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Dual serine/threonine and tyrosine protein kinase

Acts as a positive regulator of ERK phosphorylation downstream of fibroblast growth factor-receptor activation. Involved in the regulation of both caspase-dependent apoptosis and caspase-independent cell death. In the skin, it plays a predominant role in suppressing caspase-dependent apoptosis in response to UV stress in a range of dermal cell types.

AlphaFold DB , UniProt , Accession A0A087WP69, Species MOUSE (Mus musculus, Mouse), Gene Dstyk, Length 882 aa.

						>A0A087WP69_MOUSE|A0A087WP69|Dstyk
MEADGQSWAGESVSGPGPGGGGMIRELCRGFSRYRRYLGRLRQNLRETQKFFRDIKCSHSHSCPSSPAGGGAAELGPAGDVAEAPLPAGQLSCISFPPMEETYLQQLVDRLPCILILGQDCNAKCQLLNLLLGVQVLPTLKLDSDESCKLRRLRFTYGTRTRVSLALPGQYELVHTLASHQDNWETIPEEDLEVQEDSEDAAHVLADLEVTMHHALLQEVDIVVAPCPSHRPSVDVLSDLANDFLPVITYALHKDELSERGEQELREVRQYFSFPMFFFKVPKLEIISSSSGRAESERSPLYGQLVDLGYLSSSHRNCVPSDQDCKAQSMLVEQSEKLKQLSTFSHQLLQNRLVDAAKALNVVHSHCLDIFINQAFDMQRDLQITPKRLEYTRKKENELYESLMNIANRKQEEMKDMIVETLNTMKEELLDDAANMEFKDVIVPENGETIGTREIKSCIRQIQELIISRLNQAVANKLISSVDYLRESFVGTLERCLQSLEKSQDVSVHITSNYLKQILNAAYHVEVTFHSGSSVTRMLWEQIKQIIQRITWVNPPTITLEWKRKVAQEAIDSLSASKLAKSICSQFRTRLNSSHEAFAASLRQLEAGHSGRLEKTEDLWLKVRKDHAPRLARLSLESRSLQDVLLHRKPKLGQELGRGQYGVVYLCDNWGGHFPCALKSVVPPDEKHWNDLALEFHYMRSLPKHERLVDLHGSVIDYNYGGGSSVAVLLIMERLHRDLYTGLKAGLTLETRLQIALDVVEGIRFLHSQGLVHRDIKLKNVLLDKQNRAKITDLGFCKPEAMMSGSIVGTPIHMAPELFTGTRPERLPVFDEECWQLMEACWDGDPLKRPLLGIVQPMLRSIMDRLCKCSSEQPNRGLDDST
					

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(Predicted Aligned Error values between residue pairs)

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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	31.4	Very low	29.3	Very low	246 Å²	246	137.1 Å²	137.1	100%	1.212	80%	0.801	S	S	*	*				0	98.2	0	-119.5	176.4	157	0	0	107
2	E	25	Very low	29.2	Very low	200 Å²	200	135.3 Å²	135.3	94%	0.935	80%	0.802	S	S	*	*			trans	-179.9	135.8	148	-103.5	179.5	-179.3	0	0	105.5
3	A	25	Very low	29.2	Very low	106 Å²	106	135 Å²	135	88%	0.876	80%	0.801	S	S	*	*			trans	-74.5	122.8	-160.2	0	0	0	0	0	112.3
4	D	34.9	Very low	29.3	Very low	143 Å²	143	133.8 Å²	133.8	77%	0.765	80%	0.803	S	S	*	*			trans	-97.8	114.9	170.4	-103.1	-21.5	0	0	0	109.3
5	G	32.2	Very low	29.2	Very low	71 Å²	71	129.1 Å²	129.1	73%	0.732	79%	0.794	S	S	*	*			trans	-173.5	74.1	173	0	0	0	0	0	111.5
6	Q	26	Very low	29.4	Very low	153 Å²	153	130.1 Å²	130.1	72%	0.715	80%	0.803	S	S	*	*			trans	-147.2	118	157.4	-113.3	173.7	-7.2	0	0	112.3	E11	Q6-E11 PolarHBondContact NE2-OE2 3.14Å
7	S	28.6	Very low	29.2	Very low	100 Å²	100	126.1 Å²	126.1	70%	0.699	79%	0.793	S	S	*	*			trans	-53.5	139.9	164	50.3	0	0	0	0	111.1	A9	S7-A9 PolarHBondContact O-N 2.96Å
8	W	31.8	Very low	29.6	Very low	187 Å²	187	126.7 Å²	126.7	71%	0.708	80%	0.798	S	S	*	*	S	Bend	trans	-68.8	85	164.8	-73.3	69.1	0	0	0	109.9	R29	W8-R29 VanDerWaalsContact CZ2-NH1 3.3Å
9	A	28.5	Very low	30.1	Very low	77 Å²	77	124.4 Å²	124.4	64%	0.636	80%	0.802	S	S	*	*	S	Bend	trans	-133	136.2	154.5	0	0	0	0	0	105.6	S7 E11	S7-A9 PolarHBondContact O-N 2.96Å; A9-E11 PolarHBondContact O-N 2.99Å
10	G	35.2	Very low	30.9	Very low	86 Å²	86	119.8 Å²	119.8	89%	0.887	78%	0.778	S	S	*	*			trans	-53.8	127.1	-163	0	0	0	0	0	114.7
11	E	23.8	Very low	32.3	Very low	139 Å²	139	116.9 Å²	116.9	65%	0.65	77%	0.77	S	S	*	*			trans	-126.6	104.8	154.9	-81.5	-174.2	158.1	0	0	108	Q6 A9 V13	Q6-E11 PolarHBondContact NE2-OE2 3.14Å; A9-E11 PolarHBondContact O-N 2.99Å; E11-V13 PolarHBondContact O-N 2.94Å; E11-V13 VanDerWaalsContact O-N 3.09Å
12	S	28.7	Very low	34.6	Very low	115 Å²	115	106.7 Å²	106.7	80%	0.804	73%	0.728	S	S	*	*			trans	-63.8	95.6	159.7	48.2	0	0	0	0	108.5	S14	S12-S14 VanDerWaalsContact C-N 3.33Å; S12-S14 PolarHBondContact O-N 3.15Å
13	V	28.9	Very low	37.6	Very low	132 Å²	132	97.8 Å²	97.8	80%	0.8	69%	0.686	S	S	*	*			trans	-74.4	94.9	163.1	-178.7	0	0	0	0	107.1	E11 G15	E11-V13 PolarHBondContact O-N 2.94Å; E11-V13 VanDerWaalsContact O-N 3.09Å; V13-G15 PolarHBondContact O-N 3.27Å
14	S	30.9	Very low	40.7	Very low	118 Å²	118	94 Å²	94	83%	0.825	65%	0.651	S	S	*	*			trans	-74.5	108.5	174.9	50	0	0	0	0	110.5	S12	S12-S14 VanDerWaalsContact C-N 3.33Å; S12-S14 PolarHBondContact O-N 3.15Å
15	G	27	Very low	43.3	Very low	64 Å²	64	95.5 Å²	95.5	66%	0.66	65%	0.646	S	S	*	*			trans	-139.4	124	159.3	0	0	0	0	0	108	V13	V13-G15 PolarHBondContact O-N 3.27Å
16	P	32.3	Very low	46.1	Very low	145 Å²	145	96.5 Å²	96.5	94%	0.942	63%	0.631	S	S	*	*			trans	-86	120.6	-169.8	32.8	-30	0	0	0	110.8
17	G	27.2	Very low	49.3	Very low	62 Å²	62	89.3 Å²	89.3	64%	0.639	60%	0.598	S	S	*	*			trans	-154	141	164.5	0	0	0	0	0	108.5	G19	G17-G19 PolarHBondContact O-N 2.68Å
18	P	34.7	Very low	52.4	Low	136 Å²	136	85.5 Å²	85.5	88%	0.883	57%	0.571	S	S	*	*			trans	-72.2	121.1	-167.3	10	1.8	0	0	0	111.2	G20	P18-G20 PolarHBondContact O-N 3.33Å
19	G	39.8	Very low	55.3	Low	84 Å²	84	83.9 Å²	83.9	87%	0.866	57%	0.565	S	S	*	*	S	Bend	trans	73.3	-37.2	148.9	0	0	0	0	0	120.9	G17	G17-G19 PolarHBondContact O-N 2.68Å
20	G	45.5	Very low	58.3	Low	32 Å²	32	80.8 Å²	80.8	33%	0.33	54%	0.541	S	S	.	.	S	Bend	trans	-92.5	-35.6	-163.7	0	0	0	0	0	117.2	P18 G22	P18-G20 PolarHBondContact O-N 3.33Å; G20-G22 VanDerWaalsContact C-N 3.34Å; G20-G22 PolarHBondContact O-N 3.05Å
21	G	61.6	Low	61.1	Low	58 Å²	58	76.8 Å²	76.8	60%	0.598	50%	0.499	S	S	*	.	H	α-helix	trans	-69.4	-24.2	-168.1	0	0	0	0	0	115.8	R25	G21-R25 WeakPolarHBondContact O-CB 3.48Å; G21-R25 PolarHBondContact O-N 3.44Å
22	G	79.9	Confident	64.3	Low	32 Å²	32	71.9 Å²	71.9	33%	0.33	48%	0.48	S	S	.	.	H	α-helix	trans	-69.1	-43.1	-179	0	0	0	0	0	113.2	G20 E26	G20-G22 VanDerWaalsContact C-N 3.34Å; G20-G22 PolarHBondContact O-N 3.05Å; G22-E26 WeakPolarHBondContact O-CG 3.34Å; G22-E26 PolarHBondContact O-N 3.41Å
23	M	86.9	Confident	67.3	Low	14 Å²	14	69 Å²	69	7%	0.069	45%	0.452	C	S	.	.	H	α-helix	trans	-68	-48.3	-178.8	175.2	-173.4	76	0	0	112	R25 E26 L27 L131 L338 K339	M23-R25 VanDerWaalsContact C-N 3.26Å; M23-R25 PolarHBondContact O-N 3.04Å; M23-E26 PolarHBondContact O-N 2.88Å; M23-E26 VanDerWaalsContact O-N 3.09Å; M23-L27 HydrophobicContact CG-CD1 3.95Å; M23-L27 HydrophobicContact CG-CG 4.46Å; M23-L27 PolarHBondContact O-N 3Å; M23-L131 HydrophobicContact CE-CD2 4.22Å; M23-L338 HydrophobicContact CE-CD2 3.92Å; M23-L338 HydrophobicContact CE-CG 4.37Å; M23-L338 HydrophobicContact SD-CB 4.19Å; M23-L338 HydrophobicContact SD-CD2 3.73Å; M23-L338 HydrophobicContact SD-CG 3.52Å; M23-L338 VanDerWaalsContact SD-CG 3.52Å; M23-K339 HydrophobicContact CB-CB 4.34Å
24	I	89.9	Confident	70.3	Confident	26 Å²	26	63 Å²	63	13%	0.133	41%	0.414	C	S	.	.	H	α-helix	trans	-56.6	-45.7	179.8	-65.3	172.9	0	0	0	109.6	E26 L27 C28 L216	I24-E26 VanDerWaalsContact C-N 3.34Å; I24-E26 PolarHBondContact O-N 3.23Å; I24-L27 PolarHBondContact O-N 2.9Å; I24-C28 WeakPolarHBondContact O-CB 3.28Å; I24-C28 PolarHBondContact O-N 3.33Å; I24-C28 PolarHBondContact O-SG 3.09Å; I24-L216 HydrophobicContact CG2-CB 4.38Å
25	R	90.4	Very high	73.2	Confident	175 Å²	175	61.3 Å²	61.3	66%	0.66	39%	0.39	S	S	*	.	H	α-helix	trans	-59.6	-41.2	177.1	-173.9	177.9	64.1	-169.3	-0.6	112.8	G21 M23 R29	G21-R25 WeakPolarHBondContact O-CB 3.48Å; G21-R25 PolarHBondContact O-N 3.44Å; M23-R25 VanDerWaalsContact C-N 3.26Å; M23-R25 PolarHBondContact O-N 3.04Å; R25-R29 WeakPolarHBondContact O-CB 3.33Å; R25-R29 PolarHBondContact O-N 3.47Å
26	E	91	Very high	76.3	Confident	91 Å²	91	65.4 Å²	65.4	43%	0.425	39%	0.386	S	S	.	.	H	α-helix	trans	-68.5	-41.6	176.9	-73.8	-178.9	-178.9	0	0	112.7	G22 M23 I24 R29 G30 S342	G22-E26 WeakPolarHBondContact O-CG 3.34Å; G22-E26 PolarHBondContact O-N 3.41Å; M23-E26 PolarHBondContact O-N 2.88Å; M23-E26 VanDerWaalsContact O-N 3.09Å; I24-E26 VanDerWaalsContact C-N 3.34Å; I24-E26 PolarHBondContact O-N 3.23Å; E26-R29 PolarHBondContact O-N 3.07Å; E26-G30 PolarHBondContact O-N 2.6Å; E26-S342 PolarHBondContact OE2-OG 2.74Å
27	L	92.8	Very high	79.2	Confident	2 Å²	2	60 Å²	60	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-51.7	174.8	-74.5	167.9	0	0	0	110.8	M23 I24 R29 G30 F31 L216 L341	M23-L27 HydrophobicContact CG-CD1 3.95Å; M23-L27 HydrophobicContact CG-CG 4.46Å; M23-L27 PolarHBondContact O-N 3Å; I24-L27 PolarHBondContact O-N 2.9Å; L27-R29 VanDerWaalsContact C-N 3.27Å; L27-R29 PolarHBondContact O-N 2.97Å; L27-G30 WeakPolarHBondContact O-CA 3.45Å; L27-G30 PolarHBondContact O-N 2.87Å; L27-F31 HydrophobicContact CB-CD2 4.4Å; L27-F31 HydrophobicContact CB-CE2 4.38Å; L27-F31 HydrophobicContact CD2-CE2 3.98Å; L27-F31 WeakPolarHBondContact O-CD2 2.99Å; L27-F31 PolarHBondContact O-N 2.8Å; L27-L216 HydrophobicContact CB-CD1 3.67Å; L27-L216 HydrophobicContact CD1-CD1 4.43Å; L27-L216 HydrophobicContact CD1-CD2 4.3Å; L27-L341 HydrophobicContact CD1-CD2 4.45Å; L27-L341 HydrophobicContact CD2-CG 4.24Å
28	C	94	Very high	82.3	Confident	21 Å²	21	57.2 Å²	57.2	14%	0.142	32%	0.317	C	S	.	.	H	α-helix	trans	-52.5	-46.9	175.3	-69.2	0	0	0	0	110.9	I24 G30 S32 A215 E219	I24-C28 WeakPolarHBondContact O-CB 3.28Å; I24-C28 PolarHBondContact O-N 3.33Å; I24-C28 PolarHBondContact O-SG 3.09Å; C28-G30 VanDerWaalsContact C-N 3.34Å; C28-G30 PolarHBondContact O-N 2.98Å; C28-S32 WeakPolarHBondContact O-CB 2.98Å; C28-S32 PolarHBondContact O-N 3.49Å; C28-A215 PolarHBondContact SG-O 3.06Å; C28-E219 HydrophobicContact CB-CG 4.32Å
29	R	91.5	Very high	85.1	Confident	152 Å²	152	52.5 Å²	52.5	57%	0.574	29%	0.293	S	S	*	.	H	α-helix	trans	-61.2	-41.2	177	-170.6	-178.1	-173.6	-179.1	7.7	112.3	W8 R25 E26 L27 R33	W8-R29 VanDerWaalsContact CZ2-NH1 3.3Å; R25-R29 WeakPolarHBondContact O-CB 3.33Å; R25-R29 PolarHBondContact O-N 3.47Å; E26-R29 PolarHBondContact O-N 3.07Å; L27-R29 VanDerWaalsContact C-N 3.27Å; L27-R29 PolarHBondContact O-N 2.97Å; R29-R33 WeakPolarHBondContact O-CB 3.49Å; R29-R33 PolarHBondContact O-N 2.71Å
30	G	91.5	Very high	87.6	Confident	13 Å²	13	52.4 Å²	52.4	13%	0.134	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-52.1	178.1	0	0	0	0	0	112.8	E26 L27 C28 R33 Y34	E26-G30 PolarHBondContact O-N 2.6Å; L27-G30 WeakPolarHBondContact O-CA 3.45Å; L27-G30 PolarHBondContact O-N 2.87Å; C28-G30 VanDerWaalsContact C-N 3.34Å; C28-G30 PolarHBondContact O-N 2.98Å; G30-R33 PolarHBondContact O-N 3.45Å; G30-Y34 PolarHBondContact O-N 3.4Å
31	F	94.4	Very high	89.9	Confident	1 Å²	1	51 Å²	51	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-42.1	179.6	-73.1	-73.4	0	0	0	112.5	L27 R33 Y34 R35 P112 I114 L216 E219 V220 V247 L349	L27-F31 HydrophobicContact CB-CD2 4.4Å; L27-F31 HydrophobicContact CB-CE2 4.38Å; L27-F31 HydrophobicContact CD2-CE2 3.98Å; L27-F31 WeakPolarHBondContact O-CD2 2.99Å; L27-F31 PolarHBondContact O-N 2.8Å; F31-R33 VanDerWaalsContact C-N 3.32Å; F31-R33 PolarHBondContact O-N 3.38Å; F31-Y34 WeakPolarHBondContact O-CB 3.4Å; F31-Y34 PolarHBondContact O-N 3.16Å; F31-Y34 VanDerWaalsContact O-N 3.12Å; F31-R35 PolarHBondContact O-N 3.04Å; F31-P112 HydrophobicContact CD1-CB 4.04Å; F31-P112 HydrophobicContact CD1-CG 3.78Å; F31-P112 HydrophobicContact CE1-CB 3.9Å; F31-P112 HydrophobicContact CE1-CG 4.16Å; F31-I114 HydrophobicContact CE2-CD1 4.05Å; F31-I114 HydrophobicContact CE2-CG1 4.4Å; F31-I114 HydrophobicContact CZ-CD1 4.04Å; F31-I114 HydrophobicContact CZ-CG1 3.87Å; F31-L216 HydrophobicContact CD2-CD1 4.37Å; F31-E219 HydrophobicContact CB-CB 3.83Å; F31-V220 HydrophobicContact CD1-CB 3.87Å; F31-V220 HydrophobicContact CD1-CG1 4.5Å; F31-V220 HydrophobicContact CD1-CG2 3.83Å; F31-V220 HydrophobicContact CD2-CB 4.1Å; F31-V220 HydrophobicContact CD2-CG1 3.89Å; F31-V220 HydrophobicContact CE1-CB 3.99Å; F31-V220 HydrophobicContact CE1-CG1 4.43Å; F31-V220 HydrophobicContact CE1-CG2 3.53Å; F31-V220 HydrophobicContact CE2-CB 4.23Å; F31-V220 HydrophobicContact CE2-CG1 3.83Å; F31-V220 HydrophobicContact CE2-CG2 4.39Å; F31-V220 HydrophobicContact CG-CB 3.94Å; F31-V220 HydrophobicContact CG-CG1 4.26Å; F31-V220 HydrophobicContact CG-CG2 4.39Å; F31-V220 HydrophobicContact CZ-CB 4.19Å; F31-V220 HydrophobicContact CZ-CG1 4.12Å; F31-V220 HydrophobicContact CZ-CG2 3.86Å; F31-V247 HydrophobicContact CE1-CG2 4.19Å; F31-V247 HydrophobicContact CZ-CG2 4.17Å; F31-L349 HydrophobicContact CD1-CD1 3.6Å; F31-L349 HydrophobicContact CE1-CD1 3.59Å; F31-L349 HydrophobicContact CG-CD1 4.4Å; F31-L349 HydrophobicContact CZ-CD1 4.38Å
32	S	91.8	Very high	91.5	Very high	36 Å²	36	52 Å²	52	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-41.9	175.3	-168.4	0	0	0	0	111.6	C28 R35 R36 E219	C28-S32 WeakPolarHBondContact O-CB 2.98Å; C28-S32 PolarHBondContact O-N 3.49Å; S32-R35 PolarHBondContact O-N 3.14Å; S32-R36 WeakPolarHBondContact O-CB 3.49Å; S32-R36 PolarHBondContact O-N 3.09Å; S32-E219 VanDerWaalsContact CA-OE2 3.28Å; S32-E219 WeakPolarHBondContact CA-OE2 3.13Å; S32-E219 WeakPolarHBondContact CB-OE1 3.35Å; S32-E219 WeakPolarHBondContact CB-OE2 3.07Å; S32-E219 PolarHBondContact OG-OE1 2.93Å
33	R	91.1	Very high	92.2	Very high	55 Å²	55	54.2 Å²	54.2	21%	0.208	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-44.9	173.2	-175.1	177.9	179.8	-154.7	-8.4	111.2	R29 G30 F31 R36 Y37 H346	R29-R33 WeakPolarHBondContact O-CB 3.49Å; R29-R33 PolarHBondContact O-N 2.71Å; G30-R33 PolarHBondContact O-N 3.45Å; F31-R33 VanDerWaalsContact C-N 3.32Å; F31-R33 PolarHBondContact O-N 3.38Å; R33-R36 PolarHBondContact O-N 3.46Å; R33-Y37 HydrophobicContact CG-CD2 3.8Å; R33-Y37 HydrophobicContact CG-CE2 3.55Å; R33-Y37 WeakPolarHBondContact O-CD2 3.39Å; R33-Y37 PolarHBondContact O-N 3.38Å; R33-H346 PolarHBondContact NH1-CE1 3.46Å; R33-H346 PolarHBondContact NH1-NE2 2.94Å; R33-H346 VanDerWaalsContact NH1-NE2 3.19Å
34	Y	92.9	Very high	92.5	Very high	5 Å²	5	53.9 Å²	53.9	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-51.7	176.5	175.4	-94.4	0	0	0	111.5	G30 F31 R36 Y37 L38 P112 L245 L349 L353	G30-Y34 PolarHBondContact O-N 3.4Å; F31-Y34 WeakPolarHBondContact O-CB 3.4Å; F31-Y34 PolarHBondContact O-N 3.16Å; F31-Y34 VanDerWaalsContact O-N 3.12Å; Y34-R36 VanDerWaalsContact C-N 3.28Å; Y34-R36 PolarHBondContact O-N 3.15Å; Y34-Y37 PolarHBondContact O-N 2.86Å; Y34-Y37 VanDerWaalsContact O-N 3.17Å; Y34-L38 HydrophobicContact CE1-CB 4.35Å; Y34-L38 HydrophobicContact CE1-CD2 3.8Å; Y34-L38 HydrophobicContact CE1-CG 4.49Å; Y34-L38 VanDerWaalsContact O-CB 3.32Å; Y34-L38 WeakPolarHBondContact O-CB 3.26Å; Y34-L38 PolarHBondContact O-N 3.12Å; Y34-P112 HydrophobicContact CD1-CG 3.83Å; Y34-P112 HydrophobicContact CE1-CB 4.39Å; Y34-P112 HydrophobicContact CE1-CG 3.91Å; Y34-L245 HydrophobicContact CE2-CD2 4.33Å; Y34-L245 WeakPolarHBondContact OH-CD2 3.47Å; Y34-L349 HydrophobicContact CD1-CD2 4.44Å; Y34-L349 HydrophobicContact CD2-CB 3.53Å; Y34-L349 HydrophobicContact CD2-CD1 4.46Å; Y34-L349 HydrophobicContact CD2-CD2 4.01Å; Y34-L349 HydrophobicContact CD2-CG 4.19Å; Y34-L349 HydrophobicContact CE1-CD2 4.46Å; Y34-L349 HydrophobicContact CE2-CB 4.05Å; Y34-L349 HydrophobicContact CE2-CD2 3.98Å; Y34-L349 WeakPolarHBondContact CE2-O 3.3Å; Y34-L349 HydrophobicContact CG-CB 4.11Å; Y34-L349 HydrophobicContact CG-CD1 4.23Å; Y34-L349 HydrophobicContact CG-CD2 4.22Å; Y34-L349 HydrophobicContact CG-CG 4.42Å; Y34-L353 HydrophobicContact CD2-CD1 3.43Å; Y34-L353 VanDerWaalsContact CD2-CD1 3.43Å; Y34-L353 HydrophobicContact CD2-CD2 3.83Å; Y34-L353 HydrophobicContact CD2-CG 3.5Å; Y34-L353 HydrophobicContact CE2-CD1 4Å; Y34-L353 HydrophobicContact CE2-CD2 3.6Å; Y34-L353 HydrophobicContact CE2-CG 3.5Å; Y34-L353 HydrophobicContact CG-CD1 4.24Å
35	R	91.7	Very high	92.8	Very high	83 Å²	83	52.8 Å²	52.8	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-55.6	-42.2	178.1	-74.7	-179.2	172	-161.2	-1.9	112.3	F31 S32 L38 G39 Q218 E219	F31-R35 PolarHBondContact O-N 3.04Å; S32-R35 PolarHBondContact O-N 3.14Å; R35-L38 PolarHBondContact O-N 3.16Å; R35-G39 PolarHBondContact O-N 3.42Å; R35-Q218 PolarHBondContact NH1-O 3.41Å; R35-E219 PolarHBondContact NE-O 2.94Å; R35-E219 VanDerWaalsContact NH2-C 3.28Å; R35-E219 PolarHBondContact NH2-O 2.68Å
36	R	91.1	Very high	93	Very high	150 Å²	150	51.1 Å²	51.1	57%	0.566	23%	0.226	S	C	*	.	H	α-helix	trans	-59.7	-48.4	177.4	-173.3	-175.4	-60	-177.5	-0.6	112.4	S32 R33 Y34 G39 R40	S32-R36 WeakPolarHBondContact O-CB 3.49Å; S32-R36 PolarHBondContact O-N 3.09Å; R33-R36 PolarHBondContact O-N 3.46Å; Y34-R36 VanDerWaalsContact C-N 3.28Å; Y34-R36 PolarHBondContact O-N 3.15Å; R36-G39 PolarHBondContact O-N 3.32Å; R36-R40 PolarHBondContact O-N 3.26Å
37	Y	93	Very high	93.1	Very high	33 Å²	33	49.9 Å²	49.9	13%	0.129	22%	0.22	C	C	.	.	H	α-helix	trans	-75.7	-32.4	180	-71.6	-66	0	0	0	112.7	R33 Y34 G39 R40 L41 L641 V644 L645	R33-Y37 HydrophobicContact CG-CD2 3.8Å; R33-Y37 HydrophobicContact CG-CE2 3.55Å; R33-Y37 WeakPolarHBondContact O-CD2 3.39Å; R33-Y37 PolarHBondContact O-N 3.38Å; Y34-Y37 PolarHBondContact O-N 2.86Å; Y34-Y37 VanDerWaalsContact O-N 3.17Å; Y37-G39 VanDerWaalsContact C-N 3.3Å; Y37-G39 PolarHBondContact O-N 2.94Å; Y37-R40 WeakPolarHBondContact O-CB 3.07Å; Y37-R40 PolarHBondContact O-N 3Å; Y37-R40 VanDerWaalsContact O-N 3.15Å; Y37-L41 PolarHBondContact O-N 3.35Å; Y37-L641 HydrophobicContact CD1-CD1 3.43Å; Y37-L641 VanDerWaalsContact CD1-CD1 3.43Å; Y37-L641 HydrophobicContact CE1-CD1 4.12Å; Y37-L641 HydrophobicContact CG-CD1 4.26Å; Y37-V644 HydrophobicContact CE1-CG1 3.79Å; Y37-V644 VanDerWaalsContact OH-CG1 3.27Å; Y37-V644 WeakPolarHBondContact OH-CG1 3.08Å; Y37-L645 HydrophobicContact CD1-CD2 4.39Å; Y37-L645 HydrophobicContact CD2-CD2 4.02Å; Y37-L645 HydrophobicContact CG-CD2 3.93Å
38	L	93.9	Very high	93.1	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-42.9	170	-174.2	67.6	0	0	0	111	Y34 R35 R40 L41 R42 V108 L111 L353	Y34-L38 HydrophobicContact CE1-CB 4.35Å; Y34-L38 HydrophobicContact CE1-CD2 3.8Å; Y34-L38 HydrophobicContact CE1-CG 4.49Å; Y34-L38 VanDerWaalsContact O-CB 3.32Å; Y34-L38 WeakPolarHBondContact O-CB 3.26Å; Y34-L38 PolarHBondContact O-N 3.12Å; R35-L38 PolarHBondContact O-N 3.16Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.26Å; L38-L41 WeakPolarHBondContact O-CB 3.34Å; L38-L41 PolarHBondContact O-N 3.23Å; L38-R42 WeakPolarHBondContact O-CG 3.45Å; L38-R42 PolarHBondContact O-N 3.36Å; L38-V108 HydrophobicContact CD1-CB 4.23Å; L38-V108 HydrophobicContact CD1-CG1 4.48Å; L38-L111 HydrophobicContact CD2-CD2 3.81Å; L38-L353 HydrophobicContact CB-CD2 4.16Å; L38-L353 HydrophobicContact CD1-CD2 4.26Å
39	G	93.1	Very high	93	Very high	37 Å²	37	50 Å²	50	38%	0.381	22%	0.219	S	C	.	.	H	α-helix	trans	-58.9	-38.5	174	0	0	0	0	0	112.9	R35 R36 Y37 Q43	R35-G39 PolarHBondContact O-N 3.42Å; R36-G39 PolarHBondContact O-N 3.32Å; Y37-G39 VanDerWaalsContact C-N 3.3Å; Y37-G39 PolarHBondContact O-N 2.94Å; G39-Q43 PolarHBondContact O-N 2.8Å
40	R	92.3	Very high	93	Very high	83 Å²	83	47.1 Å²	47.1	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-68.3	-42.1	174	-67.3	-176.5	-179.7	-171.3	-1.6	112.4	R36 Y37 L38 Q43 N44 L641	R36-R40 PolarHBondContact O-N 3.26Å; Y37-R40 WeakPolarHBondContact O-CB 3.07Å; Y37-R40 PolarHBondContact O-N 3Å; Y37-R40 VanDerWaalsContact O-N 3.15Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.26Å; R40-Q43 PolarHBondContact O-N 3.33Å; R40-N44 WeakPolarHBondContact O-CB 3.48Å; R40-N44 PolarHBondContact O-N 2.84Å; R40-L641 HydrophobicContact CB-CD2 4.14Å
41	L	94.1	Very high	92.9	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-46.9	173.9	-79.5	170.8	0	0	0	111.5	Y37 L38 Q43 N44 L45 V108 L353 A356 A357 L641	Y37-L41 PolarHBondContact O-N 3.35Å; L38-L41 WeakPolarHBondContact O-CB 3.34Å; L38-L41 PolarHBondContact O-N 3.23Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 3.41Å; L41-N44 PolarHBondContact O-N 2.92Å; L41-L45 WeakPolarHBondContact O-CB 3.14Å; L41-L45 PolarHBondContact O-N 3.35Å; L41-V108 HydrophobicContact CB-CG1 4.12Å; L41-L353 HydrophobicContact CD1-CB 4.34Å; L41-L353 HydrophobicContact CD1-CD2 3.55Å; L41-A356 HydrophobicContact CD1-CB 3.8Å; L41-A356 HydrophobicContact CD2-CB 4.3Å; L41-A357 HydrophobicContact CD2-CB 4.01Å; L41-L641 HydrophobicContact CB-CD2 4.46Å; L41-L641 HydrophobicContact CD2-CD2 3.51Å; L41-L641 HydrophobicContact CD2-CG 4.36Å; L41-L641 HydrophobicContact CG-CD2 3.61Å
42	R	95.1	Very high	92.6	Very high	79 Å²	79	47 Å²	47	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-44.4	175.6	-74.3	178.7	178.9	179.1	-3.2	111.5	L38 R46 V108 D109	L38-R42 WeakPolarHBondContact O-CG 3.45Å; L38-R42 PolarHBondContact O-N 3.36Å; R42-R46 WeakPolarHBondContact O-CB 3.36Å; R42-R46 VanDerWaalsContact O-CG 3.29Å; R42-R46 WeakPolarHBondContact O-CG 3.3Å; R42-R46 PolarHBondContact O-N 3.09Å; R42-V108 HydrophobicContact CG-CB 3.81Å; R42-V108 HydrophobicContact CG-CG2 4.02Å; R42-V108 PolarHBondContact NE-O 3.25Å; R42-V108 PolarHBondContact NH2-O 3Å; R42-D109 PolarHBondContact NH2-O 3.28Å
43	Q	93.9	Very high	92.4	Very high	78 Å²	78	51.6 Å²	51.6	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-47.2	176.5	-178.2	56.7	27.4	0	0	111.4	G39 R40 L41 R46 E47	G39-Q43 PolarHBondContact O-N 2.8Å; R40-Q43 PolarHBondContact O-N 3.33Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 3.41Å; Q43-R46 PolarHBondContact O-N 3.03Å; Q43-E47 PolarHBondContact NE2-OE1 2.93Å; Q43-E47 WeakPolarHBondContact O-CG 3.23Å; Q43-E47 PolarHBondContact O-N 3.29Å
44	N	93.4	Very high	92	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.032	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-48	-179.5	-159.6	-52.5	0	0	0	111.1	R40 L41 R46 E47 T48 L360 H364 E637 S638	R40-N44 WeakPolarHBondContact O-CB 3.48Å; R40-N44 PolarHBondContact O-N 2.84Å; L41-N44 PolarHBondContact O-N 2.92Å; N44-R46 VanDerWaalsContact C-N 3.34Å; N44-R46 PolarHBondContact O-N 3.07Å; N44-E47 PolarHBondContact O-N 2.93Å; N44-E47 VanDerWaalsContact O-N 3.17Å; N44-T48 PolarHBondContact O-N 3.48Å; N44-T48 PolarHBondContact O-OG1 3.38Å; N44-L360 HydrophobicContact CB-CD2 3.91Å; N44-L360 WeakPolarHBondContact OD1-CD2 3.36Å; N44-H364 PolarHBondContact OD1-CE1 3.47Å; N44-H364 VanDerWaalsContact OD1-CE1 3.28Å; N44-E637 WeakPolarHBondContact ND2-CB 3.23Å; N44-S638 PolarHBondContact ND2-N 3.43Å
45	L	95.1	Very high	91.3	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-42.9	175.8	-177.5	64.1	0	0	0	112.5	L41 T48 Q49 F96 L104 V108 L360	L41-L45 WeakPolarHBondContact O-CB 3.14Å; L41-L45 PolarHBondContact O-N 3.35Å; L45-T48 WeakPolarHBondContact O-CB 3.37Å; L45-T48 PolarHBondContact O-N 3.46Å; L45-Q49 WeakPolarHBondContact O-CG 3.11Å; L45-Q49 PolarHBondContact O-N 3.45Å; L45-F96 HydrophobicContact CD1-CE1 3.72Å; L45-F96 HydrophobicContact CD1-CZ 3.76Å; L45-L104 HydrophobicContact CD1-CB 4.08Å; L45-L104 HydrophobicContact CD1-CD1 4.27Å; L45-L104 HydrophobicContact CD2-CB 4.2Å; L45-V108 HydrophobicContact CD2-CG2 3.71Å; L45-L360 HydrophobicContact CD1-CD1 4.19Å
46	R	94.9	Very high	90.5	Very high	140 Å²	140	54.1 Å²	54.1	53%	0.528	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-43.1	176.9	-76.3	-171.6	-59.4	-173.6	1.1	112.3	R42 Q43 N44 T48 Q49 K50	R42-R46 WeakPolarHBondContact O-CB 3.36Å; R42-R46 VanDerWaalsContact O-CG 3.29Å; R42-R46 WeakPolarHBondContact O-CG 3.3Å; R42-R46 PolarHBondContact O-N 3.09Å; Q43-R46 PolarHBondContact O-N 3.03Å; N44-R46 VanDerWaalsContact C-N 3.34Å; N44-R46 PolarHBondContact O-N 3.07Å; R46-T48 VanDerWaalsContact C-N 3.34Å; R46-Q49 PolarHBondContact O-N 3.17Å; R46-K50 WeakPolarHBondContact O-CB 3.41Å; R46-K50 PolarHBondContact O-N 3.4Å
47	E	93.4	Very high	89.4	Confident	65 Å²	65	50.3 Å²	50.3	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-35.7	176.4	-66.6	-55.5	137.7	0	0	111.7	Q43 N44 K50 F51 L634	Q43-E47 PolarHBondContact NE2-OE1 2.93Å; Q43-E47 WeakPolarHBondContact O-CG 3.23Å; Q43-E47 PolarHBondContact O-N 3.29Å; N44-E47 PolarHBondContact O-N 2.93Å; N44-E47 VanDerWaalsContact O-N 3.17Å; E47-K50 PolarHBondContact O-N 3.45Å; E47-F51 WeakPolarHBondContact O-CB 3.28Å; E47-F51 PolarHBondContact O-N 3.26Å; E47-L634 HydrophobicContact CB-CD2 3.74Å
48	T	93.1	Very high	87.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-50.4	172	-55.2	0	0	0	0	111.6	N44 L45 R46 K50 F51 F52 F96 L360 H364	N44-T48 PolarHBondContact O-N 3.48Å; N44-T48 PolarHBondContact O-OG1 3.38Å; L45-T48 WeakPolarHBondContact O-CB 3.37Å; L45-T48 PolarHBondContact O-N 3.46Å; R46-T48 VanDerWaalsContact C-N 3.34Å; T48-K50 VanDerWaalsContact C-N 3.28Å; T48-K50 PolarHBondContact O-N 2.94Å; T48-F51 WeakPolarHBondContact O-CB 3.43Å; T48-F51 PolarHBondContact O-N 2.9Å; T48-F52 HydrophobicContact CG2-CD2 3.88Å; T48-F52 HydrophobicContact CG2-CE2 3.63Å; T48-F52 VanDerWaalsContact O-CD2 3.22Å; T48-F52 WeakPolarHBondContact O-CD2 3.45Å; T48-F52 PolarHBondContact O-N 3.33Å; T48-F96 HydrophobicContact CG2-CD1 3.89Å; T48-F96 HydrophobicContact CG2-CE1 3.62Å; T48-F96 HydrophobicContact CG2-CZ 4.4Å; T48-L360 HydrophobicContact CG2-CD1 4.35Å; T48-H364 WeakPolarHBondContact CG2-NE2 3.35Å; T48-H364 PolarHBondContact OG1-CE1 3.39Å; T48-H364 VanDerWaalsContact OG1-CE1 3.26Å; T48-H364 PolarHBondContact OG1-NE2 2.88Å
49	Q	92.6	Very high	86.1	Confident	26 Å²	26	54.3 Å²	54.3	12%	0.121	26%	0.257	C	S	.	.	H	α-helix	trans	-59.5	-40.9	176.3	-71.8	171.3	-25.9	0	0	111.5	L45 R46 F52 R53 F96 E101	L45-Q49 WeakPolarHBondContact O-CG 3.11Å; L45-Q49 PolarHBondContact O-N 3.45Å; R46-Q49 PolarHBondContact O-N 3.17Å; Q49-F52 PolarHBondContact O-N 3.36Å; Q49-R53 WeakPolarHBondContact O-CG 3.49Å; Q49-R53 PolarHBondContact O-N 3.34Å; Q49-F96 HydrophobicContact CG-CD1 4.36Å; Q49-F96 HydrophobicContact CG-CE1 4.23Å; Q49-E101 PolarHBondContact NE2-OE1 2.86Å
50	K	91.6	Very high	84	Confident	91 Å²	91	56.1 Å²	56.1	40%	0.396	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-46.2	175	-176.4	-176.9	173.5	-170.7	0	111.4	R46 E47 T48 F52 R53 D54	R46-K50 WeakPolarHBondContact O-CB 3.41Å; R46-K50 PolarHBondContact O-N 3.4Å; E47-K50 PolarHBondContact O-N 3.45Å; T48-K50 VanDerWaalsContact C-N 3.28Å; T48-K50 PolarHBondContact O-N 2.94Å; K50-F52 PolarHBondContact O-N 3.39Å; K50-R53 WeakPolarHBondContact O-CB 3.28Å; K50-R53 PolarHBondContact O-N 3.4Å; K50-R53 VanDerWaalsContact O-N 3.14Å; K50-D54 VanDerWaalsContact O-CG 3.26Å; K50-D54 PolarHBondContact O-N 3.03Å
51	F	89.5	Confident	81.6	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-55.3	-47.7	176.8	170.6	-95.4	0	0	0	112.2	E47 T48 R53 D54 I55 F371 H627 R630 L631 L634	E47-F51 WeakPolarHBondContact O-CB 3.28Å; E47-F51 PolarHBondContact O-N 3.26Å; T48-F51 WeakPolarHBondContact O-CB 3.43Å; T48-F51 PolarHBondContact O-N 2.9Å; F51-R53 VanDerWaalsContact C-N 3.35Å; F51-R53 PolarHBondContact O-N 3.09Å; F51-D54 PolarHBondContact O-N 3.39Å; F51-I55 HydrophobicContact CD1-CD1 3.93Å; F51-I55 HydrophobicContact CD2-CD1 4.48Å; F51-I55 HydrophobicContact CE1-CD1 3.28Å; F51-I55 HydrophobicContact CE1-CG1 4.49Å; F51-I55 HydrophobicContact CE2-CD1 3.92Å; F51-I55 HydrophobicContact CG-CD1 4.49Å; F51-I55 HydrophobicContact CZ-CD1 3.29Å; F51-I55 HydrophobicContact CZ-CG1 4.35Å; F51-I55 PolarHBondContact O-N 2.99Å; F51-I55 VanDerWaalsContact O-N 3.08Å; F51-F371 HydrophobicContact CZ-CE2 4.25Å; F51-F371 HydrophobicContact CZ-CZ 4.44Å; F51-H627 HydrophobicContact CE2-CB 3.85Å; F51-H627 WeakPolarHBondContact CE2-O 3.49Å; F51-H627 HydrophobicContact CZ-CB 4.04Å; F51-R630 HydrophobicContact CD2-CB 4.25Å; F51-R630 HydrophobicContact CE2-CB 4.17Å; F51-L631 HydrophobicContact CD1-CD1 4.26Å; F51-L631 HydrophobicContact CE1-CB 4.15Å; F51-L631 HydrophobicContact CE1-CD1 3.86Å; F51-L631 HydrophobicContact CE1-CD2 4.16Å; F51-L631 HydrophobicContact CE1-CG 4.28Å; F51-L631 HydrophobicContact CE2-CB 4.11Å; F51-L631 HydrophobicContact CZ-CB 3.66Å; F51-L631 HydrophobicContact CZ-CD1 4.27Å; F51-L631 HydrophobicContact CZ-CD2 4.2Å; F51-L631 HydrophobicContact CZ-CG 4.26Å; F51-L634 HydrophobicContact CB-CD1 4.05Å; F51-L634 HydrophobicContact CG-CD1 4.29Å
52	F	87.1	Confident	79.1	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.035	31%	0.311	C	S	.	.	H	α-helix	trans	-70.2	-28.7	178.4	-74.5	-72.5	0	0	0	113.4	T48 Q49 K50 K56 I94 F96 C367	T48-F52 HydrophobicContact CG2-CD2 3.88Å; T48-F52 HydrophobicContact CG2-CE2 3.63Å; T48-F52 VanDerWaalsContact O-CD2 3.22Å; T48-F52 WeakPolarHBondContact O-CD2 3.45Å; T48-F52 PolarHBondContact O-N 3.33Å; Q49-F52 PolarHBondContact O-N 3.36Å; K50-F52 PolarHBondContact O-N 3.39Å; F52-K56 WeakPolarHBondContact O-CG 3.44Å; F52-K56 PolarHBondContact O-N 3.12Å; F52-I94 HydrophobicContact CE1-CG2 4.01Å; F52-F96 HydrophobicContact CD2-CB 3.73Å; F52-F96 AromaticContact CD2-CD1 3.91Å; F52-F96 HydrophobicContact CD2-CD1 3.91Å; F52-F96 HydrophobicContact CD2-CG 4.13Å; F52-F96 HydrophobicContact CE2-CB 4.03Å; F52-F96 HydrophobicContact CE2-CD1 4.19Å; F52-F96 HydrophobicContact CE2-CG 4.23Å; F52-F96 HydrophobicContact CG-CB 4.05Å; F52-C367 HydrophobicContact CZ-CB 4.23Å
53	R	86.4	Confident	76.2	Confident	133 Å²	133	63.5 Å²	63.5	50%	0.502	32%	0.322	S	S	.	.	H	α-helix	trans	-67.2	-45.2	169.4	-74.2	-171.6	-62.1	-97.4	-0.4	111.6	Q49 K50 F51 I55 K56 C57	Q49-R53 WeakPolarHBondContact O-CG 3.49Å; Q49-R53 PolarHBondContact O-N 3.34Å; K50-R53 WeakPolarHBondContact O-CB 3.28Å; K50-R53 PolarHBondContact O-N 3.4Å; K50-R53 VanDerWaalsContact O-N 3.14Å; F51-R53 VanDerWaalsContact C-N 3.35Å; F51-R53 PolarHBondContact O-N 3.09Å; R53-I55 VanDerWaalsContact C-N 3.32Å; R53-I55 PolarHBondContact O-N 3.36Å; R53-K56 PolarHBondContact O-N 3.13Å; R53-K56 VanDerWaalsContact O-N 3.14Å; R53-C57 PolarHBondContact O-N 3.04Å; R53-C57 PolarHBondContact O-SG 3Å
54	D	83.1	Confident	73.2	Confident	48 Å²	48	65.7 Å²	65.7	26%	0.257	34%	0.343	S	S	.	.	H	α-helix	trans	-59.5	-42	179.5	-68.1	-9.7	0	0	0	111.5	K50 F51 C57 S58 R630	K50-D54 VanDerWaalsContact O-CG 3.26Å; K50-D54 PolarHBondContact O-N 3.03Å; F51-D54 PolarHBondContact O-N 3.39Å; D54-C57 PolarHBondContact O-N 3.39Å; D54-S58 WeakPolarHBondContact O-CB 3.33Å; D54-S58 PolarHBondContact O-N 3.13Å; D54-S58 PolarHBondContact O-OG 2.86Å; D54-R630 IonicContact OD2-CZ 2.82Å; D54-R630 IonicContact OD2-NH1 3.86Å; D54-R630 IonicContact OD2-NH2 3.16Å; D54-R630 PolarHBondContact OD2-NH2 3.47Å
55	I	78.4	Confident	70.4	Confident	6 Å²	6	71 Å²	71	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-60.5	-46.1	175.5	-73.7	171.7	0	0	0	110.7	F51 R53 C57 H59 F371 H627	F51-I55 HydrophobicContact CD1-CD1 3.93Å; F51-I55 HydrophobicContact CD2-CD1 4.48Å; F51-I55 HydrophobicContact CE1-CD1 3.28Å; F51-I55 HydrophobicContact CE1-CG1 4.49Å; F51-I55 HydrophobicContact CE2-CD1 3.92Å; F51-I55 HydrophobicContact CG-CD1 4.49Å; F51-I55 HydrophobicContact CZ-CD1 3.29Å; F51-I55 HydrophobicContact CZ-CG1 4.35Å; F51-I55 PolarHBondContact O-N 2.99Å; F51-I55 VanDerWaalsContact O-N 3.08Å; R53-I55 VanDerWaalsContact C-N 3.32Å; R53-I55 PolarHBondContact O-N 3.36Å; I55-C57 PolarHBondContact O-N 3.4Å; I55-H59 PolarHBondContact O-CD2 3.44Å; I55-F371 HydrophobicContact CD1-CZ 3.92Å; I55-H627 HydrophobicContact CD1-CB 4.43Å
56	K	75.2	Confident	67.4	Low	142 Å²	142	75.8 Å²	75.8	62%	0.617	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-42.7	178.7	-71.9	176.3	-179	-179.9	0	112.1	F52 R53	F52-K56 WeakPolarHBondContact O-CG 3.44Å; F52-K56 PolarHBondContact O-N 3.12Å; R53-K56 PolarHBondContact O-N 3.13Å; R53-K56 VanDerWaalsContact O-N 3.14Å
57	C	67.4	Low	64.5	Low	70 Å²	70	75.1 Å²	75.1	47%	0.473	43%	0.428	S	S	.	.	H	α-helix	trans	-75.5	-33.5	-177.5	-67.4	0	0	0	0	114.1	R53 D54 I55 H59 S60 H61	R53-C57 PolarHBondContact O-N 3.04Å; R53-C57 PolarHBondContact O-SG 3Å; D54-C57 PolarHBondContact O-N 3.39Å; I55-C57 PolarHBondContact O-N 3.4Å; C57-H59 PolarHBondContact O-N 3.42Å; C57-H59 VanDerWaalsContact O-N 3.15Å; C57-S60 PolarHBondContact O-N 3.03Å; C57-S60 PolarHBondContact O-OG 2.96Å; C57-H61 PolarHBondContact O-CD2 2.78Å
58	S	61.4	Low	61.8	Low	63 Å²	63	77.4 Å²	77.4	44%	0.441	46%	0.458	S	S	.	.	H	α-helix	trans	-63	-21.7	179.4	-58.9	0	0	0	0	112.4	D54	D54-S58 WeakPolarHBondContact O-CB 3.33Å; D54-S58 PolarHBondContact O-N 3.13Å; D54-S58 PolarHBondContact O-OG 2.86Å
59	H	56.5	Low	58.8	Low	57 Å²	57	80.9 Å²	80.9	26%	0.264	49%	0.493	S	S	.	.	H	α-helix	trans	-94.6	-21.3	177.9	-71.2	-56.5	0	0	0	114.9	I55 C57 H61 S62 L91	I55-H59 PolarHBondContact O-CD2 3.44Å; C57-H59 PolarHBondContact O-N 3.42Å; C57-H59 VanDerWaalsContact O-N 3.15Å; H59-H61 VanDerWaalsContact C-N 3.3Å; H59-H61 PolarHBondContact O-N 3.45Å; H59-S62 PolarHBondContact O-OG 3.12Å; H59-L91 WeakPolarHBondContact NE2-CD1 3.44Å
60	S	50.1	Low	56.1	Low	75 Å²	75	83.9 Å²	83.9	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-72.1	-24.9	174.9	51.6	0	0	0	0	112.9	C57	C57-S60 PolarHBondContact O-N 3.03Å; C57-S60 PolarHBondContact O-OG 2.96Å
61	H	42.3	Very low	53.1	Low	162 Å²	162	83.3 Å²	83.3	75%	0.75	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-5.5	-176.9	-71.2	-63.2	0	0	0	115.2	C57 H59 C63	C57-H61 PolarHBondContact O-CD2 2.78Å; H59-H61 VanDerWaalsContact C-N 3.3Å; H59-H61 PolarHBondContact O-N 3.45Å; H61-C63 VanDerWaalsContact C-N 3.33Å
62	S	40.9	Very low	50.6	Low	80 Å²	80	88.4 Å²	88.4	56%	0.559	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	0.6	176.1	51.4	0	0	0	0	114.3	H59	H59-S62 PolarHBondContact O-OG 3.12Å
63	C	33.1	Very low	47.9	Very low	78 Å²	78	92.5 Å²	92.5	53%	0.527	63%	0.629	S	S	.	*	S	Bend	trans	-101.5	114.9	171.7	-69.1	0	0	0	0	109.2	H61 S65	H61-C63 VanDerWaalsContact C-N 3.33Å; C63-S65 PolarHBondContact O-N 2.98Å
64	P	32.7	Very low	45.2	Very low	124 Å²	124	95.5 Å²	95.5	81%	0.805	65%	0.649	S	S	*	*			trans	-69.8	102.3	170.6	27.7	-29.3	0	0	0	108.3	S66	P64-S66 PolarHBondContact O-N 3.48Å
65	S	34.3	Very low	42.8	Very low	116 Å²	116	101.9 Å²	101.9	81%	0.811	68%	0.682	S	S	*	*			trans	-71.8	104.2	164.2	53.3	0	0	0	0	108.3	C63	C63-S65 PolarHBondContact O-N 2.98Å
66	S	30.4	Very low	40.3	Very low	106 Å²	106	104.9 Å²	104.9	74%	0.741	71%	0.714	S	S	*	*			trans	-58.9	140.1	169.7	-62.8	0	0	0	0	110.3	P64 A68	P64-S66 PolarHBondContact O-N 3.48Å; S66-A68 PolarHBondContact O-N 3.32Å
67	P	35.7	Very low	38.3	Very low	126 Å²	126	104.6 Å²	104.6	82%	0.818	73%	0.727	S	S	*	*			trans	-71.9	131.5	176.5	11.7	-0.7	0	0	0	109.7	G69	P67-G69 PolarHBondContact O-N 2.89Å; P67-G69 VanDerWaalsContact O-N 3.15Å
68	A	36.2	Very low	36.6	Very low	112 Å²	112	105.8 Å²	105.8	93%	0.926	74%	0.742	S	S	*	*			trans	-63.5	110.6	172.5	0	0	0	0	0	110.2	S66	S66-A68 PolarHBondContact O-N 3.32Å
69	G	30	Very low	35.1	Very low	73 Å²	73	106.8 Å²	106.8	75%	0.753	76%	0.762	S	S	*	*			trans	-117.2	115.4	166.5	0	0	0	0	0	109.3	P67	P67-G69 PolarHBondContact O-N 2.89Å; P67-G69 VanDerWaalsContact O-N 3.15Å
70	G	36.2	Very low	33.6	Very low	90 Å²	90	111.6 Å²	111.6	93%	0.928	79%	0.79	S	S	*	*			trans	-69.5	138.7	176.8	0	0	0	0	0	112.4
71	G	28.2	Very low	32.7	Very low	79 Å²	79	114.8 Å²	114.8	81%	0.814	81%	0.806	S	S	*	*			trans	-179.9	114.3	171.6	0	0	0	0	0	110.5
72	A	37.9	Very low	32.1	Very low	109 Å²	109	111.3 Å²	111.3	90%	0.901	81%	0.805	S	S	*	*			trans	-74.7	135.6	178	0	0	0	0	0	111.7
73	A	30.3	Very low	31.6	Very low	94 Å²	94	115.9 Å²	115.9	78%	0.777	82%	0.817	S	S	*	*			trans	-169.9	119.5	151.4	0	0	0	0	0	112.5
74	E	29.8	Very low	31.4	Very low	195 Å²	195	116.3 Å²	116.3	91%	0.911	83%	0.827	S	S	*	*			trans	37.5	133.4	143.5	-62.2	-173.8	154.7	0	0	124
75	L	31.4	Very low	31.3	Very low	183 Å²	183	116.1 Å²	116.1	96%	0.958	83%	0.825	S	S	*	*			trans	-72.5	136.4	176.2	-74	112.4	0	0	0	113.8
76	G	26.9	Very low	31.4	Very low	68 Å²	68	117 Å²	117	70%	0.701	82%	0.82	S	S	*	*			trans	-137.7	147.9	157.1	0	0	0	0	0	110.7
77	P	33.8	Very low	32	Very low	137 Å²	137	117 Å²	117	89%	0.89	82%	0.818	S	S	*	*			trans	-100.7	111.1	-174.3	35.1	-25.8	0	0	0	112
78	A	30.2	Very low	32.1	Very low	95 Å²	95	116.3 Å²	116.3	79%	0.785	82%	0.823	S	S	*	*			trans	-158.2	115.4	154.9	0	0	0	0	0	107.7	D80	A78-D80 PolarHBondContact O-N 3Å
79	G	30.3	Very low	32.5	Very low	83 Å²	83	112.8 Å²	112.8	86%	0.856	80%	0.797	S	S	*	*			trans	-75.6	90.7	-174.6	0	0	0	0	0	112.1
80	D	25.7	Very low	33.6	Very low	159 Å²	159	111.8 Å²	111.8	85%	0.85	77%	0.773	S	S	*	*			trans	-83.3	117.7	152.4	-84.5	-33.2	0	0	0	108	A78 A82	A78-D80 PolarHBondContact O-N 3Å; D80-A82 PolarHBondContact O-N 3.2Å
81	V	31.4	Very low	34.5	Very low	141 Å²	141	108.4 Å²	108.4	86%	0.855	73%	0.734	S	S	*	*			trans	-69.2	99.3	174.3	-178.1	0	0	0	0	107.1	E83	V81-E83 PolarHBondContact O-N 2.9Å
82	A	28.9	Very low	35.9	Very low	89 Å²	89	109 Å²	109	74%	0.736	73%	0.725	S	S	*	*			trans	-52.5	122.4	172	0	0	0	0	0	109.9	D80 A84	D80-A82 PolarHBondContact O-N 3.2Å; A82-A84 PolarHBondContact O-N 3.4Å; A82-A84 VanDerWaalsContact O-N 3.12Å
83	E	31.1	Very low	36.8	Very low	176 Å²	176	106.6 Å²	106.6	82%	0.822	70%	0.701	S	S	*	*			trans	-55.6	115	169.9	-77.4	-173.7	134.2	0	0	109.2	V81	V81-E83 PolarHBondContact O-N 2.9Å
84	A	27.9	Very low	38.7	Very low	88 Å²	88	102.4 Å²	102.4	73%	0.727	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-66.6	139.8	171	0	0	0	0	0	110	A82	A82-A84 PolarHBondContact O-N 3.4Å; A82-A84 VanDerWaalsContact O-N 3.12Å
85	P	30.8	Very low	41	Very low	119 Å²	119	95.3 Å²	95.3	77%	0.773	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-62.7	139	175.7	25.6	-32.2	0	0	0	110.7
86	L	36.8	Very low	43.5	Very low	134 Å²	134	87.1 Å²	87.1	70%	0.702	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-51.9	135.1	177.9	-73.7	155.1	0	0	0	111.2
87	P	42.9	Very low	46.3	Very low	108 Å²	108	85.7 Å²	85.7	70%	0.701	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-79.7	137.7	-175.9	30.1	-31.7	0	0	0	111.9	G89	P87-G89 PolarHBondContact O-N 3.48Å
88	A	38.2	Very low	48.8	Very low	110 Å²	110	83.2 Å²	83.2	91%	0.909	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	30	178.8	0	0	0	0	0	115.8
89	G	44.5	Very low	51.6	Low	38 Å²	38	85.5 Å²	85.5	39%	0.392	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.5	-28.4	-164.2	0	0	0	0	0	117.6	P87 L91 S92	P87-G89 PolarHBondContact O-N 3.48Å; G89-L91 PolarHBondContact O-N 3.25Å; G89-S92 WeakPolarHBondContact O-CB 3.37Å; G89-S92 PolarHBondContact O-N 2.91Å; G89-S92 PolarHBondContact O-OG 3.4Å
90	Q	52.9	Low	54.3	Low	53 Å²	53	85.7 Å²	85.7	25%	0.248	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-27.1	-164.2	-78.6	-178.6	-28.4	0	0	115	C93 D505	Q90-C93 PolarHBondContact O-SG 2.97Å; Q90-D505 PolarHBondContact NE2-OD2 3.25Å
91	L	55.3	Low	57.5	Low	19 Å²	19	81.1 Å²	81.1	10%	0.099	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	3.2	178.5	-70.9	159.2	0	0	0	113.4	H59 G89 C93 I94 F371 W620 V623	H59-L91 WeakPolarHBondContact NE2-CD1 3.44Å; G89-L91 PolarHBondContact O-N 3.25Å; L91-C93 PolarHBondContact O-N 3.41Å; L91-I94 HydrophobicContact CD2-CD1 3.68Å; L91-I94 HydrophobicContact CD2-CG1 4.4Å; L91-I94 PolarHBondContact O-N 3.21Å; L91-F371 HydrophobicContact CD2-CE1 4.35Å; L91-W620 HydrophobicContact CD2-CE3 4.48Å; L91-W620 HydrophobicContact CD2-CH2 3.3Å; L91-W620 HydrophobicContact CD2-CZ2 3.87Å; L91-W620 HydrophobicContact CD2-CZ3 3.69Å; L91-W620 HydrophobicContact CG-CH2 4.18Å; L91-W620 HydrophobicContact CG-CZ2 4.28Å; L91-V623 HydrophobicContact CD1-CG2 3.93Å; L91-V623 HydrophobicContact CD2-CG1 4.22Å
92	S	55.9	Low	60.3	Low	90 Å²	90	77.8 Å²	77.8	63%	0.629	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.3	175.5	65.7	0	0	0	0	112.9	G89 I94	G89-S92 WeakPolarHBondContact O-CB 3.37Å; G89-S92 PolarHBondContact O-N 2.91Å; G89-S92 PolarHBondContact O-OG 3.4Å; S92-I94 PolarHBondContact O-N 3.33Å
93	C	58.3	Low	63.2	Low	59 Å²	59	78.3 Å²	78.3	40%	0.399	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.5	172.8	60.2	0	0	0	0	113.6	Q90 L91 Q374	Q90-C93 PolarHBondContact O-SG 2.97Å; L91-C93 PolarHBondContact O-N 3.41Å; C93-Q374 PolarHBondContact SG-NE2 3.46Å
94	I	69.9	Low	66.1	Low	6 Å²	6	70.1 Å²	70.1	3%	0.031	43%	0.43	C	S	.	.			trans	-105.1	91.1	-178.8	-51.5	-173.7	0	0	0	108.7	F52 L91 S92 I370 F371 W620	F52-I94 HydrophobicContact CE1-CG2 4.01Å; L91-I94 HydrophobicContact CD2-CD1 3.68Å; L91-I94 HydrophobicContact CD2-CG1 4.4Å; L91-I94 PolarHBondContact O-N 3.21Å; S92-I94 PolarHBondContact O-N 3.33Å; I94-I370 HydrophobicContact CD1-CG2 4.18Å; I94-I370 HydrophobicContact CG1-CG2 3.93Å; I94-F371 HydrophobicContact CB-CZ 4.43Å; I94-F371 HydrophobicContact CD1-CD1 3.55Å; I94-F371 HydrophobicContact CD1-CD2 4Å; I94-F371 HydrophobicContact CD1-CE1 3.25Å; I94-F371 HydrophobicContact CD1-CE2 3.77Å; I94-F371 HydrophobicContact CD1-CG 3.91Å; I94-F371 HydrophobicContact CD1-CZ 3.42Å; I94-F371 VanDerWaalsContact CD1-CZ 3.42Å; I94-F371 HydrophobicContact CG1-CZ 4.46Å; I94-F371 HydrophobicContact CG2-CD2 4.38Å; I94-F371 HydrophobicContact CG2-CE2 3.51Å; I94-F371 HydrophobicContact CG2-CZ 3.6Å; I94-W620 HydrophobicContact CD1-CH2 4.15Å; I94-W620 HydrophobicContact CD1-CZ3 4.26Å
95	S	77.3	Confident	69.1	Low	47 Å²	47	68.8 Å²	68.8	33%	0.329	41%	0.409	S	S	.	.			trans	-137.7	158.9	177.1	63.3	0	0	0	0	110.4	P97	S95-P97 VanDerWaalsContact O-CD 3.23Å; S95-P97 WeakPolarHBondContact O-CD 3.34Å
96	F	85.1	Confident	71.8	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.048	39%	0.394	C	S	.	.			trans	-70.7	118.8	164	-156.4	149.2	0	0	0	107.3	L45 T48 Q49 F52 P98 E100 E101 L104 V363	L45-F96 HydrophobicContact CD1-CE1 3.72Å; L45-F96 HydrophobicContact CD1-CZ 3.76Å; T48-F96 HydrophobicContact CG2-CD1 3.89Å; T48-F96 HydrophobicContact CG2-CE1 3.62Å; T48-F96 HydrophobicContact CG2-CZ 4.4Å; Q49-F96 HydrophobicContact CG-CD1 4.36Å; Q49-F96 HydrophobicContact CG-CE1 4.23Å; F52-F96 HydrophobicContact CD2-CB 3.73Å; F52-F96 AromaticContact CD2-CD1 3.91Å; F52-F96 HydrophobicContact CD2-CD1 3.91Å; F52-F96 HydrophobicContact CD2-CG 4.13Å; F52-F96 HydrophobicContact CE2-CB 4.03Å; F52-F96 HydrophobicContact CE2-CD1 4.19Å; F52-F96 HydrophobicContact CE2-CG 4.23Å; F52-F96 HydrophobicContact CG-CB 4.05Å; F96-P98 WeakPolarHBondContact O-CD 3.21Å; F96-E100 HydrophobicContact CE2-CB 4.14Å; F96-E101 HydrophobicContact CD1-CB 4.36Å; F96-E101 HydrophobicContact CD1-CG 4.3Å; F96-E101 HydrophobicContact CD2-CB 3.76Å; F96-E101 HydrophobicContact CE1-CB 4.38Å; F96-E101 HydrophobicContact CE1-CG 4.29Å; F96-E101 HydrophobicContact CE2-CB 3.81Å; F96-E101 HydrophobicContact CG-CB 4.09Å; F96-E101 HydrophobicContact CG-CG 4.45Å; F96-E101 HydrophobicContact CZ-CB 4.14Å; F96-E101 HydrophobicContact CZ-CG 4.45Å; F96-L104 HydrophobicContact CE2-CD1 4.24Å; F96-L104 HydrophobicContact CZ-CD1 3.87Å; F96-V363 HydrophobicContact CD2-CG1 4.16Å; F96-V363 HydrophobicContact CE2-CG1 4.07Å; F96-V363 HydrophobicContact CE2-CG2 4.22Å
97	P	85.1	Confident	74.2	Confident	37 Å²	37	62.4 Å²	62.4	24%	0.24	37%	0.366	C	S	.	.			trans	-55.5	123.8	173.4	-29	40	0	0	0	111.8	S95 M99 E100 E101	S95-P97 VanDerWaalsContact O-CD 3.23Å; S95-P97 WeakPolarHBondContact O-CD 3.34Å; P97-M99 VanDerWaalsContact C-N 3.3Å; P97-M99 PolarHBondContact O-N 3.07Å; P97-E100 HydrophobicContact CB-CB 4.2Å; P97-E100 HydrophobicContact CB-CG 4.26Å; P97-E100 WeakPolarHBondContact CB-OE2 3.08Å; P97-E100 PolarHBondContact O-N 3.43Å; P97-E101 PolarHBondContact O-N 3.37Å
98	P	86.8	Confident	76.4	Confident	86 Å²	86	57.4 Å²	57.4	56%	0.558	33%	0.333	S	S	*	.	H	α-helix	trans	-63	-31.3	-171.9	-25.8	33.8	0	0	0	114.8	F96 T102	F96-P98 WeakPolarHBondContact O-CD 3.21Å; P98-T102 WeakPolarHBondContact O-CB 3.4Å; P98-T102 PolarHBondContact O-N 2.84Å; P98-T102 PolarHBondContact O-OG1 3.43Å
99	M	87.9	Confident	78.7	Confident	142 Å²	142	56.3 Å²	56.3	70%	0.7	31%	0.312	S	S	*	.	H	α-helix	trans	-68.4	-46.8	178.7	-67.9	-68.5	99	0	0	110.6	P97 T102 Y103	P97-M99 VanDerWaalsContact C-N 3.3Å; P97-M99 PolarHBondContact O-N 3.07Å; M99-T102 PolarHBondContact O-N 2.93Å; M99-Y103 VanDerWaalsContact O-CB 3.28Å; M99-Y103 WeakPolarHBondContact O-CB 3.15Å; M99-Y103 PolarHBondContact O-N 3.42Å
100	E	88.9	Confident	80.7	Confident	87 Å²	87	58 Å²	58	41%	0.407	31%	0.307	S	S	.	.	H	α-helix	trans	-65.7	-39.9	176.8	-70.7	79.8	166.9	0	0	111.5	F96 P97 Y103 L104 V363	F96-E100 HydrophobicContact CE2-CB 4.14Å; P97-E100 HydrophobicContact CB-CB 4.2Å; P97-E100 HydrophobicContact CB-CG 4.26Å; P97-E100 WeakPolarHBondContact CB-OE2 3.08Å; P97-E100 PolarHBondContact O-N 3.43Å; E100-Y103 PolarHBondContact O-N 3.37Å; E100-L104 VanDerWaalsContact O-CB 3.29Å; E100-L104 WeakPolarHBondContact O-CB 3.37Å; E100-L104 VanDerWaalsContact O-CG 3.32Å; E100-L104 WeakPolarHBondContact O-CG 3.39Å; E100-L104 PolarHBondContact O-N 3.29Å; E100-V363 HydrophobicContact CB-CG2 4.15Å; E100-V363 HydrophobicContact CG-CG2 4.29Å
101	E	90.9	Very high	82.5	Confident	64 Å²	64	58.6 Å²	58.6	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-59.8	-50.4	174.3	-175.3	172.9	-167.3	0	0	111	Q49 F96 P97 Y103 L104 Q105	Q49-E101 PolarHBondContact NE2-OE1 2.86Å; F96-E101 HydrophobicContact CD1-CB 4.36Å; F96-E101 HydrophobicContact CD1-CG 4.3Å; F96-E101 HydrophobicContact CD2-CB 3.76Å; F96-E101 HydrophobicContact CE1-CB 4.38Å; F96-E101 HydrophobicContact CE1-CG 4.29Å; F96-E101 HydrophobicContact CE2-CB 3.81Å; F96-E101 HydrophobicContact CG-CB 4.09Å; F96-E101 HydrophobicContact CG-CG 4.45Å; F96-E101 HydrophobicContact CZ-CB 4.14Å; F96-E101 HydrophobicContact CZ-CG 4.45Å; P97-E101 PolarHBondContact O-N 3.37Å; E101-Y103 PolarHBondContact O-N 2.95Å; E101-L104 PolarHBondContact O-N 2.94Å; E101-Q105 VanDerWaalsContact O-CB 3.28Å; E101-Q105 WeakPolarHBondContact O-CB 3.42Å; E101-Q105 PolarHBondContact O-N 3.39Å
102	T	90.9	Very high	84.2	Confident	70 Å²	70	57.9 Å²	57.9	43%	0.429	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-45	179.2	-54.3	0	0	0	0	111.5	P98 M99 Q105 Q106	P98-T102 WeakPolarHBondContact O-CB 3.4Å; P98-T102 PolarHBondContact O-N 2.84Å; P98-T102 PolarHBondContact O-OG1 3.43Å; M99-T102 PolarHBondContact O-N 2.93Å; T102-Q105 PolarHBondContact O-N 3.1Å; T102-Q106 VanDerWaalsContact O-CG 3.31Å; T102-Q106 WeakPolarHBondContact O-CG 3.1Å; T102-Q106 PolarHBondContact O-N 3.48Å
103	Y	90	Very high	86.1	Confident	101 Å²	101	53.7 Å²	53.7	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-48.3	177.5	170.2	-102.3	0	0	0	112.2	M99 E100 E101 Q106 L107 A359	M99-Y103 VanDerWaalsContact O-CB 3.28Å; M99-Y103 WeakPolarHBondContact O-CB 3.15Å; M99-Y103 PolarHBondContact O-N 3.42Å; E100-Y103 PolarHBondContact O-N 3.37Å; E101-Y103 PolarHBondContact O-N 2.95Å; Y103-Q106 PolarHBondContact O-N 3.48Å; Y103-L107 HydrophobicContact CE1-CD1 4.14Å; Y103-L107 WeakPolarHBondContact O-CB 3.41Å; Y103-L107 PolarHBondContact O-N 3.42Å; Y103-A359 HydrophobicContact CE1-CB 4.32Å
104	L	91.5	Very high	87.9	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-40.5	179	-77.9	167.8	0	0	0	111.6	L45 F96 E100 E101 L107 V108 A356 A359 L360	L45-L104 HydrophobicContact CD1-CB 4.08Å; L45-L104 HydrophobicContact CD1-CD1 4.27Å; L45-L104 HydrophobicContact CD2-CB 4.2Å; F96-L104 HydrophobicContact CE2-CD1 4.24Å; F96-L104 HydrophobicContact CZ-CD1 3.87Å; E100-L104 VanDerWaalsContact O-CB 3.29Å; E100-L104 WeakPolarHBondContact O-CB 3.37Å; E100-L104 VanDerWaalsContact O-CG 3.32Å; E100-L104 WeakPolarHBondContact O-CG 3.39Å; E100-L104 PolarHBondContact O-N 3.29Å; E101-L104 PolarHBondContact O-N 2.94Å; L104-L107 PolarHBondContact O-N 3.11Å; L104-V108 WeakPolarHBondContact O-CG1 3.48Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 3.36Å; L104-A356 HydrophobicContact CD2-CB 4.24Å; L104-A359 HydrophobicContact CD2-CB 3.95Å; L104-A359 HydrophobicContact CG-CB 4.47Å; L104-L360 HydrophobicContact CD1-CB 4.23Å; L104-L360 HydrophobicContact CD1-CD1 4.01Å; L104-L360 HydrophobicContact CD2-CB 4.41Å
105	Q	91.9	Very high	89.1	Confident	60 Å²	60	50.6 Å²	50.6	28%	0.28	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-50.9	177.1	-168.7	63.5	54.2	0	0	111	E101 T102 L107 V108 D109	E101-Q105 VanDerWaalsContact O-CB 3.28Å; E101-Q105 WeakPolarHBondContact O-CB 3.42Å; E101-Q105 PolarHBondContact O-N 3.39Å; T102-Q105 PolarHBondContact O-N 3.1Å; Q105-L107 VanDerWaalsContact C-N 3.29Å; Q105-L107 PolarHBondContact O-N 2.81Å; Q105-V108 WeakPolarHBondContact O-CG2 3.32Å; Q105-V108 PolarHBondContact O-N 3.03Å; Q105-D109 WeakPolarHBondContact CG-OD2 3.13Å; Q105-D109 VanDerWaalsContact NE2-CG 3.26Å; Q105-D109 PolarHBondContact NE2-OD1 2.8Å; Q105-D109 PolarHBondContact NE2-OD2 2.75Å; Q105-D109 WeakPolarHBondContact O-CB 3.2Å; Q105-D109 PolarHBondContact O-N 3.41Å
106	Q	88	Confident	90.1	Very high	99 Å²	99	48.4 Å²	48.4	46%	0.463	24%	0.242	S	C	.	.	H	α-helix	trans	-58.7	-39.9	176	-72	176.3	-3.5	0	0	112.5	T102 Y103 R110	T102-Q106 VanDerWaalsContact O-CG 3.31Å; T102-Q106 WeakPolarHBondContact O-CG 3.1Å; T102-Q106 PolarHBondContact O-N 3.48Å; Y103-Q106 PolarHBondContact O-N 3.48Å; Q106-R110 WeakPolarHBondContact O-CG 3.44Å
107	L	86.3	Confident	90.5	Very high	19 Å²	19	47.9 Å²	47.9	10%	0.099	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-45.5	179.7	-167.5	163.8	0	0	0	111.3	Y103 L104 Q105 A356	Y103-L107 HydrophobicContact CE1-CD1 4.14Å; Y103-L107 WeakPolarHBondContact O-CB 3.41Å; Y103-L107 PolarHBondContact O-N 3.42Å; L104-L107 PolarHBondContact O-N 3.11Å; Q105-L107 VanDerWaalsContact C-N 3.29Å; Q105-L107 PolarHBondContact O-N 2.81Å; L107-A356 HydrophobicContact CD1-CB 3.79Å; L107-A356 HydrophobicContact CD2-CB 3.51Å; L107-A356 HydrophobicContact CG-CB 4.24Å
108	V	88.3	Confident	90.8	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-76.4	-24.9	-176.6	-59.8	0	0	0	0	113.4	L38 L41 R42 L45 L104 Q105	L38-V108 HydrophobicContact CD1-CB 4.23Å; L38-V108 HydrophobicContact CD1-CG1 4.48Å; L41-V108 HydrophobicContact CB-CG1 4.12Å; R42-V108 HydrophobicContact CG-CB 3.81Å; R42-V108 HydrophobicContact CG-CG2 4.02Å; R42-V108 PolarHBondContact NE-O 3.25Å; R42-V108 PolarHBondContact NH2-O 3Å; L45-V108 HydrophobicContact CD2-CG2 3.71Å; L104-V108 WeakPolarHBondContact O-CG1 3.48Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 3.36Å; Q105-V108 WeakPolarHBondContact O-CG2 3.32Å; Q105-V108 PolarHBondContact O-N 3.03Å
109	D	87.8	Confident	90.8	Very high	86 Å²	86	43.1 Å²	43.1	46%	0.46	21%	0.208	S	C	.	.	H	α-helix	trans	-76	-28.6	-177.2	-72.9	-20	0	0	0	112.9	R42 Q105 L111	R42-D109 PolarHBondContact NH2-O 3.28Å; Q105-D109 WeakPolarHBondContact CG-OD2 3.13Å; Q105-D109 VanDerWaalsContact NE2-CG 3.26Å; Q105-D109 PolarHBondContact NE2-OD1 2.8Å; Q105-D109 PolarHBondContact NE2-OD2 2.75Å; Q105-D109 WeakPolarHBondContact O-CB 3.2Å; Q105-D109 PolarHBondContact O-N 3.41Å; D109-L111 PolarHBondContact O-N 3.41Å
110	R	86.9	Confident	90.6	Very high	75 Å²	75	36.8 Å²	36.8	28%	0.283	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-74.5	123.4	-179.3	-67	177.1	-176.6	175.2	5.7	112.5	Q106 A241 N242	Q106-R110 WeakPolarHBondContact O-CG 3.44Å; R110-A241 PolarHBondContact NE-O 2.64Å; R110-A241 PolarHBondContact NH1-O 3.29Å; R110-N242 PolarHBondContact NE-O 3.45Å; R110-N242 PolarHBondContact NH2-O 2.9Å
111	L	89	Confident	90.5	Very high	65 Å²	65	32.7 Å²	32.7	34%	0.34	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	152	172.1	-70.4	178.3	0	0	0	110.8	L38 D109 F244 L245	L38-L111 HydrophobicContact CD2-CD2 3.81Å; D109-L111 PolarHBondContact O-N 3.41Å; L111-F244 CarbonylContact O-C 3.2Å; L111-F244 WeakPolarHBondContact O-CA 3.44Å; L111-L245 PolarHBondContact O-N 3.43Å
112	P	92.6	Very high	90.3	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	148	-179.3	33.6	-32.5	0	0	0	110.5	F31 Y34 V220 L245 L349	F31-P112 HydrophobicContact CD1-CB 4.04Å; F31-P112 HydrophobicContact CD1-CG 3.78Å; F31-P112 HydrophobicContact CE1-CB 3.9Å; F31-P112 HydrophobicContact CE1-CG 4.16Å; Y34-P112 HydrophobicContact CD1-CG 3.83Å; Y34-P112 HydrophobicContact CE1-CB 4.39Å; Y34-P112 HydrophobicContact CE1-CG 3.91Å; P112-V220 WeakPolarHBondContact O-CG2 3.31Å; P112-L245 VanDerWaalsContact CA-O 3.3Å; P112-L245 WeakPolarHBondContact CA-O 3.4Å; P112-L349 HydrophobicContact CB-CD2 3.69Å; P112-L349 HydrophobicContact CG-CD2 4.49Å
113	C	94.4	Very high	90.3	Very high	2 Å²	2	27 Å²	27	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.6	175.6	-179.9	0	0	0	0	108.6	D221 V223 F244 L245 P246 V247	C113-D221 WeakPolarHBondContact CA-O 3.27Å; C113-D221 PolarHBondContact SG-O 3.39Å; C113-D221 VanDerWaalsContact SG-O 3.4Å; C113-V223 VanDerWaalsContact SG-CG2 3.57Å; C113-F244 HydrophobicContact CB-CB 3.9Å; C113-F244 HydrophobicContact CB-CD1 4.16Å; C113-F244 HydrophobicContact CB-CG 4.1Å; C113-L245 PolarHBondContact N-O 2.98Å; C113-P246 CarbonylContact O-C 3.59Å; C113-P246 WeakPolarHBondContact O-CA 3.45Å; C113-V247 PolarHBondContact O-N 2.86Å
114	I	96.4	Very high	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	123.4	168.7	-60.9	175.9	0	0	0	107.6	F31 I116 L131 V220 D221 I222 V223 V247 T249	F31-I114 HydrophobicContact CE2-CD1 4.05Å; F31-I114 HydrophobicContact CE2-CG1 4.4Å; F31-I114 HydrophobicContact CZ-CD1 4.04Å; F31-I114 HydrophobicContact CZ-CG1 3.87Å; I114-I116 HydrophobicContact CG2-CG1 4.31Å; I114-L131 HydrophobicContact CG2-CD1 4.38Å; I114-V220 HydrophobicContact CD1-CG1 3.84Å; I114-V220 HydrophobicContact CG1-CG1 4.16Å; I114-V220 HydrophobicContact CG1-CG2 4.07Å; I114-D221 PolarHBondContact N-O 3.23Å; I114-I222 HydrophobicContact CB-CG1 4.21Å; I114-I222 HydrophobicContact CB-CG2 4.24Å; I114-I222 HydrophobicContact CD1-CG1 4.39Å; I114-I222 HydrophobicContact CG2-CG2 4.28Å; I114-I222 CarbonylContact O-C 3.56Å; I114-I222 WeakPolarHBondContact O-CA 3.5Å; I114-V223 PolarHBondContact O-N 3.37Å; I114-V247 HydrophobicContact CG1-CB 4.43Å; I114-T249 HydrophobicContact CG2-CG2 4.29Å
115	L	96.2	Very high	90.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.6	174.5	176.5	60.1	0	0	0	109.5	L117 V223 A225 V236 L237 L240 P246 V247 T249	L115-L117 HydrophobicContact CD1-CD2 4.37Å; L115-L117 HydrophobicContact CD2-CD2 4.16Å; L115-L117 HydrophobicContact CD2-CG 4.39Å; L115-L117 HydrophobicContact CG-CD2 4.15Å; L115-L117 HydrophobicContact CG-CG 4.3Å; L115-V223 CarbonylContact C-O 3.49Å; L115-V223 WeakPolarHBondContact CA-O 3.37Å; L115-V223 HydrophobicContact CD1-CB 4.19Å; L115-V223 HydrophobicContact CD1-CG1 4Å; L115-A225 HydrophobicContact CD1-CB 4.42Å; L115-V236 HydrophobicContact CD1-CG1 4.34Å; L115-L237 HydrophobicContact CD2-CD2 3.3Å; L115-L237 HydrophobicContact CD2-CG 4Å; L115-L240 HydrophobicContact CD1-CD1 3.53Å; L115-L240 HydrophobicContact CD2-CD1 3.87Å; L115-L240 HydrophobicContact CG-CD1 4.19Å; L115-P246 HydrophobicContact CB-CB 4.41Å; L115-V247 PolarHBondContact N-O 2.84Å; L115-T249 PolarHBondContact O-N 3.23Å; L115-T249 PolarHBondContact O-OG1 3.38Å
116	I	96.4	Very high	90.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	102.6	177.1	-55	-179.5	0	0	0	109.1	I114 K124 L127 L128 L131 I222 V223 V224 A225 T249	I114-I116 HydrophobicContact CG2-CG1 4.31Å; I116-K124 HydrophobicContact CG2-CB 4.08Å; I116-K124 HydrophobicContact CG2-CG 4.15Å; I116-L127 HydrophobicContact CG2-CB 4.45Å; I116-L127 HydrophobicContact CG2-CD2 4.09Å; I116-L127 HydrophobicContact CG2-CG 4.49Å; I116-L128 HydrophobicContact CD1-CB 3.92Å; I116-L128 HydrophobicContact CD1-CD1 3.88Å; I116-L131 HydrophobicContact CD1-CD1 3.78Å; I116-L131 HydrophobicContact CG1-CD1 4.41Å; I116-I222 HydrophobicContact CD1-CG2 3.76Å; I116-I222 HydrophobicContact CG1-CG2 4.13Å; I116-V223 PolarHBondContact N-O 3.03Å; I116-V224 HydrophobicContact CB-CG2 4.45Å; I116-V224 HydrophobicContact CD1-CG2 4.26Å; I116-A225 WeakPolarHBondContact O-CB 3.38Å; I116-A225 PolarHBondContact O-N 2.81Å; I116-T249 WeakPolarHBondContact CA-OG1 3.32Å
117	L	94.3	Very high	90.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	171.7	162	-56.2	-177.1	0	0	0	109	L115 A225 L237 I248 T249 Y250 A251 M276	L115-L117 HydrophobicContact CD1-CD2 4.37Å; L115-L117 HydrophobicContact CD2-CD2 4.16Å; L115-L117 HydrophobicContact CD2-CG 4.39Å; L115-L117 HydrophobicContact CG-CD2 4.15Å; L115-L117 HydrophobicContact CG-CG 4.3Å; L117-A225 HydrophobicContact CD2-CB 3.5Å; L117-A225 VanDerWaalsContact CD2-CB 3.5Å; L117-L237 HydrophobicContact CD1-CD1 4.22Å; L117-I248 HydrophobicContact CD1-CG2 3.84Å; L117-I248 HydrophobicContact CG-CG2 4.26Å; L117-T249 WeakPolarHBondContact CB-O 3.19Å; L117-T249 PolarHBondContact N-O 3.06Å; L117-Y250 HydrophobicContact CB-CD2 3.56Å; L117-Y250 HydrophobicContact CB-CE2 4.11Å; L117-Y250 HydrophobicContact CB-CG 4.37Å; L117-Y250 HydrophobicContact CD1-CD2 4.39Å; L117-Y250 CarbonylContact O-C 3.6Å; L117-Y250 WeakPolarHBondContact O-CA 3.11Å; L117-A251 PolarHBondContact O-N 3.37Å; L117-M276 HydrophobicContact CD1-CE 4.07Å
118	G	91.1	Very high	91	Very high	3 Å²	3	14.4 Å²	14.4	3%	0.031	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.1	165.9	172.9	0	0	0	0	0	114.2	D120 A251	G118-D120 VanDerWaalsContact C-N 3.28Å; G118-D120 PolarHBondContact O-N 3.44Å; G118-A251 CarbonylContact C-O 3.59Å; G118-A251 WeakPolarHBondContact CA-O 3.43Å
119	Q	86.8	Confident	91.2	Very high	21 Å²	21	15 Å²	15	10%	0.098	7%	0.074	C	C	.	.	S	Bend	trans	-59.6	-37	-178.3	180	171.2	35.1	0	0	112.9	Y250 A251 L252 E256	Q119-Y250 HydrophobicContact CB-CE1 4.34Å; Q119-A251 PolarHBondContact N-O 3.35Å; Q119-L252 HydrophobicContact CB-CD2 4.41Å; Q119-E256 PolarHBondContact NE2-O 3.43Å
120	D	84.9	Confident	91.4	Very high	8 Å²	8	14 Å²	14	4%	0.043	7%	0.069	C	C	.	.	S	Bend	trans	-150.2	167.6	179.8	62.1	68.5	0	0	0	111.1	G118 N122 A123 K124 D145	G118-D120 VanDerWaalsContact C-N 3.28Å; G118-D120 PolarHBondContact O-N 3.44Å; D120-N122 VanDerWaalsContact C-N 3.32Å; D120-N122 PolarHBondContact O-N 2.71Å; D120-N122 WeakPolarHBondContact OD1-CA 3.32Å; D120-N122 WeakPolarHBondContact OD1-CB 3.43Å; D120-N122 PolarHBondContact OD1-N 3.21Å; D120-A123 WeakPolarHBondContact OD1-CB 3.4Å; D120-A123 PolarHBondContact OD1-N 2.87Å; D120-K124 WeakPolarHBondContact O-CG 3.36Å; D120-K124 PolarHBondContact O-N 3.35Å; D120-D145 VanDerWaalsContact CB-OD1 3.3Å; D120-D145 WeakPolarHBondContact CB-OD1 3.32Å
121	C	86.3	Confident	91.7	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.014	6%	0.055	C	C	.	.	H	α-helix	trans	-60.3	-38.8	-179.6	-64.4	0	0	0	0	113.2	K124 C125 L140 C148 L150	C121-K124 PolarHBondContact O-N 2.84Å; C121-C125 PolarHBondContact O-N 3.14Å; C121-C125 PolarHBondContact O-SG 3.14Å; C121-L140 HydrophobicContact CB-CD1 3.99Å; C121-C148 HydrophobicContact CB-CB 4.03Å; C121-C148 WeakPolarHBondContact CB-SG 3.4Å; C121-C148 WeakPolarHBondContact SG-CB 3.46Å; C121-C148 CovalentContact SG-SG 2.05Å; C121-C148 PolarHBondContact SG-SG 3.26Å; C121-L150 HydrophobicContact CB-CB 4.49Å; C121-L150 HydrophobicContact CB-CD2 4.25Å
122	N	86.7	Confident	91.9	Very high	14 Å²	14	7.5 Å²	7.5	8%	0.075	4%	0.04	C	C	.	.	H	α-helix	trans	-69.2	-42.5	-176.5	-173.6	17.4	0	0	0	111	D120 K124 C125 Q126 L140 L142	D120-N122 VanDerWaalsContact C-N 3.32Å; D120-N122 PolarHBondContact O-N 2.71Å; D120-N122 WeakPolarHBondContact OD1-CA 3.32Å; D120-N122 WeakPolarHBondContact OD1-CB 3.43Å; D120-N122 PolarHBondContact OD1-N 3.21Å; N122-K124 VanDerWaalsContact C-N 3.29Å; N122-K124 PolarHBondContact O-N 3.2Å; N122-C125 PolarHBondContact O-N 3.4Å; N122-Q126 VanDerWaalsContact CG-NE2 3.26Å; N122-Q126 PolarHBondContact ND2-NE2 2.68Å; N122-Q126 WeakPolarHBondContact O-CB 3.22Å; N122-Q126 VanDerWaalsContact O-CG 3.29Å; N122-Q126 WeakPolarHBondContact O-CG 3.27Å; N122-Q126 PolarHBondContact O-N 3.05Å; N122-Q126 PolarHBondContact OD1-NE2 3.38Å; N122-L140 HydrophobicContact CB-CB 4.33Å; N122-L140 PolarHBondContact ND2-O 3.35Å; N122-L140 VanDerWaalsContact ND2-O 3.12Å; N122-L142 HydrophobicContact CB-CD1 3.42Å; N122-L142 VanDerWaalsContact CB-CD1 3.42Å; N122-L142 HydrophobicContact CB-CG 4.41Å
123	A	89.9	Confident	91.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57	-43.6	174.2	0	0	0	0	0	111.4	D120 L127 A251 H253 V281	D120-A123 WeakPolarHBondContact OD1-CB 3.4Å; D120-A123 PolarHBondContact OD1-N 2.87Å; A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 PolarHBondContact O-N 2.83Å; A123-A251 VanDerWaalsContact C-CB 3.5Å; A123-A251 HydrophobicContact CB-CB 3.8Å; A123-A251 WeakPolarHBondContact O-CB 3.26Å; A123-H253 HydrophobicContact CB-CB 4.1Å; A123-V281 HydrophobicContact CB-CG2 4.19Å
124	K	92.3	Very high	91.5	Very high	3 Å²	3	12.9 Å²	12.9	1%	0.013	8%	0.083	C	C	.	.	H	α-helix	trans	-62.4	-49.1	176.6	-68.3	-177.5	-66.6	-178.9	0	112	I116 D120 C121 N122 L127 L128 V224 A225 P226	I116-K124 HydrophobicContact CG2-CB 4.08Å; I116-K124 HydrophobicContact CG2-CG 4.15Å; D120-K124 WeakPolarHBondContact O-CG 3.36Å; D120-K124 PolarHBondContact O-N 3.35Å; C121-K124 PolarHBondContact O-N 2.84Å; N122-K124 VanDerWaalsContact C-N 3.29Å; N122-K124 PolarHBondContact O-N 3.2Å; K124-L127 PolarHBondContact O-N 2.72Å; K124-L128 PolarHBondContact O-N 2.95Å; K124-V224 HydrophobicContact CB-CG1 3.85Å; K124-V224 HydrophobicContact CD-CG1 4.31Å; K124-A225 PolarHBondContact NZ-O 3.23Å; K124-P226 VanDerWaalsContact NZ-C 3.33Å; K124-P226 PolarHBondContact NZ-O 3.31Å
125	C	91.5	Very high	91.2	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-62.3	-43.6	178.3	-66.8	0	0	0	0	112.2	C121 N122 L128 N129 L137	C121-C125 PolarHBondContact O-N 3.14Å; C121-C125 PolarHBondContact O-SG 3.14Å; N122-C125 PolarHBondContact O-N 3.4Å; C125-L128 PolarHBondContact O-N 3.17Å; C125-N129 PolarHBondContact O-N 2.91Å; C125-L137 HydrophobicContact CB-CB 3.97Å; C125-L137 HydrophobicContact CB-CD1 4.04Å
126	Q	91.3	Very high	91	Very high	13 Å²	13	19 Å²	19	6%	0.061	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.6	-74.7	179.5	26.9	0	0	111.8	N122 L128 N129 L130 T139 V281	N122-Q126 VanDerWaalsContact CG-NE2 3.26Å; N122-Q126 PolarHBondContact ND2-NE2 2.68Å; N122-Q126 WeakPolarHBondContact O-CB 3.22Å; N122-Q126 VanDerWaalsContact O-CG 3.29Å; N122-Q126 WeakPolarHBondContact O-CG 3.27Å; N122-Q126 PolarHBondContact O-N 3.05Å; N122-Q126 PolarHBondContact OD1-NE2 3.38Å; Q126-L128 VanDerWaalsContact C-N 3.35Å; Q126-L128 PolarHBondContact O-N 2.82Å; Q126-N129 PolarHBondContact O-N 2.92Å; Q126-L130 VanDerWaalsContact O-CG 3.28Å; Q126-L130 WeakPolarHBondContact O-CG 3.32Å; Q126-L130 PolarHBondContact O-N 3.26Å; Q126-T139 HydrophobicContact CG-CG2 4.13Å; Q126-V281 HydrophobicContact CB-CB 4.25Å; Q126-V281 HydrophobicContact CB-CG1 4.13Å; Q126-V281 HydrophobicContact CB-CG2 4.47Å; Q126-V281 VanDerWaalsContact OE1-CG2 3.31Å
127	L	93.4	Very high	90.7	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-42.6	177	-179.6	54.1	0	0	0	111.4	I116 A123 K124 N129 L130 L131 A251 F279 V281 L338	I116-L127 HydrophobicContact CG2-CB 4.45Å; I116-L127 HydrophobicContact CG2-CD2 4.09Å; I116-L127 HydrophobicContact CG2-CG 4.49Å; A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 PolarHBondContact O-N 2.83Å; K124-L127 PolarHBondContact O-N 2.72Å; L127-N129 PolarHBondContact O-N 2.71Å; L127-L130 PolarHBondContact O-N 3.47Å; L127-L131 HydrophobicContact CD1-CD1 4.32Å; L127-L131 HydrophobicContact CD1-CG 4.1Å; L127-L131 HydrophobicContact CG-CD1 4.16Å; L127-L131 HydrophobicContact CG-CG 4.41Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.48Å; L127-A251 HydrophobicContact CB-CB 3.98Å; L127-A251 HydrophobicContact CD2-CB 3.82Å; L127-F279 HydrophobicContact CD1-CD1 3.66Å; L127-F279 HydrophobicContact CD1-CE1 4.14Å; L127-F279 HydrophobicContact CD1-CG 4.34Å; L127-V281 HydrophobicContact CB-CG1 4.13Å; L127-L338 HydrophobicContact CD1-CD1 4.02Å
128	L	94.7	Very high	90.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-48.9	175.2	-177.5	74.6	0	0	0	111.6	I116 K124 C125 Q126 L130 L131 L132 L137 F155 I222 V224	I116-L128 HydrophobicContact CD1-CB 3.92Å; I116-L128 HydrophobicContact CD1-CD1 3.88Å; K124-L128 PolarHBondContact O-N 2.95Å; C125-L128 PolarHBondContact O-N 3.17Å; Q126-L128 VanDerWaalsContact C-N 3.35Å; Q126-L128 PolarHBondContact O-N 2.82Å; L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 PolarHBondContact O-N 2.92Å; L128-L131 PolarHBondContact O-N 2.98Å; L128-L131 VanDerWaalsContact O-N 3.09Å; L128-L132 HydrophobicContact CD1-CD1 4.13Å; L128-L132 HydrophobicContact CD1-CG 4.33Å; L128-L132 HydrophobicContact CD2-CD1 4.36Å; L128-L132 HydrophobicContact CG-CD1 4Å; L128-L132 HydrophobicContact CG-CG 4.42Å; L128-L132 PolarHBondContact O-N 3.45Å; L128-L137 HydrophobicContact CB-CD1 4.34Å; L128-L137 HydrophobicContact CD2-CD1 3.33Å; L128-L137 HydrophobicContact CD2-CG 3.81Å; L128-L137 HydrophobicContact CG-CD1 4.44Å; L128-F155 HydrophobicContact CD1-CD2 4.34Å; L128-F155 HydrophobicContact CD2-CD1 4.43Å; L128-F155 HydrophobicContact CD2-CD2 3.82Å; L128-F155 HydrophobicContact CD2-CE1 3.97Å; L128-F155 HydrophobicContact CD2-CE2 3.3Å; L128-F155 HydrophobicContact CD2-CG 4.38Å; L128-F155 HydrophobicContact CD2-CZ 3.39Å; L128-I222 HydrophobicContact CD1-CB 4.2Å; L128-I222 HydrophobicContact CD1-CD1 4.18Å; L128-I222 HydrophobicContact CD1-CG2 3.54Å; L128-V224 HydrophobicContact CB-CG2 4.43Å; L128-V224 HydrophobicContact CD1-CG2 4.27Å; L128-V224 HydrophobicContact CD2-CG2 4.12Å
129	N	93	Very high	89.5	Confident	17 Å²	17	21.8 Å²	21.8	9%	0.091	13%	0.129	C	C	.	.	H	α-helix	trans	-58.8	-39.9	178.8	-72.4	-21.4	0	0	0	111.6	C125 Q126 L127 G133 V134 V136 L137	C125-N129 PolarHBondContact O-N 2.91Å; Q126-N129 PolarHBondContact O-N 2.92Å; L127-N129 PolarHBondContact O-N 2.71Å; N129-G133 WeakPolarHBondContact O-CA 3.44Å; N129-G133 PolarHBondContact O-N 3.31Å; N129-V134 WeakPolarHBondContact CA-O 3.35Å; N129-V134 PolarHBondContact O-N 3.47Å; N129-V134 PolarHBondContact OD1-O 2.91Å; N129-V136 PolarHBondContact OD1-N 3.43Å; N129-L137 PolarHBondContact ND2-O 3.39Å; N129-L137 PolarHBondContact OD1-N 2.93Å
130	L	92.3	Very high	88.4	Confident	66 Å²	66	22.1 Å²	22.1	35%	0.346	13%	0.131	S	C	.	.	H	α-helix	trans	-65.6	-38.7	174.8	-70.7	171.5	0	0	0	112.8	Q126 L127 L128 G133 F279 P282 L338	Q126-L130 VanDerWaalsContact O-CG 3.28Å; Q126-L130 WeakPolarHBondContact O-CG 3.32Å; Q126-L130 PolarHBondContact O-N 3.26Å; L127-L130 PolarHBondContact O-N 3.47Å; L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 PolarHBondContact O-N 2.92Å; L130-G133 PolarHBondContact O-N 2.89Å; L130-F279 HydrophobicContact CD1-CE1 3.89Å; L130-F279 HydrophobicContact CD1-CZ 4.48Å; L130-P282 HydrophobicContact CD1-CG 4.42Å; L130-L338 HydrophobicContact CB-CD2 3.95Å
131	L	92.4	Very high	87	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69	-38.7	178.5	-71.4	174.6	0	0	0	112.7	M23 I114 I116 L127 L128 L341	M23-L131 HydrophobicContact CE-CD2 4.22Å; I114-L131 HydrophobicContact CG2-CD1 4.38Å; I116-L131 HydrophobicContact CD1-CD1 3.78Å; I116-L131 HydrophobicContact CG1-CD1 4.41Å; L127-L131 HydrophobicContact CD1-CD1 4.32Å; L127-L131 HydrophobicContact CD1-CG 4.1Å; L127-L131 HydrophobicContact CG-CD1 4.16Å; L127-L131 HydrophobicContact CG-CG 4.41Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.48Å; L128-L131 PolarHBondContact O-N 2.98Å; L128-L131 VanDerWaalsContact O-N 3.09Å; L131-L341 HydrophobicContact CD2-CD2 3.31Å
132	L	92.5	Very high	85.2	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-80.9	-18.2	176.5	-62.4	179	0	0	0	112.2	L128 V134 V136 F155 M212 H214 L217 I222	L128-L132 HydrophobicContact CD1-CD1 4.13Å; L128-L132 HydrophobicContact CD1-CG 4.33Å; L128-L132 HydrophobicContact CD2-CD1 4.36Å; L128-L132 HydrophobicContact CG-CD1 4Å; L128-L132 HydrophobicContact CG-CG 4.42Å; L128-L132 PolarHBondContact O-N 3.45Å; L132-V134 HydrophobicContact CB-CG2 3.6Å; L132-V134 PolarHBondContact O-N 3.39Å; L132-V136 HydrophobicContact CD1-CG2 4.15Å; L132-F155 HydrophobicContact CD1-CD1 4.31Å; L132-M212 HydrophobicContact CD1-SD 4.26Å; L132-H214 PolarHBondContact O-NE2 3.05Å; L132-L217 HydrophobicContact CD2-CD2 4.32Å; L132-L217 HydrophobicContact CD2-CG 4.28Å; L132-I222 HydrophobicContact CD2-CD1 3.92Å
133	G	89.8	Confident	82.9	Confident	54 Å²	54	41.2 Å²	41.2	56%	0.557	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	14.3	-174.6	0	0	0	0	0	113.5	N129 L130	N129-G133 WeakPolarHBondContact O-CA 3.44Å; N129-G133 PolarHBondContact O-N 3.31Å; L130-G133 PolarHBondContact O-N 2.89Å
134	V	89.5	Confident	81.1	Confident	66 Å²	66	45 Å²	45	40%	0.4	25%	0.249	S	C	.	.	S	Bend	trans	-136.2	142.7	178.6	-73.2	0	0	0	0	108.7	N129 L132 V136 M212	N129-V134 WeakPolarHBondContact CA-O 3.35Å; N129-V134 PolarHBondContact O-N 3.47Å; N129-V134 PolarHBondContact OD1-O 2.91Å; L132-V134 HydrophobicContact CB-CG2 3.6Å; L132-V134 PolarHBondContact O-N 3.39Å; V134-V136 HydrophobicContact CB-CG2 4.3Å; V134-V136 HydrophobicContact CG2-CG2 3.6Å; V134-V136 PolarHBondContact O-N 3.32Å; V134-M212 HydrophobicContact CG2-CE 4.33Å
135	Q	89.8	Confident	79.2	Confident	116 Å²	116	48.1 Å²	48.1	54%	0.542	27%	0.267	S	S	.	.			trans	-83.9	94.3	178	-171.2	174.6	-0.1	0	0	109	T186	Q135-T186 HydrophobicContact CG-CG2 3.9Å
136	V	91.4	Very high	77.4	Confident	12 Å²	12	57.5 Å²	57.5	7%	0.073	31%	0.31	C	S	.	.			trans	-101.2	-37	-179	-176.2	0	0	0	0	111.1	N129 L132 V134 F155 T186 I187 M212	N129-V136 PolarHBondContact OD1-N 3.43Å; L132-V136 HydrophobicContact CD1-CG2 4.15Å; V134-V136 HydrophobicContact CB-CG2 4.3Å; V134-V136 HydrophobicContact CG2-CG2 3.6Å; V134-V136 PolarHBondContact O-N 3.32Å; V136-F155 HydrophobicContact CG1-CE1 3.86Å; V136-F155 HydrophobicContact CG1-CZ 4.41Å; V136-T186 CarbonylContact O-C 3.58Å; V136-T186 WeakPolarHBondContact O-CA 3.49Å; V136-T186 WeakPolarHBondContact O-CB 3.44Å; V136-I187 HydrophobicContact CG1-CD1 3.95Å; V136-I187 HydrophobicContact CG1-CG1 4.13Å; V136-I187 PolarHBondContact O-N 2.83Å; V136-M212 HydrophobicContact CG2-CE 3.98Å; V136-M212 HydrophobicContact CG2-SD 4.18Å
137	L	91.3	Very high	76	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-97.3	146.1	175.4	-64.6	-178.6	0	0	0	111	C125 L128 N129 L153 F155 I187 L192	C125-L137 HydrophobicContact CB-CB 3.97Å; C125-L137 HydrophobicContact CB-CD1 4.04Å; L128-L137 HydrophobicContact CB-CD1 4.34Å; L128-L137 HydrophobicContact CD2-CD1 3.33Å; L128-L137 HydrophobicContact CD2-CG 3.81Å; L128-L137 HydrophobicContact CG-CD1 4.44Å; N129-L137 PolarHBondContact ND2-O 3.39Å; N129-L137 PolarHBondContact OD1-N 2.93Å; L137-L153 HydrophobicContact CD1-CD1 3.64Å; L137-L153 HydrophobicContact CD2-CD1 3.92Å; L137-L153 HydrophobicContact CG-CD1 4.46Å; L137-F155 HydrophobicContact CD1-CZ 4.46Å; L137-F155 HydrophobicContact CD2-CZ 4.07Å; L137-F155 HydrophobicContact CG-CZ 4.25Å; L137-I187 HydrophobicContact CD2-CB 4.41Å; L137-I187 HydrophobicContact CD2-CD1 4.1Å; L137-L192 HydrophobicContact CD2-CD1 4.05Å; L137-L192 HydrophobicContact CD2-CD2 3.65Å
138	P	87.3	Confident	74.9	Confident	11 Å²	11	60.5 Å²	60.5	7%	0.071	33%	0.333	C	S	.	.			trans	-64.5	141.6	174.8	26.8	-31.6	0	0	0	110.3	L140 I187 E189 L192	P138-L140 PolarHBondContact O-N 2.86Å; P138-I187 WeakPolarHBondContact CD-O 3.39Å; P138-E189 HydrophobicContact CB-CG 4.15Å; P138-E189 HydrophobicContact CG-CG 3.65Å; P138-L192 VanDerWaalsContact CD-CD1 3.49Å; P138-L192 HydrophobicContact CG-CD1 3.66Å
139	T	72.6	Confident	74.1	Confident	50 Å²	50	63.3 Å²	63.3	31%	0.307	35%	0.345	S	S	.	.			trans	-83.2	95.1	167.4	46.4	0	0	0	0	107.8	Q126 K141 L284	Q126-T139 HydrophobicContact CG-CG2 4.13Å; T139-K141 PolarHBondContact O-N 2.55Å; T139-L284 HydrophobicContact CG2-CD1 4.24Å
140	L	63.8	Low	73.8	Confident	28 Å²	28	62.7 Å²	62.7	15%	0.147	34%	0.342	C	S	.	.			trans	-56	126.2	-177.5	-68.6	158.1	0	0	0	110.4	C121 N122 P138 L142 E189	C121-L140 HydrophobicContact CB-CD1 3.99Å; N122-L140 HydrophobicContact CB-CB 4.33Å; N122-L140 PolarHBondContact ND2-O 3.35Å; N122-L140 VanDerWaalsContact ND2-O 3.12Å; P138-L140 PolarHBondContact O-N 2.86Å; L140-L142 PolarHBondContact O-N 3.28Å; L140-L142 VanDerWaalsContact O-N 3.13Å; L140-E189 HydrophobicContact CD2-CG 4.26Å
141	K	55.2	Low	73.7	Confident	208 Å²	208	60.2 Å²	60.2	90%	0.904	33%	0.328	S	S	*	.			trans	-76.7	92	171.4	-69.3	179.5	-178.9	174.6	0	108.1	T139 D143	T139-K141 PolarHBondContact O-N 2.55Å; K141-D143 PolarHBondContact O-N 2.84Å
142	L	48.3	Very low	73.7	Confident	59 Å²	59	61 Å²	61	31%	0.309	33%	0.331	S	S	.	.			trans	-87.1	106.2	-177.8	-84.4	164.8	0	0	0	111.9	N122 L140 S144	N122-L142 HydrophobicContact CB-CD1 3.42Å; N122-L142 VanDerWaalsContact CB-CD1 3.42Å; N122-L142 HydrophobicContact CB-CG 4.41Å; L140-L142 PolarHBondContact O-N 3.28Å; L140-L142 VanDerWaalsContact O-N 3.13Å; L142-S144 WeakPolarHBondContact CD2-O 3.34Å
143	D	39.5	Very low	73.7	Confident	159 Å²	159	61 Å²	61	85%	0.85	33%	0.33	S	S	*	.	S	Bend	trans	-102.5	114.4	134	-81.6	-34.6	0	0	0	106.5	K141	K141-D143 PolarHBondContact O-N 2.84Å
144	S	51.9	Low	73.9	Confident	78 Å²	78	61.3 Å²	61.3	55%	0.545	32%	0.315	S	S	.	.			trans	87.5	111.7	176.3	78.8	0	0	0	0	119.4	L142 E146	L142-S144 WeakPolarHBondContact CD2-O 3.34Å; S144-E146 PolarHBondContact O-N 3.24Å
145	D	51.9	Low	74.2	Confident	70 Å²	70	58.1 Å²	58.1	37%	0.374	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.8	170.3	-108.8	-37.1	0	0	0	114	D120 K254	D120-D145 VanDerWaalsContact CB-OD1 3.3Å; D120-D145 WeakPolarHBondContact CB-OD1 3.32Å; D145-K254 IonicContact OD2-NZ 2.76Å; D145-K254 PolarHBondContact OD2-NZ 2.92Å
146	E	54.6	Low	74.4	Confident	197 Å²	197	53.7 Å²	53.7	92%	0.921	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.2	-168.4	-66.4	-163.9	160.7	0	0	114.5	S144	S144-E146 PolarHBondContact O-N 3.24Å
147	S	60.5	Low	74.6	Confident	70 Å²	70	57.2 Å²	57.2	49%	0.49	29%	0.289	S	S	.	.	S	Bend	trans	-103.4	-15.7	-175.5	59.1	0	0	0	0	115.1	K149	S147-K149 PolarHBondContact O-N 3.5Å
148	C	70.9	Confident	74.7	Confident	7 Å²	7	57.8 Å²	57.8	5%	0.047	30%	0.295	C	S	.	.			trans	-70	123.1	-176.2	178.2	0	0	0	0	112.2	C121 C227	C121-C148 HydrophobicContact CB-CB 4.03Å; C121-C148 WeakPolarHBondContact CB-SG 3.4Å; C121-C148 WeakPolarHBondContact SG-CB 3.46Å; C121-C148 CovalentContact SG-SG 2.05Å; C121-C148 PolarHBondContact SG-SG 3.26Å; C148-C227 PolarHBondContact O-SG 2.93Å
149	K	78.8	Confident	74.8	Confident	60 Å²	60	63 Å²	63	26%	0.261	33%	0.326	S	S	.	.			trans	-116.9	39.3	178.1	-65.6	174.4	-173.7	137.2	0	112.9	S147 R151 E193 V194 E196	S147-K149 PolarHBondContact O-N 3.5Å; K149-R151 PolarHBondContact O-N 3.35Å; K149-R151 VanDerWaalsContact O-N 3.14Å; K149-E193 HydrophobicContact CB-CB 4.32Å; K149-E193 WeakPolarHBondContact O-CA 3.46Å; K149-V194 WeakPolarHBondContact CD-O 3.49Å; K149-V194 PolarHBondContact O-N 2.76Å; K149-E196 HydrophobicContact CD-CG 4.33Å; K149-E196 WeakPolarHBondContact CE-OE1 3.32Å; K149-E196 VanDerWaalsContact NZ-CG 3.29Å; K149-E196 IonicContact NZ-OE1 2.75Å; K149-E196 PolarHBondContact NZ-OE1 2.82Å; K149-E196 IonicContact NZ-OE2 3.53Å; K149-E196 PolarHBondContact NZ-OE2 2.8Å
150	L	86.6	Confident	75.5	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.021	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-53.7	119.5	-179.3	-174.8	66.1	0	0	0	111.2	C121 L153 L192 V224 P226 C227	C121-L150 HydrophobicContact CB-CB 4.49Å; C121-L150 HydrophobicContact CB-CD2 4.25Å; L150-L153 HydrophobicContact CD1-CD1 4.13Å; L150-L153 HydrophobicContact CD1-CD2 4.26Å; L150-L153 HydrophobicContact CD1-CG 4.33Å; L150-L192 HydrophobicContact CD1-CB 4Å; L150-V224 HydrophobicContact CD2-CG1 4.35Å; L150-P226 CarbonylContact O-C 3.52Å; L150-P226 WeakPolarHBondContact O-CA 3.38Å; L150-P226 VanDerWaalsContact O-CB 3.28Å; L150-P226 WeakPolarHBondContact O-CB 3.36Å; L150-C227 PolarHBondContact O-N 2.75Å
151	R	89.7	Confident	76.8	Confident	13 Å²	13	72.8 Å²	72.8	5%	0.049	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-75.1	166	170.1	73.3	-174.8	57.8	-134.5	10.1	110.5	K149 L153 L165 L192 E193 V194 H203 A206 L208	K149-R151 PolarHBondContact O-N 3.35Å; K149-R151 VanDerWaalsContact O-N 3.14Å; R151-L153 HydrophobicContact CG-CD2 4.09Å; R151-L153 PolarHBondContact O-N 3.32Å; R151-L165 VanDerWaalsContact NH1-CD2 3.31Å; R151-L192 WeakPolarHBondContact CG-O 3.34Å; R151-L192 PolarHBondContact N-O 3.02Å; R151-E193 PolarHBondContact NE-O 2.92Å; R151-E193 PolarHBondContact NH2-O 3.02Å; R151-V194 HydrophobicContact CB-CG2 3.78Å; R151-H203 PolarHBondContact NH1-O 2.71Å; R151-A206 PolarHBondContact NH1-O 2.86Å; R151-L208 HydrophobicContact CG-CB 4.21Å
152	R	90.9	Very high	78.5	Confident	18 Å²	18	69 Å²	69	7%	0.068	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-66.5	133	175.4	178.2	165.3	37.8	-173	-7.5	108.9	D207 L208 V223 P226 D239	R152-D207 WeakPolarHBondContact CB-OD1 3.39Å; R152-D207 IonicContact CZ-OD1 3.98Å; R152-D207 IonicContact CZ-OD2 2.98Å; R152-D207 VanDerWaalsContact NE-CG 3.25Å; R152-D207 IonicContact NE-OD1 3.29Å; R152-D207 PolarHBondContact NE-OD1 2.94Å; R152-D207 IonicContact NE-OD2 3.81Å; R152-D207 PolarHBondContact NE-OD2 3.5Å; R152-D207 IonicContact NH2-OD1 3.36Å; R152-D207 PolarHBondContact NH2-OD1 3.34Å; R152-D207 IonicContact NH2-OD2 2.71Å; R152-D207 WeakPolarHBondContact O-CA 3.26Å; R152-L208 PolarHBondContact O-N 3.1Å; R152-V223 HydrophobicContact CG-CG1 3.95Å; R152-P226 HydrophobicContact CB-CB 4.47Å; R152-P226 HydrophobicContact CB-CG 4.38Å; R152-D239 IonicContact CZ-OD2 3.71Å; R152-D239 IonicContact NH1-OD2 3.36Å; R152-D239 PolarHBondContact NH1-OD2 3.34Å
153	L	93.4	Very high	80.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.5	178.6	-42.7	178.1	0	0	0	109.4	L137 L150 R151 F155 L192 L208 V223 V224	L137-L153 HydrophobicContact CD1-CD1 3.64Å; L137-L153 HydrophobicContact CD2-CD1 3.92Å; L137-L153 HydrophobicContact CG-CD1 4.46Å; L150-L153 HydrophobicContact CD1-CD1 4.13Å; L150-L153 HydrophobicContact CD1-CD2 4.26Å; L150-L153 HydrophobicContact CD1-CG 4.33Å; R151-L153 HydrophobicContact CG-CD2 4.09Å; R151-L153 PolarHBondContact O-N 3.32Å; L153-F155 HydrophobicContact CB-CD2 4.39Å; L153-F155 HydrophobicContact CB-CE2 3.86Å; L153-F155 HydrophobicContact CD1-CE2 4.2Å; L153-L192 HydrophobicContact CD1-CD2 3.92Å; L153-L192 HydrophobicContact CD2-CD2 3.75Å; L153-L208 CarbonylContact C-O 3.51Å; L153-L208 WeakPolarHBondContact CA-O 3.39Å; L153-L208 HydrophobicContact CD2-CB 3.7Å; L153-L208 HydrophobicContact CD2-CD2 3.97Å; L153-L208 HydrophobicContact CD2-CG 4.48Å; L153-V223 CarbonylContact O-C 3.51Å; L153-V223 WeakPolarHBondContact O-CA 3.32Å; L153-V224 HydrophobicContact CB-CB 4.03Å; L153-V224 HydrophobicContact CB-CG2 4.34Å; L153-V224 HydrophobicContact CD1-CB 4.24Å; L153-V224 HydrophobicContact CD1-CG2 4.41Å; L153-V224 HydrophobicContact CG-CB 4.25Å; L153-V224 PolarHBondContact N-O 3.38Å; L153-V224 VanDerWaalsContact N-O 3.07Å; L153-V224 PolarHBondContact O-N 3.1Å
154	R	93.6	Very high	83.1	Confident	61 Å²	61	59.2 Å²	59.2	23%	0.23	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	117.1	176.5	-175.3	-178.1	179.2	143.2	2.9	110.1	T156 L208 E209 V210 D221 V223	R154-T156 HydrophobicContact CG-CG2 4.01Å; R154-L208 PolarHBondContact N-O 3.5Å; R154-E209 HydrophobicContact CB-CG 4.4Å; R154-E209 WeakPolarHBondContact O-CA 3.41Å; R154-V210 PolarHBondContact O-N 2.92Å; R154-D221 IonicContact CZ-OD2 3.05Å; R154-D221 IonicContact NE-OD2 2.8Å; R154-D221 IonicContact NH2-OD2 3.02Å; R154-D221 PolarHBondContact NH2-OD2 3.01Å; R154-V223 HydrophobicContact CG-CG2 4.19Å
155	F	95.9	Very high	84.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.2	177.5	-72.7	-102.2	0	0	0	110.3	L128 L132 V136 L137 L153 I187 V210 M212 L217 I222	L128-F155 HydrophobicContact CD1-CD2 4.34Å; L128-F155 HydrophobicContact CD2-CD1 4.43Å; L128-F155 HydrophobicContact CD2-CD2 3.82Å; L128-F155 HydrophobicContact CD2-CE1 3.97Å; L128-F155 HydrophobicContact CD2-CE2 3.3Å; L128-F155 HydrophobicContact CD2-CG 4.38Å; L128-F155 HydrophobicContact CD2-CZ 3.39Å; L132-F155 HydrophobicContact CD1-CD1 4.31Å; V136-F155 HydrophobicContact CG1-CE1 3.86Å; V136-F155 HydrophobicContact CG1-CZ 4.41Å; L137-F155 HydrophobicContact CD1-CZ 4.46Å; L137-F155 HydrophobicContact CD2-CZ 4.07Å; L137-F155 HydrophobicContact CG-CZ 4.25Å; L153-F155 HydrophobicContact CB-CD2 4.39Å; L153-F155 HydrophobicContact CB-CE2 3.86Å; L153-F155 HydrophobicContact CD1-CE2 4.2Å; F155-I187 HydrophobicContact CE1-CD1 4.5Å; F155-I187 HydrophobicContact CZ-CD1 4.27Å; F155-V210 VanDerWaalsContact CA-O 3.3Å; F155-V210 WeakPolarHBondContact CA-O 3.31Å; F155-V210 HydrophobicContact CD1-CB 3.72Å; F155-V210 HydrophobicContact CD1-CG1 3.8Å; F155-V210 HydrophobicContact CD1-CG2 4.44Å; F155-V210 HydrophobicContact CE1-CB 3.65Å; F155-V210 HydrophobicContact CE1-CG1 3.56Å; F155-V210 HydrophobicContact CE1-CG2 3.96Å; F155-V210 HydrophobicContact CE2-CG2 4.32Å; F155-V210 HydrophobicContact CG-CB 4.21Å; F155-V210 HydrophobicContact CZ-CB 4.07Å; F155-V210 HydrophobicContact CZ-CG1 4.33Å; F155-V210 HydrophobicContact CZ-CG2 3.87Å; F155-M212 HydrophobicContact CD1-SD 4.18Å; F155-M212 HydrophobicContact CE1-SD 4.48Å; F155-L217 HydrophobicContact CB-CD1 4.27Å; F155-L217 HydrophobicContact CB-CD2 4Å; F155-I222 HydrophobicContact CB-CB 4.28Å; F155-I222 PolarHBondContact N-O 2.94Å; F155-I222 PolarHBondContact O-N 3.43Å
156	T	94.5	Very high	86.5	Confident	22 Å²	22	52.7 Å²	52.7	14%	0.135	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	164.1	-178.3	61.1	0	0	0	0	111.1	R154 V210 T211 M212	R154-T156 HydrophobicContact CG-CG2 4.01Å; T156-V210 PolarHBondContact N-O 3.25Å; T156-T211 WeakPolarHBondContact O-CA 3.48Å; T156-T211 VanDerWaalsContact OG1-CG2 3.25Å; T156-T211 WeakPolarHBondContact OG1-CG2 3.36Å; T156-M212 PolarHBondContact O-N 2.76Å
157	Y	95.2	Very high	87.9	Confident	87 Å²	87	44.7 Å²	44.7	34%	0.341	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	132.5	178.4	179.8	-107.5	0	0	0	112.5	H213 L217 Q218	Y157-H213 AromaticContact CE2-ND1 3.55Å; Y157-H213 AromaticContact CZ-ND1 3.82Å; Y157-H213 PolarHBondContact OH-CE1 3.29Å; Y157-H213 PolarHBondContact OH-ND1 3.34Å; Y157-L217 WeakPolarHBondContact CB-O 3.41Å; Y157-Q218 HydrophobicContact CD1-CG 4.19Å; Y157-Q218 HydrophobicContact CD2-CB 4.3Å; Y157-Q218 HydrophobicContact CD2-CG 3.27Å; Y157-Q218 HydrophobicContact CE1-CG 4.14Å; Y157-Q218 HydrophobicContact CE2-CG 3.21Å; Y157-Q218 VanDerWaalsContact CE2-NE2 3.31Å; Y157-Q218 HydrophobicContact CG-CG 3.77Å; Y157-Q218 VanDerWaalsContact CZ-NE2 3.33Å; Y157-Q218 PolarHBondContact OH-NE2 3.38Å; Y157-Q218 VanDerWaalsContact OH-NE2 3.09Å
158	G	93.1	Very high	88.2	Confident	12 Å²	12	44.2 Å²	44.2	12%	0.124	21%	0.212	C	C	.	.			trans	-139.5	156.3	169.4	0	0	0	0	0	111.5	M212 H213	G158-M212 PolarHBondContact N-O 3.31Å; G158-M212 CarbonylContact O-C 3.57Å; G158-M212 VanDerWaalsContact O-C 3.26Å; G158-H213 WeakPolarHBondContact O-CA 3.47Å; G158-H213 WeakPolarHBondContact O-CB 3.39Å; G158-H213 PolarHBondContact O-N 2.87Å
159	T	89.4	Confident	87.7	Confident	119 Å²	119	48 Å²	48	73%	0.73	25%	0.252	S	S	*	.	S	Bend	trans	-76.2	-17.2	171.1	52.7	0	0	0	0	112.5
160	R	88.6	Confident	87.2	Confident	208 Å²	208	51.5 Å²	51.5	79%	0.785	27%	0.269	S	S	*	.	S	Bend	trans	-132.8	150.7	174.5	-64.9	-175.7	178	-174.6	-1.2	108.7	R162	R160-R162 PolarHBondContact O-N 2.98Å
161	T	90	Very high	86.5	Confident	77 Å²	77	59.5 Å²	59.5	47%	0.472	30%	0.3	S	S	.	.			trans	-74.2	123.4	171.6	-54.8	0	0	0	0	109.3	W184 T211 M212	T161-W184 HydrophobicContact CG2-CH2 3.78Å; T161-W184 HydrophobicContact CG2-CZ2 4.1Å; T161-T211 CarbonylContact C-O 3.6Å; T161-T211 WeakPolarHBondContact CA-O 3.25Å; T161-M212 HydrophobicContact CG2-CB 4.2Å
162	R	91.1	Very high	86.1	Confident	129 Å²	129	63.3 Å²	63.3	49%	0.487	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	135.9	173.8	172.1	-170.3	-174.2	-168.4	6.9	109.2	R160 E172 T211	R160-R162 PolarHBondContact O-N 2.98Å; R162-E172 IonicContact CZ-OE1 2.72Å; R162-E172 IonicContact CZ-OE2 3.65Å; R162-E172 IonicContact NE-OE1 3.8Å; R162-E172 IonicContact NH1-OE2 3.68Å; R162-E172 IonicContact NH2-OE1 3.52Å; R162-E172 PolarHBondContact NH2-OE1 3.41Å; R162-E172 IonicContact NH2-OE2 2.74Å; R162-E172 PolarHBondContact NH2-OE2 3.32Å; R162-T211 WeakPolarHBondContact CB-OG1 3.47Å; R162-T211 PolarHBondContact N-O 3.48Å; R162-T211 PolarHBondContact N-OG1 3.35Å; R162-T211 PolarHBondContact O-N 2.93Å; R162-T211 PolarHBondContact O-OG1 3.36Å; R162-T211 VanDerWaalsContact O-OG1 3.1Å
163	V	92	Very high	85.5	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.024	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.7	175	-172.5	0	0	0	0	108	L177 H180 W184 I187 L208 E209 V210	V163-L177 HydrophobicContact CB-CD1 4.43Å; V163-L177 HydrophobicContact CG1-CD1 3.93Å; V163-H180 PolarHBondContact O-NE2 2.82Å; V163-W184 HydrophobicContact CG2-CH2 4.31Å; V163-W184 HydrophobicContact CG2-CZ2 3.87Å; V163-I187 HydrophobicContact CG2-CD1 4.39Å; V163-L208 HydrophobicContact CG1-CD1 3.65Å; V163-L208 HydrophobicContact CG1-CD2 4.03Å; V163-L208 HydrophobicContact CG1-CG 3.87Å; V163-E209 WeakPolarHBondContact CA-O 3.32Å; V163-V210 HydrophobicContact CG1-CG2 4.44Å; V163-V210 HydrophobicContact CG2-CG1 4.47Å
164	S	91.6	Very high	84.3	Confident	7 Å²	7	71.3 Å²	71.3	5%	0.049	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151.3	179.4	49.6	0	0	0	0	111	E172 E209	S164-E172 WeakPolarHBondContact CB-OE1 3.27Å; S164-E209 PolarHBondContact N-O 3.19Å; S164-E209 PolarHBondContact O-N 2.65Å
165	L	90.2	Very high	83.3	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.026	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.3	168.2	-78.5	171.1	0	0	0	109.3	R151 L173 H175 L177 A206 L208	R151-L165 VanDerWaalsContact NH1-CD2 3.31Å; L165-L173 HydrophobicContact CB-CB 4.23Å; L165-L173 HydrophobicContact CB-CD1 4.4Å; L165-L173 PolarHBondContact O-N 2.9Å; L165-H175 HydrophobicContact CD1-CB 4.38Å; L165-L177 HydrophobicContact CD1-CD2 3.78Å; L165-L177 HydrophobicContact CG-CD2 3.99Å; L165-A206 HydrophobicContact CB-CB 4.4Å; L165-A206 HydrophobicContact CD2-CB 4.18Å; L165-L208 HydrophobicContact CD2-CD1 3.85Å; L165-L208 HydrophobicContact CG-CD1 4.17Å
166	A	86.8	Confident	82.3	Confident	6 Å²	6	76.6 Å²	76.6	5%	0.05	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.7	178.8	0	0	0	0	0	111.2	Y171 A206 D207 E209	A166-Y171 WeakPolarHBondContact CA-O 3.31Å; A166-A206 CarbonylContact O-C 3.59Å; A166-A206 WeakPolarHBondContact O-CA 3.39Å; A166-D207 PolarHBondContact N-O 2.64Å; A166-D207 PolarHBondContact O-N 3.1Å; A166-E209 HydrophobicContact CB-CG 3.93Å
167	L	82.6	Confident	81.8	Confident	30 Å²	30	75.8 Å²	75.8	16%	0.157	40%	0.396	C	S	.	.			trans	-72.3	139.4	165.3	-72.8	172.5	0	0	0	109.2	G169 Q170 Y171 L173 A202 L205 A206	L167-G169 PolarHBondContact O-N 3Å; L167-Q170 HydrophobicContact CB-CB 4.14Å; L167-Q170 PolarHBondContact O-N 3.32Å; L167-Q170 VanDerWaalsContact O-N 3.1Å; L167-Y171 PolarHBondContact N-O 3.42Å; L167-L173 HydrophobicContact CD1-CD2 4.4Å; L167-L173 HydrophobicContact CG-CD2 4.42Å; L167-A202 HydrophobicContact CD1-CB 4.29Å; L167-A202 HydrophobicContact CD2-CB 4.3Å; L167-A202 WeakPolarHBondContact CD2-O 3.21Å; L167-L205 HydrophobicContact CD2-CB 4.16Å; L167-A206 HydrophobicContact CD2-CB 4.47Å
168	P	66.8	Low	81.3	Confident	60 Å²	60	72.3 Å²	72.3	39%	0.39	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	105.5	-177.1	-28.1	34	0	0	0	112.8	Q170	P168-Q170 PolarHBondContact O-N 3.34Å
169	G	61.3	Low	80.8	Confident	86 Å²	86	72.3 Å²	72.3	89%	0.887	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	16.4	175.2	0	0	0	0	0	116.8	L167	L167-G169 PolarHBondContact O-N 3Å
170	Q	67	Low	80.6	Confident	133 Å²	133	71.1 Å²	71.1	62%	0.621	37%	0.37	S	S	*	.	S	Bend	trans	-123	-73.7	-170.5	-65.1	-177.2	-0.3	0	0	114.2	L167 P168	L167-Q170 HydrophobicContact CB-CB 4.14Å; L167-Q170 PolarHBondContact O-N 3.32Å; L167-Q170 VanDerWaalsContact O-N 3.1Å; P168-Q170 PolarHBondContact O-N 3.34Å
171	Y	73.9	Confident	80.1	Confident	173 Å²	173	67.8 Å²	67.8	68%	0.678	36%	0.363	S	S	*	.			trans	-149.1	141.6	-170.5	-59.2	-78.6	0	0	0	111.4	A166 L167	A166-Y171 WeakPolarHBondContact CA-O 3.31Å; L167-Y171 PolarHBondContact N-O 3.42Å
172	E	80	Confident	79.2	Confident	92 Å²	92	69.8 Å²	69.8	43%	0.43	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-70.8	127	165.9	-172.8	177.1	179.2	0	0	108.8	R162 S164	R162-E172 IonicContact CZ-OE1 2.72Å; R162-E172 IonicContact CZ-OE2 3.65Å; R162-E172 IonicContact NE-OE1 3.8Å; R162-E172 IonicContact NH1-OE2 3.68Å; R162-E172 IonicContact NH2-OE1 3.52Å; R162-E172 PolarHBondContact NH2-OE1 3.41Å; R162-E172 IonicContact NH2-OE2 2.74Å; R162-E172 PolarHBondContact NH2-OE2 3.32Å; S164-E172 WeakPolarHBondContact CB-OE1 3.27Å
173	L	79	Confident	78.5	Confident	31 Å²	31	72 Å²	72	16%	0.162	39%	0.392	C	S	.	.			trans	-75.7	129.4	174.7	-65.9	179.4	0	0	0	108.9	L165 L167 H175 A202 A206	L165-L173 HydrophobicContact CB-CB 4.23Å; L165-L173 HydrophobicContact CB-CD1 4.4Å; L165-L173 PolarHBondContact O-N 2.9Å; L167-L173 HydrophobicContact CD1-CD2 4.4Å; L167-L173 HydrophobicContact CG-CD2 4.42Å; L173-H175 VanDerWaalsContact C-N 3.29Å; L173-H175 PolarHBondContact O-N 2.93Å; L173-A202 HydrophobicContact CD2-CB 4.36Å; L173-A206 HydrophobicContact CD1-CB 3.54Å
174	V	68.1	Low	78.2	Confident	155 Å²	155	75.6 Å²	75.6	94%	0.939	41%	0.405	S	S	*	.			trans	-73.4	89.8	172.8	-176.9	0	0	0	0	107.7
175	H	72.4	Confident	77.7	Confident	79 Å²	79	84.4 Å²	84.4	37%	0.366	45%	0.446	S	S	.	.			trans	-133.5	141.9	178.5	-161.3	75.2	0	0	0	110.1	L165 L173 L177 H203	L165-H175 HydrophobicContact CD1-CB 4.38Å; L173-H175 VanDerWaalsContact C-N 3.29Å; L173-H175 PolarHBondContact O-N 2.93Å; H175-L177 PolarHBondContact O-N 3.42Å; H175-H203 AromaticContact CE1-CE1 3.68Å; H175-H203 AromaticContact CG-CE1 3.59Å; H175-H203 AromaticContact ND1-CE1 3.23Å; H175-H203 PolarHBondContact ND1-CE1 2.79Å; H175-H203 AromaticContact ND1-NE2 3.62Å
176	T	75.6	Confident	77.7	Confident	94 Å²	94	86 Å²	86	58%	0.577	46%	0.456	S	S	*	.			trans	-89.5	103.7	175.9	-49.1	0	0	0	0	107.5	Q181	T176-Q181 HydrophobicContact CG2-CG 4.14Å; T176-Q181 VanDerWaalsContact CG2-NE2 3.27Å
177	L	83.6	Confident	77.9	Confident	4 Å²	4	85.7 Å²	85.7	2%	0.021	45%	0.453	C	S	.	.			trans	-80.7	154.1	178.5	-67.2	172.8	0	0	0	110.5	V163 L165 H175 S179 H180 D191 L208	V163-L177 HydrophobicContact CB-CD1 4.43Å; V163-L177 HydrophobicContact CG1-CD1 3.93Å; L165-L177 HydrophobicContact CD1-CD2 3.78Å; L165-L177 HydrophobicContact CG-CD2 3.99Å; H175-L177 PolarHBondContact O-N 3.42Å; L177-S179 WeakPolarHBondContact CB-OG 3.15Å; L177-S179 PolarHBondContact O-N 3.07Å; L177-H180 PolarHBondContact N-ND1 3.38Å; L177-H180 WeakPolarHBondContact O-CB 3.38Å; L177-H180 PolarHBondContact O-N 3.5Å; L177-D191 HydrophobicContact CD2-CB 4.38Å; L177-D191 WeakPolarHBondContact CD2-OD1 3.43Å; L177-L208 HydrophobicContact CD1-CD1 4.24Å
178	A	83.8	Confident	78.3	Confident	14 Å²	14	85.6 Å²	85.6	12%	0.116	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-58.8	-37.4	174.8	0	0	0	0	0	110.9	H180 Q181 D182 P188 E190 D191	A178-H180 PolarHBondContact O-N 3.06Å; A178-H180 VanDerWaalsContact O-N 3.08Å; A178-Q181 PolarHBondContact O-N 3.37Å; A178-Q181 VanDerWaalsContact O-N 3.07Å; A178-D182 PolarHBondContact O-N 2.89Å; A178-P188 HydrophobicContact CB-CB 3.84Å; A178-P188 HydrophobicContact CB-CG 3.87Å; A178-E190 VanDerWaalsContact CB-CD 3.5Å; A178-E190 HydrophobicContact CB-CG 3.59Å; A178-E190 WeakPolarHBondContact CB-OE1 3.34Å; A178-D191 WeakPolarHBondContact CB-OD1 3.33Å; A178-D191 PolarHBondContact N-OD1 3.4Å; A178-D191 PolarHBondContact N-OD2 2.89Å
179	S	83.7	Confident	79.2	Confident	12 Å²	12	87.5 Å²	87.5	8%	0.084	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-61.3	-10.9	173.2	51	0	0	0	0	115.4	L177 W184 D191	L177-S179 WeakPolarHBondContact CB-OG 3.15Å; L177-S179 PolarHBondContact O-N 3.07Å; S179-W184 PolarHBondContact O-NE1 2.86Å; S179-W184 VanDerWaalsContact O-NE1 3.09Å; S179-D191 WeakPolarHBondContact CB-OD2 3.37Å; S179-D191 PolarHBondContact N-OD2 2.88Å; S179-D191 PolarHBondContact OG-OD2 2.84Å
180	H	85.6	Confident	80.3	Confident	95 Å²	95	89.3 Å²	89.3	44%	0.44	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-92.2	-19.7	174.3	-59.3	163.7	0	0	0	113.5	V163 L177 A178	V163-H180 PolarHBondContact O-NE2 2.82Å; L177-H180 PolarHBondContact N-ND1 3.38Å; L177-H180 WeakPolarHBondContact O-CB 3.38Å; L177-H180 PolarHBondContact O-N 3.5Å; A178-H180 PolarHBondContact O-N 3.06Å; A178-H180 VanDerWaalsContact O-N 3.08Å
181	Q	78	Confident	81.3	Confident	137 Å²	137	83.4 Å²	83.4	64%	0.64	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-36.3	-171	-61.2	-174	11.1	0	0	112.6	T176 A178	T176-Q181 HydrophobicContact CG2-CG 4.14Å; T176-Q181 VanDerWaalsContact CG2-NE2 3.27Å; A178-Q181 PolarHBondContact O-N 3.37Å; A178-Q181 VanDerWaalsContact O-N 3.07Å
182	D	69.5	Low	82	Confident	119 Å²	119	75.5 Å²	75.5	64%	0.636	39%	0.385	S	S	*	.	S	Bend	trans	-122.2	157.8	-173.6	-71.5	-47.5	0	0	0	113.3	A178 W184	A178-D182 PolarHBondContact O-N 2.89Å; D182-W184 VanDerWaalsContact O-CD1 3.28Å; D182-W184 PolarHBondContact O-N 3.27Å
183	N	76.6	Confident	82.3	Confident	177 Å²	177	74 Å²	74	95%	0.947	38%	0.379	S	S	*	.			trans	-75.8	118.4	165.5	-75.8	-27.5	0	0	0	108.8
184	W	85.3	Confident	82.4	Confident	78 Å²	78	73.2 Å²	73.2	30%	0.295	38%	0.375	S	S	.	.			trans	-113.3	142.6	-178.8	49.7	-94.3	0	0	0	111.4	T161 V163 S179 D182 T186 I187 P188	T161-W184 HydrophobicContact CG2-CH2 3.78Å; T161-W184 HydrophobicContact CG2-CZ2 4.1Å; V163-W184 HydrophobicContact CG2-CH2 4.31Å; V163-W184 HydrophobicContact CG2-CZ2 3.87Å; S179-W184 PolarHBondContact O-NE1 2.86Å; S179-W184 VanDerWaalsContact O-NE1 3.09Å; D182-W184 VanDerWaalsContact O-CD1 3.28Å; D182-W184 PolarHBondContact O-N 3.27Å; W184-T186 WeakPolarHBondContact CB-O 3.48Å; W184-T186 VanDerWaalsContact CE3-C 3.43Å; W184-I187 HydrophobicContact CE3-CG1 4.41Å; W184-I187 HydrophobicContact CH2-CG1 4Å; W184-I187 HydrophobicContact CZ3-CG1 3.88Å; W184-P188 HydrophobicContact CB-CG 4.39Å
185	E	83.1	Confident	82.6	Confident	192 Å²	192	71.7 Å²	71.7	90%	0.897	36%	0.358	S	S	*	.	S	Bend	trans	-82.6	-38.7	171.8	-67.6	-173.1	170.2	0	0	111.3
186	T	90.3	Very high	81.9	Confident	38 Å²	38	75.3 Å²	75.3	23%	0.233	38%	0.375	C	S	.	.	S	Bend	trans	-127.4	154.2	171.4	57.1	0	0	0	0	109.6	Q135 V136 W184	Q135-T186 HydrophobicContact CG-CG2 3.9Å; V136-T186 CarbonylContact O-C 3.58Å; V136-T186 WeakPolarHBondContact O-CA 3.49Å; V136-T186 WeakPolarHBondContact O-CB 3.44Å; W184-T186 WeakPolarHBondContact CB-O 3.48Å; W184-T186 VanDerWaalsContact CE3-C 3.43Å
187	I	90.8	Very high	81	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.005	39%	0.388	C	S	.	.			trans	-54.5	128.5	177.5	-60.7	177.2	0	0	0	109.3	V136 L137 P138 F155 V163 W184 D191 L192 L208 V210	V136-I187 HydrophobicContact CG1-CD1 3.95Å; V136-I187 HydrophobicContact CG1-CG1 4.13Å; V136-I187 PolarHBondContact O-N 2.83Å; L137-I187 HydrophobicContact CD2-CB 4.41Å; L137-I187 HydrophobicContact CD2-CD1 4.1Å; P138-I187 WeakPolarHBondContact CD-O 3.39Å; F155-I187 HydrophobicContact CE1-CD1 4.5Å; F155-I187 HydrophobicContact CZ-CD1 4.27Å; V163-I187 HydrophobicContact CG2-CD1 4.39Å; W184-I187 HydrophobicContact CE3-CG1 4.41Å; W184-I187 HydrophobicContact CH2-CG1 4Å; W184-I187 HydrophobicContact CZ3-CG1 3.88Å; I187-D191 HydrophobicContact CG2-CB 4.18Å; I187-L192 HydrophobicContact CB-CD2 4.35Å; I187-L192 HydrophobicContact CG2-CD2 3.81Å; I187-L192 HydrophobicContact CG2-CG 4.03Å; I187-L208 HydrophobicContact CG2-CD2 4.14Å; I187-V210 HydrophobicContact CD1-CB 4.43Å; I187-V210 HydrophobicContact CD1-CG1 4.04Å; I187-V210 HydrophobicContact CD1-CG2 3.52Å
188	P	89.3	Confident	79.9	Confident	27 Å²	27	80.3 Å²	80.3	18%	0.175	40%	0.401	C	S	.	.			trans	-56.1	139.8	-179.8	-27.4	36.7	0	0	0	112.5	A178 W184 E190 D191	A178-P188 HydrophobicContact CB-CB 3.84Å; A178-P188 HydrophobicContact CB-CG 3.87Å; W184-P188 HydrophobicContact CB-CG 4.39Å; P188-E190 HydrophobicContact CB-CG 3.94Å; P188-E190 PolarHBondContact O-N 3.37Å; P188-D191 PolarHBondContact O-N 3.47Å; P188-D191 VanDerWaalsContact O-N 3.1Å
189	E	86	Confident	78.7	Confident	100 Å²	100	89.3 Å²	89.3	47%	0.467	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-34.5	-178.9	-69.8	179.2	180	0	0	112.2	P138 L140 D191 L192 E193	P138-E189 HydrophobicContact CB-CG 4.15Å; P138-E189 HydrophobicContact CG-CG 3.65Å; L140-E189 HydrophobicContact CD2-CG 4.26Å; E189-D191 VanDerWaalsContact C-N 3.28Å; E189-D191 PolarHBondContact O-N 3.38Å; E189-L192 WeakPolarHBondContact O-CB 3.45Å; E189-L192 PolarHBondContact O-N 3.43Å; E189-E193 PolarHBondContact O-N 3.4Å
190	E	85.1	Confident	78.4	Confident	125 Å²	125	92.5 Å²	92.5	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-28.6	176.7	60.7	-166.4	-111.4	0	0	114.4	A178 P188	A178-E190 VanDerWaalsContact CB-CD 3.5Å; A178-E190 HydrophobicContact CB-CG 3.59Å; A178-E190 WeakPolarHBondContact CB-OE1 3.34Å; P188-E190 HydrophobicContact CB-CG 3.94Å; P188-E190 PolarHBondContact O-N 3.37Å
191	D	88.4	Confident	78	Confident	9 Å²	9	91.2 Å²	91.2	5%	0.048	46%	0.462	C	S	.	.	H	α-helix	trans	-79.4	-22.8	175.1	-70.5	-16.9	0	0	0	111.4	L177 A178 S179 I187 P188 E189	L177-D191 HydrophobicContact CD2-CB 4.38Å; L177-D191 WeakPolarHBondContact CD2-OD1 3.43Å; A178-D191 WeakPolarHBondContact CB-OD1 3.33Å; A178-D191 PolarHBondContact N-OD1 3.4Å; A178-D191 PolarHBondContact N-OD2 2.89Å; S179-D191 WeakPolarHBondContact CB-OD2 3.37Å; S179-D191 PolarHBondContact N-OD2 2.88Å; S179-D191 PolarHBondContact OG-OD2 2.84Å; I187-D191 HydrophobicContact CG2-CB 4.18Å; P188-D191 PolarHBondContact O-N 3.47Å; P188-D191 VanDerWaalsContact O-N 3.1Å; E189-D191 VanDerWaalsContact C-N 3.28Å; E189-D191 PolarHBondContact O-N 3.38Å
192	L	88	Confident	78	Confident	6 Å²	6	85.8 Å²	85.8	3%	0.031	44%	0.441	C	S	.	.	H	α-helix	trans	-86.4	-22.6	-177.2	-61.8	174	0	0	0	113.2	L137 P138 L150 R151 L153 I187 E189 L208	L137-L192 HydrophobicContact CD2-CD1 4.05Å; L137-L192 HydrophobicContact CD2-CD2 3.65Å; P138-L192 VanDerWaalsContact CD-CD1 3.49Å; P138-L192 HydrophobicContact CG-CD1 3.66Å; L150-L192 HydrophobicContact CD1-CB 4Å; R151-L192 WeakPolarHBondContact CG-O 3.34Å; R151-L192 PolarHBondContact N-O 3.02Å; L153-L192 HydrophobicContact CD1-CD2 3.92Å; L153-L192 HydrophobicContact CD2-CD2 3.75Å; I187-L192 HydrophobicContact CB-CD2 4.35Å; I187-L192 HydrophobicContact CG2-CD2 3.81Å; I187-L192 HydrophobicContact CG2-CG 4.03Å; E189-L192 WeakPolarHBondContact O-CB 3.45Å; E189-L192 PolarHBondContact O-N 3.43Å; L192-L208 HydrophobicContact CD2-CD2 3.66Å
193	E	86.1	Confident	78.4	Confident	62 Å²	62	81.7 Å²	81.7	29%	0.29	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-102.8	151.9	-175	-64.2	-162.3	150.2	0	0	113.1	K149 R151 E189	K149-E193 HydrophobicContact CB-CB 4.32Å; K149-E193 WeakPolarHBondContact O-CA 3.46Å; R151-E193 PolarHBondContact NE-O 2.92Å; R151-E193 PolarHBondContact NH2-O 3.02Å; E189-E193 PolarHBondContact O-N 3.4Å
194	V	80.6	Confident	78.5	Confident	14 Å²	14	75.6 Å²	75.6	9%	0.085	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-83.8	122.2	169.3	-174.4	0	0	0	0	109	K149 R151 V204	K149-V194 WeakPolarHBondContact CD-O 3.49Å; K149-V194 PolarHBondContact O-N 2.76Å; R151-V194 HydrophobicContact CB-CG2 3.78Å; V194-V204 HydrophobicContact CG1-CB 4.41Å; V194-V204 HydrophobicContact CG1-CG1 4.34Å; V194-V204 HydrophobicContact CG1-CG2 4.23Å
195	Q	73.1	Confident	78.3	Confident	122 Å²	122	77 Å²	77	57%	0.57	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-76.8	132.9	178.7	-62.9	-176.3	3.4	0	0	110.9	D197 S198	Q195-D197 VanDerWaalsContact C-N 3.33Å; Q195-D197 PolarHBondContact O-N 3.15Å; Q195-S198 PolarHBondContact O-N 3.32Å
196	E	57.8	Low	78.5	Confident	156 Å²	156	67.9 Å²	67.9	73%	0.729	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.3	-175.5	-91.8	174.1	171.5	0	0	114.4	K149 S198	K149-E196 HydrophobicContact CD-CG 4.33Å; K149-E196 WeakPolarHBondContact CE-OE1 3.32Å; K149-E196 VanDerWaalsContact NZ-CG 3.29Å; K149-E196 IonicContact NZ-OE1 2.75Å; K149-E196 PolarHBondContact NZ-OE1 2.82Å; K149-E196 IonicContact NZ-OE2 3.53Å; K149-E196 PolarHBondContact NZ-OE2 2.8Å; E196-S198 VanDerWaalsContact C-N 3.31Å; E196-S198 PolarHBondContact O-N 3.33Å
197	D	57.4	Low	78.5	Confident	161 Å²	161	66.8 Å²	66.8	86%	0.861	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	6.4	-176	-60.7	-38.8	0	0	0	113.4	Q195 E199	Q195-D197 VanDerWaalsContact C-N 3.33Å; Q195-D197 PolarHBondContact O-N 3.15Å; D197-E199 PolarHBondContact O-N 3.16Å
198	S	58.7	Low	78.6	Confident	41 Å²	41	66.7 Å²	66.7	29%	0.287	35%	0.35	S	S	.	.			trans	-81.6	101.8	-179.8	-163.5	0	0	0	0	110.6	Q195 E196 D200 H203	Q195-S198 PolarHBondContact O-N 3.32Å; E196-S198 VanDerWaalsContact C-N 3.31Å; E196-S198 PolarHBondContact O-N 3.33Å; S198-D200 PolarHBondContact O-N 3.37Å; S198-H203 WeakPolarHBondContact OG-CB 3.15Å
199	E	60.1	Low	78.8	Confident	203 Å²	203	67.8 Å²	67.8	95%	0.949	35%	0.353	S	S	*	.			trans	-66	-10.8	172	-65.8	-170.3	166.6	0	0	113	D197 A201	D197-E199 PolarHBondContact O-N 3.16Å; E199-A201 PolarHBondContact O-N 3.48Å
200	D	76.1	Confident	79.1	Confident	80 Å²	80	63 Å²	63	43%	0.428	33%	0.33	S	S	.	.			trans	-87	107.1	-177.3	-170.6	-6.8	0	0	0	111.8	S198 A202 H203 V204	S198-D200 PolarHBondContact O-N 3.37Å; D200-A202 PolarHBondContact O-N 3.29Å; D200-A202 VanDerWaalsContact O-N 3.1Å; D200-A202 VanDerWaalsContact OD1-CB 3.25Å; D200-A202 WeakPolarHBondContact OD1-CB 3.29Å; D200-A202 PolarHBondContact OD1-N 3.12Å; D200-H203 HydrophobicContact CB-CB 4.33Å; D200-H203 WeakPolarHBondContact O-CB 3.05Å; D200-H203 PolarHBondContact O-N 2.86Å; D200-H203 IonicContact OD2-CD2 2.89Å; D200-V204 PolarHBondContact O-N 2.66Å
201	A	77.8	Confident	79.6	Confident	67 Å²	67	58.6 Å²	58.6	55%	0.554	31%	0.312	S	S	*	.	H	α-helix	trans	-55.5	-27.4	175.6	0	0	0	0	0	113.3	E199 H203 V204 L205	E199-A201 PolarHBondContact O-N 3.48Å; A201-H203 VanDerWaalsContact C-N 3.35Å; A201-V204 PolarHBondContact O-N 2.88Å; A201-L205 WeakPolarHBondContact O-CG 3.49Å; A201-L205 PolarHBondContact O-N 3.48Å
202	A	78.6	Confident	79.8	Confident	24 Å²	24	59.1 Å²	59.1	20%	0.198	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-36.8	176	0	0	0	0	0	111.9	L167 L173 D200 L205 A206	L167-A202 HydrophobicContact CD1-CB 4.29Å; L167-A202 HydrophobicContact CD2-CB 4.3Å; L167-A202 WeakPolarHBondContact CD2-O 3.21Å; L173-A202 HydrophobicContact CD2-CB 4.36Å; D200-A202 PolarHBondContact O-N 3.29Å; D200-A202 VanDerWaalsContact O-N 3.1Å; D200-A202 VanDerWaalsContact OD1-CB 3.25Å; D200-A202 WeakPolarHBondContact OD1-CB 3.29Å; D200-A202 PolarHBondContact OD1-N 3.12Å; A202-L205 PolarHBondContact O-N 3.27Å; A202-A206 WeakPolarHBondContact O-CB 3.11Å; A202-A206 PolarHBondContact O-N 3.14Å
203	H	78.4	Confident	80.1	Confident	33 Å²	33	64.6 Å²	64.6	15%	0.153	34%	0.339	C	S	.	.	H	α-helix	trans	-69.6	-33.5	178.6	-94.8	-75.8	0	0	0	113.3	R151 H175 S198 D200 A201	R151-H203 PolarHBondContact NH1-O 2.71Å; H175-H203 AromaticContact CE1-CE1 3.68Å; H175-H203 AromaticContact CG-CE1 3.59Å; H175-H203 AromaticContact ND1-CE1 3.23Å; H175-H203 PolarHBondContact ND1-CE1 2.79Å; H175-H203 AromaticContact ND1-NE2 3.62Å; S198-H203 WeakPolarHBondContact OG-CB 3.15Å; D200-H203 HydrophobicContact CB-CB 4.33Å; D200-H203 WeakPolarHBondContact O-CB 3.05Å; D200-H203 PolarHBondContact O-N 2.86Å; D200-H203 IonicContact OD2-CD2 2.89Å; A201-H203 VanDerWaalsContact C-N 3.35Å
204	V	78.6	Confident	80.5	Confident	48 Å²	48	62.8 Å²	62.8	29%	0.291	33%	0.331	S	S	.	.	H	α-helix	trans	-71.4	-35	177.5	179.5	0	0	0	0	111.5	V194 D200 A201 H230	V194-V204 HydrophobicContact CG1-CB 4.41Å; V194-V204 HydrophobicContact CG1-CG1 4.34Å; V194-V204 HydrophobicContact CG1-CG2 4.23Å; D200-V204 PolarHBondContact O-N 2.66Å; A201-V204 PolarHBondContact O-N 2.88Å; V204-H230 PolarHBondContact O-NE2 3.05Å
205	L	80.7	Confident	81.1	Confident	107 Å²	107	64.5 Å²	64.5	56%	0.56	35%	0.347	S	S	*	.	H	α-helix	trans	-89.8	-13	-179.4	-66.9	174.9	0	0	0	114.2	L167 A201 A202	L167-L205 HydrophobicContact CD2-CB 4.16Å; A201-L205 WeakPolarHBondContact O-CG 3.49Å; A201-L205 PolarHBondContact O-N 3.48Å; A202-L205 PolarHBondContact O-N 3.27Å
206	A	87.4	Confident	82.1	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.008	32%	0.32	C	S	.	.			trans	-70.4	132.1	-177.4	0	0	0	0	0	112.8	R151 L165 A166 L167 L173 A202	R151-A206 PolarHBondContact NH1-O 2.86Å; L165-A206 HydrophobicContact CB-CB 4.4Å; L165-A206 HydrophobicContact CD2-CB 4.18Å; A166-A206 CarbonylContact O-C 3.59Å; A166-A206 WeakPolarHBondContact O-CA 3.39Å; L167-A206 HydrophobicContact CD2-CB 4.47Å; L173-A206 HydrophobicContact CD1-CB 3.54Å; A202-A206 WeakPolarHBondContact O-CB 3.11Å; A202-A206 PolarHBondContact O-N 3.14Å
207	D	89.4	Confident	83.8	Confident	15 Å²	15	51.4 Å²	51.4	8%	0.08	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	146.1	171.8	-65.7	-10.1	0	0	0	109.4	R152 A166 E209	R152-D207 WeakPolarHBondContact CB-OD1 3.39Å; R152-D207 IonicContact CZ-OD1 3.98Å; R152-D207 IonicContact CZ-OD2 2.98Å; R152-D207 VanDerWaalsContact NE-CG 3.25Å; R152-D207 IonicContact NE-OD1 3.29Å; R152-D207 PolarHBondContact NE-OD1 2.94Å; R152-D207 IonicContact NE-OD2 3.81Å; R152-D207 PolarHBondContact NE-OD2 3.5Å; R152-D207 IonicContact NH2-OD1 3.36Å; R152-D207 PolarHBondContact NH2-OD1 3.34Å; R152-D207 IonicContact NH2-OD2 2.71Å; R152-D207 WeakPolarHBondContact O-CA 3.26Å; A166-D207 PolarHBondContact N-O 2.64Å; A166-D207 PolarHBondContact O-N 3.1Å; D207-E209 PolarHBondContact O-N 3.07Å
208	L	92.3	Very high	85.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112	168.9	-163.9	72.2	0	0	0	109.2	R151 R152 L153 R154 V163 L165 L177 I187 L192 V210	R151-L208 HydrophobicContact CG-CB 4.21Å; R152-L208 PolarHBondContact O-N 3.1Å; L153-L208 CarbonylContact C-O 3.51Å; L153-L208 WeakPolarHBondContact CA-O 3.39Å; L153-L208 HydrophobicContact CD2-CB 3.7Å; L153-L208 HydrophobicContact CD2-CD2 3.97Å; L153-L208 HydrophobicContact CD2-CG 4.48Å; R154-L208 PolarHBondContact N-O 3.5Å; V163-L208 HydrophobicContact CG1-CD1 3.65Å; V163-L208 HydrophobicContact CG1-CD2 4.03Å; V163-L208 HydrophobicContact CG1-CG 3.87Å; L165-L208 HydrophobicContact CD2-CD1 3.85Å; L165-L208 HydrophobicContact CG-CD1 4.17Å; L177-L208 HydrophobicContact CD1-CD1 4.24Å; I187-L208 HydrophobicContact CG2-CD2 4.14Å; L192-L208 HydrophobicContact CD2-CD2 3.66Å; L208-V210 HydrophobicContact CD2-CG2 4.35Å; L208-V210 HydrophobicContact CG-CG2 4.42Å
209	E	93.4	Very high	87.2	Confident	50 Å²	50	47.5 Å²	47.5	23%	0.234	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	122	175	-65.1	-164.5	163.4	0	0	110.6	R154 V163 S164 A166 D207	R154-E209 HydrophobicContact CB-CG 4.4Å; R154-E209 WeakPolarHBondContact O-CA 3.41Å; V163-E209 WeakPolarHBondContact CA-O 3.32Å; S164-E209 PolarHBondContact N-O 3.19Å; S164-E209 PolarHBondContact O-N 2.65Å; A166-E209 HydrophobicContact CB-CG 3.93Å; D207-E209 PolarHBondContact O-N 3.07Å
210	V	94.2	Very high	88.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	105.5	177.8	-174.3	0	0	0	0	108.2	R154 F155 T156 V163 I187 L208	R154-V210 PolarHBondContact O-N 2.92Å; F155-V210 VanDerWaalsContact CA-O 3.3Å; F155-V210 WeakPolarHBondContact CA-O 3.31Å; F155-V210 HydrophobicContact CD1-CB 3.72Å; F155-V210 HydrophobicContact CD1-CG1 3.8Å; F155-V210 HydrophobicContact CD1-CG2 4.44Å; F155-V210 HydrophobicContact CE1-CB 3.65Å; F155-V210 HydrophobicContact CE1-CG1 3.56Å; F155-V210 HydrophobicContact CE1-CG2 3.96Å; F155-V210 HydrophobicContact CE2-CG2 4.32Å; F155-V210 HydrophobicContact CG-CB 4.21Å; F155-V210 HydrophobicContact CZ-CB 4.07Å; F155-V210 HydrophobicContact CZ-CG1 4.33Å; F155-V210 HydrophobicContact CZ-CG2 3.87Å; T156-V210 PolarHBondContact N-O 3.25Å; V163-V210 HydrophobicContact CG1-CG2 4.44Å; V163-V210 HydrophobicContact CG2-CG1 4.47Å; I187-V210 HydrophobicContact CD1-CB 4.43Å; I187-V210 HydrophobicContact CD1-CG1 4.04Å; I187-V210 HydrophobicContact CD1-CG2 3.52Å; L208-V210 HydrophobicContact CD2-CG2 4.35Å; L208-V210 HydrophobicContact CG-CG2 4.42Å
211	T	93.8	Very high	89.7	Confident	32 Å²	32	35.5 Å²	35.5	20%	0.196	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.8	169.4	56.5	0	0	0	0	108.4	T156 T161 R162	T156-T211 WeakPolarHBondContact O-CA 3.48Å; T156-T211 VanDerWaalsContact OG1-CG2 3.25Å; T156-T211 WeakPolarHBondContact OG1-CG2 3.36Å; T161-T211 CarbonylContact C-O 3.6Å; T161-T211 WeakPolarHBondContact CA-O 3.25Å; R162-T211 WeakPolarHBondContact CB-OG1 3.47Å; R162-T211 PolarHBondContact N-O 3.48Å; R162-T211 PolarHBondContact N-OG1 3.35Å; R162-T211 PolarHBondContact O-N 2.93Å; R162-T211 PolarHBondContact O-OG1 3.36Å; R162-T211 VanDerWaalsContact O-OG1 3.1Å
212	M	94.3	Very high	90.6	Very high	19 Å²	19	32.3 Å²	32.3	9%	0.094	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.3	176.2	67.2	179.9	-63.8	0	0	113.5	L132 V134 V136 F155 T156 G158 T161 H214 L217	L132-M212 HydrophobicContact CD1-SD 4.26Å; V134-M212 HydrophobicContact CG2-CE 4.33Å; V136-M212 HydrophobicContact CG2-CE 3.98Å; V136-M212 HydrophobicContact CG2-SD 4.18Å; F155-M212 HydrophobicContact CD1-SD 4.18Å; F155-M212 HydrophobicContact CE1-SD 4.48Å; T156-M212 PolarHBondContact O-N 2.76Å; G158-M212 PolarHBondContact N-O 3.31Å; G158-M212 CarbonylContact O-C 3.57Å; G158-M212 VanDerWaalsContact O-C 3.26Å; T161-M212 HydrophobicContact CG2-CB 4.2Å; M212-H214 HydrophobicContact CG-CB 4.43Å; M212-H214 PolarHBondContact O-N 3Å; M212-L217 HydrophobicContact CG-CD1 3.37Å; M212-L217 HydrophobicContact SD-CD1 4.06Å
213	H	93.7	Very high	91.4	Very high	121 Å²	121	31.3 Å²	31.3	56%	0.56	17%	0.165	S	C	*	.			trans	-81.4	97.8	178.4	-171.1	70.2	0	0	0	110.8	Y157 G158	Y157-H213 AromaticContact CE2-ND1 3.55Å; Y157-H213 AromaticContact CZ-ND1 3.82Å; Y157-H213 PolarHBondContact OH-CE1 3.29Å; Y157-H213 PolarHBondContact OH-ND1 3.34Å; G158-H213 WeakPolarHBondContact O-CA 3.47Å; G158-H213 WeakPolarHBondContact O-CB 3.39Å; G158-H213 PolarHBondContact O-N 2.87Å
214	H	94.3	Very high	92.1	Very high	24 Å²	24	29.8 Å²	29.8	11%	0.111	16%	0.158	C	C	.	.			trans	-146.3	137.6	179.5	-171.1	-98.9	0	0	0	112.1	L132 M212 L216 L217 Q218	L132-H214 PolarHBondContact O-NE2 3.05Å; M212-H214 HydrophobicContact CG-CB 4.43Å; M212-H214 PolarHBondContact O-N 3Å; H214-L216 VanDerWaalsContact C-N 3.35Å; H214-L216 VanDerWaalsContact CE1-CB 3.45Å; H214-L216 WeakPolarHBondContact CE1-CB 3.16Å; H214-L216 WeakPolarHBondContact ND1-CB 3.43Å; H214-L216 PolarHBondContact ND1-N 2.93Å; H214-L216 VanDerWaalsContact ND1-N 3.2Å; H214-L216 PolarHBondContact O-N 2.94Å; H214-L217 HydrophobicContact CB-CB 4.26Å; H214-L217 HydrophobicContact CB-CD1 3.94Å; H214-L217 HydrophobicContact CB-CG 4Å; H214-L217 PolarHBondContact O-N 2.97Å; H214-L217 VanDerWaalsContact O-N 3.15Å; H214-Q218 PolarHBondContact O-N 3.11Å
215	A	92.6	Very high	92.8	Very high	51 Å²	51	27.5 Å²	27.5	42%	0.421	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-36.7	-174.9	0	0	0	0	0	113.4	C28	C28-A215 PolarHBondContact SG-O 3.06Å
216	L	93.8	Very high	93.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-39	175.9	-173.9	58.1	0	0	0	111.8	I24 L27 F31 H214 Q218 E219 V220 I222	I24-L216 HydrophobicContact CG2-CB 4.38Å; L27-L216 HydrophobicContact CB-CD1 3.67Å; L27-L216 HydrophobicContact CD1-CD1 4.43Å; L27-L216 HydrophobicContact CD1-CD2 4.3Å; F31-L216 HydrophobicContact CD2-CD1 4.37Å; H214-L216 VanDerWaalsContact C-N 3.35Å; H214-L216 VanDerWaalsContact CE1-CB 3.45Å; H214-L216 WeakPolarHBondContact CE1-CB 3.16Å; H214-L216 WeakPolarHBondContact ND1-CB 3.43Å; H214-L216 PolarHBondContact ND1-N 2.93Å; H214-L216 VanDerWaalsContact ND1-N 3.2Å; H214-L216 PolarHBondContact O-N 2.94Å; L216-Q218 VanDerWaalsContact C-N 3.26Å; L216-Q218 PolarHBondContact O-N 3.12Å; L216-E219 PolarHBondContact O-N 3.17Å; L216-V220 HydrophobicContact CD1-CG1 3.79Å; L216-V220 HydrophobicContact CG-CG1 3.94Å; L216-V220 PolarHBondContact O-N 3.29Å; L216-I222 HydrophobicContact CD2-CD1 4.07Å
217	L	95.2	Very high	93.2	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.1	-177.1	-62.5	-179.9	0	0	0	112.3	L132 F155 Y157 M212 H214 E219 V220 I222	L132-L217 HydrophobicContact CD2-CD2 4.32Å; L132-L217 HydrophobicContact CD2-CG 4.28Å; F155-L217 HydrophobicContact CB-CD1 4.27Å; F155-L217 HydrophobicContact CB-CD2 4Å; Y157-L217 WeakPolarHBondContact CB-O 3.41Å; M212-L217 HydrophobicContact CG-CD1 3.37Å; M212-L217 HydrophobicContact SD-CD1 4.06Å; H214-L217 HydrophobicContact CB-CB 4.26Å; H214-L217 HydrophobicContact CB-CD1 3.94Å; H214-L217 HydrophobicContact CB-CG 4Å; H214-L217 PolarHBondContact O-N 2.97Å; H214-L217 VanDerWaalsContact O-N 3.15Å; L217-E219 PolarHBondContact O-N 3.27Å; L217-V220 WeakPolarHBondContact CA-O 3.44Å; L217-I222 HydrophobicContact CD2-CB 4.48Å; L217-I222 HydrophobicContact CD2-CD1 3.94Å; L217-I222 HydrophobicContact CD2-CG1 3.84Å
218	Q	92.7	Very high	92.6	Very high	82 Å²	82	23.8 Å²	23.8	38%	0.383	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.6	169.7	-70.5	-180	-12.5	0	0	112	R35 Y157 H214 L216	R35-Q218 PolarHBondContact NH1-O 3.41Å; Y157-Q218 HydrophobicContact CD1-CG 4.19Å; Y157-Q218 HydrophobicContact CD2-CB 4.3Å; Y157-Q218 HydrophobicContact CD2-CG 3.27Å; Y157-Q218 HydrophobicContact CE1-CG 4.14Å; Y157-Q218 HydrophobicContact CE2-CG 3.21Å; Y157-Q218 VanDerWaalsContact CE2-NE2 3.31Å; Y157-Q218 HydrophobicContact CG-CG 3.77Å; Y157-Q218 VanDerWaalsContact CZ-NE2 3.33Å; Y157-Q218 PolarHBondContact OH-NE2 3.38Å; Y157-Q218 VanDerWaalsContact OH-NE2 3.09Å; H214-Q218 PolarHBondContact O-N 3.11Å; L216-Q218 VanDerWaalsContact C-N 3.26Å; L216-Q218 PolarHBondContact O-N 3.12Å
219	E	93.1	Very high	91.8	Very high	37 Å²	37	27.6 Å²	27.6	17%	0.173	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-27.8	-172.5	-61.8	-65.6	177.2	0	0	113.6	C28 F31 S32 R35 L216 L217	C28-E219 HydrophobicContact CB-CG 4.32Å; F31-E219 HydrophobicContact CB-CB 3.83Å; S32-E219 VanDerWaalsContact CA-OE2 3.28Å; S32-E219 WeakPolarHBondContact CA-OE2 3.13Å; S32-E219 WeakPolarHBondContact CB-OE1 3.35Å; S32-E219 WeakPolarHBondContact CB-OE2 3.07Å; S32-E219 PolarHBondContact OG-OE1 2.93Å; R35-E219 PolarHBondContact NE-O 2.94Å; R35-E219 VanDerWaalsContact NH2-C 3.28Å; R35-E219 PolarHBondContact NH2-O 2.68Å; L216-E219 PolarHBondContact O-N 3.17Å; L217-E219 PolarHBondContact O-N 3.27Å
220	V	94.9	Very high	91.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.159	C	C	.	.			trans	-154.2	137.7	-176.9	70.6	0	0	0	0	112.3	F31 P112 I114 L216 L217	F31-V220 HydrophobicContact CD1-CB 3.87Å; F31-V220 HydrophobicContact CD1-CG1 4.5Å; F31-V220 HydrophobicContact CD1-CG2 3.83Å; F31-V220 HydrophobicContact CD2-CB 4.1Å; F31-V220 HydrophobicContact CD2-CG1 3.89Å; F31-V220 HydrophobicContact CE1-CB 3.99Å; F31-V220 HydrophobicContact CE1-CG1 4.43Å; F31-V220 HydrophobicContact CE1-CG2 3.53Å; F31-V220 HydrophobicContact CE2-CB 4.23Å; F31-V220 HydrophobicContact CE2-CG1 3.83Å; F31-V220 HydrophobicContact CE2-CG2 4.39Å; F31-V220 HydrophobicContact CG-CB 3.94Å; F31-V220 HydrophobicContact CG-CG1 4.26Å; F31-V220 HydrophobicContact CG-CG2 4.39Å; F31-V220 HydrophobicContact CZ-CB 4.19Å; F31-V220 HydrophobicContact CZ-CG1 4.12Å; F31-V220 HydrophobicContact CZ-CG2 3.86Å; P112-V220 WeakPolarHBondContact O-CG2 3.31Å; I114-V220 HydrophobicContact CD1-CG1 3.84Å; I114-V220 HydrophobicContact CG1-CG1 4.16Å; I114-V220 HydrophobicContact CG1-CG2 4.07Å; L216-V220 HydrophobicContact CD1-CG1 3.79Å; L216-V220 HydrophobicContact CG-CG1 3.94Å; L216-V220 PolarHBondContact O-N 3.29Å; L217-V220 WeakPolarHBondContact CA-O 3.44Å
221	D	94.4	Very high	90.5	Very high	31 Å²	31	31.7 Å²	31.7	17%	0.166	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	147.1	170.6	-69.8	6.1	0	0	0	109.7	C113 I114 R154	C113-D221 WeakPolarHBondContact CA-O 3.27Å; C113-D221 PolarHBondContact SG-O 3.39Å; C113-D221 VanDerWaalsContact SG-O 3.4Å; I114-D221 PolarHBondContact N-O 3.23Å; R154-D221 IonicContact CZ-OD2 3.05Å; R154-D221 IonicContact NE-OD2 2.8Å; R154-D221 IonicContact NH2-OD2 3.02Å; R154-D221 PolarHBondContact NH2-OD2 3.01Å
222	I	96.5	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.4	175	-50.8	179.6	0	0	0	108.9	I114 I116 L128 L132 F155 L216 L217	I114-I222 HydrophobicContact CB-CG1 4.21Å; I114-I222 HydrophobicContact CB-CG2 4.24Å; I114-I222 HydrophobicContact CD1-CG1 4.39Å; I114-I222 HydrophobicContact CG2-CG2 4.28Å; I114-I222 CarbonylContact O-C 3.56Å; I114-I222 WeakPolarHBondContact O-CA 3.5Å; I116-I222 HydrophobicContact CD1-CG2 3.76Å; I116-I222 HydrophobicContact CG1-CG2 4.13Å; L128-I222 HydrophobicContact CD1-CB 4.2Å; L128-I222 HydrophobicContact CD1-CD1 4.18Å; L128-I222 HydrophobicContact CD1-CG2 3.54Å; L132-I222 HydrophobicContact CD2-CD1 3.92Å; F155-I222 HydrophobicContact CB-CB 4.28Å; F155-I222 PolarHBondContact N-O 2.94Å; F155-I222 PolarHBondContact O-N 3.43Å; L216-I222 HydrophobicContact CD2-CD1 4.07Å; L217-I222 HydrophobicContact CD2-CB 4.48Å; L217-I222 HydrophobicContact CD2-CD1 3.94Å; L217-I222 HydrophobicContact CD2-CG1 3.84Å
223	V	94.9	Very high	89.9	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.024	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.8	176.8	176.9	0	0	0	0	109	C113 I114 L115 I116 R152 L153 R154 L240	C113-V223 VanDerWaalsContact SG-CG2 3.57Å; I114-V223 PolarHBondContact O-N 3.37Å; L115-V223 CarbonylContact C-O 3.49Å; L115-V223 WeakPolarHBondContact CA-O 3.37Å; L115-V223 HydrophobicContact CD1-CB 4.19Å; L115-V223 HydrophobicContact CD1-CG1 4Å; I116-V223 PolarHBondContact N-O 3.03Å; R152-V223 HydrophobicContact CG-CG1 3.95Å; L153-V223 CarbonylContact O-C 3.51Å; L153-V223 WeakPolarHBondContact O-CA 3.32Å; R154-V223 HydrophobicContact CG-CG2 4.19Å; V223-L240 HydrophobicContact CB-CD1 4.39Å; V223-L240 HydrophobicContact CG1-CD1 4Å; V223-L240 HydrophobicContact CG2-CD2 4.28Å
224	V	94.9	Very high	89.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.8	171.8	-172.7	0	0	0	0	108.1	I116 K124 L128 L150 L153	I116-V224 HydrophobicContact CB-CG2 4.45Å; I116-V224 HydrophobicContact CD1-CG2 4.26Å; K124-V224 HydrophobicContact CB-CG1 3.85Å; K124-V224 HydrophobicContact CD-CG1 4.31Å; L128-V224 HydrophobicContact CB-CG2 4.43Å; L128-V224 HydrophobicContact CD1-CG2 4.27Å; L128-V224 HydrophobicContact CD2-CG2 4.12Å; L150-V224 HydrophobicContact CD2-CG1 4.35Å; L153-V224 HydrophobicContact CB-CB 4.03Å; L153-V224 HydrophobicContact CB-CG2 4.34Å; L153-V224 HydrophobicContact CD1-CB 4.24Å; L153-V224 HydrophobicContact CD1-CG2 4.41Å; L153-V224 HydrophobicContact CG-CB 4.25Å; L153-V224 PolarHBondContact N-O 3.38Å; L153-V224 VanDerWaalsContact N-O 3.07Å; L153-V224 PolarHBondContact O-N 3.1Å
225	A	92.4	Very high	89.4	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.008	17%	0.168	C	C	.	.			trans	-67.5	145.4	179.9	0	0	0	0	0	111.4	L115 I116 L117 K124 V236	L115-A225 HydrophobicContact CD1-CB 4.42Å; I116-A225 WeakPolarHBondContact O-CB 3.38Å; I116-A225 PolarHBondContact O-N 2.81Å; L117-A225 HydrophobicContact CD2-CB 3.5Å; L117-A225 VanDerWaalsContact CD2-CB 3.5Å; K124-A225 PolarHBondContact NZ-O 3.23Å; A225-V236 HydrophobicContact CB-CG1 4.14Å
226	P	90.4	Very high	89.2	Confident	4 Å²	4	27.2 Å²	27.2	3%	0.026	15%	0.148	C	C	.	.			trans	-63.2	174.3	176	29.1	-35.4	0	0	0	111.7	K124 L150 R152 R231 V236	K124-P226 VanDerWaalsContact NZ-C 3.33Å; K124-P226 PolarHBondContact NZ-O 3.31Å; L150-P226 CarbonylContact O-C 3.52Å; L150-P226 WeakPolarHBondContact O-CA 3.38Å; L150-P226 VanDerWaalsContact O-CB 3.28Å; L150-P226 WeakPolarHBondContact O-CB 3.36Å; R152-P226 HydrophobicContact CB-CB 4.47Å; R152-P226 HydrophobicContact CB-CG 4.38Å; P226-R231 HydrophobicContact CG-CB 3.75Å; P226-V236 HydrophobicContact CG-CG2 3.85Å
227	C	85.5	Confident	89	Confident	8 Å²	8	27.2 Å²	27.2	5%	0.054	15%	0.148	C	C	.	.			trans	-60.6	136.9	170.7	-165.2	0	0	0	0	110.7	C148 L150 S229 H230 R231	C148-C227 PolarHBondContact O-SG 2.93Å; L150-C227 PolarHBondContact O-N 2.75Å; C227-S229 PolarHBondContact O-N 2.92Å; C227-S229 VanDerWaalsContact O-N 3.13Å; C227-S229 PolarHBondContact SG-OG 3.38Å; C227-H230 HydrophobicContact CB-CB 4.49Å; C227-H230 WeakPolarHBondContact O-CA 3.45Å; C227-H230 WeakPolarHBondContact O-CB 3.39Å; C227-H230 PolarHBondContact O-N 3.25Å; C227-R231 PolarHBondContact O-N 3.33Å
228	P	77.8	Confident	88.7	Confident	32 Å²	32	29.8 Å²	29.8	21%	0.208	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.7	180	-25.8	34.7	0	0	0	114.8	H230	P228-H230 VanDerWaalsContact C-N 3.34Å
229	S	75.8	Confident	88.3	Confident	81 Å²	81	28.5 Å²	28.5	57%	0.566	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-29.6	171.6	47.2	0	0	0	0	112.8	C227	C227-S229 PolarHBondContact O-N 2.92Å; C227-S229 VanDerWaalsContact O-N 3.13Å; C227-S229 PolarHBondContact SG-OG 3.38Å
230	H	77.1	Confident	87.9	Confident	71 Å²	71	27.3 Å²	27.3	33%	0.329	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-47.2	177.5	-173.8	57.3	0	0	0	111.4	V204 C227 P228	V204-H230 PolarHBondContact O-NE2 3.05Å; C227-H230 HydrophobicContact CB-CB 4.49Å; C227-H230 WeakPolarHBondContact O-CA 3.45Å; C227-H230 WeakPolarHBondContact O-CB 3.39Å; C227-H230 PolarHBondContact O-N 3.25Å; P228-H230 VanDerWaalsContact C-N 3.34Å
231	R	83.1	Confident	87.3	Confident	64 Å²	64	27.9 Å²	27.9	24%	0.242	16%	0.161	C	C	.	.	S	Bend	trans	-150.5	127.5	177	-162.2	171.8	-174.9	-168.4	-6.3	111.9	P226 C227 D235 V236 D239	P226-R231 HydrophobicContact CG-CB 3.75Å; C227-R231 PolarHBondContact O-N 3.33Å; R231-D235 HydrophobicContact CG-CB 4.25Å; R231-V236 HydrophobicContact CB-CG2 4.44Å; R231-V236 HydrophobicContact CG-CG2 4.19Å; R231-D239 IonicContact CZ-OD1 2.62Å; R231-D239 IonicContact CZ-OD2 2.92Å; R231-D239 IonicContact NH1-OD2 3.03Å; R231-D239 PolarHBondContact NH1-OD2 3Å; R231-D239 IonicContact NH2-OD1 3.76Å; R231-D239 PolarHBondContact NH2-OD1 3.19Å; R231-D239 IonicContact NH2-OD2 3.65Å; R231-D239 PolarHBondContact NH2-OD2 3.38Å
232	P	86.7	Confident	86.6	Confident	59 Å²	59	31.1 Å²	31.1	38%	0.383	18%	0.178	S	C	.	.			trans	-60.2	144.9	178.4	-23.6	33.2	0	0	0	113.2	V234 D235 V236	P232-V234 PolarHBondContact O-N 3.36Å; P232-D235 WeakPolarHBondContact CD-OD2 3.42Å; P232-D235 PolarHBondContact O-N 3.4Å; P232-D235 VanDerWaalsContact O-N 3.12Å; P232-V236 WeakPolarHBondContact O-CG2 3.49Å; P232-V236 PolarHBondContact O-N 2.84Å
233	S	88.4	Confident	85.9	Confident	5 Å²	5	36.3 Å²	36.3	4%	0.035	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-29.5	179.6	-65.2	0	0	0	0	113.6	V236 L237 E264	S233-V236 PolarHBondContact O-N 3.24Å; S233-L237 WeakPolarHBondContact O-CB 3.49Å; S233-L237 WeakPolarHBondContact O-CG 3.32Å; S233-L237 PolarHBondContact O-N 3.28Å; S233-E264 WeakPolarHBondContact CB-OE1 3.42Å; S233-E264 PolarHBondContact OG-OE1 3.25Å
234	V	89.6	Confident	85.5	Confident	19 Å²	19	37.7 Å²	37.7	12%	0.115	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175.3	177.6	0	0	0	0	111.2	P232 L237 S238 E267 V268 Y271 F272	P232-V234 PolarHBondContact O-N 3.36Å; V234-L237 PolarHBondContact O-N 2.82Å; V234-S238 WeakPolarHBondContact O-CB 3.46Å; V234-S238 PolarHBondContact O-N 3.29Å; V234-E267 HydrophobicContact CG2-CB 3.86Å; V234-V268 HydrophobicContact CG2-CG2 4.03Å; V234-Y271 HydrophobicContact CG1-CD2 3.76Å; V234-Y271 HydrophobicContact CG1-CE2 4.37Å; V234-Y271 HydrophobicContact CG1-CG 4.15Å; V234-Y271 HydrophobicContact CG2-CD2 4.42Å; V234-F272 HydrophobicContact CG1-CE2 4.03Å
235	D	88.4	Confident	85.2	Confident	71 Å²	71	38.4 Å²	38.4	38%	0.38	22%	0.216	S	C	.	.	H	α-helix	trans	-69.1	-40.4	-179.7	-64.2	-21.5	0	0	0	111.1	R231 P232 L237 S238 D239	R231-D235 HydrophobicContact CG-CB 4.25Å; P232-D235 WeakPolarHBondContact CD-OD2 3.42Å; P232-D235 PolarHBondContact O-N 3.4Å; P232-D235 VanDerWaalsContact O-N 3.12Å; D235-L237 VanDerWaalsContact C-N 3.32Å; D235-L237 PolarHBondContact O-N 2.83Å; D235-S238 WeakPolarHBondContact O-CB 3.3Å; D235-S238 PolarHBondContact O-N 2.82Å; D235-D239 PolarHBondContact O-N 2.79Å
236	V	87.5	Confident	85.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-42.4	176.2	178.8	0	0	0	0	110.8	L115 A225 P226 R231 P232 S233 L240	L115-V236 HydrophobicContact CD1-CG1 4.34Å; A225-V236 HydrophobicContact CB-CG1 4.14Å; P226-V236 HydrophobicContact CG-CG2 3.85Å; R231-V236 HydrophobicContact CB-CG2 4.44Å; R231-V236 HydrophobicContact CG-CG2 4.19Å; P232-V236 WeakPolarHBondContact O-CG2 3.49Å; P232-V236 PolarHBondContact O-N 2.84Å; S233-V236 PolarHBondContact O-N 3.24Å; V236-L240 HydrophobicContact CG1-CD1 4.01Å; V236-L240 WeakPolarHBondContact O-CB 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.37Å; V236-L240 PolarHBondContact O-N 2.81Å; V236-L240 VanDerWaalsContact O-N 3.14Å
237	L	89.2	Confident	85.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-40.6	174.8	-80.4	167.5	0	0	0	112.1	L115 L117 S233 V234 D235 L240 A241 I248 V268 F272	L115-L237 HydrophobicContact CD2-CD2 3.3Å; L115-L237 HydrophobicContact CD2-CG 4Å; L117-L237 HydrophobicContact CD1-CD1 4.22Å; S233-L237 WeakPolarHBondContact O-CB 3.49Å; S233-L237 WeakPolarHBondContact O-CG 3.32Å; S233-L237 PolarHBondContact O-N 3.28Å; V234-L237 PolarHBondContact O-N 2.82Å; D235-L237 VanDerWaalsContact C-N 3.32Å; D235-L237 PolarHBondContact O-N 2.83Å; L237-L240 PolarHBondContact O-N 3.05Å; L237-A241 WeakPolarHBondContact O-CB 3.08Å; L237-A241 PolarHBondContact O-N 3.49Å; L237-I248 HydrophobicContact CD2-CD1 3.58Å; L237-I248 HydrophobicContact CD2-CG1 4.06Å; L237-V268 HydrophobicContact CD1-CB 4.38Å; L237-V268 HydrophobicContact CD1-CG1 3.58Å; L237-V268 HydrophobicContact CD1-CG2 3.93Å; L237-F272 HydrophobicContact CB-CD2 4.16Å; L237-F272 HydrophobicContact CB-CE2 3.64Å; L237-F272 HydrophobicContact CB-CZ 3.86Å; L237-F272 HydrophobicContact CD1-CD2 4.07Å; L237-F272 HydrophobicContact CD1-CE2 4.28Å
238	S	88.4	Confident	85.8	Confident	56 Å²	56	38 Å²	38	39%	0.392	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-47.4	178.2	-169.1	0	0	0	0	111.7	V234 D235 L240 N242	V234-S238 WeakPolarHBondContact O-CB 3.46Å; V234-S238 PolarHBondContact O-N 3.29Å; D235-S238 WeakPolarHBondContact O-CB 3.3Å; D235-S238 PolarHBondContact O-N 2.82Å; S238-L240 PolarHBondContact O-N 2.68Å; S238-N242 PolarHBondContact O-ND2 3.23Å; S238-N242 VanDerWaalsContact O-ND2 3.13Å
239	D	85.4	Confident	86.6	Confident	55 Å²	55	36.5 Å²	36.5	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-55.7	-53.2	174.1	-76.3	8.5	0	0	0	111.2	R152 R231 D235	R152-D239 IonicContact CZ-OD2 3.71Å; R152-D239 IonicContact NH1-OD2 3.36Å; R152-D239 PolarHBondContact NH1-OD2 3.34Å; R231-D239 IonicContact CZ-OD1 2.62Å; R231-D239 IonicContact CZ-OD2 2.92Å; R231-D239 IonicContact NH1-OD2 3.03Å; R231-D239 PolarHBondContact NH1-OD2 3Å; R231-D239 IonicContact NH2-OD1 3.76Å; R231-D239 PolarHBondContact NH2-OD1 3.19Å; R231-D239 IonicContact NH2-OD2 3.65Å; R231-D239 PolarHBondContact NH2-OD2 3.38Å; D235-D239 PolarHBondContact O-N 2.79Å
240	L	83.8	Confident	87.6	Confident	13 Å²	13	32.7 Å²	32.7	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-71.7	-34.3	-173.1	-72.9	170.4	0	0	0	113	L115 V223 V236 L237 S238 N242 D243 F244	L115-L240 HydrophobicContact CD1-CD1 3.53Å; L115-L240 HydrophobicContact CD2-CD1 3.87Å; L115-L240 HydrophobicContact CG-CD1 4.19Å; V223-L240 HydrophobicContact CB-CD1 4.39Å; V223-L240 HydrophobicContact CG1-CD1 4Å; V223-L240 HydrophobicContact CG2-CD2 4.28Å; V236-L240 HydrophobicContact CG1-CD1 4.01Å; V236-L240 WeakPolarHBondContact O-CB 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.37Å; V236-L240 PolarHBondContact O-N 2.81Å; V236-L240 VanDerWaalsContact O-N 3.14Å; L237-L240 PolarHBondContact O-N 3.05Å; S238-L240 PolarHBondContact O-N 2.68Å; L240-N242 PolarHBondContact O-N 2.86Å; L240-D243 PolarHBondContact O-N 3.48Å; L240-F244 HydrophobicContact CD2-CD2 3.89Å; L240-F244 HydrophobicContact CD2-CE2 4.32Å; L240-F244 WeakPolarHBondContact O-CA 3.22Å; L240-F244 WeakPolarHBondContact O-CB 3.46Å; L240-F244 PolarHBondContact O-N 3.19Å
241	A	82.9	Confident	88.4	Confident	12 Å²	12	29.3 Å²	29.3	10%	0.099	16%	0.161	C	C	.	.	H	α-helix	trans	-67.7	-19	-177.3	0	0	0	0	0	113	R110 L237 F272 F274	R110-A241 PolarHBondContact NE-O 2.64Å; R110-A241 PolarHBondContact NH1-O 3.29Å; L237-A241 WeakPolarHBondContact O-CB 3.08Å; L237-A241 PolarHBondContact O-N 3.49Å; A241-F272 HydrophobicContact CB-CE1 4.47Å; A241-F274 HydrophobicContact CB-CE2 4.5Å
242	N	79.5	Confident	88.8	Confident	98 Å²	98	26.3 Å²	26.3	52%	0.524	15%	0.149	S	C	.	.	H	α-helix	trans	-71.9	-41.7	175.4	-71.4	-36	0	0	0	112	R110 S238 L240	R110-N242 PolarHBondContact NE-O 3.45Å; R110-N242 PolarHBondContact NH2-O 2.9Å; S238-N242 PolarHBondContact O-ND2 3.23Å; S238-N242 VanDerWaalsContact O-ND2 3.13Å; L240-N242 PolarHBondContact O-N 2.86Å
243	D	81.1	Confident	88.8	Confident	109 Å²	109	25.8 Å²	25.8	58%	0.583	14%	0.142	S	C	*	.	H	α-helix	trans	-104	-25.8	-170.9	-61.9	-36.4	0	0	0	113.5	L240	L240-D243 PolarHBondContact O-N 3.48Å
244	F	87.1	Confident	88.6	Confident	34 Å²	34	30 Å²	30	15%	0.149	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	160.6	-172.7	-57.4	-80.9	0	0	0	112.5	L111 C113 L240 P246	L111-F244 CarbonylContact O-C 3.2Å; L111-F244 WeakPolarHBondContact O-CA 3.44Å; C113-F244 HydrophobicContact CB-CB 3.9Å; C113-F244 HydrophobicContact CB-CD1 4.16Å; C113-F244 HydrophobicContact CB-CG 4.1Å; L240-F244 HydrophobicContact CD2-CD2 3.89Å; L240-F244 HydrophobicContact CD2-CE2 4.32Å; L240-F244 WeakPolarHBondContact O-CA 3.22Å; L240-F244 WeakPolarHBondContact O-CB 3.46Å; L240-F244 PolarHBondContact O-N 3.19Å; F244-P246 VanDerWaalsContact O-CD 3.28Å; F244-P246 WeakPolarHBondContact O-CD 3.47Å
245	L	88.5	Confident	88.4	Confident	15 Å²	15	32.6 Å²	32.6	8%	0.079	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	99	166	176.3	64.9	0	0	0	108.6	Y34 L111 P112 C113 V247 L349 R352	Y34-L245 HydrophobicContact CE2-CD2 4.33Å; Y34-L245 WeakPolarHBondContact OH-CD2 3.47Å; L111-L245 PolarHBondContact O-N 3.43Å; P112-L245 VanDerWaalsContact CA-O 3.3Å; P112-L245 WeakPolarHBondContact CA-O 3.4Å; C113-L245 PolarHBondContact N-O 2.98Å; L245-V247 PolarHBondContact O-N 3.47Å; L245-L349 HydrophobicContact CD2-CD2 3.68Å; L245-L349 HydrophobicContact CG-CD2 4.47Å; L245-R352 HydrophobicContact CD1-CG 4.02Å; L245-R352 HydrophobicContact CD2-CB 4.16Å; L245-R352 HydrophobicContact CD2-CG 3.85Å
246	P	90.9	Very high	88.4	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.026	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.8	-173.6	30.1	-35	0	0	0	111.9	C113 L115 F244 I248	C113-P246 CarbonylContact O-C 3.59Å; C113-P246 WeakPolarHBondContact O-CA 3.45Å; L115-P246 HydrophobicContact CB-CB 4.41Å; F244-P246 VanDerWaalsContact O-CD 3.28Å; F244-P246 WeakPolarHBondContact O-CD 3.47Å; P246-I248 HydrophobicContact CB-CG1 3.97Å; P246-I248 HydrophobicContact CG-CG1 4.3Å
247	V	94.6	Very high	88.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	99.8	158.3	179.3	0	0	0	0	106.4	F31 C113 I114 L115 L245 L341 F344 S345 L348	F31-V247 HydrophobicContact CE1-CG2 4.19Å; F31-V247 HydrophobicContact CZ-CG2 4.17Å; C113-V247 PolarHBondContact O-N 2.86Å; I114-V247 HydrophobicContact CG1-CB 4.43Å; L115-V247 PolarHBondContact N-O 2.84Å; L245-V247 PolarHBondContact O-N 3.47Å; V247-L341 HydrophobicContact CG1-CD1 4.4Å; V247-F344 HydrophobicContact CG1-CD1 4.19Å; V247-F344 HydrophobicContact CG1-CE1 4.02Å; V247-S345 WeakPolarHBondContact CG1-OG 3.15Å; V247-L348 HydrophobicContact CB-CD2 4.48Å; V247-L348 HydrophobicContact CG2-CD2 3.99Å
248	I	95.3	Very high	88.5	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.4	-171.8	-52.6	172.3	0	0	0	109.9	L117 L237 P246 F274 M276 F277	L117-I248 HydrophobicContact CD1-CG2 3.84Å; L117-I248 HydrophobicContact CG-CG2 4.26Å; L237-I248 HydrophobicContact CD2-CD1 3.58Å; L237-I248 HydrophobicContact CD2-CG1 4.06Å; P246-I248 HydrophobicContact CB-CG1 3.97Å; P246-I248 HydrophobicContact CG-CG1 4.3Å; I248-F274 HydrophobicContact CD1-CB 3.51Å; I248-F274 HydrophobicContact CD1-CD2 4.04Å; I248-F274 HydrophobicContact CD1-CG 3.99Å; I248-M276 HydrophobicContact CB-CG 4.09Å; I248-M276 HydrophobicContact CG2-CE 3.83Å; I248-M276 HydrophobicContact CG2-CG 3.81Å; I248-M276 HydrophobicContact CG2-SD 4.28Å; I248-F277 PolarHBondContact O-N 3.05Å
249	T	96.2	Very high	88.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.4	171	62.7	0	0	0	0	109.3	I114 L115 I116 L117 F277 L341	I114-T249 HydrophobicContact CG2-CG2 4.29Å; L115-T249 PolarHBondContact O-N 3.23Å; L115-T249 PolarHBondContact O-OG1 3.38Å; I116-T249 WeakPolarHBondContact CA-OG1 3.32Å; L117-T249 WeakPolarHBondContact CB-O 3.19Å; L117-T249 PolarHBondContact N-O 3.06Å; T249-F277 CarbonylContact C-O 3.54Å; T249-F277 VanDerWaalsContact CA-O 3.27Å; T249-F277 WeakPolarHBondContact CA-O 3.38Å; T249-F277 HydrophobicContact CG2-CB 4.25Å; T249-F277 HydrophobicContact CG2-CD1 4.33Å; T249-L341 HydrophobicContact CG2-CD1 3.74Å; T249-L341 HydrophobicContact CG2-CD2 4.39Å
250	Y	95.6	Very high	88.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110.4	176.2	-165.4	-80.6	0	0	0	109.2	L117 Q119 L252 L257 L265 M276 F277 F278 F279	L117-Y250 HydrophobicContact CB-CD2 3.56Å; L117-Y250 HydrophobicContact CB-CE2 4.11Å; L117-Y250 HydrophobicContact CB-CG 4.37Å; L117-Y250 HydrophobicContact CD1-CD2 4.39Å; L117-Y250 CarbonylContact O-C 3.6Å; L117-Y250 WeakPolarHBondContact O-CA 3.11Å; Q119-Y250 HydrophobicContact CB-CE1 4.34Å; Y250-L252 HydrophobicContact CD1-CD2 3.73Å; Y250-L252 HydrophobicContact CD1-CG 4.06Å; Y250-L252 HydrophobicContact CE1-CD2 3.61Å; Y250-L252 HydrophobicContact CE1-CG 4.41Å; Y250-L257 HydrophobicContact CE1-CD2 4.39Å; Y250-L265 HydrophobicContact CD2-CD2 3.81Å; Y250-L265 HydrophobicContact CE2-CD2 3.68Å; Y250-L265 HydrophobicContact CE2-CG 4.27Å; Y250-L265 HydrophobicContact CG-CD2 4.49Å; Y250-M276 HydrophobicContact CD2-CE 3.73Å; Y250-M276 HydrophobicContact CG-CE 4.12Å; Y250-F277 PolarHBondContact N-O 2.69Å; Y250-F278 AromaticContact CD1-CD1 3.88Å; Y250-F278 HydrophobicContact CD1-CD1 3.88Å; Y250-F278 HydrophobicContact CD1-CE1 4.11Å; Y250-F278 AromaticContact CG-CD1 3.91Å; Y250-F278 HydrophobicContact CG-CD1 3.91Å; Y250-F278 AromaticContact CG-CE1 3.9Å; Y250-F278 HydrophobicContact CG-CE1 3.9Å; Y250-F278 WeakPolarHBondContact O-CA 3.41Å; Y250-F279 PolarHBondContact O-N 3Å
251	A	94.1	Very high	88.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	132.3	-179.3	0	0	0	0	0	111.4	L117 G118 Q119 A123 L127 F279 V281	L117-A251 PolarHBondContact O-N 3.37Å; G118-A251 CarbonylContact C-O 3.59Å; G118-A251 WeakPolarHBondContact CA-O 3.43Å; Q119-A251 PolarHBondContact N-O 3.35Å; A123-A251 VanDerWaalsContact C-CB 3.5Å; A123-A251 HydrophobicContact CB-CB 3.8Å; A123-A251 WeakPolarHBondContact O-CB 3.26Å; L127-A251 HydrophobicContact CB-CB 3.98Å; L127-A251 HydrophobicContact CD2-CB 3.82Å; A251-F279 CarbonylContact C-O 3.59Å; A251-F279 WeakPolarHBondContact CA-O 3.47Å; A251-V281 HydrophobicContact CB-CG1 4.48Å
252	L	91.8	Very high	89	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.9	-179.1	-64.1	165.6	0	0	0	109.3	Q119 Y250 L257 F278 F279 K280 V281 L301 L331	Q119-L252 HydrophobicContact CB-CD2 4.41Å; Y250-L252 HydrophobicContact CD1-CD2 3.73Å; Y250-L252 HydrophobicContact CD1-CG 4.06Å; Y250-L252 HydrophobicContact CE1-CD2 3.61Å; Y250-L252 HydrophobicContact CE1-CG 4.41Å; L252-L257 HydrophobicContact CD2-CD2 3.71Å; L252-F278 HydrophobicContact CD1-CB 4.08Å; L252-F278 HydrophobicContact CD1-CD1 4.43Å; L252-F279 PolarHBondContact N-O 2.85Å; L252-K280 CarbonylContact O-C 3.57Å; L252-K280 VanDerWaalsContact O-CA 3.26Å; L252-K280 WeakPolarHBondContact O-CA 3.32Å; L252-V281 WeakPolarHBondContact O-CG2 3.47Å; L252-V281 PolarHBondContact O-N 3.2Å; L252-L301 HydrophobicContact CD1-CD1 4.25Å; L252-L301 HydrophobicContact CD1-CD2 4.32Å; L252-L301 HydrophobicContact CD2-CD2 4.31Å; L252-L331 HydrophobicContact CD1-CD1 3.72Å
253	H	85.5	Confident	89.6	Confident	49 Å²	49	48.6 Å²	48.6	23%	0.227	23%	0.234	C	C	.	.			trans	-112.7	-37.1	174.9	-176.3	68.1	0	0	0	112.2	A123 V281	A123-H253 HydrophobicContact CB-CB 4.1Å; H253-V281 HydrophobicContact CB-CG2 4.08Å
254	K	85	Confident	90	Very high	93 Å²	93	44.4 Å²	44.4	40%	0.404	21%	0.211	S	C	.	.	S	Bend	trans	-86.8	164.7	-178.7	-59.2	174.8	-176.1	161.5	0	111.2	D145 E256 L301	D145-K254 IonicContact OD2-NZ 2.76Å; D145-K254 PolarHBondContact OD2-NZ 2.92Å; K254-E256 VanDerWaalsContact C-N 3.25Å; K254-E256 PolarHBondContact O-N 3.39Å; K254-L301 WeakPolarHBondContact O-CD1 3.46Å
255	D	85.3	Confident	90.2	Very high	74 Å²	74	42.8 Å²	42.8	40%	0.396	20%	0.204	S	C	.	.	S	Bend	trans	-82.3	-1.9	179.2	-66.7	-63.6	0	0	0	113.3	K280 K283 L301	D255-K280 WeakPolarHBondContact OD1-CE 3.34Å; D255-K280 IonicContact OD1-NZ 3.94Å; D255-K280 PolarHBondContact OD1-NZ 2.94Å; D255-K283 IonicContact OD2-NZ 2.67Å; D255-K283 PolarHBondContact OD2-NZ 3.05Å; D255-L301 WeakPolarHBondContact O-CG 3.39Å
256	E	87.9	Confident	90.4	Very high	116 Å²	116	47.3 Å²	47.3	54%	0.542	22%	0.22	S	C	.	.	S	Bend	trans	-149.7	152.9	-179.8	-73.5	174.5	-173.4	0	0	110.5	Q119 K254 P300	Q119-E256 PolarHBondContact NE2-O 3.43Å; K254-E256 VanDerWaalsContact C-N 3.25Å; K254-E256 PolarHBondContact O-N 3.39Å; E256-P300 HydrophobicContact CG-CB 3.59Å; E256-P300 HydrophobicContact CG-CG 4.34Å
257	L	89.7	Confident	90.5	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.058	23%	0.234	C	C	.	.			trans	-82.2	142.3	168.8	-68.1	168.8	0	0	0	110.4	Y250 L252 E262 L265 L301 Q304 L305 L308	Y250-L257 HydrophobicContact CE1-CD2 4.39Å; L252-L257 HydrophobicContact CD2-CD2 3.71Å; L257-E262 HydrophobicContact CB-CG 3.96Å; L257-E262 HydrophobicContact CD1-CG 4.41Å; L257-L265 HydrophobicContact CD1-CD1 3.76Å; L257-L265 HydrophobicContact CD2-CD1 4.33Å; L257-L301 HydrophobicContact CD2-CD2 4.47Å; L257-L301 HydrophobicContact CG-CD2 3.94Å; L257-Q304 HydrophobicContact CD1-CB 4.26Å; L257-Q304 PolarHBondContact O-NE2 3.29Å; L257-Q304 VanDerWaalsContact O-NE2 3.08Å; L257-L305 HydrophobicContact CD1-CD2 4.1Å; L257-L308 HydrophobicContact CD1-CD1 4.02Å
258	S	89.1	Confident	90.3	Very high	60 Å²	60	50.6 Å²	50.6	42%	0.42	24%	0.235	S	C	.	.			trans	-77.3	162.1	169.5	61.1	0	0	0	0	110.9	R260 G261 E262	S258-R260 PolarHBondContact O-N 2.84Å; S258-G261 PolarHBondContact O-N 2.91Å; S258-G261 PolarHBondContact OG-N 3.04Å; S258-E262 PolarHBondContact O-N 2.82Å
259	E	87.7	Confident	90	Very high	170 Å²	170	55.8 Å²	55.8	79%	0.794	25%	0.254	S	S	*	.	H	α-helix	trans	-53.2	-39.6	174.9	-67.5	-175.2	170.1	0	0	112.3	E262 Q263	E259-E262 PolarHBondContact O-N 3.34Å; E259-Q263 WeakPolarHBondContact O-CB 3.46Å; E259-Q263 PolarHBondContact O-N 3.3Å
260	R	85	Confident	89.8	Confident	148 Å²	148	62.6 Å²	62.6	56%	0.558	29%	0.286	S	S	*	.	H	α-helix	trans	-63.7	-43.9	175.2	-173	-179.9	-178.6	-167.8	0.3	112.1	S258 Q263 E264	S258-R260 PolarHBondContact O-N 2.84Å; R260-Q263 PolarHBondContact O-N 2.9Å; R260-E264 PolarHBondContact O-N 3.33Å
261	G	87.9	Confident	89.4	Confident	6 Å²	6	69.9 Å²	69.9	6%	0.062	32%	0.315	C	S	.	.	H	α-helix	trans	-67.7	-36.9	178.1	0	0	0	0	0	112.8	S258 L265	S258-G261 PolarHBondContact O-N 2.91Å; S258-G261 PolarHBondContact OG-N 3.04Å; G261-L265 WeakPolarHBondContact O-CG 3.41Å; G261-L265 PolarHBondContact O-N 3.48Å; G261-L265 VanDerWaalsContact O-N 3.13Å
262	E	91.8	Very high	89	Confident	42 Å²	42	71.6 Å²	71.6	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-63.8	-43.8	171.8	-69.1	-171.9	177.8	0	0	111.7	L257 S258 E259 L265 R266 Q304 L308	L257-E262 HydrophobicContact CB-CG 3.96Å; L257-E262 HydrophobicContact CD1-CG 4.41Å; S258-E262 PolarHBondContact O-N 2.82Å; E259-E262 PolarHBondContact O-N 3.34Å; E262-L265 PolarHBondContact O-N 3.45Å; E262-R266 WeakPolarHBondContact O-CG 3.5Å; E262-R266 PolarHBondContact O-N 3.09Å; E262-R266 IonicContact OE2-CZ 3Å; E262-R266 IonicContact OE2-NH2 2.67Å; E262-R266 PolarHBondContact OE2-NH2 2.96Å; E262-Q304 PolarHBondContact OE1-NE2 3.16Å; E262-L308 HydrophobicContact CG-CD1 4.48Å
263	Q	90.6	Very high	88.6	Confident	87 Å²	87	77.6 Å²	77.6	41%	0.407	36%	0.364	S	S	.	.	H	α-helix	trans	-62	-45	178.3	-177.1	58.3	24	0	0	111.8	E259 R260 L265 R266 E267	E259-Q263 WeakPolarHBondContact O-CB 3.46Å; E259-Q263 PolarHBondContact O-N 3.3Å; R260-Q263 PolarHBondContact O-N 2.9Å; Q263-L265 VanDerWaalsContact C-N 3.35Å; Q263-L265 PolarHBondContact O-N 3.13Å; Q263-R266 WeakPolarHBondContact O-CB 3.17Å; Q263-R266 PolarHBondContact O-N 3.43Å; Q263-E267 PolarHBondContact NE2-OE1 3.24Å; Q263-E267 WeakPolarHBondContact O-CG 3.23Å; Q263-E267 PolarHBondContact O-N 2.89Å
264	E	89.8	Confident	88.5	Confident	21 Å²	21	77.3 Å²	77.3	10%	0.098	36%	0.362	C	S	.	.	H	α-helix	trans	-56.1	-47.8	174.9	-175.5	-164.9	157.1	0	0	111.7	S233 R260 R266 E267 V268	S233-E264 WeakPolarHBondContact CB-OE1 3.42Å; S233-E264 PolarHBondContact OG-OE1 3.25Å; R260-E264 PolarHBondContact O-N 3.33Å; E264-R266 PolarHBondContact O-N 2.97Å; E264-E267 PolarHBondContact O-N 2.94Å; E264-V268 WeakPolarHBondContact O-CG2 3.49Å; E264-V268 PolarHBondContact O-N 2.85Å
265	L	92.8	Very high	88.8	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-67.5	-34.2	179	-71.9	177.6	0	0	0	112.6	Y250 L257 G261 E262 Q263 R269 M276 F278 L305 L308 Y310	Y250-L265 HydrophobicContact CD2-CD2 3.81Å; Y250-L265 HydrophobicContact CE2-CD2 3.68Å; Y250-L265 HydrophobicContact CE2-CG 4.27Å; Y250-L265 HydrophobicContact CG-CD2 4.49Å; L257-L265 HydrophobicContact CD1-CD1 3.76Å; L257-L265 HydrophobicContact CD2-CD1 4.33Å; G261-L265 WeakPolarHBondContact O-CG 3.41Å; G261-L265 PolarHBondContact O-N 3.48Å; G261-L265 VanDerWaalsContact O-N 3.13Å; E262-L265 PolarHBondContact O-N 3.45Å; Q263-L265 VanDerWaalsContact C-N 3.35Å; Q263-L265 PolarHBondContact O-N 3.13Å; L265-R269 WeakPolarHBondContact O-CB 3.42Å; L265-R269 PolarHBondContact O-N 2.92Å; L265-M276 HydrophobicContact CD2-CE 3.88Å; L265-M276 HydrophobicContact CD2-SD 4.43Å; L265-F278 HydrophobicContact CD1-CE1 3.94Å; L265-F278 HydrophobicContact CD2-CE1 4Å; L265-F278 HydrophobicContact CD2-CZ 4.32Å; L265-L305 HydrophobicContact CD1-CD2 4.01Å; L265-L308 HydrophobicContact CB-CD1 4.07Å; L265-L308 HydrophobicContact CD1-CD1 4.04Å; L265-Y310 HydrophobicContact CB-CE2 3.97Å; L265-Y310 HydrophobicContact CD2-CE2 4.44Å; L265-Y310 PolarHBondContact O-OH 3.36Å
266	R	92.9	Very high	89.2	Confident	110 Å²	110	70.6 Å²	70.6	42%	0.415	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-45.5	171.7	-72.6	-178	-160.2	105.7	8.7	111.2	E262 Q263 E264 R269 Q270 L308	E262-R266 WeakPolarHBondContact O-CG 3.5Å; E262-R266 PolarHBondContact O-N 3.09Å; E262-R266 IonicContact OE2-CZ 3Å; E262-R266 IonicContact OE2-NH2 2.67Å; E262-R266 PolarHBondContact OE2-NH2 2.96Å; Q263-R266 WeakPolarHBondContact O-CB 3.17Å; Q263-R266 PolarHBondContact O-N 3.43Å; E264-R266 PolarHBondContact O-N 2.97Å; R266-R269 PolarHBondContact O-N 2.81Å; R266-Q270 WeakPolarHBondContact O-CB 3.45Å; R266-Q270 PolarHBondContact O-N 3.31Å; R266-L308 HydrophobicContact CG-CD2 3.36Å
267	E	91.5	Very high	89.6	Confident	70 Å²	70	65.1 Å²	65.1	33%	0.327	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-47.2	179.2	-72.1	172.4	-165.9	0	0	111.2	V234 Q263 E264 R269 Q270 Y271	V234-E267 HydrophobicContact CG2-CB 3.86Å; Q263-E267 PolarHBondContact NE2-OE1 3.24Å; Q263-E267 WeakPolarHBondContact O-CG 3.23Å; Q263-E267 PolarHBondContact O-N 2.89Å; E264-E267 PolarHBondContact O-N 2.94Å; E267-R269 VanDerWaalsContact C-N 3.27Å; E267-R269 PolarHBondContact O-N 2.95Å; E267-Q270 WeakPolarHBondContact O-CB 3.32Å; E267-Q270 PolarHBondContact O-N 2.77Å; E267-Q270 VanDerWaalsContact O-N 3.09Å; E267-Y271 VanDerWaalsContact O-CD2 3.28Å; E267-Y271 WeakPolarHBondContact O-CD2 3.35Å; E267-Y271 PolarHBondContact O-N 2.81Å
268	V	91	Very high	89.9	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-55.2	-45.3	175.2	169.6	0	0	0	0	111	V234 L237 E264 Q270 Y271 F272 M276	V234-V268 HydrophobicContact CG2-CG2 4.03Å; L237-V268 HydrophobicContact CD1-CB 4.38Å; L237-V268 HydrophobicContact CD1-CG1 3.58Å; L237-V268 HydrophobicContact CD1-CG2 3.93Å; E264-V268 WeakPolarHBondContact O-CG2 3.49Å; E264-V268 PolarHBondContact O-N 2.85Å; V268-Q270 VanDerWaalsContact C-N 3.34Å; V268-Q270 PolarHBondContact O-N 3.01Å; V268-Y271 PolarHBondContact O-N 3.44Å; V268-F272 WeakPolarHBondContact O-CA 3.28Å; V268-F272 WeakPolarHBondContact O-CB 3.2Å; V268-F272 PolarHBondContact O-N 3.25Å; V268-M276 HydrophobicContact CG1-SD 4.18Å
269	R	89.7	Confident	90.2	Very high	110 Å²	110	61.7 Å²	61.7	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-31.8	179.1	-169.4	-177	179.7	95.6	-2.9	113.6	L265 R266 E267 Y271 F272 L308 G309 Y310	L265-R269 WeakPolarHBondContact O-CB 3.42Å; L265-R269 PolarHBondContact O-N 2.92Å; R266-R269 PolarHBondContact O-N 2.81Å; E267-R269 VanDerWaalsContact C-N 3.27Å; E267-R269 PolarHBondContact O-N 2.95Å; R269-Y271 VanDerWaalsContact C-N 3.34Å; R269-F272 WeakPolarHBondContact CA-O 3.36Å; R269-L308 WeakPolarHBondContact CD-O 3.5Å; R269-L308 VanDerWaalsContact CZ-O 3.29Å; R269-L308 PolarHBondContact NE-O 2.98Å; R269-L308 VanDerWaalsContact NE-O 3.17Å; R269-L308 PolarHBondContact NH1-O 2.91Å; R269-G309 PolarHBondContact NH1-O 3.43Å; R269-G309 VanDerWaalsContact NH2-C 3.25Å; R269-G309 PolarHBondContact NH2-O 3.09Å; R269-Y310 HydrophobicContact CB-CE2 4.25Å; R269-Y310 VanDerWaalsContact NH1-N 3.11Å
270	Q	90.7	Very high	90.4	Very high	143 Å²	143	55 Å²	55	67%	0.668	25%	0.252	S	S	*	.	H	α-helix	trans	-64.6	-39.9	178.5	-179.3	179.4	-12.6	0	0	111.5	R266 E267 V268	R266-Q270 WeakPolarHBondContact O-CB 3.45Å; R266-Q270 PolarHBondContact O-N 3.31Å; E267-Q270 WeakPolarHBondContact O-CB 3.32Å; E267-Q270 PolarHBondContact O-N 2.77Å; E267-Q270 VanDerWaalsContact O-N 3.09Å; V268-Q270 VanDerWaalsContact C-N 3.34Å; V268-Q270 PolarHBondContact O-N 3.01Å
271	Y	87.5	Confident	90.6	Very high	154 Å²	154	48.1 Å²	48.1	60%	0.604	23%	0.227	S	C	*	.	H	α-helix	trans	-93.7	-26.6	-178.2	-67.4	-77.3	0	0	0	113.5	V234 E267 V268 R269	V234-Y271 HydrophobicContact CG1-CD2 3.76Å; V234-Y271 HydrophobicContact CG1-CE2 4.37Å; V234-Y271 HydrophobicContact CG1-CG 4.15Å; V234-Y271 HydrophobicContact CG2-CD2 4.42Å; E267-Y271 VanDerWaalsContact O-CD2 3.28Å; E267-Y271 WeakPolarHBondContact O-CD2 3.35Å; E267-Y271 PolarHBondContact O-N 2.81Å; V268-Y271 PolarHBondContact O-N 3.44Å; R269-Y271 VanDerWaalsContact C-N 3.34Å
272	F	86.7	Confident	90.5	Very high	36 Å²	36	50.4 Å²	50.4	16%	0.158	24%	0.24	C	C	.	.			trans	-131.2	136	-173.4	-57	-77.3	0	0	0	113.1	V234 L237 A241 V268 R269 F274	V234-F272 HydrophobicContact CG1-CE2 4.03Å; L237-F272 HydrophobicContact CB-CD2 4.16Å; L237-F272 HydrophobicContact CB-CE2 3.64Å; L237-F272 HydrophobicContact CB-CZ 3.86Å; L237-F272 HydrophobicContact CD1-CD2 4.07Å; L237-F272 HydrophobicContact CD1-CE2 4.28Å; A241-F272 HydrophobicContact CB-CE1 4.47Å; V268-F272 WeakPolarHBondContact O-CA 3.28Å; V268-F272 WeakPolarHBondContact O-CB 3.2Å; V268-F272 PolarHBondContact O-N 3.25Å; R269-F272 WeakPolarHBondContact CA-O 3.36Å; F272-F274 HydrophobicContact CB-CD2 3.8Å; F272-F274 HydrophobicContact CB-CE2 4.36Å; F272-F274 HydrophobicContact CD1-CD2 4Å; F272-F274 AromaticContact CD1-CE2 3.71Å; F272-F274 HydrophobicContact CD1-CE2 3.71Å; F272-F274 HydrophobicContact CE1-CE2 4.47Å; F272-F274 HydrophobicContact CG-CD2 4.2Å; F272-F274 HydrophobicContact CG-CE2 4.37Å
273	S	83.6	Confident	89.5	Confident	126 Å²	126	54.1 Å²	54.1	88%	0.881	26%	0.256	S	S	*	.			trans	-100.5	23.5	176.2	53.5	0	0	0	0	113.2
274	F	83.1	Confident	87.9	Confident	43 Å²	43	56.1 Å²	56.1	19%	0.189	27%	0.269	C	S	.	.			trans	-74.5	136.8	-178	-69.5	-67.2	0	0	0	112	A241 I248 F272	A241-F274 HydrophobicContact CB-CE2 4.5Å; I248-F274 HydrophobicContact CD1-CB 3.51Å; I248-F274 HydrophobicContact CD1-CD2 4.04Å; I248-F274 HydrophobicContact CD1-CG 3.99Å; F272-F274 HydrophobicContact CB-CD2 3.8Å; F272-F274 HydrophobicContact CB-CE2 4.36Å; F272-F274 HydrophobicContact CD1-CD2 4Å; F272-F274 AromaticContact CD1-CE2 3.71Å; F272-F274 HydrophobicContact CD1-CE2 3.71Å; F272-F274 HydrophobicContact CE1-CE2 4.47Å; F272-F274 HydrophobicContact CG-CD2 4.2Å; F272-F274 HydrophobicContact CG-CE2 4.37Å
275	P	91.3	Very high	85.8	Confident	25 Å²	25	63.6 Å²	63.6	16%	0.162	30%	0.304	C	S	.	.			trans	-61.4	142.9	166.9	-21.4	33.6	0	0	0	111.2	A327 S329 F344 L348	P275-A327 HydrophobicContact CG-CB 4.26Å; P275-A327 WeakPolarHBondContact CG-O 3.5Å; P275-S329 WeakPolarHBondContact CA-OG 3.43Å; P275-F344 HydrophobicContact CB-CE2 3.87Å; P275-F344 HydrophobicContact CB-CZ 3.94Å; P275-L348 HydrophobicContact CB-CD1 4.38Å; P275-L348 HydrophobicContact CG-CD1 3.9Å
276	M	94	Very high	83.2	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.9	179.9	-67.5	-178.9	62	0	0	112.2	L117 I248 Y250 L265 V268 F278 Y310 S329 M330	L117-M276 HydrophobicContact CD1-CE 4.07Å; I248-M276 HydrophobicContact CB-CG 4.09Å; I248-M276 HydrophobicContact CG2-CE 3.83Å; I248-M276 HydrophobicContact CG2-CG 3.81Å; I248-M276 HydrophobicContact CG2-SD 4.28Å; Y250-M276 HydrophobicContact CD2-CE 3.73Å; Y250-M276 HydrophobicContact CG-CE 4.12Å; L265-M276 HydrophobicContact CD2-CE 3.88Å; L265-M276 HydrophobicContact CD2-SD 4.43Å; V268-M276 HydrophobicContact CG1-SD 4.18Å; M276-F278 HydrophobicContact CB-CD2 4.25Å; M276-F278 HydrophobicContact CB-CE2 3.62Å; M276-F278 HydrophobicContact CB-CZ 3.89Å; M276-F278 HydrophobicContact CE-CE1 4.13Å; M276-F278 HydrophobicContact CE-CZ 4.03Å; M276-F278 HydrophobicContact SD-CZ 4.19Å; M276-Y310 HydrophobicContact CB-CD1 4.46Å; M276-Y310 HydrophobicContact CB-CE1 4.41Å; M276-Y310 HydrophobicContact CG-CE1 4.03Å; M276-Y310 HydrophobicContact SD-CD1 4.28Å; M276-Y310 HydrophobicContact SD-CE1 3.38Å; M276-Y310 WeakPolarHBondContact SD-CE1 3.48Å; M276-S329 PolarHBondContact N-OG 3.35Å; M276-S329 CarbonylContact O-C 3.6Å; M276-S329 WeakPolarHBondContact O-CA 3.5Å; M276-S329 VanDerWaalsContact O-CB 3.23Å; M276-S329 WeakPolarHBondContact O-CB 3.49Å; M276-M330 PolarHBondContact O-N 3.49Å
277	F	95.9	Very high	80.6	Confident	1 Å²	1	74 Å²	74	0%	0.004	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	100.3	173.1	-173.9	-91.2	0	0	0	109.9	I248 T249 Y250 F279 M330 V332 L338 Q340 L341 F344	I248-F277 PolarHBondContact O-N 3.05Å; T249-F277 CarbonylContact C-O 3.54Å; T249-F277 VanDerWaalsContact CA-O 3.27Å; T249-F277 WeakPolarHBondContact CA-O 3.38Å; T249-F277 HydrophobicContact CG2-CB 4.25Å; T249-F277 HydrophobicContact CG2-CD1 4.33Å; Y250-F277 PolarHBondContact N-O 2.69Å; F277-F279 HydrophobicContact CD1-CB 4.12Å; F277-F279 HydrophobicContact CE1-CB 3.81Å; F277-F279 HydrophobicContact CE1-CD2 4.15Å; F277-F279 HydrophobicContact CE1-CG 4.29Å; F277-M330 HydrophobicContact CD2-CG 3.49Å; F277-M330 VanDerWaalsContact CD2-CG 3.49Å; F277-M330 HydrophobicContact CD2-SD 3.53Å; F277-M330 VanDerWaalsContact CD2-SD 3.53Å; F277-M330 HydrophobicContact CE2-CG 3.84Å; F277-M330 HydrophobicContact CE2-SD 3.57Å; F277-M330 VanDerWaalsContact CE2-SD 3.57Å; F277-M330 HydrophobicContact CG-CG 4.42Å; F277-V332 HydrophobicContact CE1-CG2 4.48Å; F277-V332 HydrophobicContact CE2-CG2 3.74Å; F277-V332 HydrophobicContact CZ-CB 4.09Å; F277-V332 HydrophobicContact CZ-CG2 3.61Å; F277-L338 HydrophobicContact CE1-CD1 4.12Å; F277-Q340 HydrophobicContact CE2-CB 4.15Å; F277-Q340 HydrophobicContact CZ-CB 4.46Å; F277-L341 HydrophobicContact CB-CD1 4.14Å; F277-L341 HydrophobicContact CD1-CB 4.45Å; F277-L341 HydrophobicContact CD1-CD1 3.84Å; F277-L341 HydrophobicContact CD2-CD1 4.15Å; F277-L341 HydrophobicContact CE1-CB 4Å; F277-L341 HydrophobicContact CE1-CD1 4.26Å; F277-L341 HydrophobicContact CE2-CB 4.13Å; F277-L341 HydrophobicContact CG-CD1 3.78Å; F277-L341 HydrophobicContact CZ-CB 3.84Å; F277-F344 HydrophobicContact CB-CD1 3.81Å; F277-F344 HydrophobicContact CB-CE1 3.76Å; F277-F344 HydrophobicContact CB-CE2 4.5Å; F277-F344 HydrophobicContact CB-CG 4.22Å; F277-F344 HydrophobicContact CB-CZ 4.12Å; F277-F344 HydrophobicContact CD2-CB 3.9Å; F277-F344 HydrophobicContact CD2-CD1 4.18Å; F277-F344 HydrophobicContact CD2-CD2 4.38Å; F277-F344 AromaticContact CD2-CG 3.9Å; F277-F344 HydrophobicContact CD2-CG 3.9Å; F277-F344 HydrophobicContact CE2-CB 4.43Å; F277-F344 HydrophobicContact CG-CD1 4.36Å; F277-F344 HydrophobicContact CG-CG 4.5Å
278	F	95.8	Very high	77.8	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	125.4	176.4	-62.2	-90.1	0	0	0	109.6	Y250 L252 L265 M276 L305 Y310 M330 L331 V332	Y250-F278 AromaticContact CD1-CD1 3.88Å; Y250-F278 HydrophobicContact CD1-CD1 3.88Å; Y250-F278 HydrophobicContact CD1-CE1 4.11Å; Y250-F278 AromaticContact CG-CD1 3.91Å; Y250-F278 HydrophobicContact CG-CD1 3.91Å; Y250-F278 AromaticContact CG-CE1 3.9Å; Y250-F278 HydrophobicContact CG-CE1 3.9Å; Y250-F278 WeakPolarHBondContact O-CA 3.41Å; L252-F278 HydrophobicContact CD1-CB 4.08Å; L252-F278 HydrophobicContact CD1-CD1 4.43Å; L265-F278 HydrophobicContact CD1-CE1 3.94Å; L265-F278 HydrophobicContact CD2-CE1 4Å; L265-F278 HydrophobicContact CD2-CZ 4.32Å; M276-F278 HydrophobicContact CB-CD2 4.25Å; M276-F278 HydrophobicContact CB-CE2 3.62Å; M276-F278 HydrophobicContact CB-CZ 3.89Å; M276-F278 HydrophobicContact CE-CE1 4.13Å; M276-F278 HydrophobicContact CE-CZ 4.03Å; M276-F278 HydrophobicContact SD-CZ 4.19Å; F278-L305 HydrophobicContact CB-CD1 4.14Å; F278-L305 HydrophobicContact CD1-CD1 3.96Å; F278-L305 HydrophobicContact CD1-CD2 3.99Å; F278-L305 HydrophobicContact CD2-CD1 3.98Å; F278-L305 HydrophobicContact CE1-CD1 4.39Å; F278-L305 HydrophobicContact CE1-CD2 3.61Å; F278-L305 HydrophobicContact CE2-CD1 4.38Å; F278-L305 HydrophobicContact CE2-CD2 4.17Å; F278-L305 HydrophobicContact CG-CD1 3.75Å; F278-L305 HydrophobicContact CG-CD2 4.44Å; F278-L305 HydrophobicContact CZ-CD2 3.71Å; F278-Y310 AromaticContact CE2-CD1 3.83Å; F278-Y310 HydrophobicContact CE2-CD1 3.83Å; F278-Y310 AromaticContact CE2-CG 3.88Å; F278-Y310 HydrophobicContact CE2-CG 3.88Å; F278-Y310 AromaticContact CZ-CD1 3.81Å; F278-Y310 HydrophobicContact CZ-CD1 3.81Å; F278-Y310 HydrophobicContact CZ-CD2 4.16Å; F278-Y310 HydrophobicContact CZ-CE1 4.15Å; F278-Y310 HydrophobicContact CZ-CE2 4.48Å; F278-Y310 AromaticContact CZ-CG 3.8Å; F278-Y310 HydrophobicContact CZ-CG 3.8Å; F278-M330 WeakPolarHBondContact CB-O 3.35Å; F278-M330 PolarHBondContact N-O 3.36Å; F278-L331 HydrophobicContact CB-CB 4.38Å; F278-L331 HydrophobicContact CB-CD1 3.69Å; F278-L331 WeakPolarHBondContact O-CA 3.46Å; F278-V332 PolarHBondContact O-N 2.92Å
279	F	94.9	Very high	75.6	Confident	0 Å²	0	81 Å²	81	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127	-177.8	-178.2	-102.7	0	0	0	111.8	L127 L130 Y250 A251 L252 F277 V281 V332 L338	L127-F279 HydrophobicContact CD1-CD1 3.66Å; L127-F279 HydrophobicContact CD1-CE1 4.14Å; L127-F279 HydrophobicContact CD1-CG 4.34Å; L130-F279 HydrophobicContact CD1-CE1 3.89Å; L130-F279 HydrophobicContact CD1-CZ 4.48Å; Y250-F279 PolarHBondContact O-N 3Å; A251-F279 CarbonylContact C-O 3.59Å; A251-F279 WeakPolarHBondContact CA-O 3.47Å; L252-F279 PolarHBondContact N-O 2.85Å; F277-F279 HydrophobicContact CD1-CB 4.12Å; F277-F279 HydrophobicContact CE1-CB 3.81Å; F277-F279 HydrophobicContact CE1-CD2 4.15Å; F277-F279 HydrophobicContact CE1-CG 4.29Å; F279-V281 HydrophobicContact CD1-CG1 4.03Å; F279-V281 HydrophobicContact CE1-CG1 4.11Å; F279-V332 WeakPolarHBondContact CA-O 3.49Å; F279-V332 HydrophobicContact CD2-CB 3.98Å; F279-V332 HydrophobicContact CD2-CG1 3.84Å; F279-V332 HydrophobicContact CE2-CG1 4.01Å; F279-L338 HydrophobicContact CD1-CD1 4.04Å; F279-L338 HydrophobicContact CD2-CB 4.39Å; F279-L338 HydrophobicContact CD2-CD1 3.61Å; F279-L338 HydrophobicContact CE1-CD1 4Å; F279-L338 HydrophobicContact CE2-CB 3.62Å; F279-L338 HydrophobicContact CE2-CD1 3.61Å; F279-L338 HydrophobicContact CE2-CG 4.12Å; F279-L338 HydrophobicContact CG-CD1 3.82Å; F279-L338 HydrophobicContact CZ-CB 3.84Å; F279-L338 HydrophobicContact CZ-CD1 3.79Å; F279-L338 HydrophobicContact CZ-CD2 4.25Å; F279-L338 HydrophobicContact CZ-CG 4.14Å
280	K	92.3	Very high	73.2	Confident	29 Å²	29	81 Å²	81	13%	0.126	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.1	174.9	-160.6	179.3	-166.6	168.2	0	110.5	L252 D255 V332 E333	L252-K280 CarbonylContact O-C 3.57Å; L252-K280 VanDerWaalsContact O-CA 3.26Å; L252-K280 WeakPolarHBondContact O-CA 3.32Å; D255-K280 WeakPolarHBondContact OD1-CE 3.34Å; D255-K280 IonicContact OD1-NZ 3.94Å; D255-K280 PolarHBondContact OD1-NZ 2.94Å; K280-V332 PolarHBondContact N-O 3.44Å; K280-E333 HydrophobicContact CB-CB 4.32Å; K280-E333 HydrophobicContact CB-CG 4.44Å; K280-E333 HydrophobicContact CD-CB 4.05Å; K280-E333 HydrophobicContact CD-CG 4.16Å; K280-E333 IonicContact NZ-OE1 3.05Å; K280-E333 PolarHBondContact NZ-OE1 3.28Å
281	V	89.4	Confident	70.7	Confident	4 Å²	4	79.2 Å²	79.2	2%	0.024	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-72.2	145.5	178.3	-64.1	0	0	0	0	110.8	A123 Q126 L127 A251 L252 H253 F279	A123-V281 HydrophobicContact CB-CG2 4.19Å; Q126-V281 HydrophobicContact CB-CB 4.25Å; Q126-V281 HydrophobicContact CB-CG1 4.13Å; Q126-V281 HydrophobicContact CB-CG2 4.47Å; Q126-V281 VanDerWaalsContact OE1-CG2 3.31Å; L127-V281 HydrophobicContact CB-CG1 4.13Å; A251-V281 HydrophobicContact CB-CG1 4.48Å; L252-V281 WeakPolarHBondContact O-CG2 3.47Å; L252-V281 PolarHBondContact O-N 3.2Å; H253-V281 HydrophobicContact CB-CG2 4.08Å; F279-V281 HydrophobicContact CD1-CG1 4.03Å; F279-V281 HydrophobicContact CE1-CG1 4.11Å
282	P	84.3	Confident	68.5	Low	54 Å²	54	75.8 Å²	75.8	35%	0.351	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-62.3	140.7	179.5	-14.7	26.4	0	0	0	112.2	L130	L130-P282 HydrophobicContact CD1-CG 4.42Å
283	K	71.6	Confident	66.5	Low	120 Å²	120	85.4 Å²	85.4	52%	0.522	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-70.8	133.8	168.8	-65.7	-177.7	-176.6	175.3	0	108.9	D255 E285	D255-K283 IonicContact OD2-NZ 2.67Å; D255-K283 PolarHBondContact OD2-NZ 3.05Å; K283-E285 PolarHBondContact O-N 3.25Å
284	L	57.2	Low	64.4	Low	129 Å²	129	83.5 Å²	83.5	68%	0.675	48%	0.48	S	S	*	.			trans	-74.1	-1.2	-178.4	-101.9	124.9	0	0	0	114.1	T139	T139-L284 HydrophobicContact CG2-CD1 4.24Å
285	E	46.4	Very low	62.7	Low	178 Å²	178	90.4 Å²	90.4	83%	0.832	51%	0.513	S	S	*	.	S	Bend	trans	-78.1	129.3	179.1	-68.1	-169.6	168	0	0	111.9	K283	K283-E285 PolarHBondContact O-N 3.25Å
286	I	37.1	Very low	60.6	Low	152 Å²	152	94 Å²	94	78%	0.779	54%	0.539	S	S	*	.			trans	-19.6	133.3	176	-61.7	163.9	0	0	0	114.3	S288	I286-S288 PolarHBondContact O-N 2.98Å
287	I	39.2	Very low	58.8	Low	175 Å²	175	102.9 Å²	102.9	90%	0.897	58%	0.58	S	S	*	*			trans	-48.5	87.6	164.9	-55.5	167.8	0	0	0	109.1
288	S	32.7	Very low	57.6	Low	94 Å²	94	110.4 Å²	110.4	66%	0.657	61%	0.608	S	S	*	*			trans	-107.1	116.5	157.5	52.9	0	0	0	0	105.1	I286 S290	I286-S288 PolarHBondContact O-N 2.98Å; S288-S290 PolarHBondContact O-N 3.34Å
289	S	44.9	Very low	57	Low	127 Å²	127	111.6 Å²	111.6	89%	0.888	62%	0.617	S	S	*	*			trans	-43	103.8	175.2	49.7	0	0	0	0	110.2
290	S	38.3	Very low	56.6	Low	109 Å²	109	115 Å²	115	76%	0.762	64%	0.638	S	S	*	*			trans	-105.7	124.9	170.4	48.3	0	0	0	0	109.3	S288	S288-S290 PolarHBondContact O-N 3.34Å
291	S	38.1	Very low	56.4	Low	106 Å²	106	113.6 Å²	113.6	74%	0.741	63%	0.632	S	S	*	*			trans	-36.8	135.8	174.1	38.6	0	0	0	0	113.8	R293	S291-R293 PolarHBondContact O-N 2.9Å
292	G	42.3	Very low	56.4	Low	82 Å²	82	114.8 Å²	114.8	85%	0.845	64%	0.637	S	S	*	*			trans	-55.5	105.4	166.3	0	0	0	0	0	110.2	A294	G292-A294 PolarHBondContact O-N 3.43Å
293	R	44.6	Very low	56.6	Low	238 Å²	238	113.6 Å²	113.6	90%	0.898	63%	0.634	S	S	*	*			trans	-68.3	124.7	159	-78.3	-174.2	176.8	-178.1	-0.8	107	S291	S291-R293 PolarHBondContact O-N 2.9Å
294	A	38.5	Very low	57.6	Low	87 Å²	87	109.4 Å²	109.4	72%	0.719	62%	0.616	S	S	*	*			trans	-54.2	139.9	176.8	0	0	0	0	0	110.5	G292 S296	G292-A294 PolarHBondContact O-N 3.43Å; A294-S296 PolarHBondContact O-N 3.14Å
295	E	47.7	Very low	59.3	Low	188 Å²	188	103.2 Å²	103.2	88%	0.879	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	21.7	-177.7	-63.6	-179.4	132.7	0	0	115.2
296	S	47.7	Very low	61.4	Low	101 Å²	101	96.4 Å²	96.4	71%	0.706	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-16.8	-165.8	-166	0	0	0	0	115.9	A294	A294-S296 PolarHBondContact O-N 3.14Å
297	E	55.7	Low	64	Low	186 Å²	186	95.9 Å²	95.9	87%	0.869	55%	0.553	S	S	*	*	S	Bend	trans	-106.2	126.7	178.5	-75.2	-178.9	170.3	0	0	111.1
298	R	70.1	Confident	66.5	Low	160 Å²	160	88.2 Å²	88.2	60%	0.604	51%	0.514	S	S	*	.			trans	-66.8	131.5	174.6	-69.8	174.3	175.1	-177.6	-2.4	108.5	Y302 S313	R298-Y302 HydrophobicContact CB-CD1 3.93Å; R298-Y302 HydrophobicContact CG-CD1 3.91Å; R298-Y302 HydrophobicContact CG-CE1 4.06Å; R298-S313 PolarHBondContact NH2-O 2.94Å
299	S	83.6	Confident	69.2	Low	25 Å²	25	85.2 Å²	85.2	18%	0.175	50%	0.498	C	S	.	.			trans	-65.2	153.4	177.9	58.4	0	0	0	0	111.5	L301 Y302 G303 E333	S299-L301 VanDerWaalsContact C-N 3.27Å; S299-L301 PolarHBondContact O-N 3.34Å; S299-Y302 WeakPolarHBondContact O-CB 3.41Å; S299-Y302 PolarHBondContact O-N 3.18Å; S299-Y302 WeakPolarHBondContact OG-CB 3.28Å; S299-Y302 PolarHBondContact OG-N 2.87Å; S299-G303 PolarHBondContact O-N 3.32Å; S299-G303 VanDerWaalsContact O-N 3.13Å; S299-E333 WeakPolarHBondContact CB-OE2 3.31Å; S299-E333 PolarHBondContact OG-OE2 2.92Å
300	P	86.3	Confident	71.3	Confident	70 Å²	70	80 Å²	80	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-53.1	-43.7	173.5	-27.9	36.1	0	0	0	112.6	E256 Y302 G303 Q304	E256-P300 HydrophobicContact CG-CB 3.59Å; E256-P300 HydrophobicContact CG-CG 4.34Å; P300-Y302 VanDerWaalsContact C-N 3.32Å; P300-Y302 PolarHBondContact O-N 3Å; P300-G303 WeakPolarHBondContact O-CA 3.47Å; P300-G303 PolarHBondContact O-N 3.36Å; P300-G303 VanDerWaalsContact O-N 3.08Å; P300-Q304 PolarHBondContact O-N 2.96Å
301	L	88.9	Confident	73.8	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-54.3	-44.5	172.2	-77.9	167.8	0	0	0	113.1	L252 K254 D255 L257 S299 G303 Q304 L305 L331	L252-L301 HydrophobicContact CD1-CD1 4.25Å; L252-L301 HydrophobicContact CD1-CD2 4.32Å; L252-L301 HydrophobicContact CD2-CD2 4.31Å; K254-L301 WeakPolarHBondContact O-CD1 3.46Å; D255-L301 WeakPolarHBondContact O-CG 3.39Å; L257-L301 HydrophobicContact CD2-CD2 4.47Å; L257-L301 HydrophobicContact CG-CD2 3.94Å; S299-L301 VanDerWaalsContact C-N 3.27Å; S299-L301 PolarHBondContact O-N 3.34Å; L301-G303 VanDerWaalsContact C-N 3.3Å; L301-G303 PolarHBondContact O-N 2.9Å; L301-Q304 PolarHBondContact O-N 3.43Å; L301-L305 WeakPolarHBondContact O-CB 3.33Å; L301-L305 WeakPolarHBondContact O-CG 3.44Å; L301-L305 PolarHBondContact O-N 2.72Å; L301-L331 HydrophobicContact CB-CD2 4.15Å
302	Y	89.4	Confident	75.9	Confident	29 Å²	29	72.8 Å²	72.8	11%	0.114	41%	0.407	C	S	.	.	H	α-helix	trans	-61.8	-41.8	177.9	-177.5	-85.2	0	0	0	110.9	R298 S299 P300 L305 V306 L311 S312 L331	R298-Y302 HydrophobicContact CB-CD1 3.93Å; R298-Y302 HydrophobicContact CG-CD1 3.91Å; R298-Y302 HydrophobicContact CG-CE1 4.06Å; S299-Y302 WeakPolarHBondContact O-CB 3.41Å; S299-Y302 PolarHBondContact O-N 3.18Å; S299-Y302 WeakPolarHBondContact OG-CB 3.28Å; S299-Y302 PolarHBondContact OG-N 2.87Å; P300-Y302 VanDerWaalsContact C-N 3.32Å; P300-Y302 PolarHBondContact O-N 3Å; Y302-L305 PolarHBondContact O-N 3.33Å; Y302-V306 HydrophobicContact CD1-CG2 3.97Å; Y302-V306 HydrophobicContact CE1-CG2 3.62Å; Y302-V306 VanDerWaalsContact O-CG2 3.27Å; Y302-V306 WeakPolarHBondContact O-CG2 3.27Å; Y302-V306 PolarHBondContact O-N 3.36Å; Y302-L311 HydrophobicContact CD2-CD1 3.59Å; Y302-L311 HydrophobicContact CE2-CD1 3.84Å; Y302-L311 HydrophobicContact CG-CD1 4.29Å; Y302-S312 PolarHBondContact OH-O 2.89Å; Y302-L331 HydrophobicContact CD2-CD2 4.49Å
303	G	88.7	Confident	77.1	Confident	29 Å²	29	72.2 Å²	72.2	30%	0.299	39%	0.39	S	S	.	.	H	α-helix	trans	-57.9	-53.9	173.9	0	0	0	0	0	112.2	S299 P300 L301 L305 V306 D307	S299-G303 PolarHBondContact O-N 3.32Å; S299-G303 VanDerWaalsContact O-N 3.13Å; P300-G303 WeakPolarHBondContact O-CA 3.47Å; P300-G303 PolarHBondContact O-N 3.36Å; P300-G303 VanDerWaalsContact O-N 3.08Å; L301-G303 VanDerWaalsContact C-N 3.3Å; L301-G303 PolarHBondContact O-N 2.9Å; G303-L305 VanDerWaalsContact C-N 3.32Å; G303-L305 PolarHBondContact O-N 3.26Å; G303-V306 WeakPolarHBondContact O-CB 3.49Å; G303-V306 PolarHBondContact O-N 3.48Å; G303-V306 VanDerWaalsContact O-N 3.08Å; G303-D307 PolarHBondContact O-N 2.99Å
304	Q	92.6	Very high	77.7	Confident	32 Å²	32	65.3 Å²	65.3	15%	0.15	38%	0.378	C	S	.	.	H	α-helix	trans	-58.1	-42.2	179.6	-68.2	176.7	-64.6	0	0	112.1	L257 E262 P300 L301 V306 D307 L308	L257-Q304 HydrophobicContact CD1-CB 4.26Å; L257-Q304 PolarHBondContact O-NE2 3.29Å; L257-Q304 VanDerWaalsContact O-NE2 3.08Å; E262-Q304 PolarHBondContact OE1-NE2 3.16Å; P300-Q304 PolarHBondContact O-N 2.96Å; L301-Q304 PolarHBondContact O-N 3.43Å; Q304-V306 PolarHBondContact O-N 3.29Å; Q304-D307 PolarHBondContact O-N 3.5Å; Q304-L308 WeakPolarHBondContact O-CB 3.45Å; Q304-L308 WeakPolarHBondContact O-CG 3.4Å; Q304-L308 PolarHBondContact O-N 3.25Å
305	L	92.1	Very high	78.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-72.1	-26	178.6	-68.5	177.4	0	0	0	113.6	L257 L265 F278 L301 Y302 G303 L308 G309 Y310 L311 L331	L257-L305 HydrophobicContact CD1-CD2 4.1Å; L265-L305 HydrophobicContact CD1-CD2 4.01Å; F278-L305 HydrophobicContact CB-CD1 4.14Å; F278-L305 HydrophobicContact CD1-CD1 3.96Å; F278-L305 HydrophobicContact CD1-CD2 3.99Å; F278-L305 HydrophobicContact CD2-CD1 3.98Å; F278-L305 HydrophobicContact CE1-CD1 4.39Å; F278-L305 HydrophobicContact CE1-CD2 3.61Å; F278-L305 HydrophobicContact CE2-CD1 4.38Å; F278-L305 HydrophobicContact CE2-CD2 4.17Å; F278-L305 HydrophobicContact CG-CD1 3.75Å; F278-L305 HydrophobicContact CG-CD2 4.44Å; F278-L305 HydrophobicContact CZ-CD2 3.71Å; L301-L305 WeakPolarHBondContact O-CB 3.33Å; L301-L305 WeakPolarHBondContact O-CG 3.44Å; L301-L305 PolarHBondContact O-N 2.72Å; Y302-L305 PolarHBondContact O-N 3.33Å; G303-L305 VanDerWaalsContact C-N 3.32Å; G303-L305 PolarHBondContact O-N 3.26Å; L305-L308 HydrophobicContact CD2-CD1 4.38Å; L305-G309 PolarHBondContact O-N 2.94Å; L305-Y310 HydrophobicContact CD2-CD2 4.49Å; L305-Y310 PolarHBondContact O-N 3.4Å; L305-L311 HydrophobicContact CB-CD1 3.68Å; L305-L311 HydrophobicContact CB-CG 3.88Å; L305-L311 HydrophobicContact CD1-CD1 4.08Å; L305-L311 PolarHBondContact O-N 3.06Å; L305-L331 HydrophobicContact CD1-CB 4.25Å; L305-L331 HydrophobicContact CD1-CD1 4.09Å; L305-L331 HydrophobicContact CD1-CD2 4.24Å; L305-L331 HydrophobicContact CD1-CG 4.42Å
306	V	91.4	Very high	78.5	Confident	34 Å²	34	67.3 Å²	67.3	21%	0.206	36%	0.363	C	S	.	.	H	α-helix	trans	-70.5	-42.7	169.3	169.1	0	0	0	0	110.4	Y302 G303 Q304 L308 G309 L311	Y302-V306 HydrophobicContact CD1-CG2 3.97Å; Y302-V306 HydrophobicContact CE1-CG2 3.62Å; Y302-V306 VanDerWaalsContact O-CG2 3.27Å; Y302-V306 WeakPolarHBondContact O-CG2 3.27Å; Y302-V306 PolarHBondContact O-N 3.36Å; G303-V306 WeakPolarHBondContact O-CB 3.49Å; G303-V306 PolarHBondContact O-N 3.48Å; G303-V306 VanDerWaalsContact O-N 3.08Å; Q304-V306 PolarHBondContact O-N 3.29Å; V306-L308 VanDerWaalsContact C-N 3.32Å; V306-L308 PolarHBondContact O-N 3.46Å; V306-G309 VanDerWaalsContact O-CA 3.22Å; V306-G309 WeakPolarHBondContact O-CA 3.15Å; V306-G309 PolarHBondContact O-N 2.93Å; V306-L311 HydrophobicContact CG2-CB 3.76Å
307	D	91.4	Very high	78.3	Confident	141 Å²	141	67.8 Å²	67.8	75%	0.754	36%	0.358	S	S	*	.	H	α-helix	trans	-66.7	-35.7	179	-67.4	-21	0	0	0	111.9	G303 Q304 G309	G303-D307 PolarHBondContact O-N 2.99Å; Q304-D307 PolarHBondContact O-N 3.5Å; D307-G309 PolarHBondContact O-N 3.25Å
308	L	91.6	Very high	77.3	Confident	15 Å²	15	63.8 Å²	63.8	8%	0.079	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-4.6	169	-65.2	170.6	0	0	0	112.8	L257 E262 L265 R266 R269 Q304 L305 V306 Y310	L257-L308 HydrophobicContact CD1-CD1 4.02Å; E262-L308 HydrophobicContact CG-CD1 4.48Å; L265-L308 HydrophobicContact CB-CD1 4.07Å; L265-L308 HydrophobicContact CD1-CD1 4.04Å; R266-L308 HydrophobicContact CG-CD2 3.36Å; R269-L308 WeakPolarHBondContact CD-O 3.5Å; R269-L308 VanDerWaalsContact CZ-O 3.29Å; R269-L308 PolarHBondContact NE-O 2.98Å; R269-L308 VanDerWaalsContact NE-O 3.17Å; R269-L308 PolarHBondContact NH1-O 2.91Å; Q304-L308 WeakPolarHBondContact O-CB 3.45Å; Q304-L308 WeakPolarHBondContact O-CG 3.4Å; Q304-L308 PolarHBondContact O-N 3.25Å; L305-L308 HydrophobicContact CD2-CD1 4.38Å; V306-L308 VanDerWaalsContact C-N 3.32Å; V306-L308 PolarHBondContact O-N 3.46Å; L308-Y310 VanDerWaalsContact C-N 3.3Å; L308-Y310 HydrophobicContact CB-CD2 3.81Å; L308-Y310 HydrophobicContact CB-CE2 4.26Å; L308-Y310 PolarHBondContact O-N 2.98Å
309	G	89.6	Confident	75.8	Confident	30 Å²	30	62.4 Å²	62.4	31%	0.309	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	5.7	176.7	0	0	0	0	0	115.4	R269 L305 V306 D307 L311	R269-G309 PolarHBondContact NH1-O 3.43Å; R269-G309 VanDerWaalsContact NH2-C 3.25Å; R269-G309 PolarHBondContact NH2-O 3.09Å; L305-G309 PolarHBondContact O-N 2.94Å; V306-G309 VanDerWaalsContact O-CA 3.22Å; V306-G309 WeakPolarHBondContact O-CA 3.15Å; V306-G309 PolarHBondContact O-N 2.93Å; D307-G309 PolarHBondContact O-N 3.25Å; G309-L311 VanDerWaalsContact C-N 3.34Å
310	Y	89.8	Confident	73.6	Confident	17 Å²	17	64.5 Å²	64.5	7%	0.067	37%	0.372	C	S	.	.	S	Bend	trans	-68.9	-36	179.9	-79.5	-82	0	0	0	111.5	L265 R269 M276 F278 L305 L308 S329	L265-Y310 HydrophobicContact CB-CE2 3.97Å; L265-Y310 HydrophobicContact CD2-CE2 4.44Å; L265-Y310 PolarHBondContact O-OH 3.36Å; R269-Y310 HydrophobicContact CB-CE2 4.25Å; R269-Y310 VanDerWaalsContact NH1-N 3.11Å; M276-Y310 HydrophobicContact CB-CD1 4.46Å; M276-Y310 HydrophobicContact CB-CE1 4.41Å; M276-Y310 HydrophobicContact CG-CE1 4.03Å; M276-Y310 HydrophobicContact SD-CD1 4.28Å; M276-Y310 HydrophobicContact SD-CE1 3.38Å; M276-Y310 WeakPolarHBondContact SD-CE1 3.48Å; F278-Y310 AromaticContact CE2-CD1 3.83Å; F278-Y310 HydrophobicContact CE2-CD1 3.83Å; F278-Y310 AromaticContact CE2-CG 3.88Å; F278-Y310 HydrophobicContact CE2-CG 3.88Å; F278-Y310 AromaticContact CZ-CD1 3.81Å; F278-Y310 HydrophobicContact CZ-CD1 3.81Å; F278-Y310 HydrophobicContact CZ-CD2 4.16Å; F278-Y310 HydrophobicContact CZ-CE1 4.15Å; F278-Y310 HydrophobicContact CZ-CE2 4.48Å; F278-Y310 AromaticContact CZ-CG 3.8Å; F278-Y310 HydrophobicContact CZ-CG 3.8Å; L305-Y310 HydrophobicContact CD2-CD2 4.49Å; L305-Y310 PolarHBondContact O-N 3.4Å; L308-Y310 VanDerWaalsContact C-N 3.3Å; L308-Y310 HydrophobicContact CB-CD2 3.81Å; L308-Y310 HydrophobicContact CB-CE2 4.26Å; L308-Y310 PolarHBondContact O-N 2.98Å; Y310-S329 VanDerWaalsContact O-CB 3.31Å; Y310-S329 WeakPolarHBondContact O-CB 3.49Å
311	L	89.9	Confident	71.2	Confident	17 Å²	17	65.8 Å²	65.8	9%	0.089	38%	0.382	C	S	.	.	S	Bend	trans	-111.1	154.4	179.8	-54.7	179.1	0	0	0	111.1	Y302 L305 V306 G309 S329 L331	Y302-L311 HydrophobicContact CD2-CD1 3.59Å; Y302-L311 HydrophobicContact CE2-CD1 3.84Å; Y302-L311 HydrophobicContact CG-CD1 4.29Å; L305-L311 HydrophobicContact CB-CD1 3.68Å; L305-L311 HydrophobicContact CB-CG 3.88Å; L305-L311 HydrophobicContact CD1-CD1 4.08Å; L305-L311 PolarHBondContact O-N 3.06Å; V306-L311 HydrophobicContact CG2-CB 3.76Å; G309-L311 VanDerWaalsContact C-N 3.34Å; L311-S329 WeakPolarHBondContact CD2-O 3.41Å; L311-L331 HydrophobicContact CD1-CB 3.86Å
312	S	82.3	Confident	69	Low	48 Å²	48	73.5 Å²	73.5	34%	0.336	42%	0.424	S	S	.	.			trans	-97.6	138.7	175.6	179.6	0	0	0	0	111.8	Y302 S314	Y302-S312 PolarHBondContact OH-O 2.89Å; S312-S314 PolarHBondContact O-N 2.78Å; S312-S314 PolarHBondContact OG-N 2.72Å; S312-S314 PolarHBondContact OG-OG 3.04Å; S312-S314 VanDerWaalsContact OG-OG 3.05Å
313	S	66.8	Low	66.6	Low	69 Å²	69	80.6 Å²	80.6	48%	0.483	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.5	179.9	62.8	0	0	0	0	114.2	R298	R298-S313 PolarHBondContact NH2-O 2.94Å
314	S	57.6	Low	64.3	Low	93 Å²	93	85.9 Å²	85.9	65%	0.65	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-11.4	-173.2	42.8	0	0	0	0	114.8	S312	S312-S314 PolarHBondContact O-N 2.78Å; S312-S314 PolarHBondContact OG-N 2.72Å; S312-S314 PolarHBondContact OG-OG 3.04Å; S312-S314 VanDerWaalsContact OG-OG 3.05Å
315	H	52.7	Low	62.4	Low	109 Å²	109	87.3 Å²	87.3	51%	0.505	49%	0.492	S	S	.	.			trans	-105.8	110.2	178.8	-69.8	-72.8	0	0	0	110.7
316	R	50.1	Low	61.1	Low	208 Å²	208	95.7 Å²	95.7	79%	0.785	53%	0.528	S	S	*	.			trans	-60.4	151.9	152.2	-71	-173.7	177	-163.4	-2.7	107.2	C318	R316-C318 PolarHBondContact O-N 3.35Å
317	N	44	Very low	60.1	Low	112 Å²	112	94.6 Å²	94.6	60%	0.599	52%	0.523	S	S	*	.	S	Bend	trans	-58.5	59.1	176	-73.4	-23.2	0	0	0	112.7
318	C	35.7	Very low	59.9	Low	102 Å²	102	93.5 Å²	93.5	69%	0.689	51%	0.513	S	S	*	.			trans	-89.1	129.8	173.5	-74.1	0	0	0	0	107.1	R316	R316-C318 PolarHBondContact O-N 3.35Å
319	V	37.8	Very low	60	Low	130 Å²	130	93.8 Å²	93.8	79%	0.788	52%	0.517	S	S	*	.			trans	-44.9	129	166.2	-179.4	0	0	0	0	107.9	S321	V319-S321 PolarHBondContact O-N 2.9Å
320	P	36.4	Very low	60.1	Low	69 Å²	69	94.2 Å²	94.2	45%	0.448	51%	0.511	S	S	.	.			trans	-54.6	131.2	-179.4	-22	31.6	0	0	0	109.5
321	S	36.6	Very low	60.2	Low	97 Å²	97	93.8 Å²	93.8	68%	0.678	51%	0.51	S	S	*	.			trans	-57.6	138.3	158.3	49	0	0	0	0	107.9	V319 Q323	V319-S321 PolarHBondContact O-N 2.9Å; S321-Q323 PolarHBondContact O-N 3.13Å
322	D	41.8	Very low	60.3	Low	163 Å²	163	93.2 Å²	93.2	87%	0.872	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	8.4	-171.7	-113.3	-6.5	0	0	0	117.3
323	Q	39.8	Very low	60.5	Low	178 Å²	178	94.2 Å²	94.2	83%	0.832	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-13.6	-169.6	-71.5	-173.6	-15.5	0	0	115.7	S321	S321-Q323 PolarHBondContact O-N 3.13Å
324	D	40.8	Very low	61.3	Low	140 Å²	140	95.8 Å²	95.8	75%	0.749	51%	0.506	S	S	*	.			trans	-129.4	93.7	172.3	-102.9	-33.9	0	0	0	111.3	K326	D324-K326 PolarHBondContact O-N 3.42Å
325	C	51.9	Low	62.4	Low	62 Å²	62	94.4 Å²	94.4	42%	0.419	50%	0.496	S	S	.	.			trans	-79.4	2.4	-167.4	-76.8	0	0	0	0	115.9	A327 N351	C325-A327 PolarHBondContact O-N 2.89Å; C325-N351 VanDerWaalsContact O-CG 3.23Å; C325-N351 PolarHBondContact O-ND2 3.33Å; C325-N351 PolarHBondContact O-OD1 2.82Å
326	K	64.8	Low	63.8	Low	175 Å²	175	97.3 Å²	97.3	76%	0.761	51%	0.51	S	S	*	.			trans	-72	121.8	-176.4	-75.2	-174.1	178.9	179.6	0	110.9	D324 Q328	D324-K326 PolarHBondContact O-N 3.42Å; K326-Q328 PolarHBondContact O-N 3.43Å
327	A	71.7	Confident	65.4	Low	11 Å²	11	91.3 Å²	91.3	9%	0.091	49%	0.49	C	S	.	.			trans	-58.3	125.3	173	0	0	0	0	0	109	P275 C325 Q347 L348 N351	P275-A327 HydrophobicContact CG-CB 4.26Å; P275-A327 WeakPolarHBondContact CG-O 3.5Å; C325-A327 PolarHBondContact O-N 2.89Å; A327-Q347 HydrophobicContact CB-CB 4Å; A327-L348 HydrophobicContact CB-CB 4.25Å; A327-L348 HydrophobicContact CB-CD1 4.24Å; A327-N351 PolarHBondContact N-ND2 2.89Å
328	Q	86.9	Confident	67.5	Low	119 Å²	119	86.6 Å²	86.6	56%	0.556	47%	0.465	S	S	*	.			trans	-107.8	152.2	177.5	-64.7	-176.8	-0.3	0	0	109.3	K326 F344	K326-Q328 PolarHBondContact O-N 3.43Å; Q328-F344 WeakPolarHBondContact O-CE2 3.34Å
329	S	92	Very high	70	Confident	21 Å²	21	87.8 Å²	87.8	15%	0.147	46%	0.458	C	S	.	.			trans	-62.3	148.5	172.4	-48.6	0	0	0	0	109.9	P275 M276 Y310 L311	P275-S329 WeakPolarHBondContact CA-OG 3.43Å; M276-S329 PolarHBondContact N-OG 3.35Å; M276-S329 CarbonylContact O-C 3.6Å; M276-S329 WeakPolarHBondContact O-CA 3.5Å; M276-S329 VanDerWaalsContact O-CB 3.23Å; M276-S329 WeakPolarHBondContact O-CB 3.49Å; Y310-S329 VanDerWaalsContact O-CB 3.31Å; Y310-S329 WeakPolarHBondContact O-CB 3.49Å; L311-S329 WeakPolarHBondContact CD2-O 3.41Å
330	M	92.3	Very high	72.5	Confident	39 Å²	39	84.1 Å²	84.1	19%	0.192	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	150	-177.2	69.8	-169.1	-39.8	0	0	111.8	M276 F277 F278 Q340 F344	M276-M330 PolarHBondContact O-N 3.49Å; F277-M330 HydrophobicContact CD2-CG 3.49Å; F277-M330 VanDerWaalsContact CD2-CG 3.49Å; F277-M330 HydrophobicContact CD2-SD 3.53Å; F277-M330 VanDerWaalsContact CD2-SD 3.53Å; F277-M330 HydrophobicContact CE2-CG 3.84Å; F277-M330 HydrophobicContact CE2-SD 3.57Å; F277-M330 VanDerWaalsContact CE2-SD 3.57Å; F277-M330 HydrophobicContact CG-CG 4.42Å; F278-M330 WeakPolarHBondContact CB-O 3.35Å; F278-M330 PolarHBondContact N-O 3.36Å; M330-Q340 HydrophobicContact CE-CB 4.42Å; M330-F344 HydrophobicContact CG-CD2 4.34Å; M330-F344 HydrophobicContact SD-CB 3.87Å; M330-F344 HydrophobicContact SD-CD2 3.99Å; M330-F344 HydrophobicContact SD-CG 4.26Å
331	L	92.6	Very high	75.2	Confident	8 Å²	8	80.9 Å²	80.9	4%	0.042	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.3	174.6	174.9	67	0	0	0	110.2	L252 F278 L301 Y302 L305 L311 E333	L252-L331 HydrophobicContact CD1-CD1 3.72Å; F278-L331 HydrophobicContact CB-CB 4.38Å; F278-L331 HydrophobicContact CB-CD1 3.69Å; F278-L331 WeakPolarHBondContact O-CA 3.46Å; L301-L331 HydrophobicContact CB-CD2 4.15Å; Y302-L331 HydrophobicContact CD2-CD2 4.49Å; L305-L331 HydrophobicContact CD1-CB 4.25Å; L305-L331 HydrophobicContact CD1-CD1 4.09Å; L305-L331 HydrophobicContact CD1-CD2 4.24Å; L305-L331 HydrophobicContact CD1-CG 4.42Å; L311-L331 HydrophobicContact CD1-CB 3.86Å; L331-E333 HydrophobicContact CD1-CG 4.08Å; L331-E333 HydrophobicContact CD2-CG 3.97Å; L331-E333 HydrophobicContact CG-CG 3.86Å
332	V	91.2	Very high	77.8	Confident	4 Å²	4	76.8 Å²	76.8	2%	0.024	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	104.1	177.6	179.9	0	0	0	0	109.1	F277 F278 F279 K280 K337 Q340	F277-V332 HydrophobicContact CE1-CG2 4.48Å; F277-V332 HydrophobicContact CE2-CG2 3.74Å; F277-V332 HydrophobicContact CZ-CB 4.09Å; F277-V332 HydrophobicContact CZ-CG2 3.61Å; F278-V332 PolarHBondContact O-N 2.92Å; F279-V332 WeakPolarHBondContact CA-O 3.49Å; F279-V332 HydrophobicContact CD2-CB 3.98Å; F279-V332 HydrophobicContact CD2-CG1 3.84Å; F279-V332 HydrophobicContact CE2-CG1 4.01Å; K280-V332 PolarHBondContact N-O 3.44Å; V332-K337 HydrophobicContact CG1-CB 3.6Å; V332-Q340 HydrophobicContact CG2-CB 4.44Å
333	E	86.9	Confident	80.1	Confident	69 Å²	69	72.4 Å²	72.4	32%	0.322	36%	0.362	S	S	.	.			trans	-94.4	-13.2	-178.6	-62.8	-169.9	78.9	0	0	114.1	K280 S299 L331	K280-E333 HydrophobicContact CB-CB 4.32Å; K280-E333 HydrophobicContact CB-CG 4.44Å; K280-E333 HydrophobicContact CD-CB 4.05Å; K280-E333 HydrophobicContact CD-CG 4.16Å; K280-E333 IonicContact NZ-OE1 3.05Å; K280-E333 PolarHBondContact NZ-OE1 3.28Å; S299-E333 WeakPolarHBondContact CB-OE2 3.31Å; S299-E333 PolarHBondContact OG-OE2 2.92Å; L331-E333 HydrophobicContact CD1-CG 4.08Å; L331-E333 HydrophobicContact CD2-CG 3.97Å; L331-E333 HydrophobicContact CG-CG 3.86Å
334	Q	83.8	Confident	82.6	Confident	103 Å²	103	64 Å²	64	48%	0.481	32%	0.323	S	S	.	.	S	Bend	trans	-101.1	124.2	-179.2	-68.5	173.8	-26.2	0	0	109.8	E336 K337	Q334-E336 VanDerWaalsContact C-N 3.3Å; Q334-E336 PolarHBondContact O-N 3.04Å; Q334-K337 HydrophobicContact CB-CB 4.42Å; Q334-K337 HydrophobicContact CB-CD 4.24Å; Q334-K337 HydrophobicContact CB-CG 4.29Å; Q334-K337 WeakPolarHBondContact O-CB 3.43Å; Q334-K337 PolarHBondContact O-N 3.44Å; Q334-K337 VanDerWaalsContact OE1-CD 3.24Å
335	S	80.5	Confident	85.1	Confident	63 Å²	63	57.5 Å²	57.5	44%	0.441	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.4	-39.7	-176.2	59	0	0	0	0	113.3	K337 L338	S335-K337 PolarHBondContact O-N 3.34Å; S335-K337 VanDerWaalsContact O-N 3.1Å; S335-L338 WeakPolarHBondContact O-CB 3.47Å; S335-L338 PolarHBondContact O-N 3.05Å; S335-L338 VanDerWaalsContact O-N 3.1Å
336	E	81.2	Confident	86.9	Confident	171 Å²	171	56.5 Å²	56.5	80%	0.799	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-61.8	-19.4	177.3	-57.3	-178.6	-165.4	0	0	113.8	Q334	Q334-E336 VanDerWaalsContact C-N 3.3Å; Q334-E336 PolarHBondContact O-N 3.04Å
337	K	85.4	Confident	88.1	Confident	82 Å²	82	50.4 Å²	50.4	36%	0.357	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-93.3	4.5	179.8	-69.8	-177.1	177.2	164.2	0	113.2	V332 Q334 S335 K339 Q340	V332-K337 HydrophobicContact CG1-CB 3.6Å; Q334-K337 HydrophobicContact CB-CB 4.42Å; Q334-K337 HydrophobicContact CB-CD 4.24Å; Q334-K337 HydrophobicContact CB-CG 4.29Å; Q334-K337 WeakPolarHBondContact O-CB 3.43Å; Q334-K337 PolarHBondContact O-N 3.44Å; Q334-K337 VanDerWaalsContact OE1-CD 3.24Å; S335-K337 PolarHBondContact O-N 3.34Å; S335-K337 VanDerWaalsContact O-N 3.1Å; K337-K339 PolarHBondContact O-N 3.1Å; K337-Q340 HydrophobicContact CB-CG 4.48Å; K337-Q340 VanDerWaalsContact O-CB 3.3Å; K337-Q340 WeakPolarHBondContact O-CB 3.5Å; K337-Q340 VanDerWaalsContact O-CG 3.31Å; K337-Q340 WeakPolarHBondContact O-CG 3.23Å; K337-Q340 PolarHBondContact O-N 3.05Å
338	L	87.1	Confident	88.9	Confident	13 Å²	13	50.4 Å²	50.4	7%	0.068	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.3	174.5	-176.9	61.2	0	0	0	112.5	M23 L127 L130 F277 F279 S335 Q340 L341	M23-L338 HydrophobicContact CE-CD2 3.92Å; M23-L338 HydrophobicContact CE-CG 4.37Å; M23-L338 HydrophobicContact SD-CB 4.19Å; M23-L338 HydrophobicContact SD-CD2 3.73Å; M23-L338 HydrophobicContact SD-CG 3.52Å; M23-L338 VanDerWaalsContact SD-CG 3.52Å; L127-L338 HydrophobicContact CD1-CD1 4.02Å; L130-L338 HydrophobicContact CB-CD2 3.95Å; F277-L338 HydrophobicContact CE1-CD1 4.12Å; F279-L338 HydrophobicContact CD1-CD1 4.04Å; F279-L338 HydrophobicContact CD2-CB 4.39Å; F279-L338 HydrophobicContact CD2-CD1 3.61Å; F279-L338 HydrophobicContact CE1-CD1 4Å; F279-L338 HydrophobicContact CE2-CB 3.62Å; F279-L338 HydrophobicContact CE2-CD1 3.61Å; F279-L338 HydrophobicContact CE2-CG 4.12Å; F279-L338 HydrophobicContact CG-CD1 3.82Å; F279-L338 HydrophobicContact CZ-CB 3.84Å; F279-L338 HydrophobicContact CZ-CD1 3.79Å; F279-L338 HydrophobicContact CZ-CD2 4.25Å; F279-L338 HydrophobicContact CZ-CG 4.14Å; S335-L338 WeakPolarHBondContact O-CB 3.47Å; S335-L338 PolarHBondContact O-N 3.05Å; S335-L338 VanDerWaalsContact O-N 3.1Å; L338-Q340 PolarHBondContact O-N 3.12Å; L338-L341 VanDerWaalsContact O-CB 3.25Å; L338-L341 WeakPolarHBondContact O-CB 3.22Å; L338-L341 PolarHBondContact O-N 2.86Å
339	K	88.4	Confident	89.2	Confident	126 Å²	126	44.9 Å²	44.9	55%	0.548	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-22.9	172.4	65.9	-177.9	176	-174.1	0	114.5	M23 K337 L341 S342	M23-K339 HydrophobicContact CB-CB 4.34Å; K337-K339 PolarHBondContact O-N 3.1Å; K339-L341 PolarHBondContact O-N 3.46Å; K339-S342 WeakPolarHBondContact O-CB 3.14Å; K339-S342 PolarHBondContact O-N 3.46Å; K339-S342 PolarHBondContact O-OG 3.16Å
340	Q	90.3	Very high	89.1	Confident	54 Å²	54	45.4 Å²	45.4	25%	0.252	22%	0.224	S	C	.	.	H	α-helix	trans	-61.8	-20.5	174.4	-67.4	-177.5	-0.1	0	0	113.2	F277 M330 V332 K337 L338 S342 T343 F344	F277-Q340 HydrophobicContact CE2-CB 4.15Å; F277-Q340 HydrophobicContact CZ-CB 4.46Å; M330-Q340 HydrophobicContact CE-CB 4.42Å; V332-Q340 HydrophobicContact CG2-CB 4.44Å; K337-Q340 HydrophobicContact CB-CG 4.48Å; K337-Q340 VanDerWaalsContact O-CB 3.3Å; K337-Q340 WeakPolarHBondContact O-CB 3.5Å; K337-Q340 VanDerWaalsContact O-CG 3.31Å; K337-Q340 WeakPolarHBondContact O-CG 3.23Å; K337-Q340 PolarHBondContact O-N 3.05Å; L338-Q340 PolarHBondContact O-N 3.12Å; Q340-S342 PolarHBondContact O-N 3.49Å; Q340-T343 PolarHBondContact O-N 2.95Å; Q340-T343 VanDerWaalsContact O-N 3.1Å; Q340-F344 PolarHBondContact O-N 2.91Å
341	L	92.6	Very high	88.9	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-34	171.4	-179.3	62.8	0	0	0	111.8	L27 L131 V247 T249 F277 L338 K339 T343 F344 S345	L27-L341 HydrophobicContact CD1-CD2 4.45Å; L27-L341 HydrophobicContact CD2-CG 4.24Å; L131-L341 HydrophobicContact CD2-CD2 3.31Å; V247-L341 HydrophobicContact CG1-CD1 4.4Å; T249-L341 HydrophobicContact CG2-CD1 3.74Å; T249-L341 HydrophobicContact CG2-CD2 4.39Å; F277-L341 HydrophobicContact CB-CD1 4.14Å; F277-L341 HydrophobicContact CD1-CB 4.45Å; F277-L341 HydrophobicContact CD1-CD1 3.84Å; F277-L341 HydrophobicContact CD2-CD1 4.15Å; F277-L341 HydrophobicContact CE1-CB 4Å; F277-L341 HydrophobicContact CE1-CD1 4.26Å; F277-L341 HydrophobicContact CE2-CB 4.13Å; F277-L341 HydrophobicContact CG-CD1 3.78Å; F277-L341 HydrophobicContact CZ-CB 3.84Å; L338-L341 VanDerWaalsContact O-CB 3.25Å; L338-L341 WeakPolarHBondContact O-CB 3.22Å; L338-L341 PolarHBondContact O-N 2.86Å; K339-L341 PolarHBondContact O-N 3.46Å; L341-T343 VanDerWaalsContact C-N 3.33Å; L341-T343 PolarHBondContact O-N 3.43Å; L341-F344 HydrophobicContact CD1-CD1 4.17Å; L341-F344 PolarHBondContact O-N 3.05Å; L341-S345 VanDerWaalsContact O-CB 3.26Å; L341-S345 WeakPolarHBondContact O-CB 3.41Å; L341-S345 PolarHBondContact O-N 3.36Å; L341-S345 PolarHBondContact O-OG 3.44Å
342	S	91.4	Very high	88.8	Confident	11 Å²	11	48.4 Å²	48.4	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-42.3	176.9	77.1	0	0	0	0	111.5	E26 K339 Q340 H346	E26-S342 PolarHBondContact OE2-OG 2.74Å; K339-S342 WeakPolarHBondContact O-CB 3.14Å; K339-S342 PolarHBondContact O-N 3.46Å; K339-S342 PolarHBondContact O-OG 3.16Å; Q340-S342 PolarHBondContact O-N 3.49Å; S342-H346 VanDerWaalsContact O-CB 3.27Å; S342-H346 WeakPolarHBondContact O-CB 3.4Å; S342-H346 PolarHBondContact O-N 3.25Å
343	T	90.3	Very high	88.8	Confident	72 Å²	72	48.4 Å²	48.4	44%	0.442	24%	0.235	S	C	.	.	H	α-helix	trans	-71	-45.2	179.2	-58.8	0	0	0	0	111	Q340 L341 H346 Q347	Q340-T343 PolarHBondContact O-N 2.95Å; Q340-T343 VanDerWaalsContact O-N 3.1Å; L341-T343 VanDerWaalsContact C-N 3.33Å; L341-T343 PolarHBondContact O-N 3.43Å; T343-H346 PolarHBondContact O-N 3.29Å; T343-Q347 WeakPolarHBondContact O-CG 3.37Å; T343-Q347 PolarHBondContact O-N 3.33Å
344	F	92.3	Very high	89.1	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-57.6	-50.8	175.5	173.7	-96.3	0	0	0	111.8	V247 P275 F277 Q328 M330 Q340 L341 H346 Q347 L348	V247-F344 HydrophobicContact CG1-CD1 4.19Å; V247-F344 HydrophobicContact CG1-CE1 4.02Å; P275-F344 HydrophobicContact CB-CE2 3.87Å; P275-F344 HydrophobicContact CB-CZ 3.94Å; F277-F344 HydrophobicContact CB-CD1 3.81Å; F277-F344 HydrophobicContact CB-CE1 3.76Å; F277-F344 HydrophobicContact CB-CE2 4.5Å; F277-F344 HydrophobicContact CB-CG 4.22Å; F277-F344 HydrophobicContact CB-CZ 4.12Å; F277-F344 HydrophobicContact CD2-CB 3.9Å; F277-F344 HydrophobicContact CD2-CD1 4.18Å; F277-F344 HydrophobicContact CD2-CD2 4.38Å; F277-F344 AromaticContact CD2-CG 3.9Å; F277-F344 HydrophobicContact CD2-CG 3.9Å; F277-F344 HydrophobicContact CE2-CB 4.43Å; F277-F344 HydrophobicContact CG-CD1 4.36Å; F277-F344 HydrophobicContact CG-CG 4.5Å; Q328-F344 WeakPolarHBondContact O-CE2 3.34Å; M330-F344 HydrophobicContact CG-CD2 4.34Å; M330-F344 HydrophobicContact SD-CB 3.87Å; M330-F344 HydrophobicContact SD-CD2 3.99Å; M330-F344 HydrophobicContact SD-CG 4.26Å; Q340-F344 PolarHBondContact O-N 2.91Å; L341-F344 HydrophobicContact CD1-CD1 4.17Å; L341-F344 PolarHBondContact O-N 3.05Å; F344-H346 VanDerWaalsContact C-N 3.32Å; F344-H346 PolarHBondContact O-N 2.76Å; F344-Q347 PolarHBondContact O-N 2.75Å; F344-L348 PolarHBondContact O-N 3.13Å
345	S	92.9	Very high	89.4	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-43.5	178	-53.6	0	0	0	0	110.8	V247 L341 Q347 L348 L349	V247-S345 WeakPolarHBondContact CG1-OG 3.15Å; L341-S345 VanDerWaalsContact O-CB 3.26Å; L341-S345 WeakPolarHBondContact O-CB 3.41Å; L341-S345 PolarHBondContact O-N 3.36Å; L341-S345 PolarHBondContact O-OG 3.44Å; S345-Q347 PolarHBondContact O-N 2.76Å; S345-L348 PolarHBondContact O-N 3.14Å; S345-L349 VanDerWaalsContact O-CB 3.3Å; S345-L349 WeakPolarHBondContact O-CB 3.4Å; S345-L349 WeakPolarHBondContact O-CG 3.47Å; S345-L349 PolarHBondContact O-N 3.29Å
346	H	90.6	Very high	89.9	Confident	41 Å²	41	41.3 Å²	41.3	19%	0.19	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-46.5	178.3	-173.2	50.7	0	0	0	112.4	R33 S342 T343 F344 Q350	R33-H346 PolarHBondContact NH1-CE1 3.46Å; R33-H346 PolarHBondContact NH1-NE2 2.94Å; R33-H346 VanDerWaalsContact NH1-NE2 3.19Å; S342-H346 VanDerWaalsContact O-CB 3.27Å; S342-H346 WeakPolarHBondContact O-CB 3.4Å; S342-H346 PolarHBondContact O-N 3.25Å; T343-H346 PolarHBondContact O-N 3.29Å; F344-H346 VanDerWaalsContact C-N 3.32Å; F344-H346 PolarHBondContact O-N 2.76Å; H346-Q350 PolarHBondContact NE2-OE1 2.89Å; H346-Q350 WeakPolarHBondContact O-CB 3.44Å; H346-Q350 PolarHBondContact O-N 3.15Å
347	Q	89.3	Confident	90.6	Very high	46 Å²	46	33.1 Å²	33.1	22%	0.215	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-46	179.2	-72.2	172.6	-11.8	0	0	111.8	A327 T343 F344 S345 L349 Q350 N351	A327-Q347 HydrophobicContact CB-CB 4Å; T343-Q347 WeakPolarHBondContact O-CG 3.37Å; T343-Q347 PolarHBondContact O-N 3.33Å; F344-Q347 PolarHBondContact O-N 2.75Å; S345-Q347 PolarHBondContact O-N 2.76Å; Q347-L349 PolarHBondContact O-N 3Å; Q347-Q350 PolarHBondContact O-N 3.08Å; Q347-N351 WeakPolarHBondContact O-CB 3.28Å; Q347-N351 PolarHBondContact O-N 3.28Å; Q347-N351 PolarHBondContact O-ND2 3.08Å
348	L	90	Very high	90.9	Very high	12 Å²	12	34.7 Å²	34.7	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-58.7	-50.6	178.8	-171.4	81.7	0	0	0	111.1	V247 P275 A327 F344 S345 R352	V247-L348 HydrophobicContact CB-CD2 4.48Å; V247-L348 HydrophobicContact CG2-CD2 3.99Å; P275-L348 HydrophobicContact CB-CD1 4.38Å; P275-L348 HydrophobicContact CG-CD1 3.9Å; A327-L348 HydrophobicContact CB-CB 4.25Å; A327-L348 HydrophobicContact CB-CD1 4.24Å; F344-L348 PolarHBondContact O-N 3.13Å; S345-L348 PolarHBondContact O-N 3.14Å; L348-R352 WeakPolarHBondContact O-CG 3.39Å; L348-R352 PolarHBondContact O-N 3.18Å
349	L	91.6	Very high	91.2	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-41.4	-178.7	-68.2	179	0	0	0	112.1	F31 Y34 P112 L245 S345 Q347 R352 L353	F31-L349 HydrophobicContact CD1-CD1 3.6Å; F31-L349 HydrophobicContact CE1-CD1 3.59Å; F31-L349 HydrophobicContact CG-CD1 4.4Å; F31-L349 HydrophobicContact CZ-CD1 4.38Å; Y34-L349 HydrophobicContact CD1-CD2 4.44Å; Y34-L349 HydrophobicContact CD2-CB 3.53Å; Y34-L349 HydrophobicContact CD2-CD1 4.46Å; Y34-L349 HydrophobicContact CD2-CD2 4.01Å; Y34-L349 HydrophobicContact CD2-CG 4.19Å; Y34-L349 HydrophobicContact CE1-CD2 4.46Å; Y34-L349 HydrophobicContact CE2-CB 4.05Å; Y34-L349 HydrophobicContact CE2-CD2 3.98Å; Y34-L349 WeakPolarHBondContact CE2-O 3.3Å; Y34-L349 HydrophobicContact CG-CB 4.11Å; Y34-L349 HydrophobicContact CG-CD1 4.23Å; Y34-L349 HydrophobicContact CG-CD2 4.22Å; Y34-L349 HydrophobicContact CG-CG 4.42Å; P112-L349 HydrophobicContact CB-CD2 3.69Å; P112-L349 HydrophobicContact CG-CD2 4.49Å; L245-L349 HydrophobicContact CD2-CD2 3.68Å; L245-L349 HydrophobicContact CG-CD2 4.47Å; S345-L349 VanDerWaalsContact O-CB 3.3Å; S345-L349 WeakPolarHBondContact O-CB 3.4Å; S345-L349 WeakPolarHBondContact O-CG 3.47Å; S345-L349 PolarHBondContact O-N 3.29Å; Q347-L349 PolarHBondContact O-N 3Å; L349-R352 PolarHBondContact O-N 3.38Å; L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.19Å; L349-L353 VanDerWaalsContact O-N 3.16Å
350	Q	91.1	Very high	91.4	Very high	32 Å²	32	29.6 Å²	29.6	15%	0.15	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-44	178.4	-177.5	179.1	-9.3	0	0	111.4	H346 Q347 R352 L353 V354 L645	H346-Q350 PolarHBondContact NE2-OE1 2.89Å; H346-Q350 WeakPolarHBondContact O-CB 3.44Å; H346-Q350 PolarHBondContact O-N 3.15Å; Q347-Q350 PolarHBondContact O-N 3.08Å; Q350-R352 VanDerWaalsContact C-N 3.3Å; Q350-R352 PolarHBondContact O-N 3.2Å; Q350-L353 PolarHBondContact O-N 2.9Å; Q350-V354 HydrophobicContact CG-CG2 4.44Å; Q350-V354 WeakPolarHBondContact O-CG2 3.44Å; Q350-V354 PolarHBondContact O-N 2.96Å; Q350-L645 PolarHBondContact NE2-O 3.02Å
351	N	88.2	Confident	91.5	Very high	31 Å²	31	27.5 Å²	27.5	17%	0.166	14%	0.14	C	C	.	.	H	α-helix	trans	-57.6	-44.3	176.6	-74.3	-31.9	0	0	0	111.9	C325 A327 Q347 L353 V354 D355	C325-N351 VanDerWaalsContact O-CG 3.23Å; C325-N351 PolarHBondContact O-ND2 3.33Å; C325-N351 PolarHBondContact O-OD1 2.82Å; A327-N351 PolarHBondContact N-ND2 2.89Å; Q347-N351 WeakPolarHBondContact O-CB 3.28Å; Q347-N351 PolarHBondContact O-N 3.28Å; Q347-N351 PolarHBondContact O-ND2 3.08Å; N351-L353 PolarHBondContact O-N 3.01Å; N351-V354 PolarHBondContact O-N 3.38Å; N351-D355 VanDerWaalsContact O-CG 3.31Å; N351-D355 PolarHBondContact O-N 3.37Å
352	R	89	Confident	91.5	Very high	79 Å²	79	31.6 Å²	31.6	30%	0.298	16%	0.164	S	C	.	.	H	α-helix	trans	-60.4	-43.4	177.1	-69.2	-64.3	-172.9	-177.6	-0.1	112.7	L245 L348 L349 Q350 D355 A356	L245-R352 HydrophobicContact CD1-CG 4.02Å; L245-R352 HydrophobicContact CD2-CB 4.16Å; L245-R352 HydrophobicContact CD2-CG 3.85Å; L348-R352 WeakPolarHBondContact O-CG 3.39Å; L348-R352 PolarHBondContact O-N 3.18Å; L349-R352 PolarHBondContact O-N 3.38Å; Q350-R352 VanDerWaalsContact C-N 3.3Å; Q350-R352 PolarHBondContact O-N 3.2Å; R352-D355 PolarHBondContact O-N 3.24Å; R352-A356 PolarHBondContact O-N 2.63Å; R352-A356 VanDerWaalsContact O-N 3.12Å
353	L	92.3	Very high	91.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-40.1	175.7	-65.4	173.4	0	0	0	112	Y34 L38 L41 L349 Q350 N351 A357 L645	Y34-L353 HydrophobicContact CD2-CD1 3.43Å; Y34-L353 VanDerWaalsContact CD2-CD1 3.43Å; Y34-L353 HydrophobicContact CD2-CD2 3.83Å; Y34-L353 HydrophobicContact CD2-CG 3.5Å; Y34-L353 HydrophobicContact CE2-CD1 4Å; Y34-L353 HydrophobicContact CE2-CD2 3.6Å; Y34-L353 HydrophobicContact CE2-CG 3.5Å; Y34-L353 HydrophobicContact CG-CD1 4.24Å; L38-L353 HydrophobicContact CB-CD2 4.16Å; L38-L353 HydrophobicContact CD1-CD2 4.26Å; L41-L353 HydrophobicContact CD1-CB 4.34Å; L41-L353 HydrophobicContact CD1-CD2 3.55Å; L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.19Å; L349-L353 VanDerWaalsContact O-N 3.16Å; Q350-L353 PolarHBondContact O-N 2.9Å; N351-L353 PolarHBondContact O-N 3.01Å; L353-A357 VanDerWaalsContact O-CB 3.31Å; L353-A357 WeakPolarHBondContact O-CB 3.29Å; L353-A357 PolarHBondContact O-N 3.33Å; L353-L645 HydrophobicContact CB-CD1 3.63Å; L353-L645 HydrophobicContact CB-CD2 3.86Å; L353-L645 HydrophobicContact CB-CG 4.37Å; L353-L645 HydrophobicContact CD1-CD2 3.74Å; L353-L645 HydrophobicContact CG-CD2 4.47Å
354	V	92.4	Very high	91.5	Very high	15 Å²	15	28 Å²	28	9%	0.091	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-45	177.6	169.9	0	0	0	0	110.6	Q350 N351 A357 K358 L645 L646	Q350-V354 HydrophobicContact CG-CG2 4.44Å; Q350-V354 WeakPolarHBondContact O-CG2 3.44Å; Q350-V354 PolarHBondContact O-N 2.96Å; N351-V354 PolarHBondContact O-N 3.38Å; V354-A357 PolarHBondContact O-N 3.27Å; V354-K358 WeakPolarHBondContact O-CB 3.37Å; V354-K358 PolarHBondContact O-N 2.93Å; V354-L645 HydrophobicContact CG2-CB 3.63Å; V354-L646 HydrophobicContact CG1-CD2 3.81Å; V354-L646 HydrophobicContact CG1-CG 4.19Å; V354-L646 HydrophobicContact CG2-CD2 4Å; V354-L646 HydrophobicContact CG2-CG 4.21Å
355	D	90.1	Very high	91.3	Very high	70 Å²	70	29 Å²	29	37%	0.374	15%	0.149	S	C	.	.	H	α-helix	trans	-61.4	-45.3	179	-71.9	-22.9	0	0	0	111.3	N351 R352 K358 A359	N351-D355 VanDerWaalsContact O-CG 3.31Å; N351-D355 PolarHBondContact O-N 3.37Å; R352-D355 PolarHBondContact O-N 3.24Å; D355-K358 PolarHBondContact O-N 3.39Å; D355-A359 WeakPolarHBondContact O-CB 3.44Å; D355-A359 PolarHBondContact O-N 3.5Å
356	A	92.3	Very high	91	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-47.6	174.6	0	0	0	0	0	113.1	L41 L104 L107 R352 K358 A359 L360	L41-A356 HydrophobicContact CD1-CB 3.8Å; L41-A356 HydrophobicContact CD2-CB 4.3Å; L104-A356 HydrophobicContact CD2-CB 4.24Å; L107-A356 HydrophobicContact CD1-CB 3.79Å; L107-A356 HydrophobicContact CD2-CB 3.51Å; L107-A356 HydrophobicContact CG-CB 4.24Å; R352-A356 PolarHBondContact O-N 2.63Å; R352-A356 VanDerWaalsContact O-N 3.12Å; A356-K358 VanDerWaalsContact C-N 3.26Å; A356-K358 PolarHBondContact O-N 3.3Å; A356-A359 PolarHBondContact O-N 3.16Å; A356-L360 WeakPolarHBondContact O-CB 3.24Å; A356-L360 PolarHBondContact O-N 3.2Å
357	A	94.5	Very high	90.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-39.6	178.1	0	0	0	0	0	111.3	L41 L353 V354 N361 L641 Q642 L645	L41-A357 HydrophobicContact CD2-CB 4.01Å; L353-A357 VanDerWaalsContact O-CB 3.31Å; L353-A357 WeakPolarHBondContact O-CB 3.29Å; L353-A357 PolarHBondContact O-N 3.33Å; V354-A357 PolarHBondContact O-N 3.27Å; A357-N361 VanDerWaalsContact O-CB 3.27Å; A357-N361 WeakPolarHBondContact O-CB 3.22Å; A357-N361 PolarHBondContact O-N 3.27Å; A357-L641 HydrophobicContact CB-CG 4.36Å; A357-Q642 HydrophobicContact CB-CB 3.94Å; A357-L645 HydrophobicContact CB-CD1 4.1Å
358	K	93.1	Very high	90.5	Very high	115 Å²	115	30 Å²	30	50%	0.5	15%	0.154	S	C	.	.	H	α-helix	trans	-65.7	-50	176.6	-176.5	178.9	178.7	-176.4	0	111.5	V354 D355 A356 L360 N361 V362	V354-K358 WeakPolarHBondContact O-CB 3.37Å; V354-K358 PolarHBondContact O-N 2.93Å; D355-K358 PolarHBondContact O-N 3.39Å; A356-K358 VanDerWaalsContact C-N 3.26Å; A356-K358 PolarHBondContact O-N 3.3Å; K358-L360 VanDerWaalsContact C-N 3.33Å; K358-L360 PolarHBondContact O-N 3.39Å; K358-N361 PolarHBondContact O-N 2.8Å; K358-V362 WeakPolarHBondContact O-CG2 3.28Å; K358-V362 PolarHBondContact O-N 3.33Å
359	A	92	Very high	90.1	Very high	28 Å²	28	32.2 Å²	32.2	23%	0.231	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-45	178.8	0	0	0	0	0	111.2	Y103 L104 D355 A356 N361 V362 V363	Y103-A359 HydrophobicContact CE1-CB 4.32Å; L104-A359 HydrophobicContact CD2-CB 3.95Å; L104-A359 HydrophobicContact CG-CB 4.47Å; D355-A359 WeakPolarHBondContact O-CB 3.44Å; D355-A359 PolarHBondContact O-N 3.5Å; A356-A359 PolarHBondContact O-N 3.16Å; A359-N361 PolarHBondContact O-N 3.39Å; A359-V362 PolarHBondContact O-N 3.46Å; A359-V363 WeakPolarHBondContact O-CG2 3.11Å; A359-V363 PolarHBondContact O-N 3.16Å; A359-V363 VanDerWaalsContact O-N 3.15Å
360	L	93.5	Very high	89.4	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-40.7	176.2	-172.3	63	0	0	0	112.3	N44 L45 T48 L104 A356 K358 V363 H364	N44-L360 HydrophobicContact CB-CD2 3.91Å; N44-L360 WeakPolarHBondContact OD1-CD2 3.36Å; L45-L360 HydrophobicContact CD1-CD1 4.19Å; T48-L360 HydrophobicContact CG2-CD1 4.35Å; L104-L360 HydrophobicContact CD1-CB 4.23Å; L104-L360 HydrophobicContact CD1-CD1 4.01Å; L104-L360 HydrophobicContact CD2-CB 4.41Å; A356-L360 WeakPolarHBondContact O-CB 3.24Å; A356-L360 PolarHBondContact O-N 3.2Å; K358-L360 VanDerWaalsContact C-N 3.33Å; K358-L360 PolarHBondContact O-N 3.39Å; L360-V363 PolarHBondContact O-N 3.22Å; L360-H364 WeakPolarHBondContact CD1-NE2 3.36Å; L360-H364 VanDerWaalsContact O-CG 3.3Å; L360-H364 PolarHBondContact O-N 2.88Å
361	N	93	Very high	88.7	Confident	10 Å²	10	32.6 Å²	32.6	5%	0.053	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-41.4	175.4	-176.6	-112.2	0	0	0	112.8	A357 K358 A359 V363 H364 S365 S635 S638 R639	A357-N361 VanDerWaalsContact O-CB 3.27Å; A357-N361 WeakPolarHBondContact O-CB 3.22Å; A357-N361 PolarHBondContact O-N 3.27Å; K358-N361 PolarHBondContact O-N 2.8Å; A359-N361 PolarHBondContact O-N 3.39Å; N361-V363 VanDerWaalsContact C-N 3.33Å; N361-V363 PolarHBondContact O-N 2.89Å; N361-H364 PolarHBondContact O-N 3.04Å; N361-S365 WeakPolarHBondContact O-CB 3.44Å; N361-S365 PolarHBondContact O-N 3.2Å; N361-S365 PolarHBondContact O-OG 3.05Å; N361-S635 PolarHBondContact ND2-O 3.25Å; N361-S638 VanDerWaalsContact CA-OG 3.29Å; N361-S638 WeakPolarHBondContact CA-OG 3.34Å; N361-S638 WeakPolarHBondContact CB-OG 3.33Å; N361-S638 PolarHBondContact ND2-OG 3.38Å; N361-R639 WeakPolarHBondContact ND2-CB 3.22Å
362	V	91.3	Very high	87.9	Confident	86 Å²	86	31.8 Å²	31.8	52%	0.521	16%	0.164	S	C	.	.	H	α-helix	trans	-58.9	-45.2	176	168.8	0	0	0	0	110.9	K358 A359 H366	K358-V362 WeakPolarHBondContact O-CG2 3.28Å; K358-V362 PolarHBondContact O-N 3.33Å; A359-V362 PolarHBondContact O-N 3.46Å; V362-H366 WeakPolarHBondContact O-CB 3.22Å; V362-H366 PolarHBondContact O-N 3.26Å
363	V	90.3	Very high	87.1	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-49.2	175.9	173.9	0	0	0	0	110.7	F96 E100 A359 L360 N361 H366 C367	F96-V363 HydrophobicContact CD2-CG1 4.16Å; F96-V363 HydrophobicContact CE2-CG1 4.07Å; F96-V363 HydrophobicContact CE2-CG2 4.22Å; E100-V363 HydrophobicContact CB-CG2 4.15Å; E100-V363 HydrophobicContact CG-CG2 4.29Å; A359-V363 WeakPolarHBondContact O-CG2 3.11Å; A359-V363 PolarHBondContact O-N 3.16Å; A359-V363 VanDerWaalsContact O-N 3.15Å; L360-V363 PolarHBondContact O-N 3.22Å; N361-V363 VanDerWaalsContact C-N 3.33Å; N361-V363 PolarHBondContact O-N 2.89Å; V363-H366 PolarHBondContact O-N 2.85Å; V363-C367 WeakPolarHBondContact O-CB 3.49Å; V363-C367 PolarHBondContact O-N 2.98Å; V363-C367 PolarHBondContact O-SG 3.4Å
364	H	91.7	Very high	86.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-47.2	-179.5	-63.6	167	0	0	0	113	N44 T48 L360 N361 C367 L368 L631 L634 S635 S638	N44-H364 PolarHBondContact OD1-CE1 3.47Å; N44-H364 VanDerWaalsContact OD1-CE1 3.28Å; T48-H364 WeakPolarHBondContact CG2-NE2 3.35Å; T48-H364 PolarHBondContact OG1-CE1 3.39Å; T48-H364 VanDerWaalsContact OG1-CE1 3.26Å; T48-H364 PolarHBondContact OG1-NE2 2.88Å; L360-H364 WeakPolarHBondContact CD1-NE2 3.36Å; L360-H364 VanDerWaalsContact O-CG 3.3Å; L360-H364 PolarHBondContact O-N 2.88Å; N361-H364 PolarHBondContact O-N 3.04Å; H364-C367 PolarHBondContact O-N 3.06Å; H364-L368 VanDerWaalsContact O-CB 3.27Å; H364-L368 WeakPolarHBondContact O-CB 3.31Å; H364-L368 PolarHBondContact O-N 2.82Å; H364-L631 HydrophobicContact CB-CD1 4.43Å; H364-L634 PolarHBondContact CE1-O 3.04Å; H364-L634 PolarHBondContact ND1-O 3.14Å; H364-S635 PolarHBondContact ND1-N 3.44Å; H364-S638 PolarHBondContact ND1-OG 3.2Å; H364-S638 VanDerWaalsContact ND1-OG 3.14Å
365	S	88.1	Confident	84.8	Confident	21 Å²	21	34 Å²	34	15%	0.147	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-46.3	179	-65.7	0	0	0	0	111.1	N361 C367 L368 D369	N361-S365 WeakPolarHBondContact O-CB 3.44Å; N361-S365 PolarHBondContact O-N 3.2Å; N361-S365 PolarHBondContact O-OG 3.05Å; S365-C367 PolarHBondContact O-N 3.41Å; S365-L368 PolarHBondContact O-N 2.85Å; S365-D369 WeakPolarHBondContact O-CB 3.42Å; S365-D369 PolarHBondContact O-N 2.88Å
366	H	86.9	Confident	83.7	Confident	110 Å²	110	33.5 Å²	33.5	51%	0.509	17%	0.174	S	C	.	.	H	α-helix	trans	-60.4	-47.1	178.8	-177.7	60.6	0	0	0	112.3	V362 V363 L368 D369 I370	V362-H366 WeakPolarHBondContact O-CB 3.22Å; V362-H366 PolarHBondContact O-N 3.26Å; V363-H366 PolarHBondContact O-N 2.85Å; H366-L368 VanDerWaalsContact C-N 3.34Å; H366-L368 PolarHBondContact O-N 3.27Å; H366-D369 PolarHBondContact O-N 2.83Å; H366-I370 WeakPolarHBondContact O-CG1 3.16Å; H366-I370 PolarHBondContact O-N 3.41Å
367	C	84.8	Confident	82.5	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.02	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-39.4	178	-66.9	0	0	0	0	111.9	F52 V363 H364 S365 I370 F371 L631	F52-C367 HydrophobicContact CZ-CB 4.23Å; V363-C367 WeakPolarHBondContact O-CB 3.49Å; V363-C367 PolarHBondContact O-N 2.98Å; V363-C367 PolarHBondContact O-SG 3.4Å; H364-C367 PolarHBondContact O-N 3.06Å; S365-C367 PolarHBondContact O-N 3.41Å; C367-I370 WeakPolarHBondContact O-CB 3.38Å; C367-I370 PolarHBondContact O-N 3.01Å; C367-F371 WeakPolarHBondContact O-CD2 3.44Å; C367-F371 PolarHBondContact O-N 3.32Å; C367-F371 VanDerWaalsContact O-N 3.08Å; C367-L631 HydrophobicContact CB-CD2 3.76Å
368	L	84	Confident	81.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-37.9	177.9	-172.2	55.4	0	0	0	111.7	H364 S365 H366 I370 F371 I372 A628 L631 A632 L694 H697	H364-L368 VanDerWaalsContact O-CB 3.27Å; H364-L368 WeakPolarHBondContact O-CB 3.31Å; H364-L368 PolarHBondContact O-N 2.82Å; S365-L368 PolarHBondContact O-N 2.85Å; H366-L368 VanDerWaalsContact C-N 3.34Å; H366-L368 PolarHBondContact O-N 3.27Å; L368-I370 VanDerWaalsContact C-N 3.33Å; L368-F371 WeakPolarHBondContact O-CB 3.35Å; L368-F371 PolarHBondContact O-N 3.03Å; L368-I372 HydrophobicContact CD1-CD1 4.18Å; L368-I372 HydrophobicContact CD1-CG1 4.47Å; L368-I372 HydrophobicContact CG-CD1 3.84Å; L368-I372 WeakPolarHBondContact O-CB 3.31Å; L368-I372 WeakPolarHBondContact O-CD1 3.2Å; L368-I372 VanDerWaalsContact O-CG1 3.26Å; L368-I372 WeakPolarHBondContact O-CG1 3.46Å; L368-I372 PolarHBondContact O-N 3.13Å; L368-A628 HydrophobicContact CD1-CB 4.19Å; L368-L631 HydrophobicContact CB-CD2 3.94Å; L368-L631 HydrophobicContact CB-CG 4.25Å; L368-L631 HydrophobicContact CD1-CB 4.47Å; L368-L631 HydrophobicContact CD1-CD2 4.34Å; L368-A632 HydrophobicContact CD2-CB 3.71Å; L368-L694 HydrophobicContact CD1-CD1 4.45Å; L368-H697 HydrophobicContact CD2-CB 3.88Å
369	D	81.1	Confident	79.7	Confident	58 Å²	58	34.5 Å²	34.5	31%	0.31	18%	0.184	S	C	.	.	H	α-helix	trans	-65	-37.3	174.2	-67	-19	0	0	0	111.5	S365 H366 I372 N373 H697	S365-D369 WeakPolarHBondContact O-CB 3.42Å; S365-D369 PolarHBondContact O-N 2.88Å; H366-D369 PolarHBondContact O-N 2.83Å; D369-I372 PolarHBondContact O-N 3.21Å; D369-N373 VanDerWaalsContact O-CB 3.22Å; D369-N373 WeakPolarHBondContact O-CB 3.31Å; D369-N373 PolarHBondContact O-N 3.46Å; D369-N373 PolarHBondContact O-ND2 3.33Å; D369-H697 IonicContact OD1-CE1 3.7Å; D369-H697 PolarHBondContact OD1-CE1 3.4Å; D369-H697 IonicContact OD1-NE2 2.91Å; D369-H697 PolarHBondContact OD1-NE2 2.91Å
370	I	78.8	Confident	78.4	Confident	36 Å²	36	40.2 Å²	40.2	19%	0.185	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-49.7	171.7	-68.8	166.5	0	0	0	110.5	I94 H366 C367 L368 I372 N373 Q374	I94-I370 HydrophobicContact CD1-CG2 4.18Å; I94-I370 HydrophobicContact CG1-CG2 3.93Å; H366-I370 WeakPolarHBondContact O-CG1 3.16Å; H366-I370 PolarHBondContact O-N 3.41Å; C367-I370 WeakPolarHBondContact O-CB 3.38Å; C367-I370 PolarHBondContact O-N 3.01Å; L368-I370 VanDerWaalsContact C-N 3.33Å; I370-I372 VanDerWaalsContact C-N 3.31Å; I370-I372 PolarHBondContact O-N 2.87Å; I370-N373 PolarHBondContact O-N 2.93Å; I370-Q374 HydrophobicContact CG2-CG 4.35Å; I370-Q374 VanDerWaalsContact CG2-OE1 3.32Å; I370-Q374 WeakPolarHBondContact O-CB 3.47Å; I370-Q374 WeakPolarHBondContact O-CG 3.42Å; I370-Q374 PolarHBondContact O-N 3.37Å; I370-Q374 PolarHBondContact O-OE1 2.92Å
371	F	75.1	Confident	77	Confident	7 Å²	7	42.6 Å²	42.6	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-56.7	-44.9	177.2	-84.3	-70.8	0	0	0	112.4	F51 I55 L91 I94 C367 L368 A375 W620 V623 H627 L631	F51-F371 HydrophobicContact CZ-CE2 4.25Å; F51-F371 HydrophobicContact CZ-CZ 4.44Å; I55-F371 HydrophobicContact CD1-CZ 3.92Å; L91-F371 HydrophobicContact CD2-CE1 4.35Å; I94-F371 HydrophobicContact CB-CZ 4.43Å; I94-F371 HydrophobicContact CD1-CD1 3.55Å; I94-F371 HydrophobicContact CD1-CD2 4Å; I94-F371 HydrophobicContact CD1-CE1 3.25Å; I94-F371 HydrophobicContact CD1-CE2 3.77Å; I94-F371 HydrophobicContact CD1-CG 3.91Å; I94-F371 HydrophobicContact CD1-CZ 3.42Å; I94-F371 VanDerWaalsContact CD1-CZ 3.42Å; I94-F371 HydrophobicContact CG1-CZ 4.46Å; I94-F371 HydrophobicContact CG2-CD2 4.38Å; I94-F371 HydrophobicContact CG2-CE2 3.51Å; I94-F371 HydrophobicContact CG2-CZ 3.6Å; C367-F371 WeakPolarHBondContact O-CD2 3.44Å; C367-F371 PolarHBondContact O-N 3.32Å; C367-F371 VanDerWaalsContact O-N 3.08Å; L368-F371 WeakPolarHBondContact O-CB 3.35Å; L368-F371 PolarHBondContact O-N 3.03Å; F371-A375 VanDerWaalsContact O-CB 3.27Å; F371-A375 WeakPolarHBondContact O-CB 3.41Å; F371-A375 PolarHBondContact O-N 3.29Å; F371-W620 HydrophobicContact CD1-CZ3 4.11Å; F371-V623 HydrophobicContact CD1-CG1 3.69Å; F371-V623 HydrophobicContact CE1-CG1 3.21Å; F371-V623 HydrophobicContact CZ-CG1 4.3Å; F371-H627 HydrophobicContact CZ-CB 4.46Å; F371-L631 HydrophobicContact CD2-CD2 3.68Å; F371-L631 HydrophobicContact CE2-CD2 3.7Å
372	I	71.9	Confident	75.7	Confident	14 Å²	14	44.2 Å²	44.2	7%	0.072	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-46.5	-177.3	-71.1	165	0	0	0	110.6	L368 D369 I370 A375 F376 Y698	L368-I372 HydrophobicContact CD1-CD1 4.18Å; L368-I372 HydrophobicContact CD1-CG1 4.47Å; L368-I372 HydrophobicContact CG-CD1 3.84Å; L368-I372 WeakPolarHBondContact O-CB 3.31Å; L368-I372 WeakPolarHBondContact O-CD1 3.2Å; L368-I372 VanDerWaalsContact O-CG1 3.26Å; L368-I372 WeakPolarHBondContact O-CG1 3.46Å; L368-I372 PolarHBondContact O-N 3.13Å; D369-I372 PolarHBondContact O-N 3.21Å; I370-I372 VanDerWaalsContact C-N 3.31Å; I370-I372 PolarHBondContact O-N 2.87Å; I372-A375 WeakPolarHBondContact O-CB 3.45Å; I372-A375 PolarHBondContact O-N 2.91Å; I372-F376 HydrophobicContact CG2-CD2 3.65Å; I372-F376 HydrophobicContact CG2-CE2 3.27Å; I372-F376 HydrophobicContact CG2-CZ 4.35Å; I372-F376 WeakPolarHBondContact O-CD2 3.37Å; I372-F376 PolarHBondContact O-N 2.89Å; I372-Y698 HydrophobicContact CD1-CE1 3.66Å; I372-Y698 HydrophobicContact CG1-CE1 4.24Å; I372-Y698 HydrophobicContact CG2-CE1 4.17Å
373	N	72.4	Confident	74.4	Confident	89 Å²	89	45.2 Å²	45.2	48%	0.476	22%	0.22	S	C	.	.	H	α-helix	trans	-67.8	-42	-178.2	-70.4	-32.5	0	0	0	112.1	D369 I370 A375 F376 D377	D369-N373 VanDerWaalsContact O-CB 3.22Å; D369-N373 WeakPolarHBondContact O-CB 3.31Å; D369-N373 PolarHBondContact O-N 3.46Å; D369-N373 PolarHBondContact O-ND2 3.33Å; I370-N373 PolarHBondContact O-N 2.93Å; N373-A375 VanDerWaalsContact C-N 3.27Å; N373-A375 PolarHBondContact O-N 3.47Å; N373-F376 WeakPolarHBondContact O-CB 3.27Å; N373-F376 PolarHBondContact O-N 3.47Å; N373-F376 VanDerWaalsContact O-N 3.08Å; N373-D377 PolarHBondContact O-N 2.84Å
374	Q	70.6	Confident	73.4	Confident	53 Å²	53	47.1 Å²	47.1	25%	0.248	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-36.9	174.5	-74	175.9	-38.7	0	0	112.1	C93 I370 F376 D377 M378 W620	C93-Q374 PolarHBondContact SG-NE2 3.46Å; I370-Q374 HydrophobicContact CG2-CG 4.35Å; I370-Q374 VanDerWaalsContact CG2-OE1 3.32Å; I370-Q374 WeakPolarHBondContact O-CB 3.47Å; I370-Q374 WeakPolarHBondContact O-CG 3.42Å; I370-Q374 PolarHBondContact O-N 3.37Å; I370-Q374 PolarHBondContact O-OE1 2.92Å; Q374-F376 VanDerWaalsContact C-N 3.33Å; Q374-F376 PolarHBondContact O-N 3.5Å; Q374-D377 PolarHBondContact O-N 3.43Å; Q374-M378 VanDerWaalsContact O-CB 3.31Å; Q374-M378 WeakPolarHBondContact O-CB 3.43Å; Q374-M378 PolarHBondContact O-N 3.44Å; Q374-W620 HydrophobicContact CB-CH2 4.09Å; Q374-W620 HydrophobicContact CB-CZ2 4.48Å; Q374-W620 HydrophobicContact CB-CZ3 4.1Å; Q374-W620 HydrophobicContact CG-CH2 4.43Å
375	A	65.9	Low	72.4	Confident	3 Å²	3	47.9 Å²	47.9	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-39.8	172.7	0	0	0	0	0	112.7	F371 I372 N373 Q379 R624	F371-A375 VanDerWaalsContact O-CB 3.27Å; F371-A375 WeakPolarHBondContact O-CB 3.41Å; F371-A375 PolarHBondContact O-N 3.29Å; I372-A375 WeakPolarHBondContact O-CB 3.45Å; I372-A375 PolarHBondContact O-N 2.91Å; N373-A375 VanDerWaalsContact C-N 3.27Å; N373-A375 PolarHBondContact O-N 3.47Å; A375-Q379 PolarHBondContact O-N 2.79Å; A375-R624 VanDerWaalsContact CB-CZ 3.5Å; A375-R624 PolarHBondContact O-NH2 3.38Å
376	F	66.8	Low	71.8	Confident	59 Å²	59	50 Å²	50	26%	0.259	25%	0.247	S	C	.	.	H	α-helix	trans	-68.5	-45.8	175.1	-77.1	-63	0	0	0	112.5	I372 N373 Q374 M378 Q379 R380 P799 A801	I372-F376 HydrophobicContact CG2-CD2 3.65Å; I372-F376 HydrophobicContact CG2-CE2 3.27Å; I372-F376 HydrophobicContact CG2-CZ 4.35Å; I372-F376 WeakPolarHBondContact O-CD2 3.37Å; I372-F376 PolarHBondContact O-N 2.89Å; N373-F376 WeakPolarHBondContact O-CB 3.27Å; N373-F376 PolarHBondContact O-N 3.47Å; N373-F376 VanDerWaalsContact O-N 3.08Å; Q374-F376 VanDerWaalsContact C-N 3.33Å; Q374-F376 PolarHBondContact O-N 3.5Å; F376-M378 PolarHBondContact O-N 3.23Å; F376-Q379 PolarHBondContact O-N 2.89Å; F376-R380 WeakPolarHBondContact O-CB 3.41Å; F376-R380 PolarHBondContact O-N 3.22Å; F376-P799 HydrophobicContact CE1-CB 3.69Å; F376-P799 HydrophobicContact CZ-CB 3.53Å; F376-P799 HydrophobicContact CZ-CG 3.92Å; F376-A801 HydrophobicContact CD1-CB 3.37Å; F376-A801 HydrophobicContact CE1-CB 3.52Å; F376-A801 HydrophobicContact CG-CB 4.45Å
377	D	67	Low	71.3	Confident	90 Å²	90	51.9 Å²	51.9	48%	0.481	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-45.8	179.4	-73	-28.2	0	0	0	111	N373 Q374 Q379 R380 D381	N373-D377 PolarHBondContact O-N 2.84Å; Q374-D377 PolarHBondContact O-N 3.43Å; D377-Q379 VanDerWaalsContact C-N 3.3Å; D377-Q379 PolarHBondContact O-N 2.81Å; D377-R380 WeakPolarHBondContact O-CB 3.17Å; D377-R380 PolarHBondContact O-N 2.95Å; D377-D381 PolarHBondContact O-N 3.05Å
378	M	66.1	Low	70.8	Confident	17 Å²	17	56 Å²	56	8%	0.084	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-40.9	176.4	-174.3	-177.1	71.5	0	0	112.2	Q374 F376 D381 L382 T616 E617 W620	Q374-M378 VanDerWaalsContact O-CB 3.31Å; Q374-M378 WeakPolarHBondContact O-CB 3.43Å; Q374-M378 PolarHBondContact O-N 3.44Å; F376-M378 PolarHBondContact O-N 3.23Å; M378-D381 PolarHBondContact O-N 2.79Å; M378-L382 WeakPolarHBondContact O-CG 3.25Å; M378-L382 PolarHBondContact O-N 2.9Å; M378-T616 HydrophobicContact SD-CG2 3.97Å; M378-E617 HydrophobicContact CE-CB 4.18Å; M378-E617 HydrophobicContact CE-CG 4.06Å; M378-E617 HydrophobicContact SD-CB 4.31Å; M378-W620 HydrophobicContact CE-CB 3.57Å; M378-W620 HydrophobicContact CE-CG 4.28Å; M378-W620 HydrophobicContact SD-CB 3.62Å; M378-W620 VanDerWaalsContact SD-CD1 3.53Å; M378-W620 HydrophobicContact SD-CG 3.75Å
379	Q	62.6	Low	70.5	Confident	29 Å²	29	56.3 Å²	56.3	14%	0.136	27%	0.27	C	S	.	.	H	α-helix	trans	-70.9	-38.2	177.7	-178.6	149.3	-6	0	0	113.5	A375 F376 D377 D381 L382 Q383 A801	A375-Q379 PolarHBondContact O-N 2.79Å; F376-Q379 PolarHBondContact O-N 2.89Å; D377-Q379 VanDerWaalsContact C-N 3.3Å; D377-Q379 PolarHBondContact O-N 2.81Å; Q379-D381 PolarHBondContact O-N 3.15Å; Q379-L382 WeakPolarHBondContact O-CB 3.47Å; Q379-L382 PolarHBondContact O-N 2.86Å; Q379-Q383 WeakPolarHBondContact O-CG 3.23Å; Q379-Q383 PolarHBondContact O-N 3.21Å; Q379-A801 HydrophobicContact CB-CB 4.3Å; Q379-A801 HydrophobicContact CG-CB 4.32Å; Q379-A801 VanDerWaalsContact NE2-CA 3.31Å; Q379-A801 PolarHBondContact NE2-O 2.82Å; Q379-A801 PolarHBondContact OE1-O 2.85Å
380	R	65.2	Low	70.6	Confident	147 Å²	147	58 Å²	58	56%	0.555	28%	0.276	S	S	*	.	H	α-helix	trans	-59	-41.9	171.9	-177.9	-179.8	-177.3	-175.5	1.6	109.8	F376 D377 Q383 I384	F376-R380 WeakPolarHBondContact O-CB 3.41Å; F376-R380 PolarHBondContact O-N 3.22Å; D377-R380 WeakPolarHBondContact O-CB 3.17Å; D377-R380 PolarHBondContact O-N 2.95Å; R380-Q383 PolarHBondContact O-N 3.02Å; R380-I384 HydrophobicContact CG-CD1 3.37Å; R380-I384 HydrophobicContact CG-CG1 4.03Å; R380-I384 VanDerWaalsContact NE-CD1 3.34Å; R380-I384 VanDerWaalsContact O-CB 3.28Å; R380-I384 WeakPolarHBondContact O-CB 3.29Å; R380-I384 VanDerWaalsContact O-CG1 3.27Å; R380-I384 WeakPolarHBondContact O-CG1 3.46Å; R380-I384 PolarHBondContact O-N 2.71Å
381	D	64.4	Low	70.6	Confident	53 Å²	53	61.6 Å²	61.6	28%	0.283	29%	0.288	S	S	.	.	H	α-helix	trans	-65.9	-40	176.8	-74.6	-13.2	0	0	0	112.4	D377 M378 Q379 Q383 T385 L613	D377-D381 PolarHBondContact O-N 3.05Å; M378-D381 PolarHBondContact O-N 2.79Å; Q379-D381 PolarHBondContact O-N 3.15Å; D381-Q383 VanDerWaalsContact C-N 3.26Å; D381-Q383 PolarHBondContact O-N 3.18Å; D381-T385 WeakPolarHBondContact O-CB 3.48Å; D381-T385 PolarHBondContact O-N 3.31Å; D381-T385 PolarHBondContact O-OG1 2.94Å; D381-L613 HydrophobicContact CB-CD2 4.27Å
382	L	64.7	Low	70.7	Confident	45 Å²	45	61.3 Å²	61.3	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-57.5	-36.1	171.7	-77.4	163	0	0	0	112.6	M378 Q379 P386 L613 E617	M378-L382 WeakPolarHBondContact O-CG 3.25Å; M378-L382 PolarHBondContact O-N 2.9Å; Q379-L382 WeakPolarHBondContact O-CB 3.47Å; Q379-L382 PolarHBondContact O-N 2.86Å; L382-P386 WeakPolarHBondContact O-CD 3.23Å; L382-P386 VanDerWaalsContact O-CG 3.28Å; L382-P386 WeakPolarHBondContact O-CG 3.49Å; L382-L613 HydrophobicContact CB-CD2 4.22Å; L382-L613 HydrophobicContact CD2-CB 3.94Å; L382-L613 HydrophobicContact CD2-CD2 3.43Å; L382-L613 VanDerWaalsContact CD2-CD2 3.43Å; L382-L613 HydrophobicContact CD2-CG 4.29Å; L382-L613 HydrophobicContact CG-CD2 3.41Å; L382-L613 VanDerWaalsContact CG-CD2 3.41Å; L382-E617 HydrophobicContact CD1-CB 4.3Å; L382-E617 HydrophobicContact CD1-CG 4Å; L382-E617 WeakPolarHBondContact CD1-OE1 3.41Å; L382-E617 VanDerWaalsContact CD1-OE2 3.3Å; L382-E617 WeakPolarHBondContact CD1-OE2 3.43Å
383	Q	64.6	Low	71.2	Confident	107 Å²	107	65.2 Å²	65.2	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-89.4	-36.2	-177.5	-68.3	-173.7	-0	0	0	114.1	Q379 R380 D381 K387	Q379-Q383 WeakPolarHBondContact O-CG 3.23Å; Q379-Q383 PolarHBondContact O-N 3.21Å; R380-Q383 PolarHBondContact O-N 3.02Å; D381-Q383 VanDerWaalsContact C-N 3.26Å; D381-Q383 PolarHBondContact O-N 3.18Å; Q383-K387 WeakPolarHBondContact O-CD 3.5Å; Q383-K387 WeakPolarHBondContact O-CG 3.39Å
384	I	68.5	Low	71.7	Confident	48 Å²	48	66.7 Å²	66.7	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-86.5	-39.5	-173.1	-65.9	-174.6	0	0	0	111.1	R380 K387 R388	R380-I384 HydrophobicContact CG-CD1 3.37Å; R380-I384 HydrophobicContact CG-CG1 4.03Å; R380-I384 VanDerWaalsContact NE-CD1 3.34Å; R380-I384 VanDerWaalsContact O-CB 3.28Å; R380-I384 WeakPolarHBondContact O-CB 3.29Å; R380-I384 VanDerWaalsContact O-CG1 3.27Å; R380-I384 WeakPolarHBondContact O-CG1 3.46Å; R380-I384 PolarHBondContact O-N 2.71Å; I384-K387 WeakPolarHBondContact O-CB 3.38Å; I384-K387 PolarHBondContact O-N 2.95Å; I384-R388 HydrophobicContact CG2-CG 3.96Å; I384-R388 WeakPolarHBondContact O-CG 3.32Å; I384-R388 PolarHBondContact O-N 3.38Å
385	T	71.9	Confident	72.1	Confident	16 Å²	16	67 Å²	67	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-46.7	-174.9	-55.2	0	0	0	0	112.5	D381 K387 R388 L389 L500	D381-T385 WeakPolarHBondContact O-CB 3.48Å; D381-T385 PolarHBondContact O-N 3.31Å; D381-T385 PolarHBondContact O-OG1 2.94Å; T385-K387 VanDerWaalsContact C-N 3.31Å; T385-K387 PolarHBondContact O-N 2.99Å; T385-R388 PolarHBondContact O-N 2.93Å; T385-R388 VanDerWaalsContact O-N 3.14Å; T385-L389 HydrophobicContact CG2-CD1 4.24Å; T385-L389 HydrophobicContact CG2-CG 4.5Å; T385-L389 WeakPolarHBondContact O-CG 3.28Å; T385-L389 PolarHBondContact O-N 3.36Å; T385-L500 HydrophobicContact CG2-CD2 4.2Å
386	P	73.8	Confident	72.7	Confident	66 Å²	66	67.6 Å²	67.6	43%	0.429	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-40.1	175.7	-24	35.1	0	0	0	112.6	L382 R388 L389 E390	L382-P386 WeakPolarHBondContact O-CD 3.23Å; L382-P386 VanDerWaalsContact O-CG 3.28Å; L382-P386 WeakPolarHBondContact O-CG 3.49Å; P386-R388 VanDerWaalsContact C-N 3.33Å; P386-R388 PolarHBondContact O-N 3.32Å; P386-L389 PolarHBondContact O-N 3.34Å; P386-E390 WeakPolarHBondContact O-CB 3.19Å; P386-E390 PolarHBondContact O-N 3.32Å
387	K	76.9	Confident	73.5	Confident	149 Å²	149	68.1 Å²	68.1	65%	0.648	31%	0.311	S	S	*	.	H	α-helix	trans	-64.6	-36.6	177.1	-66.4	178.2	-178.1	175.5	0	112.3	Q383 I384 T385 Y391	Q383-K387 WeakPolarHBondContact O-CD 3.5Å; Q383-K387 WeakPolarHBondContact O-CG 3.39Å; I384-K387 WeakPolarHBondContact O-CB 3.38Å; I384-K387 PolarHBondContact O-N 2.95Å; T385-K387 VanDerWaalsContact C-N 3.31Å; T385-K387 PolarHBondContact O-N 2.99Å; K387-Y391 WeakPolarHBondContact O-CB 3.49Å; K387-Y391 PolarHBondContact O-N 3.32Å
388	R	75.4	Confident	74.2	Confident	89 Å²	89	67.9 Å²	67.9	34%	0.336	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-41.7	175.5	-74	-179.8	175.8	173.8	-0	111.7	I384 T385 P386 Y391 T392 S499 L500	I384-R388 HydrophobicContact CG2-CG 3.96Å; I384-R388 WeakPolarHBondContact O-CG 3.32Å; I384-R388 PolarHBondContact O-N 3.38Å; T385-R388 PolarHBondContact O-N 2.93Å; T385-R388 VanDerWaalsContact O-N 3.14Å; P386-R388 VanDerWaalsContact C-N 3.33Å; P386-R388 PolarHBondContact O-N 3.32Å; R388-Y391 PolarHBondContact O-N 3.5Å; R388-T392 PolarHBondContact O-N 3.07Å; R388-T392 PolarHBondContact O-OG1 3.43Å; R388-T392 VanDerWaalsContact O-OG1 3.05Å; R388-S499 PolarHBondContact NH1-O 3.37Å; R388-S499 VanDerWaalsContact NH1-O 3.11Å; R388-S499 PolarHBondContact NH1-OG 3.25Å; R388-L500 HydrophobicContact CB-CD2 3.87Å
389	L	77.7	Confident	74.6	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-43.9	174.5	-68.8	172.8	0	0	0	111.2	T385 P386 Y391 T392 R393 L500 L602 L605 E606	T385-L389 HydrophobicContact CG2-CD1 4.24Å; T385-L389 HydrophobicContact CG2-CG 4.5Å; T385-L389 WeakPolarHBondContact O-CG 3.28Å; T385-L389 PolarHBondContact O-N 3.36Å; P386-L389 PolarHBondContact O-N 3.34Å; L389-Y391 VanDerWaalsContact C-N 3.34Å; L389-Y391 PolarHBondContact O-N 2.84Å; L389-T392 PolarHBondContact O-N 3.1Å; L389-R393 WeakPolarHBondContact O-CB 3.23Å; L389-R393 PolarHBondContact O-N 3.49Å; L389-L500 HydrophobicContact CD2-CD1 4.02Å; L389-L602 HydrophobicContact CD2-CD1 3.83Å; L389-L605 HydrophobicContact CD2-CD2 3.92Å; L389-E606 HydrophobicContact CD1-CB 4.07Å; L389-E606 HydrophobicContact CD1-CG 4.06Å
390	E	81.4	Confident	75.4	Confident	93 Å²	93	69 Å²	69	44%	0.435	31%	0.312	S	S	.	.	H	α-helix	trans	-57.6	-45.3	174	-175.1	65.6	-156.9	0	0	112	P386 R393 K394	P386-E390 WeakPolarHBondContact O-CB 3.19Å; P386-E390 PolarHBondContact O-N 3.32Å; E390-R393 VanDerWaalsContact CD-NH1 3.27Å; E390-R393 WeakPolarHBondContact O-CB 3.34Å; E390-R393 PolarHBondContact O-N 3.35Å; E390-R393 IonicContact OE1-CZ 2.73Å; E390-R393 VanDerWaalsContact OE1-CZ 3.25Å; E390-R393 IonicContact OE1-NH1 3.45Å; E390-R393 PolarHBondContact OE1-NH1 3.35Å; E390-R393 VanDerWaalsContact OE1-NH1 3.1Å; E390-R393 IonicContact OE1-NH2 2.63Å; E390-R393 PolarHBondContact OE1-NH2 3.49Å; E390-R393 IonicContact OE2-CZ 3.78Å; E390-R393 IonicContact OE2-NE 3.69Å; E390-R393 IonicContact OE2-NH1 3.66Å; E390-R393 PolarHBondContact OE2-NH1 3.43Å; E390-R393 IonicContact OE2-NH2 2.6Å; E390-R393 PolarHBondContact OE2-NH2 3.34Å; E390-K394 WeakPolarHBondContact O-CB 3.47Å; E390-K394 PolarHBondContact O-N 3.07Å
391	Y	80.5	Confident	76.2	Confident	111 Å²	111	67 Å²	67	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-44.6	177.4	179.1	-98.1	0	0	0	112	K387 R388 L389 R393 K394 K395	K387-Y391 WeakPolarHBondContact O-CB 3.49Å; K387-Y391 PolarHBondContact O-N 3.32Å; R388-Y391 PolarHBondContact O-N 3.5Å; L389-Y391 VanDerWaalsContact C-N 3.34Å; L389-Y391 PolarHBondContact O-N 2.84Å; Y391-R393 VanDerWaalsContact C-N 3.34Å; Y391-R393 PolarHBondContact O-N 3.14Å; Y391-K394 PolarHBondContact O-N 2.59Å; Y391-K395 HydrophobicContact CD1-CG 4.25Å; Y391-K395 HydrophobicContact CE1-CG 3.77Å; Y391-K395 HydrophobicContact CE2-CG 4.17Å; Y391-K395 WeakPolarHBondContact O-CG 3.35Å; Y391-K395 PolarHBondContact O-N 3.33Å; Y391-K395 VanDerWaalsContact OH-CE 3.23Å; Y391-K395 WeakPolarHBondContact OH-CE 3.46Å
392	T	75.9	Confident	76.7	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-45	174.9	-62.1	0	0	0	0	111.2	R388 L389 K394 K395 E396 L493 L497 F598 L602	R388-T392 PolarHBondContact O-N 3.07Å; R388-T392 PolarHBondContact O-OG1 3.43Å; R388-T392 VanDerWaalsContact O-OG1 3.05Å; L389-T392 PolarHBondContact O-N 3.1Å; T392-K394 PolarHBondContact O-N 3.25Å; T392-K395 PolarHBondContact O-N 2.78Å; T392-E396 PolarHBondContact O-N 2.87Å; T392-L493 HydrophobicContact CG2-CD1 4.28Å; T392-L493 HydrophobicContact CG2-CG 4.3Å; T392-L497 HydrophobicContact CG2-CD2 4.37Å; T392-F598 HydrophobicContact CG2-CZ 3.97Å; T392-L602 HydrophobicContact CG2-CD1 4.38Å
393	R	82.8	Confident	77.1	Confident	96 Å²	96	65.1 Å²	65.1	36%	0.362	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-45.1	174.9	-175	162.2	51.5	59.1	132.6	112.1	L389 E390 Y391 E396 N397 L602	L389-R393 WeakPolarHBondContact O-CB 3.23Å; L389-R393 PolarHBondContact O-N 3.49Å; E390-R393 VanDerWaalsContact CD-NH1 3.27Å; E390-R393 WeakPolarHBondContact O-CB 3.34Å; E390-R393 PolarHBondContact O-N 3.35Å; E390-R393 IonicContact OE1-CZ 2.73Å; E390-R393 VanDerWaalsContact OE1-CZ 3.25Å; E390-R393 IonicContact OE1-NH1 3.45Å; E390-R393 PolarHBondContact OE1-NH1 3.35Å; E390-R393 VanDerWaalsContact OE1-NH1 3.1Å; E390-R393 IonicContact OE1-NH2 2.63Å; E390-R393 PolarHBondContact OE1-NH2 3.49Å; E390-R393 IonicContact OE2-CZ 3.78Å; E390-R393 IonicContact OE2-NE 3.69Å; E390-R393 IonicContact OE2-NH1 3.66Å; E390-R393 PolarHBondContact OE2-NH1 3.43Å; E390-R393 IonicContact OE2-NH2 2.6Å; E390-R393 PolarHBondContact OE2-NH2 3.34Å; Y391-R393 VanDerWaalsContact C-N 3.34Å; Y391-R393 PolarHBondContact O-N 3.14Å; R393-E396 PolarHBondContact O-N 3.27Å; R393-N397 PolarHBondContact O-N 3.28Å; R393-L602 HydrophobicContact CB-CD2 3.73Å; R393-L602 HydrophobicContact CG-CD2 4.3Å
394	K	84.1	Confident	77.7	Confident	120 Å²	120	61.5 Å²	61.5	52%	0.522	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-45.4	177.9	-177	178.9	177.4	179.4	0	111.5	E390 Y391 T392 E396 N397 E398	E390-K394 WeakPolarHBondContact O-CB 3.47Å; E390-K394 PolarHBondContact O-N 3.07Å; Y391-K394 PolarHBondContact O-N 2.59Å; T392-K394 PolarHBondContact O-N 3.25Å; K394-E396 VanDerWaalsContact C-N 3.34Å; K394-N397 PolarHBondContact O-N 2.93Å; K394-E398 VanDerWaalsContact CE-OE1 3.25Å; K394-E398 WeakPolarHBondContact CE-OE1 3.48Å; K394-E398 WeakPolarHBondContact O-CG 3.11Å; K394-E398 PolarHBondContact O-N 3.3Å
395	K	78.4	Confident	78	Confident	61 Å²	61	63 Å²	63	27%	0.265	30%	0.295	S	S	.	.	H	α-helix	trans	-63.3	-42.1	179.5	-76.3	-72.5	157.4	-153.7	0	111.6	Y391 T392 E398 L399 F489	Y391-K395 HydrophobicContact CD1-CG 4.25Å; Y391-K395 HydrophobicContact CE1-CG 3.77Å; Y391-K395 HydrophobicContact CE2-CG 4.17Å; Y391-K395 WeakPolarHBondContact O-CG 3.35Å; Y391-K395 PolarHBondContact O-N 3.33Å; Y391-K395 VanDerWaalsContact OH-CE 3.23Å; Y391-K395 WeakPolarHBondContact OH-CE 3.46Å; T392-K395 PolarHBondContact O-N 2.78Å; K395-E398 IonicContact NZ-OE1 2.71Å; K395-E398 IonicContact NZ-OE2 2.88Å; K395-E398 PolarHBondContact NZ-OE2 3.14Å; K395-E398 WeakPolarHBondContact O-CB 3.33Å; K395-E398 PolarHBondContact O-N 3.42Å; K395-L399 PolarHBondContact O-N 2.99Å; K395-L399 VanDerWaalsContact O-N 3.13Å; K395-F489 WeakPolarHBondContact O-CE2 3.22Å
396	E	79.1	Confident	77.8	Confident	15 Å²	15	64.9 Å²	64.9	7%	0.07	30%	0.303	C	S	.	.	H	α-helix	trans	-65.7	-43.5	176.9	-172.9	-88.9	170.3	0	0	113	T392 R393 K394 E398 L399 Y400 F489 L493 H595 F598	T392-E396 PolarHBondContact O-N 2.87Å; R393-E396 PolarHBondContact O-N 3.27Å; K394-E396 VanDerWaalsContact C-N 3.34Å; E396-E398 VanDerWaalsContact C-N 3.3Å; E396-E398 PolarHBondContact O-N 3.28Å; E396-L399 PolarHBondContact O-N 3.29Å; E396-L399 VanDerWaalsContact O-N 3.09Å; E396-Y400 PolarHBondContact O-N 3.43Å; E396-F489 HydrophobicContact CB-CE2 4.49Å; E396-F489 HydrophobicContact CB-CZ 3.95Å; E396-F489 HydrophobicContact CG-CZ 4.04Å; E396-L493 HydrophobicContact CB-CD1 4.19Å; E396-H595 VanDerWaalsContact CD-ND1 3.31Å; E396-H595 IonicContact OE1-CE1 2.91Å; E396-H595 IonicContact OE1-CG 2.95Å; E396-H595 IonicContact OE1-ND1 3.91Å; E396-H595 PolarHBondContact OE1-ND1 3.37Å; E396-H595 IonicContact OE2-CE1 2.76Å; E396-H595 PolarHBondContact OE2-CE1 2.87Å; E396-H595 VanDerWaalsContact OE2-CE1 3.29Å; E396-H595 IonicContact OE2-ND1 3.73Å; E396-H595 PolarHBondContact OE2-ND1 2.86Å; E396-H595 VanDerWaalsContact OE2-ND1 3.16Å; E396-F598 HydrophobicContact CB-CD1 3.97Å; E396-F598 HydrophobicContact CB-CE1 3.43Å; E396-F598 VanDerWaalsContact CB-CE1 3.43Å; E396-F598 HydrophobicContact CB-CZ 3.76Å; E396-F598 VanDerWaalsContact CD-CD1 3.41Å; E396-F598 HydrophobicContact CG-CD1 3.39Å; E396-F598 HydrophobicContact CG-CD2 4.17Å; E396-F598 HydrophobicContact CG-CE1 3.39Å; E396-F598 HydrophobicContact CG-CE2 4.14Å; E396-F598 HydrophobicContact CG-CG 3.81Å; E396-F598 HydrophobicContact CG-CZ 3.79Å
397	N	83.6	Confident	77.4	Confident	69 Å²	69	61.9 Å²	61.9	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-57	-42.5	171.7	-81.7	-3.3	0	0	0	112.3	R393 K394 L399 Y400 E401 H595	R393-N397 PolarHBondContact O-N 3.28Å; K394-N397 PolarHBondContact O-N 2.93Å; N397-L399 VanDerWaalsContact C-N 3.3Å; N397-L399 PolarHBondContact O-N 3.35Å; N397-Y400 PolarHBondContact O-N 2.85Å; N397-E401 WeakPolarHBondContact O-CB 3.33Å; N397-E401 WeakPolarHBondContact O-CG 3.33Å; N397-E401 PolarHBondContact O-N 3.46Å; N397-H595 PolarHBondContact OD1-CE1 2.77Å
398	E	80.9	Confident	77.1	Confident	86 Å²	86	58.9 Å²	58.9	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-39.6	176.6	-75.1	170.9	-169.8	0	0	111.8	K394 K395 E396 S402	K394-E398 VanDerWaalsContact CE-OE1 3.25Å; K394-E398 WeakPolarHBondContact CE-OE1 3.48Å; K394-E398 WeakPolarHBondContact O-CG 3.11Å; K394-E398 PolarHBondContact O-N 3.3Å; K395-E398 IonicContact NZ-OE1 2.71Å; K395-E398 IonicContact NZ-OE2 2.88Å; K395-E398 PolarHBondContact NZ-OE2 3.14Å; K395-E398 WeakPolarHBondContact O-CB 3.33Å; K395-E398 PolarHBondContact O-N 3.42Å; E396-E398 VanDerWaalsContact C-N 3.3Å; E396-E398 PolarHBondContact O-N 3.28Å; E398-S402 WeakPolarHBondContact O-CB 3.34Å; E398-S402 PolarHBondContact O-N 2.8Å
399	L	74.8	Confident	76.7	Confident	30 Å²	30	64.7 Å²	64.7	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-68.3	-48.9	174.8	178.8	72	0	0	0	111.5	K395 E396 N397 E401 S402 L403 F489	K395-L399 PolarHBondContact O-N 2.99Å; K395-L399 VanDerWaalsContact O-N 3.13Å; E396-L399 PolarHBondContact O-N 3.29Å; E396-L399 VanDerWaalsContact O-N 3.09Å; N397-L399 VanDerWaalsContact C-N 3.3Å; N397-L399 PolarHBondContact O-N 3.35Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.89Å; L399-S402 WeakPolarHBondContact O-CB 3.3Å; L399-S402 PolarHBondContact O-N 3.27Å; L399-S402 VanDerWaalsContact O-N 3.07Å; L399-L403 HydrophobicContact CD1-CD1 3.88Å; L399-L403 HydrophobicContact CD1-CD2 4.47Å; L399-L403 HydrophobicContact CD1-CG 3.89Å; L399-L403 HydrophobicContact CD2-CD1 3.88Å; L399-L403 HydrophobicContact CG-CD1 3.7Å; L399-L403 HydrophobicContact CG-CG 4.06Å; L399-L403 WeakPolarHBondContact O-CG 3.4Å; L399-L403 PolarHBondContact O-N 2.9Å; L399-F489 HydrophobicContact CB-CD2 3.51Å; L399-F489 HydrophobicContact CB-CE1 4.4Å; L399-F489 HydrophobicContact CB-CE2 3.42Å; L399-F489 VanDerWaalsContact CB-CE2 3.42Å; L399-F489 HydrophobicContact CB-CG 4.04Å; L399-F489 HydrophobicContact CB-CZ 3.85Å; L399-F489 HydrophobicContact CD1-CB 4.02Å; L399-F489 HydrophobicContact CD1-CD2 4.22Å; L399-F489 HydrophobicContact CD1-CG 4.04Å; L399-F489 HydrophobicContact CD2-CB 4.05Å; L399-F489 HydrophobicContact CD2-CD1 3.17Å; L399-F489 HydrophobicContact CD2-CD2 3.78Å; L399-F489 HydrophobicContact CD2-CE1 3.3Å; L399-F489 HydrophobicContact CD2-CE2 3.91Å; L399-F489 HydrophobicContact CD2-CG 3.37Å; L399-F489 HydrophobicContact CD2-CZ 3.64Å; L399-F489 HydrophobicContact CG-CB 4.49Å; L399-F489 HydrophobicContact CG-CD1 4.24Å; L399-F489 HydrophobicContact CG-CD2 3.98Å; L399-F489 HydrophobicContact CG-CE1 4.39Å; L399-F489 HydrophobicContact CG-CE2 4.18Å; L399-F489 HydrophobicContact CG-CG 3.97Å; L399-F489 HydrophobicContact CG-CZ 4.33Å
400	Y	78.4	Confident	75.9	Confident	40 Å²	40	68.2 Å²	68.2	16%	0.157	31%	0.312	C	S	.	.	H	α-helix	trans	-54.3	-49	179.7	167.5	-101	0	0	0	110.5	E396 N397 S402 L403 M404 N592 H595	E396-Y400 PolarHBondContact O-N 3.43Å; N397-Y400 PolarHBondContact O-N 2.85Å; Y400-S402 VanDerWaalsContact C-N 3.35Å; Y400-S402 PolarHBondContact O-N 2.84Å; Y400-L403 PolarHBondContact O-N 2.81Å; Y400-M404 WeakPolarHBondContact O-CB 3.46Å; Y400-M404 PolarHBondContact O-N 2.98Å; Y400-N592 WeakPolarHBondContact CE2-OD1 3.16Å; Y400-N592 PolarHBondContact OH-OD1 3.32Å; Y400-H595 HydrophobicContact CD2-CB 3.55Å; Y400-H595 AromaticContact CD2-CG 3.68Å; Y400-H595 HydrophobicContact CE2-CB 3.89Å; Y400-H595 HydrophobicContact CG-CB 4.17Å; Y400-H595 AromaticContact CG-CG 3.82Å; Y400-H595 AromaticContact CG-ND1 3.86Å
401	E	81.6	Confident	75.1	Confident	103 Å²	103	66.5 Å²	66.5	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-41.3	175.9	-74	-63.3	152.3	0	0	112.2	N397 L399 M404 N405	N397-E401 WeakPolarHBondContact O-CB 3.33Å; N397-E401 WeakPolarHBondContact O-CG 3.33Å; N397-E401 PolarHBondContact O-N 3.46Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.89Å; E401-M404 PolarHBondContact O-N 3.45Å; E401-N405 WeakPolarHBondContact O-CB 3.27Å; E401-N405 PolarHBondContact O-N 2.73Å; E401-N405 PolarHBondContact O-ND2 3.32Å
402	S	76.7	Confident	74.4	Confident	47 Å²	47	66.2 Å²	66.2	33%	0.329	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-48.1	177.4	-172.2	0	0	0	0	112.1	E398 L399 Y400 M404 N405 I406	E398-S402 WeakPolarHBondContact O-CB 3.34Å; E398-S402 PolarHBondContact O-N 2.8Å; L399-S402 WeakPolarHBondContact O-CB 3.3Å; L399-S402 PolarHBondContact O-N 3.27Å; L399-S402 VanDerWaalsContact O-N 3.07Å; Y400-S402 VanDerWaalsContact C-N 3.35Å; Y400-S402 PolarHBondContact O-N 2.84Å; S402-M404 PolarHBondContact O-N 3.37Å; S402-N405 PolarHBondContact O-N 2.83Å; S402-I406 VanDerWaalsContact O-CG1 3.29Å; S402-I406 WeakPolarHBondContact O-CG1 3.49Å; S402-I406 PolarHBondContact O-N 2.94Å
403	L	72.8	Confident	73.9	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-37	178.4	-68.6	177.5	0	0	0	111.9	L399 Y400 I406 A407 V482 L485 L591	L399-L403 HydrophobicContact CD1-CD1 3.88Å; L399-L403 HydrophobicContact CD1-CD2 4.47Å; L399-L403 HydrophobicContact CD1-CG 3.89Å; L399-L403 HydrophobicContact CD2-CD1 3.88Å; L399-L403 HydrophobicContact CG-CD1 3.7Å; L399-L403 HydrophobicContact CG-CG 4.06Å; L399-L403 WeakPolarHBondContact O-CG 3.4Å; L399-L403 PolarHBondContact O-N 2.9Å; Y400-L403 PolarHBondContact O-N 2.81Å; L403-I406 PolarHBondContact O-N 2.93Å; L403-A407 WeakPolarHBondContact O-CB 3.38Å; L403-A407 PolarHBondContact O-N 3.47Å; L403-V482 HydrophobicContact CD2-CG1 4.48Å; L403-L485 HydrophobicContact CD2-CB 4.45Å; L403-L485 HydrophobicContact CD2-CD1 4.26Å; L403-L591 HydrophobicContact CB-CD1 4.11Å; L403-L591 HydrophobicContact CB-CD2 3.72Å; L403-L591 HydrophobicContact CD1-CD2 3.68Å; L403-L591 HydrophobicContact CG-CD2 4.35Å
404	M	76.9	Confident	73	Confident	30 Å²	30	66.9 Å²	66.9	15%	0.148	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-39.4	175.5	-163.4	59.7	165.6	0	0	111.4	Y400 E401 S402 I406 A407 N408 R588	Y400-M404 WeakPolarHBondContact O-CB 3.46Å; Y400-M404 PolarHBondContact O-N 2.98Å; E401-M404 PolarHBondContact O-N 3.45Å; S402-M404 PolarHBondContact O-N 3.37Å; M404-I406 VanDerWaalsContact C-N 3.35Å; M404-I406 PolarHBondContact O-N 3.47Å; M404-A407 WeakPolarHBondContact O-CB 3.41Å; M404-A407 PolarHBondContact O-N 3.39Å; M404-N408 WeakPolarHBondContact O-CB 3.45Å; M404-N408 PolarHBondContact O-N 2.87Å; M404-N408 PolarHBondContact O-ND2 3.01Å; M404-N408 VanDerWaalsContact O-ND2 3.14Å; M404-R588 HydrophobicContact CE-CB 4.14Å; M404-R588 HydrophobicContact CE-CG 3.8Å; M404-R588 HydrophobicContact SD-CB 4.33Å; M404-R588 HydrophobicContact SD-CG 3.72Å
405	N	73.7	Confident	72.2	Confident	81 Å²	81	64.1 Å²	64.1	43%	0.433	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-37.4	172.6	-79.6	-47.1	0	0	0	112.4	E401 S402 N408 R409	E401-N405 WeakPolarHBondContact O-CB 3.27Å; E401-N405 PolarHBondContact O-N 2.73Å; E401-N405 PolarHBondContact O-ND2 3.32Å; S402-N405 PolarHBondContact O-N 2.83Å; N405-N408 PolarHBondContact O-N 3.31Å; N405-R409 WeakPolarHBondContact O-CB 3.28Å; N405-R409 PolarHBondContact O-N 3.39Å
406	I	69.2	Low	71.9	Confident	54 Å²	54	65.5 Å²	65.5	28%	0.277	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-46.5	172.1	-69.1	164.7	0	0	0	110.1	S402 L403 M404 N408 R409 K410 L485	S402-I406 VanDerWaalsContact O-CG1 3.29Å; S402-I406 WeakPolarHBondContact O-CG1 3.49Å; S402-I406 PolarHBondContact O-N 2.94Å; L403-I406 PolarHBondContact O-N 2.93Å; M404-I406 VanDerWaalsContact C-N 3.35Å; M404-I406 PolarHBondContact O-N 3.47Å; I406-N408 PolarHBondContact O-N 3.36Å; I406-R409 PolarHBondContact O-N 3.34Å; I406-K410 HydrophobicContact CG2-CG 3.87Å; I406-K410 WeakPolarHBondContact O-CB 3.39Å; I406-K410 WeakPolarHBondContact O-CG 3.36Å; I406-K410 PolarHBondContact O-N 3.46Å; I406-L485 HydrophobicContact CD1-CD1 3.18Å
407	A	65.5	Low	71.4	Confident	3 Å²	3	66.4 Å²	66.4	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-56.9	-36.8	175.7	0	0	0	0	0	112.4	L403 M404 F587 R588	L403-A407 WeakPolarHBondContact O-CB 3.38Å; L403-A407 PolarHBondContact O-N 3.47Å; M404-A407 WeakPolarHBondContact O-CB 3.41Å; M404-A407 PolarHBondContact O-N 3.39Å; A407-F587 HydrophobicContact CB-CD1 3.61Å; A407-F587 HydrophobicContact CB-CE1 3.78Å; A407-R588 HydrophobicContact CB-CG 3.96Å
408	N	70.1	Confident	70.6	Confident	87 Å²	87	63.1 Å²	63.1	47%	0.465	30%	0.3	S	S	.	.	H	α-helix	trans	-80.5	-44.4	-179.2	-69.7	-26.4	0	0	0	112.9	M404 N405 I406	M404-N408 WeakPolarHBondContact O-CB 3.45Å; M404-N408 PolarHBondContact O-N 2.87Å; M404-N408 PolarHBondContact O-ND2 3.01Å; M404-N408 VanDerWaalsContact O-ND2 3.14Å; N405-N408 PolarHBondContact O-N 3.31Å; I406-N408 PolarHBondContact O-N 3.36Å
409	R	67.1	Low	70.2	Confident	211 Å²	211	61.9 Å²	61.9	80%	0.796	30%	0.298	S	S	*	.	H	α-helix	trans	-73.6	-30.6	179.7	-76.1	178	83.4	160.5	2.5	112.9	N405 I406	N405-R409 WeakPolarHBondContact O-CB 3.28Å; N405-R409 PolarHBondContact O-N 3.39Å; I406-R409 PolarHBondContact O-N 3.34Å
410	K	60.8	Low	70.3	Confident	81 Å²	81	66 Å²	66	35%	0.352	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	1.7	-175.6	-65.3	-73.3	-174	175.2	0	114.7	I406 E412 E413 M414	I406-K410 HydrophobicContact CG2-CG 3.87Å; I406-K410 WeakPolarHBondContact O-CB 3.39Å; I406-K410 WeakPolarHBondContact O-CG 3.36Å; I406-K410 PolarHBondContact O-N 3.46Å; K410-E412 PolarHBondContact O-N 2.94Å; K410-E413 HydrophobicContact CD-CB 4Å; K410-E413 HydrophobicContact CD-CG 4.28Å; K410-E413 WeakPolarHBondContact CD-OE2 3.37Å; K410-E413 WeakPolarHBondContact CE-OE2 3.12Å; K410-E413 IonicContact NZ-OE1 2.96Å; K410-E413 IonicContact NZ-OE2 2.71Å; K410-E413 PolarHBondContact NZ-OE2 3.2Å; K410-E413 PolarHBondContact O-N 3.37Å; K410-M414 WeakPolarHBondContact O-CA 3.22Å; K410-M414 WeakPolarHBondContact O-CB 3.48Å; K410-M414 PolarHBondContact O-N 3.02Å
411	Q	64	Low	70	Confident	58 Å²	58	64.4 Å²	64.4	27%	0.271	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-37.1	179.1	-167.7	-174.8	-74.2	0	0	112.2	K415	Q411-K415 PolarHBondContact O-N 3.36Å
412	E	65.6	Low	69.5	Low	104 Å²	104	60.1 Å²	60.1	49%	0.486	29%	0.291	S	S	.	.	H	α-helix	trans	-78.3	-41.9	178.4	-154.9	62.7	-153.8	0	0	111.6	K410 M414 K415 D416	K410-E412 PolarHBondContact O-N 2.94Å; E412-M414 VanDerWaalsContact C-N 3.31Å; E412-M414 PolarHBondContact O-N 3.12Å; E412-K415 VanDerWaalsContact O-CB 3.27Å; E412-K415 WeakPolarHBondContact O-CB 3.15Å; E412-K415 PolarHBondContact O-N 3Å; E412-K415 IonicContact OE1-NZ 2.77Å; E412-K415 PolarHBondContact OE1-NZ 3.34Å; E412-D416 PolarHBondContact O-N 3.44Å
413	E	65.5	Low	69.6	Low	104 Å²	104	63.1 Å²	63.1	49%	0.486	30%	0.303	S	S	.	.	H	α-helix	trans	-66.7	-31.3	174.6	-66.8	-175.6	-144.3	0	0	113	K410 K415 D416 M417	K410-E413 HydrophobicContact CD-CB 4Å; K410-E413 HydrophobicContact CD-CG 4.28Å; K410-E413 WeakPolarHBondContact CD-OE2 3.37Å; K410-E413 WeakPolarHBondContact CE-OE2 3.12Å; K410-E413 IonicContact NZ-OE1 2.96Å; K410-E413 IonicContact NZ-OE2 2.71Å; K410-E413 PolarHBondContact NZ-OE2 3.2Å; K410-E413 PolarHBondContact O-N 3.37Å; E413-K415 VanDerWaalsContact C-N 3.34Å; E413-D416 PolarHBondContact O-N 3.18Å; E413-M417 WeakPolarHBondContact O-CB 3.49Å; E413-M417 PolarHBondContact O-N 2.9Å
414	M	64.2	Low	70	Confident	8 Å²	8	67.5 Å²	67.5	4%	0.039	33%	0.331	C	S	.	.	H	α-helix	trans	-69.8	-34.3	175.5	-171.5	177.8	-65.7	0	0	110.8	K410 E412 D416 M417 I418 L478 A580 I583	K410-M414 WeakPolarHBondContact O-CA 3.22Å; K410-M414 WeakPolarHBondContact O-CB 3.48Å; K410-M414 PolarHBondContact O-N 3.02Å; E412-M414 VanDerWaalsContact C-N 3.31Å; E412-M414 PolarHBondContact O-N 3.12Å; M414-D416 VanDerWaalsContact C-N 3.34Å; M414-M417 HydrophobicContact CB-CE 4.45Å; M414-M417 HydrophobicContact CG-CE 3.92Å; M414-I418 HydrophobicContact CG-CD1 3.92Å; M414-I418 HydrophobicContact CG-CG1 4.46Å; M414-I418 WeakPolarHBondContact O-CB 3.38Å; M414-I418 VanDerWaalsContact O-CD1 3.26Å; M414-I418 WeakPolarHBondContact O-CD1 3.23Å; M414-I418 WeakPolarHBondContact O-CG1 3.27Å; M414-I418 PolarHBondContact O-N 3.38Å; M414-L478 HydrophobicContact CE-CD1 3.41Å; M414-L478 VanDerWaalsContact CE-CD1 3.41Å; M414-L478 HydrophobicContact CE-CD2 3.45Å; M414-L478 VanDerWaalsContact CE-CD2 3.45Å; M414-L478 HydrophobicContact CE-CG 4.02Å; M414-L478 HydrophobicContact CG-CD1 4.48Å; M414-L478 HydrophobicContact SD-CD1 4.04Å; M414-A580 HydrophobicContact CB-CB 4.43Å; M414-A580 HydrophobicContact CG-CB 4.36Å; M414-I583 HydrophobicContact CE-CG2 4.28Å; M414-I583 HydrophobicContact SD-CB 3.99Å; M414-I583 HydrophobicContact SD-CG2 3.5Å; M414-I583 VanDerWaalsContact SD-CG2 3.5Å
415	K	68	Low	70.1	Confident	61 Å²	61	67.3 Å²	67.3	27%	0.265	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-47.7	169.9	-176.1	-169.1	107.4	-166.2	0	110.1	Q411 E412 E413 I418 V419 A576 A580	Q411-K415 PolarHBondContact O-N 3.36Å; E412-K415 VanDerWaalsContact O-CB 3.27Å; E412-K415 WeakPolarHBondContact O-CB 3.15Å; E412-K415 PolarHBondContact O-N 3Å; E412-K415 IonicContact OE1-NZ 2.77Å; E412-K415 PolarHBondContact OE1-NZ 3.34Å; E413-K415 VanDerWaalsContact C-N 3.34Å; K415-I418 PolarHBondContact O-N 2.86Å; K415-V419 VanDerWaalsContact O-CG2 3.31Å; K415-V419 WeakPolarHBondContact O-CG2 3.33Å; K415-V419 PolarHBondContact O-N 3.48Å; K415-A576 HydrophobicContact CG-CB 4.14Å; K415-A580 HydrophobicContact CB-CB 4.24Å
416	D	71.1	Confident	70.4	Confident	91 Å²	91	66.3 Å²	66.3	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-40.7	-179.2	-63.5	-21.1	0	0	0	111.8	E412 E413 M414 I418 V419 E420	E412-D416 PolarHBondContact O-N 3.44Å; E413-D416 PolarHBondContact O-N 3.18Å; M414-D416 VanDerWaalsContact C-N 3.34Å; D416-I418 PolarHBondContact O-N 2.96Å; D416-V419 WeakPolarHBondContact O-CB 3.38Å; D416-V419 PolarHBondContact O-N 3.4Å; D416-E420 WeakPolarHBondContact O-CB 3.42Å; D416-E420 PolarHBondContact O-N 3.16Å
417	M	69.9	Low	71.1	Confident	34 Å²	34	68.9 Å²	68.9	17%	0.167	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-36	174	-178.5	-172.6	55.4	0	0	113	E413 M414 T421 V474 K477 L478	E413-M417 WeakPolarHBondContact O-CB 3.49Å; E413-M417 PolarHBondContact O-N 2.9Å; M414-M417 HydrophobicContact CB-CE 4.45Å; M414-M417 HydrophobicContact CG-CE 3.92Å; M417-T421 WeakPolarHBondContact O-CB 3.46Å; M417-T421 PolarHBondContact O-N 3.24Å; M417-T421 PolarHBondContact O-OG1 3.29Å; M417-V474 HydrophobicContact CE-CG1 3.97Å; M417-K477 HydrophobicContact CG-CD 4.11Å; M417-K477 HydrophobicContact SD-CB 3.73Å; M417-K477 HydrophobicContact SD-CD 4.07Å; M417-L478 HydrophobicContact CE-CD1 4.03Å; M417-L478 HydrophobicContact CE-CG 3.94Å
418	I	66.1	Low	72	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-41.8	173.3	-72.6	159.8	0	0	0	109.9	M414 K415 D416 T421 L422 V474 A576 L579 A580 I583	M414-I418 HydrophobicContact CG-CD1 3.92Å; M414-I418 HydrophobicContact CG-CG1 4.46Å; M414-I418 WeakPolarHBondContact O-CB 3.38Å; M414-I418 VanDerWaalsContact O-CD1 3.26Å; M414-I418 WeakPolarHBondContact O-CD1 3.23Å; M414-I418 WeakPolarHBondContact O-CG1 3.27Å; M414-I418 PolarHBondContact O-N 3.38Å; K415-I418 PolarHBondContact O-N 2.86Å; D416-I418 PolarHBondContact O-N 2.96Å; I418-T421 PolarHBondContact O-N 2.87Å; I418-L422 HydrophobicContact CG2-CD1 3.81Å; I418-L422 HydrophobicContact CG2-CG 4.38Å; I418-L422 WeakPolarHBondContact O-CB 3.48Å; I418-L422 VanDerWaalsContact O-CG 3.28Å; I418-L422 WeakPolarHBondContact O-CG 3.12Å; I418-L422 PolarHBondContact O-N 3.43Å; I418-V474 HydrophobicContact CD1-CG1 4.41Å; I418-V474 HydrophobicContact CG1-CG1 3.88Å; I418-V474 HydrophobicContact CG1-CG2 3.78Å; I418-A576 HydrophobicContact CB-CB 4.31Å; I418-A576 HydrophobicContact CG2-CB 3.79Å; I418-L579 HydrophobicContact CD1-CB 4.35Å; I418-L579 HydrophobicContact CD1-CD2 3.85Å; I418-L579 HydrophobicContact CG1-CD2 4.17Å; I418-L579 HydrophobicContact CG2-CD2 3.92Å; I418-A580 HydrophobicContact CD1-CB 3.79Å; I418-I583 HydrophobicContact CD1-CD1 4.27Å
419	V	72.9	Confident	72.5	Confident	60 Å²	60	69.6 Å²	69.6	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-47.1	175.2	171.3	0	0	0	0	110.8	K415 D416 L422 N423 A576	K415-V419 VanDerWaalsContact O-CG2 3.31Å; K415-V419 WeakPolarHBondContact O-CG2 3.33Å; K415-V419 PolarHBondContact O-N 3.48Å; D416-V419 WeakPolarHBondContact O-CB 3.38Å; D416-V419 PolarHBondContact O-N 3.4Å; V419-L422 PolarHBondContact O-N 2.74Å; V419-N423 WeakPolarHBondContact O-CB 3.39Å; V419-N423 PolarHBondContact O-N 3.32Å; V419-N423 PolarHBondContact O-ND2 3.35Å; V419-A576 HydrophobicContact CG2-CB 3.48Å; V419-A576 VanDerWaalsContact CG2-CB 3.48Å
420	E	76.2	Confident	73.4	Confident	117 Å²	117	59.8 Å²	59.8	55%	0.547	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-46	177.7	-172.6	-175.8	-160.8	0	0	111.4	D416 N423 T424	D416-E420 WeakPolarHBondContact O-CB 3.42Å; D416-E420 PolarHBondContact O-N 3.16Å; E420-N423 PolarHBondContact O-N 3.43Å; E420-T424 PolarHBondContact O-N 3.28Å; E420-T424 PolarHBondContact O-OG1 3.48Å
421	T	73.3	Confident	74.4	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-39.9	-179.3	-55.8	0	0	0	0	111.5	M417 I418 N423 T424 M425 A473 V474 K477	M417-T421 WeakPolarHBondContact O-CB 3.46Å; M417-T421 PolarHBondContact O-N 3.24Å; M417-T421 PolarHBondContact O-OG1 3.29Å; I418-T421 PolarHBondContact O-N 2.87Å; T421-N423 VanDerWaalsContact C-N 3.33Å; T421-N423 PolarHBondContact O-N 3.48Å; T421-T424 PolarHBondContact O-N 2.98Å; T421-M425 HydrophobicContact CG2-CG 4.2Å; T421-M425 HydrophobicContact CG2-SD 3.54Å; T421-M425 VanDerWaalsContact CG2-SD 3.54Å; T421-M425 WeakPolarHBondContact O-CB 3.38Å; T421-M425 VanDerWaalsContact O-CG 3.31Å; T421-M425 WeakPolarHBondContact O-CG 3.49Å; T421-M425 PolarHBondContact O-N 3.28Å; T421-A473 HydrophobicContact CG2-CB 3.89Å; T421-V474 HydrophobicContact CG2-CG2 4.36Å; T421-K477 PolarHBondContact OG1-NZ 2.72Å
422	L	70.6	Confident	75.4	Confident	13 Å²	13	58.7 Å²	58.7	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-57.6	-45.1	170.4	-86.2	167	0	0	0	111.7	I418 V419 T424 K426 L470 I571 L574	I418-L422 HydrophobicContact CG2-CD1 3.81Å; I418-L422 HydrophobicContact CG2-CG 4.38Å; I418-L422 WeakPolarHBondContact O-CB 3.48Å; I418-L422 VanDerWaalsContact O-CG 3.28Å; I418-L422 WeakPolarHBondContact O-CG 3.12Å; I418-L422 PolarHBondContact O-N 3.43Å; V419-L422 PolarHBondContact O-N 2.74Å; L422-T424 VanDerWaalsContact C-N 3.35Å; L422-K426 WeakPolarHBondContact O-CA 3.27Å; L422-K426 VanDerWaalsContact O-CB 3.31Å; L422-K426 WeakPolarHBondContact O-CB 3.44Å; L422-K426 PolarHBondContact O-N 2.98Å; L422-L470 HydrophobicContact CD1-CD2 4.26Å; L422-L470 HydrophobicContact CD2-CD1 3.77Å; L422-L470 HydrophobicContact CD2-CD2 3.69Å; L422-L470 HydrophobicContact CD2-CG 4.31Å; L422-L470 HydrophobicContact CG-CD1 3.69Å; L422-L470 HydrophobicContact CG-CD2 3.97Å; L422-L470 HydrophobicContact CG-CG 4.49Å; L422-I571 HydrophobicContact CD2-CG2 4.33Å; L422-L574 HydrophobicContact CD2-CD1 4.19Å
423	N	77.9	Confident	76.2	Confident	111 Å²	111	53.7 Å²	53.7	59%	0.594	27%	0.272	S	S	*	.	H	α-helix	trans	-66.9	-36.6	178.8	-72.5	-26.8	0	0	0	112.2	V419 E420 T421	V419-N423 WeakPolarHBondContact O-CB 3.39Å; V419-N423 PolarHBondContact O-N 3.32Å; V419-N423 PolarHBondContact O-ND2 3.35Å; E420-N423 PolarHBondContact O-N 3.43Å; T421-N423 VanDerWaalsContact C-N 3.33Å; T421-N423 PolarHBondContact O-N 3.48Å
424	T	81.7	Confident	77.1	Confident	105 Å²	105	49 Å²	49	64%	0.644	25%	0.251	S	S	*	.	H	α-helix	trans	-73.6	-39.8	-179.3	-37.5	0	0	0	0	111.7	E420 T421 L422	E420-T424 PolarHBondContact O-N 3.28Å; E420-T424 PolarHBondContact O-OG1 3.48Å; T421-T424 PolarHBondContact O-N 2.98Å; L422-T424 VanDerWaalsContact C-N 3.35Å
425	M	78.4	Confident	78	Confident	26 Å²	26	54.1 Å²	54.1	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-88.7	-2.9	-178.2	-62.8	178.7	72	0	0	113.2	T421 E427 E428 L429 R469 A473	T421-M425 HydrophobicContact CG2-CG 4.2Å; T421-M425 HydrophobicContact CG2-SD 3.54Å; T421-M425 VanDerWaalsContact CG2-SD 3.54Å; T421-M425 WeakPolarHBondContact O-CB 3.38Å; T421-M425 VanDerWaalsContact O-CG 3.31Å; T421-M425 WeakPolarHBondContact O-CG 3.49Å; T421-M425 PolarHBondContact O-N 3.28Å; M425-E427 PolarHBondContact O-N 3.1Å; M425-E428 PolarHBondContact O-N 3.2Å; M425-L429 HydrophobicContact CB-CD1 3.91Å; M425-L429 HydrophobicContact CB-CG 4.19Å; M425-L429 WeakPolarHBondContact O-CB 3.33Å; M425-L429 VanDerWaalsContact O-CG 3.29Å; M425-L429 WeakPolarHBondContact O-CG 3.44Å; M425-L429 PolarHBondContact O-N 3.19Å; M425-R469 HydrophobicContact CE-CB 4.49Å; M425-A473 HydrophobicContact CE-CB 3.76Å; M425-A473 HydrophobicContact SD-CB 3.23Å; M425-A473 WeakPolarHBondContact SD-CB 3.39Å
426	K	80.6	Confident	78.7	Confident	59 Å²	59	53 Å²	53	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-52.6	-54.9	-172	-175.3	173	176.4	168.7	0	112	L422 E428 L429 L430 Q568 I571	L422-K426 WeakPolarHBondContact O-CA 3.27Å; L422-K426 VanDerWaalsContact O-CB 3.31Å; L422-K426 WeakPolarHBondContact O-CB 3.44Å; L422-K426 PolarHBondContact O-N 2.98Å; K426-E428 PolarHBondContact O-N 2.93Å; K426-L429 PolarHBondContact O-N 3.32Å; K426-L430 HydrophobicContact CG-CD1 4.19Å; K426-L430 WeakPolarHBondContact O-CG 3.46Å; K426-L430 PolarHBondContact O-N 2.86Å; K426-Q568 VanDerWaalsContact CE-CD 3.45Å; K426-I571 HydrophobicContact CG-CD1 4.48Å
427	E	83.4	Confident	79	Confident	109 Å²	109	57.1 Å²	57.1	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-37.8	-178.8	-70.9	-56.7	141.4	0	0	112.7	M425 L430 D431 R564	M425-E427 PolarHBondContact O-N 3.1Å; E427-L430 PolarHBondContact O-N 2.71Å; E427-D431 PolarHBondContact O-N 2.93Å; E427-R564 IonicContact OE2-NH2 2.65Å; E427-R564 PolarHBondContact OE2-NH2 3.35Å; E427-R564 VanDerWaalsContact OE2-NH2 3.1Å
428	E	84.4	Confident	79.6	Confident	103 Å²	103	56.6 Å²	56.6	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-43.4	176.7	-170.3	-173.6	165.9	0	0	111.7	M425 K426 L430 D431 D432	M425-E428 PolarHBondContact O-N 3.2Å; K426-E428 PolarHBondContact O-N 2.93Å; E428-L430 VanDerWaalsContact C-N 3.33Å; E428-L430 PolarHBondContact O-N 3.11Å; E428-D431 PolarHBondContact O-N 3.26Å; E428-D432 WeakPolarHBondContact O-CB 3.33Å; E428-D432 PolarHBondContact O-N 2.77Å
429	L	82.1	Confident	79.9	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-33.9	177.8	-69.6	167.7	0	0	0	112.3	M425 K426 A433 I466 R469 I571	M425-L429 HydrophobicContact CB-CD1 3.91Å; M425-L429 HydrophobicContact CB-CG 4.19Å; M425-L429 WeakPolarHBondContact O-CB 3.33Å; M425-L429 VanDerWaalsContact O-CG 3.29Å; M425-L429 WeakPolarHBondContact O-CG 3.44Å; M425-L429 PolarHBondContact O-N 3.19Å; K426-L429 PolarHBondContact O-N 3.32Å; L429-A433 VanDerWaalsContact O-CB 3.28Å; L429-A433 WeakPolarHBondContact O-CB 3.22Å; L429-A433 PolarHBondContact O-N 3.42Å; L429-I466 HydrophobicContact CD1-CG2 4.43Å; L429-R469 HydrophobicContact CD2-CB 3.59Å; L429-R469 HydrophobicContact CD2-CG 4.17Å; L429-I571 HydrophobicContact CB-CD1 4.15Å
430	L	83.9	Confident	79.7	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-67.6	-42	174.8	-70.7	173.8	0	0	0	111.4	K426 E427 E428 A434 R564 A567 Q568 I571	K426-L430 HydrophobicContact CG-CD1 4.19Å; K426-L430 WeakPolarHBondContact O-CG 3.46Å; K426-L430 PolarHBondContact O-N 2.86Å; E427-L430 PolarHBondContact O-N 2.71Å; E428-L430 VanDerWaalsContact C-N 3.33Å; E428-L430 PolarHBondContact O-N 3.11Å; L430-A434 WeakPolarHBondContact O-CB 3.3Å; L430-A434 PolarHBondContact O-N 3.34Å; L430-R564 HydrophobicContact CB-CG 3.85Å; L430-R564 HydrophobicContact CD2-CG 4.14Å; L430-R564 VanDerWaalsContact CD2-O 3.32Å; L430-R564 WeakPolarHBondContact CD2-O 3.36Å; L430-R564 HydrophobicContact CG-CG 4.45Å; L430-A567 HydrophobicContact CD2-CB 3.88Å; L430-Q568 HydrophobicContact CD2-CB 3.84Å; L430-I571 HydrophobicContact CD2-CD1 4.18Å; L430-I571 HydrophobicContact CG-CD1 4.36Å
431	D	83.8	Confident	79.5	Confident	68 Å²	68	64.6 Å²	64.6	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-67.8	-42.8	175.4	-78.7	-16	0	0	0	111.7	E427 E428 A433 A434 N435 R564	E427-D431 PolarHBondContact O-N 2.93Å; E428-D431 PolarHBondContact O-N 3.26Å; D431-A433 VanDerWaalsContact C-N 3.35Å; D431-A433 PolarHBondContact O-N 2.94Å; D431-A434 PolarHBondContact O-N 3.33Å; D431-N435 PolarHBondContact O-N 3.06Å; D431-N435 PolarHBondContact O-ND2 3.49Å; D431-N435 VanDerWaalsContact O-ND2 3.08Å; D431-R564 IonicContact OD1-CZ 3.1Å; D431-R564 IonicContact OD1-NH1 3.07Å; D431-R564 PolarHBondContact OD1-NH1 3.41Å; D431-R564 IonicContact OD1-NH2 3.25Å; D431-R564 PolarHBondContact OD1-NH2 3.27Å
432	D	84.1	Confident	79.2	Confident	47 Å²	47	71.9 Å²	71.9	25%	0.251	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-42.8	175.3	-85.3	-8.3	0	0	0	111.8	E428 N435 M436 L465 R469	E428-D432 WeakPolarHBondContact O-CB 3.33Å; E428-D432 PolarHBondContact O-N 2.77Å; D432-N435 PolarHBondContact O-N 2.86Å; D432-M436 PolarHBondContact O-N 2.8Å; D432-L465 HydrophobicContact CB-CD2 4.39Å; D432-R469 IonicContact OD2-CZ 3.45Å; D432-R469 IonicContact OD2-NH1 2.68Å; D432-R469 PolarHBondContact OD2-NH1 3.37Å; D432-R469 IonicContact OD2-NH2 3.72Å; D432-R469 PolarHBondContact OD2-NH2 2.79Å; D432-R469 VanDerWaalsContact OD2-NH2 3.15Å
433	A	83.1	Confident	79	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-68.3	-36.4	176.6	0	0	0	0	0	112.5	L429 D431 N435 M436 I462 K563 A567	L429-A433 VanDerWaalsContact O-CB 3.28Å; L429-A433 WeakPolarHBondContact O-CB 3.22Å; L429-A433 PolarHBondContact O-N 3.42Å; D431-A433 VanDerWaalsContact C-N 3.35Å; D431-A433 PolarHBondContact O-N 2.94Å; A433-N435 VanDerWaalsContact C-N 3.34Å; A433-M436 WeakPolarHBondContact O-CB 3.13Å; A433-M436 PolarHBondContact O-N 2.68Å; A433-I462 HydrophobicContact CB-CG2 4.16Å; A433-K563 WeakPolarHBondContact O-CB 3.4Å; A433-K563 VanDerWaalsContact O-CD 3.27Å; A433-K563 WeakPolarHBondContact O-CD 3.49Å; A433-A567 HydrophobicContact CB-CB 3.45Å; A433-A567 VanDerWaalsContact CB-CB 3.45Å
434	A	83.2	Confident	78.3	Confident	5 Å²	5	71.1 Å²	71.1	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-43.5	175	0	0	0	0	0	111.1	L430 D431 M436 L560 K563	L430-A434 WeakPolarHBondContact O-CB 3.3Å; L430-A434 PolarHBondContact O-N 3.34Å; D431-A434 PolarHBondContact O-N 3.33Å; A434-M436 VanDerWaalsContact C-N 3.29Å; A434-M436 PolarHBondContact O-N 3.35Å; A434-L560 HydrophobicContact CB-CD2 3.99Å; A434-L560 VanDerWaalsContact O-CD2 3.26Å; A434-L560 WeakPolarHBondContact O-CD2 3.35Å; A434-K563 WeakPolarHBondContact O-CD 3.26Å; A434-K563 PolarHBondContact O-NZ 3.03Å
435	N	83.8	Confident	77.2	Confident	116 Å²	116	75.3 Å²	75.3	62%	0.62	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	0.6	-178.4	-62.8	-38.1	0	0	0	113.9	D431 D432 A433 E437	D431-N435 PolarHBondContact O-N 3.06Å; D431-N435 PolarHBondContact O-ND2 3.49Å; D431-N435 VanDerWaalsContact O-ND2 3.08Å; D432-N435 PolarHBondContact O-N 2.86Å; A433-N435 VanDerWaalsContact C-N 3.34Å; N435-E437 PolarHBondContact O-N 3.37Å
436	M	81.5	Confident	76.2	Confident	36 Å²	36	80.9 Å²	80.9	18%	0.177	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-68.4	130	-177.2	-173.4	179.6	-168.6	0	0	112.4	D432 A433 A434 F438 Q461 I462 L465 K563	D432-M436 PolarHBondContact O-N 2.8Å; A433-M436 WeakPolarHBondContact O-CB 3.13Å; A433-M436 PolarHBondContact O-N 2.68Å; A434-M436 VanDerWaalsContact C-N 3.29Å; A434-M436 PolarHBondContact O-N 3.35Å; M436-F438 HydrophobicContact SD-CE1 4.34Å; M436-Q461 HydrophobicContact CE-CB 3.86Å; M436-I462 HydrophobicContact SD-CG1 4.05Å; M436-L465 HydrophobicContact CB-CD2 4.44Å; M436-L465 HydrophobicContact CE-CB 4.27Å; M436-L465 HydrophobicContact CE-CD2 4.47Å; M436-L465 HydrophobicContact CG-CD2 4.32Å; M436-L465 HydrophobicContact SD-CB 4.29Å; M436-L465 HydrophobicContact SD-CD2 3.78Å; M436-K563 PolarHBondContact O-NZ 3.44Å
437	E	79.3	Confident	75.1	Confident	179 Å²	179	80.3 Å²	80.3	84%	0.836	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-89.3	131.1	166.3	-66.2	-177.7	177.4	0	0	110.2	N435	N435-E437 PolarHBondContact O-N 3.37Å
438	F	81.8	Confident	73.9	Confident	22 Å²	22	81.6 Å²	81.6	10%	0.096	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-83.1	131.2	-178.8	-65.5	-65.7	0	0	0	110.9	M436 V441 V443 C458 Q461 I462 I558 W562 K563	M436-F438 HydrophobicContact SD-CE1 4.34Å; F438-V441 HydrophobicContact CB-CB 4.01Å; F438-V441 HydrophobicContact CB-CG2 4.46Å; F438-V443 HydrophobicContact CD2-CG2 4.18Å; F438-C458 HydrophobicContact CD1-CB 3.85Å; F438-C458 HydrophobicContact CD2-CB 4.32Å; F438-C458 HydrophobicContact CE1-CB 3.52Å; F438-C458 WeakPolarHBondContact CE1-O 3.27Å; F438-C458 HydrophobicContact CE2-CB 4.02Å; F438-C458 HydrophobicContact CG-CB 4.24Å; F438-C458 HydrophobicContact CZ-CB 3.62Å; F438-Q461 HydrophobicContact CD1-CB 4.16Å; F438-Q461 HydrophobicContact CE1-CB 4.46Å; F438-I462 HydrophobicContact CE1-CD1 3.94Å; F438-I462 HydrophobicContact CE1-CG1 3.87Å; F438-I462 HydrophobicContact CZ-CD1 3.71Å; F438-I462 HydrophobicContact CZ-CG1 4.11Å; F438-I558 HydrophobicContact CD2-CG2 4.33Å; F438-I558 HydrophobicContact CE2-CD1 4.38Å; F438-I558 HydrophobicContact CE2-CG2 3.6Å; F438-W562 HydrophobicContact CZ-CZ3 4.27Å; F438-K563 HydrophobicContact CE2-CD 4.03Å; F438-K563 HydrophobicContact CE2-CG 4.23Å; F438-K563 HydrophobicContact CZ-CD 4.09Å; F438-K563 HydrophobicContact CZ-CG 4.1Å
439	K	72.7	Confident	72.5	Confident	157 Å²	157	80.9 Å²	80.9	68%	0.683	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	136.7	171.8	-65.8	-177.2	178.5	-179.7	0	109.7	V441 Q461	K439-V441 PolarHBondContact O-N 3.48Å; K439-Q461 PolarHBondContact O-NE2 3.35Å
440	D	68.9	Low	71.8	Confident	171 Å²	171	81.9 Å²	81.9	91%	0.914	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	24	175.3	-48.8	-45.4	0	0	0	115.1
441	V	71.5	Confident	71	Confident	17 Å²	17	83.4 Å²	83.4	10%	0.103	45%	0.447	C	S	.	.			trans	-131.9	118.6	173.1	-177.4	0	0	0	0	109.2	F438 K439 V443 E454	F438-V441 HydrophobicContact CB-CB 4.01Å; F438-V441 HydrophobicContact CB-CG2 4.46Å; K439-V441 PolarHBondContact O-N 3.48Å; V441-V443 PolarHBondContact O-N 2.98Å; V441-E454 HydrophobicContact CG1-CB 4.14Å
442	I	66.3	Low	70.2	Confident	159 Å²	159	85 Å²	85	82%	0.815	46%	0.46	S	S	*	.			trans	-84.3	114.1	174.6	-57.4	173.5	0	0	0	107.7	P444	I442-P444 WeakPolarHBondContact O-CD 3.37Å
443	V	66.1	Low	69.5	Low	59 Å²	59	92.4 Å²	92.4	36%	0.358	48%	0.484	S	S	.	.			trans	-90.1	112.7	175	-176.1	0	0	0	0	108.1	F438 V441 I450 I558	F438-V443 HydrophobicContact CD2-CG2 4.18Å; V441-V443 PolarHBondContact O-N 2.98Å; V443-I450 HydrophobicContact CG1-CD1 4.36Å; V443-I558 HydrophobicContact CG1-CB 4.11Å; V443-I558 HydrophobicContact CG1-CG2 4.32Å; V443-I558 HydrophobicContact CG2-CD1 4.38Å; V443-I558 HydrophobicContact CG2-CG2 4.38Å
444	P	64.8	Low	69	Low	48 Å²	48	96.1 Å²	96.1	31%	0.312	50%	0.502	S	S	.	.			trans	-70.4	134.6	-179.9	25.5	-30.2	0	0	0	111.5	I442 N446 E448 I450	I442-P444 WeakPolarHBondContact O-CD 3.37Å; P444-N446 PolarHBondContact O-N 2.88Å; P444-N446 VanDerWaalsContact O-N 3.17Å; P444-E448 HydrophobicContact CG-CB 4.19Å; P444-I450 HydrophobicContact CG-CG1 4.38Å
445	E	58.1	Low	68.5	Low	193 Å²	193	96.8 Å²	96.8	90%	0.902	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.8	-176.2	-67.7	-178.6	163.9	0	0	114
446	N	57.7	Low	67.9	Low	143 Å²	143	96.3 Å²	96.3	77%	0.765	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	12	-169.4	-64	-11.5	0	0	0	115.1	P444 E448	P444-N446 PolarHBondContact O-N 2.88Å; P444-N446 VanDerWaalsContact O-N 3.17Å; N446-E448 VanDerWaalsContact C-N 3.32Å; N446-E448 PolarHBondContact O-N 3Å
447	G	56.2	Low	67.6	Low	47 Å²	47	95.8 Å²	95.8	49%	0.485	50%	0.497	S	S	.	.			trans	70.5	25.3	179	0	0	0	0	0	114.4	T557	G447-T557 WeakPolarHBondContact O-CG2 3.47Å
448	E	59.4	Low	67.5	Low	137 Å²	137	87.2 Å²	87.2	64%	0.64	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-76.3	150.6	171.7	-72.4	-171.5	167.8	0	0	112.2	P444 N446	P444-E448 HydrophobicContact CG-CB 4.19Å; N446-E448 VanDerWaalsContact C-N 3.32Å; N446-E448 PolarHBondContact O-N 3Å
449	T	55.2	Low	67.2	Low	88 Å²	88	86.2 Å²	86.2	54%	0.54	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-78.5	123.7	-172.6	59.9	0	0	0	0	111.6	P555	T449-P555 HydrophobicContact CG2-CB 3.51Å; T449-P555 HydrophobicContact CG2-CG 3.73Å
450	I	66.7	Low	67.2	Low	22 Å²	22	84.4 Å²	84.4	11%	0.113	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-82.3	149.5	-179.6	-66.2	167.4	0	0	0	110.6	V443 P444 E454 I455 I558	V443-I450 HydrophobicContact CG1-CD1 4.36Å; P444-I450 HydrophobicContact CG-CG1 4.38Å; I450-E454 HydrophobicContact CG2-CB 3.32Å; I450-E454 HydrophobicContact CG2-CG 4.14Å; I450-I455 HydrophobicContact CB-CG1 4.34Å; I450-I455 HydrophobicContact CG2-CG1 4.19Å; I450-I455 WeakPolarHBondContact O-CD1 3.47Å; I450-I558 HydrophobicContact CD1-CB 4.24Å; I450-I558 HydrophobicContact CD1-CD1 3.26Å; I450-I558 HydrophobicContact CD1-CG1 3.66Å
451	G	66.7	Low	67.7	Low	37 Å²	37	77.3 Å²	77.3	38%	0.381	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-62.2	154.7	178	0	0	0	0	0	113.9	R453 E454 I455	G451-R453 PolarHBondContact O-N 2.78Å; G451-E454 WeakPolarHBondContact CA-OE2 3.41Å; G451-E454 PolarHBondContact O-N 3.27Å; G451-E454 VanDerWaalsContact O-OE2 3.14Å; G451-I455 WeakPolarHBondContact O-CG1 3.5Å; G451-I455 PolarHBondContact O-N 3.01Å; G451-I455 VanDerWaalsContact O-N 3.07Å
452	T	66.8	Low	68	Low	102 Å²	102	76.5 Å²	76.5	63%	0.626	40%	0.398	S	S	*	.	H	α-helix	trans	-65.7	-18.9	-176.6	49	0	0	0	0	113.9	K456	T452-K456 WeakPolarHBondContact O-CD 3.43Å; T452-K456 VanDerWaalsContact O-CG 3.25Å; T452-K456 WeakPolarHBondContact O-CG 3.25Å; T452-K456 PolarHBondContact O-N 3.48Å
453	R	69.5	Low	68.2	Low	203 Å²	203	69.3 Å²	69.3	77%	0.766	36%	0.361	S	S	*	.	H	α-helix	trans	-80.5	-38.5	177.6	-174	-179.5	177.1	177.4	-2.5	111.3	G451 K456 S457	G451-R453 PolarHBondContact O-N 2.78Å; R453-K456 WeakPolarHBondContact O-CB 3.41Å; R453-K456 PolarHBondContact O-N 3.15Å; R453-S457 PolarHBondContact O-N 3.4Å; R453-S457 VanDerWaalsContact O-N 3.12Å
454	E	72.1	Confident	68.5	Low	77 Å²	77	71.1 Å²	71.1	36%	0.36	37%	0.365	S	S	.	.	H	α-helix	trans	-72.3	-42.8	178.5	-63.7	71.9	-154.1	0	0	110.1	V441 I450 G451 K456 S457 C458	V441-E454 HydrophobicContact CG1-CB 4.14Å; I450-E454 HydrophobicContact CG2-CB 3.32Å; I450-E454 HydrophobicContact CG2-CG 4.14Å; G451-E454 WeakPolarHBondContact CA-OE2 3.41Å; G451-E454 PolarHBondContact O-N 3.27Å; G451-E454 VanDerWaalsContact O-OE2 3.14Å; E454-K456 VanDerWaalsContact C-N 3.29Å; E454-K456 PolarHBondContact O-N 3.29Å; E454-S457 WeakPolarHBondContact O-CA 3.4Å; E454-S457 VanDerWaalsContact O-CB 3.31Å; E454-S457 WeakPolarHBondContact O-CB 3.47Å; E454-S457 PolarHBondContact O-N 3.42Å; E454-C458 PolarHBondContact O-N 3.18Å; E454-C458 PolarHBondContact O-SG 3.04Å; E454-C458 VanDerWaalsContact O-SG 3.32Å
455	I	74.1	Confident	69.1	Low	20 Å²	20	70.8 Å²	70.8	10%	0.103	36%	0.361	C	S	.	.	H	α-helix	trans	-57.2	-42.3	171.7	-68.4	168.8	0	0	0	111.1	I450 G451 S457 C458 I459 P556 W562	I450-I455 HydrophobicContact CB-CG1 4.34Å; I450-I455 HydrophobicContact CG2-CG1 4.19Å; I450-I455 WeakPolarHBondContact O-CD1 3.47Å; G451-I455 WeakPolarHBondContact O-CG1 3.5Å; G451-I455 PolarHBondContact O-N 3.01Å; G451-I455 VanDerWaalsContact O-N 3.07Å; I455-S457 VanDerWaalsContact C-N 3.3Å; I455-S457 PolarHBondContact O-N 3.3Å; I455-C458 PolarHBondContact O-N 3.33Å; I455-I459 HydrophobicContact CG2-CD1 3.87Å; I455-I459 HydrophobicContact CG2-CG1 4.46Å; I455-I459 WeakPolarHBondContact O-CG1 3.27Å; I455-I459 PolarHBondContact O-N 3.48Å; I455-P556 HydrophobicContact CD1-CG 3.99Å; I455-W562 HydrophobicContact CG2-CH2 4.48Å; I455-W562 HydrophobicContact CG2-CZ2 4.06Å
456	K	71	Confident	69.9	Low	105 Å²	105	61.7 Å²	61.7	46%	0.457	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-38.1	174.4	-81.6	172.7	-176.6	175.6	0	112.6	T452 R453 E454 R460 I547	T452-K456 WeakPolarHBondContact O-CD 3.43Å; T452-K456 VanDerWaalsContact O-CG 3.25Å; T452-K456 WeakPolarHBondContact O-CG 3.25Å; T452-K456 PolarHBondContact O-N 3.48Å; R453-K456 WeakPolarHBondContact O-CB 3.41Å; R453-K456 PolarHBondContact O-N 3.15Å; E454-K456 VanDerWaalsContact C-N 3.29Å; E454-K456 PolarHBondContact O-N 3.29Å; K456-R460 WeakPolarHBondContact O-CB 3.11Å; K456-R460 PolarHBondContact O-N 2.79Å; K456-R460 VanDerWaalsContact O-N 3.14Å; K456-I547 HydrophobicContact CD-CD1 4.22Å; K456-I547 HydrophobicContact CG-CD1 3.57Å
457	S	75.4	Confident	70.4	Confident	25 Å²	25	55.2 Å²	55.2	18%	0.175	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-43.8	175.9	-165.9	0	0	0	0	111.4	R453 E454 I455 R460 Q461	R453-S457 PolarHBondContact O-N 3.4Å; R453-S457 VanDerWaalsContact O-N 3.12Å; E454-S457 WeakPolarHBondContact O-CA 3.4Å; E454-S457 VanDerWaalsContact O-CB 3.31Å; E454-S457 WeakPolarHBondContact O-CB 3.47Å; E454-S457 PolarHBondContact O-N 3.42Å; I455-S457 VanDerWaalsContact C-N 3.3Å; I455-S457 PolarHBondContact O-N 3.3Å; S457-R460 WeakPolarHBondContact O-CB 3.41Å; S457-R460 PolarHBondContact O-N 3.35Å; S457-Q461 WeakPolarHBondContact O-CG 3.49Å; S457-Q461 PolarHBondContact O-N 2.85Å; S457-Q461 PolarHBondContact OG-NE2 3.01Å
458	C	77.1	Confident	71	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.6	-45.5	177.9	-64.6	0	0	0	0	112.6	F438 E454 I455 R460 Q461 I462 I558 W562	F438-C458 HydrophobicContact CD1-CB 3.85Å; F438-C458 HydrophobicContact CD2-CB 4.32Å; F438-C458 HydrophobicContact CE1-CB 3.52Å; F438-C458 WeakPolarHBondContact CE1-O 3.27Å; F438-C458 HydrophobicContact CE2-CB 4.02Å; F438-C458 HydrophobicContact CG-CB 4.24Å; F438-C458 HydrophobicContact CZ-CB 3.62Å; E454-C458 PolarHBondContact O-N 3.18Å; E454-C458 PolarHBondContact O-SG 3.04Å; E454-C458 VanDerWaalsContact O-SG 3.32Å; I455-C458 PolarHBondContact O-N 3.33Å; C458-R460 VanDerWaalsContact C-N 3.3Å; C458-R460 PolarHBondContact O-N 2.78Å; C458-Q461 PolarHBondContact O-N 2.98Å; C458-I462 PolarHBondContact O-N 3Å; C458-I558 HydrophobicContact CB-CD1 4.4Å; C458-W562 HydrophobicContact CB-CH2 4.07Å; C458-W562 HydrophobicContact CB-CZ3 4.3Å
459	I	75.1	Confident	71.7	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-59.8	-43.2	175.9	-67.1	167.7	0	0	0	110.5	I455 I462 Q463 I547 W562 V566	I455-I459 HydrophobicContact CG2-CD1 3.87Å; I455-I459 HydrophobicContact CG2-CG1 4.46Å; I455-I459 WeakPolarHBondContact O-CG1 3.27Å; I455-I459 PolarHBondContact O-N 3.48Å; I459-I462 PolarHBondContact O-N 3.43Å; I459-Q463 WeakPolarHBondContact O-CG 2.88Å; I459-Q463 PolarHBondContact O-N 3.05Å; I459-Q463 VanDerWaalsContact O-N 3.1Å; I459-I547 HydrophobicContact CD1-CG1 4.08Å; I459-W562 HydrophobicContact CG1-CH2 4.15Å; I459-W562 HydrophobicContact CG1-CZ2 4.21Å; I459-V566 HydrophobicContact CB-CG1 4.47Å; I459-V566 HydrophobicContact CG1-CG1 4.03Å; I459-V566 HydrophobicContact CG2-CG1 4.35Å
460	R	72.7	Confident	72.4	Confident	118 Å²	118	49.2 Å²	49.2	45%	0.445	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-44.4	177.1	-177.6	-178.7	63.4	-174.8	0.2	111.7	K456 S457 C458 Q463 E464	K456-R460 WeakPolarHBondContact O-CB 3.11Å; K456-R460 PolarHBondContact O-N 2.79Å; K456-R460 VanDerWaalsContact O-N 3.14Å; S457-R460 WeakPolarHBondContact O-CB 3.41Å; S457-R460 PolarHBondContact O-N 3.35Å; C458-R460 VanDerWaalsContact C-N 3.3Å; C458-R460 PolarHBondContact O-N 2.78Å; R460-Q463 PolarHBondContact O-N 3.38Å; R460-E464 WeakPolarHBondContact O-CG 3.23Å; R460-E464 PolarHBondContact O-N 3.12Å
461	Q	78.7	Confident	72.4	Confident	22 Å²	22	48.9 Å²	48.9	10%	0.103	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-41	-179.8	-73.2	-176.7	56	0	0	112.7	M436 F438 K439 S457 C458 Q463 E464 L465	M436-Q461 HydrophobicContact CE-CB 3.86Å; F438-Q461 HydrophobicContact CD1-CB 4.16Å; F438-Q461 HydrophobicContact CE1-CB 4.46Å; K439-Q461 PolarHBondContact O-NE2 3.35Å; S457-Q461 WeakPolarHBondContact O-CG 3.49Å; S457-Q461 PolarHBondContact O-N 2.85Å; S457-Q461 PolarHBondContact OG-NE2 3.01Å; C458-Q461 PolarHBondContact O-N 2.98Å; Q461-Q463 VanDerWaalsContact C-N 3.35Å; Q461-Q463 PolarHBondContact O-N 3.42Å; Q461-E464 PolarHBondContact O-N 3.31Å; Q461-L465 PolarHBondContact O-N 2.83Å
462	I	77.8	Confident	72.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-43.8	173.9	-75.3	161.9	0	0	0	111	A433 M436 F438 C458 I459 L465 I466 W562 K563 V566 A567	A433-I462 HydrophobicContact CB-CG2 4.16Å; M436-I462 HydrophobicContact SD-CG1 4.05Å; F438-I462 HydrophobicContact CE1-CD1 3.94Å; F438-I462 HydrophobicContact CE1-CG1 3.87Å; F438-I462 HydrophobicContact CZ-CD1 3.71Å; F438-I462 HydrophobicContact CZ-CG1 4.11Å; C458-I462 PolarHBondContact O-N 3Å; I459-I462 PolarHBondContact O-N 3.43Å; I462-L465 WeakPolarHBondContact O-CB 3.25Å; I462-L465 PolarHBondContact O-N 3.44Å; I462-I466 HydrophobicContact CG2-CD1 3.74Å; I462-I466 WeakPolarHBondContact O-CG1 3.25Å; I462-I466 PolarHBondContact O-N 3.29Å; I462-I466 VanDerWaalsContact O-N 3.07Å; I462-W562 HydrophobicContact CD1-CZ3 4.43Å; I462-K563 HydrophobicContact CD1-CB 4.19Å; I462-K563 HydrophobicContact CD1-CG 4.32Å; I462-V566 HydrophobicContact CD1-CB 4.31Å; I462-V566 HydrophobicContact CD1-CG1 3.99Å; I462-V566 HydrophobicContact CG2-CG1 4.31Å; I462-A567 HydrophobicContact CG2-CB 3.92Å
463	Q	71.8	Confident	72.6	Confident	9 Å²	9	48.6 Å²	48.6	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-42.3	178.4	-73.7	179.9	-19	0	0	112.1	I459 R460 Q461 L465 I466 I467 A570	I459-Q463 WeakPolarHBondContact O-CG 2.88Å; I459-Q463 PolarHBondContact O-N 3.05Å; I459-Q463 VanDerWaalsContact O-N 3.1Å; R460-Q463 PolarHBondContact O-N 3.38Å; Q461-Q463 VanDerWaalsContact C-N 3.35Å; Q461-Q463 PolarHBondContact O-N 3.42Å; Q463-L465 VanDerWaalsContact C-N 3.31Å; Q463-L465 PolarHBondContact O-N 3.03Å; Q463-I466 PolarHBondContact O-N 3.1Å; Q463-I467 WeakPolarHBondContact O-CB 3.47Å; Q463-I467 WeakPolarHBondContact O-CD1 3.27Å; Q463-I467 WeakPolarHBondContact O-CG1 3.38Å; Q463-I467 PolarHBondContact O-N 3.32Å; Q463-A570 HydrophobicContact CG-CB 3.84Å
464	E	71.2	Confident	72.4	Confident	97 Å²	97	39 Å²	39	45%	0.453	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-40.4	175.3	-77.4	173.5	-174.9	0	0	112.1	R460 Q461 S468	R460-E464 WeakPolarHBondContact O-CG 3.23Å; R460-E464 PolarHBondContact O-N 3.12Å; Q461-E464 PolarHBondContact O-N 3.31Å; E464-S468 WeakPolarHBondContact O-CB 3.39Å; E464-S468 PolarHBondContact O-N 3.02Å
465	L	78.6	Confident	71.9	Confident	41 Å²	41	35.6 Å²	35.6	22%	0.215	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-51.1	174.8	178.8	68	0	0	0	111.7	D432 M436 Q461 I462 Q463 I467 S468 R469	D432-L465 HydrophobicContact CB-CD2 4.39Å; M436-L465 HydrophobicContact CB-CD2 4.44Å; M436-L465 HydrophobicContact CE-CB 4.27Å; M436-L465 HydrophobicContact CE-CD2 4.47Å; M436-L465 HydrophobicContact CG-CD2 4.32Å; M436-L465 HydrophobicContact SD-CB 4.29Å; M436-L465 HydrophobicContact SD-CD2 3.78Å; Q461-L465 PolarHBondContact O-N 2.83Å; I462-L465 WeakPolarHBondContact O-CB 3.25Å; I462-L465 PolarHBondContact O-N 3.44Å; Q463-L465 VanDerWaalsContact C-N 3.31Å; Q463-L465 PolarHBondContact O-N 3.03Å; L465-I467 PolarHBondContact O-N 2.92Å; L465-S468 PolarHBondContact O-N 2.83Å; L465-R469 HydrophobicContact CD1-CG 4.47Å; L465-R469 PolarHBondContact O-N 3.25Å
466	I	74.8	Confident	71.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-44.8	-178.3	-67.9	165	0	0	0	110.9	L429 I462 Q463 L470 A567 A570 I571 L574	L429-I466 HydrophobicContact CD1-CG2 4.43Å; I462-I466 HydrophobicContact CG2-CD1 3.74Å; I462-I466 WeakPolarHBondContact O-CG1 3.25Å; I462-I466 PolarHBondContact O-N 3.29Å; I462-I466 VanDerWaalsContact O-N 3.07Å; Q463-I466 PolarHBondContact O-N 3.1Å; I466-L470 WeakPolarHBondContact O-CB 3.5Å; I466-L470 PolarHBondContact O-N 2.96Å; I466-A567 HydrophobicContact CD1-CB 3.81Å; I466-A570 HydrophobicContact CD1-CB 3.9Å; I466-I571 HydrophobicContact CD1-CG1 4.31Å; I466-I571 HydrophobicContact CG2-CG1 4.06Å; I466-L574 HydrophobicContact CG2-CD1 3.99Å
467	I	67.9	Low	71.2	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-42.4	179.3	-64.9	155.1	0	0	0	111	Q463 L465 L470 N471 V535 L539	Q463-I467 WeakPolarHBondContact O-CB 3.47Å; Q463-I467 WeakPolarHBondContact O-CD1 3.27Å; Q463-I467 WeakPolarHBondContact O-CG1 3.38Å; Q463-I467 PolarHBondContact O-N 3.32Å; L465-I467 PolarHBondContact O-N 2.92Å; I467-L470 PolarHBondContact O-N 3.49Å; I467-N471 WeakPolarHBondContact CG2-ND2 3.2Å; I467-N471 WeakPolarHBondContact O-CB 3.45Å; I467-N471 PolarHBondContact O-N 3.28Å; I467-N471 PolarHBondContact O-ND2 3.1Å; I467-V535 HydrophobicContact CG2-CG1 4.35Å; I467-L539 HydrophobicContact CD1-CD1 3.11Å; I467-L539 HydrophobicContact CG1-CD1 4.09Å
468	S	68.9	Low	70.5	Confident	61 Å²	61	39 Å²	39	43%	0.427	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-50.3	179.2	-174.5	0	0	0	0	110.7	E464 L465 N471 Q472	E464-S468 WeakPolarHBondContact O-CB 3.39Å; E464-S468 PolarHBondContact O-N 3.02Å; L465-S468 PolarHBondContact O-N 2.83Å; S468-N471 PolarHBondContact O-N 3.36Å; S468-Q472 WeakPolarHBondContact O-CB 3.29Å; S468-Q472 PolarHBondContact O-N 3.08Å
469	R	72.9	Confident	69.7	Low	83 Å²	83	41.4 Å²	41.4	31%	0.313	20%	0.202	S	C	.	.	H	α-helix	trans	-65.1	-41.5	178.4	-73.3	-64.3	-168.7	85.3	13.6	112.8	M425 L429 D432 L465 Q472 A473	M425-R469 HydrophobicContact CE-CB 4.49Å; L429-R469 HydrophobicContact CD2-CB 3.59Å; L429-R469 HydrophobicContact CD2-CG 4.17Å; D432-R469 IonicContact OD2-CZ 3.45Å; D432-R469 IonicContact OD2-NH1 2.68Å; D432-R469 PolarHBondContact OD2-NH1 3.37Å; D432-R469 IonicContact OD2-NH2 3.72Å; D432-R469 PolarHBondContact OD2-NH2 2.79Å; D432-R469 VanDerWaalsContact OD2-NH2 3.15Å; L465-R469 HydrophobicContact CD1-CG 4.47Å; L465-R469 PolarHBondContact O-N 3.25Å; R469-Q472 PolarHBondContact O-N 3.36Å; R469-A473 PolarHBondContact O-N 2.86Å
470	L	70.8	Confident	69	Low	1 Å²	1	45 Å²	45	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-46.7	177.3	-179.1	65.2	0	0	0	111.9	L422 I466 I467 Q472 A473 V474 L574 L579	L422-L470 HydrophobicContact CD1-CD2 4.26Å; L422-L470 HydrophobicContact CD2-CD1 3.77Å; L422-L470 HydrophobicContact CD2-CD2 3.69Å; L422-L470 HydrophobicContact CD2-CG 4.31Å; L422-L470 HydrophobicContact CG-CD1 3.69Å; L422-L470 HydrophobicContact CG-CD2 3.97Å; L422-L470 HydrophobicContact CG-CG 4.49Å; I466-L470 WeakPolarHBondContact O-CB 3.5Å; I466-L470 PolarHBondContact O-N 2.96Å; I467-L470 PolarHBondContact O-N 3.49Å; L470-Q472 VanDerWaalsContact C-N 3.25Å; L470-Q472 PolarHBondContact O-N 3.22Å; L470-A473 PolarHBondContact O-N 3.17Å; L470-V474 HydrophobicContact CD1-CG2 4Å; L470-V474 HydrophobicContact CG-CG2 4.33Å; L470-V474 WeakPolarHBondContact O-CB 3.47Å; L470-V474 VanDerWaalsContact O-CG2 3.23Å; L470-V474 WeakPolarHBondContact O-CG2 3.28Å; L470-V474 PolarHBondContact O-N 3.49Å; L470-L574 HydrophobicContact CD2-CD1 4.18Å; L470-L579 HydrophobicContact CD2-CD1 4.31Å; L470-L579 HydrophobicContact CD2-CD2 3.77Å; L470-L579 HydrophobicContact CG-CD2 4.26Å
471	N	66.6	Low	68.3	Low	16 Å²	16	43.4 Å²	43.4	9%	0.086	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-40.9	176.5	-76.5	-20.2	0	0	0	110.7	I467 S468 A475	I467-N471 WeakPolarHBondContact CG2-ND2 3.2Å; I467-N471 WeakPolarHBondContact O-CB 3.45Å; I467-N471 PolarHBondContact O-N 3.28Å; I467-N471 PolarHBondContact O-ND2 3.1Å; S468-N471 PolarHBondContact O-N 3.36Å; N471-A475 WeakPolarHBondContact O-CB 3.4Å; N471-A475 PolarHBondContact O-N 3.23Å
472	Q	68.1	Low	67.5	Low	112 Å²	112	43 Å²	43	52%	0.523	23%	0.233	S	C	.	.	H	α-helix	trans	-66.5	-43.7	178.9	-167.9	172.3	13.3	0	0	112.7	S468 R469 L470 A475 N476	S468-Q472 WeakPolarHBondContact O-CB 3.29Å; S468-Q472 PolarHBondContact O-N 3.08Å; R469-Q472 PolarHBondContact O-N 3.36Å; L470-Q472 VanDerWaalsContact C-N 3.25Å; L470-Q472 PolarHBondContact O-N 3.22Å; Q472-A475 WeakPolarHBondContact O-CB 3.45Å; Q472-A475 PolarHBondContact O-N 3.42Å; Q472-N476 PolarHBondContact O-N 3.11Å; Q472-N476 PolarHBondContact O-ND2 2.93Å
473	A	69.6	Low	66.8	Low	21 Å²	21	44.9 Å²	44.9	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-69	-41.1	179.1	0	0	0	0	0	113	T421 M425 R469 L470 A475 N476 K477	T421-A473 HydrophobicContact CG2-CB 3.89Å; M425-A473 HydrophobicContact CE-CB 3.76Å; M425-A473 HydrophobicContact SD-CB 3.23Å; M425-A473 WeakPolarHBondContact SD-CB 3.39Å; R469-A473 PolarHBondContact O-N 2.86Å; L470-A473 PolarHBondContact O-N 3.17Å; A473-A475 VanDerWaalsContact C-N 3.35Å; A473-N476 PolarHBondContact O-N 3.46Å; A473-K477 PolarHBondContact O-N 3.45Å
474	V	65.8	Low	66.3	Low	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-39.6	176.2	173.5	0	0	0	0	110.6	M417 I418 T421 L470 K477 L478 I583	M417-V474 HydrophobicContact CE-CG1 3.97Å; I418-V474 HydrophobicContact CD1-CG1 4.41Å; I418-V474 HydrophobicContact CG1-CG1 3.88Å; I418-V474 HydrophobicContact CG1-CG2 3.78Å; T421-V474 HydrophobicContact CG2-CG2 4.36Å; L470-V474 HydrophobicContact CD1-CG2 4Å; L470-V474 HydrophobicContact CG-CG2 4.33Å; L470-V474 WeakPolarHBondContact O-CB 3.47Å; L470-V474 VanDerWaalsContact O-CG2 3.23Å; L470-V474 WeakPolarHBondContact O-CG2 3.28Å; L470-V474 PolarHBondContact O-N 3.49Å; V474-K477 PolarHBondContact O-N 3.4Å; V474-L478 HydrophobicContact CG1-CD1 3.99Å; V474-L478 WeakPolarHBondContact O-CD1 3.14Å; V474-L478 PolarHBondContact O-N 3.33Å; V474-I583 HydrophobicContact CG1-CD1 3.97Å
475	A	60.9	Low	65.7	Low	6 Å²	6	50.9 Å²	50.9	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-58.3	-49.4	173.3	0	0	0	0	0	112.1	N471 Q472 A473 K477 L478 I479 F529	N471-A475 WeakPolarHBondContact O-CB 3.4Å; N471-A475 PolarHBondContact O-N 3.23Å; Q472-A475 WeakPolarHBondContact O-CB 3.45Å; Q472-A475 PolarHBondContact O-N 3.42Å; A473-A475 VanDerWaalsContact C-N 3.35Å; A475-K477 VanDerWaalsContact C-N 3.31Å; A475-K477 PolarHBondContact O-N 3.42Å; A475-L478 WeakPolarHBondContact O-CB 3.48Å; A475-L478 PolarHBondContact O-N 3.06Å; A475-I479 HydrophobicContact CB-CD1 4.38Å; A475-I479 WeakPolarHBondContact O-CB 3.4Å; A475-I479 WeakPolarHBondContact O-CD1 3.43Å; A475-I479 WeakPolarHBondContact O-CG1 3.41Å; A475-I479 PolarHBondContact O-N 3.47Å; A475-F529 HydrophobicContact CB-CD2 3.23Å; A475-F529 HydrophobicContact CB-CE2 3.41Å; A475-F529 VanDerWaalsContact CB-CE2 3.41Å; A475-F529 HydrophobicContact CB-CG 4.35Å
476	N	65.9	Low	65.1	Low	97 Å²	97	52.2 Å²	52.2	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-37.4	-178	-71.4	-15	0	0	0	112.8	Q472 A473	Q472-N476 PolarHBondContact O-N 3.11Å; Q472-N476 PolarHBondContact O-ND2 2.93Å; A473-N476 PolarHBondContact O-N 3.46Å
477	K	65.1	Low	64.7	Low	88 Å²	88	58.7 Å²	58.7	38%	0.383	30%	0.299	S	S	.	.	H	α-helix	trans	-70.5	-28.7	174.4	-79.7	-173.9	175.2	179	0	113.6	M417 T421 A473 V474 A475 S480	M417-K477 HydrophobicContact CG-CD 4.11Å; M417-K477 HydrophobicContact SD-CB 3.73Å; M417-K477 HydrophobicContact SD-CD 4.07Å; T421-K477 PolarHBondContact OG1-NZ 2.72Å; A473-K477 PolarHBondContact O-N 3.45Å; V474-K477 PolarHBondContact O-N 3.4Å; A475-K477 VanDerWaalsContact C-N 3.31Å; A475-K477 PolarHBondContact O-N 3.42Å; K477-S480 PolarHBondContact O-OG 3.36Å; K477-S480 VanDerWaalsContact O-OG 3.08Å
478	L	60.4	Low	64.4	Low	36 Å²	36	62.2 Å²	62.2	19%	0.188	32%	0.324	C	S	.	.	H	α-helix	trans	-77.4	-38.7	175.6	-85.4	154	0	0	0	112.5	M414 M417 V474 A475 S480 S481 V482 I583	M414-L478 HydrophobicContact CE-CD1 3.41Å; M414-L478 VanDerWaalsContact CE-CD1 3.41Å; M414-L478 HydrophobicContact CE-CD2 3.45Å; M414-L478 VanDerWaalsContact CE-CD2 3.45Å; M414-L478 HydrophobicContact CE-CG 4.02Å; M414-L478 HydrophobicContact CG-CD1 4.48Å; M414-L478 HydrophobicContact SD-CD1 4.04Å; M417-L478 HydrophobicContact CE-CD1 4.03Å; M417-L478 HydrophobicContact CE-CG 3.94Å; V474-L478 HydrophobicContact CG1-CD1 3.99Å; V474-L478 WeakPolarHBondContact O-CD1 3.14Å; V474-L478 PolarHBondContact O-N 3.33Å; A475-L478 WeakPolarHBondContact O-CB 3.48Å; A475-L478 PolarHBondContact O-N 3.06Å; L478-S480 VanDerWaalsContact C-N 3.32Å; L478-S480 PolarHBondContact O-N 2.95Å; L478-S481 PolarHBondContact O-N 3.11Å; L478-V482 WeakPolarHBondContact O-CG2 3.27Å; L478-V482 PolarHBondContact O-N 2.89Å; L478-V482 VanDerWaalsContact O-N 3.16Å; L478-I583 HydrophobicContact CD1-CG2 4.24Å
479	I	59.6	Low	64.2	Low	51 Å²	51	60.6 Å²	60.6	26%	0.262	31%	0.309	S	S	.	.	H	α-helix	trans	-55.4	-46.8	-179.6	-74.8	163.3	0	0	0	110.2	A475 S481 V482 D483	A475-I479 HydrophobicContact CB-CD1 4.38Å; A475-I479 WeakPolarHBondContact O-CB 3.4Å; A475-I479 WeakPolarHBondContact O-CD1 3.43Å; A475-I479 WeakPolarHBondContact O-CG1 3.41Å; A475-I479 PolarHBondContact O-N 3.47Å; I479-S481 VanDerWaalsContact C-N 3.3Å; I479-S481 PolarHBondContact O-N 2.84Å; I479-V482 PolarHBondContact O-N 3.24Å; I479-V482 VanDerWaalsContact O-N 3.16Å; I479-D483 WeakPolarHBondContact CG2-OD2 3.14Å; I479-D483 VanDerWaalsContact O-CB 3.25Å; I479-D483 WeakPolarHBondContact O-CB 3.21Å; I479-D483 PolarHBondContact O-N 2.83Å
480	S	61	Low	63.9	Low	76 Å²	76	57.3 Å²	57.3	53%	0.531	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-32.3	-179.3	61.1	0	0	0	0	115	K477 L478	K477-S480 PolarHBondContact O-OG 3.36Å; K477-S480 VanDerWaalsContact O-OG 3.08Å; L478-S480 VanDerWaalsContact C-N 3.32Å; L478-S480 PolarHBondContact O-N 2.95Å
481	S	58.3	Low	63.7	Low	85 Å²	85	58.1 Å²	58.1	59%	0.594	31%	0.307	S	S	*	.	H	α-helix	trans	-82	-30.8	178.7	-62.2	0	0	0	0	112.7	L478 I479	L478-S481 PolarHBondContact O-N 3.11Å; I479-S481 VanDerWaalsContact C-N 3.3Å; I479-S481 PolarHBondContact O-N 2.84Å
482	V	61.5	Low	63.8	Low	15 Å²	15	59.1 Å²	59.1	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-79.4	-35.1	176.9	174.2	0	0	0	0	111	L403 L478 I479 Y484 L485 R486 F587	L403-V482 HydrophobicContact CD2-CG1 4.48Å; L478-V482 WeakPolarHBondContact O-CG2 3.27Å; L478-V482 PolarHBondContact O-N 2.89Å; L478-V482 VanDerWaalsContact O-N 3.16Å; I479-V482 PolarHBondContact O-N 3.24Å; I479-V482 VanDerWaalsContact O-N 3.16Å; V482-Y484 VanDerWaalsContact C-N 3.34Å; V482-Y484 PolarHBondContact O-N 3.01Å; V482-L485 PolarHBondContact O-N 2.92Å; V482-R486 WeakPolarHBondContact O-CB 3.24Å; V482-R486 PolarHBondContact O-N 3.48Å; V482-F587 HydrophobicContact CG2-CE2 4.45Å; V482-F587 HydrophobicContact CG2-CZ 4.11Å
483	D	62.5	Low	63.8	Low	39 Å²	39	54.1 Å²	54.1	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-40	-179.8	-73.9	-7.8	0	0	0	112.2	I479 R486 E487	I479-D483 WeakPolarHBondContact CG2-OD2 3.14Å; I479-D483 VanDerWaalsContact O-CB 3.25Å; I479-D483 WeakPolarHBondContact O-CB 3.21Å; I479-D483 PolarHBondContact O-N 2.83Å; D483-R486 WeakPolarHBondContact O-CB 3.36Å; D483-R486 PolarHBondContact O-N 3.22Å; D483-R486 IonicContact OD1-CZ 3.61Å; D483-R486 IonicContact OD1-NH1 3.39Å; D483-R486 PolarHBondContact OD1-NH1 2.93Å; D483-R486 IonicContact OD1-NH2 3.02Å; D483-R486 PolarHBondContact OD1-NH2 3.03Å; D483-R486 IonicContact OD2-NH2 2.76Å; D483-E487 WeakPolarHBondContact O-CG 3.27Å; D483-E487 PolarHBondContact O-N 3.48Å
484	Y	61.6	Low	63.8	Low	179 Å²	179	56.2 Å²	56.2	70%	0.702	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-44.9	177.5	178.3	-98.5	0	0	0	113	V482 R486 S488	V482-Y484 VanDerWaalsContact C-N 3.34Å; V482-Y484 PolarHBondContact O-N 3.01Å; Y484-R486 VanDerWaalsContact C-N 3.34Å; Y484-S488 PolarHBondContact O-N 2.76Å
485	L	59.7	Low	64	Low	53 Å²	53	63.8 Å²	63.8	28%	0.277	33%	0.325	S	S	.	.	H	α-helix	trans	-69.3	-35.8	176.4	-73.4	167.1	0	0	0	111.5	L403 I406 V482 F489	L403-L485 HydrophobicContact CD2-CB 4.45Å; L403-L485 HydrophobicContact CD2-CD1 4.26Å; I406-L485 HydrophobicContact CD1-CD1 3.18Å; V482-L485 PolarHBondContact O-N 2.92Å; L485-F489 VanDerWaalsContact O-CB 3.27Å; L485-F489 WeakPolarHBondContact O-CB 3.42Å; L485-F489 PolarHBondContact O-N 3Å
486	R	64.2	Low	64.2	Low	69 Å²	69	64.9 Å²	64.9	26%	0.26	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-50.4	175.7	-172.7	-179.6	71.4	-139.7	-7.1	111.2	V482 D483 Y484 S488 F489 V490	V482-R486 WeakPolarHBondContact O-CB 3.24Å; V482-R486 PolarHBondContact O-N 3.48Å; D483-R486 WeakPolarHBondContact O-CB 3.36Å; D483-R486 PolarHBondContact O-N 3.22Å; D483-R486 IonicContact OD1-CZ 3.61Å; D483-R486 IonicContact OD1-NH1 3.39Å; D483-R486 PolarHBondContact OD1-NH1 2.93Å; D483-R486 IonicContact OD1-NH2 3.02Å; D483-R486 PolarHBondContact OD1-NH2 3.03Å; D483-R486 IonicContact OD2-NH2 2.76Å; Y484-R486 VanDerWaalsContact C-N 3.34Å; R486-S488 PolarHBondContact O-N 3.48Å; R486-F489 PolarHBondContact O-N 3.17Å; R486-V490 HydrophobicContact CG-CG2 3.86Å; R486-V490 VanDerWaalsContact O-CB 3.29Å; R486-V490 WeakPolarHBondContact O-CB 3.37Å; R486-V490 WeakPolarHBondContact O-CG2 3.44Å; R486-V490 PolarHBondContact O-N 3.07Å
487	E	66.6	Low	64.3	Low	138 Å²	138	60.2 Å²	60.2	65%	0.645	31%	0.307	S	S	*	.	H	α-helix	trans	-62.9	-44.8	-176.6	-76.4	-174.6	172.2	0	0	113	D483 F489 G491	D483-E487 WeakPolarHBondContact O-CG 3.27Å; D483-E487 PolarHBondContact O-N 3.48Å; E487-F489 VanDerWaalsContact C-N 3.29Å; E487-F489 PolarHBondContact O-N 3.02Å; E487-G491 PolarHBondContact O-N 3.5Å
488	S	62.4	Low	64.4	Low	81 Å²	81	59.9 Å²	59.9	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-63.1	-36.2	177.2	-179.3	0	0	0	0	112.5	Y484 R486 T492	Y484-S488 PolarHBondContact O-N 2.76Å; R486-S488 PolarHBondContact O-N 3.48Å; S488-T492 PolarHBondContact O-N 2.92Å; S488-T492 PolarHBondContact O-OG1 3.4Å
489	F	64.3	Low	64.6	Low	27 Å²	27	60.2 Å²	60.2	12%	0.118	31%	0.312	C	S	.	.	H	α-helix	trans	-76.8	-51	-179.8	172.2	-96	0	0	0	112.2	K395 E396 L399 L485 R486 E487 G491 T492 L493	K395-F489 WeakPolarHBondContact O-CE2 3.22Å; E396-F489 HydrophobicContact CB-CE2 4.49Å; E396-F489 HydrophobicContact CB-CZ 3.95Å; E396-F489 HydrophobicContact CG-CZ 4.04Å; L399-F489 HydrophobicContact CB-CD2 3.51Å; L399-F489 HydrophobicContact CB-CE1 4.4Å; L399-F489 HydrophobicContact CB-CE2 3.42Å; L399-F489 VanDerWaalsContact CB-CE2 3.42Å; L399-F489 HydrophobicContact CB-CG 4.04Å; L399-F489 HydrophobicContact CB-CZ 3.85Å; L399-F489 HydrophobicContact CD1-CB 4.02Å; L399-F489 HydrophobicContact CD1-CD2 4.22Å; L399-F489 HydrophobicContact CD1-CG 4.04Å; L399-F489 HydrophobicContact CD2-CB 4.05Å; L399-F489 HydrophobicContact CD2-CD1 3.17Å; L399-F489 HydrophobicContact CD2-CD2 3.78Å; L399-F489 HydrophobicContact CD2-CE1 3.3Å; L399-F489 HydrophobicContact CD2-CE2 3.91Å; L399-F489 HydrophobicContact CD2-CG 3.37Å; L399-F489 HydrophobicContact CD2-CZ 3.64Å; L399-F489 HydrophobicContact CG-CB 4.49Å; L399-F489 HydrophobicContact CG-CD1 4.24Å; L399-F489 HydrophobicContact CG-CD2 3.98Å; L399-F489 HydrophobicContact CG-CE1 4.39Å; L399-F489 HydrophobicContact CG-CE2 4.18Å; L399-F489 HydrophobicContact CG-CG 3.97Å; L399-F489 HydrophobicContact CG-CZ 4.33Å; L485-F489 VanDerWaalsContact O-CB 3.27Å; L485-F489 WeakPolarHBondContact O-CB 3.42Å; L485-F489 PolarHBondContact O-N 3Å; R486-F489 PolarHBondContact O-N 3.17Å; E487-F489 VanDerWaalsContact C-N 3.29Å; E487-F489 PolarHBondContact O-N 3.02Å; F489-G491 VanDerWaalsContact C-N 3.26Å; F489-G491 PolarHBondContact O-N 3.44Å; F489-T492 WeakPolarHBondContact O-CA 3.49Å; F489-T492 WeakPolarHBondContact O-CB 3.48Å; F489-T492 PolarHBondContact O-N 3.19Å; F489-L493 HydrophobicContact CE1-CB 4.35Å; F489-L493 HydrophobicContact CE1-CD1 3.61Å; F489-L493 HydrophobicContact CE1-CG 4.5Å; F489-L493 HydrophobicContact CE2-CD1 3.83Å; F489-L493 HydrophobicContact CZ-CD1 3.17Å; F489-L493 HydrophobicContact CZ-CG 4.4Å; F489-L493 PolarHBondContact O-N 3.16Å
490	V	66.5	Low	64.7	Low	13 Å²	13	58.2 Å²	58.2	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-57.1	-43.9	179.6	169.8	0	0	0	0	109.5	R486 T492 L493 E494 Y523	R486-V490 HydrophobicContact CG-CG2 3.86Å; R486-V490 VanDerWaalsContact O-CB 3.29Å; R486-V490 WeakPolarHBondContact O-CB 3.37Å; R486-V490 WeakPolarHBondContact O-CG2 3.44Å; R486-V490 PolarHBondContact O-N 3.07Å; V490-T492 VanDerWaalsContact C-N 3.26Å; V490-T492 PolarHBondContact O-N 2.98Å; V490-L493 PolarHBondContact O-N 2.81Å; V490-E494 WeakPolarHBondContact O-CB 3.48Å; V490-E494 PolarHBondContact O-N 3.33Å; V490-Y523 HydrophobicContact CG1-CE1 3.68Å; V490-Y523 HydrophobicContact CG1-CE2 4.36Å; V490-Y523 WeakPolarHBondContact CG1-OH 3.39Å
491	G	67.6	Low	64.7	Low	18 Å²	18	57.4 Å²	57.4	19%	0.186	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-29	176.3	0	0	0	0	0	114	E487 F489 R495	E487-G491 PolarHBondContact O-N 3.5Å; F489-G491 VanDerWaalsContact C-N 3.26Å; F489-G491 PolarHBondContact O-N 3.44Å; G491-R495 WeakPolarHBondContact O-CB 3.43Å; G491-R495 WeakPolarHBondContact O-CG 3.3Å; G491-R495 PolarHBondContact O-N 3.29Å; G491-R495 PolarHBondContact O-NE 3.45Å; G491-R495 VanDerWaalsContact O-NE 3.11Å; G491-R495 PolarHBondContact O-NH2 3.15Å
492	T	67.9	Low	64.5	Low	38 Å²	38	61.7 Å²	61.7	23%	0.233	30%	0.298	C	S	.	.	H	α-helix	trans	-76.9	-42.3	175.1	-59.5	0	0	0	0	111.2	S488 F489 V490 R495 C496	S488-T492 PolarHBondContact O-N 2.92Å; S488-T492 PolarHBondContact O-OG1 3.4Å; F489-T492 WeakPolarHBondContact O-CA 3.49Å; F489-T492 WeakPolarHBondContact O-CB 3.48Å; F489-T492 PolarHBondContact O-N 3.19Å; V490-T492 VanDerWaalsContact C-N 3.26Å; V490-T492 PolarHBondContact O-N 2.98Å; T492-R495 PolarHBondContact O-N 2.83Å; T492-C496 PolarHBondContact O-N 3.45Å; T492-C496 PolarHBondContact O-SG 2.85Å
493	L	67.9	Low	64	Low	6 Å²	6	63.1 Å²	63.1	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-41	-178.4	-154	127.7	0	0	0	111.3	T392 E396 F489 V490 R495 C496 L497 I518 F598	T392-L493 HydrophobicContact CG2-CD1 4.28Å; T392-L493 HydrophobicContact CG2-CG 4.3Å; E396-L493 HydrophobicContact CB-CD1 4.19Å; F489-L493 HydrophobicContact CE1-CB 4.35Å; F489-L493 HydrophobicContact CE1-CD1 3.61Å; F489-L493 HydrophobicContact CE1-CG 4.5Å; F489-L493 HydrophobicContact CE2-CD1 3.83Å; F489-L493 HydrophobicContact CZ-CD1 3.17Å; F489-L493 HydrophobicContact CZ-CG 4.4Å; F489-L493 PolarHBondContact O-N 3.16Å; V490-L493 PolarHBondContact O-N 2.81Å; L493-R495 PolarHBondContact O-N 3.4Å; L493-C496 PolarHBondContact O-N 3.25Å; L493-L497 HydrophobicContact CD2-CD1 3.45Å; L493-L497 VanDerWaalsContact CD2-CD1 3.45Å; L493-L497 HydrophobicContact CD2-CG 4.1Å; L493-L497 HydrophobicContact CG-CD1 4.46Å; L493-L497 WeakPolarHBondContact O-CB 3.27Å; L493-L497 VanDerWaalsContact O-CG 3.27Å; L493-L497 WeakPolarHBondContact O-CG 3.48Å; L493-L497 PolarHBondContact O-N 2.76Å; L493-I518 HydrophobicContact CD2-CG2 4.26Å; L493-F598 HydrophobicContact CD1-CE2 4.04Å; L493-F598 HydrophobicContact CD1-CZ 3.89Å; L493-F598 HydrophobicContact CD2-CE2 3.7Å; L493-F598 HydrophobicContact CD2-CZ 4.11Å
494	E	69.7	Low	63.1	Low	65 Å²	65	70.8 Å²	70.8	30%	0.304	34%	0.343	S	S	.	.	H	α-helix	trans	-58.6	-45.9	172.2	-172.1	-178.8	-174.3	0	0	111.2	V490 C496 L497 Q498 L519	V490-E494 WeakPolarHBondContact O-CB 3.48Å; V490-E494 PolarHBondContact O-N 3.33Å; E494-C496 VanDerWaalsContact C-N 3.35Å; E494-C496 PolarHBondContact O-N 2.79Å; E494-L497 PolarHBondContact O-N 3.25Å; E494-Q498 HydrophobicContact CG-CG 4.27Å; E494-Q498 VanDerWaalsContact O-CB 3.24Å; E494-Q498 WeakPolarHBondContact O-CB 3.25Å; E494-Q498 WeakPolarHBondContact O-CG 3.08Å; E494-Q498 PolarHBondContact O-N 2.84Å; E494-Q498 PolarHBondContact OE1-NE2 3.25Å; E494-L519 HydrophobicContact CB-CD2 4.26Å; E494-L519 HydrophobicContact CG-CD2 4.3Å
495	R	70.8	Confident	62.2	Low	159 Å²	159	65.8 Å²	65.8	60%	0.6	33%	0.329	S	S	*	.	H	α-helix	trans	-62	-39.3	174.3	-81.9	-177.4	-101.7	115	-2.4	113	G491 T492 L493 S499	G491-R495 WeakPolarHBondContact O-CB 3.43Å; G491-R495 WeakPolarHBondContact O-CG 3.3Å; G491-R495 PolarHBondContact O-N 3.29Å; G491-R495 PolarHBondContact O-NE 3.45Å; G491-R495 VanDerWaalsContact O-NE 3.11Å; G491-R495 PolarHBondContact O-NH2 3.15Å; T492-R495 PolarHBondContact O-N 2.83Å; L493-R495 PolarHBondContact O-N 3.4Å; R495-S499 WeakPolarHBondContact O-CB 3.47Å; R495-S499 PolarHBondContact O-N 2.96Å; R495-S499 VanDerWaalsContact O-N 3.15Å
496	C	65.3	Low	61.4	Low	29 Å²	29	69.2 Å²	69.2	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-67	-43.8	177.6	-66.8	0	0	0	0	111.5	T492 L493 E494 S499 L500	T492-C496 PolarHBondContact O-N 3.45Å; T492-C496 PolarHBondContact O-SG 2.85Å; L493-C496 PolarHBondContact O-N 3.25Å; E494-C496 VanDerWaalsContact C-N 3.35Å; E494-C496 PolarHBondContact O-N 2.79Å; C496-S499 WeakPolarHBondContact O-CB 3.39Å; C496-S499 PolarHBondContact O-N 3.32Å; C496-L500 PolarHBondContact O-N 3.24Å
497	L	67.4	Low	60.6	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-71.9	-42.6	-179.9	-70.8	177.6	0	0	0	112.4	T392 L493 E494 S499 L500 E501 L515 I518 L519	T392-L497 HydrophobicContact CG2-CD2 4.37Å; L493-L497 HydrophobicContact CD2-CD1 3.45Å; L493-L497 VanDerWaalsContact CD2-CD1 3.45Å; L493-L497 HydrophobicContact CD2-CG 4.1Å; L493-L497 HydrophobicContact CG-CD1 4.46Å; L493-L497 WeakPolarHBondContact O-CB 3.27Å; L493-L497 VanDerWaalsContact O-CG 3.27Å; L493-L497 WeakPolarHBondContact O-CG 3.48Å; L493-L497 PolarHBondContact O-N 2.76Å; E494-L497 PolarHBondContact O-N 3.25Å; L497-S499 PolarHBondContact O-N 2.93Å; L497-L500 HydrophobicContact CD2-CD1 4.14Å; L497-L500 WeakPolarHBondContact O-CA 3.34Å; L497-L500 VanDerWaalsContact O-CB 3.3Å; L497-L500 WeakPolarHBondContact O-CB 3.49Å; L497-L500 PolarHBondContact O-N 2.78Å; L497-E501 PolarHBondContact O-N 3.43Å; L497-L515 HydrophobicContact CB-CD1 4.17Å; L497-L515 HydrophobicContact CB-CD2 3.57Å; L497-L515 HydrophobicContact CB-CG 3.8Å; L497-L515 HydrophobicContact CD1-CG 4.32Å; L497-L515 HydrophobicContact CD2-CD1 4.44Å; L497-L515 HydrophobicContact CD2-CG 4.42Å; L497-L515 HydrophobicContact CG-CG 4.42Å; L497-I518 HydrophobicContact CD1-CB 4.32Å; L497-I518 HydrophobicContact CD1-CG2 3.62Å; L497-I518 HydrophobicContact CD2-CD1 4.46Å; L497-I518 HydrophobicContact CD2-CG2 4.46Å; L497-L519 HydrophobicContact CD1-CG 4.25Å
498	Q	67.2	Low	59.7	Low	81 Å²	81	64.1 Å²	64.1	38%	0.379	34%	0.338	S	S	.	.	H	α-helix	trans	-61.1	-31.2	173	-74.9	175	-1.7	0	0	111.9	E494 L500 E501 K502	E494-Q498 HydrophobicContact CG-CG 4.27Å; E494-Q498 VanDerWaalsContact O-CB 3.24Å; E494-Q498 WeakPolarHBondContact O-CB 3.25Å; E494-Q498 WeakPolarHBondContact O-CG 3.08Å; E494-Q498 PolarHBondContact O-N 2.84Å; E494-Q498 PolarHBondContact OE1-NE2 3.25Å; Q498-L500 PolarHBondContact O-N 2.99Å; Q498-E501 PolarHBondContact O-N 3.3Å; Q498-K502 PolarHBondContact O-N 3.01Å
499	S	64.1	Low	58.9	Low	42 Å²	42	67.5 Å²	67.5	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-69.1	-19.8	172.9	-177.4	0	0	0	0	113.4	R388 R495 C496 L497	R388-S499 PolarHBondContact NH1-O 3.37Å; R388-S499 VanDerWaalsContact NH1-O 3.11Å; R388-S499 PolarHBondContact NH1-OG 3.25Å; R495-S499 WeakPolarHBondContact O-CB 3.47Å; R495-S499 PolarHBondContact O-N 2.96Å; R495-S499 VanDerWaalsContact O-N 3.15Å; C496-S499 WeakPolarHBondContact O-CB 3.39Å; C496-S499 PolarHBondContact O-N 3.32Å; L497-S499 PolarHBondContact O-N 2.93Å
500	L	62.2	Low	58.3	Low	9 Å²	9	70.7 Å²	70.7	5%	0.047	36%	0.362	C	S	.	.	H	α-helix	trans	-80.8	-20.6	172.4	-65.8	167.2	0	0	0	111.9	T385 R388 L389 C496 L497 Q498 S503	T385-L500 HydrophobicContact CG2-CD2 4.2Å; R388-L500 HydrophobicContact CB-CD2 3.87Å; L389-L500 HydrophobicContact CD2-CD1 4.02Å; C496-L500 PolarHBondContact O-N 3.24Å; L497-L500 HydrophobicContact CD2-CD1 4.14Å; L497-L500 WeakPolarHBondContact O-CA 3.34Å; L497-L500 VanDerWaalsContact O-CB 3.3Å; L497-L500 WeakPolarHBondContact O-CB 3.49Å; L497-L500 PolarHBondContact O-N 2.78Å; Q498-L500 PolarHBondContact O-N 2.99Å; L500-S503 PolarHBondContact O-OG 3.03Å
501	E	61.2	Low	57.8	Low	59 Å²	59	70.3 Å²	70.3	28%	0.276	36%	0.36	S	S	.	.	H	α-helix	trans	-85.2	-20.3	176.1	-66.2	-174.4	144.8	0	0	113.6	L497 Q498 S503 T511 S512 L515	L497-E501 PolarHBondContact O-N 3.43Å; Q498-E501 PolarHBondContact O-N 3.3Å; E501-S503 VanDerWaalsContact C-N 3.29Å; E501-S503 PolarHBondContact O-N 3.43Å; E501-T511 HydrophobicContact CG-CG2 4.23Å; E501-S512 VanDerWaalsContact OE1-CA 3.28Å; E501-S512 WeakPolarHBondContact OE1-CA 3.19Å; E501-S512 WeakPolarHBondContact OE1-CB 3.41Å; E501-L515 HydrophobicContact CG-CD1 3.83Å; E501-L515 HydrophobicContact CG-CD2 4.07Å
502	K	54.3	Low	57.4	Low	175 Å²	175	70.7 Å²	70.7	76%	0.761	36%	0.36	S	S	*	.			trans	-77.4	-2.5	-176.9	-80.2	-175.8	178.3	179.3	0	115.3	Q498 Q504	Q498-K502 PolarHBondContact O-N 3.01Å; K502-Q504 PolarHBondContact O-N 3.07Å
503	S	50.9	Low	57	Low	46 Å²	46	73.2 Å²	73.2	32%	0.322	37%	0.372	S	S	.	.	S	Bend	trans	-73	111.7	169.6	51.3	0	0	0	0	108.5	L500 E501 D505	L500-S503 PolarHBondContact O-OG 3.03Å; E501-S503 VanDerWaalsContact C-N 3.29Å; E501-S503 PolarHBondContact O-N 3.43Å; S503-D505 PolarHBondContact O-N 3.19Å
504	Q	43.4	Very low	56.7	Low	200 Å²	200	75.8 Å²	75.8	94%	0.935	38%	0.382	S	S	*	.			trans	-59.4	93.5	-175	-77.6	173.1	-39.7	0	0	111.9	K502	K502-Q504 PolarHBondContact O-N 3.07Å
505	D	43.3	Very low	56.3	Low	73 Å²	73	72.9 Å²	72.9	39%	0.39	37%	0.368	S	S	.	.	S	Bend	trans	-156.2	160.8	156.8	-134.8	-11	0	0	0	111.6	Q90 S503 S507 V508	Q90-D505 PolarHBondContact NE2-OD2 3.25Å; S503-D505 PolarHBondContact O-N 3.19Å; D505-S507 PolarHBondContact O-N 3.27Å; D505-V508 VanDerWaalsContact O-CG2 3.3Å; D505-V508 WeakPolarHBondContact O-CG2 2.99Å
506	V	43.1	Very low	56.1	Low	126 Å²	126	70.8 Å²	70.8	76%	0.764	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	0	-177.4	-177.9	0	0	0	0	113.6	V508	V506-V508 PolarHBondContact O-N 3.48Å
507	S	45.9	Very low	56	Low	21 Å²	21	73.8 Å²	73.8	15%	0.147	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.9	176.5	77.1	0	0	0	0	115.6	D505 H509 I510 T511 R612	D505-S507 PolarHBondContact O-N 3.27Å; S507-H509 PolarHBondContact O-N 3.33Å; S507-I510 PolarHBondContact O-N 3.13Å; S507-I510 VanDerWaalsContact O-N 3.11Å; S507-T511 PolarHBondContact O-N 3.17Å; S507-R612 VanDerWaalsContact CB-CZ 3.49Å
508	V	47.5	Very low	55.8	Low	78 Å²	78	73.8 Å²	73.8	47%	0.473	37%	0.374	S	S	.	.	H	α-helix	trans	-45.2	-37	-175	-173.2	0	0	0	0	112.7	D505 V506 S512	D505-V508 VanDerWaalsContact O-CG2 3.3Å; D505-V508 WeakPolarHBondContact O-CG2 2.99Å; V506-V508 PolarHBondContact O-N 3.48Å; V508-S512 WeakPolarHBondContact O-CB 3.47Å; V508-S512 PolarHBondContact O-N 3.14Å; V508-S512 VanDerWaalsContact O-N 3.11Å
509	H	47.1	Very low	55.6	Low	152 Å²	152	71.1 Å²	71.1	70%	0.704	36%	0.363	S	S	*	.	H	α-helix	trans	-74.3	-31.8	-175.1	-79.2	-68.7	0	0	0	115.7	S507 N513	S507-H509 PolarHBondContact O-N 3.33Å; H509-N513 PolarHBondContact O-N 2.82Å; H509-N513 PolarHBondContact O-ND2 3.48Å
510	I	52	Low	55.6	Low	94 Å²	94	73.2 Å²	73.2	48%	0.482	37%	0.37	S	S	.	.	H	α-helix	trans	-83.4	-47.4	-177.3	-63.2	174.6	0	0	0	109.7	S507 S512 N513 Y514	S507-I510 PolarHBondContact O-N 3.13Å; S507-I510 VanDerWaalsContact O-N 3.11Å; I510-S512 VanDerWaalsContact C-N 3.28Å; I510-S512 PolarHBondContact O-N 2.96Å; I510-N513 PolarHBondContact O-N 2.89Å; I510-Y514 HydrophobicContact CG2-CD2 3.9Å; I510-Y514 HydrophobicContact CG2-CE2 3.59Å; I510-Y514 WeakPolarHBondContact O-CD2 3.24Å; I510-Y514 PolarHBondContact O-N 3.04Å
511	T	55.5	Low	55.5	Low	5 Å²	5	73.6 Å²	73.6	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-39.3	176.1	-53.8	0	0	0	0	110.9	E501 S507 N513 Y514 L515 L605 H609	E501-T511 HydrophobicContact CG-CG2 4.23Å; S507-T511 PolarHBondContact O-N 3.17Å; T511-N513 PolarHBondContact O-N 3.01Å; T511-Y514 PolarHBondContact O-N 2.91Å; T511-L515 HydrophobicContact CG2-CD1 3.86Å; T511-L515 WeakPolarHBondContact O-CB 3.45Å; T511-L515 PolarHBondContact O-N 3.41Å; T511-L605 HydrophobicContact CG2-CD1 4.35Å; T511-H609 WeakPolarHBondContact CG2-NE2 3.27Å; T511-H609 PolarHBondContact OG1-CE1 3.07Å; T511-H609 PolarHBondContact OG1-NE2 3.19Å; T511-H609 VanDerWaalsContact OG1-NE2 3.16Å
512	S	59.5	Low	55.2	Low	27 Å²	27	71.5 Å²	71.5	19%	0.189	37%	0.368	C	S	.	.	H	α-helix	trans	-65.1	-34.8	177.5	-172.3	0	0	0	0	113.8	E501 V508 I510 K516	E501-S512 VanDerWaalsContact OE1-CA 3.28Å; E501-S512 WeakPolarHBondContact OE1-CA 3.19Å; E501-S512 WeakPolarHBondContact OE1-CB 3.41Å; V508-S512 WeakPolarHBondContact O-CB 3.47Å; V508-S512 PolarHBondContact O-N 3.14Å; V508-S512 VanDerWaalsContact O-N 3.11Å; I510-S512 VanDerWaalsContact C-N 3.28Å; I510-S512 PolarHBondContact O-N 2.96Å; S512-K516 WeakPolarHBondContact O-CB 3.38Å; S512-K516 WeakPolarHBondContact O-CG 3.01Å; S512-K516 PolarHBondContact O-N 3.36Å
513	N	59.6	Low	55.2	Low	91 Å²	91	68.1 Å²	68.1	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-70.6	-40.6	177	-76.4	-19.8	0	0	0	112.1	H509 I510 T511 K516 Q517	H509-N513 PolarHBondContact O-N 2.82Å; H509-N513 PolarHBondContact O-ND2 3.48Å; I510-N513 PolarHBondContact O-N 2.89Å; T511-N513 PolarHBondContact O-N 3.01Å; N513-K516 PolarHBondContact O-N 3.28Å; N513-Q517 WeakPolarHBondContact O-CG 3.48Å; N513-Q517 PolarHBondContact O-N 2.85Å
514	Y	60	Low	55.2	Low	60 Å²	60	72 Å²	72	24%	0.235	36%	0.363	C	S	.	.	H	α-helix	trans	-69.2	-38.6	173.4	-71.2	-63.4	0	0	0	111.9	I510 T511 K516 Q517 I518 Q604 L605	I510-Y514 HydrophobicContact CG2-CD2 3.9Å; I510-Y514 HydrophobicContact CG2-CE2 3.59Å; I510-Y514 WeakPolarHBondContact O-CD2 3.24Å; I510-Y514 PolarHBondContact O-N 3.04Å; T511-Y514 PolarHBondContact O-N 2.91Å; Y514-K516 VanDerWaalsContact C-N 3.32Å; Y514-K516 PolarHBondContact O-N 3.34Å; Y514-Q517 WeakPolarHBondContact O-CB 3.4Å; Y514-Q517 PolarHBondContact O-N 3.19Å; Y514-Q517 VanDerWaalsContact O-N 3.15Å; Y514-I518 WeakPolarHBondContact O-CB 3.26Å; Y514-I518 VanDerWaalsContact O-CG1 3.24Å; Y514-I518 WeakPolarHBondContact O-CG1 3.45Å; Y514-I518 PolarHBondContact O-N 3.38Å; Y514-Q604 HydrophobicContact CD1-CG 4.47Å; Y514-Q604 HydrophobicContact CE1-CB 4.5Å; Y514-Q604 HydrophobicContact CE1-CG 3.75Å; Y514-Q604 PolarHBondContact OH-NE2 2.92Å; Y514-L605 HydrophobicContact CD2-CD1 4.42Å; Y514-L605 HydrophobicContact CG-CD1 4.32Å
515	L	63.1	Low	55.5	Low	4 Å²	4	63.6 Å²	63.6	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-58.8	-45	171.8	-120.4	99.3	0	0	0	111.2	L497 E501 T511 Q517 I518 L519	L497-L515 HydrophobicContact CB-CD1 4.17Å; L497-L515 HydrophobicContact CB-CD2 3.57Å; L497-L515 HydrophobicContact CB-CG 3.8Å; L497-L515 HydrophobicContact CD1-CG 4.32Å; L497-L515 HydrophobicContact CD2-CD1 4.44Å; L497-L515 HydrophobicContact CD2-CG 4.42Å; L497-L515 HydrophobicContact CG-CG 4.42Å; E501-L515 HydrophobicContact CG-CD1 3.83Å; E501-L515 HydrophobicContact CG-CD2 4.07Å; T511-L515 HydrophobicContact CG2-CD1 3.86Å; T511-L515 WeakPolarHBondContact O-CB 3.45Å; T511-L515 PolarHBondContact O-N 3.41Å; L515-Q517 VanDerWaalsContact C-N 3.31Å; L515-Q517 PolarHBondContact O-N 2.93Å; L515-I518 PolarHBondContact O-N 3.1Å; L515-L519 HydrophobicContact CD2-CD1 4.1Å; L515-L519 VanDerWaalsContact O-CB 3.26Å; L515-L519 WeakPolarHBondContact O-CB 3.33Å; L515-L519 WeakPolarHBondContact O-CD1 3.47Å; L515-L519 WeakPolarHBondContact O-CG 3.31Å; L515-L519 PolarHBondContact O-N 2.99Å
516	K	65.3	Low	55.6	Low	115 Å²	115	66 Å²	66	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-38.9	174.9	-77.8	171.2	-173.9	176.4	0	111.7	S512 N513 Y514 N520	S512-K516 WeakPolarHBondContact O-CB 3.38Å; S512-K516 WeakPolarHBondContact O-CG 3.01Å; S512-K516 PolarHBondContact O-N 3.36Å; N513-K516 PolarHBondContact O-N 3.28Å; Y514-K516 VanDerWaalsContact C-N 3.32Å; Y514-K516 PolarHBondContact O-N 3.34Å; K516-N520 WeakPolarHBondContact O-CB 3.39Å; K516-N520 PolarHBondContact O-N 3.23Å; K516-N520 PolarHBondContact O-ND2 3.28Å; K516-N520 PolarHBondContact O-OD1 3.07Å
517	Q	64.4	Low	55.8	Low	91 Å²	91	61.2 Å²	61.2	43%	0.425	31%	0.306	S	S	.	.	H	α-helix	trans	-66.6	-42.1	174.4	-74.2	176.5	-4.2	0	0	112.3	N513 Y514 L515 N520 A521	N513-Q517 WeakPolarHBondContact O-CG 3.48Å; N513-Q517 PolarHBondContact O-N 2.85Å; Y514-Q517 WeakPolarHBondContact O-CB 3.4Å; Y514-Q517 PolarHBondContact O-N 3.19Å; Y514-Q517 VanDerWaalsContact O-N 3.15Å; L515-Q517 VanDerWaalsContact C-N 3.31Å; L515-Q517 PolarHBondContact O-N 2.93Å; Q517-N520 PolarHBondContact O-N 3.28Å; Q517-A521 WeakPolarHBondContact O-CB 3.24Å; Q517-A521 PolarHBondContact O-N 3.3Å
518	I	62.1	Low	55.7	Low	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.5	-46.3	177.3	-68.5	167.1	0	0	0	110.7	L493 L497 Y514 L515 A521 A522 F598 L602 L605	L493-I518 HydrophobicContact CD2-CG2 4.26Å; L497-I518 HydrophobicContact CD1-CB 4.32Å; L497-I518 HydrophobicContact CD1-CG2 3.62Å; L497-I518 HydrophobicContact CD2-CD1 4.46Å; L497-I518 HydrophobicContact CD2-CG2 4.46Å; Y514-I518 WeakPolarHBondContact O-CB 3.26Å; Y514-I518 VanDerWaalsContact O-CG1 3.24Å; Y514-I518 WeakPolarHBondContact O-CG1 3.45Å; Y514-I518 PolarHBondContact O-N 3.38Å; L515-I518 PolarHBondContact O-N 3.1Å; I518-A521 PolarHBondContact O-N 3.06Å; I518-A522 WeakPolarHBondContact O-CB 3.47Å; I518-A522 PolarHBondContact O-N 3.15Å; I518-F598 HydrophobicContact CG2-CD2 3.76Å; I518-F598 HydrophobicContact CG2-CE2 3.29Å; I518-F598 HydrophobicContact CG2-CZ 4.06Å; I518-L602 HydrophobicContact CD1-CD1 4.45Å; I518-L605 HydrophobicContact CD1-CB 4.31Å; I518-L605 HydrophobicContact CD1-CD2 3.73Å
519	L	63.6	Low	55.8	Low	26 Å²	26	61.1 Å²	61.1	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-48	174.3	-79.2	157.1	0	0	0	109.6	E494 L497 L515 A521 A522 Y523	E494-L519 HydrophobicContact CB-CD2 4.26Å; E494-L519 HydrophobicContact CG-CD2 4.3Å; L497-L519 HydrophobicContact CD1-CG 4.25Å; L515-L519 HydrophobicContact CD2-CD1 4.1Å; L515-L519 VanDerWaalsContact O-CB 3.26Å; L515-L519 WeakPolarHBondContact O-CB 3.33Å; L515-L519 WeakPolarHBondContact O-CD1 3.47Å; L515-L519 WeakPolarHBondContact O-CG 3.31Å; L515-L519 PolarHBondContact O-N 2.99Å; L519-A521 VanDerWaalsContact C-N 3.32Å; L519-A521 PolarHBondContact O-N 3.49Å; L519-A522 CarbonylContact O-C 3.57Å; L519-A522 WeakPolarHBondContact O-CA 3.49Å; L519-A522 WeakPolarHBondContact O-CB 3.29Å; L519-A522 PolarHBondContact O-N 3.45Å; L519-Y523 VanDerWaalsContact C-CD2 3.49Å; L519-Y523 HydrophobicContact CB-CD2 3.93Å; L519-Y523 HydrophobicContact CB-CE2 3.89Å; L519-Y523 HydrophobicContact CD2-CD2 4.35Å; L519-Y523 HydrophobicContact CD2-CE2 3.59Å; L519-Y523 HydrophobicContact CG-CE2 4.32Å; L519-Y523 WeakPolarHBondContact O-CB 3.4Å; L519-Y523 WeakPolarHBondContact O-CD2 3.27Å; L519-Y523 PolarHBondContact O-N 3.24Å
520	N	64.1	Low	55.9	Low	85 Å²	85	60.2 Å²	60.2	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-40.1	176.4	-76.2	-10.6	0	0	0	112.3	K516 Q517 A522 Y523 H524	K516-N520 WeakPolarHBondContact O-CB 3.39Å; K516-N520 PolarHBondContact O-N 3.23Å; K516-N520 PolarHBondContact O-ND2 3.28Å; K516-N520 PolarHBondContact O-OD1 3.07Å; Q517-N520 PolarHBondContact O-N 3.28Å; N520-A522 VanDerWaalsContact C-N 3.3Å; N520-A522 PolarHBondContact O-N 2.99Å; N520-Y523 PolarHBondContact O-N 3.08Å; N520-H524 VanDerWaalsContact O-CB 3.29Å; N520-H524 WeakPolarHBondContact O-CB 3.39Å; N520-H524 PolarHBondContact O-CD2 2.69Å; N520-H524 VanDerWaalsContact O-CD2 3.25Å; N520-H524 PolarHBondContact O-N 2.91Å
521	A	58.9	Low	55.7	Low	17 Å²	17	58.7 Å²	58.7	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-34.5	175.2	0	0	0	0	0	112.3	Q517 I518 L519 S594 A597	Q517-A521 WeakPolarHBondContact O-CB 3.24Å; Q517-A521 PolarHBondContact O-N 3.3Å; I518-A521 PolarHBondContact O-N 3.06Å; L519-A521 VanDerWaalsContact C-N 3.32Å; L519-A521 PolarHBondContact O-N 3.49Å; A521-S594 PolarHBondContact O-OG 3.26Å; A521-A597 HydrophobicContact CB-CB 4.41Å
522	A	55.7	Low	55.3	Low	15 Å²	15	59.4 Å²	59.4	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-77.9	-30.5	174.4	0	0	0	0	0	113.5	I518 L519 N520	I518-A522 WeakPolarHBondContact O-CB 3.47Å; I518-A522 PolarHBondContact O-N 3.15Å; L519-A522 CarbonylContact O-C 3.57Å; L519-A522 WeakPolarHBondContact O-CA 3.49Å; L519-A522 WeakPolarHBondContact O-CB 3.29Å; L519-A522 PolarHBondContact O-N 3.45Å; N520-A522 VanDerWaalsContact C-N 3.3Å; N520-A522 PolarHBondContact O-N 2.99Å
523	Y	53.8	Low	54.8	Low	104 Å²	104	62.9 Å²	62.9	41%	0.408	33%	0.328	S	S	.	.	H	α-helix	trans	-82.8	-31.7	180	-81.3	-68.4	0	0	0	112.8	V490 L519 N520 V525	V490-Y523 HydrophobicContact CG1-CE1 3.68Å; V490-Y523 HydrophobicContact CG1-CE2 4.36Å; V490-Y523 WeakPolarHBondContact CG1-OH 3.39Å; L519-Y523 VanDerWaalsContact C-CD2 3.49Å; L519-Y523 HydrophobicContact CB-CD2 3.93Å; L519-Y523 HydrophobicContact CB-CE2 3.89Å; L519-Y523 HydrophobicContact CD2-CD2 4.35Å; L519-Y523 HydrophobicContact CD2-CE2 3.59Å; L519-Y523 HydrophobicContact CG-CE2 4.32Å; L519-Y523 WeakPolarHBondContact O-CB 3.4Å; L519-Y523 WeakPolarHBondContact O-CD2 3.27Å; L519-Y523 PolarHBondContact O-N 3.24Å; N520-Y523 PolarHBondContact O-N 3.08Å; Y523-V525 PolarHBondContact O-N 3.06Å; Y523-V525 VanDerWaalsContact O-N 3.11Å
524	H	50.5	Low	54.4	Low	127 Å²	127	61.8 Å²	61.8	59%	0.588	33%	0.328	S	S	*	.			trans	-81.9	24.8	-176	-81.7	-59.8	0	0	0	115.6	N520 E526	N520-H524 VanDerWaalsContact O-CB 3.29Å; N520-H524 WeakPolarHBondContact O-CB 3.39Å; N520-H524 PolarHBondContact O-CD2 2.69Å; N520-H524 VanDerWaalsContact O-CD2 3.25Å; N520-H524 PolarHBondContact O-N 2.91Å; H524-E526 PolarHBondContact O-N 3.06Å
525	V	49.8	Very low	54	Low	24 Å²	24	59.7 Å²	59.7	15%	0.145	32%	0.321	C	S	.	.			trans	-73.4	48.4	156.6	-163.9	0	0	0	0	109.2	Y523 V527	Y523-V525 PolarHBondContact O-N 3.06Å; Y523-V525 VanDerWaalsContact O-N 3.11Å; V525-V527 HydrophobicContact CG1-CG2 4.35Å; V525-V527 PolarHBondContact O-N 3.24Å
526	E	45.3	Very low	53.3	Low	124 Å²	124	62.4 Å²	62.4	58%	0.579	34%	0.338	S	S	*	.			trans	-73.5	110.6	166.3	-84.3	-171.4	159.9	0	0	107.2	H524 T528 R590	H524-E526 PolarHBondContact O-N 3.06Å; E526-T528 PolarHBondContact O-N 3.43Å; E526-R590 PolarHBondContact O-NH1 3.41Å
527	V	47.8	Very low	52.7	Low	25 Å²	25	66.4 Å²	66.4	15%	0.152	35%	0.35	C	S	.	.			trans	-82.1	69.1	-179.7	-158.4	0	0	0	0	109.3	V525 F529 F587	V525-V527 HydrophobicContact CG1-CG2 4.35Å; V525-V527 PolarHBondContact O-N 3.24Å; V527-F529 HydrophobicContact CB-CE2 3.98Å; V527-F529 HydrophobicContact CB-CZ 4.39Å; V527-F529 HydrophobicContact CG1-CD1 4.42Å; V527-F529 HydrophobicContact CG1-CD2 3.78Å; V527-F529 HydrophobicContact CG1-CE1 3.8Å; V527-F529 HydrophobicContact CG1-CE2 3.13Å; V527-F529 HydrophobicContact CG1-CG 4.43Å; V527-F529 HydrophobicContact CG1-CZ 3.15Å; V527-F529 WeakPolarHBondContact O-CD2 3.43Å; V527-F529 PolarHBondContact O-N 3.45Å; V527-F587 HydrophobicContact CG1-CD2 4.26Å; V527-F587 HydrophobicContact CG2-CD2 4.36Å; V527-F587 HydrophobicContact CG2-CE2 4.22Å
528	T	45.3	Very low	52.2	Low	66 Å²	66	65.9 Å²	65.9	41%	0.405	35%	0.348	S	S	.	.			trans	-79	92.6	171.4	52.1	0	0	0	0	110	E526 H530 R590	E526-T528 PolarHBondContact O-N 3.43Å; T528-H530 PolarHBondContact O-N 2.86Å; T528-H530 PolarHBondContact O-ND1 2.98Å; T528-R590 VanDerWaalsContact O-CZ 3.28Å; T528-R590 PolarHBondContact O-NH1 2.96Å; T528-R590 PolarHBondContact O-NH2 2.88Å; T528-R590 PolarHBondContact OG1-NH1 3.46Å; T528-R590 PolarHBondContact OG1-NH2 3.46Å
529	F	49.4	Very low	51.6	Low	32 Å²	32	66.6 Å²	66.6	14%	0.14	35%	0.352	C	S	.	.			trans	-69	124.2	174.5	-64.2	-84.4	0	0	0	109.6	A475 V527 I583	A475-F529 HydrophobicContact CB-CD2 3.23Å; A475-F529 HydrophobicContact CB-CE2 3.41Å; A475-F529 VanDerWaalsContact CB-CE2 3.41Å; A475-F529 HydrophobicContact CB-CG 4.35Å; V527-F529 HydrophobicContact CB-CE2 3.98Å; V527-F529 HydrophobicContact CB-CZ 4.39Å; V527-F529 HydrophobicContact CG1-CD1 4.42Å; V527-F529 HydrophobicContact CG1-CD2 3.78Å; V527-F529 HydrophobicContact CG1-CE1 3.8Å; V527-F529 HydrophobicContact CG1-CE2 3.13Å; V527-F529 HydrophobicContact CG1-CG 4.43Å; V527-F529 HydrophobicContact CG1-CZ 3.15Å; V527-F529 WeakPolarHBondContact O-CD2 3.43Å; V527-F529 PolarHBondContact O-N 3.45Å; F529-I583 HydrophobicContact CD1-CG2 4.28Å; F529-I583 HydrophobicContact CE1-CB 4.3Å; F529-I583 HydrophobicContact CE1-CG2 3.48Å; F529-I583 VanDerWaalsContact CE1-CG2 3.48Å; F529-I583 HydrophobicContact CZ-CG2 3.78Å
530	H	48.6	Very low	50.9	Low	132 Å²	132	72.2 Å²	72.2	61%	0.611	37%	0.372	S	S	*	.			trans	-117.6	142	172.5	-67.3	18.1	0	0	0	107.7	T528 G532	T528-H530 PolarHBondContact O-N 2.86Å; T528-H530 PolarHBondContact O-ND1 2.98Å; H530-G532 VanDerWaalsContact C-N 3.34Å; H530-G532 PolarHBondContact O-N 3.05Å
531	S	47	Very low	50.5	Low	62 Å²	62	74.1 Å²	74.1	43%	0.434	38%	0.378	S	S	.	.			trans	-57.9	92.1	178.9	-57.2	0	0	0	0	110.4
532	G	48.2	Very low	50.2	Low	21 Å²	21	76.5 Å²	76.5	22%	0.216	39%	0.386	C	S	.	.			trans	-69.6	154.4	-177.8	0	0	0	0	0	112.5	H530 S534 V535 T536	H530-G532 VanDerWaalsContact C-N 3.34Å; H530-G532 PolarHBondContact O-N 3.05Å; G532-S534 PolarHBondContact O-N 3.29Å; G532-V535 PolarHBondContact O-N 3.21Å; G532-V535 VanDerWaalsContact O-N 3.16Å; G532-T536 PolarHBondContact O-N 2.71Å
533	S	48.6	Very low	49.9	Very low	99 Å²	99	76.4 Å²	76.4	69%	0.692	38%	0.384	S	S	*	.	H	α-helix	trans	-58.5	-19.4	-178.5	64.9	0	0	0	0	114.7	T536 R537	S533-T536 WeakPolarHBondContact CA-OG1 3.42Å; S533-T536 PolarHBondContact O-OG1 3.43Å; S533-T536 VanDerWaalsContact O-OG1 3.13Å; S533-R537 WeakPolarHBondContact O-CB 3.41Å; S533-R537 PolarHBondContact O-N 3.35Å; S533-R537 VanDerWaalsContact O-N 3.14Å
534	S	51.8	Low	49.9	Very low	69 Å²	69	77.1 Å²	77.1	48%	0.483	39%	0.389	S	S	.	.	H	α-helix	trans	-75.3	-39.9	177.7	56.1	0	0	0	0	112.8	G532 M538	G532-S534 PolarHBondContact O-N 3.29Å; S534-M538 WeakPolarHBondContact O-CB 3.42Å; S534-M538 PolarHBondContact O-N 3.38Å; S534-M538 VanDerWaalsContact O-N 3.1Å
535	V	50.8	Low	50.1	Low	15 Å²	15	75.4 Å²	75.4	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-70.8	-43.1	178.9	179.6	0	0	0	0	110	I467 G532 M538 L539 S582	I467-V535 HydrophobicContact CG2-CG1 4.35Å; G532-V535 PolarHBondContact O-N 3.21Å; G532-V535 VanDerWaalsContact O-N 3.16Å; V535-M538 WeakPolarHBondContact O-CB 3.35Å; V535-M538 PolarHBondContact O-N 2.73Å; V535-L539 HydrophobicContact CG1-CD1 4.24Å; V535-L539 WeakPolarHBondContact O-CD1 3.19Å; V535-L539 WeakPolarHBondContact O-CG 3.06Å; V535-L539 PolarHBondContact O-N 2.63Å; V535-S582 WeakPolarHBondContact CG2-OG 3.34Å
536	T	48	Very low	50.3	Low	61 Å²	61	75 Å²	75	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-67.1	-37.9	177.9	56.8	0	0	0	0	112.3	G532 S533 L539 W540	G532-T536 PolarHBondContact O-N 2.71Å; S533-T536 WeakPolarHBondContact CA-OG1 3.42Å; S533-T536 PolarHBondContact O-OG1 3.43Å; S533-T536 VanDerWaalsContact O-OG1 3.13Å; T536-L539 PolarHBondContact O-N 2.76Å; T536-W540 PolarHBondContact O-N 3.17Å; T536-W540 VanDerWaalsContact O-N 3.12Å
537	R	54	Low	50.6	Low	200 Å²	200	70.5 Å²	70.5	76%	0.755	36%	0.357	S	S	*	.	H	α-helix	trans	-68.3	-33.4	174.3	-174.8	175.3	159.8	177.7	-5.4	112.9	S533 L539 W540	S533-R537 WeakPolarHBondContact O-CB 3.41Å; S533-R537 PolarHBondContact O-N 3.35Å; S533-R537 VanDerWaalsContact O-N 3.14Å; R537-L539 VanDerWaalsContact C-N 3.32Å; R537-W540 PolarHBondContact O-N 2.79Å
538	M	53.8	Low	50.8	Low	79 Å²	79	75.7 Å²	75.7	39%	0.389	38%	0.38	S	S	.	.	H	α-helix	trans	-65.5	-35.6	175	-127	-176.2	69.7	0	0	112.7	S534 V535 K578	S534-M538 WeakPolarHBondContact O-CB 3.42Å; S534-M538 PolarHBondContact O-N 3.38Å; S534-M538 VanDerWaalsContact O-N 3.1Å; V535-M538 WeakPolarHBondContact O-CB 3.35Å; V535-M538 PolarHBondContact O-N 2.73Å; M538-K578 HydrophobicContact CE-CB 3.62Å; M538-K578 HydrophobicContact CE-CD 3.27Å; M538-K578 HydrophobicContact CE-CG 4.08Å; M538-K578 HydrophobicContact SD-CB 3.88Å; M538-K578 HydrophobicContact SD-CD 3.5Å; M538-K578 WeakPolarHBondContact SD-CD 3.48Å; M538-K578 HydrophobicContact SD-CG 4.24Å
539	L	48.4	Very low	51.3	Low	15 Å²	15	81.7 Å²	81.7	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-80	-29.2	179.7	-72.2	159.6	0	0	0	112.1	I467 V535 T536 R537 E541 Q542 I543 L574	I467-L539 HydrophobicContact CD1-CD1 3.11Å; I467-L539 HydrophobicContact CG1-CD1 4.09Å; V535-L539 HydrophobicContact CG1-CD1 4.24Å; V535-L539 WeakPolarHBondContact O-CD1 3.19Å; V535-L539 WeakPolarHBondContact O-CG 3.06Å; V535-L539 PolarHBondContact O-N 2.63Å; T536-L539 PolarHBondContact O-N 2.76Å; R537-L539 VanDerWaalsContact C-N 3.32Å; L539-E541 PolarHBondContact O-N 3.49Å; L539-Q542 CarbonylContact O-C 3.51Å; L539-Q542 WeakPolarHBondContact O-CA 3.4Å; L539-Q542 PolarHBondContact O-N 2.86Å; L539-I543 VanDerWaalsContact O-CG1 3.29Å; L539-I543 WeakPolarHBondContact O-CG1 3.45Å; L539-I543 PolarHBondContact O-N 3.24Å; L539-L574 HydrophobicContact CD2-CD2 4.33Å
540	W	48.2	Very low	51.4	Low	144 Å²	144	81.8 Å²	81.8	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-55.9	-36.8	172.8	-167.8	-105.8	0	0	0	113.4	T536 R537 Q542 I543 K544	T536-W540 PolarHBondContact O-N 3.17Å; T536-W540 VanDerWaalsContact O-N 3.12Å; R537-W540 PolarHBondContact O-N 2.79Å; W540-Q542 VanDerWaalsContact C-N 3.33Å; W540-I543 HydrophobicContact CE3-CD1 3.98Å; W540-K544 PolarHBondContact O-N 2.94Å
541	E	56.5	Low	51.4	Low	125 Å²	125	79.5 Å²	79.5	58%	0.584	39%	0.392	S	S	*	.	H	α-helix	trans	-66.3	-32.5	173.5	-75.6	-89.4	132.3	0	0	112.5	L539	L539-E541 PolarHBondContact O-N 3.49Å
542	Q	53	Low	51.5	Low	68 Å²	68	87.6 Å²	87.6	32%	0.318	41%	0.414	S	S	.	.	H	α-helix	trans	-86.5	-31.4	179.2	-65	-66.2	-48.8	0	0	112.6	L539 W540 K544 Q545 I546	L539-Q542 CarbonylContact O-C 3.51Å; L539-Q542 WeakPolarHBondContact O-CA 3.4Å; L539-Q542 PolarHBondContact O-N 2.86Å; W540-Q542 VanDerWaalsContact C-N 3.33Å; Q542-K544 PolarHBondContact O-N 3.37Å; Q542-Q545 WeakPolarHBondContact O-CA 3.49Å; Q542-Q545 WeakPolarHBondContact O-CB 3.44Å; Q542-Q545 PolarHBondContact O-N 3.08Å; Q542-I546 PolarHBondContact O-N 2.83Å
543	I	49.9	Very low	51.4	Low	13 Å²	13	92 Å²	92	7%	0.067	44%	0.436	C	S	.	.	H	α-helix	trans	-54.7	-41.3	168.9	-72.9	171.7	0	0	0	109.5	L539 W540 Q545 I547	L539-I543 VanDerWaalsContact O-CG1 3.29Å; L539-I543 WeakPolarHBondContact O-CG1 3.45Å; L539-I543 PolarHBondContact O-N 3.24Å; W540-I543 HydrophobicContact CE3-CD1 3.98Å; I543-Q545 VanDerWaalsContact C-N 3.3Å; I543-Q545 PolarHBondContact O-N 3.3Å; I543-I547 HydrophobicContact CG2-CD1 3.34Å; I543-I547 HydrophobicContact CG2-CG1 4.15Å; I543-I547 VanDerWaalsContact O-CB 3.24Å; I543-I547 WeakPolarHBondContact O-CB 3.31Å; I543-I547 WeakPolarHBondContact O-CD1 3.43Å; I543-I547 WeakPolarHBondContact O-CG1 3.29Å; I543-I547 PolarHBondContact O-N 3.39Å
544	K	52.3	Low	51.6	Low	118 Å²	118	94.3 Å²	94.3	51%	0.513	44%	0.44	S	S	.	.	H	α-helix	trans	-57.6	-40.9	172.8	-81.8	-178.6	178.2	173.9	0	112.5	W540 Q542 Q548	W540-K544 PolarHBondContact O-N 2.94Å; Q542-K544 PolarHBondContact O-N 3.37Å; K544-Q548 VanDerWaalsContact O-CB 3.32Å; K544-Q548 WeakPolarHBondContact O-CB 3.14Å; K544-Q548 WeakPolarHBondContact O-CG 3.4Å; K544-Q548 PolarHBondContact O-N 3.26Å
545	Q	56.3	Low	51.6	Low	92 Å²	92	94.5 Å²	94.5	43%	0.43	44%	0.44	S	S	.	.	H	α-helix	trans	-75.2	-41.1	-178.3	-65.8	-159.1	1.2	0	0	113.2	Q542 I543 Q548 R549	Q542-Q545 WeakPolarHBondContact O-CA 3.49Å; Q542-Q545 WeakPolarHBondContact O-CB 3.44Å; Q542-Q545 PolarHBondContact O-N 3.08Å; I543-Q545 VanDerWaalsContact C-N 3.3Å; I543-Q545 PolarHBondContact O-N 3.3Å; Q545-Q548 PolarHBondContact O-N 3.01Å; Q545-R549 WeakPolarHBondContact O-CG 3.43Å; Q545-R549 PolarHBondContact O-N 3.5Å; Q545-R549 VanDerWaalsContact O-N 3.12Å
546	I	52.8	Low	52	Low	15 Å²	15	95.1 Å²	95.1	8%	0.077	45%	0.445	C	S	.	.	H	α-helix	trans	-65.9	-45.5	177	-67.2	170.4	0	0	0	110	Q542 Q548 R549 I550	Q542-I546 PolarHBondContact O-N 2.83Å; I546-Q548 VanDerWaalsContact C-N 3.35Å; I546-Q548 PolarHBondContact O-N 3.33Å; I546-R549 PolarHBondContact O-N 2.95Å; I546-I550 HydrophobicContact CG2-CD1 3.48Å; I546-I550 VanDerWaalsContact CG2-CD1 3.48Å; I546-I550 HydrophobicContact CG2-CG1 4.27Å; I546-I550 WeakPolarHBondContact O-CB 3.28Å; I546-I550 VanDerWaalsContact O-CG1 3.31Å; I546-I550 WeakPolarHBondContact O-CG1 3.38Å; I546-I550 PolarHBondContact O-N 2.89Å
547	I	51.3	Low	52.8	Low	29 Å²	29	94.9 Å²	94.9	15%	0.149	44%	0.443	C	S	.	.	H	α-helix	trans	-60.8	-44.9	175.6	-67.9	169.9	0	0	0	110.5	K456 I459 I543 R549 I550 T551	K456-I547 HydrophobicContact CD-CD1 4.22Å; K456-I547 HydrophobicContact CG-CD1 3.57Å; I459-I547 HydrophobicContact CD1-CG1 4.08Å; I543-I547 HydrophobicContact CG2-CD1 3.34Å; I543-I547 HydrophobicContact CG2-CG1 4.15Å; I543-I547 VanDerWaalsContact O-CB 3.24Å; I543-I547 WeakPolarHBondContact O-CB 3.31Å; I543-I547 WeakPolarHBondContact O-CD1 3.43Å; I543-I547 WeakPolarHBondContact O-CG1 3.29Å; I543-I547 PolarHBondContact O-N 3.39Å; I547-R549 VanDerWaalsContact C-N 3.25Å; I547-R549 PolarHBondContact O-N 3.41Å; I547-I550 PolarHBondContact O-N 2.86Å; I547-T551 HydrophobicContact CG2-CG2 3.7Å; I547-T551 WeakPolarHBondContact O-CB 3.26Å; I547-T551 VanDerWaalsContact O-CG2 3.22Å; I547-T551 WeakPolarHBondContact O-CG2 3.48Å; I547-T551 PolarHBondContact O-N 2.86Å; I547-T551 PolarHBondContact O-OG1 3.11Å
548	Q	53.5	Low	53.6	Low	135 Å²	135	86.3 Å²	86.3	63%	0.631	41%	0.412	S	S	*	.	H	α-helix	trans	-58.2	-36.1	177.2	-83.6	175	-11.9	0	0	112.9	K544 Q545 I546 T551	K544-Q548 VanDerWaalsContact O-CB 3.32Å; K544-Q548 WeakPolarHBondContact O-CB 3.14Å; K544-Q548 WeakPolarHBondContact O-CG 3.4Å; K544-Q548 PolarHBondContact O-N 3.26Å; Q545-Q548 PolarHBondContact O-N 3.01Å; I546-Q548 VanDerWaalsContact C-N 3.35Å; I546-Q548 PolarHBondContact O-N 3.33Å; Q548-T551 PolarHBondContact O-OG1 3.37Å
549	R	54.5	Low	54.5	Low	191 Å²	191	85.4 Å²	85.4	72%	0.721	41%	0.411	S	S	*	.	H	α-helix	trans	-77	-37.3	176.7	-72	-179.8	-174.7	179.3	3	113.4	Q545 I546 I547	Q545-R549 WeakPolarHBondContact O-CG 3.43Å; Q545-R549 PolarHBondContact O-N 3.5Å; Q545-R549 VanDerWaalsContact O-N 3.12Å; I546-R549 PolarHBondContact O-N 2.95Å; I547-R549 VanDerWaalsContact C-N 3.25Å; I547-R549 PolarHBondContact O-N 3.41Å
550	I	51.3	Low	55.9	Low	34 Å²	34	89.9 Å²	89.9	17%	0.174	44%	0.435	C	S	.	.	H	α-helix	trans	-79.4	-31.5	-177.4	-65.1	176	0	0	0	111.8	I546 I547 W552 P556 V566	I546-I550 HydrophobicContact CG2-CD1 3.48Å; I546-I550 VanDerWaalsContact CG2-CD1 3.48Å; I546-I550 HydrophobicContact CG2-CG1 4.27Å; I546-I550 WeakPolarHBondContact O-CB 3.28Å; I546-I550 VanDerWaalsContact O-CG1 3.31Å; I546-I550 WeakPolarHBondContact O-CG1 3.38Å; I546-I550 PolarHBondContact O-N 2.89Å; I547-I550 PolarHBondContact O-N 2.86Å; I550-W552 PolarHBondContact O-N 3.38Å; I550-W552 VanDerWaalsContact O-N 3.09Å; I550-P556 HydrophobicContact CG2-CG 4.46Å; I550-V566 HydrophobicContact CD1-CG2 4.46Å
551	T	49.6	Very low	57.3	Low	85 Å²	85	90.7 Å²	90.7	52%	0.521	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-0.7	-179.4	51.9	0	0	0	0	115.7	I547 Q548	I547-T551 HydrophobicContact CG2-CG2 3.7Å; I547-T551 WeakPolarHBondContact O-CB 3.26Å; I547-T551 VanDerWaalsContact O-CG2 3.22Å; I547-T551 WeakPolarHBondContact O-CG2 3.48Å; I547-T551 PolarHBondContact O-N 2.86Å; I547-T551 PolarHBondContact O-OG1 3.11Å; Q548-T551 PolarHBondContact O-OG1 3.37Å
552	W	48.9	Very low	58.5	Low	232 Å²	232	85.8 Å²	85.8	88%	0.879	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	2	-178.3	-110.9	64.9	0	0	0	114.9	I550	I550-W552 PolarHBondContact O-N 3.38Å; I550-W552 VanDerWaalsContact O-N 3.09Å
553	V	46.6	Very low	59.9	Low	113 Å²	113	84 Å²	84	69%	0.685	41%	0.411	S	S	*	.	S	Bend	trans	-123.6	143.7	169.6	-172.1	0	0	0	0	107.2
554	N	51.3	Low	61.4	Low	147 Å²	147	87.5 Å²	87.5	79%	0.786	42%	0.424	S	S	*	.	S	Bend	trans	-33.2	149	-176	-69	-38.6	0	0	0	115.1
555	P	52.6	Low	62.7	Low	74 Å²	74	88.1 Å²	88.1	48%	0.481	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-57.3	127.9	-161.5	-14.5	26.8	0	0	0	110.8	T449 T557	T449-P555 HydrophobicContact CG2-CB 3.51Å; T449-P555 HydrophobicContact CG2-CG 3.73Å; P555-T557 PolarHBondContact O-N 3.44Å
556	P	59	Low	63.7	Low	28 Å²	28	84 Å²	84	18%	0.182	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-71.5	126.1	-172.8	26.4	-31.8	0	0	0	110	I455 I550 W562	I455-P556 HydrophobicContact CD1-CG 3.99Å; I550-P556 HydrophobicContact CG2-CG 4.46Å; P556-W562 HydrophobicContact CB-CG 4.35Å
557	T	64.6	Low	65	Low	55 Å²	55	83.2 Å²	83.2	34%	0.337	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-69.1	133.6	159.7	39.1	0	0	0	0	108.5	G447 P555 T559	G447-T557 WeakPolarHBondContact O-CG2 3.47Å; P555-T557 PolarHBondContact O-N 3.44Å; T557-T559 PolarHBondContact O-N 2.97Å
558	I	70.4	Confident	66.4	Low	21 Å²	21	83.9 Å²	83.9	11%	0.108	41%	0.406	C	S	.	.			trans	-74.7	81.2	178.5	-64.8	-176.4	0	0	0	108.2	F438 V443 I450 C458 W562 K563	F438-I558 HydrophobicContact CD2-CG2 4.33Å; F438-I558 HydrophobicContact CE2-CD1 4.38Å; F438-I558 HydrophobicContact CE2-CG2 3.6Å; V443-I558 HydrophobicContact CG1-CB 4.11Å; V443-I558 HydrophobicContact CG1-CG2 4.32Å; V443-I558 HydrophobicContact CG2-CD1 4.38Å; V443-I558 HydrophobicContact CG2-CG2 4.38Å; I450-I558 HydrophobicContact CD1-CB 4.24Å; I450-I558 HydrophobicContact CD1-CD1 3.26Å; I450-I558 HydrophobicContact CD1-CG1 3.66Å; C458-I558 HydrophobicContact CB-CD1 4.4Å; I558-W562 HydrophobicContact CB-CE3 4.24Å; I558-W562 HydrophobicContact CB-CZ3 4.46Å; I558-W562 HydrophobicContact CD1-CZ3 4.28Å; I558-W562 HydrophobicContact CG1-CE3 4.05Å; I558-W562 HydrophobicContact CG1-CH2 4.37Å; I558-W562 HydrophobicContact CG1-CZ3 3.91Å; I558-W562 HydrophobicContact CG2-CE3 3.97Å; I558-W562 HydrophobicContact CG2-CZ3 4.06Å; I558-K563 HydrophobicContact CG2-CG 4.22Å
559	T	74.3	Confident	67.4	Low	60 Å²	60	80.1 Å²	80.1	37%	0.368	39%	0.389	S	S	.	.			trans	-92.7	163.3	174.3	62.1	0	0	0	0	110.8	T557 E561 W562 K563	T557-T559 PolarHBondContact O-N 2.97Å; T559-E561 PolarHBondContact O-N 3.46Å; T559-W562 WeakPolarHBondContact O-CB 3.3Å; T559-W562 PolarHBondContact O-N 3.4Å; T559-W562 VanDerWaalsContact O-N 3.1Å; T559-W562 WeakPolarHBondContact OG1-CB 3.44Å; T559-W562 PolarHBondContact OG1-N 3.49Å; T559-W562 VanDerWaalsContact OG1-N 3.12Å; T559-K563 PolarHBondContact O-N 3.39Å
560	L	78.3	Confident	68.2	Low	109 Å²	109	71.2 Å²	71.2	57%	0.571	36%	0.356	S	S	*	.	H	α-helix	trans	-51.4	-43.7	170.9	-77.7	155.9	0	0	0	111.4	A434 K563 R564	A434-L560 HydrophobicContact CB-CD2 3.99Å; A434-L560 VanDerWaalsContact O-CD2 3.26Å; A434-L560 WeakPolarHBondContact O-CD2 3.35Å; L560-K563 PolarHBondContact O-N 2.89Å; L560-R564 WeakPolarHBondContact O-CB 3.33Å; L560-R564 PolarHBondContact O-N 3.38Å
561	E	76.9	Confident	69.3	Low	161 Å²	161	70.2 Å²	70.2	75%	0.752	35%	0.351	S	S	*	.	H	α-helix	trans	-65.9	-38.1	177.5	-65.4	-177.1	172	0	0	112.8	T559 R564 K565	T559-E561 PolarHBondContact O-N 3.46Å; E561-R564 PolarHBondContact O-N 3.35Å; E561-K565 WeakPolarHBondContact O-CB 3.26Å; E561-K565 PolarHBondContact O-N 2.87Å
562	W	81.1	Confident	70.4	Confident	22 Å²	22	71.3 Å²	71.3	8%	0.083	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-46.3	175.9	178.1	84.4	0	0	0	111.5	F438 I455 C458 I459 I462 P556 I558 T559 R564 K565 V566	F438-W562 HydrophobicContact CZ-CZ3 4.27Å; I455-W562 HydrophobicContact CG2-CH2 4.48Å; I455-W562 HydrophobicContact CG2-CZ2 4.06Å; C458-W562 HydrophobicContact CB-CH2 4.07Å; C458-W562 HydrophobicContact CB-CZ3 4.3Å; I459-W562 HydrophobicContact CG1-CH2 4.15Å; I459-W562 HydrophobicContact CG1-CZ2 4.21Å; I462-W562 HydrophobicContact CD1-CZ3 4.43Å; P556-W562 HydrophobicContact CB-CG 4.35Å; I558-W562 HydrophobicContact CB-CE3 4.24Å; I558-W562 HydrophobicContact CB-CZ3 4.46Å; I558-W562 HydrophobicContact CD1-CZ3 4.28Å; I558-W562 HydrophobicContact CG1-CE3 4.05Å; I558-W562 HydrophobicContact CG1-CH2 4.37Å; I558-W562 HydrophobicContact CG1-CZ3 3.91Å; I558-W562 HydrophobicContact CG2-CE3 3.97Å; I558-W562 HydrophobicContact CG2-CZ3 4.06Å; T559-W562 WeakPolarHBondContact O-CB 3.3Å; T559-W562 PolarHBondContact O-N 3.4Å; T559-W562 VanDerWaalsContact O-N 3.1Å; T559-W562 WeakPolarHBondContact OG1-CB 3.44Å; T559-W562 PolarHBondContact OG1-N 3.49Å; T559-W562 VanDerWaalsContact OG1-N 3.12Å; W562-R564 VanDerWaalsContact C-N 3.32Å; W562-R564 PolarHBondContact O-N 3.2Å; W562-K565 PolarHBondContact O-N 2.86Å; W562-V566 HydrophobicContact CD2-CG2 3.95Å; W562-V566 HydrophobicContact CE3-CG2 4.34Å; W562-V566 HydrophobicContact CG-CG2 4.5Å; W562-V566 HydrophobicContact CH2-CG2 4.1Å; W562-V566 HydrophobicContact CZ2-CG2 3.66Å; W562-V566 HydrophobicContact CZ3-CG2 4.41Å; W562-V566 WeakPolarHBondContact O-CG2 3.18Å; W562-V566 PolarHBondContact O-N 2.96Å
563	K	81.9	Confident	71.3	Confident	29 Å²	29	61.9 Å²	61.9	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-43.3	177	-64.6	-176.2	-162.6	170.7	0	111.4	A433 A434 M436 F438 I462 I558 T559 L560 K565 V566 A567	A433-K563 WeakPolarHBondContact O-CB 3.4Å; A433-K563 VanDerWaalsContact O-CD 3.27Å; A433-K563 WeakPolarHBondContact O-CD 3.49Å; A434-K563 WeakPolarHBondContact O-CD 3.26Å; A434-K563 PolarHBondContact O-NZ 3.03Å; M436-K563 PolarHBondContact O-NZ 3.44Å; F438-K563 HydrophobicContact CE2-CD 4.03Å; F438-K563 HydrophobicContact CE2-CG 4.23Å; F438-K563 HydrophobicContact CZ-CD 4.09Å; F438-K563 HydrophobicContact CZ-CG 4.1Å; I462-K563 HydrophobicContact CD1-CB 4.19Å; I462-K563 HydrophobicContact CD1-CG 4.32Å; I558-K563 HydrophobicContact CG2-CG 4.22Å; T559-K563 PolarHBondContact O-N 3.39Å; L560-K563 PolarHBondContact O-N 2.89Å; K563-K565 PolarHBondContact O-N 3.32Å; K563-V566 PolarHBondContact O-N 3.49Å; K563-A567 WeakPolarHBondContact O-CB 3.32Å; K563-A567 PolarHBondContact O-N 3.34Å
564	R	83	Confident	72.3	Confident	87 Å²	87	57.9 Å²	57.9	33%	0.328	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-42	176.6	-150.7	180	-179	122.7	6.5	111.4	E427 L430 D431 L560 E561 W562 A567 Q568	E427-R564 IonicContact OE2-NH2 2.65Å; E427-R564 PolarHBondContact OE2-NH2 3.35Å; E427-R564 VanDerWaalsContact OE2-NH2 3.1Å; L430-R564 HydrophobicContact CB-CG 3.85Å; L430-R564 HydrophobicContact CD2-CG 4.14Å; L430-R564 VanDerWaalsContact CD2-O 3.32Å; L430-R564 WeakPolarHBondContact CD2-O 3.36Å; L430-R564 HydrophobicContact CG-CG 4.45Å; D431-R564 IonicContact OD1-CZ 3.1Å; D431-R564 IonicContact OD1-NH1 3.07Å; D431-R564 PolarHBondContact OD1-NH1 3.41Å; D431-R564 IonicContact OD1-NH2 3.25Å; D431-R564 PolarHBondContact OD1-NH2 3.27Å; L560-R564 WeakPolarHBondContact O-CB 3.33Å; L560-R564 PolarHBondContact O-N 3.38Å; E561-R564 PolarHBondContact O-N 3.35Å; W562-R564 VanDerWaalsContact C-N 3.32Å; W562-R564 PolarHBondContact O-N 3.2Å; R564-A567 PolarHBondContact O-N 3.17Å; R564-Q568 WeakPolarHBondContact O-CB 3.37Å; R564-Q568 PolarHBondContact O-N 3.14Å
565	K	78.7	Confident	73.2	Confident	132 Å²	132	53.1 Å²	53.1	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-66.5	-42.8	176.4	-172.4	178	179.6	-179	0	112.8	E561 W562 K563 A567 Q568 E569	E561-K565 WeakPolarHBondContact O-CB 3.26Å; E561-K565 PolarHBondContact O-N 2.87Å; W562-K565 PolarHBondContact O-N 2.86Å; K563-K565 PolarHBondContact O-N 3.32Å; K565-A567 VanDerWaalsContact C-N 3.33Å; K565-Q568 WeakPolarHBondContact O-CB 3.09Å; K565-Q568 PolarHBondContact O-N 2.85Å; K565-E569 WeakPolarHBondContact CE-OE1 3.22Å; K565-E569 WeakPolarHBondContact O-CG 3.45Å; K565-E569 PolarHBondContact O-N 3.47Å
566	V	78	Confident	73.9	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.024	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-41.1	175.2	170.2	0	0	0	0	111	I459 I462 I550 W562 K563 A570	I459-V566 HydrophobicContact CB-CG1 4.47Å; I459-V566 HydrophobicContact CG1-CG1 4.03Å; I459-V566 HydrophobicContact CG2-CG1 4.35Å; I462-V566 HydrophobicContact CD1-CB 4.31Å; I462-V566 HydrophobicContact CD1-CG1 3.99Å; I462-V566 HydrophobicContact CG2-CG1 4.31Å; I550-V566 HydrophobicContact CD1-CG2 4.46Å; W562-V566 HydrophobicContact CD2-CG2 3.95Å; W562-V566 HydrophobicContact CE3-CG2 4.34Å; W562-V566 HydrophobicContact CG-CG2 4.5Å; W562-V566 HydrophobicContact CH2-CG2 4.1Å; W562-V566 HydrophobicContact CZ2-CG2 3.66Å; W562-V566 HydrophobicContact CZ3-CG2 4.41Å; W562-V566 WeakPolarHBondContact O-CG2 3.18Å; W562-V566 PolarHBondContact O-N 2.96Å; K563-V566 PolarHBondContact O-N 3.49Å; V566-A570 VanDerWaalsContact O-CB 3.28Å; V566-A570 WeakPolarHBondContact O-CB 3.26Å; V566-A570 PolarHBondContact O-N 2.97Å
567	A	79.1	Confident	74.4	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-41.6	174.3	0	0	0	0	0	112.3	L430 A433 I462 I466 K563 R564 K565 A570 I571	L430-A567 HydrophobicContact CD2-CB 3.88Å; A433-A567 HydrophobicContact CB-CB 3.45Å; A433-A567 VanDerWaalsContact CB-CB 3.45Å; I462-A567 HydrophobicContact CG2-CB 3.92Å; I466-A567 HydrophobicContact CD1-CB 3.81Å; K563-A567 WeakPolarHBondContact O-CB 3.32Å; K563-A567 PolarHBondContact O-N 3.34Å; R564-A567 PolarHBondContact O-N 3.17Å; K565-A567 VanDerWaalsContact C-N 3.33Å; A567-A570 WeakPolarHBondContact O-CB 3.28Å; A567-A570 PolarHBondContact O-N 3.26Å; A567-I571 VanDerWaalsContact O-CG1 3.28Å; A567-I571 WeakPolarHBondContact O-CG1 3.46Å; A567-I571 PolarHBondContact O-N 3.19Å
568	Q	80.7	Confident	74.5	Confident	42 Å²	42	53.7 Å²	53.7	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-48	175.6	-175.9	54.5	52.2	0	0	111.8	K426 L430 R564 K565 A570 I571 D572	K426-Q568 VanDerWaalsContact CE-CD 3.45Å; L430-Q568 HydrophobicContact CD2-CB 3.84Å; R564-Q568 WeakPolarHBondContact O-CB 3.37Å; R564-Q568 PolarHBondContact O-N 3.14Å; K565-Q568 WeakPolarHBondContact O-CB 3.09Å; K565-Q568 PolarHBondContact O-N 2.85Å; Q568-A570 VanDerWaalsContact C-N 3.31Å; Q568-A570 PolarHBondContact O-N 3.23Å; Q568-I571 PolarHBondContact O-N 2.95Å; Q568-D572 PolarHBondContact NE2-OD1 2.73Å; Q568-D572 PolarHBondContact NE2-OD2 3.12Å; Q568-D572 VanDerWaalsContact O-CG 3.25Å; Q568-D572 PolarHBondContact O-N 3.2Å
569	E	74	Confident	74.3	Confident	57 Å²	57	53.1 Å²	53.1	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-65.9	-33	176.4	-70.3	179.6	-166.9	0	0	112.3	K565 S573	K565-E569 WeakPolarHBondContact CE-OE1 3.22Å; K565-E569 WeakPolarHBondContact O-CG 3.45Å; K565-E569 PolarHBondContact O-N 3.47Å; E569-S573 VanDerWaalsContact O-CB 3.32Å; E569-S573 WeakPolarHBondContact O-CB 3.36Å; E569-S573 PolarHBondContact O-N 3.16Å; E569-S573 VanDerWaalsContact O-N 3.12Å; E569-S573 PolarHBondContact O-OG 3.11Å
570	A	71.9	Confident	74.1	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-41.9	172.4	0	0	0	0	0	112.1	Q463 I466 V566 A567 Q568 S573 L574	Q463-A570 HydrophobicContact CG-CB 3.84Å; I466-A570 HydrophobicContact CD1-CB 3.9Å; V566-A570 VanDerWaalsContact O-CB 3.28Å; V566-A570 WeakPolarHBondContact O-CB 3.26Å; V566-A570 PolarHBondContact O-N 2.97Å; A567-A570 WeakPolarHBondContact O-CB 3.28Å; A567-A570 PolarHBondContact O-N 3.26Å; Q568-A570 VanDerWaalsContact C-N 3.31Å; Q568-A570 PolarHBondContact O-N 3.23Å; A570-S573 WeakPolarHBondContact CA-OG 3.46Å; A570-S573 PolarHBondContact O-N 3.22Å; A570-S573 PolarHBondContact O-OG 3.48Å; A570-L574 WeakPolarHBondContact O-CG 3.5Å; A570-L574 PolarHBondContact O-N 3.04Å
571	I	73.5	Confident	73.7	Confident	13 Å²	13	50.4 Å²	50.4	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-46.8	176.2	-71.1	164.3	0	0	0	110.6	L422 K426 L429 L430 I466 A567 Q568 S573 L574	L422-I571 HydrophobicContact CD2-CG2 4.33Å; K426-I571 HydrophobicContact CG-CD1 4.48Å; L429-I571 HydrophobicContact CB-CD1 4.15Å; L430-I571 HydrophobicContact CD2-CD1 4.18Å; L430-I571 HydrophobicContact CG-CD1 4.36Å; I466-I571 HydrophobicContact CD1-CG1 4.31Å; I466-I571 HydrophobicContact CG2-CG1 4.06Å; A567-I571 VanDerWaalsContact O-CG1 3.28Å; A567-I571 WeakPolarHBondContact O-CG1 3.46Å; A567-I571 PolarHBondContact O-N 3.19Å; Q568-I571 PolarHBondContact O-N 2.95Å; I571-S573 PolarHBondContact O-N 2.97Å; I571-L574 WeakPolarHBondContact O-CB 3.17Å; I571-L574 PolarHBondContact O-N 2.86Å; I571-L574 VanDerWaalsContact O-N 3.16Å
572	D	72.7	Confident	73.4	Confident	108 Å²	108	43.7 Å²	43.7	58%	0.578	22%	0.218	S	C	*	.	H	α-helix	trans	-69.4	-22.1	-177.5	-65.1	-23.7	0	0	0	112.9	Q568	Q568-D572 PolarHBondContact NE2-OD1 2.73Å; Q568-D572 PolarHBondContact NE2-OD2 3.12Å; Q568-D572 VanDerWaalsContact O-CG 3.25Å; Q568-D572 PolarHBondContact O-N 3.2Å
573	S	68.2	Low	72.6	Confident	34 Å²	34	42.9 Å²	42.9	24%	0.238	22%	0.215	C	C	.	.	H	α-helix	trans	-87.8	-8.4	175.6	58.7	0	0	0	0	114	E569 A570 I571 S575	E569-S573 VanDerWaalsContact O-CB 3.32Å; E569-S573 WeakPolarHBondContact O-CB 3.36Å; E569-S573 PolarHBondContact O-N 3.16Å; E569-S573 VanDerWaalsContact O-N 3.12Å; E569-S573 PolarHBondContact O-OG 3.11Å; A570-S573 WeakPolarHBondContact CA-OG 3.46Å; A570-S573 PolarHBondContact O-N 3.22Å; A570-S573 PolarHBondContact O-OG 3.48Å; I571-S573 PolarHBondContact O-N 2.97Å; S573-S575 PolarHBondContact O-N 2.76Å
574	L	67.3	Low	71.9	Confident	29 Å²	29	41.5 Å²	41.5	15%	0.152	21%	0.209	C	C	.	.			trans	-72.7	117.5	175.2	-76.2	165.4	0	0	0	110.8	L422 I466 L470 L539 A570 I571 A576 L579	L422-L574 HydrophobicContact CD2-CD1 4.19Å; I466-L574 HydrophobicContact CG2-CD1 3.99Å; L470-L574 HydrophobicContact CD2-CD1 4.18Å; L539-L574 HydrophobicContact CD2-CD2 4.33Å; A570-L574 WeakPolarHBondContact O-CG 3.5Å; A570-L574 PolarHBondContact O-N 3.04Å; I571-L574 WeakPolarHBondContact O-CB 3.17Å; I571-L574 PolarHBondContact O-N 2.86Å; I571-L574 VanDerWaalsContact O-N 3.16Å; L574-A576 PolarHBondContact O-N 3.48Å; L574-L579 HydrophobicContact CD2-CD1 4.35Å
575	S	71.3	Confident	71.4	Confident	47 Å²	47	39.7 Å²	39.7	33%	0.329	21%	0.21	S	C	.	.			trans	-83.2	104.8	170.3	179.7	0	0	0	0	110.3	S573 S577 K578 L579	S573-S575 PolarHBondContact O-N 2.76Å; S575-S577 PolarHBondContact O-N 3.34Å; S575-S577 VanDerWaalsContact O-N 3.15Å; S575-K578 PolarHBondContact O-N 3.39Å; S575-L579 PolarHBondContact O-N 3.47Å
576	A	67.5	Low	70.9	Confident	12 Å²	12	35.9 Å²	35.9	10%	0.099	19%	0.194	C	C	.	.	H	α-helix	trans	-52.5	-35.6	174.5	0	0	0	0	0	112.7	K415 I418 V419 L574 L579 A580	K415-A576 HydrophobicContact CG-CB 4.14Å; I418-A576 HydrophobicContact CB-CB 4.31Å; I418-A576 HydrophobicContact CG2-CB 3.79Å; V419-A576 HydrophobicContact CG2-CB 3.48Å; V419-A576 VanDerWaalsContact CG2-CB 3.48Å; L574-A576 PolarHBondContact O-N 3.48Å; A576-L579 PolarHBondContact O-N 3.42Å; A576-A580 VanDerWaalsContact O-CB 3.27Å; A576-A580 WeakPolarHBondContact O-CB 3.46Å; A576-A580 PolarHBondContact O-N 2.91Å
577	S	68.4	Low	70.4	Confident	45 Å²	45	36.6 Å²	36.6	32%	0.315	20%	0.197	S	C	.	.	H	α-helix	trans	-64.2	-40.5	177	-174.9	0	0	0	0	113.1	S575 K581	S575-S577 PolarHBondContact O-N 3.34Å; S575-S577 VanDerWaalsContact O-N 3.15Å; S577-K581 WeakPolarHBondContact O-CG 3.37Å; S577-K581 PolarHBondContact O-N 3.02Å; S577-K581 VanDerWaalsContact O-N 3.14Å
578	K	67.7	Low	70.1	Confident	112 Å²	112	39.8 Å²	39.8	49%	0.487	21%	0.209	S	C	.	.	H	α-helix	trans	-76.2	-34.6	178.9	-66.1	-176.3	-177.6	179.2	0	111.5	M538 S575 K581 S582	M538-K578 HydrophobicContact CE-CB 3.62Å; M538-K578 HydrophobicContact CE-CD 3.27Å; M538-K578 HydrophobicContact CE-CG 4.08Å; M538-K578 HydrophobicContact SD-CB 3.88Å; M538-K578 HydrophobicContact SD-CD 3.5Å; M538-K578 WeakPolarHBondContact SD-CD 3.48Å; M538-K578 HydrophobicContact SD-CG 4.24Å; S575-K578 PolarHBondContact O-N 3.39Å; K578-K581 PolarHBondContact O-N 3.13Å; K578-S582 PolarHBondContact O-N 3.23Å
579	L	66.3	Low	69.8	Low	9 Å²	9	42.1 Å²	42.1	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-46.9	174.5	-155.3	108.1	0	0	0	111.1	I418 L470 L574 S575 A576 K581 S582 I583	I418-L579 HydrophobicContact CD1-CB 4.35Å; I418-L579 HydrophobicContact CD1-CD2 3.85Å; I418-L579 HydrophobicContact CG1-CD2 4.17Å; I418-L579 HydrophobicContact CG2-CD2 3.92Å; L470-L579 HydrophobicContact CD2-CD1 4.31Å; L470-L579 HydrophobicContact CD2-CD2 3.77Å; L470-L579 HydrophobicContact CG-CD2 4.26Å; L574-L579 HydrophobicContact CD2-CD1 4.35Å; S575-L579 PolarHBondContact O-N 3.47Å; A576-L579 PolarHBondContact O-N 3.42Å; L579-K581 VanDerWaalsContact C-N 3.34Å; L579-K581 PolarHBondContact O-N 3.3Å; L579-S582 PolarHBondContact O-N 2.98Å; L579-S582 VanDerWaalsContact O-N 3.11Å; L579-I583 HydrophobicContact CD2-CD1 3.7Å; L579-I583 HydrophobicContact CG-CD1 4.17Å; L579-I583 WeakPolarHBondContact O-CG1 3.27Å; L579-I583 PolarHBondContact O-N 2.96Å
580	A	68.9	Low	69.6	Low	1 Å²	1	43.8 Å²	43.8	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-55.9	-46.4	173.8	0	0	0	0	0	111.7	M414 K415 I418 A576 S582 I583 C584	M414-A580 HydrophobicContact CB-CB 4.43Å; M414-A580 HydrophobicContact CG-CB 4.36Å; K415-A580 HydrophobicContact CB-CB 4.24Å; I418-A580 HydrophobicContact CD1-CB 3.79Å; A576-A580 VanDerWaalsContact O-CB 3.27Å; A576-A580 WeakPolarHBondContact O-CB 3.46Å; A576-A580 PolarHBondContact O-N 2.91Å; A580-S582 VanDerWaalsContact C-N 3.34Å; A580-S582 PolarHBondContact O-N 3.49Å; A580-I583 PolarHBondContact O-N 3.42Å; A580-C584 VanDerWaalsContact O-CB 3.31Å; A580-C584 WeakPolarHBondContact O-CB 3.19Å; A580-C584 PolarHBondContact O-N 2.89Å; A580-C584 PolarHBondContact O-SG 3.39Å; A580-C584 VanDerWaalsContact O-SG 3.37Å
581	K	71.2	Confident	69.5	Low	110 Å²	110	44 Å²	44	48%	0.478	23%	0.23	S	C	.	.	H	α-helix	trans	-59.4	-41.2	175.6	-78.5	176.7	-178.2	-178.2	0	112.8	S577 K578 L579 S585	S577-K581 WeakPolarHBondContact O-CG 3.37Å; S577-K581 PolarHBondContact O-N 3.02Å; S577-K581 VanDerWaalsContact O-N 3.14Å; K578-K581 PolarHBondContact O-N 3.13Å; L579-K581 VanDerWaalsContact C-N 3.34Å; L579-K581 PolarHBondContact O-N 3.3Å; K581-S585 VanDerWaalsContact O-CB 3.28Å; K581-S585 WeakPolarHBondContact O-CB 3.34Å; K581-S585 PolarHBondContact O-N 3Å
582	S	69.1	Low	69.8	Low	21 Å²	21	46 Å²	46	15%	0.147	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-45.6	178.5	-172.6	0	0	0	0	112	V535 K578 L579 A580 S585 Q586	V535-S582 WeakPolarHBondContact CG2-OG 3.34Å; K578-S582 PolarHBondContact O-N 3.23Å; L579-S582 PolarHBondContact O-N 2.98Å; L579-S582 VanDerWaalsContact O-N 3.11Å; A580-S582 VanDerWaalsContact C-N 3.34Å; A580-S582 PolarHBondContact O-N 3.49Å; S582-S585 PolarHBondContact O-N 3.48Å; S582-Q586 WeakPolarHBondContact O-CG 3.36Å; S582-Q586 PolarHBondContact O-N 3.37Å
583	I	65	Low	69.9	Low	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-48	179.3	-68.5	174.4	0	0	0	110.6	M414 I418 V474 L478 F529 L579 A580 S585 Q586 F587	M414-I583 HydrophobicContact CE-CG2 4.28Å; M414-I583 HydrophobicContact SD-CB 3.99Å; M414-I583 HydrophobicContact SD-CG2 3.5Å; M414-I583 VanDerWaalsContact SD-CG2 3.5Å; I418-I583 HydrophobicContact CD1-CD1 4.27Å; V474-I583 HydrophobicContact CG1-CD1 3.97Å; L478-I583 HydrophobicContact CD1-CG2 4.24Å; F529-I583 HydrophobicContact CD1-CG2 4.28Å; F529-I583 HydrophobicContact CE1-CB 4.3Å; F529-I583 HydrophobicContact CE1-CG2 3.48Å; F529-I583 VanDerWaalsContact CE1-CG2 3.48Å; F529-I583 HydrophobicContact CZ-CG2 3.78Å; L579-I583 HydrophobicContact CD2-CD1 3.7Å; L579-I583 HydrophobicContact CG-CD1 4.17Å; L579-I583 WeakPolarHBondContact O-CG1 3.27Å; L579-I583 PolarHBondContact O-N 2.96Å; A580-I583 PolarHBondContact O-N 3.42Å; I583-S585 VanDerWaalsContact C-N 3.29Å; I583-S585 PolarHBondContact O-N 2.89Å; I583-Q586 PolarHBondContact O-N 2.95Å; I583-F587 WeakPolarHBondContact O-CB 3.34Å; I583-F587 PolarHBondContact O-N 3.11Å
584	C	68.1	Low	70.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-38.4	174.3	-74.6	0	0	0	0	112.3	A580 R588	A580-C584 VanDerWaalsContact O-CB 3.31Å; A580-C584 WeakPolarHBondContact O-CB 3.19Å; A580-C584 PolarHBondContact O-N 2.89Å; A580-C584 PolarHBondContact O-SG 3.39Å; A580-C584 VanDerWaalsContact O-SG 3.37Å; C584-R588 WeakPolarHBondContact O-CB 3.28Å; C584-R588 VanDerWaalsContact O-CG 3.3Å; C584-R588 WeakPolarHBondContact O-CG 3.49Å; C584-R588 PolarHBondContact O-N 3.06Å; C584-R588 PolarHBondContact O-NE 3.24Å
585	S	72.3	Confident	70.8	Confident	50 Å²	50	44.3 Å²	44.3	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-45.5	176.7	-167.3	0	0	0	0	111.8	K581 S582 I583 F587 R588 T589	K581-S585 VanDerWaalsContact O-CB 3.28Å; K581-S585 WeakPolarHBondContact O-CB 3.34Å; K581-S585 PolarHBondContact O-N 3Å; S582-S585 PolarHBondContact O-N 3.48Å; I583-S585 VanDerWaalsContact C-N 3.29Å; I583-S585 PolarHBondContact O-N 2.89Å; S585-F587 VanDerWaalsContact C-N 3.34Å; S585-F587 PolarHBondContact O-N 3.18Å; S585-R588 PolarHBondContact O-N 3.14Å; S585-T589 PolarHBondContact O-N 3.5Å; S585-T589 PolarHBondContact O-OG1 2.95Å
586	Q	67.8	Low	71.3	Confident	51 Å²	51	48.4 Å²	48.4	24%	0.238	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-40.4	177.4	-72.1	-178.4	5	0	0	111.9	S582 I583 T589 R590	S582-Q586 WeakPolarHBondContact O-CG 3.36Å; S582-Q586 PolarHBondContact O-N 3.37Å; I583-Q586 PolarHBondContact O-N 2.95Å; Q586-T589 PolarHBondContact O-N 3.25Å; Q586-R590 PolarHBondContact O-N 3.46Å; Q586-R590 VanDerWaalsContact O-N 3.1Å
587	F	68.3	Low	71.7	Confident	20 Å²	20	49.9 Å²	49.9	9%	0.088	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-47.1	176	-175.4	-114.5	0	0	0	111.9	A407 V482 V527 I583 S585 T589 R590 L591	A407-F587 HydrophobicContact CB-CD1 3.61Å; A407-F587 HydrophobicContact CB-CE1 3.78Å; V482-F587 HydrophobicContact CG2-CE2 4.45Å; V482-F587 HydrophobicContact CG2-CZ 4.11Å; V527-F587 HydrophobicContact CG1-CD2 4.26Å; V527-F587 HydrophobicContact CG2-CD2 4.36Å; V527-F587 HydrophobicContact CG2-CE2 4.22Å; I583-F587 WeakPolarHBondContact O-CB 3.34Å; I583-F587 PolarHBondContact O-N 3.11Å; S585-F587 VanDerWaalsContact C-N 3.34Å; S585-F587 PolarHBondContact O-N 3.18Å; F587-T589 PolarHBondContact O-N 3.28Å; F587-R590 PolarHBondContact O-N 3.17Å; F587-L591 HydrophobicContact CD1-CD1 3.61Å; F587-L591 HydrophobicContact CD2-CD1 4.44Å; F587-L591 HydrophobicContact CE1-CD1 3.24Å; F587-L591 HydrophobicContact CE1-CG 4.4Å; F587-L591 HydrophobicContact CE2-CD1 4.13Å; F587-L591 HydrophobicContact CG-CD1 4.21Å; F587-L591 HydrophobicContact CZ-CD1 3.53Å; F587-L591 HydrophobicContact CZ-CG 4.3Å; F587-L591 WeakPolarHBondContact O-CB 3.39Å; F587-L591 PolarHBondContact O-N 3.5Å
588	R	72.6	Confident	72.2	Confident	66 Å²	66	47.9 Å²	47.9	25%	0.249	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-45.7	175.5	-77.3	-173	-92.8	110.7	-3.8	112.5	M404 A407 C584 S585 R590 L591 N592	M404-R588 HydrophobicContact CE-CB 4.14Å; M404-R588 HydrophobicContact CE-CG 3.8Å; M404-R588 HydrophobicContact SD-CB 4.33Å; M404-R588 HydrophobicContact SD-CG 3.72Å; A407-R588 HydrophobicContact CB-CG 3.96Å; C584-R588 WeakPolarHBondContact O-CB 3.28Å; C584-R588 VanDerWaalsContact O-CG 3.3Å; C584-R588 WeakPolarHBondContact O-CG 3.49Å; C584-R588 PolarHBondContact O-N 3.06Å; C584-R588 PolarHBondContact O-NE 3.24Å; S585-R588 PolarHBondContact O-N 3.14Å; R588-R590 VanDerWaalsContact C-N 3.33Å; R588-R590 PolarHBondContact O-N 3.44Å; R588-L591 PolarHBondContact O-N 3.06Å; R588-N592 PolarHBondContact O-N 2.86Å; R588-N592 PolarHBondContact O-OD1 3.27Å
589	T	72.9	Confident	72.9	Confident	91 Å²	91	43.4 Å²	43.4	56%	0.558	23%	0.231	S	C	*	.	H	α-helix	trans	-62.9	-39.5	179.5	-55.7	0	0	0	0	112	S585 Q586 F587 S593	S585-T589 PolarHBondContact O-N 3.5Å; S585-T589 PolarHBondContact O-OG1 2.95Å; Q586-T589 PolarHBondContact O-N 3.25Å; F587-T589 PolarHBondContact O-N 3.28Å; T589-S593 WeakPolarHBondContact O-CB 3.42Å; T589-S593 PolarHBondContact O-N 3Å
590	R	69.9	Low	73.6	Confident	93 Å²	93	45.3 Å²	45.3	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-69.6	-40.3	175.9	-73	-169.8	-176.7	-158.9	3.3	112.9	E526 T528 Q586 F587 R588 S593 S594	E526-R590 PolarHBondContact O-NH1 3.41Å; T528-R590 VanDerWaalsContact O-CZ 3.28Å; T528-R590 PolarHBondContact O-NH1 2.96Å; T528-R590 PolarHBondContact O-NH2 2.88Å; T528-R590 PolarHBondContact OG1-NH1 3.46Å; T528-R590 PolarHBondContact OG1-NH2 3.46Å; Q586-R590 PolarHBondContact O-N 3.46Å; Q586-R590 VanDerWaalsContact O-N 3.1Å; F587-R590 PolarHBondContact O-N 3.17Å; R588-R590 VanDerWaalsContact C-N 3.33Å; R588-R590 PolarHBondContact O-N 3.44Å; R590-S593 PolarHBondContact O-N 3.17Å; R590-S594 WeakPolarHBondContact O-CB 3.13Å; R590-S594 PolarHBondContact O-N 3.28Å
591	L	71.6	Confident	74	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-48.6	174	-90	162.2	0	0	0	111.7	L403 F587 R588 S593 S594 H595	L403-L591 HydrophobicContact CB-CD1 4.11Å; L403-L591 HydrophobicContact CB-CD2 3.72Å; L403-L591 HydrophobicContact CD1-CD2 3.68Å; L403-L591 HydrophobicContact CG-CD2 4.35Å; F587-L591 HydrophobicContact CD1-CD1 3.61Å; F587-L591 HydrophobicContact CD2-CD1 4.44Å; F587-L591 HydrophobicContact CE1-CD1 3.24Å; F587-L591 HydrophobicContact CE1-CG 4.4Å; F587-L591 HydrophobicContact CE2-CD1 4.13Å; F587-L591 HydrophobicContact CG-CD1 4.21Å; F587-L591 HydrophobicContact CZ-CD1 3.53Å; F587-L591 HydrophobicContact CZ-CG 4.3Å; F587-L591 WeakPolarHBondContact O-CB 3.39Å; F587-L591 PolarHBondContact O-N 3.5Å; R588-L591 PolarHBondContact O-N 3.06Å; L591-S593 VanDerWaalsContact C-N 3.34Å; L591-S593 PolarHBondContact O-N 3.23Å; L591-S594 PolarHBondContact O-N 3.49Å; L591-H595 WeakPolarHBondContact O-CB 3.38Å; L591-H595 PolarHBondContact O-N 2.97Å
592	N	78.5	Confident	74.4	Confident	55 Å²	55	41.2 Å²	41.2	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-45.3	176.3	-76.1	16.7	0	0	0	111.6	Y400 R588 S594 H595 E596	Y400-N592 WeakPolarHBondContact CE2-OD1 3.16Å; Y400-N592 PolarHBondContact OH-OD1 3.32Å; R588-N592 PolarHBondContact O-N 2.86Å; R588-N592 PolarHBondContact O-OD1 3.27Å; N592-S594 VanDerWaalsContact C-N 3.34Å; N592-S594 PolarHBondContact O-N 3.5Å; N592-H595 PolarHBondContact O-N 3.36Å; N592-E596 WeakPolarHBondContact O-CB 3.47Å; N592-E596 WeakPolarHBondContact O-CG 3.37Å; N592-E596 PolarHBondContact O-N 3.28Å
593	S	76.3	Confident	75	Confident	72 Å²	72	48 Å²	48	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-38.3	179.1	-177.9	0	0	0	0	112.7	T589 R590 L591 A597	T589-S593 WeakPolarHBondContact O-CB 3.42Å; T589-S593 PolarHBondContact O-N 3Å; R590-S593 PolarHBondContact O-N 3.17Å; L591-S593 VanDerWaalsContact C-N 3.34Å; L591-S593 PolarHBondContact O-N 3.23Å; S593-A597 VanDerWaalsContact O-CB 3.3Å; S593-A597 WeakPolarHBondContact O-CB 3.4Å; S593-A597 PolarHBondContact O-N 2.76Å
594	S	72.3	Confident	75.6	Confident	27 Å²	27	52.4 Å²	52.4	19%	0.189	28%	0.276	C	S	.	.	H	α-helix	trans	-69	-43	176.3	173.6	0	0	0	0	111.5	A521 R590 L591 N592 A597 F598	A521-S594 PolarHBondContact O-OG 3.26Å; R590-S594 WeakPolarHBondContact O-CB 3.13Å; R590-S594 PolarHBondContact O-N 3.28Å; L591-S594 PolarHBondContact O-N 3.49Å; N592-S594 VanDerWaalsContact C-N 3.34Å; N592-S594 PolarHBondContact O-N 3.5Å; S594-A597 PolarHBondContact O-N 2.98Å; S594-F598 WeakPolarHBondContact O-CB 3.35Å; S594-F598 PolarHBondContact O-N 2.69Å
595	H	80	Confident	76	Confident	38 Å²	38	52.5 Å²	52.5	18%	0.176	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-46.4	174.6	176.4	61.3	0	0	0	112.3	E396 N397 Y400 L591 N592 A597 F598 A599	E396-H595 VanDerWaalsContact CD-ND1 3.31Å; E396-H595 IonicContact OE1-CE1 2.91Å; E396-H595 IonicContact OE1-CG 2.95Å; E396-H595 IonicContact OE1-ND1 3.91Å; E396-H595 PolarHBondContact OE1-ND1 3.37Å; E396-H595 IonicContact OE2-CE1 2.76Å; E396-H595 PolarHBondContact OE2-CE1 2.87Å; E396-H595 VanDerWaalsContact OE2-CE1 3.29Å; E396-H595 IonicContact OE2-ND1 3.73Å; E396-H595 PolarHBondContact OE2-ND1 2.86Å; E396-H595 VanDerWaalsContact OE2-ND1 3.16Å; N397-H595 PolarHBondContact OD1-CE1 2.77Å; Y400-H595 HydrophobicContact CD2-CB 3.55Å; Y400-H595 AromaticContact CD2-CG 3.68Å; Y400-H595 HydrophobicContact CE2-CB 3.89Å; Y400-H595 HydrophobicContact CG-CB 4.17Å; Y400-H595 AromaticContact CG-CG 3.82Å; Y400-H595 AromaticContact CG-ND1 3.86Å; L591-H595 WeakPolarHBondContact O-CB 3.38Å; L591-H595 PolarHBondContact O-N 2.97Å; N592-H595 PolarHBondContact O-N 3.36Å; H595-A597 PolarHBondContact O-N 3.31Å; H595-F598 PolarHBondContact O-N 3.2Å; H595-A599 WeakPolarHBondContact O-CB 3.33Å; H595-A599 PolarHBondContact O-N 2.82Å
596	E	81.9	Confident	76.2	Confident	133 Å²	133	54.2 Å²	54.2	62%	0.621	28%	0.279	S	S	*	.	H	α-helix	trans	-63	-42.4	176.6	-75.7	176.7	-176.2	0	0	112.1	N592 A599 A600	N592-E596 WeakPolarHBondContact O-CB 3.47Å; N592-E596 WeakPolarHBondContact O-CG 3.37Å; N592-E596 PolarHBondContact O-N 3.28Å; E596-A599 PolarHBondContact O-N 3.47Å; E596-A600 WeakPolarHBondContact O-CB 3.01Å; E596-A600 PolarHBondContact O-N 3.29Å
597	A	76.9	Confident	76.6	Confident	42 Å²	42	55 Å²	55	35%	0.347	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-44.5	176	0	0	0	0	0	111.6	A521 S593 S594 H595 A600 S601	A521-A597 HydrophobicContact CB-CB 4.41Å; S593-A597 VanDerWaalsContact O-CB 3.3Å; S593-A597 WeakPolarHBondContact O-CB 3.4Å; S593-A597 PolarHBondContact O-N 2.76Å; S594-A597 PolarHBondContact O-N 2.98Å; H595-A597 PolarHBondContact O-N 3.31Å; A597-A600 PolarHBondContact O-N 3.18Å; A597-S601 PolarHBondContact O-N 2.82Å; A597-S601 PolarHBondContact O-OG 2.97Å
598	F	78.8	Confident	76.8	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-49.8	175.2	-178.2	-85.8	0	0	0	111.5	T392 E396 L493 I518 S594 H595 A600 S601 L602	T392-F598 HydrophobicContact CG2-CZ 3.97Å; E396-F598 HydrophobicContact CB-CD1 3.97Å; E396-F598 HydrophobicContact CB-CE1 3.43Å; E396-F598 VanDerWaalsContact CB-CE1 3.43Å; E396-F598 HydrophobicContact CB-CZ 3.76Å; E396-F598 VanDerWaalsContact CD-CD1 3.41Å; E396-F598 HydrophobicContact CG-CD1 3.39Å; E396-F598 HydrophobicContact CG-CD2 4.17Å; E396-F598 HydrophobicContact CG-CE1 3.39Å; E396-F598 HydrophobicContact CG-CE2 4.14Å; E396-F598 HydrophobicContact CG-CG 3.81Å; E396-F598 HydrophobicContact CG-CZ 3.79Å; L493-F598 HydrophobicContact CD1-CE2 4.04Å; L493-F598 HydrophobicContact CD1-CZ 3.89Å; L493-F598 HydrophobicContact CD2-CE2 3.7Å; L493-F598 HydrophobicContact CD2-CZ 4.11Å; I518-F598 HydrophobicContact CG2-CD2 3.76Å; I518-F598 HydrophobicContact CG2-CE2 3.29Å; I518-F598 HydrophobicContact CG2-CZ 4.06Å; S594-F598 WeakPolarHBondContact O-CB 3.35Å; S594-F598 PolarHBondContact O-N 2.69Å; H595-F598 PolarHBondContact O-N 3.2Å; F598-A600 VanDerWaalsContact C-N 3.3Å; F598-A600 PolarHBondContact O-N 3.32Å; F598-S601 PolarHBondContact O-N 3.37Å; F598-L602 HydrophobicContact CE1-CB 4.45Å; F598-L602 HydrophobicContact CE1-CD2 4.02Å; F598-L602 WeakPolarHBondContact O-CB 3.16Å; F598-L602 PolarHBondContact O-N 3.37Å
599	A	81.7	Confident	76.7	Confident	17 Å²	17	53.9 Å²	53.9	14%	0.14	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-37.6	179	0	0	0	0	0	112.1	H595 E596 R603	H595-A599 WeakPolarHBondContact O-CB 3.33Å; H595-A599 PolarHBondContact O-N 2.82Å; E596-A599 PolarHBondContact O-N 3.47Å; A599-R603 WeakPolarHBondContact O-CB 3.34Å; A599-R603 VanDerWaalsContact O-CG 3.28Å; A599-R603 WeakPolarHBondContact O-CG 3.44Å; A599-R603 PolarHBondContact O-N 3.08Å
600	A	82.1	Confident	76.6	Confident	50 Å²	50	52.2 Å²	52.2	41%	0.413	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-47.5	174.9	0	0	0	0	0	112.1	E596 A597 F598 L602 R603 Q604	E596-A600 WeakPolarHBondContact O-CB 3.01Å; E596-A600 PolarHBondContact O-N 3.29Å; A597-A600 PolarHBondContact O-N 3.18Å; F598-A600 VanDerWaalsContact C-N 3.3Å; F598-A600 PolarHBondContact O-N 3.32Å; A600-L602 VanDerWaalsContact C-N 3.34Å; A600-L602 PolarHBondContact O-N 2.84Å; A600-R603 PolarHBondContact O-N 3.4Å; A600-Q604 PolarHBondContact O-N 2.98Å
601	S	76.9	Confident	76.5	Confident	18 Å²	18	49 Å²	49	13%	0.126	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-38.4	177.1	-63.7	0	0	0	0	112.4	A597 F598 Q604 L605	A597-S601 PolarHBondContact O-N 2.82Å; A597-S601 PolarHBondContact O-OG 2.97Å; F598-S601 PolarHBondContact O-N 3.37Å; S601-Q604 PolarHBondContact O-N 3.48Å; S601-L605 WeakPolarHBondContact O-CB 3.5Å; S601-L605 PolarHBondContact O-N 2.86Å
602	L	79.3	Confident	76.3	Confident	6 Å²	6	52.9 Å²	52.9	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-41.5	176.5	-170.1	67.1	0	0	0	111.8	L389 T392 R393 I518 F598 A600 Q604 L605 E606	L389-L602 HydrophobicContact CD2-CD1 3.83Å; T392-L602 HydrophobicContact CG2-CD1 4.38Å; R393-L602 HydrophobicContact CB-CD2 3.73Å; R393-L602 HydrophobicContact CG-CD2 4.3Å; I518-L602 HydrophobicContact CD1-CD1 4.45Å; F598-L602 HydrophobicContact CE1-CB 4.45Å; F598-L602 HydrophobicContact CE1-CD2 4.02Å; F598-L602 WeakPolarHBondContact O-CB 3.16Å; F598-L602 PolarHBondContact O-N 3.37Å; A600-L602 VanDerWaalsContact C-N 3.34Å; A600-L602 PolarHBondContact O-N 2.84Å; L602-Q604 VanDerWaalsContact C-N 3.32Å; L602-Q604 PolarHBondContact O-N 3.14Å; L602-L605 HydrophobicContact CD1-CD2 4.39Å; L602-L605 WeakPolarHBondContact O-CB 3.27Å; L602-L605 PolarHBondContact O-N 3.19Å; L602-E606 WeakPolarHBondContact O-CB 3.21Å; L602-E606 PolarHBondContact O-N 3.25Å
603	R	82.1	Confident	75.7	Confident	165 Å²	165	51.7 Å²	51.7	62%	0.623	30%	0.297	S	S	*	.	H	α-helix	trans	-62.4	-38.8	173.7	-75.3	-179.2	-163.3	110.2	-1.6	112.2	A599 A600 E606 A607	A599-R603 WeakPolarHBondContact O-CB 3.34Å; A599-R603 VanDerWaalsContact O-CG 3.28Å; A599-R603 WeakPolarHBondContact O-CG 3.44Å; A599-R603 PolarHBondContact O-N 3.08Å; A600-R603 PolarHBondContact O-N 3.4Å; R603-E606 PolarHBondContact O-N 2.93Å; R603-A607 WeakPolarHBondContact O-CB 3.26Å; R603-A607 PolarHBondContact O-N 2.99Å
604	Q	77.3	Confident	75.3	Confident	96 Å²	96	53.4 Å²	53.4	45%	0.449	30%	0.297	S	S	.	.	H	α-helix	trans	-68.2	-40	177.3	-168.1	175.9	8.4	0	0	111.7	Y514 A600 S601 L602 G608	Y514-Q604 HydrophobicContact CD1-CG 4.47Å; Y514-Q604 HydrophobicContact CE1-CB 4.5Å; Y514-Q604 HydrophobicContact CE1-CG 3.75Å; Y514-Q604 PolarHBondContact OH-NE2 2.92Å; A600-Q604 PolarHBondContact O-N 2.98Å; S601-Q604 PolarHBondContact O-N 3.48Å; L602-Q604 VanDerWaalsContact C-N 3.32Å; L602-Q604 PolarHBondContact O-N 3.14Å; Q604-G608 PolarHBondContact O-N 3.39Å
605	L	76.2	Confident	75.1	Confident	2 Å²	2	58 Å²	58	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-45.5	171.9	-177.2	72.2	0	0	0	111	L389 T511 Y514 I518 S601 L602 G608 H609	L389-L605 HydrophobicContact CD2-CD2 3.92Å; T511-L605 HydrophobicContact CG2-CD1 4.35Å; Y514-L605 HydrophobicContact CD2-CD1 4.42Å; Y514-L605 HydrophobicContact CG-CD1 4.32Å; I518-L605 HydrophobicContact CD1-CB 4.31Å; I518-L605 HydrophobicContact CD1-CD2 3.73Å; S601-L605 WeakPolarHBondContact O-CB 3.5Å; S601-L605 PolarHBondContact O-N 2.86Å; L602-L605 HydrophobicContact CD1-CD2 4.39Å; L602-L605 WeakPolarHBondContact O-CB 3.27Å; L602-L605 PolarHBondContact O-N 3.19Å; L605-G608 PolarHBondContact O-N 3.15Å; L605-H609 WeakPolarHBondContact CD1-CD2 3.46Å; L605-H609 WeakPolarHBondContact O-CB 3.28Å; L605-H609 PolarHBondContact O-CD2 3.49Å; L605-H609 VanDerWaalsContact O-CD2 3.31Å; L605-H609 PolarHBondContact O-N 3.2Å
606	E	77.1	Confident	74.4	Confident	85 Å²	85	57.6 Å²	57.6	40%	0.397	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-48.2	177.6	-174.8	174.5	-164.7	0	0	111.8	L389 L602 R603 G608 H609 S610	L389-E606 HydrophobicContact CD1-CB 4.07Å; L389-E606 HydrophobicContact CD1-CG 4.06Å; L602-E606 WeakPolarHBondContact O-CB 3.21Å; L602-E606 PolarHBondContact O-N 3.25Å; R603-E606 PolarHBondContact O-N 2.93Å; E606-G608 PolarHBondContact O-N 3.44Å; E606-H609 PolarHBondContact O-N 3.47Å; E606-S610 VanDerWaalsContact O-CB 3.27Å; E606-S610 WeakPolarHBondContact O-CB 3.48Å; E606-S610 PolarHBondContact O-N 3.2Å
607	A	76.9	Confident	73.7	Confident	68 Å²	68	53.5 Å²	53.5	56%	0.562	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-42.1	176.7	0	0	0	0	0	112.2	R603 G611	R603-A607 WeakPolarHBondContact O-CB 3.26Å; R603-A607 PolarHBondContact O-N 2.99Å; A607-G611 PolarHBondContact O-N 2.96Å
608	G	72.1	Confident	73.3	Confident	33 Å²	33	56.2 Å²	56.2	34%	0.34	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-40.5	176.9	0	0	0	0	0	113.1	Q604 L605 E606 R612	Q604-G608 PolarHBondContact O-N 3.39Å; L605-G608 PolarHBondContact O-N 3.15Å; E606-G608 PolarHBondContact O-N 3.44Å; G608-R612 WeakPolarHBondContact O-CB 3.5Å; G608-R612 WeakPolarHBondContact O-CD 3.44Å; G608-R612 WeakPolarHBondContact O-CG 3.29Å; G608-R612 PolarHBondContact O-N 3.2Å
609	H	70.6	Confident	72.6	Confident	30 Å²	30	58.8 Å²	58.8	14%	0.139	32%	0.317	C	S	.	.	H	α-helix	trans	-70.9	-46.9	175.4	-88.7	-85.5	0	0	0	111.9	T511 L605 E606 R612 L613	T511-H609 WeakPolarHBondContact CG2-NE2 3.27Å; T511-H609 PolarHBondContact OG1-CE1 3.07Å; T511-H609 PolarHBondContact OG1-NE2 3.19Å; T511-H609 VanDerWaalsContact OG1-NE2 3.16Å; L605-H609 WeakPolarHBondContact CD1-CD2 3.46Å; L605-H609 WeakPolarHBondContact O-CB 3.28Å; L605-H609 PolarHBondContact O-CD2 3.49Å; L605-H609 VanDerWaalsContact O-CD2 3.31Å; L605-H609 PolarHBondContact O-N 3.2Å; E606-H609 PolarHBondContact O-N 3.47Å; H609-R612 PolarHBondContact O-N 3.15Å; H609-L613 WeakPolarHBondContact O-CB 3.17Å; H609-L613 PolarHBondContact O-N 3.09Å
610	S	69.5	Low	72	Confident	55 Å²	55	58.7 Å²	58.7	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-49.4	179.4	-161.4	0	0	0	0	111.3	E606 R612 L613 E614	E606-S610 VanDerWaalsContact O-CB 3.27Å; E606-S610 WeakPolarHBondContact O-CB 3.48Å; E606-S610 PolarHBondContact O-N 3.2Å; S610-R612 VanDerWaalsContact C-N 3.27Å; S610-R612 PolarHBondContact O-N 2.92Å; S610-L613 PolarHBondContact O-N 3.41Å; S610-E614 WeakPolarHBondContact O-CB 3.39Å; S610-E614 WeakPolarHBondContact O-CG 3.3Å; S610-E614 PolarHBondContact O-N 2.9Å; S610-E614 PolarHBondContact OG-OE1 2.69Å
611	G	68.6	Low	71.4	Confident	27 Å²	27	59.4 Å²	59.4	28%	0.278	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-28.9	179.7	0	0	0	0	0	113.6	A607 K615	A607-G611 PolarHBondContact O-N 2.96Å; G611-K615 VanDerWaalsContact O-CG 3.25Å; G611-K615 WeakPolarHBondContact O-CG 3.36Å; G611-K615 PolarHBondContact O-N 2.93Å
612	R	67.9	Low	70.9	Confident	88 Å²	88	65 Å²	65	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-74.5	-46.1	171.7	-75.8	176.1	63.8	143.4	12.5	111.9	S507 G608 H609 S610 E614 K615 T616	S507-R612 VanDerWaalsContact CB-CZ 3.49Å; G608-R612 WeakPolarHBondContact O-CB 3.5Å; G608-R612 WeakPolarHBondContact O-CD 3.44Å; G608-R612 WeakPolarHBondContact O-CG 3.29Å; G608-R612 PolarHBondContact O-N 3.2Å; H609-R612 PolarHBondContact O-N 3.15Å; S610-R612 VanDerWaalsContact C-N 3.27Å; S610-R612 PolarHBondContact O-N 2.92Å; R612-E614 VanDerWaalsContact C-N 3.33Å; R612-E614 PolarHBondContact O-N 3.32Å; R612-K615 PolarHBondContact O-N 2.92Å; R612-T616 VanDerWaalsContact O-CB 3.3Å; R612-T616 WeakPolarHBondContact O-CB 3.03Å; R612-T616 PolarHBondContact O-N 3.48Å; R612-T616 PolarHBondContact O-OG1 3.39Å; R612-T616 VanDerWaalsContact O-OG1 3.07Å
613	L	65.6	Low	70.4	Confident	30 Å²	30	65 Å²	65	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-41.1	179.5	-101.5	132.6	0	0	0	111.5	D381 L382 H609 S610 T616 E617	D381-L613 HydrophobicContact CB-CD2 4.27Å; L382-L613 HydrophobicContact CB-CD2 4.22Å; L382-L613 HydrophobicContact CD2-CB 3.94Å; L382-L613 HydrophobicContact CD2-CD2 3.43Å; L382-L613 VanDerWaalsContact CD2-CD2 3.43Å; L382-L613 HydrophobicContact CD2-CG 4.29Å; L382-L613 HydrophobicContact CG-CD2 3.41Å; L382-L613 VanDerWaalsContact CG-CD2 3.41Å; H609-L613 WeakPolarHBondContact O-CB 3.17Å; H609-L613 PolarHBondContact O-N 3.09Å; S610-L613 PolarHBondContact O-N 3.41Å; L613-T616 PolarHBondContact O-N 2.83Å; L613-E617 WeakPolarHBondContact O-CA 3.49Å; L613-E617 WeakPolarHBondContact O-CB 3.2Å; L613-E617 PolarHBondContact O-N 3.36Å
614	E	66.9	Low	69.8	Low	107 Å²	107	58.9 Å²	58.9	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-47	174.7	-74.3	169.9	-160.1	0	0	112	S610 R612 T616 E617 D618	S610-E614 WeakPolarHBondContact O-CB 3.39Å; S610-E614 WeakPolarHBondContact O-CG 3.3Å; S610-E614 PolarHBondContact O-N 2.9Å; S610-E614 PolarHBondContact OG-OE1 2.69Å; R612-E614 VanDerWaalsContact C-N 3.33Å; R612-E614 PolarHBondContact O-N 3.32Å; E614-T616 VanDerWaalsContact C-N 3.34Å; E614-T616 PolarHBondContact O-N 3.22Å; E614-E617 PolarHBondContact O-N 3.45Å; E614-D618 PolarHBondContact O-N 3.18Å
615	K	68.6	Low	69.5	Low	123 Å²	123	61.6 Å²	61.6	54%	0.535	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-41.1	176.8	-74.1	175.8	-176.4	-178.6	0	112.1	G611 R612 L619	G611-K615 VanDerWaalsContact O-CG 3.25Å; G611-K615 WeakPolarHBondContact O-CG 3.36Å; G611-K615 PolarHBondContact O-N 2.93Å; R612-K615 PolarHBondContact O-N 2.92Å; K615-L619 PolarHBondContact O-N 3.47Å
616	T	65.6	Low	69.4	Low	30 Å²	30	65.9 Å²	65.9	18%	0.184	34%	0.342	C	S	.	.	H	α-helix	trans	-69.8	-40.7	176.7	-65.1	0	0	0	0	110.6	M378 R612 L613 E614 L619 W620	M378-T616 HydrophobicContact SD-CG2 3.97Å; R612-T616 VanDerWaalsContact O-CB 3.3Å; R612-T616 WeakPolarHBondContact O-CB 3.03Å; R612-T616 PolarHBondContact O-N 3.48Å; R612-T616 PolarHBondContact O-OG1 3.39Å; R612-T616 VanDerWaalsContact O-OG1 3.07Å; L613-T616 PolarHBondContact O-N 2.83Å; E614-T616 VanDerWaalsContact C-N 3.34Å; E614-T616 PolarHBondContact O-N 3.22Å; T616-L619 WeakPolarHBondContact O-CB 3.35Å; T616-L619 PolarHBondContact O-N 3.31Å; T616-W620 VanDerWaalsContact CG2-CD1 3.47Å; T616-W620 PolarHBondContact O-N 2.92Å
617	E	67.3	Low	69.6	Low	47 Å²	47	62.7 Å²	62.7	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-49.3	175.7	-177.1	175.9	-164	0	0	111.4	M378 L382 L613 E614 L619 W620 L621	M378-E617 HydrophobicContact CE-CB 4.18Å; M378-E617 HydrophobicContact CE-CG 4.06Å; M378-E617 HydrophobicContact SD-CB 4.31Å; L382-E617 HydrophobicContact CD1-CB 4.3Å; L382-E617 HydrophobicContact CD1-CG 4Å; L382-E617 WeakPolarHBondContact CD1-OE1 3.41Å; L382-E617 VanDerWaalsContact CD1-OE2 3.3Å; L382-E617 WeakPolarHBondContact CD1-OE2 3.43Å; L613-E617 WeakPolarHBondContact O-CA 3.49Å; L613-E617 WeakPolarHBondContact O-CB 3.2Å; L613-E617 PolarHBondContact O-N 3.36Å; E614-E617 PolarHBondContact O-N 3.45Å; E617-L619 VanDerWaalsContact C-N 3.26Å; E617-L619 PolarHBondContact O-N 2.95Å; E617-W620 PolarHBondContact O-N 3.15Å; E617-L621 WeakPolarHBondContact O-CB 3.41Å; E617-L621 PolarHBondContact O-N 3.17Å
618	D	68.2	Low	69.9	Low	100 Å²	100	59.6 Å²	59.6	54%	0.535	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-38.9	177.4	-83.4	-18.2	0	0	0	112.5	E614 K622	E614-D618 PolarHBondContact O-N 3.18Å; D618-K622 WeakPolarHBondContact O-CG 3.49Å; D618-K622 PolarHBondContact O-N 2.91Å
619	L	65	Low	70.5	Confident	58 Å²	58	58.7 Å²	58.7	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-52	176.6	-174.6	68.1	0	0	0	111	K615 T616 E617 L621 K622 V623	K615-L619 PolarHBondContact O-N 3.47Å; T616-L619 WeakPolarHBondContact O-CB 3.35Å; T616-L619 PolarHBondContact O-N 3.31Å; E617-L619 VanDerWaalsContact C-N 3.26Å; E617-L619 PolarHBondContact O-N 2.95Å; L619-L621 VanDerWaalsContact C-N 3.29Å; L619-L621 PolarHBondContact O-N 3.19Å; L619-K622 PolarHBondContact O-N 3.31Å; L619-V623 VanDerWaalsContact O-CG2 3.28Å; L619-V623 WeakPolarHBondContact O-CG2 3.41Å; L619-V623 PolarHBondContact O-N 3.15Å
620	W	68	Low	71.3	Confident	15 Å²	15	61.5 Å²	61.5	6%	0.057	30%	0.299	C	S	.	.	H	α-helix	trans	-68.4	-28.1	-179.9	-80.9	102.1	0	0	0	112.8	L91 I94 F371 Q374 M378 T616 E617 V623 R624	L91-W620 HydrophobicContact CD2-CE3 4.48Å; L91-W620 HydrophobicContact CD2-CH2 3.3Å; L91-W620 HydrophobicContact CD2-CZ2 3.87Å; L91-W620 HydrophobicContact CD2-CZ3 3.69Å; L91-W620 HydrophobicContact CG-CH2 4.18Å; L91-W620 HydrophobicContact CG-CZ2 4.28Å; I94-W620 HydrophobicContact CD1-CH2 4.15Å; I94-W620 HydrophobicContact CD1-CZ3 4.26Å; F371-W620 HydrophobicContact CD1-CZ3 4.11Å; Q374-W620 HydrophobicContact CB-CH2 4.09Å; Q374-W620 HydrophobicContact CB-CZ2 4.48Å; Q374-W620 HydrophobicContact CB-CZ3 4.1Å; Q374-W620 HydrophobicContact CG-CH2 4.43Å; M378-W620 HydrophobicContact CE-CB 3.57Å; M378-W620 HydrophobicContact CE-CG 4.28Å; M378-W620 HydrophobicContact SD-CB 3.62Å; M378-W620 VanDerWaalsContact SD-CD1 3.53Å; M378-W620 HydrophobicContact SD-CG 3.75Å; T616-W620 VanDerWaalsContact CG2-CD1 3.47Å; T616-W620 PolarHBondContact O-N 2.92Å; E617-W620 PolarHBondContact O-N 3.15Å; W620-V623 HydrophobicContact CE3-CG1 4.29Å; W620-V623 HydrophobicContact CZ3-CG1 4.39Å; W620-V623 PolarHBondContact O-N 3.37Å; W620-R624 WeakPolarHBondContact O-CB 3.18Å; W620-R624 PolarHBondContact O-N 2.86Å
621	L	68.8	Low	72.3	Confident	65 Å²	65	58.9 Å²	58.9	34%	0.34	28%	0.281	S	S	.	.	H	α-helix	trans	-68.9	-41.9	176	-163.8	151.7	0	0	0	110.7	E617 L619 K625	E617-L621 WeakPolarHBondContact O-CB 3.41Å; E617-L621 PolarHBondContact O-N 3.17Å; L619-L621 VanDerWaalsContact C-N 3.29Å; L619-L621 PolarHBondContact O-N 3.19Å; L621-K625 VanDerWaalsContact O-CB 3.27Å; L621-K625 WeakPolarHBondContact O-CB 3.13Å; L621-K625 PolarHBondContact O-N 3.43Å
622	K	67.3	Low	73.3	Confident	135 Å²	135	57.6 Å²	57.6	59%	0.587	27%	0.268	S	S	*	.	H	α-helix	trans	-62.2	-48.6	171.2	-72.5	171.8	-175.1	171.4	0	111.4	D618 L619 R624 K625 D626	D618-K622 WeakPolarHBondContact O-CG 3.49Å; D618-K622 PolarHBondContact O-N 2.91Å; L619-K622 PolarHBondContact O-N 3.31Å; K622-R624 VanDerWaalsContact C-N 3.32Å; K622-R624 PolarHBondContact O-N 3.21Å; K622-K625 PolarHBondContact O-N 2.74Å; K622-K625 VanDerWaalsContact O-N 3.14Å; K622-D626 WeakPolarHBondContact O-CB 3.39Å; K622-D626 PolarHBondContact O-N 2.97Å
623	V	68.1	Low	74.5	Confident	6 Å²	6	57 Å²	57	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-43.3	179.2	167.8	0	0	0	0	111.9	L91 F371 L619 W620 H627 A628	L91-V623 HydrophobicContact CD1-CG2 3.93Å; L91-V623 HydrophobicContact CD2-CG1 4.22Å; F371-V623 HydrophobicContact CD1-CG1 3.69Å; F371-V623 HydrophobicContact CE1-CG1 3.21Å; F371-V623 HydrophobicContact CZ-CG1 4.3Å; L619-V623 VanDerWaalsContact O-CG2 3.28Å; L619-V623 WeakPolarHBondContact O-CG2 3.41Å; L619-V623 PolarHBondContact O-N 3.15Å; W620-V623 HydrophobicContact CE3-CG1 4.29Å; W620-V623 HydrophobicContact CZ3-CG1 4.39Å; W620-V623 PolarHBondContact O-N 3.37Å; V623-H627 WeakPolarHBondContact O-CA 3.19Å; V623-H627 VanDerWaalsContact O-CB 3.29Å; V623-H627 WeakPolarHBondContact O-CB 3.34Å; V623-H627 PolarHBondContact O-N 3.47Å; V623-A628 PolarHBondContact O-N 2.99Å
624	R	70.6	Confident	75.8	Confident	36 Å²	36	56.1 Å²	56.1	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-36	176.9	-175.6	-168.1	-59.4	-179.6	2.9	112.7	A375 W620 K622 A628 P629 M802	A375-R624 VanDerWaalsContact CB-CZ 3.5Å; A375-R624 PolarHBondContact O-NH2 3.38Å; W620-R624 WeakPolarHBondContact O-CB 3.18Å; W620-R624 PolarHBondContact O-N 2.86Å; K622-R624 VanDerWaalsContact C-N 3.32Å; K622-R624 PolarHBondContact O-N 3.21Å; R624-A628 WeakPolarHBondContact O-CB 3.46Å; R624-P629 WeakPolarHBondContact O-CD 3.38Å; R624-M802 VanDerWaalsContact CD-CE 3.46Å; R624-M802 HydrophobicContact CG-CE 3.44Å; R624-M802 VanDerWaalsContact CG-CE 3.44Å; R624-M802 HydrophobicContact CG-SD 4.38Å
625	K	71.6	Confident	77.1	Confident	153 Å²	153	51.1 Å²	51.1	67%	0.665	24%	0.238	S	C	*	.	H	α-helix	trans	-76.7	-37.6	-179	-171	179.9	177.7	-175.1	0	112.1	L621 K622 P629	L621-K625 VanDerWaalsContact O-CB 3.27Å; L621-K625 WeakPolarHBondContact O-CB 3.13Å; L621-K625 PolarHBondContact O-N 3.43Å; K622-K625 PolarHBondContact O-N 2.74Å; K622-K625 VanDerWaalsContact O-N 3.14Å; K625-P629 WeakPolarHBondContact O-CG 3.41Å
626	D	73.9	Confident	78.3	Confident	92 Å²	92	45.3 Å²	45.3	49%	0.492	21%	0.213	S	C	.	.	H	α-helix	trans	-102.1	-36.1	-168.9	-60.5	-22.9	0	0	0	112.7	K622 R630	K622-D626 WeakPolarHBondContact O-CB 3.39Å; K622-D626 PolarHBondContact O-N 2.97Å; D626-R630 VanDerWaalsContact O-CD 3.26Å; D626-R630 WeakPolarHBondContact O-CD 3.36Å; D626-R630 WeakPolarHBondContact O-CG 3.31Å
627	H	81.1	Confident	79.6	Confident	18 Å²	18	45.2 Å²	45.2	8%	0.083	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-42.8	-174.3	-59.3	-58.4	0	0	0	113.6	F51 I55 F371 V623 R630 L631	F51-H627 HydrophobicContact CE2-CB 3.85Å; F51-H627 WeakPolarHBondContact CE2-O 3.49Å; F51-H627 HydrophobicContact CZ-CB 4.04Å; I55-H627 HydrophobicContact CD1-CB 4.43Å; F371-H627 HydrophobicContact CZ-CB 4.46Å; V623-H627 WeakPolarHBondContact O-CA 3.19Å; V623-H627 VanDerWaalsContact O-CB 3.29Å; V623-H627 WeakPolarHBondContact O-CB 3.34Å; V623-H627 PolarHBondContact O-N 3.47Å; H627-R630 PolarHBondContact O-N 2.88Å; H627-L631 PolarHBondContact O-N 3.27Å
628	A	83.1	Confident	80.9	Confident	3 Å²	3	43 Å²	43	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-57.9	-41.9	-178	0	0	0	0	0	113.5	L368 V623 R624 R630 L631 A632	L368-A628 HydrophobicContact CD1-CB 4.19Å; V623-A628 PolarHBondContact O-N 2.99Å; R624-A628 WeakPolarHBondContact O-CB 3.46Å; A628-R630 PolarHBondContact O-N 3.05Å; A628-L631 PolarHBondContact O-N 2.9Å; A628-A632 WeakPolarHBondContact O-CB 3.47Å; A628-A632 PolarHBondContact O-N 3.34Å
629	P	84.5	Confident	82.2	Confident	14 Å²	14	39.9 Å²	39.9	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-69.4	-34.5	179.2	-20.2	35.1	0	0	0	112.5	R624 K625 A632 R633 N690	R624-P629 WeakPolarHBondContact O-CD 3.38Å; K625-P629 WeakPolarHBondContact O-CG 3.41Å; P629-A632 PolarHBondContact O-N 3.31Å; P629-R633 PolarHBondContact O-N 3.02Å; P629-N690 HydrophobicContact CB-CB 3.58Å
630	R	87.4	Confident	83.6	Confident	89 Å²	89	37.4 Å²	37.4	34%	0.336	17%	0.168	S	C	.	.	H	α-helix	trans	-64.6	-42.5	173.2	-71.1	175	63.4	-168.2	-2.5	111.4	F51 D54 D626 H627 A628 R633 L634	F51-R630 HydrophobicContact CD2-CB 4.25Å; F51-R630 HydrophobicContact CE2-CB 4.17Å; D54-R630 IonicContact OD2-CZ 2.82Å; D54-R630 IonicContact OD2-NH1 3.86Å; D54-R630 IonicContact OD2-NH2 3.16Å; D54-R630 PolarHBondContact OD2-NH2 3.47Å; D626-R630 VanDerWaalsContact O-CD 3.26Å; D626-R630 WeakPolarHBondContact O-CD 3.36Å; D626-R630 WeakPolarHBondContact O-CG 3.31Å; H627-R630 PolarHBondContact O-N 2.88Å; A628-R630 PolarHBondContact O-N 3.05Å; R630-R633 WeakPolarHBondContact O-CB 3.45Å; R630-R633 PolarHBondContact O-N 3.4Å; R630-L634 PolarHBondContact O-N 3.32Å; R630-L634 VanDerWaalsContact O-N 3.14Å
631	L	89.5	Confident	84.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.5	-38.6	176.7	-174.9	59.6	0	0	0	112	F51 H364 C367 L368 F371 H627 A628 R633 L634 S635	F51-L631 HydrophobicContact CD1-CD1 4.26Å; F51-L631 HydrophobicContact CE1-CB 4.15Å; F51-L631 HydrophobicContact CE1-CD1 3.86Å; F51-L631 HydrophobicContact CE1-CD2 4.16Å; F51-L631 HydrophobicContact CE1-CG 4.28Å; F51-L631 HydrophobicContact CE2-CB 4.11Å; F51-L631 HydrophobicContact CZ-CB 3.66Å; F51-L631 HydrophobicContact CZ-CD1 4.27Å; F51-L631 HydrophobicContact CZ-CD2 4.2Å; F51-L631 HydrophobicContact CZ-CG 4.26Å; H364-L631 HydrophobicContact CB-CD1 4.43Å; C367-L631 HydrophobicContact CB-CD2 3.76Å; L368-L631 HydrophobicContact CB-CD2 3.94Å; L368-L631 HydrophobicContact CB-CG 4.25Å; L368-L631 HydrophobicContact CD1-CB 4.47Å; L368-L631 HydrophobicContact CD1-CD2 4.34Å; F371-L631 HydrophobicContact CD2-CD2 3.68Å; F371-L631 HydrophobicContact CE2-CD2 3.7Å; H627-L631 PolarHBondContact O-N 3.27Å; A628-L631 PolarHBondContact O-N 2.9Å; L631-R633 VanDerWaalsContact C-N 3.28Å; L631-R633 PolarHBondContact O-N 3.48Å; L631-L634 HydrophobicContact CD1-CD1 4.47Å; L631-L634 PolarHBondContact O-N 2.92Å; L631-S635 WeakPolarHBondContact O-CB 3.48Å; L631-S635 PolarHBondContact O-N 3.17Å
632	A	90.4	Very high	86.1	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-59.7	-39.7	173.5	0	0	0	0	0	111.8	L368 A628 P629 S635 L636 A693 L694	L368-A632 HydrophobicContact CD2-CB 3.71Å; A628-A632 WeakPolarHBondContact O-CB 3.47Å; A628-A632 PolarHBondContact O-N 3.34Å; P629-A632 PolarHBondContact O-N 3.31Å; A632-S635 WeakPolarHBondContact O-CB 3.22Å; A632-S635 PolarHBondContact O-N 3.06Å; A632-L636 WeakPolarHBondContact O-CB 3.44Å; A632-L636 PolarHBondContact O-N 3.31Å; A632-A693 HydrophobicContact CB-CB 4.18Å; A632-L694 HydrophobicContact CB-CB 4.04Å; A632-L694 HydrophobicContact CB-CD1 3.96Å
633	R	92	Very high	87.4	Confident	74 Å²	74	28.4 Å²	28.4	28%	0.279	13%	0.127	S	C	.	.	H	α-helix	trans	-59.3	-48.9	171.6	174.5	177.7	179.4	170.6	-1.5	112.3	P629 R630 L631 S635 L636 E637 N690 A693	P629-R633 PolarHBondContact O-N 3.02Å; R630-R633 WeakPolarHBondContact O-CB 3.45Å; R630-R633 PolarHBondContact O-N 3.4Å; L631-R633 VanDerWaalsContact C-N 3.28Å; L631-R633 PolarHBondContact O-N 3.48Å; R633-S635 VanDerWaalsContact C-N 3.27Å; R633-S635 PolarHBondContact O-N 3.36Å; R633-L636 PolarHBondContact O-N 2.94Å; R633-E637 HydrophobicContact CG-CG 4.46Å; R633-E637 IonicContact CZ-OE1 2.91Å; R633-E637 IonicContact NE-OE1 3.48Å; R633-E637 PolarHBondContact NE-OE1 2.91Å; R633-E637 IonicContact NH2-OE1 2.6Å; R633-E637 WeakPolarHBondContact O-CG 3.29Å; R633-E637 PolarHBondContact O-N 2.85Å; R633-N690 WeakPolarHBondContact CD-OD1 3.28Å; R633-A693 HydrophobicContact CB-CB 4.15Å
634	L	93.5	Very high	88.6	Confident	13 Å²	13	28.5 Å²	28.5	7%	0.068	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-38.8	176.5	-68.5	173.8	0	0	0	111.8	E47 F51 H364 R630 L631 E637 S638	E47-L634 HydrophobicContact CB-CD2 3.74Å; F51-L634 HydrophobicContact CB-CD1 4.05Å; F51-L634 HydrophobicContact CG-CD1 4.29Å; H364-L634 PolarHBondContact CE1-O 3.04Å; H364-L634 PolarHBondContact ND1-O 3.14Å; R630-L634 PolarHBondContact O-N 3.32Å; R630-L634 VanDerWaalsContact O-N 3.14Å; L631-L634 HydrophobicContact CD1-CD1 4.47Å; L631-L634 PolarHBondContact O-N 2.92Å; L634-E637 PolarHBondContact O-N 3.18Å; L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 2.87Å; L634-S638 PolarHBondContact O-OG 2.88Å
635	S	93.8	Very high	89.6	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-47.2	174.5	-173.6	0	0	0	0	112.1	N361 H364 L631 A632 R633 S638 R639	N361-S635 PolarHBondContact ND2-O 3.25Å; H364-S635 PolarHBondContact ND1-N 3.44Å; L631-S635 WeakPolarHBondContact O-CB 3.48Å; L631-S635 PolarHBondContact O-N 3.17Å; A632-S635 WeakPolarHBondContact O-CB 3.22Å; A632-S635 PolarHBondContact O-N 3.06Å; R633-S635 VanDerWaalsContact C-N 3.27Å; R633-S635 PolarHBondContact O-N 3.36Å; S635-S638 PolarHBondContact O-N 2.99Å; S635-S638 PolarHBondContact O-OG 2.67Å; S635-S638 VanDerWaalsContact O-OG 3.11Å; S635-R639 VanDerWaalsContact O-CB 3.26Å; S635-R639 WeakPolarHBondContact O-CB 3.39Å; S635-R639 PolarHBondContact O-N 3.46Å
636	L	93.8	Very high	90.6	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-62.8	-42.3	175.9	173.9	63	0	0	0	111.6	A632 R633 R639 S640 A693 F696 I716 V728	A632-L636 WeakPolarHBondContact O-CB 3.44Å; A632-L636 PolarHBondContact O-N 3.31Å; R633-L636 PolarHBondContact O-N 2.94Å; L636-R639 PolarHBondContact O-N 3.19Å; L636-S640 WeakPolarHBondContact O-CB 3.39Å; L636-S640 PolarHBondContact O-N 3.45Å; L636-A693 HydrophobicContact CB-CB 4.09Å; L636-A693 HydrophobicContact CD2-CB 3.88Å; L636-F696 HydrophobicContact CB-CD1 4.32Å; L636-F696 HydrophobicContact CD1-CB 4.41Å; L636-F696 HydrophobicContact CD1-CD1 3.51Å; L636-F696 HydrophobicContact CD1-CD2 4.14Å; L636-F696 HydrophobicContact CD1-CE1 3.69Å; L636-F696 HydrophobicContact CD1-CE2 4.29Å; L636-F696 HydrophobicContact CD1-CG 3.74Å; L636-F696 HydrophobicContact CD1-CZ 4.08Å; L636-F696 HydrophobicContact CG-CD1 4.45Å; L636-I716 HydrophobicContact CG-CD1 4.31Å; L636-V728 HydrophobicContact CD1-CG1 4.4Å; L636-V728 HydrophobicContact CD2-CG1 4.2Å; L636-V728 HydrophobicContact CD2-CG2 4.19Å
637	E	94.4	Very high	91.4	Very high	28 Å²	28	21.6 Å²	21.6	13%	0.131	10%	0.098	C	C	.	.	H	α-helix	trans	-65.5	-45.2	178.7	-72.5	176.5	-172.9	0	0	112.1	N44 R633 L634 S640 L641 I716	N44-E637 WeakPolarHBondContact ND2-CB 3.23Å; R633-E637 HydrophobicContact CG-CG 4.46Å; R633-E637 IonicContact CZ-OE1 2.91Å; R633-E637 IonicContact NE-OE1 3.48Å; R633-E637 PolarHBondContact NE-OE1 2.91Å; R633-E637 IonicContact NH2-OE1 2.6Å; R633-E637 WeakPolarHBondContact O-CG 3.29Å; R633-E637 PolarHBondContact O-N 2.85Å; L634-E637 PolarHBondContact O-N 3.18Å; E637-S640 PolarHBondContact O-N 3.03Å; E637-L641 WeakPolarHBondContact O-CB 3.5Å; E637-L641 PolarHBondContact O-N 3Å; E637-I716 HydrophobicContact CB-CD1 4.18Å; E637-I716 HydrophobicContact CG-CD1 3.6Å
638	S	94.9	Very high	91.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.8	-38.6	177.4	64.9	0	0	0	0	111.5	N44 N361 H364 L634 S635 L641 Q642	N44-S638 PolarHBondContact ND2-N 3.43Å; N361-S638 VanDerWaalsContact CA-OG 3.29Å; N361-S638 WeakPolarHBondContact CA-OG 3.34Å; N361-S638 WeakPolarHBondContact CB-OG 3.33Å; N361-S638 PolarHBondContact ND2-OG 3.38Å; H364-S638 PolarHBondContact ND1-OG 3.2Å; H364-S638 VanDerWaalsContact ND1-OG 3.14Å; L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 2.87Å; L634-S638 PolarHBondContact O-OG 2.88Å; S635-S638 PolarHBondContact O-N 2.99Å; S635-S638 PolarHBondContact O-OG 2.67Å; S635-S638 VanDerWaalsContact O-OG 3.11Å; S638-L641 PolarHBondContact O-N 2.91Å; S638-Q642 PolarHBondContact O-N 3.41Å
639	R	94.3	Very high	92.1	Very high	35 Å²	35	31.7 Å²	31.7	13%	0.132	14%	0.137	C	C	.	.	H	α-helix	trans	-64.7	-48	174.6	179.8	51.3	-167.8	-161.1	-4	112	N361 S635 L636 L641 Q642 D643 F696 R700	N361-R639 WeakPolarHBondContact ND2-CB 3.22Å; S635-R639 VanDerWaalsContact O-CB 3.26Å; S635-R639 WeakPolarHBondContact O-CB 3.39Å; S635-R639 PolarHBondContact O-N 3.46Å; L636-R639 PolarHBondContact O-N 3.19Å; R639-L641 PolarHBondContact O-N 3.37Å; R639-Q642 WeakPolarHBondContact O-CB 3.33Å; R639-Q642 PolarHBondContact O-N 3.34Å; R639-Q642 VanDerWaalsContact O-N 3.13Å; R639-D643 IonicContact CZ-OD1 3.33Å; R639-D643 IonicContact CZ-OD2 3.76Å; R639-D643 IonicContact NE-OD1 3.98Å; R639-D643 PolarHBondContact NE-OD1 3.12Å; R639-D643 IonicContact NE-OD2 2.66Å; R639-D643 PolarHBondContact NE-OD2 3.44Å; R639-D643 IonicContact NH1-OD1 3.29Å; R639-D643 IonicContact NH2-OD1 3.05Å; R639-D643 PolarHBondContact NH2-OD1 3.39Å; R639-D643 IonicContact NH2-OD2 2.69Å; R639-D643 PolarHBondContact O-N 3.03Å; R639-F696 HydrophobicContact CB-CE1 4.49Å; R639-F696 HydrophobicContact CG-CE1 4.23Å; R639-F696 HydrophobicContact CG-CZ 4.21Å; R639-R700 VanDerWaalsContact CD-CZ 3.45Å; R639-R700 VanDerWaalsContact CZ-CZ 3.46Å; R639-R700 VanDerWaalsContact NE-CZ 3.34Å
640	S	95.3	Very high	92.4	Very high	6 Å²	6	31.3 Å²	31.3	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-58.7	-39.3	178.5	166.4	0	0	0	0	111.3	L636 E637 D643 V644 S714 V715 I716	L636-S640 WeakPolarHBondContact O-CB 3.39Å; L636-S640 PolarHBondContact O-N 3.45Å; E637-S640 PolarHBondContact O-N 3.03Å; S640-D643 PolarHBondContact O-N 3.28Å; S640-V644 WeakPolarHBondContact O-CB 3.48Å; S640-V644 VanDerWaalsContact O-CG2 3.28Å; S640-V644 WeakPolarHBondContact O-CG2 3.32Å; S640-V644 PolarHBondContact O-N 2.92Å; S640-S714 WeakPolarHBondContact CA-O 3.25Å; S640-V715 WeakPolarHBondContact OG-CA 3.3Å; S640-I716 PolarHBondContact OG-N 2.92Å
641	L	94.7	Very high	92.5	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.052	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-45	177.5	-175.3	49.2	0	0	0	110.9	Y37 R40 L41 A357 E637 S638 R639 D643 V644 L645	Y37-L641 HydrophobicContact CD1-CD1 3.43Å; Y37-L641 VanDerWaalsContact CD1-CD1 3.43Å; Y37-L641 HydrophobicContact CE1-CD1 4.12Å; Y37-L641 HydrophobicContact CG-CD1 4.26Å; R40-L641 HydrophobicContact CB-CD2 4.14Å; L41-L641 HydrophobicContact CB-CD2 4.46Å; L41-L641 HydrophobicContact CD2-CD2 3.51Å; L41-L641 HydrophobicContact CD2-CG 4.36Å; L41-L641 HydrophobicContact CG-CD2 3.61Å; A357-L641 HydrophobicContact CB-CG 4.36Å; E637-L641 WeakPolarHBondContact O-CB 3.5Å; E637-L641 PolarHBondContact O-N 3Å; S638-L641 PolarHBondContact O-N 2.91Å; R639-L641 PolarHBondContact O-N 3.37Å; L641-D643 PolarHBondContact O-N 3.36Å; L641-V644 PolarHBondContact O-N 3.16Å; L641-L645 HydrophobicContact CD1-CD1 4.03Å; L641-L645 HydrophobicContact CD1-CG 4.22Å; L641-L645 HydrophobicContact CG-CD1 4.01Å; L641-L645 WeakPolarHBondContact O-CB 3.38Å; L641-L645 WeakPolarHBondContact O-CD1 3.14Å; L641-L645 WeakPolarHBondContact O-CG 3.35Å; L641-L645 PolarHBondContact O-N 3.32Å
642	Q	94.8	Very high	92.6	Very high	15 Å²	15	38.3 Å²	38.3	7%	0.07	17%	0.171	C	C	.	.	H	α-helix	trans	-56.7	-49.4	173.3	-173	-171.9	24.7	0	0	111.9	A357 S638 R639 V644 L645 L646	A357-Q642 HydrophobicContact CB-CB 3.94Å; S638-Q642 PolarHBondContact O-N 3.41Å; R639-Q642 WeakPolarHBondContact O-CB 3.33Å; R639-Q642 PolarHBondContact O-N 3.34Å; R639-Q642 VanDerWaalsContact O-N 3.13Å; Q642-V644 PolarHBondContact O-N 3.12Å; Q642-L645 PolarHBondContact O-N 3.41Å; Q642-L646 HydrophobicContact CG-CD1 3.95Å; Q642-L646 WeakPolarHBondContact O-CG 3.46Å; Q642-L646 PolarHBondContact O-N 3.44Å
643	D	94.6	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-42.3	-178.8	-78.9	-21.5	0	0	0	112	R639 S640 L641 L645 L646 H647 W670 S714	R639-D643 IonicContact CZ-OD1 3.33Å; R639-D643 IonicContact CZ-OD2 3.76Å; R639-D643 IonicContact NE-OD1 3.98Å; R639-D643 PolarHBondContact NE-OD1 3.12Å; R639-D643 IonicContact NE-OD2 2.66Å; R639-D643 PolarHBondContact NE-OD2 3.44Å; R639-D643 IonicContact NH1-OD1 3.29Å; R639-D643 IonicContact NH2-OD1 3.05Å; R639-D643 PolarHBondContact NH2-OD1 3.39Å; R639-D643 IonicContact NH2-OD2 2.69Å; R639-D643 PolarHBondContact O-N 3.03Å; S640-D643 PolarHBondContact O-N 3.28Å; L641-D643 PolarHBondContact O-N 3.36Å; D643-L645 VanDerWaalsContact C-N 3.34Å; D643-L646 PolarHBondContact O-N 2.97Å; D643-H647 PolarHBondContact O-N 2.87Å; D643-W670 HydrophobicContact CB-CH2 3.84Å; D643-W670 HydrophobicContact CB-CZ2 4.02Å; D643-S714 VanDerWaalsContact CB-O 3.32Å; D643-S714 WeakPolarHBondContact CB-O 3.26Å; D643-S714 PolarHBondContact OD2-N 3.1Å
644	V	93.6	Very high	92.6	Very high	8 Å²	8	43.7 Å²	43.7	5%	0.048	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-37.1	175.3	171.5	0	0	0	0	111.9	Y37 S640 L641 Q642 R648 V715	Y37-V644 HydrophobicContact CE1-CG1 3.79Å; Y37-V644 VanDerWaalsContact OH-CG1 3.27Å; Y37-V644 WeakPolarHBondContact OH-CG1 3.08Å; S640-V644 WeakPolarHBondContact O-CB 3.48Å; S640-V644 VanDerWaalsContact O-CG2 3.28Å; S640-V644 WeakPolarHBondContact O-CG2 3.32Å; S640-V644 PolarHBondContact O-N 2.92Å; L641-V644 PolarHBondContact O-N 3.16Å; Q642-V644 PolarHBondContact O-N 3.12Å; V644-R648 WeakPolarHBondContact O-CA 3.41Å; V644-R648 PolarHBondContact O-N 3.44Å; V644-V715 HydrophobicContact CG2-CB 3.97Å; V644-V715 HydrophobicContact CG2-CG1 3.36Å; V644-V715 HydrophobicContact CG2-CG2 3.58Å
645	L	91.6	Very high	92.6	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-69.4	-37.6	177.8	-71.1	165.7	0	0	0	111.3	Y37 Q350 L353 V354 A357 L641 Q642 D643	Y37-L645 HydrophobicContact CD1-CD2 4.39Å; Y37-L645 HydrophobicContact CD2-CD2 4.02Å; Y37-L645 HydrophobicContact CG-CD2 3.93Å; Q350-L645 PolarHBondContact NE2-O 3.02Å; L353-L645 HydrophobicContact CB-CD1 3.63Å; L353-L645 HydrophobicContact CB-CD2 3.86Å; L353-L645 HydrophobicContact CB-CG 4.37Å; L353-L645 HydrophobicContact CD1-CD2 3.74Å; L353-L645 HydrophobicContact CG-CD2 4.47Å; V354-L645 HydrophobicContact CG2-CB 3.63Å; A357-L645 HydrophobicContact CB-CD1 4.1Å; L641-L645 HydrophobicContact CD1-CD1 4.03Å; L641-L645 HydrophobicContact CD1-CG 4.22Å; L641-L645 HydrophobicContact CG-CD1 4.01Å; L641-L645 WeakPolarHBondContact O-CB 3.38Å; L641-L645 WeakPolarHBondContact O-CD1 3.14Å; L641-L645 WeakPolarHBondContact O-CG 3.35Å; L641-L645 PolarHBondContact O-N 3.32Å; Q642-L645 PolarHBondContact O-N 3.41Å; D643-L645 VanDerWaalsContact C-N 3.34Å
646	L	90.8	Very high	92.4	Very high	62 Å²	62	51 Å²	51	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-76.9	-49.3	178.9	-72.9	170.9	0	0	0	112.8	V354 Q642 D643	V354-L646 HydrophobicContact CG1-CD2 3.81Å; V354-L646 HydrophobicContact CG1-CG 4.19Å; V354-L646 HydrophobicContact CG2-CD2 4Å; V354-L646 HydrophobicContact CG2-CG 4.21Å; Q642-L646 HydrophobicContact CG-CD1 3.95Å; Q642-L646 WeakPolarHBondContact O-CG 3.46Å; Q642-L646 PolarHBondContact O-N 3.44Å; D643-L646 PolarHBondContact O-N 2.97Å
647	H	90.6	Very high	92	Very high	71 Å²	71	52.3 Å²	52.3	33%	0.329	26%	0.259	S	S	.	.	H	α-helix	trans	-116.6	0.1	-164.3	-55.1	-50.3	0	0	0	113.9	D643 W670 G671	D643-H647 PolarHBondContact O-N 2.87Å; H647-W670 HydrophobicContact CB-CD2 4.15Å; H647-W670 HydrophobicContact CB-CH2 4.31Å; H647-W670 HydrophobicContact CB-CZ2 3.69Å; H647-W670 AromaticContact CD2-CH2 3.75Å; H647-W670 AromaticContact CD2-CZ2 4Å; H647-G671 VanDerWaalsContact ND1-CA 3.33Å; H647-G671 WeakPolarHBondContact ND1-CA 3.46Å
648	R	90.1	Very high	91.6	Very high	136 Å²	136	59.2 Å²	59.2	51%	0.513	28%	0.284	S	S	.	.			trans	62	174.4	-171.1	-49.9	-178.3	179.5	-176.2	-0.3	111.8	V644 W670	V644-R648 WeakPolarHBondContact O-CA 3.41Å; V644-R648 PolarHBondContact O-N 3.44Å; R648-W670 PolarHBondContact O-NE1 2.71Å
649	K	90.1	Very high	90.4	Very high	98 Å²	98	61.6 Å²	61.6	43%	0.426	31%	0.309	S	S	.	.	S	Bend	trans	-67.8	132.6	176.2	-173.3	178	175.3	-177.1	0	109.4	V715 D717	K649-V715 HydrophobicContact CG-CG1 4.25Å; K649-D717 VanDerWaalsContact CE-CG 3.46Å; K649-D717 VanDerWaalsContact CE-OD2 3.28Å; K649-D717 WeakPolarHBondContact CE-OD2 3.47Å; K649-D717 IonicContact NZ-OD1 3.64Å; K649-D717 PolarHBondContact NZ-OD1 2.81Å; K649-D717 IonicContact NZ-OD2 3.55Å; K649-D717 PolarHBondContact NZ-OD2 3.29Å
650	P	91.3	Very high	89.1	Confident	6 Å²	6	67.9 Å²	67.9	4%	0.039	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-62.8	146.6	176.7	25.3	-33.6	0	0	0	111.1	W670 L678 L729 I731	P650-W670 HydrophobicContact CB-CG 4.19Å; P650-L678 HydrophobicContact CB-CD1 3.96Å; P650-L678 HydrophobicContact CG-CD1 3.56Å; P650-L678 HydrophobicContact CG-CD2 4.24Å; P650-L729 HydrophobicContact CG-CD1 4.2Å; P650-I731 HydrophobicContact CB-CG1 4.45Å; P650-I731 HydrophobicContact CG-CD1 4.28Å; P650-I731 HydrophobicContact CG-CG1 4.22Å
651	K	89.8	Confident	87.8	Confident	162 Å²	162	70.7 Å²	70.7	70%	0.704	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-80.1	129.4	171.4	-66.1	-176.8	-179.5	-178.9	0	109
652	L	89.6	Confident	87.3	Confident	74 Å²	74	71.2 Å²	71.2	39%	0.387	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-80.5	118	173	-79.4	75.7	0	0	0	108.8	Y665 L678	L652-Y665 HydrophobicContact CD2-CD2 3.98Å; L652-Y665 HydrophobicContact CD2-CE1 4.47Å; L652-Y665 HydrophobicContact CD2-CE2 3.86Å; L652-Y665 HydrophobicContact CD2-CG 4.31Å; L652-Y665 HydrophobicContact CG-CD2 4.38Å; L652-Y665 HydrophobicContact CG-CG 4.45Å; L652-L678 HydrophobicContact CD1-CD2 3.7Å; L652-L678 HydrophobicContact CG-CD2 3.65Å
653	G	90.9	Very high	87	Confident	37 Å²	37	71 Å²	71	38%	0.381	36%	0.358	S	S	.	.			trans	-91.2	-153.6	170.4	0	0	0	0	0	112.2	Y665 L666	G653-Y665 WeakPolarHBondContact O-CD1 2.96Å; G653-L666 VanDerWaalsContact CA-O 3.23Å; G653-L666 WeakPolarHBondContact CA-O 3.32Å; G653-L666 PolarHBondContact N-O 2.95Å
654	Q	92.6	Very high	86.9	Confident	151 Å²	151	73.1 Å²	73.1	71%	0.706	37%	0.37	S	S	*	.	S	Bend	trans	-62.1	143.3	178.6	-176	-179	-4.1	0	0	112.1	L656 Y665 L666	Q654-L656 PolarHBondContact O-N 3.37Å; Q654-Y665 CarbonylContact O-C 3.52Å; Q654-Y665 WeakPolarHBondContact O-CA 3.09Å; Q654-L666 PolarHBondContact O-N 2.88Å
655	E	94.2	Very high	86.9	Confident	79 Å²	79	74.2 Å²	74.2	37%	0.369	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	119	169.2	-176.6	171.4	144	0	0	110	R658 V663 Y665	E655-R658 VanDerWaalsContact OE1-CB 3.32Å; E655-R658 WeakPolarHBondContact OE1-CB 3.38Å; E655-R658 IonicContact OE1-NE 3.46Å; E655-R658 PolarHBondContact OE1-NE 2.9Å; E655-R658 IonicContact OE1-NH2 3.87Å; E655-R658 IonicContact OE2-CZ 3.58Å; E655-R658 IonicContact OE2-NE 3.47Å; E655-R658 IonicContact OE2-NH2 2.71Å; E655-R658 PolarHBondContact OE2-NH2 2.88Å; E655-V663 HydrophobicContact CB-CG1 4.46Å; E655-V663 VanDerWaalsContact CD-CG1 3.47Å; E655-V663 HydrophobicContact CG-CG1 3.55Å; E655-V663 WeakPolarHBondContact OE2-CG1 3.28Å; E655-Y665 HydrophobicContact CB-CD1 4.2Å; E655-Y665 HydrophobicContact CB-CE1 4.18Å
656	L	88.8	Confident	87	Confident	88 Å²	88	75.9 Å²	75.9	46%	0.461	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-30.3	174.8	-63.7	178.1	0	0	0	111.5	Q654 V664 L666	Q654-L656 PolarHBondContact O-N 3.37Å; L656-V664 HydrophobicContact CB-CG1 4.37Å; L656-V664 HydrophobicContact CD1-CG1 4.36Å; L656-V664 PolarHBondContact N-O 2.6Å; L656-L666 HydrophobicContact CD1-CB 4.32Å; L656-L666 HydrophobicContact CD2-CB 4.16Å; L656-L666 HydrophobicContact CG-CB 4.21Å
657	G	85.1	Confident	87.2	Confident	30 Å²	30	73 Å²	73	31%	0.309	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.3	159.4	176.7	0	0	0	0	0	112.8	V664	G657-V664 PolarHBondContact N-O 3.26Å; G657-V664 PolarHBondContact O-N 3.27Å
658	R	86	Confident	87	Confident	172 Å²	172	74.6 Å²	74.6	65%	0.649	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.7	177.4	-179.5	176.1	-61	-134.4	-1	110	E655 V663	E655-R658 VanDerWaalsContact OE1-CB 3.32Å; E655-R658 WeakPolarHBondContact OE1-CB 3.38Å; E655-R658 IonicContact OE1-NE 3.46Å; E655-R658 PolarHBondContact OE1-NE 2.9Å; E655-R658 IonicContact OE1-NH2 3.87Å; E655-R658 IonicContact OE2-CZ 3.58Å; E655-R658 IonicContact OE2-NE 3.47Å; E655-R658 IonicContact OE2-NH2 2.71Å; E655-R658 PolarHBondContact OE2-NH2 2.88Å; R658-V663 HydrophobicContact CG-CG2 4.13Å
659	G	70.8	Confident	87	Confident	51 Å²	51	72.9 Å²	72.9	53%	0.526	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	-175.9	178.4	0	0	0	0	0	111.8	Y661 G662	G659-Y661 PolarHBondContact O-N 2.95Å; G659-G662 PolarHBondContact N-O 2.86Å; G659-G662 PolarHBondContact O-N 2.89Å
660	Q	66.5	Low	87.1	Confident	166 Å²	166	68.6 Å²	68.6	78%	0.776	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.7	176.6	-177.8	176.6	-6.1	0	0	112.6
661	Y	68.4	Low	87	Confident	65 Å²	65	69.8 Å²	69.8	26%	0.255	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	7.6	-172.5	-47.3	-65.7	0	0	0	113.6	G659 D793 F796	G659-Y661 PolarHBondContact O-N 2.95Å; Y661-D793 WeakPolarHBondContact CD2-OD2 3.21Å; Y661-F796 HydrophobicContact CD1-CE2 4.43Å; Y661-F796 HydrophobicContact CD1-CZ 4.38Å; Y661-F796 HydrophobicContact CD2-CE2 4.49Å; Y661-F796 AromaticContact CE1-CE2 3.67Å; Y661-F796 HydrophobicContact CE1-CE2 3.67Å; Y661-F796 AromaticContact CE1-CZ 3.4Å; Y661-F796 HydrophobicContact CE1-CZ 3.4Å; Y661-F796 VanDerWaalsContact CE1-CZ 3.4Å; Y661-F796 AromaticContact CE2-CE2 3.72Å; Y661-F796 HydrophobicContact CE2-CE2 3.72Å; Y661-F796 HydrophobicContact CE2-CZ 4.25Å; Y661-F796 AromaticContact CZ-CE2 3.26Å; Y661-F796 AromaticContact CZ-CZ 3.32Å; Y661-F796 VanDerWaalsContact OH-CE2 3.22Å; Y661-F796 WeakPolarHBondContact OH-CE2 3.34Å; Y661-F796 WeakPolarHBondContact OH-CZ 3.12Å
662	G	82.5	Confident	87	Confident	22 Å²	22	65.3 Å²	65.3	23%	0.227	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.8	-161.1	178.4	0	0	0	0	0	114.3	G659 S680	G659-G662 PolarHBondContact N-O 2.86Å; G659-G662 PolarHBondContact O-N 2.89Å; G662-S680 VanDerWaalsContact CA-O 3.23Å; G662-S680 WeakPolarHBondContact CA-O 3.46Å
663	V	90.1	Very high	87	Confident	11 Å²	11	65 Å²	65	7%	0.067	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.6	-171.7	-169.5	0	0	0	0	109.8	E655 R658 Y665 S680	E655-V663 HydrophobicContact CB-CG1 4.46Å; E655-V663 VanDerWaalsContact CD-CG1 3.47Å; E655-V663 HydrophobicContact CG-CG1 3.55Å; E655-V663 WeakPolarHBondContact OE2-CG1 3.28Å; R658-V663 HydrophobicContact CG-CG2 4.13Å; V663-Y665 HydrophobicContact CB-CD2 4.46Å; V663-Y665 HydrophobicContact CB-CE2 3.64Å; V663-Y665 HydrophobicContact CG1-CD1 4.44Å; V663-Y665 HydrophobicContact CG1-CD2 4.25Å; V663-Y665 HydrophobicContact CG1-CE1 3.81Å; V663-Y665 HydrophobicContact CG1-CE2 3.61Å; V663-Y665 WeakPolarHBondContact CG1-OH 3.32Å; V663-S680 PolarHBondContact N-O 3.49Å; V663-S680 PolarHBondContact O-N 3.27Å
664	V	92	Very high	86.9	Confident	43 Å²	43	70.3 Å²	70.3	26%	0.261	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127	176.5	-174.1	0	0	0	0	109	L656 G657 A677 L678 K679	L656-V664 HydrophobicContact CB-CG1 4.37Å; L656-V664 HydrophobicContact CD1-CG1 4.36Å; L656-V664 PolarHBondContact N-O 2.6Å; G657-V664 PolarHBondContact N-O 3.26Å; G657-V664 PolarHBondContact O-N 3.27Å; V664-A677 HydrophobicContact CG1-CB 4.26Å; V664-L678 CarbonylContact C-O 3.6Å; V664-L678 WeakPolarHBondContact CA-O 3.5Å; V664-K679 HydrophobicContact CG2-CB 4.23Å; V664-K679 HydrophobicContact CG2-CG 4.21Å
665	Y	93.9	Very high	86.8	Confident	31 Å²	31	65.3 Å²	65.3	12%	0.122	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	152.9	179	-57.2	-87.9	0	0	0	111	L652 G653 Q654 E655 V663 L678 Y720	L652-Y665 HydrophobicContact CD2-CD2 3.98Å; L652-Y665 HydrophobicContact CD2-CE1 4.47Å; L652-Y665 HydrophobicContact CD2-CE2 3.86Å; L652-Y665 HydrophobicContact CD2-CG 4.31Å; L652-Y665 HydrophobicContact CG-CD2 4.38Å; L652-Y665 HydrophobicContact CG-CG 4.45Å; G653-Y665 WeakPolarHBondContact O-CD1 2.96Å; Q654-Y665 CarbonylContact O-C 3.52Å; Q654-Y665 WeakPolarHBondContact O-CA 3.09Å; E655-Y665 HydrophobicContact CB-CD1 4.2Å; E655-Y665 HydrophobicContact CB-CE1 4.18Å; V663-Y665 HydrophobicContact CB-CD2 4.46Å; V663-Y665 HydrophobicContact CB-CE2 3.64Å; V663-Y665 HydrophobicContact CG1-CD1 4.44Å; V663-Y665 HydrophobicContact CG1-CD2 4.25Å; V663-Y665 HydrophobicContact CG1-CE1 3.81Å; V663-Y665 HydrophobicContact CG1-CE2 3.61Å; V663-Y665 WeakPolarHBondContact CG1-OH 3.32Å; Y665-L678 PolarHBondContact N-O 3.18Å; Y665-L678 PolarHBondContact O-N 3.05Å; Y665-Y720 PolarHBondContact OH-OH 3.49Å
666	L	93.8	Very high	86.8	Confident	39 Å²	39	61.5 Å²	61.5	20%	0.204	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.2	165.6	-178.5	66	0	0	0	109.1	G653 Q654 L656 R734	G653-L666 VanDerWaalsContact CA-O 3.23Å; G653-L666 WeakPolarHBondContact CA-O 3.32Å; G653-L666 PolarHBondContact N-O 2.95Å; Q654-L666 PolarHBondContact O-N 2.88Å; L656-L666 HydrophobicContact CD1-CB 4.32Å; L656-L666 HydrophobicContact CD2-CB 4.16Å; L656-L666 HydrophobicContact CG-CB 4.21Å; L666-R734 VanDerWaalsContact CD1-CD 3.49Å
667	C	93.4	Very high	87.1	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.014	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	112.3	169	-171.5	0	0	0	0	107.8	C676 L678	C667-C676 CarbonylContact C-O 3.59Å; C667-C676 HydrophobicContact CB-CB 3.88Å; C667-C676 PolarHBondContact N-O 3.49Å; C667-C676 CarbonylContact O-C 3.58Å; C667-C676 VanDerWaalsContact O-C 3.29Å; C667-C676 VanDerWaalsContact O-CA 3.25Å; C667-C676 WeakPolarHBondContact O-CA 3.41Å; C667-C676 VanDerWaalsContact O-CB 3.23Å; C667-C676 WeakPolarHBondContact O-CB 3.47Å; C667-C676 PolarHBondContact O-N 2.99Å; C667-L678 HydrophobicContact CB-CB 4.24Å
668	D	86.4	Confident	87.5	Confident	103 Å²	103	56.3 Å²	56.3	55%	0.551	31%	0.313	S	S	*	.	S	Bend	trans	-63.7	-61.3	-173.7	-65.3	-42.3	0	0	0	110.8	F674	D668-F674 HydrophobicContact CB-CD2 4.47Å; D668-F674 HydrophobicContact CB-CE2 4.3Å; D668-F674 WeakPolarHBondContact O-CD2 3.38Å
669	N	90.4	Very high	87.8	Confident	100 Å²	100	49.2 Å²	49.2	54%	0.535	29%	0.286	S	S	.	.			trans	-133.9	136.1	-179.5	-177.8	3.1	0	0	0	111.3	G672 H673 F674	N669-G672 PolarHBondContact OD1-N 3.29Å; N669-H673 VanDerWaalsContact CA-O 3.26Å; N669-H673 WeakPolarHBondContact CA-O 3.29Å; N669-H673 PolarHBondContact OD1-O 3.27Å; N669-H673 VanDerWaalsContact OD1-O 3.1Å; N669-F674 HydrophobicContact CB-CD2 4.49Å
670	W	93.7	Very high	88.8	Confident	9 Å²	9	46.9 Å²	46.9	3%	0.034	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-147.3	125.3	168.4	-173.5	78.5	0	0	0	111	D643 H647 R648 P650 G672 H673 H712 V715 I731	D643-W670 HydrophobicContact CB-CH2 3.84Å; D643-W670 HydrophobicContact CB-CZ2 4.02Å; H647-W670 HydrophobicContact CB-CD2 4.15Å; H647-W670 HydrophobicContact CB-CH2 4.31Å; H647-W670 HydrophobicContact CB-CZ2 3.69Å; H647-W670 AromaticContact CD2-CH2 3.75Å; H647-W670 AromaticContact CD2-CZ2 4Å; R648-W670 PolarHBondContact O-NE1 2.71Å; P650-W670 HydrophobicContact CB-CG 4.19Å; W670-G672 PolarHBondContact O-N 3.21Å; W670-H673 PolarHBondContact N-O 2.73Å; W670-H673 WeakPolarHBondContact O-CB 3.41Å; W670-H673 PolarHBondContact O-N 3.01Å; W670-H712 HydrophobicContact CZ3-CB 4.44Å; W670-V715 HydrophobicContact CZ2-CG2 4.04Å; W670-I731 HydrophobicContact CB-CG2 4.24Å; W670-I731 HydrophobicContact CD2-CB 4.38Å; W670-I731 HydrophobicContact CD2-CD1 4.46Å; W670-I731 HydrophobicContact CD2-CG1 3.85Å; W670-I731 HydrophobicContact CD2-CG2 4.09Å; W670-I731 HydrophobicContact CE3-CB 3.95Å; W670-I731 HydrophobicContact CE3-CG1 3.89Å; W670-I731 HydrophobicContact CE3-CG2 3.67Å; W670-I731 HydrophobicContact CG-CG1 4.35Å; W670-I731 HydrophobicContact CG-CG2 4.37Å; W670-I731 HydrophobicContact CH2-CD1 4.15Å; W670-I731 HydrophobicContact CH2-CG1 4.4Å; W670-I731 HydrophobicContact CZ2-CD1 4.11Å; W670-I731 HydrophobicContact CZ2-CG1 4.39Å; W670-I731 HydrophobicContact CZ3-CB 4.17Å; W670-I731 HydrophobicContact CZ3-CD1 4.36Å; W670-I731 HydrophobicContact CZ3-CG1 4.17Å; W670-I731 HydrophobicContact CZ3-CG2 4.33Å
671	G	87.9	Confident	90	Very high	30 Å²	30	39.8 Å²	39.8	31%	0.309	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	28.7	178.1	0	0	0	0	0	114.9	H647 H673	H647-G671 VanDerWaalsContact ND1-CA 3.33Å; H647-G671 WeakPolarHBondContact ND1-CA 3.46Å; G671-H673 VanDerWaalsContact C-N 3.27Å; G671-H673 PolarHBondContact O-N 3.28Å
672	G	89.7	Confident	91	Very high	68 Å²	68	39.7 Å²	39.7	70%	0.701	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.2	-2.4	-175.8	0	0	0	0	0	114.2	N669 W670	N669-G672 PolarHBondContact OD1-N 3.29Å; W670-G672 PolarHBondContact O-N 3.21Å
673	H	90	Very high	91.3	Very high	67 Å²	67	39.4 Å²	39.4	31%	0.31	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-87.5	130.3	173.8	-61.8	-77.7	0	0	0	110.7	N669 W670 G671 C676 H712	N669-H673 VanDerWaalsContact CA-O 3.26Å; N669-H673 WeakPolarHBondContact CA-O 3.29Å; N669-H673 PolarHBondContact OD1-O 3.27Å; N669-H673 VanDerWaalsContact OD1-O 3.1Å; W670-H673 PolarHBondContact N-O 2.73Å; W670-H673 WeakPolarHBondContact O-CB 3.41Å; W670-H673 PolarHBondContact O-N 3.01Å; G671-H673 VanDerWaalsContact C-N 3.27Å; G671-H673 PolarHBondContact O-N 3.28Å; H673-C676 VanDerWaalsContact C-SG 3.57Å; H673-C676 WeakPolarHBondContact CB-SG 3.14Å; H673-C676 PolarHBondContact O-SG 3.19Å; H673-H712 AromaticContact CD2-CG 3.84Å; H673-H712 AromaticContact CE1-ND1 3.68Å; H673-H712 AromaticContact CG-CD2 3.63Å; H673-H712 AromaticContact CG-CG 3.66Å; H673-H712 AromaticContact CG-ND1 3.9Å; H673-H712 AromaticContact CG-NE2 3.87Å; H673-H712 AromaticContact ND1-CD2 3.94Å; H673-H712 AromaticContact ND1-CE1 3.54Å; H673-H712 AromaticContact ND1-CG 3.82Å; H673-H712 AromaticContact ND1-ND1 3.56Å; H673-H712 AromaticContact ND1-NE2 3.76Å
674	F	88.9	Confident	91.1	Very high	150 Å²	150	43.9 Å²	43.9	66%	0.658	26%	0.259	S	S	*	.			trans	-150.2	135.1	174	173.4	-82.1	0	0	0	108.9	D668 N669	D668-F674 HydrophobicContact CB-CD2 4.47Å; D668-F674 HydrophobicContact CB-CE2 4.3Å; D668-F674 WeakPolarHBondContact O-CD2 3.38Å; N669-F674 HydrophobicContact CB-CD2 4.49Å
675	P	90.4	Very high	90.9	Very high	45 Å²	45	45.5 Å²	45.5	29%	0.292	27%	0.267	S	S	.	.	S	Bend	cis	-84.2	149.4	-7.7	33.7	-34.1	0	0	0	113	R734	P675-R734 HydrophobicContact CB-CB 4.1Å; P675-R734 HydrophobicContact CG-CB 4.17Å; P675-R734 WeakPolarHBondContact O-CB 3.45Å; P675-R734 PolarHBondContact O-N 3.18Å; P675-R734 VanDerWaalsContact O-N 3.08Å
676	C	94.2	Very high	90.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	155.6	-179.3	-63.4	0	0	0	0	113.7	C667 H673 I731 M732	C667-C676 CarbonylContact C-O 3.59Å; C667-C676 HydrophobicContact CB-CB 3.88Å; C667-C676 PolarHBondContact N-O 3.49Å; C667-C676 CarbonylContact O-C 3.58Å; C667-C676 VanDerWaalsContact O-C 3.29Å; C667-C676 VanDerWaalsContact O-CA 3.25Å; C667-C676 WeakPolarHBondContact O-CA 3.41Å; C667-C676 VanDerWaalsContact O-CB 3.23Å; C667-C676 WeakPolarHBondContact O-CB 3.47Å; C667-C676 PolarHBondContact O-N 2.99Å; H673-C676 VanDerWaalsContact C-SG 3.57Å; H673-C676 WeakPolarHBondContact CB-SG 3.14Å; H673-C676 PolarHBondContact O-SG 3.19Å; C676-I731 HydrophobicContact CB-CG2 4.18Å; C676-M732 CarbonylContact C-O 3.59Å; C676-M732 WeakPolarHBondContact CA-O 3.27Å
677	A	94.2	Very high	90.1	Very high	9 Å²	9	54.8 Å²	54.8	7%	0.074	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.5	168.4	0	0	0	0	0	108.9	V664 M732 R734	V664-A677 HydrophobicContact CG1-CB 4.26Å; A677-M732 PolarHBondContact N-O 3.47Å; A677-M732 PolarHBondContact O-N 2.97Å; A677-R734 HydrophobicContact CB-CB 4.21Å; A677-R734 HydrophobicContact CB-CG 4.26Å
678	L	94	Very high	89.7	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	109.8	-179.3	-170.2	79.5	0	0	0	109.9	P650 L652 V664 Y665 C667 L729 L730 I731	P650-L678 HydrophobicContact CB-CD1 3.96Å; P650-L678 HydrophobicContact CG-CD1 3.56Å; P650-L678 HydrophobicContact CG-CD2 4.24Å; L652-L678 HydrophobicContact CD1-CD2 3.7Å; L652-L678 HydrophobicContact CG-CD2 3.65Å; V664-L678 CarbonylContact C-O 3.6Å; V664-L678 WeakPolarHBondContact CA-O 3.5Å; Y665-L678 PolarHBondContact N-O 3.18Å; Y665-L678 PolarHBondContact O-N 3.05Å; C667-L678 HydrophobicContact CB-CB 4.24Å; L678-L729 HydrophobicContact CD1-CB 3.91Å; L678-L729 HydrophobicContact CD2-CB 4.5Å; L678-L729 HydrophobicContact CD2-CD1 4.37Å; L678-L729 HydrophobicContact CD2-CD2 4.44Å; L678-L729 HydrophobicContact CG-CB 4.3Å; L678-L730 CarbonylContact C-O 3.49Å; L678-L730 WeakPolarHBondContact CA-O 3.3Å; L678-I731 HydrophobicContact CD1-CD1 4.09Å; L678-I731 HydrophobicContact CD1-CG1 3.65Å
679	K	92.1	Very high	89.7	Confident	23 Å²	23	55.1 Å²	55.1	10%	0.1	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.4	173	-179.1	175.6	176.9	177.1	0	109.3	V664 V681 L729 L730 M732 D793	V664-K679 HydrophobicContact CG2-CB 4.23Å; V664-K679 HydrophobicContact CG2-CG 4.21Å; K679-V681 HydrophobicContact CD-CG2 4.42Å; K679-V681 HydrophobicContact CG-CG2 4.05Å; K679-L729 CarbonylContact O-C 3.56Å; K679-L729 WeakPolarHBondContact O-CA 3.48Å; K679-L730 HydrophobicContact CB-CB 4.35Å; K679-L730 PolarHBondContact N-O 3.46Å; K679-L730 PolarHBondContact O-N 3.3Å; K679-M732 HydrophobicContact CB-CE 3.45Å; K679-M732 VanDerWaalsContact CB-CE 3.45Å; K679-M732 HydrophobicContact CD-CE 4.27Å; K679-M732 HydrophobicContact CG-CE 4.49Å; K679-D793 IonicContact NZ-OD1 2.82Å; K679-D793 PolarHBondContact NZ-OD1 3.42Å; K679-D793 IonicContact NZ-OD2 3.62Å; K679-D793 PolarHBondContact NZ-OD2 3.03Å
680	S	92.6	Very high	89.5	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.007	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.9	173.1	178.8	0	0	0	0	109.7	G662 V663 Y720	G662-S680 VanDerWaalsContact CA-O 3.23Å; G662-S680 WeakPolarHBondContact CA-O 3.46Å; V663-S680 PolarHBondContact N-O 3.49Å; V663-S680 PolarHBondContact O-N 3.27Å; S680-Y720 WeakPolarHBondContact OG-CE2 3.41Å
681	V	90.9	Very high	89	Confident	18 Å²	18	53.9 Å²	53.9	11%	0.109	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.3	178.2	-173.5	0	0	0	0	108.5	K679 P683 L692 A727 V728 L730	K679-V681 HydrophobicContact CD-CG2 4.42Å; K679-V681 HydrophobicContact CG-CG2 4.05Å; V681-P683 VanDerWaalsContact O-CD 3.27Å; V681-P683 WeakPolarHBondContact O-CD 3.42Å; V681-L692 HydrophobicContact CB-CD2 4Å; V681-L692 HydrophobicContact CG1-CD1 4.21Å; V681-L692 HydrophobicContact CG1-CD2 3.65Å; V681-A727 CarbonylContact O-C 3.51Å; V681-A727 WeakPolarHBondContact O-CA 3.45Å; V681-V728 PolarHBondContact N-O 3.41Å; V681-V728 PolarHBondContact O-N 3.06Å; V681-L730 HydrophobicContact CG2-CD1 4.41Å
682	V	90.9	Very high	88.9	Confident	62 Å²	62	53.2 Å²	53.2	38%	0.376	29%	0.288	S	S	.	.			trans	-106.7	97.9	174.6	-177.8	0	0	0	0	107.9	Y720 A727	V682-Y720 HydrophobicContact CG2-CD1 3.85Å; V682-Y720 HydrophobicContact CG2-CE1 3.67Å; V682-A727 HydrophobicContact CG2-CB 3.94Å
683	P	88.1	Confident	88.8	Confident	17 Å²	17	50 Å²	50	11%	0.11	26%	0.255	C	S	.	.			trans	-67.6	129.7	176.2	26	-34.4	0	0	0	110.6	V681 H688 W689	V681-P683 VanDerWaalsContact O-CD 3.27Å; V681-P683 WeakPolarHBondContact O-CD 3.42Å; P683-H688 HydrophobicContact CB-CB 4.22Å; P683-W689 HydrophobicContact CB-CB 4.21Å; P683-W689 HydrophobicContact CB-CE3 4Å; P683-W689 HydrophobicContact CG-CB 4.33Å; P683-W689 HydrophobicContact CG-CD2 3.78Å; P683-W689 HydrophobicContact CG-CE3 2.98Å; P683-W689 HydrophobicContact CG-CG 4.4Å; P683-W689 HydrophobicContact CG-CH2 4.13Å; P683-W689 HydrophobicContact CG-CZ3 3.15Å
684	P	86.1	Confident	88.5	Confident	105 Å²	105	47.8 Å²	47.8	68%	0.682	25%	0.245	S	C	*	.	S	Bend	trans	-77.6	-22.6	-173.9	29.7	-36.8	0	0	0	114.3	H688	P684-H688 HydrophobicContact CG-CB 4.17Å
685	D	87.9	Confident	88.1	Confident	77 Å²	77	43.1 Å²	43.1	41%	0.412	23%	0.226	S	C	.	.	S	Bend	trans	-150.4	176.5	179.7	63.4	41.7	0	0	0	111.6	K687 H688 W689	D685-K687 VanDerWaalsContact C-N 3.31Å; D685-K687 PolarHBondContact O-N 3.37Å; D685-K687 WeakPolarHBondContact OD1-CA 3.44Å; D685-K687 WeakPolarHBondContact OD1-CB 3.19Å; D685-K687 PolarHBondContact OD1-N 3.27Å; D685-H688 PolarHBondContact O-N 3.38Å; D685-H688 IonicContact OD1-CE1 3.39Å; D685-H688 IonicContact OD1-CG 2.66Å; D685-H688 PolarHBondContact OD1-N 3.09Å; D685-H688 IonicContact OD1-ND1 2.55Å; D685-H688 PolarHBondContact OD1-ND1 3.22Å; D685-H688 IonicContact OD2-CE1 3.56Å; D685-H688 PolarHBondContact OD2-CE1 3.27Å; D685-H688 VanDerWaalsContact OD2-CE1 3.29Å; D685-H688 IonicContact OD2-ND1 2.71Å; D685-H688 PolarHBondContact OD2-ND1 2.87Å; D685-W689 PolarHBondContact O-N 2.91Å
686	E	86.4	Confident	87.9	Confident	139 Å²	139	41.2 Å²	41.2	65%	0.65	21%	0.213	S	C	*	.	H	α-helix	trans	-64.1	-32.3	-179.3	-66.8	-163.6	147.6	0	0	113.8	W689 N690	E686-W689 WeakPolarHBondContact O-CB 3.43Å; E686-W689 PolarHBondContact O-N 2.92Å; E686-N690 WeakPolarHBondContact O-CB 3.43Å; E686-N690 PolarHBondContact O-N 3.48Å; E686-N690 PolarHBondContact O-ND2 3.31Å
687	K	83.4	Confident	87.5	Confident	125 Å²	125	41.6 Å²	41.6	54%	0.543	21%	0.214	S	C	.	.	H	α-helix	trans	-67.1	-49.6	179.9	-178.4	-172.2	171.8	-168.5	0	109.8	D685 W689 N690 D691	D685-K687 VanDerWaalsContact C-N 3.31Å; D685-K687 PolarHBondContact O-N 3.37Å; D685-K687 WeakPolarHBondContact OD1-CA 3.44Å; D685-K687 WeakPolarHBondContact OD1-CB 3.19Å; D685-K687 PolarHBondContact OD1-N 3.27Å; K687-W689 PolarHBondContact O-N 3.49Å; K687-N690 PolarHBondContact O-N 3.36Å; K687-N690 VanDerWaalsContact O-N 3.16Å; K687-D691 PolarHBondContact O-N 3.28Å
688	H	84.6	Confident	86.8	Confident	90 Å²	90	41.7 Å²	41.7	42%	0.417	21%	0.213	S	C	.	.	H	α-helix	trans	-64.1	-31.6	176.3	-65.3	92.2	0	0	0	112	P683 P684 D685 L692	P683-H688 HydrophobicContact CB-CB 4.22Å; P684-H688 HydrophobicContact CG-CB 4.17Å; D685-H688 PolarHBondContact O-N 3.38Å; D685-H688 IonicContact OD1-CE1 3.39Å; D685-H688 IonicContact OD1-CG 2.66Å; D685-H688 PolarHBondContact OD1-N 3.09Å; D685-H688 IonicContact OD1-ND1 2.55Å; D685-H688 PolarHBondContact OD1-ND1 3.22Å; D685-H688 IonicContact OD2-CE1 3.56Å; D685-H688 PolarHBondContact OD2-CE1 3.27Å; D685-H688 VanDerWaalsContact OD2-CE1 3.29Å; D685-H688 IonicContact OD2-ND1 2.71Å; D685-H688 PolarHBondContact OD2-ND1 2.87Å; H688-L692 VanDerWaalsContact O-CB 3.22Å; H688-L692 WeakPolarHBondContact O-CB 3.44Å; H688-L692 PolarHBondContact O-N 3.34Å
689	W	86.9	Confident	86.2	Confident	22 Å²	22	42.9 Å²	42.9	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-47.5	172.2	-167.3	-72	0	0	0	111.6	P683 D685 E686 K687 A693 I716 V726 V728	P683-W689 HydrophobicContact CB-CB 4.21Å; P683-W689 HydrophobicContact CB-CE3 4Å; P683-W689 HydrophobicContact CG-CB 4.33Å; P683-W689 HydrophobicContact CG-CD2 3.78Å; P683-W689 HydrophobicContact CG-CE3 2.98Å; P683-W689 HydrophobicContact CG-CG 4.4Å; P683-W689 HydrophobicContact CG-CH2 4.13Å; P683-W689 HydrophobicContact CG-CZ3 3.15Å; D685-W689 PolarHBondContact O-N 2.91Å; E686-W689 WeakPolarHBondContact O-CB 3.43Å; E686-W689 PolarHBondContact O-N 2.92Å; K687-W689 PolarHBondContact O-N 3.49Å; W689-A693 WeakPolarHBondContact O-CB 3.4Å; W689-A693 PolarHBondContact O-N 3.02Å; W689-I716 HydrophobicContact CH2-CG2 4.13Å; W689-I716 HydrophobicContact CZ2-CD1 4.26Å; W689-I716 HydrophobicContact CZ2-CG2 4.18Å; W689-V726 HydrophobicContact CH2-CB 3.89Å; W689-V726 HydrophobicContact CH2-CG1 3.28Å; W689-V726 HydrophobicContact CZ2-CG1 4.24Å; W689-V726 HydrophobicContact CZ3-CB 3.71Å; W689-V726 HydrophobicContact CZ3-CG1 3.68Å; W689-V728 HydrophobicContact CH2-CG2 3.72Å; W689-V728 HydrophobicContact CZ2-CG2 3.83Å
690	N	87.5	Confident	85.8	Confident	26 Å²	26	45.7 Å²	45.7	14%	0.139	23%	0.229	C	C	.	.	H	α-helix	trans	-70	-39.7	-179.3	-67.4	-25.4	0	0	0	112.1	P629 R633 E686 K687 A693 L694	P629-N690 HydrophobicContact CB-CB 3.58Å; R633-N690 WeakPolarHBondContact CD-OD1 3.28Å; E686-N690 WeakPolarHBondContact O-CB 3.43Å; E686-N690 PolarHBondContact O-N 3.48Å; E686-N690 PolarHBondContact O-ND2 3.31Å; K687-N690 PolarHBondContact O-N 3.36Å; K687-N690 VanDerWaalsContact O-N 3.16Å; N690-A693 PolarHBondContact O-N 2.86Å; N690-L694 PolarHBondContact O-N 2.91Å
691	D	81.6	Confident	85.3	Confident	58 Å²	58	48.9 Å²	48.9	31%	0.31	25%	0.251	S	S	.	.	H	α-helix	trans	-60.8	-49.1	175	-72.8	-22.4	0	0	0	110.3	K687 A693 L694 E695	K687-D691 PolarHBondContact O-N 3.28Å; D691-A693 VanDerWaalsContact C-N 3.29Å; D691-A693 PolarHBondContact O-N 3.41Å; D691-L694 PolarHBondContact O-N 2.75Å; D691-E695 VanDerWaalsContact O-CG 3.27Å; D691-E695 WeakPolarHBondContact O-CG 3.4Å; D691-E695 PolarHBondContact O-N 2.77Å
692	L	85.3	Confident	85	Confident	16 Å²	16	49.2 Å²	49.2	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-39.7	175.3	176.5	63.5	0	0	0	112.6	V681 H688 E695 F696 V728	V681-L692 HydrophobicContact CB-CD2 4Å; V681-L692 HydrophobicContact CG1-CD1 4.21Å; V681-L692 HydrophobicContact CG1-CD2 3.65Å; H688-L692 VanDerWaalsContact O-CB 3.22Å; H688-L692 WeakPolarHBondContact O-CB 3.44Å; H688-L692 PolarHBondContact O-N 3.34Å; L692-E695 PolarHBondContact O-N 2.91Å; L692-F696 WeakPolarHBondContact O-CB 3.39Å; L692-F696 PolarHBondContact O-N 3.42Å; L692-V728 HydrophobicContact CD2-CB 3.86Å; L692-V728 HydrophobicContact CD2-CG1 4.41Å; L692-V728 HydrophobicContact CD2-CG2 3.68Å
693	A	89.4	Confident	84.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-37.3	179.1	0	0	0	0	0	112.4	A632 R633 L636 W689 N690 D691 F696 H697	A632-A693 HydrophobicContact CB-CB 4.18Å; R633-A693 HydrophobicContact CB-CB 4.15Å; L636-A693 HydrophobicContact CB-CB 4.09Å; L636-A693 HydrophobicContact CD2-CB 3.88Å; W689-A693 WeakPolarHBondContact O-CB 3.4Å; W689-A693 PolarHBondContact O-N 3.02Å; N690-A693 PolarHBondContact O-N 2.86Å; D691-A693 VanDerWaalsContact C-N 3.29Å; D691-A693 PolarHBondContact O-N 3.41Å; A693-F696 PolarHBondContact O-N 3.28Å; A693-H697 PolarHBondContact O-N 3.33Å
694	L	83.3	Confident	85	Confident	20 Å²	20	55.9 Å²	55.9	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-42.9	174.8	-171.4	68.7	0	0	0	111.3	L368 A632 N690 D691 F696 H697 Y698 M802	L368-L694 HydrophobicContact CD1-CD1 4.45Å; A632-L694 HydrophobicContact CB-CB 4.04Å; A632-L694 HydrophobicContact CB-CD1 3.96Å; N690-L694 PolarHBondContact O-N 2.91Å; D691-L694 PolarHBondContact O-N 2.75Å; L694-F696 VanDerWaalsContact C-N 3.34Å; L694-F696 PolarHBondContact O-N 2.94Å; L694-H697 PolarHBondContact O-N 3.29Å; L694-Y698 HydrophobicContact CD1-CE2 4.09Å; L694-Y698 HydrophobicContact CD2-CE2 4.11Å; L694-Y698 HydrophobicContact CG-CD2 4.32Å; L694-Y698 HydrophobicContact CG-CE2 3.65Å; L694-Y698 VanDerWaalsContact O-CD2 3.23Å; L694-Y698 WeakPolarHBondContact O-CD2 3.42Å; L694-Y698 PolarHBondContact O-N 3.41Å; L694-Y698 VanDerWaalsContact O-N 3.17Å; L694-M802 HydrophobicContact CD2-CE 4.32Å
695	E	80.3	Confident	85.4	Confident	53 Å²	53	52.8 Å²	52.8	25%	0.248	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-48.1	172.6	-70.2	164.5	-158.3	0	0	111.3	D691 L692 H697 Y698 M699 G795	D691-E695 VanDerWaalsContact O-CG 3.27Å; D691-E695 WeakPolarHBondContact O-CG 3.4Å; D691-E695 PolarHBondContact O-N 2.77Å; L692-E695 PolarHBondContact O-N 2.91Å; E695-H697 VanDerWaalsContact C-N 3.3Å; E695-H697 PolarHBondContact O-N 3.01Å; E695-Y698 PolarHBondContact O-N 3.49Å; E695-M699 WeakPolarHBondContact O-CG 3.49Å; E695-M699 PolarHBondContact O-N 3.02Å; E695-G795 WeakPolarHBondContact CG-O 3.49Å; E695-G795 WeakPolarHBondContact OE2-CA 3.37Å; E695-G795 VanDerWaalsContact OE2-O 3.12Å
696	F	85.4	Confident	85.7	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-42.6	176.7	174.4	-95.5	0	0	0	112.3	L636 R639 L692 A693 L694 Y698 M699 R700 L711 S714 L730	L636-F696 HydrophobicContact CB-CD1 4.32Å; L636-F696 HydrophobicContact CD1-CB 4.41Å; L636-F696 HydrophobicContact CD1-CD1 3.51Å; L636-F696 HydrophobicContact CD1-CD2 4.14Å; L636-F696 HydrophobicContact CD1-CE1 3.69Å; L636-F696 HydrophobicContact CD1-CE2 4.29Å; L636-F696 HydrophobicContact CD1-CG 3.74Å; L636-F696 HydrophobicContact CD1-CZ 4.08Å; L636-F696 HydrophobicContact CG-CD1 4.45Å; R639-F696 HydrophobicContact CB-CE1 4.49Å; R639-F696 HydrophobicContact CG-CE1 4.23Å; R639-F696 HydrophobicContact CG-CZ 4.21Å; L692-F696 WeakPolarHBondContact O-CB 3.39Å; L692-F696 PolarHBondContact O-N 3.42Å; A693-F696 PolarHBondContact O-N 3.28Å; L694-F696 VanDerWaalsContact C-N 3.34Å; L694-F696 PolarHBondContact O-N 2.94Å; F696-Y698 PolarHBondContact O-N 2.77Å; F696-M699 PolarHBondContact O-N 3.25Å; F696-R700 VanDerWaalsContact O-CB 3.25Å; F696-R700 WeakPolarHBondContact O-CB 3.31Å; F696-R700 PolarHBondContact O-N 2.87Å; F696-L711 HydrophobicContact CD2-CD2 3.86Å; F696-L711 HydrophobicContact CE2-CD2 3.62Å; F696-L711 HydrophobicContact CE2-CG 4.39Å; F696-L711 HydrophobicContact CZ-CD2 4.5Å; F696-S714 WeakPolarHBondContact CE2-OG 3.28Å; F696-S714 WeakPolarHBondContact CZ-OG 3.46Å; F696-L730 HydrophobicContact CD2-CD2 3.7Å; F696-L730 HydrophobicContact CE2-CD2 4.12Å
697	H	85.9	Confident	86.2	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-46.8	177.7	-174.9	76.7	0	0	0	111.6	L368 D369 A693 L694 E695 R700 S701	L368-H697 HydrophobicContact CD2-CB 3.88Å; D369-H697 IonicContact OD1-CE1 3.7Å; D369-H697 PolarHBondContact OD1-CE1 3.4Å; D369-H697 IonicContact OD1-NE2 2.91Å; D369-H697 PolarHBondContact OD1-NE2 2.91Å; A693-H697 PolarHBondContact O-N 3.33Å; L694-H697 PolarHBondContact O-N 3.29Å; E695-H697 VanDerWaalsContact C-N 3.3Å; E695-H697 PolarHBondContact O-N 3.01Å; H697-R700 PolarHBondContact O-N 3.07Å; H697-S701 PolarHBondContact O-N 3.06Å; H697-S701 PolarHBondContact O-OG 3Å
698	Y	79.3	Confident	86.8	Confident	11 Å²	11	43.9 Å²	43.9	4%	0.043	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-46.1	176.5	-68.3	-54	0	0	0	112.6	I372 L694 E695 F696 R700 S701 L702 L771 P799 M802	I372-Y698 HydrophobicContact CD1-CE1 3.66Å; I372-Y698 HydrophobicContact CG1-CE1 4.24Å; I372-Y698 HydrophobicContact CG2-CE1 4.17Å; L694-Y698 HydrophobicContact CD1-CE2 4.09Å; L694-Y698 HydrophobicContact CD2-CE2 4.11Å; L694-Y698 HydrophobicContact CG-CD2 4.32Å; L694-Y698 HydrophobicContact CG-CE2 3.65Å; L694-Y698 VanDerWaalsContact O-CD2 3.23Å; L694-Y698 WeakPolarHBondContact O-CD2 3.42Å; L694-Y698 PolarHBondContact O-N 3.41Å; L694-Y698 VanDerWaalsContact O-N 3.17Å; E695-Y698 PolarHBondContact O-N 3.49Å; F696-Y698 PolarHBondContact O-N 2.77Å; Y698-R700 PolarHBondContact O-N 2.8Å; Y698-S701 PolarHBondContact O-N 3.09Å; Y698-S701 PolarHBondContact O-OG 3.44Å; Y698-S701 VanDerWaalsContact O-OG 3.1Å; Y698-L702 WeakPolarHBondContact O-CG 3.44Å; Y698-L702 PolarHBondContact O-N 3.33Å; Y698-L771 HydrophobicContact CD1-CD2 4.24Å; Y698-L771 HydrophobicContact CG-CD2 4.35Å; Y698-P799 HydrophobicContact CD1-CG 4.46Å; Y698-P799 HydrophobicContact CE1-CG 3.68Å; Y698-P799 HydrophobicContact CE2-CG 3.99Å; Y698-P799 VanDerWaalsContact CZ-CG 3.43Å; Y698-P799 WeakPolarHBondContact OH-CG 3.38Å; Y698-M802 PolarHBondContact OH-SD 3.25Å
699	M	82.2	Confident	87.2	Confident	26 Å²	26	40.2 Å²	40.2	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-57.6	-38	178.7	-71.4	-176.5	62.8	0	0	112.2	E695 F696 L711 L794	E695-M699 WeakPolarHBondContact O-CG 3.49Å; E695-M699 PolarHBondContact O-N 3.02Å; F696-M699 PolarHBondContact O-N 3.25Å; M699-L711 HydrophobicContact CB-CD2 3.94Å; M699-L711 HydrophobicContact CE-CD2 4.41Å; M699-L794 HydrophobicContact CE-CB 4.11Å; M699-L794 HydrophobicContact CE-CD1 4.36Å; M699-L794 HydrophobicContact CE-CG 4.39Å; M699-L794 HydrophobicContact CG-CB 3.57Å; M699-L794 HydrophobicContact CG-CD1 3.99Å; M699-L794 HydrophobicContact CG-CG 4.34Å; M699-L794 HydrophobicContact SD-CB 3.82Å
700	R	84.4	Confident	87.4	Confident	81 Å²	81	40.6 Å²	40.6	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-78	-33.2	-177.3	177.8	-179.5	168.5	81.5	3.1	113.2	R639 F696 H697 Y698 L702 L711	R639-R700 VanDerWaalsContact CD-CZ 3.45Å; R639-R700 VanDerWaalsContact CZ-CZ 3.46Å; R639-R700 VanDerWaalsContact NE-CZ 3.34Å; F696-R700 VanDerWaalsContact O-CB 3.25Å; F696-R700 WeakPolarHBondContact O-CB 3.31Å; F696-R700 PolarHBondContact O-N 2.87Å; H697-R700 PolarHBondContact O-N 3.07Å; Y698-R700 PolarHBondContact O-N 2.8Å; R700-L702 VanDerWaalsContact C-N 3.26Å; R700-L711 HydrophobicContact CB-CD2 4.41Å
701	S	81.7	Confident	87.6	Confident	68 Å²	68	41.2 Å²	41.2	48%	0.476	21%	0.206	S	C	.	.	H	α-helix	trans	-77.1	-14.8	-180	63.1	0	0	0	0	113	H697 Y698	H697-S701 PolarHBondContact O-N 3.06Å; H697-S701 PolarHBondContact O-OG 3Å; Y698-S701 PolarHBondContact O-N 3.09Å; Y698-S701 PolarHBondContact O-OG 3.44Å; Y698-S701 VanDerWaalsContact O-OG 3.1Å
702	L	84.4	Confident	88.1	Confident	25 Å²	25	39.9 Å²	39.9	13%	0.131	20%	0.197	C	C	.	.	S	Bend	trans	-63.1	132.3	176	-75.8	172.7	0	0	0	111.8	Y698 R700 L708 F765 L766 Q769 L771 L794	Y698-L702 WeakPolarHBondContact O-CG 3.44Å; Y698-L702 PolarHBondContact O-N 3.33Å; R700-L702 VanDerWaalsContact C-N 3.26Å; L702-L708 HydrophobicContact CD1-CD1 4.18Å; L702-F765 HydrophobicContact CD2-CE1 4.22Å; L702-L766 HydrophobicContact CD1-CD2 3.74Å; L702-L766 HydrophobicContact CD2-CD2 4.49Å; L702-Q769 HydrophobicContact CD2-CB 3.72Å; L702-Q769 HydrophobicContact CD2-CG 3.64Å; L702-L771 HydrophobicContact CD1-CD1 4.04Å; L702-L771 HydrophobicContact CD2-CD1 3.85Å; L702-L771 HydrophobicContact CG-CD1 4.12Å; L702-L794 HydrophobicContact CD1-CD1 3.82Å
703	P	88.4	Confident	88.4	Confident	68 Å²	68	39.1 Å²	39.1	44%	0.442	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-56.7	144.2	166	-21.5	31	0	0	0	110.6	H705 F765	P703-H705 PolarHBondContact O-N 3.05Å; P703-F765 HydrophobicContact CB-CE2 4.48Å; P703-F765 HydrophobicContact CB-CZ 4.03Å; P703-F765 HydrophobicContact CG-CZ 4.23Å; P703-F765 VanDerWaalsContact O-CZ 3.31Å; P703-F765 WeakPolarHBondContact O-CZ 3.46Å
704	K	90.5	Very high	88.6	Confident	152 Å²	152	39.1 Å²	39.1	66%	0.661	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-57	138.2	173.5	-71	-168	171.5	-136.2	0	110.5	D710	K704-D710 IonicContact NZ-OD2 3.6Å; K704-D710 PolarHBondContact NZ-OD2 3.1Å
705	H	94.3	Very high	89.2	Confident	40 Å²	40	38.3 Å²	38.3	19%	0.185	19%	0.19	C	C	.	.			trans	-144.8	137.8	-177.1	-173	-95	0	0	0	110.9	P703 R707 L708 F765	P703-H705 PolarHBondContact O-N 3.05Å; H705-R707 PolarHBondContact ND1-N 2.89Å; H705-R707 VanDerWaalsContact ND1-N 3.18Å; H705-R707 PolarHBondContact O-N 3.32Å; H705-L708 HydrophobicContact CB-CB 4.48Å; H705-L708 HydrophobicContact CB-CD1 4.48Å; H705-L708 HydrophobicContact CB-CG 4.32Å; H705-L708 PolarHBondContact O-N 3.5Å; H705-L708 VanDerWaalsContact O-N 3.15Å; H705-F765 HydrophobicContact CB-CD1 3.79Å; H705-F765 HydrophobicContact CB-CD2 4.34Å; H705-F765 HydrophobicContact CB-CE1 3.7Å; H705-F765 HydrophobicContact CB-CE2 4.26Å; H705-F765 HydrophobicContact CB-CG 4.11Å; H705-F765 HydrophobicContact CB-CZ 3.94Å; H705-F765 AromaticContact CD2-CD2 3.38Å; H705-F765 WeakPolarHBondContact CD2-CD2 3.31Å; H705-F765 AromaticContact CD2-CE2 3.92Å; H705-F765 AromaticContact CD2-CG 3.44Å; H705-F765 VanDerWaalsContact CD2-CG 3.44Å; H705-F765 WeakPolarHBondContact CD2-CG 3.42Å; H705-F765 AromaticContact CG-CD1 3.73Å; H705-F765 AromaticContact CG-CD2 3.92Å; H705-F765 AromaticContact CG-CG 3.61Å; H705-F765 AromaticContact NE2-CD2 3.98Å; H705-F765 AromaticContact NE2-CG 3.83Å
706	E	95.4	Very high	89.9	Confident	126 Å²	126	36 Å²	36	59%	0.589	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.1	-173.8	-66.5	-164.6	164.2	0	0	114.6	K790	E706-K790 WeakPolarHBondContact O-CE 3.35Å; E706-K790 WeakPolarHBondContact O-CG 3.44Å
707	R	96.6	Very high	90.2	Very high	19 Å²	19	36.5 Å²	36.5	7%	0.072	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	9.2	-176.4	-48.3	-58.7	172.9	-125	-23	114.2	H705 D758 E761 A789 K790 I791	H705-R707 PolarHBondContact ND1-N 2.89Å; H705-R707 VanDerWaalsContact ND1-N 3.18Å; H705-R707 PolarHBondContact O-N 3.32Å; R707-D758 WeakPolarHBondContact CB-O 3.41Å; R707-D758 WeakPolarHBondContact CG-O 3.45Å; R707-D758 IonicContact CZ-OD1 2.69Å; R707-D758 IonicContact NE-OD1 3.17Å; R707-D758 PolarHBondContact NE-OD1 2.95Å; R707-E761 HydrophobicContact CG-CB 4.05Å; R707-E761 HydrophobicContact CG-CG 3.94Å; R707-E761 WeakPolarHBondContact CG-OE2 3.03Å; R707-E761 IonicContact CZ-OE2 2.95Å; R707-E761 IonicContact NE-OE2 3.56Å; R707-E761 PolarHBondContact NE-OE2 2.91Å; R707-E761 IonicContact NH2-OE2 3.68Å; R707-A789 WeakPolarHBondContact CD-O 3.33Å; R707-K790 CarbonylContact O-C 3.6Å; R707-K790 WeakPolarHBondContact O-CA 3.3Å; R707-I791 PolarHBondContact O-N 2.91Å
708	L	94.7	Very high	90.3	Very high	8 Å²	8	40 Å²	40	4%	0.042	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-119.5	146	172.5	-62.7	-171.8	0	0	0	109.6	L702 H705 D710 F765 L766 I791	L702-L708 HydrophobicContact CD1-CD1 4.18Å; H705-L708 HydrophobicContact CB-CB 4.48Å; H705-L708 HydrophobicContact CB-CD1 4.48Å; H705-L708 HydrophobicContact CB-CG 4.32Å; H705-L708 PolarHBondContact O-N 3.5Å; H705-L708 VanDerWaalsContact O-N 3.15Å; L708-D710 PolarHBondContact O-N 3.05Å; L708-F765 HydrophobicContact CD1-CD1 3.54Å; L708-F765 HydrophobicContact CD1-CE1 3.61Å; L708-F765 HydrophobicContact CG-CD1 4.2Å; L708-L766 HydrophobicContact CD1-CD2 3.71Å; L708-L766 HydrophobicContact CD1-CG 4.11Å; L708-L766 HydrophobicContact CD2-CD1 4.05Å; L708-L766 HydrophobicContact CD2-CD2 4.38Å; L708-L766 HydrophobicContact CD2-CG 4.08Å; L708-I791 HydrophobicContact CD2-CB 3.85Å; L708-I791 HydrophobicContact CD2-CD1 4.33Å; L708-I791 HydrophobicContact CD2-CG1 4.48Å
709	V	93.3	Very high	90.7	Very high	14 Å²	14	43.7 Å²	43.7	9%	0.085	22%	0.216	C	C	.	.			trans	-70.3	121.7	175.4	170	0	0	0	0	110.2	L711 M732 E733 L735 L782 K790 I791	V709-L711 PolarHBondContact O-N 2.98Å; V709-M732 HydrophobicContact CG1-CB 4.05Å; V709-E733 WeakPolarHBondContact CA-OE1 3.16Å; V709-E733 HydrophobicContact CB-CG 4.41Å; V709-E733 HydrophobicContact CG1-CG 3.71Å; V709-L735 HydrophobicContact CG2-CD1 4.31Å; V709-L782 HydrophobicContact CG2-CD1 4.09Å; V709-K790 HydrophobicContact CG2-CB 3.87Å; V709-I791 WeakPolarHBondContact CG2-O 3.42Å; V709-I791 PolarHBondContact N-O 2.6Å
710	D	91.6	Very high	90.8	Very high	29 Å²	29	44.7 Å²	44.7	16%	0.155	22%	0.219	C	C	.	.			trans	-64.8	127.3	177.2	-89.7	12.6	0	0	0	111.4	K704 L708 M732 E733	K704-D710 IonicContact NZ-OD2 3.6Å; K704-D710 PolarHBondContact NZ-OD2 3.1Å; L708-D710 PolarHBondContact O-N 3.05Å; D710-M732 CarbonylContact O-C 3.57Å; D710-M732 VanDerWaalsContact O-CA 3.27Å; D710-M732 WeakPolarHBondContact O-CA 3.3Å; D710-E733 HydrophobicContact CB-CB 4.22Å; D710-E733 HydrophobicContact CB-CG 4.04Å; D710-E733 PolarHBondContact N-OE1 3.15Å; D710-E733 PolarHBondContact O-N 3.24Å
711	L	91.9	Very high	90.6	Very high	39 Å²	39	43.6 Å²	43.6	20%	0.204	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.7	168.5	-179	67.8	0	0	0	109.2	F696 M699 R700 V709 L730 M732	F696-L711 HydrophobicContact CD2-CD2 3.86Å; F696-L711 HydrophobicContact CE2-CD2 3.62Å; F696-L711 HydrophobicContact CE2-CG 4.39Å; F696-L711 HydrophobicContact CZ-CD2 4.5Å; M699-L711 HydrophobicContact CB-CD2 3.94Å; M699-L711 HydrophobicContact CE-CD2 4.41Å; R700-L711 HydrophobicContact CB-CD2 4.41Å; V709-L711 PolarHBondContact O-N 2.98Å; L711-L730 HydrophobicContact CD1-CB 4.2Å; L711-M732 HydrophobicContact CD1-CG 3.85Å
712	H	91.6	Very high	90.5	Very high	30 Å²	30	44.3 Å²	44.3	14%	0.139	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-34.1	-179.6	-61.9	-32.6	0	0	0	112.6	W670 H673 I731	W670-H712 HydrophobicContact CZ3-CB 4.44Å; H673-H712 AromaticContact CD2-CG 3.84Å; H673-H712 AromaticContact CE1-ND1 3.68Å; H673-H712 AromaticContact CG-CD2 3.63Å; H673-H712 AromaticContact CG-CG 3.66Å; H673-H712 AromaticContact CG-ND1 3.9Å; H673-H712 AromaticContact CG-NE2 3.87Å; H673-H712 AromaticContact ND1-CD2 3.94Å; H673-H712 AromaticContact ND1-CE1 3.54Å; H673-H712 AromaticContact ND1-CG 3.82Å; H673-H712 AromaticContact ND1-ND1 3.56Å; H673-H712 AromaticContact ND1-NE2 3.76Å; H712-I731 HydrophobicContact CB-CB 4.46Å; H712-I731 HydrophobicContact CB-CG2 4.13Å; H712-I731 PolarHBondContact N-O 3.45Å
713	G	92.2	Very high	90.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.8	-173.4	178.8	0	0	0	0	0	113.8	I731	G713-I731 PolarHBondContact N-O 2.89Å; G713-I731 WeakPolarHBondContact O-CD1 3.09Å; G713-I731 PolarHBondContact O-N 2.87Å
714	S	93.6	Very high	89.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.7	178.6	56.5	0	0	0	0	112.6	S640 D643 F696 L729	S640-S714 WeakPolarHBondContact CA-O 3.25Å; D643-S714 VanDerWaalsContact CB-O 3.32Å; D643-S714 WeakPolarHBondContact CB-O 3.26Å; D643-S714 PolarHBondContact OD2-N 3.1Å; F696-S714 WeakPolarHBondContact CE2-OG 3.28Å; F696-S714 WeakPolarHBondContact CZ-OG 3.46Å; S714-L729 CarbonylContact C-O 3.24Å; S714-L729 VanDerWaalsContact CA-O 3.27Å; S714-L729 WeakPolarHBondContact CA-O 3.4Å
715	V	95.3	Very high	89.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	124.1	173	171.8	0	0	0	0	110.4	S640 V644 K649 W670 L729 I731	S640-V715 WeakPolarHBondContact OG-CA 3.3Å; V644-V715 HydrophobicContact CG2-CB 3.97Å; V644-V715 HydrophobicContact CG2-CG1 3.36Å; V644-V715 HydrophobicContact CG2-CG2 3.58Å; K649-V715 HydrophobicContact CG-CG1 4.25Å; W670-V715 HydrophobicContact CZ2-CG2 4.04Å; V715-L729 HydrophobicContact CB-CB 4.34Å; V715-L729 HydrophobicContact CB-CD1 4.49Å; V715-L729 HydrophobicContact CG1-CD1 4.36Å; V715-L729 PolarHBondContact N-O 3Å; V715-L729 WeakPolarHBondContact O-CA 3.35Å; V715-L729 VanDerWaalsContact O-CB 3.24Å; V715-L729 WeakPolarHBondContact O-CB 3.38Å; V715-L729 WeakPolarHBondContact O-CG 3.47Å; V715-L729 PolarHBondContact O-N 3Å; V715-I731 HydrophobicContact CG2-CD1 4.1Å
716	I	94.6	Very high	89.2	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.9	169.8	-58.5	171.4	0	0	0	108.5	L636 E637 S640 W689 Y718 V726 A727	L636-I716 HydrophobicContact CG-CD1 4.31Å; E637-I716 HydrophobicContact CB-CD1 4.18Å; E637-I716 HydrophobicContact CG-CD1 3.6Å; S640-I716 PolarHBondContact OG-N 2.92Å; W689-I716 HydrophobicContact CH2-CG2 4.13Å; W689-I716 HydrophobicContact CZ2-CD1 4.26Å; W689-I716 HydrophobicContact CZ2-CG2 4.18Å; I716-Y718 HydrophobicContact CB-CE2 3.97Å; I716-Y718 HydrophobicContact CG2-CD1 4.26Å; I716-Y718 HydrophobicContact CG2-CD2 3.98Å; I716-Y718 HydrophobicContact CG2-CE1 3.87Å; I716-Y718 HydrophobicContact CG2-CE2 3.57Å; I716-Y718 HydrophobicContact CG2-CG 4.32Å; I716-V726 HydrophobicContact CG2-CG1 3.55Å; I716-A727 CarbonylContact C-O 3.52Å; I716-A727 WeakPolarHBondContact CA-O 3.45Å
717	D	92.3	Very high	89.1	Confident	14 Å²	14	36.8 Å²	36.8	8%	0.075	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	97.9	174.9	-172.6	18.6	0	0	0	111	K649 N719 V726 A727 L729	K649-D717 VanDerWaalsContact CE-CG 3.46Å; K649-D717 VanDerWaalsContact CE-OD2 3.28Å; K649-D717 WeakPolarHBondContact CE-OD2 3.47Å; K649-D717 IonicContact NZ-OD1 3.64Å; K649-D717 PolarHBondContact NZ-OD1 2.81Å; K649-D717 IonicContact NZ-OD2 3.55Å; K649-D717 PolarHBondContact NZ-OD2 3.29Å; D717-N719 PolarHBondContact O-N 3.27Å; D717-N719 PolarHBondContact OD1-N 3.1Å; D717-V726 WeakPolarHBondContact O-CA 3.38Å; D717-A727 PolarHBondContact N-O 3.35Å; D717-A727 PolarHBondContact O-N 2.99Å; D717-L729 HydrophobicContact CB-CD1 4.01Å; D717-L729 HydrophobicContact CB-CG 4.21Å
718	Y	88.8	Confident	88.9	Confident	81 Å²	81	35.9 Å²	35.9	32%	0.318	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-12.5	176.7	-60.9	-87.1	0	0	0	113.8	I716 V726	I716-Y718 HydrophobicContact CB-CE2 3.97Å; I716-Y718 HydrophobicContact CG2-CD1 4.26Å; I716-Y718 HydrophobicContact CG2-CD2 3.98Å; I716-Y718 HydrophobicContact CG2-CE1 3.87Å; I716-Y718 HydrophobicContact CG2-CE2 3.57Å; I716-Y718 HydrophobicContact CG2-CG 4.32Å; Y718-V726 HydrophobicContact CD1-CG1 3.86Å; Y718-V726 HydrophobicContact CD1-CG2 4.21Å; Y718-V726 HydrophobicContact CE1-CG1 4.22Å; Y718-V726 HydrophobicContact CG-CG1 4.38Å
719	N	86.6	Confident	88.9	Confident	89 Å²	89	35.5 Å²	35.5	48%	0.476	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	17.7	-178.6	-65.4	2.6	0	0	0	111.5	D717 G722 G723	D717-N719 PolarHBondContact O-N 3.27Å; D717-N719 PolarHBondContact OD1-N 3.1Å; N719-G722 PolarHBondContact O-N 2.87Å; N719-G723 PolarHBondContact O-N 2.69Å
720	Y	85.4	Confident	88.9	Confident	48 Å²	48	35.3 Å²	35.3	19%	0.188	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	141.8	-178.8	-168.2	-97	0	0	0	110.7	Y665 S680 V682 G722 G723 S724 S725 A727	Y665-Y720 PolarHBondContact OH-OH 3.49Å; S680-Y720 WeakPolarHBondContact OG-CE2 3.41Å; V682-Y720 HydrophobicContact CG2-CD1 3.85Å; V682-Y720 HydrophobicContact CG2-CE1 3.67Å; Y720-G722 PolarHBondContact O-N 3.04Å; Y720-G723 PolarHBondContact O-N 2.91Å; Y720-G723 VanDerWaalsContact O-N 3.13Å; Y720-S724 PolarHBondContact O-N 3.2Å; Y720-S725 WeakPolarHBondContact CB-O 3.43Å; Y720-S725 PolarHBondContact N-O 2.87Å; Y720-S725 PolarHBondContact O-N 3.36Å; Y720-S725 VanDerWaalsContact O-O 3.07Å; Y720-A727 HydrophobicContact CD1-CB 3.87Å; Y720-A727 HydrophobicContact CD2-CB 3.69Å; Y720-A727 HydrophobicContact CE1-CB 4.43Å; Y720-A727 HydrophobicContact CE2-CB 4.28Å; Y720-A727 HydrophobicContact CG-CB 3.45Å; Y720-A727 VanDerWaalsContact CG-CB 3.45Å
721	G	80	Confident	89	Confident	58 Å²	58	33.9 Å²	33.9	60%	0.598	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	59.2	30.1	-175.8	0	0	0	0	0	114.2
722	G	80	Confident	89.1	Confident	82 Å²	82	32.7 Å²	32.7	85%	0.845	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	78.6	18.8	-178	0	0	0	0	0	114.3	N719 Y720	N719-G722 PolarHBondContact O-N 2.87Å; Y720-G722 PolarHBondContact O-N 3.04Å
723	G	78.9	Confident	89.1	Confident	49 Å²	49	32.7 Å²	32.7	51%	0.505	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	94.1	3.2	-178.6	0	0	0	0	0	114.4	N719 Y720 S725	N719-G723 PolarHBondContact O-N 2.69Å; Y720-G723 PolarHBondContact O-N 2.91Å; Y720-G723 VanDerWaalsContact O-N 3.13Å; G723-S725 VanDerWaalsContact C-N 3.32Å
724	S	76.8	Confident	89.2	Confident	104 Å²	104	36.7 Å²	36.7	73%	0.727	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.4	175.8	-57.1	0	0	0	0	113.5	Y720	Y720-S724 PolarHBondContact O-N 3.2Å
725	S	84.8	Confident	89.2	Confident	51 Å²	51	37.9 Å²	37.9	36%	0.357	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	156.1	-179.9	-56.9	0	0	0	0	111.5	Y720 G723	Y720-S725 WeakPolarHBondContact CB-O 3.43Å; Y720-S725 PolarHBondContact N-O 2.87Å; Y720-S725 PolarHBondContact O-N 3.36Å; Y720-S725 VanDerWaalsContact O-O 3.07Å; G723-S725 VanDerWaalsContact C-N 3.32Å
726	V	90	Very high	89.1	Confident	49 Å²	49	42.4 Å²	42.4	30%	0.297	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130	170.4	-170.4	0	0	0	0	108	W689 I716 D717 Y718	W689-V726 HydrophobicContact CH2-CB 3.89Å; W689-V726 HydrophobicContact CH2-CG1 3.28Å; W689-V726 HydrophobicContact CZ2-CG1 4.24Å; W689-V726 HydrophobicContact CZ3-CB 3.71Å; W689-V726 HydrophobicContact CZ3-CG1 3.68Å; I716-V726 HydrophobicContact CG2-CG1 3.55Å; D717-V726 WeakPolarHBondContact O-CA 3.38Å; Y718-V726 HydrophobicContact CD1-CG1 3.86Å; Y718-V726 HydrophobicContact CD1-CG2 4.21Å; Y718-V726 HydrophobicContact CE1-CG1 4.22Å; Y718-V726 HydrophobicContact CG-CG1 4.38Å
727	A	92.2	Very high	89	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.7	176.9	0	0	0	0	0	111.4	V681 V682 I716 D717 Y720 L729	V681-A727 CarbonylContact O-C 3.51Å; V681-A727 WeakPolarHBondContact O-CA 3.45Å; V682-A727 HydrophobicContact CG2-CB 3.94Å; I716-A727 CarbonylContact C-O 3.52Å; I716-A727 WeakPolarHBondContact CA-O 3.45Å; D717-A727 PolarHBondContact N-O 3.35Å; D717-A727 PolarHBondContact O-N 2.99Å; Y720-A727 HydrophobicContact CD1-CB 3.87Å; Y720-A727 HydrophobicContact CD2-CB 3.69Å; Y720-A727 HydrophobicContact CE1-CB 4.43Å; Y720-A727 HydrophobicContact CE2-CB 4.28Å; Y720-A727 HydrophobicContact CG-CB 3.45Å; Y720-A727 VanDerWaalsContact CG-CB 3.45Å; A727-L729 HydrophobicContact CB-CD2 4.33Å
728	V	93.2	Very high	89.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.7	166	-176	0	0	0	0	107.8	L636 V681 W689 L692 L730	L636-V728 HydrophobicContact CD1-CG1 4.4Å; L636-V728 HydrophobicContact CD2-CG1 4.2Å; L636-V728 HydrophobicContact CD2-CG2 4.19Å; V681-V728 PolarHBondContact N-O 3.41Å; V681-V728 PolarHBondContact O-N 3.06Å; W689-V728 HydrophobicContact CH2-CG2 3.72Å; W689-V728 HydrophobicContact CZ2-CG2 3.83Å; L692-V728 HydrophobicContact CD2-CB 3.86Å; L692-V728 HydrophobicContact CD2-CG1 4.41Å; L692-V728 HydrophobicContact CD2-CG2 3.68Å; V728-L730 HydrophobicContact CG1-CD2 3.88Å; V728-L730 HydrophobicContact CG1-CG 4.49Å
729	L	93.9	Very high	89.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.4	177.1	-49.1	178.4	0	0	0	108.4	P650 L678 K679 S714 V715 D717 A727	P650-L729 HydrophobicContact CG-CD1 4.2Å; L678-L729 HydrophobicContact CD1-CB 3.91Å; L678-L729 HydrophobicContact CD2-CB 4.5Å; L678-L729 HydrophobicContact CD2-CD1 4.37Å; L678-L729 HydrophobicContact CD2-CD2 4.44Å; L678-L729 HydrophobicContact CG-CB 4.3Å; K679-L729 CarbonylContact O-C 3.56Å; K679-L729 WeakPolarHBondContact O-CA 3.48Å; S714-L729 CarbonylContact C-O 3.24Å; S714-L729 VanDerWaalsContact CA-O 3.27Å; S714-L729 WeakPolarHBondContact CA-O 3.4Å; V715-L729 HydrophobicContact CB-CB 4.34Å; V715-L729 HydrophobicContact CB-CD1 4.49Å; V715-L729 HydrophobicContact CG1-CD1 4.36Å; V715-L729 PolarHBondContact N-O 3Å; V715-L729 WeakPolarHBondContact O-CA 3.35Å; V715-L729 VanDerWaalsContact O-CB 3.24Å; V715-L729 WeakPolarHBondContact O-CB 3.38Å; V715-L729 WeakPolarHBondContact O-CG 3.47Å; V715-L729 PolarHBondContact O-N 3Å; D717-L729 HydrophobicContact CB-CD1 4.01Å; D717-L729 HydrophobicContact CB-CG 4.21Å; A727-L729 HydrophobicContact CB-CD2 4.33Å
730	L	93.2	Very high	89.6	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.052	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	120.5	176.4	-55.9	178.4	0	0	0	109.1	L678 K679 V681 F696 L711 V728	L678-L730 CarbonylContact C-O 3.49Å; L678-L730 WeakPolarHBondContact CA-O 3.3Å; K679-L730 HydrophobicContact CB-CB 4.35Å; K679-L730 PolarHBondContact N-O 3.46Å; K679-L730 PolarHBondContact O-N 3.3Å; V681-L730 HydrophobicContact CG2-CD1 4.41Å; F696-L730 HydrophobicContact CD2-CD2 3.7Å; F696-L730 HydrophobicContact CE2-CD2 4.12Å; L711-L730 HydrophobicContact CD1-CB 4.2Å; V728-L730 HydrophobicContact CG1-CD2 3.88Å; V728-L730 HydrophobicContact CG1-CG 4.49Å
731	I	94.2	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.7	179	-55.7	77.4	0	0	0	107.6	P650 W670 C676 L678 H712 G713 V715	P650-I731 HydrophobicContact CB-CG1 4.45Å; P650-I731 HydrophobicContact CG-CD1 4.28Å; P650-I731 HydrophobicContact CG-CG1 4.22Å; W670-I731 HydrophobicContact CB-CG2 4.24Å; W670-I731 HydrophobicContact CD2-CB 4.38Å; W670-I731 HydrophobicContact CD2-CD1 4.46Å; W670-I731 HydrophobicContact CD2-CG1 3.85Å; W670-I731 HydrophobicContact CD2-CG2 4.09Å; W670-I731 HydrophobicContact CE3-CB 3.95Å; W670-I731 HydrophobicContact CE3-CG1 3.89Å; W670-I731 HydrophobicContact CE3-CG2 3.67Å; W670-I731 HydrophobicContact CG-CG1 4.35Å; W670-I731 HydrophobicContact CG-CG2 4.37Å; W670-I731 HydrophobicContact CH2-CD1 4.15Å; W670-I731 HydrophobicContact CH2-CG1 4.4Å; W670-I731 HydrophobicContact CZ2-CD1 4.11Å; W670-I731 HydrophobicContact CZ2-CG1 4.39Å; W670-I731 HydrophobicContact CZ3-CB 4.17Å; W670-I731 HydrophobicContact CZ3-CD1 4.36Å; W670-I731 HydrophobicContact CZ3-CG1 4.17Å; W670-I731 HydrophobicContact CZ3-CG2 4.33Å; C676-I731 HydrophobicContact CB-CG2 4.18Å; L678-I731 HydrophobicContact CD1-CD1 4.09Å; L678-I731 HydrophobicContact CD1-CG1 3.65Å; H712-I731 HydrophobicContact CB-CB 4.46Å; H712-I731 HydrophobicContact CB-CG2 4.13Å; H712-I731 PolarHBondContact N-O 3.45Å; G713-I731 PolarHBondContact N-O 2.89Å; G713-I731 WeakPolarHBondContact O-CD1 3.09Å; G713-I731 PolarHBondContact O-N 2.87Å; V715-I731 HydrophobicContact CG2-CD1 4.1Å
732	M	93.2	Very high	90.5	Very high	14 Å²	14	42.2 Å²	42.2	7%	0.069	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	163.2	-174.3	-59.7	175.2	-66.1	0	0	110.7	C676 A677 K679 V709 D710 L711	C676-M732 CarbonylContact C-O 3.59Å; C676-M732 WeakPolarHBondContact CA-O 3.27Å; A677-M732 PolarHBondContact N-O 3.47Å; A677-M732 PolarHBondContact O-N 2.97Å; K679-M732 HydrophobicContact CB-CE 3.45Å; K679-M732 VanDerWaalsContact CB-CE 3.45Å; K679-M732 HydrophobicContact CD-CE 4.27Å; K679-M732 HydrophobicContact CG-CE 4.49Å; V709-M732 HydrophobicContact CG1-CB 4.05Å; D710-M732 CarbonylContact O-C 3.57Å; D710-M732 VanDerWaalsContact O-CA 3.27Å; D710-M732 WeakPolarHBondContact O-CA 3.3Å; L711-M732 HydrophobicContact CD1-CG 3.85Å
733	E	92.5	Very high	91	Very high	29 Å²	29	40.7 Å²	40.7	14%	0.136	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	144.1	168.9	67.9	174.5	147.4	0	0	111	V709 D710 K790	V709-E733 WeakPolarHBondContact CA-OE1 3.16Å; V709-E733 HydrophobicContact CB-CG 4.41Å; V709-E733 HydrophobicContact CG1-CG 3.71Å; D710-E733 HydrophobicContact CB-CB 4.22Å; D710-E733 HydrophobicContact CB-CG 4.04Å; D710-E733 PolarHBondContact N-OE1 3.15Å; D710-E733 PolarHBondContact O-N 3.24Å; E733-K790 WeakPolarHBondContact OE1-CD 3.18Å; E733-K790 IonicContact OE1-NZ 2.88Å; E733-K790 PolarHBondContact OE1-NZ 2.66Å; E733-K790 IonicContact OE2-NZ 2.84Å; E733-K790 PolarHBondContact OE2-NZ 3.2Å
734	R	93.3	Very high	91.6	Very high	85 Å²	85	45.6 Å²	45.6	32%	0.321	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-97.6	125.2	175.8	-166.3	177.4	74.6	81.8	-7.5	111.6	L666 P675 A677	L666-R734 VanDerWaalsContact CD1-CD 3.49Å; P675-R734 HydrophobicContact CB-CB 4.1Å; P675-R734 HydrophobicContact CG-CB 4.17Å; P675-R734 WeakPolarHBondContact O-CB 3.45Å; P675-R734 PolarHBondContact O-N 3.18Å; P675-R734 VanDerWaalsContact O-N 3.08Å; A677-R734 HydrophobicContact CB-CB 4.21Å; A677-R734 HydrophobicContact CB-CG 4.26Å
735	L	93.8	Very high	92.3	Very high	25 Å²	25	44 Å²	44	13%	0.131	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-99.9	172	170.4	-67.9	-169.5	0	0	0	112.7	V709 L782 L783 D784 K790	V709-L735 HydrophobicContact CG2-CD1 4.31Å; L735-L782 HydrophobicContact CB-CB 3.92Å; L735-L782 HydrophobicContact CB-CD1 4.36Å; L735-L782 HydrophobicContact CD1-CB 3.43Å; L735-L782 VanDerWaalsContact CD1-CB 3.43Å; L735-L782 HydrophobicContact CG-CB 4.2Å; L735-L783 WeakPolarHBondContact CB-O 3.36Å; L735-D784 HydrophobicContact CD2-CB 3.91Å; L735-K790 HydrophobicContact CD1-CB 3.71Å; L735-K790 HydrophobicContact CD1-CD 3.95Å; L735-K790 HydrophobicContact CD1-CG 3.87Å
736	H	93.4	Very high	92.6	Very high	97 Å²	97	44.1 Å²	44.1	45%	0.449	23%	0.232	S	C	.	.	S	Bend	trans	-73.9	-45.1	-170.8	179.2	54.4	0	0	0	112.3	L783 K785	H736-L783 WeakPolarHBondContact CA-O 3.49Å; H736-L783 WeakPolarHBondContact CB-O 3.5Å; H736-L783 PolarHBondContact N-O 2.75Å; H736-K785 HydrophobicContact CB-CG 4.34Å
737	R	92.4	Very high	92.7	Very high	68 Å²	68	42.4 Å²	42.4	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	165.5	-177.2	59.4	-171.2	170.2	-147.1	9.6	111.8	T741 L782 L783 N787	R737-T741 HydrophobicContact CB-CG2 4.43Å; R737-L782 CarbonylContact O-C 3.56Å; R737-L783 HydrophobicContact CG-CB 4.17Å; R737-L783 HydrophobicContact CG-CD1 4.45Å; R737-L783 PolarHBondContact N-O 2.84Å; R737-L783 PolarHBondContact O-N 2.8Å; R737-N787 PolarHBondContact NH2-OD1 2.94Å
738	D	93.5	Very high	92.7	Very high	43 Å²	43	46.2 Å²	46.2	23%	0.23	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	160.6	165.6	62	59.5	0	0	0	112.3	Y740 T741 G742 V781 L782	D738-Y740 VanDerWaalsContact C-N 3.29Å; D738-Y740 PolarHBondContact O-N 3.46Å; D738-Y740 WeakPolarHBondContact OD1-CB 3.37Å; D738-Y740 PolarHBondContact OD1-N 3.01Å; D738-T741 PolarHBondContact O-N 2.77Å; D738-T741 VanDerWaalsContact OD1-CB 3.32Å; D738-T741 WeakPolarHBondContact OD1-CB 3.23Å; D738-T741 PolarHBondContact OD1-N 2.72Å; D738-T741 PolarHBondContact OD1-OG1 3.27Å; D738-T741 PolarHBondContact OD2-OG1 2.94Å; D738-G742 PolarHBondContact O-N 2.84Å; D738-V781 CarbonylContact C-O 3.53Å; D738-V781 WeakPolarHBondContact CA-O 3.43Å; D738-L782 HydrophobicContact CB-CD2 3.92Å
739	L	94.6	Very high	92.4	Very high	17 Å²	17	48.1 Å²	48.1	9%	0.089	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-33.2	-178.8	175.3	59.8	0	0	0	112.1	T741 G742 L743 L747 I755 L778 V781 L783	L739-T741 VanDerWaalsContact C-N 3.33Å; L739-T741 PolarHBondContact O-N 2.97Å; L739-G742 PolarHBondContact O-N 2.81Å; L739-L743 HydrophobicContact CD1-CD1 4.35Å; L739-L743 HydrophobicContact CD1-CG 4.03Å; L739-L743 HydrophobicContact CG-CD1 4.13Å; L739-L743 HydrophobicContact CG-CG 4.31Å; L739-L743 WeakPolarHBondContact O-CG 3.4Å; L739-L743 PolarHBondContact O-N 3.02Å; L739-L747 HydrophobicContact CD1-CD1 3.92Å; L739-I755 HydrophobicContact CD1-CD1 3.9Å; L739-I755 HydrophobicContact CD1-CG2 3.89Å; L739-I755 HydrophobicContact CD2-CG2 3.92Å; L739-L778 WeakPolarHBondContact CB-O 3.48Å; L739-L778 HydrophobicContact CD2-CD2 3.64Å; L739-L778 HydrophobicContact CG-CD2 4.03Å; L739-L778 PolarHBondContact N-O 2.75Å; L739-V781 HydrophobicContact CB-CB 3.9Å; L739-V781 HydrophobicContact CB-CG1 4.05Å; L739-V781 WeakPolarHBondContact CB-O 3.31Å; L739-V781 HydrophobicContact CD2-CB 4.03Å; L739-V781 HydrophobicContact CD2-CG1 3.99Å; L739-V781 HydrophobicContact CD2-CG2 4.47Å; L739-V781 PolarHBondContact N-O 3.49Å; L739-L783 HydrophobicContact CD1-CD1 4.12Å; L739-L783 HydrophobicContact CD1-CD2 4.46Å
740	Y	91.8	Very high	92.2	Very high	99 Å²	99	53.6 Å²	53.6	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-59.3	-45.9	175.9	177	-95.6	0	0	0	111.5	D738 L743 K744 L778	D738-Y740 VanDerWaalsContact C-N 3.29Å; D738-Y740 PolarHBondContact O-N 3.46Å; D738-Y740 WeakPolarHBondContact OD1-CB 3.37Å; D738-Y740 PolarHBondContact OD1-N 3.01Å; Y740-L743 PolarHBondContact O-N 2.85Å; Y740-K744 HydrophobicContact CE1-CD 3.93Å; Y740-K744 PolarHBondContact O-N 2.92Å; Y740-K744 VanDerWaalsContact O-N 3.13Å; Y740-K744 WeakPolarHBondContact OH-CE 3.27Å; Y740-K744 PolarHBondContact OH-NZ 2.88Å; Y740-L778 HydrophobicContact CD2-CD1 4.22Å; Y740-L778 PolarHBondContact N-O 3.23Å
741	T	91.9	Very high	92.2	Very high	64 Å²	64	54.7 Å²	54.7	39%	0.393	29%	0.287	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.2	-56	0	0	0	0	111	R737 D738 L739 K744 A745	R737-T741 HydrophobicContact CB-CG2 4.43Å; D738-T741 PolarHBondContact O-N 2.77Å; D738-T741 VanDerWaalsContact OD1-CB 3.32Å; D738-T741 WeakPolarHBondContact OD1-CB 3.23Å; D738-T741 PolarHBondContact OD1-N 2.72Å; D738-T741 PolarHBondContact OD1-OG1 3.27Å; D738-T741 PolarHBondContact OD2-OG1 2.94Å; L739-T741 VanDerWaalsContact C-N 3.33Å; L739-T741 PolarHBondContact O-N 2.97Å; T741-K744 PolarHBondContact O-N 2.81Å; T741-A745 WeakPolarHBondContact O-CB 3.28Å; T741-A745 PolarHBondContact O-N 3.42Å
742	G	93.5	Very high	92.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-56.9	-50.6	172.7	0	0	0	0	0	112.3	D738 L739 K744 A745 G746 L747	D738-G742 PolarHBondContact O-N 2.84Å; L739-G742 PolarHBondContact O-N 2.81Å; G742-K744 VanDerWaalsContact C-N 3.32Å; G742-K744 PolarHBondContact O-N 3.03Å; G742-A745 CarbonylContact O-C 3.29Å; G742-A745 WeakPolarHBondContact O-CA 3.45Å; G742-A745 WeakPolarHBondContact O-CB 3.41Å; G742-A745 PolarHBondContact O-N 3.35Å; G742-G746 PolarHBondContact O-N 3.09Å; G742-L747 WeakPolarHBondContact O-CG 3.13Å
743	L	90.4	Very high	92	Very high	51 Å²	51	58.7 Å²	58.7	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-41.2	179	-72.3	169.8	0	0	0	112.1	L739 Y740 A745 G746 L747 R752 L778	L739-L743 HydrophobicContact CD1-CD1 4.35Å; L739-L743 HydrophobicContact CD1-CG 4.03Å; L739-L743 HydrophobicContact CG-CD1 4.13Å; L739-L743 HydrophobicContact CG-CG 4.31Å; L739-L743 WeakPolarHBondContact O-CG 3.4Å; L739-L743 PolarHBondContact O-N 3.02Å; Y740-L743 PolarHBondContact O-N 2.85Å; L743-A745 VanDerWaalsContact C-N 3.26Å; L743-A745 PolarHBondContact O-N 2.95Å; L743-G746 PolarHBondContact O-N 2.92Å; L743-G746 VanDerWaalsContact O-N 3.12Å; L743-L747 HydrophobicContact CD2-CD1 4.29Å; L743-L747 HydrophobicContact CG-CD1 4.45Å; L743-R752 HydrophobicContact CD2-CG 4.06Å; L743-L778 HydrophobicContact CD1-CD1 4.04Å; L743-L778 HydrophobicContact CD1-CD2 3.96Å
744	K	91.5	Very high	92.2	Very high	152 Å²	152	59.9 Å²	59.9	66%	0.661	31%	0.307	S	S	*	.	H	α-helix	trans	-63.1	-31.3	173.5	-80.1	-166.9	172.1	-179.8	0	113.5	Y740 T741 G742 G746	Y740-K744 HydrophobicContact CE1-CD 3.93Å; Y740-K744 PolarHBondContact O-N 2.92Å; Y740-K744 VanDerWaalsContact O-N 3.13Å; Y740-K744 WeakPolarHBondContact OH-CE 3.27Å; Y740-K744 PolarHBondContact OH-NZ 2.88Å; T741-K744 PolarHBondContact O-N 2.81Å; G742-K744 VanDerWaalsContact C-N 3.32Å; G742-K744 PolarHBondContact O-N 3.03Å; K744-G746 PolarHBondContact O-N 2.92Å
745	A	91.8	Very high	92.3	Very high	69 Å²	69	56.1 Å²	56.1	57%	0.57	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	2.3	176	0	0	0	0	0	113.6	T741 G742 L743	T741-A745 WeakPolarHBondContact O-CB 3.28Å; T741-A745 PolarHBondContact O-N 3.42Å; G742-A745 CarbonylContact O-C 3.29Å; G742-A745 WeakPolarHBondContact O-CA 3.45Å; G742-A745 WeakPolarHBondContact O-CB 3.41Å; G742-A745 PolarHBondContact O-N 3.35Å; L743-A745 VanDerWaalsContact C-N 3.26Å; L743-A745 PolarHBondContact O-N 2.95Å
746	G	91.4	Very high	92.4	Very high	54 Å²	54	56.6 Å²	56.6	56%	0.557	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	48.4	172	0	0	0	0	0	114.9	G742 L743 K744 T748	G742-G746 PolarHBondContact O-N 3.09Å; L743-G746 PolarHBondContact O-N 2.92Å; L743-G746 VanDerWaalsContact O-N 3.12Å; K744-G746 PolarHBondContact O-N 2.92Å; G746-T748 PolarHBondContact O-N 2.82Å
747	L	92.2	Very high	92.4	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	28%	0.282	C	S	.	.			trans	-57.6	134.7	172.2	-67.9	169.6	0	0	0	111.7	L739 G742 L743 T751 R752 I755 L783 N787	L739-L747 HydrophobicContact CD1-CD1 3.92Å; G742-L747 WeakPolarHBondContact O-CG 3.13Å; L743-L747 HydrophobicContact CD2-CD1 4.29Å; L743-L747 HydrophobicContact CG-CD1 4.45Å; L747-T751 HydrophobicContact CD2-CG2 3.86Å; L747-R752 HydrophobicContact CB-CG 4.06Å; L747-R752 PolarHBondContact O-NE 2.9Å; L747-R752 PolarHBondContact O-NH2 2.77Å; L747-I755 HydrophobicContact CD1-CD1 3.7Å; L747-L783 HydrophobicContact CD1-CD1 4.05Å; L747-N787 HydrophobicContact CD2-CB 4.33Å
748	T	90.9	Very high	92.7	Very high	81 Å²	81	49.2 Å²	49.2	50%	0.497	27%	0.27	S	S	.	.			trans	-66.2	161.6	175.3	68.2	0	0	0	0	111.3	G746 E750 T751 R752	G746-T748 PolarHBondContact O-N 2.82Å; T748-E750 PolarHBondContact O-N 3.25Å; T748-T751 PolarHBondContact O-N 2.83Å; T748-T751 PolarHBondContact OG1-N 3.19Å; T748-T751 PolarHBondContact OG1-OG1 3.07Å; T748-R752 VanDerWaalsContact O-CG 3.28Å; T748-R752 WeakPolarHBondContact O-CG 3.39Å; T748-R752 PolarHBondContact O-N 3.47Å
749	L	87.1	Confident	92.8	Very high	39 Å²	39	48.1 Å²	48.1	20%	0.204	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-47.1	177.2	-179.1	70.4	0	0	0	111.8	T751 R752 L753 V829 F830 L866	L749-T751 VanDerWaalsContact C-N 3.32Å; L749-T751 PolarHBondContact O-N 3.4Å; L749-R752 WeakPolarHBondContact O-CB 3.28Å; L749-R752 PolarHBondContact O-N 2.82Å; L749-R752 VanDerWaalsContact O-N 3.09Å; L749-L753 HydrophobicContact CD1-CD1 4.44Å; L749-L753 HydrophobicContact CD1-CG 4.46Å; L749-L753 HydrophobicContact CD2-CD1 4.41Å; L749-L753 HydrophobicContact CG-CD1 4.02Å; L749-L753 HydrophobicContact CG-CG 4.41Å; L749-L753 WeakPolarHBondContact O-CG 3.1Å; L749-L753 PolarHBondContact O-N 3.29Å; L749-V829 HydrophobicContact CB-CG2 4.16Å; L749-V829 HydrophobicContact CD1-CG1 4.15Å; L749-V829 HydrophobicContact CD1-CG2 3.98Å; L749-V829 HydrophobicContact CD2-CG2 3.47Å; L749-V829 VanDerWaalsContact CD2-CG2 3.47Å; L749-V829 HydrophobicContact CG-CG2 4.05Å; L749-F830 HydrophobicContact CD1-CD1 4.11Å; L749-F830 HydrophobicContact CD1-CE1 3.66Å; L749-L866 HydrophobicContact CD2-CB 4.26Å; L749-L866 HydrophobicContact CD2-CD1 3.99Å
750	E	89.8	Confident	92.8	Very high	115 Å²	115	47.9 Å²	47.9	54%	0.537	26%	0.264	S	S	.	.	H	α-helix	trans	-53.6	-49.6	177.3	176.4	178.2	-172.5	0	0	111.2	T748 R752 L753 Q754	T748-E750 PolarHBondContact O-N 3.25Å; E750-R752 VanDerWaalsContact C-N 3.33Å; E750-R752 PolarHBondContact O-N 2.93Å; E750-L753 PolarHBondContact O-N 3.02Å; E750-Q754 PolarHBondContact O-N 3.31Å
751	T	93.4	Very high	93	Very high	33 Å²	33	45.9 Å²	45.9	20%	0.202	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-36.5	178.5	-53.2	0	0	0	0	112.1	L747 T748 L749 Q754 I755 N787	L747-T751 HydrophobicContact CD2-CG2 3.86Å; T748-T751 PolarHBondContact O-N 2.83Å; T748-T751 PolarHBondContact OG1-N 3.19Å; T748-T751 PolarHBondContact OG1-OG1 3.07Å; L749-T751 VanDerWaalsContact C-N 3.32Å; L749-T751 PolarHBondContact O-N 3.4Å; T751-Q754 PolarHBondContact O-N 3.02Å; T751-I755 HydrophobicContact CG2-CD1 3.89Å; T751-I755 HydrophobicContact CG2-CG1 4.45Å; T751-I755 WeakPolarHBondContact O-CB 3.49Å; T751-I755 WeakPolarHBondContact O-CD1 3.45Å; T751-I755 WeakPolarHBondContact O-CG1 3.45Å; T751-I755 PolarHBondContact O-N 3.46Å; T751-N787 HydrophobicContact CG2-CB 3.48Å; T751-N787 VanDerWaalsContact CG2-CB 3.48Å
752	R	92.1	Very high	93.1	Very high	89 Å²	89	42.8 Å²	42.8	34%	0.336	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-41.7	175.1	-68.9	172.2	-167	-151.5	1.3	112	L743 L747 T748 L749 E750 I755 A756	L743-R752 HydrophobicContact CD2-CG 4.06Å; L747-R752 HydrophobicContact CB-CG 4.06Å; L747-R752 PolarHBondContact O-NE 2.9Å; L747-R752 PolarHBondContact O-NH2 2.77Å; T748-R752 VanDerWaalsContact O-CG 3.28Å; T748-R752 WeakPolarHBondContact O-CG 3.39Å; T748-R752 PolarHBondContact O-N 3.47Å; L749-R752 WeakPolarHBondContact O-CB 3.28Å; L749-R752 PolarHBondContact O-N 2.82Å; L749-R752 VanDerWaalsContact O-N 3.09Å; E750-R752 VanDerWaalsContact C-N 3.33Å; E750-R752 PolarHBondContact O-N 2.93Å; R752-I755 PolarHBondContact O-N 2.97Å; R752-A756 PolarHBondContact O-N 2.76Å
753	L	91.6	Very high	93	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-66.6	-41.3	176.6	-69.5	171.8	0	0	0	111.2	L749 E750 I755 A756 L757 L859 I862 M863 L866	L749-L753 HydrophobicContact CD1-CD1 4.44Å; L749-L753 HydrophobicContact CD1-CG 4.46Å; L749-L753 HydrophobicContact CD2-CD1 4.41Å; L749-L753 HydrophobicContact CG-CD1 4.02Å; L749-L753 HydrophobicContact CG-CG 4.41Å; L749-L753 WeakPolarHBondContact O-CG 3.1Å; L749-L753 PolarHBondContact O-N 3.29Å; E750-L753 PolarHBondContact O-N 3.02Å; L753-I755 PolarHBondContact O-N 3.08Å; L753-A756 WeakPolarHBondContact O-CB 3.36Å; L753-A756 PolarHBondContact O-N 2.94Å; L753-L757 PolarHBondContact O-N 3.34Å; L753-L859 HydrophobicContact CD2-CD2 4.41Å; L753-I862 HydrophobicContact CD1-CG2 4.47Å; L753-I862 HydrophobicContact CD2-CG2 4.4Å; L753-M863 HydrophobicContact CB-CB 4.18Å; L753-M863 HydrophobicContact CB-CG 3.97Å; L753-M863 HydrophobicContact CB-SD 4.16Å; L753-M863 HydrophobicContact CD1-CB 4.22Å; L753-M863 HydrophobicContact CD1-CG 4.33Å; L753-L866 HydrophobicContact CD1-CD1 4.12Å
754	Q	95.8	Very high	93	Very high	54 Å²	54	46.6 Å²	46.6	25%	0.252	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-43.2	173.6	-175	58.6	64.6	0	0	111.9	E750 T751 A756 L757 D758 M863	E750-Q754 PolarHBondContact O-N 3.31Å; T751-Q754 PolarHBondContact O-N 3.02Å; Q754-A756 VanDerWaalsContact C-N 3.33Å; Q754-A756 PolarHBondContact O-N 3.01Å; Q754-L757 WeakPolarHBondContact O-CB 3.27Å; Q754-L757 PolarHBondContact O-N 3.13Å; Q754-D758 PolarHBondContact NE2-OD1 3.01Å; Q754-D758 WeakPolarHBondContact O-CB 3.25Å; Q754-D758 PolarHBondContact O-N 3.08Å; Q754-M863 HydrophobicContact CB-SD 4.33Å
755	I	96.5	Very high	92.9	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-41.3	174.6	-73.1	162.9	0	0	0	111.1	L739 L747 T751 R752 L753 L757 D758 V759 V781 L783 N787 A789	L739-I755 HydrophobicContact CD1-CD1 3.9Å; L739-I755 HydrophobicContact CD1-CG2 3.89Å; L739-I755 HydrophobicContact CD2-CG2 3.92Å; L747-I755 HydrophobicContact CD1-CD1 3.7Å; T751-I755 HydrophobicContact CG2-CD1 3.89Å; T751-I755 HydrophobicContact CG2-CG1 4.45Å; T751-I755 WeakPolarHBondContact O-CB 3.49Å; T751-I755 WeakPolarHBondContact O-CD1 3.45Å; T751-I755 WeakPolarHBondContact O-CG1 3.45Å; T751-I755 PolarHBondContact O-N 3.46Å; R752-I755 PolarHBondContact O-N 2.97Å; L753-I755 PolarHBondContact O-N 3.08Å; I755-L757 VanDerWaalsContact C-N 3.33Å; I755-L757 PolarHBondContact O-N 3.02Å; I755-D758 WeakPolarHBondContact O-CB 3.2Å; I755-D758 PolarHBondContact O-N 2.6Å; I755-V759 HydrophobicContact CG2-CG2 4.47Å; I755-V759 VanDerWaalsContact O-CG2 3.31Å; I755-V759 WeakPolarHBondContact O-CG2 3.37Å; I755-V759 PolarHBondContact O-N 2.85Å; I755-V781 HydrophobicContact CG2-CG1 4.48Å; I755-L783 HydrophobicContact CD1-CD1 4.06Å; I755-L783 HydrophobicContact CD1-CD2 3.72Å; I755-L783 HydrophobicContact CG1-CD2 3.84Å; I755-L783 HydrophobicContact CG2-CD2 4.46Å; I755-N787 WeakPolarHBondContact CG1-O 3.39Å; I755-A789 HydrophobicContact CB-CB 4.32Å; I755-A789 HydrophobicContact CG1-CB 4.27Å; I755-A789 HydrophobicContact CG2-CB 3.9Å
756	A	94	Very high	92.7	Very high	35 Å²	35	37.4 Å²	37.4	29%	0.289	20%	0.2	S	C	.	.	H	α-helix	trans	-62.5	-41	176.5	0	0	0	0	0	111.7	R752 L753 Q754 V759 V760 L859	R752-A756 PolarHBondContact O-N 2.76Å; L753-A756 WeakPolarHBondContact O-CB 3.36Å; L753-A756 PolarHBondContact O-N 2.94Å; Q754-A756 VanDerWaalsContact C-N 3.33Å; Q754-A756 PolarHBondContact O-N 3.01Å; A756-V759 PolarHBondContact O-N 3.32Å; A756-V760 WeakPolarHBondContact O-CG2 3.47Å; A756-V760 PolarHBondContact O-N 2.89Å; A756-L859 HydrophobicContact CB-CD1 4.41Å; A756-L859 HydrophobicContact CB-CD2 4.44Å
757	L	95.3	Very high	92.3	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-44.9	173.9	-75.4	172	0	0	0	112.4	L753 Q754 I755 V759 V760 E761 Q856 L859 R860 M863	L753-L757 PolarHBondContact O-N 3.34Å; Q754-L757 WeakPolarHBondContact O-CB 3.27Å; Q754-L757 PolarHBondContact O-N 3.13Å; I755-L757 VanDerWaalsContact C-N 3.33Å; I755-L757 PolarHBondContact O-N 3.02Å; L757-V759 VanDerWaalsContact C-N 3.34Å; L757-V759 PolarHBondContact O-N 3.49Å; L757-V760 PolarHBondContact O-N 3.28Å; L757-E761 WeakPolarHBondContact O-CB 3.47Å; L757-E761 PolarHBondContact O-N 3.29Å; L757-Q856 HydrophobicContact CD2-CG 4.05Å; L757-L859 HydrophobicContact CD2-CB 3.54Å; L757-L859 HydrophobicContact CD2-CD1 4.47Å; L757-L859 HydrophobicContact CG-CB 4.18Å; L757-R860 HydrophobicContact CD1-CG 3.89Å; L757-R860 HydrophobicContact CD2-CG 3.55Å; L757-R860 HydrophobicContact CG-CG 4.4Å; L757-M863 HydrophobicContact CD1-CE 3.5Å; L757-M863 HydrophobicContact CD1-SD 3.61Å
758	D	97.4	Very high	91.8	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-43.3	177.3	-73.5	-0.7	0	0	0	111.3	R707 Q754 I755 E761 G762 R788 A789	R707-D758 WeakPolarHBondContact CB-O 3.41Å; R707-D758 WeakPolarHBondContact CG-O 3.45Å; R707-D758 IonicContact CZ-OD1 2.69Å; R707-D758 IonicContact NE-OD1 3.17Å; R707-D758 PolarHBondContact NE-OD1 2.95Å; Q754-D758 PolarHBondContact NE2-OD1 3.01Å; Q754-D758 WeakPolarHBondContact O-CB 3.25Å; Q754-D758 PolarHBondContact O-N 3.08Å; I755-D758 WeakPolarHBondContact O-CB 3.2Å; I755-D758 PolarHBondContact O-N 2.6Å; D758-E761 PolarHBondContact O-N 3.29Å; D758-G762 PolarHBondContact O-N 3.48Å; D758-R788 IonicContact OD1-CZ 3.15Å; D758-R788 IonicContact OD1-NE 3.74Å; D758-R788 PolarHBondContact OD1-NE 3.36Å; D758-R788 IonicContact OD1-NH2 2.68Å; D758-R788 PolarHBondContact OD1-NH2 3.39Å; D758-R788 WeakPolarHBondContact OD2-CA 3.47Å; D758-R788 IonicContact OD2-CZ 3.72Å; D758-R788 IonicContact OD2-NE 2.98Å; D758-R788 PolarHBondContact OD2-NE 3.29Å; D758-R788 IonicContact OD2-NH2 2.79Å; D758-A789 HydrophobicContact CB-CB 3.66Å; D758-A789 PolarHBondContact OD2-N 3.47Å
759	V	96.3	Very high	91.4	Very high	20 Å²	20	42.4 Å²	42.4	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-46.4	176.1	171	0	0	0	0	111.1	I755 A756 L757 E761 G762 I763 V781 A789 I791	I755-V759 HydrophobicContact CG2-CG2 4.47Å; I755-V759 VanDerWaalsContact O-CG2 3.31Å; I755-V759 WeakPolarHBondContact O-CG2 3.37Å; I755-V759 PolarHBondContact O-N 2.85Å; A756-V759 PolarHBondContact O-N 3.32Å; L757-V759 VanDerWaalsContact C-N 3.34Å; L757-V759 PolarHBondContact O-N 3.49Å; V759-E761 VanDerWaalsContact C-N 3.29Å; V759-E761 PolarHBondContact O-N 3.17Å; V759-G762 PolarHBondContact O-N 2.96Å; V759-I763 HydrophobicContact CG1-CD1 3.78Å; V759-I763 HydrophobicContact CG1-CG1 4.34Å; V759-I763 WeakPolarHBondContact O-CG1 3.36Å; V759-I763 PolarHBondContact O-N 2.83Å; V759-V781 HydrophobicContact CG2-CG1 3.78Å; V759-V781 HydrophobicContact CG2-CG2 3.89Å; V759-A789 HydrophobicContact CG2-CB 4.26Å; V759-I791 HydrophobicContact CG1-CD1 4.41Å
760	V	94.3	Very high	90.7	Very high	13 Å²	13	41.5 Å²	41.5	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-41	177.6	168.1	0	0	0	0	111.1	A756 L757 I763 R764 L852 V855 Q856 L859	A756-V760 WeakPolarHBondContact O-CG2 3.47Å; A756-V760 PolarHBondContact O-N 2.89Å; L757-V760 PolarHBondContact O-N 3.28Å; V760-I763 PolarHBondContact O-N 3.29Å; V760-R764 HydrophobicContact CG1-CG 4.41Å; V760-R764 WeakPolarHBondContact O-CB 3.34Å; V760-R764 VanDerWaalsContact O-CG 3.27Å; V760-R764 WeakPolarHBondContact O-CG 3.22Å; V760-R764 PolarHBondContact O-N 3.37Å; V760-L852 HydrophobicContact CG1-CB 4.46Å; V760-L852 HydrophobicContact CG1-CD2 4.18Å; V760-L852 HydrophobicContact CG2-CD2 4.48Å; V760-V855 HydrophobicContact CG2-CG1 4.2Å; V760-Q856 HydrophobicContact CG1-CB 3.69Å; V760-Q856 HydrophobicContact CG1-CG 4.15Å; V760-L859 HydrophobicContact CG2-CD1 3.91Å
761	E	95.5	Very high	90.1	Very high	56 Å²	56	36.4 Å²	36.4	26%	0.262	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-45.4	174.9	-176.6	-176.3	-164.6	0	0	111.6	R707 L757 D758 V759 R764 F765	R707-E761 HydrophobicContact CG-CB 4.05Å; R707-E761 HydrophobicContact CG-CG 3.94Å; R707-E761 WeakPolarHBondContact CG-OE2 3.03Å; R707-E761 IonicContact CZ-OE2 2.95Å; R707-E761 IonicContact NE-OE2 3.56Å; R707-E761 PolarHBondContact NE-OE2 2.91Å; R707-E761 IonicContact NH2-OE2 3.68Å; L757-E761 WeakPolarHBondContact O-CB 3.47Å; L757-E761 PolarHBondContact O-N 3.29Å; D758-E761 PolarHBondContact O-N 3.29Å; V759-E761 VanDerWaalsContact C-N 3.29Å; V759-E761 PolarHBondContact O-N 3.17Å; E761-R764 PolarHBondContact O-N 2.81Å; E761-F765 PolarHBondContact O-N 2.8Å
762	G	94.6	Very high	89.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-42.8	175.2	0	0	0	0	0	113.9	D758 V759 F765 L766	D758-G762 PolarHBondContact O-N 3.48Å; V759-G762 PolarHBondContact O-N 2.96Å; G762-F765 PolarHBondContact O-N 2.86Å; G762-L766 PolarHBondContact O-N 3.09Å
763	I	91.4	Very high	89	Confident	28 Å²	28	32.5 Å²	32.5	14%	0.144	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-42.6	177.4	-61.7	168.7	0	0	0	110.6	V759 V760 F765 L766 H767 I776 I791 L852	V759-I763 HydrophobicContact CG1-CD1 3.78Å; V759-I763 HydrophobicContact CG1-CG1 4.34Å; V759-I763 WeakPolarHBondContact O-CG1 3.36Å; V759-I763 PolarHBondContact O-N 2.83Å; V760-I763 PolarHBondContact O-N 3.29Å; I763-F765 VanDerWaalsContact C-N 3.28Å; I763-F765 PolarHBondContact O-N 3.44Å; I763-L766 PolarHBondContact O-N 2.94Å; I763-H767 WeakPolarHBondContact CG2-NE2 3.26Å; I763-H767 PolarHBondContact O-CD2 3.04Å; I763-H767 PolarHBondContact O-N 3.33Å; I763-I776 HydrophobicContact CD1-CD1 4.48Å; I763-I776 HydrophobicContact CD1-CG1 4.29Å; I763-I776 HydrophobicContact CG1-CD1 4.33Å; I763-I791 HydrophobicContact CG1-CD1 3.82Å; I763-L852 HydrophobicContact CB-CD1 4.04Å; I763-L852 HydrophobicContact CG2-CD1 3.43Å; I763-L852 VanDerWaalsContact CG2-CD1 3.43Å
764	R	89.3	Confident	88.2	Confident	102 Å²	102	34.5 Å²	34.5	39%	0.385	18%	0.18	S	C	.	.	H	α-helix	trans	-58.1	-42.5	175.5	-78.8	-176.1	67	158.2	6.3	111.7	V760 E761 H767 S768 L852 Q856	V760-R764 HydrophobicContact CG1-CG 4.41Å; V760-R764 WeakPolarHBondContact O-CB 3.34Å; V760-R764 VanDerWaalsContact O-CG 3.27Å; V760-R764 WeakPolarHBondContact O-CG 3.22Å; V760-R764 PolarHBondContact O-N 3.37Å; E761-R764 PolarHBondContact O-N 2.81Å; R764-H767 PolarHBondContact O-N 3.29Å; R764-S768 PolarHBondContact O-N 2.85Å; R764-L852 HydrophobicContact CG-CB 3.51Å; R764-L852 HydrophobicContact CG-CD1 3.94Å; R764-L852 HydrophobicContact CG-CG 4.34Å; R764-Q856 VanDerWaalsContact CD-OE1 3.22Å
765	F	91.3	Very high	87.4	Confident	29 Å²	29	33.1 Å²	33.1	13%	0.127	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-50.6	175.6	174.1	-99.6	0	0	0	111.1	L702 P703 H705 L708 E761 G762 I763 H767 S768 Q769	L702-F765 HydrophobicContact CD2-CE1 4.22Å; P703-F765 HydrophobicContact CB-CE2 4.48Å; P703-F765 HydrophobicContact CB-CZ 4.03Å; P703-F765 HydrophobicContact CG-CZ 4.23Å; P703-F765 VanDerWaalsContact O-CZ 3.31Å; P703-F765 WeakPolarHBondContact O-CZ 3.46Å; H705-F765 HydrophobicContact CB-CD1 3.79Å; H705-F765 HydrophobicContact CB-CD2 4.34Å; H705-F765 HydrophobicContact CB-CE1 3.7Å; H705-F765 HydrophobicContact CB-CE2 4.26Å; H705-F765 HydrophobicContact CB-CG 4.11Å; H705-F765 HydrophobicContact CB-CZ 3.94Å; H705-F765 AromaticContact CD2-CD2 3.38Å; H705-F765 WeakPolarHBondContact CD2-CD2 3.31Å; H705-F765 AromaticContact CD2-CE2 3.92Å; H705-F765 AromaticContact CD2-CG 3.44Å; H705-F765 VanDerWaalsContact CD2-CG 3.44Å; H705-F765 WeakPolarHBondContact CD2-CG 3.42Å; H705-F765 AromaticContact CG-CD1 3.73Å; H705-F765 AromaticContact CG-CD2 3.92Å; H705-F765 AromaticContact CG-CG 3.61Å; H705-F765 AromaticContact NE2-CD2 3.98Å; H705-F765 AromaticContact NE2-CG 3.83Å; L708-F765 HydrophobicContact CD1-CD1 3.54Å; L708-F765 HydrophobicContact CD1-CE1 3.61Å; L708-F765 HydrophobicContact CG-CD1 4.2Å; E761-F765 PolarHBondContact O-N 2.8Å; G762-F765 PolarHBondContact O-N 2.86Å; I763-F765 VanDerWaalsContact C-N 3.28Å; I763-F765 PolarHBondContact O-N 3.44Å; F765-H767 VanDerWaalsContact C-N 3.32Å; F765-H767 PolarHBondContact O-N 3.47Å; F765-S768 WeakPolarHBondContact O-CB 3.42Å; F765-S768 PolarHBondContact O-N 2.89Å; F765-S768 PolarHBondContact O-OG 3.34Å; F765-Q769 HydrophobicContact CE1-CG 4.22Å; F765-Q769 HydrophobicContact CE2-CG 4.26Å; F765-Q769 HydrophobicContact CZ-CG 4.02Å; F765-Q769 WeakPolarHBondContact O-CG 3.38Å; F765-Q769 PolarHBondContact O-N 3.27Å
766	L	86.5	Confident	86.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.5	-45.7	176.4	-72.6	172.2	0	0	0	112.4	L702 L708 G762 I763 S768 Q769 G770 L771 H773 L794	L702-L766 HydrophobicContact CD1-CD2 3.74Å; L702-L766 HydrophobicContact CD2-CD2 4.49Å; L708-L766 HydrophobicContact CD1-CD2 3.71Å; L708-L766 HydrophobicContact CD1-CG 4.11Å; L708-L766 HydrophobicContact CD2-CD1 4.05Å; L708-L766 HydrophobicContact CD2-CD2 4.38Å; L708-L766 HydrophobicContact CD2-CG 4.08Å; G762-L766 PolarHBondContact O-N 3.09Å; I763-L766 PolarHBondContact O-N 2.94Å; L766-S768 VanDerWaalsContact C-N 3.3Å; L766-S768 PolarHBondContact O-N 2.84Å; L766-Q769 CarbonylContact O-C 3.54Å; L766-Q769 WeakPolarHBondContact O-CA 3.38Å; L766-Q769 WeakPolarHBondContact O-CB 3.48Å; L766-Q769 PolarHBondContact O-N 3.26Å; L766-G770 PolarHBondContact O-N 2.95Å; L766-L771 CarbonylContact C-O 3.56Å; L766-L771 VanDerWaalsContact C-O 3.24Å; L766-L771 PolarHBondContact O-N 3.48Å; L766-H773 HydrophobicContact CD1-CB 4.04Å; L766-L794 HydrophobicContact CD1-CD2 3.98Å; L766-L794 HydrophobicContact CD2-CD2 4.27Å
767	H	84.1	Confident	86.5	Confident	89 Å²	89	38.2 Å²	38.2	41%	0.412	19%	0.193	S	C	.	.	H	α-helix	trans	-63.8	-35.5	178.1	-71	-164.8	0	0	0	112	I763 R764 F765 Q769 G770 L771	I763-H767 WeakPolarHBondContact CG2-NE2 3.26Å; I763-H767 PolarHBondContact O-CD2 3.04Å; I763-H767 PolarHBondContact O-N 3.33Å; R764-H767 PolarHBondContact O-N 3.29Å; F765-H767 VanDerWaalsContact C-N 3.32Å; F765-H767 PolarHBondContact O-N 3.47Å; H767-Q769 PolarHBondContact O-N 2.96Å; H767-G770 PolarHBondContact O-N 3.36Å; H767-L771 PolarHBondContact CD2-O 3.48Å; H767-L771 PolarHBondContact N-O 3.02Å
768	S	81.3	Confident	86.2	Confident	82 Å²	82	41.5 Å²	41.5	57%	0.573	21%	0.21	S	C	*	.	H	α-helix	trans	-64.7	-24.6	174.5	79.8	0	0	0	0	113.1	R764 F765 L766 G770	R764-S768 PolarHBondContact O-N 2.85Å; F765-S768 WeakPolarHBondContact O-CB 3.42Å; F765-S768 PolarHBondContact O-N 2.89Å; F765-S768 PolarHBondContact O-OG 3.34Å; L766-S768 VanDerWaalsContact C-N 3.3Å; L766-S768 PolarHBondContact O-N 2.84Å; S768-G770 VanDerWaalsContact C-N 3.3Å
769	Q	81.2	Confident	85.7	Confident	82 Å²	82	47.9 Å²	47.9	38%	0.383	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7.6	173.5	-54.3	-56.5	-64.2	0	0	112.2	L702 F765 L766 H767 L771	L702-Q769 HydrophobicContact CD2-CB 3.72Å; L702-Q769 HydrophobicContact CD2-CG 3.64Å; F765-Q769 HydrophobicContact CE1-CG 4.22Å; F765-Q769 HydrophobicContact CE2-CG 4.26Å; F765-Q769 HydrophobicContact CZ-CG 4.02Å; F765-Q769 WeakPolarHBondContact O-CG 3.38Å; F765-Q769 PolarHBondContact O-N 3.27Å; L766-Q769 CarbonylContact O-C 3.54Å; L766-Q769 WeakPolarHBondContact O-CA 3.38Å; L766-Q769 WeakPolarHBondContact O-CB 3.48Å; L766-Q769 PolarHBondContact O-N 3.26Å; H767-Q769 PolarHBondContact O-N 2.96Å; Q769-L771 VanDerWaalsContact C-N 3.3Å; Q769-L771 PolarHBondContact O-N 3.32Å
770	G	73.7	Confident	85.5	Confident	20 Å²	20	47.4 Å²	47.4	21%	0.206	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	14.4	-179.7	0	0	0	0	0	114.8	L766 H767 S768 P799 E800	L766-G770 PolarHBondContact O-N 2.95Å; H767-G770 PolarHBondContact O-N 3.36Å; S768-G770 VanDerWaalsContact C-N 3.3Å; G770-P799 CarbonylContact O-C 3.56Å; G770-P799 VanDerWaalsContact O-CA 3.3Å; G770-P799 WeakPolarHBondContact O-CA 3.48Å; G770-E800 PolarHBondContact O-N 2.94Å
771	L	77.7	Confident	85.5	Confident	7 Å²	7	47 Å²	47	4%	0.037	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.3	-179	-63.3	-179	0	0	0	112	Y698 L702 L766 H767 Q769 P799	Y698-L771 HydrophobicContact CD1-CD2 4.24Å; Y698-L771 HydrophobicContact CG-CD2 4.35Å; L702-L771 HydrophobicContact CD1-CD1 4.04Å; L702-L771 HydrophobicContact CD2-CD1 3.85Å; L702-L771 HydrophobicContact CG-CD1 4.12Å; L766-L771 CarbonylContact C-O 3.56Å; L766-L771 VanDerWaalsContact C-O 3.24Å; L766-L771 PolarHBondContact O-N 3.48Å; H767-L771 PolarHBondContact CD2-O 3.48Å; H767-L771 PolarHBondContact N-O 3.02Å; Q769-L771 VanDerWaalsContact C-N 3.3Å; Q769-L771 PolarHBondContact O-N 3.32Å; L771-P799 HydrophobicContact CD2-CG 3.91Å
772	V	79.8	Confident	85.5	Confident	37 Å²	37	46 Å²	46	22%	0.224	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.2	171.5	-174	0	0	0	0	109.2	R774 C797 K798 E800 M803	V772-R774 HydrophobicContact CB-CG 4.22Å; V772-R774 HydrophobicContact CG1-CG 3.76Å; V772-C797 VanDerWaalsContact O-CA 3.27Å; V772-C797 WeakPolarHBondContact O-CA 3.43Å; V772-K798 PolarHBondContact N-O 3.32Å; V772-K798 PolarHBondContact O-N 3.25Å; V772-E800 HydrophobicContact CG2-CB 4.34Å; V772-M803 HydrophobicContact CG2-CE 4.29Å; V772-M803 HydrophobicContact CG2-SD 4.31Å
773	H	81.7	Confident	85.6	Confident	3 Å²	3	46 Å²	46	1%	0.014	23%	0.228	C	C	.	.			trans	-63.5	-42	-176.7	-172.7	-66.5	0	0	0	113.9	L766 D775 I776 I791 T792 D793 L794 F796	L766-H773 HydrophobicContact CD1-CB 4.04Å; H773-D775 PolarHBondContact CE1-O 3.39Å; H773-D775 VanDerWaalsContact CE1-O 3.27Å; H773-D775 VanDerWaalsContact ND1-C 3.31Å; H773-D775 PolarHBondContact ND1-N 2.88Å; H773-D775 VanDerWaalsContact ND1-N 3.14Å; H773-D775 PolarHBondContact O-N 3.24Å; H773-I776 HydrophobicContact CB-CD1 3.8Å; H773-I776 HydrophobicContact CB-CG1 3.96Å; H773-I791 WeakPolarHBondContact CD2-CG2 3.2Å; H773-I791 VanDerWaalsContact NE2-CG2 3.32Å; H773-I791 WeakPolarHBondContact NE2-CG2 3.33Å; H773-T792 PolarHBondContact NE2-O 2.97Å; H773-D793 PolarHBondContact CE1-O 3.05Å; H773-L794 VanDerWaalsContact CD2-CD2 3.42Å; H773-L794 WeakPolarHBondContact CD2-CD2 3.5Å; H773-F796 CarbonylContact O-C 3.26Å; H773-F796 WeakPolarHBondContact O-CB 3.48Å
774	R	75.4	Confident	85.8	Confident	51 Å²	51	46.4 Å²	46.4	19%	0.192	23%	0.231	C	C	.	.			trans	66.6	-40.8	-178.4	-56.6	-172.9	-65.6	151.9	12.4	115.3	V772 I776 F796 K798 H813	V772-R774 HydrophobicContact CB-CG 4.22Å; V772-R774 HydrophobicContact CG1-CG 3.76Å; R774-I776 PolarHBondContact O-N 3.47Å; R774-F796 HydrophobicContact CB-CB 4.16Å; R774-F796 PolarHBondContact NE-O 3.21Å; R774-F796 PolarHBondContact NH2-O 3.49Å; R774-K798 VanDerWaalsContact NH2-CG 3.34Å; R774-H813 VanDerWaalsContact C-CE1 3.43Å; R774-H813 WeakPolarHBondContact CB-CE1 3.28Å; R774-H813 PolarHBondContact O-CE1 2.94Å; R774-H813 PolarHBondContact O-ND1 2.82Å
775	D	78.9	Confident	86.1	Confident	25 Å²	25	49.6 Å²	49.6	13%	0.134	25%	0.247	C	C	.	.			trans	-101.4	49.7	179.8	-169.7	34.7	0	0	0	114.9	H773 K777 N780 F796	H773-D775 PolarHBondContact CE1-O 3.39Å; H773-D775 VanDerWaalsContact CE1-O 3.27Å; H773-D775 VanDerWaalsContact ND1-C 3.31Å; H773-D775 PolarHBondContact ND1-N 2.88Å; H773-D775 VanDerWaalsContact ND1-N 3.14Å; H773-D775 PolarHBondContact O-N 3.24Å; D775-K777 PolarHBondContact O-N 3.38Å; D775-K777 IonicContact OD1-NZ 3.08Å; D775-K777 PolarHBondContact OD1-NZ 3.21Å; D775-K777 WeakPolarHBondContact OD2-CE 3.32Å; D775-K777 IonicContact OD2-NZ 3.97Å; D775-K777 PolarHBondContact OD2-NZ 2.92Å; D775-N780 PolarHBondContact O-ND2 2.86Å; D775-N780 PolarHBondContact OD2-ND2 2.79Å; D775-F796 HydrophobicContact CB-CB 3.92Å; D775-F796 HydrophobicContact CB-CD2 3.41Å; D775-F796 VanDerWaalsContact CB-CD2 3.41Å; D775-F796 HydrophobicContact CB-CE2 4.18Å; D775-F796 HydrophobicContact CB-CG 3.81Å
776	I	85.3	Confident	86.2	Confident	69 Å²	69	54.9 Å²	54.9	35%	0.354	27%	0.272	S	S	.	.			trans	-76.6	117	176.8	-62	-66.6	0	0	0	109.8	I763 H773 R774 I791	I763-I776 HydrophobicContact CD1-CD1 4.48Å; I763-I776 HydrophobicContact CD1-CG1 4.29Å; I763-I776 HydrophobicContact CG1-CD1 4.33Å; H773-I776 HydrophobicContact CB-CD1 3.8Å; H773-I776 HydrophobicContact CB-CG1 3.96Å; R774-I776 PolarHBondContact O-N 3.47Å; I776-I791 HydrophobicContact CD1-CD1 4.18Å; I776-I791 HydrophobicContact CD1-CG2 3.71Å
777	K	85.6	Confident	86.7	Confident	80 Å²	80	56.4 Å²	56.4	35%	0.348	28%	0.281	S	S	.	.			trans	-152	164.3	177.6	63	-171.2	174	-138	0	111.4	D775 K779 N780 V781	D775-K777 PolarHBondContact O-N 3.38Å; D775-K777 IonicContact OD1-NZ 3.08Å; D775-K777 PolarHBondContact OD1-NZ 3.21Å; D775-K777 WeakPolarHBondContact OD2-CE 3.32Å; D775-K777 IonicContact OD2-NZ 3.97Å; D775-K777 PolarHBondContact OD2-NZ 2.92Å; K777-K779 HydrophobicContact CG-CB 4.49Å; K777-K779 PolarHBondContact O-N 3.47Å; K777-N780 WeakPolarHBondContact CE-ND2 3.42Å; K777-N780 WeakPolarHBondContact CE-OD1 3.39Å; K777-N780 HydrophobicContact CG-CB 4.06Å; K777-N780 PolarHBondContact O-N 2.97Å; K777-V781 PolarHBondContact O-N 3.14Å
778	L	89.4	Confident	87.3	Confident	77 Å²	77	55.7 Å²	55.7	40%	0.403	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-54.7	-30.2	-178.2	-58.7	178.7	0	0	0	114	L739 Y740 L743	L739-L778 WeakPolarHBondContact CB-O 3.48Å; L739-L778 HydrophobicContact CD2-CD2 3.64Å; L739-L778 HydrophobicContact CG-CD2 4.03Å; L739-L778 PolarHBondContact N-O 2.75Å; Y740-L778 HydrophobicContact CD2-CD1 4.22Å; Y740-L778 PolarHBondContact N-O 3.23Å; L743-L778 HydrophobicContact CD1-CD1 4.04Å; L743-L778 HydrophobicContact CD1-CD2 3.96Å
779	K	87.1	Confident	88.1	Confident	135 Å²	135	51.9 Å²	51.9	59%	0.587	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-78.6	-18.7	177.4	-67.5	-171.7	175.6	-174.8	0	114	K777	K777-K779 HydrophobicContact CG-CB 4.49Å; K777-K779 PolarHBondContact O-N 3.47Å
780	N	90.8	Very high	88.8	Confident	11 Å²	11	49.6 Å²	49.6	6%	0.059	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-100.5	5.8	179.5	-67.1	2	0	0	0	112.2	D775 K777 T792	D775-N780 PolarHBondContact O-ND2 2.86Å; D775-N780 PolarHBondContact OD2-ND2 2.79Å; K777-N780 WeakPolarHBondContact CE-ND2 3.42Å; K777-N780 WeakPolarHBondContact CE-OD1 3.39Å; K777-N780 HydrophobicContact CG-CB 4.06Å; K777-N780 PolarHBondContact O-N 2.97Å; N780-T792 HydrophobicContact CB-CG2 4.44Å; N780-T792 PolarHBondContact O-N 2.97Å
781	V	95.2	Very high	89.9	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.024	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.1	168.4	-179.8	0	0	0	0	107.1	D738 L739 I755 V759 K777 A789	D738-V781 CarbonylContact C-O 3.53Å; D738-V781 WeakPolarHBondContact CA-O 3.43Å; L739-V781 HydrophobicContact CB-CB 3.9Å; L739-V781 HydrophobicContact CB-CG1 4.05Å; L739-V781 WeakPolarHBondContact CB-O 3.31Å; L739-V781 HydrophobicContact CD2-CB 4.03Å; L739-V781 HydrophobicContact CD2-CG1 3.99Å; L739-V781 HydrophobicContact CD2-CG2 4.47Å; L739-V781 PolarHBondContact N-O 3.49Å; I755-V781 HydrophobicContact CG2-CG1 4.48Å; V759-V781 HydrophobicContact CG2-CG1 3.78Å; V759-V781 HydrophobicContact CG2-CG2 3.89Å; K777-V781 PolarHBondContact O-N 3.14Å; V781-A789 HydrophobicContact CG1-CB 3.76Å
782	L	95.8	Very high	90.4	Very high	36 Å²	36	49.2 Å²	49.2	19%	0.188	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	147.2	179.3	-60.5	-169.5	0	0	0	110.1	V709 L735 R737 D738 A789 K790 T792	V709-L782 HydrophobicContact CG2-CD1 4.09Å; L735-L782 HydrophobicContact CB-CB 3.92Å; L735-L782 HydrophobicContact CB-CD1 4.36Å; L735-L782 HydrophobicContact CD1-CB 3.43Å; L735-L782 VanDerWaalsContact CD1-CB 3.43Å; L735-L782 HydrophobicContact CG-CB 4.2Å; R737-L782 CarbonylContact O-C 3.56Å; D738-L782 HydrophobicContact CB-CD2 3.92Å; L782-A789 CarbonylContact O-C 3.47Å; L782-A789 WeakPolarHBondContact O-CA 3.36Å; L782-K790 PolarHBondContact N-O 3.13Å; L782-K790 PolarHBondContact O-N 2.88Å; L782-T792 HydrophobicContact CD1-CG2 3.88Å; L782-T792 HydrophobicContact CD2-CG2 4.21Å; L782-T792 HydrophobicContact CG-CG2 3.7Å
783	L	97.1	Very high	90.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.5	-177.2	-58.7	-178	0	0	0	110.3	L735 H736 R737 L739 L747 I755 R788 A789	L735-L783 WeakPolarHBondContact CB-O 3.36Å; H736-L783 WeakPolarHBondContact CA-O 3.49Å; H736-L783 WeakPolarHBondContact CB-O 3.5Å; H736-L783 PolarHBondContact N-O 2.75Å; R737-L783 HydrophobicContact CG-CB 4.17Å; R737-L783 HydrophobicContact CG-CD1 4.45Å; R737-L783 PolarHBondContact N-O 2.84Å; R737-L783 PolarHBondContact O-N 2.8Å; L739-L783 HydrophobicContact CD1-CD1 4.12Å; L739-L783 HydrophobicContact CD1-CD2 4.46Å; L747-L783 HydrophobicContact CD1-CD1 4.05Å; I755-L783 HydrophobicContact CD1-CD1 4.06Å; I755-L783 HydrophobicContact CD1-CD2 3.72Å; I755-L783 HydrophobicContact CG1-CD2 3.84Å; I755-L783 HydrophobicContact CG2-CD2 4.46Å; L783-R788 WeakPolarHBondContact CA-O 3.48Å; L783-A789 HydrophobicContact CD2-CB 3.91Å
784	D	95.3	Very high	90.2	Very high	36 Å²	36	48.8 Å²	48.8	19%	0.193	23%	0.227	C	C	.	.			trans	-73.9	-174.8	168.7	73.1	10.3	0	0	0	112	L735 Q786 N787 R788	L735-D784 HydrophobicContact CD2-CB 3.91Å; D784-Q786 PolarHBondContact O-N 3.48Å; D784-Q786 VanDerWaalsContact OD1-C 3.22Å; D784-Q786 VanDerWaalsContact OD1-CA 3.26Å; D784-Q786 WeakPolarHBondContact OD1-CA 3.44Å; D784-Q786 WeakPolarHBondContact OD1-CB 3.49Å; D784-Q786 PolarHBondContact OD1-N 3.42Å; D784-N787 PolarHBondContact O-N 3.1Å; D784-N787 PolarHBondContact OD1-N 2.86Å; D784-R788 PolarHBondContact N-O 2.91Å; D784-R788 PolarHBondContact OD1-N 3.41Å; D784-R788 WeakPolarHBondContact OD2-CB 3.38Å
785	K	94.2	Very high	89.7	Confident	168 Å²	168	46.8 Å²	46.8	73%	0.73	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-19	179.8	-66.8	-178.4	-179	176.8	0	112.9	H736	H736-K785 HydrophobicContact CB-CG 4.34Å
786	Q	95.3	Very high	88.8	Confident	140 Å²	140	48.2 Å²	48.2	65%	0.654	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	6	178.4	-67.4	72.9	23.5	0	0	111.9	D784 R788	D784-Q786 PolarHBondContact O-N 3.48Å; D784-Q786 VanDerWaalsContact OD1-C 3.22Å; D784-Q786 VanDerWaalsContact OD1-CA 3.26Å; D784-Q786 WeakPolarHBondContact OD1-CA 3.44Å; D784-Q786 WeakPolarHBondContact OD1-CB 3.49Å; D784-Q786 PolarHBondContact OD1-N 3.42Å; Q786-R788 HydrophobicContact CB-CG 4.33Å; Q786-R788 PolarHBondContact O-N 3.1Å
787	N	95.4	Very high	88.1	Confident	33 Å²	33	45.1 Å²	45.1	18%	0.176	21%	0.212	C	C	.	.			trans	59.3	27.9	-173.3	-58.7	-59	0	0	0	114.6	R737 L747 T751 I755 D784	R737-N787 PolarHBondContact NH2-OD1 2.94Å; L747-N787 HydrophobicContact CD2-CB 4.33Å; T751-N787 HydrophobicContact CG2-CB 3.48Å; T751-N787 VanDerWaalsContact CG2-CB 3.48Å; I755-N787 WeakPolarHBondContact CG1-O 3.39Å; D784-N787 PolarHBondContact O-N 3.1Å; D784-N787 PolarHBondContact OD1-N 2.86Å
788	R	97	Very high	87.2	Confident	74 Å²	74	44 Å²	44	28%	0.279	21%	0.207	S	C	.	.			trans	-80	141.1	165.8	-56.6	-58.2	-58.5	-83.3	1	109.8	D758 L783 D784 Q786	D758-R788 IonicContact OD1-CZ 3.15Å; D758-R788 IonicContact OD1-NE 3.74Å; D758-R788 PolarHBondContact OD1-NE 3.36Å; D758-R788 IonicContact OD1-NH2 2.68Å; D758-R788 PolarHBondContact OD1-NH2 3.39Å; D758-R788 WeakPolarHBondContact OD2-CA 3.47Å; D758-R788 IonicContact OD2-CZ 3.72Å; D758-R788 IonicContact OD2-NE 2.98Å; D758-R788 PolarHBondContact OD2-NE 3.29Å; D758-R788 IonicContact OD2-NH2 2.79Å; L783-R788 WeakPolarHBondContact CA-O 3.48Å; D784-R788 PolarHBondContact N-O 2.91Å; D784-R788 PolarHBondContact OD1-N 3.41Å; D784-R788 WeakPolarHBondContact OD2-CB 3.38Å; Q786-R788 HydrophobicContact CB-CG 4.33Å; Q786-R788 PolarHBondContact O-N 3.1Å
789	A	97.8	Very high	86	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.3	-171.8	0	0	0	0	0	112.4	R707 I755 D758 V759 V781 L782 L783	R707-A789 WeakPolarHBondContact CD-O 3.33Å; I755-A789 HydrophobicContact CB-CB 4.32Å; I755-A789 HydrophobicContact CG1-CB 4.27Å; I755-A789 HydrophobicContact CG2-CB 3.9Å; D758-A789 HydrophobicContact CB-CB 3.66Å; D758-A789 PolarHBondContact OD2-N 3.47Å; V759-A789 HydrophobicContact CG2-CB 4.26Å; V781-A789 HydrophobicContact CG1-CB 3.76Å; L782-A789 CarbonylContact O-C 3.47Å; L782-A789 WeakPolarHBondContact O-CA 3.36Å; L783-A789 HydrophobicContact CD2-CB 3.91Å
790	K	97.3	Very high	84.8	Confident	34 Å²	34	39.5 Å²	39.5	15%	0.148	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.1	166.8	-57	-165.6	176.4	-169.4	0	110.5	E706 R707 V709 E733 L735 L782	E706-K790 WeakPolarHBondContact O-CE 3.35Å; E706-K790 WeakPolarHBondContact O-CG 3.44Å; R707-K790 CarbonylContact O-C 3.6Å; R707-K790 WeakPolarHBondContact O-CA 3.3Å; V709-K790 HydrophobicContact CG2-CB 3.87Å; E733-K790 WeakPolarHBondContact OE1-CD 3.18Å; E733-K790 IonicContact OE1-NZ 2.88Å; E733-K790 PolarHBondContact OE1-NZ 2.66Å; E733-K790 IonicContact OE2-NZ 2.84Å; E733-K790 PolarHBondContact OE2-NZ 3.2Å; L735-K790 HydrophobicContact CD1-CB 3.71Å; L735-K790 HydrophobicContact CD1-CD 3.95Å; L735-K790 HydrophobicContact CD1-CG 3.87Å; L782-K790 PolarHBondContact N-O 3.13Å; L782-K790 PolarHBondContact O-N 2.88Å
791	I	95.1	Very high	83	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.5	177.6	-55.9	172.7	0	0	0	109.1	R707 L708 V709 V759 I763 H773 I776 L794	R707-I791 PolarHBondContact O-N 2.91Å; L708-I791 HydrophobicContact CD2-CB 3.85Å; L708-I791 HydrophobicContact CD2-CD1 4.33Å; L708-I791 HydrophobicContact CD2-CG1 4.48Å; V709-I791 WeakPolarHBondContact CG2-O 3.42Å; V709-I791 PolarHBondContact N-O 2.6Å; V759-I791 HydrophobicContact CG1-CD1 4.41Å; I763-I791 HydrophobicContact CG1-CD1 3.82Å; H773-I791 WeakPolarHBondContact CD2-CG2 3.2Å; H773-I791 VanDerWaalsContact NE2-CG2 3.32Å; H773-I791 WeakPolarHBondContact NE2-CG2 3.33Å; I776-I791 HydrophobicContact CD1-CD1 4.18Å; I776-I791 HydrophobicContact CD1-CG2 3.71Å; I791-L794 HydrophobicContact CG2-CD2 4.49Å
792	T	90.3	Very high	81	Confident	19 Å²	19	40.8 Å²	40.8	12%	0.117	19%	0.193	C	C	.	.			trans	-126.1	177.2	175.8	-161.3	0	0	0	0	111.2	H773 N780 L782	H773-T792 PolarHBondContact NE2-O 2.97Å; N780-T792 HydrophobicContact CB-CG2 4.44Å; N780-T792 PolarHBondContact O-N 2.97Å; L782-T792 HydrophobicContact CD1-CG2 3.88Å; L782-T792 HydrophobicContact CD2-CG2 4.21Å; L782-T792 HydrophobicContact CG-CG2 3.7Å
793	D	82.2	Confident	79	Confident	24 Å²	24	42.5 Å²	42.5	13%	0.128	20%	0.201	C	C	.	.			trans	60.7	54.3	179	-146	-3.4	0	0	0	114.1	Y661 K679 H773 G795	Y661-D793 WeakPolarHBondContact CD2-OD2 3.21Å; K679-D793 IonicContact NZ-OD1 2.82Å; K679-D793 PolarHBondContact NZ-OD1 3.42Å; K679-D793 IonicContact NZ-OD2 3.62Å; K679-D793 PolarHBondContact NZ-OD2 3.03Å; H773-D793 PolarHBondContact CE1-O 3.05Å; D793-G795 PolarHBondContact O-N 2.93Å
794	L	74.9	Confident	76.4	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-69.1	10.8	173.1	-55.4	-177.8	0	0	0	113	M699 L702 L766 H773 I791 F796 C797	M699-L794 HydrophobicContact CE-CB 4.11Å; M699-L794 HydrophobicContact CE-CD1 4.36Å; M699-L794 HydrophobicContact CE-CG 4.39Å; M699-L794 HydrophobicContact CG-CB 3.57Å; M699-L794 HydrophobicContact CG-CD1 3.99Å; M699-L794 HydrophobicContact CG-CG 4.34Å; M699-L794 HydrophobicContact SD-CB 3.82Å; L702-L794 HydrophobicContact CD1-CD1 3.82Å; L766-L794 HydrophobicContact CD1-CD2 3.98Å; L766-L794 HydrophobicContact CD2-CD2 4.27Å; H773-L794 VanDerWaalsContact CD2-CD2 3.42Å; H773-L794 WeakPolarHBondContact CD2-CD2 3.5Å; I791-L794 HydrophobicContact CG2-CD2 4.49Å; L794-F796 PolarHBondContact O-N 2.69Å; L794-F796 VanDerWaalsContact O-N 3.15Å; L794-C797 HydrophobicContact CB-CB 4.36Å; L794-C797 WeakPolarHBondContact O-CB 3.43Å; L794-C797 PolarHBondContact O-N 2.92Å
795	G	63.3	Low	73.8	Confident	9 Å²	9	48.6 Å²	48.6	9%	0.093	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62.5	-17.7	176	0	0	0	0	0	113.1	E695 D793	E695-G795 WeakPolarHBondContact CG-O 3.49Å; E695-G795 WeakPolarHBondContact OE2-CA 3.37Å; E695-G795 VanDerWaalsContact OE2-O 3.12Å; D793-G795 PolarHBondContact O-N 2.93Å
796	F	61.5	Low	71	Confident	54 Å²	54	42.5 Å²	42.5	24%	0.237	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-94.5	1.5	170.3	-67.3	-80.4	0	0	0	113.7	Y661 H773 R774 D775 L794 K798	Y661-F796 HydrophobicContact CD1-CE2 4.43Å; Y661-F796 HydrophobicContact CD1-CZ 4.38Å; Y661-F796 HydrophobicContact CD2-CE2 4.49Å; Y661-F796 AromaticContact CE1-CE2 3.67Å; Y661-F796 HydrophobicContact CE1-CE2 3.67Å; Y661-F796 AromaticContact CE1-CZ 3.4Å; Y661-F796 HydrophobicContact CE1-CZ 3.4Å; Y661-F796 VanDerWaalsContact CE1-CZ 3.4Å; Y661-F796 AromaticContact CE2-CE2 3.72Å; Y661-F796 HydrophobicContact CE2-CE2 3.72Å; Y661-F796 HydrophobicContact CE2-CZ 4.25Å; Y661-F796 AromaticContact CZ-CE2 3.26Å; Y661-F796 AromaticContact CZ-CZ 3.32Å; Y661-F796 VanDerWaalsContact OH-CE2 3.22Å; Y661-F796 WeakPolarHBondContact OH-CE2 3.34Å; Y661-F796 WeakPolarHBondContact OH-CZ 3.12Å; H773-F796 CarbonylContact O-C 3.26Å; H773-F796 WeakPolarHBondContact O-CB 3.48Å; R774-F796 HydrophobicContact CB-CB 4.16Å; R774-F796 PolarHBondContact NE-O 3.21Å; R774-F796 PolarHBondContact NH2-O 3.49Å; D775-F796 HydrophobicContact CB-CB 3.92Å; D775-F796 HydrophobicContact CB-CD2 3.41Å; D775-F796 VanDerWaalsContact CB-CD2 3.41Å; D775-F796 HydrophobicContact CB-CE2 4.18Å; D775-F796 HydrophobicContact CB-CG 3.81Å; L794-F796 PolarHBondContact O-N 2.69Å; L794-F796 VanDerWaalsContact O-N 3.15Å; F796-K798 PolarHBondContact O-N 2.87Å
797	C	70.3	Confident	67.9	Low	4 Å²	4	43.9 Å²	43.9	3%	0.027	25%	0.248	C	C	.	.			trans	-62	126.2	176.3	-76.2	0	0	0	0	110.7	V772 L794	V772-C797 VanDerWaalsContact O-CA 3.27Å; V772-C797 WeakPolarHBondContact O-CA 3.43Å; L794-C797 HydrophobicContact CB-CB 4.36Å; L794-C797 WeakPolarHBondContact O-CB 3.43Å; L794-C797 PolarHBondContact O-N 2.92Å
798	K	66.5	Low	64.8	Low	58 Å²	58	46.9 Å²	46.9	25%	0.252	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.3	167	-82.2	-171.3	-176.5	-175.2	0	109.9	V772 R774 F796 E800	V772-K798 PolarHBondContact N-O 3.32Å; V772-K798 PolarHBondContact O-N 3.25Å; R774-K798 VanDerWaalsContact NH2-CG 3.34Å; F796-K798 PolarHBondContact O-N 2.87Å; K798-E800 PolarHBondContact O-N 3.28Å
799	P	64.6	Low	61.6	Low	1 Å²	1	45.5 Å²	45.5	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	131.2	163	-31.9	40.2	0	0	0	110.6	F376 Y698 G770 L771 A801 M802 M803	F376-P799 HydrophobicContact CE1-CB 3.69Å; F376-P799 HydrophobicContact CZ-CB 3.53Å; F376-P799 HydrophobicContact CZ-CG 3.92Å; Y698-P799 HydrophobicContact CD1-CG 4.46Å; Y698-P799 HydrophobicContact CE1-CG 3.68Å; Y698-P799 HydrophobicContact CE2-CG 3.99Å; Y698-P799 VanDerWaalsContact CZ-CG 3.43Å; Y698-P799 WeakPolarHBondContact OH-CG 3.38Å; G770-P799 CarbonylContact O-C 3.56Å; G770-P799 VanDerWaalsContact O-CA 3.3Å; G770-P799 WeakPolarHBondContact O-CA 3.48Å; L771-P799 HydrophobicContact CD2-CG 3.91Å; P799-A801 HydrophobicContact CB-CB 4.42Å; P799-A801 PolarHBondContact O-N 3.13Å; P799-A801 VanDerWaalsContact O-N 3.13Å; P799-M802 HydrophobicContact CB-CB 4.03Å; P799-M802 HydrophobicContact CB-CG 3.81Å; P799-M802 HydrophobicContact CB-SD 4.1Å; P799-M802 HydrophobicContact CG-CB 4.45Å; P799-M802 HydrophobicContact CG-CG 4.11Å; P799-M802 HydrophobicContact CG-SD 3.72Å; P799-M802 PolarHBondContact O-N 3.42Å; P799-M803 WeakPolarHBondContact O-CG 3.28Å
800	E	61	Low	58.4	Low	116 Å²	116	49.9 Å²	49.9	54%	0.542	30%	0.302	S	S	.	.	S	Bend	trans	-52.8	-34.7	171.9	171.6	165.2	-151.2	0	0	110.6	G770 V772 K798 M802 M803	G770-E800 PolarHBondContact O-N 2.94Å; V772-E800 HydrophobicContact CG2-CB 4.34Å; K798-E800 PolarHBondContact O-N 3.28Å; E800-M802 VanDerWaalsContact C-N 3.35Å; E800-M802 PolarHBondContact O-N 2.99Å; E800-M803 VanDerWaalsContact CA-CE 3.48Å; E800-M803 HydrophobicContact CB-CE 3.85Å; E800-M803 HydrophobicContact CG-CE 3.59Å; E800-M803 WeakPolarHBondContact O-CB 3.42Å; E800-M803 WeakPolarHBondContact O-CG 3.29Å; E800-M803 PolarHBondContact O-N 2.76Å
801	A	52.5	Low	55.1	Low	7 Å²	7	52.7 Å²	52.7	6%	0.058	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-58.5	-44.6	174.6	0	0	0	0	0	113.4	F376 Q379 P799 M803	F376-A801 HydrophobicContact CD1-CB 3.37Å; F376-A801 HydrophobicContact CE1-CB 3.52Å; F376-A801 HydrophobicContact CG-CB 4.45Å; Q379-A801 HydrophobicContact CB-CB 4.3Å; Q379-A801 HydrophobicContact CG-CB 4.32Å; Q379-A801 VanDerWaalsContact NE2-CA 3.31Å; Q379-A801 PolarHBondContact NE2-O 2.82Å; Q379-A801 PolarHBondContact OE1-O 2.85Å; P799-A801 HydrophobicContact CB-CB 4.42Å; P799-A801 PolarHBondContact O-N 3.13Å; P799-A801 VanDerWaalsContact O-N 3.13Å; A801-M803 PolarHBondContact O-N 2.84Å
802	M	53.6	Low	52.3	Low	34 Å²	34	58.1 Å²	58.1	17%	0.167	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-82.3	14.3	-174.1	-61.1	-178.6	59.5	0	0	113.6	R624 L694 Y698 P799 E800	R624-M802 VanDerWaalsContact CD-CE 3.46Å; R624-M802 HydrophobicContact CG-CE 3.44Å; R624-M802 VanDerWaalsContact CG-CE 3.44Å; R624-M802 HydrophobicContact CG-SD 4.38Å; L694-M802 HydrophobicContact CD2-CE 4.32Å; Y698-M802 PolarHBondContact OH-SD 3.25Å; P799-M802 HydrophobicContact CB-CB 4.03Å; P799-M802 HydrophobicContact CB-CG 3.81Å; P799-M802 HydrophobicContact CB-SD 4.1Å; P799-M802 HydrophobicContact CG-CB 4.45Å; P799-M802 HydrophobicContact CG-CG 4.11Å; P799-M802 HydrophobicContact CG-SD 3.72Å; P799-M802 PolarHBondContact O-N 3.42Å; E800-M802 VanDerWaalsContact C-N 3.35Å; E800-M802 PolarHBondContact O-N 2.99Å
803	M	54.1	Low	50	Low	72 Å²	72	61.3 Å²	61.3	36%	0.355	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-85.7	-20.6	-178.2	-61.4	-163.8	-62.6	0	0	114	V772 P799 E800 A801 G805 S806	V772-M803 HydrophobicContact CG2-CE 4.29Å; V772-M803 HydrophobicContact CG2-SD 4.31Å; P799-M803 WeakPolarHBondContact O-CG 3.28Å; E800-M803 VanDerWaalsContact CA-CE 3.48Å; E800-M803 HydrophobicContact CB-CE 3.85Å; E800-M803 HydrophobicContact CG-CE 3.59Å; E800-M803 WeakPolarHBondContact O-CB 3.42Å; E800-M803 WeakPolarHBondContact O-CG 3.29Å; E800-M803 PolarHBondContact O-N 2.76Å; A801-M803 PolarHBondContact O-N 2.84Å; M803-G805 PolarHBondContact O-N 3.27Å; M803-S806 PolarHBondContact O-N 3.37Å; M803-S806 PolarHBondContact O-OG 3.34Å
804	S	42.8	Very low	48.2	Very low	85 Å²	85	64.7 Å²	64.7	59%	0.594	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	129.4	179.6	-165	0	0	0	0	111.6	S806	S804-S806 VanDerWaalsContact C-N 3.27Å; S804-S806 PolarHBondContact O-N 3.3Å
805	G	39.9	Very low	46.6	Very low	79 Å²	79	66 Å²	66	81%	0.814	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-4.2	178.4	0	0	0	0	0	116.5	M803 I807	M803-G805 PolarHBondContact O-N 3.27Å; G805-I807 PolarHBondContact O-N 3.38Å
806	S	35.8	Very low	45.5	Very low	41 Å²	41	70 Å²	70	29%	0.287	42%	0.418	S	S	.	.			trans	-89.4	81.3	173.3	75.2	0	0	0	0	111.3	M803 S804 V808	M803-S806 PolarHBondContact O-N 3.37Å; M803-S806 PolarHBondContact O-OG 3.34Å; S804-S806 VanDerWaalsContact C-N 3.27Å; S804-S806 PolarHBondContact O-N 3.3Å; S806-V808 PolarHBondContact O-N 2.52Å
807	I	30.7	Very low	44.8	Very low	169 Å²	169	68.9 Å²	68.9	87%	0.867	41%	0.413	S	S	*	.			trans	-72.8	64.2	156	-54.7	173.2	0	0	0	107.1	G805	G805-I807 PolarHBondContact O-N 3.38Å
808	V	30.6	Very low	43.4	Very low	96 Å²	96	71.8 Å²	71.8	58%	0.582	43%	0.428	S	S	*	.			trans	-138.5	82.3	166.6	-170.4	0	0	0	0	106.2	S806	S806-V808 PolarHBondContact O-N 2.52Å
809	G	29.7	Very low	42.3	Very low	44 Å²	44	74.8 Å²	74.8	45%	0.454	44%	0.441	S	S	.	.	S	Bend	trans	-165.7	108.8	173.5	0	0	0	0	0	103.5
810	T	28.8	Very low	41.5	Very low	93 Å²	93	79.1 Å²	79.1	57%	0.571	47%	0.468	S	S	*	.			trans	-47.6	148	170.5	-47.9	0	0	0	0	108.2	I812	T810-I812 VanDerWaalsContact CB-CD1 3.42Å; T810-I812 HydrophobicContact CG2-CD1 3.53Å; T810-I812 HydrophobicContact CG2-CG1 3.47Å; T810-I812 VanDerWaalsContact CG2-CG1 3.47Å; T810-I812 HydrophobicContact CG2-CG2 4.45Å; T810-I812 WeakPolarHBondContact O-CG1 3.37Å; T810-I812 PolarHBondContact O-N 2.82Å
811	P	29.8	Very low	41	Very low	94 Å²	94	76.7 Å²	76.7	61%	0.61	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-52.5	-1.6	-179.4	-27.3	33.9	0	0	0	117.1	H813 F819	P811-H813 PolarHBondContact O-N 3.23Å; P811-F819 HydrophobicContact CB-CE1 4.03Å; P811-F819 HydrophobicContact CB-CE2 4.46Å; P811-F819 HydrophobicContact CB-CZ 3.45Å; P811-F819 VanDerWaalsContact CB-CZ 3.45Å; P811-F819 WeakPolarHBondContact O-CE2 3.49Å; P811-F819 WeakPolarHBondContact O-CZ 3.49Å
812	I	35.9	Very low	40.9	Very low	115 Å²	115	81 Å²	81	59%	0.59	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-76.4	2.4	-169.1	34.2	176	0	0	0	117.4	T810 M814	T810-I812 VanDerWaalsContact CB-CD1 3.42Å; T810-I812 HydrophobicContact CG2-CD1 3.53Å; T810-I812 HydrophobicContact CG2-CG1 3.47Å; T810-I812 VanDerWaalsContact CG2-CG1 3.47Å; T810-I812 HydrophobicContact CG2-CG2 4.45Å; T810-I812 WeakPolarHBondContact O-CG1 3.37Å; T810-I812 PolarHBondContact O-N 2.82Å; I812-M814 PolarHBondContact O-N 3.29Å
813	H	41.6	Very low	41.2	Very low	86 Å²	86	85.4 Å²	85.4	40%	0.398	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-80.7	-6.5	171.6	-61.5	-54.4	0	0	0	113.3	R774 P811	R774-H813 VanDerWaalsContact C-CE1 3.43Å; R774-H813 WeakPolarHBondContact CB-CE1 3.28Å; R774-H813 PolarHBondContact O-CE1 2.94Å; R774-H813 PolarHBondContact O-ND1 2.82Å; P811-H813 PolarHBondContact O-N 3.23Å
814	M	43.6	Very low	41.7	Very low	95 Å²	95	85.1 Å²	85.1	47%	0.468	52%	0.518	S	S	.	.	S	Bend	trans	-80.3	127.8	161.1	-71.6	-177.6	-178.5	0	0	108.2	I812 L818 F819	I812-M814 PolarHBondContact O-N 3.29Å; M814-L818 HydrophobicContact CB-CB 3.98Å; M814-L818 HydrophobicContact CB-CD1 3.8Å; M814-L818 HydrophobicContact CG-CD1 4Å; M814-L818 HydrophobicContact SD-CB 4.45Å; M814-F819 HydrophobicContact CB-CD2 4.35Å; M814-F819 HydrophobicContact CB-CE2 3.81Å
815	A	41.9	Very low	42.9	Very low	35 Å²	35	89.4 Å²	89.4	29%	0.289	53%	0.528	S	S	.	.			trans	-52.5	136.9	172.4	0	0	0	0	0	109.1	E817 L818	A815-E817 HydrophobicContact CB-CG 4.07Å; A815-E817 WeakPolarHBondContact CB-OE1 3.44Å; A815-E817 WeakPolarHBondContact CB-OE2 3.49Å; A815-E817 PolarHBondContact O-N 3.26Å; A815-L818 WeakPolarHBondContact O-CB 3.21Å; A815-L818 PolarHBondContact O-N 3.12Å
816	P	39.5	Very low	44.8	Very low	93 Å²	93	90 Å²	90	60%	0.604	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-23.6	-168.5	18.3	-31	0	0	0	114.6	L818 F819 T820	P816-L818 PolarHBondContact O-N 3.02Å; P816-F819 PolarHBondContact O-N 2.81Å; P816-F819 VanDerWaalsContact O-N 3.16Å; P816-T820 PolarHBondContact O-N 3.47Å; P816-T820 VanDerWaalsContact O-N 3.12Å; P816-T820 PolarHBondContact O-OG1 3.07Å
817	E	47	Very low	46.6	Very low	30 Å²	30	91.6 Å²	91.6	14%	0.14	51%	0.511	C	S	.	.	H	α-helix	trans	-60.3	-24.9	170.1	60.4	-92.8	-144.6	0	0	114.5	A815 T820 G821 T822 W842	A815-E817 HydrophobicContact CB-CG 4.07Å; A815-E817 WeakPolarHBondContact CB-OE1 3.44Å; A815-E817 WeakPolarHBondContact CB-OE2 3.49Å; A815-E817 PolarHBondContact O-N 3.26Å; E817-T820 WeakPolarHBondContact CA-OG1 3.4Å; E817-G821 CarbonylContact O-C 3.53Å; E817-G821 WeakPolarHBondContact O-CA 3.46Å; E817-G821 PolarHBondContact O-N 3.4Å; E817-T822 WeakPolarHBondContact CA-O 3.45Å; E817-T822 WeakPolarHBondContact CB-O 3.39Å; E817-W842 PolarHBondContact OE1-NE1 2.97Å
818	L	41.4	Very low	48.8	Very low	64 Å²	64	90 Å²	90	34%	0.335	51%	0.512	S	S	.	.	H	α-helix	trans	-79	-22.5	175.1	-72.3	165.4	0	0	0	112.3	M814 A815 P816	M814-L818 HydrophobicContact CB-CB 3.98Å; M814-L818 HydrophobicContact CB-CD1 3.8Å; M814-L818 HydrophobicContact CG-CD1 4Å; M814-L818 HydrophobicContact SD-CB 4.45Å; A815-L818 WeakPolarHBondContact O-CB 3.21Å; A815-L818 PolarHBondContact O-N 3.12Å; P816-L818 PolarHBondContact O-N 3.02Å
819	F	42.7	Very low	50.8	Low	121 Å²	121	88.8 Å²	88.8	53%	0.531	50%	0.504	S	S	.	.	H	α-helix	trans	-84.6	-35.1	171.7	-78.4	-79.8	0	0	0	112.9	P811 M814 P816	P811-F819 HydrophobicContact CB-CE1 4.03Å; P811-F819 HydrophobicContact CB-CE2 4.46Å; P811-F819 HydrophobicContact CB-CZ 3.45Å; P811-F819 VanDerWaalsContact CB-CZ 3.45Å; P811-F819 WeakPolarHBondContact O-CE2 3.49Å; P811-F819 WeakPolarHBondContact O-CZ 3.49Å; M814-F819 HydrophobicContact CB-CD2 4.35Å; M814-F819 HydrophobicContact CB-CE2 3.81Å; P816-F819 PolarHBondContact O-N 2.81Å; P816-F819 VanDerWaalsContact O-N 3.16Å
820	T	48.5	Very low	53.2	Low	93 Å²	93	88.3 Å²	88.3	57%	0.571	49%	0.49	S	S	*	.	H	α-helix	trans	-100.7	-14.8	-172.2	50	0	0	0	0	113.1	P816 E817 T822	P816-T820 PolarHBondContact O-N 3.47Å; P816-T820 VanDerWaalsContact O-N 3.12Å; P816-T820 PolarHBondContact O-OG1 3.07Å; E817-T820 WeakPolarHBondContact CA-OG1 3.4Å; T820-T822 WeakPolarHBondContact CB-OG1 3.45Å; T820-T822 PolarHBondContact O-N 3.05Å; T820-T822 PolarHBondContact OG1-OG1 3.02Å
821	G	49.7	Very low	55.7	Low	65 Å²	65	85.8 Å²	85.8	67%	0.67	47%	0.473	S	S	*	.			trans	71.9	-4	-172	0	0	0	0	0	114.3	E817 R823	E817-G821 CarbonylContact O-C 3.53Å; E817-G821 WeakPolarHBondContact O-CA 3.46Å; E817-G821 PolarHBondContact O-N 3.4Å; G821-R823 PolarHBondContact O-N 2.8Å
822	T	50.8	Low	58.4	Low	98 Å²	98	85.9 Å²	85.9	60%	0.601	47%	0.465	S	S	*	.			trans	-91.4	103.8	-175.1	38.6	0	0	0	0	111.6	E817 T820	E817-T822 WeakPolarHBondContact CA-O 3.45Å; E817-T822 WeakPolarHBondContact CB-O 3.39Å; T820-T822 WeakPolarHBondContact CB-OG1 3.45Å; T820-T822 PolarHBondContact O-N 3.05Å; T820-T822 PolarHBondContact OG1-OG1 3.02Å
823	R	60.3	Low	60.8	Low	126 Å²	126	83.2 Å²	83.2	48%	0.475	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-75.5	149.7	170.4	-64.4	-175.4	179	-162.7	-5.6	110.8	G821 E839	G821-R823 PolarHBondContact O-N 2.8Å; R823-E839 IonicContact NH1-OE1 3.1Å; R823-E839 PolarHBondContact NH1-OE1 2.88Å
824	P	65.4	Low	62.9	Low	65 Å²	65	79.4 Å²	79.4	42%	0.422	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-56.2	149.3	172.6	-20.6	31.3	0	0	0	111.3	W835 W842	P824-W835 WeakPolarHBondContact O-CH2 3.47Å; P824-W842 HydrophobicContact CB-CH2 4.29Å; P824-W842 HydrophobicContact CG-CH2 3.67Å; P824-W842 HydrophobicContact CG-CZ2 3.87Å; P824-W842 HydrophobicContact CG-CZ3 4.48Å
825	E	68.1	Low	64.9	Low	175 Å²	175	76.4 Å²	76.4	82%	0.818	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-70.5	138.1	173	-166.2	174.3	-173.6	0	0	110.2	L827	E825-L827 PolarHBondContact O-N 2.74Å; E825-L827 VanDerWaalsContact O-N 3.09Å
826	R	78.1	Confident	67.2	Low	93 Å²	93	79.7 Å²	79.7	35%	0.351	43%	0.426	S	S	.	.			trans	-64.3	112.9	175.6	-179.3	176.4	177.2	173.6	-2.7	109.3	F830 D831 E832 W835	R826-F830 PolarHBondContact NE-O 2.9Å; R826-F830 VanDerWaalsContact NE-O 3.14Å; R826-F830 PolarHBondContact NH2-O 2.94Å; R826-F830 VanDerWaalsContact NH2-O 3.15Å; R826-D831 PolarHBondContact NH2-O 3.03Å; R826-E832 IonicContact CZ-OE2 2.76Å; R826-E832 IonicContact NH1-OE2 2.86Å; R826-E832 PolarHBondContact NH1-OE2 2.81Å; R826-E832 VanDerWaalsContact NH2-CA 3.27Å; R826-E832 IonicContact NH2-OE2 3.07Å; R826-E832 PolarHBondContact NH2-OE2 2.96Å; R826-W835 VanDerWaalsContact CA-CZ3 3.47Å; R826-W835 HydrophobicContact CB-CD2 3.92Å; R826-W835 HydrophobicContact CB-CE3 3.67Å; R826-W835 HydrophobicContact CB-CH2 3.83Å; R826-W835 HydrophobicContact CB-CZ2 4.07Å; R826-W835 HydrophobicContact CB-CZ3 3.63Å; R826-W835 HydrophobicContact CG-CD2 3.79Å; R826-W835 HydrophobicContact CG-CE3 3.6Å; R826-W835 HydrophobicContact CG-CG 4.25Å; R826-W835 HydrophobicContact CG-CZ3 4.08Å
827	L	74.6	Confident	69.5	Low	73 Å²	73	75.7 Å²	75.7	38%	0.382	40%	0.4	S	S	.	.			trans	-67.4	141.5	174.8	-58.8	-179.9	0	0	0	109.9	E825 V829 F830	E825-L827 PolarHBondContact O-N 2.74Å; E825-L827 VanDerWaalsContact O-N 3.09Å; L827-V829 HydrophobicContact CB-CG1 3.86Å; L827-V829 HydrophobicContact CD1-CG1 4.49Å; L827-V829 PolarHBondContact O-N 2.67Å; L827-F830 HydrophobicContact CB-CD2 3.68Å; L827-F830 HydrophobicContact CB-CE2 3.84Å; L827-F830 HydrophobicContact CB-CG 4.5Å; L827-F830 HydrophobicContact CD1-CD2 4.37Å; L827-F830 HydrophobicContact CD1-CE2 3.65Å; L827-F830 HydrophobicContact CD1-CZ 4.16Å; L827-F830 HydrophobicContact CG-CD2 4.14Å; L827-F830 HydrophobicContact CG-CE2 3.84Å; L827-F830 PolarHBondContact O-N 2.92Å
828	P	76.2	Confident	71.4	Confident	137 Å²	137	76.7 Å²	76.7	89%	0.89	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.1	179.8	-26.3	33.8	0	0	0	114.3	F830	P828-F830 VanDerWaalsContact C-N 3.29Å
829	V	73.3	Confident	73.5	Confident	70 Å²	70	76.8 Å²	76.8	42%	0.424	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-13.5	179.5	71.3	0	0	0	0	113.4	L749 L827	L749-V829 HydrophobicContact CB-CG2 4.16Å; L749-V829 HydrophobicContact CD1-CG1 4.15Å; L749-V829 HydrophobicContact CD1-CG2 3.98Å; L749-V829 HydrophobicContact CD2-CG2 3.47Å; L749-V829 VanDerWaalsContact CD2-CG2 3.47Å; L749-V829 HydrophobicContact CG-CG2 4.05Å; L827-V829 HydrophobicContact CB-CG1 3.86Å; L827-V829 HydrophobicContact CD1-CG1 4.49Å; L827-V829 PolarHBondContact O-N 2.67Å
830	F	80.1	Confident	75.6	Confident	34 Å²	34	72.8 Å²	72.8	15%	0.149	39%	0.393	C	S	.	.			trans	-93.4	117.3	179	-63.4	-45.8	0	0	0	111.8	L749 R826 L827 P828 C834 M838	L749-F830 HydrophobicContact CD1-CD1 4.11Å; L749-F830 HydrophobicContact CD1-CE1 3.66Å; R826-F830 PolarHBondContact NE-O 2.9Å; R826-F830 VanDerWaalsContact NE-O 3.14Å; R826-F830 PolarHBondContact NH2-O 2.94Å; R826-F830 VanDerWaalsContact NH2-O 3.15Å; L827-F830 HydrophobicContact CB-CD2 3.68Å; L827-F830 HydrophobicContact CB-CE2 3.84Å; L827-F830 HydrophobicContact CB-CG 4.5Å; L827-F830 HydrophobicContact CD1-CD2 4.37Å; L827-F830 HydrophobicContact CD1-CE2 3.65Å; L827-F830 HydrophobicContact CD1-CZ 4.16Å; L827-F830 HydrophobicContact CG-CD2 4.14Å; L827-F830 HydrophobicContact CG-CE2 3.84Å; L827-F830 PolarHBondContact O-N 2.92Å; P828-F830 VanDerWaalsContact C-N 3.29Å; F830-C834 HydrophobicContact CB-CB 4.38Å; F830-C834 VanDerWaalsContact CD1-SG 3.54Å; F830-M838 HydrophobicContact CD2-SD 4.36Å; F830-M838 HydrophobicContact CE2-CE 4.45Å; F830-M838 HydrophobicContact CE2-SD 4.35Å
831	D	82.2	Confident	77.4	Confident	40 Å²	40	70.7 Å²	70.7	21%	0.214	38%	0.382	C	S	.	.			trans	-68	172.5	172.8	74.8	-5.6	0	0	0	111.9	R826 E833 C834 W835 R865 L866	R826-D831 PolarHBondContact NH2-O 3.03Å; D831-E833 VanDerWaalsContact C-N 3.31Å; D831-E833 PolarHBondContact O-N 2.84Å; D831-C834 PolarHBondContact O-N 3.09Å; D831-C834 WeakPolarHBondContact OD1-CB 3.38Å; D831-C834 PolarHBondContact OD1-N 2.83Å; D831-W835 PolarHBondContact O-N 3.43Å; D831-R865 IonicContact OD2-CZ 2.71Å; D831-R865 IonicContact OD2-NH2 3.4Å; D831-R865 PolarHBondContact OD2-NH2 3.43Å; D831-L866 HydrophobicContact CB-CD2 4.31Å
832	E	85.8	Confident	79	Confident	95 Å²	95	70 Å²	70	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-39.2	-174.3	-174.3	58.1	-153	0	0	112.3	R826 W835 Q836	R826-E832 IonicContact CZ-OE2 2.76Å; R826-E832 IonicContact NH1-OE2 2.86Å; R826-E832 PolarHBondContact NH1-OE2 2.81Å; R826-E832 VanDerWaalsContact NH2-CA 3.27Å; R826-E832 IonicContact NH2-OE2 3.07Å; R826-E832 PolarHBondContact NH2-OE2 2.96Å; E832-W835 PolarHBondContact O-N 2.68Å; E832-Q836 WeakPolarHBondContact O-CB 3.43Å; E832-Q836 VanDerWaalsContact O-CG 3.28Å; E832-Q836 WeakPolarHBondContact O-CG 3.34Å; E832-Q836 PolarHBondContact O-N 3.49Å; E832-Q836 PolarHBondContact OE1-NE2 3.19Å
833	E	85.7	Confident	80.4	Confident	59 Å²	59	67.7 Å²	67.7	28%	0.276	34%	0.343	S	S	.	.	H	α-helix	trans	-71.7	-38.9	-178.9	-169.1	172.6	159	0	0	112.3	D831 W835 Q836 L837 I862 R865	D831-E833 VanDerWaalsContact C-N 3.31Å; D831-E833 PolarHBondContact O-N 2.84Å; E833-W835 VanDerWaalsContact C-N 3.31Å; E833-W835 PolarHBondContact O-N 3.03Å; E833-Q836 PolarHBondContact O-N 2.89Å; E833-L837 WeakPolarHBondContact O-CB 3.43Å; E833-L837 PolarHBondContact O-N 2.62Å; E833-I862 HydrophobicContact CG-CD1 4.35Å; E833-I862 HydrophobicContact CG-CG1 4.29Å; E833-R865 IonicContact OE1-NH1 2.97Å; E833-R865 IonicContact OE2-CZ 2.68Å; E833-R865 IonicContact OE2-NH1 3.04Å; E833-R865 PolarHBondContact OE2-NH1 2.74Å; E833-R865 IonicContact OE2-NH2 3.27Å; E833-R865 PolarHBondContact OE2-NH2 3.49Å
834	C	85.5	Confident	80.8	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-43.6	171.5	-173.2	0	0	0	0	111	F830 D831 L837 M838 I862	F830-C834 HydrophobicContact CB-CB 4.38Å; F830-C834 VanDerWaalsContact CD1-SG 3.54Å; D831-C834 PolarHBondContact O-N 3.09Å; D831-C834 WeakPolarHBondContact OD1-CB 3.38Å; D831-C834 PolarHBondContact OD1-N 2.83Å; C834-L837 PolarHBondContact O-N 3.49Å; C834-M838 VanDerWaalsContact O-CG 3.26Å; C834-M838 WeakPolarHBondContact O-CG 3.42Å; C834-M838 PolarHBondContact O-N 2.97Å; C834-M838 VanDerWaalsContact O-N 3.09Å; C834-I862 HydrophobicContact CB-CD1 4.25Å; C834-I862 HydrophobicContact CB-CG2 4.03Å
835	W	87.1	Confident	81.1	Confident	32 Å²	32	63.5 Å²	63.5	12%	0.121	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-47.3	178	-172.8	-107.1	0	0	0	112.3	P824 R826 D831 E832 E833 L837 M838 E839 W842	P824-W835 WeakPolarHBondContact O-CH2 3.47Å; R826-W835 VanDerWaalsContact CA-CZ3 3.47Å; R826-W835 HydrophobicContact CB-CD2 3.92Å; R826-W835 HydrophobicContact CB-CE3 3.67Å; R826-W835 HydrophobicContact CB-CH2 3.83Å; R826-W835 HydrophobicContact CB-CZ2 4.07Å; R826-W835 HydrophobicContact CB-CZ3 3.63Å; R826-W835 HydrophobicContact CG-CD2 3.79Å; R826-W835 HydrophobicContact CG-CE3 3.6Å; R826-W835 HydrophobicContact CG-CG 4.25Å; R826-W835 HydrophobicContact CG-CZ3 4.08Å; D831-W835 PolarHBondContact O-N 3.43Å; E832-W835 PolarHBondContact O-N 2.68Å; E833-W835 VanDerWaalsContact C-N 3.31Å; E833-W835 PolarHBondContact O-N 3.03Å; W835-L837 VanDerWaalsContact C-N 3.32Å; W835-L837 PolarHBondContact O-N 3.08Å; W835-M838 HydrophobicContact CE3-SD 4.39Å; W835-M838 WeakPolarHBondContact O-CB 3.14Å; W835-M838 PolarHBondContact O-N 2.89Å; W835-M838 VanDerWaalsContact O-N 3.14Å; W835-E839 HydrophobicContact CZ2-CG 4.39Å; W835-E839 VanDerWaalsContact NE1-CD 3.32Å; W835-E839 WeakPolarHBondContact O-CG 3.43Å; W835-E839 PolarHBondContact O-N 2.74Å; W835-W842 HydrophobicContact CH2-CZ3 4.16Å; W835-W842 HydrophobicContact CZ3-CZ3 4.22Å
836	Q	89	Confident	81.1	Confident	105 Å²	105	59.3 Å²	59.3	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-39.9	177.6	-74.2	174.5	7.1	0	0	112.5	E832 E833 M838 E839 A840	E832-Q836 WeakPolarHBondContact O-CB 3.43Å; E832-Q836 VanDerWaalsContact O-CG 3.28Å; E832-Q836 WeakPolarHBondContact O-CG 3.34Å; E832-Q836 PolarHBondContact O-N 3.49Å; E832-Q836 PolarHBondContact OE1-NE2 3.19Å; E833-Q836 PolarHBondContact O-N 2.89Å; Q836-M838 VanDerWaalsContact C-N 3.35Å; Q836-E839 PolarHBondContact O-N 2.71Å; Q836-A840 WeakPolarHBondContact O-CB 3.2Å; Q836-A840 PolarHBondContact O-N 2.94Å
837	L	89.1	Confident	80.8	Confident	9 Å²	9	62.6 Å²	62.6	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-41.8	175.8	-178.8	60.8	0	0	0	111.5	E833 C834 W835 A840 C841 V855 M858 L859 I862	E833-L837 WeakPolarHBondContact O-CB 3.43Å; E833-L837 PolarHBondContact O-N 2.62Å; C834-L837 PolarHBondContact O-N 3.49Å; W835-L837 VanDerWaalsContact C-N 3.32Å; W835-L837 PolarHBondContact O-N 3.08Å; L837-A840 PolarHBondContact O-N 3.12Å; L837-C841 PolarHBondContact O-N 3.27Å; L837-C841 PolarHBondContact O-SG 3.35Å; L837-V855 HydrophobicContact CD1-CG1 4.45Å; L837-V855 HydrophobicContact CD1-CG2 4.33Å; L837-M858 HydrophobicContact CB-CE 4.46Å; L837-M858 HydrophobicContact CD1-CB 4.37Å; L837-M858 HydrophobicContact CD1-CE 4.1Å; L837-M858 HydrophobicContact CD1-SD 3.95Å; L837-M858 HydrophobicContact CD2-CB 3.89Å; L837-L859 HydrophobicContact CD2-CD2 4.09Å; L837-L859 HydrophobicContact CD2-CG 3.82Å; L837-I862 HydrophobicContact CD2-CD1 3.86Å
838	M	86.7	Confident	81	Confident	51 Å²	51	65.6 Å²	65.6	25%	0.251	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-46.5	176.2	-67.9	173.8	83.1	0	0	111.1	F830 C834 W835 Q836 A840 C841 W842	F830-M838 HydrophobicContact CD2-SD 4.36Å; F830-M838 HydrophobicContact CE2-CE 4.45Å; F830-M838 HydrophobicContact CE2-SD 4.35Å; C834-M838 VanDerWaalsContact O-CG 3.26Å; C834-M838 WeakPolarHBondContact O-CG 3.42Å; C834-M838 PolarHBondContact O-N 2.97Å; C834-M838 VanDerWaalsContact O-N 3.09Å; W835-M838 HydrophobicContact CE3-SD 4.39Å; W835-M838 WeakPolarHBondContact O-CB 3.14Å; W835-M838 PolarHBondContact O-N 2.89Å; W835-M838 VanDerWaalsContact O-N 3.14Å; Q836-M838 VanDerWaalsContact C-N 3.35Å; M838-A840 VanDerWaalsContact C-N 3.34Å; M838-A840 PolarHBondContact O-N 2.98Å; M838-C841 WeakPolarHBondContact O-CB 3.41Å; M838-C841 PolarHBondContact O-N 3.35Å; M838-C841 VanDerWaalsContact O-N 3.16Å; M838-W842 HydrophobicContact CB-CE3 4.08Å; M838-W842 HydrophobicContact CB-CH2 3.92Å; M838-W842 HydrophobicContact CB-CZ2 4.35Å; M838-W842 HydrophobicContact CB-CZ3 3.76Å; M838-W842 HydrophobicContact CE-CH2 3.38Å; M838-W842 HydrophobicContact CE-CZ2 3.7Å; M838-W842 HydrophobicContact CE-CZ3 4.32Å; M838-W842 VanDerWaalsContact O-CD2 3.22Å; M838-W842 VanDerWaalsContact O-CG 3.3Å; M838-W842 PolarHBondContact O-N 3.34Å; M838-W842 HydrophobicContact SD-CH2 4.43Å
839	E	85.6	Confident	81.3	Confident	66 Å²	66	63 Å²	63	31%	0.308	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-40.6	177.5	-69.5	-162.1	122.6	0	0	113	R823 W835 Q836 C841 W842 D843	R823-E839 IonicContact NH1-OE1 3.1Å; R823-E839 PolarHBondContact NH1-OE1 2.88Å; W835-E839 HydrophobicContact CZ2-CG 4.39Å; W835-E839 VanDerWaalsContact NE1-CD 3.32Å; W835-E839 WeakPolarHBondContact O-CG 3.43Å; W835-E839 PolarHBondContact O-N 2.74Å; Q836-E839 PolarHBondContact O-N 2.71Å; E839-C841 VanDerWaalsContact C-N 3.34Å; E839-W842 CarbonylContact O-C 3.46Å; E839-W842 PolarHBondContact O-N 3.47Å; E839-W842 VanDerWaalsContact O-N 3.15Å; E839-D843 PolarHBondContact O-N 2.98Å
840	A	87.1	Confident	81.8	Confident	37 Å²	37	61.1 Å²	61.1	31%	0.306	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-38.8	175.1	0	0	0	0	0	111.9	Q836 L837 M838 W842 D843 P850	Q836-A840 WeakPolarHBondContact O-CB 3.2Å; Q836-A840 PolarHBondContact O-N 2.94Å; L837-A840 PolarHBondContact O-N 3.12Å; M838-A840 VanDerWaalsContact C-N 3.34Å; M838-A840 PolarHBondContact O-N 2.98Å; A840-W842 PolarHBondContact O-N 3Å; A840-D843 PolarHBondContact O-N 3.42Å; A840-P850 HydrophobicContact CB-CG 4.16Å; A840-P850 WeakPolarHBondContact O-CD 2.96Å
841	C	85.3	Confident	82	Confident	49 Å²	49	65.7 Å²	65.7	33%	0.331	35%	0.346	S	S	.	.	H	α-helix	trans	-65.4	-28.6	174.2	-66.2	0	0	0	0	112.6	L837 M838 E839	L837-C841 PolarHBondContact O-N 3.27Å; L837-C841 PolarHBondContact O-SG 3.35Å; M838-C841 WeakPolarHBondContact O-CB 3.41Å; M838-C841 PolarHBondContact O-N 3.35Å; M838-C841 VanDerWaalsContact O-N 3.16Å; E839-C841 VanDerWaalsContact C-N 3.34Å
842	W	83.4	Confident	82.1	Confident	49 Å²	49	65.7 Å²	65.7	19%	0.186	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	11.4	-179.8	-64.4	-39.4	0	0	0	114.6	E817 P824 W835 M838 E839 A840 G844	E817-W842 PolarHBondContact OE1-NE1 2.97Å; P824-W842 HydrophobicContact CB-CH2 4.29Å; P824-W842 HydrophobicContact CG-CH2 3.67Å; P824-W842 HydrophobicContact CG-CZ2 3.87Å; P824-W842 HydrophobicContact CG-CZ3 4.48Å; W835-W842 HydrophobicContact CH2-CZ3 4.16Å; W835-W842 HydrophobicContact CZ3-CZ3 4.22Å; M838-W842 HydrophobicContact CB-CE3 4.08Å; M838-W842 HydrophobicContact CB-CH2 3.92Å; M838-W842 HydrophobicContact CB-CZ2 4.35Å; M838-W842 HydrophobicContact CB-CZ3 3.76Å; M838-W842 HydrophobicContact CE-CH2 3.38Å; M838-W842 HydrophobicContact CE-CZ2 3.7Å; M838-W842 HydrophobicContact CE-CZ3 4.32Å; M838-W842 VanDerWaalsContact O-CD2 3.22Å; M838-W842 VanDerWaalsContact O-CG 3.3Å; M838-W842 PolarHBondContact O-N 3.34Å; M838-W842 HydrophobicContact SD-CH2 4.43Å; E839-W842 CarbonylContact O-C 3.46Å; E839-W842 PolarHBondContact O-N 3.47Å; E839-W842 VanDerWaalsContact O-N 3.15Å; A840-W842 PolarHBondContact O-N 3Å; W842-G844 PolarHBondContact O-N 2.05Å
843	D	81	Confident	81.8	Confident	50 Å²	50	63 Å²	63	27%	0.267	34%	0.344	S	S	.	.			trans	-57.2	136.6	179.2	-159.1	-54.5	0	0	0	110.8	E839 A840 D845 K848 R849	E839-D843 PolarHBondContact O-N 2.98Å; A840-D843 PolarHBondContact O-N 3.42Å; D843-D845 PolarHBondContact O-N 2.92Å; D843-D845 PolarHBondContact OD1-N 3.03Å; D843-K848 HydrophobicContact CB-CB 4.23Å; D843-K848 WeakPolarHBondContact OD2-CB 3.37Å; D843-R849 HydrophobicContact CB-CG 4.03Å; D843-R849 VanDerWaalsContact O-CZ 3.26Å; D843-R849 PolarHBondContact O-NE 3.31Å; D843-R849 PolarHBondContact O-NH2 2.82Å
844	G	67.6	Low	82	Confident	46 Å²	46	64.6 Å²	64.6	47%	0.474	35%	0.353	S	S	.	.	S	Bend	trans	-67.5	-26.7	178.2	0	0	0	0	0	112.5	W842 P846	W842-G844 PolarHBondContact O-N 2.05Å; G844-P846 WeakPolarHBondContact O-CD 3.45Å
845	D	71.8	Confident	82.2	Confident	57 Å²	57	64.7 Å²	64.7	31%	0.305	35%	0.354	S	S	.	.	S	Bend	trans	-90.5	112.5	173.2	-175.5	-8.3	0	0	0	110.3	D843 L847 K848	D843-D845 PolarHBondContact O-N 2.92Å; D843-D845 PolarHBondContact OD1-N 3.03Å; D845-L847 PolarHBondContact O-N 2.9Å; D845-L847 VanDerWaalsContact O-N 3.12Å; D845-L847 WeakPolarHBondContact OD1-CB 3.3Å; D845-L847 PolarHBondContact OD1-N 3.13Å; D845-K848 HydrophobicContact CB-CB 4.27Å; D845-K848 HydrophobicContact CB-CD 3.92Å; D845-K848 HydrophobicContact CB-CG 3.97Å; D845-K848 PolarHBondContact O-N 2.93Å; D845-K848 WeakPolarHBondContact OD2-CE 3.15Å
846	P	68.9	Low	82.3	Confident	87 Å²	87	64 Å²	64	57%	0.565	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.4	178.7	-23.7	34.4	0	0	0	114	G844 K848 R849	G844-P846 WeakPolarHBondContact O-CD 3.45Å; P846-K848 VanDerWaalsContact C-N 3.27Å; P846-K848 PolarHBondContact O-N 3.14Å; P846-R849 PolarHBondContact O-N 3.1Å
847	L	71.8	Confident	82.4	Confident	163 Å²	163	62.4 Å²	62.4	85%	0.853	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.3	179.7	-64.7	174.3	0	0	0	112.9	D845	D845-L847 PolarHBondContact O-N 2.9Å; D845-L847 VanDerWaalsContact O-N 3.12Å; D845-L847 WeakPolarHBondContact OD1-CB 3.3Å; D845-L847 PolarHBondContact OD1-N 3.13Å
848	K	77.1	Confident	82.5	Confident	136 Å²	136	64.9 Å²	64.9	59%	0.591	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.4	177.9	-65.5	-177	-171.8	170.7	0	113.2	D843 D845 P846	D843-K848 HydrophobicContact CB-CB 4.23Å; D843-K848 WeakPolarHBondContact OD2-CB 3.37Å; D845-K848 HydrophobicContact CB-CB 4.27Å; D845-K848 HydrophobicContact CB-CD 3.92Å; D845-K848 HydrophobicContact CB-CG 3.97Å; D845-K848 PolarHBondContact O-N 2.93Å; D845-K848 WeakPolarHBondContact OD2-CE 3.15Å; P846-K848 VanDerWaalsContact C-N 3.27Å; P846-K848 PolarHBondContact O-N 3.14Å
849	R	83.3	Confident	82.8	Confident	81 Å²	81	63.4 Å²	63.4	31%	0.306	36%	0.355	S	S	.	.	S	Bend	trans	-65.8	138.6	178.2	-64.2	-179.4	-169.8	159	4.3	110.2	D843 P846	D843-R849 HydrophobicContact CB-CG 4.03Å; D843-R849 VanDerWaalsContact O-CZ 3.26Å; D843-R849 PolarHBondContact O-NE 3.31Å; D843-R849 PolarHBondContact O-NH2 2.82Å; P846-R849 PolarHBondContact O-N 3.1Å
850	P	84.6	Confident	83.1	Confident	32 Å²	32	66.3 Å²	66.3	21%	0.208	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-65.8	141	179.2	27.6	-34.3	0	0	0	110.7	A840 V855	A840-P850 HydrophobicContact CB-CG 4.16Å; A840-P850 WeakPolarHBondContact O-CD 2.96Å; P850-V855 HydrophobicContact CB-CG2 3.84Å; P850-V855 HydrophobicContact CG-CG2 3.61Å
851	L	84.1	Confident	83.3	Confident	130 Å²	130	66.9 Å²	66.9	68%	0.681	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-64	146.2	171.4	-63.1	175.7	0	0	0	110	G853 I854 V855	L851-G853 PolarHBondContact O-N 3.27Å; L851-I854 WeakPolarHBondContact O-CA 3.19Å; L851-I854 WeakPolarHBondContact O-CB 3.48Å; L851-I854 PolarHBondContact O-N 3.02Å; L851-V855 PolarHBondContact O-N 3.01Å; L851-V855 VanDerWaalsContact O-N 3.11Å
852	L	84	Confident	83.5	Confident	40 Å²	40	64.5 Å²	64.5	21%	0.209	35%	0.349	C	S	.	.	H	α-helix	trans	-58.3	-24.9	178.7	-64.6	169.2	0	0	0	113.2	V760 I763 R764 I854 V855 Q856	V760-L852 HydrophobicContact CG1-CB 4.46Å; V760-L852 HydrophobicContact CG1-CD2 4.18Å; V760-L852 HydrophobicContact CG2-CD2 4.48Å; I763-L852 HydrophobicContact CB-CD1 4.04Å; I763-L852 HydrophobicContact CG2-CD1 3.43Å; I763-L852 VanDerWaalsContact CG2-CD1 3.43Å; R764-L852 HydrophobicContact CG-CB 3.51Å; R764-L852 HydrophobicContact CG-CD1 3.94Å; R764-L852 HydrophobicContact CG-CG 4.34Å; L852-I854 PolarHBondContact O-N 3.29Å; L852-V855 PolarHBondContact O-N 3.37Å; L852-Q856 PolarHBondContact O-N 3.02Å; L852-Q856 VanDerWaalsContact O-N 3.1Å
853	G	80.2	Confident	83.8	Confident	39 Å²	39	63.5 Å²	63.5	40%	0.402	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-21.9	172.1	0	0	0	0	0	114.6	L851 P857	L851-G853 PolarHBondContact O-N 3.27Å; G853-P857 WeakPolarHBondContact O-CD 3.37Å; G853-P857 VanDerWaalsContact O-CG 3.32Å; G853-P857 WeakPolarHBondContact O-CG 3.48Å
854	I	87.9	Confident	84.1	Confident	91 Å²	91	65.2 Å²	65.2	47%	0.467	36%	0.356	S	S	.	.	H	α-helix	trans	-95.4	-42.4	175.1	-58.4	173.4	0	0	0	110.1	L851 L852 Q856 P857 M858	L851-I854 WeakPolarHBondContact O-CA 3.19Å; L851-I854 WeakPolarHBondContact O-CB 3.48Å; L851-I854 PolarHBondContact O-N 3.02Å; L852-I854 PolarHBondContact O-N 3.29Å; I854-Q856 VanDerWaalsContact C-N 3.35Å; I854-Q856 PolarHBondContact O-N 3.44Å; I854-P857 WeakPolarHBondContact O-CD 3.44Å; I854-M858 HydrophobicContact CG2-CG 4.47Å; I854-M858 HydrophobicContact CG2-SD 3.83Å; I854-M858 WeakPolarHBondContact O-CG 3.28Å; I854-M858 PolarHBondContact O-N 3.21Å
855	V	89.8	Confident	85	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.055	35%	0.35	C	S	.	.	H	α-helix	trans	-59.3	-43.8	-179.1	177.6	0	0	0	0	111.8	V760 L837 P850 L851 L852 M858 L859	V760-V855 HydrophobicContact CG2-CG1 4.2Å; L837-V855 HydrophobicContact CD1-CG1 4.45Å; L837-V855 HydrophobicContact CD1-CG2 4.33Å; P850-V855 HydrophobicContact CB-CG2 3.84Å; P850-V855 HydrophobicContact CG-CG2 3.61Å; L851-V855 PolarHBondContact O-N 3.01Å; L851-V855 VanDerWaalsContact O-N 3.11Å; L852-V855 PolarHBondContact O-N 3.37Å; V855-M858 PolarHBondContact O-N 2.91Å; V855-L859 HydrophobicContact CG1-CD1 3.71Å; V855-L859 HydrophobicContact CG1-CG 4.31Å; V855-L859 WeakPolarHBondContact O-CB 3.36Å; V855-L859 PolarHBondContact O-N 3.3Å
856	Q	90.1	Very high	85.5	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.075	34%	0.344	C	S	.	.	H	α-helix	trans	-65	-49.7	-175.8	-169.9	-177.2	9.1	0	0	113.4	L757 V760 R764 L852 I854 M858 L859 R860	L757-Q856 HydrophobicContact CD2-CG 4.05Å; V760-Q856 HydrophobicContact CG1-CB 3.69Å; V760-Q856 HydrophobicContact CG1-CG 4.15Å; R764-Q856 VanDerWaalsContact CD-OE1 3.22Å; L852-Q856 PolarHBondContact O-N 3.02Å; L852-Q856 VanDerWaalsContact O-N 3.1Å; I854-Q856 VanDerWaalsContact C-N 3.35Å; I854-Q856 PolarHBondContact O-N 3.44Å; Q856-M858 VanDerWaalsContact C-N 3.32Å; Q856-M858 PolarHBondContact O-N 3.44Å; Q856-L859 PolarHBondContact O-N 3.46Å; Q856-R860 WeakPolarHBondContact O-CG 3.4Å; Q856-R860 PolarHBondContact O-N 3.07Å; Q856-R860 VanDerWaalsContact O-N 3.07Å
857	P	91.4	Very high	85.8	Confident	72 Å²	72	63.5 Å²	63.5	47%	0.468	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-40.7	173	-26.2	33.8	0	0	0	113.9	G853 I854 R860 S861	G853-P857 WeakPolarHBondContact O-CD 3.37Å; G853-P857 VanDerWaalsContact O-CG 3.32Å; G853-P857 WeakPolarHBondContact O-CG 3.48Å; I854-P857 WeakPolarHBondContact O-CD 3.44Å; P857-R860 PolarHBondContact O-N 3.08Å; P857-S861 PolarHBondContact O-N 2.94Å
858	M	91.8	Very high	85.7	Confident	61 Å²	61	62.1 Å²	62.1	30%	0.3	31%	0.314	S	S	.	.	H	α-helix	trans	-64.6	-46.3	178.5	-69.5	-177.7	70.5	0	0	111.8	L837 I854 V855 Q856 R860 S861 I862	L837-M858 HydrophobicContact CB-CE 4.46Å; L837-M858 HydrophobicContact CD1-CB 4.37Å; L837-M858 HydrophobicContact CD1-CE 4.1Å; L837-M858 HydrophobicContact CD1-SD 3.95Å; L837-M858 HydrophobicContact CD2-CB 3.89Å; I854-M858 HydrophobicContact CG2-CG 4.47Å; I854-M858 HydrophobicContact CG2-SD 3.83Å; I854-M858 WeakPolarHBondContact O-CG 3.28Å; I854-M858 PolarHBondContact O-N 3.21Å; V855-M858 PolarHBondContact O-N 2.91Å; Q856-M858 VanDerWaalsContact C-N 3.32Å; Q856-M858 PolarHBondContact O-N 3.44Å; M858-R860 VanDerWaalsContact C-N 3.3Å; M858-R860 PolarHBondContact O-N 2.94Å; M858-S861 WeakPolarHBondContact O-CB 3.5Å; M858-S861 PolarHBondContact O-N 3.3Å; M858-I862 WeakPolarHBondContact O-CD1 3.08Å; M858-I862 WeakPolarHBondContact O-CG1 3.41Å; M858-I862 PolarHBondContact O-N 2.9Å
859	L	91.3	Very high	84.7	Confident	20 Å²	20	60.1 Å²	60.1	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-40.1	174.6	-82.5	166.8	0	0	0	112.5	L753 A756 L757 V760 L837 V855 Q856 I862 M863	L753-L859 HydrophobicContact CD2-CD2 4.41Å; A756-L859 HydrophobicContact CB-CD1 4.41Å; A756-L859 HydrophobicContact CB-CD2 4.44Å; L757-L859 HydrophobicContact CD2-CB 3.54Å; L757-L859 HydrophobicContact CD2-CD1 4.47Å; L757-L859 HydrophobicContact CG-CB 4.18Å; V760-L859 HydrophobicContact CG2-CD1 3.91Å; L837-L859 HydrophobicContact CD2-CD2 4.09Å; L837-L859 HydrophobicContact CD2-CG 3.82Å; V855-L859 HydrophobicContact CG1-CD1 3.71Å; V855-L859 HydrophobicContact CG1-CG 4.31Å; V855-L859 WeakPolarHBondContact O-CB 3.36Å; V855-L859 PolarHBondContact O-N 3.3Å; Q856-L859 PolarHBondContact O-N 3.46Å; L859-I862 PolarHBondContact O-N 3.24Å; L859-M863 WeakPolarHBondContact O-CB 3.32Å; L859-M863 PolarHBondContact O-N 3.13Å
860	R	92	Very high	83.3	Confident	127 Å²	127	60.4 Å²	60.4	48%	0.479	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-45.7	176.1	-71.5	-174.3	-167.4	-151.3	4.8	111.4	L757 Q856 P857 M858 I862 M863 D864	L757-R860 HydrophobicContact CD1-CG 3.89Å; L757-R860 HydrophobicContact CD2-CG 3.55Å; L757-R860 HydrophobicContact CG-CG 4.4Å; Q856-R860 WeakPolarHBondContact O-CG 3.4Å; Q856-R860 PolarHBondContact O-N 3.07Å; Q856-R860 VanDerWaalsContact O-N 3.07Å; P857-R860 PolarHBondContact O-N 3.08Å; M858-R860 VanDerWaalsContact C-N 3.3Å; M858-R860 PolarHBondContact O-N 2.94Å; R860-I862 PolarHBondContact O-N 3.36Å; R860-M863 PolarHBondContact O-N 3.41Å; R860-D864 PolarHBondContact O-N 3.21Å
861	S	91.3	Very high	81.8	Confident	49 Å²	49	63.5 Å²	63.5	34%	0.343	35%	0.352	S	S	.	.	H	α-helix	trans	-57.6	-48.1	176	179.5	0	0	0	0	111.6	P857 M858 M863 D864 R865	P857-S861 PolarHBondContact O-N 2.94Å; M858-S861 WeakPolarHBondContact O-CB 3.5Å; M858-S861 PolarHBondContact O-N 3.3Å; S861-M863 PolarHBondContact O-N 3.23Å; S861-D864 PolarHBondContact O-N 3.41Å; S861-R865 WeakPolarHBondContact O-CG 3.4Å; S861-R865 PolarHBondContact O-N 3Å; S861-R865 VanDerWaalsContact O-N 3.09Å
862	I	90	Very high	80	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-59	-47.2	176.9	-68.6	159.9	0	0	0	110.7	L753 E833 C834 L837 M858 L859 R860 R865 L866	L753-I862 HydrophobicContact CD1-CG2 4.47Å; L753-I862 HydrophobicContact CD2-CG2 4.4Å; E833-I862 HydrophobicContact CG-CD1 4.35Å; E833-I862 HydrophobicContact CG-CG1 4.29Å; C834-I862 HydrophobicContact CB-CD1 4.25Å; C834-I862 HydrophobicContact CB-CG2 4.03Å; L837-I862 HydrophobicContact CD2-CD1 3.86Å; M858-I862 WeakPolarHBondContact O-CD1 3.08Å; M858-I862 WeakPolarHBondContact O-CG1 3.41Å; M858-I862 PolarHBondContact O-N 2.9Å; L859-I862 PolarHBondContact O-N 3.24Å; R860-I862 PolarHBondContact O-N 3.36Å; I862-R865 PolarHBondContact O-N 3.19Å; I862-L866 HydrophobicContact CG2-CD1 3.52Å; I862-L866 HydrophobicContact CG2-CG 4.21Å; I862-L866 WeakPolarHBondContact O-CB 3.33Å; I862-L866 WeakPolarHBondContact O-CG 3.36Å; I862-L866 PolarHBondContact O-N 2.97Å
863	M	89.4	Confident	78	Confident	27 Å²	27	71.3 Å²	71.3	13%	0.133	38%	0.384	C	S	.	.	H	α-helix	trans	-60.3	-49.5	178.6	-171.6	176.7	74.6	0	0	111.9	L753 Q754 L757 L859 R860 S861 R865 L866 C867	L753-M863 HydrophobicContact CB-CB 4.18Å; L753-M863 HydrophobicContact CB-CG 3.97Å; L753-M863 HydrophobicContact CB-SD 4.16Å; L753-M863 HydrophobicContact CD1-CB 4.22Å; L753-M863 HydrophobicContact CD1-CG 4.33Å; Q754-M863 HydrophobicContact CB-SD 4.33Å; L757-M863 HydrophobicContact CD1-CE 3.5Å; L757-M863 HydrophobicContact CD1-SD 3.61Å; L859-M863 WeakPolarHBondContact O-CB 3.32Å; L859-M863 PolarHBondContact O-N 3.13Å; R860-M863 PolarHBondContact O-N 3.41Å; S861-M863 PolarHBondContact O-N 3.23Å; M863-R865 VanDerWaalsContact C-N 3.26Å; M863-R865 PolarHBondContact O-N 3.23Å; M863-L866 PolarHBondContact O-N 3.1Å; M863-C867 VanDerWaalsContact O-CB 3.23Å; M863-C867 WeakPolarHBondContact O-CB 3.36Å; M863-C867 PolarHBondContact O-N 3.43Å; M863-C867 PolarHBondContact O-SG 3.25Å
864	D	88.2	Confident	76.1	Confident	87 Å²	87	74.3 Å²	74.3	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-59.2	-38.2	-180	-74.7	-15.4	0	0	0	111.9	R860 S861 K868	R860-D864 PolarHBondContact O-N 3.21Å; S861-D864 PolarHBondContact O-N 3.41Å; D864-K868 VanDerWaalsContact O-CB 3.28Å; D864-K868 WeakPolarHBondContact O-CB 3.42Å; D864-K868 VanDerWaalsContact O-CD 3.3Å; D864-K868 WeakPolarHBondContact O-CD 3.25Å; D864-K868 WeakPolarHBondContact O-CG 3.39Å; D864-K868 PolarHBondContact O-N 3.36Å
865	R	86.9	Confident	73.9	Confident	90 Å²	90	78.2 Å²	78.2	34%	0.34	42%	0.419	S	S	.	.	H	α-helix	trans	-73.4	-50.4	178.4	-69.4	-165.7	-43.5	-135.9	7.1	113	D831 E833 S861 I862 M863 C867 K868 C869	D831-R865 IonicContact OD2-CZ 2.71Å; D831-R865 IonicContact OD2-NH2 3.4Å; D831-R865 PolarHBondContact OD2-NH2 3.43Å; E833-R865 IonicContact OE1-NH1 2.97Å; E833-R865 IonicContact OE2-CZ 2.68Å; E833-R865 IonicContact OE2-NH1 3.04Å; E833-R865 PolarHBondContact OE2-NH1 2.74Å; E833-R865 IonicContact OE2-NH2 3.27Å; E833-R865 PolarHBondContact OE2-NH2 3.49Å; S861-R865 WeakPolarHBondContact O-CG 3.4Å; S861-R865 PolarHBondContact O-N 3Å; S861-R865 VanDerWaalsContact O-N 3.09Å; I862-R865 PolarHBondContact O-N 3.19Å; M863-R865 VanDerWaalsContact C-N 3.26Å; M863-R865 PolarHBondContact O-N 3.23Å; R865-C867 VanDerWaalsContact C-N 3.27Å; R865-C867 PolarHBondContact O-N 3.23Å; R865-K868 PolarHBondContact O-N 3Å; R865-C869 PolarHBondContact O-N 3.42Å
866	L	80.9	Confident	71.7	Confident	36 Å²	36	89.6 Å²	89.6	19%	0.188	46%	0.461	C	S	.	.	H	α-helix	trans	-66.9	-33	-176	-68	177.3	0	0	0	111.1	L749 L753 D831 I862 M863 S870	L749-L866 HydrophobicContact CD2-CB 4.26Å; L749-L866 HydrophobicContact CD2-CD1 3.99Å; L753-L866 HydrophobicContact CD1-CD1 4.12Å; D831-L866 HydrophobicContact CB-CD2 4.31Å; I862-L866 HydrophobicContact CG2-CD1 3.52Å; I862-L866 HydrophobicContact CG2-CG 4.21Å; I862-L866 WeakPolarHBondContact O-CB 3.33Å; I862-L866 WeakPolarHBondContact O-CG 3.36Å; I862-L866 PolarHBondContact O-N 2.97Å; M863-L866 PolarHBondContact O-N 3.1Å; L866-S870 PolarHBondContact O-OG 2.89Å; L866-S870 VanDerWaalsContact O-OG 3.07Å
867	C	76.3	Confident	69.3	Low	28 Å²	28	92.3 Å²	92.3	19%	0.189	49%	0.492	C	S	.	.	H	α-helix	trans	-78.9	-30.3	178.2	-56.9	0	0	0	0	112.8	M863 R865 S870	M863-C867 VanDerWaalsContact O-CB 3.23Å; M863-C867 WeakPolarHBondContact O-CB 3.36Å; M863-C867 PolarHBondContact O-N 3.43Å; M863-C867 PolarHBondContact O-SG 3.25Å; R865-C867 VanDerWaalsContact C-N 3.27Å; R865-C867 PolarHBondContact O-N 3.23Å; C867-S870 WeakPolarHBondContact CA-OG 3.02Å; C867-S870 PolarHBondContact O-OG 3.5Å
868	K	69.3	Low	67.2	Low	134 Å²	134	96.8 Å²	96.8	58%	0.583	51%	0.512	S	S	*	.	H	α-helix	trans	-70.6	-38.4	172.3	-77.7	173.2	-173.9	173.7	0	112.9	D864 R865 S870 S871	D864-K868 VanDerWaalsContact O-CB 3.28Å; D864-K868 WeakPolarHBondContact O-CB 3.42Å; D864-K868 VanDerWaalsContact O-CD 3.3Å; D864-K868 WeakPolarHBondContact O-CD 3.25Å; D864-K868 WeakPolarHBondContact O-CG 3.39Å; D864-K868 PolarHBondContact O-N 3.36Å; R865-K868 PolarHBondContact O-N 3Å; K868-S870 PolarHBondContact O-N 2.67Å; K868-S871 PolarHBondContact O-N 3.2Å; K868-S871 PolarHBondContact O-OG 3.24Å
869	C	57	Low	64.7	Low	94 Å²	94	101.1 Å²	101.1	64%	0.635	54%	0.536	S	S	*	.	H	α-helix	trans	-64.3	-29.2	176.1	-77.9	0	0	0	0	112.9	R865	R865-C869 PolarHBondContact O-N 3.42Å
870	S	53.9	Low	62.3	Low	87 Å²	87	106.7 Å²	106.7	61%	0.608	57%	0.566	S	S	*	*	H	α-helix	trans	-77	-19.1	176.8	33.8	0	0	0	0	114.8	L866 C867 K868	L866-S870 PolarHBondContact O-OG 2.89Å; L866-S870 VanDerWaalsContact O-OG 3.07Å; C867-S870 WeakPolarHBondContact CA-OG 3.02Å; C867-S870 PolarHBondContact O-OG 3.5Å; K868-S870 PolarHBondContact O-N 2.67Å
871	S	52.3	Low	59.9	Low	96 Å²	96	106.2 Å²	106.2	67%	0.671	58%	0.582	S	S	*	*	H	α-helix	trans	-90.9	-9.9	176.2	55.5	0	0	0	0	113.9	K868	K868-S871 PolarHBondContact O-N 3.2Å; K868-S871 PolarHBondContact O-OG 3.24Å
872	E	46.2	Very low	57.4	Low	158 Å²	158	113.3 Å²	113.3	74%	0.738	62%	0.624	S	S	*	*			trans	-104.8	25	179.8	-70.2	-171.7	167.6	0	0	114.3	P874	E872-P874 WeakPolarHBondContact O-CD 3.42Å
873	Q	41.1	Very low	55.8	Low	176 Å²	176	119 Å²	119	82%	0.822	66%	0.655	S	S	*	*			trans	-91.6	95.5	160.6	-77.2	-157.3	-12.1	0	0	110.5
874	P	40.8	Very low	54	Low	103 Å²	103	123.8 Å²	123.8	67%	0.669	68%	0.682	S	S	*	*			trans	-72.5	142	164.3	31.2	-31.9	0	0	0	109	E872 R876	E872-P874 WeakPolarHBondContact O-CD 3.42Å; P874-R876 PolarHBondContact O-N 3.47Å
875	N	41.6	Very low	52.1	Low	173 Å²	173	125.9 Å²	125.9	93%	0.925	70%	0.695	S	S	*	*			trans	-22.5	104.1	160.2	-90.5	-18.9	0	0	0	112.3
876	R	43.5	Very low	50.1	Low	248 Å²	248	128 Å²	128	94%	0.936	72%	0.715	S	S	*	*			trans	-120.9	99.1	157.2	-84	-169.3	176	-175.8	0.5	107	P874	P874-R876 PolarHBondContact O-N 3.47Å
877	G	39.4	Very low	48.2	Very low	72 Å²	72	133.8 Å²	133.8	74%	0.742	75%	0.748	S	S	*	*	S	Bend	trans	163.1	22.6	174.5	0	0	0	0	0	116.9
878	L	47.3	Very low	46.3	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	79%	0.786	S	S	*	*			trans	-141.8	100.5	159.7	-81.9	167.4	0	0	0	107.4
879	D	40.8	Very low	44.6	Very low	152 Å²	152	141.3 Å²	141.3	81%	0.813	80%	0.8	S	S	*	*			trans	-162.5	95.7	147.5	-93.8	-7.2	0	0	0	103.3
880	D	41	Very low	43.7	Very low	137 Å²	137	144.9 Å²	144.9	73%	0.733	81%	0.813	S	S	*	*				88.1	96.7	88.8	-94.3	-5.1	0	0	0	111.5
881	S	40.8	Very low	42.8	Very low	118 Å²	118	149.8 Å²	149.8	83%	0.825	83%	0.83	S	S	*	*			trans	-97.9	80.5	141.7	53.6	0	0	0	0	107.9
882	T	39.3	Very low	42	Very low	198 Å²	198	154.6 Å²	154.6	100%	1.215	84%	0.844	S	S	*	*				-170.4	0	122.8	25.9	0	0	0	0	110.8

Retrieved 882 of 882 residues in 1827.2 ms (Link to these results)

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