBondContact O-N 3.38Å; G104-R151 VanDerWaalsContact O-N 3.09Å
105	L	97.5	Very high	92.5	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.7	170.9	-62.4	-179.9	0	0	0	110.3	V66 V84 I87 F88 L116 L148 Y149 L150	V66-L105 HydrophobicContact CG1-CD2 3.88Å; V84-L105 HydrophobicContact CG1-CB 4.03Å; V84-L105 HydrophobicContact CG1-CD1 4.06Å; I87-L105 HydrophobicContact CB-CD1 3.88Å; I87-L105 HydrophobicContact CG2-CD1 3.69Å; F88-L105 HydrophobicContact CB-CD1 3.97Å; F88-L105 HydrophobicContact CB-CG 4.12Å; F88-L105 HydrophobicContact CD2-CG 4.06Å; L105-L116 PolarHBondContact O-N 3.17Å; L105-L148 HydrophobicContact CD1-CD1 4.08Å; L105-Y149 WeakPolarHBondContact CA-O 3.46Å; L105-L150 HydrophobicContact CD2-CB 4.4Å; L105-L150 HydrophobicContact CD2-CD1 4.2Å
106	C	96.7	Very high	92.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	162.4	177.1	59.1	0	0	0	0	112.3	Y113 R114 F115 Y149 R151	C106-Y113 VanDerWaalsContact SG-CD1 3.53Å; C106-R114 VanDerWaalsContact CA-O 3.3Å; C106-R114 WeakPolarHBondContact CA-O 3.48Å; C106-R114 VanDerWaalsContact CB-O 3.27Å; C106-R114 WeakPolarHBondContact CB-O 3.07Å; C106-F115 HydrophobicContact CB-CB 4.42Å; C106-F115 HydrophobicContact CB-CD1 3.72Å; C106-F115 HydrophobicContact CB-CD2 4.49Å; C106-F115 HydrophobicContact CB-CE1 4.03Å; C106-F115 HydrophobicContact CB-CG 3.98Å; C106-Y149 PolarHBondContact N-O 2.91Å; C106-Y149 PolarHBondContact O-N 3.02Å; C106-Y149 PolarHBondContact SG-O 2.85Å; C106-Y149 VanDerWaalsContact SG-O 3.39Å; C106-R151 WeakPolarHBondContact SG-CG 3.41Å
107	V	95.1	Very high	92.5	Very high	18 Å²	18	41 Å²	41	11%	0.109	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.9	167.5	-72.5	0	0	0	0	109.3	I109 R114 L116 L148	V107-I109 HydrophobicContact CG2-CD1 3.82Å; V107-I109 HydrophobicContact CG2-CG1 4.05Å; V107-R114 PolarHBondContact N-O 3.43Å; V107-R114 PolarHBondContact O-N 3.21Å; V107-L116 HydrophobicContact CG1-CD1 4.16Å; V107-L116 HydrophobicContact CG1-CD2 4.33Å; V107-L116 HydrophobicContact CG1-CG 4.46Å; V107-L116 HydrophobicContact CG2-CD2 4.11Å; V107-L148 HydrophobicContact CG1-CD2 3.7Å
108	R	92.5	Very high	92.5	Very high	131 Å²	131	44.3 Å²	44.3	49%	0.494	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.8	176.7	-166.1	170	67.5	126.6	-0.8	110.1	E112 Y113 Y149	R108-E112 CarbonylContact C-O 3.59Å; R108-E112 WeakPolarHBondContact CA-O 3.01Å; R108-Y113 HydrophobicContact CB-CD1 4.23Å; R108-Y113 HydrophobicContact CB-CE1 4.16Å; R108-Y113 HydrophobicContact CG-CD1 4.38Å; R108-Y113 HydrophobicContact CG-CE1 4.18Å; R108-Y149 HydrophobicContact CB-CD2 4.09Å; R108-Y149 HydrophobicContact CB-CE2 3.49Å; R108-Y149 VanDerWaalsContact CB-CE2 3.49Å
109	I	90.7	Very high	92.6	Very high	42 Å²	42	41.5 Å²	41.5	22%	0.215	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.3	-175.8	-50.4	176.3	0	0	0	108.4	V107 N111 E112 R114 Y480	V107-I109 HydrophobicContact CG2-CD1 3.82Å; V107-I109 HydrophobicContact CG2-CG1 4.05Å; I109-N111 PolarHBondContact O-N 3.5Å; I109-N111 VanDerWaalsContact O-N 3.14Å; I109-E112 PolarHBondContact N-O 3.25Å; I109-E112 WeakPolarHBondContact O-CB 3.49Å; I109-E112 PolarHBondContact O-N 3.32Å; I109-R114 HydrophobicContact CD1-CB 4.49Å; I109-Y480 WeakPolarHBondContact CD1-OH 3.35Å
110	E	85.8	Confident	92.9	Very high	94 Å²	94	41.4 Å²	41.4	44%	0.439	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	32.6	179.4	-64.2	157.4	124	0	0	112	E112 R114 S346	E110-E112 PolarHBondContact O-N 3.34Å; E110-R114 IonicContact OE2-CZ 3.5Å; E110-R114 VanDerWaalsContact OE2-CZ 3.24Å; E110-R114 IonicContact OE2-NH1 2.99Å; E110-R114 PolarHBondContact OE2-NH1 3.4Å; E110-R114 IonicContact OE2-NH2 3.29Å; E110-R114 PolarHBondContact OE2-NH2 3.04Å; E110-S346 PolarHBondContact OE1-OG 3.13Å
111	N	85.3	Confident	93.2	Very high	107 Å²	107	44.7 Å²	44.7	57%	0.572	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	6.2	-169.8	-69.1	-24.4	0	0	0	116.8	I109	I109-N111 PolarHBondContact O-N 3.5Å; I109-N111 VanDerWaalsContact O-N 3.14Å
112	E	91.1	Very high	93.2	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.047	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	148.8	170.6	-58.1	177	157.5	0	0	111.1	R108 I109 E110 R114 Y277 R278 K350	R108-E112 CarbonylContact C-O 3.59Å; R108-E112 WeakPolarHBondContact CA-O 3.01Å; I109-E112 PolarHBondContact N-O 3.25Å; I109-E112 WeakPolarHBondContact O-CB 3.49Å; I109-E112 PolarHBondContact O-N 3.32Å; E110-E112 PolarHBondContact O-N 3.34Å; E112-R114 IonicContact OE2-CZ 3.29Å; E112-R114 IonicContact OE2-NE 3.58Å; E112-R114 PolarHBondContact OE2-NE 3.24Å; E112-R114 IonicContact OE2-NH2 3.97Å; E112-R114 PolarHBondContact OE2-NH2 2.98Å; E112-Y277 HydrophobicContact CB-CD1 4.45Å; E112-Y277 HydrophobicContact CG-CD1 4.49Å; E112-R278 PolarHBondContact OE1-N 2.91Å; E112-K350 VanDerWaalsContact CD-NZ 3.26Å; E112-K350 WeakPolarHBondContact OE1-CE 3.39Å; E112-K350 IonicContact OE1-NZ 2.71Å; E112-K350 PolarHBondContact OE1-NZ 2.83Å; E112-K350 WeakPolarHBondContact OE2-CE 3.48Å; E112-K350 IonicContact OE2-NZ 2.72Å; E112-K350 PolarHBondContact OE2-NZ 3.37Å
113	Y	94.3	Very high	92.9	Very high	67 Å²	67	45 Å²	45	26%	0.263	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126.9	165.1	-67.9	-68.3	0	0	0	109.7	C106 R108 Y149 R151 Y277	C106-Y113 VanDerWaalsContact SG-CD1 3.53Å; R108-Y113 HydrophobicContact CB-CD1 4.23Å; R108-Y113 HydrophobicContact CB-CE1 4.16Å; R108-Y113 HydrophobicContact CG-CD1 4.38Å; R108-Y113 HydrophobicContact CG-CE1 4.18Å; Y113-Y149 HydrophobicContact CD1-CD2 4.34Å; Y113-Y149 HydrophobicContact CD1-CG 4.3Å; Y113-Y149 AromaticContact CE1-CD1 3.99Å; Y113-Y149 HydrophobicContact CE1-CD1 3.99Å; Y113-Y149 HydrophobicContact CE1-CD2 4.02Å; Y113-Y149 HydrophobicContact CE1-CE1 4.48Å; Y113-Y149 AromaticContact CE1-CG 3.73Å; Y113-Y149 HydrophobicContact CE1-CG 3.73Å; Y113-R151 HydrophobicContact CD1-CG 4.22Å; Y113-R151 HydrophobicContact CD2-CG 4.48Å; Y113-R151 HydrophobicContact CE1-CG 4.38Å; Y113-R151 HydrophobicContact CG-CG 4.28Å; Y113-R151 VanDerWaalsContact CZ-NE 3.34Å; Y113-R151 PolarHBondContact OH-NE 3.35Å; Y113-R151 PolarHBondContact OH-NH2 2.95Å; Y113-Y277 WeakPolarHBondContact O-CE1 3.28Å
114	R	94.8	Very high	92.5	Very high	19 Å²	19	47.3 Å²	47.3	7%	0.072	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.8	174.5	-59.3	-163.3	-172.1	133.8	7.1	110.2	C106 V107 I109 E110 E112 Y353	C106-R114 VanDerWaalsContact CA-O 3.3Å; C106-R114 WeakPolarHBondContact CA-O 3.48Å; C106-R114 VanDerWaalsContact CB-O 3.27Å; C106-R114 WeakPolarHBondContact CB-O 3.07Å; V107-R114 PolarHBondContact N-O 3.43Å; V107-R114 PolarHBondContact O-N 3.21Å; I109-R114 HydrophobicContact CD1-CB 4.49Å; E110-R114 IonicContact OE2-CZ 3.5Å; E110-R114 VanDerWaalsContact OE2-CZ 3.24Å; E110-R114 IonicContact OE2-NH1 2.99Å; E110-R114 PolarHBondContact OE2-NH1 3.4Å; E110-R114 IonicContact OE2-NH2 3.29Å; E110-R114 PolarHBondContact OE2-NH2 3.04Å; E112-R114 IonicContact OE2-CZ 3.29Å; E112-R114 IonicContact OE2-NE 3.58Å; E112-R114 PolarHBondContact OE2-NE 3.24Å; E112-R114 IonicContact OE2-NH2 3.97Å; E112-R114 PolarHBondContact OE2-NH2 2.98Å; R114-Y353 WeakPolarHBondContact CA-OH 3.43Å; R114-Y353 HydrophobicContact CB-CD2 4.28Å; R114-Y353 HydrophobicContact CB-CE1 4.16Å; R114-Y353 HydrophobicContact CB-CE2 3.88Å; R114-Y353 HydrophobicContact CG-CD1 4.21Å; R114-Y353 HydrophobicContact CG-CE1 3.94Å
115	F	96.8	Very high	92	Very high	14 Å²	14	47.5 Å²	47.5	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	141.5	-176	-71	-84.7	0	0	0	112.3	C106 R151 V152 Y153 H275 Y353 F357	C106-F115 HydrophobicContact CB-CB 4.42Å; C106-F115 HydrophobicContact CB-CD1 3.72Å; C106-F115 HydrophobicContact CB-CD2 4.49Å; C106-F115 HydrophobicContact CB-CE1 4.03Å; C106-F115 HydrophobicContact CB-CG 3.98Å; F115-R151 HydrophobicContact CE1-CB 4.04Å; F115-R151 HydrophobicContact CZ-CB 3.88Å; F115-V152 VanDerWaalsContact CZ-O 3.31Å; F115-V152 WeakPolarHBondContact CZ-O 3.44Å; F115-Y153 HydrophobicContact CB-CD2 4.02Å; F115-Y153 HydrophobicContact CB-CE2 3.59Å; F115-Y153 AromaticContact CD1-CD2 3.42Å; F115-Y153 HydrophobicContact CD1-CD2 3.42Å; F115-Y153 VanDerWaalsContact CD1-CD2 3.42Å; F115-Y153 AromaticContact CD1-CE2 3.93Å; F115-Y153 HydrophobicContact CD1-CE2 3.93Å; F115-Y153 HydrophobicContact CD1-CG 4.38Å; F115-Y153 HydrophobicContact CD2-CD2 4.25Å; F115-Y153 HydrophobicContact CD2-CE2 4.32Å; F115-Y153 AromaticContact CE1-CD2 3.89Å; F115-Y153 HydrophobicContact CE1-CD2 3.89Å; F115-Y153 HydrophobicContact CE1-CG 4.46Å; F115-Y153 AromaticContact CG-CD2 3.62Å; F115-Y153 HydrophobicContact CG-CD2 3.62Å; F115-Y153 AromaticContact CG-CE2 3.68Å; F115-Y153 HydrophobicContact CG-CE2 3.68Å; F115-Y153 HydrophobicContact CZ-CD2 4.49Å; F115-H275 AromaticContact CE2-CE1 3.47Å; F115-H275 VanDerWaalsContact CE2-CE1 3.47Å; F115-H275 WeakPolarHBondContact CE2-CE1 3.42Å; F115-H275 AromaticContact CE2-ND1 3.82Å; F115-H275 AromaticContact CZ-CE1 3.72Å; F115-Y353 PolarHBondContact N-OH 2.91Å; F115-Y353 WeakPolarHBondContact O-CE2 3.24Å; F115-F357 HydrophobicContact CD2-CD2 4.02Å; F115-F357 AromaticContact CD2-CE2 3.43Å; F115-F357 HydrophobicContact CD2-CE2 3.43Å; F115-F357 VanDerWaalsContact CD2-CE2 3.43Å; F115-F357 HydrophobicContact CD2-CZ 4.2Å; F115-F357 AromaticContact CE2-CE2 3.91Å; F115-F357 HydrophobicContact CE2-CE2 3.91Å; F115-F357 HydrophobicContact CE2-CZ 4.28Å; F115-F357 HydrophobicContact CG-CE2 4.26Å
116	L	95.4	Very high	91.6	Very high	17 Å²	17	47.6 Å²	47.6	9%	0.089	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-92.2	148.4	177.1	-62.3	178.3	0	0	0	110	V84 L105 V107 C125 L148	V84-L116 HydrophobicContact CB-CB 4.42Å; V84-L116 HydrophobicContact CG1-CB 3.85Å; V84-L116 HydrophobicContact CG1-CD1 4.26Å; V84-L116 HydrophobicContact CG2-CB 4.05Å; V84-L116 HydrophobicContact CG2-CD1 3.93Å; L105-L116 PolarHBondContact O-N 3.17Å; V107-L116 HydrophobicContact CG1-CD1 4.16Å; V107-L116 HydrophobicContact CG1-CD2 4.33Å; V107-L116 HydrophobicContact CG1-CG 4.46Å; V107-L116 HydrophobicContact CG2-CD2 4.11Å; L116-C125 HydrophobicContact CD1-CB 4.1Å; L116-C125 HydrophobicContact CD2-CB 3.57Å; L116-C125 HydrophobicContact CG-CB 4.5Å; L116-L148 HydrophobicContact CD1-CD1 4.44Å; L116-L148 HydrophobicContact CD1-CD2 3.76Å
117	E	92.4	Very high	91.1	Very high	40 Å²	40	50.9 Å²	50.9	19%	0.187	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-75.7	136.1	176.4	-45.4	168.3	42.2	0	0	110.1	V84 T119 Q120 R356	V84-E117 WeakPolarHBondContact CB-O 3.29Å; E117-T119 PolarHBondContact O-N 2.94Å; E117-T119 PolarHBondContact OE1-OG1 3.37Å; E117-Q120 HydrophobicContact CB-CB 3.97Å; E117-Q120 VanDerWaalsContact O-CB 3.27Å; E117-Q120 WeakPolarHBondContact O-CB 3.32Å; E117-Q120 PolarHBondContact O-N 3.34Å; E117-R356 VanDerWaalsContact CD-NH2 3.3Å; E117-R356 IonicContact OE1-CZ 3.81Å; E117-R356 IonicContact OE1-NH1 2.68Å; E117-R356 PolarHBondContact OE1-NH1 3.07Å; E117-R356 IonicContact OE1-NH2 3.97Å; E117-R356 PolarHBondContact OE1-NH2 3.36Å; E117-R356 IonicContact OE2-CZ 3.24Å; E117-R356 IonicContact OE2-NH1 2.67Å; E117-R356 PolarHBondContact OE2-NH1 3.5Å; E117-R356 IonicContact OE2-NH2 3.2Å
118	P	92.6	Very high	90.6	Very high	81 Å²	81	56.4 Å²	56.4	53%	0.526	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.4	172.3	-27.7	35.8	0	0	0	113.8	K83 G85	K83-P118 WeakPolarHBondContact CB-O 3.33Å; G85-P118 WeakPolarHBondContact CA-O 3.48Å; G85-P118 PolarHBondContact N-O 2.95Å
119	T	92.2	Very high	90.1	Very high	94 Å²	94	55.7 Å²	55.7	58%	0.577	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-15.3	176.3	47.4	0	0	0	0	114.6	E117	E117-T119 PolarHBondContact O-N 2.94Å; E117-T119 PolarHBondContact OE1-OG1 3.37Å
120	Q	92	Very high	90.1	Very high	26 Å²	26	54.3 Å²	54.3	12%	0.121	28%	0.281	C	S	.	.	S	Bend	trans	-71.2	134	-176.8	-176	172.6	4.7	0	0	110.4	K83 V84 E117 K124	K83-Q120 CarbonylContact C-O 3.58Å; K83-Q120 VanDerWaalsContact CA-O 3.25Å; K83-Q120 WeakPolarHBondContact CA-O 3.21Å; V84-Q120 HydrophobicContact CG2-CB 4.4Å; V84-Q120 PolarHBondContact N-O 2.87Å; E117-Q120 HydrophobicContact CB-CB 3.97Å; E117-Q120 VanDerWaalsContact O-CB 3.27Å; E117-Q120 WeakPolarHBondContact O-CB 3.32Å; E117-Q120 PolarHBondContact O-N 3.34Å; Q120-K124 HydrophobicContact CG-CB 4.38Å
121	K	92.8	Very high	90.1	Very high	123 Å²	123	51.3 Å²	51.3	54%	0.535	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-71	134	171.7	-64.6	-167.6	176.7	-166.8	0	110.1	C82 A123 K124	C82-K121 WeakPolarHBondContact O-CA 3.44Å; K121-A123 VanDerWaalsContact C-N 3.25Å; K121-A123 PolarHBondContact O-N 3.35Å; K121-K124 WeakPolarHBondContact O-CB 3.37Å; K121-K124 PolarHBondContact O-N 2.94Å
122	L	91.6	Very high	90.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-51.2	-44.8	-178.9	177.8	65.8	0	0	0	112.1	I64 V78 C82 I87 K124 C125 T126 W130	I64-L122 HydrophobicContact CG2-CD2 4.26Å; V78-L122 HydrophobicContact CB-CD2 4.05Å; V78-L122 HydrophobicContact CG2-CD2 3.23Å; C82-L122 PolarHBondContact O-N 3.39Å; I87-L122 HydrophobicContact CD1-CB 4.49Å; I87-L122 HydrophobicContact CD1-CD1 3.92Å; I87-L122 HydrophobicContact CD1-CD2 4.18Å; I87-L122 HydrophobicContact CD1-CG 4.42Å; L122-K124 PolarHBondContact O-N 2.98Å; L122-C125 PolarHBondContact O-N 3.46Å; L122-C125 PolarHBondContact O-SG 3.49Å; L122-T126 HydrophobicContact CD1-CG2 3.84Å; L122-T126 HydrophobicContact CG-CG2 3.87Å; L122-T126 WeakPolarHBondContact O-CG2 3.28Å; L122-T126 PolarHBondContact O-N 2.9Å; L122-W130 HydrophobicContact CD2-CH2 3.83Å; L122-W130 HydrophobicContact CD2-CZ3 3.86Å; L122-W130 HydrophobicContact CG-CZ3 4.24Å
123	A	88.8	Confident	89.7	Confident	44 Å²	44	57 Å²	57	36%	0.364	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-56.9	-10.9	178.6	0	0	0	0	0	115.8	K121 T126 A131	K121-A123 VanDerWaalsContact C-N 3.25Å; K121-A123 PolarHBondContact O-N 3.35Å; A123-T126 WeakPolarHBondContact CA-OG1 3.43Å; A123-A131 HydrophobicContact CB-CB 3.79Å
124	K	88.1	Confident	88.8	Confident	55 Å²	55	58.1 Å²	58.1	24%	0.239	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-93.6	-17.8	173.7	-70.3	-169.1	165.5	-175.1	0	114.7	Q120 K121 L122 S476 D477	Q120-K124 HydrophobicContact CG-CB 4.38Å; K121-K124 WeakPolarHBondContact O-CB 3.37Å; K121-K124 PolarHBondContact O-N 2.94Å; L122-K124 PolarHBondContact O-N 2.98Å; K124-S476 PolarHBondContact NZ-O 3.47Å; K124-D477 WeakPolarHBondContact CE-OD1 3.32Å; K124-D477 IonicContact NZ-OD1 3.44Å; K124-D477 PolarHBondContact NZ-OD1 3.31Å
125	C	85.4	Confident	88.4	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.074	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-12.3	174.5	53.1	0	0	0	0	113.7	L116 L122	L116-C125 HydrophobicContact CD1-CB 4.1Å; L116-C125 HydrophobicContact CD2-CB 3.57Å; L116-C125 HydrophobicContact CG-CB 4.5Å; L122-C125 PolarHBondContact O-N 3.46Å; L122-C125 PolarHBondContact O-SG 3.49Å
126	T	88.6	Confident	87.9	Confident	7 Å²	7	61.9 Å²	61.9	4%	0.043	36%	0.364	C	S	.	.	S	Bend	trans	-80.3	161.8	174.4	58.3	0	0	0	0	113.5	L122 A123 W130 V146	L122-T126 HydrophobicContact CD1-CG2 3.84Å; L122-T126 HydrophobicContact CG-CG2 3.87Å; L122-T126 WeakPolarHBondContact O-CG2 3.28Å; L122-T126 PolarHBondContact O-N 2.9Å; A123-T126 WeakPolarHBondContact CA-OG1 3.43Å; T126-W130 HydrophobicContact CG2-CD2 3.95Å; T126-W130 HydrophobicContact CG2-CE3 3.55Å; T126-W130 HydrophobicContact CG2-CH2 4.44Å; T126-W130 HydrophobicContact CG2-CZ3 3.83Å; T126-V146 HydrophobicContact CG2-CB 4.46Å; T126-V146 HydrophobicContact CG2-CG1 3.96Å; T126-V146 HydrophobicContact CG2-CG2 3.67Å
127	P	86.1	Confident	87.6	Confident	69 Å²	69	61.2 Å²	61.2	45%	0.448	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-52.8	152.3	173.2	-27.3	35.4	0	0	0	113.8	N129 W130	P127-N129 PolarHBondContact O-N 3.48Å; P127-W130 HydrophobicContact CB-CB 4.38Å; P127-W130 VanDerWaalsContact O-CB 3.24Å; P127-W130 WeakPolarHBondContact O-CB 3.47Å; P127-W130 PolarHBondContact O-N 2.69Å
128	K	84.6	Confident	87.5	Confident	134 Å²	134	61.4 Å²	61.4	58%	0.583	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	134	175.4	-94.2	176	165.6	150.6	0	110.7	W130 Y480	K128-W130 PolarHBondContact O-N 2.92Å; K128-W130 VanDerWaalsContact O-N 3.17Å; K128-Y480 VanDerWaalsContact CD-O 3.25Å; K128-Y480 WeakPolarHBondContact CD-O 3.27Å; K128-Y480 WeakPolarHBondContact CE-O 3.38Å; K128-Y480 PolarHBondContact NZ-O 2.96Å
129	N	83.4	Confident	87.2	Confident	116 Å²	116	60.7 Å²	60.7	62%	0.62	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	3.1	-176.2	-55.7	-28.9	0	0	0	116.5	P127 A131 K132 S133	P127-N129 PolarHBondContact O-N 3.48Å; N129-A131 VanDerWaalsContact C-N 3.32Å; N129-A131 PolarHBondContact O-N 3.23Å; N129-K132 CarbonylContact O-C 3.56Å; N129-K132 WeakPolarHBondContact O-CA 3.43Å; N129-K132 PolarHBondContact O-N 3.35Å; N129-S133 PolarHBondContact O-N 3.03Å
130	W	89.8	Confident	86.9	Confident	13 Å²	13	65 Å²	65	5%	0.049	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-55.4	-45.9	176.5	176.7	89.3	0	0	0	112	K62 I64 V78 V80 L122 T126 P127 K128 K132 S133 G137 V146	K62-W130 HydrophobicContact CB-CH2 3.59Å; K62-W130 HydrophobicContact CB-CZ2 3.54Å; K62-W130 HydrophobicContact CB-CZ3 4.47Å; K62-W130 HydrophobicContact CD-CD2 3.99Å; K62-W130 HydrophobicContact CD-CE3 4.01Å; K62-W130 HydrophobicContact CD-CH2 3.79Å; K62-W130 HydrophobicContact CD-CZ2 3.74Å; K62-W130 HydrophobicContact CD-CZ3 3.92Å; K62-W130 WeakPolarHBondContact CD-O 3.38Å; K62-W130 WeakPolarHBondContact CE-O 3.33Å; K62-W130 HydrophobicContact CG-CH2 4.28Å; K62-W130 HydrophobicContact CG-CZ2 4.26Å; K62-W130 PolarHBondContact NZ-O 3.49Å; K62-W130 VanDerWaalsContact NZ-O 3.1Å; I64-W130 HydrophobicContact CG2-CH2 3.79Å; I64-W130 HydrophobicContact CG2-CZ2 3.68Å; V78-W130 HydrophobicContact CG2-CH2 4.27Å; V80-W130 HydrophobicContact CG1-CZ3 4.07Å; L122-W130 HydrophobicContact CD2-CH2 3.83Å; L122-W130 HydrophobicContact CD2-CZ3 3.86Å; L122-W130 HydrophobicContact CG-CZ3 4.24Å; T126-W130 HydrophobicContact CG2-CD2 3.95Å; T126-W130 HydrophobicContact CG2-CE3 3.55Å; T126-W130 HydrophobicContact CG2-CH2 4.44Å; T126-W130 HydrophobicContact CG2-CZ3 3.83Å; P127-W130 HydrophobicContact CB-CB 4.38Å; P127-W130 VanDerWaalsContact O-CB 3.24Å; P127-W130 WeakPolarHBondContact O-CB 3.47Å; P127-W130 PolarHBondContact O-N 2.69Å; K128-W130 PolarHBondContact O-N 2.92Å; K128-W130 VanDerWaalsContact O-N 3.17Å; W130-K132 PolarHBondContact O-N 3.1Å; W130-S133 PolarHBondContact O-N 3.42Å; W130-S133 PolarHBondContact O-OG 2.88Å; W130-G137 PolarHBondContact NE1-O 3.18Å; W130-V146 HydrophobicContact CD2-CG2 3.98Å; W130-V146 HydrophobicContact CG-CG2 4.01Å; W130-V146 HydrophobicContact CZ2-CG2 4.22Å
131	A	86.5	Confident	86.6	Confident	31 Å²	31	69.8 Å²	69.8	26%	0.256	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-64.6	-18.8	175.6	0	0	0	0	0	114.2	V80 A123 N129	V80-A131 HydrophobicContact CB-CB 4.02Å; V80-A131 HydrophobicContact CG1-CB 4.14Å; A123-A131 HydrophobicContact CB-CB 3.79Å; N129-A131 VanDerWaalsContact C-N 3.32Å; N129-A131 PolarHBondContact O-N 3.23Å
132	K	85.6	Confident	86.3	Confident	180 Å²	180	65 Å²	65	78%	0.783	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-103.8	-7.6	-179	-66.5	-172.3	175.9	-173.9	0	113.9	N129 W130	N129-K132 CarbonylContact O-C 3.56Å; N129-K132 WeakPolarHBondContact O-CA 3.43Å; N129-K132 PolarHBondContact O-N 3.35Å; W130-K132 PolarHBondContact O-N 3.1Å
133	S	82.7	Confident	86.2	Confident	55 Å²	55	68.3 Å²	68.3	39%	0.385	40%	0.396	S	S	.	.	S	Bend	trans	-68.6	138.8	-176.3	62.4	0	0	0	0	111.4	K62 N129 W130 G135	K62-S133 PolarHBondContact NZ-O 3.18Å; K62-S133 PolarHBondContact NZ-OG 3.04Å; N129-S133 PolarHBondContact O-N 3.03Å; W130-S133 PolarHBondContact O-N 3.42Å; W130-S133 PolarHBondContact O-OG 2.88Å; S133-G135 PolarHBondContact O-N 3.44Å
134	G	75.6	Confident	86.3	Confident	92 Å²	92	66.7 Å²	66.7	95%	0.948	38%	0.382	S	S	*	.	S	Bend	trans	-74.4	88.9	171.8	0	0	0	0	0	110.3
135	G	84.4	Confident	86.4	Confident	46 Å²	46	67 Å²	67	47%	0.474	39%	0.39	S	S	.	.	S	Bend	trans	160.4	167.3	-178.4	0	0	0	0	0	113	K62 S133 G137	K62-G135 PolarHBondContact NZ-O 3.05Å; S133-G135 PolarHBondContact O-N 3.44Å; G135-G137 PolarHBondContact O-N 2.85Å
136	L	88.1	Confident	86.8	Confident	65 Å²	65	67 Å²	67	34%	0.34	39%	0.39	S	S	.	.	S	Bend	trans	-69	9.4	-171.1	-59.6	173.5	0	0	0	114.9	L57 K62 Y63 T138	L57-L136 HydrophobicContact CB-CD2 3.87Å; L57-L136 HydrophobicContact CD1-CD2 4.14Å; L57-L136 HydrophobicContact CG-CD2 4.08Å; K62-L136 CarbonylContact C-O 3.57Å; K62-L136 WeakPolarHBondContact CA-O 3.38Å; Y63-L136 HydrophobicContact CD2-CB 4.14Å; Y63-L136 HydrophobicContact CE2-CD1 4.45Å; Y63-L136 PolarHBondContact N-O 3.09Å; L136-T138 VanDerWaalsContact C-N 3.29Å
137	G	88.7	Confident	87.1	Confident	4 Å²	4	70.1 Å²	70.1	4%	0.041	41%	0.406	C	S	.	.	S	Bend	trans	80.7	6.9	-176.3	0	0	0	0	0	114.5	W130 G135 S145	W130-G137 PolarHBondContact NE1-O 3.18Å; G135-G137 PolarHBondContact O-N 2.85Å; G137-S145 PolarHBondContact O-N 3.07Å; G137-S145 PolarHBondContact O-OG 2.95Å
138	T	89.5	Confident	87.6	Confident	43 Å²	43	66.9 Å²	66.9	26%	0.264	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-95.1	163.1	178.1	57.3	0	0	0	0	113.1	T53 Y63 L136 G142 Q143 S145	T53-T138 HydrophobicContact CG2-CG2 3.98Å; Y63-T138 HydrophobicContact CD2-CG2 4.39Å; L136-T138 VanDerWaalsContact C-N 3.29Å; T138-G142 WeakPolarHBondContact CG2-O 3.44Å; T138-Q143 CarbonylContact C-O 3.56Å; T138-Q143 WeakPolarHBondContact CA-O 3.47Å; T138-Q143 WeakPolarHBondContact CB-O 3.44Å; T138-S145 VanDerWaalsContact C-OG 3.24Å
139	D	87.6	Confident	88.2	Confident	67 Å²	67	61.8 Å²	61.8	36%	0.358	36%	0.362	S	S	.	.			trans	-84.5	-170.5	170.3	76.2	-6.9	0	0	0	112.9	H141 G142 Q143 S145	D139-H141 PolarHBondContact O-N 3.02Å; D139-H141 WeakPolarHBondContact OD1-CA 3.35Å; D139-H141 WeakPolarHBondContact OD1-CB 3.36Å; D139-H141 PolarHBondContact OD1-N 3Å; D139-H141 IonicContact OD2-CD2 2.79Å; D139-G142 PolarHBondContact O-N 3.02Å; D139-G142 PolarHBondContact OD1-N 3.36Å; D139-Q143 PolarHBondContact N-O 3.14Å; D139-Q143 PolarHBondContact OD1-N 3.24Å; D139-S145 PolarHBondContact N-OG 3.28Å
140	M	85.6	Confident	88.9	Confident	183 Å²	183	56.3 Å²	56.3	90%	0.901	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-11	177.2	-64.4	-177.9	69.8	0	0	114.2
141	H	85.9	Confident	89.3	Confident	127 Å²	127	56.4 Å²	56.4	59%	0.588	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	6.4	177.2	-55.9	-59.4	0	0	0	112.1	D139 Q143	D139-H141 PolarHBondContact O-N 3.02Å; D139-H141 WeakPolarHBondContact OD1-CA 3.35Å; D139-H141 WeakPolarHBondContact OD1-CB 3.36Å; D139-H141 PolarHBondContact OD1-N 3Å; D139-H141 IonicContact OD2-CD2 2.79Å; H141-Q143 HydrophobicContact CB-CG 4.48Å; H141-Q143 PolarHBondContact O-N 2.81Å
142	G	86.4	Confident	89.7	Confident	22 Å²	22	55 Å²	55	23%	0.227	32%	0.321	C	S	.	.	S	Bend	trans	74.1	10.4	-177.6	0	0	0	0	0	114	T53 T138 D139	T53-G142 VanDerWaalsContact CB-O 3.3Å; T53-G142 WeakPolarHBondContact CB-O 3.35Å; T53-G142 WeakPolarHBondContact CG2-O 3.44Å; T53-G142 PolarHBondContact OG1-O 3.32Å; T138-G142 WeakPolarHBondContact CG2-O 3.44Å; D139-G142 PolarHBondContact O-N 3.02Å; D139-G142 PolarHBondContact OD1-N 3.36Å
143	Q	87.9	Confident	90.3	Very high	71 Å²	71	47.7 Å²	47.7	33%	0.332	29%	0.289	S	S	.	.			trans	-89	140.2	178.6	-63.1	-54.4	-51.8	0	0	110.7	Y75 T138 D139 H141 S145	Y75-Q143 PolarHBondContact OH-NE2 3.02Å; Y75-Q143 PolarHBondContact OH-OE1 3.34Å; T138-Q143 CarbonylContact C-O 3.56Å; T138-Q143 WeakPolarHBondContact CA-O 3.47Å; T138-Q143 WeakPolarHBondContact CB-O 3.44Å; D139-Q143 PolarHBondContact N-O 3.14Å; D139-Q143 PolarHBondContact OD1-N 3.24Å; H141-Q143 HydrophobicContact CB-CG 4.48Å; H141-Q143 PolarHBondContact O-N 2.81Å; Q143-S145 PolarHBondContact O-N 3.06Å
144	P	91.9	Very high	90.8	Very high	10 Å²	10	45 Å²	45	7%	0.065	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-61.6	127.5	179.8	-22.9	35.2	0	0	0	112.1	T53 D65 Y75 V146	T53-P144 HydrophobicContact CG2-CG 3.81Å; D65-P144 HydrophobicContact CB-CB 4.04Å; D65-P144 HydrophobicContact CB-CG 4.01Å; Y75-P144 HydrophobicContact CD1-CG 3.74Å; Y75-P144 HydrophobicContact CE1-CG 3.99Å; P144-V146 PolarHBondContact O-N 2.72Å
145	S	90	Very high	91.7	Very high	60 Å²	60	41 Å²	41	42%	0.42	23%	0.226	S	C	.	.	S	Bend	trans	-75.5	11.4	-178	-45.2	0	0	0	0	114.1	G137 T138 D139 Q143	G137-S145 PolarHBondContact O-N 3.07Å; G137-S145 PolarHBondContact O-OG 2.95Å; T138-S145 VanDerWaalsContact C-OG 3.24Å; D139-S145 PolarHBondContact N-OG 3.28Å; Q143-S145 PolarHBondContact O-N 3.06Å
146	V	93.6	Very high	92	Very high	11 Å²	11	38.8 Å²	38.8	7%	0.067	20%	0.204	C	C	.	.			trans	-138.9	115.5	-179.2	169.1	0	0	0	0	107	I64 D65 T126 W130 P144 L148	I64-V146 HydrophobicContact CB-CB 4.4Å; I64-V146 HydrophobicContact CB-CG1 4.2Å; I64-V146 HydrophobicContact CG2-CB 3.91Å; I64-V146 HydrophobicContact CG2-CG1 3.74Å; D65-V146 PolarHBondContact N-O 3.17Å; T126-V146 HydrophobicContact CG2-CB 4.46Å; T126-V146 HydrophobicContact CG2-CG1 3.96Å; T126-V146 HydrophobicContact CG2-CG2 3.67Å; W130-V146 HydrophobicContact CD2-CG2 3.98Å; W130-V146 HydrophobicContact CG-CG2 4.01Å; W130-V146 HydrophobicContact CZ2-CG2 4.22Å; P144-V146 PolarHBondContact O-N 2.72Å; V146-L148 HydrophobicContact CG1-CD2 4.43Å
147	I	94.8	Very high	91.8	Very high	73 Å²	73	38.7 Å²	38.7	37%	0.374	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.8	175.2	-54	174.8	0	0	0	107.6	D65 Y149	D65-I147 HydrophobicContact CB-CG1 4.2Å; D65-I147 WeakPolarHBondContact O-CA 3.36Å; I147-Y149 HydrophobicContact CG2-CE1 4.2Å; I147-Y149 HydrophobicContact CG2-CE2 4.16Å
148	L	97.2	Very high	91.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	158.6	164.2	-55.6	-175.7	0	0	0	109	I64 D65 V66 Q67 I87 L105 V107 L116 V146	I64-L148 HydrophobicContact CD1-CD1 3.9Å; I64-L148 HydrophobicContact CD1-CG 4.44Å; D65-L148 PolarHBondContact O-N 2.64Å; V66-L148 CarbonylContact C-O 3.55Å; V66-L148 WeakPolarHBondContact CA-O 3.44Å; V66-L148 HydrophobicContact CG2-CB 4.39Å; Q67-L148 PolarHBondContact N-O 3.38Å; I87-L148 HydrophobicContact CD1-CD1 4.4Å; L105-L148 HydrophobicContact CD1-CD1 4.08Å; V107-L148 HydrophobicContact CG1-CD2 3.7Å; L116-L148 HydrophobicContact CD1-CD1 4.44Å; L116-L148 HydrophobicContact CD1-CD2 3.76Å; V146-L148 HydrophobicContact CG1-CD2 4.43Å
149	Y	97.6	Very high	91.8	Very high	28 Å²	28	38.8 Å²	38.8	11%	0.11	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.3	177.2	-57.5	-93.3	0	0	0	109.2	Q67 L105 C106 R108 Y113 I147	Q67-Y149 HydrophobicContact CB-CD1 3.88Å; Q67-Y149 HydrophobicContact CB-CE1 4.26Å; L105-Y149 WeakPolarHBondContact CA-O 3.46Å; C106-Y149 PolarHBondContact N-O 2.91Å; C106-Y149 PolarHBondContact O-N 3.02Å; C106-Y149 PolarHBondContact SG-O 2.85Å; C106-Y149 VanDerWaalsContact SG-O 3.39Å; R108-Y149 HydrophobicContact CB-CD2 4.09Å; R108-Y149 HydrophobicContact CB-CE2 3.49Å; R108-Y149 VanDerWaalsContact CB-CE2 3.49Å; Y113-Y149 HydrophobicContact CD1-CD2 4.34Å; Y113-Y149 HydrophobicContact CD1-CG 4.3Å; Y113-Y149 AromaticContact CE1-CD1 3.99Å; Y113-Y149 HydrophobicContact CE1-CD1 3.99Å; Y113-Y149 HydrophobicContact CE1-CD2 4.02Å; Y113-Y149 HydrophobicContact CE1-CE1 4.48Å; Y113-Y149 AromaticContact CE1-CG 3.73Å; Y113-Y149 HydrophobicContact CE1-CG 3.73Å; I147-Y149 HydrophobicContact CG2-CE1 4.2Å; I147-Y149 HydrophobicContact CG2-CE2 4.16Å
150	L	97.6	Very high	91.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.6	164.6	-176.5	69.9	0	0	0	108.1	Q67 L68 L69 F88 V91 I95 F103 L105	Q67-L150 PolarHBondContact O-N 2.54Å; L68-L150 HydrophobicContact CD2-CB 4.41Å; L68-L150 HydrophobicContact CD2-CD2 4Å; L69-L150 HydrophobicContact CD1-CG 4.44Å; L69-L150 WeakPolarHBondContact CG-O 3.25Å; F88-L150 HydrophobicContact CD2-CD1 4.33Å; F88-L150 HydrophobicContact CE2-CD1 4.05Å; V91-L150 HydrophobicContact CG1-CD1 4.39Å; V91-L150 HydrophobicContact CG1-CD2 4.13Å; I95-L150 HydrophobicContact CD1-CD2 3.7Å; F103-L150 HydrophobicContact CB-CD1 4.16Å; L105-L150 HydrophobicContact CD2-CB 4.4Å; L105-L150 HydrophobicContact CD2-CD1 4.2Å
151	R	97.2	Very high	92	Very high	16 Å²	16	34.3 Å²	34.3	6%	0.06	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	161	176.9	-61.5	-66.8	171.4	-151.3	-3.8	110.2	F103 G104 C106 Y113 F115 Y153	F103-R151 WeakPolarHBondContact CA-O 3.41Å; G104-R151 PolarHBondContact N-O 2.89Å; G104-R151 PolarHBondContact O-N 3.38Å; G104-R151 VanDerWaalsContact O-N 3.09Å; C106-R151 WeakPolarHBondContact SG-CG 3.41Å; Y113-R151 HydrophobicContact CD1-CG 4.22Å; Y113-R151 HydrophobicContact CD2-CG 4.48Å; Y113-R151 HydrophobicContact CE1-CG 4.38Å; Y113-R151 HydrophobicContact CG-CG 4.28Å; Y113-R151 VanDerWaalsContact CZ-NE 3.34Å; Y113-R151 PolarHBondContact OH-NE 3.35Å; Y113-R151 PolarHBondContact OH-NH2 2.95Å; F115-R151 HydrophobicContact CE1-CB 4.04Å; F115-R151 HydrophobicContact CZ-CB 3.88Å; R151-Y153 PolarHBondContact O-N 2.97Å
152	V	96.8	Very high	92.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	124.8	169.3	173.5	0	0	0	0	108.4	L102 F103 F115 Y155 Y171 Q174 H275	L102-V152 CarbonylContact O-C 3.56Å; L102-V152 VanDerWaalsContact O-CA 3.22Å; L102-V152 WeakPolarHBondContact O-CA 3.28Å; L102-V152 WeakPolarHBondContact O-CG1 3.45Å; F103-V152 HydrophobicContact CD1-CG2 4.27Å; F103-V152 HydrophobicContact CE1-CG2 3.95Å; F115-V152 VanDerWaalsContact CZ-O 3.31Å; F115-V152 WeakPolarHBondContact CZ-O 3.44Å; V152-Y155 HydrophobicContact CB-CD1 4.31Å; V152-Y155 HydrophobicContact CB-CE1 3.86Å; V152-Y155 HydrophobicContact CG1-CD1 3.57Å; V152-Y155 HydrophobicContact CG1-CE1 3.65Å; V152-Y155 HydrophobicContact CG1-CG 4.09Å; V152-Y155 HydrophobicContact CG2-CE1 4.46Å; V152-Y171 HydrophobicContact CB-CD2 4.46Å; V152-Y171 HydrophobicContact CG1-CD2 3.79Å; V152-Y171 HydrophobicContact CG1-CE2 3.65Å; V152-Y171 HydrophobicContact CG2-CD2 3.74Å; V152-Y171 HydrophobicContact CG2-CE2 4.38Å; V152-Q174 HydrophobicContact CB-CB 4.39Å; V152-Q174 HydrophobicContact CB-CG 4Å; V152-Q174 HydrophobicContact CG2-CB 3.58Å; V152-Q174 HydrophobicContact CG2-CG 3.75Å; V152-H275 PolarHBondContact O-CE1 2.83Å; V152-H275 PolarHBondContact O-NE2 2.73Å
153	Y	96.3	Very high	92.4	Very high	27 Å²	27	34.7 Å²	34.7	11%	0.106	16%	0.164	C	C	.	.	S	Bend	trans	-86.6	-62.3	178.7	-169.4	-73.3	0	0	0	110.5	L102 F103 F115 R151 H275 F357 M360 F361	L102-Y153 PolarHBondContact O-N 3.01Å; F103-Y153 WeakPolarHBondContact O-CB 3.39Å; F115-Y153 HydrophobicContact CB-CD2 4.02Å; F115-Y153 HydrophobicContact CB-CE2 3.59Å; F115-Y153 AromaticContact CD1-CD2 3.42Å; F115-Y153 HydrophobicContact CD1-CD2 3.42Å; F115-Y153 VanDerWaalsContact CD1-CD2 3.42Å; F115-Y153 AromaticContact CD1-CE2 3.93Å; F115-Y153 HydrophobicContact CD1-CE2 3.93Å; F115-Y153 HydrophobicContact CD1-CG 4.38Å; F115-Y153 HydrophobicContact CD2-CD2 4.25Å; F115-Y153 HydrophobicContact CD2-CE2 4.32Å; F115-Y153 AromaticContact CE1-CD2 3.89Å; F115-Y153 HydrophobicContact CE1-CD2 3.89Å; F115-Y153 HydrophobicContact CE1-CG 4.46Å; F115-Y153 AromaticContact CG-CD2 3.62Å; F115-Y153 HydrophobicContact CG-CD2 3.62Å; F115-Y153 AromaticContact CG-CE2 3.68Å; F115-Y153 HydrophobicContact CG-CE2 3.68Å; F115-Y153 HydrophobicContact CZ-CD2 4.49Å; R151-Y153 PolarHBondContact O-N 2.97Å; Y153-H275 PolarHBondContact O-NE2 2.88Å; Y153-F357 HydrophobicContact CE1-CE2 4.13Å; Y153-F357 HydrophobicContact CE2-CE2 4.28Å; Y153-F357 AromaticContact CZ-CE2 3.93Å; Y153-M360 HydrophobicContact CE1-CB 4.21Å; Y153-M360 WeakPolarHBondContact OH-CB 3.15Å; Y153-F361 WeakPolarHBondContact O-CD2 3.49Å
154	T	95	Very high	92.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-102.1	109.4	175.9	-65.3	0	0	0	0	109.1	I156 N364 L365 L368	T154-I156 HydrophobicContact CG2-CG2 4.23Å; T154-N364 HydrophobicContact CG2-CB 4.45Å; T154-N364 WeakPolarHBondContact OG1-CB 3.31Å; T154-L365 HydrophobicContact CG2-CB 4.24Å; T154-L365 HydrophobicContact CG2-CD1 4.33Å; T154-L368 HydrophobicContact CG2-CD1 3.64Å
155	Y	94.2	Very high	92.7	Very high	6 Å²	6	34.6 Å²	34.6	2%	0.024	17%	0.17	C	C	.	.			trans	-70.3	155.5	161.3	-63.8	-71.3	0	0	0	109.7	V152 Y171 Q174 L175 N178 N273 A274 H275 P296 F361	V152-Y155 HydrophobicContact CB-CD1 4.31Å; V152-Y155 HydrophobicContact CB-CE1 3.86Å; V152-Y155 HydrophobicContact CG1-CD1 3.57Å; V152-Y155 HydrophobicContact CG1-CE1 3.65Å; V152-Y155 HydrophobicContact CG1-CG 4.09Å; V152-Y155 HydrophobicContact CG2-CE1 4.46Å; Y155-Y171 AromaticContact CD1-CE2 4Å; Y155-Y171 HydrophobicContact CD1-CE2 4Å; Y155-Q174 HydrophobicContact CE1-CG 3.99Å; Y155-Q174 WeakPolarHBondContact OH-CG 3.37Å; Y155-L175 HydrophobicContact CD1-CD2 4.2Å; Y155-L175 HydrophobicContact CE1-CD2 4.08Å; Y155-N178 PolarHBondContact OH-ND2 2.95Å; Y155-N273 WeakPolarHBondContact CB-O 3.39Å; Y155-N273 VanDerWaalsContact CD2-C 3.46Å; Y155-N273 WeakPolarHBondContact CD2-O 3.33Å; Y155-A274 VanDerWaalsContact CE2-C 3.5Å; Y155-A274 WeakPolarHBondContact CE2-O 3.37Å; Y155-H275 AromaticContact CD2-CD2 3.6Å; Y155-H275 AromaticContact CD2-NE2 3.52Å; Y155-H275 AromaticContact CE2-CD2 3.47Å; Y155-H275 VanDerWaalsContact CE2-CD2 3.47Å; Y155-H275 WeakPolarHBondContact CE2-CD2 3.38Å; Y155-H275 AromaticContact CE2-CE1 3.52Å; Y155-H275 AromaticContact CE2-CG 3.9Å; Y155-H275 AromaticContact CE2-ND1 3.94Å; Y155-H275 AromaticContact CE2-NE2 3.23Å; Y155-H275 WeakPolarHBondContact CE2-NE2 3.48Å; Y155-P296 WeakPolarHBondContact O-CG 3.16Å; Y155-F361 HydrophobicContact CD2-CE2 4.49Å
156	I	90.4	Very high	93	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.			trans	-138.7	149.2	178	61	174.5	0	0	0	110.6	L102 T154 V158 L161 I162 Y171 S266 L365 L368	L102-I156 HydrophobicContact CD2-CD1 4.42Å; L102-I156 HydrophobicContact CD2-CG2 4.33Å; T154-I156 HydrophobicContact CG2-CG2 4.23Å; I156-V158 WeakPolarHBondContact CD1-O 3.42Å; I156-L161 HydrophobicContact CD1-CB 3.9Å; I156-L161 HydrophobicContact CD1-CD1 4.43Å; I156-I162 HydrophobicContact CD1-CD1 4.24Å; I156-I162 HydrophobicContact CD1-CG1 3.7Å; I156-Y171 PolarHBondContact N-OH 3.13Å; I156-Y171 PolarHBondContact O-OH 3.05Å; I156-S266 PolarHBondContact O-OG 2.71Å; I156-S266 VanDerWaalsContact O-OG 3.06Å; I156-L365 HydrophobicContact CG2-CD1 4.12Å; I156-L368 HydrophobicContact CG2-CD1 3.94Å
157	D	84.6	Confident	93.1	Very high	64 Å²	64	31.8 Å²	31.8	34%	0.342	15%	0.15	S	C	.	.	S	Bend	trans	-81.8	-35.5	173.1	-59.6	-29.2	0	0	0	110.8	V159 N273 P296	D157-V159 PolarHBondContact O-N 3.44Å; D157-N273 PolarHBondContact OD1-ND2 2.9Å; D157-P296 WeakPolarHBondContact OD1-CB 3.3Å; D157-P296 VanDerWaalsContact OD1-CG 3.29Å; D157-P296 WeakPolarHBondContact OD1-CG 3.33Å
158	V	86.3	Confident	93.2	Very high	46 Å²	46	28.5 Å²	28.5	28%	0.279	13%	0.133	S	C	.	.			trans	-92.9	81.3	-176	-167.6	0	0	0	0	111	I156 R160 L161	I156-V158 WeakPolarHBondContact CD1-O 3.42Å; V158-R160 HydrophobicContact CG1-CG 3.92Å; V158-R160 PolarHBondContact O-N 3.21Å; V158-L161 HydrophobicContact CB-CD1 4.19Å; V158-L161 HydrophobicContact CB-CG 4.26Å; V158-L161 HydrophobicContact CG1-CG 4.32Å; V158-L161 WeakPolarHBondContact O-CB 3.43Å; V158-L161 WeakPolarHBondContact O-CG 3.48Å; V158-L161 PolarHBondContact O-N 2.92Å
159	V	90.9	Very high	93.1	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-55.3	-26.6	-176.6	178.5	0	0	0	0	113.7	D157 L161 I162 L168 Y259 C262	D157-V159 PolarHBondContact O-N 3.44Å; V159-L161 PolarHBondContact O-N 3.26Å; V159-I162 HydrophobicContact CG1-CD1 4.48Å; V159-I162 WeakPolarHBondContact O-CG1 3.38Å; V159-I162 PolarHBondContact O-N 2.75Å; V159-L168 HydrophobicContact CG1-CD1 3.94Å; V159-Y259 HydrophobicContact CB-CE2 4.18Å; V159-Y259 HydrophobicContact CG1-CD2 3.92Å; V159-Y259 HydrophobicContact CG1-CE2 3.81Å; V159-C262 HydrophobicContact CB-CB 4.49Å; V159-C262 HydrophobicContact CG1-CB 3.71Å; V159-C262 HydrophobicContact CG2-CB 3.95Å
160	R	88.5	Confident	93	Very high	125 Å²	125	27.8 Å²	27.8	47%	0.472	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-58.6	-10.9	174.1	103.6	-170.4	78.9	-114.1	2.1	115	V158 Y259	V158-R160 HydrophobicContact CG1-CG 3.92Å; V158-R160 PolarHBondContact O-N 3.21Å; R160-Y259 HydrophobicContact CB-CE2 4.37Å
161	L	89	Confident	93	Very high	30 Å²	30	27.8 Å²	27.8	16%	0.157	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-77.2	-21.7	172.4	-60.2	175.3	0	0	0	113.1	I156 V158 V159 R163 G372	I156-L161 HydrophobicContact CD1-CB 3.9Å; I156-L161 HydrophobicContact CD1-CD1 4.43Å; V158-L161 HydrophobicContact CB-CD1 4.19Å; V158-L161 HydrophobicContact CB-CG 4.26Å; V158-L161 HydrophobicContact CG1-CG 4.32Å; V158-L161 WeakPolarHBondContact O-CB 3.43Å; V158-L161 WeakPolarHBondContact O-CG 3.48Å; V158-L161 PolarHBondContact O-N 2.92Å; V159-L161 PolarHBondContact O-N 3.26Å; L161-R163 PolarHBondContact O-N 3.36Å; L161-G372 VanDerWaalsContact CD2-CA 3.49Å
162	I	91.8	Very high	92.9	Very high	17 Å²	17	27.1 Å²	27.1	9%	0.087	13%	0.129	C	C	.	.			trans	-77.1	111.1	178	-46.4	-173.9	0	0	0	108.9	L102 I156 V159 L168 Y171	L102-I162 HydrophobicContact CD1-CB 4.23Å; L102-I162 HydrophobicContact CD1-CD1 3.99Å; L102-I162 HydrophobicContact CD1-CG1 3.73Å; L102-I162 HydrophobicContact CD1-CG2 3.81Å; I156-I162 HydrophobicContact CD1-CD1 4.24Å; I156-I162 HydrophobicContact CD1-CG1 3.7Å; V159-I162 HydrophobicContact CG1-CD1 4.48Å; V159-I162 WeakPolarHBondContact O-CG1 3.38Å; V159-I162 PolarHBondContact O-N 2.75Å; I162-L168 HydrophobicContact CD1-CD1 4.26Å; I162-L168 HydrophobicContact CG2-CB 4.02Å; I162-Y171 HydrophobicContact CD1-CD1 3.42Å; I162-Y171 VanDerWaalsContact CD1-CD1 3.42Å; I162-Y171 HydrophobicContact CD1-CD2 3.87Å; I162-Y171 HydrophobicContact CD1-CE1 3.84Å; I162-Y171 HydrophobicContact CD1-CE2 4.25Å; I162-Y171 HydrophobicContact CD1-CG 3.46Å; I162-Y171 VanDerWaalsContact CD1-CG 3.46Å
163	R	88.7	Confident	92.9	Very high	141 Å²	141	28.6 Å²	28.6	53%	0.532	14%	0.136	S	C	.	.			trans	-97.9	-32	-171.2	-73.9	169	172.8	-111.9	-26.3	113.7	D99 L161 P165 N375	D99-R163 PolarHBondContact OD1-N 3.23Å; D99-R163 VanDerWaalsContact OD1-N 3.12Å; L161-R163 PolarHBondContact O-N 3.36Å; R163-P165 WeakPolarHBondContact O-CD 3.46Å; R163-N375 VanDerWaalsContact CZ-CB 3.42Å; R163-N375 VanDerWaalsContact NH1-CG 3.34Å; R163-N375 PolarHBondContact NH1-OD1 3.09Å
164	C	93.1	Very high	92.9	Very high	8 Å²	8	27.8 Å²	27.8	5%	0.054	13%	0.133	C	C	.	.			trans	-84.1	125	179.2	-168.2	0	0	0	0	111	Q98 D99 V166 S167 L168	Q98-C164 HydrophobicContact CB-CB 4.11Å; Q98-C164 HydrophobicContact CG-CB 4.34Å; D99-C164 WeakPolarHBondContact OD2-CB 3.37Å; D99-C164 PolarHBondContact OD2-N 3.16Å; C164-V166 PolarHBondContact O-N 3.12Å; C164-V166 VanDerWaalsContact O-N 3.14Å; C164-S167 WeakPolarHBondContact CB-OG 3.45Å; C164-S167 WeakPolarHBondContact O-CA 3.38Å; C164-S167 WeakPolarHBondContact O-CB 3.31Å; C164-S167 PolarHBondContact O-N 2.81Å; C164-L168 PolarHBondContact O-N 3.27Å
165	P	94.2	Very high	92.9	Very high	71 Å²	71	27.8 Å²	27.8	46%	0.461	13%	0.133	S	C	.	.	H	α-helix	trans	-55.5	-31	174.4	-30.4	38.3	0	0	0	113.8	R163 A169	R163-P165 WeakPolarHBondContact O-CD 3.46Å; P165-A169 WeakPolarHBondContact O-CB 3.3Å; P165-A169 PolarHBondContact O-N 3.3Å
166	V	95.4	Very high	93	Very high	12 Å²	12	29 Å²	29	7%	0.073	14%	0.138	C	C	.	.	H	α-helix	trans	-66.8	-45.8	174.6	179.4	0	0	0	0	110.8	I23 I95 A97 C164 A169 H170	I23-V166 HydrophobicContact CG2-CG2 4.48Å; I95-V166 WeakPolarHBondContact O-CG1 3.44Å; A97-V166 HydrophobicContact CB-CG1 4.26Å; C164-V166 PolarHBondContact O-N 3.12Å; C164-V166 VanDerWaalsContact O-N 3.14Å; V166-A169 PolarHBondContact O-N 2.96Å; V166-H170 PolarHBondContact O-N 2.85Å; V166-H170 PolarHBondContact O-ND1 3.23Å
167	S	95.8	Very high	93.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-43.3	176.2	-58.2	0	0	0	0	111.2	D99 C164 A169 H170 Y171	D99-S167 WeakPolarHBondContact OD2-CB 3.38Å; D99-S167 PolarHBondContact OD2-OG 2.93Å; C164-S167 WeakPolarHBondContact CB-OG 3.45Å; C164-S167 WeakPolarHBondContact O-CA 3.38Å; C164-S167 WeakPolarHBondContact O-CB 3.31Å; C164-S167 PolarHBondContact O-N 2.81Å; S167-A169 VanDerWaalsContact C-N 3.34Å; S167-A169 PolarHBondContact O-N 3.15Å; S167-H170 PolarHBondContact O-N 3.03Å; S167-H170 VanDerWaalsContact O-N 3.17Å; S167-Y171 WeakPolarHBondContact O-CB 3.31Å; S167-Y171 PolarHBondContact O-N 3.03Å
168	L	96.1	Very high	93.5	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-43.2	176.5	-178.9	62.6	0	0	0	111.4	V159 I162 C164 H170 Y171 Y172 R258 C262	V159-L168 HydrophobicContact CG1-CD1 3.94Å; I162-L168 HydrophobicContact CD1-CD1 4.26Å; I162-L168 HydrophobicContact CG2-CB 4.02Å; C164-L168 PolarHBondContact O-N 3.27Å; L168-H170 VanDerWaalsContact C-N 3.34Å; L168-H170 PolarHBondContact O-N 2.72Å; L168-Y171 PolarHBondContact O-N 3.22Å; L168-Y172 VanDerWaalsContact O-CB 3.25Å; L168-Y172 WeakPolarHBondContact O-CB 3.45Å; L168-Y172 PolarHBondContact O-N 3.17Å; L168-R258 HydrophobicContact CG-CB 4.42Å; L168-C262 HydrophobicContact CD1-CB 4.33Å
169	A	96.1	Very high	93.8	Very high	2 Å²	2	26.7 Å²	26.7	2%	0.017	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-38.7	174.8	0	0	0	0	0	112.9	I23 P165 V166 S167 M173	I23-A169 HydrophobicContact CD1-CB 3.69Å; P165-A169 WeakPolarHBondContact O-CB 3.3Å; P165-A169 PolarHBondContact O-N 3.3Å; V166-A169 PolarHBondContact O-N 2.96Å; S167-A169 VanDerWaalsContact C-N 3.34Å; S167-A169 PolarHBondContact O-N 3.15Å; A169-M173 WeakPolarHBondContact O-CG 3.46Å; A169-M173 PolarHBondContact O-N 2.97Å; A169-M173 VanDerWaalsContact O-N 3.08Å
170	H	95.5	Very high	93.8	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.056	13%	0.132	C	C	.	.	H	α-helix	trans	-70.2	-38.9	176	-76.8	72	0	0	0	112.5	L69 F103 V166 S167 L168 M173 Q174	L69-H170 HydrophobicContact CD1-CB 3.84Å; F103-H170 HydrophobicContact CE1-CB 3.71Å; F103-H170 HydrophobicContact CZ-CB 3.65Å; V166-H170 PolarHBondContact O-N 2.85Å; V166-H170 PolarHBondContact O-ND1 3.23Å; S167-H170 PolarHBondContact O-N 3.03Å; S167-H170 VanDerWaalsContact O-N 3.17Å; L168-H170 VanDerWaalsContact C-N 3.34Å; L168-H170 PolarHBondContact O-N 2.72Å; H170-M173 HydrophobicContact CB-CE 4.37Å; H170-M173 PolarHBondContact O-N 2.69Å; H170-Q174 PolarHBondContact O-N 2.83Å
171	Y	96.3	Very high	93.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-45.6	174.9	-166.9	-102.5	0	0	0	111.3	V152 Y155 I156 I162 S167 L168 M173 Q174 L175 C262	V152-Y171 HydrophobicContact CB-CD2 4.46Å; V152-Y171 HydrophobicContact CG1-CD2 3.79Å; V152-Y171 HydrophobicContact CG1-CE2 3.65Å; V152-Y171 HydrophobicContact CG2-CD2 3.74Å; V152-Y171 HydrophobicContact CG2-CE2 4.38Å; Y155-Y171 AromaticContact CD1-CE2 4Å; Y155-Y171 HydrophobicContact CD1-CE2 4Å; I156-Y171 PolarHBondContact N-OH 3.13Å; I156-Y171 PolarHBondContact O-OH 3.05Å; I162-Y171 HydrophobicContact CD1-CD1 3.42Å; I162-Y171 VanDerWaalsContact CD1-CD1 3.42Å; I162-Y171 HydrophobicContact CD1-CD2 3.87Å; I162-Y171 HydrophobicContact CD1-CE1 3.84Å; I162-Y171 HydrophobicContact CD1-CE2 4.25Å; I162-Y171 HydrophobicContact CD1-CG 3.46Å; I162-Y171 VanDerWaalsContact CD1-CG 3.46Å; S167-Y171 WeakPolarHBondContact O-CB 3.31Å; S167-Y171 PolarHBondContact O-N 3.03Å; L168-Y171 PolarHBondContact O-N 3.22Å; Y171-M173 PolarHBondContact O-N 3.35Å; Y171-Q174 PolarHBondContact O-N 2.61Å; Y171-L175 HydrophobicContact CD1-CD1 3.56Å; Y171-L175 HydrophobicContact CD1-CG 4.3Å; Y171-L175 HydrophobicContact CE1-CD1 3.31Å; Y171-L175 HydrophobicContact CE1-CG 4.18Å; Y171-L175 WeakPolarHBondContact O-CG 3.19Å; Y171-L175 PolarHBondContact O-N 2.9Å; Y171-C262 HydrophobicContact CD1-CB 4.28Å; Y171-C262 HydrophobicContact CE1-CB 4.46Å
172	Y	96.9	Very high	93.5	Very high	2 Å²	2	27 Å²	27	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-53.9	-48.7	171.4	161.4	-98.3	0	0	0	112.7	L168 Q174 L175 R176 A200 A203 D204 R258 F261 C262	L168-Y172 VanDerWaalsContact O-CB 3.25Å; L168-Y172 WeakPolarHBondContact O-CB 3.45Å; L168-Y172 PolarHBondContact O-N 3.17Å; Y172-Q174 VanDerWaalsContact C-N 3.33Å; Y172-Q174 PolarHBondContact O-N 3.07Å; Y172-L175 PolarHBondContact O-N 3.27Å; Y172-R176 VanDerWaalsContact CE1-NH1 3.28Å; Y172-R176 PolarHBondContact O-N 2.88Å; Y172-R176 PolarHBondContact OH-NH1 3.33Å; Y172-A200 HydrophobicContact CE2-CB 4.23Å; Y172-A200 VanDerWaalsContact OH-CA 3.25Å; Y172-A200 WeakPolarHBondContact OH-CA 3.47Å; Y172-A200 VanDerWaalsContact OH-CB 3.32Å; Y172-A200 WeakPolarHBondContact OH-CB 3.36Å; Y172-A200 PolarHBondContact OH-O 3.48Å; Y172-A203 HydrophobicContact CE1-CB 4.2Å; Y172-A203 HydrophobicContact CE2-CB 3.79Å; Y172-D204 WeakPolarHBondContact CE1-OD1 3.41Å; Y172-D204 PolarHBondContact OH-OD1 3.44Å; Y172-R258 HydrophobicContact CD1-CG 3.92Å; Y172-R258 HydrophobicContact CD2-CB 4.23Å; Y172-R258 HydrophobicContact CD2-CG 3.91Å; Y172-R258 HydrophobicContact CE1-CG 4.29Å; Y172-R258 HydrophobicContact CE2-CG 4.28Å; Y172-R258 HydrophobicContact CG-CB 4.17Å; Y172-R258 HydrophobicContact CG-CG 3.73Å; Y172-F261 HydrophobicContact CD2-CB 4.02Å; Y172-F261 AromaticContact CD2-CD1 3.47Å; Y172-F261 HydrophobicContact CD2-CD1 3.47Å; Y172-F261 VanDerWaalsContact CD2-CD1 3.47Å; Y172-F261 HydrophobicContact CD2-CD2 4.48Å; Y172-F261 HydrophobicContact CD2-CE1 4.03Å; Y172-F261 AromaticContact CD2-CG 3.74Å; Y172-F261 HydrophobicContact CD2-CG 3.74Å; Y172-F261 HydrophobicContact CE2-CB 4.09Å; Y172-F261 AromaticContact CE2-CD1 3.78Å; Y172-F261 HydrophobicContact CE2-CD1 3.78Å; Y172-F261 AromaticContact CE2-CD2 3.98Å; Y172-F261 HydrophobicContact CE2-CD2 3.98Å; Y172-F261 HydrophobicContact CE2-CE1 4.19Å; Y172-F261 HydrophobicContact CE2-CE2 4.37Å; Y172-F261 AromaticContact CE2-CG 3.67Å; Y172-F261 HydrophobicContact CE2-CG 3.67Å; Y172-F261 HydrophobicContact CE2-CZ 4.48Å; Y172-C262 VanDerWaalsContact CA-SG 3.58Å
173	M	95.9	Very high	93.3	Very high	31 Å²	31	26.9 Å²	26.9	15%	0.153	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-39.8	178.2	-73.5	-177.1	-67.2	0	0	112.4	L69 T70 A169 H170 Y171 E177	L69-M173 HydrophobicContact CB-CB 4.41Å; L69-M173 HydrophobicContact CB-CE 4.16Å; T70-M173 HydrophobicContact CG2-CE 3.68Å; T70-M173 HydrophobicContact CG2-SD 3.81Å; A169-M173 WeakPolarHBondContact O-CG 3.46Å; A169-M173 PolarHBondContact O-N 2.97Å; A169-M173 VanDerWaalsContact O-N 3.08Å; H170-M173 HydrophobicContact CB-CE 4.37Å; H170-M173 PolarHBondContact O-N 2.69Å; Y171-M173 PolarHBondContact O-N 3.35Å; M173-E177 PolarHBondContact O-N 2.79Å; M173-E177 VanDerWaalsContact O-N 3.14Å
174	Q	96	Very high	92.9	Very high	9 Å²	9	21.9 Å²	21.9	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-44.5	173.8	-175.8	63.5	74.7	0	0	112	L69 V152 Y155 H170 Y171 Y172 R176 E177 N178	L69-Q174 HydrophobicContact CD2-CB 3.87Å; L69-Q174 HydrophobicContact CD2-CG 4.44Å; L69-Q174 VanDerWaalsContact CD2-OE1 3.28Å; V152-Q174 HydrophobicContact CB-CB 4.39Å; V152-Q174 HydrophobicContact CB-CG 4Å; V152-Q174 HydrophobicContact CG2-CB 3.58Å; V152-Q174 HydrophobicContact CG2-CG 3.75Å; Y155-Q174 HydrophobicContact CE1-CG 3.99Å; Y155-Q174 WeakPolarHBondContact OH-CG 3.37Å; H170-Q174 PolarHBondContact O-N 2.83Å; Y171-Q174 PolarHBondContact O-N 2.61Å; Y172-Q174 VanDerWaalsContact C-N 3.33Å; Y172-Q174 PolarHBondContact O-N 3.07Å; Q174-R176 VanDerWaalsContact C-N 3.34Å; Q174-R176 PolarHBondContact O-N 3.19Å; Q174-E177 WeakPolarHBondContact O-CB 3.49Å; Q174-E177 PolarHBondContact O-N 3.41Å; Q174-N178 PolarHBondContact NE2-OD1 3.22Å; Q174-N178 PolarHBondContact O-N 3.35Å; Q174-N178 PolarHBondContact O-OD1 2.95Å; Q174-N178 VanDerWaalsContact O-OD1 3.13Å
175	L	95.3	Very high	92.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.6	-33.5	-179.3	-71.7	177	0	0	0	112.1	Y155 Y171 Y172 N178 V179 F261 C262 V265 V272	Y155-L175 HydrophobicContact CD1-CD2 4.2Å; Y155-L175 HydrophobicContact CE1-CD2 4.08Å; Y171-L175 HydrophobicContact CD1-CD1 3.56Å; Y171-L175 HydrophobicContact CD1-CG 4.3Å; Y171-L175 HydrophobicContact CE1-CD1 3.31Å; Y171-L175 HydrophobicContact CE1-CG 4.18Å; Y171-L175 WeakPolarHBondContact O-CG 3.19Å; Y171-L175 PolarHBondContact O-N 2.9Å; Y172-L175 PolarHBondContact O-N 3.27Å; L175-N178 PolarHBondContact O-N 2.92Å; L175-V179 WeakPolarHBondContact O-CG2 3.36Å; L175-V179 PolarHBondContact O-N 2.8Å; L175-F261 HydrophobicContact CB-CE1 4Å; L175-C262 HydrophobicContact CD1-CB 4.06Å; L175-V265 HydrophobicContact CB-CG2 4Å; L175-V265 HydrophobicContact CD1-CG2 3.76Å; L175-V265 HydrophobicContact CD2-CG2 4.32Å; L175-V265 HydrophobicContact CG-CG2 4.26Å; L175-V272 HydrophobicContact CD2-CG1 3.91Å; L175-V272 WeakPolarHBondContact CD2-O 3.48Å
176	R	95.2	Very high	91.4	Very high	32 Å²	32	28.3 Å²	28.3	12%	0.121	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-43.2	171.8	-168.5	171.4	83.9	-151	17.3	112.1	Y172 Q174 N178 V179 R180 D204 L223 F261	Y172-R176 VanDerWaalsContact CE1-NH1 3.28Å; Y172-R176 PolarHBondContact O-N 2.88Å; Y172-R176 PolarHBondContact OH-NH1 3.33Å; Q174-R176 VanDerWaalsContact C-N 3.34Å; Q174-R176 PolarHBondContact O-N 3.19Å; R176-N178 VanDerWaalsContact C-N 3.28Å; R176-N178 PolarHBondContact O-N 2.98Å; R176-V179 PolarHBondContact O-N 3.42Å; R176-R180 WeakPolarHBondContact O-CD 3.46Å; R176-R180 VanDerWaalsContact O-CG 3.23Å; R176-R180 WeakPolarHBondContact O-CG 3.48Å; R176-R180 PolarHBondContact O-N 3.45Å; R176-D204 IonicContact CZ-OD1 3.23Å; R176-D204 IonicContact CZ-OD2 3.76Å; R176-D204 VanDerWaalsContact CZ-OD2 3.26Å; R176-D204 IonicContact NH1-OD1 3.72Å; R176-D204 PolarHBondContact NH1-OD1 3.33Å; R176-D204 IonicContact NH1-OD2 2.67Å; R176-D204 PolarHBondContact NH1-OD2 3.45Å; R176-D204 IonicContact NH2-OD2 2.74Å; R176-D204 PolarHBondContact NH2-OD2 2.99Å; R176-L223 PolarHBondContact NE-O 3.42Å; R176-F261 HydrophobicContact CB-CE1 4.38Å; R176-F261 HydrophobicContact CB-CZ 4.03Å; R176-F261 HydrophobicContact CG-CZ 4.36Å
177	E	93.5	Very high	90.5	Very high	54 Å²	54	29.1 Å²	29.1	25%	0.252	14%	0.143	S	C	.	.	H	α-helix	trans	-59.1	-40.5	172.3	-170.9	78.1	152.6	0	0	111.4	M173 Q174 R180 S181	M173-E177 PolarHBondContact O-N 2.79Å; M173-E177 VanDerWaalsContact O-N 3.14Å; Q174-E177 WeakPolarHBondContact O-CB 3.49Å; Q174-E177 PolarHBondContact O-N 3.41Å; E177-R180 IonicContact OE2-CZ 2.9Å; E177-R180 IonicContact OE2-NH1 3.82Å; E177-R180 PolarHBondContact OE2-NH1 3.36Å; E177-S181 WeakPolarHBondContact O-CB 3.49Å; E177-S181 PolarHBondContact O-N 3.46Å; E177-S181 PolarHBondContact O-OG 3.38Å
178	N	92.4	Very high	89.8	Confident	6 Å²	6	29.7 Å²	29.7	3%	0.032	15%	0.147	C	C	.	.	H	α-helix	trans	-68.2	-44.8	177.5	-65.6	-0.2	0	0	0	112	Y155 Q174 L175 R176 R180 S181 Q182 V272	Y155-N178 PolarHBondContact OH-ND2 2.95Å; Q174-N178 PolarHBondContact NE2-OD1 3.22Å; Q174-N178 PolarHBondContact O-N 3.35Å; Q174-N178 PolarHBondContact O-OD1 2.95Å; Q174-N178 VanDerWaalsContact O-OD1 3.13Å; L175-N178 PolarHBondContact O-N 2.92Å; R176-N178 VanDerWaalsContact C-N 3.28Å; R176-N178 PolarHBondContact O-N 2.98Å; N178-R180 VanDerWaalsContact C-N 3.32Å; N178-R180 PolarHBondContact O-N 3.35Å; N178-S181 PolarHBondContact O-N 2.91Å; N178-S181 VanDerWaalsContact O-N 3.15Å; N178-S181 PolarHBondContact O-OG 2.66Å; N178-Q182 HydrophobicContact CB-CG 4.46Å; N178-Q182 WeakPolarHBondContact O-CA 3.02Å; N178-Q182 WeakPolarHBondContact O-CB 3.35Å; N178-Q182 WeakPolarHBondContact O-CG 3Å; N178-Q182 PolarHBondContact O-N 3.18Å; N178-Q182 PolarHBondContact OD1-NE2 3.41Å; N178-V272 HydrophobicContact CB-CB 4.33Å; N178-V272 HydrophobicContact CB-CG1 4Å; N178-V272 HydrophobicContact CB-CG2 4.13Å; N178-V272 PolarHBondContact ND2-O 3.31Å
179	V	92.9	Very high	89.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-51	-52	174.6	160.8	0	0	0	0	110.7	L175 R176 S181 W183 V196 P226 F261 V265 V272	L175-V179 WeakPolarHBondContact O-CG2 3.36Å; L175-V179 PolarHBondContact O-N 2.8Å; R176-V179 PolarHBondContact O-N 3.42Å; V179-S181 VanDerWaalsContact C-N 3.26Å; V179-S181 PolarHBondContact O-N 2.77Å; V179-W183 HydrophobicContact CB-CD2 4.43Å; V179-W183 HydrophobicContact CB-CE3 4.48Å; V179-W183 HydrophobicContact CG1-CD2 4.05Å; V179-W183 HydrophobicContact CG1-CE3 3.65Å; V179-W183 HydrophobicContact CG1-CZ3 4.02Å; V179-W183 HydrophobicContact CG2-CD2 4.14Å; V179-W183 HydrophobicContact CG2-CE3 4.32Å; V179-W183 HydrophobicContact CG2-CH2 4.3Å; V179-W183 HydrophobicContact CG2-CZ2 4.11Å; V179-W183 HydrophobicContact CG2-CZ3 4.4Å; V179-W183 WeakPolarHBondContact O-CB 3.32Å; V179-W183 PolarHBondContact O-N 2.92Å; V179-V196 HydrophobicContact CG1-CG2 4.42Å; V179-P226 HydrophobicContact CG1-CG 4.36Å; V179-F261 HydrophobicContact CG2-CZ 4.15Å; V179-V265 HydrophobicContact CG2-CB 4.48Å; V179-V265 HydrophobicContact CG2-CG1 3.94Å; V179-V272 HydrophobicContact CG2-CG1 4.05Å; V179-V272 HydrophobicContact CG2-CG2 4.37Å
180	R	91.7	Very high	88.9	Confident	61 Å²	61	35.5 Å²	35.5	23%	0.23	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-33.3	-178.2	-62	161.7	71.2	-152.4	2.5	113.7	R176 E177 N178 E222 L223	R176-R180 WeakPolarHBondContact O-CD 3.46Å; R176-R180 VanDerWaalsContact O-CG 3.23Å; R176-R180 WeakPolarHBondContact O-CG 3.48Å; R176-R180 PolarHBondContact O-N 3.45Å; E177-R180 IonicContact OE2-CZ 2.9Å; E177-R180 IonicContact OE2-NH1 3.82Å; E177-R180 PolarHBondContact OE2-NH1 3.36Å; N178-R180 VanDerWaalsContact C-N 3.32Å; N178-R180 PolarHBondContact O-N 3.35Å; R180-E222 PolarHBondContact NE-O 3.01Å; R180-E222 PolarHBondContact NH2-O 2.78Å; R180-L223 WeakPolarHBondContact CD-O 3.41Å
181	S	86.8	Confident	88.5	Confident	69 Å²	69	37 Å²	37	48%	0.483	18%	0.176	S	C	.	.	H	α-helix	trans	-108.1	-12.8	-168.2	59.6	0	0	0	0	115	E177 N178 V179	E177-S181 WeakPolarHBondContact O-CB 3.49Å; E177-S181 PolarHBondContact O-N 3.46Å; E177-S181 PolarHBondContact O-OG 3.38Å; N178-S181 PolarHBondContact O-N 2.91Å; N178-S181 VanDerWaalsContact O-N 3.15Å; N178-S181 PolarHBondContact O-OG 2.66Å; V179-S181 VanDerWaalsContact C-N 3.26Å; V179-S181 PolarHBondContact O-N 2.77Å
182	Q	84.9	Confident	88.2	Confident	36 Å²	36	39.1 Å²	39.1	17%	0.168	18%	0.184	C	C	.	.	H	α-helix	trans	-129	-21.9	-171.7	-51.6	176.5	11.1	0	0	113.9	N178 A271 V272 I276	N178-Q182 HydrophobicContact CB-CG 4.46Å; N178-Q182 WeakPolarHBondContact O-CA 3.02Å; N178-Q182 WeakPolarHBondContact O-CB 3.35Å; N178-Q182 WeakPolarHBondContact O-CG 3Å; N178-Q182 PolarHBondContact O-N 3.18Å; N178-Q182 PolarHBondContact OD1-NE2 3.41Å; Q182-A271 PolarHBondContact OE1-O 3.19Å; Q182-V272 HydrophobicContact CB-CG2 4.06Å; Q182-I276 HydrophobicContact CB-CD1 4.34Å; Q182-I276 HydrophobicContact CG-CD1 3.98Å
183	W	87	Confident	88	Confident	14 Å²	14	39 Å²	39	5%	0.053	18%	0.184	C	C	.	.			trans	-74	137.1	170.3	-79.6	-1.9	0	0	0	111.3	V179 V188 R192 V196 P226 W228 V265 V272	V179-W183 HydrophobicContact CB-CD2 4.43Å; V179-W183 HydrophobicContact CB-CE3 4.48Å; V179-W183 HydrophobicContact CG1-CD2 4.05Å; V179-W183 HydrophobicContact CG1-CE3 3.65Å; V179-W183 HydrophobicContact CG1-CZ3 4.02Å; V179-W183 HydrophobicContact CG2-CD2 4.14Å; V179-W183 HydrophobicContact CG2-CE3 4.32Å; V179-W183 HydrophobicContact CG2-CH2 4.3Å; V179-W183 HydrophobicContact CG2-CZ2 4.11Å; V179-W183 HydrophobicContact CG2-CZ3 4.4Å; V179-W183 WeakPolarHBondContact O-CB 3.32Å; V179-W183 PolarHBondContact O-N 2.92Å; W183-V188 HydrophobicContact CB-CG2 4.19Å; W183-V188 HydrophobicContact CD2-CB 4.23Å; W183-V188 HydrophobicContact CD2-CG1 3.97Å; W183-V188 HydrophobicContact CD2-CG2 3.75Å; W183-V188 HydrophobicContact CE3-CB 4.38Å; W183-V188 HydrophobicContact CE3-CG1 3.73Å; W183-V188 HydrophobicContact CE3-CG2 4.37Å; W183-V188 HydrophobicContact CG-CB 4.32Å; W183-V188 HydrophobicContact CG-CG2 3.65Å; W183-V188 HydrophobicContact CH2-CG1 4.29Å; W183-V188 HydrophobicContact CZ2-CG1 4.5Å; W183-V188 HydrophobicContact CZ3-CG1 3.9Å; W183-R192 HydrophobicContact CH2-CG 3.93Å; W183-R192 HydrophobicContact CZ3-CG 4.3Å; W183-V196 HydrophobicContact CH2-CB 4.4Å; W183-V196 HydrophobicContact CH2-CG1 3.93Å; W183-V196 HydrophobicContact CH2-CG2 3.65Å; W183-V196 HydrophobicContact CZ3-CG2 3.48Å; W183-V196 VanDerWaalsContact CZ3-CG2 3.48Å; W183-P226 HydrophobicContact CB-CB 4.37Å; W183-P226 HydrophobicContact CB-CG 3.8Å; W183-P226 HydrophobicContact CE3-CG 4.19Å; W183-W228 PolarHBondContact O-NE1 2.86Å; W183-V265 HydrophobicContact CH2-CG1 3.95Å; W183-V265 HydrophobicContact CZ2-CB 4.21Å; W183-V265 HydrophobicContact CZ2-CG1 3.79Å; W183-V272 HydrophobicContact CG-CG2 4.12Å; W183-V272 VanDerWaalsContact NE1-CG2 3.32Å
184	Q	80	Confident	87.9	Confident	35 Å²	35	37.9 Å²	37.9	16%	0.164	18%	0.178	C	C	.	.			trans	-136.2	150.6	-174.6	-58.8	-174.9	18	0	0	109.5	L186 L187 V188	Q184-L186 PolarHBondContact O-N 3.29Å; Q184-L186 VanDerWaalsContact O-N 3.16Å; Q184-L187 HydrophobicContact CB-CD1 4.49Å; Q184-L187 PolarHBondContact O-N 3.27Å; Q184-V188 PolarHBondContact O-N 3.25Å; Q184-V188 VanDerWaalsContact O-N 3.07Å
185	E	80	Confident	87.7	Confident	121 Å²	121	39.7 Å²	39.7	57%	0.565	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-36.4	-172	-172.4	170.8	-164.6	0	0	113.8	L187 W228	E185-L187 VanDerWaalsContact C-N 3.31Å; E185-L187 PolarHBondContact O-N 3.45Å; E185-W228 HydrophobicContact CB-CD2 3.77Å; E185-W228 HydrophobicContact CB-CE3 3.72Å; E185-W228 HydrophobicContact CB-CG 4.24Å; E185-W228 HydrophobicContact CB-CH2 4.4Å; E185-W228 HydrophobicContact CB-CZ2 4.45Å; E185-W228 HydrophobicContact CB-CZ3 4.04Å; E185-W228 HydrophobicContact CG-CD2 4.37Å; E185-W228 HydrophobicContact CG-CE3 3.8Å; E185-W228 HydrophobicContact CG-CH2 4.42Å; E185-W228 HydrophobicContact CG-CZ3 3.82Å
186	L	76	Confident	87.7	Confident	94 Å²	94	39.7 Å²	39.7	49%	0.492	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-17.1	178.1	-59.6	178.6	0	0	0	114.2	Q184 F311	Q184-L186 PolarHBondContact O-N 3.29Å; Q184-L186 VanDerWaalsContact O-N 3.16Å; L186-F311 WeakPolarHBondContact O-CE1 3.48Å; L186-F311 WeakPolarHBondContact O-CZ 3.16Å
187	L	75.4	Confident	87.7	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.147	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-30	-173.4	-59.1	179.2	0	0	0	112.4	Q184 E185 C270 F311	Q184-L187 HydrophobicContact CB-CD1 4.49Å; Q184-L187 PolarHBondContact O-N 3.27Å; E185-L187 VanDerWaalsContact C-N 3.31Å; E185-L187 PolarHBondContact O-N 3.45Å; L187-C270 PolarHBondContact O-SG 2.84Å; L187-C270 VanDerWaalsContact O-SG 3.4Å; L187-F311 HydrophobicContact CD2-CD1 3.76Å; L187-F311 HydrophobicContact CD2-CE1 4.04Å; L187-F311 HydrophobicContact CD2-CG 4.36Å
188	V	81.1	Confident	87.9	Confident	12 Å²	12	35.7 Å²	35.7	7%	0.073	17%	0.169	C	C	.	.	S	Bend	trans	-133.4	127.4	-173.5	-178	0	0	0	0	111.4	W183 Q184 R192 W228 C270	W183-V188 HydrophobicContact CB-CG2 4.19Å; W183-V188 HydrophobicContact CD2-CB 4.23Å; W183-V188 HydrophobicContact CD2-CG1 3.97Å; W183-V188 HydrophobicContact CD2-CG2 3.75Å; W183-V188 HydrophobicContact CE3-CB 4.38Å; W183-V188 HydrophobicContact CE3-CG1 3.73Å; W183-V188 HydrophobicContact CE3-CG2 4.37Å; W183-V188 HydrophobicContact CG-CB 4.32Å; W183-V188 HydrophobicContact CG-CG2 3.65Å; W183-V188 HydrophobicContact CH2-CG1 4.29Å; W183-V188 HydrophobicContact CZ2-CG1 4.5Å; W183-V188 HydrophobicContact CZ3-CG1 3.9Å; Q184-V188 PolarHBondContact O-N 3.25Å; Q184-V188 VanDerWaalsContact O-N 3.07Å; V188-R192 HydrophobicContact CG1-CB 3.87Å; V188-R192 HydrophobicContact CG1-CG 3.93Å; V188-W228 WeakPolarHBondContact O-CH2 3.47Å; V188-W228 WeakPolarHBondContact O-CZ2 3.17Å; V188-C270 HydrophobicContact CG2-CB 4.25Å; V188-C270 WeakPolarHBondContact CG2-SG 3.22Å
189	R	84.5	Confident	88.1	Confident	106 Å²	106	35.6 Å²	35.6	40%	0.4	17%	0.168	S	C	.	.			trans	-63	143.1	174.9	-64.7	-178.9	59.1	82.8	-4.2	111.3	E191 R192 D882	R189-E191 VanDerWaalsContact C-N 3.32Å; R189-E191 IonicContact CZ-OE2 3.86Å; R189-E191 IonicContact NE-OE2 2.94Å; R189-E191 PolarHBondContact NE-OE2 3.13Å; R189-E191 IonicContact NH2-OE1 2.68Å; R189-E191 IonicContact NH2-OE2 2.85Å; R189-E191 PolarHBondContact NH2-OE2 2.89Å; R189-E191 PolarHBondContact O-N 3.46Å; R189-R192 VanDerWaalsContact O-CB 3.29Å; R189-R192 WeakPolarHBondContact O-CB 3.46Å; R189-R192 PolarHBondContact O-N 3.34Å; R189-R192 VanDerWaalsContact O-N 3.08Å; R189-D882 IonicContact NH2-OD1 2.84Å; R189-D882 IonicContact NH2-OD2 3.96Å
190	E	89.1	Confident	88.3	Confident	23 Å²	23	35.5 Å²	35.5	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-39.4	-176	-156.6	-162.9	140.1	0	0	112.2	R192 C193 Y194 W228 V229 R233	E190-R192 PolarHBondContact O-N 3.28Å; E190-R192 VanDerWaalsContact O-N 3.14Å; E190-C193 WeakPolarHBondContact O-CA 3.35Å; E190-C193 VanDerWaalsContact O-CB 3.24Å; E190-C193 WeakPolarHBondContact O-CB 3.32Å; E190-C193 PolarHBondContact O-N 2.82Å; E190-Y194 HydrophobicContact CG-CE2 3.83Å; E190-Y194 WeakPolarHBondContact O-CD2 3.25Å; E190-Y194 PolarHBondContact O-N 3.09Å; E190-Y194 WeakPolarHBondContact OE1-CE2 3.4Å; E190-Y194 PolarHBondContact OE1-OH 2.82Å; E190-W228 HydrophobicContact CB-CH2 4.11Å; E190-W228 HydrophobicContact CB-CZ3 4.34Å; E190-W228 HydrophobicContact CG-CH2 4.17Å; E190-W228 HydrophobicContact CG-CZ3 4.13Å; E190-V229 HydrophobicContact CG-CG1 3.94Å; E190-V229 HydrophobicContact CG-CG2 4.28Å; E190-R233 VanDerWaalsContact CD-NE 3.3Å; E190-R233 VanDerWaalsContact OE1-CG 3.31Å; E190-R233 WeakPolarHBondContact OE1-CG 3.4Å; E190-R233 IonicContact OE1-CZ 2.67Å; E190-R233 IonicContact OE1-NE 2.89Å; E190-R233 PolarHBondContact OE1-NE 3.25Å; E190-R233 IonicContact OE1-NH2 2.65Å; E190-R233 IonicContact OE2-CZ 2.73Å; E190-R233 VanDerWaalsContact OE2-CZ 3.26Å; E190-R233 IonicContact OE2-NE 3.79Å; E190-R233 PolarHBondContact OE2-NE 3.11Å; E190-R233 IonicContact OE2-NH2 3.23Å; E190-R233 PolarHBondContact OE2-NH2 2.9Å
191	E	88.3	Confident	88.5	Confident	44 Å²	44	32.6 Å²	32.6	21%	0.206	16%	0.157	C	C	.	.	H	α-helix	trans	-53.3	-37.5	176.4	-44.2	84.2	-103.1	0	0	112	R189 C193 Y194 E195 L885	R189-E191 VanDerWaalsContact C-N 3.32Å; R189-E191 IonicContact CZ-OE2 3.86Å; R189-E191 IonicContact NE-OE2 2.94Å; R189-E191 PolarHBondContact NE-OE2 3.13Å; R189-E191 IonicContact NH2-OE1 2.68Å; R189-E191 IonicContact NH2-OE2 2.85Å; R189-E191 PolarHBondContact NH2-OE2 2.89Å; R189-E191 PolarHBondContact O-N 3.46Å; E191-C193 VanDerWaalsContact C-N 3.29Å; E191-C193 PolarHBondContact O-N 2.97Å; E191-Y194 PolarHBondContact O-N 2.84Å; E191-Y194 VanDerWaalsContact O-N 3.12Å; E191-E195 PolarHBondContact O-N 3.03Å; E191-E195 VanDerWaalsContact O-N 3.07Å; E191-L885 HydrophobicContact CG-CD2 4.21Å
192	R	89.6	Confident	89	Confident	44 Å²	44	29.3 Å²	29.3	17%	0.166	13%	0.134	C	C	.	.	H	α-helix	trans	-66.6	-30.9	179.1	-175.2	51.5	162.3	167.9	-11.4	112.4	W183 V188 R189 E190 E195 V196 D264 R588	W183-R192 HydrophobicContact CH2-CG 3.93Å; W183-R192 HydrophobicContact CZ3-CG 4.3Å; V188-R192 HydrophobicContact CG1-CB 3.87Å; V188-R192 HydrophobicContact CG1-CG 3.93Å; R189-R192 VanDerWaalsContact O-CB 3.29Å; R189-R192 WeakPolarHBondContact O-CB 3.46Å; R189-R192 PolarHBondContact O-N 3.34Å; R189-R192 VanDerWaalsContact O-N 3.08Å; E190-R192 PolarHBondContact O-N 3.28Å; E190-R192 VanDerWaalsContact O-N 3.14Å; R192-E195 WeakPolarHBondContact CD-OE2 3.38Å; R192-E195 IonicContact CZ-OE2 3.87Å; R192-E195 IonicContact NE-OE2 3.04Å; R192-E195 IonicContact NH1-OE2 3.26Å; R192-E195 PolarHBondContact NH1-OE2 3.16Å; R192-E195 PolarHBondContact O-N 3.47Å; R192-V196 PolarHBondContact O-N 3.11Å; R192-D264 VanDerWaalsContact CZ-CG 3.45Å; R192-D264 IonicContact CZ-OD1 3.94Å; R192-D264 IonicContact CZ-OD2 3.93Å; R192-D264 IonicContact NH1-OD1 2.8Å; R192-D264 PolarHBondContact NH1-OD1 2.8Å; R192-D264 IonicContact NH1-OD2 3.44Å; R192-D264 PolarHBondContact NH1-OD2 3.17Å; R192-D264 VanDerWaalsContact NH2-C 3.31Å; R192-D264 VanDerWaalsContact NH2-CA 3.33Å; R192-D264 PolarHBondContact NH2-O 3.2Å; R192-D264 IonicContact NH2-OD1 2.77Å; R192-D264 PolarHBondContact NH2-OD1 2.93Å; R192-D264 IonicContact NH2-OD2 3.58Å; R192-R588 VanDerWaalsContact CZ-NH2 3.27Å
193	C	92.8	Very high	89.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-39.1	172.4	-58.8	0	0	0	0	111.2	E190 E191 A197 F225 V229	E190-C193 WeakPolarHBondContact O-CA 3.35Å; E190-C193 VanDerWaalsContact O-CB 3.24Å; E190-C193 WeakPolarHBondContact O-CB 3.32Å; E190-C193 PolarHBondContact O-N 2.82Å; E191-C193 VanDerWaalsContact C-N 3.29Å; E191-C193 PolarHBondContact O-N 2.97Å; C193-A197 WeakPolarHBondContact O-CB 3.34Å; C193-A197 PolarHBondContact O-N 3.39Å; C193-F225 HydrophobicContact CB-CD1 3.82Å; C193-F225 HydrophobicContact CB-CE1 3.85Å; C193-V229 HydrophobicContact CB-CG2 4.16Å
194	Y	93.8	Very high	89.9	Confident	7 Å²	7	28.5 Å²	28.5	3%	0.027	13%	0.132	C	C	.	.	H	α-helix	trans	-68.5	-41.1	174.8	-64	-90.5	0	0	0	112.8	E190 E191 V196 A197 A198 F225 L238 I245 L885	E190-Y194 HydrophobicContact CG-CE2 3.83Å; E190-Y194 WeakPolarHBondContact O-CD2 3.25Å; E190-Y194 PolarHBondContact O-N 3.09Å; E190-Y194 WeakPolarHBondContact OE1-CE2 3.4Å; E190-Y194 PolarHBondContact OE1-OH 2.82Å; E191-Y194 PolarHBondContact O-N 2.84Å; E191-Y194 VanDerWaalsContact O-N 3.12Å; Y194-V196 PolarHBondContact O-N 2.76Å; Y194-A197 PolarHBondContact O-N 3.28Å; Y194-A198 WeakPolarHBondContact O-CB 3.25Å; Y194-A198 PolarHBondContact O-N 3.37Å; Y194-F225 AromaticContact CD1-CE1 3.9Å; Y194-F225 HydrophobicContact CD1-CE1 3.9Å; Y194-F225 AromaticContact CD1-CZ 3.59Å; Y194-F225 HydrophobicContact CD1-CZ 3.59Å; Y194-F225 HydrophobicContact CD2-CE1 4.3Å; Y194-F225 HydrophobicContact CE1-CE1 4.04Å; Y194-F225 AromaticContact CE1-CZ 3.92Å; Y194-F225 HydrophobicContact CE1-CZ 3.92Å; Y194-F225 HydrophobicContact CE2-CE1 4.44Å; Y194-F225 HydrophobicContact CG-CE1 4.01Å; Y194-F225 HydrophobicContact CG-CZ 4.03Å; Y194-L238 HydrophobicContact CE1-CD2 3.6Å; Y194-L238 WeakPolarHBondContact OH-CD2 3.46Å; Y194-I245 HydrophobicContact CD1-CD1 4.05Å; Y194-I245 HydrophobicContact CG-CD1 4.12Å; Y194-L885 HydrophobicContact CE2-CD1 4.15Å
195	E	92.2	Very high	90.5	Very high	46 Å²	46	29.2 Å²	29.2	22%	0.215	13%	0.134	C	C	.	.	H	α-helix	trans	-55.1	-52.3	176.7	-68.6	-173.4	156.4	0	0	111.5	E191 R192 A198 L199 R588	E191-E195 PolarHBondContact O-N 3.03Å; E191-E195 VanDerWaalsContact O-N 3.07Å; R192-E195 WeakPolarHBondContact CD-OE2 3.38Å; R192-E195 IonicContact CZ-OE2 3.87Å; R192-E195 IonicContact NE-OE2 3.04Å; R192-E195 IonicContact NH1-OE2 3.26Å; R192-E195 PolarHBondContact NH1-OE2 3.16Å; R192-E195 PolarHBondContact O-N 3.47Å; E195-A198 PolarHBondContact O-N 2.82Å; E195-L199 WeakPolarHBondContact O-CG 3.23Å; E195-L199 PolarHBondContact O-N 3.33Å; E195-L199 VanDerWaalsContact O-N 3.07Å; E195-R588 IonicContact OE1-CZ 3.36Å; E195-R588 IonicContact OE1-NH1 3.26Å; E195-R588 PolarHBondContact OE1-NH1 3.05Å; E195-R588 IonicContact OE2-CZ 2.67Å; E195-R588 IonicContact OE2-NH1 2.84Å; E195-R588 PolarHBondContact OE2-NH1 3.37Å; E195-R588 IonicContact OE2-NH2 3.23Å; E195-R588 PolarHBondContact OE2-NH2 3.28Å
196	V	94.2	Very high	91.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-76.8	-27.5	-177.3	-53.7	0	0	0	0	112.6	V179 W183 R192 Y194 A200 F261 V265	V179-V196 HydrophobicContact CG1-CG2 4.42Å; W183-V196 HydrophobicContact CH2-CB 4.4Å; W183-V196 HydrophobicContact CH2-CG1 3.93Å; W183-V196 HydrophobicContact CH2-CG2 3.65Å; W183-V196 HydrophobicContact CZ3-CG2 3.48Å; W183-V196 VanDerWaalsContact CZ3-CG2 3.48Å; R192-V196 PolarHBondContact O-N 3.11Å; Y194-V196 PolarHBondContact O-N 2.76Å; V196-A200 WeakPolarHBondContact O-CB 3.34Å; V196-A200 PolarHBondContact O-N 3.43Å; V196-F261 HydrophobicContact CB-CD2 3.9Å; V196-F261 HydrophobicContact CB-CE2 3.71Å; V196-F261 HydrophobicContact CG2-CE2 4.18Å; V196-F261 VanDerWaalsContact O-CD2 3.29Å; V196-F261 WeakPolarHBondContact O-CD2 3.47Å; V196-F261 VanDerWaalsContact O-CE2 3.32Å; V196-F261 WeakPolarHBondContact O-CE2 3.32Å; V196-V265 HydrophobicContact CB-CG1 4.37Å; V196-V265 HydrophobicContact CG1-CG1 3.87Å
197	A	96.5	Very high	91.9	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	11%	0.114	C	C	.	.	H	α-helix	trans	-65.1	-41.2	170.7	0	0	0	0	0	111.6	C193 Y194 A200 L201 F225 T242	C193-A197 WeakPolarHBondContact O-CB 3.34Å; C193-A197 PolarHBondContact O-N 3.39Å; Y194-A197 PolarHBondContact O-N 3.28Å; A197-A200 PolarHBondContact O-N 3.35Å; A197-L201 VanDerWaalsContact O-CG 3.3Å; A197-L201 WeakPolarHBondContact O-CG 3.48Å; A197-L201 PolarHBondContact O-N 2.96Å; A197-F225 HydrophobicContact CB-CD2 3.97Å; A197-F225 HydrophobicContact CB-CE1 4.26Å; A197-F225 HydrophobicContact CB-CE2 3.31Å; A197-F225 HydrophobicContact CB-CZ 3.49Å; A197-F225 VanDerWaalsContact CB-CZ 3.49Å; A197-T242 HydrophobicContact CB-CG2 4.06Å
198	A	96.3	Very high	92.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.2	-46.2	175.2	0	0	0	0	0	111.9	Y194 E195 A200 L201 Q202 I245 L249	Y194-A198 WeakPolarHBondContact O-CB 3.25Å; Y194-A198 PolarHBondContact O-N 3.37Å; E195-A198 PolarHBondContact O-N 2.82Å; A198-A200 PolarHBondContact O-N 3.01Å; A198-L201 PolarHBondContact O-N 3.46Å; A198-L201 VanDerWaalsContact O-N 3.17Å; A198-Q202 PolarHBondContact O-N 3.49Å; A198-I245 HydrophobicContact CB-CB 4.09Å; A198-I245 HydrophobicContact CB-CG2 3.64Å; A198-L249 HydrophobicContact CB-CD1 3.71Å; A198-L249 WeakPolarHBondContact O-CD1 3.25Å
199	L	97.2	Very high	92.7	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-58.7	-37.1	172.8	-72.8	171.3	0	0	0	112	E195 A203 L249 M252 R260 F261	E195-L199 WeakPolarHBondContact O-CG 3.23Å; E195-L199 PolarHBondContact O-N 3.33Å; E195-L199 VanDerWaalsContact O-N 3.07Å; L199-A203 VanDerWaalsContact O-CB 3.23Å; L199-A203 WeakPolarHBondContact O-CB 3.42Å; L199-A203 PolarHBondContact O-N 3.06Å; L199-L249 HydrophobicContact CD2-CD1 4.18Å; L199-L249 HydrophobicContact CD2-CD2 4Å; L199-L249 HydrophobicContact CG-CD1 4.45Å; L199-M252 HydrophobicContact CD2-CE 4.37Å; L199-M252 HydrophobicContact CD2-SD 3.9Å; L199-R260 HydrophobicContact CD1-CB 4.31Å; L199-R260 HydrophobicContact CD2-CB 4.18Å; L199-F261 HydrophobicContact CB-CB 4.25Å; L199-F261 HydrophobicContact CB-CD2 4.29Å
200	A	97.3	Very high	92.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-71.6	-32.2	177.6	0	0	0	0	0	113.4	Y172 V196 A197 A198 A203 D204 Y224 F261	Y172-A200 HydrophobicContact CE2-CB 4.23Å; Y172-A200 VanDerWaalsContact OH-CA 3.25Å; Y172-A200 WeakPolarHBondContact OH-CA 3.47Å; Y172-A200 VanDerWaalsContact OH-CB 3.32Å; Y172-A200 WeakPolarHBondContact OH-CB 3.36Å; Y172-A200 PolarHBondContact OH-O 3.48Å; V196-A200 WeakPolarHBondContact O-CB 3.34Å; V196-A200 PolarHBondContact O-N 3.43Å; A197-A200 PolarHBondContact O-N 3.35Å; A198-A200 PolarHBondContact O-N 3.01Å; A200-A203 PolarHBondContact O-N 3.44Å; A200-D204 PolarHBondContact O-N 3.15Å; A200-D204 VanDerWaalsContact O-N 3.11Å; A200-Y224 HydrophobicContact CB-CD1 3.57Å; A200-Y224 HydrophobicContact CB-CE1 3.86Å; A200-F261 HydrophobicContact CB-CD2 3.93Å; A200-F261 HydrophobicContact CB-CE2 3.79Å
201	L	96	Very high	91.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.2	-44.1	172.3	-70	164.5	0	0	0	111	A197 A198 A203 D204 F205 Y218 F219 Y224 T242	A197-L201 VanDerWaalsContact O-CG 3.3Å; A197-L201 WeakPolarHBondContact O-CG 3.48Å; A197-L201 PolarHBondContact O-N 2.96Å; A198-L201 PolarHBondContact O-N 3.46Å; A198-L201 VanDerWaalsContact O-N 3.17Å; L201-A203 VanDerWaalsContact C-N 3.25Å; L201-A203 PolarHBondContact O-N 2.93Å; L201-D204 PolarHBondContact O-N 3.04Å; L201-F205 HydrophobicContact CD2-CD2 4.04Å; L201-F205 HydrophobicContact CD2-CE2 3.86Å; L201-F205 WeakPolarHBondContact O-CD2 3.43Å; L201-F205 PolarHBondContact O-N 3.41Å; L201-Y218 HydrophobicContact CB-CE2 4.42Å; L201-Y218 HydrophobicContact CD2-CD2 4.44Å; L201-Y218 HydrophobicContact CD2-CE2 3.83Å; L201-F219 HydrophobicContact CD1-CD2 4.12Å; L201-F219 HydrophobicContact CD1-CE2 4.4Å; L201-F219 HydrophobicContact CD1-CG 4.35Å; L201-F219 HydrophobicContact CD2-CB 4.22Å; L201-F219 HydrophobicContact CD2-CD2 3.82Å; L201-F219 HydrophobicContact CD2-CG 4.25Å; L201-F219 HydrophobicContact CG-CD2 4.48Å; L201-Y224 HydrophobicContact CD2-CD1 4.5Å; L201-Y224 HydrophobicContact CD2-CD2 4.31Å; L201-Y224 HydrophobicContact CD2-CE1 4.07Å; L201-Y224 HydrophobicContact CD2-CE2 3.85Å; L201-Y224 HydrophobicContact CG-CD1 4.5Å; L201-Y224 HydrophobicContact CG-CE1 4.36Å; L201-T242 HydrophobicContact CD1-CG2 3.72Å
202	Q	96.5	Very high	90.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-35.3	174.3	-167.9	75.2	36.5	0	0	111.4	A198 G206 D207 H246 L249 M252 A257	A198-Q202 PolarHBondContact O-N 3.49Å; Q202-G206 VanDerWaalsContact O-CA 3.31Å; Q202-G206 WeakPolarHBondContact O-CA 3.24Å; Q202-G206 PolarHBondContact O-N 2.63Å; Q202-D207 PolarHBondContact NE2-OD1 3.17Å; Q202-H246 PolarHBondContact OE1-CD2 2.69Å; Q202-H246 VanDerWaalsContact OE1-CD2 3.23Å; Q202-L249 HydrophobicContact CB-CB 4.49Å; Q202-L249 HydrophobicContact CB-CD1 4.11Å; Q202-L249 HydrophobicContact CG-CB 4.27Å; Q202-M252 HydrophobicContact CG-CB 4.15Å; Q202-M252 HydrophobicContact CG-CG 4.48Å; Q202-M252 PolarHBondContact NE2-O 2.96Å; Q202-A257 HydrophobicContact CB-CB 3.93Å; Q202-A257 HydrophobicContact CG-CB 3.84Å
203	A	96.4	Very high	89.5	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-29.2	176.8	0	0	0	0	0	115.1	Y172 L199 A200 L201 A257 R258	Y172-A203 HydrophobicContact CE1-CB 4.2Å; Y172-A203 HydrophobicContact CE2-CB 3.79Å; L199-A203 VanDerWaalsContact O-CB 3.23Å; L199-A203 WeakPolarHBondContact O-CB 3.42Å; L199-A203 PolarHBondContact O-N 3.06Å; A200-A203 PolarHBondContact O-N 3.44Å; L201-A203 VanDerWaalsContact C-N 3.25Å; L201-A203 PolarHBondContact O-N 2.93Å; A203-A257 HydrophobicContact CB-CB 4.03Å; A203-R258 HydrophobicContact CB-CG 3.48Å; A203-R258 VanDerWaalsContact CB-CG 3.48Å; A203-R258 VanDerWaalsContact O-CZ 3.31Å; A203-R258 PolarHBondContact O-NE 2.85Å; A203-R258 PolarHBondContact O-NH2 3.07Å
204	D	94.2	Very high	88	Confident	32 Å²	32	38.3 Å²	38.3	17%	0.171	21%	0.205	C	C	.	.	H	α-helix	trans	-93.7	-37.7	179.8	-85.8	25.2	0	0	0	112.3	Y172 R176 A200 L201 Y224	Y172-D204 WeakPolarHBondContact CE1-OD1 3.41Å; Y172-D204 PolarHBondContact OH-OD1 3.44Å; R176-D204 IonicContact CZ-OD1 3.23Å; R176-D204 IonicContact CZ-OD2 3.76Å; R176-D204 VanDerWaalsContact CZ-OD2 3.26Å; R176-D204 IonicContact NH1-OD1 3.72Å; R176-D204 PolarHBondContact NH1-OD1 3.33Å; R176-D204 IonicContact NH1-OD2 2.67Å; R176-D204 PolarHBondContact NH1-OD2 3.45Å; R176-D204 IonicContact NH2-OD2 2.74Å; R176-D204 PolarHBondContact NH2-OD2 2.99Å; A200-D204 PolarHBondContact O-N 3.15Å; A200-D204 VanDerWaalsContact O-N 3.11Å; L201-D204 PolarHBondContact O-N 3.04Å; D204-Y224 PolarHBondContact OD2-OH 3.06Å
205	F	92.6	Very high	86	Confident	50 Å²	50	44.4 Å²	44.4	22%	0.219	24%	0.238	C	C	.	.	H	α-helix	trans	-112.4	-19.5	-171.4	-58.4	-71.1	0	0	0	115.3	L201 L212 Y218 Y224	L201-F205 HydrophobicContact CD2-CD2 4.04Å; L201-F205 HydrophobicContact CD2-CE2 3.86Å; L201-F205 WeakPolarHBondContact O-CD2 3.43Å; L201-F205 PolarHBondContact O-N 3.41Å; F205-L212 HydrophobicContact CB-CD1 4.13Å; F205-L212 HydrophobicContact CB-CD2 3.95Å; F205-L212 HydrophobicContact CD1-CD1 3.98Å; F205-L212 HydrophobicContact CG-CD1 4.24Å; F205-L212 HydrophobicContact CG-CD2 4.46Å; F205-Y218 HydrophobicContact CB-CD2 4.49Å; F205-Y218 HydrophobicContact CD1-CD2 4.35Å; F205-Y218 AromaticContact CD2-CD2 3.53Å; F205-Y218 HydrophobicContact CD2-CD2 3.53Å; F205-Y218 AromaticContact CD2-CE2 3.73Å; F205-Y218 HydrophobicContact CD2-CE2 3.73Å; F205-Y218 AromaticContact CE2-CD2 3.74Å; F205-Y218 HydrophobicContact CE2-CD2 3.74Å; F205-Y218 HydrophobicContact CE2-CE2 4.2Å; F205-Y218 WeakPolarHBondContact CE2-O 3.48Å; F205-Y218 AromaticContact CG-CD2 3.86Å; F205-Y218 HydrophobicContact CG-CD2 3.86Å; F205-Y218 HydrophobicContact CG-CE2 4.25Å; F205-Y218 HydrophobicContact CZ-CD2 4.24Å; F205-Y218 WeakPolarHBondContact CZ-O 3.29Å; F205-Y224 WeakPolarHBondContact CE2-OH 3.41Å
206	G	92.4	Very high	84.4	Confident	18 Å²	18	44.1 Å²	44.1	19%	0.186	24%	0.242	C	C	.	.			trans	72.3	-160.9	-165.5	0	0	0	0	0	111.9	Q202 H246	Q202-G206 VanDerWaalsContact O-CA 3.31Å; Q202-G206 WeakPolarHBondContact O-CA 3.24Å; Q202-G206 PolarHBondContact O-N 2.63Å; G206-H246 PolarHBondContact O-NE2 3.35Å
207	D	93.3	Very high	83.2	Confident	82 Å²	82	47.3 Å²	47.3	44%	0.439	27%	0.268	S	S	.	.	S	Bend	trans	-53.2	138.3	-172.6	-68.9	-27.7	0	0	0	114.3	Q202 V250 G251	Q202-D207 PolarHBondContact NE2-OD1 3.17Å; D207-V250 HydrophobicContact CB-CG1 4.27Å; D207-V250 HydrophobicContact CB-CG2 4.31Å; D207-V250 WeakPolarHBondContact OD1-CA 3.4Å; D207-G251 PolarHBondContact OD1-N 2.98Å
208	Y	89.7	Confident	82.7	Confident	48 Å²	48	47.9 Å²	47.9	19%	0.188	27%	0.27	C	S	.	.			trans	-62.5	134.2	170.3	-177.4	-81.9	0	0	0	111.7	T213 P243 H246 Q247	Y208-T213 HydrophobicContact CE2-CG2 3.69Å; Y208-P243 HydrophobicContact CD2-CB 4.32Å; Y208-P243 HydrophobicContact CE2-CB 3.87Å; Y208-H246 AromaticContact CD2-CE1 3.4Å; Y208-H246 VanDerWaalsContact CD2-CE1 3.4Å; Y208-H246 WeakPolarHBondContact CD2-CE1 3.33Å; Y208-Q247 HydrophobicContact CD1-CG 3.46Å; Y208-Q247 VanDerWaalsContact CD1-CG 3.46Å; Y208-Q247 HydrophobicContact CD2-CG 4.27Å; Y208-Q247 HydrophobicContact CE1-CG 4Å; Y208-Q247 HydrophobicContact CG-CG 3.63Å
209	G	83.2	Confident	82.4	Confident	28 Å²	28	48.6 Å²	48.6	29%	0.289	27%	0.273	S	S	.	.			trans	-162.8	162.1	168.9	0	0	0	0	0	111.7	L211 L212	G209-L211 VanDerWaalsContact C-N 3.31Å; G209-L211 PolarHBondContact O-N 3.29Å; G209-L212 WeakPolarHBondContact O-CB 3.5Å; G209-L212 PolarHBondContact O-N 2.92Å
210	D	72.3	Confident	82.2	Confident	110 Å²	110	50 Å²	50	59%	0.588	28%	0.282	S	S	*	.	H	α-helix	trans	-63.6	-33.9	-167.1	-51.7	-53.8	0	0	0	113.4	L212 T213 E214	D210-L212 PolarHBondContact O-N 3Å; D210-T213 PolarHBondContact O-N 2.67Å; D210-T213 PolarHBondContact O-OG1 3.23Å; D210-E214 WeakPolarHBondContact O-CG 3.43Å; D210-E214 PolarHBondContact O-N 2.76Å
211	L	69.1	Low	82	Confident	154 Å²	154	50 Å²	50	81%	0.806	28%	0.282	S	S	*	.	H	α-helix	trans	-57.8	-22.6	173.4	-67.1	173.1	0	0	0	113.8	G209	G209-L211 VanDerWaalsContact C-N 3.31Å; G209-L211 PolarHBondContact O-N 3.29Å
212	L	73.4	Confident	81.9	Confident	34 Å²	34	52.5 Å²	52.5	18%	0.178	29%	0.294	C	S	.	.	H	α-helix	trans	-77.1	-33.6	177.3	-171.5	61.2	0	0	0	111.6	F205 G209 D210 S216 Y218	F205-L212 HydrophobicContact CB-CD1 4.13Å; F205-L212 HydrophobicContact CB-CD2 3.95Å; F205-L212 HydrophobicContact CD1-CD1 3.98Å; F205-L212 HydrophobicContact CG-CD1 4.24Å; F205-L212 HydrophobicContact CG-CD2 4.46Å; G209-L212 WeakPolarHBondContact O-CB 3.5Å; G209-L212 PolarHBondContact O-N 2.92Å; D210-L212 PolarHBondContact O-N 3Å; L212-S216 PolarHBondContact O-OG 2.87Å; L212-Y218 HydrophobicContact CD1-CD2 4.17Å; L212-Y218 HydrophobicContact CD2-CD2 3.51Å; L212-Y218 HydrophobicContact CD2-CE2 3.59Å; L212-Y218 HydrophobicContact CD2-CG 4.23Å; L212-Y218 HydrophobicContact CG-CD2 3.66Å; L212-Y218 HydrophobicContact CG-CE2 4.24Å; L212-Y218 HydrophobicContact CG-CG 3.97Å
213	T	70.9	Confident	81.7	Confident	58 Å²	58	55.9 Å²	55.9	36%	0.356	31%	0.312	S	S	.	.	H	α-helix	trans	-94	-31.1	-175.3	56.6	0	0	0	0	113.5	Y208 D210 N215 Y218	Y208-T213 HydrophobicContact CE2-CG2 3.69Å; D210-T213 PolarHBondContact O-N 2.67Å; D210-T213 PolarHBondContact O-OG1 3.23Å; T213-N215 VanDerWaalsContact C-N 3.3Å; T213-N215 PolarHBondContact O-N 2.89Å; T213-Y218 HydrophobicContact CG2-CD1 4.15Å; T213-Y218 HydrophobicContact CG2-CE1 4.38Å
214	E	60	Low	81.7	Confident	132 Å²	132	56.3 Å²	56.3	62%	0.617	31%	0.314	S	S	*	.	S	Bend	trans	-61.4	-29.6	-176.4	-77.2	-177.9	160.4	0	0	115	D210	D210-E214 WeakPolarHBondContact O-CG 3.43Å; D210-E214 PolarHBondContact O-N 2.76Å
215	N	52.3	Low	81.8	Confident	134 Å²	134	54.9 Å²	54.9	72%	0.717	31%	0.306	S	S	*	.	S	Bend	trans	-138.3	14.2	-166.4	-81.5	-78.9	0	0	0	115.3	T213	T213-N215 VanDerWaalsContact C-N 3.3Å; T213-N215 PolarHBondContact O-N 2.89Å
216	S	58	Low	81.8	Confident	41 Å²	41	52.5 Å²	52.5	29%	0.287	30%	0.296	S	S	.	.	S	Bend	trans	-141.1	152.7	-174.7	91.1	0	0	0	0	115	L212 Y218	L212-S216 PolarHBondContact O-OG 2.87Å; S216-Y218 PolarHBondContact O-N 3.18Å; S216-Y218 WeakPolarHBondContact OG-CA 3.35Å; S216-Y218 WeakPolarHBondContact OG-CB 3.47Å; S216-Y218 PolarHBondContact OG-N 2.93Å
217	A	70.3	Confident	81.7	Confident	67 Å²	67	53.7 Å²	53.7	55%	0.554	30%	0.304	S	S	*	.			trans	-76.4	49.3	165	0	0	0	0	0	111	L16 F219	L16-A217 HydrophobicContact CD1-CB 3.98Å; L16-A217 HydrophobicContact CD2-CB 4Å; A217-F219 VanDerWaalsContact C-N 3.25Å; A217-F219 PolarHBondContact O-N 3.47Å
218	Y	84.8	Confident	81.6	Confident	13 Å²	13	51.7 Å²	51.7	5%	0.051	29%	0.29	C	S	.	.			trans	-52	-41.9	-173.6	140.3	-103.2	0	0	0	112.2	L201 F205 L212 T213 S216 P243 H246	L201-Y218 HydrophobicContact CB-CE2 4.42Å; L201-Y218 HydrophobicContact CD2-CD2 4.44Å; L201-Y218 HydrophobicContact CD2-CE2 3.83Å; F205-Y218 HydrophobicContact CB-CD2 4.49Å; F205-Y218 HydrophobicContact CD1-CD2 4.35Å; F205-Y218 AromaticContact CD2-CD2 3.53Å; F205-Y218 HydrophobicContact CD2-CD2 3.53Å; F205-Y218 AromaticContact CD2-CE2 3.73Å; F205-Y218 HydrophobicContact CD2-CE2 3.73Å; F205-Y218 AromaticContact CE2-CD2 3.74Å; F205-Y218 HydrophobicContact CE2-CD2 3.74Å; F205-Y218 HydrophobicContact CE2-CE2 4.2Å; F205-Y218 WeakPolarHBondContact CE2-O 3.48Å; F205-Y218 AromaticContact CG-CD2 3.86Å; F205-Y218 HydrophobicContact CG-CD2 3.86Å; F205-Y218 HydrophobicContact CG-CE2 4.25Å; F205-Y218 HydrophobicContact CZ-CD2 4.24Å; F205-Y218 WeakPolarHBondContact CZ-O 3.29Å; L212-Y218 HydrophobicContact CD1-CD2 4.17Å; L212-Y218 HydrophobicContact CD2-CD2 3.51Å; L212-Y218 HydrophobicContact CD2-CE2 3.59Å; L212-Y218 HydrophobicContact CD2-CG 4.23Å; L212-Y218 HydrophobicContact CG-CD2 3.66Å; L212-Y218 HydrophobicContact CG-CE2 4.24Å; L212-Y218 HydrophobicContact CG-CG 3.97Å; T213-Y218 HydrophobicContact CG2-CD1 4.15Å; T213-Y218 HydrophobicContact CG2-CE1 4.38Å; S216-Y218 PolarHBondContact O-N 3.18Å; S216-Y218 WeakPolarHBondContact OG-CA 3.35Å; S216-Y218 WeakPolarHBondContact OG-CB 3.47Å; S216-Y218 PolarHBondContact OG-N 2.93Å; Y218-P243 HydrophobicContact CE1-CB 4.41Å; Y218-P243 HydrophobicContact CE1-CG 4.12Å; Y218-H246 AromaticContact CE2-CE1 3.16Å; Y218-H246 WeakPolarHBondContact CE2-CE1 3.36Å; Y218-H246 AromaticContact CE2-ND1 3.84Å; Y218-H246 AromaticContact CE2-NE2 3.71Å; Y218-H246 AromaticContact CZ-CE1 2.82Å; Y218-H246 AromaticContact CZ-ND1 3.71Å; Y218-H246 PolarHBondContact OH-CE1 2.95Å; Y218-H246 PolarHBondContact OH-ND1 3.39Å
219	F	90.7	Very high	81.8	Confident	16 Å²	16	49.4 Å²	49.4	7%	0.07	28%	0.281	C	S	.	.			trans	-128.8	109.3	-178.1	179.1	-135.9	0	0	0	113.1	L201 A217 P221 Y224 F225 L238 R239 T242 P243	L201-F219 HydrophobicContact CD1-CD2 4.12Å; L201-F219 HydrophobicContact CD1-CE2 4.4Å; L201-F219 HydrophobicContact CD1-CG 4.35Å; L201-F219 HydrophobicContact CD2-CB 4.22Å; L201-F219 HydrophobicContact CD2-CD2 3.82Å; L201-F219 HydrophobicContact CD2-CG 4.25Å; L201-F219 HydrophobicContact CG-CD2 4.48Å; A217-F219 VanDerWaalsContact C-N 3.25Å; A217-F219 PolarHBondContact O-N 3.47Å; F219-P221 HydrophobicContact CE1-CG 4.01Å; F219-P221 HydrophobicContact CE2-CB 4.37Å; F219-P221 HydrophobicContact CE2-CG 4.36Å; F219-P221 HydrophobicContact CZ-CB 3.99Å; F219-P221 HydrophobicContact CZ-CG 3.86Å; F219-Y224 AromaticContact CD2-CD2 3.61Å; F219-Y224 HydrophobicContact CD2-CD2 3.61Å; F219-Y224 AromaticContact CD2-CE2 3.99Å; F219-Y224 HydrophobicContact CD2-CE2 3.99Å; F219-Y224 HydrophobicContact CD2-CG 4.41Å; F219-Y224 AromaticContact CE2-CD2 3.64Å; F219-Y224 HydrophobicContact CE2-CD2 3.64Å; F219-Y224 HydrophobicContact CE2-CE2 4.47Å; F219-Y224 HydrophobicContact CE2-CG 4.13Å; F219-F225 HydrophobicContact CE2-CD2 4.33Å; F219-F225 HydrophobicContact CE2-CE2 4.24Å; F219-F225 AromaticContact CZ-CD2 3.99Å; F219-F225 HydrophobicContact CZ-CD2 3.99Å; F219-F225 AromaticContact CZ-CE2 3.69Å; F219-F225 HydrophobicContact CZ-CE2 3.69Å; F219-L238 HydrophobicContact CE1-CB 4.32Å; F219-L238 WeakPolarHBondContact CE1-O 3.34Å; F219-L238 HydrophobicContact CZ-CB 4.37Å; F219-R239 HydrophobicContact CD1-CG 4.31Å; F219-T242 HydrophobicContact CE1-CG2 4.2Å; F219-T242 WeakPolarHBondContact CE1-OG1 3.48Å; F219-T242 HydrophobicContact CZ-CG2 4.05Å; F219-P243 HydrophobicContact CD1-CG 4.47Å
220	C	92.3	Very high	82.3	Confident	32 Å²	32	48.8 Å²	48.8	22%	0.216	27%	0.272	C	S	.	.			trans	-106	105.7	168.8	-162.4	0	0	0	0	107.9	E222 L223 Y224	C220-E222 PolarHBondContact O-N 3.24Å; C220-E222 VanDerWaalsContact O-N 3.08Å; C220-E222 PolarHBondContact SG-OE2 2.71Å; C220-L223 HydrophobicContact CB-CD1 3.94Å; C220-L223 HydrophobicContact CB-CG 4.02Å; C220-L223 WeakPolarHBondContact O-CB 3.48Å; C220-L223 PolarHBondContact O-N 3.09Å; C220-Y224 WeakPolarHBondContact O-CD2 3.5Å
221	P	94	Very high	83.3	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-52.6	-35.3	-171.8	-29.7	36.3	0	0	0	114.6	F219 L223 Y224 F225 V230 Q235 L238 R239	F219-P221 HydrophobicContact CE1-CG 4.01Å; F219-P221 HydrophobicContact CE2-CB 4.37Å; F219-P221 HydrophobicContact CE2-CG 4.36Å; F219-P221 HydrophobicContact CZ-CB 3.99Å; F219-P221 HydrophobicContact CZ-CG 3.86Å; P221-L223 PolarHBondContact O-N 3.17Å; P221-L223 VanDerWaalsContact O-N 3.09Å; P221-Y224 PolarHBondContact O-N 3.46Å; P221-Y224 VanDerWaalsContact O-N 3.09Å; P221-F225 PolarHBondContact O-N 3.05Å; P221-V230 HydrophobicContact CB-CG2 4.31Å; P221-Q235 HydrophobicContact CG-CB 4.26Å; P221-L238 HydrophobicContact CB-CB 4Å; P221-L238 HydrophobicContact CB-CD1 3.76Å; P221-L238 HydrophobicContact CG-CB 3.9Å; P221-R239 HydrophobicContact CG-CG 3.98Å
222	E	93.7	Very high	84.3	Confident	54 Å²	54	46 Å²	46	25%	0.252	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-52.8	-28.5	175.7	-67.2	65	-145.4	0	0	113.7	R180 C220 V230 Q235	R180-E222 PolarHBondContact NE-O 3.01Å; R180-E222 PolarHBondContact NH2-O 2.78Å; C220-E222 PolarHBondContact O-N 3.24Å; C220-E222 VanDerWaalsContact O-N 3.08Å; C220-E222 PolarHBondContact SG-OE2 2.71Å; E222-V230 WeakPolarHBondContact OE1-CG1 3.44Å; E222-Q235 WeakPolarHBondContact OE1-CG 3.48Å; E222-Q235 PolarHBondContact OE1-NE2 3.45Å
223	L	93.1	Very high	85.3	Confident	70 Å²	70	48.7 Å²	48.7	37%	0.366	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-88.4	-5.8	-175.4	-59.2	-176.1	0	0	0	113.7	R176 R180 C220 P221	R176-L223 PolarHBondContact NE-O 3.42Å; R180-L223 WeakPolarHBondContact CD-O 3.41Å; C220-L223 HydrophobicContact CB-CD1 3.94Å; C220-L223 HydrophobicContact CB-CG 4.02Å; C220-L223 WeakPolarHBondContact O-CB 3.48Å; C220-L223 PolarHBondContact O-N 3.09Å; P221-L223 PolarHBondContact O-N 3.17Å; P221-L223 VanDerWaalsContact O-N 3.09Å
224	Y	95.5	Very high	86.3	Confident	9 Å²	9	47.3 Å²	47.3	4%	0.035	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	-35.2	-172.5	-62.2	-81.4	0	0	0	113.3	A200 L201 D204 F205 F219 C220 P221	A200-Y224 HydrophobicContact CB-CD1 3.57Å; A200-Y224 HydrophobicContact CB-CE1 3.86Å; L201-Y224 HydrophobicContact CD2-CD1 4.5Å; L201-Y224 HydrophobicContact CD2-CD2 4.31Å; L201-Y224 HydrophobicContact CD2-CE1 4.07Å; L201-Y224 HydrophobicContact CD2-CE2 3.85Å; L201-Y224 HydrophobicContact CG-CD1 4.5Å; L201-Y224 HydrophobicContact CG-CE1 4.36Å; D204-Y224 PolarHBondContact OD2-OH 3.06Å; F205-Y224 WeakPolarHBondContact CE2-OH 3.41Å; F219-Y224 AromaticContact CD2-CD2 3.61Å; F219-Y224 HydrophobicContact CD2-CD2 3.61Å; F219-Y224 AromaticContact CD2-CE2 3.99Å; F219-Y224 HydrophobicContact CD2-CE2 3.99Å; F219-Y224 HydrophobicContact CD2-CG 4.41Å; F219-Y224 AromaticContact CE2-CD2 3.64Å; F219-Y224 HydrophobicContact CE2-CD2 3.64Å; F219-Y224 HydrophobicContact CE2-CE2 4.47Å; F219-Y224 HydrophobicContact CE2-CG 4.13Å; C220-Y224 WeakPolarHBondContact O-CD2 3.5Å; P221-Y224 PolarHBondContact O-N 3.46Å; P221-Y224 VanDerWaalsContact O-N 3.09Å
225	F	95.5	Very high	87.8	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.009	26%	0.256	C	S	.	.	S	Bend	trans	-97.7	150.3	-178.4	-78.2	-93.5	0	0	0	112.7	C193 Y194 A197 F219 P221 V229 V230 L238 T242	C193-F225 HydrophobicContact CB-CD1 3.82Å; C193-F225 HydrophobicContact CB-CE1 3.85Å; Y194-F225 AromaticContact CD1-CE1 3.9Å; Y194-F225 HydrophobicContact CD1-CE1 3.9Å; Y194-F225 AromaticContact CD1-CZ 3.59Å; Y194-F225 HydrophobicContact CD1-CZ 3.59Å; Y194-F225 HydrophobicContact CD2-CE1 4.3Å; Y194-F225 HydrophobicContact CE1-CE1 4.04Å; Y194-F225 AromaticContact CE1-CZ 3.92Å; Y194-F225 HydrophobicContact CE1-CZ 3.92Å; Y194-F225 HydrophobicContact CE2-CE1 4.44Å; Y194-F225 HydrophobicContact CG-CE1 4.01Å; Y194-F225 HydrophobicContact CG-CZ 4.03Å; A197-F225 HydrophobicContact CB-CD2 3.97Å; A197-F225 HydrophobicContact CB-CE1 4.26Å; A197-F225 HydrophobicContact CB-CE2 3.31Å; A197-F225 HydrophobicContact CB-CZ 3.49Å; A197-F225 VanDerWaalsContact CB-CZ 3.49Å; F219-F225 HydrophobicContact CE2-CD2 4.33Å; F219-F225 HydrophobicContact CE2-CE2 4.24Å; F219-F225 AromaticContact CZ-CD2 3.99Å; F219-F225 HydrophobicContact CZ-CD2 3.99Å; F219-F225 AromaticContact CZ-CE2 3.69Å; F219-F225 HydrophobicContact CZ-CE2 3.69Å; P221-F225 PolarHBondContact O-N 3.05Å; F225-V229 HydrophobicContact CB-CB 4.38Å; F225-V229 HydrophobicContact CD1-CB 3.95Å; F225-V229 HydrophobicContact CD1-CG1 3.65Å; F225-V229 HydrophobicContact CD1-CG2 4.29Å; F225-V229 HydrophobicContact CE1-CG1 4.13Å; F225-V230 HydrophobicContact CB-CG2 3.76Å; F225-L238 HydrophobicContact CB-CD1 4.46Å; F225-L238 HydrophobicContact CD1-CD2 4.34Å; F225-L238 HydrophobicContact CD2-CD1 4.26Å; F225-L238 HydrophobicContact CE1-CD2 4.06Å; F225-L238 HydrophobicContact CE2-CD2 4.37Å; F225-L238 HydrophobicContact CG-CD1 4.16Å; F225-L238 HydrophobicContact CZ-CD2 4.07Å; F225-T242 HydrophobicContact CE2-CG2 3.91Å; F225-T242 WeakPolarHBondContact CE2-OG1 3.41Å; F225-T242 HydrophobicContact CZ-CG2 4.1Å
226	P	93	Very high	89.6	Confident	1 Å²	1	43 Å²	43	1%	0.006	25%	0.247	C	C	.	.			trans	-60.8	146.9	164.6	-21.3	34	0	0	0	111.8	V179 W183 W228 V229 V230	V179-P226 HydrophobicContact CG1-CG 4.36Å; W183-P226 HydrophobicContact CB-CB 4.37Å; W183-P226 HydrophobicContact CB-CG 3.8Å; W183-P226 HydrophobicContact CE3-CG 4.19Å; P226-W228 VanDerWaalsContact CB-CD1 3.49Å; P226-W228 HydrophobicContact CB-CG 4.36Å; P226-W228 VanDerWaalsContact CB-NE1 3.32Å; P226-W228 PolarHBondContact O-N 2.86Å; P226-W228 VanDerWaalsContact O-N 3.1Å; P226-V229 HydrophobicContact CB-CG2 4.44Å; P226-V229 HydrophobicContact CG-CG2 4.41Å; P226-V229 PolarHBondContact O-N 3.37Å; P226-V230 PolarHBondContact O-N 2.8Å
227	A	91.1	Very high	91.2	Very high	43 Å²	43	42.4 Å²	42.4	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-55.9	-32.2	-176.7	0	0	0	0	0	113.9	V230 N231	A227-V230 PolarHBondContact O-N 3.45Å; A227-N231 WeakPolarHBondContact O-CB 3.33Å; A227-N231 PolarHBondContact O-N 3.12Å; A227-N231 PolarHBondContact O-ND2 3.08Å; A227-N231 PolarHBondContact O-OD1 3.14Å
228	W	90.6	Very high	92.3	Very high	40 Å²	40	39.2 Å²	39.2	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-36.8	177.8	64.9	-93.5	0	0	0	112.8	W183 E185 V188 E190 P226 N231 S232	W183-W228 PolarHBondContact O-NE1 2.86Å; E185-W228 HydrophobicContact CB-CD2 3.77Å; E185-W228 HydrophobicContact CB-CE3 3.72Å; E185-W228 HydrophobicContact CB-CG 4.24Å; E185-W228 HydrophobicContact CB-CH2 4.4Å; E185-W228 HydrophobicContact CB-CZ2 4.45Å; E185-W228 HydrophobicContact CB-CZ3 4.04Å; E185-W228 HydrophobicContact CG-CD2 4.37Å; E185-W228 HydrophobicContact CG-CE3 3.8Å; E185-W228 HydrophobicContact CG-CH2 4.42Å; E185-W228 HydrophobicContact CG-CZ3 3.82Å; V188-W228 WeakPolarHBondContact O-CH2 3.47Å; V188-W228 WeakPolarHBondContact O-CZ2 3.17Å; E190-W228 HydrophobicContact CB-CH2 4.11Å; E190-W228 HydrophobicContact CB-CZ3 4.34Å; E190-W228 HydrophobicContact CG-CH2 4.17Å; E190-W228 HydrophobicContact CG-CZ3 4.13Å; P226-W228 VanDerWaalsContact CB-CD1 3.49Å; P226-W228 HydrophobicContact CB-CG 4.36Å; P226-W228 VanDerWaalsContact CB-NE1 3.32Å; P226-W228 PolarHBondContact O-N 2.86Å; P226-W228 VanDerWaalsContact O-N 3.1Å; W228-N231 PolarHBondContact O-N 3.17Å; W228-S232 VanDerWaalsContact O-CB 3.31Å; W228-S232 WeakPolarHBondContact O-CB 3.48Å; W228-S232 PolarHBondContact O-N 2.8Å; W228-S232 PolarHBondContact O-OG 3.48Å; W228-S232 VanDerWaalsContact O-OG 3.09Å
229	V	93.7	Very high	92.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.6	-41.9	176.3	-169.2	0	0	0	0	110.8	E190 C193 F225 P226 N231 S232 R233 L238	E190-V229 HydrophobicContact CG-CG1 3.94Å; E190-V229 HydrophobicContact CG-CG2 4.28Å; C193-V229 HydrophobicContact CB-CG2 4.16Å; F225-V229 HydrophobicContact CB-CB 4.38Å; F225-V229 HydrophobicContact CD1-CB 3.95Å; F225-V229 HydrophobicContact CD1-CG1 3.65Å; F225-V229 HydrophobicContact CD1-CG2 4.29Å; F225-V229 HydrophobicContact CE1-CG1 4.13Å; P226-V229 HydrophobicContact CB-CG2 4.44Å; P226-V229 HydrophobicContact CG-CG2 4.41Å; P226-V229 PolarHBondContact O-N 3.37Å; V229-N231 VanDerWaalsContact C-N 3.28Å; V229-N231 PolarHBondContact O-N 2.85Å; V229-S232 PolarHBondContact O-N 3.16Å; V229-S232 PolarHBondContact O-OG 2.89Å; V229-R233 HydrophobicContact CG1-CG 4.2Å; V229-R233 WeakPolarHBondContact O-CB 3.44Å; V229-R233 PolarHBondContact O-N 2.84Å; V229-L238 HydrophobicContact CG1-CD1 4.45Å; V229-L238 HydrophobicContact CG1-CD2 4.12Å
230	V	94.2	Very high	92.5	Very high	15 Å²	15	47.4 Å²	47.4	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-39.8	176.5	-177.3	0	0	0	0	110.7	P221 E222 F225 P226 A227 G234 Q235 L238	P221-V230 HydrophobicContact CB-CG2 4.31Å; E222-V230 WeakPolarHBondContact OE1-CG1 3.44Å; F225-V230 HydrophobicContact CB-CG2 3.76Å; P226-V230 PolarHBondContact O-N 2.8Å; A227-V230 PolarHBondContact O-N 3.45Å; V230-G234 WeakPolarHBondContact O-CA 3.16Å; V230-G234 PolarHBondContact O-N 3.44Å; V230-Q235 HydrophobicContact CG1-CG 4.24Å; V230-L238 HydrophobicContact CB-CD1 4.48Å; V230-L238 HydrophobicContact CG2-CD1 4.08Å
231	N	92.7	Very high	92.3	Very high	136 Å²	136	45.9 Å²	45.9	73%	0.727	23%	0.233	S	C	*	.	H	α-helix	trans	-73.1	-35.7	177.8	-68.3	-12.6	0	0	0	113.4	A227 W228 V229	A227-N231 WeakPolarHBondContact O-CB 3.33Å; A227-N231 PolarHBondContact O-N 3.12Å; A227-N231 PolarHBondContact O-ND2 3.08Å; A227-N231 PolarHBondContact O-OD1 3.14Å; W228-N231 PolarHBondContact O-N 3.17Å; V229-N231 VanDerWaalsContact C-N 3.28Å; V229-N231 PolarHBondContact O-N 2.85Å
232	S	91.4	Very high	92.3	Very high	68 Å²	68	45.9 Å²	45.9	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-84.6	-30.4	-176.2	68.8	0	0	0	0	113.9	W228 V229	W228-S232 VanDerWaalsContact O-CB 3.31Å; W228-S232 WeakPolarHBondContact O-CB 3.48Å; W228-S232 PolarHBondContact O-N 2.8Å; W228-S232 PolarHBondContact O-OG 3.48Å; W228-S232 VanDerWaalsContact O-OG 3.09Å; V229-S232 PolarHBondContact O-N 3.16Å; V229-S232 PolarHBondContact O-OG 2.89Å
233	R	93	Very high	92.1	Very high	91 Å²	91	44.1 Å²	44.1	34%	0.343	23%	0.226	S	C	.	.	H	α-helix	trans	-101.9	-26.2	179.2	-61.9	-60.1	-175.9	-171.1	-4.6	114.1	E190 V229 F237 L238	E190-R233 VanDerWaalsContact CD-NE 3.3Å; E190-R233 VanDerWaalsContact OE1-CG 3.31Å; E190-R233 WeakPolarHBondContact OE1-CG 3.4Å; E190-R233 IonicContact OE1-CZ 2.67Å; E190-R233 IonicContact OE1-NE 2.89Å; E190-R233 PolarHBondContact OE1-NE 3.25Å; E190-R233 IonicContact OE1-NH2 2.65Å; E190-R233 IonicContact OE2-CZ 2.73Å; E190-R233 VanDerWaalsContact OE2-CZ 3.26Å; E190-R233 IonicContact OE2-NE 3.79Å; E190-R233 PolarHBondContact OE2-NE 3.11Å; E190-R233 IonicContact OE2-NH2 3.23Å; E190-R233 PolarHBondContact OE2-NH2 2.9Å; V229-R233 HydrophobicContact CG1-CG 4.2Å; V229-R233 WeakPolarHBondContact O-CB 3.44Å; V229-R233 PolarHBondContact O-N 2.84Å; R233-F237 HydrophobicContact CB-CB 4.46Å; R233-F237 HydrophobicContact CB-CD1 3.78Å; R233-F237 HydrophobicContact CB-CE1 4.46Å; R233-F237 HydrophobicContact CB-CG 4.37Å; R233-F237 HydrophobicContact CG-CD1 4.17Å; R233-F237 HydrophobicContact CG-CE1 4.36Å; R233-F237 VanDerWaalsContact O-CB 3.26Å; R233-F237 WeakPolarHBondContact O-CB 3.34Å; R233-L238 HydrophobicContact CB-CD2 4.2Å; R233-L238 HydrophobicContact CB-CG 4.23Å
234	G	92	Very high	92	Very high	30 Å²	30	42.9 Å²	42.9	31%	0.309	22%	0.221	S	C	.	.			trans	77.7	153	-172	0	0	0	0	0	113	V230 D236 L238	V230-G234 WeakPolarHBondContact O-CA 3.16Å; V230-G234 PolarHBondContact O-N 3.44Å; G234-D236 VanDerWaalsContact C-N 3.34Å; G234-D236 PolarHBondContact O-N 2.77Å; G234-L238 PolarHBondContact O-N 2.94Å
235	Q	92.5	Very high	91.8	Very high	77 Å²	77	43 Å²	43	36%	0.36	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-41.8	-174.8	-65.8	179.5	5.7	0	0	113.3	P221 E222 V230 L238 R239	P221-Q235 HydrophobicContact CG-CB 4.26Å; E222-Q235 WeakPolarHBondContact OE1-CG 3.48Å; E222-Q235 PolarHBondContact OE1-NE2 3.45Å; V230-Q235 HydrophobicContact CG1-CG 4.24Å; Q235-L238 PolarHBondContact O-N 3.23Å; Q235-R239 VanDerWaalsContact CB-NH1 3.35Å; Q235-R239 WeakPolarHBondContact O-CG 3.24Å; Q235-R239 PolarHBondContact O-N 2.98Å; Q235-R239 VanDerWaalsContact OE1-CZ 3.28Å
236	D	89.8	Confident	91.8	Very high	99 Å²	99	43 Å²	43	53%	0.529	22%	0.222	S	C	.	.	H	α-helix	trans	-78	-27.8	-168.7	-57.5	-42.9	0	0	0	112.9	G234 R239 R240	G234-D236 VanDerWaalsContact C-N 3.34Å; G234-D236 PolarHBondContact O-N 2.77Å; D236-R239 IonicContact OD1-CZ 3.18Å; D236-R239 IonicContact OD1-NH1 3.38Å; D236-R239 PolarHBondContact OD1-NH1 2.83Å; D236-R240 VanDerWaalsContact O-CB 3.31Å; D236-R240 WeakPolarHBondContact O-CB 3.36Å; D236-R240 PolarHBondContact O-N 3.02Å
237	F	91.6	Very high	91.8	Very high	28 Å²	28	47 Å²	47	12%	0.123	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-50.1	166.3	-177.5	-89.9	0	0	0	110.4	R233 R239 R240 H241 L889	R233-F237 HydrophobicContact CB-CB 4.46Å; R233-F237 HydrophobicContact CB-CD1 3.78Å; R233-F237 HydrophobicContact CB-CE1 4.46Å; R233-F237 HydrophobicContact CB-CG 4.37Å; R233-F237 HydrophobicContact CG-CD1 4.17Å; R233-F237 HydrophobicContact CG-CE1 4.36Å; R233-F237 VanDerWaalsContact O-CB 3.26Å; R233-F237 WeakPolarHBondContact O-CB 3.34Å; F237-R239 PolarHBondContact O-N 1.95Å; F237-R240 WeakPolarHBondContact O-CB 3.42Å; F237-R240 PolarHBondContact O-N 3.48Å; F237-R240 VanDerWaalsContact O-N 3.17Å; F237-H241 AromaticContact CD1-CD2 3.87Å; F237-H241 AromaticContact CD2-CD2 3.48Å; F237-H241 VanDerWaalsContact CD2-CD2 3.48Å; F237-H241 WeakPolarHBondContact CD2-CD2 3.21Å; F237-H241 AromaticContact CD2-NE2 3.65Å; F237-H241 AromaticContact CE1-CD2 3.75Å; F237-H241 AromaticContact CE2-CD2 3.35Å; F237-H241 WeakPolarHBondContact CE2-CD2 3.14Å; F237-H241 AromaticContact CE2-NE2 3.43Å; F237-H241 WeakPolarHBondContact CE2-NE2 3.48Å; F237-H241 AromaticContact CG-CD2 3.75Å; F237-H241 AromaticContact CZ-CD2 3.49Å; F237-H241 VanDerWaalsContact CZ-CD2 3.49Å; F237-H241 WeakPolarHBondContact CZ-CD2 3.49Å; F237-H241 AromaticContact CZ-NE2 3.97Å; F237-H241 PolarHBondContact O-CD2 3.34Å; F237-H241 PolarHBondContact O-N 2.82Å; F237-L889 HydrophobicContact CE2-CD2 3.9Å; F237-L889 HydrophobicContact CZ-CD2 3.7Å; F237-L889 HydrophobicContact CZ-CG 4.4Å
238	L	93.8	Very high	91.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-49	177.9	-63.7	175.5	0	0	0	110.5	Y194 F219 P221 F225 V229 V230 R233 G234 Q235 R240 H241 T242	Y194-L238 HydrophobicContact CE1-CD2 3.6Å; Y194-L238 WeakPolarHBondContact OH-CD2 3.46Å; F219-L238 HydrophobicContact CE1-CB 4.32Å; F219-L238 WeakPolarHBondContact CE1-O 3.34Å; F219-L238 HydrophobicContact CZ-CB 4.37Å; P221-L238 HydrophobicContact CB-CB 4Å; P221-L238 HydrophobicContact CB-CD1 3.76Å; P221-L238 HydrophobicContact CG-CB 3.9Å; F225-L238 HydrophobicContact CB-CD1 4.46Å; F225-L238 HydrophobicContact CD1-CD2 4.34Å; F225-L238 HydrophobicContact CD2-CD1 4.26Å; F225-L238 HydrophobicContact CE1-CD2 4.06Å; F225-L238 HydrophobicContact CE2-CD2 4.37Å; F225-L238 HydrophobicContact CG-CD1 4.16Å; F225-L238 HydrophobicContact CZ-CD2 4.07Å; V229-L238 HydrophobicContact CG1-CD1 4.45Å; V229-L238 HydrophobicContact CG1-CD2 4.12Å; V230-L238 HydrophobicContact CB-CD1 4.48Å; V230-L238 HydrophobicContact CG2-CD1 4.08Å; R233-L238 HydrophobicContact CB-CD2 4.2Å; R233-L238 HydrophobicContact CB-CG 4.23Å; G234-L238 PolarHBondContact O-N 2.94Å; Q235-L238 PolarHBondContact O-N 3.23Å; L238-R240 PolarHBondContact O-N 2.94Å; L238-H241 PolarHBondContact O-N 3.44Å; L238-H241 VanDerWaalsContact O-N 3.12Å; L238-T242 WeakPolarHBondContact O-CB 3.29Å; L238-T242 PolarHBondContact O-N 3.17Å; L238-T242 PolarHBondContact O-OG1 3.33Å
239	R	91.3	Very high	92	Very high	89 Å²	89	46.6 Å²	46.6	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-55	-34.2	176.2	-74.8	178.1	-176.2	120.2	9.6	113.6	F219 P221 Q235 D236 F237 P243	F219-R239 HydrophobicContact CD1-CG 4.31Å; P221-R239 HydrophobicContact CG-CG 3.98Å; Q235-R239 VanDerWaalsContact CB-NH1 3.35Å; Q235-R239 WeakPolarHBondContact O-CG 3.24Å; Q235-R239 PolarHBondContact O-N 2.98Å; Q235-R239 VanDerWaalsContact OE1-CZ 3.28Å; D236-R239 IonicContact OD1-CZ 3.18Å; D236-R239 IonicContact OD1-NH1 3.38Å; D236-R239 PolarHBondContact OD1-NH1 2.83Å; F237-R239 PolarHBondContact O-N 1.95Å; R239-P243 WeakPolarHBondContact O-CD 3.44Å; R239-P243 VanDerWaalsContact O-CG 3.24Å; R239-P243 WeakPolarHBondContact O-CG 3.42Å
240	R	87.6	Confident	92	Very high	111 Å²	111	50.2 Å²	50.2	42%	0.419	26%	0.258	S	S	.	.	H	α-helix	trans	-74.5	-39.6	177.8	-175.1	177.9	-62.6	150.2	3.6	112.8	D236 F237 L238 D892 T894	D236-R240 VanDerWaalsContact O-CB 3.31Å; D236-R240 WeakPolarHBondContact O-CB 3.36Å; D236-R240 PolarHBondContact O-N 3.02Å; F237-R240 WeakPolarHBondContact O-CB 3.42Å; F237-R240 PolarHBondContact O-N 3.48Å; F237-R240 VanDerWaalsContact O-N 3.17Å; L238-R240 PolarHBondContact O-N 2.94Å; R240-D892 IonicContact CZ-OD2 3.86Å; R240-D892 VanDerWaalsContact NH1-CG 3.3Å; R240-D892 IonicContact NH1-OD1 3.51Å; R240-D892 PolarHBondContact NH1-OD1 3.05Å; R240-D892 IonicContact NH1-OD2 3.78Å; R240-D892 PolarHBondContact NH1-OD2 2.86Å; R240-T894 PolarHBondContact NH1-OG1 3.33Å
241	H	89.2	Confident	92	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-105.6	-33.1	-165.9	-62.9	-59.6	0	0	0	115.3	F237 L238 V244 A888 D892	F237-H241 AromaticContact CD1-CD2 3.87Å; F237-H241 AromaticContact CD2-CD2 3.48Å; F237-H241 VanDerWaalsContact CD2-CD2 3.48Å; F237-H241 WeakPolarHBondContact CD2-CD2 3.21Å; F237-H241 AromaticContact CD2-NE2 3.65Å; F237-H241 AromaticContact CE1-CD2 3.75Å; F237-H241 AromaticContact CE2-CD2 3.35Å; F237-H241 WeakPolarHBondContact CE2-CD2 3.14Å; F237-H241 AromaticContact CE2-NE2 3.43Å; F237-H241 WeakPolarHBondContact CE2-NE2 3.48Å; F237-H241 AromaticContact CG-CD2 3.75Å; F237-H241 AromaticContact CZ-CD2 3.49Å; F237-H241 VanDerWaalsContact CZ-CD2 3.49Å; F237-H241 WeakPolarHBondContact CZ-CD2 3.49Å; F237-H241 AromaticContact CZ-NE2 3.97Å; F237-H241 PolarHBondContact O-CD2 3.34Å; F237-H241 PolarHBondContact O-N 2.82Å; L238-H241 PolarHBondContact O-N 3.44Å; L238-H241 VanDerWaalsContact O-N 3.12Å; H241-V244 WeakPolarHBondContact O-CB 3.26Å; H241-V244 PolarHBondContact O-N 2.87Å; H241-A888 HydrophobicContact CB-CB 3.76Å; H241-A888 PolarHBondContact CE1-O 3.35Å; H241-D892 IonicContact NE2-OD2 3.23Å; H241-D892 PolarHBondContact NE2-OD2 3.03Å
242	T	92.4	Very high	92.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-39.1	176.9	-45.3	0	0	0	0	113.1	A197 L201 F219 F225 L238 V244 I245 H246	A197-T242 HydrophobicContact CB-CG2 4.06Å; L201-T242 HydrophobicContact CD1-CG2 3.72Å; F219-T242 HydrophobicContact CE1-CG2 4.2Å; F219-T242 WeakPolarHBondContact CE1-OG1 3.48Å; F219-T242 HydrophobicContact CZ-CG2 4.05Å; F225-T242 HydrophobicContact CE2-CG2 3.91Å; F225-T242 WeakPolarHBondContact CE2-OG1 3.41Å; F225-T242 HydrophobicContact CZ-CG2 4.1Å; L238-T242 WeakPolarHBondContact O-CB 3.29Å; L238-T242 PolarHBondContact O-N 3.17Å; L238-T242 PolarHBondContact O-OG1 3.33Å; T242-V244 VanDerWaalsContact C-N 3.25Å; T242-V244 PolarHBondContact O-N 3.36Å; T242-I245 PolarHBondContact O-N 2.94Å; T242-H246 PolarHBondContact O-N 3.05Å; T242-H246 VanDerWaalsContact O-N 3.1Å
243	P	91.3	Very high	92.2	Very high	16 Å²	16	48.2 Å²	48.2	10%	0.104	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-27.1	178.2	-24.9	36.5	0	0	0	114.5	Y208 Y218 F219 R239 I245 H246 Q247	Y208-P243 HydrophobicContact CD2-CB 4.32Å; Y208-P243 HydrophobicContact CE2-CB 3.87Å; Y218-P243 HydrophobicContact CE1-CB 4.41Å; Y218-P243 HydrophobicContact CE1-CG 4.12Å; F219-P243 HydrophobicContact CD1-CG 4.47Å; R239-P243 WeakPolarHBondContact O-CD 3.44Å; R239-P243 VanDerWaalsContact O-CG 3.24Å; R239-P243 WeakPolarHBondContact O-CG 3.42Å; P243-I245 PolarHBondContact O-N 3.28Å; P243-H246 WeakPolarHBondContact O-CB 3.41Å; P243-H246 PolarHBondContact O-N 3.35Å; P243-Q247 WeakPolarHBondContact O-CG 3.48Å; P243-Q247 PolarHBondContact O-N 3.39Å
244	V	90	Very high	92.3	Very high	44 Å²	44	45.3 Å²	45.3	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-64.8	-32.4	174.8	-173.2	0	0	0	0	111.1	H241 T242	H241-V244 WeakPolarHBondContact O-CB 3.26Å; H241-V244 PolarHBondContact O-N 2.87Å; T242-V244 VanDerWaalsContact C-N 3.25Å; T242-V244 PolarHBondContact O-N 3.36Å
245	I	92.1	Very high	92.4	Very high	13 Å²	13	47.5 Å²	47.5	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-82.7	-27.9	178	-53.3	172.4	0	0	0	110.4	Y194 A198 T242 P243 D248 P884	Y194-I245 HydrophobicContact CD1-CD1 4.05Å; Y194-I245 HydrophobicContact CG-CD1 4.12Å; A198-I245 HydrophobicContact CB-CB 4.09Å; A198-I245 HydrophobicContact CB-CG2 3.64Å; T242-I245 PolarHBondContact O-N 2.94Å; P243-I245 PolarHBondContact O-N 3.28Å; I245-D248 PolarHBondContact O-N 3.07Å; I245-P884 HydrophobicContact CD1-CB 4.11Å; I245-P884 HydrophobicContact CG1-CB 4.34Å
246	H	94.3	Very high	92.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-36.2	168.8	-172.7	-150	0	0	0	112	Q202 G206 Y208 Y218 T242 P243 D248 L249	Q202-H246 PolarHBondContact OE1-CD2 2.69Å; Q202-H246 VanDerWaalsContact OE1-CD2 3.23Å; G206-H246 PolarHBondContact O-NE2 3.35Å; Y208-H246 AromaticContact CD2-CE1 3.4Å; Y208-H246 VanDerWaalsContact CD2-CE1 3.4Å; Y208-H246 WeakPolarHBondContact CD2-CE1 3.33Å; Y218-H246 AromaticContact CE2-CE1 3.16Å; Y218-H246 WeakPolarHBondContact CE2-CE1 3.36Å; Y218-H246 AromaticContact CE2-ND1 3.84Å; Y218-H246 AromaticContact CE2-NE2 3.71Å; Y218-H246 AromaticContact CZ-CE1 2.82Å; Y218-H246 AromaticContact CZ-ND1 3.71Å; Y218-H246 PolarHBondContact OH-CE1 2.95Å; Y218-H246 PolarHBondContact OH-ND1 3.39Å; T242-H246 PolarHBondContact O-N 3.05Å; T242-H246 VanDerWaalsContact O-N 3.1Å; P243-H246 WeakPolarHBondContact O-CB 3.41Å; P243-H246 PolarHBondContact O-N 3.35Å; H246-D248 VanDerWaalsContact C-N 3.28Å; H246-D248 PolarHBondContact O-N 3.1Å; H246-L249 WeakPolarHBondContact O-CB 3.5Å; H246-L249 PolarHBondContact O-N 3.23Å
247	Q	93.4	Very high	92.9	Very high	85 Å²	85	41.8 Å²	41.8	40%	0.397	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-35.1	172.7	-72.9	168.5	4.9	0	0	113	Y208 P243 L249 V250	Y208-Q247 HydrophobicContact CD1-CG 3.46Å; Y208-Q247 VanDerWaalsContact CD1-CG 3.46Å; Y208-Q247 HydrophobicContact CD2-CG 4.27Å; Y208-Q247 HydrophobicContact CE1-CG 4Å; Y208-Q247 HydrophobicContact CG-CG 3.63Å; P243-Q247 WeakPolarHBondContact O-CG 3.48Å; P243-Q247 PolarHBondContact O-N 3.39Å; Q247-L249 PolarHBondContact O-N 2.89Å; Q247-L249 VanDerWaalsContact O-N 3.16Å; Q247-V250 WeakPolarHBondContact O-CG2 3.5Å; Q247-V250 PolarHBondContact O-N 3.24Å
248	D	92.6	Very high	93.2	Very high	70 Å²	70	41.8 Å²	41.8	37%	0.374	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-1.1	176.6	-70.2	-27.6	0	0	0	113	I245 H246 R887	I245-D248 PolarHBondContact O-N 3.07Å; H246-D248 VanDerWaalsContact C-N 3.28Å; H246-D248 PolarHBondContact O-N 3.1Å; D248-R887 IonicContact OD1-NH1 3.4Å; D248-R887 PolarHBondContact OD1-NH1 3.25Å; D248-R887 IonicContact OD2-NH1 2.66Å; D248-R887 PolarHBondContact OD2-NH1 3.24Å
249	L	94	Very high	93.3	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-4.1	176.5	-68.4	172.2	0	0	0	114.9	A198 L199 Q202 H246 Q247 G251 M252 Y585	A198-L249 HydrophobicContact CB-CD1 3.71Å; A198-L249 WeakPolarHBondContact O-CD1 3.25Å; L199-L249 HydrophobicContact CD2-CD1 4.18Å; L199-L249 HydrophobicContact CD2-CD2 4Å; L199-L249 HydrophobicContact CG-CD1 4.45Å; Q202-L249 HydrophobicContact CB-CB 4.49Å; Q202-L249 HydrophobicContact CB-CD1 4.11Å; Q202-L249 HydrophobicContact CG-CB 4.27Å; H246-L249 WeakPolarHBondContact O-CB 3.5Å; H246-L249 PolarHBondContact O-N 3.23Å; Q247-L249 PolarHBondContact O-N 2.89Å; Q247-L249 VanDerWaalsContact O-N 3.16Å; L249-G251 PolarHBondContact O-N 3.34Å; L249-M252 HydrophobicContact CD2-CE 3.58Å; L249-M252 HydrophobicContact CD2-SD 4.3Å; L249-M252 VanDerWaalsContact O-CB 3.24Å; L249-M252 WeakPolarHBondContact O-CB 3.39Å; L249-M252 PolarHBondContact O-N 3.46Å; L249-M252 VanDerWaalsContact O-N 3.09Å; L249-Y585 HydrophobicContact CD2-CE1 4.06Å; L249-Y585 HydrophobicContact CD2-CE2 3.8Å; L249-Y585 VanDerWaalsContact CD2-CZ 3.49Å; L249-Y585 WeakPolarHBondContact CD2-OH 3.43Å
250	V	93.5	Very high	93.4	Very high	76 Å²	76	41.6 Å²	41.6	46%	0.461	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	132.6	-176.1	169.3	0	0	0	0	112	D207 Q247	D207-V250 HydrophobicContact CB-CG1 4.27Å; D207-V250 HydrophobicContact CB-CG2 4.31Å; D207-V250 WeakPolarHBondContact OD1-CA 3.4Å; Q247-V250 WeakPolarHBondContact O-CG2 3.5Å; Q247-V250 PolarHBondContact O-N 3.24Å
251	G	93.2	Very high	93.8	Very high	61 Å²	61	36.4 Å²	36.4	63%	0.629	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.3	-2.9	-172.4	0	0	0	0	0	114.4	D207 L249	D207-G251 PolarHBondContact OD1-N 2.98Å; L249-G251 PolarHBondContact O-N 3.34Å
252	M	95.1	Very high	94.1	Very high	21 Å²	21	36.3 Å²	36.3	10%	0.103	20%	0.202	C	C	.	.			trans	-87.8	121.5	171.8	-175.6	179.4	-56.1	0	0	110.8	L199 Q202 L249 E256 A257 R260	L199-M252 HydrophobicContact CD2-CE 4.37Å; L199-M252 HydrophobicContact CD2-SD 3.9Å; Q202-M252 HydrophobicContact CG-CB 4.15Å; Q202-M252 HydrophobicContact CG-CG 4.48Å; Q202-M252 PolarHBondContact NE2-O 2.96Å; L249-M252 HydrophobicContact CD2-CE 3.58Å; L249-M252 HydrophobicContact CD2-SD 4.3Å; L249-M252 VanDerWaalsContact O-CB 3.24Å; L249-M252 WeakPolarHBondContact O-CB 3.39Å; L249-M252 PolarHBondContact O-N 3.46Å; L249-M252 VanDerWaalsContact O-N 3.09Å; M252-E256 HydrophobicContact CG-CB 4.18Å; M252-E256 HydrophobicContact CG-CG 3.93Å; M252-E256 HydrophobicContact SD-CG 4.35Å; M252-A257 HydrophobicContact CG-CB 4.3Å; M252-A257 HydrophobicContact SD-CB 3.97Å; M252-R260 VanDerWaalsContact CE-NH1 3.28Å
253	D	93.2	Very high	94	Very high	95 Å²	95	38.3 Å²	38.3	51%	0.508	21%	0.211	S	C	.	.			trans	-68.2	155.2	178	79.9	74.2	0	0	0	112.5	H255 E256 A257	D253-H255 PolarHBondContact O-N 3.37Å; D253-H255 VanDerWaalsContact OD1-CA 3.28Å; D253-H255 WeakPolarHBondContact OD1-CA 3.48Å; D253-H255 WeakPolarHBondContact OD1-CB 3.45Å; D253-H255 PolarHBondContact OD1-N 3.38Å; D253-E256 PolarHBondContact O-N 2.84Å; D253-E256 PolarHBondContact OD1-N 3.15Å; D253-A257 WeakPolarHBondContact O-CB 3.21Å; D253-A257 PolarHBondContact O-N 3.18Å
254	A	95.1	Very high	93.9	Very high	30 Å²	30	38.6 Å²	38.6	25%	0.248	21%	0.212	C	C	.	.	H	α-helix	trans	-71.5	-9.9	-174.7	0	0	0	0	0	114.4	R258	A254-R258 VanDerWaalsContact O-CG 3.28Å; A254-R258 WeakPolarHBondContact O-CG 3.48Å; A254-R258 PolarHBondContact O-NE 3.46Å; A254-R258 PolarHBondContact O-NH1 2.95Å
255	H	95.2	Very high	94	Very high	77 Å²	77	36.6 Å²	36.6	36%	0.356	20%	0.2	S	C	.	.	H	α-helix	trans	-83.1	-47.5	169.1	176	-86.7	0	0	0	110.5	D253 A257 R258 Y259	D253-H255 PolarHBondContact O-N 3.37Å; D253-H255 VanDerWaalsContact OD1-CA 3.28Å; D253-H255 WeakPolarHBondContact OD1-CA 3.48Å; D253-H255 WeakPolarHBondContact OD1-CB 3.45Å; D253-H255 PolarHBondContact OD1-N 3.38Å; H255-A257 VanDerWaalsContact C-N 3.32Å; H255-A257 PolarHBondContact O-N 3.09Å; H255-R258 PolarHBondContact O-N 3.33Å; H255-R258 VanDerWaalsContact O-N 3.13Å; H255-Y259 PolarHBondContact O-N 3.32Å
256	E	95.5	Very high	93.8	Very high	55 Å²	55	36.1 Å²	36.1	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-59.9	-40.6	174	177.1	65.8	170.1	0	0	111.8	M252 D253 R258 Y259 R260	M252-E256 HydrophobicContact CG-CB 4.18Å; M252-E256 HydrophobicContact CG-CG 3.93Å; M252-E256 HydrophobicContact SD-CG 4.35Å; D253-E256 PolarHBondContact O-N 2.84Å; D253-E256 PolarHBondContact OD1-N 3.15Å; E256-R258 VanDerWaalsContact C-N 3.3Å; E256-R258 PolarHBondContact O-N 2.79Å; E256-Y259 PolarHBondContact O-N 2.98Å; E256-R260 HydrophobicContact CG-CG 4.5Å; E256-R260 WeakPolarHBondContact O-CB 3.3Å; E256-R260 WeakPolarHBondContact O-CG 3.48Å; E256-R260 PolarHBondContact O-N 3.04Å; E256-R260 IonicContact OE1-CZ 2.72Å; E256-R260 IonicContact OE1-NE 3.42Å; E256-R260 PolarHBondContact OE1-NE 3.39Å; E256-R260 IonicContact OE1-NH2 3.87Å; E256-R260 PolarHBondContact OE1-NH2 3.26Å
257	A	97.3	Very high	92.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-39.2	174.2	0	0	0	0	0	112.7	Q202 A203 M252 D253 H255 F261	Q202-A257 HydrophobicContact CB-CB 3.93Å; Q202-A257 HydrophobicContact CG-CB 3.84Å; A203-A257 HydrophobicContact CB-CB 4.03Å; M252-A257 HydrophobicContact CG-CB 4.3Å; M252-A257 HydrophobicContact SD-CB 3.97Å; D253-A257 WeakPolarHBondContact O-CB 3.21Å; D253-A257 PolarHBondContact O-N 3.18Å; H255-A257 VanDerWaalsContact C-N 3.32Å; H255-A257 PolarHBondContact O-N 3.09Å; A257-F261 VanDerWaalsContact O-CB 3.29Å; A257-F261 WeakPolarHBondContact O-CB 3.41Å; A257-F261 PolarHBondContact O-N 3.49Å
258	R	96.8	Very high	91.6	Very high	29 Å²	29	38 Å²	38	11%	0.109	23%	0.227	C	C	.	.	H	α-helix	trans	-71.9	-41.5	174.8	-68.8	178.9	-149.4	113.4	5.5	112	L168 Y172 A203 A254 H255 E256 F261 C262	L168-R258 HydrophobicContact CG-CB 4.42Å; Y172-R258 HydrophobicContact CD1-CG 3.92Å; Y172-R258 HydrophobicContact CD2-CB 4.23Å; Y172-R258 HydrophobicContact CD2-CG 3.91Å; Y172-R258 HydrophobicContact CE1-CG 4.29Å; Y172-R258 HydrophobicContact CE2-CG 4.28Å; Y172-R258 HydrophobicContact CG-CB 4.17Å; Y172-R258 HydrophobicContact CG-CG 3.73Å; A203-R258 HydrophobicContact CB-CG 3.48Å; A203-R258 VanDerWaalsContact CB-CG 3.48Å; A203-R258 VanDerWaalsContact O-CZ 3.31Å; A203-R258 PolarHBondContact O-NE 2.85Å; A203-R258 PolarHBondContact O-NH2 3.07Å; A254-R258 VanDerWaalsContact O-CG 3.28Å; A254-R258 WeakPolarHBondContact O-CG 3.48Å; A254-R258 PolarHBondContact O-NE 3.46Å; A254-R258 PolarHBondContact O-NH1 2.95Å; H255-R258 PolarHBondContact O-N 3.33Å; H255-R258 VanDerWaalsContact O-N 3.13Å; E256-R258 VanDerWaalsContact C-N 3.3Å; E256-R258 PolarHBondContact O-N 2.79Å; R258-F261 PolarHBondContact O-N 2.62Å; R258-C262 WeakPolarHBondContact O-CB 3.29Å; R258-C262 PolarHBondContact O-N 3.4Å; R258-C262 PolarHBondContact O-SG 2.92Å
259	Y	95.7	Very high	89.8	Confident	44 Å²	44	38.4 Å²	38.4	17%	0.173	23%	0.233	C	C	.	.	H	α-helix	trans	-57.3	-53	175.1	179.2	-88.2	0	0	0	110.4	V159 R160 H255 E256 C262 E263	V159-Y259 HydrophobicContact CB-CE2 4.18Å; V159-Y259 HydrophobicContact CG1-CD2 3.92Å; V159-Y259 HydrophobicContact CG1-CE2 3.81Å; R160-Y259 HydrophobicContact CB-CE2 4.37Å; H255-Y259 PolarHBondContact O-N 3.32Å; E256-Y259 PolarHBondContact O-N 2.98Å; Y259-C262 PolarHBondContact O-N 2.98Å; Y259-E263 HydrophobicContact CE1-CB 4.21Å; Y259-E263 VanDerWaalsContact CE1-OE1 3.28Å; Y259-E263 WeakPolarHBondContact CE1-OE1 3.24Å; Y259-E263 PolarHBondContact O-N 3.41Å; Y259-E263 PolarHBondContact OH-OE1 2.93Å
260	R	94	Very high	88.5	Confident	40 Å²	40	38.7 Å²	38.7	15%	0.151	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-47	178.5	-70.7	-171.5	-169.8	-178	13.5	112.2	L199 M252 E256 C262 E263 D264	L199-R260 HydrophobicContact CD1-CB 4.31Å; L199-R260 HydrophobicContact CD2-CB 4.18Å; M252-R260 VanDerWaalsContact CE-NH1 3.28Å; E256-R260 HydrophobicContact CG-CG 4.5Å; E256-R260 WeakPolarHBondContact O-CB 3.3Å; E256-R260 WeakPolarHBondContact O-CG 3.48Å; E256-R260 PolarHBondContact O-N 3.04Å; E256-R260 IonicContact OE1-CZ 2.72Å; E256-R260 IonicContact OE1-NE 3.42Å; E256-R260 PolarHBondContact OE1-NE 3.39Å; E256-R260 IonicContact OE1-NH2 3.87Å; E256-R260 PolarHBondContact OE1-NH2 3.26Å; R260-C262 VanDerWaalsContact C-N 3.29Å; R260-C262 PolarHBondContact O-N 3.5Å; R260-E263 PolarHBondContact O-N 3.23Å; R260-D264 VanDerWaalsContact O-CB 3.24Å; R260-D264 WeakPolarHBondContact O-CB 3.48Å; R260-D264 PolarHBondContact O-N 3.05Å
261	F	96	Very high	87.2	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-53.1	-48.4	175.4	179.7	-80.3	0	0	0	111.3	Y172 L175 R176 V179 V196 L199 A200 A257 R258 D264 V265	Y172-F261 HydrophobicContact CD2-CB 4.02Å; Y172-F261 AromaticContact CD2-CD1 3.47Å; Y172-F261 HydrophobicContact CD2-CD1 3.47Å; Y172-F261 VanDerWaalsContact CD2-CD1 3.47Å; Y172-F261 HydrophobicContact CD2-CD2 4.48Å; Y172-F261 HydrophobicContact CD2-CE1 4.03Å; Y172-F261 AromaticContact CD2-CG 3.74Å; Y172-F261 HydrophobicContact CD2-CG 3.74Å; Y172-F261 HydrophobicContact CE2-CB 4.09Å; Y172-F261 AromaticContact CE2-CD1 3.78Å; Y172-F261 HydrophobicContact CE2-CD1 3.78Å; Y172-F261 AromaticContact CE2-CD2 3.98Å; Y172-F261 HydrophobicContact CE2-CD2 3.98Å; Y172-F261 HydrophobicContact CE2-CE1 4.19Å; Y172-F261 HydrophobicContact CE2-CE2 4.37Å; Y172-F261 AromaticContact CE2-CG 3.67Å; Y172-F261 HydrophobicContact CE2-CG 3.67Å; Y172-F261 HydrophobicContact CE2-CZ 4.48Å; L175-F261 HydrophobicContact CB-CE1 4Å; R176-F261 HydrophobicContact CB-CE1 4.38Å; R176-F261 HydrophobicContact CB-CZ 4.03Å; R176-F261 HydrophobicContact CG-CZ 4.36Å; V179-F261 HydrophobicContact CG2-CZ 4.15Å; V196-F261 HydrophobicContact CB-CD2 3.9Å; V196-F261 HydrophobicContact CB-CE2 3.71Å; V196-F261 HydrophobicContact CG2-CE2 4.18Å; V196-F261 VanDerWaalsContact O-CD2 3.29Å; V196-F261 WeakPolarHBondContact O-CD2 3.47Å; V196-F261 VanDerWaalsContact O-CE2 3.32Å; V196-F261 WeakPolarHBondContact O-CE2 3.32Å; L199-F261 HydrophobicContact CB-CB 4.25Å; L199-F261 HydrophobicContact CB-CD2 4.29Å; A200-F261 HydrophobicContact CB-CD2 3.93Å; A200-F261 HydrophobicContact CB-CE2 3.79Å; A257-F261 VanDerWaalsContact O-CB 3.29Å; A257-F261 WeakPolarHBondContact O-CB 3.41Å; A257-F261 PolarHBondContact O-N 3.49Å; R258-F261 PolarHBondContact O-N 2.62Å; F261-D264 PolarHBondContact O-N 3.17Å; F261-V265 HydrophobicContact CD1-CG2 4.36Å; F261-V265 HydrophobicContact CE1-CG1 4.24Å; F261-V265 HydrophobicContact CE1-CG2 4.15Å; F261-V265 HydrophobicContact CZ-CG1 4.3Å; F261-V265 WeakPolarHBondContact O-CG1 3.22Å; F261-V265 WeakPolarHBondContact O-CG2 3.41Å; F261-V265 PolarHBondContact O-N 3.11Å; F261-V265 VanDerWaalsContact O-N 3.1Å
262	C	94.8	Very high	86.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-44.9	179.9	-68.9	0	0	0	0	112.3	V159 L168 Y171 Y172 L175 R258 Y259 R260 S266	V159-C262 HydrophobicContact CB-CB 4.49Å; V159-C262 HydrophobicContact CG1-CB 3.71Å; V159-C262 HydrophobicContact CG2-CB 3.95Å; L168-C262 HydrophobicContact CD1-CB 4.33Å; Y171-C262 HydrophobicContact CD1-CB 4.28Å; Y171-C262 HydrophobicContact CE1-CB 4.46Å; Y172-C262 VanDerWaalsContact CA-SG 3.58Å; L175-C262 HydrophobicContact CD1-CB 4.06Å; R258-C262 WeakPolarHBondContact O-CB 3.29Å; R258-C262 PolarHBondContact O-N 3.4Å; R258-C262 PolarHBondContact O-SG 2.92Å; Y259-C262 PolarHBondContact O-N 2.98Å; R260-C262 VanDerWaalsContact C-N 3.29Å; R260-C262 PolarHBondContact O-N 3.5Å; C262-S266 VanDerWaalsContact O-CB 3.24Å; C262-S266 WeakPolarHBondContact O-CB 3.18Å; C262-S266 PolarHBondContact O-N 3.02Å; C262-S266 PolarHBondContact O-OG 3.08Å
263	E	91.9	Very high	86.5	Confident	41 Å²	41	32 Å²	32	19%	0.192	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-47.2	176.7	-172.7	173.9	-89.8	0	0	110.8	Y259 R260 V265 S266 S267 N592	Y259-E263 HydrophobicContact CE1-CB 4.21Å; Y259-E263 VanDerWaalsContact CE1-OE1 3.28Å; Y259-E263 WeakPolarHBondContact CE1-OE1 3.24Å; Y259-E263 PolarHBondContact O-N 3.41Å; Y259-E263 PolarHBondContact OH-OE1 2.93Å; R260-E263 PolarHBondContact O-N 3.23Å; E263-V265 PolarHBondContact O-N 3.34Å; E263-S266 PolarHBondContact O-N 3.18Å; E263-S267 WeakPolarHBondContact O-CB 3.16Å; E263-S267 PolarHBondContact O-N 3.45Å; E263-S267 PolarHBondContact O-OG 2.71Å; E263-N592 PolarHBondContact OE2-ND2 3.33Å
264	D	89.2	Confident	86.4	Confident	22 Å²	22	27.5 Å²	27.5	12%	0.118	16%	0.161	C	C	.	.	H	α-helix	trans	-64.3	-33.4	-177.7	-102.6	-21.8	0	0	0	113.9	R192 R260 F261 R588	R192-D264 VanDerWaalsContact CZ-CG 3.45Å; R192-D264 IonicContact CZ-OD1 3.94Å; R192-D264 IonicContact CZ-OD2 3.93Å; R192-D264 IonicContact NH1-OD1 2.8Å; R192-D264 PolarHBondContact NH1-OD1 2.8Å; R192-D264 IonicContact NH1-OD2 3.44Å; R192-D264 PolarHBondContact NH1-OD2 3.17Å; R192-D264 VanDerWaalsContact NH2-C 3.31Å; R192-D264 VanDerWaalsContact NH2-CA 3.33Å; R192-D264 PolarHBondContact NH2-O 3.2Å; R192-D264 IonicContact NH2-OD1 2.77Å; R192-D264 PolarHBondContact NH2-OD1 2.93Å; R192-D264 IonicContact NH2-OD2 3.58Å; R260-D264 VanDerWaalsContact O-CB 3.24Å; R260-D264 WeakPolarHBondContact O-CB 3.48Å; R260-D264 PolarHBondContact O-N 3.05Å; F261-D264 PolarHBondContact O-N 3.17Å; D264-R588 IonicContact OD1-CZ 3.5Å; D264-R588 IonicContact OD1-NE 3.67Å; D264-R588 IonicContact OD1-NH2 3.7Å; D264-R588 PolarHBondContact OD1-NH2 2.99Å; D264-R588 IonicContact OD2-NH2 2.64Å; D264-R588 PolarHBondContact OD2-NH2 2.96Å
265	V	91	Very high	86.4	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-91.9	-25.6	177.7	-54	0	0	0	0	113.4	L175 V179 W183 V196 F261 E263 V272	L175-V265 HydrophobicContact CB-CG2 4Å; L175-V265 HydrophobicContact CD1-CG2 3.76Å; L175-V265 HydrophobicContact CD2-CG2 4.32Å; L175-V265 HydrophobicContact CG-CG2 4.26Å; V179-V265 HydrophobicContact CG2-CB 4.48Å; V179-V265 HydrophobicContact CG2-CG1 3.94Å; W183-V265 HydrophobicContact CH2-CG1 3.95Å; W183-V265 HydrophobicContact CZ2-CB 4.21Å; W183-V265 HydrophobicContact CZ2-CG1 3.79Å; V196-V265 HydrophobicContact CB-CG1 4.37Å; V196-V265 HydrophobicContact CG1-CG1 3.87Å; F261-V265 HydrophobicContact CD1-CG2 4.36Å; F261-V265 HydrophobicContact CE1-CG1 4.24Å; F261-V265 HydrophobicContact CE1-CG2 4.15Å; F261-V265 HydrophobicContact CZ-CG1 4.3Å; F261-V265 WeakPolarHBondContact O-CG1 3.22Å; F261-V265 WeakPolarHBondContact O-CG2 3.41Å; F261-V265 PolarHBondContact O-N 3.11Å; F261-V265 VanDerWaalsContact O-N 3.1Å; E263-V265 PolarHBondContact O-N 3.34Å; V265-V272 HydrophobicContact CB-CG1 4.1Å; V265-V272 HydrophobicContact CG2-CG1 4.08Å
266	S	89.1	Confident	86.1	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-73.8	-32.6	172.9	-86.1	0	0	0	0	112.6	I156 C262 E263 G268 N273	I156-S266 PolarHBondContact O-OG 2.71Å; I156-S266 VanDerWaalsContact O-OG 3.06Å; C262-S266 VanDerWaalsContact O-CB 3.24Å; C262-S266 WeakPolarHBondContact O-CB 3.18Å; C262-S266 PolarHBondContact O-N 3.02Å; C262-S266 PolarHBondContact O-OG 3.08Å; E263-S266 PolarHBondContact O-N 3.18Å; S266-G268 PolarHBondContact O-N 3.01Å; S266-N273 PolarHBondContact O-ND2 3.02Å
267	S	74.6	Confident	86	Confident	87 Å²	87	23 Å²	23	61%	0.608	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	18.1	-177.6	81.4	0	0	0	0	114.7	E263	E263-S267 WeakPolarHBondContact O-CB 3.16Å; E263-S267 PolarHBondContact O-N 3.45Å; E263-S267 PolarHBondContact O-OG 2.71Å
268	G	65.6	Low	85.7	Confident	39 Å²	39	27.7 Å²	27.7	40%	0.402	15%	0.154	S	C	.	.	S	Bend	trans	-105.3	159.5	-169.9	0	0	0	0	0	114.5	S266 C270	S266-G268 PolarHBondContact O-N 3.01Å; G268-C270 PolarHBondContact O-N 3.24Å; G268-C270 VanDerWaalsContact O-N 3.13Å
269	C	55.9	Low	85.5	Confident	77 Å²	77	26.3 Å²	26.3	52%	0.52	15%	0.148	S	C	.	.	S	Bend	trans	-75.2	12.4	172.2	57.9	0	0	0	0	114.3
270	C	65	Low	85.3	Confident	11 Å²	11	25.6 Å²	25.6	7%	0.074	15%	0.147	C	C	.	.	S	Bend	trans	-119	137.2	-167.8	-64.2	0	0	0	0	110.5	L187 V188 G268 V272	L187-C270 PolarHBondContact O-SG 2.84Å; L187-C270 VanDerWaalsContact O-SG 3.4Å; V188-C270 HydrophobicContact CG2-CB 4.25Å; V188-C270 WeakPolarHBondContact CG2-SG 3.22Å; G268-C270 PolarHBondContact O-N 3.24Å; G268-C270 VanDerWaalsContact O-N 3.13Å; C270-V272 PolarHBondContact O-N 2.77Å
271	A	67.8	Low	85.1	Confident	10 Å²	10	29.9 Å²	29.9	8%	0.083	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-68.3	21.1	-168	0	0	0	0	0	117	Q182 N273 A274 I276 A293 F302	Q182-A271 PolarHBondContact OE1-O 3.19Å; A271-N273 VanDerWaalsContact C-N 3.28Å; A271-N273 PolarHBondContact O-N 3.46Å; A271-A274 HydrophobicContact CB-CB 4.06Å; A271-A274 WeakPolarHBondContact O-CA 3.32Å; A271-A274 WeakPolarHBondContact O-CB 3.2Å; A271-A274 PolarHBondContact O-N 3.33Å; A271-I276 HydrophobicContact CB-CD1 4.26Å; A271-A293 HydrophobicContact CB-CB 4.18Å; A271-F302 HydrophobicContact CB-CE2 4.29Å; A271-F302 HydrophobicContact CB-CZ 4.07Å
272	V	83.8	Confident	84.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-67.1	-26.5	179.7	152.4	0	0	0	0	113.1	L175 N178 V179 Q182 W183 V265 C270 A274	L175-V272 HydrophobicContact CD2-CG1 3.91Å; L175-V272 WeakPolarHBondContact CD2-O 3.48Å; N178-V272 HydrophobicContact CB-CB 4.33Å; N178-V272 HydrophobicContact CB-CG1 4Å; N178-V272 HydrophobicContact CB-CG2 4.13Å; N178-V272 PolarHBondContact ND2-O 3.31Å; V179-V272 HydrophobicContact CG2-CG1 4.05Å; V179-V272 HydrophobicContact CG2-CG2 4.37Å; Q182-V272 HydrophobicContact CB-CG2 4.06Å; W183-V272 HydrophobicContact CG-CG2 4.12Å; W183-V272 VanDerWaalsContact NE1-CG2 3.32Å; V265-V272 HydrophobicContact CB-CG1 4.1Å; V265-V272 HydrophobicContact CG2-CG1 4.08Å; C270-V272 PolarHBondContact O-N 2.77Å; V272-A274 VanDerWaalsContact C-N 3.26Å; V272-A274 PolarHBondContact O-N 2.73Å
273	N	89.7	Confident	84	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.043	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-87.1	24	167.8	63.6	-15.2	0	0	0	112.7	Y155 D157 S266 A271 P296	Y155-N273 WeakPolarHBondContact CB-O 3.39Å; Y155-N273 VanDerWaalsContact CD2-C 3.46Å; Y155-N273 WeakPolarHBondContact CD2-O 3.33Å; D157-N273 PolarHBondContact OD1-ND2 2.9Å; S266-N273 PolarHBondContact O-ND2 3.02Å; A271-N273 VanDerWaalsContact C-N 3.28Å; A271-N273 PolarHBondContact O-N 3.46Å; N273-P296 WeakPolarHBondContact O-CD 3.39Å
274	A	91.4	Very high	83.2	Confident	1 Å²	1	44 Å²	44	1%	0.008	25%	0.247	C	C	.	.	S	Bend	trans	-131.8	159.9	-173.7	0	0	0	0	0	114.9	Y155 A271 V272 A293 V294 A295	Y155-A274 VanDerWaalsContact CE2-C 3.5Å; Y155-A274 WeakPolarHBondContact CE2-O 3.37Å; A271-A274 HydrophobicContact CB-CB 4.06Å; A271-A274 WeakPolarHBondContact O-CA 3.32Å; A271-A274 WeakPolarHBondContact O-CB 3.2Å; A271-A274 PolarHBondContact O-N 3.33Å; V272-A274 VanDerWaalsContact C-N 3.26Å; V272-A274 PolarHBondContact O-N 2.73Å; A274-A293 HydrophobicContact CB-CB 3.99Å; A274-V294 CarbonylContact C-O 3.45Å; A274-V294 VanDerWaalsContact CA-O 3.31Å; A274-V294 WeakPolarHBondContact CA-O 3.46Å; A274-V294 WeakPolarHBondContact CB-O 3.42Å; A274-A295 HydrophobicContact CB-CB 3.74Å
275	H	93.2	Very high	82.7	Confident	16 Å²	16	44.6 Å²	44.6	7%	0.074	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.4	169.7	-69.9	-79	0	0	0	110.7	F115 V152 Y153 Y155 Y277 A293 V294 F357 F361	F115-H275 AromaticContact CE2-CE1 3.47Å; F115-H275 VanDerWaalsContact CE2-CE1 3.47Å; F115-H275 WeakPolarHBondContact CE2-CE1 3.42Å; F115-H275 AromaticContact CE2-ND1 3.82Å; F115-H275 AromaticContact CZ-CE1 3.72Å; V152-H275 PolarHBondContact O-CE1 2.83Å; V152-H275 PolarHBondContact O-NE2 2.73Å; Y153-H275 PolarHBondContact O-NE2 2.88Å; Y155-H275 AromaticContact CD2-CD2 3.6Å; Y155-H275 AromaticContact CD2-NE2 3.52Å; Y155-H275 AromaticContact CE2-CD2 3.47Å; Y155-H275 VanDerWaalsContact CE2-CD2 3.47Å; Y155-H275 WeakPolarHBondContact CE2-CD2 3.38Å; Y155-H275 AromaticContact CE2-CE1 3.52Å; Y155-H275 AromaticContact CE2-CG 3.9Å; Y155-H275 AromaticContact CE2-ND1 3.94Å; Y155-H275 AromaticContact CE2-NE2 3.23Å; Y155-H275 WeakPolarHBondContact CE2-NE2 3.48Å; H275-Y277 HydrophobicContact CB-CD2 4.42Å; H275-Y277 HydrophobicContact CB-CE2 3.66Å; H275-A293 CarbonylContact O-C 3.53Å; H275-A293 WeakPolarHBondContact O-CA 3.42Å; H275-V294 HydrophobicContact CB-CB 4.42Å; H275-V294 PolarHBondContact N-O 3.37Å; H275-V294 PolarHBondContact O-N 2.89Å; H275-F357 HydrophobicContact CB-CE1 3.9Å; H275-F357 HydrophobicContact CB-CZ 4.14Å; H275-F357 AromaticContact CD2-CE1 3.97Å; H275-F357 AromaticContact CD2-CZ 3.48Å; H275-F357 VanDerWaalsContact CD2-CZ 3.48Å; H275-F357 WeakPolarHBondContact CD2-CZ 3.24Å; H275-F357 AromaticContact CG-CE1 3.99Å; H275-F357 AromaticContact CG-CZ 3.7Å; H275-F357 AromaticContact NE2-CZ 3.91Å; H275-F361 AromaticContact CD2-CE2 3.85Å
276	I	90.8	Very high	81.5	Confident	47 Å²	47	51.5 Å²	51.5	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.7	-174.9	-56.3	179.1	0	0	0	110.2	Q182 A271 L291 A293	Q182-I276 HydrophobicContact CB-CD1 4.34Å; Q182-I276 HydrophobicContact CG-CD1 3.98Å; A271-I276 HydrophobicContact CB-CD1 4.26Å; I276-L291 HydrophobicContact CG2-CB 4.08Å; I276-L291 HydrophobicContact CG2-CD1 3.68Å; I276-L291 HydrophobicContact CG2-CG 4.38Å; I276-A293 HydrophobicContact CG1-CB 4.35Å
277	Y	92.5	Very high	80.7	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	145.6	176.5	-60.4	-81	0	0	0	111.4	E112 Y113 H275 L291 L292 V294 Y353 L354 F357	E112-Y277 HydrophobicContact CB-CD1 4.45Å; E112-Y277 HydrophobicContact CG-CD1 4.49Å; Y113-Y277 WeakPolarHBondContact O-CE1 3.28Å; H275-Y277 HydrophobicContact CB-CD2 4.42Å; H275-Y277 HydrophobicContact CB-CE2 3.66Å; Y277-L291 WeakPolarHBondContact O-CA 3.16Å; Y277-L292 PolarHBondContact N-O 2.92Å; Y277-L292 PolarHBondContact O-N 3.41Å; Y277-V294 HydrophobicContact CD2-CG2 4.37Å; Y277-V294 HydrophobicContact CE2-CG2 4.33Å; Y277-Y353 HydrophobicContact CD1-CE1 4.48Å; Y277-Y353 AromaticContact CE1-CE1 3.62Å; Y277-Y353 HydrophobicContact CE1-CE1 3.62Å; Y277-Y353 AromaticContact CZ-CE1 3.78Å; Y277-Y353 PolarHBondContact OH-OH 3.03Å; Y277-L354 HydrophobicContact CD1-CD2 3.78Å; Y277-L354 HydrophobicContact CD2-CD2 3.54Å; Y277-L354 HydrophobicContact CE1-CD2 4.18Å; Y277-L354 HydrophobicContact CE2-CD2 3.95Å; Y277-L354 HydrophobicContact CG-CD2 3.43Å; Y277-L354 VanDerWaalsContact CG-CD2 3.43Å; Y277-F357 AromaticContact CE2-CD1 3.72Å; Y277-F357 HydrophobicContact CE2-CD1 3.72Å; Y277-F357 AromaticContact CE2-CE1 3.73Å; Y277-F357 HydrophobicContact CE2-CE1 3.73Å; Y277-F357 AromaticContact CZ-CD1 3.94Å; Y277-F357 WeakPolarHBondContact OH-CD1 3.47Å; Y277-F357 WeakPolarHBondContact OH-CE1 3.46Å
278	R	91.1	Very high	81	Confident	100 Å²	100	51.7 Å²	51.7	38%	0.377	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.4	-175.3	-55.9	-167.2	168.3	-89.6	-8	111.2	E112 E288 L291 N304 K350	E112-R278 PolarHBondContact OE1-N 2.91Å; R278-E288 HydrophobicContact CB-CB 3.73Å; R278-E288 HydrophobicContact CB-CG 4.06Å; R278-E288 WeakPolarHBondContact CB-OE2 3.19Å; R278-E288 WeakPolarHBondContact CD-OE2 3.38Å; R278-L291 HydrophobicContact CB-CD2 4.29Å; R278-L291 HydrophobicContact CG-CD2 3.82Å; R278-N304 PolarHBondContact NH1-ND2 2.95Å; R278-N304 PolarHBondContact NH1-OD1 2.95Å; R278-K350 WeakPolarHBondContact O-CE 3.24Å; R278-K350 PolarHBondContact O-NZ 2.71Å
279	L	92.6	Very high	81.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	163.2	-175.5	-66	-179.3	0	0	0	111	E288 S289 V290 L292 F343 T345 L354	L279-E288 CarbonylContact O-C 3.52Å; L279-E288 WeakPolarHBondContact O-CA 3.13Å; L279-E288 WeakPolarHBondContact O-CB 3.49Å; L279-S289 PolarHBondContact O-N 3.38Å; L279-V290 HydrophobicContact CB-CB 4.29Å; L279-V290 PolarHBondContact N-O 3.44Å; L279-V290 PolarHBondContact O-N 2.93Å; L279-V290 VanDerWaalsContact O-O 3.1Å; L279-L292 HydrophobicContact CD1-CB 3.72Å; L279-L292 HydrophobicContact CD1-CD1 4.42Å; L279-L292 HydrophobicContact CD1-CD2 4.2Å; L279-L292 HydrophobicContact CD1-CG 4.34Å; L279-L292 HydrophobicContact CG-CB 4.34Å; L279-F343 HydrophobicContact CB-CB 4.3Å; L279-F343 HydrophobicContact CD1-CB 3.77Å; L279-F343 HydrophobicContact CD1-CD2 4.39Å; L279-F343 HydrophobicContact CD1-CG 4.05Å; L279-T345 HydrophobicContact CD2-CG2 3.42Å; L279-T345 VanDerWaalsContact CD2-CG2 3.42Å; L279-L354 HydrophobicContact CD2-CD1 3.8Å
280	M	91.1	Very high	83.3	Confident	28 Å²	28	48.1 Å²	48.1	14%	0.138	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-101.9	145.6	167.6	-62.4	163.3	-76.1	0	0	109.8	N282 D285 G287 F343 F344 T345	M280-N282 WeakPolarHBondContact CB-O 3.18Å; M280-D285 HydrophobicContact CB-CB 4.17Å; M280-D285 HydrophobicContact CG-CB 4.23Å; M280-G287 WeakPolarHBondContact CG-O 3.37Å; M280-F343 WeakPolarHBondContact O-CA 3.44Å; M280-F344 HydrophobicContact CB-CB 4.19Å; M280-F344 HydrophobicContact CE-CB 4.04Å; M280-F344 WeakPolarHBondContact CE-O 3.44Å; M280-F344 PolarHBondContact N-O 2.99Å; M280-F344 PolarHBondContact O-N 3.29Å; M280-T345 VanDerWaalsContact CE-O 3.31Å; M280-T345 WeakPolarHBondContact CE-O 3.44Å
281	R	89.3	Confident	84.5	Confident	130 Å²	130	47.8 Å²	47.8	49%	0.491	26%	0.264	S	S	.	.	S	Bend	trans	-72	-45.5	172	-166.6	-178.8	-164.9	136	2.5	110.7	D285 S289 V290 E303 F344	R281-D285 WeakPolarHBondContact CA-OD2 3.36Å; R281-D285 WeakPolarHBondContact CB-OD2 3.44Å; R281-D285 PolarHBondContact N-OD2 2.91Å; R281-S289 PolarHBondContact N-OG 3.21Å; R281-V290 HydrophobicContact CB-CG2 3.91Å; R281-E303 IonicContact CZ-OE1 3.73Å; R281-E303 IonicContact NH1-OE1 2.66Å; R281-E303 PolarHBondContact NH1-OE1 3.39Å; R281-E303 IonicContact NH2-OE1 3.98Å; R281-F344 WeakPolarHBondContact O-CD2 3.47Å; R281-F344 WeakPolarHBondContact O-CE2 3.31Å
282	N	87	Confident	85.6	Confident	91 Å²	91	47.3 Å²	47.3	49%	0.487	26%	0.26	S	S	.	.	S	Bend	trans	-117	166.7	179.2	-43.3	-75.2	0	0	0	112.8	M280 G284 D285	M280-N282 WeakPolarHBondContact CB-O 3.18Å; N282-G284 PolarHBondContact O-N 2.93Å; N282-D285 VanDerWaalsContact CB-OD1 3.28Å; N282-D285 WeakPolarHBondContact CB-OD1 3.39Å; N282-D285 PolarHBondContact N-OD2 2.89Å; N282-D285 PolarHBondContact ND2-OD1 3.39Å
283	K	82.3	Confident	86	Confident	184 Å²	184	47.3 Å²	47.3	80%	0.8	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	88.7	177.3	-175.4	-149.1	168.6	-161.5	0	110.6	F344	K283-F344 HydrophobicContact CB-CD1 3.83Å; K283-F344 HydrophobicContact CB-CE1 3.65Å; K283-F344 HydrophobicContact CB-CE2 4.43Å; K283-F344 HydrophobicContact CB-CG 4.29Å; K283-F344 HydrophobicContact CB-CZ 3.98Å; K283-F344 HydrophobicContact CG-CD1 4.27Å; K283-F344 HydrophobicContact CG-CE1 4.26Å
284	G	74.1	Confident	86.2	Confident	65 Å²	65	47 Å²	47	67%	0.67	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.4	22.1	175.8	0	0	0	0	0	114.8	N282	N282-G284 PolarHBondContact O-N 2.93Å
285	D	78	Confident	86.3	Confident	34 Å²	34	47 Å²	47	18%	0.182	26%	0.258	C	S	.	.			trans	-51.5	139.4	165.7	-67.6	-19	0	0	0	109.8	M280 R281 N282 G287 S289	M280-D285 HydrophobicContact CB-CB 4.17Å; M280-D285 HydrophobicContact CG-CB 4.23Å; R281-D285 WeakPolarHBondContact CA-OD2 3.36Å; R281-D285 WeakPolarHBondContact CB-OD2 3.44Å; R281-D285 PolarHBondContact N-OD2 2.91Å; N282-D285 VanDerWaalsContact CB-OD1 3.28Å; N282-D285 WeakPolarHBondContact CB-OD1 3.39Å; N282-D285 PolarHBondContact N-OD2 2.89Å; N282-D285 PolarHBondContact ND2-OD1 3.39Å; D285-G287 PolarHBondContact O-N 2.84Å; D285-S289 PolarHBondContact OD2-OG 3.49Å
286	P	66.7	Low	86.1	Confident	147 Å²	147	46.5 Å²	46.5	96%	0.955	26%	0.257	S	S	*	.	S	Bend	trans	-77.5	59.8	-179.1	33.1	-36.7	0	0	0	112
287	G	72.5	Confident	86	Confident	44 Å²	44	46.8 Å²	46.8	45%	0.454	27%	0.266	S	S	.	.	S	Bend	trans	137.7	161.7	-176.1	0	0	0	0	0	111.9	M280 D285 S289	M280-G287 WeakPolarHBondContact CG-O 3.37Å; D285-G287 PolarHBondContact O-N 2.84Å; G287-S289 PolarHBondContact O-N 3.25Å
288	E	80.1	Confident	85.9	Confident	51 Å²	51	46.7 Å²	46.7	24%	0.238	27%	0.266	C	S	.	.			trans	-78.2	86.7	177.6	-63.1	178	121.2	0	0	109.7	R278 L279 V290 N304 K350	R278-E288 HydrophobicContact CB-CB 3.73Å; R278-E288 HydrophobicContact CB-CG 4.06Å; R278-E288 WeakPolarHBondContact CB-OE2 3.19Å; R278-E288 WeakPolarHBondContact CD-OE2 3.38Å; L279-E288 CarbonylContact O-C 3.52Å; L279-E288 WeakPolarHBondContact O-CA 3.13Å; L279-E288 WeakPolarHBondContact O-CB 3.49Å; E288-V290 VanDerWaalsContact C-N 3.3Å; E288-V290 PolarHBondContact O-N 3.4Å; E288-N304 WeakPolarHBondContact O-CB 3.45Å; E288-N304 PolarHBondContact O-ND2 2.76Å; E288-K350 IonicContact OE1-NZ 2.73Å; E288-K350 PolarHBondContact OE1-NZ 2.88Å
289	S	82.7	Confident	86	Confident	34 Å²	34	41.9 Å²	41.9	24%	0.238	25%	0.248	C	C	.	.			trans	-71.1	-8.4	-172.6	53.4	0	0	0	0	116.2	L279 R281 D285 G287 N304	L279-S289 PolarHBondContact O-N 3.38Å; R281-S289 PolarHBondContact N-OG 3.21Å; D285-S289 PolarHBondContact OD2-OG 3.49Å; G287-S289 PolarHBondContact O-N 3.25Å; S289-N304 PolarHBondContact O-N 3.4Å
290	V	88.3	Confident	85.8	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.8	-177.1	179.9	0	0	0	0	110.4	L279 R281 E288 L301 F302 F343	L279-V290 HydrophobicContact CB-CB 4.29Å; L279-V290 PolarHBondContact N-O 3.44Å; L279-V290 PolarHBondContact O-N 2.93Å; L279-V290 VanDerWaalsContact O-O 3.1Å; R281-V290 HydrophobicContact CB-CG2 3.91Å; E288-V290 VanDerWaalsContact C-N 3.3Å; E288-V290 PolarHBondContact O-N 3.4Å; V290-L301 HydrophobicContact CG1-CD2 4.06Å; V290-F302 CarbonylContact C-O 2.99Å; V290-F302 WeakPolarHBondContact CA-O 3.47Å; V290-F343 HydrophobicContact CB-CD1 4.4Å; V290-F343 HydrophobicContact CG1-CD1 4.13Å; V290-F343 HydrophobicContact CG1-CE1 3.96Å; V290-F343 HydrophobicContact CG2-CD1 4.22Å; V290-F343 HydrophobicContact CG2-CE1 4.23Å
291	L	88.9	Confident	85.8	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.3	165	-51.6	-162.9	0	0	0	110.7	I276 Y277 R278 L301 F302 N304 L309	I276-L291 HydrophobicContact CG2-CB 4.08Å; I276-L291 HydrophobicContact CG2-CD1 3.68Å; I276-L291 HydrophobicContact CG2-CG 4.38Å; Y277-L291 WeakPolarHBondContact O-CA 3.16Å; R278-L291 HydrophobicContact CB-CD2 4.29Å; R278-L291 HydrophobicContact CG-CD2 3.82Å; L291-L301 WeakPolarHBondContact O-CA 3.4Å; L291-F302 HydrophobicContact CB-CB 4.25Å; L291-F302 PolarHBondContact N-O 2.91Å; L291-F302 PolarHBondContact O-N 2.91Å; L291-N304 HydrophobicContact CD2-CB 3.9Å; L291-N304 HydrophobicContact CG-CB 4.02Å; L291-L309 HydrophobicContact CD1-CD1 3.71Å; L291-L309 HydrophobicContact CD1-CD2 3.52Å; L291-L309 HydrophobicContact CD1-CG 4.23Å; L291-L309 HydrophobicContact CG-CD2 3.97Å
292	L	92.2	Very high	85.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	110.3	171.2	180	86.9	0	0	0	108.1	Y277 L279 V294 I299 L301 F331 L354	Y277-L292 PolarHBondContact N-O 2.92Å; Y277-L292 PolarHBondContact O-N 3.41Å; L279-L292 HydrophobicContact CD1-CB 3.72Å; L279-L292 HydrophobicContact CD1-CD1 4.42Å; L279-L292 HydrophobicContact CD1-CD2 4.2Å; L279-L292 HydrophobicContact CD1-CG 4.34Å; L279-L292 HydrophobicContact CG-CB 4.34Å; L292-V294 HydrophobicContact CD2-CG2 4.37Å; L292-I299 HydrophobicContact CD1-CG2 3.36Å; L292-I299 HydrophobicContact CG-CG2 4.24Å; L292-L301 HydrophobicContact CB-CD2 4.45Å; L292-L301 HydrophobicContact CD1-CD2 3.68Å; L292-F331 HydrophobicContact CD1-CE1 4.33Å; L292-F331 HydrophobicContact CD2-CE1 4.13Å; L292-L354 HydrophobicContact CD2-CD1 4.43Å; L292-L354 HydrophobicContact CD2-CD2 4.22Å
293	A	92	Very high	85.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	126.5	171.9	0	0	0	0	0	110.1	A271 A274 H275 I276 I299 Q300 F302	A271-A293 HydrophobicContact CB-CB 4.18Å; A274-A293 HydrophobicContact CB-CB 3.99Å; H275-A293 CarbonylContact O-C 3.53Å; H275-A293 WeakPolarHBondContact O-CA 3.42Å; I276-A293 HydrophobicContact CG1-CB 4.35Å; A293-I299 WeakPolarHBondContact O-CA 2.98Å; A293-Q300 HydrophobicContact CB-CB 4.28Å; A293-Q300 PolarHBondContact N-O 2.9Å; A293-Q300 PolarHBondContact O-N 3.36Å; A293-F302 HydrophobicContact CB-CD2 4.39Å; A293-F302 HydrophobicContact CB-CE2 3.78Å
294	V	94.1	Very high	84.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	109.2	174.4	-176.8	0	0	0	0	108.1	A274 H275 Y277 L292 W318 F357 F361	A274-V294 CarbonylContact C-O 3.45Å; A274-V294 VanDerWaalsContact CA-O 3.31Å; A274-V294 WeakPolarHBondContact CA-O 3.46Å; A274-V294 WeakPolarHBondContact CB-O 3.42Å; H275-V294 HydrophobicContact CB-CB 4.42Å; H275-V294 PolarHBondContact N-O 3.37Å; H275-V294 PolarHBondContact O-N 2.89Å; Y277-V294 HydrophobicContact CD2-CG2 4.37Å; Y277-V294 HydrophobicContact CE2-CG2 4.33Å; L292-V294 HydrophobicContact CD2-CG2 4.37Å; V294-W318 HydrophobicContact CG1-CH2 3.95Å; V294-W318 HydrophobicContact CG1-CZ2 3.91Å; V294-F357 HydrophobicContact CB-CE1 4.11Å; V294-F357 HydrophobicContact CG1-CE1 4.06Å; V294-F357 HydrophobicContact CG2-CD1 4.44Å; V294-F357 HydrophobicContact CG2-CE1 4.38Å; V294-F361 HydrophobicContact CG1-CB 4.4Å; V294-F361 HydrophobicContact CG1-CD1 3.88Å; V294-F361 HydrophobicContact CG1-CD2 4.33Å; V294-F361 HydrophobicContact CG1-CE1 4.24Å; V294-F361 HydrophobicContact CG1-CG 3.94Å
295	A	92.2	Very high	84	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.008	17%	0.174	C	C	.	.			trans	-123.2	168.8	-170	0	0	0	0	0	111.1	A274 A297 G298 W318 F361	A274-A295 HydrophobicContact CB-CB 3.74Å; A295-A297 PolarHBondContact O-N 2.94Å; A295-G298 CarbonylContact C-O 3.55Å; A295-G298 PolarHBondContact N-O 3.09Å; A295-G298 PolarHBondContact O-N 3.27Å; A295-G298 VanDerWaalsContact O-O 3.05Å; A295-W318 PolarHBondContact O-NE1 2.93Å; A295-W318 VanDerWaalsContact O-NE1 3.13Å; A295-F361 VanDerWaalsContact O-CE1 3.31Å; A295-F361 WeakPolarHBondContact O-CE1 3.34Å
296	P	90.7	Very high	82.8	Confident	6 Å²	6	31 Å²	31	4%	0.039	20%	0.2	C	C	.	.	S	Bend	trans	-68.3	-38.5	-177.8	-13.4	30.5	0	0	0	110.8	Y155 D157 N273 G298 W318 L365	Y155-P296 WeakPolarHBondContact O-CG 3.16Å; D157-P296 WeakPolarHBondContact OD1-CB 3.3Å; D157-P296 VanDerWaalsContact OD1-CG 3.29Å; D157-P296 WeakPolarHBondContact OD1-CG 3.33Å; N273-P296 WeakPolarHBondContact O-CD 3.39Å; P296-G298 VanDerWaalsContact C-N 3.33Å; P296-G298 PolarHBondContact O-N 3.04Å; P296-W318 PolarHBondContact O-NE1 3.06Å; P296-L365 HydrophobicContact CB-CD1 4.18Å; P296-L365 HydrophobicContact CB-CD2 4.39Å; P296-L365 WeakPolarHBondContact O-CD2 3.18Å
297	A	87.2	Confident	82	Confident	53 Å²	53	30.5 Å²	30.5	44%	0.438	19%	0.19	S	C	.	.	S	Bend	trans	-62	-31.6	171.7	0	0	0	0	0	114.6	A295 P317 W318	A295-A297 PolarHBondContact O-N 2.94Å; A297-P317 WeakPolarHBondContact O-CA 3.4Å; A297-W318 PolarHBondContact O-N 2.77Å
298	G	91	Very high	81	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	-154.7	-173.7	0	0	0	0	0	114.9	A295 P296 F316	A295-G298 CarbonylContact C-O 3.55Å; A295-G298 PolarHBondContact N-O 3.09Å; A295-G298 PolarHBondContact O-N 3.27Å; A295-G298 VanDerWaalsContact O-O 3.05Å; P296-G298 VanDerWaalsContact C-N 3.33Å; P296-G298 PolarHBondContact O-N 3.04Å; G298-F316 CarbonylContact C-O 3.42Å; G298-F316 VanDerWaalsContact CA-O 3.32Å; G298-F316 WeakPolarHBondContact CA-O 3.48Å
299	I	92.3	Very high	79.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.3	172.6	-66.8	-176.3	0	0	0	109.7	L292 A293 F316 W318 I321 L324 L333	L292-I299 HydrophobicContact CD1-CG2 3.36Å; L292-I299 HydrophobicContact CG-CG2 4.24Å; A293-I299 WeakPolarHBondContact O-CA 2.98Å; I299-F316 PolarHBondContact N-O 2.98Å; I299-F316 PolarHBondContact O-N 3.04Å; I299-W318 HydrophobicContact CD1-CH2 4.31Å; I299-W318 HydrophobicContact CD1-CZ3 4.31Å; I299-W318 HydrophobicContact CG1-CH2 4Å; I299-W318 HydrophobicContact CG1-CZ3 4.27Å; I299-I321 HydrophobicContact CB-CD1 4Å; I299-I321 HydrophobicContact CD1-CD1 3.89Å; I299-I321 HydrophobicContact CG1-CD1 3.79Å; I299-L324 HydrophobicContact CD1-CD1 3.94Å; I299-L324 HydrophobicContact CD1-CD2 4.02Å; I299-L333 HydrophobicContact CB-CD1 4.31Å; I299-L333 HydrophobicContact CD1-CD1 4.28Å; I299-L333 HydrophobicContact CG2-CD1 4.05Å
300	Q	89.8	Confident	78.7	Confident	26 Å²	26	35.7 Å²	35.7	12%	0.121	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	147.9	174.2	-65.9	172	-1.6	0	0	110.7	A293 F302 P312	A293-Q300 HydrophobicContact CB-CB 4.28Å; A293-Q300 PolarHBondContact N-O 2.9Å; A293-Q300 PolarHBondContact O-N 3.36Å; Q300-F302 HydrophobicContact CB-CE2 3.68Å; Q300-F302 HydrophobicContact CB-CZ 4.16Å; Q300-P312 HydrophobicContact CB-CB 4.48Å
301	L	89.6	Confident	77.6	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.052	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132.2	179.8	-68	174.1	0	0	0	110.8	V290 L291 L292 P312 V313 A314 F316 L341 F343	V290-L301 HydrophobicContact CG1-CD2 4.06Å; L291-L301 WeakPolarHBondContact O-CA 3.4Å; L292-L301 HydrophobicContact CB-CD2 4.45Å; L292-L301 HydrophobicContact CD1-CD2 3.68Å; L301-P312 CarbonylContact O-C 3.41Å; L301-P312 VanDerWaalsContact O-CA 3.28Å; L301-P312 WeakPolarHBondContact O-CA 3.46Å; L301-V313 PolarHBondContact O-N 3.23Å; L301-A314 HydrophobicContact CD1-CB 4.34Å; L301-A314 PolarHBondContact N-O 3.18Å; L301-A314 PolarHBondContact O-N 3.39Å; L301-F316 HydrophobicContact CD1-CE2 3.99Å; L301-L341 HydrophobicContact CD1-CD1 3.5Å; L301-L341 VanDerWaalsContact CD1-CD1 3.5Å; L301-F343 HydrophobicContact CD1-CE1 4.43Å; L301-F343 HydrophobicContact CD1-CE2 3.92Å; L301-F343 HydrophobicContact CD1-CZ 3.46Å; L301-F343 VanDerWaalsContact CD1-CZ 3.46Å; L301-F343 HydrophobicContact CD2-CE1 4.49Å; L301-F343 HydrophobicContact CD2-CE2 4.05Å; L301-F343 HydrophobicContact CD2-CZ 3.91Å; L301-F343 HydrophobicContact CG-CZ 4.36Å
302	F	84.2	Confident	76.8	Confident	7 Å²	7	42.6 Å²	42.6	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.8	177.8	-54.1	-104.2	0	0	0	109.2	A271 V290 L291 A293 Q300 L309 R310 P312	A271-F302 HydrophobicContact CB-CE2 4.29Å; A271-F302 HydrophobicContact CB-CZ 4.07Å; V290-F302 CarbonylContact C-O 2.99Å; V290-F302 WeakPolarHBondContact CA-O 3.47Å; L291-F302 HydrophobicContact CB-CB 4.25Å; L291-F302 PolarHBondContact N-O 2.91Å; L291-F302 PolarHBondContact O-N 2.91Å; A293-F302 HydrophobicContact CB-CD2 4.39Å; A293-F302 HydrophobicContact CB-CE2 3.78Å; Q300-F302 HydrophobicContact CB-CE2 3.68Å; Q300-F302 HydrophobicContact CB-CZ 4.16Å; F302-L309 HydrophobicContact CB-CD2 4.3Å; F302-R310 WeakPolarHBondContact CD1-O 3.14Å; F302-P312 HydrophobicContact CD1-CB 4.21Å; F302-P312 HydrophobicContact CE1-CB 3.79Å; F302-P312 HydrophobicContact CE1-CG 4.22Å; F302-P312 HydrophobicContact CE2-CB 4.45Å; F302-P312 HydrophobicContact CZ-CB 3.91Å; F302-P312 HydrophobicContact CZ-CG 4.46Å
303	E	79.6	Confident	76.3	Confident	35 Å²	35	46.5 Å²	46.5	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	125.8	169	-81.9	176.6	-172.4	0	0	109.8	R281 H305 V313	R281-E303 IonicContact CZ-OE1 3.73Å; R281-E303 IonicContact NH1-OE1 2.66Å; R281-E303 PolarHBondContact NH1-OE1 3.39Å; R281-E303 IonicContact NH2-OE1 3.98Å; E303-H305 VanDerWaalsContact CB-CE1 3.49Å; E303-H305 WeakPolarHBondContact CB-CE1 3.41Å; E303-H305 VanDerWaalsContact CD-CE1 3.42Å; E303-H305 PolarHBondContact O-N 3.18Å; E303-H305 IonicContact OE2-CE1 2.58Å; E303-H305 PolarHBondContact OE2-CE1 3.14Å; E303-H305 IonicContact OE2-NE2 3.36Å; E303-H305 PolarHBondContact OE2-NE2 3.47Å; E303-V313 HydrophobicContact CB-CG2 4.18Å; E303-V313 HydrophobicContact CG-CG2 3.97Å
304	N	69.3	Low	76.1	Confident	49 Å²	49	47.9 Å²	47.9	26%	0.262	27%	0.265	S	S	.	.			trans	-90	76.8	-177.7	-174.6	58.1	0	0	0	109.5	R278 E288 S289 L291	R278-N304 PolarHBondContact NH1-ND2 2.95Å; R278-N304 PolarHBondContact NH1-OD1 2.95Å; E288-N304 WeakPolarHBondContact O-CB 3.45Å; E288-N304 PolarHBondContact O-ND2 2.76Å; S289-N304 PolarHBondContact O-N 3.4Å; L291-N304 HydrophobicContact CD2-CB 3.9Å; L291-N304 HydrophobicContact CG-CB 4.02Å
305	H	62.4	Low	75.8	Confident	86 Å²	86	50.8 Å²	50.8	40%	0.398	29%	0.285	S	S	.	.			trans	-75.2	161.8	169.4	-64.5	-5.5	0	0	0	110.3	E303 D307 R310	E303-H305 VanDerWaalsContact CB-CE1 3.49Å; E303-H305 WeakPolarHBondContact CB-CE1 3.41Å; E303-H305 VanDerWaalsContact CD-CE1 3.42Å; E303-H305 PolarHBondContact O-N 3.18Å; E303-H305 IonicContact OE2-CE1 2.58Å; E303-H305 PolarHBondContact OE2-CE1 3.14Å; E303-H305 IonicContact OE2-NE2 3.36Å; E303-H305 PolarHBondContact OE2-NE2 3.47Å; H305-D307 VanDerWaalsContact C-N 3.25Å; H305-D307 PolarHBondContact O-N 2.88Å; H305-R310 VanDerWaalsContact CD2-CZ 3.45Å; H305-R310 PolarHBondContact CD2-NE 3.48Å; H305-R310 PolarHBondContact NE2-NH1 2.92Å
306	A	54	Low	75.8	Confident	89 Å²	89	51.2 Å²	51.2	74%	0.736	29%	0.287	S	S	*	.	S	Bend	trans	-64.1	-33.8	177.5	0	0	0	0	0	112.4	N308	A306-N308 PolarHBondContact O-N 3.4Å
307	D	48.6	Very low	75.8	Confident	137 Å²	137	53.1 Å²	53.1	73%	0.733	30%	0.299	S	S	*	.	S	Bend	trans	-105.7	62	-168.1	-47.1	-58.1	0	0	0	111.5	H305	H305-D307 VanDerWaalsContact C-N 3.25Å; H305-D307 PolarHBondContact O-N 2.88Å
308	N	52.3	Low	76	Confident	86 Å²	86	50.8 Å²	50.8	46%	0.46	28%	0.28	S	S	.	.			trans	75.7	160	-178.6	-48.2	-69.3	0	0	0	116.1	A306	A306-N308 PolarHBondContact O-N 3.4Å
309	L	54.4	Low	75.8	Confident	16 Å²	16	52.4 Å²	52.4	8%	0.084	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75	129.7	171.5	-61.2	176.8	0	0	0	109.9	L291 F302	L291-L309 HydrophobicContact CD1-CD1 3.71Å; L291-L309 HydrophobicContact CD1-CD2 3.52Å; L291-L309 HydrophobicContact CD1-CG 4.23Å; L291-L309 HydrophobicContact CG-CD2 3.97Å; F302-L309 HydrophobicContact CB-CD2 4.3Å
310	R	58.9	Low	75.6	Confident	137 Å²	137	56.8 Å²	56.8	52%	0.517	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-76	172.9	165.9	-65.4	179.4	172	176.8	-1	110	F302 H305	F302-R310 WeakPolarHBondContact CD1-O 3.14Å; H305-R310 VanDerWaalsContact CD2-CZ 3.45Å; H305-R310 PolarHBondContact CD2-NE 3.48Å; H305-R310 PolarHBondContact NE2-NH1 2.92Å
311	F	65.4	Low	75.7	Confident	109 Å²	109	55.6 Å²	55.6	48%	0.478	31%	0.308	S	S	.	.	S	Bend	trans	-48.9	154.2	168.5	-63	-75.4	0	0	0	112.3	L186 L187 V313	L186-F311 WeakPolarHBondContact O-CE1 3.48Å; L186-F311 WeakPolarHBondContact O-CZ 3.16Å; L187-F311 HydrophobicContact CD2-CD1 3.76Å; L187-F311 HydrophobicContact CD2-CE1 4.04Å; L187-F311 HydrophobicContact CD2-CG 4.36Å; F311-V313 PolarHBondContact O-N 2.98Å
312	P	72.7	Confident	75.6	Confident	46 Å²	46	56.2 Å²	56.2	30%	0.299	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-57.9	117.5	178	23.6	-32.9	0	0	0	110.3	Q300 L301 F302 A314	Q300-P312 HydrophobicContact CB-CB 4.48Å; L301-P312 CarbonylContact O-C 3.41Å; L301-P312 VanDerWaalsContact O-CA 3.28Å; L301-P312 WeakPolarHBondContact O-CA 3.46Å; F302-P312 HydrophobicContact CD1-CB 4.21Å; F302-P312 HydrophobicContact CE1-CB 3.79Å; F302-P312 HydrophobicContact CE1-CG 4.22Å; F302-P312 HydrophobicContact CE2-CB 4.45Å; F302-P312 HydrophobicContact CZ-CB 3.91Å; F302-P312 HydrophobicContact CZ-CG 4.46Å; P312-A314 PolarHBondContact O-N 3.38Å
313	V	81.9	Confident	75.9	Confident	82 Å²	82	58.6 Å²	58.6	50%	0.497	33%	0.327	S	S	.	.	S	Bend	trans	-69.6	-26.4	-177.5	178.5	0	0	0	0	111	L301 E303 F311	L301-V313 PolarHBondContact O-N 3.23Å; E303-V313 HydrophobicContact CB-CG2 4.18Å; E303-V313 HydrophobicContact CG-CG2 3.97Å; F311-V313 PolarHBondContact O-N 2.98Å
314	A	86.8	Confident	76.5	Confident	30 Å²	30	56.9 Å²	56.9	25%	0.248	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	154.9	163.6	0	0	0	0	0	110.6	L301 P312 F316	L301-A314 HydrophobicContact CD1-CB 4.34Å; L301-A314 PolarHBondContact N-O 3.18Å; L301-A314 PolarHBondContact O-N 3.39Å; P312-A314 PolarHBondContact O-N 3.38Å; A314-F316 HydrophobicContact CB-CD2 4.4Å; A314-F316 HydrophobicContact CB-CE2 3.6Å; A314-F316 HydrophobicContact CB-CZ 4.08Å
315	S	88.7	Confident	77.6	Confident	60 Å²	60	55.3 Å²	55.3	42%	0.42	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.4	172.8	-174.6	0	0	0	0	108.7
316	F	91.4	Very high	79.1	Confident	10 Å²	10	52.4 Å²	52.4	4%	0.044	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	97.6	180	-64.9	-82.3	0	0	0	108.7	G298 I299 L301 A314 I321 L333 L341	G298-F316 CarbonylContact C-O 3.42Å; G298-F316 VanDerWaalsContact CA-O 3.32Å; G298-F316 WeakPolarHBondContact CA-O 3.48Å; I299-F316 PolarHBondContact N-O 2.98Å; I299-F316 PolarHBondContact O-N 3.04Å; L301-F316 HydrophobicContact CD1-CE2 3.99Å; A314-F316 HydrophobicContact CB-CD2 4.4Å; A314-F316 HydrophobicContact CB-CE2 3.6Å; A314-F316 HydrophobicContact CB-CZ 4.08Å; F316-I321 HydrophobicContact CB-CD1 4.13Å; F316-I321 HydrophobicContact CB-CG1 3.78Å; F316-I321 WeakPolarHBondContact O-CD1 3.46Å; F316-L333 HydrophobicContact CB-CD1 4.31Å; F316-L333 HydrophobicContact CD1-CD2 3.82Å; F316-L333 HydrophobicContact CD2-CD1 3.98Å; F316-L333 HydrophobicContact CD2-CD2 4.02Å; F316-L333 HydrophobicContact CE1-CD2 3.96Å; F316-L333 HydrophobicContact CE2-CD2 4.15Å; F316-L333 HydrophobicContact CG-CD1 4.14Å; F316-L333 HydrophobicContact CG-CD2 3.86Å; F316-L333 HydrophobicContact CZ-CD2 4.12Å; F316-L341 HydrophobicContact CE2-CD1 3.5Å; F316-L341 VanDerWaalsContact CE2-CD1 3.5Å; F316-L341 HydrophobicContact CZ-CD1 3.56Å; F316-L341 HydrophobicContact CZ-CG 4.34Å
317	P	90.9	Very high	80.8	Confident	46 Å²	46	51.4 Å²	51.4	30%	0.299	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	148	170.6	-25.5	34.4	0	0	0	111.3	A297 A319 Q320 I321	A297-P317 WeakPolarHBondContact O-CA 3.4Å; P317-A319 PolarHBondContact O-N 3.25Å; P317-A319 VanDerWaalsContact O-N 3.09Å; P317-Q320 HydrophobicContact CB-CG 4.42Å; P317-Q320 HydrophobicContact CG-CG 4.43Å; P317-Q320 PolarHBondContact O-N 3.47Å; P317-I321 PolarHBondContact O-N 3.25Å
318	W	91	Very high	82.8	Confident	5 Å²	5	54 Å²	54	2%	0.019	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-53.8	-35.6	-179.5	-68.3	110.3	0	0	0	113.1	V294 A295 P296 A297 I299 Q320 I321 C358 F361 H362 C679	V294-W318 HydrophobicContact CG1-CH2 3.95Å; V294-W318 HydrophobicContact CG1-CZ2 3.91Å; A295-W318 PolarHBondContact O-NE1 2.93Å; A295-W318 VanDerWaalsContact O-NE1 3.13Å; P296-W318 PolarHBondContact O-NE1 3.06Å; A297-W318 PolarHBondContact O-N 2.77Å; I299-W318 HydrophobicContact CD1-CH2 4.31Å; I299-W318 HydrophobicContact CD1-CZ3 4.31Å; I299-W318 HydrophobicContact CG1-CH2 4Å; I299-W318 HydrophobicContact CG1-CZ3 4.27Å; W318-Q320 VanDerWaalsContact C-N 3.27Å; W318-Q320 PolarHBondContact O-N 3.09Å; W318-I321 HydrophobicContact CE3-CD1 3.85Å; W318-I321 HydrophobicContact CZ3-CD1 4.11Å; W318-I321 PolarHBondContact O-N 3.4Å; W318-C358 HydrophobicContact CH2-CB 4.27Å; W318-C358 HydrophobicContact CZ3-CB 4.46Å; W318-F361 HydrophobicContact CH2-CD1 4.39Å; W318-F361 AromaticContact CZ2-CD1 3.69Å; W318-F361 HydrophobicContact CZ2-CD1 3.69Å; W318-F361 HydrophobicContact CZ2-CE1 4Å; W318-H362 VanDerWaalsContact CB-CE1 3.41Å; W318-H362 WeakPolarHBondContact CB-CE1 3.27Å; W318-H362 WeakPolarHBondContact CB-NE2 3.31Å; W318-H362 AromaticContact CD1-CE1 3.24Å; W318-H362 HydrophobicContact CD2-CB 4.36Å; W318-H362 AromaticContact CD2-CE1 2.92Å; W318-H362 AromaticContact CD2-ND1 3.5Å; W318-H362 AromaticContact CE2-CE1 3.42Å; W318-H362 VanDerWaalsContact CE2-CE1 3.42Å; W318-H362 HydrophobicContact CE3-CB 4.07Å; W318-H362 AromaticContact CE3-CE1 3.47Å; W318-H362 VanDerWaalsContact CE3-CE1 3.47Å; W318-H362 AromaticContact CE3-CG 3.95Å; W318-H362 AromaticContact CE3-ND1 3.71Å; W318-H362 AromaticContact CG-CE1 2.85Å; W318-H362 AromaticContact CG-ND1 3.53Å; W318-H362 AromaticContact CG-NE2 3.89Å; W318-H362 HydrophobicContact CH2-CB 4.32Å; W318-H362 HydrophobicContact CZ3-CB 4.05Å; W318-H362 AromaticContact NE1-CE1 3.54Å; W318-C679 HydrophobicContact CE3-CB 4.38Å; W318-C679 WeakPolarHBondContact O-CB 3.49Å
319	A	86.9	Confident	84.7	Confident	35 Å²	35	56.9 Å²	56.9	29%	0.289	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-57.2	-33.5	173.2	0	0	0	0	0	114.7	P317 D681	P317-A319 PolarHBondContact O-N 3.25Å; P317-A319 VanDerWaalsContact O-N 3.09Å; A319-D681 HydrophobicContact CB-CB 3.59Å; A319-D681 VanDerWaalsContact CB-OD2 3.23Å; A319-D681 WeakPolarHBondContact CB-OD2 3.47Å
320	Q	89.1	Confident	86.6	Confident	92 Å²	92	59.9 Å²	59.9	43%	0.43	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-93.3	-6.3	-176.4	-63	-177.9	0.8	0	0	112.4	P317 W318 G322 S335 T336	P317-Q320 HydrophobicContact CB-CG 4.42Å; P317-Q320 HydrophobicContact CG-CG 4.43Å; P317-Q320 PolarHBondContact O-N 3.47Å; W318-Q320 VanDerWaalsContact C-N 3.27Å; W318-Q320 PolarHBondContact O-N 3.09Å; Q320-G322 PolarHBondContact O-N 3.1Å; Q320-S335 CarbonylContact O-C 3.55Å; Q320-S335 WeakPolarHBondContact O-CA 3.3Å; Q320-S335 PolarHBondContact O-OG 3.43Å; Q320-T336 PolarHBondContact O-N 3.01Å; Q320-T336 PolarHBondContact O-OG1 3.02Å
321	I	91.4	Very high	88.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.			trans	-84.1	82.1	178.1	-61.1	170.5	0	0	0	109.4	I299 F316 P317 W318 K323 L324 C679	I299-I321 HydrophobicContact CB-CD1 4Å; I299-I321 HydrophobicContact CD1-CD1 3.89Å; I299-I321 HydrophobicContact CG1-CD1 3.79Å; F316-I321 HydrophobicContact CB-CD1 4.13Å; F316-I321 HydrophobicContact CB-CG1 3.78Å; F316-I321 WeakPolarHBondContact O-CD1 3.46Å; P317-I321 PolarHBondContact O-N 3.25Å; W318-I321 HydrophobicContact CE3-CD1 3.85Å; W318-I321 HydrophobicContact CZ3-CD1 4.11Å; W318-I321 PolarHBondContact O-N 3.4Å; I321-K323 VanDerWaalsContact C-N 3.26Å; I321-K323 PolarHBondContact O-N 3.4Å; I321-L324 HydrophobicContact CG2-CD1 4.29Å; I321-L324 HydrophobicContact CG2-CD2 3.53Å; I321-L324 HydrophobicContact CG2-CG 3.55Å; I321-C679 HydrophobicContact CB-CB 4.02Å; I321-C679 HydrophobicContact CG2-CB 4.39Å; I321-C679 WeakPolarHBondContact O-CB 3.31Å; I321-C679 PolarHBondContact O-N 2.69Å
322	G	88.1	Confident	89.6	Confident	24 Å²	24	49.3 Å²	49.3	25%	0.247	26%	0.255	C	S	.	.			trans	-58.2	-36.8	177.2	0	0	0	0	0	112.9	Q320 V334 T678	Q320-G322 PolarHBondContact O-N 3.1Å; G322-V334 PolarHBondContact N-O 3.37Å; G322-V334 VanDerWaalsContact N-O 3.13Å; G322-T678 WeakPolarHBondContact O-CG2 3.45Å
323	K	89.8	Confident	90.6	Very high	56 Å²	56	47.2 Å²	47.2	24%	0.243	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	123.4	178.5	178.4	162.2	-174.1	143.7	0	114.7	I321 V334 H670 T676 I677	I321-K323 VanDerWaalsContact C-N 3.26Å; I321-K323 PolarHBondContact O-N 3.4Å; K323-V334 HydrophobicContact CB-CB 4.07Å; K323-V334 HydrophobicContact CB-CG2 4.22Å; K323-V334 HydrophobicContact CG-CG2 4.49Å; K323-V334 PolarHBondContact N-O 3.28Å; K323-V334 PolarHBondContact O-N 2.97Å; K323-H670 PolarHBondContact NZ-CE1 2.89Å; K323-H670 PolarHBondContact NZ-NE2 3.31Å; K323-H670 VanDerWaalsContact NZ-NE2 3.18Å; K323-T676 HydrophobicContact CD-CG2 3.98Å; K323-T676 WeakPolarHBondContact CE-OG1 3.35Å; K323-T676 HydrophobicContact CG-CG2 3.96Å; K323-T676 PolarHBondContact NZ-OG1 2.79Å; K323-I677 WeakPolarHBondContact CA-O 3.28Å
324	L	93.4	Very high	91.1	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	141.5	159.2	-59.4	179.5	0	0	0	110.2	I299 I321 F331 L332 L333 L355 C358 T676 I677	I299-L324 HydrophobicContact CD1-CD1 3.94Å; I299-L324 HydrophobicContact CD1-CD2 4.02Å; I321-L324 HydrophobicContact CG2-CD1 4.29Å; I321-L324 HydrophobicContact CG2-CD2 3.53Å; I321-L324 HydrophobicContact CG2-CG 3.55Å; L324-F331 HydrophobicContact CD2-CZ 4.37Å; L324-L332 WeakPolarHBondContact CA-O 3.47Å; L324-L333 HydrophobicContact CD2-CB 4.01Å; L324-L333 HydrophobicContact CD2-CD1 3.99Å; L324-L333 HydrophobicContact CD2-CG 3.82Å; L324-L355 HydrophobicContact CB-CD1 3.5Å; L324-L355 VanDerWaalsContact CB-CD1 3.5Å; L324-C358 HydrophobicContact CD1-CB 3.54Å; L324-T676 CarbonylContact O-C 3.38Å; L324-T676 VanDerWaalsContact O-CA 3.25Å; L324-T676 WeakPolarHBondContact O-CA 3.49Å; L324-I677 HydrophobicContact CB-CB 4.44Å; L324-I677 HydrophobicContact CB-CD1 4.33Å; L324-I677 HydrophobicContact CD1-CD1 4.38Å; L324-I677 PolarHBondContact N-O 3.22Å; L324-I677 PolarHBondContact O-N 3.35Å
325	S	92.4	Very high	91.3	Very high	16 Å²	16	43.9 Å²	43.9	11%	0.112	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	168.3	175.3	53	0	0	0	0	113	L332 T675	S325-L332 PolarHBondContact N-O 3.48Å; S325-L332 PolarHBondContact O-N 3.24Å; S325-T675 VanDerWaalsContact CA-O 3.27Å; S325-T675 WeakPolarHBondContact CA-O 3.45Å; S325-T675 WeakPolarHBondContact CB-O 3.29Å
326	F	92.3	Very high	91.3	Very high	24 Å²	24	45.4 Å²	45.4	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.9	172.4	85.3	-84.7	0	0	0	112.5	K330 A351 R352 L355 T675	F326-K330 CarbonylContact C-O 3.58Å; F326-K330 WeakPolarHBondContact CA-O 3.43Å; F326-K330 VanDerWaalsContact CB-O 3.31Å; F326-K330 WeakPolarHBondContact CB-O 3.36Å; F326-A351 HydrophobicContact CB-CB 4.13Å; F326-A351 HydrophobicContact CD2-CB 4.12Å; F326-A351 HydrophobicContact CG-CB 4.4Å; F326-R352 HydrophobicContact CE1-CB 4.15Å; F326-R352 HydrophobicContact CE1-CG 4.16Å; F326-R352 HydrophobicContact CE2-CB 3.97Å; F326-R352 HydrophobicContact CZ-CB 3.74Å; F326-R352 HydrophobicContact CZ-CG 3.87Å; F326-L355 HydrophobicContact CD1-CB 4.13Å; F326-L355 HydrophobicContact CD1-CD2 3.68Å; F326-L355 HydrophobicContact CE1-CD2 4.19Å; F326-T675 HydrophobicContact CD1-CG2 4.46Å; F326-T675 HydrophobicContact CE1-CG2 3.95Å; F326-T675 HydrophobicContact CZ-CG2 4.28Å
327	D	90.1	Very high	91.2	Very high	68 Å²	68	49.7 Å²	49.7	36%	0.364	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	103.6	173.1	165.4	39.4	0	0	0	109.4	R329 K330 L332	D327-R329 PolarHBondContact O-N 3.41Å; D327-K330 HydrophobicContact CB-CB 4.35Å; D327-K330 HydrophobicContact CB-CD 4.25Å; D327-K330 PolarHBondContact N-O 3.47Å; D327-K330 VanDerWaalsContact O-CB 3.3Å; D327-K330 WeakPolarHBondContact O-CB 3.31Å; D327-K330 PolarHBondContact O-N 3.07Å; D327-K330 WeakPolarHBondContact OD2-CD 3.27Å; D327-K330 WeakPolarHBondContact OD2-CE 3.48Å; D327-K330 IonicContact OD2-NZ 2.74Å; D327-K330 PolarHBondContact OD2-NZ 3.25Å; D327-L332 HydrophobicContact CB-CD1 4.43Å
328	R	91.1	Very high	91	Very high	192 Å²	192	50 Å²	50	73%	0.725	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	-110.9	-172.2	-53.6	176.5	-172.7	-162.4	0	110.4	D348 A351	R328-D348 WeakPolarHBondContact CA-OD1 3.23Å; R328-D348 WeakPolarHBondContact O-CA 3.31Å; R328-D348 WeakPolarHBondContact O-CB 3.47Å; R328-A351 WeakPolarHBondContact O-CB 3.21Å
329	R	92.8	Very high	90.8	Very high	146 Å²	146	54.8 Å²	54.8	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.2	176.5	-57.4	-165.9	-167.3	-176.4	9.4	113.9	D327 T345 S346	D327-R329 PolarHBondContact O-N 3.41Å; R329-T345 WeakPolarHBondContact CA-OG1 3.42Å; R329-T345 WeakPolarHBondContact CD-O 3.08Å; R329-T345 PolarHBondContact O-N 2.75Å; R329-T345 PolarHBondContact O-OG1 2.7Å; R329-S346 PolarHBondContact NH1-O 3.17Å
330	K	93.1	Very high	91	Very high	80 Å²	80	59.8 Å²	59.8	35%	0.348	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.6	178	-57.7	174.7	-167.5	152	0	109.7	F326 D327 L332 T342 F343 F344	F326-K330 CarbonylContact C-O 3.58Å; F326-K330 WeakPolarHBondContact CA-O 3.43Å; F326-K330 VanDerWaalsContact CB-O 3.31Å; F326-K330 WeakPolarHBondContact CB-O 3.36Å; D327-K330 HydrophobicContact CB-CB 4.35Å; D327-K330 HydrophobicContact CB-CD 4.25Å; D327-K330 PolarHBondContact N-O 3.47Å; D327-K330 VanDerWaalsContact O-CB 3.3Å; D327-K330 WeakPolarHBondContact O-CB 3.31Å; D327-K330 PolarHBondContact O-N 3.07Å; D327-K330 WeakPolarHBondContact OD2-CD 3.27Å; D327-K330 WeakPolarHBondContact OD2-CE 3.48Å; D327-K330 IonicContact OD2-NZ 2.74Å; D327-K330 PolarHBondContact OD2-NZ 3.25Å; K330-L332 HydrophobicContact CB-CD1 3.72Å; K330-T342 HydrophobicContact CB-CG2 4.32Å; K330-T342 HydrophobicContact CD-CG2 4.5Å; K330-T342 HydrophobicContact CG-CG2 4.46Å; K330-F343 CarbonylContact C-O 3.6Å; K330-F343 VanDerWaalsContact CA-O 3.29Å; K330-F343 WeakPolarHBondContact CA-O 3.4Å; K330-F344 HydrophobicContact CD-CE1 4.44Å; K330-F344 HydrophobicContact CG-CD1 4.03Å; K330-F344 HydrophobicContact CG-CE1 3.66Å; K330-F344 HydrophobicContact CG-CZ 4.38Å
331	F	94	Very high	91.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.6	164.4	-174.8	-103.3	0	0	0	107.8	L292 L324 T342 F343 L354 L355	L292-F331 HydrophobicContact CD1-CE1 4.33Å; L292-F331 HydrophobicContact CD2-CE1 4.13Å; L324-F331 HydrophobicContact CD2-CZ 4.37Å; F331-T342 WeakPolarHBondContact O-CA 3.46Å; F331-F343 PolarHBondContact N-O 2.71Å; F331-F343 PolarHBondContact O-N 3.31Å; F331-L354 HydrophobicContact CD2-CB 4.11Å; F331-L354 HydrophobicContact CE2-CB 3.91Å; F331-L354 HydrophobicContact CZ-CB 4.46Å; F331-L355 HydrophobicContact CE2-CB 4.23Å; F331-L355 HydrophobicContact CE2-CD1 4.47Å
332	L	93.6	Very high	91.3	Very high	24 Å²	24	60 Å²	60	13%	0.126	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128	-172.2	-61.2	90.3	0	0	0	110	L324 S325 D327 K330 L341 T342	L324-L332 WeakPolarHBondContact CA-O 3.47Å; S325-L332 PolarHBondContact N-O 3.48Å; S325-L332 PolarHBondContact O-N 3.24Å; D327-L332 HydrophobicContact CB-CD1 4.43Å; K330-L332 HydrophobicContact CB-CD1 3.72Å; L332-L341 WeakPolarHBondContact CA-O 3.27Å; L332-T342 HydrophobicContact CG-CG2 4.18Å
333	L	94.2	Very high	91.5	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.4	170.9	-176.9	156.2	0	0	0	107.5	I299 F316 L324 L341	I299-L333 HydrophobicContact CB-CD1 4.31Å; I299-L333 HydrophobicContact CD1-CD1 4.28Å; I299-L333 HydrophobicContact CG2-CD1 4.05Å; F316-L333 HydrophobicContact CB-CD1 4.31Å; F316-L333 HydrophobicContact CD1-CD2 3.82Å; F316-L333 HydrophobicContact CD2-CD1 3.98Å; F316-L333 HydrophobicContact CD2-CD2 4.02Å; F316-L333 HydrophobicContact CE1-CD2 3.96Å; F316-L333 HydrophobicContact CE2-CD2 4.15Å; F316-L333 HydrophobicContact CG-CD1 4.14Å; F316-L333 HydrophobicContact CG-CD2 3.86Å; F316-L333 HydrophobicContact CZ-CD2 4.12Å; L324-L333 HydrophobicContact CD2-CB 4.01Å; L324-L333 HydrophobicContact CD2-CD1 3.99Å; L324-L333 HydrophobicContact CD2-CG 3.82Å; L333-L341 PolarHBondContact N-O 3Å; L333-L341 PolarHBondContact O-N 3.39Å
334	V	93	Very high	91.7	Very high	35 Å²	35	58.7 Å²	58.7	21%	0.212	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.6	169.6	-159.6	0	0	0	0	107.8	G322 K323 Q339 K340	G322-V334 PolarHBondContact N-O 3.37Å; G322-V334 VanDerWaalsContact N-O 3.13Å; K323-V334 HydrophobicContact CB-CB 4.07Å; K323-V334 HydrophobicContact CB-CG2 4.22Å; K323-V334 HydrophobicContact CG-CG2 4.49Å; K323-V334 PolarHBondContact N-O 3.28Å; K323-V334 PolarHBondContact O-N 2.97Å; V334-Q339 CarbonylContact C-O 3.53Å; V334-Q339 VanDerWaalsContact CA-O 3.3Å; V334-Q339 WeakPolarHBondContact CA-O 3.48Å; V334-K340 HydrophobicContact CG1-CB 4.4Å; V334-K340 HydrophobicContact CG2-CG 4.32Å
335	S	91.2	Very high	91.7	Very high	7 Å²	7	58.7 Å²	58.7	5%	0.049	29%	0.291	C	S	.	.			trans	-82	160.7	175.2	164.4	0	0	0	0	110.9	Q320 D337 G338 Q339	Q320-S335 CarbonylContact O-C 3.55Å; Q320-S335 WeakPolarHBondContact O-CA 3.3Å; Q320-S335 PolarHBondContact O-OG 3.43Å; S335-D337 WeakPolarHBondContact CB-OD1 3.39Å; S335-D337 PolarHBondContact O-N 2.95Å; S335-D337 PolarHBondContact OG-N 3.43Å; S335-D337 PolarHBondContact OG-OD1 3.39Å; S335-G338 PolarHBondContact O-N 3.18Å; S335-Q339 PolarHBondContact N-O 2.84Å
336	T	88.4	Confident	91.6	Very high	93 Å²	93	59.6 Å²	59.6	57%	0.571	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.2	177.4	47.4	0	0	0	0	113.4	Q320 G338	Q320-T336 PolarHBondContact O-N 3.01Å; Q320-T336 PolarHBondContact O-OG1 3.02Å; T336-G338 PolarHBondContact O-N 3.42Å
337	D	88.6	Confident	91.6	Very high	99 Å²	99	60.8 Å²	60.8	53%	0.529	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-0.8	171.9	73.8	-18.8	0	0	0	113.7	S335 Q339	S335-D337 WeakPolarHBondContact CB-OD1 3.39Å; S335-D337 PolarHBondContact O-N 2.95Å; S335-D337 PolarHBondContact OG-N 3.43Å; S335-D337 PolarHBondContact OG-OD1 3.39Å; D337-Q339 WeakPolarHBondContact OD1-CB 3.23Å; D337-Q339 PolarHBondContact OD1-N 2.73Å; D337-Q339 WeakPolarHBondContact OD2-CG 3.41Å; D337-Q339 PolarHBondContact OD2-NE2 3.29Å
338	G	85.8	Confident	91.6	Very high	53 Å²	53	59.8 Å²	59.8	55%	0.546	30%	0.3	S	S	.	.			trans	88.3	-3.7	-178.4	0	0	0	0	0	115.1	S335 T336 K340	S335-G338 PolarHBondContact O-N 3.18Å; T336-G338 PolarHBondContact O-N 3.42Å; G338-K340 PolarHBondContact O-N 2.79Å
339	Q	88.2	Confident	91.7	Very high	106 Å²	106	55.1 Å²	55.1	50%	0.495	29%	0.287	S	S	.	.			trans	-59.1	131.5	173.1	-75.6	-174.9	59.4	0	0	110.5	V334 S335 D337	V334-Q339 CarbonylContact C-O 3.53Å; V334-Q339 VanDerWaalsContact CA-O 3.3Å; V334-Q339 WeakPolarHBondContact CA-O 3.48Å; S335-Q339 PolarHBondContact N-O 2.84Å; D337-Q339 WeakPolarHBondContact OD1-CB 3.23Å; D337-Q339 PolarHBondContact OD1-N 2.73Å; D337-Q339 WeakPolarHBondContact OD2-CG 3.41Å; D337-Q339 PolarHBondContact OD2-NE2 3.29Å
340	K	91.2	Very high	91.7	Very high	139 Å²	139	48.2 Å²	48.2	60%	0.604	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	108.5	-173.6	178.9	179.8	176.5	-175	0	111.1	V334 G338	V334-K340 HydrophobicContact CG1-CB 4.4Å; V334-K340 HydrophobicContact CG2-CG 4.32Å; G338-K340 PolarHBondContact O-N 2.79Å
341	L	92.4	Very high	91.7	Very high	51 Å²	51	44.4 Å²	44.4	27%	0.267	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	147.2	170.9	-57.6	-176.1	0	0	0	110.5	L301 F316 L332 L333 F343	L301-L341 HydrophobicContact CD1-CD1 3.5Å; L301-L341 VanDerWaalsContact CD1-CD1 3.5Å; F316-L341 HydrophobicContact CE2-CD1 3.5Å; F316-L341 VanDerWaalsContact CE2-CD1 3.5Å; F316-L341 HydrophobicContact CZ-CD1 3.56Å; F316-L341 HydrophobicContact CZ-CG 4.34Å; L332-L341 WeakPolarHBondContact CA-O 3.27Å; L333-L341 PolarHBondContact N-O 3Å; L333-L341 PolarHBondContact O-N 3.39Å; L341-F343 HydrophobicContact CB-CE2 3.67Å; L341-F343 HydrophobicContact CB-CZ 3.82Å; L341-F343 HydrophobicContact CD1-CE2 4.36Å; L341-F343 HydrophobicContact CD1-CZ 4.03Å; L341-F343 HydrophobicContact CG-CZ 4.5Å
342	T	93	Very high	91.7	Very high	46 Å²	46	48.9 Å²	48.9	28%	0.282	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	126.4	178.2	-65.8	0	0	0	0	108.9	K330 F331 L332 F344	K330-T342 HydrophobicContact CB-CG2 4.32Å; K330-T342 HydrophobicContact CD-CG2 4.5Å; K330-T342 HydrophobicContact CG-CG2 4.46Å; F331-T342 WeakPolarHBondContact O-CA 3.46Å; L332-T342 HydrophobicContact CG-CG2 4.18Å; T342-F344 HydrophobicContact CG2-CE2 4.29Å; T342-F344 HydrophobicContact CG2-CZ 4.28Å
343	F	94.1	Very high	91.7	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	163.7	-179.6	-56.6	-73.4	0	0	0	109.8	L279 M280 V290 L301 K330 F331 L341	L279-F343 HydrophobicContact CB-CB 4.3Å; L279-F343 HydrophobicContact CD1-CB 3.77Å; L279-F343 HydrophobicContact CD1-CD2 4.39Å; L279-F343 HydrophobicContact CD1-CG 4.05Å; M280-F343 WeakPolarHBondContact O-CA 3.44Å; V290-F343 HydrophobicContact CB-CD1 4.4Å; V290-F343 HydrophobicContact CG1-CD1 4.13Å; V290-F343 HydrophobicContact CG1-CE1 3.96Å; V290-F343 HydrophobicContact CG2-CD1 4.22Å; V290-F343 HydrophobicContact CG2-CE1 4.23Å; L301-F343 HydrophobicContact CD1-CE1 4.43Å; L301-F343 HydrophobicContact CD1-CE2 3.92Å; L301-F343 HydrophobicContact CD1-CZ 3.46Å; L301-F343 VanDerWaalsContact CD1-CZ 3.46Å; L301-F343 HydrophobicContact CD2-CE1 4.49Å; L301-F343 HydrophobicContact CD2-CE2 4.05Å; L301-F343 HydrophobicContact CD2-CZ 3.91Å; L301-F343 HydrophobicContact CG-CZ 4.36Å; K330-F343 CarbonylContact C-O 3.6Å; K330-F343 VanDerWaalsContact CA-O 3.29Å; K330-F343 WeakPolarHBondContact CA-O 3.4Å; F331-F343 PolarHBondContact N-O 2.71Å; F331-F343 PolarHBondContact O-N 3.31Å; L341-F343 HydrophobicContact CB-CE2 3.67Å; L341-F343 HydrophobicContact CB-CZ 3.82Å; L341-F343 HydrophobicContact CD1-CE2 4.36Å; L341-F343 HydrophobicContact CD1-CZ 4.03Å; L341-F343 HydrophobicContact CG-CZ 4.5Å
344	F	93.8	Very high	91.8	Very high	39 Å²	39	49.4 Å²	49.4	17%	0.171	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	139	-179.8	-59.4	-98.4	0	0	0	110.4	M280 R281 K283 K330 T342	M280-F344 HydrophobicContact CB-CB 4.19Å; M280-F344 HydrophobicContact CE-CB 4.04Å; M280-F344 WeakPolarHBondContact CE-O 3.44Å; M280-F344 PolarHBondContact N-O 2.99Å; M280-F344 PolarHBondContact O-N 3.29Å; R281-F344 WeakPolarHBondContact O-CD2 3.47Å; R281-F344 WeakPolarHBondContact O-CE2 3.31Å; K283-F344 HydrophobicContact CB-CD1 3.83Å; K283-F344 HydrophobicContact CB-CE1 3.65Å; K283-F344 HydrophobicContact CB-CE2 4.43Å; K283-F344 HydrophobicContact CB-CG 4.29Å; K283-F344 HydrophobicContact CB-CZ 3.98Å; K283-F344 HydrophobicContact CG-CD1 4.27Å; K283-F344 HydrophobicContact CG-CE1 4.26Å; K330-F344 HydrophobicContact CD-CE1 4.44Å; K330-F344 HydrophobicContact CG-CD1 4.03Å; K330-F344 HydrophobicContact CG-CE1 3.66Å; K330-F344 HydrophobicContact CG-CZ 4.38Å; T342-F344 HydrophobicContact CG2-CE2 4.29Å; T342-F344 HydrophobicContact CG2-CZ 4.28Å
345	T	93.2	Very high	91.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.			trans	-103.4	158.4	178.7	51	0	0	0	0	111.3	L279 M280 R329 N347 K350 A351 L354	L279-T345 HydrophobicContact CD2-CG2 3.42Å; L279-T345 VanDerWaalsContact CD2-CG2 3.42Å; M280-T345 VanDerWaalsContact CE-O 3.31Å; M280-T345 WeakPolarHBondContact CE-O 3.44Å; R329-T345 WeakPolarHBondContact CA-OG1 3.42Å; R329-T345 WeakPolarHBondContact CD-O 3.08Å; R329-T345 PolarHBondContact O-N 2.75Å; R329-T345 PolarHBondContact O-OG1 2.7Å; T345-N347 PolarHBondContact O-N 3.23Å; T345-N347 PolarHBondContact OG1-O 2.98Å; T345-K350 HydrophobicContact CG2-CB 4.2Å; T345-K350 HydrophobicContact CG2-CD 4.3Å; T345-K350 HydrophobicContact CG2-CG 3.97Å; T345-A351 HydrophobicContact CG2-CB 3.97Å; T345-A351 WeakPolarHBondContact OG1-CB 3.49Å; T345-L354 HydrophobicContact CG2-CD1 4.04Å
346	S	90.4	Very high	91.9	Very high	36 Å²	36	53.1 Å²	53.1	25%	0.252	27%	0.271	S	S	.	.	S	Bend	trans	-55.1	-39	173.8	66	0	0	0	0	111.7	E110 R329	E110-S346 PolarHBondContact OE1-OG 3.13Å; R329-S346 PolarHBondContact NH1-O 3.17Å
347	N	90.5	Very high	92.3	Very high	48 Å²	48	48.8 Å²	48.8	26%	0.257	24%	0.244	S	C	.	.	S	Bend	trans	-151.2	159.3	179.9	65.9	77.8	0	0	0	113	T345 Q349 K350 A351	T345-N347 PolarHBondContact O-N 3.23Å; T345-N347 PolarHBondContact OG1-O 2.98Å; N347-Q349 PolarHBondContact O-N 2.84Å; N347-Q349 WeakPolarHBondContact OD1-CA 3.47Å; N347-Q349 VanDerWaalsContact OD1-CB 3.31Å; N347-Q349 WeakPolarHBondContact OD1-CB 3.48Å; N347-Q349 PolarHBondContact OD1-N 3.14Å; N347-Q349 VanDerWaalsContact OD1-N 3.08Å; N347-K350 WeakPolarHBondContact O-CB 3.46Å; N347-K350 PolarHBondContact O-N 3.16Å; N347-K350 PolarHBondContact OD1-N 3.41Å; N347-A351 PolarHBondContact O-N 3.48Å
348	D	92	Very high	92.6	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-62.7	-24.1	-177.6	153.3	101.5	0	0	0	113.8	R328 A351 R352	R328-D348 WeakPolarHBondContact CA-OD1 3.23Å; R328-D348 WeakPolarHBondContact O-CA 3.31Å; R328-D348 WeakPolarHBondContact O-CB 3.47Å; D348-A351 PolarHBondContact O-N 2.93Å; D348-R352 VanDerWaalsContact CG-NH2 3.26Å; D348-R352 WeakPolarHBondContact O-CB 3.45Å; D348-R352 PolarHBondContact O-N 3.47Å; D348-R352 IonicContact OD1-CZ 2.7Å; D348-R352 IonicContact OD1-NH1 3.2Å; D348-R352 IonicContact OD1-NH2 3.17Å; D348-R352 PolarHBondContact OD1-NH2 2.67Å; D348-R352 IonicContact OD2-CZ 2.75Å; D348-R352 VanDerWaalsContact OD2-CZ 3.23Å; D348-R352 IonicContact OD2-NH1 2.83Å; D348-R352 PolarHBondContact OD2-NH1 3.07Å; D348-R352 IonicContact OD2-NH2 3.74Å; D348-R352 PolarHBondContact OD2-NH2 2.78Å
349	Q	91.6	Very high	92.9	Very high	94 Å²	94	42.9 Å²	42.9	44%	0.439	20%	0.198	S	C	.	.	H	α-helix	trans	-71.1	-36	173.3	-57.6	-67.5	-3	0	0	111.6	N347 Y353	N347-Q349 PolarHBondContact O-N 2.84Å; N347-Q349 WeakPolarHBondContact OD1-CA 3.47Å; N347-Q349 VanDerWaalsContact OD1-CB 3.31Å; N347-Q349 WeakPolarHBondContact OD1-CB 3.48Å; N347-Q349 PolarHBondContact OD1-N 3.14Å; N347-Q349 VanDerWaalsContact OD1-N 3.08Å; Q349-Y353 WeakPolarHBondContact O-CB 3.43Å; Q349-Y353 PolarHBondContact O-N 3.2Å
350	K	94	Very high	93	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-43.8	172.5	-172.6	174.9	-174.2	166.1	0	110.6	E112 R278 E288 T345 N347 Y353 L354	E112-K350 VanDerWaalsContact CD-NZ 3.26Å; E112-K350 WeakPolarHBondContact OE1-CE 3.39Å; E112-K350 IonicContact OE1-NZ 2.71Å; E112-K350 PolarHBondContact OE1-NZ 2.83Å; E112-K350 WeakPolarHBondContact OE2-CE 3.48Å; E112-K350 IonicContact OE2-NZ 2.72Å; E112-K350 PolarHBondContact OE2-NZ 3.37Å; R278-K350 WeakPolarHBondContact O-CE 3.24Å; R278-K350 PolarHBondContact O-NZ 2.71Å; E288-K350 IonicContact OE1-NZ 2.73Å; E288-K350 PolarHBondContact OE1-NZ 2.88Å; T345-K350 HydrophobicContact CG2-CB 4.2Å; T345-K350 HydrophobicContact CG2-CD 4.3Å; T345-K350 HydrophobicContact CG2-CG 3.97Å; N347-K350 WeakPolarHBondContact O-CB 3.46Å; N347-K350 PolarHBondContact O-N 3.16Å; N347-K350 PolarHBondContact OD1-N 3.41Å; K350-Y353 PolarHBondContact O-N 3.07Å; K350-L354 HydrophobicContact CG-CD1 4.25Å; K350-L354 WeakPolarHBondContact O-CB 3.39Å; K350-L354 VanDerWaalsContact O-CG 3.25Å; K350-L354 WeakPolarHBondContact O-CG 3.35Å; K350-L354 PolarHBondContact O-N 3.05Å
351	A	93.5	Very high	93.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-45.4	177	0	0	0	0	0	113.1	F326 R328 T345 N347 D348 L354 L355	F326-A351 HydrophobicContact CB-CB 4.13Å; F326-A351 HydrophobicContact CD2-CB 4.12Å; F326-A351 HydrophobicContact CG-CB 4.4Å; R328-A351 WeakPolarHBondContact O-CB 3.21Å; T345-A351 HydrophobicContact CG2-CB 3.97Å; T345-A351 WeakPolarHBondContact OG1-CB 3.49Å; N347-A351 PolarHBondContact O-N 3.48Å; D348-A351 PolarHBondContact O-N 2.93Å; A351-L354 PolarHBondContact O-N 3.25Å; A351-L355 PolarHBondContact O-N 2.81Å; A351-L355 VanDerWaalsContact O-N 3.15Å
352	R	93	Very high	93.1	Very high	94 Å²	94	31.2 Å²	31.2	36%	0.355	15%	0.145	S	C	.	.	H	α-helix	trans	-62	-43.3	174.9	-178.1	-179.2	-63.4	92.3	16.8	112.3	F326 D348 R356	F326-R352 HydrophobicContact CE1-CB 4.15Å; F326-R352 HydrophobicContact CE1-CG 4.16Å; F326-R352 HydrophobicContact CE2-CB 3.97Å; F326-R352 HydrophobicContact CZ-CB 3.74Å; F326-R352 HydrophobicContact CZ-CG 3.87Å; D348-R352 VanDerWaalsContact CG-NH2 3.26Å; D348-R352 WeakPolarHBondContact O-CB 3.45Å; D348-R352 PolarHBondContact O-N 3.47Å; D348-R352 IonicContact OD1-CZ 2.7Å; D348-R352 IonicContact OD1-NH1 3.2Å; D348-R352 IonicContact OD1-NH2 3.17Å; D348-R352 PolarHBondContact OD1-NH2 2.67Å; D348-R352 IonicContact OD2-CZ 2.75Å; D348-R352 VanDerWaalsContact OD2-CZ 3.23Å; D348-R352 IonicContact OD2-NH1 2.83Å; D348-R352 PolarHBondContact OD2-NH1 3.07Å; D348-R352 IonicContact OD2-NH2 3.74Å; D348-R352 PolarHBondContact OD2-NH2 2.78Å; R352-R356 PolarHBondContact O-N 3.28Å; R352-R356 VanDerWaalsContact O-N 3.17Å
353	Y	94.3	Very high	93	Very high	36 Å²	36	29.8 Å²	29.8	14%	0.141	14%	0.135	C	C	.	.	H	α-helix	trans	-60.6	-49.6	175.9	167.5	-95.2	0	0	0	111.1	R114 F115 Y277 Q349 K350 L355 R356 F357	R114-Y353 WeakPolarHBondContact CA-OH 3.43Å; R114-Y353 HydrophobicContact CB-CD2 4.28Å; R114-Y353 HydrophobicContact CB-CE1 4.16Å; R114-Y353 HydrophobicContact CB-CE2 3.88Å; R114-Y353 HydrophobicContact CG-CD1 4.21Å; R114-Y353 HydrophobicContact CG-CE1 3.94Å; F115-Y353 PolarHBondContact N-OH 2.91Å; F115-Y353 WeakPolarHBondContact O-CE2 3.24Å; Y277-Y353 HydrophobicContact CD1-CE1 4.48Å; Y277-Y353 AromaticContact CE1-CE1 3.62Å; Y277-Y353 HydrophobicContact CE1-CE1 3.62Å; Y277-Y353 AromaticContact CZ-CE1 3.78Å; Y277-Y353 PolarHBondContact OH-OH 3.03Å; Q349-Y353 WeakPolarHBondContact O-CB 3.43Å; Q349-Y353 PolarHBondContact O-N 3.2Å; K350-Y353 PolarHBondContact O-N 3.07Å; Y353-L355 PolarHBondContact O-N 3.5Å; Y353-R356 PolarHBondContact O-N 3.22Å; Y353-R356 VanDerWaalsContact O-N 3.15Å; Y353-F357 HydrophobicContact CE1-CB 4.11Å; Y353-F357 HydrophobicContact CE1-CG 4.4Å; Y353-F357 HydrophobicContact CE2-CB 4.34Å; Y353-F357 WeakPolarHBondContact O-CB 3.41Å; Y353-F357 PolarHBondContact O-N 3.24Å; Y353-F357 WeakPolarHBondContact OH-CD2 3.29Å
354	L	95.5	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-44.2	-178.4	-73.3	171.8	0	0	0	112.3	Y277 L279 L292 F331 T345 K350 A351 R356 F357 C358	Y277-L354 HydrophobicContact CD1-CD2 3.78Å; Y277-L354 HydrophobicContact CD2-CD2 3.54Å; Y277-L354 HydrophobicContact CE1-CD2 4.18Å; Y277-L354 HydrophobicContact CE2-CD2 3.95Å; Y277-L354 HydrophobicContact CG-CD2 3.43Å; Y277-L354 VanDerWaalsContact CG-CD2 3.43Å; L279-L354 HydrophobicContact CD2-CD1 3.8Å; L292-L354 HydrophobicContact CD2-CD1 4.43Å; L292-L354 HydrophobicContact CD2-CD2 4.22Å; F331-L354 HydrophobicContact CD2-CB 4.11Å; F331-L354 HydrophobicContact CE2-CB 3.91Å; F331-L354 HydrophobicContact CZ-CB 4.46Å; T345-L354 HydrophobicContact CG2-CD1 4.04Å; K350-L354 HydrophobicContact CG-CD1 4.25Å; K350-L354 WeakPolarHBondContact O-CB 3.39Å; K350-L354 VanDerWaalsContact O-CG 3.25Å; K350-L354 WeakPolarHBondContact O-CG 3.35Å; K350-L354 PolarHBondContact O-N 3.05Å; A351-L354 PolarHBondContact O-N 3.25Å; L354-R356 VanDerWaalsContact C-N 3.34Å; L354-R356 PolarHBondContact O-N 2.91Å; L354-F357 PolarHBondContact O-N 2.74Å; L354-C358 PolarHBondContact O-N 3.1Å; L354-C358 PolarHBondContact O-SG 3.41Å; L354-C358 VanDerWaalsContact O-SG 3.34Å
355	L	94.8	Very high	92.7	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-57.3	-51.2	174.6	-175.1	71.4	0	0	0	110.2	L324 F326 F331 A351 Y353 F357 C358 R359 I677	L324-L355 HydrophobicContact CB-CD1 3.5Å; L324-L355 VanDerWaalsContact CB-CD1 3.5Å; F326-L355 HydrophobicContact CD1-CB 4.13Å; F326-L355 HydrophobicContact CD1-CD2 3.68Å; F326-L355 HydrophobicContact CE1-CD2 4.19Å; F331-L355 HydrophobicContact CE2-CB 4.23Å; F331-L355 HydrophobicContact CE2-CD1 4.47Å; A351-L355 PolarHBondContact O-N 2.81Å; A351-L355 VanDerWaalsContact O-N 3.15Å; Y353-L355 PolarHBondContact O-N 3.5Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 2.93Å; L355-C358 PolarHBondContact O-N 3.27Å; L355-R359 PolarHBondContact O-N 3.31Å; L355-R359 VanDerWaalsContact O-N 3.16Å; L355-I677 HydrophobicContact CD1-CD1 3.5Å; L355-I677 VanDerWaalsContact CD1-CD1 3.5Å; L355-I677 HydrophobicContact CD1-CG1 3.99Å; L355-I677 HydrophobicContact CG-CD1 3.8Å; L355-I677 HydrophobicContact CG-CG1 4.28Å; L355-I677 WeakPolarHBondContact O-CD1 3.49Å
356	R	92.2	Very high	92.4	Very high	112 Å²	112	29 Å²	29	42%	0.423	13%	0.133	S	C	.	.	H	α-helix	trans	-60.9	-42.4	-179.5	-175.8	168.9	-166.8	158.3	-1.2	112.7	E117 R352 Y353 L354 R359 M360	E117-R356 VanDerWaalsContact CD-NH2 3.3Å; E117-R356 IonicContact OE1-CZ 3.81Å; E117-R356 IonicContact OE1-NH1 2.68Å; E117-R356 PolarHBondContact OE1-NH1 3.07Å; E117-R356 IonicContact OE1-NH2 3.97Å; E117-R356 PolarHBondContact OE1-NH2 3.36Å; E117-R356 IonicContact OE2-CZ 3.24Å; E117-R356 IonicContact OE2-NH1 2.67Å; E117-R356 PolarHBondContact OE2-NH1 3.5Å; E117-R356 IonicContact OE2-NH2 3.2Å; R352-R356 PolarHBondContact O-N 3.28Å; R352-R356 VanDerWaalsContact O-N 3.17Å; Y353-R356 PolarHBondContact O-N 3.22Å; Y353-R356 VanDerWaalsContact O-N 3.15Å; L354-R356 VanDerWaalsContact C-N 3.34Å; L354-R356 PolarHBondContact O-N 2.91Å; R356-R359 WeakPolarHBondContact O-CB 3.18Å; R356-R359 PolarHBondContact O-N 2.89Å; R356-M360 HydrophobicContact CG-CG 4.36Å; R356-M360 WeakPolarHBondContact O-CG 3.02Å; R356-M360 PolarHBondContact O-N 2.82Å; R356-M360 VanDerWaalsContact O-N 3.08Å
357	F	95.2	Very high	92.3	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.013	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-48.2	-179.9	-179.4	-104.8	0	0	0	110.8	F115 Y153 H275 Y277 V294 Y353 L354 L355 R359 M360 F361	F115-F357 HydrophobicContact CD2-CD2 4.02Å; F115-F357 AromaticContact CD2-CE2 3.43Å; F115-F357 HydrophobicContact CD2-CE2 3.43Å; F115-F357 VanDerWaalsContact CD2-CE2 3.43Å; F115-F357 HydrophobicContact CD2-CZ 4.2Å; F115-F357 AromaticContact CE2-CE2 3.91Å; F115-F357 HydrophobicContact CE2-CE2 3.91Å; F115-F357 HydrophobicContact CE2-CZ 4.28Å; F115-F357 HydrophobicContact CG-CE2 4.26Å; Y153-F357 HydrophobicContact CE1-CE2 4.13Å; Y153-F357 HydrophobicContact CE2-CE2 4.28Å; Y153-F357 AromaticContact CZ-CE2 3.93Å; H275-F357 HydrophobicContact CB-CE1 3.9Å; H275-F357 HydrophobicContact CB-CZ 4.14Å; H275-F357 AromaticContact CD2-CE1 3.97Å; H275-F357 AromaticContact CD2-CZ 3.48Å; H275-F357 VanDerWaalsContact CD2-CZ 3.48Å; H275-F357 WeakPolarHBondContact CD2-CZ 3.24Å; H275-F357 AromaticContact CG-CE1 3.99Å; H275-F357 AromaticContact CG-CZ 3.7Å; H275-F357 AromaticContact NE2-CZ 3.91Å; Y277-F357 AromaticContact CE2-CD1 3.72Å; Y277-F357 HydrophobicContact CE2-CD1 3.72Å; Y277-F357 AromaticContact CE2-CE1 3.73Å; Y277-F357 HydrophobicContact CE2-CE1 3.73Å; Y277-F357 AromaticContact CZ-CD1 3.94Å; Y277-F357 WeakPolarHBondContact OH-CD1 3.47Å; Y277-F357 WeakPolarHBondContact OH-CE1 3.46Å; V294-F357 HydrophobicContact CB-CE1 4.11Å; V294-F357 HydrophobicContact CG1-CE1 4.06Å; V294-F357 HydrophobicContact CG2-CD1 4.44Å; V294-F357 HydrophobicContact CG2-CE1 4.38Å; Y353-F357 HydrophobicContact CE1-CB 4.11Å; Y353-F357 HydrophobicContact CE1-CG 4.4Å; Y353-F357 HydrophobicContact CE2-CB 4.34Å; Y353-F357 WeakPolarHBondContact O-CB 3.41Å; Y353-F357 PolarHBondContact O-N 3.24Å; Y353-F357 WeakPolarHBondContact OH-CD2 3.29Å; L354-F357 PolarHBondContact O-N 2.74Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 2.93Å; F357-R359 VanDerWaalsContact C-N 3.32Å; F357-R359 PolarHBondContact O-N 3.32Å; F357-M360 PolarHBondContact O-N 2.9Å; F357-F361 HydrophobicContact CE1-CB 4.47Å; F357-F361 HydrophobicContact CE1-CD2 4.32Å; F357-F361 HydrophobicContact CZ-CB 4.44Å; F357-F361 AromaticContact CZ-CD2 3.97Å; F357-F361 HydrophobicContact CZ-CD2 3.97Å; F357-F361 VanDerWaalsContact O-CB 3.29Å; F357-F361 WeakPolarHBondContact O-CB 3.38Å; F357-F361 PolarHBondContact O-N 2.72Å
358	C	95.1	Very high	92.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-59.2	-39.1	176.1	-64.6	0	0	0	0	112.6	W318 L324 L354 L355 H362	W318-C358 HydrophobicContact CH2-CB 4.27Å; W318-C358 HydrophobicContact CZ3-CB 4.46Å; L324-C358 HydrophobicContact CD1-CB 3.54Å; L354-C358 PolarHBondContact O-N 3.1Å; L354-C358 PolarHBondContact O-SG 3.41Å; L354-C358 VanDerWaalsContact O-SG 3.34Å; L355-C358 PolarHBondContact O-N 3.27Å; C358-H362 VanDerWaalsContact O-CB 3.24Å; C358-H362 WeakPolarHBondContact O-CB 3.47Å; C358-H362 PolarHBondContact O-N 3.1Å
359	R	92	Very high	91.6	Very high	27 Å²	27	31.8 Å²	31.8	10%	0.102	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-54.5	173.6	-171.6	179.7	178.5	147	-8.2	111.2	L355 R356 F357 H362 Q363 D663 I677	L355-R359 PolarHBondContact O-N 3.31Å; L355-R359 VanDerWaalsContact O-N 3.16Å; R356-R359 WeakPolarHBondContact O-CB 3.18Å; R356-R359 PolarHBondContact O-N 2.89Å; F357-R359 VanDerWaalsContact C-N 3.32Å; F357-R359 PolarHBondContact O-N 3.32Å; R359-H362 PolarHBondContact O-N 3.39Å; R359-Q363 HydrophobicContact CG-CG 4.28Å; R359-Q363 WeakPolarHBondContact O-CB 3.48Å; R359-Q363 VanDerWaalsContact O-CG 3.31Å; R359-Q363 WeakPolarHBondContact O-CG 2.95Å; R359-Q363 PolarHBondContact O-N 3.19Å; R359-D663 IonicContact CZ-OD1 3.64Å; R359-D663 IonicContact NH2-OD1 3.36Å; R359-D663 PolarHBondContact NH2-OD1 3.15Å; R359-I677 HydrophobicContact CB-CD1 3.53Å; R359-I677 HydrophobicContact CB-CG1 4.02Å; R359-I677 HydrophobicContact CG-CD1 4.35Å; R359-I677 HydrophobicContact CG-CG1 4.34Å
360	M	91.9	Very high	91	Very high	49 Å²	49	32.3 Å²	32.3	24%	0.241	14%	0.137	C	C	.	.	H	α-helix	trans	-69.4	-38.4	-172.2	-66.6	-55.7	-45.3	0	0	111.9	Y153 R356 F357 N364	Y153-M360 HydrophobicContact CE1-CB 4.21Å; Y153-M360 WeakPolarHBondContact OH-CB 3.15Å; R356-M360 HydrophobicContact CG-CG 4.36Å; R356-M360 WeakPolarHBondContact O-CG 3.02Å; R356-M360 PolarHBondContact O-N 2.82Å; R356-M360 VanDerWaalsContact O-N 3.08Å; F357-M360 PolarHBondContact O-N 2.9Å; M360-N364 WeakPolarHBondContact O-CB 3.37Å; M360-N364 VanDerWaalsContact O-CG 3.32Å; M360-N364 PolarHBondContact O-N 3.01Å
361	F	94.3	Very high	90.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.3	-50.8	173.4	-176.7	-81.8	0	0	0	110.8	Y153 Y155 H275 V294 A295 W318 F357 N364 L365	Y153-F361 WeakPolarHBondContact O-CD2 3.49Å; Y155-F361 HydrophobicContact CD2-CE2 4.49Å; H275-F361 AromaticContact CD2-CE2 3.85Å; V294-F361 HydrophobicContact CG1-CB 4.4Å; V294-F361 HydrophobicContact CG1-CD1 3.88Å; V294-F361 HydrophobicContact CG1-CD2 4.33Å; V294-F361 HydrophobicContact CG1-CE1 4.24Å; V294-F361 HydrophobicContact CG1-CG 3.94Å; A295-F361 VanDerWaalsContact O-CE1 3.31Å; A295-F361 WeakPolarHBondContact O-CE1 3.34Å; W318-F361 HydrophobicContact CH2-CD1 4.39Å; W318-F361 AromaticContact CZ2-CD1 3.69Å; W318-F361 HydrophobicContact CZ2-CD1 3.69Å; W318-F361 HydrophobicContact CZ2-CE1 4Å; F357-F361 HydrophobicContact CE1-CB 4.47Å; F357-F361 HydrophobicContact CE1-CD2 4.32Å; F357-F361 HydrophobicContact CZ-CB 4.44Å; F357-F361 AromaticContact CZ-CD2 3.97Å; F357-F361 HydrophobicContact CZ-CD2 3.97Å; F357-F361 VanDerWaalsContact O-CB 3.29Å; F357-F361 WeakPolarHBondContact O-CB 3.38Å; F357-F361 PolarHBondContact O-N 2.72Å; F361-N364 PolarHBondContact O-N 3.23Å; F361-L365 WeakPolarHBondContact O-CB 3.38Å; F361-L365 PolarHBondContact O-N 3.14Å
362	H	91.7	Very high	89.3	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-47	178.2	-178.8	63.1	0	0	0	112	W318 C358 R359 N364 L365 M366 I680	W318-H362 VanDerWaalsContact CB-CE1 3.41Å; W318-H362 WeakPolarHBondContact CB-CE1 3.27Å; W318-H362 WeakPolarHBondContact CB-NE2 3.31Å; W318-H362 AromaticContact CD1-CE1 3.24Å; W318-H362 HydrophobicContact CD2-CB 4.36Å; W318-H362 AromaticContact CD2-CE1 2.92Å; W318-H362 AromaticContact CD2-ND1 3.5Å; W318-H362 AromaticContact CE2-CE1 3.42Å; W318-H362 VanDerWaalsContact CE2-CE1 3.42Å; W318-H362 HydrophobicContact CE3-CB 4.07Å; W318-H362 AromaticContact CE3-CE1 3.47Å; W318-H362 VanDerWaalsContact CE3-CE1 3.47Å; W318-H362 AromaticContact CE3-CG 3.95Å; W318-H362 AromaticContact CE3-ND1 3.71Å; W318-H362 AromaticContact CG-CE1 2.85Å; W318-H362 AromaticContact CG-ND1 3.53Å; W318-H362 AromaticContact CG-NE2 3.89Å; W318-H362 HydrophobicContact CH2-CB 4.32Å; W318-H362 HydrophobicContact CZ3-CB 4.05Å; W318-H362 AromaticContact NE1-CE1 3.54Å; C358-H362 VanDerWaalsContact O-CB 3.24Å; C358-H362 WeakPolarHBondContact O-CB 3.47Å; C358-H362 PolarHBondContact O-N 3.1Å; R359-H362 PolarHBondContact O-N 3.39Å; H362-N364 VanDerWaalsContact C-N 3.34Å; H362-N364 PolarHBondContact O-N 2.93Å; H362-L365 WeakPolarHBondContact O-CB 3.24Å; H362-L365 PolarHBondContact O-N 2.86Å; H362-M366 WeakPolarHBondContact NE2-CE 3.31Å; H362-M366 PolarHBondContact NE2-SD 2.92Å; H362-M366 VanDerWaalsContact NE2-SD 3.41Å; H362-M366 WeakPolarHBondContact O-CG 3.21Å; H362-M366 PolarHBondContact O-N 3.12Å; H362-I680 PolarHBondContact NE2-O 2.8Å
363	Q	90	Very high	88.1	Confident	17 Å²	17	37.2 Å²	37.2	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-39.4	176.5	-75.9	-176.4	-33	0	0	112.9	R359 R367 Y662 D663	R359-Q363 HydrophobicContact CG-CG 4.28Å; R359-Q363 WeakPolarHBondContact O-CB 3.48Å; R359-Q363 VanDerWaalsContact O-CG 3.31Å; R359-Q363 WeakPolarHBondContact O-CG 2.95Å; R359-Q363 PolarHBondContact O-N 3.19Å; Q363-R367 WeakPolarHBondContact O-CG 3.29Å; Q363-R367 PolarHBondContact O-N 3.39Å; Q363-Y662 HydrophobicContact CG-CD1 4.04Å; Q363-Y662 HydrophobicContact CG-CE1 3.72Å; Q363-D663 PolarHBondContact NE2-OD1 3.25Å
364	N	91.6	Very high	87	Confident	15 Å²	15	41.7 Å²	41.7	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-69.1	-38.1	175.2	-78.3	6.6	0	0	0	112.1	T154 M360 F361 H362 R367 L368	T154-N364 HydrophobicContact CG2-CB 4.45Å; T154-N364 WeakPolarHBondContact OG1-CB 3.31Å; M360-N364 WeakPolarHBondContact O-CB 3.37Å; M360-N364 VanDerWaalsContact O-CG 3.32Å; M360-N364 PolarHBondContact O-N 3.01Å; F361-N364 PolarHBondContact O-N 3.23Å; H362-N364 VanDerWaalsContact C-N 3.34Å; H362-N364 PolarHBondContact O-N 2.93Å; N364-R367 PolarHBondContact O-N 2.9Å; N364-R367 PolarHBondContact OD1-NH1 2.78Å; N364-L368 WeakPolarHBondContact O-CG 3.49Å; N364-L368 PolarHBondContact O-N 2.74Å
365	L	90.3	Very high	85.3	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-44	175.1	-175.8	68.1	0	0	0	111.2	T154 I156 P296 F361 H362 R367 L368 H369	T154-L365 HydrophobicContact CG2-CB 4.24Å; T154-L365 HydrophobicContact CG2-CD1 4.33Å; I156-L365 HydrophobicContact CG2-CD1 4.12Å; P296-L365 HydrophobicContact CB-CD1 4.18Å; P296-L365 HydrophobicContact CB-CD2 4.39Å; P296-L365 WeakPolarHBondContact O-CD2 3.18Å; F361-L365 WeakPolarHBondContact O-CB 3.38Å; F361-L365 PolarHBondContact O-N 3.14Å; H362-L365 WeakPolarHBondContact O-CB 3.24Å; H362-L365 PolarHBondContact O-N 2.86Å; L365-R367 VanDerWaalsContact C-N 3.32Å; L365-R367 PolarHBondContact O-N 3.42Å; L365-L368 PolarHBondContact O-N 2.94Å; L365-H369 PolarHBondContact O-CD2 2.85Å; L365-H369 VanDerWaalsContact O-CD2 3.28Å; L365-H369 PolarHBondContact O-N 3.09Å; L365-H369 VanDerWaalsContact O-N 3.09Å
366	M	85.7	Confident	83.5	Confident	16 Å²	16	47 Å²	47	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-43.4	176.9	-58.6	-51.5	88.4	0	0	111.3	H362 H369 E370 P682 L685	H362-M366 WeakPolarHBondContact NE2-CE 3.31Å; H362-M366 PolarHBondContact NE2-SD 2.92Å; H362-M366 VanDerWaalsContact NE2-SD 3.41Å; H362-M366 WeakPolarHBondContact O-CG 3.21Å; H362-M366 PolarHBondContact O-N 3.12Å; M366-H369 PolarHBondContact O-N 3.08Å; M366-E370 WeakPolarHBondContact O-CB 3.36Å; M366-E370 PolarHBondContact O-N 2.78Å; M366-P682 HydrophobicContact CE-CB 3.74Å; M366-P682 HydrophobicContact CE-CG 3.89Å; M366-P682 HydrophobicContact SD-CB 3.71Å; M366-P682 HydrophobicContact SD-CG 4.29Å; M366-L685 HydrophobicContact CB-CD1 4.29Å; M366-L685 HydrophobicContact CG-CD1 4.36Å; M366-L685 HydrophobicContact SD-CD1 4.15Å
367	R	88.9	Confident	81.3	Confident	106 Å²	106	44 Å²	44	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-45.4	177	-71.7	172.3	-178.9	146.9	0.7	112.7	L101 Q363 N364 L365 H369 E370 E371	L101-R367 HydrophobicContact CD1-CB 3.87Å; Q363-R367 WeakPolarHBondContact O-CG 3.29Å; Q363-R367 PolarHBondContact O-N 3.39Å; N364-R367 PolarHBondContact O-N 2.9Å; N364-R367 PolarHBondContact OD1-NH1 2.78Å; L365-R367 VanDerWaalsContact C-N 3.32Å; L365-R367 PolarHBondContact O-N 3.42Å; R367-H369 VanDerWaalsContact C-N 3.28Å; R367-H369 PolarHBondContact O-N 3.02Å; R367-E370 PolarHBondContact O-N 2.69Å; R367-E370 VanDerWaalsContact O-N 3.15Å; R367-E371 WeakPolarHBondContact O-CB 3.36Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 3.27Å
368	L	86.8	Confident	79	Confident	12 Å²	12	49.4 Å²	49.4	6%	0.063	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-35.9	178.2	-75.1	163.8	0	0	0	112.2	L101 L102 T154 I156 N364 L365 G372	L101-L368 HydrophobicContact CB-CD1 4.22Å; L101-L368 HydrophobicContact CB-CD2 4.02Å; L101-L368 HydrophobicContact CB-CG 4.11Å; L101-L368 HydrophobicContact CD1-CD2 4.09Å; L101-L368 HydrophobicContact CD1-CG 4Å; L102-L368 HydrophobicContact CD2-CD1 3.78Å; L102-L368 HydrophobicContact CD2-CD2 4.2Å; T154-L368 HydrophobicContact CG2-CD1 3.64Å; I156-L368 HydrophobicContact CG2-CD1 3.94Å; N364-L368 WeakPolarHBondContact O-CG 3.49Å; N364-L368 PolarHBondContact O-N 2.74Å; L365-L368 PolarHBondContact O-N 2.94Å; L368-G372 PolarHBondContact O-N 3.23Å
369	H	81.2	Confident	76.2	Confident	72 Å²	72	57 Å²	57	33%	0.333	28%	0.279	S	S	.	.	H	α-helix	trans	-70.7	-39.5	172.7	-81.9	-110.9	0	0	0	112.5	L365 M366 R367 G372 R373	L365-H369 PolarHBondContact O-CD2 2.85Å; L365-H369 VanDerWaalsContact O-CD2 3.28Å; L365-H369 PolarHBondContact O-N 3.09Å; L365-H369 VanDerWaalsContact O-N 3.09Å; M366-H369 PolarHBondContact O-N 3.08Å; R367-H369 VanDerWaalsContact C-N 3.28Å; R367-H369 PolarHBondContact O-N 3.02Å; H369-G372 WeakPolarHBondContact O-CA 3.41Å; H369-G372 PolarHBondContact O-N 2.84Å; H369-R373 PolarHBondContact O-N 2.74Å
370	E	79.2	Confident	73.4	Confident	105 Å²	105	59.4 Å²	59.4	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-65.8	-44.3	176.6	-166.2	-166.1	157	0	0	112.2	M366 R367 G372 R373 K374	M366-E370 WeakPolarHBondContact O-CB 3.36Å; M366-E370 PolarHBondContact O-N 2.78Å; R367-E370 PolarHBondContact O-N 2.69Å; R367-E370 VanDerWaalsContact O-N 3.15Å; E370-G372 VanDerWaalsContact C-N 3.3Å; E370-R373 PolarHBondContact O-N 3.05Å; E370-K374 WeakPolarHBondContact O-CG 3.35Å; E370-K374 PolarHBondContact O-N 2.84Å; E370-K374 VanDerWaalsContact OE1-CE 3.27Å; E370-K374 WeakPolarHBondContact OE1-CE 3.41Å; E370-K374 IonicContact OE1-NZ 2.72Å; E370-K374 PolarHBondContact OE1-NZ 3.38Å
371	E	78.3	Confident	70.7	Confident	89 Å²	89	58.8 Å²	58.8	42%	0.416	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-40.3	171.1	-71.9	167.4	-166.7	0	0	110.7	R367 N375	R367-E371 WeakPolarHBondContact O-CB 3.36Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 3.27Å; E371-N375 PolarHBondContact O-N 2.9Å; E371-N375 VanDerWaalsContact O-N 3.15Å; E371-N375 PolarHBondContact O-ND2 2.89Å
372	G	72.4	Confident	68.1	Low	12 Å²	12	62.5 Å²	62.5	12%	0.124	33%	0.325	C	S	.	.	H	α-helix	trans	-54.8	-53.8	170.8	0	0	0	0	0	113.2	L161 L368 H369 E370 N375 A376	L161-G372 VanDerWaalsContact CD2-CA 3.49Å; L368-G372 PolarHBondContact O-N 3.23Å; H369-G372 WeakPolarHBondContact O-CA 3.41Å; H369-G372 PolarHBondContact O-N 2.84Å; E370-G372 VanDerWaalsContact C-N 3.3Å; G372-N375 PolarHBondContact O-N 3.41Å; G372-A376 WeakPolarHBondContact O-CB 3.19Å; G372-A376 PolarHBondContact O-N 3.01Å
373	R	68.8	Low	65.6	Low	96 Å²	96	65.8 Å²	65.8	36%	0.362	35%	0.345	S	S	.	.	H	α-helix	trans	-57.6	-51.4	178.5	177.1	-175	165.6	104.6	-3.8	111.7	H369 E370 N375 A376 G377 S689 D690 E693	H369-R373 PolarHBondContact O-N 2.74Å; E370-R373 PolarHBondContact O-N 3.05Å; R373-N375 VanDerWaalsContact C-N 3.28Å; R373-N375 PolarHBondContact O-N 3.21Å; R373-A376 WeakPolarHBondContact O-CB 3.38Å; R373-A376 PolarHBondContact O-N 3.12Å; R373-G377 PolarHBondContact O-N 2.93Å; R373-S689 PolarHBondContact NH1-OG 2.87Å; R373-D690 IonicContact CZ-OD1 3.69Å; R373-D690 VanDerWaalsContact CZ-OD1 3.26Å; R373-D690 IonicContact NH1-OD1 3.92Å; R373-D690 PolarHBondContact NH1-OD1 3.3Å; R373-D690 IonicContact NH1-OD2 2.77Å; R373-D690 IonicContact NH2-OD1 3.81Å; R373-D690 PolarHBondContact NH2-OD1 3.49Å; R373-E693 IonicContact CZ-OE1 3.84Å; R373-E693 IonicContact NH2-OE1 2.69Å; R373-E693 PolarHBondContact NH2-OE1 3.28Å; R373-E693 IonicContact NH2-OE2 2.78Å; R373-E693 PolarHBondContact NH2-OE2 3.33Å
374	K	70.3	Confident	63.3	Low	131 Å²	131	69.1 Å²	69.1	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-56	-43.8	-178.3	-72.2	169.4	-175.5	169	0	111.8	E370 Q378	E370-K374 WeakPolarHBondContact O-CG 3.35Å; E370-K374 PolarHBondContact O-N 2.84Å; E370-K374 VanDerWaalsContact OE1-CE 3.27Å; E370-K374 WeakPolarHBondContact OE1-CE 3.41Å; E370-K374 IonicContact OE1-NZ 2.72Å; E370-K374 PolarHBondContact OE1-NZ 3.38Å; K374-Q378 PolarHBondContact O-N 3.17Å
375	N	61.2	Low	60.9	Low	60 Å²	60	70.8 Å²	70.8	32%	0.321	38%	0.378	S	S	.	.	H	α-helix	trans	-80.3	-17.7	179.1	-69.7	-81.8	0	0	0	114.2	R163 E371 G372 R373 Q378 Y379	R163-N375 VanDerWaalsContact CZ-CB 3.42Å; R163-N375 VanDerWaalsContact NH1-CG 3.34Å; R163-N375 PolarHBondContact NH1-OD1 3.09Å; E371-N375 PolarHBondContact O-N 2.9Å; E371-N375 VanDerWaalsContact O-N 3.15Å; E371-N375 PolarHBondContact O-ND2 2.89Å; G372-N375 PolarHBondContact O-N 3.41Å; R373-N375 VanDerWaalsContact C-N 3.28Å; R373-N375 PolarHBondContact O-N 3.21Å; N375-Q378 WeakPolarHBondContact O-CB 3.41Å; N375-Q378 PolarHBondContact O-N 3.46Å; N375-Y379 PolarHBondContact O-N 3.11Å
376	A	56.5	Low	58.8	Low	58 Å²	58	74.6 Å²	74.6	48%	0.479	40%	0.402	S	S	.	.	H	α-helix	trans	-70.7	-37.4	171.9	0	0	0	0	0	111.3	G372 R373 Y379 C380	G372-A376 WeakPolarHBondContact O-CB 3.19Å; G372-A376 PolarHBondContact O-N 3.01Å; R373-A376 WeakPolarHBondContact O-CB 3.38Å; R373-A376 PolarHBondContact O-N 3.12Å; A376-Y379 PolarHBondContact O-N 2.67Å; A376-C380 PolarHBondContact O-N 3.23Å
377	G	45.8	Very low	56.7	Low	50 Å²	50	77.5 Å²	77.5	52%	0.515	42%	0.421	S	S	.	.	H	α-helix	trans	-59.6	-44.4	169.8	0	0	0	0	0	112.3	R373 Y379 C380 G381	R373-G377 PolarHBondContact O-N 2.93Å; G377-Y379 PolarHBondContact O-N 3Å; G377-C380 PolarHBondContact O-N 3.05Å; G377-G381 PolarHBondContact O-N 3.19Å; G377-G381 VanDerWaalsContact O-N 3.08Å
378	Q	48	Very low	54.5	Low	116 Å²	116	77.7 Å²	77.7	54%	0.542	43%	0.429	S	S	.	.	H	α-helix	trans	-57	-49.6	173.6	-169.5	69.5	55.1	0	0	111.7	K374 N375 C380 G381 D382	K374-Q378 PolarHBondContact O-N 3.17Å; N375-Q378 WeakPolarHBondContact O-CB 3.41Å; N375-Q378 PolarHBondContact O-N 3.46Å; Q378-C380 VanDerWaalsContact C-N 3.29Å; Q378-C380 PolarHBondContact O-N 2.9Å; Q378-G381 CarbonylContact O-C 3.59Å; Q378-G381 WeakPolarHBondContact O-CA 3.38Å; Q378-G381 PolarHBondContact O-N 3.39Å; Q378-D382 PolarHBondContact NE2-OD1 2.81Å; Q378-D382 VanDerWaalsContact O-CG 3.24Å; Q378-D382 PolarHBondContact O-N 3.38Å
379	Y	35.3	Very low	52.4	Low	162 Å²	162	83.7 Å²	83.7	64%	0.635	46%	0.461	S	S	*	.	H	α-helix	trans	-64	-32.6	-178.7	-151	-90.4	0	0	0	113	N375 A376 G377 V383	N375-Y379 PolarHBondContact O-N 3.11Å; A376-Y379 PolarHBondContact O-N 2.67Å; G377-Y379 PolarHBondContact O-N 3Å; Y379-V383 HydrophobicContact CD1-CG2 3.99Å; Y379-V383 HydrophobicContact CE1-CG2 3.96Å; Y379-V383 WeakPolarHBondContact O-CB 3.31Å; Y379-V383 VanDerWaalsContact O-CG2 3.28Å; Y379-V383 WeakPolarHBondContact O-CG2 3.23Å; Y379-V383 PolarHBondContact O-N 3.32Å; Y379-V383 VanDerWaalsContact O-N 3.08Å
380	C	34.1	Very low	50.5	Low	76 Å²	76	84.4 Å²	84.4	51%	0.514	47%	0.474	S	S	.	.	H	α-helix	trans	-65.3	-44.8	171.8	-164.3	0	0	0	0	111	A376 G377 Q378 V383 I384	A376-C380 PolarHBondContact O-N 3.23Å; G377-C380 PolarHBondContact O-N 3.05Å; Q378-C380 VanDerWaalsContact C-N 3.29Å; Q378-C380 PolarHBondContact O-N 2.9Å; C380-V383 PolarHBondContact O-N 3.07Å; C380-I384 WeakPolarHBondContact O-CB 3.43Å; C380-I384 WeakPolarHBondContact O-CD1 3.37Å; C380-I384 VanDerWaalsContact O-CG1 3.24Å; C380-I384 WeakPolarHBondContact O-CG1 3.24Å; C380-I384 PolarHBondContact O-N 3.38Å
381	G	33.7	Very low	48.6	Very low	37 Å²	37	84.6 Å²	84.6	38%	0.381	48%	0.483	S	S	.	.	H	α-helix	trans	-59.5	-45.5	173.8	0	0	0	0	0	113.3	G377 Q378 V383 I384 A385	G377-G381 PolarHBondContact O-N 3.19Å; G377-G381 VanDerWaalsContact O-N 3.08Å; Q378-G381 CarbonylContact O-C 3.59Å; Q378-G381 WeakPolarHBondContact O-CA 3.38Å; Q378-G381 PolarHBondContact O-N 3.39Å; G381-V383 PolarHBondContact O-N 3.13Å; G381-I384 PolarHBondContact O-N 2.93Å; G381-A385 WeakPolarHBondContact O-CB 3.43Å; G381-A385 PolarHBondContact O-N 2.83Å
382	D	40.5	Very low	46.5	Very low	78 Å²	78	87.1 Å²	87.1	42%	0.417	50%	0.497	S	S	.	.	H	α-helix	trans	-67.8	-36.2	-178.7	-58.6	-24	0	0	0	112	Q378 T386	Q378-D382 PolarHBondContact NE2-OD1 2.81Å; Q378-D382 VanDerWaalsContact O-CG 3.24Å; Q378-D382 PolarHBondContact O-N 3.38Å; D382-T386 WeakPolarHBondContact O-CB 3.46Å; D382-T386 WeakPolarHBondContact O-CG2 3.48Å; D382-T386 PolarHBondContact O-N 2.58Å; D382-T386 PolarHBondContact O-OG1 2.81Å
383	V	39.5	Very low	44.5	Very low	70 Å²	70	91.9 Å²	91.9	42%	0.424	52%	0.524	S	S	.	.	H	α-helix	trans	-71.1	-38	173.9	170.8	0	0	0	0	111.9	Y379 C380 G381 T386 T387	Y379-V383 HydrophobicContact CD1-CG2 3.99Å; Y379-V383 HydrophobicContact CE1-CG2 3.96Å; Y379-V383 WeakPolarHBondContact O-CB 3.31Å; Y379-V383 VanDerWaalsContact O-CG2 3.28Å; Y379-V383 WeakPolarHBondContact O-CG2 3.23Å; Y379-V383 PolarHBondContact O-N 3.32Å; Y379-V383 VanDerWaalsContact O-N 3.08Å; C380-V383 PolarHBondContact O-N 3.07Å; G381-V383 PolarHBondContact O-N 3.13Å; V383-T386 WeakPolarHBondContact CA-OG1 3.26Å; V383-T386 PolarHBondContact O-OG1 3Å; V383-T387 WeakPolarHBondContact O-CB 3.48Å; V383-T387 PolarHBondContact O-N 3.42Å; V383-T387 PolarHBondContact O-OG1 2.85Å
384	I	41.5	Very low	43	Very low	87 Å²	87	92.7 Å²	92.7	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-43.2	174.3	-72.3	167.3	0	0	0	110.5	C380 G381 T387 L388	C380-I384 WeakPolarHBondContact O-CB 3.43Å; C380-I384 WeakPolarHBondContact O-CD1 3.37Å; C380-I384 VanDerWaalsContact O-CG1 3.24Å; C380-I384 WeakPolarHBondContact O-CG1 3.24Å; C380-I384 PolarHBondContact O-N 3.38Å; G381-I384 PolarHBondContact O-N 2.93Å; I384-T387 WeakPolarHBondContact CA-OG1 3.3Å; I384-T387 PolarHBondContact O-N 2.8Å; I384-T387 PolarHBondContact O-OG1 2.94Å; I384-L388 HydrophobicContact CG2-CD1 3.73Å; I384-L388 HydrophobicContact CG2-CG 4.5Å; I384-L388 WeakPolarHBondContact O-CB 3.24Å; I384-L388 WeakPolarHBondContact O-CG 3.45Å; I384-L388 PolarHBondContact O-N 2.91Å
385	A	41	Very low	41	Very low	49 Å²	49	93.6 Å²	93.6	41%	0.405	56%	0.558	S	S	.	*	H	α-helix	trans	-61.2	-48.6	176	0	0	0	0	0	111.6	G381 T387 L388 D389	G381-A385 WeakPolarHBondContact O-CB 3.43Å; G381-A385 PolarHBondContact O-N 2.83Å; A385-T387 VanDerWaalsContact C-N 3.33Å; A385-T387 PolarHBondContact O-N 3.29Å; A385-L388 PolarHBondContact O-N 3.17Å; A385-D389 PolarHBondContact O-N 3.29Å
386	T	45.8	Very low	39.7	Very low	84 Å²	84	94 Å²	94	52%	0.515	58%	0.577	S	S	.	*	H	α-helix	trans	-67.2	-29.5	179.2	46.1	0	0	0	0	113.5	D382 V383 S390	D382-T386 WeakPolarHBondContact O-CB 3.46Å; D382-T386 WeakPolarHBondContact O-CG2 3.48Å; D382-T386 PolarHBondContact O-N 2.58Å; D382-T386 PolarHBondContact O-OG1 2.81Å; V383-T386 WeakPolarHBondContact CA-OG1 3.26Å; V383-T386 PolarHBondContact O-OG1 3Å; T386-S390 WeakPolarHBondContact O-CB 3.47Å; T386-S390 PolarHBondContact O-N 3.39Å; T386-S390 VanDerWaalsContact O-N 3.11Å; T386-S390 PolarHBondContact O-OG 3.47Å
387	T	42.4	Very low	38.6	Very low	78 Å²	78	96.4 Å²	96.4	48%	0.479	59%	0.59	S	S	.	*	H	α-helix	trans	-78.2	-28.2	172.7	46.2	0	0	0	0	113.5	V383 I384 A385 T391	V383-T387 WeakPolarHBondContact O-CB 3.48Å; V383-T387 PolarHBondContact O-N 3.42Å; V383-T387 PolarHBondContact O-OG1 2.85Å; I384-T387 WeakPolarHBondContact CA-OG1 3.3Å; I384-T387 PolarHBondContact O-N 2.8Å; I384-T387 PolarHBondContact O-OG1 2.94Å; A385-T387 VanDerWaalsContact C-N 3.33Å; A385-T387 PolarHBondContact O-N 3.29Å; T387-T391 WeakPolarHBondContact O-CG2 3.42Å; T387-T391 PolarHBondContact O-N 3.12Å; T387-T391 PolarHBondContact O-OG1 3.33Å
388	L	42.9	Very low	37.9	Very low	110 Å²	110	100.7 Å²	100.7	58%	0.576	60%	0.601	S	S	*	*	H	α-helix	trans	-73.4	-45.1	172.7	-76.6	166.2	0	0	0	112.1	I384 A385 S390 T391	I384-L388 HydrophobicContact CG2-CD1 3.73Å; I384-L388 HydrophobicContact CG2-CG 4.5Å; I384-L388 WeakPolarHBondContact O-CB 3.24Å; I384-L388 WeakPolarHBondContact O-CG 3.45Å; I384-L388 PolarHBondContact O-N 2.91Å; A385-L388 PolarHBondContact O-N 3.17Å; L388-S390 VanDerWaalsContact C-N 3.29Å; L388-S390 PolarHBondContact O-N 3.2Å; L388-T391 PolarHBondContact O-N 3.39Å; L388-T391 PolarHBondContact O-OG1 3.08Å
389	D	42.1	Very low	37.3	Very low	138 Å²	138	103 Å²	103	74%	0.738	62%	0.617	S	S	*	*	H	α-helix	trans	-63.6	-36.1	173.2	-87.9	-21.5	0	0	0	111.6	A385 T391	A385-D389 PolarHBondContact O-N 3.29Å; D389-T391 VanDerWaalsContact C-N 3.26Å; D389-T391 PolarHBondContact O-N 3.4Å
390	S	42.4	Very low	37.1	Very low	87 Å²	87	102.8 Å²	102.8	61%	0.608	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.7	179.2	-59.7	0	0	0	0	114.8	T386 L388	T386-S390 WeakPolarHBondContact O-CB 3.47Å; T386-S390 PolarHBondContact O-N 3.39Å; T386-S390 VanDerWaalsContact O-N 3.11Å; T386-S390 PolarHBondContact O-OG 3.47Å; L388-S390 VanDerWaalsContact C-N 3.29Å; L388-S390 PolarHBondContact O-N 3.2Å
391	T	37.4	Very low	37.1	Very low	109 Å²	109	105.8 Å²	105.8	67%	0.669	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	0	-179	39.1	0	0	0	0	114.6	T387 L388 D389	T387-T391 WeakPolarHBondContact O-CG2 3.42Å; T387-T391 PolarHBondContact O-N 3.12Å; T387-T391 PolarHBondContact O-OG1 3.33Å; L388-T391 PolarHBondContact O-N 3.39Å; L388-T391 PolarHBondContact O-OG1 3.08Å; D389-T391 VanDerWaalsContact C-N 3.26Å; D389-T391 PolarHBondContact O-N 3.4Å
392	I	34.3	Very low	37	Very low	141 Å²	141	110.8 Å²	110.8	72%	0.723	65%	0.654	S	S	*	*			trans	-101.5	75.6	171.1	-49.5	-178.8	0	0	0	110.5	P394	I392-P394 VanDerWaalsContact O-CD 3.24Å; I392-P394 WeakPolarHBondContact O-CD 3.5Å
393	V	31.6	Very low	36.5	Very low	113 Å²	113	110.5 Å²	110.5	69%	0.685	67%	0.669	S	S	*	*			trans	-104	97.7	175.1	-177.2	0	0	0	0	110.7	T395	V393-T395 PolarHBondContact O-N 2.92Å
394	P	36.1	Very low	36	Very low	113 Å²	113	115.5 Å²	115.5	73%	0.734	69%	0.693	S	S	*	*			trans	-69.7	125.8	170	28.7	-33.1	0	0	0	110.3	I392 G396	I392-P394 VanDerWaalsContact O-CD 3.24Å; I392-P394 WeakPolarHBondContact O-CD 3.5Å; P394-G396 PolarHBondContact O-N 3.08Å
395	T	29.4	Very low	35.5	Very low	149 Å²	149	117.6 Å²	117.6	91%	0.914	71%	0.714	S	S	*	*			trans	-75.9	93.3	-176.5	36	0	0	0	0	112.2	V393	V393-T395 PolarHBondContact O-N 2.92Å
396	G	32.4	Very low	35.1	Very low	70 Å²	70	120.3 Å²	120.3	72%	0.722	73%	0.729	S	S	*	*			trans	-145.2	97.4	-177.3	0	0	0	0	0	115.2	P394	P394-G396 PolarHBondContact O-N 3.08Å
397	S	34.4	Very low	34.3	Very low	107 Å²	107	122 Å²	122	75%	0.748	73%	0.734	S	S	*	*			trans	27.4	120.9	160.1	-170.4	0	0	0	0	120.7
398	N	30.8	Very low	33.9	Very low	141 Å²	141	125.7 Å²	125.7	75%	0.754	74%	0.744	S	S	*	*			trans	0.3	129.6	148	-40.1	-63.1	0	0	0	117.9
399	D	35.5	Very low	33.2	Very low	164 Å²	164	127.5 Å²	127.5	88%	0.877	75%	0.754	S	S	*	*				-151.4	164	113.7	-129.7	-33.7	0	0	0	113.1
400	K	31.9	Very low	32.6	Very low	157 Å²	157	128.5 Å²	128.5	68%	0.683	76%	0.759	S	S	*	*			trans	-89.4	129	-172.2	-69.9	178.7	172.6	-175.9	0	113.4	N766	K400-N766 PolarHBondContact NZ-OD1 3.14Å
401	V	34.2	Very low	31.8	Very low	139 Å²	139	129.1 Å²	129.1	84%	0.842	77%	0.769	S	S	*	*			trans	-135	119.8	160.3	-178.3	0	0	0	0	110.4
402	N	30.7	Very low	31.6	Very low	143 Å²	143	130.2 Å²	130.2	77%	0.765	77%	0.77	S	S	*	*			trans	-76.9	136.1	164.8	-82.5	1.1	0	0	0	109.1
403	G	30	Very low	31.5	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	78%	0.777	S	S	*	*			trans	-149.7	102.7	175.8	0	0	0	0	0	113.2	C405	G403-C405 PolarHBondContact O-N 2.94Å
404	N	29.8	Very low	31.3	Very low	175 Å²	175	131.6 Å²	131.6	94%	0.936	78%	0.782	S	S	*	*			trans	-61	132.4	152.2	-88	6.8	0	0	0	107.7
405	C	29.8	Very low	31.1	Very low	131 Å²	131	134.3 Å²	134.3	89%	0.885	79%	0.79	S	S	*	*			trans	-125.3	125.1	155.8	-161.9	0	0	0	0	108.9	G403	G403-C405 PolarHBondContact O-N 2.94Å
406	C	32.2	Very low	31.4	Very low	106 Å²	106	131.8 Å²	131.8	72%	0.716	78%	0.778	S	S	*	*			trans	-107.5	147	-179.2	51.4	0	0	0	0	110
407	D	29.6	Very low	31.5	Very low	119 Å²	119	135.1 Å²	135.1	64%	0.636	78%	0.784	S	S	*	*	S	Bend		19.3	120.1	129.9	-160.8	15.6	0	0	0	117.9
408	K	34.3	Very low	31.4	Very low	156 Å²	156	133.3 Å²	133.3	68%	0.678	78%	0.782	S	S	*	*			trans	86.3	121.7	168.6	-57.5	126	-177.7	156.6	0	119.8
409	N	28.3	Very low	31.6	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	79%	0.792	S	S	*	*			trans	37.6	112.6	134.3	-57	-32	0	0	0	119.6
410	L	29.5	Very low	31.4	Very low	159 Å²	159	140.2 Å²	140.2	83%	0.832	79%	0.794	S	S	*	*				-156.6	150.5	124.2	-135.9	71.2	0	0	0	111.4	I412	L410-I412 HydrophobicContact CD2-CD1 3.78Å; L410-I412 HydrophobicContact CD2-CG1 4.23Å
411	A	26.4	Very low	31.8	Very low	99 Å²	99	139.6 Å²	139.6	82%	0.818	80%	0.803	S	S	*	*			trans	-126.9	107.3	174.4	0	0	0	0	0	109.9
412	I	31.4	Very low	31.6	Very low	133 Å²	133	137.8 Å²	137.8	68%	0.682	80%	0.797	S	S	*	*			trans	-142.2	102.4	173.5	-58.5	-176.2	0	0	0	104.5	L410	L410-I412 HydrophobicContact CD2-CD1 3.78Å; L410-I412 HydrophobicContact CD2-CG1 4.23Å
413	Q	33.8	Very low	32	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	80%	0.801	S	S	*	*				57.6	125	93.3	-73.3	-170.5	-24	0	0	114.3
414	A	27.6	Very low	32.2	Very low	94 Å²	94	141.2 Å²	141.2	78%	0.777	80%	0.802	S	S	*	*			trans	-86.6	146.2	-177.9	0	0	0	0	0	112.7
415	N	31	Very low	32.4	Very low	169 Å²	169	137.7 Å²	137.7	90%	0.904	79%	0.791	S	S	*	*				-169.9	174.7	127.1	-116.6	-45.7	0	0	0	113.9
416	S	35.4	Very low	32.7	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	79%	0.793	S	S	*	*			trans	95.6	96.6	157.7	-166.6	0	0	0	0	119.8
417	V	35.1	Very low	32.8	Very low	140 Å²	140	139.1 Å²	139.1	85%	0.848	80%	0.796	S	S	*	*			trans	50.2	108.7	135.4	-169.2	0	0	0	0	117.1
418	G	31.1	Very low	33.4	Very low	69 Å²	69	138.3 Å²	138.3	71%	0.711	80%	0.8	S	S	*	*			cis	114.5	112	35.5	0	0	0	0	0	111.1
419	Q	35.6	Very low	33.7	Very low	204 Å²	204	135 Å²	135	95%	0.953	80%	0.796	S	S	*	*			trans	-147.5	147.9	161.2	-109.2	177.3	1.4	0	0	110.1
420	R	31.5	Very low	34.3	Very low	246 Å²	246	134.7 Å²	134.7	93%	0.928	79%	0.794	S	S	*	*			trans	-106.6	135.2	-178.5	-80.3	175.5	160.4	-174.8	-5.6	110.9
421	V	40.3	Very low	34.8	Very low	144 Å²	144	133 Å²	133	87%	0.873	79%	0.791	S	S	*	*			trans	-142.5	145.8	151.6	-174.5	0	0	0	0	108
422	S	31	Very low	35.3	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	79%	0.79	S	S	*	*			trans	-153.4	124.2	-176.1	56.7	0	0	0	0	112.7
423	L	38.1	Very low	35.8	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	79%	0.792	S	S	*	*			trans	-143.8	129.8	167.7	-63.2	172.5	0	0	0	105.6
424	V	33.9	Very low	36.1	Very low	124 Å²	124	127.4 Å²	127.4	75%	0.752	78%	0.784	S	S	*	*			cis	69.7	119.7	37.8	-175.2	0	0	0	0	111.7
425	S	34.3	Very low	36.7	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	79%	0.789	S	S	*	*			cis	-169.4	168.1	-12.6	-97	0	0	0	0	108.1
426	D	36.3	Very low	37	Very low	173 Å²	173	129.1 Å²	129.1	93%	0.925	78%	0.782	S	S	*	*			trans	-156.8	155.1	141	-109.1	-34.2	0	0	0	112.7
427	A	35.2	Very low	37.4	Very low	94 Å²	94	130.2 Å²	130.2	78%	0.777	79%	0.79	S	S	*	*			trans	-109.4	177.6	-173.2	0	0	0	0	0	111.6
428	S	40.4	Very low	37.5	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	79%	0.787	S	S	*	*			cis	-159.8	-177.4	26.3	60.4	0	0	0	0	109
429	S	42.4	Very low	37.9	Very low	85 Å²	85	135.7 Å²	135.7	59%	0.594	79%	0.79	S	S	*	*			cis	-164.2	140.6	34.6	-94.9	0	0	0	0	113.3
430	N	40	Very low	38.1	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	78%	0.776	S	S	*	*				49.2	141.5	122.1	-44.8	-17.2	0	0	0	120.6
431	T	39.4	Very low	38.3	Very low	123 Å²	123	131.9 Å²	131.9	76%	0.755	77%	0.773	S	S	*	*			cis	-153.3	155.6	15	53.9	0	0	0	0	114.4
432	T	37.9	Very low	38.1	Very low	130 Å²	130	129.8 Å²	129.8	80%	0.798	77%	0.77	S	S	*	*			trans	21.6	143.6	137.3	-137.6	0	0	0	0	121.2
433	S	42.1	Very low	38.6	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	77%	0.77	S	S	*	*			cis	-157.4	179.9	9.3	-35.6	0	0	0	0	109.3
434	G	40	Very low	38.7	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	77%	0.765	S	S	*	*			cis	121.5	89.7	-9.5	0	0	0	0	0	117
435	I	40.4	Very low	39	Very low	175 Å²	175	131.3 Å²	131.3	90%	0.897	76%	0.762	S	S	*	*			trans	-169.6	156.9	162.4	-99.1	152.3	0	0	0	111.3
436	V	36.5	Very low	39.5	Very low	124 Å²	124	130.8 Å²	130.8	75%	0.752	76%	0.758	S	S	*	*			trans	-129.3	154.1	-176.5	174.4	0	0	0	0	111.2
437	S	44.4	Very low	39.7	Very low	119 Å²	119	131.6 Å²	131.6	83%	0.832	76%	0.756	S	S	*	*			trans	-159.4	139.6	157.9	-78.8	0	0	0	0	114
438	D	37.7	Very low	39.8	Very low	147 Å²	147	133 Å²	133	79%	0.786	75%	0.751	S	S	*	*			trans	-87.3	156.4	176.2	-66.9	-79.3	0	0	0	113.8
439	K	39.8	Very low	39.8	Very low	177 Å²	177	134.1 Å²	134.1	77%	0.77	75%	0.749	S	S	*	*				170.7	126.3	103.7	-93	-172.7	173.3	-179	0	117.6
440	Q	38.5	Very low	39.7	Very low	141 Å²	141	136 Å²	136	66%	0.659	75%	0.752	S	S	*	*				48	109.1	128.7	-57.8	178.7	-83.6	0	0	123.3
441	R	35.2	Very low	39.7	Very low	230 Å²	230	136.9 Å²	136.9	87%	0.868	75%	0.751	S	S	*	*				67.9	114.8	120.8	-69.2	-172.7	177	-173.1	-1.8	123.7
442	A	37.8	Very low	39.6	Very low	99 Å²	99	134.3 Å²	134.3	82%	0.818	75%	0.749	S	S	*	*				94.8	155.6	111.5	0	0	0	0	0	123.5
443	H	40.5	Very low	39.5	Very low	156 Å²	156	135.1 Å²	135.1	72%	0.722	75%	0.749	S	S	*	*			trans	96.3	90.2	157.4	-144.9	-72.5	0	0	0	120.6	D445	H443-D445 IonicContact CE1-OD2 3.58Å
444	D	40.3	Very low	39.5	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	75%	0.748	S	S	*	*				47	162	123.5	-90.5	-40.1	0	0	0	125
445	D	39.9	Very low	39.2	Very low	128 Å²	128	141 Å²	141	68%	0.684	75%	0.75	S	S	*	*			trans	73.5	152.1	163	-66.9	-54.1	0	0	0	120	H443	H443-D445 IonicContact CE1-OD2 3.58Å
446	S	45.2	Very low	39.1	Very low	89 Å²	89	139 Å²	139	62%	0.622	74%	0.74	S	S	*	*			cis	-174.1	157.9	-30.5	-97.8	0	0	0	0	109.5
447	E	40.4	Very low	38.9	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	74%	0.744	S	S	*	*			trans	63	163.8	159.8	-69.2	171.9	169.3	0	0	119.5
448	N	37	Very low	38.5	Very low	124 Å²	124	141.7 Å²	141.7	66%	0.663	75%	0.745	S	S	*	*			cis	-166.2	179.1	-36.9	-168.9	32.9	0	0	0	109.3
449	D	40.9	Very low	38.3	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	75%	0.749	S	S	*	*			trans	68.7	154	156.4	-65.8	-48.9	0	0	0	118.5
450	N	40.9	Very low	38.1	Very low	123 Å²	123	134.9 Å²	134.9	66%	0.658	75%	0.749	S	S	*	*			cis	170.6	165.1	-16.3	-150	24.9	0	0	0	103.8
451	E	39.5	Very low	37.9	Very low	163 Å²	163	135.6 Å²	135.6	76%	0.762	76%	0.758	S	S	*	*			cis	-161.3	160.4	-12	-149.5	165.2	-177.1	0	0	109.1
452	G	36.6	Very low	38	Very low	69 Å²	69	130.7 Å²	130.7	71%	0.711	75%	0.749	S	S	*	*			trans	77.6	167.9	149.7	0	0	0	0	0	121
453	D	36.9	Very low	37.8	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	74%	0.739	S	S	*	*			cis	-166.7	167.4	-21.5	-151.8	-4.9	0	0	0	112.3
454	L	40.7	Very low	37.5	Very low	136 Å²	136	129.1 Å²	129.1	71%	0.712	74%	0.739	S	S	*	*			trans	66.6	159.3	162.4	-55	178.2	0	0	0	120.5
455	E	34.6	Very low	37.1	Very low	160 Å²	160	133.2 Å²	133.2	75%	0.748	74%	0.744	S	S	*	*			cis	-168.2	-178.2	-48.7	-130.4	-172	170.8	0	0	111.9
456	L	37.3	Very low	36.6	Very low	134 Å²	134	136 Å²	136	70%	0.702	75%	0.752	S	S	*	*			trans	76.4	106.2	159.5	-103.2	69.6	0	0	0	122.6
457	E	33.1	Very low	36.1	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	75%	0.752	S	S	*	*				34.7	143.8	117.4	-55.6	-160.8	127.3	0	0	121.1
458	S	36.6	Very low	35.4	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	75%	0.75	S	S	*	*				-160.4	174.9	58.7	65.6	0	0	0	0	117
459	A	33.7	Very low	35	Very low	107 Å²	107	135.5 Å²	135.5	88%	0.884	76%	0.758	S	S	*	*			trans	-74.3	166.5	-165.4	0	0	0	0	0	118.7
460	G	34.2	Very low	34.4	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	76%	0.762	S	S	*	*			trans	-170.3	112.2	168.6	0	0	0	0	0	113.7
461	D	35.6	Very low	33.7	Very low	157 Å²	157	136.7 Å²	136.7	84%	0.84	77%	0.768	S	S	*	*			trans	-56	166	176	-84.3	-35.3	0	0	0	114.6
462	N	35.8	Very low	33.2	Very low	126 Å²	126	136.6 Å²	136.6	67%	0.674	77%	0.773	S	S	*	*			cis	-160.7	164.7	19.5	-142.3	-53.9	0	0	0	112.6
463	S	34.5	Very low	32.8	Very low	89 Å²	89	137.6 Å²	137.6	62%	0.622	77%	0.768	S	S	*	*			trans	37.5	132.5	155.4	70.8	0	0	0	0	120.7
464	N	34	Very low	32.5	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	77%	0.772	S	S	*	*			cis	-164.1	126.5	44.7	-135.3	-28.3	0	0	0	113.5
465	R	32.8	Very low	31.9	Very low	223 Å²	223	138.3 Å²	138.3	84%	0.842	77%	0.773	S	S	*	*			trans	33.2	109.6	151.9	-63.7	174	179.7	-162.8	-2.1	119.4
466	H	29.1	Very low	31.8	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.856	76%	0.762	S	S	*	*				80.4	148.9	84.8	-98.3	-117.5	0	0	0	115.9
467	P	34	Very low	31.3	Very low	96 Å²	96	133.1 Å²	133.1	62%	0.623	76%	0.757	S	S	*	*				-141	-155.3	-121.4	41.3	-18.8	0	0	0	114.2
468	L	26.1	Very low	31.2	Very low	161 Å²	161	127 Å²	127	84%	0.843	73%	0.731	S	S	*	*			trans	20.1	118	149.9	-65.2	166.4	0	0	0	118.8
469	V	28.2	Very low	30.9	Very low	137 Å²	137	125.5 Å²	125.5	83%	0.83	72%	0.721	S	S	*	*			trans	-165.7	157.2	133.1	127.8	0	0	0	0	112.9
470	H	29.3	Very low	30.8	Very low	161 Å²	161	124.7 Å²	124.7	75%	0.745	70%	0.696	S	S	*	*			trans	-25	145.9	-176.3	-59	-69.3	0	0	0	122.6
471	S	26.2	Very low	30.6	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	69%	0.688	S	S	*	*				12	125.4	128.3	-43.4	0	0	0	0	119.3
472	D	28.4	Very low	30.3	Very low	162 Å²	162	123 Å²	123	87%	0.866	69%	0.689	S	S	*	*			trans	-152.7	164.3	141.6	-142.4	-23.4	0	0	0	113.8
473	S	27.1	Very low	30.1	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	70%	0.699	S	S	*	*			trans	-101.1	115.4	-164.6	-166	0	0	0	0	113.3	R475	S473-R475 PolarHBondContact O-N 3.41Å
474	A	31.5	Very low	29.8	Very low	105 Å²	105	126 Å²	126	87%	0.868	71%	0.705	S	S	*	*			trans	-70.3	83.4	179.6	0	0	0	0	0	113.1	S476	A474-S476 PolarHBondContact O-N 3.34Å
475	R	28.5	Very low	29.6	Very low	194 Å²	194	124.5 Å²	124.5	73%	0.732	71%	0.712	S	S	*	*			trans	-65.6	113.5	174.1	-73.7	-178.6	165.4	107.2	-6.3	111.8	S473 D477	S473-R475 PolarHBondContact O-N 3.41Å; R475-D477 PolarHBondContact O-N 2.98Å; R475-D477 VanDerWaalsContact O-N 3.14Å
476	S	31.1	Very low	29.5	Very low	72 Å²	72	119.3 Å²	119.3	50%	0.503	71%	0.71	S	S	.	*			trans	-78.6	85.8	169.8	49.1	0	0	0	0	111.6	K124 A474 V478	K124-S476 PolarHBondContact NZ-O 3.47Å; A474-S476 PolarHBondContact O-N 3.34Å; S476-V478 PolarHBondContact O-N 3.4Å
477	D	28.4	Very low	29.7	Very low	112 Å²	112	115.2 Å²	115.2	60%	0.599	71%	0.708	S	S	*	*			trans	-81.7	83.3	-177.5	-74.9	-17.1	0	0	0	113.4	K124 R475	K124-D477 WeakPolarHBondContact CE-OD1 3.32Å; K124-D477 IonicContact NZ-OD1 3.44Å; K124-D477 PolarHBondContact NZ-OD1 3.31Å; R475-D477 PolarHBondContact O-N 2.98Å; R475-D477 VanDerWaalsContact O-N 3.14Å
478	V	31	Very low	29.9	Very low	50 Å²	50	117.7 Å²	117.7	30%	0.303	72%	0.716	S	S	.	*			trans	-76.8	116.7	159.2	-177.8	0	0	0	0	108.3	S476	S476-V478 PolarHBondContact O-N 3.4Å
479	S	28.8	Very low	30.5	Very low	90 Å²	90	115.5 Å²	115.5	63%	0.629	71%	0.714	S	S	*	*			trans	-133.3	123.9	171.4	68.6	0	0	0	0	110.8	A481	S479-A481 PolarHBondContact O-N 3.42Å
480	Y	32.5	Very low	30.8	Very low	90 Å²	90	118.1 Å²	118.1	35%	0.353	72%	0.715	S	S	.	*			trans	-67	125.2	-177.7	-91.2	-101.5	0	0	0	111.5	I109 K128	I109-Y480 WeakPolarHBondContact CD1-OH 3.35Å; K128-Y480 VanDerWaalsContact CD-O 3.25Å; K128-Y480 WeakPolarHBondContact CD-O 3.27Å; K128-Y480 WeakPolarHBondContact CE-O 3.38Å; K128-Y480 PolarHBondContact NZ-O 2.96Å
481	A	30.3	Very low	31.2	Very low	71 Å²	71	118 Å²	118	59%	0.587	71%	0.714	S	S	*	*			trans	-148.9	71.6	-179.6	0	0	0	0	0	111.8	S479 K483	S479-A481 PolarHBondContact O-N 3.42Å; A481-K483 PolarHBondContact O-N 2.82Å
482	S	28.9	Very low	31.8	Very low	124 Å²	124	118.5 Å²	118.5	87%	0.867	71%	0.708	S	S	*	*			trans	-66.7	102.3	167.7	-53.1	0	0	0	0	110
483	K	31.5	Very low	32.3	Very low	203 Å²	203	115.2 Å²	115.2	88%	0.883	70%	0.703	S	S	*	*			trans	-125.2	127.3	158.6	-86.1	-165.1	170.7	-168.2	0	108	A481	A481-K483 PolarHBondContact O-N 2.82Å
484	G	28.9	Very low	33	Very low	74 Å²	74	117.8 Å²	117.8	76%	0.763	71%	0.71	S	S	*	*			trans	-94.3	-169.6	168.1	0	0	0	0	0	111.8
485	A	29.9	Very low	33.5	Very low	103 Å²	103	117.7 Å²	117.7	85%	0.851	70%	0.703	S	S	*	*			trans	73.1	115.1	176.9	0	0	0	0	0	117.3
486	S	29.5	Very low	34.2	Very low	115 Å²	115	113.9 Å²	113.9	80%	0.804	70%	0.704	S	S	*	*			trans	29	126.8	131.1	-160.2	0	0	0	0	121.1
487	A	34.2	Very low	34.8	Very low	98 Å²	98	117.3 Å²	117.3	81%	0.81	72%	0.722	S	S	*	*				-160.3	136.9	126.8	0	0	0	0	0	109.7
488	D	37	Very low	35.4	Very low	149 Å²	149	117.7 Å²	117.7	80%	0.797	73%	0.73	S	S	*	*			trans	-95.9	172.1	170.5	-92.9	-54.6	0	0	0	111.7
489	S	39.4	Very low	35.7	Very low	115 Å²	115	123.6 Å²	123.6	80%	0.804	76%	0.76	S	S	*	*			trans	41	86.2	152.1	-59.8	0	0	0	0	119.2
490	K	34	Very low	36.2	Very low	192 Å²	192	122.5 Å²	122.5	84%	0.835	76%	0.763	S	S	*	*			trans	-40.3	128	150	169.1	-159.2	177.7	-162.8	0	113
491	E	38.6	Very low	36.4	Very low	158 Å²	158	122 Å²	122	74%	0.738	78%	0.784	S	S	*	*				-162.7	139.4	123	-105.5	-166.9	128.9	0	0	115.5
492	N	38.2	Very low	36.8	Very low	123 Å²	123	130.1 Å²	130.1	66%	0.658	80%	0.8	S	S	*	*			trans	46.1	107.5	146.8	-50.2	-18.7	0	0	0	123.5
493	A	39.8	Very low	37.1	Very low	92 Å²	92	129.2 Å²	129.2	76%	0.76	79%	0.794	S	S	*	*				93	141.3	115.4	0	0	0	0	0	122.7
494	D	40	Very low	37.2	Very low	144 Å²	144	123 Å²	123	77%	0.77	79%	0.787	S	S	*	*			trans	67.2	86	155.3	-69.4	-50.6	0	0	0	124.6
495	S	42.3	Very low	37.3	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	79%	0.79	S	S	*	*				80.4	152	107.2	-62.9	0	0	0	0	120.7
496	P	44.2	Very low	37.4	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	78%	0.784	S	S	*	*			trans	-132.8	171.7	-147.4	42.4	-26.4	0	0	0	117.1
497	T	43	Very low	37.4	Very low	144 Å²	144	131.8 Å²	131.8	88%	0.883	78%	0.784	S	S	*	*				-171.2	156.2	128.6	14.8	0	0	0	0	113.1
498	P	40.4	Very low	37.3	Very low	119 Å²	119	130.5 Å²	130.5	77%	0.773	78%	0.78	S	S	*	*			trans	-131.3	158.7	-174.7	42	-27.3	0	0	0	117.1
499	D	39.2	Very low	37.1	Very low	175 Å²	175	127.5 Å²	127.5	94%	0.936	78%	0.776	S	S	*	*			trans	-169.1	159.4	151.6	-120.4	-26.6	0	0	0	108.9
500	G	39.1	Very low	36.7	Very low	66 Å²	66	129.3 Å²	129.3	68%	0.68	78%	0.777	S	S	*	*			cis	176.5	146	-5.9	0	0	0	0	0	111.7
501	G	36.2	Very low	36.6	Very low	79 Å²	79	125.4 Å²	125.4	81%	0.814	77%	0.773	S	S	*	*			trans	87	139.6	175.5	0	0	0	0	0	116.3
502	R	37.8	Very low	36.3	Very low	243 Å²	243	124.1 Å²	124.1	92%	0.917	77%	0.771	S	S	*	*			cis	88.5	123.3	25.1	-167.5	-175.7	-175.8	-159.1	1	113.1
503	S	35.3	Very low	35.9	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	78%	0.778	S	S	*	*			cis	-172.9	148.5	-7	49.5	0	0	0	0	114.1
504	G	34	Very low	35.7	Very low	72 Å²	72	127.8 Å²	127.8	74%	0.742	78%	0.782	S	S	*	*			trans	80.2	171.4	158	0	0	0	0	0	116.9
505	F	31.5	Very low	35.3	Very low	190 Å²	190	128.2 Å²	128.2	83%	0.833	78%	0.784	S	S	*	*			cis	-170.6	141.7	-18	-136.4	-58.8	0	0	0	108.9
506	L	32.1	Very low	35.3	Very low	138 Å²	138	129 Å²	129	72%	0.723	79%	0.787	S	S	*	*			trans	65.1	160.5	173.6	-45.2	177.8	0	0	0	114.6
507	D	30.1	Very low	34.8	Very low	150 Å²	150	127 Å²	127	80%	0.802	79%	0.787	S	S	*	*			cis	-159.7	171.3	-28	-110.3	-26.6	0	0	0	108
508	G	31	Very low	34.2	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	79%	0.787	S	S	*	*			trans	112.6	83.7	152.3	0	0	0	0	0	120
509	A	33.2	Very low	34	Very low	86 Å²	86	128.4 Å²	128.4	71%	0.711	79%	0.787	S	S	*	*				49.2	114.1	127.8	0	0	0	0	0	123.3
510	N	30.5	Very low	33.4	Very low	152 Å²	152	123.3 Å²	123.3	81%	0.813	78%	0.776	S	S	*	*				86.3	135.6	124.4	-60.9	-6.2	0	0	0	123.3
511	S	31.4	Very low	33	Very low	110 Å²	110	130 Å²	130	77%	0.769	79%	0.786	S	S	*	*			trans	72.9	144.1	150	-62.6	0	0	0	0	118.4
512	L	32	Very low	32.7	Very low	132 Å²	132	131.7 Å²	131.7	69%	0.691	78%	0.783	S	S	*	*			cis	-150.5	167	-1.8	-148	68.3	0	0	0	109.9
513	E	30.3	Very low	32.1	Very low	169 Å²	169	127.4 Å²	127.4	79%	0.79	78%	0.778	S	S	*	*			trans	23.8	138.4	155.7	-70.8	157.4	171.6	0	0	120.9
514	S	35.3	Very low	31.7	Very low	122 Å²	122	128.7 Å²	128.7	85%	0.853	78%	0.782	S	S	*	*			cis	-161	163.7	45.1	58.9	0	0	0	0	115.4
515	D	33.5	Very low	31.2	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	79%	0.791	S	S	*	*			trans	-93.6	-170.9	-178.9	-130.4	-5.7	0	0	0	112.6
516	P	41.2	Very low	30.9	Very low	119 Å²	119	137 Å²	137	77%	0.773	79%	0.791	S	S	*	*			cis	-131.9	-177.2	-20.5	38	-19.6	0	0	0	114.7
517	G	34	Very low	30.4	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	80%	0.797	S	S	*	*			trans	-164.5	17.6	-176	0	0	0	0	0	123.6
518	D	30.8	Very low	30	Very low	163 Å²	163	133.3 Å²	133.3	87%	0.872	79%	0.79	S	S	*	*			trans	59	173.2	161.9	-159.1	29.1	0	0	0	121.7
519	V	35.4	Very low	29.6	Very low	129 Å²	129	141.4 Å²	141.4	78%	0.782	80%	0.799	S	S	*	*			trans	79.4	102	172.1	-167.1	0	0	0	0	116.6
520	G	27.7	Very low	29.2	Very low	68 Å²	68	146.2 Å²	146.2	70%	0.701	80%	0.804	S	S	*	*			trans	-116.5	177.8	-176	0	0	0	0	0	117.2
521	K	30.1	Very low	28.9	Very low	207 Å²	207	143.8 Å²	143.8	90%	0.9	80%	0.798	S	S	*	*			trans	-161.1	158.3	163	-104.8	147.4	-172.7	171	0	109.8
522	P	28.8	Very low	28.6	Very low	115 Å²	115	144.8 Å²	144.8	75%	0.747	79%	0.79	S	S	*	*			trans	-88.5	141.5	-145.7	31.2	-36.7	0	0	0	117.8
523	N	26.5	Very low	28.3	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	79%	0.793	S	S	*	*			trans	48.9	74	145.9	-63.8	-0.3	0	0	0	118.8
524	T	26.3	Very low	27.9	Very low	131 Å²	131	148.5 Å²	148.5	80%	0.804	80%	0.796	S	S	*	*			trans	-67.7	128.9	149.2	43.1	0	0	0	0	110.4	R526	T524-R526 VanDerWaalsContact C-N 3.29Å; T524-R526 PolarHBondContact O-N 3.33Å
525	F	24.7	Very low	27.5	Very low	214 Å²	214	147.3 Å²	147.3	94%	0.939	79%	0.785	S	S	*	*			trans	-70.9	85.8	169.6	-94.9	-86.6	0	0	0	110.2	A527	F525-A527 PolarHBondContact O-N 2.85Å
526	R	23.4	Very low	27.2	Very low	222 Å²	222	147.1 Å²	147.1	84%	0.838	78%	0.783	S	S	*	*			trans	-69.2	124.8	176.6	-163.4	174.8	-170.5	170.8	2.6	109.3	T524 V528	T524-R526 VanDerWaalsContact C-N 3.29Å; T524-R526 PolarHBondContact O-N 3.33Å; R526-V528 PolarHBondContact O-N 3.46Å; R526-V528 VanDerWaalsContact O-N 3.12Å
527	A	21.8	Very low	26.5	Very low	102 Å²	102	146.4 Å²	146.4	84%	0.843	77%	0.772	S	S	*	*			trans	-64.7	112.7	-177.5	0	0	0	0	0	111.3	F525	F525-A527 PolarHBondContact O-N 2.85Å
528	V	22.5	Very low	26.5	Very low	108 Å²	108	146.4 Å²	146.4	66%	0.655	76%	0.759	S	S	*	*			trans	-87.6	112.5	176.4	-173.2	0	0	0	0	109.3	R526 F530	R526-V528 PolarHBondContact O-N 3.46Å; R526-V528 VanDerWaalsContact O-N 3.12Å; V528-F530 HydrophobicContact CG1-CD2 3.43Å; V528-F530 VanDerWaalsContact CG1-CD2 3.43Å; V528-F530 HydrophobicContact CG1-CE2 3.52Å; V528-F530 HydrophobicContact CG1-CG 4.29Å; V528-F530 HydrophobicContact CG1-CZ 4.42Å
529	R	22.2	Very low	26.6	Very low	241 Å²	241	141.6 Å²	141.6	91%	0.909	74%	0.738	S	S	*	*			trans	-75.7	121.2	157.6	-74.7	176.2	170.2	167.5	-5.1	107.5
530	F	24.9	Very low	26.4	Very low	188 Å²	188	138.2 Å²	138.2	83%	0.825	72%	0.723	S	S	*	*			trans	-109.1	143.5	158.9	-95.6	-65.3	0	0	0	110.2	V528	V528-F530 HydrophobicContact CG1-CD2 3.43Å; V528-F530 VanDerWaalsContact CG1-CD2 3.43Å; V528-F530 HydrophobicContact CG1-CE2 3.52Å; V528-F530 HydrophobicContact CG1-CG 4.29Å; V528-F530 HydrophobicContact CG1-CZ 4.42Å
531	C	24	Very low	26.8	Very low	101 Å²	101	140.9 Å²	140.9	68%	0.682	72%	0.721	S	S	*	*			trans	-84.5	137.9	-178.1	-56.3	0	0	0	0	108.8
532	Q	24.9	Very low	27.1	Very low	130 Å²	130	135 Å²	135	61%	0.607	70%	0.702	S	S	*	*				61	146.7	99.4	-57.6	-173	-29.2	0	0	116
533	H	25.3	Very low	27.6	Very low	160 Å²	160	132.6 Å²	132.6	74%	0.741	69%	0.686	S	S	*	*			trans	75.6	130.1	-171.7	-35.3	-49.9	0	0	0	112.6
534	Y	23.8	Very low	28	Very low	219 Å²	219	130.4 Å²	130.4	86%	0.859	67%	0.673	S	S	*	*			cis	-125	153.3	10.9	-87	-101.7	0	0	0	113.3
535	P	26.1	Very low	28.7	Very low	97 Å²	97	128.7 Å²	128.7	63%	0.63	66%	0.656	S	S	*	*			trans	-92	128.1	175.3	34.5	-30.9	0	0	0	112.8
536	I	27	Very low	29.5	Very low	150 Å²	150	124.4 Å²	124.4	77%	0.769	64%	0.639	S	S	*	*			trans	-98.5	99	161.1	-59.6	-178.1	0	0	0	107.8
537	L	27.2	Very low	30.2	Very low	104 Å²	104	120.5 Å²	120.5	55%	0.545	63%	0.628	S	S	.	*			trans	-69.8	132	-174	-85.2	155.3	0	0	0	112.7	S539 A540	L537-S539 PolarHBondContact O-N 3.18Å; L537-A540 WeakPolarHBondContact O-CB 3.33Å; L537-A540 PolarHBondContact O-N 2.99Å
538	P	33.9	Very low	31.1	Very low	72 Å²	72	121.1 Å²	121.1	47%	0.468	62%	0.617	S	S	.	*	H	α-helix	trans	-56.3	-23.2	171.8	-28.2	36.2	0	0	0	114.7	A540 L541	P538-A540 VanDerWaalsContact C-N 3.31Å; P538-A540 PolarHBondContact O-N 2.87Å; P538-L541 PolarHBondContact O-N 3.28Å
539	S	31.5	Very low	32	Very low	63 Å²	63	123.3 Å²	123.3	44%	0.441	61%	0.613	S	S	.	*	H	α-helix	trans	-69.9	-22	175.5	55.6	0	0	0	0	114.1	L537 L541 T542 T543	L537-S539 PolarHBondContact O-N 3.18Å; S539-L541 VanDerWaalsContact C-N 3.34Å; S539-T542 WeakPolarHBondContact CA-OG1 3.15Å; S539-T542 PolarHBondContact O-OG1 2.66Å; S539-T542 VanDerWaalsContact O-OG1 3.06Å; S539-T543 WeakPolarHBondContact O-CB 3.42Å; S539-T543 PolarHBondContact O-N 3.13Å; S539-T543 PolarHBondContact O-OG1 3.13Å
540	A	31.7	Very low	33	Very low	57 Å²	57	118 Å²	118	47%	0.471	60%	0.603	S	S	.	*	H	α-helix	trans	-66	-40.6	174.7	0	0	0	0	0	111	L537 P538 T543 L544	L537-A540 WeakPolarHBondContact O-CB 3.33Å; L537-A540 PolarHBondContact O-N 2.99Å; P538-A540 VanDerWaalsContact C-N 3.31Å; P538-A540 PolarHBondContact O-N 2.87Å; A540-T543 PolarHBondContact O-N 2.96Å; A540-L544 WeakPolarHBondContact O-CB 3.45Å; A540-L544 PolarHBondContact O-N 3.07Å
541	L	36.1	Very low	33.4	Very low	125 Å²	125	114.1 Å²	114.1	65%	0.654	60%	0.598	S	S	*	*	H	α-helix	trans	-69	-42.8	-178.2	-132	159.1	0	0	0	111.3	P538 S539 T543 L544 E545	P538-L541 PolarHBondContact O-N 3.28Å; S539-L541 VanDerWaalsContact C-N 3.34Å; L541-T543 PolarHBondContact O-N 2.89Å; L541-L544 PolarHBondContact O-N 2.84Å; L541-E545 WeakPolarHBondContact O-CB 3.46Å; L541-E545 PolarHBondContact O-N 3.02Å
542	T	37.5	Very low	34	Very low	82 Å²	82	117.4 Å²	117.4	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-66	-36.4	173.3	52.8	0	0	0	0	112.9	S539 E545 Q546	S539-T542 WeakPolarHBondContact CA-OG1 3.15Å; S539-T542 PolarHBondContact O-OG1 2.66Å; S539-T542 VanDerWaalsContact O-OG1 3.06Å; T542-E545 PolarHBondContact O-N 3.4Å; T542-Q546 PolarHBondContact O-N 3.07Å
543	T	39.3	Very low	34.3	Very low	65 Å²	65	118.3 Å²	118.3	40%	0.399	61%	0.612	S	S	.	*	H	α-helix	trans	-67.2	-38.2	176.3	-55.2	0	0	0	0	111.3	S539 A540 L541 Q546 K547	S539-T543 WeakPolarHBondContact O-CB 3.42Å; S539-T543 PolarHBondContact O-N 3.13Å; S539-T543 PolarHBondContact O-OG1 3.13Å; A540-T543 PolarHBondContact O-N 2.96Å; L541-T543 PolarHBondContact O-N 2.89Å; T543-Q546 PolarHBondContact O-N 3.39Å; T543-K547 WeakPolarHBondContact O-CG 3.46Å; T543-K547 PolarHBondContact O-N 3.39Å
544	L	34.1	Very low	34.4	Very low	107 Å²	107	117 Å²	117	56%	0.56	62%	0.615	S	S	*	*	H	α-helix	trans	-73.5	-35.1	177.7	-159.4	142.6	0	0	0	111.5	A540 L541 Q546 K547 L548	A540-L544 WeakPolarHBondContact O-CB 3.45Å; A540-L544 PolarHBondContact O-N 3.07Å; L541-L544 PolarHBondContact O-N 2.84Å; L544-Q546 VanDerWaalsContact C-N 3.34Å; L544-Q546 PolarHBondContact O-N 3.34Å; L544-K547 PolarHBondContact O-N 2.84Å; L544-L548 HydrophobicContact CD2-CD1 3.64Å; L544-L548 HydrophobicContact CD2-CG 4.11Å; L544-L548 WeakPolarHBondContact O-CB 3.26Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.43Å
545	E	40.2	Very low	34.8	Very low	95 Å²	95	115.9 Å²	115.9	44%	0.444	62%	0.618	S	S	.	*	H	α-helix	trans	-64.6	-30.3	168.2	-87	-157.2	173.1	0	0	114.2	L541 T542 R549	L541-E545 WeakPolarHBondContact O-CB 3.46Å; L541-E545 PolarHBondContact O-N 3.02Å; T542-E545 PolarHBondContact O-N 3.4Å; E545-R549 PolarHBondContact O-N 3.47Å; E545-R549 PolarHBondContact O-NE 3Å; E545-R549 VanDerWaalsContact O-NE 3.07Å; E545-R549 IonicContact OE2-CZ 2.69Å; E545-R549 IonicContact OE2-NH2 3.97Å; E545-R549 PolarHBondContact OE2-NH2 3.29Å
546	Q	41.6	Very low	34.9	Very low	125 Å²	125	120.5 Å²	120.5	58%	0.584	63%	0.631	S	S	*	*	H	α-helix	trans	-75.3	-43.3	171.4	-79.5	-176.9	-50.8	0	0	111.2	T542 T543 L544 L548 R549 N550	T542-Q546 PolarHBondContact O-N 3.07Å; T543-Q546 PolarHBondContact O-N 3.39Å; L544-Q546 VanDerWaalsContact C-N 3.34Å; L544-Q546 PolarHBondContact O-N 3.34Å; Q546-L548 PolarHBondContact O-N 3.46Å; Q546-R549 PolarHBondContact O-N 3.08Å; Q546-N550 PolarHBondContact O-N 3.19Å; Q546-N550 PolarHBondContact O-OD1 3.07Å
547	K	38.1	Very low	35	Very low	140 Å²	140	118.1 Å²	118.1	61%	0.609	63%	0.633	S	S	*	*	H	α-helix	trans	-62.6	-41.7	175.8	-74.2	-175.2	176.3	-174.4	0	112.4	T543 L544 R549 N550 C551	T543-K547 WeakPolarHBondContact O-CG 3.46Å; T543-K547 PolarHBondContact O-N 3.39Å; L544-K547 PolarHBondContact O-N 2.84Å; K547-R549 VanDerWaalsContact C-N 3.29Å; K547-R549 PolarHBondContact O-N 3.19Å; K547-N550 PolarHBondContact O-N 3.49Å; K547-C551 WeakPolarHBondContact O-CB 3.41Å; K547-C551 PolarHBondContact O-N 3.04Å; K547-C551 PolarHBondContact O-SG 2.26Å
548	L	42.3	Very low	35.1	Very low	114 Å²	114	119 Å²	119	60%	0.597	65%	0.648	S	S	*	*	H	α-helix	trans	-64.8	-29.1	174.9	-76.4	175	0	0	0	113.5	L544 Q546	L544-L548 HydrophobicContact CD2-CD1 3.64Å; L544-L548 HydrophobicContact CD2-CG 4.11Å; L544-L548 WeakPolarHBondContact O-CB 3.26Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.43Å; Q546-L548 PolarHBondContact O-N 3.46Å
549	R	40.5	Very low	35	Very low	154 Å²	154	121.1 Å²	121.1	58%	0.581	66%	0.662	S	S	*	*	H	α-helix	trans	-76.2	-33.2	171.7	-85.6	178.3	-92.5	-135.6	0.4	113	E545 Q546 K547	E545-R549 PolarHBondContact O-N 3.47Å; E545-R549 PolarHBondContact O-NE 3Å; E545-R549 VanDerWaalsContact O-NE 3.07Å; E545-R549 IonicContact OE2-CZ 2.69Å; E545-R549 IonicContact OE2-NH2 3.97Å; E545-R549 PolarHBondContact OE2-NH2 3.29Å; Q546-R549 PolarHBondContact O-N 3.08Å; K547-R549 VanDerWaalsContact C-N 3.29Å; K547-R549 PolarHBondContact O-N 3.19Å
550	N	42.5	Very low	34.9	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	68%	0.679	S	S	*	*	H	α-helix	trans	-81.4	-23.7	-179.3	-68.1	6.1	0	0	0	113.5	Q546 K547 Q552	Q546-N550 PolarHBondContact O-N 3.19Å; Q546-N550 PolarHBondContact O-OD1 3.07Å; K547-N550 PolarHBondContact O-N 3.49Å; N550-Q552 VanDerWaalsContact C-N 3.31Å; N550-Q552 PolarHBondContact O-N 3.38Å
551	C	34.7	Very low	34.7	Very low	108 Å²	108	132 Å²	132	73%	0.73	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	6.7	-178.6	-69.7	0	0	0	0	115.5	K547	K547-C551 WeakPolarHBondContact O-CB 3.41Å; K547-C551 PolarHBondContact O-N 3.04Å; K547-C551 PolarHBondContact O-SG 2.26Å
552	Q	36.6	Very low	34.5	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	16.1	179.1	-65.7	-163.9	-52	0	0	114.4	N550	N550-Q552 VanDerWaalsContact C-N 3.31Å; N550-Q552 PolarHBondContact O-N 3.38Å
553	L	29.5	Very low	34	Very low	149 Å²	149	134 Å²	134	78%	0.78	71%	0.711	S	S	*	*	S	Bend	trans	-134.4	50.8	-172.3	-76.5	173.5	0	0	0	115.3
554	T	28.6	Very low	33.6	Very low	132 Å²	132	135.8 Å²	135.8	81%	0.81	73%	0.726	S	S	*	*			trans	-166.5	115.1	152	30.4	0	0	0	0	112.6
555	Q	32	Very low	33.2	Very low	196 Å²	196	136.3 Å²	136.3	92%	0.916	74%	0.739	S	S	*	*				162.1	139.6	128.6	-87.8	172.9	32.4	0	0	110.2
556	Q	28.8	Very low	32.7	Very low	195 Å²	195	136 Å²	136	91%	0.911	75%	0.746	S	S	*	*			trans	-132.2	142	-175.7	-85.7	-175.5	-36.7	0	0	112.3
557	A	29.2	Very low	32.2	Very low	99 Å²	99	136.2 Å²	136.2	82%	0.818	75%	0.752	S	S	*	*			trans	47.7	125.2	143.9	0	0	0	0	0	122
558	S	27.8	Very low	31.7	Very low	122 Å²	122	136.2 Å²	136.2	85%	0.853	76%	0.757	S	S	*	*				-165.1	136.9	110.3	-163.8	0	0	0	0	111.8
559	P	31.8	Very low	31.1	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	77%	0.767	S	S	*	*			trans	-115.7	159.5	-174.8	40.7	-33.1	0	0	0	116.3
560	R	29.7	Very low	30.5	Very low	210 Å²	210	140.4 Å²	140.4	79%	0.792	78%	0.782	S	S	*	*			trans	-174.8	161.1	163.8	-102.5	-161.5	149.5	78.5	27	109.7
561	E	27.8	Very low	29.6	Very low	140 Å²	140	145.2 Å²	145.2	65%	0.654	79%	0.79	S	S	*	*			cis	-162.3	151.7	-30.9	-131.9	165.8	-147.2	0	0	108.1
562	P	32.3	Very low	29.1	Very low	118 Å²	118	145 Å²	145	77%	0.766	79%	0.79	S	S	*	*			trans	-126.2	152.1	-160.7	40.9	-28	0	0	0	118.9
563	C	26.3	Very low	28.7	Very low	130 Å²	130	145.1 Å²	145.1	88%	0.878	79%	0.793	S	S	*	*			trans	-173.1	160.3	157.3	-105.9	0	0	0	0	109
564	S	30.9	Very low	28.6	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	80%	0.796	S	S	*	*			cis	-164.3	159.4	-6.9	48.8	0	0	0	0	111
565	S	26.9	Very low	28.4	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	79%	0.79	S	S	*	*			trans	-0.1	139.8	161.5	-130.7	0	0	0	0	119.4
566	S	29.5	Very low	28.1	Very low	87 Å²	87	142.2 Å²	142.2	61%	0.608	79%	0.786	S	S	*	*			cis	-153.9	-166.9	27.1	63.8	0	0	0	0	111.9
567	D	30.8	Very low	28.1	Very low	131 Å²	131	137.4 Å²	137.4	70%	0.701	78%	0.78	S	S	*	*			cis	-155.7	-173.4	16.5	-131.2	-42.3	0	0	0	117.7
568	I	28	Very low	27.9	Very low	139 Å²	139	142.1 Å²	142.1	71%	0.713	79%	0.785	S	S	*	*			trans	-60	157.8	-171.2	-80.6	162.4	0	0	0	120.8
569	K	28.5	Very low	28.1	Very low	188 Å²	188	140.3 Å²	140.3	82%	0.817	78%	0.777	S	S	*	*			trans	77.8	130.9	178.5	-75.2	171.1	-176.9	174.5	0	114.5
570	L	28.3	Very low	28.2	Very low	168 Å²	168	139.1 Å²	139.1	88%	0.88	77%	0.77	S	S	*	*			cis	-136.2	162.9	4.2	-105.3	161.4	0	0	0	110.8
571	R	24.5	Very low	28.6	Very low	231 Å²	231	132.8 Å²	132.8	87%	0.872	75%	0.754	S	S	*	*			trans	-107.3	154.5	-177.5	-87.5	-171.4	173.3	-164.1	-0.8	113.6
572	S	24.2	Very low	28.9	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	74%	0.737	S	S	*	*			trans	60.4	97.6	148.4	61.1	0	0	0	0	120.7
573	M	28.1	Very low	28.9	Very low	171 Å²	171	126.1 Å²	126.1	84%	0.842	72%	0.724	S	S	*	*				-139.6	104.3	124	-71.6	-163.5	170.2	0	0	106.3
574	L	26.7	Very low	29.1	Very low	162 Å²	162	124.8 Å²	124.8	85%	0.848	70%	0.703	S	S	*	*				80.6	130.1	82.2	-80.6	170.9	0	0	0	113.3
575	S	25.3	Very low	29.4	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	68%	0.676	S	S	*	*			trans	-83	-178.7	175.4	62.7	0	0	0	0	111.7
576	N	25.7	Very low	29.9	Very low	156 Å²	156	120.9 Å²	120.9	83%	0.834	66%	0.659	S	S	*	*			trans	82.1	91.1	174.8	-48.8	10.7	0	0	0	113.3
577	A	27.2	Very low	30.1	Very low	95 Å²	95	123 Å²	123	79%	0.785	66%	0.659	S	S	*	*			trans	-138.2	97	161.9	0	0	0	0	0	108.3	A579	A577-A579 PolarHBondContact O-N 2.74Å
578	E	26.3	Very low	30.2	Very low	197 Å²	197	120.1 Å²	120.1	92%	0.921	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-66.5	123.4	162.5	-66.8	173.4	131.8	0	0	107.2	P580	E578-P580 WeakPolarHBondContact O-CD 3.21Å
579	A	32	Very low	30.6	Very low	84 Å²	84	116.3 Å²	116.3	69%	0.694	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-80.5	118	-175.4	0	0	0	0	0	110.4	A577 V581	A577-A579 PolarHBondContact O-N 2.74Å; A579-V581 PolarHBondContact O-N 3.31Å
580	P	33.6	Very low	30.8	Very low	93 Å²	93	109.3 Å²	109.3	60%	0.604	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-72.2	124.8	175.8	29	-33.3	0	0	0	110.2	E578 S582	E578-P580 WeakPolarHBondContact O-CD 3.21Å; P580-S582 PolarHBondContact O-N 2.9Å
581	V	37	Very low	31.2	Very low	77 Å²	77	106 Å²	106	47%	0.467	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-55.8	132.4	174.7	176.4	0	0	0	0	110.1	A579 Q586	A579-V581 PolarHBondContact O-N 3.31Å; V581-Q586 HydrophobicContact CG1-CG 4.49Å; V581-Q586 PolarHBondContact O-NE2 3.24Å
582	S	33.9	Very low	31.5	Very low	42 Å²	42	97.9 Å²	97.9	29%	0.294	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-46.3	132.2	-176.9	171.3	0	0	0	0	113.4	P580 F584 Y585 Q586	P580-S582 PolarHBondContact O-N 2.9Å; S582-F584 PolarHBondContact O-N 3.33Å; S582-Y585 PolarHBondContact O-N 3.22Å; S582-Q586 PolarHBondContact O-N 2.96Å
583	P	32.3	Very low	31.9	Very low	75 Å²	75	98.3 Å²	98.3	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-54.6	-28.2	-179.4	-28.4	35.5	0	0	0	114.6	Q586 H587	P583-Q586 PolarHBondContact O-N 3.08Å; P583-H587 PolarHBondContact O-N 3.01Å
584	F	32.4	Very low	32.1	Very low	102 Å²	102	97.5 Å²	97.5	45%	0.447	54%	0.539	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.5	-167.3	-97.3	0	0	0	111.8	S582 R588	S582-F584 PolarHBondContact O-N 3.33Å; F584-R588 PolarHBondContact O-N 3.1Å
585	Y	37.1	Very low	32.3	Very low	37 Å²	37	92.8 Å²	92.8	15%	0.145	52%	0.523	C	S	.	.	H	α-helix	trans	-71.5	-35.7	174.5	-75.5	-70.1	0	0	0	112.1	L249 S582 R588 L589	L249-Y585 HydrophobicContact CD2-CE1 4.06Å; L249-Y585 HydrophobicContact CD2-CE2 3.8Å; L249-Y585 VanDerWaalsContact CD2-CZ 3.49Å; L249-Y585 WeakPolarHBondContact CD2-OH 3.43Å; S582-Y585 PolarHBondContact O-N 3.22Å; Y585-R588 PolarHBondContact O-N 3.4Å; Y585-L589 WeakPolarHBondContact O-CB 3.41Å; Y585-L589 WeakPolarHBondContact O-CG 3.39Å; Y585-L589 PolarHBondContact O-N 3.44Å
586	Q	36.6	Very low	32.6	Very low	103 Å²	103	89.8 Å²	89.8	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-42.7	175.4	-62.6	-169.6	10.6	0	0	112.3	V581 S582 P583 R588 L589 A590	V581-Q586 HydrophobicContact CG1-CG 4.49Å; V581-Q586 PolarHBondContact O-NE2 3.24Å; S582-Q586 PolarHBondContact O-N 2.96Å; P583-Q586 PolarHBondContact O-N 3.08Å; Q586-R588 VanDerWaalsContact C-N 3.32Å; Q586-R588 PolarHBondContact O-N 3.49Å; Q586-L589 PolarHBondContact O-N 2.89Å; Q586-A590 WeakPolarHBondContact O-CB 3.48Å; Q586-A590 PolarHBondContact O-N 3.03Å
587	H	33.5	Very low	32.8	Very low	131 Å²	131	85 Å²	85	61%	0.606	48%	0.484	S	S	*	.	H	α-helix	trans	-63.7	-38.6	178.7	-169	-1.4	0	0	0	111.8	P583 A590 L591	P583-H587 PolarHBondContact O-N 3.01Å; H587-A590 PolarHBondContact O-N 3.33Å; H587-L591 WeakPolarHBondContact O-CG 3.46Å; H587-L591 PolarHBondContact O-N 2.8Å
588	R	33.9	Very low	33.1	Very low	71 Å²	71	83.4 Å²	83.4	27%	0.268	47%	0.471	S	S	.	.	H	α-helix	trans	-71.4	-41.1	177.9	-169.4	167.4	172.8	162.9	-8.8	112.5	R192 E195 D264 F584 Y585 Q586 A590 L591 N592	R192-R588 VanDerWaalsContact CZ-NH2 3.27Å; E195-R588 IonicContact OE1-CZ 3.36Å; E195-R588 IonicContact OE1-NH1 3.26Å; E195-R588 PolarHBondContact OE1-NH1 3.05Å; E195-R588 IonicContact OE2-CZ 2.67Å; E195-R588 IonicContact OE2-NH1 2.84Å; E195-R588 PolarHBondContact OE2-NH1 3.37Å; E195-R588 IonicContact OE2-NH2 3.23Å; E195-R588 PolarHBondContact OE2-NH2 3.28Å; D264-R588 IonicContact OD1-CZ 3.5Å; D264-R588 IonicContact OD1-NE 3.67Å; D264-R588 IonicContact OD1-NH2 3.7Å; D264-R588 PolarHBondContact OD1-NH2 2.99Å; D264-R588 IonicContact OD2-NH2 2.64Å; D264-R588 PolarHBondContact OD2-NH2 2.96Å; F584-R588 PolarHBondContact O-N 3.1Å; Y585-R588 PolarHBondContact O-N 3.4Å; Q586-R588 VanDerWaalsContact C-N 3.32Å; Q586-R588 PolarHBondContact O-N 3.49Å; R588-A590 VanDerWaalsContact C-N 3.32Å; R588-A590 PolarHBondContact O-N 3.08Å; R588-L591 WeakPolarHBondContact O-CB 3.35Å; R588-L591 PolarHBondContact O-N 2.74Å; R588-L591 VanDerWaalsContact O-N 3.07Å; R588-N592 PolarHBondContact O-N 2.99Å
589	L	35.1	Very low	33.4	Very low	58 Å²	58	79.4 Å²	79.4	30%	0.304	46%	0.46	S	S	.	.	H	α-helix	trans	-56.3	-44.7	170.1	-78.5	164.5	0	0	0	111.8	Y585 Q586 L591 N592 L593	Y585-L589 WeakPolarHBondContact O-CB 3.41Å; Y585-L589 WeakPolarHBondContact O-CG 3.39Å; Y585-L589 PolarHBondContact O-N 3.44Å; Q586-L589 PolarHBondContact O-N 2.89Å; L589-L591 PolarHBondContact O-N 2.93Å; L589-N592 PolarHBondContact O-N 3.14Å; L589-L593 WeakPolarHBondContact O-CB 3.37Å; L589-L593 WeakPolarHBondContact O-CG 3.39Å; L589-L593 PolarHBondContact O-N 3.21Å
590	A	33.3	Very low	33.4	Very low	42 Å²	42	79.6 Å²	79.6	35%	0.347	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-18.5	178	0	0	0	0	0	113.9	Q586 H587 R588 K594	Q586-A590 WeakPolarHBondContact O-CB 3.48Å; Q586-A590 PolarHBondContact O-N 3.03Å; H587-A590 PolarHBondContact O-N 3.33Å; R588-A590 VanDerWaalsContact C-N 3.32Å; R588-A590 PolarHBondContact O-N 3.08Å; A590-K594 WeakPolarHBondContact O-CD 3.19Å; A590-K594 VanDerWaalsContact O-CG 3.28Å; A590-K594 WeakPolarHBondContact O-CG 3.35Å
591	L	36.8	Very low	33.2	Very low	99 Å²	99	82.7 Å²	82.7	52%	0.518	47%	0.467	S	S	.	.	H	α-helix	trans	-86	-46.3	172.3	-67.9	168.7	0	0	0	111.5	H587 R588 L589 L593 K594 A595	H587-L591 WeakPolarHBondContact O-CG 3.46Å; H587-L591 PolarHBondContact O-N 2.8Å; R588-L591 WeakPolarHBondContact O-CB 3.35Å; R588-L591 PolarHBondContact O-N 2.74Å; R588-L591 VanDerWaalsContact O-N 3.07Å; L589-L591 PolarHBondContact O-N 2.93Å; L591-L593 PolarHBondContact O-N 3.3Å; L591-K594 PolarHBondContact O-N 3.29Å; L591-A595 PolarHBondContact O-N 3.34Å
592	N	31.4	Very low	32.8	Very low	59 Å²	59	84 Å²	84	32%	0.316	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-41.2	176.3	-76.4	22.4	0	0	0	111.8	E263 R588 L589 K594 A595 S596	E263-N592 PolarHBondContact OE2-ND2 3.33Å; R588-N592 PolarHBondContact O-N 2.99Å; L589-N592 PolarHBondContact O-N 3.14Å; N592-K594 PolarHBondContact O-N 2.85Å; N592-A595 PolarHBondContact O-N 2.93Å; N592-S596 PolarHBondContact O-N 2.89Å; N592-S596 PolarHBondContact O-OG 3.28Å
593	L	32.7	Very low	32.5	Very low	113 Å²	113	87.4 Å²	87.4	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-59.6	-44.9	175.2	-76.5	165.1	0	0	0	111.5	L589 L591 S596 A597	L589-L593 WeakPolarHBondContact O-CB 3.37Å; L589-L593 WeakPolarHBondContact O-CG 3.39Å; L589-L593 PolarHBondContact O-N 3.21Å; L591-L593 PolarHBondContact O-N 3.3Å; L593-S596 PolarHBondContact O-N 2.84Å; L593-S596 PolarHBondContact O-OG 3.01Å; L593-A597 PolarHBondContact O-N 3.17Å
594	K	31.6	Very low	32.4	Very low	155 Å²	155	90.9 Å²	90.9	67%	0.674	52%	0.523	S	S	*	.	H	α-helix	trans	-66	-36.5	176	-75.6	178.1	-179.3	180	0	112.9	A590 L591 N592 A598	A590-K594 WeakPolarHBondContact O-CD 3.19Å; A590-K594 VanDerWaalsContact O-CG 3.28Å; A590-K594 WeakPolarHBondContact O-CG 3.35Å; L591-K594 PolarHBondContact O-N 3.29Å; N592-K594 PolarHBondContact O-N 2.85Å; K594-A598 WeakPolarHBondContact O-CB 3.31Å; K594-A598 PolarHBondContact O-N 3.41Å; K594-A598 VanDerWaalsContact O-N 3.08Å
595	A	30.7	Very low	32.3	Very low	62 Å²	62	94.7 Å²	94.7	51%	0.512	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-41.3	173.2	0	0	0	0	0	111.9	L591 N592 A598 T599	L591-A595 PolarHBondContact O-N 3.34Å; N592-A595 PolarHBondContact O-N 2.93Å; A595-A598 PolarHBondContact O-N 3.19Å; A595-T599 PolarHBondContact O-OG1 2.95Å
596	S	31.7	Very low	32.2	Very low	35 Å²	35	97.8 Å²	97.8	25%	0.245	57%	0.567	C	S	.	*	H	α-helix	trans	-72.5	-34.2	178	64.1	0	0	0	0	114.2	N592 L593 A598 T599	N592-S596 PolarHBondContact O-N 2.89Å; N592-S596 PolarHBondContact O-OG 3.28Å; L593-S596 PolarHBondContact O-N 2.84Å; L593-S596 PolarHBondContact O-OG 3.01Å; S596-A598 VanDerWaalsContact C-N 3.32Å; S596-T599 PolarHBondContact O-N 3.01Å; S596-T599 PolarHBondContact O-OG1 3.32Å
597	A	30.2	Very low	31.8	Very low	56 Å²	56	101.4 Å²	101.4	46%	0.463	59%	0.586	S	S	.	*	H	α-helix	trans	-69.3	-30.7	172.6	0	0	0	0	0	112.3	L593 T599 S600	L593-A597 PolarHBondContact O-N 3.17Å; A597-T599 PolarHBondContact O-N 3.35Å; A597-S600 PolarHBondContact O-N 2.69Å; A597-S600 PolarHBondContact O-OG 2.64Å; A597-S600 VanDerWaalsContact O-OG 3.11Å
598	A	32.6	Very low	31.4	Very low	61 Å²	61	102.6 Å²	102.6	50%	0.504	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-68.7	-13.5	172.6	0	0	0	0	0	113.3	K594 A595 S596 S600	K594-A598 WeakPolarHBondContact O-CB 3.31Å; K594-A598 PolarHBondContact O-N 3.41Å; K594-A598 VanDerWaalsContact O-N 3.08Å; A595-A598 PolarHBondContact O-N 3.19Å; S596-A598 VanDerWaalsContact C-N 3.32Å; A598-S600 VanDerWaalsContact C-N 3.34Å
599	T	33.5	Very low	31	Very low	112 Å²	112	104.7 Å²	104.7	69%	0.687	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-86.8	2	177.7	-20	0	0	0	0	113.8	A595 S596 A597	A595-T599 PolarHBondContact O-OG1 2.95Å; S596-T599 PolarHBondContact O-N 3.01Å; S596-T599 PolarHBondContact O-OG1 3.32Å; A597-T599 PolarHBondContact O-N 3.35Å
600	S	32.4	Very low	30.5	Very low	89 Å²	89	111.1 Å²	111.1	62%	0.622	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-123.1	23.4	-174.5	66	0	0	0	0	115	A597 A598	A597-S600 PolarHBondContact O-N 2.69Å; A597-S600 PolarHBondContact O-OG 2.64Å; A597-S600 VanDerWaalsContact O-OG 3.11Å; A598-S600 VanDerWaalsContact C-N 3.34Å
601	L	29.5	Very low	30.4	Very low	157 Å²	157	117.4 Å²	117.4	82%	0.822	67%	0.672	S	S	*	*			trans	-133.7	70.5	-179.6	-77.6	170.4	0	0	0	112
602	S	27.8	Very low	30	Very low	104 Å²	104	116 Å²	116	73%	0.727	68%	0.681	S	S	*	*			trans	-105.7	63.4	179.9	55.2	0	0	0	0	112.8
603	S	27.5	Very low	29.9	Very low	115 Å²	115	121.5 Å²	121.5	80%	0.804	71%	0.71	S	S	*	*			trans	-156.5	73.9	173.6	-176.5	0	0	0	0	113.8
604	V	29.6	Very low	29.5	Very low	148 Å²	148	122.7 Å²	122.7	90%	0.897	72%	0.716	S	S	*	*			trans	-144.8	128.2	158.1	-172.4	0	0	0	0	108.2
605	E	31.2	Very low	29.4	Very low	181 Å²	181	126.5 Å²	126.5	85%	0.846	73%	0.728	S	S	*	*			trans	-110.7	-172.6	-175.9	-132.7	-159.2	-162.9	0	0	111.8
606	P	35.5	Very low	29.2	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	74%	0.737	S	S	*	*				-117.7	150.8	-119.9	38.2	-22.8	0	0	0	116.4
607	M	26.7	Very low	29.2	Very low	179 Å²	179	135.5 Å²	135.5	88%	0.882	77%	0.768	S	S	*	*			trans	-145.3	110.9	159.2	-82.5	-159.5	-179.5	0	0	114.4
608	I	26.1	Very low	29.2	Very low	157 Å²	157	138.6 Å²	138.6	81%	0.805	78%	0.783	S	S	*	*				31.1	112.2	122.6	-54.7	164	0	0	0	116.7
609	S	25.8	Very low	29.1	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	80%	0.799	S	S	*	*				175.3	169.5	100.4	-144.6	0	0	0	0	114.6
610	K	24.8	Very low	29.1	Very low	194 Å²	194	142 Å²	142	84%	0.843	81%	0.808	S	S	*	*			trans	-65.1	127.6	-174.8	-60.5	165	178.5	172.4	0	114.2
611	I	31.2	Very low	29	Very low	174 Å²	174	143.9 Å²	143.9	89%	0.892	82%	0.816	S	S	*	*			trans	-170.5	138.6	140.1	-90.2	140.7	0	0	0	106.1
612	G	26.9	Very low	29.2	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	82%	0.818	S	S	*	*			cis	132.9	55.9	0.4	0	0	0	0	0	113.6
613	L	30.7	Very low	29.4	Very low	175 Å²	175	142.6 Å²	142.6	92%	0.916	82%	0.821	S	S	*	*			trans	-146.5	146.1	170.3	-108.8	168.9	0	0	0	110.8
614	L	24.5	Very low	29.7	Very low	137 Å²	137	142.8 Å²	142.8	72%	0.717	82%	0.819	S	S	*	*			trans	-112.4	140.7	-164.5	-71.4	158.7	0	0	0	112.2
615	Y	27.7	Very low	29.6	Very low	235 Å²	235	140.6 Å²	140.6	92%	0.922	81%	0.81	S	S	*	*			trans	-143.4	106.3	145.4	-94	-75.1	0	0	0	109.4
616	T	27.1	Very low	29.5	Very low	117 Å²	117	138.8 Å²	138.8	72%	0.718	81%	0.811	S	S	*	*			trans	-137.7	129	176.8	50.2	0	0	0	0	109.2
617	L	31.4	Very low	29.2	Very low	170 Å²	170	138.4 Å²	138.4	89%	0.89	81%	0.811	S	S	*	*			trans	-124.9	150.7	168.2	-78.1	170.6	0	0	0	109.4
618	P	31.8	Very low	29.1	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	81%	0.807	S	S	*	*				-112.2	152.9	-126.4	37.7	-33.6	0	0	0	115.3
619	S	28.8	Very low	29.4	Very low	119 Å²	119	136 Å²	136	83%	0.832	81%	0.809	S	S	*	*			trans	-79.8	145.1	158.6	-56.1	0	0	0	0	109.9
620	S	33.9	Very low	29.7	Very low	125 Å²	125	138.1 Å²	138.1	87%	0.874	81%	0.806	S	S	*	*			trans	-118	142.7	169.4	-171.9	0	0	0	0	110.2
621	T	30.6	Very low	30	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	80%	0.802	S	S	*	*			trans	-129.2	140.4	-170.6	52.2	0	0	0	0	111.6
622	A	33.5	Very low	29.9	Very low	104 Å²	104	134.9 Å²	134.9	86%	0.86	80%	0.799	S	S	*	*			trans	-138.8	139.4	161.4	0	0	0	0	0	109.9
623	V	31.7	Very low	30.2	Very low	131 Å²	131	137 Å²	137	79%	0.794	80%	0.803	S	S	*	*			trans	-135.7	156.2	174.1	-144.8	0	0	0	0	106.2
624	P	34.5	Very low	30.1	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	80%	0.796	S	S	*	*				-145.5	164.7	92.3	36.1	-18.5	0	0	0	116.1
625	S	26.7	Very low	30.6	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	80%	0.8	S	S	*	*			trans	-29.3	152.5	168.3	54.8	0	0	0	0	120.1
626	V	29.6	Very low	30.5	Very low	144 Å²	144	128.5 Å²	128.5	87%	0.873	80%	0.796	S	S	*	*				-162.8	157.4	117.2	137.1	0	0	0	0	112.4
627	S	28.6	Very low	30.5	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	80%	0.801	S	S	*	*			trans	-45.4	143.3	-164.1	57.4	0	0	0	0	124
628	F	26.3	Very low	30.3	Very low	184 Å²	184	129.4 Å²	129.4	81%	0.807	80%	0.797	S	S	*	*			trans	41.2	126	131.3	-78.4	-97.6	0	0	0	123.2
629	A	32.4	Very low	30.2	Very low	101 Å²	101	130.5 Å²	130.5	84%	0.835	80%	0.795	S	S	*	*				-156.8	154.6	112.9	0	0	0	0	0	110.2
630	E	30.5	Very low	30.2	Very low	160 Å²	160	132.3 Å²	132.3	75%	0.748	79%	0.79	S	S	*	*			trans	-103.9	153.2	-169.8	-61.9	153.6	98.4	0	0	113.8
631	T	31.4	Very low	29.8	Very low	121 Å²	121	132 Å²	132	74%	0.742	79%	0.788	S	S	*	*				179.9	136.7	111.4	23.4	0	0	0	0	113.8
632	Q	29.7	Very low	29.7	Very low	179 Å²	179	132.5 Å²	132.5	84%	0.836	79%	0.791	S	S	*	*			trans	65.1	134.2	155.5	-60.7	169.4	42.1	0	0	117.4
633	S	32.5	Very low	29.4	Very low	114 Å²	114	134 Å²	134	80%	0.797	79%	0.79	S	S	*	*			cis	-140	152.4	11.3	-59.9	0	0	0	0	112.9
634	A	29.7	Very low	29.4	Very low	92 Å²	92	133.6 Å²	133.6	76%	0.76	79%	0.792	S	S	*	*			trans	-83.9	175.1	169.1	0	0	0	0	0	110.7
635	S	33.6	Very low	29	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	79%	0.794	S	S	*	*			cis	-147.5	156.3	21.3	-57.4	0	0	0	0	113.7
636	L	25.6	Very low	29.4	Very low	158 Å²	158	134.7 Å²	134.7	83%	0.827	80%	0.795	S	S	*	*			trans	-116.2	158.1	169.4	-84.1	169.9	0	0	0	111.4
637	L	28.6	Very low	29.5	Very low	157 Å²	157	133.1 Å²	133.1	82%	0.822	79%	0.79	S	S	*	*			trans	10.2	121.3	147.3	-59	168.9	0	0	0	118
638	N	27	Very low	29.5	Very low	150 Å²	150	133.5 Å²	133.5	80%	0.802	79%	0.793	S	S	*	*			trans	-161.3	178.8	131	-135	-39.7	0	0	0	112.7
639	L	28.4	Very low	29.6	Very low	143 Å²	143	129.6 Å²	129.6	75%	0.749	79%	0.788	S	S	*	*			trans	75.5	135.8	175.1	-48.1	175.6	0	0	0	116
640	Q	28.5	Very low	29.4	Very low	158 Å²	158	130 Å²	130	74%	0.738	79%	0.785	S	S	*	*			cis	-166.9	148.9	-37.6	-125.1	170.8	-7.9	0	0	106.9	T642	Q640-T642 PolarHBondContact O-N 2.76Å
641	S	26.5	Very low	29.4	Very low	117 Å²	117	129.6 Å²	129.6	82%	0.818	79%	0.787	S	S	*	*			trans	-78.7	116.5	175.3	54.8	0	0	0	0	111.5
642	T	28.4	Very low	29.2	Very low	139 Å²	139	133.8 Å²	133.8	85%	0.853	80%	0.796	S	S	*	*			trans	-150	152.9	159.2	8.9	0	0	0	0	110.7	Q640	Q640-T642 PolarHBondContact O-N 2.76Å
643	V	26.6	Very low	29.1	Very low	137 Å²	137	131.4 Å²	131.4	83%	0.83	79%	0.793	S	S	*	*			trans	-100.9	123.2	-167.5	175.4	0	0	0	0	111
644	S	31.7	Very low	29.1	Very low	121 Å²	121	131 Å²	131	85%	0.846	79%	0.791	S	S	*	*			trans	-156.7	123.7	160.9	-70.4	0	0	0	0	110.8
645	T	27.6	Very low	29	Very low	130 Å²	130	135.8 Å²	135.8	80%	0.798	79%	0.794	S	S	*	*			trans	-105.9	179.7	165.8	52.2	0	0	0	0	108.5
646	P	35	Very low	29	Very low	114 Å²	114	135.5 Å²	135.5	74%	0.74	79%	0.79	S	S	*	*			cis	-131	-159.6	-7.5	32.9	-10.4	0	0	0	113
647	S	31.1	Very low	29.2	Very low	111 Å²	111	136 Å²	136	78%	0.776	79%	0.787	S	S	*	*			trans	83.9	138	160.2	76.6	0	0	0	0	118.9
648	S	29	Very low	29.3	Very low	100 Å²	100	137.1 Å²	137.1	70%	0.699	79%	0.789	S	S	*	*			cis	-165.2	145.9	-20.6	43.4	0	0	0	0	113.1
649	S	28.7	Very low	29.7	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	78%	0.775	S	S	*	*			trans	65.3	140.5	152.2	58.2	0	0	0	0	121.6
650	S	28.3	Very low	30.1	Very low	109 Å²	109	132 Å²	132	76%	0.762	77%	0.766	S	S	*	*			trans	73.8	141.2	168	86.8	0	0	0	0	115.9
651	L	30.6	Very low	31	Very low	152 Å²	152	129 Å²	129	80%	0.796	76%	0.755	S	S	*	*			cis	-130.5	142.3	0.7	-74.9	167.9	0	0	0	111.4
652	F	25.9	Very low	31.9	Very low	209 Å²	209	125.4 Å²	125.4	92%	0.917	72%	0.724	S	S	*	*			trans	-90.3	109.8	165.4	-92.1	-94	0	0	0	110.4
653	T	28.8	Very low	32.9	Very low	129 Å²	129	121.8 Å²	121.8	79%	0.791	70%	0.699	S	S	*	*			trans	-145.9	73.9	165.1	55	0	0	0	0	111.3	K655	T653-K655 PolarHBondContact O-N 2.84Å
654	S	30.6	Very low	33.8	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	68%	0.68	S	S	*	*			trans	-77.2	107.8	173.3	36.7	0	0	0	0	111.1
655	K	29.1	Very low	34.3	Very low	192 Å²	192	115.4 Å²	115.4	84%	0.835	65%	0.653	S	S	*	*			trans	-72.8	142.8	159.1	-79	-178.9	175.5	175.8	0	108.9	T653 Q657	T653-K655 PolarHBondContact O-N 2.84Å; K655-Q657 PolarHBondContact O-N 2.95Å; K655-Q657 VanDerWaalsContact O-N 3.09Å
656	P	32.3	Very low	34.9	Very low	111 Å²	111	109.6 Å²	109.6	72%	0.721	62%	0.617	S	S	*	*			trans	-61.4	115.7	172.5	25.8	-33.3	0	0	0	109.3
657	Q	29.6	Very low	35.3	Very low	167 Å²	167	109.3 Å²	109.3	78%	0.78	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-82.3	121	-174.8	-170	168	-10.6	0	0	109.3	K655	K655-Q657 PolarHBondContact O-N 2.95Å; K655-Q657 VanDerWaalsContact O-N 3.09Å
658	Q	31.3	Very low	35.8	Very low	182 Å²	182	112 Å²	112	85%	0.85	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.5	140.4	178.3	-72.8	-177.1	-49.6	0	0	110.8
659	L	36.6	Very low	36.4	Very low	99 Å²	99	113.7 Å²	113.7	52%	0.518	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-52.6	137.1	170.1	-83.3	118.6	0	0	0	110.1	N661	L659-N661 PolarHBondContact O-N 3.34Å; L659-N661 VanDerWaalsContact O-N 3.16Å
660	P	36.5	Very low	37.2	Very low	86 Å²	86	112 Å²	112	56%	0.558	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-57.1	122.8	177.3	-24	33.7	0	0	0	110.7	Y662	P660-Y662 PolarHBondContact O-N 2.69Å
661	N	47.3	Very low	37.4	Very low	94 Å²	94	110 Å²	110	50%	0.503	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-55.3	128	170.7	175.9	-5.5	0	0	0	108.5	L659 D663 E664 A665	L659-N661 PolarHBondContact O-N 3.34Å; L659-N661 VanDerWaalsContact O-N 3.16Å; N661-D663 PolarHBondContact O-N 2.87Å; N661-D663 VanDerWaalsContact O-N 3.14Å; N661-D663 PolarHBondContact OD1-N 3.01Å; N661-E664 HydrophobicContact CB-CB 4.26Å; N661-E664 HydrophobicContact CB-CG 4.18Å; N661-E664 WeakPolarHBondContact O-CA 3.49Å; N661-E664 WeakPolarHBondContact O-CB 3.17Å; N661-E664 PolarHBondContact O-N 3.26Å; N661-A665 PolarHBondContact O-N 2.77Å
662	Y	45.8	Very low	38.1	Very low	43 Å²	43	112.6 Å²	112.6	17%	0.169	58%	0.579	C	S	.	*	H	α-helix	trans	-51.6	-38.7	178.9	178.5	-83.2	0	0	0	112	Q363 P660 E664 A665 V666 T678 I680	Q363-Y662 HydrophobicContact CG-CD1 4.04Å; Q363-Y662 HydrophobicContact CG-CE1 3.72Å; P660-Y662 PolarHBondContact O-N 2.69Å; Y662-E664 PolarHBondContact O-N 3.31Å; Y662-A665 PolarHBondContact O-N 3.42Å; Y662-V666 HydrophobicContact CD1-CG2 4.03Å; Y662-V666 HydrophobicContact CE1-CG2 3.55Å; Y662-V666 HydrophobicContact CE2-CG2 4.41Å; Y662-V666 WeakPolarHBondContact O-CG2 3.47Å; Y662-V666 PolarHBondContact O-N 3.39Å; Y662-T678 PolarHBondContact OH-O 3.45Å; Y662-T678 VanDerWaalsContact OH-O 3.04Å; Y662-I680 HydrophobicContact CD2-CD1 3.98Å; Y662-I680 HydrophobicContact CE2-CD1 3.96Å; Y662-I680 HydrophobicContact CE2-CG1 4.18Å
663	D	48.5	Very low	38.9	Very low	62 Å²	62	112.2 Å²	112.2	33%	0.332	57%	0.572	S	S	.	*	H	α-helix	trans	-69.6	-30.1	176.9	-70.5	-31.6	0	0	0	112.4	R359 Q363 N661 M667	R359-D663 IonicContact CZ-OD1 3.64Å; R359-D663 IonicContact NH2-OD1 3.36Å; R359-D663 PolarHBondContact NH2-OD1 3.15Å; Q363-D663 PolarHBondContact NE2-OD1 3.25Å; N661-D663 PolarHBondContact O-N 2.87Å; N661-D663 VanDerWaalsContact O-N 3.14Å; N661-D663 PolarHBondContact OD1-N 3.01Å; D663-M667 WeakPolarHBondContact O-CB 3.31Å; D663-M667 WeakPolarHBondContact O-CG 3.48Å; D663-M667 PolarHBondContact O-N 3.31Å
664	E	46.4	Very low	40	Very low	90 Å²	90	114.9 Å²	114.9	42%	0.421	57%	0.567	S	S	.	*	H	α-helix	trans	-70.1	-42.7	168.5	-77.2	-155.9	140.3	0	0	112.2	N661 Y662 V666 M667 R668	N661-E664 HydrophobicContact CB-CB 4.26Å; N661-E664 HydrophobicContact CB-CG 4.18Å; N661-E664 WeakPolarHBondContact O-CA 3.49Å; N661-E664 WeakPolarHBondContact O-CB 3.17Å; N661-E664 PolarHBondContact O-N 3.26Å; Y662-E664 PolarHBondContact O-N 3.31Å; E664-V666 VanDerWaalsContact C-N 3.32Å; E664-V666 PolarHBondContact O-N 3.43Å; E664-M667 PolarHBondContact O-N 3.1Å; E664-R668 WeakPolarHBondContact O-CB 3.37Å; E664-R668 WeakPolarHBondContact O-CG 3.2Å; E664-R668 PolarHBondContact O-N 3.02Å; E664-R668 IonicContact OE1-NH2 2.68Å; E664-R668 PolarHBondContact OE1-NH2 2.97Å; E664-R668 IonicContact OE2-CZ 3.03Å; E664-R668 IonicContact OE2-NH1 2.7Å; E664-R668 PolarHBondContact OE2-NH1 3.36Å; E664-R668 IonicContact OE2-NH2 2.8Å; E664-R668 PolarHBondContact OE2-NH2 3.48Å
665	A	40.7	Very low	41.2	Very low	34 Å²	34	111.5 Å²	111.5	28%	0.281	54%	0.542	S	S	.	.	H	α-helix	trans	-60	-43.6	-179.8	0	0	0	0	0	111.4	N661 Y662	N661-A665 PolarHBondContact O-N 2.77Å; Y662-A665 PolarHBondContact O-N 3.42Å
666	V	42	Very low	42.3	Very low	8 Å²	8	103.4 Å²	103.4	5%	0.048	51%	0.509	C	S	.	.	H	α-helix	trans	-67.2	-40.9	173.9	174.2	0	0	0	0	111.8	Y662 E664	Y662-V666 HydrophobicContact CD1-CG2 4.03Å; Y662-V666 HydrophobicContact CE1-CG2 3.55Å; Y662-V666 HydrophobicContact CE2-CG2 4.41Å; Y662-V666 WeakPolarHBondContact O-CG2 3.47Å; Y662-V666 PolarHBondContact O-N 3.39Å; E664-V666 VanDerWaalsContact C-N 3.32Å; E664-V666 PolarHBondContact O-N 3.43Å
667	M	42.1	Very low	44	Very low	108 Å²	108	98.3 Å²	98.3	53%	0.532	48%	0.476	S	S	.	.	H	α-helix	trans	-73.3	-28	-178.3	-70.8	-85	-82	0	0	113.7	D663 E664 Q669	D663-M667 WeakPolarHBondContact O-CB 3.31Å; D663-M667 WeakPolarHBondContact O-CG 3.48Å; D663-M667 PolarHBondContact O-N 3.31Å; E664-M667 PolarHBondContact O-N 3.1Å; M667-Q669 VanDerWaalsContact C-N 3.34Å; M667-Q669 PolarHBondContact O-N 3.5Å
668	R	41.6	Very low	45.9	Very low	167 Å²	167	91.1 Å²	91.1	63%	0.63	44%	0.443	S	S	*	.	H	α-helix	trans	-67.5	-29	178.5	-81.5	-172.6	179.7	98.8	13.5	113.6	E664	E664-R668 WeakPolarHBondContact O-CB 3.37Å; E664-R668 WeakPolarHBondContact O-CG 3.2Å; E664-R668 PolarHBondContact O-N 3.02Å; E664-R668 IonicContact OE1-NH2 2.68Å; E664-R668 PolarHBondContact OE1-NH2 2.97Å; E664-R668 IonicContact OE2-CZ 3.03Å; E664-R668 IonicContact OE2-NH1 2.7Å; E664-R668 PolarHBondContact OE2-NH1 3.36Å; E664-R668 IonicContact OE2-NH2 2.8Å; E664-R668 PolarHBondContact OE2-NH2 3.48Å
669	Q	42.6	Very low	47.7	Very low	137 Å²	137	83.3 Å²	83.3	64%	0.64	41%	0.408	S	S	*	.	H	α-helix	trans	-91.3	-27.5	-179.4	-69.8	-165.6	-12.7	0	0	114.3	M667	M667-Q669 VanDerWaalsContact C-N 3.34Å; M667-Q669 PolarHBondContact O-N 3.5Å
670	H	44.7	Very low	48.8	Very low	67 Å²	67	80.8 Å²	80.8	31%	0.31	40%	0.395	S	S	.	.	S	Bend	trans	-137.6	112	-171.8	-69	-34.5	0	0	0	112.5	K323 T676	K323-H670 PolarHBondContact NZ-CE1 2.89Å; K323-H670 PolarHBondContact NZ-NE2 3.31Å; K323-H670 VanDerWaalsContact NZ-NE2 3.18Å; H670-T676 HydrophobicContact CB-CG2 4.35Å; H670-T676 WeakPolarHBondContact CD2-CG2 3.41Å
671	G	33.5	Very low	49.8	Very low	66 Å²	66	79 Å²	79	68%	0.68	38%	0.38	S	S	*	.			trans	-63.9	164.9	-174.4	0	0	0	0	0	115.5	R673	G671-R673 PolarHBondContact O-N 2.81Å
672	K	44.4	Very low	50.2	Low	208 Å²	208	76 Å²	76	90%	0.904	37%	0.367	S	S	*	.	S	Bend	trans	-22.7	10.8	-168.6	-55.4	-177.5	-179.7	178.3	0	123.2
673	R	42.3	Very low	50.4	Low	201 Å²	201	77.3 Å²	77.3	76%	0.758	38%	0.382	S	S	*	.			trans	-116.7	120.6	179.3	-156.5	-178.6	-165.5	179.3	4.6	111.1	G671 T675	G671-R673 PolarHBondContact O-N 2.81Å; R673-T675 HydrophobicContact CG-CG2 4.08Å; R673-T675 PolarHBondContact O-N 2.96Å
674	W	53.2	Low	50.6	Low	184 Å²	184	76.6 Å²	76.6	70%	0.697	38%	0.38	S	S	*	.	S	Bend	trans	-73.6	49	-177.3	-62.5	77.8	0	0	0	113.7
675	T	55.3	Low	50.8	Low	35 Å²	35	75.6 Å²	75.6	22%	0.215	38%	0.377	C	S	.	.	S	Bend	trans	-115.2	16.8	-178.9	48.8	0	0	0	0	111.9	S325 F326 R673	S325-T675 VanDerWaalsContact CA-O 3.27Å; S325-T675 WeakPolarHBondContact CA-O 3.45Å; S325-T675 WeakPolarHBondContact CB-O 3.29Å; F326-T675 HydrophobicContact CD1-CG2 4.46Å; F326-T675 HydrophobicContact CE1-CG2 3.95Å; F326-T675 HydrophobicContact CZ-CG2 4.28Å; R673-T675 HydrophobicContact CG-CG2 4.08Å; R673-T675 PolarHBondContact O-N 2.96Å
676	T	50.9	Low	51	Low	23 Å²	23	75.9 Å²	75.9	14%	0.141	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	147.9	-175.5	-69.3	0	0	0	0	112.5	K323 L324 H670	K323-T676 HydrophobicContact CD-CG2 3.98Å; K323-T676 WeakPolarHBondContact CE-OG1 3.35Å; K323-T676 HydrophobicContact CG-CG2 3.96Å; K323-T676 PolarHBondContact NZ-OG1 2.79Å; L324-T676 CarbonylContact O-C 3.38Å; L324-T676 VanDerWaalsContact O-CA 3.25Å; L324-T676 WeakPolarHBondContact O-CA 3.49Å; H670-T676 HydrophobicContact CB-CG2 4.35Å; H670-T676 WeakPolarHBondContact CD2-CG2 3.41Å
677	I	69.7	Low	51.3	Low	4 Å²	4	81.9 Å²	81.9	2%	0.021	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.1	167.8	-52.1	154.7	0	0	0	108.1	K323 L324 L355 R359	K323-I677 WeakPolarHBondContact CA-O 3.28Å; L324-I677 HydrophobicContact CB-CB 4.44Å; L324-I677 HydrophobicContact CB-CD1 4.33Å; L324-I677 HydrophobicContact CD1-CD1 4.38Å; L324-I677 PolarHBondContact N-O 3.22Å; L324-I677 PolarHBondContact O-N 3.35Å; L355-I677 HydrophobicContact CD1-CD1 3.5Å; L355-I677 VanDerWaalsContact CD1-CD1 3.5Å; L355-I677 HydrophobicContact CD1-CG1 3.99Å; L355-I677 HydrophobicContact CG-CD1 3.8Å; L355-I677 HydrophobicContact CG-CG1 4.28Å; L355-I677 WeakPolarHBondContact O-CD1 3.49Å; R359-I677 HydrophobicContact CB-CD1 3.53Å; R359-I677 HydrophobicContact CB-CG1 4.02Å; R359-I677 HydrophobicContact CG-CD1 4.35Å; R359-I677 HydrophobicContact CG-CG1 4.34Å
678	T	67.6	Low	51.1	Low	16 Å²	16	81.2 Å²	81.2	10%	0.098	40%	0.401	C	S	.	.			trans	-103.4	132.6	162.1	46.8	0	0	0	0	108.1	G322 Y662	G322-T678 WeakPolarHBondContact O-CG2 3.45Å; Y662-T678 PolarHBondContact OH-O 3.45Å; Y662-T678 VanDerWaalsContact OH-O 3.04Å
679	C	69.3	Low	51.2	Low	17 Å²	17	74.1 Å²	74.1	12%	0.115	38%	0.377	C	S	.	.			trans	-95	157.7	178.6	-60.2	0	0	0	0	110.8	W318 I321	W318-C679 HydrophobicContact CE3-CB 4.38Å; W318-C679 WeakPolarHBondContact O-CB 3.49Å; I321-C679 HydrophobicContact CB-CB 4.02Å; I321-C679 HydrophobicContact CG2-CB 4.39Å; I321-C679 WeakPolarHBondContact O-CB 3.31Å; I321-C679 PolarHBondContact O-N 2.69Å
680	I	60.8	Low	51.4	Low	47 Å²	47	70.1 Å²	70.1	24%	0.241	36%	0.36	C	S	.	.			trans	-132.4	144.3	-179.3	-56.3	179.8	0	0	0	108	H362 Y662	H362-I680 PolarHBondContact NE2-O 2.8Å; Y662-I680 HydrophobicContact CD2-CD1 3.98Å; Y662-I680 HydrophobicContact CE2-CD1 3.96Å; Y662-I680 HydrophobicContact CE2-CG1 4.18Å
681	D	57.4	Low	51.3	Low	47 Å²	47	70.1 Å²	70.1	25%	0.251	37%	0.367	S	S	.	.			trans	-71.3	128.5	175.5	-164.7	-35.8	0	0	0	110.8	A319 S683 V684 L685	A319-D681 HydrophobicContact CB-CB 3.59Å; A319-D681 VanDerWaalsContact CB-OD2 3.23Å; A319-D681 WeakPolarHBondContact CB-OD2 3.47Å; D681-S683 PolarHBondContact O-N 3.04Å; D681-S683 WeakPolarHBondContact OD1-CA 3.34Å; D681-S683 WeakPolarHBondContact OD1-CB 3.07Å; D681-S683 PolarHBondContact OD1-N 3.29Å; D681-S683 PolarHBondContact OD1-OG 3.34Å; D681-V684 HydrophobicContact CB-CB 4.06Å; D681-V684 HydrophobicContact CB-CG2 3.8Å; D681-V684 PolarHBondContact O-N 3.3Å; D681-V684 VanDerWaalsContact O-N 3.07Å; D681-L685 PolarHBondContact O-N 3.16Å
682	P	55	Low	51.6	Low	33 Å²	33	69.7 Å²	69.7	21%	0.214	35%	0.349	C	S	.	.	H	α-helix	trans	-55.9	-30.3	170.9	20.8	-31.2	0	0	0	113	M366 V684 L685	M366-P682 HydrophobicContact CE-CB 3.74Å; M366-P682 HydrophobicContact CE-CG 3.89Å; M366-P682 HydrophobicContact SD-CB 3.71Å; M366-P682 HydrophobicContact SD-CG 4.29Å; P682-V684 VanDerWaalsContact C-N 3.33Å; P682-L685 WeakPolarHBondContact O-CB 3.32Å; P682-L685 PolarHBondContact O-N 3.39Å
683	S	51.4	Low	51.6	Low	70 Å²	70	64.2 Å²	64.2	49%	0.49	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-33.9	177.5	-37	0	0	0	0	112.1	D681 L685 S686 Q687	D681-S683 PolarHBondContact O-N 3.04Å; D681-S683 WeakPolarHBondContact OD1-CA 3.34Å; D681-S683 WeakPolarHBondContact OD1-CB 3.07Å; D681-S683 PolarHBondContact OD1-N 3.29Å; D681-S683 PolarHBondContact OD1-OG 3.34Å; S683-L685 VanDerWaalsContact C-N 3.29Å; S683-L685 PolarHBondContact O-N 3Å; S683-S686 WeakPolarHBondContact O-CB 3.32Å; S683-S686 PolarHBondContact O-N 2.89Å; S683-Q687 PolarHBondContact O-N 2.77Å
684	V	52.6	Low	51.9	Low	47 Å²	47	56.4 Å²	56.4	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-70.3	-27.3	177	167	0	0	0	0	111.1	D681 P682 S686 Q687 M688	D681-V684 HydrophobicContact CB-CB 4.06Å; D681-V684 HydrophobicContact CB-CG2 3.8Å; D681-V684 PolarHBondContact O-N 3.3Å; D681-V684 VanDerWaalsContact O-N 3.07Å; P682-V684 VanDerWaalsContact C-N 3.33Å; V684-S686 VanDerWaalsContact C-N 3.32Å; V684-S686 PolarHBondContact O-N 2.97Å; V684-Q687 PolarHBondContact O-N 3.33Å; V684-M688 HydrophobicContact CG1-CE 3.73Å; V684-M688 WeakPolarHBondContact O-CG 3.37Å; V684-M688 PolarHBondContact O-N 2.64Å
685	L	48.8	Very low	51.6	Low	68 Å²	68	53.4 Å²	53.4	36%	0.356	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-35	170.5	-64	174.5	0	0	0	112.1	M366 D681 P682 S683 M688 S689	M366-L685 HydrophobicContact CB-CD1 4.29Å; M366-L685 HydrophobicContact CG-CD1 4.36Å; M366-L685 HydrophobicContact SD-CD1 4.15Å; D681-L685 PolarHBondContact O-N 3.16Å; P682-L685 WeakPolarHBondContact O-CB 3.32Å; P682-L685 PolarHBondContact O-N 3.39Å; S683-L685 VanDerWaalsContact C-N 3.29Å; S683-L685 PolarHBondContact O-N 3Å; L685-M688 PolarHBondContact O-N 3.4Å; L685-S689 PolarHBondContact O-N 3.32Å; L685-S689 PolarHBondContact O-OG 2.89Å
686	S	45.5	Very low	50.6	Low	41 Å²	41	55.6 Å²	55.6	29%	0.287	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-49.6	171.5	-155.8	0	0	0	0	110.6	S683 V684 M688 S689 D690	S683-S686 WeakPolarHBondContact O-CB 3.32Å; S683-S686 PolarHBondContact O-N 2.89Å; V684-S686 VanDerWaalsContact C-N 3.32Å; V684-S686 PolarHBondContact O-N 2.97Å; S686-M688 PolarHBondContact O-N 2.82Å; S686-M688 VanDerWaalsContact O-N 3.17Å; S686-S689 WeakPolarHBondContact CA-OG 3.42Å; S686-S689 PolarHBondContact O-N 3.11Å; S686-S689 PolarHBondContact O-OG 2.88Å; S686-D690 VanDerWaalsContact C-OD2 3.31Å; S686-D690 WeakPolarHBondContact O-CB 3.5Å; S686-D690 PolarHBondContact O-N 3.2Å; S686-D690 PolarHBondContact OG-OD2 3.4Å
687	Q	48.3	Very low	50.5	Low	134 Å²	134	60.9 Å²	60.9	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-56.7	-36.7	178.3	-66.6	176.9	-3.8	0	0	112.6	S683 V684 S691	S683-Q687 PolarHBondContact O-N 2.77Å; V684-Q687 PolarHBondContact O-N 3.33Å; Q687-S691 WeakPolarHBondContact O-CB 3.48Å; Q687-S691 PolarHBondContact O-N 2.68Å; Q687-S691 VanDerWaalsContact O-N 3.11Å
688	M	38.7	Very low	49.5	Very low	93 Å²	93	67.2 Å²	67.2	46%	0.458	37%	0.365	S	S	.	.	H	α-helix	trans	-70.1	-41	172.6	-68.2	-163.4	-155.6	0	0	113.4	V684 L685 S686 L692	V684-M688 HydrophobicContact CG1-CE 3.73Å; V684-M688 WeakPolarHBondContact O-CG 3.37Å; V684-M688 PolarHBondContact O-N 2.64Å; L685-M688 PolarHBondContact O-N 3.4Å; S686-M688 PolarHBondContact O-N 2.82Å; S686-M688 VanDerWaalsContact O-N 3.17Å; M688-L692 WeakPolarHBondContact O-CB 3.16Å; M688-L692 PolarHBondContact O-N 3.2Å
689	S	44.2	Very low	48.3	Very low	19 Å²	19	70.1 Å²	70.1	13%	0.133	39%	0.391	C	S	.	.	H	α-helix	trans	-66.8	-45.1	176.6	60.6	0	0	0	0	111.8	R373 L685 S686 S691 L692 E693	R373-S689 PolarHBondContact NH1-OG 2.87Å; L685-S689 PolarHBondContact O-N 3.32Å; L685-S689 PolarHBondContact O-OG 2.89Å; S686-S689 WeakPolarHBondContact CA-OG 3.42Å; S686-S689 PolarHBondContact O-N 3.11Å; S686-S689 PolarHBondContact O-OG 2.88Å; S689-S691 VanDerWaalsContact C-N 3.34Å; S689-S691 PolarHBondContact O-N 2.9Å; S689-L692 PolarHBondContact O-N 2.87Å; S689-L692 VanDerWaalsContact O-N 3.16Å; S689-E693 WeakPolarHBondContact O-CB 3.5Å; S689-E693 WeakPolarHBondContact O-CG 3.45Å; S689-E693 PolarHBondContact O-N 2.68Å
690	D	46.2	Very low	46.9	Very low	53 Å²	53	76.5 Å²	76.5	28%	0.283	42%	0.419	S	S	.	.	H	α-helix	trans	-70.5	-34.3	-173.6	-55.3	-26.3	0	0	0	110.6	R373 S686 G694	R373-D690 IonicContact CZ-OD1 3.69Å; R373-D690 VanDerWaalsContact CZ-OD1 3.26Å; R373-D690 IonicContact NH1-OD1 3.92Å; R373-D690 PolarHBondContact NH1-OD1 3.3Å; R373-D690 IonicContact NH1-OD2 2.77Å; R373-D690 IonicContact NH2-OD1 3.81Å; R373-D690 PolarHBondContact NH2-OD1 3.49Å; S686-D690 VanDerWaalsContact C-OD2 3.31Å; S686-D690 WeakPolarHBondContact O-CB 3.5Å; S686-D690 PolarHBondContact O-N 3.2Å; S686-D690 PolarHBondContact OG-OD2 3.4Å; D690-G694 PolarHBondContact O-N 3.34Å
691	S	41.9	Very low	46.1	Very low	66 Å²	66	78.1 Å²	78.1	46%	0.462	44%	0.435	S	S	.	.	H	α-helix	trans	-67.4	-39.6	170.6	-173.9	0	0	0	0	112.7	Q687 S689 G694 Q695	Q687-S691 WeakPolarHBondContact O-CB 3.48Å; Q687-S691 PolarHBondContact O-N 2.68Å; Q687-S691 VanDerWaalsContact O-N 3.11Å; S689-S691 VanDerWaalsContact C-N 3.34Å; S689-S691 PolarHBondContact O-N 2.9Å; S691-G694 PolarHBondContact O-N 2.7Å; S691-Q695 WeakPolarHBondContact O-CG 3.42Å; S691-Q695 PolarHBondContact O-N 3.34Å
692	L	41.1	Very low	45.3	Very low	57 Å²	57	83.7 Å²	83.7	30%	0.298	46%	0.459	S	S	.	.	H	α-helix	trans	-73.2	-38.9	179.6	-159.1	76	0	0	0	112	M688 S689 Q695 L696	M688-L692 WeakPolarHBondContact O-CB 3.16Å; M688-L692 PolarHBondContact O-N 3.2Å; S689-L692 PolarHBondContact O-N 2.87Å; S689-L692 VanDerWaalsContact O-N 3.16Å; L692-Q695 PolarHBondContact O-N 2.84Å; L692-L696 WeakPolarHBondContact O-CG 3.41Å; L692-L696 PolarHBondContact O-N 3.09Å
693	E	43.8	Very low	44.6	Very low	93 Å²	93	87.6 Å²	87.6	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-43	170.9	-73.6	170	-174.7	0	0	110.6	R373 S689 Q695 L696 H697	R373-E693 IonicContact CZ-OE1 3.84Å; R373-E693 IonicContact NH2-OE1 2.69Å; R373-E693 PolarHBondContact NH2-OE1 3.28Å; R373-E693 IonicContact NH2-OE2 2.78Å; R373-E693 PolarHBondContact NH2-OE2 3.33Å; S689-E693 WeakPolarHBondContact O-CB 3.5Å; S689-E693 WeakPolarHBondContact O-CG 3.45Å; S689-E693 PolarHBondContact O-N 2.68Å; E693-Q695 PolarHBondContact O-N 2.75Å; E693-L696 PolarHBondContact O-N 3.46Å; E693-H697 PolarHBondContact O-CD2 3.26Å; E693-H697 VanDerWaalsContact O-CD2 3.32Å; E693-H697 PolarHBondContact O-N 3Å
694	G	47.7	Very low	43.7	Very low	37 Å²	37	88.1 Å²	88.1	38%	0.381	50%	0.501	S	S	.	.	H	α-helix	trans	-59.1	-45.2	173.2	0	0	0	0	0	113.5	D690 S691 L696 H697 Q698	D690-G694 PolarHBondContact O-N 3.34Å; S691-G694 PolarHBondContact O-N 2.7Å; G694-L696 PolarHBondContact O-N 3.13Å; G694-H697 PolarHBondContact O-N 3.35Å; G694-Q698 WeakPolarHBondContact O-CB 3.41Å; G694-Q698 PolarHBondContact O-N 3.3Å
695	Q	46.8	Very low	42.8	Very low	121 Å²	121	94 Å²	94	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-37.9	175.3	-74.8	178.2	5	0	0	112.6	S691 L692 E693 A699	S691-Q695 WeakPolarHBondContact O-CG 3.42Å; S691-Q695 PolarHBondContact O-N 3.34Å; L692-Q695 PolarHBondContact O-N 2.84Å; E693-Q695 PolarHBondContact O-N 2.75Å; Q695-A699 VanDerWaalsContact O-CB 3.31Å; Q695-A699 WeakPolarHBondContact O-CB 3.23Å; Q695-A699 PolarHBondContact O-N 2.97Å
696	L	35.9	Very low	42	Very low	81 Å²	81	94 Å²	94	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-66.8	-44.1	175.1	-80.7	163.8	0	0	0	112.2	L692 E693 G694 A699 Q700	L692-L696 WeakPolarHBondContact O-CG 3.41Å; L692-L696 PolarHBondContact O-N 3.09Å; E693-L696 PolarHBondContact O-N 3.46Å; G694-L696 PolarHBondContact O-N 3.13Å; L696-A699 PolarHBondContact O-N 2.87Å; L696-Q700 VanDerWaalsContact O-CG 3.29Å; L696-Q700 WeakPolarHBondContact O-CG 3.23Å; L696-Q700 PolarHBondContact O-N 3.14Å
697	H	48.6	Very low	41.4	Very low	134 Å²	134	99.4 Å²	99.4	62%	0.62	58%	0.578	S	S	*	*	H	α-helix	trans	-63.2	-45.2	175.7	-88.1	-107.8	0	0	0	111.7	E693 G694 A699 Q700 S701	E693-H697 PolarHBondContact O-CD2 3.26Å; E693-H697 VanDerWaalsContact O-CD2 3.32Å; E693-H697 PolarHBondContact O-N 3Å; G694-H697 PolarHBondContact O-N 3.35Å; H697-A699 VanDerWaalsContact C-N 3.31Å; H697-A699 PolarHBondContact O-N 3.12Å; H697-Q700 CarbonylContact O-C 3.6Å; H697-Q700 WeakPolarHBondContact O-CA 3.39Å; H697-Q700 PolarHBondContact O-N 2.98Å; H697-S701 WeakPolarHBondContact O-CB 3.33Å; H697-S701 PolarHBondContact O-N 3.46Å; H697-S701 PolarHBondContact O-OG 3.29Å
698	Q	48.4	Very low	40.7	Very low	137 Å²	137	96.4 Å²	96.4	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-63.9	-36.6	179.1	-167.3	169.6	16.6	0	0	112.1	G694 Q700 S701	G694-Q698 WeakPolarHBondContact O-CB 3.41Å; G694-Q698 PolarHBondContact O-N 3.3Å; Q698-Q700 PolarHBondContact O-N 3.08Å; Q698-S701 PolarHBondContact O-N 3.22Å; Q698-S701 PolarHBondContact O-OG 2.85Å
699	A	41.7	Very low	40.3	Very low	77 Å²	77	100.6 Å²	100.6	64%	0.636	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-11.4	172.8	0	0	0	0	0	114.3	Q695 L696 H697	Q695-A699 VanDerWaalsContact O-CB 3.31Å; Q695-A699 WeakPolarHBondContact O-CB 3.23Å; Q695-A699 PolarHBondContact O-N 2.97Å; L696-A699 PolarHBondContact O-N 2.87Å; H697-A699 VanDerWaalsContact C-N 3.31Å; H697-A699 PolarHBondContact O-N 3.12Å
700	Q	41.1	Very low	39.6	Very low	151 Å²	151	105.8 Å²	105.8	71%	0.706	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-11.5	177.5	-71.8	176.9	1.1	0	0	113.5	L696 H697 Q698	L696-Q700 VanDerWaalsContact O-CG 3.29Å; L696-Q700 WeakPolarHBondContact O-CG 3.23Å; L696-Q700 PolarHBondContact O-N 3.14Å; H697-Q700 CarbonylContact O-C 3.6Å; H697-Q700 WeakPolarHBondContact O-CA 3.39Å; H697-Q700 PolarHBondContact O-N 2.98Å; Q698-Q700 PolarHBondContact O-N 3.08Å
701	S	42.7	Very low	38.8	Very low	82 Å²	82	106.3 Å²	106.3	57%	0.573	65%	0.649	S	S	*	*			trans	-102.7	-2.6	-173.7	63.3	0	0	0	0	115.9	H697 Q698 P703	H697-S701 WeakPolarHBondContact O-CB 3.33Å; H697-S701 PolarHBondContact O-N 3.46Å; H697-S701 PolarHBondContact O-OG 3.29Å; Q698-S701 PolarHBondContact O-N 3.22Å; Q698-S701 PolarHBondContact O-OG 2.85Å; S701-P703 WeakPolarHBondContact O-CD 3.19Å
702	E	40.1	Very low	38.3	Very low	164 Å²	164	110.9 Å²	110.9	77%	0.766	67%	0.665	S	S	*	*			trans	-68.7	112.9	177.6	-76.6	-87.9	116.1	0	0	111.6
703	P	40.4	Very low	37.7	Very low	114 Å²	114	114.5 Å²	114.5	74%	0.74	68%	0.684	S	S	*	*			trans	-85.7	124.8	-176.1	-8.1	27.5	0	0	0	112.3	S701 L705	S701-P703 WeakPolarHBondContact O-CD 3.19Å; P703-L705 PolarHBondContact O-N 3.23Å
704	G	33.2	Very low	36.9	Very low	82 Å²	82	116.2 Å²	116.2	85%	0.845	70%	0.701	S	S	*	*			trans	-74.7	118	-177.8	0	0	0	0	0	115.3
705	L	33.5	Very low	36.1	Very low	170 Å²	170	119.9 Å²	119.9	89%	0.89	72%	0.719	S	S	*	*			trans	-133.5	130.9	160.9	-65.2	166	0	0	0	105.4	P703	P703-L705 PolarHBondContact O-N 3.23Å
706	G	31.5	Very low	35.2	Very low	69 Å²	69	123.5 Å²	123.5	71%	0.711	74%	0.735	S	S	*	*			cis	95.5	122.7	45.5	0	0	0	0	0	108.3
707	V	34.2	Very low	34.8	Very low	154 Å²	154	128.4 Å²	128.4	93%	0.933	76%	0.756	S	S	*	*			cis	-155.5	144.2	14.9	171.9	0	0	0	0	111.3
708	G	31.9	Very low	34	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	76%	0.763	S	S	*	*			trans	90.5	161	154.4	0	0	0	0	0	118.5
709	H	32	Very low	33.1	Very low	181 Å²	181	126.4 Å²	126.4	84%	0.838	76%	0.764	S	S	*	*			cis	-164.6	129.1	-14	-164	47.4	0	0	0	111.1
710	V	28.7	Very low	32.2	Very low	127 Å²	127	128.8 Å²	128.8	77%	0.77	77%	0.771	S	S	*	*			trans	59.7	132.6	170.1	-164.7	0	0	0	0	117.5
711	G	29.9	Very low	31.6	Very low	65 Å²	65	131.4 Å²	131.4	67%	0.67	78%	0.776	S	S	*	*			cis	165.6	-165.1	-4.6	0	0	0	0	0	113.5
712	M	30.1	Very low	30.8	Very low	162 Å²	162	135 Å²	135	80%	0.798	78%	0.783	S	S	*	*			trans	78.7	111.8	171.8	-66.1	-83.2	82.2	0	0	120.7
713	L	29.7	Very low	30.3	Very low	132 Å²	132	134.9 Å²	134.9	69%	0.691	79%	0.788	S	S	*	*			trans	77.3	78.1	136.1	-56.5	176.9	0	0	0	122
714	T	27.3	Very low	29.8	Very low	129 Å²	129	136.7 Å²	136.7	79%	0.791	79%	0.786	S	S	*	*				49.7	150.7	114.2	51.7	0	0	0	0	123.9
715	P	29.5	Very low	29.7	Very low	115 Å²	115	142.1 Å²	142.1	75%	0.747	79%	0.79	S	S	*	*			trans	-125.8	173.1	-155.3	43	-27.9	0	0	0	116.6
716	Q	28.3	Very low	29.5	Very low	196 Å²	196	138.6 Å²	138.6	92%	0.916	78%	0.779	S	S	*	*			trans	-142.3	162.4	158.2	-75.2	-161.7	-20.5	0	0	113.2
717	Q	27.4	Very low	29.5	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	79%	0.789	S	S	*	*			trans	-94	-145.9	175.6	-45	173.9	-64	0	0	108.6
718	P	32.3	Very low	29.2	Very low	119 Å²	119	140.7 Å²	140.7	77%	0.773	78%	0.779	S	S	*	*			cis	-99.2	-143.3	-2.2	16.7	8.9	0	0	0	110.9
719	V	28.6	Very low	29.3	Very low	110 Å²	110	146.9 Å²	146.9	67%	0.667	79%	0.788	S	S	*	*			cis	-144.7	156.2	8.2	178.1	0	0	0	0	109.8	Y721	V719-Y721 HydrophobicContact CG1-CD2 3.99Å; V719-Y721 HydrophobicContact CG1-CE2 3.94Å
720	V	23.5	Very low	29.2	Very low	127 Å²	127	145.5 Å²	145.5	77%	0.77	79%	0.787	S	S	*	*			trans	-115	143.8	166.6	168.6	0	0	0	0	109.3
721	Y	28.8	Very low	29.4	Very low	207 Å²	207	151.5 Å²	151.5	81%	0.812	80%	0.796	S	S	*	*			trans	-121.6	114	163.9	-95.8	-80.8	0	0	0	112.1	V719	V719-Y721 HydrophobicContact CG1-CD2 3.99Å; V719-Y721 HydrophobicContact CG1-CE2 3.94Å
722	Q	25.4	Very low	29.4	Very low	156 Å²	156	153.8 Å²	153.8	73%	0.729	80%	0.802	S	S	*	*			trans	-84.6	165.6	151	-66.5	177.2	-37.8	0	0	108.4
723	N	31	Very low	29.5	Very low	162 Å²	162	152.1 Å²	152.1	87%	0.866	81%	0.806	S	S	*	*			trans	-147.8	143.7	135.4	-117.3	-25.1	0	0	0	111.8
724	H	29.1	Very low	29.5	Very low	152 Å²	152	151.3 Å²	151.3	70%	0.704	81%	0.812	S	S	*	*			trans	-97.3	145.1	179	-114	-100.3	0	0	0	109.1
725	E	31.4	Very low	29.7	Very low	197 Å²	197	151.1 Å²	151.1	92%	0.921	82%	0.815	S	S	*	*			trans	-134	152.5	141.3	-79.8	-154.5	120.3	0	0	109
726	S	28.4	Very low	29.8	Very low	96 Å²	96	150.7 Å²	150.7	67%	0.671	82%	0.815	S	S	*	*			trans	-141.8	137.9	-163.4	55.5	0	0	0	0	111.9
727	V	31.4	Very low	29.8	Very low	151 Å²	151	146 Å²	146	92%	0.915	80%	0.804	S	S	*	*			trans	-126.5	110.5	166.8	-179.1	0	0	0	0	108.5
728	T	28.3	Very low	29.9	Very low	116 Å²	116	148.2 Å²	148.2	71%	0.712	81%	0.806	S	S	*	*			trans	-88.9	141.2	176.2	49.6	0	0	0	0	111.3
729	Q	35.2	Very low	29.8	Very low	200 Å²	200	149.6 Å²	149.6	94%	0.935	81%	0.805	S	S	*	*			trans	-150.6	139.8	146.6	-118.6	174.3	42.4	0	0	112.1
730	N	29.4	Very low	30.1	Very low	152 Å²	152	150.7 Å²	150.7	81%	0.813	81%	0.813	S	S	*	*			trans	-88.2	145.8	-170.2	-61.4	-53.7	0	0	0	112.2
731	R	32.8	Very low	30.3	Very low	253 Å²	253	152.4 Å²	152.4	96%	0.955	82%	0.818	S	S	*	*				-164.9	146.3	114.4	-108.5	168.3	-177.6	-176.2	0.5	113.6
732	S	29.1	Very low	30.5	Very low	113 Å²	113	146.3 Å²	146.3	79%	0.79	82%	0.817	S	S	*	*			trans	-110.8	148.4	-177.3	51.3	0	0	0	0	111.4
733	S	33.4	Very low	30.7	Very low	128 Å²	128	144.7 Å²	144.7	90%	0.895	82%	0.823	S	S	*	*			trans	-161.1	135.9	145.1	50.5	0	0	0	0	110
734	S	28.2	Very low	31	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	82%	0.824	S	S	*	*			trans	-126.4	146.8	-175.9	50.7	0	0	0	0	110.6
735	S	32.6	Very low	31	Very low	124 Å²	124	141 Å²	141	87%	0.867	82%	0.824	S	S	*	*			trans	171.7	159.5	158.5	-83.1	0	0	0	0	109.7
736	S	32.2	Very low	30.9	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	82%	0.818	S	S	*	*			cis	-167.4	160	-38.8	-162.6	0	0	0	0	106.7
737	S	27.5	Very low	31.1	Very low	98 Å²	98	141.8 Å²	141.8	69%	0.685	83%	0.826	S	S	*	*			trans	-86.9	149.9	-177.3	53.5	0	0	0	0	113.6
738	Y	30.4	Very low	31.1	Very low	229 Å²	229	144.1 Å²	144.1	90%	0.898	83%	0.827	S	S	*	*			trans	-142.2	143	155.4	-89.1	-73.3	0	0	0	111.7
739	I	29.8	Very low	31.2	Very low	148 Å²	148	142 Å²	142	76%	0.759	83%	0.829	S	S	*	*			trans	-121.5	133	175.2	-62.6	170.4	0	0	0	107.2
740	T	34.5	Very low	30.9	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	82%	0.824	S	S	*	*			trans	-143.6	121.8	166.1	51.3	0	0	0	0	110.6
741	N	28.3	Very low	30.8	Very low	164 Å²	164	135.5 Å²	135.5	88%	0.877	82%	0.816	S	S	*	*			trans	-80.7	154.7	166.5	-72	-34.2	0	0	0	110.3
742	G	32.8	Very low	30.6	Very low	78 Å²	78	134.5 Å²	134.5	80%	0.804	81%	0.814	S	S	*	*			trans	178.7	104.4	171.4	0	0	0	0	0	113.9
743	S	28.3	Very low	30.6	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	81%	0.809	S	S	*	*			trans	-105.6	149.3	163.7	-53.5	0	0	0	0	109.4
744	P	37.2	Very low	30.6	Very low	135 Å²	135	132.7 Å²	132.7	88%	0.877	80%	0.803	S	S	*	*				-136.4	-170.9	124.9	36.9	-24.9	0	0	0	112.3
745	S	30.2	Very low	30.7	Very low	101 Å²	101	131.6 Å²	131.6	71%	0.706	80%	0.801	S	S	*	*			trans	-136.2	168.5	-158	60.9	0	0	0	0	115.7
746	T	29.1	Very low	30.4	Very low	129 Å²	129	128.8 Å²	128.8	79%	0.791	79%	0.792	S	S	*	*			trans	67.6	113.2	152.9	32	0	0	0	0	120.9
747	E	31.9	Very low	30.2	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	80%	0.799	S	S	*	*				-168.1	113.6	127.8	-103.5	168.7	-164.7	0	0	107.8
748	Q	31.1	Very low	30.1	Very low	200 Å²	200	135.1 Å²	135.1	94%	0.935	80%	0.802	S	S	*	*				66.3	121.5	92.5	-68	-160.4	24.5	0	0	116.5
749	G	30.4	Very low	30	Very low	73 Å²	73	130.2 Å²	130.2	75%	0.753	79%	0.791	S	S	*	*			trans	155.3	111.4	166.9	0	0	0	0	0	116.5
750	C	30.1	Very low	29.9	Very low	123 Å²	123	133.8 Å²	133.8	83%	0.831	80%	0.796	S	S	*	*			trans	30.1	108.3	157.6	-60.1	0	0	0	0	120.2
751	S	26.2	Very low	29.6	Very low	92 Å²	92	130.8 Å²	130.8	64%	0.643	79%	0.792	S	S	*	*				79.7	109.2	62.1	74.5	0	0	0	0	116.5
752	Y	29.4	Very low	29.6	Very low	232 Å²	232	128.3 Å²	128.3	91%	0.91	79%	0.788	S	S	*	*				-179.9	143.4	118.7	-105	-75.7	0	0	0	112.4
753	A	28.1	Very low	29.4	Very low	84 Å²	84	130.2 Å²	130.2	69%	0.694	79%	0.789	S	S	*	*			trans	-139.4	-156.8	172	0	0	0	0	0	106.2
754	P	35.2	Very low	29.1	Very low	118 Å²	118	133.4 Å²	133.4	77%	0.766	78%	0.783	S	S	*	*			cis	-142.3	-163	-2.4	44.1	-23.8	0	0	0	115.1
755	A	30	Very low	28.8	Very low	92 Å²	92	134 Å²	134	76%	0.76	78%	0.784	S	S	*	*			trans	67.2	148.4	153.5	0	0	0	0	0	119.9
756	G	25.8	Very low	28.5	Very low	65 Å²	65	134.5 Å²	134.5	67%	0.67	78%	0.779	S	S	*	*			cis	115.3	111.1	-14	0	0	0	0	0	116
757	Y	28.9	Very low	28.6	Very low	230 Å²	230	133.8 Å²	133.8	90%	0.902	78%	0.779	S	S	*	*			trans	-147.8	146	161.1	-92.1	-75.6	0	0	0	111.6
758	S	24.4	Very low	28.2	Very low	108 Å²	108	129 Å²	129	76%	0.755	78%	0.778	S	S	*	*			trans	-122.8	-174.5	166.1	-175.7	0	0	0	0	107.7
759	L	28.2	Very low	28	Very low	126 Å²	126	126 Å²	126	66%	0.66	78%	0.778	S	S	*	*			trans	161.8	123.5	136.4	-84.9	159.1	0	0	0	113.3
760	Y	28.7	Very low	27.6	Very low	223 Å²	223	133.2 Å²	133.2	88%	0.875	78%	0.783	S	S	*	*			trans	56	157.1	157.9	-65.8	-64.9	0	0	0	120.6
761	G	28.3	Very low	27.4	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	79%	0.785	S	S	*	*			cis	-160.1	177.7	1.6	0	0	0	0	0	112.7
762	S	26.6	Very low	27.4	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	79%	0.79	S	S	*	*			trans	-139	154.3	-163.2	-177.8	0	0	0	0	114.5
763	S	28.9	Very low	27.1	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	79%	0.79	S	S	*	*			trans	-161.2	140.5	150	58.9	0	0	0	0	113
764	Y	23.5	Very low	27.1	Very low	189 Å²	189	133.5 Å²	133.5	74%	0.741	80%	0.796	S	S	*	*			trans	-101.2	153	177.1	-86.2	-110.6	0	0	0	112.6
765	V	29.4	Very low	26.5	Very low	148 Å²	148	135.1 Å²	135.1	90%	0.897	80%	0.798	S	S	*	*			trans	-142.5	151.8	145.9	-172.8	0	0	0	0	108.8
766	N	24	Very low	26.4	Very low	111 Å²	111	136.2 Å²	136.2	59%	0.594	80%	0.8	S	S	*	*			trans	-141.1	120.6	-166.9	156.5	106.9	0	0	0	112.7	K400	K400-N766 PolarHBondContact NZ-OD1 3.14Å
767	S	30.8	Very low	26.3	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	81%	0.807	S	S	*	*			trans	-174.4	142.3	165.8	53.8	0	0	0	0	110.2
768	G	24.8	Very low	26.1	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	80%	0.799	S	S	*	*			cis	129.6	92.1	-6.3	0	0	0	0	0	113.9
769	C	25.9	Very low	26.3	Very low	138 Å²	138	135.8 Å²	135.8	93%	0.932	81%	0.805	S	S	*	*			trans	-155.2	170.4	159.5	-149.5	0	0	0	0	112
770	R	23.5	Very low	26	Very low	223 Å²	223	136.6 Å²	136.6	84%	0.842	81%	0.81	S	S	*	*			trans	-114.6	-173.4	-168.9	-71.5	175.6	163.1	179.3	-5.9	112.6
771	T	25.5	Very low	25.8	Very low	142 Å²	142	134.2 Å²	134.2	87%	0.871	81%	0.807	S	S	*	*			trans	94	134.6	167.3	70.4	0	0	0	0	115.6
772	A	25.9	Very low	25.7	Very low	93 Å²	93	138.7 Å²	138.7	77%	0.769	81%	0.813	S	S	*	*			cis	-151.7	158.1	-12.2	0	0	0	0	0	111.8
773	F	22.4	Very low	25.7	Very low	203 Å²	203	141.3 Å²	141.3	89%	0.89	82%	0.818	S	S	*	*			trans	-75.8	146.9	166.3	-81.9	-102	0	0	0	110.8
774	A	28.1	Very low	25.6	Very low	100 Å²	100	143.9 Å²	143.9	83%	0.826	82%	0.816	S	S	*	*			trans	-138.5	114.3	161.7	0	0	0	0	0	109.1
775	N	23.3	Very low	25.7	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	82%	0.818	S	S	*	*			trans	-84.5	138.5	174.9	-64.9	-16.4	0	0	0	109.8
776	S	27.6	Very low	25.6	Very low	115 Å²	115	143 Å²	143	80%	0.804	82%	0.819	S	S	*	*			trans	-140.9	82.1	162.3	64.4	0	0	0	0	110.8
777	S	24.4	Very low	25.8	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	82%	0.816	S	S	*	*			trans	-62.9	162.2	157.6	50.2	0	0	0	0	111
778	S	24.9	Very low	25.6	Very low	106 Å²	106	141.2 Å²	141.2	74%	0.741	81%	0.809	S	S	*	*			trans	82.2	96.6	-177.2	-161.5	0	0	0	0	115.2
779	I	27	Very low	25.8	Very low	172 Å²	172	142.8 Å²	142.8	88%	0.882	80%	0.802	S	S	*	*				-137.3	86.5	108.9	-86.3	150	0	0	0	105.2
780	D	23.2	Very low	25.8	Very low	143 Å²	143	141 Å²	141	77%	0.765	79%	0.792	S	S	*	*			trans	-97.6	157.4	158.6	-123	-47.1	0	0	0	107.5
781	Q	24.5	Very low	26	Very low	173 Å²	173	138.2 Å²	138.2	81%	0.808	78%	0.781	S	S	*	*			trans	58.4	85.8	-179.6	-50	177.2	16.8	0	0	115.9
782	L	24.6	Very low	26.1	Very low	165 Å²	165	135.8 Å²	135.8	86%	0.864	77%	0.766	S	S	*	*			trans	179.5	91.4	131.4	-99.6	163.4	0	0	0	112.1
783	L	28.2	Very low	26.3	Very low	167 Å²	167	137.7 Å²	137.7	87%	0.874	76%	0.759	S	S	*	*				166.8	102.3	129.5	-91	165.4	0	0	0	110.3	N785	L783-N785 PolarHBondContact O-N 3.06Å
784	H	26	Very low	26.5	Very low	172 Å²	172	131.1 Å²	131.1	80%	0.796	74%	0.738	S	S	*	*			trans	-61.3	131.9	154.6	-77.2	21.6	0	0	0	108.9
785	N	26.6	Very low	26.5	Very low	147 Å²	147	131.2 Å²	131.2	79%	0.786	72%	0.724	S	S	*	*				173.9	137.1	111.5	-89	-46.4	0	0	0	113	L783 A787	L783-N785 PolarHBondContact O-N 3.06Å; N785-A787 PolarHBondContact O-N 3.37Å
786	N	27.2	Very low	26.8	Very low	170 Å²	170	130.5 Å²	130.5	91%	0.909	72%	0.716	S	S	*	*			trans	-69.2	122.1	171.2	-65.9	-49.7	0	0	0	110.6
787	A	27.8	Very low	26.9	Very low	64 Å²	64	129.8 Å²	129.8	53%	0.529	70%	0.7	S	S	.	*			trans	-173.2	-28.3	167.3	0	0	0	0	0	115	N785	N785-A787 PolarHBondContact O-N 3.37Å
788	L	26.1	Very low	27.1	Very low	125 Å²	125	126.1 Å²	126.1	65%	0.654	68%	0.675	S	S	*	*	S	Bend	trans	-88.4	-24.2	-156.1	-78.1	165	0	0	0	116.4	S790 R791	L788-S790 PolarHBondContact O-N 3.39Å; L788-R791 PolarHBondContact O-N 2.68Å
789	V	28.6	Very low	27.3	Very low	113 Å²	113	128.1 Å²	128.1	69%	0.685	67%	0.67	S	S	*	*	H	α-helix	trans	-68.4	-38.2	-174.3	-177	0	0	0	0	112.1	R791 T792	V789-R791 PolarHBondContact O-N 2.89Å; V789-T792 PolarHBondContact O-OG1 3.44Å; V789-T792 VanDerWaalsContact O-OG1 3.07Å
790	S	27.2	Very low	27.6	Very low	102 Å²	102	127.1 Å²	127.1	71%	0.713	66%	0.656	S	S	*	*	H	α-helix	trans	-69.3	-14.6	177.5	-43.1	0	0	0	0	113.9	L788	L788-S790 PolarHBondContact O-N 3.39Å
791	R	26.1	Very low	27.9	Very low	164 Å²	164	126.9 Å²	126.9	62%	0.619	65%	0.65	S	S	*	*	H	α-helix	trans	-86	-24.1	-178.2	-78.8	-176.9	169.4	168.4	-1.2	113.9	L788 V789 L795	L788-R791 PolarHBondContact O-N 2.68Å; V789-R791 PolarHBondContact O-N 2.89Å; R791-L795 VanDerWaalsContact O-CB 3.24Å; R791-L795 WeakPolarHBondContact O-CB 3.39Å; R791-L795 WeakPolarHBondContact O-CD1 3.13Å; R791-L795 VanDerWaalsContact O-CG 3.26Å; R791-L795 WeakPolarHBondContact O-CG 3.46Å; R791-L795 PolarHBondContact O-N 3.14Å
792	T	29.2	Very low	28	Very low	91 Å²	91	127.5 Å²	127.5	56%	0.558	65%	0.646	S	S	*	*	H	α-helix	trans	-72.6	-45.7	-177.8	48.5	0	0	0	0	112.2	V789 L795 Q796	V789-T792 PolarHBondContact O-OG1 3.44Å; V789-T792 VanDerWaalsContact O-OG1 3.07Å; T792-L795 PolarHBondContact O-N 2.85Å; T792-Q796 PolarHBondContact O-N 3.2Å
793	H	29.2	Very low	28.4	Very low	132 Å²	132	125.1 Å²	125.1	61%	0.611	63%	0.626	S	S	*	*	H	α-helix	trans	-61.1	-47.3	175.6	-140	-87.4	0	0	0	111.2	L795 Q796 E797	H793-L795 VanDerWaalsContact C-N 3.34Å; H793-L795 PolarHBondContact O-N 3.14Å; H793-Q796 WeakPolarHBondContact O-CA 3.15Å; H793-Q796 WeakPolarHBondContact O-CB 3.25Å; H793-Q796 PolarHBondContact O-N 2.67Å; H793-E797 IonicContact CE1-OE1 3.61Å; H793-E797 PolarHBondContact CE1-OE1 2.86Å; H793-E797 IonicContact CG-OE1 3.39Å; H793-E797 IonicContact ND1-OE1 3.6Å; H793-E797 PolarHBondContact ND1-OE1 3.04Å; H793-E797 PolarHBondContact O-N 3.23Å
794	S	27.6	Very low	28.7	Very low	65 Å²	65	119.4 Å²	119.4	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-63	-34.1	176.6	-176.4	0	0	0	0	113.4	Q796 S798	S794-Q796 VanDerWaalsContact C-N 3.31Å; S794-S798 VanDerWaalsContact O-CB 3.23Å; S794-S798 WeakPolarHBondContact O-CB 3.2Å; S794-S798 PolarHBondContact O-N 2.92Å; S794-S798 PolarHBondContact O-OG 3.47Å
795	L	27.3	Very low	28.8	Very low	102 Å²	102	113.3 Å²	113.3	53%	0.534	58%	0.579	S	S	.	*	H	α-helix	trans	-70.4	-26	171.8	-83.9	167.3	0	0	0	113.2	R791 T792 H793 S798 K799	R791-L795 VanDerWaalsContact O-CB 3.24Å; R791-L795 WeakPolarHBondContact O-CB 3.39Å; R791-L795 WeakPolarHBondContact O-CD1 3.13Å; R791-L795 VanDerWaalsContact O-CG 3.26Å; R791-L795 WeakPolarHBondContact O-CG 3.46Å; R791-L795 PolarHBondContact O-N 3.14Å; T792-L795 PolarHBondContact O-N 2.85Å; H793-L795 VanDerWaalsContact C-N 3.34Å; H793-L795 PolarHBondContact O-N 3.14Å; L795-S798 WeakPolarHBondContact CA-OG 3.32Å; L795-K799 WeakPolarHBondContact O-CB 3.25Å; L795-K799 WeakPolarHBondContact O-CG 3.5Å; L795-K799 PolarHBondContact O-N 2.96Å
796	Q	30.5	Very low	29	Very low	137 Å²	137	109.3 Å²	109.3	64%	0.64	57%	0.567	S	S	*	*	H	α-helix	trans	-76.9	-44.8	175.7	-158.8	151	-40.2	0	0	110.4	T792 H793 S794 Y800	T792-Q796 PolarHBondContact O-N 3.2Å; H793-Q796 WeakPolarHBondContact O-CA 3.15Å; H793-Q796 WeakPolarHBondContact O-CB 3.25Å; H793-Q796 PolarHBondContact O-N 2.67Å; S794-Q796 VanDerWaalsContact C-N 3.31Å; Q796-Y800 WeakPolarHBondContact O-CD2 3.42Å
797	E	29.4	Very low	29.4	Very low	100 Å²	100	106.8 Å²	106.8	47%	0.467	55%	0.549	S	S	.	.	H	α-helix	trans	-65.5	-49	174.4	-70.5	156.8	-164.1	0	0	112.7	H793 K799 Y800 H801	H793-E797 IonicContact CE1-OE1 3.61Å; H793-E797 PolarHBondContact CE1-OE1 2.86Å; H793-E797 IonicContact CG-OE1 3.39Å; H793-E797 IonicContact ND1-OE1 3.6Å; H793-E797 PolarHBondContact ND1-OE1 3.04Å; H793-E797 PolarHBondContact O-N 3.23Å; E797-K799 VanDerWaalsContact C-N 3.31Å; E797-K799 PolarHBondContact O-N 3.24Å; E797-Y800 WeakPolarHBondContact O-CB 3.31Å; E797-Y800 PolarHBondContact O-N 3.44Å; E797-H801 PolarHBondContact O-CD2 2.94Å; E797-H801 PolarHBondContact O-N 3.32Å; E797-H801 VanDerWaalsContact O-N 3.14Å
798	S	27.6	Very low	29.5	Very low	39 Å²	39	110.8 Å²	110.8	27%	0.273	56%	0.559	S	S	.	*	H	α-helix	trans	-64.5	-30.7	-177.9	56.7	0	0	0	0	113.6	S794 L795 Y800 H801 Y802	S794-S798 VanDerWaalsContact O-CB 3.23Å; S794-S798 WeakPolarHBondContact O-CB 3.2Å; S794-S798 PolarHBondContact O-N 2.92Å; S794-S798 PolarHBondContact O-OG 3.47Å; L795-S798 WeakPolarHBondContact CA-OG 3.32Å; S798-Y800 VanDerWaalsContact C-N 3.25Å; S798-Y800 PolarHBondContact O-N 3.18Å; S798-H801 PolarHBondContact O-N 3.43Å; S798-Y802 WeakPolarHBondContact O-CD2 3.41Å; S798-Y802 PolarHBondContact O-N 2.77Å
799	K	30.1	Very low	29.7	Very low	147 Å²	147	112.5 Å²	112.5	64%	0.639	57%	0.568	S	S	*	*	H	α-helix	trans	-61.7	-31.3	171.2	-87.5	-179.2	176.3	-179.7	0	113.1	L795 E797 R803	L795-K799 WeakPolarHBondContact O-CB 3.25Å; L795-K799 WeakPolarHBondContact O-CG 3.5Å; L795-K799 PolarHBondContact O-N 2.96Å; E797-K799 VanDerWaalsContact C-N 3.31Å; E797-K799 PolarHBondContact O-N 3.24Å; K799-R803 PolarHBondContact O-N 3.15Å
800	Y	33.4	Very low	29.7	Very low	151 Å²	151	109.3 Å²	109.3	59%	0.592	56%	0.558	S	S	*	*	H	α-helix	trans	-78.8	-40.9	176.7	-77.8	-118.9	0	0	0	110.6	Q796 E797 S798 Y802 R803 S804	Q796-Y800 WeakPolarHBondContact O-CD2 3.42Å; E797-Y800 WeakPolarHBondContact O-CB 3.31Å; E797-Y800 PolarHBondContact O-N 3.44Å; S798-Y800 VanDerWaalsContact C-N 3.25Å; S798-Y800 PolarHBondContact O-N 3.18Å; Y800-Y802 PolarHBondContact O-N 3.17Å; Y800-R803 PolarHBondContact O-N 2.92Å; Y800-R803 VanDerWaalsContact O-N 3.16Å; Y800-S804 PolarHBondContact O-N 3.42Å
801	H	29.6	Very low	29.6	Very low	138 Å²	138	108.8 Å²	108.8	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-60.3	-41	173.1	-72.1	-66.3	0	0	0	113.1	E797 S798 R803 S804 A805	E797-H801 PolarHBondContact O-CD2 2.94Å; E797-H801 PolarHBondContact O-N 3.32Å; E797-H801 VanDerWaalsContact O-N 3.14Å; S798-H801 PolarHBondContact O-N 3.43Å; H801-R803 VanDerWaalsContact C-N 3.34Å; H801-R803 PolarHBondContact O-N 2.85Å; H801-S804 PolarHBondContact O-N 3.41Å; H801-A805 PolarHBondContact O-N 2.85Å
802	Y	26.9	Very low	29.7	Very low	187 Å²	187	107.7 Å²	107.7	73%	0.733	56%	0.564	S	S	*	*	H	α-helix	trans	-68	-27.8	175.3	-90.4	-73.6	0	0	0	113.8	S798 Y800 A806	S798-Y802 WeakPolarHBondContact O-CD2 3.41Å; S798-Y802 PolarHBondContact O-N 2.77Å; Y800-Y802 PolarHBondContact O-N 3.17Å; Y802-A806 PolarHBondContact O-N 3.09Å
803	R	32.4	Very low	29.7	Very low	115 Å²	115	107.6 Å²	107.6	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-73.1	-46.3	170.2	-79.6	-172.9	174	-172.8	-2.5	111.7	K799 Y800 H801 A805 A806 E807	K799-R803 PolarHBondContact O-N 3.15Å; Y800-R803 PolarHBondContact O-N 2.92Å; Y800-R803 VanDerWaalsContact O-N 3.16Å; H801-R803 VanDerWaalsContact C-N 3.34Å; H801-R803 PolarHBondContact O-N 2.85Å; R803-A805 VanDerWaalsContact C-N 3.26Å; R803-A805 PolarHBondContact O-N 3.24Å; R803-A806 CarbonylContact O-C 3.45Å; R803-A806 WeakPolarHBondContact O-CA 3.21Å; R803-A806 WeakPolarHBondContact O-CB 3.44Å; R803-A806 PolarHBondContact O-N 2.87Å; R803-E807 WeakPolarHBondContact O-CG 3.44Å; R803-E807 PolarHBondContact O-N 2.78Å
804	S	34.7	Very low	29.6	Very low	46 Å²	46	110 Å²	110	32%	0.322	58%	0.583	S	S	.	*	H	α-helix	trans	-57.5	-37.9	176.7	-177.4	0	0	0	0	112.4	Y800 H801 E807 M808	Y800-S804 PolarHBondContact O-N 3.42Å; H801-S804 PolarHBondContact O-N 3.41Å; S804-E807 PolarHBondContact O-N 3.44Å; S804-M808 WeakPolarHBondContact O-CB 3.18Å; S804-M808 WeakPolarHBondContact O-CG 3.33Å; S804-M808 PolarHBondContact O-N 2.88Å
805	A	28.5	Very low	29.5	Very low	45 Å²	45	117.3 Å²	117.3	37%	0.372	60%	0.601	S	S	.	*	H	α-helix	trans	-67.5	-33.4	173.1	0	0	0	0	0	113.7	H801 R803 L809	H801-A805 PolarHBondContact O-N 2.85Å; R803-A805 VanDerWaalsContact C-N 3.26Å; R803-A805 PolarHBondContact O-N 3.24Å; A805-L809 WeakPolarHBondContact O-CG 3.16Å; A805-L809 PolarHBondContact O-N 3.07Å
806	A	30.5	Very low	29.4	Very low	63 Å²	63	122.5 Å²	122.5	52%	0.521	62%	0.619	S	S	.	*	H	α-helix	trans	-75.1	-34.6	175	0	0	0	0	0	112.3	Y802 R803 L809 G810	Y802-A806 PolarHBondContact O-N 3.09Å; R803-A806 CarbonylContact O-C 3.45Å; R803-A806 WeakPolarHBondContact O-CA 3.21Å; R803-A806 WeakPolarHBondContact O-CB 3.44Å; R803-A806 PolarHBondContact O-N 2.87Å; A806-L809 CarbonylContact O-C 3.58Å; A806-L809 PolarHBondContact O-N 2.89Å; A806-G810 PolarHBondContact O-N 3.16Å; A806-G810 VanDerWaalsContact O-N 3.15Å
807	E	34.5	Very low	29.1	Very low	116 Å²	116	119.4 Å²	119.4	54%	0.542	62%	0.617	S	S	.	*	H	α-helix	trans	-74	-36.8	177.3	-72.3	160.4	-178.9	0	0	111.8	R803 S804 L809 G810	R803-E807 WeakPolarHBondContact O-CG 3.44Å; R803-E807 PolarHBondContact O-N 2.78Å; S804-E807 PolarHBondContact O-N 3.44Å; E807-L809 PolarHBondContact O-N 3.15Å; E807-G810 PolarHBondContact O-N 3.34Å
808	M	29.9	Very low	28.9	Very low	149 Å²	149	121.2 Å²	121.2	73%	0.734	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-18.2	170.6	-76.2	-160.7	-67.1	0	0	113.9	S804	S804-M808 WeakPolarHBondContact O-CB 3.18Å; S804-M808 WeakPolarHBondContact O-CG 3.33Å; S804-M808 PolarHBondContact O-N 2.88Å
809	L	30.8	Very low	28.7	Very low	160 Å²	160	130.7 Å²	130.7	84%	0.838	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	3.8	170.4	-67.3	171.9	0	0	0	112.7	A805 A806 E807	A805-L809 WeakPolarHBondContact O-CG 3.16Å; A805-L809 PolarHBondContact O-N 3.07Å; A806-L809 CarbonylContact O-C 3.58Å; A806-L809 PolarHBondContact O-N 2.89Å; E807-L809 PolarHBondContact O-N 3.15Å
810	G	27.8	Very low	28.6	Very low	46 Å²	46	127 Å²	127	47%	0.474	67%	0.669	S	S	.	*			trans	-116.1	24.8	-172.1	0	0	0	0	0	114.3	A806 E807 I812	A806-G810 PolarHBondContact O-N 3.16Å; A806-G810 VanDerWaalsContact O-N 3.15Å; E807-G810 PolarHBondContact O-N 3.34Å; G810-I812 PolarHBondContact O-N 3.45Å
811	A	26.7	Very low	28.2	Very low	91 Å²	91	127.9 Å²	127.9	75%	0.752	68%	0.684	S	S	*	*			trans	-74.6	49.8	-173	0	0	0	0	0	114.7	P813	A811-P813 WeakPolarHBondContact O-CD 3.36Å
812	I	27.2	Very low	28.4	Very low	141 Å²	141	129.1 Å²	129.1	72%	0.723	70%	0.696	S	S	*	*			trans	-81.1	114.6	168.5	-58.8	177.9	0	0	0	107.6	G810	G810-I812 PolarHBondContact O-N 3.45Å
813	P	28.4	Very low	28.6	Very low	90 Å²	90	123.3 Å²	123.3	58%	0.584	68%	0.681	S	S	*	*			trans	-71.9	151.1	-173.5	28.7	-35.2	0	0	0	112.5	A811 R815	A811-P813 WeakPolarHBondContact O-CD 3.36Å; P813-R815 PolarHBondContact O-N 2.67Å
814	N	27.2	Very low	28.9	Very low	181 Å²	181	123.7 Å²	123.7	97%	0.968	70%	0.702	S	S	*	*	S	Bend	trans	-64.5	78.2	169.1	-84.9	-27.3	0	0	0	111
815	R	25.3	Very low	28.9	Very low	220 Å²	220	123.2 Å²	123.2	83%	0.83	70%	0.698	S	S	*	*			trans	-123.6	4.8	-179.1	-134.9	-177.8	-169.3	-154.3	1.8	114.7	P813 A817	P813-R815 PolarHBondContact O-N 2.67Å; R815-A817 PolarHBondContact O-N 3.35Å
816	F	25.7	Very low	29.3	Very low	211 Å²	211	126 Å²	126	93%	0.925	72%	0.721	S	S	*	*			trans	-76.9	55.7	169.6	-75.3	-73.6	0	0	0	112
817	A	24.1	Very low	29.6	Very low	71 Å²	71	128.6 Å²	128.6	59%	0.587	74%	0.736	S	S	*	*			trans	-100.1	100.9	170.5	0	0	0	0	0	109.9	R815 Y819	R815-A817 PolarHBondContact O-N 3.35Å; A817-Y819 PolarHBondContact O-N 2.98Å
818	V	25.2	Very low	29.7	Very low	138 Å²	138	127.4 Å²	127.4	84%	0.836	74%	0.74	S	S	*	*	S	Bend	trans	50.1	61.7	148.8	-159.2	0	0	0	0	117.1
819	Y	23.6	Very low	29.7	Very low	238 Å²	238	124.9 Å²	124.9	93%	0.933	74%	0.736	S	S	*	*			trans	-142.3	138.6	157.8	-80.4	-79.2	0	0	0	110.6	A817	A817-Y819 PolarHBondContact O-N 2.98Å
820	G	27.4	Very low	29.6	Very low	69 Å²	69	120.2 Å²	120.2	71%	0.711	73%	0.726	S	S	*	*			trans	140.6	-6.1	172.8	0	0	0	0	0	118.7	N822	G820-N822 PolarHBondContact O-N 2.88Å
821	N	26.7	Very low	29.5	Very low	171 Å²	171	124.2 Å²	124.2	91%	0.914	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	7.5	-174.1	-93.9	4.7	0	0	0	116.4
822	N	32.4	Very low	29.5	Very low	164 Å²	164	131 Å²	131	88%	0.877	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	1	-163.7	-80.1	9.9	0	0	0	117.2	G820	G820-N822 PolarHBondContact O-N 2.88Å
823	C	31.4	Very low	29.5	Very low	64 Å²	64	129.3 Å²	129.3	43%	0.432	75%	0.751	S	S	.	*			trans	-94.7	119.6	171.5	-163.3	0	0	0	0	112.2	C825	C823-C825 HydrophobicContact CB-CB 4.48Å; C823-C825 WeakPolarHBondContact CB-SG 3.48Å; C823-C825 PolarHBondContact O-N 3.44Å; C823-C825 WeakPolarHBondContact SG-CB 3.43Å; C823-C825 CovalentContact SG-SG 2.05Å; C823-C825 PolarHBondContact SG-SG 2.92Å
824	S	39	Very low	29.4	Very low	124 Å²	124	131.4 Å²	131.4	87%	0.867	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	5.8	173.3	52.2	0	0	0	0	114.1	A826	S824-A826 VanDerWaalsContact C-N 3.35Å; S824-A826 PolarHBondContact O-N 3.18Å
825	C	34.7	Very low	29.3	Very low	36 Å²	36	124.9 Å²	124.9	24%	0.243	73%	0.725	C	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-3.1	-172.3	53.5	0	0	0	0	115.6	C823 S827 S828	C823-C825 HydrophobicContact CB-CB 4.48Å; C823-C825 WeakPolarHBondContact CB-SG 3.48Å; C823-C825 PolarHBondContact O-N 3.44Å; C823-C825 WeakPolarHBondContact SG-CB 3.43Å; C823-C825 CovalentContact SG-SG 2.05Å; C823-C825 PolarHBondContact SG-SG 2.92Å; C825-S827 PolarHBondContact O-N 2.96Å; C825-S828 PolarHBondContact O-N 2.86Å; C825-S828 PolarHBondContact O-OG 3.13Å
826	A	36.6	Very low	29.4	Very low	102 Å²	102	120.1 Å²	120.1	84%	0.843	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	7.5	-164.6	0	0	0	0	0	117	S824	S824-A826 VanDerWaalsContact C-N 3.35Å; S824-A826 PolarHBondContact O-N 3.18Å
827	S	37.9	Very low	29.6	Very low	119 Å²	119	114.3 Å²	114.3	83%	0.832	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	-0.2	-178.4	60.8	0	0	0	0	115.2	C825	C825-S827 PolarHBondContact O-N 2.96Å
828	S	34.9	Very low	29.9	Very low	91 Å²	91	116.2 Å²	116.2	64%	0.636	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	-14.8	-171.8	53.2	0	0	0	0	116.2	C825 G830	C825-S828 PolarHBondContact O-N 2.86Å; C825-S828 PolarHBondContact O-OG 3.13Å; S828-G830 PolarHBondContact O-N 2.78Å
829	C	30.2	Very low	30.1	Very low	95 Å²	95	116.4 Å²	116.4	64%	0.642	70%	0.703	S	S	*	*			trans	-75.7	106.4	173.5	-74.3	0	0	0	0	110.9
830	G	29.4	Very low	30.4	Very low	62 Å²	62	109.3 Å²	109.3	64%	0.639	69%	0.694	S	S	*	*			trans	-67.8	158.4	-178.5	0	0	0	0	0	114.6	S828 Y832	S828-G830 PolarHBondContact O-N 2.78Å; G830-Y832 PolarHBondContact O-N 3.32Å
831	T	26.2	Very low	30.4	Very low	131 Å²	131	110.4 Å²	110.4	80%	0.804	69%	0.69	S	S	*	*			trans	-68.5	118.6	-177.1	48.5	0	0	0	0	113.4	S833	T831-S833 PolarHBondContact O-N 2.83Å
832	Y	26.3	Very low	30.3	Very low	233 Å²	233	106.7 Å²	106.7	91%	0.914	68%	0.677	S	S	*	*			trans	-80.7	85.3	157.3	-85.1	-86.1	0	0	0	110.1	G830 L834	G830-Y832 PolarHBondContact O-N 3.32Å; Y832-L834 PolarHBondContact O-N 2.8Å
833	S	26.1	Very low	30.1	Very low	106 Å²	106	109.3 Å²	109.3	74%	0.741	68%	0.681	S	S	*	*			trans	-85.5	90.8	174.4	57.5	0	0	0	0	111	T831	T831-S833 PolarHBondContact O-N 2.83Å
834	L	27	Very low	29.9	Very low	134 Å²	134	116.2 Å²	116.2	70%	0.702	70%	0.698	S	S	*	*			trans	-67.3	138.2	167.9	-74.5	170.4	0	0	0	110.4	Y832	Y832-L834 PolarHBondContact O-N 2.8Å
835	S	25	Very low	29.4	Very low	44 Å²	44	118 Å²	118	31%	0.308	70%	0.696	S	S	.	*			trans	-83.8	146.8	-175.6	73.7	0	0	0	0	111.9	S837 E838	S835-S837 WeakPolarHBondContact CB-OG 3.35Å; S835-S837 PolarHBondContact O-N 3.44Å; S835-S837 PolarHBondContact OG-OG 3.48Å; S835-E838 WeakPolarHBondContact CB-OE2 3.42Å; S835-E838 PolarHBondContact N-OE2 3.03Å; S835-E838 PolarHBondContact O-N 3.34Å; S835-E838 VanDerWaalsContact OG-CD 3.32Å; S835-E838 WeakPolarHBondContact OG-CG 3.46Å; S835-E838 PolarHBondContact OG-OE2 3.16Å
836	S	28.1	Very low	29.1	Very low	119 Å²	119	123.4 Å²	123.4	83%	0.832	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-16.3	176.5	-52.2	0	0	0	0	113.7
837	S	29.6	Very low	28.7	Very low	89 Å²	89	128.8 Å²	128.8	62%	0.622	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-24.7	173.1	19.1	0	0	0	0	114.3	S835	S835-S837 WeakPolarHBondContact CB-OG 3.35Å; S835-S837 PolarHBondContact O-N 3.44Å; S835-S837 PolarHBondContact OG-OG 3.48Å
838	E	30.3	Very low	28.3	Very low	112 Å²	112	132.7 Å²	132.7	52%	0.523	72%	0.721	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90	-29.6	-172.9	-71.1	163	117.7	0	0	112.8	S835 A840 S841	S835-E838 WeakPolarHBondContact CB-OE2 3.42Å; S835-E838 PolarHBondContact N-OE2 3.03Å; S835-E838 PolarHBondContact O-N 3.34Å; S835-E838 VanDerWaalsContact OG-CD 3.32Å; S835-E838 WeakPolarHBondContact OG-CG 3.46Å; S835-E838 PolarHBondContact OG-OE2 3.16Å; E838-A840 PolarHBondContact O-N 2.91Å; E838-A840 VanDerWaalsContact O-N 3.17Å; E838-S841 PolarHBondContact O-N 3.42Å
839	L	29.5	Very low	28.4	Very low	141 Å²	141	131.8 Å²	131.8	74%	0.738	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-20.4	177.3	-92.2	73.8	0	0	0	113.9	S841	L839-S841 VanDerWaalsContact C-N 3.25Å; L839-S841 PolarHBondContact O-N 3.36Å
840	A	30.2	Very low	28.6	Very low	90 Å²	90	132.6 Å²	132.6	74%	0.744	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-11.6	179.8	0	0	0	0	0	114.1	E838	E838-A840 PolarHBondContact O-N 2.91Å; E838-A840 VanDerWaalsContact O-N 3.17Å
841	S	26.6	Very low	29.2	Very low	91 Å²	91	132.9 Å²	132.9	64%	0.636	71%	0.71	S	S	*	*	S	Bend	trans	-131.6	27.7	-153.5	-58.4	0	0	0	0	115.5	E838 L839	E838-S841 PolarHBondContact O-N 3.42Å; L839-S841 VanDerWaalsContact C-N 3.25Å; L839-S841 PolarHBondContact O-N 3.36Å
842	S	24.9	Very low	30.1	Very low	93 Å²	93	129.7 Å²	129.7	65%	0.65	70%	0.697	S	S	*	*			trans	-148.5	117.4	173.7	-94.8	0	0	0	0	116.1	R844	S842-R844 PolarHBondContact O-N 3.34Å
843	K	28.5	Very low	30.9	Very low	220 Å²	220	124.7 Å²	124.7	96%	0.957	68%	0.677	S	S	*	*			trans	-78	46.3	166.6	-64.1	-177.8	175.8	-179.6	0	112.1
844	R	26.1	Very low	32.1	Very low	209 Å²	209	120.3 Å²	120.3	79%	0.789	65%	0.647	S	S	*	*			trans	-103.8	112.3	178	-74.5	-166.8	177.3	-158.8	0.8	110.6	S842 H846	S842-R844 PolarHBondContact O-N 3.34Å; R844-H846 PolarHBondContact O-N 3.46Å
845	I	28.3	Very low	32.9	Very low	161 Å²	161	120.5 Å²	120.5	83%	0.826	65%	0.648	S	S	*	*			trans	-72.8	105.3	173.5	-56.8	167.9	0	0	0	107.5
846	H	29.4	Very low	33.8	Very low	150 Å²	150	122.1 Å²	122.1	69%	0.694	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-71.5	132.2	159.8	-87.9	-87.7	0	0	0	108.6	R844 Q850	R844-H846 PolarHBondContact O-N 3.46Å; H846-Q850 PolarHBondContact CE1-OE1 3.13Å; H846-Q850 PolarHBondContact ND1-OE1 3.18Å
847	R	27.3	Very low	35.3	Very low	214 Å²	214	118 Å²	118	81%	0.808	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-86.1	142.7	170.3	-72.1	179.1	171.3	173.2	-4.2	108.8
848	E	30.7	Very low	36.1	Very low	202 Å²	202	120.2 Å²	120.2	94%	0.944	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	143	166.6	-64.8	173.3	106.6	0	0	110.2
849	G	35.9	Very low	36.5	Very low	72 Å²	72	120.6 Å²	120.6	74%	0.742	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.7	14.7	174.3	0	0	0	0	0	117.1	T851	G849-T851 PolarHBondContact O-N 3.39Å
850	Q	35.2	Very low	37.3	Very low	112 Å²	112	119.9 Å²	119.9	52%	0.523	63%	0.63	S	S	.	*			trans	-76.8	113.6	165.6	-69.6	-167.9	-73.3	0	0	111	H846	H846-Q850 PolarHBondContact CE1-OE1 3.13Å; H846-Q850 PolarHBondContact ND1-OE1 3.18Å
851	T	42.2	Very low	37.7	Very low	68 Å²	68	119.8 Å²	119.8	42%	0.417	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.1	151	161.5	43.5	0	0	0	0	110.8	G849 E860 H861	G849-T851 PolarHBondContact O-N 3.39Å; T851-E860 WeakPolarHBondContact CB-OE2 3.46Å; T851-E860 HydrophobicContact CG2-CB 4.17Å; T851-E860 WeakPolarHBondContact CG2-OE2 3.36Å; T851-E860 PolarHBondContact OG1-OE2 3.37Å; T851-H861 CarbonylContact C-O 3.45Å; T851-H861 WeakPolarHBondContact CA-O 3.47Å
852	A	44.3	Very low	38	Very low	63 Å²	63	119.7 Å²	119.7	52%	0.521	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.9	134.4	169.9	0	0	0	0	0	109.3	H861	A852-H861 PolarHBondContact N-O 3.08Å; A852-H861 PolarHBondContact O-N 3.22Å
853	Y	44.2	Very low	38.4	Very low	128 Å²	128	120.3 Å²	120.3	50%	0.502	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.4	135.5	178.9	-171.3	-102.8	0	0	0	111.3	D855 H858 E860	Y853-D855 WeakPolarHBondContact CD1-OD1 3.29Å; Y853-H858 VanDerWaalsContact CE2-O 3.29Å; Y853-H858 WeakPolarHBondContact CE2-O 3.44Å; Y853-H858 AromaticContact CZ-ND1 3.85Å; Y853-H858 WeakPolarHBondContact OH-CA 3.31Å; Y853-H858 WeakPolarHBondContact OH-CB 3.38Å; Y853-H858 PolarHBondContact OH-ND1 2.95Å; Y853-H858 PolarHBondContact OH-O 3.48Å; Y853-E860 HydrophobicContact CD2-CG 4.2Å
854	C	50	Low	38.6	Very low	15 Å²	15	116.2 Å²	116.2	10%	0.101	61%	0.61	C	S	.	*			trans	-95.3	94.1	-178.3	177.6	0	0	0	0	111	A856 C857 H858 E859	C854-A856 PolarHBondContact O-N 3.41Å; C854-C857 HydrophobicContact CB-CB 4.32Å; C854-C857 WeakPolarHBondContact CB-SG 3Å; C854-C857 CarbonylContact O-C 3.59Å; C854-C857 PolarHBondContact O-N 2.92Å; C854-C857 WeakPolarHBondContact SG-CB 3.25Å; C854-C857 PolarHBondContact SG-N 2.93Å; C854-C857 CovalentContact SG-SG 2.04Å; C854-C857 PolarHBondContact SG-SG 3.44Å; C854-H858 WeakPolarHBondContact O-CA 3.45Å; C854-H858 PolarHBondContact O-N 2.65Å; C854-E859 WeakPolarHBondContact CB-O 3.39Å; C854-E859 PolarHBondContact N-O 2.78Å
855	D	43.6	Very low	38.8	Very low	137 Å²	137	115.1 Å²	115.1	73%	0.733	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-19.7	176.2	-73.2	-26.9	0	0	0	113.8	Y853	Y853-D855 WeakPolarHBondContact CD1-OD1 3.29Å
856	A	45.2	Very low	38.9	Very low	78 Å²	78	112.4 Å²	112.4	65%	0.645	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-11.5	177.2	0	0	0	0	0	114.6	C854	C854-A856 PolarHBondContact O-N 3.41Å
857	C	58.3	Low	38.9	Very low	32 Å²	32	112.2 Å²	112.2	22%	0.216	62%	0.618	C	S	.	*	T	Hydrogen-bonded Turn	trans	-145.3	-1.4	-174.1	66	0	0	0	0	115.2	C854 E859 H861	C854-C857 HydrophobicContact CB-CB 4.32Å; C854-C857 WeakPolarHBondContact CB-SG 3Å; C854-C857 CarbonylContact O-C 3.59Å; C854-C857 PolarHBondContact O-N 2.92Å; C854-C857 WeakPolarHBondContact SG-CB 3.25Å; C854-C857 PolarHBondContact SG-N 2.93Å; C854-C857 CovalentContact SG-SG 2.04Å; C854-C857 PolarHBondContact SG-SG 3.44Å; C857-E859 PolarHBondContact O-N 3.46Å; C857-E859 VanDerWaalsContact O-N 3.15Å; C857-H861 PolarHBondContact SG-NE2 2.97Å; C857-H861 VanDerWaalsContact SG-NE2 3.42Å
858	H	48.3	Very low	39.3	Very low	136 Å²	136	106.3 Å²	106.3	63%	0.63	60%	0.603	S	S	*	*	S	Bend	trans	58.6	14.4	178.2	-64.3	-62.5	0	0	0	116.9	Y853 C854	Y853-H858 VanDerWaalsContact CE2-O 3.29Å; Y853-H858 WeakPolarHBondContact CE2-O 3.44Å; Y853-H858 AromaticContact CZ-ND1 3.85Å; Y853-H858 WeakPolarHBondContact OH-CA 3.31Å; Y853-H858 WeakPolarHBondContact OH-CB 3.38Å; Y853-H858 PolarHBondContact OH-ND1 2.95Å; Y853-H858 PolarHBondContact OH-O 3.48Å; C854-H858 WeakPolarHBondContact O-CA 3.45Å; C854-H858 PolarHBondContact O-N 2.65Å
859	E	38.3	Very low	39.5	Very low	120 Å²	120	102.5 Å²	102.5	56%	0.561	59%	0.588	S	S	*	*			trans	-106	162.5	176.1	-67.8	-170.6	159.7	0	0	112.8	C854 C857	C854-E859 WeakPolarHBondContact CB-O 3.39Å; C854-E859 PolarHBondContact N-O 2.78Å; C857-E859 PolarHBondContact O-N 3.46Å; C857-E859 VanDerWaalsContact O-N 3.15Å
860	E	45.2	Very low	39.6	Very low	126 Å²	126	104 Å²	104	59%	0.589	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92	140.8	170.6	-78.5	-174.6	-146.7	0	0	111.5	T851 Y853	T851-E860 WeakPolarHBondContact CB-OE2 3.46Å; T851-E860 HydrophobicContact CG2-CB 4.17Å; T851-E860 WeakPolarHBondContact CG2-OE2 3.36Å; T851-E860 PolarHBondContact OG1-OE2 3.37Å; Y853-E860 HydrophobicContact CD2-CG 4.2Å
861	H	38.8	Very low	39.8	Very low	88 Å²	88	107.2 Å²	107.2	41%	0.407	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.1	131	179.4	-62.5	-13.5	0	0	0	110.8	T851 A852 C857	T851-H861 CarbonylContact C-O 3.45Å; T851-H861 WeakPolarHBondContact CA-O 3.47Å; A852-H861 PolarHBondContact N-O 3.08Å; A852-H861 PolarHBondContact O-N 3.22Å; C857-H861 PolarHBondContact SG-NE2 2.97Å; C857-H861 VanDerWaalsContact SG-NE2 3.42Å
862	C	33.3	Very low	39.5	Very low	90 Å²	90	107 Å²	107	61%	0.608	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.7	136.7	168.3	-68.2	0	0	0	0	110.6
863	S	34.2	Very low	39.2	Very low	106 Å²	106	109 Å²	109	74%	0.741	58%	0.582	S	S	*	*			trans	-73.4	146.1	163	50.5	0	0	0	0	110.6
864	V	31.6	Very low	39.1	Very low	134 Å²	134	105.1 Å²	105.1	81%	0.812	57%	0.574	S	S	*	*			trans	-131.8	136.2	176.2	-178	0	0	0	0	107.8
865	E	30.3	Very low	38.5	Very low	185 Å²	185	108.2 Å²	108.2	86%	0.864	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-64.6	147.6	179.4	-67.1	-165.2	132.7	0	0	112.4	L867	E865-L867 PolarHBondContact O-N 3.04Å
866	A	29.6	Very low	38	Very low	104 Å²	104	106.7 Å²	106.7	86%	0.86	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-71.8	120.7	179.2	0	0	0	0	0	111.3	D868	A866-D868 PolarHBondContact O-N 2.67Å
867	L	29.9	Very low	37.6	Very low	146 Å²	146	110.5 Å²	110.5	76%	0.764	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-61.4	126.4	176.3	-84.6	159.1	0	0	0	112	E865 L869	E865-L867 PolarHBondContact O-N 3.04Å; L867-L869 WeakPolarHBondContact O-CD1 3.4Å; L867-L869 PolarHBondContact O-N 2.95Å; L867-L869 VanDerWaalsContact O-N 3.13Å
868	D	35.8	Very low	36.5	Very low	91 Å²	91	119.1 Å²	119.1	49%	0.487	61%	0.612	S	S	.	*			trans	-71.4	100.7	171.6	176.1	-5.5	0	0	0	110.8	A866 D870 R871 V872	A866-D868 PolarHBondContact O-N 2.67Å; D868-D870 VanDerWaalsContact C-N 3.27Å; D868-D870 PolarHBondContact O-N 2.94Å; D868-D870 PolarHBondContact OD1-N 2.68Å; D868-R871 HydrophobicContact CB-CB 3.96Å; D868-R871 VanDerWaalsContact CG-CB 3.45Å; D868-R871 PolarHBondContact O-N 2.89Å; D868-R871 PolarHBondContact OD1-N 3.01Å; D868-R871 VanDerWaalsContact OD2-CB 3.27Å; D868-R871 WeakPolarHBondContact OD2-CB 3.08Å; D868-V872 WeakPolarHBondContact O-CG2 3.42Å; D868-V872 PolarHBondContact O-N 3.47Å; D868-V872 VanDerWaalsContact O-N 3.11Å
869	L	35.6	Very low	35.8	Very low	121 Å²	121	116.9 Å²	116.9	63%	0.634	60%	0.602	S	S	*	*	H	α-helix	trans	-62.2	-28.3	178.6	-89	84.8	0	0	0	113.7	L867 V872 K873	L867-L869 WeakPolarHBondContact O-CD1 3.4Å; L867-L869 PolarHBondContact O-N 2.95Å; L867-L869 VanDerWaalsContact O-N 3.13Å; L869-V872 PolarHBondContact O-N 2.85Å; L869-K873 WeakPolarHBondContact O-CG 3.22Å; L869-K873 PolarHBondContact O-N 3.36Å
870	D	38.3	Very low	35.3	Very low	105 Å²	105	114.6 Å²	114.6	56%	0.561	60%	0.604	S	S	*	*	H	α-helix	trans	-81.3	-31.1	-178.2	-73.7	-26.3	0	0	0	111.2	D868 K873 S874	D868-D870 VanDerWaalsContact C-N 3.27Å; D868-D870 PolarHBondContact O-N 2.94Å; D868-D870 PolarHBondContact OD1-N 2.68Å; D870-K873 PolarHBondContact O-N 3.02Å; D870-K873 WeakPolarHBondContact OD1-CD 3.4Å; D870-K873 WeakPolarHBondContact OD1-CE 3.46Å; D870-K873 IonicContact OD1-NZ 3.92Å; D870-K873 PolarHBondContact OD1-NZ 2.72Å; D870-S874 VanDerWaalsContact O-CB 3.29Å; D870-S874 WeakPolarHBondContact O-CB 3.05Å; D870-S874 PolarHBondContact O-N 2.8Å
871	R	38.8	Very low	34.9	Very low	178 Å²	178	111.9 Å²	111.9	67%	0.672	60%	0.603	S	S	*	*	H	α-helix	trans	-64.1	-38.5	164.7	-173.2	172.3	-177.5	-177.7	-1.3	112.1	D868 S874 I875	D868-R871 HydrophobicContact CB-CB 3.96Å; D868-R871 VanDerWaalsContact CG-CB 3.45Å; D868-R871 PolarHBondContact O-N 2.89Å; D868-R871 PolarHBondContact OD1-N 3.01Å; D868-R871 VanDerWaalsContact OD2-CB 3.27Å; D868-R871 WeakPolarHBondContact OD2-CB 3.08Å; R871-S874 WeakPolarHBondContact O-CB 3.18Å; R871-S874 PolarHBondContact O-N 2.79Å; R871-I875 WeakPolarHBondContact O-CG1 3.28Å; R871-I875 PolarHBondContact O-N 3.23Å; R871-I875 VanDerWaalsContact O-N 3.13Å
872	V	36.8	Very low	35.1	Very low	64 Å²	64	109.9 Å²	109.9	39%	0.388	60%	0.595	S	S	.	*	H	α-helix	trans	-64.9	-46.5	173.5	174.3	0	0	0	0	111.5	D868 L869 S874 I875 I876	D868-V872 WeakPolarHBondContact O-CG2 3.42Å; D868-V872 PolarHBondContact O-N 3.47Å; D868-V872 VanDerWaalsContact O-N 3.11Å; L869-V872 PolarHBondContact O-N 2.85Å; V872-S874 VanDerWaalsContact C-N 3.32Å; V872-S874 PolarHBondContact O-N 2.83Å; V872-I875 PolarHBondContact O-N 3.38Å; V872-I876 HydrophobicContact CG1-CD1 3.92Å; V872-I876 WeakPolarHBondContact O-CG1 3.3Å; V872-I876 PolarHBondContact O-N 2.82Å
873	K	37.8	Very low	35.8	Very low	104 Å²	104	109.5 Å²	109.5	45%	0.452	59%	0.587	S	S	.	*	H	α-helix	trans	-57.9	-42.7	173.5	-72	170.9	-159.6	155.7	0	112.3	L869 D870 I875 I876 Q877	L869-K873 WeakPolarHBondContact O-CG 3.22Å; L869-K873 PolarHBondContact O-N 3.36Å; D870-K873 PolarHBondContact O-N 3.02Å; D870-K873 WeakPolarHBondContact OD1-CD 3.4Å; D870-K873 WeakPolarHBondContact OD1-CE 3.46Å; D870-K873 IonicContact OD1-NZ 3.92Å; D870-K873 PolarHBondContact OD1-NZ 2.72Å; K873-I875 VanDerWaalsContact C-N 3.27Å; K873-I875 PolarHBondContact O-N 2.81Å; K873-I876 PolarHBondContact O-N 2.84Å; K873-Q877 WeakPolarHBondContact O-CB 3.47Å; K873-Q877 WeakPolarHBondContact O-CG 3.31Å; K873-Q877 PolarHBondContact O-N 2.9Å
874	S	41.2	Very low	36.2	Very low	47 Å²	47	107 Å²	107	33%	0.329	57%	0.568	S	S	.	*	H	α-helix	trans	-60	-36.2	177.9	-179.6	0	0	0	0	112.4	D870 R871 V872 R878	D870-S874 VanDerWaalsContact O-CB 3.29Å; D870-S874 WeakPolarHBondContact O-CB 3.05Å; D870-S874 PolarHBondContact O-N 2.8Å; R871-S874 WeakPolarHBondContact O-CB 3.18Å; R871-S874 PolarHBondContact O-N 2.79Å; V872-S874 VanDerWaalsContact C-N 3.32Å; V872-S874 PolarHBondContact O-N 2.83Å; S874-R878 WeakPolarHBondContact O-CB 3.36Å; S874-R878 WeakPolarHBondContact O-CD 3.5Å; S874-R878 VanDerWaalsContact O-CG 3.23Å; S874-R878 WeakPolarHBondContact O-CG 3.27Å; S874-R878 PolarHBondContact O-N 3.07Å
875	I	37	Very low	36.9	Very low	80 Å²	80	101.9 Å²	101.9	41%	0.41	54%	0.536	S	S	.	.	H	α-helix	trans	-69.1	-49.2	173.9	-67.8	163.1	0	0	0	110.5	R871 V872 K873 Q877 R878 Q879	R871-I875 WeakPolarHBondContact O-CG1 3.28Å; R871-I875 PolarHBondContact O-N 3.23Å; R871-I875 VanDerWaalsContact O-N 3.13Å; V872-I875 PolarHBondContact O-N 3.38Å; K873-I875 VanDerWaalsContact C-N 3.27Å; K873-I875 PolarHBondContact O-N 2.81Å; I875-Q877 PolarHBondContact O-N 3.27Å; I875-R878 CarbonylContact O-C 3.57Å; I875-R878 PolarHBondContact O-N 2.95Å; I875-R878 VanDerWaalsContact O-N 3.08Å; I875-Q879 HydrophobicContact CG2-CG 4.47Å; I875-Q879 WeakPolarHBondContact O-CG 3.07Å; I875-Q879 PolarHBondContact O-N 2.76Å; I875-Q879 VanDerWaalsContact O-N 3.12Å
876	I	34	Very low	37.6	Very low	106 Å²	106	97.4 Å²	97.4	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-46.6	180	-65.5	166.4	0	0	0	111.2	V872 K873 R878 Q879 A880	V872-I876 HydrophobicContact CG1-CD1 3.92Å; V872-I876 WeakPolarHBondContact O-CG1 3.3Å; V872-I876 PolarHBondContact O-N 2.82Å; K873-I876 PolarHBondContact O-N 2.84Å; I876-R878 PolarHBondContact O-N 3.49Å; I876-Q879 PolarHBondContact O-N 3.06Å; I876-A880 PolarHBondContact O-N 2.83Å
877	Q	35.9	Very low	38.3	Very low	158 Å²	158	98.8 Å²	98.8	74%	0.738	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-23	177.3	-72.9	-179.5	-23.8	0	0	113.3	K873 I875	K873-Q877 WeakPolarHBondContact O-CB 3.47Å; K873-Q877 WeakPolarHBondContact O-CG 3.31Å; K873-Q877 PolarHBondContact O-N 2.9Å; I875-Q877 PolarHBondContact O-N 3.27Å
878	R	35.4	Very low	38.9	Very low	212 Å²	212	92.3 Å²	92.3	80%	0.8	47%	0.467	S	S	*	.	H	α-helix	trans	-89.8	-6.3	173.4	-72.5	174.1	175.4	-168.7	-0.9	113.9	S874 I875 I876	S874-R878 WeakPolarHBondContact O-CB 3.36Å; S874-R878 WeakPolarHBondContact O-CD 3.5Å; S874-R878 VanDerWaalsContact O-CG 3.23Å; S874-R878 WeakPolarHBondContact O-CG 3.27Å; S874-R878 PolarHBondContact O-N 3.07Å; I875-R878 CarbonylContact O-C 3.57Å; I875-R878 PolarHBondContact O-N 2.95Å; I875-R878 VanDerWaalsContact O-N 3.08Å; I876-R878 PolarHBondContact O-N 3.49Å
879	Q	34.3	Very low	39.3	Very low	89 Å²	89	90.9 Å²	90.9	42%	0.416	46%	0.459	S	S	.	.			trans	-112	5.5	-179	-72.2	178.6	-11.9	0	0	113.4	I875 I876 A881	I875-Q879 HydrophobicContact CG2-CG 4.47Å; I875-Q879 WeakPolarHBondContact O-CG 3.07Å; I875-Q879 PolarHBondContact O-N 2.76Å; I875-Q879 VanDerWaalsContact O-N 3.12Å; I876-Q879 PolarHBondContact O-N 3.06Å; Q879-A881 PolarHBondContact O-N 3.42Å
880	A	28.1	Very low	39.5	Very low	73 Å²	73	89.1 Å²	89.1	60%	0.603	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	29.4	-173.4	0	0	0	0	0	116.6	I876	I876-A880 PolarHBondContact O-N 2.83Å
881	A	35.2	Very low	39.7	Very low	68 Å²	68	87 Å²	87	56%	0.562	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.5	169.1	0	0	0	0	0	113	Q879 L883	Q879-A881 PolarHBondContact O-N 3.42Å; A881-L883 PolarHBondContact O-N 2.83Å
882	D	44.6	Very low	39.6	Very low	46 Å²	46	79.3 Å²	79.3	25%	0.246	42%	0.422	C	S	.	.			trans	-77.5	38.9	-168.6	-61.8	-20.2	0	0	0	114.1	R189 I886	R189-D882 IonicContact NH2-OD1 2.84Å; R189-D882 IonicContact NH2-OD2 3.96Å; D882-I886 HydrophobicContact CB-CD1 4.21Å; D882-I886 WeakPolarHBondContact O-CG1 3.46Å; D882-I886 PolarHBondContact O-N 2.97Å
883	L	47.8	Very low	39.8	Very low	83 Å²	83	84.9 Å²	84.9	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-54.6	-44.1	-172.6	-85.4	85.9	0	0	0	115.2	A881 I886 R887 W962	A881-L883 PolarHBondContact O-N 2.83Å; L883-I886 PolarHBondContact O-N 2.59Å; L883-R887 WeakPolarHBondContact O-CB 3.46Å; L883-R887 PolarHBondContact O-N 3.45Å; L883-W962 HydrophobicContact CD2-CZ3 3.97Å
884	P	42.5	Very low	39.7	Very low	53 Å²	53	84.2 Å²	84.2	34%	0.344	45%	0.448	S	S	.	.	H	α-helix	trans	-65.7	-43.1	-173.6	-23.9	35.2	0	0	0	113.5	I245 R887 A888	I245-P884 HydrophobicContact CD1-CB 4.11Å; I245-P884 HydrophobicContact CG1-CB 4.34Å; P884-R887 PolarHBondContact O-N 3Å; P884-A888 WeakPolarHBondContact O-CB 3.48Å; P884-A888 PolarHBondContact O-N 3.31Å
885	L	46.9	Very low	39.5	Very low	27 Å²	27	86.9 Å²	86.9	14%	0.141	46%	0.457	C	S	.	.	H	α-helix	trans	-70.5	-37.8	179.3	-177.2	60.4	0	0	0	111.3	E191 Y194 A888 L889	E191-L885 HydrophobicContact CG-CD2 4.21Å; Y194-L885 HydrophobicContact CE2-CD1 4.15Å; L885-A888 WeakPolarHBondContact O-CB 3.27Å; L885-A888 PolarHBondContact O-N 2.85Å; L885-L889 HydrophobicContact CD1-CD1 4.27Å; L885-L889 HydrophobicContact CD1-CG 4.44Å; L885-L889 HydrophobicContact CG-CD1 4.06Å; L885-L889 WeakPolarHBondContact O-CB 3.43Å; L885-L889 VanDerWaalsContact O-CG 3.31Å; L885-L889 WeakPolarHBondContact O-CG 3.45Å; L885-L889 PolarHBondContact O-N 3.38Å
886	I	43.7	Very low	39.2	Very low	90 Å²	90	91.9 Å²	91.9	46%	0.462	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-44	173.6	-64.6	170.5	0	0	0	110.4	D882 L883 A888 L889 C890	D882-I886 HydrophobicContact CB-CD1 4.21Å; D882-I886 WeakPolarHBondContact O-CG1 3.46Å; D882-I886 PolarHBondContact O-N 2.97Å; L883-I886 PolarHBondContact O-N 2.59Å; I886-A888 VanDerWaalsContact C-N 3.31Å; I886-A888 PolarHBondContact O-N 2.94Å; I886-L889 PolarHBondContact O-N 3.11Å; I886-C890 VanDerWaalsContact O-CB 3.27Å; I886-C890 WeakPolarHBondContact O-CB 3.45Å; I886-C890 PolarHBondContact O-N 3.49Å; I886-C890 PolarHBondContact O-SG 2.73Å; I886-C890 VanDerWaalsContact O-SG 3.33Å
887	R	43.9	Very low	38.9	Very low	133 Å²	133	91.3 Å²	91.3	50%	0.502	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-38.9	176.1	-174.6	-178.4	-177	-161.5	0.3	111.8	D248 L883 P884 S891	D248-R887 IonicContact OD1-NH1 3.4Å; D248-R887 PolarHBondContact OD1-NH1 3.25Å; D248-R887 IonicContact OD2-NH1 2.66Å; D248-R887 PolarHBondContact OD2-NH1 3.24Å; L883-R887 WeakPolarHBondContact O-CB 3.46Å; L883-R887 PolarHBondContact O-N 3.45Å; P884-R887 PolarHBondContact O-N 3Å; R887-S891 WeakPolarHBondContact O-CB 3.08Å; R887-S891 PolarHBondContact O-N 3.33Å; R887-S891 PolarHBondContact O-OG 3.13Å; R887-S891 VanDerWaalsContact O-OG 3.09Å
888	A	43	Very low	38.4	Very low	10 Å²	10	88.4 Å²	88.4	8%	0.083	48%	0.482	C	S	.	.	H	α-helix	trans	-61.9	-59.5	172	0	0	0	0	0	111.5	H241 P884 L885 I886 C890 S891	H241-A888 HydrophobicContact CB-CB 3.76Å; H241-A888 PolarHBondContact CE1-O 3.35Å; P884-A888 WeakPolarHBondContact O-CB 3.48Å; P884-A888 PolarHBondContact O-N 3.31Å; L885-A888 WeakPolarHBondContact O-CB 3.27Å; L885-A888 PolarHBondContact O-N 2.85Å; I886-A888 VanDerWaalsContact C-N 3.31Å; I886-A888 PolarHBondContact O-N 2.94Å; A888-C890 VanDerWaalsContact C-N 3.31Å; A888-C890 PolarHBondContact O-N 3.26Å; A888-S891 PolarHBondContact O-N 2.99Å; A888-S891 PolarHBondContact O-OG 3.37Å
889	L	44.8	Very low	37.9	Very low	62 Å²	62	84.4 Å²	84.4	33%	0.325	48%	0.481	S	S	.	.	H	α-helix	trans	-59.6	-37.1	-177.8	-69.5	166.6	0	0	0	113.2	F237 L885 I886 S891	F237-L889 HydrophobicContact CE2-CD2 3.9Å; F237-L889 HydrophobicContact CZ-CD2 3.7Å; F237-L889 HydrophobicContact CZ-CG 4.4Å; L885-L889 HydrophobicContact CD1-CD1 4.27Å; L885-L889 HydrophobicContact CD1-CG 4.44Å; L885-L889 HydrophobicContact CG-CD1 4.06Å; L885-L889 WeakPolarHBondContact O-CB 3.43Å; L885-L889 VanDerWaalsContact O-CG 3.31Å; L885-L889 WeakPolarHBondContact O-CG 3.45Å; L885-L889 PolarHBondContact O-N 3.38Å; I886-L889 PolarHBondContact O-N 3.11Å; L889-S891 VanDerWaalsContact C-N 3.28Å; L889-S891 PolarHBondContact O-N 2.9Å
890	C	40.2	Very low	37.6	Very low	84 Å²	84	89.7 Å²	89.7	57%	0.568	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.7	177.3	-68.3	0	0	0	0	114.4	I886 A888	I886-C890 VanDerWaalsContact O-CB 3.27Å; I886-C890 WeakPolarHBondContact O-CB 3.45Å; I886-C890 PolarHBondContact O-N 3.49Å; I886-C890 PolarHBondContact O-SG 2.73Å; I886-C890 VanDerWaalsContact O-SG 3.33Å; A888-C890 VanDerWaalsContact C-N 3.31Å; A888-C890 PolarHBondContact O-N 3.26Å
891	S	41.6	Very low	37.5	Very low	60 Å²	60	95.7 Å²	95.7	42%	0.42	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-4.4	176.4	65.2	0	0	0	0	113.8	R887 A888 L889 H893	R887-S891 WeakPolarHBondContact O-CB 3.08Å; R887-S891 PolarHBondContact O-N 3.33Å; R887-S891 PolarHBondContact O-OG 3.13Å; R887-S891 VanDerWaalsContact O-OG 3.09Å; A888-S891 PolarHBondContact O-N 2.99Å; A888-S891 PolarHBondContact O-OG 3.37Å; L889-S891 VanDerWaalsContact C-N 3.28Å; L889-S891 PolarHBondContact O-N 2.9Å; S891-H893 PolarHBondContact O-N 2.83Å
892	D	37	Very low	37.1	Very low	17 Å²	17	96.5 Å²	96.5	9%	0.091	51%	0.511	C	S	.	.			trans	-89.9	100.2	-178.4	-162.1	-24.3	0	0	0	112.9	R240 H241 T894 I895	R240-D892 IonicContact CZ-OD2 3.86Å; R240-D892 VanDerWaalsContact NH1-CG 3.3Å; R240-D892 IonicContact NH1-OD1 3.51Å; R240-D892 PolarHBondContact NH1-OD1 3.05Å; R240-D892 IonicContact NH1-OD2 3.78Å; R240-D892 PolarHBondContact NH1-OD2 2.86Å; H241-D892 IonicContact NE2-OD2 3.23Å; H241-D892 PolarHBondContact NE2-OD2 3.03Å; D892-T894 PolarHBondContact O-N 2.73Å; D892-T894 WeakPolarHBondContact OD1-CA 3.48Å; D892-T894 VanDerWaalsContact OD1-CB 3.31Å; D892-T894 WeakPolarHBondContact OD1-CB 3.41Å; D892-T894 PolarHBondContact OD1-N 2.96Å; D892-T894 PolarHBondContact OD1-OG1 3.12Å; D892-T894 PolarHBondContact OD2-OG1 3.26Å; D892-I895 HydrophobicContact CB-CD1 3.95Å; D892-I895 HydrophobicContact CB-CG1 4.04Å
893	H	40.6	Very low	36.4	Very low	180 Å²	180	96.7 Å²	96.7	83%	0.833	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-4.8	176	-52	-35.7	0	0	0	114.2	S891	S891-H893 PolarHBondContact O-N 2.83Å
894	T	36	Very low	35.6	Very low	90 Å²	90	97.4 Å²	97.4	55%	0.552	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-8.3	179.5	69.7	0	0	0	0	113.5	R240 D892 Q896	R240-T894 PolarHBondContact NH1-OG1 3.33Å; D892-T894 PolarHBondContact O-N 2.73Å; D892-T894 WeakPolarHBondContact OD1-CA 3.48Å; D892-T894 VanDerWaalsContact OD1-CB 3.31Å; D892-T894 WeakPolarHBondContact OD1-CB 3.41Å; D892-T894 PolarHBondContact OD1-N 2.96Å; D892-T894 PolarHBondContact OD1-OG1 3.12Å; D892-T894 PolarHBondContact OD2-OG1 3.26Å; T894-Q896 VanDerWaalsContact C-N 3.29Å; T894-Q896 PolarHBondContact O-N 3.06Å
895	I	37	Very low	35.2	Very low	103 Å²	103	98.8 Å²	98.8	53%	0.528	54%	0.535	S	S	.	.			trans	-74.1	80.8	174.2	-53	177.9	0	0	0	109.6	D892 S897	D892-I895 HydrophobicContact CB-CD1 3.95Å; D892-I895 HydrophobicContact CB-CG1 4.04Å; I895-S897 PolarHBondContact O-N 2.73Å
896	Q	31.7	Very low	34.6	Very low	185 Å²	185	102.1 Å²	102.1	86%	0.864	55%	0.55	S	S	*	.			trans	-66.6	119.3	172.6	-69.8	-169.5	-4.8	0	0	110.3	T894 S898	T894-Q896 VanDerWaalsContact C-N 3.29Å; T894-Q896 PolarHBondContact O-N 3.06Å; Q896-S898 PolarHBondContact O-N 2.87Å
897	S	26.2	Very low	34.1	Very low	94 Å²	94	103.1 Å²	103.1	66%	0.657	56%	0.555	S	S	*	*			trans	-69.1	110.3	-177.7	57.2	0	0	0	0	111.9	I895 T899	I895-S897 PolarHBondContact O-N 2.73Å; S897-T899 VanDerWaalsContact C-N 3.29Å; S897-T899 PolarHBondContact O-N 2.84Å
898	S	26.7	Very low	33.5	Very low	98 Å²	98	104.6 Å²	104.6	69%	0.685	56%	0.562	S	S	*	*			trans	-70.4	84.4	168.8	61.4	0	0	0	0	111	Q896 K900	Q896-S898 PolarHBondContact O-N 2.87Å; S898-K900 PolarHBondContact O-N 2.97Å
899	T	24.9	Very low	33.2	Very low	128 Å²	128	109.3 Å²	109.3	79%	0.785	58%	0.583	S	S	*	*	S	Bend	trans	39.3	67.1	154.7	57.4	0	0	0	0	117.1	S897	S897-T899 VanDerWaalsContact C-N 3.29Å; S897-T899 PolarHBondContact O-N 2.84Å
900	K	27.5	Very low	32.8	Very low	200 Å²	200	112 Å²	112	87%	0.87	59%	0.594	S	S	*	*	S	Bend	trans	179.2	-15.1	148.1	-105.7	163.3	-174.7	178.7	0	116.1	S898	S898-K900 PolarHBondContact O-N 2.97Å
901	Y	26.2	Very low	32.5	Very low	198 Å²	198	114.2 Å²	114.2	78%	0.776	60%	0.596	S	S	*	*	S	Bend	trans	-90.1	135.9	-176.8	-64.5	-84	0	0	0	112
902	C	26.2	Very low	32.3	Very low	85 Å²	85	118.2 Å²	118.2	57%	0.574	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-55.9	146.9	174.2	-65.3	0	0	0	0	111.1	E906	C902-E906 HydrophobicContact CB-CB 4.14Å
903	S	29.5	Very low	32.2	Very low	51 Å²	51	123.1 Å²	123.1	36%	0.357	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-60.3	150.9	175.3	63.9	0	0	0	0	111.3	S905 E906 L907	S903-S905 PolarHBondContact O-N 3.45Å; S903-E906 WeakPolarHBondContact CB-OE2 3.43Å; S903-E906 PolarHBondContact N-OE2 2.84Å; S903-E906 WeakPolarHBondContact O-CA 3.49Å; S903-E906 WeakPolarHBondContact O-CB 3.31Å; S903-E906 PolarHBondContact O-N 2.99Å; S903-E906 VanDerWaalsContact OG-CG 3.28Å; S903-E906 WeakPolarHBondContact OG-CG 3.45Å; S903-E906 PolarHBondContact OG-N 2.79Å; S903-E906 PolarHBondContact OG-OE2 2.96Å; S903-L907 PolarHBondContact O-N 2.88Å; S903-L907 VanDerWaalsContact O-N 3.11Å
904	V	32.3	Very low	31.9	Very low	98 Å²	98	118.1 Å²	118.1	59%	0.594	61%	0.611	S	S	*	*	H	α-helix	trans	-56.8	-33.8	174.6	-177.3	0	0	0	0	110.6	E906 L907 Y908	V904-E906 PolarHBondContact O-N 3.34Å; V904-L907 PolarHBondContact O-N 3.41Å; V904-Y908 PolarHBondContact O-N 2.84Å
905	S	32.8	Very low	31.7	Very low	81 Å²	81	117.8 Å²	117.8	57%	0.566	61%	0.611	S	S	*	*	H	α-helix	trans	-56.8	-41.7	170.8	-49.2	0	0	0	0	113.5	S903 Q909	S903-S905 PolarHBondContact O-N 3.45Å; S905-Q909 WeakPolarHBondContact O-CG 3.5Å; S905-Q909 PolarHBondContact O-N 3.49Å; S905-Q909 VanDerWaalsContact O-N 3.08Å
906	E	34.2	Very low	31.6	Very low	97 Å²	97	118 Å²	118	45%	0.453	61%	0.612	S	S	.	*	H	α-helix	trans	-73.1	-38.8	177.5	-75.5	162.7	113.2	0	0	112.1	C902 S903 V904 Y908 Q909 Q910	C902-E906 HydrophobicContact CB-CB 4.14Å; S903-E906 WeakPolarHBondContact CB-OE2 3.43Å; S903-E906 PolarHBondContact N-OE2 2.84Å; S903-E906 WeakPolarHBondContact O-CA 3.49Å; S903-E906 WeakPolarHBondContact O-CB 3.31Å; S903-E906 PolarHBondContact O-N 2.99Å; S903-E906 VanDerWaalsContact OG-CG 3.28Å; S903-E906 WeakPolarHBondContact OG-CG 3.45Å; S903-E906 PolarHBondContact OG-N 2.79Å; S903-E906 PolarHBondContact OG-OE2 2.96Å; V904-E906 PolarHBondContact O-N 3.34Å; E906-Y908 VanDerWaalsContact C-N 3.33Å; E906-Y908 PolarHBondContact O-N 2.94Å; E906-Q909 CarbonylContact O-C 3.56Å; E906-Q909 PolarHBondContact O-N 3.2Å; E906-Q910 VanDerWaalsContact O-CB 3.31Å; E906-Q910 WeakPolarHBondContact O-CB 3.16Å; E906-Q910 PolarHBondContact O-N 2.74Å
907	L	32.9	Very low	31.6	Very low	111 Å²	111	116.9 Å²	116.9	58%	0.581	61%	0.605	S	S	*	*	H	α-helix	trans	-58.9	-45.5	172.8	-79.6	165.9	0	0	0	111.2	S903 V904 Q909 Q910 E911	S903-L907 PolarHBondContact O-N 2.88Å; S903-L907 VanDerWaalsContact O-N 3.11Å; V904-L907 PolarHBondContact O-N 3.41Å; L907-Q909 VanDerWaalsContact C-N 3.31Å; L907-Q909 PolarHBondContact O-N 2.84Å; L907-Q910 WeakPolarHBondContact O-CB 3.45Å; L907-Q910 PolarHBondContact O-N 2.83Å; L907-Q910 VanDerWaalsContact O-N 3.13Å; L907-E911 PolarHBondContact O-N 2.58Å
908	Y	32.9	Very low	31.8	Very low	164 Å²	164	120.4 Å²	120.4	64%	0.643	61%	0.613	S	S	*	*	H	α-helix	trans	-63.3	-34.9	176.4	-145	-104.6	0	0	0	112.5	V904 E906 K912	V904-Y908 PolarHBondContact O-N 2.84Å; E906-Y908 VanDerWaalsContact C-N 3.33Å; E906-Y908 PolarHBondContact O-N 2.94Å; Y908-K912 WeakPolarHBondContact O-CB 3.49Å; Y908-K912 PolarHBondContact O-N 2.66Å
909	Q	37	Very low	32.1	Very low	110 Å²	110	119.7 Å²	119.7	51%	0.514	61%	0.613	S	S	.	*	H	α-helix	trans	-74.7	-32.1	172.2	-73.3	-174.4	27.1	0	0	113.5	S905 E906 L907 K913	S905-Q909 WeakPolarHBondContact O-CG 3.5Å; S905-Q909 PolarHBondContact O-N 3.49Å; S905-Q909 VanDerWaalsContact O-N 3.08Å; E906-Q909 CarbonylContact O-C 3.56Å; E906-Q909 PolarHBondContact O-N 3.2Å; L907-Q909 VanDerWaalsContact C-N 3.31Å; L907-Q909 PolarHBondContact O-N 2.84Å; Q909-K913 WeakPolarHBondContact O-CB 3.47Å; Q909-K913 VanDerWaalsContact O-CG 3.31Å; Q909-K913 WeakPolarHBondContact O-CG 3.3Å; Q909-K913 PolarHBondContact O-N 2.92Å
910	Q	35	Very low	32.4	Very low	119 Å²	119	119.8 Å²	119.8	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-44.4	177.9	-158.7	82.4	-42.7	0	0	110.2	E906 L907 K913 C914	E906-Q910 VanDerWaalsContact O-CB 3.31Å; E906-Q910 WeakPolarHBondContact O-CB 3.16Å; E906-Q910 PolarHBondContact O-N 2.74Å; L907-Q910 WeakPolarHBondContact O-CB 3.45Å; L907-Q910 PolarHBondContact O-N 2.83Å; L907-Q910 VanDerWaalsContact O-N 3.13Å; Q910-K913 CarbonylContact O-C 3.52Å; Q910-K913 WeakPolarHBondContact O-CB 3.29Å; Q910-K913 PolarHBondContact O-N 3.28Å; Q910-C914 PolarHBondContact O-N 3.36Å
911	E	33.9	Very low	32.5	Very low	130 Å²	130	119.6 Å²	119.6	61%	0.607	61%	0.607	S	S	*	*	H	α-helix	trans	-63.1	-46.1	175.2	-164.6	167.1	-129.1	0	0	111	L907 K913 C914 C915	L907-E911 PolarHBondContact O-N 2.58Å; E911-K913 VanDerWaalsContact C-N 3.31Å; E911-K913 PolarHBondContact O-N 2.97Å; E911-C914 WeakPolarHBondContact O-CA 3.5Å; E911-C914 WeakPolarHBondContact O-CB 3.45Å; E911-C914 PolarHBondContact O-N 3.34Å; E911-C915 PolarHBondContact O-N 3.36Å; E911-C915 PolarHBondContact O-SG 3.47Å
912	K	37.3	Very low	32.5	Very low	144 Å²	144	118.6 Å²	118.6	63%	0.626	61%	0.612	S	S	*	*	H	α-helix	trans	-58	-39.9	173.1	-157.9	172.4	-168.6	176.8	0	112.4	Y908 L916	Y908-K912 WeakPolarHBondContact O-CB 3.49Å; Y908-K912 PolarHBondContact O-N 2.66Å; K912-L916 HydrophobicContact CG-CD1 4.3Å; K912-L916 WeakPolarHBondContact O-CD1 3.46Å; K912-L916 PolarHBondContact O-N 2.87Å; K912-L916 VanDerWaalsContact O-N 3.08Å
913	K	35.7	Very low	32.7	Very low	119 Å²	119	120.9 Å²	120.9	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-68.3	-32	173.2	-78.5	169.3	-179.8	165.6	0	113	Q909 Q910 E911 K917	Q909-K913 WeakPolarHBondContact O-CB 3.47Å; Q909-K913 VanDerWaalsContact O-CG 3.31Å; Q909-K913 WeakPolarHBondContact O-CG 3.3Å; Q909-K913 PolarHBondContact O-N 2.92Å; Q910-K913 CarbonylContact O-C 3.52Å; Q910-K913 WeakPolarHBondContact O-CB 3.29Å; Q910-K913 PolarHBondContact O-N 3.28Å; E911-K913 VanDerWaalsContact C-N 3.31Å; E911-K913 PolarHBondContact O-N 2.97Å; K913-K917 WeakPolarHBondContact O-CB 3.49Å; K913-K917 VanDerWaalsContact O-CG 3.3Å; K913-K917 WeakPolarHBondContact O-CG 3.38Å; K913-K917 PolarHBondContact O-N 3.15Å; K913-K917 VanDerWaalsContact O-N 3.1Å
914	C	33.7	Very low	32.7	Very low	76 Å²	76	123 Å²	123	51%	0.514	65%	0.647	S	S	.	*	H	α-helix	trans	-71.5	-44.4	174.2	-85.2	0	0	0	0	112.1	Q910 E911 L916 K917 M918	Q910-C914 PolarHBondContact O-N 3.36Å; E911-C914 WeakPolarHBondContact O-CA 3.5Å; E911-C914 WeakPolarHBondContact O-CB 3.45Å; E911-C914 PolarHBondContact O-N 3.34Å; C914-L916 PolarHBondContact O-N 2.95Å; C914-K917 PolarHBondContact O-N 3.49Å; C914-K917 VanDerWaalsContact O-N 3.08Å; C914-M918 PolarHBondContact O-N 2.82Å
915	C	32.9	Very low	32.5	Very low	82 Å²	82	125.3 Å²	125.3	55%	0.554	66%	0.661	S	S	*	*	H	α-helix	trans	-60.8	-44.8	174.5	-64.1	0	0	0	0	111.8	E911 K917 M918 A919	E911-C915 PolarHBondContact O-N 3.36Å; E911-C915 PolarHBondContact O-SG 3.47Å; C915-K917 VanDerWaalsContact C-N 3.26Å; C915-K917 PolarHBondContact O-N 3.39Å; C915-M918 PolarHBondContact O-N 2.88Å; C915-A919 PolarHBondContact O-N 2.91Å; C915-A919 VanDerWaalsContact O-N 3.14Å
916	L	33.6	Very low	32.3	Very low	108 Å²	108	132.8 Å²	132.8	57%	0.565	68%	0.677	S	S	*	*	H	α-helix	trans	-65.2	-25.9	173.7	-90.8	86.4	0	0	0	113.4	K912 C914 N920	K912-L916 HydrophobicContact CG-CD1 4.3Å; K912-L916 WeakPolarHBondContact O-CD1 3.46Å; K912-L916 PolarHBondContact O-N 2.87Å; K912-L916 VanDerWaalsContact O-N 3.08Å; C914-L916 PolarHBondContact O-N 2.95Å; L916-N920 PolarHBondContact O-ND2 2.68Å
917	K	32.4	Very low	32.2	Very low	162 Å²	162	135 Å²	135	70%	0.704	70%	0.697	S	S	*	*	H	α-helix	trans	-76.4	-27.9	173.6	-81.7	177.9	176.4	-176.2	0	113.5	K913 C914 C915	K913-K917 WeakPolarHBondContact O-CB 3.49Å; K913-K917 VanDerWaalsContact O-CG 3.3Å; K913-K917 WeakPolarHBondContact O-CG 3.38Å; K913-K917 PolarHBondContact O-N 3.15Å; K913-K917 VanDerWaalsContact O-N 3.1Å; C914-K917 PolarHBondContact O-N 3.49Å; C914-K917 VanDerWaalsContact O-N 3.08Å; C915-K917 VanDerWaalsContact C-N 3.26Å; C915-K917 PolarHBondContact O-N 3.39Å
918	M	31.1	Very low	32	Very low	168 Å²	168	136 Å²	136	83%	0.828	71%	0.709	S	S	*	*	H	α-helix	trans	-77	-31.5	172.8	-82.5	-179.1	158.9	0	0	112.9	C914 C915 N920	C914-M918 PolarHBondContact O-N 2.82Å; C915-M918 PolarHBondContact O-N 2.88Å; M918-N920 VanDerWaalsContact C-N 3.25Å; M918-N920 PolarHBondContact O-N 3.41Å
919	A	32.6	Very low	31.9	Very low	82 Å²	82	134.1 Å²	134.1	68%	0.678	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-15.4	177.7	0	0	0	0	0	114.9	C915	C915-A919 PolarHBondContact O-N 2.91Å; C915-A919 VanDerWaalsContact O-N 3.14Å
920	N	30.8	Very low	31.5	Very low	131 Å²	131	135.3 Å²	135.3	70%	0.701	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	39.3	-172.1	-80.5	-73.5	0	0	0	114	L916 M918	L916-N920 PolarHBondContact O-ND2 2.68Å; M918-N920 VanDerWaalsContact C-N 3.25Å; M918-N920 PolarHBondContact O-N 3.41Å
921	K	30.1	Very low	31.2	Very low	195 Å²	195	136.4 Å²	136.4	85%	0.848	75%	0.748	S	S	*	*			trans	-115.5	67.4	172.2	-83.1	-169.3	172	-176.2	0	112.7
922	M	26.5	Very low	30.8	Very low	177 Å²	177	136.1 Å²	136.1	87%	0.872	76%	0.756	S	S	*	*	S	Bend	trans	-123.2	156.7	157.6	-77	-163.4	-179.8	0	0	109
923	P	28.6	Very low	30.3	Very low	133 Å²	133	139 Å²	139	86%	0.864	77%	0.768	S	S	*	*			trans	-70.9	158.8	-160.5	26.2	-34.7	0	0	0	114.9
924	A	29.7	Very low	29.9	Very low	97 Å²	97	137.6 Å²	137.6	80%	0.802	78%	0.779	S	S	*	*			trans	-86.8	148.6	-160	0	0	0	0	0	116
925	T	29.8	Very low	29.7	Very low	146 Å²	146	143.6 Å²	143.6	90%	0.896	80%	0.799	S	S	*	*			trans	-134.5	157	149.4	41.6	0	0	0	0	110.2
926	R	27.9	Very low	29.5	Very low	238 Å²	238	143.6 Å²	143.6	90%	0.898	81%	0.813	S	S	*	*			trans	-87	143.1	-170.6	-64.5	168.8	167.1	171.4	-6.8	112.3
927	T	31.7	Very low	29.1	Very low	143 Å²	143	144.2 Å²	144.2	88%	0.877	83%	0.826	S	S	*	*				-174.2	167.1	102.3	24.5	0	0	0	0	112.1
928	T	29	Very low	28.9	Very low	133 Å²	133	141 Å²	141	82%	0.816	82%	0.823	S	S	*	*			trans	-113.8	151.4	-168.6	46.4	0	0	0	0	112.9
929	S	31.5	Very low	28.8	Very low	124 Å²	124	138.9 Å²	138.9	87%	0.867	82%	0.82	S	S	*	*				-170.1	157.9	126.2	-81	0	0	0	0	112.4
930	T	27.2	Very low	28.6	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	83%	0.828	S	S	*	*			trans	-107.3	169.2	-174.2	41.2	0	0	0	0	112.8
931	V	29	Very low	28.5	Very low	142 Å²	142	142.7 Å²	142.7	86%	0.861	83%	0.834	S	S	*	*				178.5	174.6	129.3	151	0	0	0	0	109.3
932	T	26.7	Very low	28.3	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	83%	0.826	S	S	*	*			trans	-130.9	166.8	-136.6	-34.4	0	0	0	0	115.4
933	F	26.3	Very low	28.1	Very low	204 Å²	204	134.4 Å²	134.4	90%	0.895	83%	0.827	S	S	*	*			trans	-58.9	155.9	177	-66.1	-104.5	0	0	0	116.7
934	A	27.3	Very low	28	Very low	90 Å²	90	133.9 Å²	133.9	74%	0.744	83%	0.826	S	S	*	*			trans	-165.4	131.4	139.7	0	0	0	0	0	114.9
935	H	28.8	Very low	27.8	Very low	202 Å²	202	136.5 Å²	136.5	94%	0.935	83%	0.826	S	S	*	*			trans	27.5	145.1	147.2	-63.2	-89.8	0	0	0	125.1
936	G	28.4	Very low	27.5	Very low	82 Å²	82	134.5 Å²	134.5	85%	0.845	82%	0.818	S	S	*	*			trans	170.4	130.4	157.1	0	0	0	0	0	113.1
937	C	26.1	Very low	27.5	Very low	122 Å²	122	131.3 Å²	131.3	82%	0.824	82%	0.817	S	S	*	*			trans	-116.5	151.3	-163	-152.9	0	0	0	0	116.4
938	S	28	Very low	27.2	Very low	94 Å²	94	131.1 Å²	131.1	66%	0.657	81%	0.811	S	S	*	*			trans	69.1	138.2	142.8	56.2	0	0	0	0	124.4
939	T	28.9	Very low	27	Very low	124 Å²	124	129.1 Å²	129.1	76%	0.761	80%	0.802	S	S	*	*			trans	66.5	106.9	147.8	48.5	0	0	0	0	121.9
940	I	28.4	Very low	26.8	Very low	164 Å²	164	130 Å²	130	84%	0.841	80%	0.802	S	S	*	*				-177.1	144.4	112.5	-93.1	159	0	0	0	109
941	P	28.2	Very low	26.9	Very low	129 Å²	129	129.6 Å²	129.6	84%	0.838	80%	0.799	S	S	*	*			trans	-93.9	138.5	-178.3	34.9	-33.6	0	0	0	114.3
942	G	26.1	Very low	26.9	Very low	66 Å²	66	128 Å²	128	68%	0.68	79%	0.785	S	S	*	*			trans	135.6	140.8	169.9	0	0	0	0	0	113.7
943	C	23.5	Very low	27	Very low	131 Å²	131	127.1 Å²	127.1	89%	0.885	78%	0.784	S	S	*	*			trans	64.5	154.8	-174.2	-50.2	0	0	0	0	113.5
944	C	26.5	Very low	27.5	Very low	123 Å²	123	118.8 Å²	118.8	83%	0.831	75%	0.752	S	S	*	*			cis	-138.8	164.5	16.2	-63.4	0	0	0	0	112.7
945	D	23.9	Very low	27.9	Very low	152 Å²	152	121.2 Å²	121.2	81%	0.813	76%	0.76	S	S	*	*			trans	-70.9	170.3	165.5	-64.6	-81.9	0	0	0	114.5
946	S	24.3	Very low	28.6	Very low	103 Å²	103	116.5 Å²	116.5	72%	0.72	75%	0.745	S	S	*	*			trans	68.4	97.4	153.5	-62.1	0	0	0	0	119.6
947	I	27.5	Very low	29	Very low	172 Å²	172	115.7 Å²	115.7	88%	0.882	74%	0.737	S	S	*	*			trans	-126.9	98.2	142.1	-61.6	-175.6	0	0	0	109.8
948	N	25.5	Very low	29.7	Very low	139 Å²	139	116.1 Å²	116.1	74%	0.743	72%	0.721	S	S	*	*			trans	-71.9	163.2	158.2	-82	-41.3	0	0	0	110.1
949	S	26	Very low	30	Very low	90 Å²	90	117 Å²	117	63%	0.629	73%	0.725	S	S	*	*			cis	-175.3	147.7	-21.7	56.1	0	0	0	0	107
950	T	25.4	Very low	30.5	Very low	143 Å²	143	113.7 Å²	113.7	88%	0.877	70%	0.702	S	S	*	*			trans	-153.5	77.3	160.4	-43.9	0	0	0	0	110.5
951	V	29.8	Very low	31.1	Very low	126 Å²	126	108.4 Å²	108.4	76%	0.764	68%	0.68	S	S	*	*			trans	-92.6	119.6	174.1	179.2	0	0	0	0	108.8	S953	V951-S953 PolarHBondContact O-N 2.95Å
952	L	29.4	Very low	31.6	Very low	107 Å²	107	109.9 Å²	109.9	56%	0.56	67%	0.669	S	S	*	*			trans	-73.8	112.7	166.6	-78.9	162.8	0	0	0	108.2	R969	L952-R969 VanDerWaalsContact CD1-NH1 3.32Å
953	S	29.6	Very low	32.2	Very low	106 Å²	106	110.4 Å²	110.4	74%	0.741	65%	0.653	S	S	*	*			trans	-95	129	-175.3	31.1	0	0	0	0	111.4	V951	V951-S953 PolarHBondContact O-N 2.95Å
954	S	35.9	Very low	33.4	Very low	30 Å²	30	107.2 Å²	107.2	21%	0.21	63%	0.626	C	S	.	*			trans	-62.9	149.4	165.6	173	0	0	0	0	110.6	T956 G957	S954-T956 PolarHBondContact O-N 2.9Å; S954-T956 PolarHBondContact OG-N 2.93Å; S954-T956 PolarHBondContact OG-OG1 2.52Å; S954-G957 PolarHBondContact O-N 2.82Å; S954-G957 VanDerWaalsContact O-N 3.12Å
955	P	36	Very low	34.3	Very low	141 Å²	141	103.7 Å²	103.7	92%	0.916	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-15.3	167.4	-25.7	35.1	0	0	0	114.9
956	T	43.5	Very low	35.3	Very low	102 Å²	102	101.2 Å²	101.2	63%	0.626	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	1.7	-178.7	59.9	0	0	0	0	115	S954 R958	S954-T956 PolarHBondContact O-N 2.9Å; S954-T956 PolarHBondContact OG-N 2.93Å; S954-T956 PolarHBondContact OG-OG1 2.52Å; T956-R958 PolarHBondContact O-N 2.74Å
957	G	36.2	Very low	36.4	Very low	66 Å²	66	99.2 Å²	99.2	68%	0.68	57%	0.568	S	S	*	*			trans	69.5	-16.7	173.9	0	0	0	0	0	117.1	S954	S954-G957 PolarHBondContact O-N 2.82Å; S954-G957 VanDerWaalsContact O-N 3.12Å
958	R	40.3	Very low	37.5	Very low	130 Å²	130	95.4 Å²	95.4	49%	0.491	55%	0.546	S	S	.	.	S	Bend	trans	-66.5	138	172.1	167.6	177.8	157.3	-174.9	-13.3	110.8	T956 L960 E964	T956-R958 PolarHBondContact O-N 2.74Å; R958-L960 PolarHBondContact O-N 3.35Å; R958-E964 IonicContact NH2-OE1 3.33Å; R958-E964 PolarHBondContact NH2-OE1 3.02Å; R958-E964 IonicContact NH2-OE2 3.9Å; R958-E964 PolarHBondContact NH2-OE2 3.05Å
959	P	35.2	Very low	38.3	Very low	112 Å²	112	95.1 Å²	95.1	73%	0.727	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-64.1	129.5	168.4	27	-34.3	0	0	0	110.8
960	L	39	Very low	39	Very low	55 Å²	55	95.5 Å²	95.5	29%	0.288	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-68.1	138.4	175.6	-61.8	172.3	0	0	0	110	R958 E964 S965	R958-L960 PolarHBondContact O-N 3.35Å; L960-E964 HydrophobicContact CB-CB 4.09Å; L960-E964 HydrophobicContact CD2-CB 4.11Å; L960-S965 WeakPolarHBondContact CB-OG 3.39Å
961	S	41	Very low	40.2	Very low	54 Å²	54	92.3 Å²	92.3	38%	0.378	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-62.5	166.1	165.9	65.8	0	0	0	0	110.9	H963 E964 S965	S961-H963 VanDerWaalsContact C-N 3.27Å; S961-H963 PolarHBondContact O-N 3.36Å; S961-E964 WeakPolarHBondContact CB-OE2 3.43Å; S961-E964 PolarHBondContact N-OE2 3.32Å; S961-E964 PolarHBondContact O-N 3.4Å; S961-E964 WeakPolarHBondContact OG-CB 3.38Å; S961-E964 VanDerWaalsContact OG-CD 3.31Å; S961-E964 VanDerWaalsContact OG-CG 3.28Å; S961-E964 WeakPolarHBondContact OG-CG 3.28Å; S961-E964 PolarHBondContact OG-N 3.2Å; S961-E964 VanDerWaalsContact OG-N 3.17Å; S961-E964 PolarHBondContact OG-OE2 3.05Å; S961-S965 WeakPolarHBondContact O-CB 3.47Å; S961-S965 PolarHBondContact O-N 3.22Å; S961-S965 PolarHBondContact O-OG 3.24Å
962	W	38.8	Very low	40.9	Very low	159 Å²	159	89.8 Å²	89.8	60%	0.602	48%	0.483	S	S	*	.	H	α-helix	trans	-61.8	-35.7	177.5	-170.5	92.4	0	0	0	112.3	L883 S965 F966	L883-W962 HydrophobicContact CD2-CZ3 3.97Å; W962-S965 PolarHBondContact O-N 3.42Å; W962-F966 HydrophobicContact CE3-CB 4.46Å; W962-F966 HydrophobicContact CH2-CD2 4.29Å; W962-F966 HydrophobicContact CZ3-CB 4.35Å; W962-F966 HydrophobicContact CZ3-CG 4.5Å; W962-F966 WeakPolarHBondContact O-CB 3.48Å; W962-F966 PolarHBondContact O-N 3.38Å
963	H	38.6	Very low	41.5	Very low	77 Å²	77	90.2 Å²	90.2	36%	0.356	49%	0.486	S	S	.	.	H	α-helix	trans	-73.7	-39.5	177.4	-166.6	-40.6	0	0	0	112.1	S961 S965 F966 V967	S961-H963 VanDerWaalsContact C-N 3.27Å; S961-H963 PolarHBondContact O-N 3.36Å; H963-S965 VanDerWaalsContact C-N 3.33Å; H963-F966 PolarHBondContact O-N 2.87Å; H963-V967 WeakPolarHBondContact ND1-CG2 3.09Å; H963-V967 WeakPolarHBondContact O-CB 3.44Å; H963-V967 WeakPolarHBondContact O-CG2 3.41Å; H963-V967 PolarHBondContact O-N 3.21Å
964	E	48.4	Very low	41.9	Very low	65 Å²	65	88.9 Å²	88.9	30%	0.304	48%	0.476	S	S	.	.	H	α-helix	trans	-61.5	-44.2	170.7	-72.3	161.7	128	0	0	110.1	R958 L960 S961 F966 V967 Q968	R958-E964 IonicContact NH2-OE1 3.33Å; R958-E964 PolarHBondContact NH2-OE1 3.02Å; R958-E964 IonicContact NH2-OE2 3.9Å; R958-E964 PolarHBondContact NH2-OE2 3.05Å; L960-E964 HydrophobicContact CB-CB 4.09Å; L960-E964 HydrophobicContact CD2-CB 4.11Å; S961-E964 WeakPolarHBondContact CB-OE2 3.43Å; S961-E964 PolarHBondContact N-OE2 3.32Å; S961-E964 PolarHBondContact O-N 3.4Å; S961-E964 WeakPolarHBondContact OG-CB 3.38Å; S961-E964 VanDerWaalsContact OG-CD 3.31Å; S961-E964 VanDerWaalsContact OG-CG 3.28Å; S961-E964 WeakPolarHBondContact OG-CG 3.28Å; S961-E964 PolarHBondContact OG-N 3.2Å; S961-E964 VanDerWaalsContact OG-N 3.17Å; S961-E964 PolarHBondContact OG-OE2 3.05Å; E964-F966 PolarHBondContact O-N 3.17Å; E964-V967 PolarHBondContact O-N 3Å; E964-Q968 WeakPolarHBondContact O-CB 2.98Å; E964-Q968 PolarHBondContact O-N 2.6Å
965	S	46.2	Very low	42	Very low	49 Å²	49	92.7 Å²	92.7	34%	0.343	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-41.7	176.6	-57.6	0	0	0	0	112.4	L960 S961 W962 H963 R969	L960-S965 WeakPolarHBondContact CB-OG 3.39Å; S961-S965 WeakPolarHBondContact O-CB 3.47Å; S961-S965 PolarHBondContact O-N 3.22Å; S961-S965 PolarHBondContact O-OG 3.24Å; W962-S965 PolarHBondContact O-N 3.42Å; H963-S965 VanDerWaalsContact C-N 3.33Å; S965-R969 VanDerWaalsContact O-CB 3.25Å; S965-R969 WeakPolarHBondContact O-CB 3.42Å; S965-R969 PolarHBondContact O-N 3.37Å
966	F	44.9	Very low	41.8	Very low	100 Å²	100	88.7 Å²	88.7	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-43.2	177.1	178.8	-94.1	0	0	0	112.1	W962 H963 E964 R969 Q970	W962-F966 HydrophobicContact CE3-CB 4.46Å; W962-F966 HydrophobicContact CH2-CD2 4.29Å; W962-F966 HydrophobicContact CZ3-CB 4.35Å; W962-F966 HydrophobicContact CZ3-CG 4.5Å; W962-F966 WeakPolarHBondContact O-CB 3.48Å; W962-F966 PolarHBondContact O-N 3.38Å; H963-F966 PolarHBondContact O-N 2.87Å; E964-F966 PolarHBondContact O-N 3.17Å; F966-R969 WeakPolarHBondContact O-CB 3.13Å; F966-R969 PolarHBondContact O-N 2.05Å; F966-Q970 HydrophobicContact CD1-CG 4.27Å; F966-Q970 HydrophobicContact CE1-CG 3.88Å; F966-Q970 HydrophobicContact CZ-CG 4.1Å; F966-Q970 WeakPolarHBondContact O-CG 3.37Å; F966-Q970 PolarHBondContact O-N 2.83Å
967	V	46.9	Very low	41.2	Very low	61 Å²	61	91.1 Å²	91.1	37%	0.37	49%	0.488	S	S	.	.	H	α-helix	trans	-67.8	-43.7	177	169.7	0	0	0	0	110.9	H963 E964 R969 Q970 I971	H963-V967 WeakPolarHBondContact ND1-CG2 3.09Å; H963-V967 WeakPolarHBondContact O-CB 3.44Å; H963-V967 WeakPolarHBondContact O-CG2 3.41Å; H963-V967 PolarHBondContact O-N 3.21Å; E964-V967 PolarHBondContact O-N 3Å; V967-R969 PolarHBondContact O-N 3.42Å; V967-Q970 PolarHBondContact O-N 2.86Å; V967-Q970 VanDerWaalsContact O-N 3.13Å; V967-I971 HydrophobicContact CG1-CD1 3.82Å; V967-I971 HydrophobicContact CG1-CG1 4.5Å; V967-I971 WeakPolarHBondContact O-CG1 3.34Å; V967-I971 PolarHBondContact O-N 3.03Å
968	Q	50.2	Low	40.8	Very low	92 Å²	92	95.8 Å²	95.8	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-56.9	-42.3	172.4	-163.7	72.4	14.4	0	0	110.4	E964 I971 E972	E964-Q968 WeakPolarHBondContact O-CB 2.98Å; E964-Q968 PolarHBondContact O-N 2.6Å; Q968-I971 PolarHBondContact O-N 3.15Å; Q968-E972 WeakPolarHBondContact O-CB 3.16Å; Q968-E972 VanDerWaalsContact O-CG 3.29Å; Q968-E972 WeakPolarHBondContact O-CG 3.46Å; Q968-E972 PolarHBondContact O-N 2.79Å
969	R	43.3	Very low	40.1	Very low	132 Å²	132	97.4 Å²	97.4	50%	0.498	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-36.8	176.4	-158	59.3	156.7	-170.1	-2.4	113.3	L952 S965 F966 V967 E972 L973	L952-R969 VanDerWaalsContact CD1-NH1 3.32Å; S965-R969 VanDerWaalsContact O-CB 3.25Å; S965-R969 WeakPolarHBondContact O-CB 3.42Å; S965-R969 PolarHBondContact O-N 3.37Å; F966-R969 WeakPolarHBondContact O-CB 3.13Å; F966-R969 PolarHBondContact O-N 2.05Å; V967-R969 PolarHBondContact O-N 3.42Å; R969-E972 WeakPolarHBondContact CD-OE2 3.13Å; R969-E972 IonicContact CZ-OE2 2.69Å; R969-E972 IonicContact NE-OE2 3.13Å; R969-E972 IonicContact NH1-OE2 2.61Å; R969-E972 PolarHBondContact NH1-OE2 3.22Å; R969-L973 HydrophobicContact CG-CD1 4.3Å; R969-L973 WeakPolarHBondContact O-CB 3.41Å; R969-L973 WeakPolarHBondContact O-CD1 3.29Å; R969-L973 WeakPolarHBondContact O-CG 3.21Å; R969-L973 PolarHBondContact O-N 2.04Å
970	Q	41.5	Very low	39.7	Very low	99 Å²	99	97.7 Å²	97.7	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-37.8	173.1	-73.4	-68.9	-30.6	0	0	111.5	F966 V967 L973 S974	F966-Q970 HydrophobicContact CD1-CG 4.27Å; F966-Q970 HydrophobicContact CE1-CG 3.88Å; F966-Q970 HydrophobicContact CZ-CG 4.1Å; F966-Q970 WeakPolarHBondContact O-CG 3.37Å; F966-Q970 PolarHBondContact O-N 2.83Å; V967-Q970 PolarHBondContact O-N 2.86Å; V967-Q970 VanDerWaalsContact O-N 3.13Å; Q970-L973 PolarHBondContact O-N 2.88Å; Q970-S974 WeakPolarHBondContact O-CB 3.37Å; Q970-S974 PolarHBondContact O-N 3.22Å; Q970-S974 PolarHBondContact O-OG 3Å
971	I	50.4	Low	39.2	Very low	75 Å²	75	103 Å²	103	39%	0.385	54%	0.542	S	S	.	.	H	α-helix	trans	-69.9	-41.2	175.5	-65.6	165.3	0	0	0	111.2	V967 Q968 L973 S974 N975	V967-I971 HydrophobicContact CG1-CD1 3.82Å; V967-I971 HydrophobicContact CG1-CG1 4.5Å; V967-I971 WeakPolarHBondContact O-CG1 3.34Å; V967-I971 PolarHBondContact O-N 3.03Å; Q968-I971 PolarHBondContact O-N 3.15Å; I971-L973 VanDerWaalsContact C-N 3.26Å; I971-L973 PolarHBondContact O-N 2.85Å; I971-S974 WeakPolarHBondContact CA-OG 3.47Å; I971-S974 PolarHBondContact O-N 3.4Å; I971-S974 PolarHBondContact O-OG 2.72Å; I971-S974 VanDerWaalsContact O-OG 3.08Å; I971-N975 VanDerWaalsContact O-CB 3.25Å; I971-N975 WeakPolarHBondContact O-CB 3.4Å; I971-N975 PolarHBondContact O-N 2.98Å; I971-N975 PolarHBondContact O-OD1 3.39Å
972	E	44.1	Very low	38.5	Very low	73 Å²	73	111.9 Å²	111.9	34%	0.341	57%	0.567	S	S	.	*	H	α-helix	trans	-59.2	-37.4	171.1	-74.9	169.7	-173.8	0	0	111.8	Q968 R969 G976	Q968-E972 WeakPolarHBondContact O-CB 3.16Å; Q968-E972 VanDerWaalsContact O-CG 3.29Å; Q968-E972 WeakPolarHBondContact O-CG 3.46Å; Q968-E972 PolarHBondContact O-N 2.79Å; R969-E972 WeakPolarHBondContact CD-OE2 3.13Å; R969-E972 IonicContact CZ-OE2 2.69Å; R969-E972 IonicContact NE-OE2 3.13Å; R969-E972 IonicContact NH1-OE2 2.61Å; R969-E972 PolarHBondContact NH1-OE2 3.22Å; E972-G976 PolarHBondContact O-N 3.44Å
973	L	41.2	Very low	37.8	Very low	117 Å²	117	109.6 Å²	109.6	61%	0.613	58%	0.575	S	S	*	*	H	α-helix	trans	-79.2	-32.1	178.1	-72.3	167.2	0	0	0	113.3	R969 Q970 I971	R969-L973 HydrophobicContact CG-CD1 4.3Å; R969-L973 WeakPolarHBondContact O-CB 3.41Å; R969-L973 WeakPolarHBondContact O-CD1 3.29Å; R969-L973 WeakPolarHBondContact O-CG 3.21Å; R969-L973 PolarHBondContact O-N 2.04Å; Q970-L973 PolarHBondContact O-N 2.88Å; I971-L973 VanDerWaalsContact C-N 3.26Å; I971-L973 PolarHBondContact O-N 2.85Å
974	S	38	Very low	37.4	Very low	77 Å²	77	115.4 Å²	115.4	54%	0.538	60%	0.599	S	S	.	*	H	α-helix	trans	-73.8	-33.8	174.8	64.8	0	0	0	0	112.4	Q970 I971 G976	Q970-S974 WeakPolarHBondContact O-CB 3.37Å; Q970-S974 PolarHBondContact O-N 3.22Å; Q970-S974 PolarHBondContact O-OG 3Å; I971-S974 WeakPolarHBondContact CA-OG 3.47Å; I971-S974 PolarHBondContact O-N 3.4Å; I971-S974 PolarHBondContact O-OG 2.72Å; I971-S974 VanDerWaalsContact O-OG 3.08Å; S974-G976 VanDerWaalsContact C-N 3.35Å
975	N	38.6	Very low	36.4	Very low	110 Å²	110	117.9 Å²	117.9	59%	0.588	62%	0.618	S	S	*	*	S	Bend	trans	-91.7	3.8	-175.3	-59.5	3.3	0	0	0	112.7	I971 N977	I971-N975 VanDerWaalsContact O-CB 3.25Å; I971-N975 WeakPolarHBondContact O-CB 3.4Å; I971-N975 PolarHBondContact O-N 2.98Å; I971-N975 PolarHBondContact O-OD1 3.39Å; N975-N977 PolarHBondContact O-N 2.6Å; N975-N977 VanDerWaalsContact O-N 3.13Å
976	G	32.1	Very low	35.5	Very low	58 Å²	58	123.1 Å²	123.1	60%	0.598	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	9.9	-177.9	0	0	0	0	0	116.3	E972 S974	E972-G976 PolarHBondContact O-N 3.44Å; S974-G976 VanDerWaalsContact C-N 3.35Å
977	N	30.8	Very low	34.6	Very low	152 Å²	152	122.3 Å²	122.3	81%	0.813	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	29.4	-170.5	-87.6	-25.9	0	0	0	114.7	N975	N975-N977 PolarHBondContact O-N 2.6Å; N975-N977 VanDerWaalsContact O-N 3.13Å
978	D	26.7	Very low	33.7	Very low	165 Å²	165	131.4 Å²	131.4	88%	0.882	68%	0.676	S	S	*	*			trans	-96.1	99.3	165.3	-98.8	-47.6	0	0	0	111
979	M	26.7	Very low	32.7	Very low	163 Å²	163	130.4 Å²	130.4	80%	0.803	69%	0.69	S	S	*	*			trans	-120.4	127.5	176.6	-127	-88.3	164.9	0	0	109.2	I981	M979-I981 PolarHBondContact O-N 2.95Å; M979-I981 VanDerWaalsContact O-N 3.17Å
980	P	26.7	Very low	32	Very low	119 Å²	119	128.5 Å²	128.5	77%	0.773	70%	0.702	S	S	*	*			trans	-79.5	105.4	-159.1	29.5	-36.6	0	0	0	113.7
981	I	27.3	Very low	31.3	Very low	167 Å²	167	132.5 Å²	132.5	86%	0.856	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-91.3	117	173.4	-60	-176.9	0	0	0	110.5	M979	M979-I981 PolarHBondContact O-N 2.95Å; M979-I981 VanDerWaalsContact O-N 3.17Å
982	R	26.9	Very low	30.3	Very low	240 Å²	240	133 Å²	133	91%	0.906	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-67.8	142.4	179.5	-83.9	175.8	160.8	171.1	-5.9	112.9
983	S	24.8	Very low	29.5	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-67.8	129	173	56.5	0	0	0	0	114.3
984	K	30.5	Very low	29.2	Very low	199 Å²	199	142.5 Å²	142.5	87%	0.865	78%	0.775	S	S	*	*			trans	-160.8	105.1	146.5	-105	172.7	-178.3	-176	0	107.3
985	V	25.8	Very low	29.1	Very low	117 Å²	117	144.8 Å²	144.8	71%	0.709	79%	0.789	S	S	*	*				90.5	115.7	62	167.2	0	0	0	0	112
986	L	27.5	Very low	28.7	Very low	160 Å²	160	142.8 Å²	142.8	84%	0.838	79%	0.794	S	S	*	*			trans	68	152.8	170.9	-61.3	165.6	0	0	0	118.1
987	S	26.8	Very low	28.7	Very low	82 Å²	82	146 Å²	146	57%	0.573	81%	0.807	S	S	*	*			cis	-178.3	150.8	-34.3	55.8	0	0	0	0	110.9
988	R	29	Very low	28.8	Very low	253 Å²	253	143.4 Å²	143.4	96%	0.955	81%	0.807	S	S	*	*			trans	70.7	147.1	174.5	-51.8	171.7	172.7	173.7	-4.4	114.9
989	G	27.9	Very low	29	Very low	70 Å²	70	141.7 Å²	141.7	72%	0.722	80%	0.803	S	S	*	*			cis	155	146.9	-10.9	0	0	0	0	0	113.3
990	A	28.9	Very low	29.3	Very low	92 Å²	92	140.6 Å²	140.6	76%	0.76	80%	0.804	S	S	*	*			trans	67.3	155.8	174.7	0	0	0	0	0	116
991	E	27.6	Very low	29.6	Very low	183 Å²	183	140.2 Å²	140.2	86%	0.855	80%	0.802	S	S	*	*			cis	-162.4	157.6	-7.8	-124.4	171.4	141.8	0	0	111
992	A	27.7	Very low	29.8	Very low	87 Å²	87	138.4 Å²	138.4	72%	0.719	80%	0.799	S	S	*	*			trans	52.5	160.5	152.6	0	0	0	0	0	120.8
993	Q	28.6	Very low	29.9	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	80%	0.796	S	S	*	*			cis	-159.5	158.3	2.1	-136.1	156.8	3.3	0	0	111.4
994	F	33.8	Very low	30.1	Very low	200 Å²	200	133.1 Å²	133.1	88%	0.877	79%	0.793	S	S	*	*			trans	-98.6	173.8	164.4	-83.7	-83.9	0	0	0	109.8
995	P	35.7	Very low	30	Very low	126 Å²	126	129.2 Å²	129.2	82%	0.818	79%	0.79	S	S	*	*			cis	-133.7	-160.7	23.4	44.2	-24.5	0	0	0	113.9
996	G	31.4	Very low	30.2	Very low	68 Å²	68	129 Å²	129	70%	0.701	80%	0.795	S	S	*	*			cis	138.1	140.7	-16.4	0	0	0	0	0	116.6
997	S	30.8	Very low	30.4	Very low	124 Å²	124	126.7 Å²	126.7	87%	0.867	79%	0.792	S	S	*	*			trans	78.3	132.7	168.6	-157.5	0	0	0	0	122
998	A	34.1	Very low	30.7	Very low	99 Å²	99	128.9 Å²	128.9	82%	0.818	80%	0.804	S	S	*	*			trans	-160.5	160.2	153.7	0	0	0	0	0	110.4
999	T	30.1	Very low	30.7	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	80%	0.795	S	S	*	*			trans	-145.8	-145.1	-170.2	-37.2	0	0	0	0	112.6
1000	V	32.7	Very low	30.9	Very low	139 Å²	139	124.8 Å²	124.8	84%	0.842	80%	0.803	S	S	*	*			trans	78.1	148.7	175.5	-73	0	0	0	0	120.5
1001	P	33.9	Very low	30.8	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	80%	0.799	S	S	*	*			trans	-143.2	-175.9	-137.4	45.3	-25.4	0	0	0	118.7
1002	V	30.6	Very low	30.8	Very low	129 Å²	129	122.7 Å²	122.7	78%	0.782	79%	0.793	S	S	*	*			trans	26.1	124.4	147.6	178.4	0	0	0	0	120.7
1003	T	29.6	Very low	31	Very low	139 Å²	139	125.9 Å²	125.9	85%	0.853	80%	0.797	S	S	*	*				-158.2	153.4	128.4	12	0	0	0	0	114.7
1004	S	29.1	Very low	30.8	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	79%	0.794	S	S	*	*			trans	-60.8	167.8	-173.5	49	0	0	0	0	121.7
1005	S	28.3	Very low	30.4	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	79%	0.791	S	S	*	*			trans	80.5	155.4	153.6	84.7	0	0	0	0	117.1
1006	S	30	Very low	29.9	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	79%	0.794	S	S	*	*			cis	-147.5	167.1	1.9	61.1	0	0	0	0	111.9
1007	S	32.5	Very low	29.6	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	80%	0.797	S	S	*	*			trans	-114	155.8	170.6	57.2	0	0	0	0	111.4
1008	P	33.6	Very low	29.5	Very low	127 Å²	127	135.4 Å²	135.4	83%	0.825	80%	0.8	S	S	*	*			trans	-133.2	158.8	138.4	37.5	-27.3	0	0	0	114.3
1009	S	28.9	Very low	29.1	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	80%	0.798	S	S	*	*			trans	-92.1	159.8	175.7	52.8	0	0	0	0	113.1
1010	S	31.7	Very low	29.3	Very low	125 Å²	125	136.1 Å²	136.1	87%	0.874	80%	0.796	S	S	*	*			trans	-149.7	147.9	142.6	-84.2	0	0	0	0	110.4
1011	S	26.7	Very low	29.1	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	79%	0.791	S	S	*	*			trans	-89.3	169.5	173.9	47.7	0	0	0	0	111.2
1012	D	27.6	Very low	28.9	Very low	133 Å²	133	135 Å²	135	71%	0.711	79%	0.792	S	S	*	*				-179.7	167.4	90.1	-83.4	-19.2	0	0	0	112
1013	L	30.7	Very low	29.1	Very low	154 Å²	154	134.5 Å²	134.5	81%	0.806	79%	0.791	S	S	*	*			trans	71	149.4	166.5	-45.4	-173	0	0	0	118.8
1014	F	25.3	Very low	29.3	Very low	188 Å²	188	133.4 Å²	133.4	83%	0.825	79%	0.786	S	S	*	*				-160.5	171.7	-50.4	-132.2	-86.9	0	0	0	107.1
1015	Y	25	Very low	29.3	Very low	205 Å²	205	133.6 Å²	133.6	80%	0.804	79%	0.785	S	S	*	*			trans	-56	145.1	-178.5	-83.4	-107.8	0	0	0	115.7
1016	E	26.3	Very low	29.4	Very low	190 Å²	190	139.2 Å²	139.2	89%	0.888	79%	0.79	S	S	*	*				-152.6	163.4	128.6	-135.3	176	-174	0	0	112.5
1017	L	24.6	Very low	29.2	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	79%	0.786	S	S	*	*			trans	-102.4	136.4	-170.7	-58.6	85.7	0	0	0	112.2
1018	L	27.4	Very low	29.1	Very low	179 Å²	179	140.7 Å²	140.7	94%	0.937	79%	0.794	S	S	*	*			trans	-140.1	98.7	158.4	-75.9	179.6	0	0	0	111.5
1019	T	27.3	Very low	28.8	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76.2	136.3	160.7	47.6	0	0	0	0	109.8
1020	P	32.9	Very low	28.8	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-63.8	143.4	170.8	28.1	-34	0	0	0	110.5
1021	P	28.9	Very low	28.7	Very low	113 Å²	113	142.8 Å²	142.8	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.8	154	-174	30.8	-36	0	0	0	112.5
1022	P	29.2	Very low	28.9	Very low	114 Å²	114	148 Å²	148	74%	0.74	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.9	145.1	167.9	31.3	-34.2	0	0	0	110.5
1023	P	36.2	Very low	28.9	Very low	118 Å²	118	146.6 Å²	146.6	77%	0.766	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-65.7	140.3	168.9	28.8	-33.7	0	0	0	110
1024	P	33.5	Very low	28.8	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.2	144.2	-176.5	29.9	-35.1	0	0	0	111.6
1025	P	29	Very low	29.1	Very low	104 Å²	104	142.3 Å²	142.3	68%	0.675	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72	145.2	158.2	33.4	-32.6	0	0	0	109.1
1026	Y	31.1	Very low	29.4	Very low	234 Å²	234	138.2 Å²	138.2	92%	0.918	80%	0.801	S	S	*	*			trans	-170.4	145.9	131	-95.4	-57.9	0	0	0	111
1027	S	25.4	Very low	29.7	Very low	103 Å²	103	137.6 Å²	137.6	72%	0.72	80%	0.803	S	S	*	*			trans	-107.2	142.7	173.5	55.2	0	0	0	0	110.5
1028	T	30.2	Very low	29.8	Very low	153 Å²	153	137 Å²	137	94%	0.939	81%	0.805	S	S	*	*			trans	-153	145.7	143.9	12.7	0	0	0	0	110.9
1029	S	26.8	Very low	30.1	Very low	96 Å²	96	133.7 Å²	133.7	67%	0.671	80%	0.797	S	S	*	*			trans	-107.3	143.2	-179.9	53.7	0	0	0	0	111.3
1030	C	29.9	Very low	30.1	Very low	139 Å²	139	133 Å²	133	94%	0.939	80%	0.798	S	S	*	*			trans	-127.2	102.2	161	-73.2	0	0	0	0	109.9
1031	H	27.9	Very low	30	Very low	173 Å²	173	133.5 Å²	133.5	80%	0.801	80%	0.802	S	S	*	*			trans	-92.9	143.8	162.5	-83.3	-92.9	0	0	0	109.4
1032	F	31.4	Very low	30.1	Very low	209 Å²	209	133.2 Å²	133.2	92%	0.917	80%	0.803	S	S	*	*			trans	178.8	148.4	146.8	-92	-67	0	0	0	107.9
1033	S	28.5	Very low	30.2	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	81%	0.807	S	S	*	*			cis	-158.6	155.4	-44.9	48.7	0	0	0	0	108.7
1034	S	28.1	Very low	30	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	81%	0.808	S	S	*	*			trans	-80	143.8	-176.8	53.4	0	0	0	0	115.2
1035	T	31.5	Very low	29.9	Very low	141 Å²	141	133 Å²	133	87%	0.865	82%	0.815	S	S	*	*			trans	-143.4	129.5	151.9	37.9	0	0	0	0	111
1036	P	31.2	Very low	29.9	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	82%	0.822	S	S	*	*			trans	-106.2	148.5	171.7	37.1	-30.2	0	0	0	112.4
1037	L	32	Very low	30	Very low	178 Å²	178	127.5 Å²	127.5	93%	0.932	82%	0.82	S	S	*	*			trans	-141.5	157.5	166.5	-88.5	177.1	0	0	0	111.8
1038	T	27.9	Very low	30.2	Very low	131 Å²	131	127.3 Å²	127.3	80%	0.804	82%	0.824	S	S	*	*			trans	-124.8	124.9	-159.9	52.6	0	0	0	0	114.1
1039	S	32.4	Very low	30.1	Very low	109 Å²	109	129 Å²	129	76%	0.762	82%	0.822	S	S	*	*			trans	178.2	113.3	152.6	50.7	0	0	0	0	108.4
1040	S	28	Very low	30.3	Very low	112 Å²	112	131 Å²	131	78%	0.783	83%	0.83	S	S	*	*				76.3	87.3	61	76.8	0	0	0	0	114.7
1041	C	31.3	Very low	30.3	Very low	127 Å²	127	130.3 Å²	130.3	86%	0.858	82%	0.82	S	S	*	*			trans	170.9	149	148.4	-95.3	0	0	0	0	109.4
1042	S	30	Very low	30.2	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	83%	0.829	S	S	*	*			cis	-180	124.7	-33.7	45.5	0	0	0	0	108.5
1043	G	31.2	Very low	30.2	Very low	81 Å²	81	129.7 Å²	129.7	84%	0.835	82%	0.823	S	S	*	*			trans	90.4	147.1	172.2	0	0	0	0	0	115.6
1044	A	32.6	Very low	30.2	Very low	94 Å²	94	133 Å²	133	78%	0.777	83%	0.833	S	S	*	*			cis	-153.8	148	-7.9	0	0	0	0	0	112.7
1045	N	32.4	Very low	30.1	Very low	170 Å²	170	132.1 Å²	132.1	91%	0.909	83%	0.832	S	S	*	*			trans	44.2	102.9	162.4	-66.9	-8.8	0	0	0	119.7
1046	S	28.2	Very low	30	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	83%	0.834	S	S	*	*			trans	-123.3	131.5	142.9	58.4	0	0	0	0	110
1047	A	32.2	Very low	29.8	Very low	105 Å²	105	141.7 Å²	141.7	87%	0.868	85%	0.854	S	S	*	*			trans	-111	138.1	170.1	0	0	0	0	0	108.3
1048	A	31.4	Very low	29.7	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	85%	0.85	S	S	*	*			cis	-136.7	144.5	-1.7	0	0	0	0	0	110.9
1049	Q	27.5	Very low	29.8	Very low	189 Å²	189	140.3 Å²	140.3	88%	0.883	85%	0.852	S	S	*	*			trans	-84.8	128.8	178.3	-64.5	176.1	-49.8	0	0	111.6
1050	V	30	Very low	29.6	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	86%	0.857	S	S	*	*			trans	-138.6	99.2	149.6	-177.1	0	0	0	0	109.4
1051	V	29.8	Very low	29.7	Very low	123 Å²	123	143.8 Å²	143.8	75%	0.745	86%	0.861	S	S	*	*			trans	55	79.7	155	-165.9	0	0	0	0	117.5
1052	M	27.1	Very low	29.6	Very low	199 Å²	199	144.9 Å²	144.9	98%	0.98	86%	0.862	S	S	*	*			trans	-93.2	97.6	137.2	-89.5	-169.1	172.1	0	0	108.4
1053	Q	29.8	Very low	29.6	Very low	171 Å²	171	147.4 Å²	147.4	80%	0.799	87%	0.869	S	S	*	*			trans	-158.4	65.6	169	-138.3	169.6	16.3	0	0	113.1
1054	N	28.5	Very low	29.5	Very low	173 Å²	173	152.1 Å²	152.1	93%	0.925	87%	0.872	S	S	*	*			trans	-153.2	67.3	165.4	-102.6	-21.9	0	0	0	110.6
1055	A	26.6	Very low	29.3	Very low	92 Å²	92	156.6 Å²	156.6	76%	0.76	88%	0.879	S	S	*	*	S	Bend	trans	-140.9	143.1	162.2	0	0	0	0	0	107
1056	V	29.3	Very low	29	Very low	151 Å²	151	155.5 Å²	155.5	92%	0.915	88%	0.876	S	S	*	*			trans	68.7	61	-168.5	-161.5	0	0	0	0	113.9
1057	R	27.8	Very low	29.1	Very low	309 Å²	309	159 Å²	159	100%	1.166	88%	0.882	S	S	*	*			trans	-153.4	0	139.4	-131.3	177.7	-168.7	168.2	6.2	112.1

Retrieved 1,057 of 1,057 residues in 706.4 ms (Link to these results)

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