A0A087X9Y7_POEFO Loading...

Tetratricopeptide repeat domain 13

AlphaFold DB , UniProt , Accession A0A087X9Y7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 826 aa.

						>A0A087X9Y7_POEFO|A0A087X9Y7
MAPASRAVAVVALSLLYLCGGIISTEFFSTLTLFNNELHKQGCSSLSEWEDYAADCESSVLQFEDPDCVEGSNPPCESVFSLNAEKILNQAKLFIEQKKIPFPVDNQNTNEELAICYVLIGNGLYDEAIKHFSLLLQSDPELVSAIYGRGIAYGKKSLQDMKNADLALYELNRVIALEPNWPEVYEQRAEILSPLGRISEALSDLTKAIQLQPSARLYRHRGTLLFISEDYVAAMEDFQSSLELKKNQPIAMLYKGLTFFHRGMLKEAIDAFKEALKLKSDFIDAYKSLGQAYRELGDFESAMESFQKALMLNQNHIQSLQLRGMMLYHHGSLQEAIGSFKRCLHLEPYNEVCQYMKGLSHVAMGQFYEGIKAQTKVMLNDPLLGQKASSEYLKVKYLREYSRYLHSHLDIPVAEYNVDQDLPGNFKNHWAKNLPFLIEDYEEQPGLQPHIKDVLPQNFDSYSTEVQKLICTADHLGALMQYDTPGFLPNKRIHRAMGLATLEVMQAMHRTWSSSKVRVNGKTRQMQWRDMFDIAVKWRRIADPDQPVLWLDQMPARSLSRGFNNHINLIRGQIINIRYLAYFDSILEFIKDRILVYHGAYNPRGLLEVRQALENVNKVEDLLPIMKQFNSKTRDGFTVNSKVPSVKDPGKEYDGFTITITGDRVGNMLFSVETQTTEERTQQYQSEIENIYKDLTVKGKALMLSTELGDSDAVCNLILSLIYYFCNLMPLSRGSSVVAYSVVMGALMASGKEVIGRIPKGKLVDFEAMTAPSPENFSKTAKSWMNLKSSPSWYRSLPSVAETFPSIRTMIEVLNTDSSSHCPKKS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.1	Very low	26.1	Very low	248 Å²	248	131.2 Å²	131.2	100%	1.222	80%	0.802	S	S	*	*				0	116.2	0	-80.7	171.8	168.1	0	0	107.8
2	A	21.2	Very low	26	Very low	93 Å²	93	126 Å²	126	77%	0.769	78%	0.783	S	S	*	*			trans	-74.9	-177.8	170.8	0	0	0	0	0	110.4
3	P	32.9	Very low	26	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	77%	0.772	S	S	*	*			cis	-132.4	161.4	3.7	32.5	-10.6	0	0	0	113.8
4	A	24.5	Very low	25.8	Very low	88 Å²	88	121.1 Å²	121.1	73%	0.727	75%	0.748	S	S	*	*			cis	79.4	112.1	36.9	0	0	0	0	0	115.9
5	S	23.6	Very low	25.6	Very low	117 Å²	117	121.2 Å²	121.2	82%	0.818	74%	0.741	S	S	*	*			trans	124.2	104.9	150.1	74.2	0	0	0	0	115.9
6	R	26.1	Very low	25.5	Very low	254 Å²	254	123 Å²	123	96%	0.958	74%	0.743	S	S	*	*	S	Bend	trans	164.6	70.9	150.8	-93.3	174.2	-174.7	-164.4	2.4	109.5
7	A	25.9	Very low	25.5	Very low	92 Å²	92	127.9 Å²	127.9	76%	0.76	75%	0.747	S	S	*	*	S	Bend	trans	-158.4	-0.1	168.5	0	0	0	0	0	115.5
8	V	26.3	Very low	25.3	Very low	128 Å²	128	128.6 Å²	128.6	78%	0.776	75%	0.746	S	S	*	*	S	Bend	trans	-110	-1.7	-170.5	-175.8	0	0	0	0	114	V10	V8-V10 PolarHBondContact O-N 3.1Å
9	A	25.6	Very low	25.1	Very low	82 Å²	82	128.3 Å²	128.3	68%	0.678	75%	0.751	S	S	*	*	S	Bend	trans	-85.3	-6.2	-176.4	0	0	0	0	0	115.7
10	V	27.8	Very low	25	Very low	123 Å²	123	125.5 Å²	125.5	75%	0.745	75%	0.751	S	S	*	*	S	Bend	trans	-103.3	-10.3	-173.1	-179.6	0	0	0	0	113.4	V8	V8-V10 PolarHBondContact O-N 3.1Å
11	V	25.7	Very low	24.9	Very low	100 Å²	100	122.3 Å²	122.3	61%	0.606	74%	0.744	S	S	*	*	S	Bend	trans	-102.3	-15.2	-176.7	-178.6	0	0	0	0	113.2	S14	V11-S14 PolarHBondContact O-OG 2.9Å; V11-S14 VanDerWaalsContact O-OG 3.13Å
12	A	23.9	Very low	24.7	Very low	69 Å²	69	116.6 Å²	116.6	57%	0.57	72%	0.717	S	S	*	*	S	Bend	trans	-85.9	-20.7	178.1	0	0	0	0	0	114.1
13	L	25.9	Very low	24.8	Very low	121 Å²	121	118 Å²	118	63%	0.634	71%	0.711	S	S	*	*	S	Bend	trans	-83.8	-19.2	178.4	-89.3	151.1	0	0	0	113.3	Y17	L13-Y17 WeakPolarHBondContact O-CD2 3.47Å
14	S	23.9	Very low	24.4	Very low	63 Å²	63	115 Å²	115	44%	0.441	69%	0.692	S	S	.	*	S	Bend	trans	-81.7	-15.1	176.4	39.2	0	0	0	0	114.3	V11	V11-S14 PolarHBondContact O-OG 2.9Å; V11-S14 VanDerWaalsContact O-OG 3.13Å
15	L	22.8	Very low	24.3	Very low	122 Å²	122	113.8 Å²	113.8	64%	0.639	68%	0.676	S	S	*	*	S	Bend	trans	-93.5	-16.2	-178	-86.4	156	0	0	0	114.2
16	L	24.3	Very low	24.5	Very low	150 Å²	150	112.6 Å²	112.6	79%	0.785	66%	0.657	S	S	*	*	S	Bend	trans	-84.6	-12.4	170.7	-82.2	159.9	0	0	0	113.2
17	Y	25.2	Very low	24.6	Very low	206 Å²	206	103.5 Å²	103.5	81%	0.808	63%	0.625	S	S	*	*	S	Bend	trans	-91.4	0.2	178.5	-90.5	-86.6	0	0	0	114.6	L13	L13-Y17 WeakPolarHBondContact O-CD2 3.47Å
18	L	21.7	Very low	24.8	Very low	140 Å²	140	102.3 Å²	102.3	73%	0.733	60%	0.602	S	S	*	*	S	Bend	trans	-105.3	-1	-177	-84.5	160.7	0	0	0	115.2
19	C	21.4	Very low	24.7	Very low	123 Å²	123	98.5 Å²	98.5	83%	0.831	58%	0.581	S	S	*	*	S	Bend	trans	-113.2	12.9	-177.9	-76.2	0	0	0	0	115.8
20	G	24	Very low	24.8	Very low	73 Å²	73	95.7 Å²	95.7	75%	0.753	56%	0.556	S	S	*	*			trans	-100.5	19	178.4	0	0	0	0	0	115.4
21	G	23.1	Very low	24.7	Very low	59 Å²	59	93.6 Å²	93.6	61%	0.608	54%	0.54	S	S	*	.			trans	-84.8	145.1	-173.8	0	0	0	0	0	113.6
22	I	23.3	Very low	24.8	Very low	128 Å²	128	91.4 Å²	91.4	66%	0.656	53%	0.527	S	S	*	.			trans	89.2	69.7	169.3	-43.3	163.5	0	0	0	114	R571	I22-R571 VanDerWaalsContact O-CZ 3.25Å; I22-R571 PolarHBondContact O-NH1 2.98Å; I22-R571 PolarHBondContact O-NH2 3.31Å
23	I	23.8	Very low	25.1	Very low	123 Å²	123	91.2 Å²	91.2	63%	0.631	52%	0.516	S	S	*	.			trans	-95.3	99.8	155.6	-58.8	172.4	0	0	0	106.1
24	S	23.3	Very low	25.3	Very low	53 Å²	53	89.4 Å²	89.4	37%	0.371	50%	0.503	S	S	.	.			trans	-145.5	73.1	175.5	67.9	0	0	0	0	110.3
25	T	23	Very low	25.5	Very low	63 Å²	63	89.5 Å²	89.5	39%	0.387	50%	0.499	S	S	.	.	S	Bend	trans	-144.2	148.1	150.1	39.4	0	0	0	0	104.9	F27	T25-F27 PolarHBondContact O-N 3.08Å
26	E	27.3	Very low	25.8	Very low	92 Å²	92	87.9 Å²	87.9	43%	0.43	49%	0.491	S	S	.	.	S	Bend	trans	-66.5	53	-176.3	-65.1	179.2	175.3	0	0	113.2	R294	E26-R294 IonicContact OE2-NH2 3.2Å
27	F	27.9	Very low	26	Very low	64 Å²	64	84.3 Å²	84.3	28%	0.281	47%	0.47	S	S	.	.			trans	-93.6	111.1	160.3	-73.1	-84.6	0	0	0	106	T25 S29 I574	T25-F27 PolarHBondContact O-N 3.08Å; F27-S29 PolarHBondContact O-N 3.23Å; F27-I574 HydrophobicContact CE1-CG2 3.79Å; F27-I574 HydrophobicContact CE2-CG2 3.92Å; F27-I574 HydrophobicContact CZ-CG2 3.46Å; F27-I574 VanDerWaalsContact CZ-CG2 3.46Å
28	F	29.8	Very low	26	Very low	66 Å²	66	79.9 Å²	79.9	29%	0.289	46%	0.46	S	S	.	.			trans	-49.6	119.7	163.6	-82.4	-84.4	0	0	0	107.2	T30 M325	F28-T30 PolarHBondContact O-N 3Å; F28-M325 HydrophobicContact CE2-CE 4.13Å; F28-M325 HydrophobicContact CZ-CE 3.98Å; F28-M325 HydrophobicContact CZ-SD 4.12Å
29	S	24.9	Very low	26.3	Very low	48 Å²	48	79.1 Å²	79.1	34%	0.336	45%	0.452	S	S	.	.			trans	-60.2	127.6	172.8	82.5	0	0	0	0	106.9	F27 L31 T32 L33	F27-S29 PolarHBondContact O-N 3.23Å; S29-L31 PolarHBondContact O-N 2.92Å; S29-L31 VanDerWaalsContact O-N 3.12Å; S29-T32 PolarHBondContact N-OG1 2.91Å; S29-T32 PolarHBondContact O-N 3.18Å; S29-T32 PolarHBondContact O-OG1 3.04Å; S29-T32 PolarHBondContact OG-N 3.26Å; S29-T32 VanDerWaalsContact OG-N 3.08Å; S29-T32 PolarHBondContact OG-OG1 3.1Å; S29-L33 PolarHBondContact O-N 2.74Å
30	T	28.4	Very low	26.5	Very low	24 Å²	24	77.9 Å²	77.9	15%	0.147	43%	0.433	C	S	.	.	H	α-helix	trans	-48	-33.1	168.6	32.4	0	0	0	0	110.5	F28 T32 L33 F34 F226 H261	F28-T30 PolarHBondContact O-N 3Å; T30-T32 PolarHBondContact O-N 3.03Å; T30-L33 WeakPolarHBondContact O-CB 3.37Å; T30-L33 PolarHBondContact O-N 2.95Å; T30-F34 WeakPolarHBondContact O-CB 3.34Å; T30-F34 PolarHBondContact O-N 2.98Å; T30-F226 HydrophobicContact CG2-CE1 4.38Å; T30-F226 HydrophobicContact CG2-CZ 4.28Å; T30-H261 WeakPolarHBondContact CG2-CE1 3.36Å; T30-H261 WeakPolarHBondContact CG2-NE2 3.31Å
31	L	25	Very low	26.7	Very low	78 Å²	78	79 Å²	79	41%	0.408	42%	0.419	S	S	.	.	H	α-helix	trans	-60.9	-31.2	171.7	-108.8	125.9	0	0	0	115.1	S29 N35	S29-L31 PolarHBondContact O-N 2.92Å; S29-L31 VanDerWaalsContact O-N 3.12Å; L31-N35 WeakPolarHBondContact O-CA 3.47Å; L31-N35 WeakPolarHBondContact O-CB 3.33Å; L31-N35 PolarHBondContact O-N 3.32Å; L31-N35 PolarHBondContact O-ND2 3.13Å
32	T	28.1	Very low	26.9	Very low	54 Å²	54	79.1 Å²	79.1	33%	0.331	42%	0.42	S	S	.	.	H	α-helix	trans	-78.5	-29.4	173.6	14.2	0	0	0	0	112.6	S29 T30 N36	S29-T32 PolarHBondContact N-OG1 2.91Å; S29-T32 PolarHBondContact O-N 3.18Å; S29-T32 PolarHBondContact O-OG1 3.04Å; S29-T32 PolarHBondContact OG-N 3.26Å; S29-T32 VanDerWaalsContact OG-N 3.08Å; S29-T32 PolarHBondContact OG-OG1 3.1Å; T30-T32 PolarHBondContact O-N 3.03Å; T32-N36 WeakPolarHBondContact O-CB 3.26Å; T32-N36 PolarHBondContact O-N 3.38Å
33	L	30.3	Very low	27.2	Very low	65 Å²	65	79 Å²	79	34%	0.34	43%	0.429	S	S	.	.	H	α-helix	trans	-67.1	-46.7	170	-106.7	143.5	0	0	0	109.9	S29 T30 E37	S29-L33 PolarHBondContact O-N 2.74Å; T30-L33 WeakPolarHBondContact O-CB 3.37Å; T30-L33 PolarHBondContact O-N 2.95Å; L33-E37 PolarHBondContact O-N 3.42Å
34	F	30.3	Very low	27.1	Very low	83 Å²	83	77.9 Å²	77.9	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-79.5	-34.3	-178.2	-129.2	-88.1	0	0	0	113.8	T30 E37 L38 I227	T30-F34 WeakPolarHBondContact O-CB 3.34Å; T30-F34 PolarHBondContact O-N 2.98Å; F34-E37 PolarHBondContact O-N 2.68Å; F34-L38 HydrophobicContact CD1-CD1 3.72Å; F34-L38 HydrophobicContact CD1-CG 4.11Å; F34-L38 HydrophobicContact CE1-CD1 4.32Å; F34-L38 WeakPolarHBondContact O-CB 3.4Å; F34-L38 PolarHBondContact O-N 3.28Å; F34-I227 HydrophobicContact CE2-CD1 4.39Å; F34-I227 HydrophobicContact CE2-CG1 4.44Å; F34-I227 HydrophobicContact CZ-CD1 4.15Å
35	N	27.7	Very low	27	Very low	66 Å²	66	79.4 Å²	79.4	35%	0.353	44%	0.442	S	S	.	.	H	α-helix	trans	-71.4	-30.6	175.3	-80.6	-14.1	0	0	0	112	L31 H39	L31-N35 WeakPolarHBondContact O-CA 3.47Å; L31-N35 WeakPolarHBondContact O-CB 3.33Å; L31-N35 PolarHBondContact O-N 3.32Å; L31-N35 PolarHBondContact O-ND2 3.13Å; N35-H39 WeakPolarHBondContact O-CB 3.33Å; N35-H39 PolarHBondContact O-N 3.34Å
36	N	28	Very low	27	Very low	88 Å²	88	82.8 Å²	82.8	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-71.2	-32.2	170.2	-94.4	-32.1	0	0	0	111.6	T32 K40	T32-N36 WeakPolarHBondContact O-CB 3.26Å; T32-N36 PolarHBondContact O-N 3.38Å; N36-K40 WeakPolarHBondContact O-CB 3.48Å; N36-K40 VanDerWaalsContact O-CG 3.3Å; N36-K40 WeakPolarHBondContact O-CG 3.3Å; N36-K40 PolarHBondContact O-N 2.88Å
37	E	28.5	Very low	26.8	Very low	74 Å²	74	81.8 Å²	81.8	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-72.3	-44.5	172.2	-76.2	-172.6	-177.4	0	0	112.3	L33 F34 H39 Q41	L33-E37 PolarHBondContact O-N 3.42Å; F34-E37 PolarHBondContact O-N 2.68Å; E37-H39 PolarHBondContact O-N 2.66Å; E37-Q41 VanDerWaalsContact O-CB 3.23Å; E37-Q41 WeakPolarHBondContact O-CB 3.49Å; E37-Q41 WeakPolarHBondContact O-CG 3.48Å; E37-Q41 PolarHBondContact O-N 3.23Å
38	L	27.1	Very low	26.7	Very low	114 Å²	114	84.6 Å²	84.6	60%	0.597	48%	0.475	S	S	*	.	H	α-helix	trans	-65.5	-36.4	175	-82.9	161.7	0	0	0	113	F34	F34-L38 HydrophobicContact CD1-CD1 3.72Å; F34-L38 HydrophobicContact CD1-CG 4.11Å; F34-L38 HydrophobicContact CE1-CD1 4.32Å; F34-L38 WeakPolarHBondContact O-CB 3.4Å; F34-L38 PolarHBondContact O-N 3.28Å
39	H	26.7	Very low	26.5	Very low	123 Å²	123	90 Å²	90	57%	0.569	49%	0.494	S	S	*	.	H	α-helix	trans	-88	-25.4	179.2	-79.8	-54.8	0	0	0	114.5	N35 E37	N35-H39 WeakPolarHBondContact O-CB 3.33Å; N35-H39 PolarHBondContact O-N 3.34Å; E37-H39 PolarHBondContact O-N 2.66Å
40	K	26.8	Very low	26.5	Very low	97 Å²	97	93.3 Å²	93.3	42%	0.422	50%	0.503	S	S	.	.	H	α-helix	trans	-84.6	-21.2	172.6	-72.7	179.7	176.4	176.9	0	113.6	N36 G42 E347	N36-K40 WeakPolarHBondContact O-CB 3.48Å; N36-K40 VanDerWaalsContact O-CG 3.3Å; N36-K40 WeakPolarHBondContact O-CG 3.3Å; N36-K40 PolarHBondContact O-N 2.88Å; K40-G42 PolarHBondContact O-N 2.62Å; K40-E347 WeakPolarHBondContact CE-OE1 3.34Å; K40-E347 IonicContact NZ-OE1 3.66Å; K40-E347 PolarHBondContact NZ-OE1 3.44Å; K40-E347 IonicContact NZ-OE2 2.92Å; K40-E347 PolarHBondContact NZ-OE2 3.14Å
41	Q	28	Very low	26.4	Very low	97 Å²	97	98.9 Å²	98.9	45%	0.453	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	25.7	173.4	-67.1	-177.9	-16.2	0	0	113.4	E37 C43	E37-Q41 VanDerWaalsContact O-CB 3.23Å; E37-Q41 WeakPolarHBondContact O-CB 3.49Å; E37-Q41 WeakPolarHBondContact O-CG 3.48Å; E37-Q41 PolarHBondContact O-N 3.23Å; Q41-C43 PolarHBondContact O-N 3.02Å
42	G	26.2	Very low	26.9	Very low	61 Å²	61	99 Å²	99	63%	0.629	53%	0.528	S	S	*	.	S	Bend	trans	-68.9	82.9	148.3	0	0	0	0	0	109.6	K40	K40-G42 PolarHBondContact O-N 2.62Å
43	C	30.5	Very low	26.9	Very low	126 Å²	126	98.4 Å²	98.4	85%	0.851	53%	0.528	S	S	*	.	S	Bend	trans	54.1	78.2	168.1	-67.2	0	0	0	0	116.8	Q41	Q41-C43 PolarHBondContact O-N 3.02Å
44	S	21.1	Very low	26.7	Very low	99 Å²	99	98.2 Å²	98.2	69%	0.692	54%	0.536	S	S	*	.	S	Bend	trans	-169.2	122.9	135.6	56.3	0	0	0	0	111.3
45	S	20.9	Very low	26.7	Very low	85 Å²	85	99.6 Å²	99.6	59%	0.594	55%	0.547	S	S	*	.			trans	91.1	86.2	176.3	89.4	0	0	0	0	116.8	S47	S45-S47 PolarHBondContact O-N 3.24Å
46	L	23.8	Very low	26.7	Very low	134 Å²	134	98.8 Å²	98.8	70%	0.702	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.1	165.4	-101.7	82.6	0	0	0	113.9	E48 W49 E50	L46-E48 PolarHBondContact O-N 3.44Å; L46-W49 PolarHBondContact O-N 3.16Å; L46-E50 WeakPolarHBondContact CD2-OE1 3.4Å; L46-E50 WeakPolarHBondContact O-CG 3.46Å; L46-E50 PolarHBondContact O-N 2.71Å
47	S	23.1	Very low	26.9	Very low	71 Å²	71	98.2 Å²	98.2	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-74.3	-21.4	-166.1	58.9	0	0	0	0	115.7	S45	S45-S47 PolarHBondContact O-N 3.24Å
48	E	25.8	Very low	27.4	Very low	124 Å²	124	95.1 Å²	95.1	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-92.3	-3.1	-179.3	-73.8	-172.8	169.7	0	0	113.7	L46 Y52	L46-E48 PolarHBondContact O-N 3.44Å; E48-Y52 WeakPolarHBondContact O-CD2 3.35Å
49	W	25.1	Very low	27.9	Very low	180 Å²	180	93.7 Å²	93.7	68%	0.682	53%	0.527	S	S	*	.	H	α-helix	trans	-106.9	-21.4	167.3	-89.7	5.1	0	0	0	112.6	L46 Y52 A53	L46-W49 PolarHBondContact O-N 3.16Å; W49-Y52 CarbonylContact O-C 3.55Å; W49-Y52 PolarHBondContact O-N 3.01Å; W49-A53 WeakPolarHBondContact O-CB 3.23Å; W49-A53 PolarHBondContact O-N 3.48Å
50	E	25.2	Very low	28.5	Very low	116 Å²	116	89 Å²	89	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-41.4	177.8	-78.8	170.1	165	0	0	112.4	L46 Y52 A53	L46-E50 WeakPolarHBondContact CD2-OE1 3.4Å; L46-E50 WeakPolarHBondContact O-CG 3.46Å; L46-E50 PolarHBondContact O-N 2.71Å; E50-Y52 PolarHBondContact O-N 3.44Å; E50-A53 PolarHBondContact O-N 3.43Å
51	D	26.4	Very low	29.1	Very low	141 Å²	141	84.8 Å²	84.8	75%	0.754	49%	0.489	S	S	*	.	H	α-helix	trans	-70.7	-15.2	176.2	-83.9	-13.2	0	0	0	114
52	Y	35.3	Very low	29.6	Very low	82 Å²	82	83.8 Å²	83.8	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-112.3	-5.7	179.6	-61.8	-73.2	0	0	0	113.8	E48 W49 E50 I250 K279	E48-Y52 WeakPolarHBondContact O-CD2 3.35Å; W49-Y52 CarbonylContact O-C 3.55Å; W49-Y52 PolarHBondContact O-N 3.01Å; E50-Y52 PolarHBondContact O-N 3.44Å; Y52-I250 HydrophobicContact CD1-CD1 3.72Å; Y52-I250 HydrophobicContact CE1-CD1 4.28Å; Y52-K279 PolarHBondContact OH-NZ 2.9Å
53	A	27.5	Very low	30.1	Very low	41 Å²	41	84 Å²	84	34%	0.339	47%	0.468	S	S	.	.	H	α-helix	trans	-79	-24	172.1	0	0	0	0	0	112.2	W49 E50 D55 C56 E57	W49-A53 WeakPolarHBondContact O-CB 3.23Å; W49-A53 PolarHBondContact O-N 3.48Å; E50-A53 PolarHBondContact O-N 3.43Å; A53-D55 PolarHBondContact O-N 2.91Å; A53-D55 VanDerWaalsContact O-N 3.14Å; A53-C56 CarbonylContact O-C 3.57Å; A53-C56 WeakPolarHBondContact O-CA 3.2Å; A53-C56 PolarHBondContact O-N 2.87Å; A53-E57 PolarHBondContact O-N 3.41Å; A53-E57 VanDerWaalsContact O-N 3.08Å
54	A	27.3	Very low	30.1	Very low	60 Å²	60	86.4 Å²	86.4	50%	0.496	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.3	-179.2	0	0	0	0	0	113.5	Q62	A54-Q62 PolarHBondContact O-NE2 3.14Å
55	D	29.4	Very low	30.6	Very low	112 Å²	112	86.3 Å²	86.3	60%	0.599	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-4.5	174.9	-90.6	-20.6	0	0	0	113.9	A53	A53-D55 PolarHBondContact O-N 2.91Å; A53-D55 VanDerWaalsContact O-N 3.14Å
56	C	29.1	Very low	31.1	Very low	50 Å²	50	87.1 Å²	87.1	34%	0.338	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-4.5	-178.1	-65.9	0	0	0	0	113.9	A53 R216 R219	A53-C56 CarbonylContact O-C 3.57Å; A53-C56 WeakPolarHBondContact O-CA 3.2Å; A53-C56 PolarHBondContact O-N 2.87Å; C56-R216 PolarHBondContact O-NH2 3.09Å; C56-R219 PolarHBondContact SG-NH2 3.24Å
57	E	32.1	Very low	31.6	Very low	75 Å²	75	87.1 Å²	87.1	35%	0.35	46%	0.462	S	S	.	.	S	Bend	trans	-68.7	137.3	168.6	-69.8	-168.5	152.5	0	0	110.5	A53 S59 Q62 R216	A53-E57 PolarHBondContact O-N 3.41Å; A53-E57 VanDerWaalsContact O-N 3.08Å; E57-S59 PolarHBondContact O-N 3.28Å; E57-Q62 HydrophobicContact CB-CG 4.3Å; E57-R216 VanDerWaalsContact C-NH1 3.27Å; E57-R216 PolarHBondContact O-NH1 3.2Å
58	S	37.3	Very low	32.1	Very low	10 Å²	10	87.9 Å²	87.9	7%	0.07	47%	0.467	C	S	.	.			trans	-53.2	139.7	173.8	70.8	0	0	0	0	108.7	V60 L61	S58-V60 PolarHBondContact O-N 3.16Å; S58-L61 PolarHBondContact O-N 2.74Å
59	S	38.8	Very low	32.6	Very low	83 Å²	83	87.4 Å²	87.4	58%	0.58	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-18.7	-179.4	48.1	0	0	0	0	113.3	E57	E57-S59 PolarHBondContact O-N 3.28Å
60	V	38.1	Very low	32.9	Very low	24 Å²	24	88.5 Å²	88.5	15%	0.145	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-32.2	176.2	174.9	0	0	0	0	112.7	S58 F94 P101	S58-V60 PolarHBondContact O-N 3.16Å; V60-F94 HydrophobicContact CG1-CZ 4.28Å; V60-F94 WeakPolarHBondContact O-CE2 3.49Å; V60-F94 WeakPolarHBondContact O-CZ 3.23Å; V60-P101 HydrophobicContact CG1-CG 3.39Å; V60-P101 HydrophobicContact CG2-CG 4.39Å
61	L	40.8	Very low	33.7	Very low	10 Å²	10	87 Å²	87	5%	0.052	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	5.4	-170	-66.3	173.8	0	0	0	114.6	S58 F63 Y117 I120 I151	S58-L61 PolarHBondContact O-N 2.74Å; L61-F63 HydrophobicContact CD2-CE2 4.28Å; L61-F63 WeakPolarHBondContact O-CD2 3.43Å; L61-F63 WeakPolarHBondContact O-CE2 3.27Å; L61-F63 PolarHBondContact O-N 3.4Å; L61-F63 VanDerWaalsContact O-N 3.12Å; L61-Y117 HydrophobicContact CD2-CD1 4.16Å; L61-I120 HydrophobicContact CD1-CG2 3.83Å; L61-I151 HydrophobicContact CD1-CG2 4.38Å
62	Q	37.9	Very low	34.3	Very low	76 Å²	76	83.9 Å²	83.9	36%	0.355	49%	0.49	S	S	.	.			trans	-71	106.1	170.5	-77.1	-177.9	-26	0	0	110.2	A54 E57 K99	A54-Q62 PolarHBondContact O-NE2 3.14Å; E57-Q62 HydrophobicContact CB-CG 4.3Å; Q62-K99 PolarHBondContact O-NZ 3.08Å; Q62-K99 VanDerWaalsContact O-NZ 3.09Å
63	F	37.6	Very low	34	Very low	65 Å²	65	87.3 Å²	87.3	29%	0.285	51%	0.514	S	S	.	.			trans	-96.9	96.7	169.9	-61.4	-83.6	0	0	0	108.5	L61 F94 V118	L61-F63 HydrophobicContact CD2-CE2 4.28Å; L61-F63 WeakPolarHBondContact O-CD2 3.43Å; L61-F63 WeakPolarHBondContact O-CE2 3.27Å; L61-F63 PolarHBondContact O-N 3.4Å; L61-F63 VanDerWaalsContact O-N 3.12Å; F63-F94 HydrophobicContact CD1-CD2 4.28Å; F63-F94 HydrophobicContact CE1-CB 4.46Å; F63-F94 AromaticContact CE1-CD2 3.35Å; F63-F94 HydrophobicContact CE1-CD2 3.35Å; F63-F94 AromaticContact CE1-CE2 3.77Å; F63-F94 HydrophobicContact CE1-CE2 3.77Å; F63-F94 HydrophobicContact CE1-CG 4.15Å; F63-F94 AromaticContact CZ-CD2 3.79Å; F63-F94 HydrophobicContact CZ-CD2 3.79Å; F63-F94 AromaticContact CZ-CE2 3.76Å; F63-F94 HydrophobicContact CZ-CE2 3.76Å; F63-V118 HydrophobicContact CE1-CG2 3.75Å; F63-V118 HydrophobicContact CZ-CB 4.41Å; F63-V118 HydrophobicContact CZ-CG2 3.85Å
64	E	29.8	Very low	34.5	Very low	176 Å²	176	90.8 Å²	90.8	82%	0.822	53%	0.532	S	S	*	.			trans	-74.3	128.3	165.5	-73.5	-177.1	163.5	0	0	108.6	P66	E64-P66 VanDerWaalsContact O-CD 3.28Å; E64-P66 WeakPolarHBondContact O-CD 3.24Å
65	D	32.3	Very low	34.9	Very low	97 Å²	97	92.8 Å²	92.8	52%	0.519	54%	0.541	S	S	.	.			trans	-81.4	109.1	172.4	-151.3	-12	0	0	0	107.7	D67	D65-D67 PolarHBondContact O-N 3.24Å
66	P	31.1	Very low	35.3	Very low	103 Å²	103	92.7 Å²	92.7	67%	0.669	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-2.3	-170.3	25.4	-31.9	0	0	0	114.8	E64	E64-P66 VanDerWaalsContact O-CD 3.28Å; E64-P66 WeakPolarHBondContact O-CD 3.24Å
67	D	32.7	Very low	35.4	Very low	134 Å²	134	98.4 Å²	98.4	72%	0.717	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	8.5	-169.6	-73.4	-35.4	0	0	0	116.5	D65 V69	D65-D67 PolarHBondContact O-N 3.24Å; D67-V69 PolarHBondContact O-N 2.98Å
68	C	35.1	Very low	35.4	Very low	86 Å²	86	99.1 Å²	99.1	58%	0.581	58%	0.582	S	S	*	*			trans	-94.5	87.8	176.7	-84	0	0	0	0	112.9	C76	C68-C76 VanDerWaalsContact SG-SG 3.69Å
69	V	34.9	Very low	35.5	Very low	114 Å²	114	104.9 Å²	104.9	69%	0.691	62%	0.617	S	S	*	*			trans	-93.3	124.2	159.5	-177.9	0	0	0	0	107.9	D67 G71 S72	D67-V69 PolarHBondContact O-N 2.98Å; V69-G71 PolarHBondContact O-N 2.88Å; V69-S72 PolarHBondContact O-N 3.29Å
70	E	33	Very low	35.3	Very low	203 Å²	203	110.3 Å²	110.3	95%	0.949	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	109.8	172.3	-82.4	-173.5	148.6	0	0	110.1
71	G	42.4	Very low	35.4	Very low	85 Å²	85	112.3 Å²	112.3	88%	0.876	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.1	5.4	172.5	0	0	0	0	0	117.5	V69	V69-G71 PolarHBondContact O-N 2.88Å
72	S	37.1	Very low	36	Very low	75 Å²	75	115 Å²	115	52%	0.524	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-86.2	142.6	170.9	58	0	0	0	0	112.5	V69	V69-S72 PolarHBondContact O-N 3.29Å
73	N	30.2	Very low	37.2	Very low	155 Å²	155	116.7 Å²	116.7	83%	0.829	67%	0.671	S	S	*	*	S	Bend	trans	-94.4	135.2	167.6	-91.9	-30.2	0	0	0	108.2
74	P	38.6	Very low	38.7	Very low	113 Å²	113	117 Å²	117	73%	0.734	69%	0.686	S	S	*	*	S	Bend	cis	-85.9	164.3	14.6	34.4	-33.8	0	0	0	114.1
75	P	34.3	Very low	40.9	Very low	103 Å²	103	115.3 Å²	115.3	67%	0.669	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-66.3	147.5	-178.4	27.4	-34	0	0	0	112	E77	P75-E77 PolarHBondContact O-N 3.45Å; P75-E77 VanDerWaalsContact O-N 3.1Å
76	C	37.8	Very low	43	Very low	110 Å²	110	115.6 Å²	115.6	74%	0.743	68%	0.675	S	S	*	*			trans	-55.3	113.7	171	-70.3	0	0	0	0	110.1	C68	C68-C76 VanDerWaalsContact SG-SG 3.69Å
77	E	32	Very low	45.3	Very low	170 Å²	170	111.6 Å²	111.6	79%	0.794	65%	0.647	S	S	*	*			trans	-68.1	149.4	175.3	-74.4	-176.1	156.4	0	0	111.3	P75	P75-E77 PolarHBondContact O-N 3.45Å; P75-E77 VanDerWaalsContact O-N 3.1Å
78	S	32.2	Very low	47.7	Very low	89 Å²	89	109.2 Å²	109.2	62%	0.622	63%	0.634	S	S	*	*			trans	-55.7	144	-177.3	58.5	0	0	0	0	114	F80	S78-F80 PolarHBondContact O-N 3.02Å
79	V	38.5	Very low	49.9	Very low	131 Å²	131	108.9 Å²	108.9	79%	0.794	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-2.2	179.8	178.6	0	0	0	0	115.9
80	F	34.3	Very low	52.1	Low	197 Å²	197	105.1 Å²	105.1	86%	0.864	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	11	-170	-79.6	-77.8	0	0	0	116.8	S78	S78-F80 PolarHBondContact O-N 3.02Å
81	S	40.4	Very low	54.4	Low	67 Å²	67	95.7 Å²	95.7	47%	0.469	56%	0.558	S	S	.	*			trans	-122.8	77.7	170.1	61	0	0	0	0	112.1	N83	S81-N83 PolarHBondContact O-N 3.37Å
82	L	53.1	Low	56.4	Low	67 Å²	67	97.5 Å²	97.5	35%	0.351	54%	0.542	S	S	.	.			trans	-77.4	103.1	168.5	-83.8	153.3	0	0	0	109.5	I87 N122 L124	L82-I87 HydrophobicContact CD2-CG1 4.23Å; L82-N122 HydrophobicContact CD1-CB 4.08Å; L82-N122 WeakPolarHBondContact CD2-OD1 3.44Å; L82-L124 HydrophobicContact CD1-CD1 4.49Å
83	N	64.8	Low	58.5	Low	110 Å²	110	97.5 Å²	97.5	59%	0.588	54%	0.535	S	S	*	.			trans	-78.6	141.7	168.5	-81	-10.9	0	0	0	110.2	S81 E85 K86 I87	S81-N83 PolarHBondContact O-N 3.37Å; N83-E85 PolarHBondContact O-N 2.91Å; N83-E85 VanDerWaalsContact O-N 3.08Å; N83-K86 WeakPolarHBondContact O-CB 3.43Å; N83-K86 PolarHBondContact O-N 3.42Å; N83-I87 PolarHBondContact O-N 2.9Å
84	A	68.3	Low	60.8	Low	72 Å²	72	90.2 Å²	90.2	60%	0.595	50%	0.496	S	S	*	.	H	α-helix	trans	-53.4	-31	176.8	0	0	0	0	0	113	K86 I87 L88	A84-K86 VanDerWaalsContact C-N 3.34Å; A84-K86 PolarHBondContact O-N 2.87Å; A84-I87 PolarHBondContact O-N 2.99Å; A84-L88 VanDerWaalsContact O-CG 3.26Å; A84-L88 WeakPolarHBondContact O-CG 3.43Å; A84-L88 PolarHBondContact O-N 3.4Å
85	E	75.5	Confident	62.9	Low	141 Å²	141	87.4 Å²	87.4	66%	0.659	47%	0.474	S	S	*	.	H	α-helix	trans	-65	-34.8	175.6	-164.4	171	-166.6	0	0	112.9	N83 N89	N83-E85 PolarHBondContact O-N 2.91Å; N83-E85 VanDerWaalsContact O-N 3.08Å; E85-N89 WeakPolarHBondContact O-CB 3.45Å; E85-N89 PolarHBondContact O-N 3.14Å; E85-N89 PolarHBondContact O-ND2 2.91Å
86	K	77.8	Confident	65.2	Low	103 Å²	103	89.5 Å²	89.5	45%	0.448	48%	0.476	S	S	.	.	H	α-helix	trans	-69.5	-42.6	176.8	-166.9	175.1	-178	178.3	0	111.3	N83 A84 N89 Q90	N83-K86 WeakPolarHBondContact O-CB 3.43Å; N83-K86 PolarHBondContact O-N 3.42Å; A84-K86 VanDerWaalsContact C-N 3.34Å; A84-K86 PolarHBondContact O-N 2.87Å; K86-N89 PolarHBondContact O-N 3.1Å; K86-Q90 WeakPolarHBondContact O-CB 3.49Å; K86-Q90 WeakPolarHBondContact O-CG 3.37Å; K86-Q90 PolarHBondContact O-N 2.93Å
87	I	79.6	Confident	67.2	Low	19 Å²	19	89.1 Å²	89.1	10%	0.097	46%	0.463	C	S	.	.	H	α-helix	trans	-62.7	-43	175.8	-67.1	170.5	0	0	0	110.5	L82 N83 A84 Q90 A91 I115 V118 L119 L124	L82-I87 HydrophobicContact CD2-CG1 4.23Å; N83-I87 PolarHBondContact O-N 2.9Å; A84-I87 PolarHBondContact O-N 2.99Å; I87-Q90 PolarHBondContact O-N 3.42Å; I87-A91 WeakPolarHBondContact O-CB 3.39Å; I87-A91 PolarHBondContact O-N 3.4Å; I87-I115 HydrophobicContact CG2-CG2 4.25Å; I87-V118 HydrophobicContact CB-CG1 4.36Å; I87-V118 HydrophobicContact CG2-CB 4.43Å; I87-V118 HydrophobicContact CG2-CG1 3.84Å; I87-L119 HydrophobicContact CD1-CD2 4.03Å; I87-L124 HydrophobicContact CD1-CD1 4.4Å
88	L	81.2	Confident	69.4	Low	83 Å²	83	90 Å²	90	44%	0.435	46%	0.464	S	S	.	.	H	α-helix	trans	-65.8	-39.4	177.7	-71.3	169.3	0	0	0	112.4	A84 A91 K92 I115	A84-L88 VanDerWaalsContact O-CG 3.26Å; A84-L88 WeakPolarHBondContact O-CG 3.43Å; A84-L88 PolarHBondContact O-N 3.4Å; L88-A91 PolarHBondContact O-N 3.13Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3Å; L88-I115 HydrophobicContact CD2-CD1 3.7Å; L88-I115 HydrophobicContact CD2-CG1 4.14Å
89	N	81.4	Confident	71.5	Confident	79 Å²	79	88.7 Å²	88.7	42%	0.422	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-40.7	175.6	-72.1	-20.6	0	0	0	111.7	E85 K86 A91 K92 L93	E85-N89 WeakPolarHBondContact O-CB 3.45Å; E85-N89 PolarHBondContact O-N 3.14Å; E85-N89 PolarHBondContact O-ND2 2.91Å; K86-N89 PolarHBondContact O-N 3.1Å; N89-A91 VanDerWaalsContact C-N 3.35Å; N89-K92 PolarHBondContact O-N 3.25Å; N89-L93 PolarHBondContact O-N 3.23Å; N89-L93 VanDerWaalsContact O-N 3.11Å
90	Q	81.9	Confident	73.6	Confident	36 Å²	36	83.2 Å²	83.2	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-62.5	-40.2	172.3	-75.4	177.3	-15	0	0	112	K86 I87 K92 L93 F94 V118 N122	K86-Q90 WeakPolarHBondContact O-CB 3.49Å; K86-Q90 WeakPolarHBondContact O-CG 3.37Å; K86-Q90 PolarHBondContact O-N 2.93Å; I87-Q90 PolarHBondContact O-N 3.42Å; Q90-K92 PolarHBondContact O-N 2.81Å; Q90-L93 PolarHBondContact O-N 3.37Å; Q90-F94 WeakPolarHBondContact O-CB 3.4Å; Q90-F94 PolarHBondContact O-N 3.4Å; Q90-V118 HydrophobicContact CB-CG1 3.85Å; Q90-V118 HydrophobicContact CB-CG2 4.13Å; Q90-N122 PolarHBondContact OE1-ND2 3.41Å
91	A	82.1	Confident	75.9	Confident	4 Å²	4	74.3 Å²	74.3	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-65	-38.8	177.6	0	0	0	0	0	112.2	I87 L88 N89 F94 I95 A114 I115 V118	I87-A91 WeakPolarHBondContact O-CB 3.39Å; I87-A91 PolarHBondContact O-N 3.4Å; L88-A91 PolarHBondContact O-N 3.13Å; N89-A91 VanDerWaalsContact C-N 3.35Å; A91-F94 WeakPolarHBondContact O-CB 3.42Å; A91-F94 PolarHBondContact O-N 3.26Å; A91-I95 WeakPolarHBondContact O-CD1 3.32Å; A91-I95 VanDerWaalsContact O-CG1 3.31Å; A91-I95 WeakPolarHBondContact O-CG1 3.31Å; A91-I95 PolarHBondContact O-N 2.9Å; A91-A114 HydrophobicContact CB-CB 4.03Å; A91-I115 HydrophobicContact CB-CG1 3.83Å; A91-V118 HydrophobicContact CB-CG2 4.12Å
92	K	83.1	Confident	78.1	Confident	124 Å²	124	72.2 Å²	72.2	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-61.2	-47.8	172.9	-73.3	173.7	-176.9	173.2	0	111.8	L88 N89 Q90 F94 I95 E96	L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3Å; N89-K92 PolarHBondContact O-N 3.25Å; Q90-K92 PolarHBondContact O-N 2.81Å; K92-F94 VanDerWaalsContact C-N 3.26Å; K92-F94 PolarHBondContact O-N 2.91Å; K92-I95 PolarHBondContact O-N 3.49Å; K92-E96 WeakPolarHBondContact O-CG 3.28Å; K92-E96 PolarHBondContact O-N 2.83Å
93	L	81.8	Confident	79.5	Confident	74 Å²	74	73.3 Å²	73.3	39%	0.387	37%	0.369	S	S	.	.	H	α-helix	trans	-59	-38.8	174.8	-74.6	161.4	0	0	0	111.7	N89 Q90 I95 E96 Q97	N89-L93 PolarHBondContact O-N 3.23Å; N89-L93 VanDerWaalsContact O-N 3.11Å; Q90-L93 PolarHBondContact O-N 3.37Å; L93-I95 VanDerWaalsContact C-N 3.34Å; L93-I95 PolarHBondContact O-N 3.09Å; L93-E96 PolarHBondContact O-N 3.38Å; L93-Q97 WeakPolarHBondContact O-CB 3.47Å; L93-Q97 VanDerWaalsContact O-CG 3.24Å; L93-Q97 WeakPolarHBondContact O-CG 3.48Å; L93-Q97 PolarHBondContact O-N 2.89Å
94	F	79.2	Confident	80.6	Confident	2 Å²	2	70 Å²	70	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-39.1	178.2	-162	-109.9	0	0	0	112.9	V60 F63 Q90 A91 K92 K98 K99 I100 A114 Y117	V60-F94 HydrophobicContact CG1-CZ 4.28Å; V60-F94 WeakPolarHBondContact O-CE2 3.49Å; V60-F94 WeakPolarHBondContact O-CZ 3.23Å; F63-F94 HydrophobicContact CD1-CD2 4.28Å; F63-F94 HydrophobicContact CE1-CB 4.46Å; F63-F94 AromaticContact CE1-CD2 3.35Å; F63-F94 HydrophobicContact CE1-CD2 3.35Å; F63-F94 AromaticContact CE1-CE2 3.77Å; F63-F94 HydrophobicContact CE1-CE2 3.77Å; F63-F94 HydrophobicContact CE1-CG 4.15Å; F63-F94 AromaticContact CZ-CD2 3.79Å; F63-F94 HydrophobicContact CZ-CD2 3.79Å; F63-F94 AromaticContact CZ-CE2 3.76Å; F63-F94 HydrophobicContact CZ-CE2 3.76Å; Q90-F94 WeakPolarHBondContact O-CB 3.4Å; Q90-F94 PolarHBondContact O-N 3.4Å; A91-F94 WeakPolarHBondContact O-CB 3.42Å; A91-F94 PolarHBondContact O-N 3.26Å; K92-F94 VanDerWaalsContact C-N 3.26Å; K92-F94 PolarHBondContact O-N 2.91Å; F94-K98 PolarHBondContact O-N 3.28Å; F94-K99 HydrophobicContact CD1-CB 4.37Å; F94-K99 HydrophobicContact CD2-CB 3.75Å; F94-K99 HydrophobicContact CD2-CD 4.07Å; F94-K99 HydrophobicContact CE1-CB 4.11Å; F94-K99 HydrophobicContact CE2-CB 3.47Å; F94-K99 VanDerWaalsContact CE2-CB 3.47Å; F94-K99 HydrophobicContact CE2-CD 3.99Å; F94-K99 HydrophobicContact CE2-CG 4.39Å; F94-K99 HydrophobicContact CG-CB 4.2Å; F94-K99 HydrophobicContact CZ-CB 3.66Å; F94-K99 WeakPolarHBondContact CZ-O 3.44Å; F94-K99 PolarHBondContact O-N 3.48Å; F94-K99 VanDerWaalsContact O-N 3.13Å; F94-I100 HydrophobicContact CD1-CG1 3.93Å; F94-I100 HydrophobicContact CE1-CG1 4.04Å; F94-A114 HydrophobicContact CD1-CB 4.12Å; F94-Y117 HydrophobicContact CE1-CD2 4.32Å; F94-Y117 HydrophobicContact CE1-CG 4.25Å
95	I	82.5	Confident	81.3	Confident	54 Å²	54	75.1 Å²	75.1	28%	0.277	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-46.5	174.2	-64	157.6	0	0	0	110.6	A91 K92 L93 Q97 K98 I100 E111 A114	A91-I95 WeakPolarHBondContact O-CD1 3.32Å; A91-I95 VanDerWaalsContact O-CG1 3.31Å; A91-I95 WeakPolarHBondContact O-CG1 3.31Å; A91-I95 PolarHBondContact O-N 2.9Å; K92-I95 PolarHBondContact O-N 3.49Å; L93-I95 VanDerWaalsContact C-N 3.34Å; L93-I95 PolarHBondContact O-N 3.09Å; I95-Q97 PolarHBondContact O-N 3.15Å; I95-K98 WeakPolarHBondContact O-CA 3.47Å; I95-K98 PolarHBondContact O-N 2.75Å; I95-I100 HydrophobicContact CG1-CD1 3.82Å; I95-E111 HydrophobicContact CD1-CB 4.38Å; I95-E111 HydrophobicContact CD1-CG 3.8Å; I95-A114 HydrophobicContact CD1-CB 3.85Å; I95-A114 HydrophobicContact CG1-CB 3.64Å
96	E	81.1	Confident	81.9	Confident	148 Å²	148	72.4 Å²	72.4	69%	0.692	36%	0.36	S	S	*	.	H	α-helix	trans	-59.3	-37.3	179.4	-74.4	175.7	-177.8	0	0	112	K92 L93 K98	K92-E96 WeakPolarHBondContact O-CG 3.28Å; K92-E96 PolarHBondContact O-N 2.83Å; L93-E96 PolarHBondContact O-N 3.38Å; E96-K98 PolarHBondContact O-N 3.09Å
97	Q	80.1	Confident	82.1	Confident	101 Å²	101	74 Å²	74	47%	0.472	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-1.2	175.6	-66.9	176.3	11.2	0	0	113.6	L93 I95 K99	L93-Q97 WeakPolarHBondContact O-CB 3.47Å; L93-Q97 VanDerWaalsContact O-CG 3.24Å; L93-Q97 WeakPolarHBondContact O-CG 3.48Å; L93-Q97 PolarHBondContact O-N 2.89Å; I95-Q97 PolarHBondContact O-N 3.15Å; Q97-K99 VanDerWaalsContact C-N 3.26Å; Q97-K99 HydrophobicContact CB-CD 4.04Å; Q97-K99 HydrophobicContact CB-CG 3.9Å; Q97-K99 PolarHBondContact O-N 3.41Å
98	K	78.9	Confident	82.3	Confident	190 Å²	190	78.2 Å²	78.2	83%	0.826	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	38.6	-177.6	-59.6	-177.4	177.5	-178.8	0	113.4	F94 I95 E96	F94-K98 PolarHBondContact O-N 3.28Å; I95-K98 WeakPolarHBondContact O-CA 3.47Å; I95-K98 PolarHBondContact O-N 2.75Å; E96-K98 PolarHBondContact O-N 3.09Å
99	K	75.7	Confident	82.6	Confident	61 Å²	61	75.6 Å²	75.6	27%	0.265	38%	0.379	S	S	.	.			trans	-89.3	-1.7	-175.8	-74.3	-177.9	170.4	174.2	0	114.8	Q62 F94 Q97 P101	Q62-K99 PolarHBondContact O-NZ 3.08Å; Q62-K99 VanDerWaalsContact O-NZ 3.09Å; F94-K99 HydrophobicContact CD1-CB 4.37Å; F94-K99 HydrophobicContact CD2-CB 3.75Å; F94-K99 HydrophobicContact CD2-CD 4.07Å; F94-K99 HydrophobicContact CE1-CB 4.11Å; F94-K99 HydrophobicContact CE2-CB 3.47Å; F94-K99 VanDerWaalsContact CE2-CB 3.47Å; F94-K99 HydrophobicContact CE2-CD 3.99Å; F94-K99 HydrophobicContact CE2-CG 4.39Å; F94-K99 HydrophobicContact CG-CB 4.2Å; F94-K99 HydrophobicContact CZ-CB 3.66Å; F94-K99 WeakPolarHBondContact CZ-O 3.44Å; F94-K99 PolarHBondContact O-N 3.48Å; F94-K99 VanDerWaalsContact O-N 3.13Å; Q97-K99 VanDerWaalsContact C-N 3.26Å; Q97-K99 HydrophobicContact CB-CD 4.04Å; Q97-K99 HydrophobicContact CB-CG 3.9Å; Q97-K99 PolarHBondContact O-N 3.41Å; K99-P101 VanDerWaalsContact O-CD 3.26Å; K99-P101 WeakPolarHBondContact O-CD 3.08Å
100	I	82.5	Confident	82.8	Confident	15 Å²	15	73 Å²	73	8%	0.077	37%	0.365	C	S	.	.			trans	-66.4	121.6	-180	-62	170.8	0	0	0	110.1	F94 I95 P103 N110 L113 A114	F94-I100 HydrophobicContact CD1-CG1 3.93Å; F94-I100 HydrophobicContact CE1-CG1 4.04Å; I95-I100 HydrophobicContact CG1-CD1 3.82Å; I100-P103 WeakPolarHBondContact O-CD 3.49Å; I100-N110 HydrophobicContact CD1-CB 3.8Å; I100-N110 WeakPolarHBondContact CD1-O 3.46Å; I100-L113 HydrophobicContact CG2-CB 4.46Å; I100-A114 HydrophobicContact CD1-CB 4.16Å; I100-A114 HydrophobicContact CG1-CB 4.4Å
101	P	83.2	Confident	83	Confident	11 Å²	11	75.5 Å²	75.5	7%	0.071	38%	0.377	C	S	.	.	S	Bend	trans	-64.9	135.9	169.5	-21.5	35.3	0	0	0	110.7	V60 K99 Y117 S144 Y147	V60-P101 HydrophobicContact CG1-CG 3.39Å; V60-P101 HydrophobicContact CG2-CG 4.39Å; K99-P101 VanDerWaalsContact O-CD 3.26Å; K99-P101 WeakPolarHBondContact O-CD 3.08Å; P101-Y117 HydrophobicContact CG-CE1 3.93Å; P101-Y117 HydrophobicContact CG-CE2 4.26Å; P101-S144 VanDerWaalsContact O-CB 3.23Å; P101-S144 WeakPolarHBondContact O-CB 3.47Å; P101-S144 PolarHBondContact O-OG 3.09Å; P101-Y147 HydrophobicContact CB-CD1 3.73Å; P101-Y147 HydrophobicContact CB-CE1 3.78Å; P101-Y147 HydrophobicContact CG-CD1 4.14Å; P101-Y147 HydrophobicContact CG-CE1 3.91Å
102	F	85.9	Confident	83.2	Confident	23 Å²	23	80.4 Å²	80.4	10%	0.101	40%	0.399	C	S	.	.	S	Bend	trans	50.9	59	177.9	-47.6	-85.6	0	0	0	112.9	V143 S144 Y147 V174 E178 W181 V184	F102-V143 HydrophobicContact CB-CB 4.34Å; F102-V143 HydrophobicContact CB-CG1 4.29Å; F102-V143 HydrophobicContact CD1-CB 4.4Å; F102-V143 HydrophobicContact CD1-CG1 3.63Å; F102-V143 HydrophobicContact CD2-CG1 4.03Å; F102-V143 HydrophobicContact CE1-CG1 3.85Å; F102-V143 HydrophobicContact CE2-CG1 4.26Å; F102-V143 HydrophobicContact CG-CB 4.3Å; F102-V143 HydrophobicContact CG-CG1 3.72Å; F102-V143 HydrophobicContact CZ-CG1 4.18Å; F102-S144 WeakPolarHBondContact O-CB 3.43Å; F102-Y147 HydrophobicContact CD2-CD1 4.13Å; F102-Y147 HydrophobicContact CD2-CG 4.28Å; F102-Y147 AromaticContact CE2-CD1 3.76Å; F102-Y147 HydrophobicContact CE2-CD1 3.76Å; F102-Y147 HydrophobicContact CE2-CD2 4.22Å; F102-Y147 HydrophobicContact CE2-CE1 4.28Å; F102-Y147 AromaticContact CE2-CG 3.71Å; F102-Y147 HydrophobicContact CE2-CG 3.71Å; F102-V174 HydrophobicContact CE2-CG1 4.38Å; F102-V174 HydrophobicContact CZ-CG1 3.99Å; F102-E178 HydrophobicContact CD1-CG 4.41Å; F102-E178 HydrophobicContact CE1-CB 4.09Å; F102-E178 HydrophobicContact CE1-CG 4.21Å; F102-W181 HydrophobicContact CD1-CD2 4.43Å; F102-W181 AromaticContact CD1-CE2 4Å; F102-W181 HydrophobicContact CD1-CZ2 4.24Å; F102-W181 HydrophobicContact CE1-CB 4.38Å; F102-W181 AromaticContact CE1-CD1 3.57Å; F102-W181 AromaticContact CE1-CD2 3.59Å; F102-W181 HydrophobicContact CE1-CD2 3.59Å; F102-W181 AromaticContact CE1-CE2 3.53Å; F102-W181 HydrophobicContact CE1-CE3 4.32Å; F102-W181 AromaticContact CE1-CG 3.6Å; F102-W181 HydrophobicContact CE1-CG 3.6Å; F102-W181 HydrophobicContact CE1-CZ2 4.19Å; F102-W181 AromaticContact CE1-NE1 3.49Å; F102-W181 HydrophobicContact CZ-CB 4.19Å; F102-W181 AromaticContact CZ-CD2 3.89Å; F102-W181 HydrophobicContact CZ-CD2 3.89Å; F102-W181 HydrophobicContact CZ-CE3 4.31Å; F102-W181 AromaticContact CZ-CG 3.83Å; F102-W181 HydrophobicContact CZ-CG 3.83Å; F102-V184 HydrophobicContact CE2-CG2 4.46Å; F102-V184 HydrophobicContact CZ-CG2 3.89Å
103	P	84	Confident	83.5	Confident	89 Å²	89	74.5 Å²	74.5	58%	0.578	37%	0.373	S	S	*	.			trans	-63.5	144	-177.8	29.3	-34.6	0	0	0	110.7	I100	I100-P103 WeakPolarHBondContact O-CD 3.49Å
104	V	86.1	Confident	83.8	Confident	42 Å²	42	71 Å²	71	26%	0.255	36%	0.355	S	S	.	.			trans	-105.3	161.9	178.6	-66.5	0	0	0	0	111.3	N106 T109 N110 L113 L142	V104-N106 HydrophobicContact CG2-CB 4.46Å; V104-N106 PolarHBondContact O-N 3.45Å; V104-T109 HydrophobicContact CG2-CG2 3.85Å; V104-N110 WeakPolarHBondContact CG2-OD1 3.42Å; V104-N110 PolarHBondContact N-OD1 2.67Å; V104-N110 PolarHBondContact O-ND2 3.46Å; V104-L113 HydrophobicContact CG2-CD1 4.48Å; V104-L142 HydrophobicContact CG1-CD1 3.58Å
105	D	84.3	Confident	84.2	Confident	179 Å²	179	73.1 Å²	73.1	96%	0.957	37%	0.366	S	S	*	.	S	Bend	trans	-66.6	-21	179.6	-66	-33	0	0	0	113.1	Q107	D105-Q107 PolarHBondContact O-N 2.87Å
106	N	86.7	Confident	84.6	Confident	84 Å²	84	70.7 Å²	70.7	45%	0.449	35%	0.354	S	S	.	.			trans	-82.9	111.9	179.8	-172.9	-8.6	0	0	0	111.8	V104 N108 T109 N110	V104-N106 HydrophobicContact CG2-CB 4.46Å; V104-N106 PolarHBondContact O-N 3.45Å; N106-N108 PolarHBondContact O-N 3.37Å; N106-N108 PolarHBondContact OD1-N 3.25Å; N106-N108 VanDerWaalsContact OD1-N 3.09Å; N106-T109 PolarHBondContact ND2-OG1 2.89Å; N106-T109 VanDerWaalsContact ND2-OG1 3.14Å; N106-T109 PolarHBondContact O-N 3.08Å; N106-N110 PolarHBondContact O-N 3.23Å; N106-N110 VanDerWaalsContact O-N 3.08Å
107	Q	82.8	Confident	84.9	Confident	136 Å²	136	63.7 Å²	63.7	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-39.1	-179.7	-170.8	171.8	-12.1	0	0	113.2	D105 T109 N110 E111	D105-Q107 PolarHBondContact O-N 2.87Å; Q107-T109 VanDerWaalsContact C-N 3.33Å; Q107-T109 PolarHBondContact O-N 3.29Å; Q107-N110 PolarHBondContact O-N 3.21Å; Q107-E111 WeakPolarHBondContact O-CG 3.44Å; Q107-E111 PolarHBondContact O-N 2.85Å
108	N	84.8	Confident	85.3	Confident	107 Å²	107	58.9 Å²	58.9	57%	0.572	30%	0.299	S	S	*	.	H	α-helix	trans	-66	-38.3	179.5	-66.1	-4.4	0	0	0	111.4	N106 E111 E112	N106-N108 PolarHBondContact O-N 3.37Å; N106-N108 PolarHBondContact OD1-N 3.25Å; N106-N108 VanDerWaalsContact OD1-N 3.09Å; N108-E111 WeakPolarHBondContact O-CB 3.31Å; N108-E111 PolarHBondContact O-N 2.93Å; N108-E112 PolarHBondContact O-N 3.22Å; N108-E112 VanDerWaalsContact O-N 3.1Å
109	T	85.6	Confident	85.7	Confident	29 Å²	29	50.1 Å²	50.1	18%	0.178	26%	0.261	C	S	.	.	H	α-helix	trans	-68.6	-37.8	176.5	-54.2	0	0	0	0	111.3	V104 N106 Q107 E111 E112 L113 L135 L142	V104-T109 HydrophobicContact CG2-CG2 3.85Å; N106-T109 PolarHBondContact ND2-OG1 2.89Å; N106-T109 VanDerWaalsContact ND2-OG1 3.14Å; N106-T109 PolarHBondContact O-N 3.08Å; Q107-T109 VanDerWaalsContact C-N 3.33Å; Q107-T109 PolarHBondContact O-N 3.29Å; T109-E111 VanDerWaalsContact C-N 3.31Å; T109-E111 PolarHBondContact O-N 3.16Å; T109-E112 PolarHBondContact O-N 3.49Å; T109-L113 HydrophobicContact CG2-CD1 4.12Å; T109-L113 HydrophobicContact CG2-CG 4.42Å; T109-L113 WeakPolarHBondContact O-CB 3.32Å; T109-L113 VanDerWaalsContact O-CG 3.24Å; T109-L113 WeakPolarHBondContact O-CG 3.4Å; T109-L113 PolarHBondContact O-N 3.3Å; T109-L135 HydrophobicContact CG2-CD2 4.44Å; T109-L142 HydrophobicContact CG2-CD2 4.04Å
110	N	86.3	Confident	86.2	Confident	24 Å²	24	47.4 Å²	47.4	13%	0.128	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-36	173.2	-74	-29.6	0	0	0	112.5	I100 V104 N106 Q107 L113 A114	I100-N110 HydrophobicContact CD1-CB 3.8Å; I100-N110 WeakPolarHBondContact CD1-O 3.46Å; V104-N110 WeakPolarHBondContact CG2-OD1 3.42Å; V104-N110 PolarHBondContact N-OD1 2.67Å; V104-N110 PolarHBondContact O-ND2 3.46Å; N106-N110 PolarHBondContact O-N 3.23Å; N106-N110 VanDerWaalsContact O-N 3.08Å; Q107-N110 PolarHBondContact O-N 3.21Å; N110-L113 PolarHBondContact O-N 3.32Å; N110-A114 WeakPolarHBondContact O-CB 3.41Å; N110-A114 PolarHBondContact O-N 2.84Å
111	E	86.1	Confident	86.2	Confident	89 Å²	89	48.4 Å²	48.4	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-63.2	-45.6	173.5	-73.4	175	-169.2	0	0	111.7	I95 Q107 N108 T109 A114 I115	I95-E111 HydrophobicContact CD1-CB 4.38Å; I95-E111 HydrophobicContact CD1-CG 3.8Å; Q107-E111 WeakPolarHBondContact O-CG 3.44Å; Q107-E111 PolarHBondContact O-N 2.85Å; N108-E111 WeakPolarHBondContact O-CB 3.31Å; N108-E111 PolarHBondContact O-N 2.93Å; T109-E111 VanDerWaalsContact C-N 3.31Å; T109-E111 PolarHBondContact O-N 3.16Å; E111-A114 PolarHBondContact O-N 3.06Å; E111-I115 WeakPolarHBondContact O-CG1 3.47Å; E111-I115 PolarHBondContact O-N 3.46Å; E111-I115 VanDerWaalsContact O-N 3.15Å
112	E	87.6	Confident	86.2	Confident	106 Å²	106	50.3 Å²	50.3	50%	0.495	27%	0.273	S	S	.	.	H	α-helix	trans	-64.1	-42	175.6	-70.1	-177.3	-176.1	0	0	112.4	N108 T109 I115 C116 L135	N108-E112 PolarHBondContact O-N 3.22Å; N108-E112 VanDerWaalsContact O-N 3.1Å; T109-E112 PolarHBondContact O-N 3.49Å; E112-I115 PolarHBondContact O-N 3.07Å; E112-C116 PolarHBondContact O-N 3.41Å; E112-C116 VanDerWaalsContact O-N 3.12Å; E112-C116 PolarHBondContact O-SG 2.04Å; E112-L135 HydrophobicContact CB-CD2 4.25Å; E112-L135 WeakPolarHBondContact OE2-CD2 3.45Å
113	L	89.1	Confident	86.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-44.4	175.5	-73.8	167.9	0	0	0	111.5	I100 V104 T109 N110 I115 C116 Y117 F132 L135 A145	I100-L113 HydrophobicContact CG2-CB 4.46Å; V104-L113 HydrophobicContact CG2-CD1 4.48Å; T109-L113 HydrophobicContact CG2-CD1 4.12Å; T109-L113 HydrophobicContact CG2-CG 4.42Å; T109-L113 WeakPolarHBondContact O-CB 3.32Å; T109-L113 VanDerWaalsContact O-CG 3.24Å; T109-L113 WeakPolarHBondContact O-CG 3.4Å; T109-L113 PolarHBondContact O-N 3.3Å; N110-L113 PolarHBondContact O-N 3.32Å; L113-I115 VanDerWaalsContact C-N 3.32Å; L113-I115 PolarHBondContact O-N 3.48Å; L113-C116 WeakPolarHBondContact O-CB 3.43Å; L113-C116 PolarHBondContact O-N 3.4Å; L113-C116 VanDerWaalsContact O-N 3.08Å; L113-Y117 HydrophobicContact CB-CE2 4.45Å; L113-Y117 WeakPolarHBondContact O-CD2 3.41Å; L113-Y117 PolarHBondContact O-N 3Å; L113-F132 HydrophobicContact CD2-CD1 4.33Å; L113-F132 HydrophobicContact CD2-CE1 3.97Å; L113-L135 HydrophobicContact CD2-CD1 3.75Å; L113-L135 HydrophobicContact CG-CD1 4.23Å; L113-A145 HydrophobicContact CD2-CB 4.04Å
114	A	87.5	Confident	86.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-43.4	178.3	0	0	0	0	0	111.8	A91 F94 I95 I100 N110 E111 C116 Y117 V118	A91-A114 HydrophobicContact CB-CB 4.03Å; F94-A114 HydrophobicContact CD1-CB 4.12Å; I95-A114 HydrophobicContact CD1-CB 3.85Å; I95-A114 HydrophobicContact CG1-CB 3.64Å; I100-A114 HydrophobicContact CD1-CB 4.16Å; I100-A114 HydrophobicContact CG1-CB 4.4Å; N110-A114 WeakPolarHBondContact O-CB 3.41Å; N110-A114 PolarHBondContact O-N 2.84Å; E111-A114 PolarHBondContact O-N 3.06Å; A114-C116 VanDerWaalsContact C-N 3.3Å; A114-C116 PolarHBondContact O-N 3.32Å; A114-Y117 PolarHBondContact O-N 3.46Å; A114-V118 VanDerWaalsContact O-CG2 3.28Å; A114-V118 WeakPolarHBondContact O-CG2 3.45Å; A114-V118 PolarHBondContact O-N 2.86Å
115	I	88.3	Confident	86.4	Confident	48 Å²	48	50.6 Å²	50.6	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-45.5	174.1	-65.6	165.4	0	0	0	110.2	I87 L88 A91 E111 E112 L113 Y117 V118 L119	I87-I115 HydrophobicContact CG2-CG2 4.25Å; L88-I115 HydrophobicContact CD2-CD1 3.7Å; L88-I115 HydrophobicContact CD2-CG1 4.14Å; A91-I115 HydrophobicContact CB-CG1 3.83Å; E111-I115 WeakPolarHBondContact O-CG1 3.47Å; E111-I115 PolarHBondContact O-N 3.46Å; E111-I115 VanDerWaalsContact O-N 3.15Å; E112-I115 PolarHBondContact O-N 3.07Å; L113-I115 VanDerWaalsContact C-N 3.32Å; L113-I115 PolarHBondContact O-N 3.48Å; I115-Y117 PolarHBondContact O-N 2.88Å; I115-V118 PolarHBondContact O-N 3.29Å; I115-L119 HydrophobicContact CG2-CD1 4.34Å; I115-L119 WeakPolarHBondContact O-CG 3.46Å; I115-L119 PolarHBondContact O-N 3.12Å
116	C	89.3	Confident	86.7	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.02	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-40.2	179.9	-60.2	0	0	0	0	113.1	E112 L113 A114 L119 I120 H131 F132	E112-C116 PolarHBondContact O-N 3.41Å; E112-C116 VanDerWaalsContact O-N 3.12Å; E112-C116 PolarHBondContact O-SG 2.04Å; L113-C116 WeakPolarHBondContact O-CB 3.43Å; L113-C116 PolarHBondContact O-N 3.4Å; L113-C116 VanDerWaalsContact O-N 3.08Å; A114-C116 VanDerWaalsContact C-N 3.3Å; A114-C116 PolarHBondContact O-N 3.32Å; C116-L119 WeakPolarHBondContact O-CB 3.42Å; C116-L119 PolarHBondContact O-N 3.44Å; C116-I120 PolarHBondContact O-N 2.88Å; C116-I120 VanDerWaalsContact O-N 3.15Å; C116-H131 WeakPolarHBondContact SG-CB 3.45Å; C116-F132 HydrophobicContact CB-CD1 3.92Å; C116-F132 HydrophobicContact CB-CD2 4.13Å; C116-F132 HydrophobicContact CB-CE1 3.38Å; C116-F132 HydrophobicContact CB-CE2 3.58Å; C116-F132 HydrophobicContact CB-CG 4.28Å; C116-F132 HydrophobicContact CB-CZ 3.18Å
117	Y	88.4	Confident	86.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-35.4	176	-75.3	-70.8	0	0	0	112.6	L61 F94 P101 L113 A114 I115 L119 I120 G121 F132 S144 Y147 G148	L61-Y117 HydrophobicContact CD2-CD1 4.16Å; F94-Y117 HydrophobicContact CE1-CD2 4.32Å; F94-Y117 HydrophobicContact CE1-CG 4.25Å; P101-Y117 HydrophobicContact CG-CE1 3.93Å; P101-Y117 HydrophobicContact CG-CE2 4.26Å; L113-Y117 HydrophobicContact CB-CE2 4.45Å; L113-Y117 WeakPolarHBondContact O-CD2 3.41Å; L113-Y117 PolarHBondContact O-N 3Å; A114-Y117 PolarHBondContact O-N 3.46Å; I115-Y117 PolarHBondContact O-N 2.88Å; Y117-L119 VanDerWaalsContact C-N 3.33Å; Y117-I120 HydrophobicContact CD1-CD1 4.25Å; Y117-I120 WeakPolarHBondContact O-CB 3.29Å; Y117-I120 PolarHBondContact O-N 2.94Å; Y117-G121 PolarHBondContact O-N 3.24Å; Y117-F132 HydrophobicContact CD1-CZ 4.42Å; Y117-F132 HydrophobicContact CD2-CZ 4.47Å; Y117-F132 HydrophobicContact CE1-CZ 4.35Å; Y117-F132 HydrophobicContact CE2-CE1 4.37Å; Y117-F132 HydrophobicContact CE2-CZ 4.35Å; Y117-F132 HydrophobicContact CG-CZ 4.49Å; Y117-S144 PolarHBondContact OH-O 2.96Å; Y117-S144 PolarHBondContact OH-OG 2.68Å; Y117-Y147 HydrophobicContact CE1-CD1 4.47Å; Y117-G148 PolarHBondContact OH-N 3.01Å
118	V	87.6	Confident	87.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-38.2	172	173	0	0	0	0	111	F63 I87 Q90 A91 A114 I115 I120 G121 N122	F63-V118 HydrophobicContact CE1-CG2 3.75Å; F63-V118 HydrophobicContact CZ-CB 4.41Å; F63-V118 HydrophobicContact CZ-CG2 3.85Å; I87-V118 HydrophobicContact CB-CG1 4.36Å; I87-V118 HydrophobicContact CG2-CB 4.43Å; I87-V118 HydrophobicContact CG2-CG1 3.84Å; Q90-V118 HydrophobicContact CB-CG1 3.85Å; Q90-V118 HydrophobicContact CB-CG2 4.13Å; A91-V118 HydrophobicContact CB-CG2 4.12Å; A114-V118 VanDerWaalsContact O-CG2 3.28Å; A114-V118 WeakPolarHBondContact O-CG2 3.45Å; A114-V118 PolarHBondContact O-N 2.86Å; I115-V118 PolarHBondContact O-N 3.29Å; V118-I120 VanDerWaalsContact C-N 3.31Å; V118-I120 PolarHBondContact O-N 3.19Å; V118-G121 PolarHBondContact O-N 3.06Å; V118-N122 VanDerWaalsContact CG1-ND2 3.32Å; V118-N122 WeakPolarHBondContact CG1-ND2 3.49Å; V118-N122 PolarHBondContact O-N 2.71Å; V118-N122 PolarHBondContact O-ND2 2.84Å
119	L	87.6	Confident	87.6	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-40.7	173.1	-70	172.2	0	0	0	111.7	I87 I115 C116 Y117 N122 G123 L124 E127 A128	I87-L119 HydrophobicContact CD1-CD2 4.03Å; I115-L119 HydrophobicContact CG2-CD1 4.34Å; I115-L119 WeakPolarHBondContact O-CG 3.46Å; I115-L119 PolarHBondContact O-N 3.12Å; C116-L119 WeakPolarHBondContact O-CB 3.42Å; C116-L119 PolarHBondContact O-N 3.44Å; Y117-L119 VanDerWaalsContact C-N 3.33Å; L119-N122 PolarHBondContact O-N 3.46Å; L119-G123 PolarHBondContact O-N 2.68Å; L119-L124 HydrophobicContact CB-CB 4.33Å; L119-L124 HydrophobicContact CD2-CB 4.11Å; L119-L124 HydrophobicContact CD2-CD1 3.73Å; L119-L124 PolarHBondContact O-N 3.09Å; L119-E127 HydrophobicContact CD1-CB 4.21Å; L119-A128 HydrophobicContact CB-CB 3.92Å
120	I	86.4	Confident	88	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-48.4	172.3	-65.3	174.2	0	0	0	110.7	L61 C116 Y117 V118 N122 G123 Y125 A128 F132 G148 I151 A152	L61-I120 HydrophobicContact CD1-CG2 3.83Å; C116-I120 PolarHBondContact O-N 2.88Å; C116-I120 VanDerWaalsContact O-N 3.15Å; Y117-I120 HydrophobicContact CD1-CD1 4.25Å; Y117-I120 WeakPolarHBondContact O-CB 3.29Å; Y117-I120 PolarHBondContact O-N 2.94Å; V118-I120 VanDerWaalsContact C-N 3.31Å; V118-I120 PolarHBondContact O-N 3.19Å; I120-N122 PolarHBondContact O-N 3.17Å; I120-G123 PolarHBondContact O-N 2.89Å; I120-Y125 HydrophobicContact CG2-CD1 4.39Å; I120-Y125 HydrophobicContact CG2-CE1 4.16Å; I120-Y125 WeakPolarHBondContact O-CE1 3.26Å; I120-A128 HydrophobicContact CG1-CB 3.82Å; I120-F132 HydrophobicContact CD1-CE2 3.75Å; I120-F132 HydrophobicContact CD1-CZ 4.22Å; I120-F132 HydrophobicContact CG1-CE2 4.36Å; I120-G148 WeakPolarHBondContact CD1-O 3.19Å; I120-I151 HydrophobicContact CD1-CB 4.41Å; I120-I151 HydrophobicContact CD1-CG2 4.31Å; I120-I151 HydrophobicContact CG2-CG2 4.21Å; I120-A152 HydrophobicContact CD1-CB 4.07Å; I120-A152 HydrophobicContact CG1-CB 4.13Å
121	G	82.5	Confident	88.3	Confident	36 Å²	36	45.1 Å²	45.1	37%	0.371	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-31.5	179.8	0	0	0	0	0	113.7	Y117 V118 G123	Y117-G121 PolarHBondContact O-N 3.24Å; V118-G121 PolarHBondContact O-N 3.06Å; G121-G123 VanDerWaalsContact C-N 3.32Å
122	N	84.3	Confident	88.7	Confident	50 Å²	50	40.9 Å²	40.9	27%	0.267	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5.7	176.3	-72.5	-77	0	0	0	113.8	L82 Q90 V118 L119 I120 L124	L82-N122 HydrophobicContact CD1-CB 4.08Å; L82-N122 WeakPolarHBondContact CD2-OD1 3.44Å; Q90-N122 PolarHBondContact OE1-ND2 3.41Å; V118-N122 VanDerWaalsContact CG1-ND2 3.32Å; V118-N122 WeakPolarHBondContact CG1-ND2 3.49Å; V118-N122 PolarHBondContact O-N 2.71Å; V118-N122 PolarHBondContact O-ND2 2.84Å; L119-N122 PolarHBondContact O-N 3.46Å; I120-N122 PolarHBondContact O-N 3.17Å; N122-L124 VanDerWaalsContact C-N 3.3Å; N122-L124 PolarHBondContact O-N 2.81Å
123	G	84.1	Confident	89	Confident	33 Å²	33	37.2 Å²	37.2	34%	0.34	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	6	179.1	0	0	0	0	0	115.4	L119 I120 G121 Y125	L119-G123 PolarHBondContact O-N 2.68Å; I120-G123 PolarHBondContact O-N 2.89Å; G121-G123 VanDerWaalsContact C-N 3.32Å; G123-Y125 VanDerWaalsContact C-N 3.25Å; G123-Y125 WeakPolarHBondContact O-CD2 3.28Å; G123-Y125 PolarHBondContact O-N 2.86Å
124	L	87.3	Confident	89.2	Confident	55 Å²	55	41.2 Å²	41.2	29%	0.288	22%	0.22	S	C	.	.			trans	-84.8	61	-179.2	-62.5	174	0	0	0	111.3	L82 I87 L119 N122 D126 E127 A128	L82-L124 HydrophobicContact CD1-CD1 4.49Å; I87-L124 HydrophobicContact CD1-CD1 4.4Å; L119-L124 HydrophobicContact CB-CB 4.33Å; L119-L124 HydrophobicContact CD2-CB 4.11Å; L119-L124 HydrophobicContact CD2-CD1 3.73Å; L119-L124 PolarHBondContact O-N 3.09Å; N122-L124 VanDerWaalsContact C-N 3.3Å; N122-L124 PolarHBondContact O-N 2.81Å; L124-D126 PolarHBondContact O-N 2.98Å; L124-E127 PolarHBondContact O-N 3.34Å; L124-A128 PolarHBondContact O-N 2.72Å; L124-A128 VanDerWaalsContact O-N 3.08Å
125	Y	89	Confident	89.5	Confident	72 Å²	72	41.9 Å²	41.9	28%	0.282	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-37.7	-170.6	-50.6	-51.6	0	0	0	113.7	I120 G123 A128 I129 K155	I120-Y125 HydrophobicContact CG2-CD1 4.39Å; I120-Y125 HydrophobicContact CG2-CE1 4.16Å; I120-Y125 WeakPolarHBondContact O-CE1 3.26Å; G123-Y125 VanDerWaalsContact C-N 3.25Å; G123-Y125 WeakPolarHBondContact O-CD2 3.28Å; G123-Y125 PolarHBondContact O-N 2.86Å; Y125-A128 PolarHBondContact O-N 3.39Å; Y125-I129 WeakPolarHBondContact O-CB 3.35Å; Y125-I129 WeakPolarHBondContact O-CD1 3.44Å; Y125-I129 WeakPolarHBondContact O-CG1 3.28Å; Y125-I129 PolarHBondContact O-N 3.39Å; Y125-K155 HydrophobicContact CD1-CB 3.92Å; Y125-K155 HydrophobicContact CD2-CB 4.32Å; Y125-K155 HydrophobicContact CE1-CB 3.61Å; Y125-K155 HydrophobicContact CE1-CG 3.96Å; Y125-K155 HydrophobicContact CE2-CB 4.02Å; Y125-K155 HydrophobicContact CG-CB 4.28Å
126	D	89.7	Confident	89.7	Confident	102 Å²	102	40.2 Å²	40.2	55%	0.545	22%	0.215	S	C	.	.	H	α-helix	trans	-67.1	-39	-179.1	-78.2	-39.6	0	0	0	112.8	L124 K130 K156	L124-D126 PolarHBondContact O-N 2.98Å; D126-K130 PolarHBondContact O-N 3.37Å; D126-K130 VanDerWaalsContact O-N 3.08Å; D126-K156 IonicContact OD1-NZ 3.59Å; D126-K156 PolarHBondContact OD1-NZ 3.35Å; D126-K156 IonicContact OD2-NZ 3.34Å
127	E	89.2	Confident	89.9	Confident	100 Å²	100	47.3 Å²	47.3	47%	0.467	25%	0.248	S	C	.	.	H	α-helix	trans	-67.8	-45.9	174.9	-63.3	-173.6	167.4	0	0	110.2	L119 L124 I129 K130 H131	L119-E127 HydrophobicContact CD1-CB 4.21Å; L124-E127 PolarHBondContact O-N 3.34Å; E127-I129 VanDerWaalsContact C-N 3.35Å; E127-I129 PolarHBondContact O-N 3.47Å; E127-K130 WeakPolarHBondContact O-CB 3.33Å; E127-K130 PolarHBondContact O-N 3.3Å; E127-K130 VanDerWaalsContact O-N 3.14Å; E127-H131 PolarHBondContact O-CD2 3Å; E127-H131 PolarHBondContact O-N 3.28Å
128	A	91	Very high	89.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.7	-48	174.7	0	0	0	0	0	111.7	L119 I120 L124 Y125 K130 H131 F132 A152	L119-A128 HydrophobicContact CB-CB 3.92Å; I120-A128 HydrophobicContact CG1-CB 3.82Å; L124-A128 PolarHBondContact O-N 2.72Å; L124-A128 VanDerWaalsContact O-N 3.08Å; Y125-A128 PolarHBondContact O-N 3.39Å; A128-K130 VanDerWaalsContact C-N 3.3Å; A128-K130 PolarHBondContact O-N 3.48Å; A128-H131 PolarHBondContact O-N 3.14Å; A128-F132 HydrophobicContact CB-CD2 4.35Å; A128-F132 HydrophobicContact CB-CE2 4.18Å; A128-F132 WeakPolarHBondContact O-CD2 3.18Å; A128-F132 PolarHBondContact O-N 3.2Å; A128-A152 HydrophobicContact CB-CB 4.48Å
129	I	93.4	Very high	89.9	Confident	16 Å²	16	56.1 Å²	56.1	8%	0.082	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-41.5	178	-70.5	160.9	0	0	0	111.2	Y125 E127 S133 A152 Y153 K156	Y125-I129 WeakPolarHBondContact O-CB 3.35Å; Y125-I129 WeakPolarHBondContact O-CD1 3.44Å; Y125-I129 WeakPolarHBondContact O-CG1 3.28Å; Y125-I129 PolarHBondContact O-N 3.39Å; E127-I129 VanDerWaalsContact C-N 3.35Å; E127-I129 PolarHBondContact O-N 3.47Å; I129-S133 VanDerWaalsContact O-CB 3.26Å; I129-S133 WeakPolarHBondContact O-CB 3.34Å; I129-S133 PolarHBondContact O-N 3.4Å; I129-S133 PolarHBondContact O-OG 2.95Å; I129-A152 HydrophobicContact CD1-CB 4.18Å; I129-A152 HydrophobicContact CG1-CB 3.59Å; I129-Y153 HydrophobicContact CD1-CD1 3.71Å; I129-Y153 HydrophobicContact CD1-CE1 3.79Å; I129-Y153 HydrophobicContact CD1-CG 4.36Å; I129-Y153 HydrophobicContact CG1-CD1 4.36Å; I129-Y153 HydrophobicContact CG1-CE1 4.29Å; I129-Y153 HydrophobicContact CG2-CE1 3.95Å; I129-Y153 HydrophobicContact CG2-CE2 4.46Å; I129-K156 HydrophobicContact CD1-CD 4.41Å
130	K	93.4	Very high	90.1	Very high	144 Å²	144	59.5 Å²	59.5	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-48	177.5	-175.3	-177.2	177.3	-173.9	0	111.1	D126 E127 A128 S133 L134	D126-K130 PolarHBondContact O-N 3.37Å; D126-K130 VanDerWaalsContact O-N 3.08Å; E127-K130 WeakPolarHBondContact O-CB 3.33Å; E127-K130 PolarHBondContact O-N 3.3Å; E127-K130 VanDerWaalsContact O-N 3.14Å; A128-K130 VanDerWaalsContact C-N 3.3Å; A128-K130 PolarHBondContact O-N 3.48Å; K130-S133 PolarHBondContact O-N 2.88Å; K130-L134 WeakPolarHBondContact O-CG 3.43Å; K130-L134 PolarHBondContact O-N 3.13Å
131	H	91.9	Very high	90.3	Very high	83 Å²	83	65.7 Å²	65.7	38%	0.384	36%	0.355	S	S	.	.	H	α-helix	trans	-65.8	-44.7	179.9	-75	-74.6	0	0	0	112.3	C116 E127 A128 S133 L134 L135	C116-H131 WeakPolarHBondContact SG-CB 3.45Å; E127-H131 PolarHBondContact O-CD2 3Å; E127-H131 PolarHBondContact O-N 3.28Å; A128-H131 PolarHBondContact O-N 3.14Å; H131-S133 VanDerWaalsContact C-N 3.25Å; H131-S133 PolarHBondContact O-N 3.1Å; H131-L134 WeakPolarHBondContact O-CB 3.48Å; H131-L134 PolarHBondContact O-N 2.98Å; H131-L134 VanDerWaalsContact O-N 3.15Å; H131-L135 PolarHBondContact O-N 3.48Å
132	F	94.6	Very high	90.8	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-35.5	172.7	-72.3	-58.3	0	0	0	112.5	L113 C116 Y117 I120 A128 L134 L135 L136 A145 G148 R149	L113-F132 HydrophobicContact CD2-CD1 4.33Å; L113-F132 HydrophobicContact CD2-CE1 3.97Å; C116-F132 HydrophobicContact CB-CD1 3.92Å; C116-F132 HydrophobicContact CB-CD2 4.13Å; C116-F132 HydrophobicContact CB-CE1 3.38Å; C116-F132 HydrophobicContact CB-CE2 3.58Å; C116-F132 HydrophobicContact CB-CG 4.28Å; C116-F132 HydrophobicContact CB-CZ 3.18Å; Y117-F132 HydrophobicContact CD1-CZ 4.42Å; Y117-F132 HydrophobicContact CD2-CZ 4.47Å; Y117-F132 HydrophobicContact CE1-CZ 4.35Å; Y117-F132 HydrophobicContact CE2-CE1 4.37Å; Y117-F132 HydrophobicContact CE2-CZ 4.35Å; Y117-F132 HydrophobicContact CG-CZ 4.49Å; I120-F132 HydrophobicContact CD1-CE2 3.75Å; I120-F132 HydrophobicContact CD1-CZ 4.22Å; I120-F132 HydrophobicContact CG1-CE2 4.36Å; A128-F132 HydrophobicContact CB-CD2 4.35Å; A128-F132 HydrophobicContact CB-CE2 4.18Å; A128-F132 WeakPolarHBondContact O-CD2 3.18Å; A128-F132 PolarHBondContact O-N 3.2Å; F132-L134 VanDerWaalsContact C-N 3.34Å; F132-L134 PolarHBondContact O-N 3.07Å; F132-L135 HydrophobicContact CD1-CD1 4.31Å; F132-L135 WeakPolarHBondContact O-CB 3.4Å; F132-L135 PolarHBondContact O-N 2.83Å; F132-L136 WeakPolarHBondContact O-CB 3.36Å; F132-L136 WeakPolarHBondContact O-CD1 3.4Å; F132-L136 WeakPolarHBondContact O-CG 3.4Å; F132-L136 PolarHBondContact O-N 3.42Å; F132-A145 HydrophobicContact CD1-CB 3.89Å; F132-G148 VanDerWaalsContact CE2-C 3.43Å; F132-R149 HydrophobicContact CB-CB 3.78Å; F132-R149 HydrophobicContact CB-CG 4.25Å; F132-R149 HydrophobicContact CD2-CB 4.28Å; F132-R149 HydrophobicContact CG-CB 4.18Å
133	S	94.6	Very high	91.2	Very high	28 Å²	28	63.2 Å²	63.2	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-68.6	-32.3	177.4	-61.3	0	0	0	0	113	I129 K130 H131 Q137 R149	I129-S133 VanDerWaalsContact O-CB 3.26Å; I129-S133 WeakPolarHBondContact O-CB 3.34Å; I129-S133 PolarHBondContact O-N 3.4Å; I129-S133 PolarHBondContact O-OG 2.95Å; K130-S133 PolarHBondContact O-N 2.88Å; H131-S133 VanDerWaalsContact C-N 3.25Å; H131-S133 PolarHBondContact O-N 3.1Å; S133-Q137 WeakPolarHBondContact O-CG 3.33Å; S133-Q137 PolarHBondContact O-N 3.49Å; S133-Q137 VanDerWaalsContact O-N 3.1Å; S133-R149 WeakPolarHBondContact OG-CD 3.42Å; S133-R149 PolarHBondContact OG-NH1 3.02Å
134	L	94.1	Very high	91.5	Very high	84 Å²	84	61.7 Å²	61.7	44%	0.44	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-43	172.3	-69.2	170	0	0	0	111.4	K130 H131 F132 L136 Q137 S138	K130-L134 WeakPolarHBondContact O-CG 3.43Å; K130-L134 PolarHBondContact O-N 3.13Å; H131-L134 WeakPolarHBondContact O-CB 3.48Å; H131-L134 PolarHBondContact O-N 2.98Å; H131-L134 VanDerWaalsContact O-N 3.15Å; F132-L134 VanDerWaalsContact C-N 3.34Å; F132-L134 PolarHBondContact O-N 3.07Å; L134-L136 VanDerWaalsContact C-N 3.29Å; L134-L136 PolarHBondContact O-N 2.84Å; L134-Q137 WeakPolarHBondContact O-CB 3.48Å; L134-Q137 PolarHBondContact O-N 2.72Å; L134-S138 PolarHBondContact O-N 3.44Å
135	L	91.9	Very high	91.8	Very high	14 Å²	14	59 Å²	59	7%	0.073	30%	0.304	C	S	.	.	H	α-helix	trans	-57.6	-44.7	173.6	-74.7	173.4	0	0	0	111.3	T109 E112 L113 H131 F132 Q137 S138 D139 L142 A145	T109-L135 HydrophobicContact CG2-CD2 4.44Å; E112-L135 HydrophobicContact CB-CD2 4.25Å; E112-L135 WeakPolarHBondContact OE2-CD2 3.45Å; L113-L135 HydrophobicContact CD2-CD1 3.75Å; L113-L135 HydrophobicContact CG-CD1 4.23Å; H131-L135 PolarHBondContact O-N 3.48Å; F132-L135 HydrophobicContact CD1-CD1 4.31Å; F132-L135 WeakPolarHBondContact O-CB 3.4Å; F132-L135 PolarHBondContact O-N 2.83Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; L135-Q137 PolarHBondContact O-N 3.2Å; L135-S138 WeakPolarHBondContact O-CB 3.14Å; L135-S138 PolarHBondContact O-N 3.12Å; L135-S138 VanDerWaalsContact O-N 3.1Å; L135-D139 PolarHBondContact O-N 2.86Å; L135-L142 HydrophobicContact CB-CD2 4.15Å; L135-A145 HydrophobicContact CB-CB 4.04Å; L135-A145 HydrophobicContact CD1-CB 4.33Å
136	L	93.3	Very high	92	Very high	14 Å²	14	55.6 Å²	55.6	7%	0.073	29%	0.29	C	S	.	.	H	α-helix	trans	-74	-14.9	-179.3	-67.5	167.9	0	0	0	114.6	F132 L134 D139 P140 L142 A145 I146 R149	F132-L136 WeakPolarHBondContact O-CB 3.36Å; F132-L136 WeakPolarHBondContact O-CD1 3.4Å; F132-L136 WeakPolarHBondContact O-CG 3.4Å; F132-L136 PolarHBondContact O-N 3.42Å; L134-L136 VanDerWaalsContact C-N 3.29Å; L134-L136 PolarHBondContact O-N 2.84Å; L136-D139 WeakPolarHBondContact CA-O 3.29Å; L136-D139 CarbonylContact O-C 3.59Å; L136-P140 WeakPolarHBondContact O-CA 3.36Å; L136-L142 HydrophobicContact CD2-CB 4.21Å; L136-A145 HydrophobicContact CD1-CB 4.27Å; L136-A145 HydrophobicContact CD2-CB 3.8Å; L136-A145 HydrophobicContact CG-CB 3.78Å; L136-I146 HydrophobicContact CD1-CG1 4.38Å; L136-I146 HydrophobicContact CD2-CD1 4.46Å; L136-I146 HydrophobicContact CD2-CG1 3.51Å; L136-R149 HydrophobicContact CD1-CB 4.47Å
137	Q	92.8	Very high	92.2	Very high	151 Å²	151	51 Å²	51	71%	0.706	27%	0.265	S	S	*	.	H	α-helix	trans	-73.2	-34.4	167.7	-76.7	172.5	7.5	0	0	111.4	S133 L134 L135	S133-Q137 WeakPolarHBondContact O-CG 3.33Å; S133-Q137 PolarHBondContact O-N 3.49Å; S133-Q137 VanDerWaalsContact O-N 3.1Å; L134-Q137 WeakPolarHBondContact O-CB 3.48Å; L134-Q137 PolarHBondContact O-N 2.72Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; L135-Q137 PolarHBondContact O-N 3.2Å
138	S	88.5	Confident	92.3	Very high	110 Å²	110	46.2 Å²	46.2	77%	0.769	24%	0.243	S	C	*	.	H	α-helix	trans	-79.2	-43	178.8	-55.6	0	0	0	0	111.5	L134 L135	L134-S138 PolarHBondContact O-N 3.44Å; L135-S138 WeakPolarHBondContact O-CB 3.14Å; L135-S138 PolarHBondContact O-N 3.12Å; L135-S138 VanDerWaalsContact O-N 3.1Å
139	D	89.2	Confident	92.4	Very high	75 Å²	75	47.9 Å²	47.9	40%	0.401	25%	0.249	S	C	.	.			trans	-135.3	99.5	176.3	-179.9	3.6	0	0	0	110.8	L135 L136 E141 L142	L135-D139 PolarHBondContact O-N 2.86Å; L136-D139 WeakPolarHBondContact CA-O 3.29Å; L136-D139 CarbonylContact O-C 3.59Å; D139-E141 PolarHBondContact O-N 3.2Å; D139-E141 PolarHBondContact OD1-N 3.02Å; D139-E141 VanDerWaalsContact OD1-N 3.09Å; D139-L142 HydrophobicContact CB-CB 4.04Å; D139-L142 WeakPolarHBondContact O-CB 3.29Å; D139-L142 PolarHBondContact O-N 3.35Å; D139-L142 PolarHBondContact OD1-N 3.23Å
140	P	90.8	Very high	92.3	Very high	77 Å²	77	47.1 Å²	47.1	50%	0.5	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	-178.2	-24.4	35.3	0	0	0	115.3	L136 R173	L136-P140 WeakPolarHBondContact O-CA 3.36Å; P140-R173 PolarHBondContact O-NH2 3.23Å
141	E	90.9	Very high	92.2	Very high	136 Å²	136	40.5 Å²	40.5	64%	0.636	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102	7.4	-177	-66	-172.4	171.5	0	0	112.7	D139 V143	D139-E141 PolarHBondContact O-N 3.2Å; D139-E141 PolarHBondContact OD1-N 3.02Å; D139-E141 VanDerWaalsContact OD1-N 3.09Å; E141-V143 PolarHBondContact O-N 3.14Å
142	L	93.2	Very high	92.1	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.047	20%	0.198	C	C	.	.			trans	-62.1	93.1	177.1	-178.1	58.8	0	0	0	111.8	V104 T109 L135 L136 D139 S144 A145 I146	V104-L142 HydrophobicContact CG1-CD1 3.58Å; T109-L142 HydrophobicContact CG2-CD2 4.04Å; L135-L142 HydrophobicContact CB-CD2 4.15Å; L136-L142 HydrophobicContact CD2-CB 4.21Å; D139-L142 HydrophobicContact CB-CB 4.04Å; D139-L142 WeakPolarHBondContact O-CB 3.29Å; D139-L142 PolarHBondContact O-N 3.35Å; D139-L142 PolarHBondContact OD1-N 3.23Å; L142-S144 VanDerWaalsContact C-N 3.3Å; L142-S144 PolarHBondContact O-N 2.71Å; L142-A145 HydrophobicContact CB-CB 4.22Å; L142-A145 HydrophobicContact CD2-CB 3.63Å; L142-A145 HydrophobicContact CG-CB 3.79Å; L142-A145 PolarHBondContact O-N 3.25Å; L142-I146 WeakPolarHBondContact O-CG1 3.43Å; L142-I146 PolarHBondContact O-N 2.89Å
143	V	91.9	Very high	92	Very high	24 Å²	24	38.3 Å²	38.3	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-54.1	-43	-172.1	-176.8	0	0	0	0	112.4	F102 E141 A145 I146 Y147 V174 L177 E178	F102-V143 HydrophobicContact CB-CB 4.34Å; F102-V143 HydrophobicContact CB-CG1 4.29Å; F102-V143 HydrophobicContact CD1-CB 4.4Å; F102-V143 HydrophobicContact CD1-CG1 3.63Å; F102-V143 HydrophobicContact CD2-CG1 4.03Å; F102-V143 HydrophobicContact CE1-CG1 3.85Å; F102-V143 HydrophobicContact CE2-CG1 4.26Å; F102-V143 HydrophobicContact CG-CB 4.3Å; F102-V143 HydrophobicContact CG-CG1 3.72Å; F102-V143 HydrophobicContact CZ-CG1 4.18Å; E141-V143 PolarHBondContact O-N 3.14Å; V143-A145 VanDerWaalsContact C-N 3.35Å; V143-A145 PolarHBondContact O-N 3.03Å; V143-I146 PolarHBondContact O-N 2.93Å; V143-Y147 VanDerWaalsContact O-CB 3.31Å; V143-Y147 WeakPolarHBondContact O-CB 3.33Å; V143-Y147 PolarHBondContact O-N 3.4Å; V143-V174 HydrophobicContact CG1-CG1 3.93Å; V143-L177 HydrophobicContact CG2-CB 4.14Å; V143-L177 HydrophobicContact CG2-CD1 3.95Å; V143-E178 HydrophobicContact CG1-CG 4.12Å; V143-E178 HydrophobicContact CG2-CG 4.24Å
144	S	91.6	Very high	91.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-41.8	178.3	-166	0	0	0	0	112.6	P101 F102 Y117 L142 Y147 G148	P101-S144 VanDerWaalsContact O-CB 3.23Å; P101-S144 WeakPolarHBondContact O-CB 3.47Å; P101-S144 PolarHBondContact O-OG 3.09Å; F102-S144 WeakPolarHBondContact O-CB 3.43Å; Y117-S144 PolarHBondContact OH-O 2.96Å; Y117-S144 PolarHBondContact OH-OG 2.68Å; L142-S144 VanDerWaalsContact C-N 3.3Å; L142-S144 PolarHBondContact O-N 2.71Å; S144-Y147 PolarHBondContact O-N 3.29Å; S144-G148 PolarHBondContact O-N 3.46Å
145	A	92.3	Very high	91.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-73.2	-35.5	179.2	0	0	0	0	0	112.1	L113 F132 L135 L136 L142 V143 R149	L113-A145 HydrophobicContact CD2-CB 4.04Å; F132-A145 HydrophobicContact CD1-CB 3.89Å; L135-A145 HydrophobicContact CB-CB 4.04Å; L135-A145 HydrophobicContact CD1-CB 4.33Å; L136-A145 HydrophobicContact CD1-CB 4.27Å; L136-A145 HydrophobicContact CD2-CB 3.8Å; L136-A145 HydrophobicContact CG-CB 3.78Å; L142-A145 HydrophobicContact CB-CB 4.22Å; L142-A145 HydrophobicContact CD2-CB 3.63Å; L142-A145 HydrophobicContact CG-CB 3.79Å; L142-A145 PolarHBondContact O-N 3.25Å; V143-A145 VanDerWaalsContact C-N 3.35Å; V143-A145 PolarHBondContact O-N 3.03Å; A145-R149 WeakPolarHBondContact O-CB 3.41Å; A145-R149 PolarHBondContact O-N 3.42Å
146	I	94.3	Very high	90.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.7	-49.5	172.1	-59.9	173.6	0	0	0	109.6	L136 L142 V143 R149 G150 E170 R173 V174 L177	L136-I146 HydrophobicContact CD1-CG1 4.38Å; L136-I146 HydrophobicContact CD2-CD1 4.46Å; L136-I146 HydrophobicContact CD2-CG1 3.51Å; L142-I146 WeakPolarHBondContact O-CG1 3.43Å; L142-I146 PolarHBondContact O-N 2.89Å; V143-I146 PolarHBondContact O-N 2.93Å; I146-R149 PolarHBondContact O-N 3.03Å; I146-G150 PolarHBondContact O-N 3.11Å; I146-E170 HydrophobicContact CG2-CB 4.1Å; I146-E170 WeakPolarHBondContact CG2-O 3.49Å; I146-E170 WeakPolarHBondContact CG2-OE2 3.45Å; I146-R173 HydrophobicContact CG2-CB 3.98Å; I146-V174 HydrophobicContact CB-CG2 4.03Å; I146-V174 HydrophobicContact CG2-CG2 3.55Å; I146-L177 HydrophobicContact CD1-CD1 3.83Å
147	Y	93.5	Very high	89.7	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-51.4	-179.8	179.6	-116.2	0	0	0	112.1	P101 F102 Y117 V143 S144 R149 G150 I151 L171 V174 V184 Q187	P101-Y147 HydrophobicContact CB-CD1 3.73Å; P101-Y147 HydrophobicContact CB-CE1 3.78Å; P101-Y147 HydrophobicContact CG-CD1 4.14Å; P101-Y147 HydrophobicContact CG-CE1 3.91Å; F102-Y147 HydrophobicContact CD2-CD1 4.13Å; F102-Y147 HydrophobicContact CD2-CG 4.28Å; F102-Y147 AromaticContact CE2-CD1 3.76Å; F102-Y147 HydrophobicContact CE2-CD1 3.76Å; F102-Y147 HydrophobicContact CE2-CD2 4.22Å; F102-Y147 HydrophobicContact CE2-CE1 4.28Å; F102-Y147 AromaticContact CE2-CG 3.71Å; F102-Y147 HydrophobicContact CE2-CG 3.71Å; Y117-Y147 HydrophobicContact CE1-CD1 4.47Å; V143-Y147 VanDerWaalsContact O-CB 3.31Å; V143-Y147 WeakPolarHBondContact O-CB 3.33Å; V143-Y147 PolarHBondContact O-N 3.4Å; S144-Y147 PolarHBondContact O-N 3.29Å; Y147-R149 VanDerWaalsContact C-N 3.35Å; Y147-R149 PolarHBondContact O-N 3.43Å; Y147-G150 PolarHBondContact O-N 3.14Å; Y147-G150 VanDerWaalsContact O-N 3.15Å; Y147-I151 HydrophobicContact CD1-CD1 3.81Å; Y147-I151 HydrophobicContact CD2-CD1 4.33Å; Y147-I151 HydrophobicContact CE1-CD1 3.36Å; Y147-I151 HydrophobicContact CE1-CG1 4.5Å; Y147-I151 HydrophobicContact CE2-CD1 3.91Å; Y147-I151 HydrophobicContact CE2-CG1 4.27Å; Y147-I151 HydrophobicContact CG-CD1 4.28Å; Y147-I151 VanDerWaalsContact CZ-CD1 3.42Å; Y147-I151 WeakPolarHBondContact O-CG1 3.25Å; Y147-I151 PolarHBondContact O-N 2.77Å; Y147-L171 HydrophobicContact CD2-CD2 3.92Å; Y147-L171 HydrophobicContact CE2-CD2 4.14Å; Y147-V174 HydrophobicContact CD2-CG2 4.46Å; Y147-V184 HydrophobicContact CD2-CG2 4.1Å; Y147-V184 HydrophobicContact CE2-CB 4.45Å; Y147-V184 HydrophobicContact CE2-CG2 3.93Å; Y147-Q187 HydrophobicContact CE2-CG 4.3Å
148	G	90.6	Very high	88.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-40.9	177.6	0	0	0	0	0	113	Y117 I120 F132 S144 I151 A152	Y117-G148 PolarHBondContact OH-N 3.01Å; I120-G148 WeakPolarHBondContact CD1-O 3.19Å; F132-G148 VanDerWaalsContact CE2-C 3.43Å; S144-G148 PolarHBondContact O-N 3.46Å; G148-I151 PolarHBondContact O-N 2.8Å; G148-A152 PolarHBondContact O-N 3.34Å
149	R	94	Very high	86.6	Confident	36 Å²	36	41.2 Å²	41.2	14%	0.136	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-40.5	174.1	-167.6	165.7	73.6	-174	-4.9	112.2	F132 S133 L136 A145 I146 Y147 A152 Y153 E170	F132-R149 HydrophobicContact CB-CB 3.78Å; F132-R149 HydrophobicContact CB-CG 4.25Å; F132-R149 HydrophobicContact CD2-CB 4.28Å; F132-R149 HydrophobicContact CG-CB 4.18Å; S133-R149 WeakPolarHBondContact OG-CD 3.42Å; S133-R149 PolarHBondContact OG-NH1 3.02Å; L136-R149 HydrophobicContact CD1-CB 4.47Å; A145-R149 WeakPolarHBondContact O-CB 3.41Å; A145-R149 PolarHBondContact O-N 3.42Å; I146-R149 PolarHBondContact O-N 3.03Å; Y147-R149 VanDerWaalsContact C-N 3.35Å; Y147-R149 PolarHBondContact O-N 3.43Å; R149-A152 PolarHBondContact O-N 3.04Å; R149-Y153 HydrophobicContact CG-CD2 3.9Å; R149-Y153 HydrophobicContact CG-CE2 3.58Å; R149-Y153 VanDerWaalsContact O-CD2 3.28Å; R149-Y153 WeakPolarHBondContact O-CD2 3.25Å; R149-Y153 PolarHBondContact O-N 3.5Å; R149-E170 IonicContact CZ-OE1 3.71Å; R149-E170 IonicContact NE-OE1 2.7Å; R149-E170 PolarHBondContact NE-OE1 3.04Å; R149-E170 IonicContact NH2-OE1 3.01Å; R149-E170 PolarHBondContact NH2-OE1 3.03Å; R149-E170 IonicContact NH2-OE2 2.74Å
150	G	92.1	Very high	85.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-46.4	174.3	0	0	0	0	0	112.5	I146 Y147 Y153 G154 A167	I146-G150 PolarHBondContact O-N 3.11Å; Y147-G150 PolarHBondContact O-N 3.14Å; Y147-G150 VanDerWaalsContact O-N 3.15Å; G150-Y153 PolarHBondContact O-N 3.22Å; G150-G154 PolarHBondContact O-N 3.08Å; G150-A167 WeakPolarHBondContact O-CB 3.27Å
151	I	90.4	Very high	85.3	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-46.3	174.9	-66.7	164.7	0	0	0	110.9	L61 I120 Y147 G148 Y153 G154 K155 Q187	L61-I151 HydrophobicContact CD1-CG2 4.38Å; I120-I151 HydrophobicContact CD1-CB 4.41Å; I120-I151 HydrophobicContact CD1-CG2 4.31Å; I120-I151 HydrophobicContact CG2-CG2 4.21Å; Y147-I151 HydrophobicContact CD1-CD1 3.81Å; Y147-I151 HydrophobicContact CD2-CD1 4.33Å; Y147-I151 HydrophobicContact CE1-CD1 3.36Å; Y147-I151 HydrophobicContact CE1-CG1 4.5Å; Y147-I151 HydrophobicContact CE2-CD1 3.91Å; Y147-I151 HydrophobicContact CE2-CG1 4.27Å; Y147-I151 HydrophobicContact CG-CD1 4.28Å; Y147-I151 VanDerWaalsContact CZ-CD1 3.42Å; Y147-I151 WeakPolarHBondContact O-CG1 3.25Å; Y147-I151 PolarHBondContact O-N 2.77Å; G148-I151 PolarHBondContact O-N 2.8Å; I151-Y153 VanDerWaalsContact C-N 3.35Å; I151-Y153 PolarHBondContact O-N 2.9Å; I151-G154 CarbonylContact O-C 3.54Å; I151-G154 WeakPolarHBondContact O-CA 3.49Å; I151-G154 PolarHBondContact O-N 3.02Å; I151-G154 VanDerWaalsContact O-N 3.07Å; I151-K155 HydrophobicContact CG2-CG 4.28Å; I151-K155 WeakPolarHBondContact O-CG 3.46Å; I151-K155 PolarHBondContact O-N 3.17Å; I151-Q187 HydrophobicContact CG1-CG 4.5Å
152	A	90.5	Very high	85	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-41.7	-179.5	0	0	0	0	0	112.1	I120 A128 I129 G148 R149 G154 K155 K156	I120-A152 HydrophobicContact CD1-CB 4.07Å; I120-A152 HydrophobicContact CG1-CB 4.13Å; A128-A152 HydrophobicContact CB-CB 4.48Å; I129-A152 HydrophobicContact CD1-CB 4.18Å; I129-A152 HydrophobicContact CG1-CB 3.59Å; G148-A152 PolarHBondContact O-N 3.34Å; R149-A152 PolarHBondContact O-N 3.04Å; A152-G154 VanDerWaalsContact C-N 3.35Å; A152-K155 PolarHBondContact O-N 2.87Å; A152-K156 WeakPolarHBondContact O-CB 3.31Å; A152-K156 PolarHBondContact O-N 3.31Å; A152-K156 VanDerWaalsContact O-N 3.12Å
153	Y	91.2	Very high	84.8	Confident	38 Å²	38	45 Å²	45	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-39.7	171.1	-78.1	-51.9	0	0	0	112.3	I129 R149 G150 I151 K156 S157 N163 L166 E170	I129-Y153 HydrophobicContact CD1-CD1 3.71Å; I129-Y153 HydrophobicContact CD1-CE1 3.79Å; I129-Y153 HydrophobicContact CD1-CG 4.36Å; I129-Y153 HydrophobicContact CG1-CD1 4.36Å; I129-Y153 HydrophobicContact CG1-CE1 4.29Å; I129-Y153 HydrophobicContact CG2-CE1 3.95Å; I129-Y153 HydrophobicContact CG2-CE2 4.46Å; R149-Y153 HydrophobicContact CG-CD2 3.9Å; R149-Y153 HydrophobicContact CG-CE2 3.58Å; R149-Y153 VanDerWaalsContact O-CD2 3.28Å; R149-Y153 WeakPolarHBondContact O-CD2 3.25Å; R149-Y153 PolarHBondContact O-N 3.5Å; G150-Y153 PolarHBondContact O-N 3.22Å; I151-Y153 VanDerWaalsContact C-N 3.35Å; I151-Y153 PolarHBondContact O-N 2.9Å; Y153-K156 CarbonylContact O-C 3.55Å; Y153-K156 PolarHBondContact O-N 3.19Å; Y153-S157 WeakPolarHBondContact O-CB 3.44Å; Y153-S157 PolarHBondContact O-N 3.36Å; Y153-N163 HydrophobicContact CD1-CB 4.44Å; Y153-L166 HydrophobicContact CD1-CB 4.21Å; Y153-L166 HydrophobicContact CD1-CD1 4.17Å; Y153-L166 HydrophobicContact CD2-CB 3.89Å; Y153-L166 HydrophobicContact CE1-CB 4.44Å; Y153-L166 HydrophobicContact CE1-CD1 3.77Å; Y153-L166 HydrophobicContact CE2-CB 4.11Å; Y153-L166 HydrophobicContact CE2-CD1 4.46Å; Y153-L166 HydrophobicContact CG-CB 3.96Å; Y153-E170 HydrophobicContact CD2-CG 4.42Å
154	G	85.9	Confident	84.5	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-41.1	177	0	0	0	0	0	113.1	G150 I151 A152 K156 S157	G150-G154 PolarHBondContact O-N 3.08Å; I151-G154 CarbonylContact O-C 3.54Å; I151-G154 WeakPolarHBondContact O-CA 3.49Å; I151-G154 PolarHBondContact O-N 3.02Å; I151-G154 VanDerWaalsContact O-N 3.07Å; A152-G154 VanDerWaalsContact C-N 3.35Å; G154-K156 PolarHBondContact O-N 3.37Å; G154-S157 WeakPolarHBondContact O-CB 3.22Å; G154-S157 PolarHBondContact O-N 3.37Å; G154-S157 VanDerWaalsContact O-N 3.11Å; G154-S157 PolarHBondContact O-OG 2.81Å
155	K	84.6	Confident	84.5	Confident	70 Å²	70	48.8 Å²	48.8	30%	0.304	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-33.9	173.2	-67.8	-65.5	-174.4	177	0	111.7	Y125 I151 A152	Y125-K155 HydrophobicContact CD1-CB 3.92Å; Y125-K155 HydrophobicContact CD2-CB 4.32Å; Y125-K155 HydrophobicContact CE1-CB 3.61Å; Y125-K155 HydrophobicContact CE1-CG 3.96Å; Y125-K155 HydrophobicContact CE2-CB 4.02Å; Y125-K155 HydrophobicContact CG-CB 4.28Å; I151-K155 HydrophobicContact CG2-CG 4.28Å; I151-K155 WeakPolarHBondContact O-CG 3.46Å; I151-K155 PolarHBondContact O-N 3.17Å; A152-K155 PolarHBondContact O-N 2.87Å
156	K	83.3	Confident	84.5	Confident	52 Å²	52	51.6 Å²	51.6	23%	0.226	25%	0.252	C	S	.	.	H	α-helix	trans	-77.9	-18.9	174	-159.8	176.4	174.2	175.9	0	113.6	D126 I129 A152 Y153 G154 L158 Q159 N163	D126-K156 IonicContact OD1-NZ 3.59Å; D126-K156 PolarHBondContact OD1-NZ 3.35Å; D126-K156 IonicContact OD2-NZ 3.34Å; I129-K156 HydrophobicContact CD1-CD 4.41Å; A152-K156 WeakPolarHBondContact O-CB 3.31Å; A152-K156 PolarHBondContact O-N 3.31Å; A152-K156 VanDerWaalsContact O-N 3.12Å; Y153-K156 CarbonylContact O-C 3.55Å; Y153-K156 PolarHBondContact O-N 3.19Å; G154-K156 PolarHBondContact O-N 3.37Å; K156-L158 PolarHBondContact O-N 3.43Å; K156-Q159 PolarHBondContact O-N 3.26Å; K156-Q159 VanDerWaalsContact O-N 3.11Å; K156-N163 HydrophobicContact CB-CB 4.46Å
157	S	72.4	Confident	84.4	Confident	20 Å²	20	51.6 Å²	51.6	14%	0.14	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.3	-175.6	74.6	0	0	0	0	114	Y153 G154 Q159 D160 A164	Y153-S157 WeakPolarHBondContact O-CB 3.44Å; Y153-S157 PolarHBondContact O-N 3.36Å; G154-S157 WeakPolarHBondContact O-CB 3.22Å; G154-S157 PolarHBondContact O-N 3.37Å; G154-S157 VanDerWaalsContact O-N 3.11Å; G154-S157 PolarHBondContact O-OG 2.81Å; S157-Q159 PolarHBondContact O-N 3.46Å; S157-Q159 VanDerWaalsContact O-N 3.1Å; S157-D160 PolarHBondContact O-N 2.88Å; S157-A164 VanDerWaalsContact CB-CA 3.46Å
158	L	58.6	Low	84.4	Confident	136 Å²	136	51.8 Å²	51.8	71%	0.712	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.1	170.3	-66.9	170.7	0	0	0	112.8	K156	K156-L158 PolarHBondContact O-N 3.43Å
159	Q	58.6	Low	84.6	Confident	173 Å²	173	58.3 Å²	58.3	81%	0.808	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-16.1	-177.3	-60.5	178	-5.5	0	0	114.1	K156 S157	K156-Q159 PolarHBondContact O-N 3.26Å; K156-Q159 VanDerWaalsContact O-N 3.11Å; S157-Q159 PolarHBondContact O-N 3.46Å; S157-Q159 VanDerWaalsContact O-N 3.1Å
160	D	72.8	Confident	84.6	Confident	74 Å²	74	57 Å²	57	40%	0.396	28%	0.275	S	S	.	.			trans	-157.6	124.5	-175.8	179.6	1.6	0	0	0	111.8	S157 K162 N163	S157-D160 PolarHBondContact O-N 2.88Å; D160-K162 PolarHBondContact O-N 3.44Å; D160-K162 WeakPolarHBondContact OD1-CB 3.48Å; D160-K162 PolarHBondContact OD1-N 2.98Å; D160-N163 PolarHBondContact O-N 3.06Å; D160-N163 VanDerWaalsContact O-N 3.16Å
161	M	78.5	Confident	84.7	Confident	145 Å²	145	57 Å²	57	71%	0.714	28%	0.275	S	S	*	.	H	α-helix	trans	-60.1	-29.1	178.5	-74.9	-144.2	-81.4	0	0	113.4	N163 A164 D165 L195	M161-N163 VanDerWaalsContact C-N 3.29Å; M161-N163 PolarHBondContact O-N 3.5Å; M161-A164 VanDerWaalsContact O-CB 3.27Å; M161-A164 WeakPolarHBondContact O-CB 3.45Å; M161-A164 PolarHBondContact O-N 2.84Å; M161-A164 VanDerWaalsContact O-N 3.12Å; M161-D165 PolarHBondContact O-N 3.29Å; M161-L195 HydrophobicContact SD-CD2 4.48Å
162	K	85.3	Confident	85	Confident	142 Å²	142	60.5 Å²	60.5	62%	0.617	29%	0.293	S	S	*	.	H	α-helix	trans	-64.6	-35	178.6	-172.1	-178.3	178.3	-174.8	0	112.2	D160 A164 D165 L166	D160-K162 PolarHBondContact O-N 3.44Å; D160-K162 WeakPolarHBondContact OD1-CB 3.48Å; D160-K162 PolarHBondContact OD1-N 2.98Å; K162-A164 VanDerWaalsContact C-N 3.3Å; K162-D165 PolarHBondContact O-N 2.85Å; K162-L166 WeakPolarHBondContact O-CG 3.48Å; K162-L166 PolarHBondContact O-N 3.29Å
163	N	87.8	Confident	85.2	Confident	16 Å²	16	63.4 Å²	63.4	9%	0.086	30%	0.304	C	S	.	.	H	α-helix	trans	-71.2	-30.1	176.4	-66.8	-42.9	0	0	0	111.3	Y153 K156 D160 M161 L166 A167	Y153-N163 HydrophobicContact CD1-CB 4.44Å; K156-N163 HydrophobicContact CB-CB 4.46Å; D160-N163 PolarHBondContact O-N 3.06Å; D160-N163 VanDerWaalsContact O-N 3.16Å; M161-N163 VanDerWaalsContact C-N 3.29Å; M161-N163 PolarHBondContact O-N 3.5Å; N163-L166 PolarHBondContact O-N 3.43Å; N163-A167 WeakPolarHBondContact O-CB 3.41Å; N163-A167 PolarHBondContact O-N 3.49Å
164	A	87.1	Confident	85.4	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-46.4	174.4	0	0	0	0	0	111.1	S157 M161 K162 L166 A167 L168 I191 L195	S157-A164 VanDerWaalsContact CB-CA 3.46Å; M161-A164 VanDerWaalsContact O-CB 3.27Å; M161-A164 WeakPolarHBondContact O-CB 3.45Å; M161-A164 PolarHBondContact O-N 2.84Å; M161-A164 VanDerWaalsContact O-N 3.12Å; K162-A164 VanDerWaalsContact C-N 3.3Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.92Å; A164-A167 WeakPolarHBondContact O-CB 3.15Å; A164-A167 PolarHBondContact O-N 3.4Å; A164-L168 VanDerWaalsContact O-CG 3.28Å; A164-L168 WeakPolarHBondContact O-CG 3.45Å; A164-L168 PolarHBondContact O-N 3.25Å; A164-I191 HydrophobicContact CB-CG2 4.26Å; A164-L195 HydrophobicContact CB-CD1 3.86Å; A164-L195 HydrophobicContact CB-CD2 3.92Å; A164-L195 HydrophobicContact CB-CG 4.34Å
165	D	90.1	Very high	85.8	Confident	103 Å²	103	62.2 Å²	62.2	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-62.4	-40.5	177.3	-72.1	-31.4	0	0	0	112.2	M161 K162 L168 Y169	M161-D165 PolarHBondContact O-N 3.29Å; K162-D165 PolarHBondContact O-N 2.85Å; D165-L168 PolarHBondContact O-N 2.89Å; D165-Y169 WeakPolarHBondContact O-CB 3.48Å; D165-Y169 PolarHBondContact O-N 2.83Å
166	L	92.6	Very high	86.3	Confident	59 Å²	59	63 Å²	63	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-43.5	174.6	-69.5	172.6	0	0	0	111.6	Y153 K162 N163 A164 Y169 E170	Y153-L166 HydrophobicContact CD1-CB 4.21Å; Y153-L166 HydrophobicContact CD1-CD1 4.17Å; Y153-L166 HydrophobicContact CD2-CB 3.89Å; Y153-L166 HydrophobicContact CE1-CB 4.44Å; Y153-L166 HydrophobicContact CE1-CD1 3.77Å; Y153-L166 HydrophobicContact CE2-CB 4.11Å; Y153-L166 HydrophobicContact CE2-CD1 4.46Å; Y153-L166 HydrophobicContact CG-CB 3.96Å; K162-L166 WeakPolarHBondContact O-CG 3.48Å; K162-L166 PolarHBondContact O-N 3.29Å; N163-L166 PolarHBondContact O-N 3.43Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.92Å; L166-Y169 WeakPolarHBondContact O-CB 3.4Å; L166-Y169 PolarHBondContact O-N 3.37Å; L166-E170 WeakPolarHBondContact O-CG 3.31Å; L166-E170 PolarHBondContact O-N 2.91Å
167	A	92.6	Very high	86.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-47.8	177.3	0	0	0	0	0	111.6	G150 N163 A164 Y169 E170 L171 I191	G150-A167 WeakPolarHBondContact O-CB 3.27Å; N163-A167 WeakPolarHBondContact O-CB 3.41Å; N163-A167 PolarHBondContact O-N 3.49Å; A164-A167 WeakPolarHBondContact O-CB 3.15Å; A164-A167 PolarHBondContact O-N 3.4Å; A167-Y169 VanDerWaalsContact C-N 3.3Å; A167-Y169 PolarHBondContact O-N 2.78Å; A167-E170 PolarHBondContact O-N 3.29Å; A167-L171 VanDerWaalsContact O-CG 3.32Å; A167-L171 WeakPolarHBondContact O-CG 3.02Å; A167-L171 PolarHBondContact O-N 3.06Å; A167-I191 HydrophobicContact CB-CD1 3.72Å
168	L	93.5	Very high	87.7	Confident	8 Å²	8	66.6 Å²	66.6	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-62.6	-38.2	177.4	-65.3	177	0	0	0	111.9	A164 D165 N172 R188 I191 L192 L195 R197	A164-L168 VanDerWaalsContact O-CG 3.28Å; A164-L168 WeakPolarHBondContact O-CG 3.45Å; A164-L168 PolarHBondContact O-N 3.25Å; D165-L168 PolarHBondContact O-N 2.89Å; L168-N172 WeakPolarHBondContact O-CB 3.26Å; L168-N172 PolarHBondContact O-N 2.98Å; L168-N172 PolarHBondContact O-ND2 2.64Å; L168-N172 PolarHBondContact O-OD1 3.42Å; L168-R188 HydrophobicContact CD2-CG 3.57Å; L168-I191 HydrophobicContact CD2-CB 4.1Å; L168-I191 HydrophobicContact CD2-CG2 3.86Å; L168-I191 HydrophobicContact CG-CG2 4.03Å; L168-L192 HydrophobicContact CD1-CD2 3.74Å; L168-L192 HydrophobicContact CD2-CD2 3.84Å; L168-L192 HydrophobicContact CD2-CG 3.81Å; L168-L192 HydrophobicContact CG-CD2 4.47Å; L168-L195 HydrophobicContact CD1-CD1 3.92Å; L168-R197 VanDerWaalsContact CD1-NH1 3.26Å
169	Y	94.6	Very high	89.3	Confident	138 Å²	138	62.8 Å²	62.8	54%	0.541	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-48.2	174.7	175.8	-98.8	0	0	0	111.9	D165 L166 A167 N172 R173	D165-Y169 WeakPolarHBondContact O-CB 3.48Å; D165-Y169 PolarHBondContact O-N 2.83Å; L166-Y169 WeakPolarHBondContact O-CB 3.4Å; L166-Y169 PolarHBondContact O-N 3.37Å; A167-Y169 VanDerWaalsContact C-N 3.3Å; A167-Y169 PolarHBondContact O-N 2.78Å; Y169-N172 WeakPolarHBondContact O-CB 3.49Å; Y169-N172 PolarHBondContact O-N 2.54Å; Y169-R173 HydrophobicContact CE1-CG 4.37Å; Y169-R173 WeakPolarHBondContact O-CG 3.43Å; Y169-R173 PolarHBondContact O-N 2.69Å; Y169-R173 VanDerWaalsContact O-N 3.17Å
170	E	94.6	Very high	90.9	Very high	8 Å²	8	59.9 Å²	59.9	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-43.3	178.4	-61.6	-63.5	-176.4	0	0	111.9	I146 R149 Y153 L166 A167 N172 R173 V174	I146-E170 HydrophobicContact CG2-CB 4.1Å; I146-E170 WeakPolarHBondContact CG2-O 3.49Å; I146-E170 WeakPolarHBondContact CG2-OE2 3.45Å; R149-E170 IonicContact CZ-OE1 3.71Å; R149-E170 IonicContact NE-OE1 2.7Å; R149-E170 PolarHBondContact NE-OE1 3.04Å; R149-E170 IonicContact NH2-OE1 3.01Å; R149-E170 PolarHBondContact NH2-OE1 3.03Å; R149-E170 IonicContact NH2-OE2 2.74Å; Y153-E170 HydrophobicContact CD2-CG 4.42Å; L166-E170 WeakPolarHBondContact O-CG 3.31Å; L166-E170 PolarHBondContact O-N 2.91Å; A167-E170 PolarHBondContact O-N 3.29Å; E170-N172 VanDerWaalsContact C-N 3.29Å; E170-N172 PolarHBondContact O-N 2.92Å; E170-R173 WeakPolarHBondContact O-CA 3.43Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 2.98Å; E170-R173 IonicContact OE2-CZ 3.7Å; E170-R173 IonicContact OE2-NH1 2.68Å; E170-R173 PolarHBondContact OE2-NH1 3.04Å; E170-V174 WeakPolarHBondContact O-CG2 3.44Å; E170-V174 PolarHBondContact O-N 3.15Å
171	L	94.7	Very high	91.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-34	178.1	-66.6	173.2	0	0	0	112.2	Y147 A167 R173 V174 I175 V184 Q187 R188 I191	Y147-L171 HydrophobicContact CD2-CD2 3.92Å; Y147-L171 HydrophobicContact CE2-CD2 4.14Å; A167-L171 VanDerWaalsContact O-CG 3.32Å; A167-L171 WeakPolarHBondContact O-CG 3.02Å; A167-L171 PolarHBondContact O-N 3.06Å; L171-R173 VanDerWaalsContact C-N 3.31Å; L171-R173 PolarHBondContact O-N 3Å; L171-V174 PolarHBondContact O-N 3.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.49Å; L171-I175 PolarHBondContact O-N 3.12Å; L171-V184 HydrophobicContact CB-CG1 4.46Å; L171-V184 HydrophobicContact CD2-CG1 4Å; L171-Q187 HydrophobicContact CD1-CB 4.3Å; L171-Q187 HydrophobicContact CD2-CB 4.44Å; L171-R188 HydrophobicContact CB-CB 4.41Å; L171-R188 HydrophobicContact CB-CG 4.35Å; L171-R188 HydrophobicContact CD1-CB 3.95Å; L171-R188 HydrophobicContact CD1-CG 4.27Å; L171-I191 HydrophobicContact CD1-CD1 3.58Å
172	N	96.1	Very high	92.2	Very high	78 Å²	78	54.8 Å²	54.8	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-38.1	171.2	-72.3	-17.9	0	0	0	112.2	L168 Y169 E170 I175 A176 R188	L168-N172 WeakPolarHBondContact O-CB 3.26Å; L168-N172 PolarHBondContact O-N 2.98Å; L168-N172 PolarHBondContact O-ND2 2.64Å; L168-N172 PolarHBondContact O-OD1 3.42Å; Y169-N172 WeakPolarHBondContact O-CB 3.49Å; Y169-N172 PolarHBondContact O-N 2.54Å; E170-N172 VanDerWaalsContact C-N 3.29Å; E170-N172 PolarHBondContact O-N 2.92Å; N172-I175 PolarHBondContact O-N 3.28Å; N172-A176 WeakPolarHBondContact O-CB 3.44Å; N172-A176 PolarHBondContact O-N 3.44Å; N172-R188 WeakPolarHBondContact OD1-CD 3.48Å; N172-R188 PolarHBondContact OD1-NH1 2.93Å
173	R	95.4	Very high	92.4	Very high	60 Å²	60	50.3 Å²	50.3	23%	0.226	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-43.6	175.2	-67.2	175.2	65.5	-144.5	-1	111.1	P140 I146 Y169 E170 L171 I175 A176 L177	P140-R173 PolarHBondContact O-NH2 3.23Å; I146-R173 HydrophobicContact CG2-CB 3.98Å; Y169-R173 HydrophobicContact CE1-CG 4.37Å; Y169-R173 WeakPolarHBondContact O-CG 3.43Å; Y169-R173 PolarHBondContact O-N 2.69Å; Y169-R173 VanDerWaalsContact O-N 3.17Å; E170-R173 WeakPolarHBondContact O-CA 3.43Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 2.98Å; E170-R173 IonicContact OE2-CZ 3.7Å; E170-R173 IonicContact OE2-NH1 2.68Å; E170-R173 PolarHBondContact OE2-NH1 3.04Å; L171-R173 VanDerWaalsContact C-N 3.31Å; L171-R173 PolarHBondContact O-N 3Å; R173-I175 VanDerWaalsContact C-N 3.34Å; R173-I175 PolarHBondContact O-N 3.22Å; R173-A176 PolarHBondContact O-N 3.23Å; R173-L177 WeakPolarHBondContact O-CG 3.45Å; R173-L177 PolarHBondContact O-N 3.34Å; R173-L177 VanDerWaalsContact O-N 3.11Å
174	V	94.9	Very high	92.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.4	-47.2	175	179.9	0	0	0	0	110.4	F102 V143 I146 Y147 E170 L171 A176 L177 E178 V184	F102-V174 HydrophobicContact CE2-CG1 4.38Å; F102-V174 HydrophobicContact CZ-CG1 3.99Å; V143-V174 HydrophobicContact CG1-CG1 3.93Å; I146-V174 HydrophobicContact CB-CG2 4.03Å; I146-V174 HydrophobicContact CG2-CG2 3.55Å; Y147-V174 HydrophobicContact CD2-CG2 4.46Å; E170-V174 WeakPolarHBondContact O-CG2 3.44Å; E170-V174 PolarHBondContact O-N 3.15Å; L171-V174 PolarHBondContact O-N 3.31Å; V174-A176 VanDerWaalsContact C-N 3.28Å; V174-A176 PolarHBondContact O-N 3.17Å; V174-L177 PolarHBondContact O-N 3.29Å; V174-L177 VanDerWaalsContact O-N 3.16Å; V174-E178 PolarHBondContact O-N 3Å; V174-V184 HydrophobicContact CB-CG1 3.88Å; V174-V184 HydrophobicContact CG1-CB 4.32Å; V174-V184 HydrophobicContact CG1-CG1 3.72Å; V174-V184 HydrophobicContact CG1-CG2 3.63Å
175	I	94.6	Very high	92.8	Very high	23 Å²	23	50.5 Å²	50.5	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-33.9	179.1	-70.5	164.3	0	0	0	112.3	L171 N172 R173 P179 V184 Y185	L171-I175 WeakPolarHBondContact O-CG1 3.49Å; L171-I175 PolarHBondContact O-N 3.12Å; N172-I175 PolarHBondContact O-N 3.28Å; R173-I175 VanDerWaalsContact C-N 3.34Å; R173-I175 PolarHBondContact O-N 3.22Å; I175-P179 WeakPolarHBondContact O-CA 3.39Å; I175-V184 HydrophobicContact CD1-CG1 4.09Å; I175-V184 HydrophobicContact CG1-CB 4.32Å; I175-V184 HydrophobicContact CG1-CG1 3.65Å; I175-Y185 HydrophobicContact CD1-CD1 3.9Å; I175-Y185 HydrophobicContact CD1-CE1 3.81Å; I175-Y185 HydrophobicContact CD1-CG 4.46Å; I175-Y185 HydrophobicContact CG1-CE1 4.2Å; I175-Y185 HydrophobicContact CG2-CE1 4.06Å; I175-Y185 WeakPolarHBondContact CG2-OH 3.3Å
176	A	94.7	Very high	92.8	Very high	86 Å²	86	46.3 Å²	46.3	71%	0.711	24%	0.235	S	C	*	.	H	α-helix	trans	-69.4	-33.7	177	0	0	0	0	0	112.7	N172 R173 V174	N172-A176 WeakPolarHBondContact O-CB 3.44Å; N172-A176 PolarHBondContact O-N 3.44Å; R173-A176 PolarHBondContact O-N 3.23Å; V174-A176 VanDerWaalsContact C-N 3.28Å; V174-A176 PolarHBondContact O-N 3.17Å
177	L	93.1	Very high	92.7	Very high	69 Å²	69	44 Å²	44	36%	0.361	22%	0.223	S	C	.	.	H	α-helix	trans	-83	-42.5	177.8	-64.8	170.9	0	0	0	111.6	V143 I146 R173 V174	V143-L177 HydrophobicContact CG2-CB 4.14Å; V143-L177 HydrophobicContact CG2-CD1 3.95Å; I146-L177 HydrophobicContact CD1-CD1 3.83Å; R173-L177 WeakPolarHBondContact O-CG 3.45Å; R173-L177 PolarHBondContact O-N 3.34Å; R173-L177 VanDerWaalsContact O-N 3.11Å; V174-L177 PolarHBondContact O-N 3.29Å; V174-L177 VanDerWaalsContact O-N 3.16Å
178	E	91.7	Very high	92.6	Very high	79 Å²	79	45.9 Å²	45.9	37%	0.369	23%	0.23	S	C	.	.			trans	-135.5	80.9	-170.2	-74.3	-64.4	163.8	0	0	111.2	F102 V143 V174 N180	F102-E178 HydrophobicContact CD1-CG 4.41Å; F102-E178 HydrophobicContact CE1-CB 4.09Å; F102-E178 HydrophobicContact CE1-CG 4.21Å; V143-E178 HydrophobicContact CG1-CG 4.12Å; V143-E178 HydrophobicContact CG2-CG 4.24Å; V174-E178 PolarHBondContact O-N 3Å; E178-N180 VanDerWaalsContact C-N 3.32Å; E178-N180 PolarHBondContact O-N 3.49Å
179	P	91.8	Very high	92.5	Very high	57 Å²	57	45.5 Å²	45.5	37%	0.37	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.9	-170	30.6	-37	0	0	0	115.3	I175 Y185	I175-P179 WeakPolarHBondContact O-CA 3.39Å; P179-Y185 WeakPolarHBondContact O-CE2 3.34Å; P179-Y185 PolarHBondContact O-OH 3.08Å
180	N	92.4	Very high	92	Very high	111 Å²	111	41.3 Å²	41.3	59%	0.594	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	15.1	-172	-67.1	-28.1	0	0	0	113.8	E178 P182 L211	E178-N180 VanDerWaalsContact C-N 3.32Å; E178-N180 PolarHBondContact O-N 3.49Å; N180-P182 WeakPolarHBondContact O-CD 3.4Å; N180-L211 HydrophobicContact CB-CD2 4.44Å
181	W	89.1	Confident	91.7	Very high	100 Å²	100	41.4 Å²	41.4	38%	0.379	21%	0.214	S	C	.	.			trans	-101.7	105.8	-178.8	-76.3	82.9	0	0	0	112	F102 E183 V184 Y185	F102-W181 HydrophobicContact CD1-CD2 4.43Å; F102-W181 AromaticContact CD1-CE2 4Å; F102-W181 HydrophobicContact CD1-CZ2 4.24Å; F102-W181 HydrophobicContact CE1-CB 4.38Å; F102-W181 AromaticContact CE1-CD1 3.57Å; F102-W181 AromaticContact CE1-CD2 3.59Å; F102-W181 HydrophobicContact CE1-CD2 3.59Å; F102-W181 AromaticContact CE1-CE2 3.53Å; F102-W181 HydrophobicContact CE1-CE3 4.32Å; F102-W181 AromaticContact CE1-CG 3.6Å; F102-W181 HydrophobicContact CE1-CG 3.6Å; F102-W181 HydrophobicContact CE1-CZ2 4.19Å; F102-W181 AromaticContact CE1-NE1 3.49Å; F102-W181 HydrophobicContact CZ-CB 4.19Å; F102-W181 AromaticContact CZ-CD2 3.89Å; F102-W181 HydrophobicContact CZ-CD2 3.89Å; F102-W181 HydrophobicContact CZ-CE3 4.31Å; F102-W181 AromaticContact CZ-CG 3.83Å; F102-W181 HydrophobicContact CZ-CG 3.83Å; W181-E183 VanDerWaalsContact C-N 3.29Å; W181-E183 PolarHBondContact O-N 3.23Å; W181-V184 HydrophobicContact CB-CG2 3.78Å; W181-V184 PolarHBondContact O-N 2.91Å; W181-Y185 WeakPolarHBondContact O-CD2 3.36Å
182	P	89.6	Confident	91.4	Very high	12 Å²	12	41.6 Å²	41.6	8%	0.078	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-33.4	-175.8	23.5	-32.1	0	0	0	113.4	N180 V184 Y185 E186 A208 L211 Q212	N180-P182 WeakPolarHBondContact O-CD 3.4Å; P182-V184 PolarHBondContact O-N 3.49Å; P182-Y185 PolarHBondContact O-N 3.43Å; P182-E186 PolarHBondContact O-N 3.32Å; P182-A208 HydrophobicContact CB-CB 4.15Å; P182-L211 HydrophobicContact CB-CB 4.1Å; P182-L211 HydrophobicContact CB-CD1 4.46Å; P182-L211 HydrophobicContact CG-CB 4.45Å; P182-Q212 HydrophobicContact CB-CB 4.28Å; P182-Q212 HydrophobicContact CG-CB 3.8Å
183	E	88.5	Confident	90.8	Very high	48 Å²	48	38.9 Å²	38.9	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-34.7	-178.8	-63.1	79.9	-179	0	0	111.7	W181 E186 Q187	W181-E183 VanDerWaalsContact C-N 3.29Å; W181-E183 PolarHBondContact O-N 3.23Å; E183-E186 PolarHBondContact O-N 3.33Å; E183-Q187 WeakPolarHBondContact O-CB 3.27Å; E183-Q187 VanDerWaalsContact O-CG 3.26Å; E183-Q187 WeakPolarHBondContact O-CG 3.49Å; E183-Q187 PolarHBondContact O-N 3.2Å
184	V	91.3	Very high	90.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-41.4	-179.2	-171.3	0	0	0	0	110.9	F102 Y147 L171 V174 I175 W181 P182 R188	F102-V184 HydrophobicContact CE2-CG2 4.46Å; F102-V184 HydrophobicContact CZ-CG2 3.89Å; Y147-V184 HydrophobicContact CD2-CG2 4.1Å; Y147-V184 HydrophobicContact CE2-CB 4.45Å; Y147-V184 HydrophobicContact CE2-CG2 3.93Å; L171-V184 HydrophobicContact CB-CG1 4.46Å; L171-V184 HydrophobicContact CD2-CG1 4Å; V174-V184 HydrophobicContact CB-CG1 3.88Å; V174-V184 HydrophobicContact CG1-CB 4.32Å; V174-V184 HydrophobicContact CG1-CG1 3.72Å; V174-V184 HydrophobicContact CG1-CG2 3.63Å; I175-V184 HydrophobicContact CD1-CG1 4.09Å; I175-V184 HydrophobicContact CG1-CB 4.32Å; I175-V184 HydrophobicContact CG1-CG1 3.65Å; W181-V184 HydrophobicContact CB-CG2 3.78Å; W181-V184 PolarHBondContact O-N 2.91Å; P182-V184 PolarHBondContact O-N 3.49Å; V184-R188 WeakPolarHBondContact O-CB 3.49Å; V184-R188 PolarHBondContact O-N 3.21Å
185	Y	93.9	Very high	89.6	Confident	20 Å²	20	43.2 Å²	43.2	8%	0.078	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-40.7	173.9	-68.2	-79.9	0	0	0	111.4	I175 P179 W181 P182 R188 A189 D204 K207 L211	I175-Y185 HydrophobicContact CD1-CD1 3.9Å; I175-Y185 HydrophobicContact CD1-CE1 3.81Å; I175-Y185 HydrophobicContact CD1-CG 4.46Å; I175-Y185 HydrophobicContact CG1-CE1 4.2Å; I175-Y185 HydrophobicContact CG2-CE1 4.06Å; I175-Y185 WeakPolarHBondContact CG2-OH 3.3Å; P179-Y185 WeakPolarHBondContact O-CE2 3.34Å; P179-Y185 PolarHBondContact O-OH 3.08Å; W181-Y185 WeakPolarHBondContact O-CD2 3.36Å; P182-Y185 PolarHBondContact O-N 3.43Å; Y185-R188 PolarHBondContact O-N 3.05Å; Y185-A189 WeakPolarHBondContact O-CB 3.45Å; Y185-A189 PolarHBondContact O-N 2.88Å; Y185-D204 HydrophobicContact CD1-CB 4.4Å; Y185-K207 HydrophobicContact CD1-CB 4.23Å; Y185-K207 HydrophobicContact CD1-CG 4.11Å; Y185-K207 HydrophobicContact CD2-CG 4.22Å; Y185-K207 HydrophobicContact CE1-CB 4.34Å; Y185-K207 HydrophobicContact CE1-CG 3.81Å; Y185-K207 HydrophobicContact CE2-CG 3.92Å; Y185-K207 HydrophobicContact CG-CB 4.46Å; Y185-K207 HydrophobicContact CG-CG 4.31Å; Y185-L211 HydrophobicContact CD2-CD1 3.94Å; Y185-L211 HydrophobicContact CE2-CD1 3.75Å
186	E	89.9	Confident	89	Confident	15 Å²	15	44.8 Å²	44.8	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-49.7	175.1	-176.9	173.4	-153	0	0	111.9	P182 E183 R188 A189 E190 L205 R216 L217	P182-E186 PolarHBondContact O-N 3.32Å; E183-E186 PolarHBondContact O-N 3.33Å; E186-R188 VanDerWaalsContact C-N 3.27Å; E186-R188 PolarHBondContact O-N 3.4Å; E186-A189 WeakPolarHBondContact O-CB 3.22Å; E186-A189 PolarHBondContact O-N 3.49Å; E186-A189 VanDerWaalsContact O-N 3.11Å; E186-E190 WeakPolarHBondContact O-CG 3.12Å; E186-E190 PolarHBondContact O-N 3.37Å; E186-L205 HydrophobicContact CG-CD2 4.47Å; E186-R216 VanDerWaalsContact OE1-CD 3.26Å; E186-R216 WeakPolarHBondContact OE1-CD 3.43Å; E186-R216 WeakPolarHBondContact OE1-CG 3.45Å; E186-R216 IonicContact OE1-CZ 2.79Å; E186-R216 IonicContact OE1-NE 3.57Å; E186-R216 PolarHBondContact OE1-NE 3.23Å; E186-R216 IonicContact OE1-NH2 2.66Å; E186-R216 IonicContact OE2-NE 3.8Å; E186-L217 HydrophobicContact CB-CD2 3.82Å; E186-L217 HydrophobicContact CG-CD2 3.77Å
187	Q	89.2	Confident	88.7	Confident	12 Å²	12	45 Å²	45	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-38.1	177.6	-70.8	-57.3	-68.1	0	0	111.9	Y147 I151 L171 E183 E190 I191	Y147-Q187 HydrophobicContact CE2-CG 4.3Å; I151-Q187 HydrophobicContact CG1-CG 4.5Å; L171-Q187 HydrophobicContact CD1-CB 4.3Å; L171-Q187 HydrophobicContact CD2-CB 4.44Å; E183-Q187 WeakPolarHBondContact O-CB 3.27Å; E183-Q187 VanDerWaalsContact O-CG 3.26Å; E183-Q187 WeakPolarHBondContact O-CG 3.49Å; E183-Q187 PolarHBondContact O-N 3.2Å; Q187-E190 PolarHBondContact NE2-OE2 3.42Å; Q187-E190 PolarHBondContact O-N 3.13Å; Q187-I191 WeakPolarHBondContact O-CD1 3.35Å; Q187-I191 WeakPolarHBondContact O-CG1 3.48Å; Q187-I191 PolarHBondContact O-N 3.41Å
188	R	91.7	Very high	88.4	Confident	38 Å²	38	43.4 Å²	43.4	14%	0.143	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-41.8	175.4	-160.5	170.9	67.4	-179.3	-3.7	111.2	L168 L171 N172 V184 Y185 E186 I191 L192 D204	L168-R188 HydrophobicContact CD2-CG 3.57Å; L171-R188 HydrophobicContact CB-CB 4.41Å; L171-R188 HydrophobicContact CB-CG 4.35Å; L171-R188 HydrophobicContact CD1-CB 3.95Å; L171-R188 HydrophobicContact CD1-CG 4.27Å; N172-R188 WeakPolarHBondContact OD1-CD 3.48Å; N172-R188 PolarHBondContact OD1-NH1 2.93Å; V184-R188 WeakPolarHBondContact O-CB 3.49Å; V184-R188 PolarHBondContact O-N 3.21Å; Y185-R188 PolarHBondContact O-N 3.05Å; E186-R188 VanDerWaalsContact C-N 3.27Å; E186-R188 PolarHBondContact O-N 3.4Å; R188-I191 PolarHBondContact O-N 3.48Å; R188-L192 HydrophobicContact CG-CD1 4.04Å; R188-L192 HydrophobicContact CG-CG 4.45Å; R188-L192 WeakPolarHBondContact O-CB 3.28Å; R188-L192 VanDerWaalsContact O-CG 3.23Å; R188-L192 WeakPolarHBondContact O-CG 3.45Å; R188-L192 PolarHBondContact O-N 2.87Å; R188-D204 IonicContact CZ-OD1 2.63Å; R188-D204 IonicContact CZ-OD2 2.72Å; R188-D204 IonicContact NE-OD1 3.25Å; R188-D204 IonicContact NE-OD2 2.8Å; R188-D204 PolarHBondContact NE-OD2 3.46Å; R188-D204 IonicContact NH2-OD1 2.63Å; R188-D204 PolarHBondContact NH2-OD1 3.28Å; R188-D204 IonicContact NH2-OD2 3.5Å; R188-D204 PolarHBondContact NH2-OD2 3.49Å
189	A	90.1	Very high	88.5	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-39.6	175.1	0	0	0	0	0	112.8	Y185 E186 I191 L192 S193 A201 D204 L205	Y185-A189 WeakPolarHBondContact O-CB 3.45Å; Y185-A189 PolarHBondContact O-N 2.88Å; E186-A189 WeakPolarHBondContact O-CB 3.22Å; E186-A189 PolarHBondContact O-N 3.49Å; E186-A189 VanDerWaalsContact O-N 3.11Å; A189-I191 PolarHBondContact O-N 2.94Å; A189-L192 PolarHBondContact O-N 3.01Å; A189-S193 WeakPolarHBondContact O-CB 3.43Å; A189-S193 PolarHBondContact O-N 2.72Å; A189-S193 PolarHBondContact O-OG 3.23Å; A189-A201 HydrophobicContact CB-CB 4.13Å; A189-D204 HydrophobicContact CB-CB 4.1Å; A189-L205 HydrophobicContact CB-CD1 4.18Å; A189-L205 HydrophobicContact CB-CD2 3.82Å; A189-L205 HydrophobicContact CB-CG 3.62Å
190	E	85.8	Confident	88.6	Confident	50 Å²	50	45.2 Å²	45.2	23%	0.234	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-34.1	175.5	-73.7	178.7	178.7	0	0	112	E186 Q187 P194 R216 H220	E186-E190 WeakPolarHBondContact O-CG 3.12Å; E186-E190 PolarHBondContact O-N 3.37Å; Q187-E190 PolarHBondContact NE2-OE2 3.42Å; Q187-E190 PolarHBondContact O-N 3.13Å; E190-P194 WeakPolarHBondContact O-CD 3.48Å; E190-R216 IonicContact OE1-CZ 2.69Å; E190-R216 IonicContact OE1-NH2 2.77Å; E190-R216 PolarHBondContact OE1-NH2 3.46Å; E190-H220 VanDerWaalsContact CG-CE1 3.41Å; E190-H220 WeakPolarHBondContact CG-CE1 3.5Å
191	I	87.4	Confident	88.6	Confident	11 Å²	11	40 Å²	40	6%	0.056	22%	0.215	C	C	.	.	H	α-helix	trans	-81.7	-40.9	176.4	-62.6	158.2	0	0	0	111.7	A164 A167 L168 L171 Q187 R188 A189 S193 P194 L195	A164-I191 HydrophobicContact CB-CG2 4.26Å; A167-I191 HydrophobicContact CB-CD1 3.72Å; L168-I191 HydrophobicContact CD2-CB 4.1Å; L168-I191 HydrophobicContact CD2-CG2 3.86Å; L168-I191 HydrophobicContact CG-CG2 4.03Å; L171-I191 HydrophobicContact CD1-CD1 3.58Å; Q187-I191 WeakPolarHBondContact O-CD1 3.35Å; Q187-I191 WeakPolarHBondContact O-CG1 3.48Å; Q187-I191 PolarHBondContact O-N 3.41Å; R188-I191 PolarHBondContact O-N 3.48Å; A189-I191 PolarHBondContact O-N 2.94Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 3.4Å; I191-P194 VanDerWaalsContact O-CD 3.3Å; I191-P194 WeakPolarHBondContact O-CD 3.44Å; I191-P194 WeakPolarHBondContact O-CG 3.26Å; I191-L195 HydrophobicContact CG2-CD1 4.21Å; I191-L195 WeakPolarHBondContact O-CG 3.46Å
192	L	88.3	Confident	88.9	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-31.8	-179.5	-72.6	168.6	0	0	0	112.9	L168 R188 A189 L195 G196 R197 E200 A201 D204	L168-L192 HydrophobicContact CD1-CD2 3.74Å; L168-L192 HydrophobicContact CD2-CD2 3.84Å; L168-L192 HydrophobicContact CD2-CG 3.81Å; L168-L192 HydrophobicContact CG-CD2 4.47Å; R188-L192 HydrophobicContact CG-CD1 4.04Å; R188-L192 HydrophobicContact CG-CG 4.45Å; R188-L192 WeakPolarHBondContact O-CB 3.28Å; R188-L192 VanDerWaalsContact O-CG 3.23Å; R188-L192 WeakPolarHBondContact O-CG 3.45Å; R188-L192 PolarHBondContact O-N 2.87Å; A189-L192 PolarHBondContact O-N 3.01Å; L192-L195 PolarHBondContact O-N 3.12Å; L192-G196 PolarHBondContact O-N 2.77Å; L192-R197 HydrophobicContact CB-CB 4.22Å; L192-R197 HydrophobicContact CD2-CB 3.79Å; L192-R197 HydrophobicContact CD2-CG 4.36Å; L192-R197 PolarHBondContact O-N 2.74Å; L192-R197 VanDerWaalsContact O-N 3.08Å; L192-E200 HydrophobicContact CD1-CB 3.82Å; L192-E200 HydrophobicContact CD2-CB 4.49Å; L192-A201 HydrophobicContact CB-CB 3.87Å; L192-D204 WeakPolarHBondContact CD1-OD2 3.47Å
193	S	83.9	Confident	89.2	Confident	21 Å²	21	39.9 Å²	39.9	15%	0.147	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-57.1	-177.3	-62.1	0	0	0	0	113.7	A189 I191 L195 G196 L224	A189-S193 WeakPolarHBondContact O-CB 3.43Å; A189-S193 PolarHBondContact O-N 2.72Å; A189-S193 PolarHBondContact O-OG 3.23Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 3.4Å; S193-L195 PolarHBondContact O-N 2.61Å; S193-G196 PolarHBondContact O-N 2.72Å; S193-G196 VanDerWaalsContact O-N 3.07Å; S193-L224 WeakPolarHBondContact OG-CD1 3.28Å; S193-L224 WeakPolarHBondContact OG-CD2 3.49Å
194	P	81.5	Confident	89.6	Confident	93 Å²	93	37.9 Å²	37.9	60%	0.604	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.8	176.9	27.4	-36	0	0	0	113.4	E190 I191 G196	E190-P194 WeakPolarHBondContact O-CD 3.48Å; I191-P194 VanDerWaalsContact O-CD 3.3Å; I191-P194 WeakPolarHBondContact O-CD 3.44Å; I191-P194 WeakPolarHBondContact O-CG 3.26Å; P194-G196 PolarHBondContact O-N 2.66Å
195	L	83.6	Confident	89.8	Confident	59 Å²	59	37.9 Å²	37.9	31%	0.309	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-4.2	172.9	-64	175.7	0	0	0	113.3	M161 A164 L168 I191 L192 S193 R197	M161-L195 HydrophobicContact SD-CD2 4.48Å; A164-L195 HydrophobicContact CB-CD1 3.86Å; A164-L195 HydrophobicContact CB-CD2 3.92Å; A164-L195 HydrophobicContact CB-CG 4.34Å; L168-L195 HydrophobicContact CD1-CD1 3.92Å; I191-L195 HydrophobicContact CG2-CD1 4.21Å; I191-L195 WeakPolarHBondContact O-CG 3.46Å; L192-L195 PolarHBondContact O-N 3.12Å; S193-L195 PolarHBondContact O-N 2.61Å; L195-R197 HydrophobicContact CB-CG 4.38Å; L195-R197 PolarHBondContact O-N 3.07Å
196	G	81.6	Confident	89.9	Confident	55 Å²	55	39.1 Å²	39.1	57%	0.567	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	8.7	-176.6	0	0	0	0	0	114	L192 S193 P194 I198	L192-G196 PolarHBondContact O-N 2.77Å; S193-G196 PolarHBondContact O-N 2.72Å; S193-G196 VanDerWaalsContact O-N 3.07Å; P194-G196 PolarHBondContact O-N 2.66Å; G196-I198 PolarHBondContact O-N 2.74Å
197	R	88	Confident	90.2	Very high	90 Å²	90	42 Å²	42	34%	0.34	24%	0.24	S	C	.	.			trans	-82.8	53.1	176.7	-66.8	173.7	66.5	-179.2	-2.2	110.8	L168 L192 L195 S199 E200 A201	L168-R197 VanDerWaalsContact CD1-NH1 3.26Å; L192-R197 HydrophobicContact CB-CB 4.22Å; L192-R197 HydrophobicContact CD2-CB 3.79Å; L192-R197 HydrophobicContact CD2-CG 4.36Å; L192-R197 PolarHBondContact O-N 2.74Å; L192-R197 VanDerWaalsContact O-N 3.08Å; L195-R197 HydrophobicContact CB-CG 4.38Å; L195-R197 PolarHBondContact O-N 3.07Å; R197-S199 PolarHBondContact O-N 2.94Å; R197-E200 IonicContact CZ-OE1 3.53Å; R197-E200 VanDerWaalsContact CZ-OE1 3.23Å; R197-E200 IonicContact CZ-OE2 3.55Å; R197-E200 IonicContact NE-OE1 3.14Å; R197-E200 PolarHBondContact NE-OE1 3.06Å; R197-E200 IonicContact NE-OE2 2.78Å; R197-E200 IonicContact NH2-OE1 2.75Å; R197-E200 PolarHBondContact NH2-OE1 3.35Å; R197-E200 IonicContact NH2-OE2 3.55Å; R197-E200 PolarHBondContact NH2-OE2 3.39Å; R197-E200 PolarHBondContact O-N 2.79Å; R197-A201 PolarHBondContact O-N 3.03Å; R197-A201 VanDerWaalsContact O-N 3.12Å
198	I	88.2	Confident	90.5	Very high	37 Å²	37	41.4 Å²	41.4	19%	0.19	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-39.2	-168.8	-54.4	-57.1	0	0	0	112.4	G196 E200 A201 L202 L224	G196-I198 PolarHBondContact O-N 2.74Å; I198-E200 VanDerWaalsContact C-N 3.31Å; I198-E200 PolarHBondContact O-N 2.93Å; I198-A201 PolarHBondContact O-N 3.37Å; I198-L202 HydrophobicContact CG2-CD1 4.01Å; I198-L202 HydrophobicContact CG2-CG 4.19Å; I198-L202 WeakPolarHBondContact O-CB 3.33Å; I198-L202 VanDerWaalsContact O-CG 3.29Å; I198-L202 WeakPolarHBondContact O-CG 3.2Å; I198-L202 PolarHBondContact O-N 3.37Å; I198-L224 HydrophobicContact CD1-CD2 4.45Å; I198-L224 HydrophobicContact CG2-CB 4.5Å
199	S	92.9	Very high	90.7	Very high	92 Å²	92	40.1 Å²	40.1	64%	0.643	23%	0.234	S	C	*	.	H	α-helix	trans	-62.4	-37.7	179.6	56.6	0	0	0	0	113.1	R197 S203	R197-S199 PolarHBondContact O-N 2.94Å; S199-S203 PolarHBondContact O-N 2.85Å
200	E	94.1	Very high	91	Very high	82 Å²	82	46.6 Å²	46.6	38%	0.383	26%	0.264	S	S	.	.	H	α-helix	trans	-73.8	-42.3	178	-65.8	178.4	-96.9	0	0	110.5	L192 R197 I198 L202 S203 D204	L192-E200 HydrophobicContact CD1-CB 3.82Å; L192-E200 HydrophobicContact CD2-CB 4.49Å; R197-E200 IonicContact CZ-OE1 3.53Å; R197-E200 VanDerWaalsContact CZ-OE1 3.23Å; R197-E200 IonicContact CZ-OE2 3.55Å; R197-E200 IonicContact NE-OE1 3.14Å; R197-E200 PolarHBondContact NE-OE1 3.06Å; R197-E200 IonicContact NE-OE2 2.78Å; R197-E200 IonicContact NH2-OE1 2.75Å; R197-E200 PolarHBondContact NH2-OE1 3.35Å; R197-E200 IonicContact NH2-OE2 3.55Å; R197-E200 PolarHBondContact NH2-OE2 3.39Å; R197-E200 PolarHBondContact O-N 2.79Å; I198-E200 VanDerWaalsContact C-N 3.31Å; I198-E200 PolarHBondContact O-N 2.93Å; E200-L202 VanDerWaalsContact C-N 3.33Å; E200-L202 PolarHBondContact O-N 2.74Å; E200-S203 WeakPolarHBondContact O-CB 3.41Å; E200-S203 PolarHBondContact O-N 3.17Å; E200-S203 VanDerWaalsContact O-N 3.17Å; E200-D204 PolarHBondContact O-N 3.34Å
201	A	92.7	Very high	91.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-43	174.2	0	0	0	0	0	112.2	A189 L192 R197 I198 S203 D204 L205 L224	A189-A201 HydrophobicContact CB-CB 4.13Å; L192-A201 HydrophobicContact CB-CB 3.87Å; R197-A201 PolarHBondContact O-N 3.03Å; R197-A201 VanDerWaalsContact O-N 3.12Å; I198-A201 PolarHBondContact O-N 3.37Å; A201-S203 PolarHBondContact O-N 2.9Å; A201-D204 PolarHBondContact O-N 2.89Å; A201-L205 WeakPolarHBondContact O-CG 3.26Å; A201-L205 PolarHBondContact O-N 2.83Å; A201-L224 HydrophobicContact CB-CD1 3.65Å
202	L	95.3	Very high	91.8	Very high	35 Å²	35	51.5 Å²	51.5	18%	0.183	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-38.4	176.2	-72.6	174.6	0	0	0	112.6	I198 E200 T206 R221 L224 L225	I198-L202 HydrophobicContact CG2-CD1 4.01Å; I198-L202 HydrophobicContact CG2-CG 4.19Å; I198-L202 WeakPolarHBondContact O-CB 3.33Å; I198-L202 VanDerWaalsContact O-CG 3.29Å; I198-L202 WeakPolarHBondContact O-CG 3.2Å; I198-L202 PolarHBondContact O-N 3.37Å; E200-L202 VanDerWaalsContact C-N 3.33Å; E200-L202 PolarHBondContact O-N 2.74Å; L202-T206 VanDerWaalsContact O-CB 3.31Å; L202-T206 WeakPolarHBondContact O-CB 3.45Å; L202-T206 PolarHBondContact O-N 3.48Å; L202-T206 PolarHBondContact O-OG1 3.36Å; L202-R221 HydrophobicContact CD2-CG 3.76Å; L202-L224 HydrophobicContact CD2-CB 3.73Å; L202-L224 HydrophobicContact CD2-CD1 4.42Å; L202-L224 HydrophobicContact CG-CB 4.42Å; L202-L225 HydrophobicContact CD1-CD2 4.09Å; L202-L225 HydrophobicContact CD2-CD2 3.87Å; L202-L225 HydrophobicContact CD2-CG 3.83Å
203	S	96	Very high	92	Very high	75 Å²	75	55.1 Å²	55.1	52%	0.524	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-44.1	174.9	-179.8	0	0	0	0	111.1	S199 E200 A201 T206 K207	S199-S203 PolarHBondContact O-N 2.85Å; E200-S203 WeakPolarHBondContact O-CB 3.41Å; E200-S203 PolarHBondContact O-N 3.17Å; E200-S203 VanDerWaalsContact O-N 3.17Å; A201-S203 PolarHBondContact O-N 2.9Å; S203-T206 PolarHBondContact O-N 3.25Å; S203-K207 PolarHBondContact O-N 3.49Å
204	D	95.5	Very high	92.4	Very high	7 Å²	7	55.9 Å²	55.9	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-47.2	179.6	-73.6	-6.4	0	0	0	112.3	Y185 R188 A189 L192 E200 A201 T206 K207 A208	Y185-D204 HydrophobicContact CD1-CB 4.4Å; R188-D204 IonicContact CZ-OD1 2.63Å; R188-D204 IonicContact CZ-OD2 2.72Å; R188-D204 IonicContact NE-OD1 3.25Å; R188-D204 IonicContact NE-OD2 2.8Å; R188-D204 PolarHBondContact NE-OD2 3.46Å; R188-D204 IonicContact NH2-OD1 2.63Å; R188-D204 PolarHBondContact NH2-OD1 3.28Å; R188-D204 IonicContact NH2-OD2 3.5Å; R188-D204 PolarHBondContact NH2-OD2 3.49Å; A189-D204 HydrophobicContact CB-CB 4.1Å; L192-D204 WeakPolarHBondContact CD1-OD2 3.47Å; E200-D204 PolarHBondContact O-N 3.34Å; A201-D204 PolarHBondContact O-N 2.89Å; D204-T206 VanDerWaalsContact C-N 3.27Å; D204-T206 PolarHBondContact O-N 3.26Å; D204-K207 PolarHBondContact O-N 2.87Å; D204-K207 VanDerWaalsContact O-N 3.12Å; D204-A208 WeakPolarHBondContact O-CB 3.08Å; D204-A208 PolarHBondContact O-N 3.34Å
205	L	95.6	Very high	92.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.3	-36.3	175.9	-67.8	171.6	0	0	0	111.7	E186 A189 A201 K207 A208 I209 L217 H220 R221 L224	E186-L205 HydrophobicContact CG-CD2 4.47Å; A189-L205 HydrophobicContact CB-CD1 4.18Å; A189-L205 HydrophobicContact CB-CD2 3.82Å; A189-L205 HydrophobicContact CB-CG 3.62Å; A201-L205 WeakPolarHBondContact O-CG 3.26Å; A201-L205 PolarHBondContact O-N 2.83Å; L205-K207 VanDerWaalsContact C-N 3.33Å; L205-K207 PolarHBondContact O-N 3.38Å; L205-A208 PolarHBondContact O-N 3.14Å; L205-I209 WeakPolarHBondContact O-CB 3.21Å; L205-I209 WeakPolarHBondContact O-CD1 3.47Å; L205-I209 WeakPolarHBondContact O-CG1 3.39Å; L205-I209 PolarHBondContact O-N 3.29Å; L205-L217 HydrophobicContact CD2-CD2 4Å; L205-H220 HydrophobicContact CD1-CB 4.35Å; L205-H220 HydrophobicContact CD2-CB 4.39Å; L205-R221 HydrophobicContact CB-CB 3.96Å; L205-R221 HydrophobicContact CB-CG 4.08Å; L205-R221 HydrophobicContact CD1-CB 3.85Å; L205-R221 HydrophobicContact CD1-CG 4.3Å; L205-L224 HydrophobicContact CD1-CD1 3.6Å; L205-L224 HydrophobicContact CD1-CG 4.4Å
206	T	97.3	Very high	93.1	Very high	47 Å²	47	51.5 Å²	51.5	29%	0.288	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-41.2	174.5	-61.9	0	0	0	0	111.3	L202 S203 D204 Q210 R221	L202-T206 VanDerWaalsContact O-CB 3.31Å; L202-T206 WeakPolarHBondContact O-CB 3.45Å; L202-T206 PolarHBondContact O-N 3.48Å; L202-T206 PolarHBondContact O-OG1 3.36Å; S203-T206 PolarHBondContact O-N 3.25Å; D204-T206 VanDerWaalsContact C-N 3.27Å; D204-T206 PolarHBondContact O-N 3.26Å; T206-Q210 VanDerWaalsContact O-CG 3.29Å; T206-Q210 WeakPolarHBondContact O-CG 3.35Å; T206-Q210 PolarHBondContact O-N 3.21Å; T206-R221 PolarHBondContact OG1-NH1 3.15Å; T206-R221 VanDerWaalsContact OG1-NH1 3.08Å
207	K	96.1	Very high	93.6	Very high	74 Å²	74	49.1 Å²	49.1	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-66.6	-42.3	175	-175.8	57.4	178.4	174.2	0	111.9	Y185 S203 D204 L205 I209 Q210 L211	Y185-K207 HydrophobicContact CD1-CB 4.23Å; Y185-K207 HydrophobicContact CD1-CG 4.11Å; Y185-K207 HydrophobicContact CD2-CG 4.22Å; Y185-K207 HydrophobicContact CE1-CB 4.34Å; Y185-K207 HydrophobicContact CE1-CG 3.81Å; Y185-K207 HydrophobicContact CE2-CG 3.92Å; Y185-K207 HydrophobicContact CG-CB 4.46Å; Y185-K207 HydrophobicContact CG-CG 4.31Å; S203-K207 PolarHBondContact O-N 3.49Å; D204-K207 PolarHBondContact O-N 2.87Å; D204-K207 VanDerWaalsContact O-N 3.12Å; L205-K207 VanDerWaalsContact C-N 3.33Å; L205-K207 PolarHBondContact O-N 3.38Å; K207-I209 PolarHBondContact O-N 3.17Å; K207-Q210 WeakPolarHBondContact O-CB 3.3Å; K207-Q210 PolarHBondContact O-N 2.97Å; K207-L211 HydrophobicContact CG-CD1 4.44Å; K207-L211 WeakPolarHBondContact O-CG 3.45Å; K207-L211 PolarHBondContact O-N 3.36Å; K207-L211 VanDerWaalsContact O-N 3.08Å
208	A	95	Very high	93.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.1	-46.4	175.8	0	0	0	0	0	111.5	P182 D204 L205 Q210 L211 Q212 L217	P182-A208 HydrophobicContact CB-CB 4.15Å; D204-A208 WeakPolarHBondContact O-CB 3.08Å; D204-A208 PolarHBondContact O-N 3.34Å; L205-A208 PolarHBondContact O-N 3.14Å; A208-Q210 VanDerWaalsContact C-N 3.33Å; A208-Q210 PolarHBondContact O-N 3.14Å; A208-L211 PolarHBondContact O-N 2.79Å; A208-L211 VanDerWaalsContact O-N 3.16Å; A208-Q212 PolarHBondContact O-N 3.24Å; A208-L217 HydrophobicContact CB-CD1 3.97Å; A208-L217 HydrophobicContact CB-CD2 3.85Å
209	I	96.3	Very high	94.2	Very high	12 Å²	12	47 Å²	47	6%	0.062	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-38.9	177.3	-69	164.3	0	0	0	111.4	L205 K207 L211 Q212 P213 L217 Y218 R221	L205-I209 WeakPolarHBondContact O-CB 3.21Å; L205-I209 WeakPolarHBondContact O-CD1 3.47Å; L205-I209 WeakPolarHBondContact O-CG1 3.39Å; L205-I209 PolarHBondContact O-N 3.29Å; K207-I209 PolarHBondContact O-N 3.17Å; I209-L211 VanDerWaalsContact C-N 3.3Å; I209-L211 PolarHBondContact O-N 3.44Å; I209-Q212 CarbonylContact O-C 3.5Å; I209-P213 VanDerWaalsContact O-CD 3.28Å; I209-P213 WeakPolarHBondContact O-CD 3.44Å; I209-P213 WeakPolarHBondContact O-CG 3.4Å; I209-L217 HydrophobicContact CD1-CB 4.23Å; I209-L217 HydrophobicContact CG1-CB 3.61Å; I209-L217 HydrophobicContact CG1-CD1 4.24Å; I209-Y218 HydrophobicContact CD1-CD1 4.04Å; I209-Y218 HydrophobicContact CD1-CE1 4.22Å; I209-Y218 HydrophobicContact CG2-CE1 3.87Å; I209-Y218 HydrophobicContact CG2-CE2 4.36Å; I209-R221 HydrophobicContact CD1-CB 4.29Å; I209-R221 VanDerWaalsContact CD1-CZ 3.44Å
210	Q	96.4	Very high	94	Very high	135 Å²	135	44 Å²	44	63%	0.631	23%	0.228	S	C	*	.	H	α-helix	trans	-64.1	-34.3	175.7	-75.3	172.4	3.1	0	0	112.9	T206 K207 A208	T206-Q210 VanDerWaalsContact O-CG 3.29Å; T206-Q210 WeakPolarHBondContact O-CG 3.35Å; T206-Q210 PolarHBondContact O-N 3.21Å; K207-Q210 WeakPolarHBondContact O-CB 3.3Å; K207-Q210 PolarHBondContact O-N 2.97Å; A208-Q210 VanDerWaalsContact C-N 3.33Å; A208-Q210 PolarHBondContact O-N 3.14Å
211	L	94.9	Very high	94	Very high	55 Å²	55	42.2 Å²	42.2	29%	0.288	22%	0.217	S	C	.	.	H	α-helix	trans	-75.8	-49.4	177.6	-69.4	170.7	0	0	0	111	N180 P182 Y185 K207 A208 I209	N180-L211 HydrophobicContact CB-CD2 4.44Å; P182-L211 HydrophobicContact CB-CB 4.1Å; P182-L211 HydrophobicContact CB-CD1 4.46Å; P182-L211 HydrophobicContact CG-CB 4.45Å; Y185-L211 HydrophobicContact CD2-CD1 3.94Å; Y185-L211 HydrophobicContact CE2-CD1 3.75Å; K207-L211 HydrophobicContact CG-CD1 4.44Å; K207-L211 WeakPolarHBondContact O-CG 3.45Å; K207-L211 PolarHBondContact O-N 3.36Å; K207-L211 VanDerWaalsContact O-N 3.08Å; A208-L211 PolarHBondContact O-N 2.79Å; A208-L211 VanDerWaalsContact O-N 3.16Å; I209-L211 VanDerWaalsContact C-N 3.3Å; I209-L211 PolarHBondContact O-N 3.44Å
212	Q	94.3	Very high	94.1	Very high	109 Å²	109	42.2 Å²	42.2	51%	0.509	22%	0.217	S	C	.	.	S	Bend	trans	-150.6	103.1	179.5	-170.2	174.2	7.9	0	0	110.7	P182 A208 I209 S214 L217	P182-Q212 HydrophobicContact CB-CB 4.28Å; P182-Q212 HydrophobicContact CG-CB 3.8Å; A208-Q212 PolarHBondContact O-N 3.24Å; I209-Q212 CarbonylContact O-C 3.5Å; Q212-S214 PolarHBondContact O-N 3.4Å; Q212-L217 VanDerWaalsContact O-CD1 3.23Å; Q212-L217 WeakPolarHBondContact O-CD1 3.28Å
213	P	93.9	Very high	93.9	Very high	79 Å²	79	41.7 Å²	41.7	51%	0.513	22%	0.216	S	C	.	.			trans	-63	133.8	175.9	-20.3	30.5	0	0	0	111.4	I209 Y218	I209-P213 VanDerWaalsContact O-CD 3.28Å; I209-P213 WeakPolarHBondContact O-CD 3.44Å; I209-P213 WeakPolarHBondContact O-CG 3.4Å; P213-Y218 HydrophobicContact CB-CE2 4.01Å
214	S	91.8	Very high	93.5	Very high	37 Å²	37	38.5 Å²	38.5	26%	0.259	19%	0.192	S	C	.	.			trans	-145.3	151.6	174.8	84.5	0	0	0	0	111.3	Q212 R216 L217 Y218	Q212-S214 PolarHBondContact O-N 3.4Å; S214-R216 PolarHBondContact O-N 3.48Å; S214-L217 PolarHBondContact O-N 2.85Å; S214-L217 VanDerWaalsContact OG-CG 3.26Å; S214-L217 WeakPolarHBondContact OG-CG 3.44Å; S214-L217 PolarHBondContact OG-N 2.97Å; S214-L217 VanDerWaalsContact OG-N 3.15Å; S214-Y218 WeakPolarHBondContact O-CD2 3.32Å; S214-Y218 PolarHBondContact O-N 2.91Å; S214-Y218 VanDerWaalsContact O-N 3.16Å
215	A	91.4	Very high	93.4	Very high	16 Å²	16	39 Å²	39	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-57.1	-36.9	178.4	0	0	0	0	0	111.9	R219 S241 L244 K245	A215-R219 WeakPolarHBondContact O-CB 3.41Å; A215-R219 PolarHBondContact O-N 3.34Å; A215-S241 WeakPolarHBondContact O-CB 3.33Å; A215-S241 PolarHBondContact O-OG 2.97Å; A215-L244 HydrophobicContact CB-CB 3.85Å; A215-L244 HydrophobicContact CB-CD1 4.48Å; A215-K245 HydrophobicContact CB-CB 3.89Å
216	R	88.9	Confident	93.2	Very high	45 Å²	45	39.9 Å²	39.9	17%	0.17	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-48.7	177.5	177.1	-177.7	170.5	146.2	0.8	111.9	C56 E57 E186 E190 S214 Y218 R219 H220	C56-R216 PolarHBondContact O-NH2 3.09Å; E57-R216 VanDerWaalsContact C-NH1 3.27Å; E57-R216 PolarHBondContact O-NH1 3.2Å; E186-R216 VanDerWaalsContact OE1-CD 3.26Å; E186-R216 WeakPolarHBondContact OE1-CD 3.43Å; E186-R216 WeakPolarHBondContact OE1-CG 3.45Å; E186-R216 IonicContact OE1-CZ 2.79Å; E186-R216 IonicContact OE1-NE 3.57Å; E186-R216 PolarHBondContact OE1-NE 3.23Å; E186-R216 IonicContact OE1-NH2 2.66Å; E186-R216 IonicContact OE2-NE 3.8Å; E190-R216 IonicContact OE1-CZ 2.69Å; E190-R216 IonicContact OE1-NH2 2.77Å; E190-R216 PolarHBondContact OE1-NH2 3.46Å; S214-R216 PolarHBondContact O-N 3.48Å; R216-Y218 PolarHBondContact O-N 3.3Å; R216-R219 PolarHBondContact O-N 3.13Å; R216-H220 WeakPolarHBondContact O-CB 3.49Å; R216-H220 PolarHBondContact O-N 3.39Å
217	L	90.8	Very high	92.6	Very high	5 Å²	5	41 Å²	41	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-43.6	-178.6	-70.6	171	0	0	0	111.8	E186 L205 A208 I209 Q212 S214 H220 R221	E186-L217 HydrophobicContact CB-CD2 3.82Å; E186-L217 HydrophobicContact CG-CD2 3.77Å; L205-L217 HydrophobicContact CD2-CD2 4Å; A208-L217 HydrophobicContact CB-CD1 3.97Å; A208-L217 HydrophobicContact CB-CD2 3.85Å; I209-L217 HydrophobicContact CD1-CB 4.23Å; I209-L217 HydrophobicContact CG1-CB 3.61Å; I209-L217 HydrophobicContact CG1-CD1 4.24Å; Q212-L217 VanDerWaalsContact O-CD1 3.23Å; Q212-L217 WeakPolarHBondContact O-CD1 3.28Å; S214-L217 PolarHBondContact O-N 2.85Å; S214-L217 VanDerWaalsContact OG-CG 3.26Å; S214-L217 WeakPolarHBondContact OG-CG 3.44Å; S214-L217 PolarHBondContact OG-N 2.97Å; S214-L217 VanDerWaalsContact OG-N 3.15Å; L217-H220 PolarHBondContact O-N 3.49Å; L217-R221 WeakPolarHBondContact O-CB 3.38Å; L217-R221 PolarHBondContact O-N 2.66Å
218	Y	95.6	Very high	92.2	Very high	43 Å²	43	40.2 Å²	40.2	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-44.5	173.5	-77.3	-65.3	0	0	0	111.8	I209 P213 S214 R216 H220 R221 G222 D237 L244	I209-Y218 HydrophobicContact CD1-CD1 4.04Å; I209-Y218 HydrophobicContact CD1-CE1 4.22Å; I209-Y218 HydrophobicContact CG2-CE1 3.87Å; I209-Y218 HydrophobicContact CG2-CE2 4.36Å; P213-Y218 HydrophobicContact CB-CE2 4.01Å; S214-Y218 WeakPolarHBondContact O-CD2 3.32Å; S214-Y218 PolarHBondContact O-N 2.91Å; S214-Y218 VanDerWaalsContact O-N 3.16Å; R216-Y218 PolarHBondContact O-N 3.3Å; Y218-H220 PolarHBondContact O-N 3.39Å; Y218-R221 PolarHBondContact O-N 2.75Å; Y218-G222 PolarHBondContact O-N 2.96Å; Y218-D237 WeakPolarHBondContact CB-O 3.1Å; Y218-D237 WeakPolarHBondContact CD1-OD1 3.41Å; Y218-D237 WeakPolarHBondContact O-CB 3.47Å; Y218-L244 HydrophobicContact CD2-CD1 3.79Å; Y218-L244 HydrophobicContact CE2-CD1 3.86Å
219	R	92.9	Very high	91.9	Very high	39 Å²	39	44.6 Å²	44.6	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-43.3	176.5	-178.2	-178.2	64.3	79.6	-6.2	111.9	C56 A215 R216 T223 F238 A251	C56-R219 PolarHBondContact SG-NH2 3.24Å; A215-R219 WeakPolarHBondContact O-CB 3.41Å; A215-R219 PolarHBondContact O-N 3.34Å; R216-R219 PolarHBondContact O-N 3.13Å; R219-T223 WeakPolarHBondContact O-CB 3.31Å; R219-T223 PolarHBondContact O-N 2.84Å; R219-T223 PolarHBondContact O-OG1 3.11Å; R219-F238 HydrophobicContact CG-CE1 4.32Å; R219-A251 HydrophobicContact CG-CB 4.33Å
220	H	89.1	Confident	91.5	Very high	30 Å²	30	46.5 Å²	46.5	14%	0.139	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-49.1	-179.6	-170.7	-176.3	0	0	0	110.6	E190 L205 R216 L217 Y218 G222 T223 L224	E190-H220 VanDerWaalsContact CG-CE1 3.41Å; E190-H220 WeakPolarHBondContact CG-CE1 3.5Å; L205-H220 HydrophobicContact CD1-CB 4.35Å; L205-H220 HydrophobicContact CD2-CB 4.39Å; R216-H220 WeakPolarHBondContact O-CB 3.49Å; R216-H220 PolarHBondContact O-N 3.39Å; L217-H220 PolarHBondContact O-N 3.49Å; Y218-H220 PolarHBondContact O-N 3.39Å; H220-G222 PolarHBondContact O-N 3.48Å; H220-T223 WeakPolarHBondContact O-CB 3.41Å; H220-T223 PolarHBondContact O-N 3.07Å; H220-T223 VanDerWaalsContact O-N 3.14Å; H220-L224 PolarHBondContact O-N 3.31Å; H220-L224 VanDerWaalsContact O-N 3.09Å
221	R	94.8	Very high	91.3	Very high	44 Å²	44	40.7 Å²	40.7	17%	0.166	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-42.2	177.6	-167.4	176.8	68	176.9	-2	111.6	L202 L205 T206 I209 L217 Y218 T223 L224 L225 D237	L202-R221 HydrophobicContact CD2-CG 3.76Å; L205-R221 HydrophobicContact CB-CB 3.96Å; L205-R221 HydrophobicContact CB-CG 4.08Å; L205-R221 HydrophobicContact CD1-CB 3.85Å; L205-R221 HydrophobicContact CD1-CG 4.3Å; T206-R221 PolarHBondContact OG1-NH1 3.15Å; T206-R221 VanDerWaalsContact OG1-NH1 3.08Å; I209-R221 HydrophobicContact CD1-CB 4.29Å; I209-R221 VanDerWaalsContact CD1-CZ 3.44Å; L217-R221 WeakPolarHBondContact O-CB 3.38Å; L217-R221 PolarHBondContact O-N 2.66Å; Y218-R221 PolarHBondContact O-N 2.75Å; R221-T223 VanDerWaalsContact C-N 3.27Å; R221-T223 PolarHBondContact O-N 3.38Å; R221-L224 PolarHBondContact O-N 2.97Å; R221-L224 VanDerWaalsContact O-N 3.16Å; R221-L225 HydrophobicContact CG-CD1 4.08Å; R221-L225 HydrophobicContact CG-CG 4.4Å; R221-L225 WeakPolarHBondContact O-CB 3.37Å; R221-L225 VanDerWaalsContact O-CG 3.28Å; R221-L225 WeakPolarHBondContact O-CG 3.25Å; R221-L225 PolarHBondContact O-N 3.3Å; R221-D237 VanDerWaalsContact CB-OD2 3.28Å; R221-D237 WeakPolarHBondContact CB-OD2 3.06Å; R221-D237 WeakPolarHBondContact CG-OD2 3.46Å; R221-D237 IonicContact CZ-OD1 3.64Å; R221-D237 IonicContact CZ-OD2 3.51Å; R221-D237 IonicContact NE-OD1 2.68Å; R221-D237 IonicContact NE-OD2 3.44Å; R221-D237 PolarHBondContact NE-OD2 3.48Å; R221-D237 IonicContact NH2-OD1 3.05Å; R221-D237 PolarHBondContact NH2-OD1 2.94Å; R221-D237 IonicContact NH2-OD2 3.73Å
222	G	94.8	Very high	91	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-37.4	173.4	0	0	0	0	0	113.2	Y218 H220 L225 F226 A234 D237 F238	Y218-G222 PolarHBondContact O-N 2.96Å; H220-G222 PolarHBondContact O-N 3.48Å; G222-L225 PolarHBondContact O-N 3.03Å; G222-F226 WeakPolarHBondContact O-CB 3.31Å; G222-F226 PolarHBondContact O-N 2.85Å; G222-A234 WeakPolarHBondContact O-CB 3.32Å; G222-D237 PolarHBondContact N-OD2 3.33Å; G222-F238 WeakPolarHBondContact O-CZ 3.4Å
223	T	89.9	Confident	90.9	Very high	24 Å²	24	36.3 Å²	36.3	15%	0.147	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-42.8	175.9	-54.1	0	0	0	0	111.6	R219 H220 R221 F226 I227 Y254	R219-T223 WeakPolarHBondContact O-CB 3.31Å; R219-T223 PolarHBondContact O-N 2.84Å; R219-T223 PolarHBondContact O-OG1 3.11Å; H220-T223 WeakPolarHBondContact O-CB 3.41Å; H220-T223 PolarHBondContact O-N 3.07Å; H220-T223 VanDerWaalsContact O-N 3.14Å; R221-T223 VanDerWaalsContact C-N 3.27Å; R221-T223 PolarHBondContact O-N 3.38Å; T223-F226 WeakPolarHBondContact O-CB 3.39Å; T223-F226 PolarHBondContact O-N 3.08Å; T223-I227 HydrophobicContact CG2-CD1 4.19Å; T223-I227 VanDerWaalsContact O-CG1 3.31Å; T223-I227 WeakPolarHBondContact O-CG1 3.45Å; T223-I227 PolarHBondContact O-N 3.27Å; T223-Y254 HydrophobicContact CG2-CE1 4.36Å
224	L	89.3	Confident	91	Very high	7 Å²	7	32.6 Å²	32.6	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-39.5	175.3	-62.7	-173.3	0	0	0	112.1	S193 I198 A201 L202 L205 H220 R221 F226 I227 S228	S193-L224 WeakPolarHBondContact OG-CD1 3.28Å; S193-L224 WeakPolarHBondContact OG-CD2 3.49Å; I198-L224 HydrophobicContact CD1-CD2 4.45Å; I198-L224 HydrophobicContact CG2-CB 4.5Å; A201-L224 HydrophobicContact CB-CD1 3.65Å; L202-L224 HydrophobicContact CD2-CB 3.73Å; L202-L224 HydrophobicContact CD2-CD1 4.42Å; L202-L224 HydrophobicContact CG-CB 4.42Å; L205-L224 HydrophobicContact CD1-CD1 3.6Å; L205-L224 HydrophobicContact CD1-CG 4.4Å; H220-L224 PolarHBondContact O-N 3.31Å; H220-L224 VanDerWaalsContact O-N 3.09Å; R221-L224 PolarHBondContact O-N 2.97Å; R221-L224 VanDerWaalsContact O-N 3.16Å; L224-F226 VanDerWaalsContact C-N 3.34Å; L224-I227 PolarHBondContact O-N 3.03Å; L224-S228 WeakPolarHBondContact O-CB 3.39Å; L224-S228 PolarHBondContact O-N 3.38Å; L224-S228 PolarHBondContact O-OG 3.4Å
225	L	93.3	Very high	91.1	Very high	19 Å²	19	32.7 Å²	32.7	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-44.4	174.6	-71.7	167	0	0	0	110.9	L202 R221 G222 I227 S228 E229 D230 A233 A234 D237	L202-L225 HydrophobicContact CD1-CD2 4.09Å; L202-L225 HydrophobicContact CD2-CD2 3.87Å; L202-L225 HydrophobicContact CD2-CG 3.83Å; R221-L225 HydrophobicContact CG-CD1 4.08Å; R221-L225 HydrophobicContact CG-CG 4.4Å; R221-L225 WeakPolarHBondContact O-CB 3.37Å; R221-L225 VanDerWaalsContact O-CG 3.28Å; R221-L225 WeakPolarHBondContact O-CG 3.25Å; R221-L225 PolarHBondContact O-N 3.3Å; G222-L225 PolarHBondContact O-N 3.03Å; L225-I227 PolarHBondContact O-N 2.96Å; L225-S228 VanDerWaalsContact CA-OG 3.29Å; L225-S228 WeakPolarHBondContact CA-OG 3.23Å; L225-S228 CarbonylContact O-C 3.43Å; L225-S228 PolarHBondContact O-N 2.91Å; L225-S228 VanDerWaalsContact O-N 3.16Å; L225-S228 PolarHBondContact O-OG 2.88Å; L225-E229 PolarHBondContact O-N 3.28Å; L225-E229 VanDerWaalsContact O-N 3.12Å; L225-D230 HydrophobicContact CD2-CB 4.25Å; L225-D230 PolarHBondContact O-N 3.03Å; L225-A233 HydrophobicContact CD1-CB 3.76Å; L225-A233 HydrophobicContact CD2-CB 4.11Å; L225-A233 HydrophobicContact CG-CB 4.4Å; L225-A234 HydrophobicContact CB-CB 3.82Å; L225-D237 WeakPolarHBondContact CD1-OD2 3.35Å
226	F	91	Very high	91.2	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-58.8	-45.5	174.4	178.6	-89.5	0	0	0	112.1	T30 G222 T223 L224 S228 E229 Y231 A234 F238 Y254 L257 T258 H261	T30-F226 HydrophobicContact CG2-CE1 4.38Å; T30-F226 HydrophobicContact CG2-CZ 4.28Å; G222-F226 WeakPolarHBondContact O-CB 3.31Å; G222-F226 PolarHBondContact O-N 2.85Å; T223-F226 WeakPolarHBondContact O-CB 3.39Å; T223-F226 PolarHBondContact O-N 3.08Å; L224-F226 VanDerWaalsContact C-N 3.34Å; F226-S228 VanDerWaalsContact C-N 3.3Å; F226-S228 PolarHBondContact O-N 3.31Å; F226-E229 WeakPolarHBondContact O-CA 3.39Å; F226-E229 PolarHBondContact O-N 2.93Å; F226-Y231 AromaticContact CD2-CD1 3.77Å; F226-Y231 HydrophobicContact CD2-CD1 3.77Å; F226-Y231 AromaticContact CD2-CE1 3.81Å; F226-Y231 HydrophobicContact CD2-CE1 3.81Å; F226-Y231 AromaticContact CE2-CD1 3.99Å; F226-Y231 HydrophobicContact CE2-CD1 3.99Å; F226-Y231 AromaticContact CE2-CE1 3.74Å; F226-Y231 HydrophobicContact CE2-CE1 3.74Å; F226-Y231 HydrophobicContact CG-CE1 4.46Å; F226-Y231 HydrophobicContact CZ-CE1 4.34Å; F226-A234 HydrophobicContact CB-CB 4.08Å; F226-F238 HydrophobicContact CB-CE2 4.43Å; F226-Y254 HydrophobicContact CD1-CD1 4.29Å; F226-Y254 HydrophobicContact CD1-CE1 4.33Å; F226-Y254 HydrophobicContact CE1-CE1 4.48Å; F226-Y254 HydrophobicContact CG-CD1 4.44Å; F226-L257 HydrophobicContact CE2-CB 3.82Å; F226-L257 HydrophobicContact CZ-CB 3.94Å; F226-T258 WeakPolarHBondContact CD2-OG1 3.46Å; F226-H261 AromaticContact CE2-CD2 3.64Å; F226-H261 AromaticContact CZ-CD2 3.5Å; F226-H261 AromaticContact CZ-NE2 3.84Å
227	I	85.3	Confident	91.6	Very high	71 Å²	71	35.7 Å²	35.7	36%	0.364	18%	0.181	S	C	.	.	H	α-helix	trans	-64.4	-36.3	176.7	-68.2	165.1	0	0	0	111.3	F34 T223 L224 L225 E229	F34-I227 HydrophobicContact CE2-CD1 4.39Å; F34-I227 HydrophobicContact CE2-CG1 4.44Å; F34-I227 HydrophobicContact CZ-CD1 4.15Å; T223-I227 HydrophobicContact CG2-CD1 4.19Å; T223-I227 VanDerWaalsContact O-CG1 3.31Å; T223-I227 WeakPolarHBondContact O-CG1 3.45Å; T223-I227 PolarHBondContact O-N 3.27Å; L224-I227 PolarHBondContact O-N 3.03Å; L225-I227 PolarHBondContact O-N 2.96Å; I227-E229 PolarHBondContact O-N 3.33Å
228	S	87	Confident	91.9	Very high	57 Å²	57	35.4 Å²	35.4	40%	0.399	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	4.6	173.6	69.5	0	0	0	0	114.2	L224 L225 F226 D230	L224-S228 WeakPolarHBondContact O-CB 3.39Å; L224-S228 PolarHBondContact O-N 3.38Å; L224-S228 PolarHBondContact O-OG 3.4Å; L225-S228 VanDerWaalsContact CA-OG 3.29Å; L225-S228 WeakPolarHBondContact CA-OG 3.23Å; L225-S228 CarbonylContact O-C 3.43Å; L225-S228 PolarHBondContact O-N 2.91Å; L225-S228 VanDerWaalsContact O-N 3.16Å; L225-S228 PolarHBondContact O-OG 2.88Å; F226-S228 VanDerWaalsContact C-N 3.3Å; F226-S228 PolarHBondContact O-N 3.31Å; S228-D230 PolarHBondContact O-N 3.24Å
229	E	87.8	Confident	92	Very high	91 Å²	91	36.6 Å²	36.6	43%	0.425	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	18.6	-179	-51.2	-175.7	175.3	0	0	114.6	L225 F226 I227 Y231	L225-E229 PolarHBondContact O-N 3.28Å; L225-E229 VanDerWaalsContact O-N 3.12Å; F226-E229 WeakPolarHBondContact O-CA 3.39Å; F226-E229 PolarHBondContact O-N 2.93Å; I227-E229 PolarHBondContact O-N 3.33Å; E229-Y231 VanDerWaalsContact C-N 3.33Å; E229-Y231 HydrophobicContact CB-CE2 3.94Å; E229-Y231 WeakPolarHBondContact O-CD2 3.35Å; E229-Y231 PolarHBondContact O-N 3.42Å; E229-Y231 VanDerWaalsContact O-N 3.17Å
230	D	89.5	Confident	92.1	Very high	53 Å²	53	36.4 Å²	36.4	28%	0.283	19%	0.191	S	C	.	.			trans	-86.6	75.8	168.8	-167	-13.7	0	0	0	110.1	L225 S228 V232 A233 A234	L225-D230 HydrophobicContact CD2-CB 4.25Å; L225-D230 PolarHBondContact O-N 3.03Å; S228-D230 PolarHBondContact O-N 3.24Å; D230-V232 VanDerWaalsContact C-N 3.33Å; D230-V232 PolarHBondContact O-N 3.47Å; D230-A233 HydrophobicContact CB-CB 4.49Å; D230-A233 PolarHBondContact OD1-N 2.91Å; D230-A234 VanDerWaalsContact O-CB 3.25Å; D230-A234 WeakPolarHBondContact O-CB 3.22Å; D230-A234 PolarHBondContact O-N 3.43Å
231	Y	90.6	Very high	92.5	Very high	12 Å²	12	35 Å²	35	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-69.2	-29.1	-174.4	-56.7	-65	0	0	0	112.9	F226 E229 M235 T258 H261 R262 Q573	F226-Y231 AromaticContact CD2-CD1 3.77Å; F226-Y231 HydrophobicContact CD2-CD1 3.77Å; F226-Y231 AromaticContact CD2-CE1 3.81Å; F226-Y231 HydrophobicContact CD2-CE1 3.81Å; F226-Y231 AromaticContact CE2-CD1 3.99Å; F226-Y231 HydrophobicContact CE2-CD1 3.99Å; F226-Y231 AromaticContact CE2-CE1 3.74Å; F226-Y231 HydrophobicContact CE2-CE1 3.74Å; F226-Y231 HydrophobicContact CG-CE1 4.46Å; F226-Y231 HydrophobicContact CZ-CE1 4.34Å; E229-Y231 VanDerWaalsContact C-N 3.33Å; E229-Y231 HydrophobicContact CB-CE2 3.94Å; E229-Y231 WeakPolarHBondContact O-CD2 3.35Å; E229-Y231 PolarHBondContact O-N 3.42Å; E229-Y231 VanDerWaalsContact O-N 3.17Å; Y231-M235 VanDerWaalsContact O-CB 3.26Å; Y231-M235 WeakPolarHBondContact O-CB 3.46Å; Y231-M235 PolarHBondContact O-N 3.45Å; Y231-T258 HydrophobicContact CD1-CG2 4.35Å; Y231-T258 WeakPolarHBondContact O-CG2 3.18Å; Y231-H261 HydrophobicContact CD1-CB 3.99Å; Y231-H261 HydrophobicContact CD2-CB 4.39Å; Y231-H261 HydrophobicContact CE1-CB 3.62Å; Y231-H261 AromaticContact CE1-CG 4Å; Y231-H261 HydrophobicContact CE2-CB 4.05Å; Y231-H261 HydrophobicContact CG-CB 4.36Å; Y231-R262 HydrophobicContact CD2-CG 4.45Å; Y231-R262 HydrophobicContact CG-CG 4.23Å; Y231-Q573 HydrophobicContact CD2-CB 4.47Å; Y231-Q573 VanDerWaalsContact N-OE1 3.09Å
232	V	89.9	Confident	92.4	Very high	50 Å²	50	33.5 Å²	33.5	30%	0.303	18%	0.18	S	C	.	.	H	α-helix	trans	-66.4	-52.3	176.5	174.9	0	0	0	0	110.3	D230 A234 M235 E236	D230-V232 VanDerWaalsContact C-N 3.33Å; D230-V232 PolarHBondContact O-N 3.47Å; V232-A234 VanDerWaalsContact C-N 3.33Å; V232-A234 PolarHBondContact O-N 2.9Å; V232-M235 WeakPolarHBondContact O-CB 3.13Å; V232-M235 PolarHBondContact O-N 3.05Å; V232-E236 PolarHBondContact O-N 3.3Å
233	A	92.4	Very high	92.5	Very high	23 Å²	23	39.5 Å²	39.5	19%	0.19	21%	0.208	C	C	.	.	H	α-helix	trans	-65.9	-37.8	179.3	0	0	0	0	0	111.7	L225 D230 M235 E236 D237	L225-A233 HydrophobicContact CD1-CB 3.76Å; L225-A233 HydrophobicContact CD2-CB 4.11Å; L225-A233 HydrophobicContact CG-CB 4.4Å; D230-A233 HydrophobicContact CB-CB 4.49Å; D230-A233 PolarHBondContact OD1-N 2.91Å; A233-M235 VanDerWaalsContact C-N 3.33Å; A233-M235 PolarHBondContact O-N 2.8Å; A233-E236 PolarHBondContact O-N 3.32Å; A233-D237 PolarHBondContact O-N 3.25Å
234	A	94.5	Very high	92.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-42.6	174.7	0	0	0	0	0	112.3	G222 L225 F226 D230 V232 E236 D237 F238 T258	G222-A234 WeakPolarHBondContact O-CB 3.32Å; L225-A234 HydrophobicContact CB-CB 3.82Å; F226-A234 HydrophobicContact CB-CB 4.08Å; D230-A234 VanDerWaalsContact O-CB 3.25Å; D230-A234 WeakPolarHBondContact O-CB 3.22Å; D230-A234 PolarHBondContact O-N 3.43Å; V232-A234 VanDerWaalsContact C-N 3.33Å; V232-A234 PolarHBondContact O-N 2.9Å; A234-E236 PolarHBondContact O-N 3.21Å; A234-D237 PolarHBondContact O-N 2.91Å; A234-F238 HydrophobicContact CB-CD2 4.42Å; A234-F238 HydrophobicContact CB-CE2 4.06Å; A234-F238 WeakPolarHBondContact O-CD2 3.39Å; A234-F238 WeakPolarHBondContact O-CG 3.44Å; A234-F238 PolarHBondContact O-N 2.85Å; A234-T258 HydrophobicContact CB-CG2 4.26Å
235	M	93.9	Very high	92.9	Very high	39 Å²	39	47.9 Å²	47.9	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-43.8	178.6	-179.1	-173.7	66.5	0	0	111.7	Y231 V232 A233 Q239 T258 F259	Y231-M235 VanDerWaalsContact O-CB 3.26Å; Y231-M235 WeakPolarHBondContact O-CB 3.46Å; Y231-M235 PolarHBondContact O-N 3.45Å; V232-M235 WeakPolarHBondContact O-CB 3.13Å; V232-M235 PolarHBondContact O-N 3.05Å; A233-M235 VanDerWaalsContact C-N 3.33Å; A233-M235 PolarHBondContact O-N 2.8Å; M235-Q239 WeakPolarHBondContact O-CB 3.46Å; M235-Q239 PolarHBondContact O-N 2.92Å; M235-T258 HydrophobicContact CB-CG2 3.76Å; M235-F259 HydrophobicContact CG-CE1 4.23Å; M235-F259 HydrophobicContact CG-CZ 4.22Å; M235-F259 HydrophobicContact SD-CD1 4.08Å; M235-F259 HydrophobicContact SD-CE1 3.35Å; M235-F259 WeakPolarHBondContact SD-CE1 3.39Å; M235-F259 HydrophobicContact SD-CZ 3.83Å
236	E	95	Very high	92.8	Very high	116 Å²	116	55 Å²	55	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-45.8	176.9	-68.8	177.7	178.6	0	0	111	V232 A233 A234 Q239 S240	V232-E236 PolarHBondContact O-N 3.3Å; A233-E236 PolarHBondContact O-N 3.32Å; A234-E236 PolarHBondContact O-N 3.21Å; E236-Q239 WeakPolarHBondContact O-CB 3.26Å; E236-Q239 PolarHBondContact O-N 2.95Å; E236-S240 PolarHBondContact O-N 3.15Å; E236-S240 PolarHBondContact O-OG 3.41Å
237	D	97	Very high	92.8	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.043	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-44	178.1	-91.2	4.5	0	0	0	112.5	Y218 R221 G222 L225 A233 A234 Q239 S240 S241	Y218-D237 WeakPolarHBondContact CB-O 3.1Å; Y218-D237 WeakPolarHBondContact CD1-OD1 3.41Å; Y218-D237 WeakPolarHBondContact O-CB 3.47Å; R221-D237 VanDerWaalsContact CB-OD2 3.28Å; R221-D237 WeakPolarHBondContact CB-OD2 3.06Å; R221-D237 WeakPolarHBondContact CG-OD2 3.46Å; R221-D237 IonicContact CZ-OD1 3.64Å; R221-D237 IonicContact CZ-OD2 3.51Å; R221-D237 IonicContact NE-OD1 2.68Å; R221-D237 IonicContact NE-OD2 3.44Å; R221-D237 PolarHBondContact NE-OD2 3.48Å; R221-D237 IonicContact NH2-OD1 3.05Å; R221-D237 PolarHBondContact NH2-OD1 2.94Å; R221-D237 IonicContact NH2-OD2 3.73Å; G222-D237 PolarHBondContact N-OD2 3.33Å; L225-D237 WeakPolarHBondContact CD1-OD2 3.35Å; A233-D237 PolarHBondContact O-N 3.25Å; A234-D237 PolarHBondContact O-N 2.91Å; D237-Q239 VanDerWaalsContact C-N 3.29Å; D237-Q239 PolarHBondContact O-N 3.07Å; D237-S240 PolarHBondContact O-N 3.27Å; D237-S241 WeakPolarHBondContact O-CB 3.27Å; D237-S241 PolarHBondContact O-N 3.35Å
238	F	96.8	Very high	93.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-36.3	174.5	-67.4	-53.5	0	0	0	112.1	R219 G222 F226 A234 S241 L242 A251 Y254 K255	R219-F238 HydrophobicContact CG-CE1 4.32Å; G222-F238 WeakPolarHBondContact O-CZ 3.4Å; F226-F238 HydrophobicContact CB-CE2 4.43Å; A234-F238 HydrophobicContact CB-CD2 4.42Å; A234-F238 HydrophobicContact CB-CE2 4.06Å; A234-F238 WeakPolarHBondContact O-CD2 3.39Å; A234-F238 WeakPolarHBondContact O-CG 3.44Å; A234-F238 PolarHBondContact O-N 2.85Å; F238-S241 PolarHBondContact O-N 3.5Å; F238-L242 WeakPolarHBondContact O-CB 3.25Å; F238-L242 WeakPolarHBondContact O-CD1 3.19Å; F238-L242 VanDerWaalsContact O-CG 3.27Å; F238-L242 WeakPolarHBondContact O-CG 3.44Å; F238-L242 PolarHBondContact O-N 3.03Å; F238-A251 HydrophobicContact CD1-CB 4.46Å; F238-Y254 HydrophobicContact CE1-CG 4.27Å; F238-Y254 HydrophobicContact CZ-CD1 4.22Å; F238-Y254 AromaticContact CZ-CG 3.9Å; F238-Y254 HydrophobicContact CZ-CG 3.9Å; F238-K255 HydrophobicContact CB-CB 3.97Å
239	Q	96.3	Very high	93.3	Very high	67 Å²	67	55.7 Å²	55.7	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-50.5	174.9	179.1	59.8	33.7	0	0	111.2	M235 E236 D237 S241 L242 E243	M235-Q239 WeakPolarHBondContact O-CB 3.46Å; M235-Q239 PolarHBondContact O-N 2.92Å; E236-Q239 WeakPolarHBondContact O-CB 3.26Å; E236-Q239 PolarHBondContact O-N 2.95Å; D237-Q239 VanDerWaalsContact C-N 3.29Å; D237-Q239 PolarHBondContact O-N 3.07Å; Q239-S241 VanDerWaalsContact C-N 3.29Å; Q239-S241 PolarHBondContact O-N 3.25Å; Q239-L242 PolarHBondContact O-N 3.47Å; Q239-L242 VanDerWaalsContact O-N 3.15Å; Q239-E243 WeakPolarHBondContact CG-OE1 3.36Å; Q239-E243 PolarHBondContact NE2-OE1 3.06Å; Q239-E243 WeakPolarHBondContact O-CG 3.37Å; Q239-E243 PolarHBondContact O-N 3.02Å
240	S	96.7	Very high	93.3	Very high	36 Å²	36	53.4 Å²	53.4	25%	0.252	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-38.2	176.6	-64.3	0	0	0	0	112.3	E236 D237 E243 L244	E236-S240 PolarHBondContact O-N 3.15Å; E236-S240 PolarHBondContact O-OG 3.41Å; D237-S240 PolarHBondContact O-N 3.27Å; S240-E243 PolarHBondContact O-N 2.86Å; S240-L244 WeakPolarHBondContact O-CG 3.35Å; S240-L244 PolarHBondContact O-N 3.45Å
241	S	95.9	Very high	93.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-46.7	173.8	-177.4	0	0	0	0	112.3	A215 D237 F238 Q239 L244 K245 Q248	A215-S241 WeakPolarHBondContact O-CB 3.33Å; A215-S241 PolarHBondContact O-OG 2.97Å; D237-S241 WeakPolarHBondContact O-CB 3.27Å; D237-S241 PolarHBondContact O-N 3.35Å; F238-S241 PolarHBondContact O-N 3.5Å; Q239-S241 VanDerWaalsContact C-N 3.29Å; Q239-S241 PolarHBondContact O-N 3.25Å; S241-L244 PolarHBondContact O-N 3.32Å; S241-K245 PolarHBondContact O-N 2.97Å; S241-Q248 PolarHBondContact O-NE2 2.98Å; S241-Q248 VanDerWaalsContact O-NE2 3.12Å; S241-Q248 PolarHBondContact OG-NE2 3.21Å; S241-Q248 PolarHBondContact OG-OE1 3.37Å
242	L	93.9	Very high	93.5	Very high	12 Å²	12	51 Å²	51	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-70.6	-29.2	-178.9	-72.2	166.4	0	0	0	113	F238 Q239 K245 K246 Q248 A251 M252 K255	F238-L242 WeakPolarHBondContact O-CB 3.25Å; F238-L242 WeakPolarHBondContact O-CD1 3.19Å; F238-L242 VanDerWaalsContact O-CG 3.27Å; F238-L242 WeakPolarHBondContact O-CG 3.44Å; F238-L242 PolarHBondContact O-N 3.03Å; Q239-L242 PolarHBondContact O-N 3.47Å; Q239-L242 VanDerWaalsContact O-N 3.15Å; L242-K245 CarbonylContact O-C 3.58Å; L242-K245 VanDerWaalsContact O-C 3.29Å; L242-K246 WeakPolarHBondContact O-CA 3.49Å; L242-K246 WeakPolarHBondContact O-CG 3.35Å; L242-K246 PolarHBondContact O-N 3.32Å; L242-Q248 HydrophobicContact CD2-CB 4.04Å; L242-A251 HydrophobicContact CD2-CB 4.03Å; L242-A251 HydrophobicContact CG-CB 4.19Å; L242-M252 HydrophobicContact CD1-CE 3.79Å; L242-M252 HydrophobicContact CD1-SD 3.89Å; L242-M252 HydrophobicContact CD2-CE 4.07Å; L242-K255 HydrophobicContact CD1-CD 3.72Å
243	E	96	Very high	93.7	Very high	126 Å²	126	49.2 Å²	49.2	59%	0.589	25%	0.245	S	C	*	.	H	α-helix	trans	-65.7	-39.4	172.1	-75.9	171	-173.5	0	0	111.9	Q239 S240	Q239-E243 WeakPolarHBondContact CG-OE1 3.36Å; Q239-E243 PolarHBondContact NE2-OE1 3.06Å; Q239-E243 WeakPolarHBondContact O-CG 3.37Å; Q239-E243 PolarHBondContact O-N 3.02Å; S240-E243 PolarHBondContact O-N 2.86Å
244	L	94.1	Very high	93.7	Very high	102 Å²	102	51 Å²	51	53%	0.534	25%	0.247	S	C	.	.	H	α-helix	trans	-74	-42.2	176	-67.5	176.9	0	0	0	112.5	A215 Y218 S240 S241	A215-L244 HydrophobicContact CB-CB 3.85Å; A215-L244 HydrophobicContact CB-CD1 4.48Å; Y218-L244 HydrophobicContact CD2-CD1 3.79Å; Y218-L244 HydrophobicContact CE2-CD1 3.86Å; S240-L244 WeakPolarHBondContact O-CG 3.35Å; S240-L244 PolarHBondContact O-N 3.45Å; S241-L244 PolarHBondContact O-N 3.32Å
245	K	93.6	Very high	93.8	Very high	105 Å²	105	52.4 Å²	52.4	46%	0.457	25%	0.253	S	S	.	.			trans	-139.8	107.7	176.9	-176	-177.7	178.7	-176.2	0	110.4	A215 S241 L242 Q248	A215-K245 HydrophobicContact CB-CB 3.89Å; S241-K245 PolarHBondContact O-N 2.97Å; L242-K245 CarbonylContact O-C 3.58Å; L242-K245 VanDerWaalsContact O-C 3.29Å; K245-Q248 HydrophobicContact CB-CG 4.37Å; K245-Q248 HydrophobicContact CD-CG 4.09Å; K245-Q248 HydrophobicContact CG-CG 4.07Å; K245-Q248 WeakPolarHBondContact O-CG 3.08Å; K245-Q248 PolarHBondContact O-NE2 3.36Å
246	K	90.5	Very high	93.9	Very high	170 Å²	170	50.5 Å²	50.5	74%	0.739	24%	0.244	S	C	*	.	S	Bend	trans	-70.9	-33.3	-175.4	-65	-177.3	-179.5	-179.1	0	114.6	L242 Q248	L242-K246 WeakPolarHBondContact O-CA 3.49Å; L242-K246 WeakPolarHBondContact O-CG 3.35Å; L242-K246 PolarHBondContact O-N 3.32Å; K246-Q248 VanDerWaalsContact C-N 3.29Å; K246-Q248 PolarHBondContact O-N 3.32Å
247	N	92.2	Very high	93.9	Very high	111 Å²	111	46.5 Å²	46.5	59%	0.594	23%	0.226	S	C	*	.			trans	-84.2	70.4	-176	-168.6	26.5	0	0	0	111.2
248	Q	91	Very high	93.8	Very high	21 Å²	21	46.1 Å²	46.1	10%	0.098	22%	0.224	C	C	.	.			trans	-136.5	85.9	179.4	-66.2	-174	83.5	0	0	110.5	S241 L242 K245 K246 I250 A251 M252	S241-Q248 PolarHBondContact O-NE2 2.98Å; S241-Q248 VanDerWaalsContact O-NE2 3.12Å; S241-Q248 PolarHBondContact OG-NE2 3.21Å; S241-Q248 PolarHBondContact OG-OE1 3.37Å; L242-Q248 HydrophobicContact CD2-CB 4.04Å; K245-Q248 HydrophobicContact CB-CG 4.37Å; K245-Q248 HydrophobicContact CD-CG 4.09Å; K245-Q248 HydrophobicContact CG-CG 4.07Å; K245-Q248 WeakPolarHBondContact O-CG 3.08Å; K245-Q248 PolarHBondContact O-NE2 3.36Å; K246-Q248 VanDerWaalsContact C-N 3.29Å; K246-Q248 PolarHBondContact O-N 3.32Å; Q248-I250 VanDerWaalsContact C-N 3.26Å; Q248-I250 PolarHBondContact O-N 2.96Å; Q248-A251 HydrophobicContact CB-CB 3.79Å; Q248-A251 PolarHBondContact O-N 3.29Å; Q248-M252 PolarHBondContact O-N 2.68Å
249	P	90.7	Very high	93.7	Very high	28 Å²	28	47.4 Å²	47.4	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-35.3	-177.9	21.9	-32.3	0	0	0	112.8	M252 L253 L278 K279 F282	P249-M252 PolarHBondContact O-N 2.82Å; P249-L253 WeakPolarHBondContact O-CB 3.29Å; P249-L253 PolarHBondContact O-N 3.28Å; P249-L278 HydrophobicContact CB-CB 4.03Å; P249-K279 HydrophobicContact CB-CB 3.88Å; P249-K279 HydrophobicContact CG-CB 4.17Å; P249-F282 HydrophobicContact CB-CD1 4.25Å; P249-F282 HydrophobicContact CB-CE1 4.11Å
250	I	88.5	Confident	93.7	Very high	42 Å²	42	44.6 Å²	44.6	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-47.9	178.8	-61.2	170.8	0	0	0	111.1	Y52 Q248 M252 L253 Y254 F282	Y52-I250 HydrophobicContact CD1-CD1 3.72Å; Y52-I250 HydrophobicContact CE1-CD1 4.28Å; Q248-I250 VanDerWaalsContact C-N 3.26Å; Q248-I250 PolarHBondContact O-N 2.96Å; I250-M252 PolarHBondContact O-N 2.86Å; I250-L253 WeakPolarHBondContact O-CB 3.37Å; I250-L253 PolarHBondContact O-N 3.37Å; I250-L253 VanDerWaalsContact O-N 3.14Å; I250-Y254 HydrophobicContact CG2-CD2 3.68Å; I250-Y254 HydrophobicContact CG2-CE2 3.67Å; I250-Y254 WeakPolarHBondContact O-CD2 3.21Å; I250-Y254 PolarHBondContact O-N 2.52Å; I250-F282 HydrophobicContact CG1-CZ 4.37Å
251	A	89.9	Confident	93.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-36.9	176.6	0	0	0	0	0	111.2	R219 F238 L242 Q248 K255	R219-A251 HydrophobicContact CG-CB 4.33Å; F238-A251 HydrophobicContact CD1-CB 4.46Å; L242-A251 HydrophobicContact CD2-CB 4.03Å; L242-A251 HydrophobicContact CG-CB 4.19Å; Q248-A251 HydrophobicContact CB-CB 3.79Å; Q248-A251 PolarHBondContact O-N 3.29Å; A251-K255 WeakPolarHBondContact O-CB 3.25Å; A251-K255 PolarHBondContact O-N 2.86Å
252	M	95	Very high	93.1	Very high	16 Å²	16	45.7 Å²	45.7	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-41.2	174.4	-166	63.9	77	0	0	112.7	L242 Q248 P249 I250 K255 G256 A271 E274 A275 L278	L242-M252 HydrophobicContact CD1-CE 3.79Å; L242-M252 HydrophobicContact CD1-SD 3.89Å; L242-M252 HydrophobicContact CD2-CE 4.07Å; Q248-M252 PolarHBondContact O-N 2.68Å; P249-M252 PolarHBondContact O-N 2.82Å; I250-M252 PolarHBondContact O-N 2.86Å; M252-K255 PolarHBondContact O-N 3.38Å; M252-K255 HydrophobicContact SD-CD 4.27Å; M252-G256 PolarHBondContact O-N 3.03Å; M252-A271 VanDerWaalsContact CG-O 3.27Å; M252-A271 WeakPolarHBondContact CG-O 3.18Å; M252-A271 HydrophobicContact SD-CB 4.38Å; M252-E274 HydrophobicContact CE-CB 4.13Å; M252-E274 VanDerWaalsContact CE-OE2 3.24Å; M252-E274 WeakPolarHBondContact CE-OE2 3.26Å; M252-E274 HydrophobicContact CG-CB 3.91Å; M252-E274 HydrophobicContact SD-CB 4.12Å; M252-A275 HydrophobicContact CB-CB 4Å; M252-A275 HydrophobicContact CG-CB 3.97Å; M252-L278 HydrophobicContact CB-CD1 4.47Å
253	L	93.1	Very high	92.9	Very high	12 Å²	12	45.5 Å²	45.5	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-50.6	173.3	175.2	68.9	0	0	0	110.9	P249 I250 K255 G256 L257 F272 F282 D284 A285	P249-L253 WeakPolarHBondContact O-CB 3.29Å; P249-L253 PolarHBondContact O-N 3.28Å; I250-L253 WeakPolarHBondContact O-CB 3.37Å; I250-L253 PolarHBondContact O-N 3.37Å; I250-L253 VanDerWaalsContact O-N 3.14Å; L253-K255 VanDerWaalsContact C-N 3.34Å; L253-K255 PolarHBondContact O-N 2.99Å; L253-G256 CarbonylContact O-C 2.94Å; L253-G256 WeakPolarHBondContact O-CA 3.48Å; L253-G256 PolarHBondContact O-N 3.33Å; L253-G256 VanDerWaalsContact O-N 3.09Å; L253-L257 HydrophobicContact CG-CD1 4.21Å; L253-L257 WeakPolarHBondContact O-CG 3.45Å; L253-L257 PolarHBondContact O-N 3.37Å; L253-F272 HydrophobicContact CD1-CD1 3.79Å; L253-F272 HydrophobicContact CD1-CE1 3.78Å; L253-F272 WeakPolarHBondContact O-CE1 3.34Å; L253-F282 HydrophobicContact CB-CE1 3.87Å; L253-F282 HydrophobicContact CB-CZ 4.17Å; L253-F282 HydrophobicContact CD2-CE1 3.94Å; L253-F282 HydrophobicContact CD2-CE2 4.06Å; L253-F282 HydrophobicContact CD2-CZ 3.42Å; L253-F282 VanDerWaalsContact CD2-CZ 3.42Å; L253-F282 HydrophobicContact CG-CE1 4.4Å; L253-F282 HydrophobicContact CG-CZ 4.34Å; L253-D284 HydrophobicContact CD2-CB 3.88Å; L253-A285 HydrophobicContact CD1-CB 4.12Å
254	Y	93.6	Very high	92.8	Very high	59 Å²	59	41.5 Å²	41.5	23%	0.231	20%	0.198	C	C	.	.	H	α-helix	trans	-66.4	-34.5	-179.9	-83.1	-80.3	0	0	0	112.9	T223 F226 F238 I250 G256 L257 T258	T223-Y254 HydrophobicContact CG2-CE1 4.36Å; F226-Y254 HydrophobicContact CD1-CD1 4.29Å; F226-Y254 HydrophobicContact CD1-CE1 4.33Å; F226-Y254 HydrophobicContact CE1-CE1 4.48Å; F226-Y254 HydrophobicContact CG-CD1 4.44Å; F238-Y254 HydrophobicContact CE1-CG 4.27Å; F238-Y254 HydrophobicContact CZ-CD1 4.22Å; F238-Y254 AromaticContact CZ-CG 3.9Å; F238-Y254 HydrophobicContact CZ-CG 3.9Å; I250-Y254 HydrophobicContact CG2-CD2 3.68Å; I250-Y254 HydrophobicContact CG2-CE2 3.67Å; I250-Y254 WeakPolarHBondContact O-CD2 3.21Å; I250-Y254 PolarHBondContact O-N 2.52Å; Y254-G256 VanDerWaalsContact C-N 3.33Å; Y254-G256 PolarHBondContact O-N 3.22Å; Y254-L257 HydrophobicContact CD1-CD1 4.2Å; Y254-L257 HydrophobicContact CE1-CD1 4.46Å; Y254-L257 PolarHBondContact O-N 2.93Å; Y254-T258 WeakPolarHBondContact O-CB 3.31Å; Y254-T258 PolarHBondContact O-N 2.85Å; Y254-T258 PolarHBondContact O-OG1 3.16Å
255	K	95.3	Very high	92.8	Very high	30 Å²	30	36.9 Å²	36.9	13%	0.13	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-45.1	168.8	-177	177.8	169.9	-171.6	0	111.3	F238 L242 A251 M252 L253 T258 F259	F238-K255 HydrophobicContact CB-CB 3.97Å; L242-K255 HydrophobicContact CD1-CD 3.72Å; A251-K255 WeakPolarHBondContact O-CB 3.25Å; A251-K255 PolarHBondContact O-N 2.86Å; M252-K255 PolarHBondContact O-N 3.38Å; M252-K255 HydrophobicContact SD-CD 4.27Å; L253-K255 VanDerWaalsContact C-N 3.34Å; L253-K255 PolarHBondContact O-N 2.99Å; K255-T258 WeakPolarHBondContact O-CB 3.43Å; K255-T258 PolarHBondContact O-N 3.39Å; K255-F259 HydrophobicContact CD-CE2 4.43Å; K255-F259 HydrophobicContact CG-CD2 4.26Å; K255-F259 HydrophobicContact CG-CE2 3.89Å; K255-F259 VanDerWaalsContact O-CD2 3.31Å; K255-F259 WeakPolarHBondContact O-CD2 3.5Å; K255-F259 PolarHBondContact O-N 3.06Å
256	G	96.3	Very high	92.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-43.3	174.3	0	0	0	0	0	113.3	M252 L253 Y254 T258 F259 F260 A268 F272	M252-G256 PolarHBondContact O-N 3.03Å; L253-G256 CarbonylContact O-C 2.94Å; L253-G256 WeakPolarHBondContact O-CA 3.48Å; L253-G256 PolarHBondContact O-N 3.33Å; L253-G256 VanDerWaalsContact O-N 3.09Å; Y254-G256 VanDerWaalsContact C-N 3.33Å; Y254-G256 PolarHBondContact O-N 3.22Å; G256-T258 VanDerWaalsContact C-N 3.29Å; G256-T258 PolarHBondContact O-N 3.16Å; G256-F259 PolarHBondContact O-N 2.53Å; G256-F260 WeakPolarHBondContact O-CB 3.39Å; G256-F260 PolarHBondContact O-N 3.45Å; G256-A268 WeakPolarHBondContact O-CB 3.33Å; G256-F272 WeakPolarHBondContact O-CZ 3.47Å
257	L	95.3	Very high	93.1	Very high	31 Å²	31	33.9 Å²	33.9	16%	0.162	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-39.1	174.9	-71.6	171.9	0	0	0	111.3	F226 L253 Y254 F260 H261 F272	F226-L257 HydrophobicContact CE2-CB 3.82Å; F226-L257 HydrophobicContact CZ-CB 3.94Å; L253-L257 HydrophobicContact CG-CD1 4.21Å; L253-L257 WeakPolarHBondContact O-CG 3.45Å; L253-L257 PolarHBondContact O-N 3.37Å; Y254-L257 HydrophobicContact CD1-CD1 4.2Å; Y254-L257 HydrophobicContact CE1-CD1 4.46Å; Y254-L257 PolarHBondContact O-N 2.93Å; L257-F260 WeakPolarHBondContact O-CB 3.49Å; L257-F260 PolarHBondContact O-N 3.34Å; L257-H261 PolarHBondContact O-CD2 3.15Å; L257-H261 PolarHBondContact O-N 2.9Å; L257-F272 HydrophobicContact CD2-CE1 4.22Å; L257-F272 HydrophobicContact CD2-CZ 4Å; L257-F272 HydrophobicContact CG-CE1 4.06Å; L257-F272 HydrophobicContact CG-CZ 4.24Å
258	T	94.3	Very high	93.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-45.8	176.7	-56.7	0	0	0	0	111.1	F226 Y231 A234 M235 Y254 K255 G256 R262	F226-T258 WeakPolarHBondContact CD2-OG1 3.46Å; Y231-T258 HydrophobicContact CD1-CG2 4.35Å; Y231-T258 WeakPolarHBondContact O-CG2 3.18Å; A234-T258 HydrophobicContact CB-CG2 4.26Å; M235-T258 HydrophobicContact CB-CG2 3.76Å; Y254-T258 WeakPolarHBondContact O-CB 3.31Å; Y254-T258 PolarHBondContact O-N 2.85Å; Y254-T258 PolarHBondContact O-OG1 3.16Å; K255-T258 WeakPolarHBondContact O-CB 3.43Å; K255-T258 PolarHBondContact O-N 3.39Å; G256-T258 VanDerWaalsContact C-N 3.29Å; G256-T258 PolarHBondContact O-N 3.16Å; T258-R262 WeakPolarHBondContact O-CG 2.98Å; T258-R262 PolarHBondContact O-N 2.89Å; T258-R262 VanDerWaalsContact O-N 3.17Å
259	F	95.8	Very high	93.7	Very high	27 Å²	27	28 Å²	28	12%	0.118	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-42.7	171.7	-75.3	-54.8	0	0	0	112.6	M235 K255 G256 H261 R262 G263 M264 E267 A268	M235-F259 HydrophobicContact CG-CE1 4.23Å; M235-F259 HydrophobicContact CG-CZ 4.22Å; M235-F259 HydrophobicContact SD-CD1 4.08Å; M235-F259 HydrophobicContact SD-CE1 3.35Å; M235-F259 WeakPolarHBondContact SD-CE1 3.39Å; M235-F259 HydrophobicContact SD-CZ 3.83Å; K255-F259 HydrophobicContact CD-CE2 4.43Å; K255-F259 HydrophobicContact CG-CD2 4.26Å; K255-F259 HydrophobicContact CG-CE2 3.89Å; K255-F259 VanDerWaalsContact O-CD2 3.31Å; K255-F259 WeakPolarHBondContact O-CD2 3.5Å; K255-F259 PolarHBondContact O-N 3.06Å; G256-F259 PolarHBondContact O-N 2.53Å; F259-H261 PolarHBondContact O-N 2.68Å; F259-R262 CarbonylContact O-C 3.58Å; F259-R262 PolarHBondContact O-N 2.98Å; F259-G263 PolarHBondContact O-N 2.98Å; F259-M264 HydrophobicContact CB-CB 4.12Å; F259-M264 HydrophobicContact CD1-CB 3.94Å; F259-M264 HydrophobicContact CD1-CE 3.88Å; F259-M264 HydrophobicContact CD1-CG 4.47Å; F259-M264 HydrophobicContact CD1-SD 3.79Å; F259-M264 HydrophobicContact CE1-CE 3.81Å; F259-M264 HydrophobicContact CE1-SD 4.12Å; F259-M264 HydrophobicContact CG-CB 4.45Å; F259-M264 PolarHBondContact O-N 3.07Å; F259-E267 HydrophobicContact CB-CB 4.24Å; F259-E267 HydrophobicContact CD1-CB 3.82Å; F259-E267 HydrophobicContact CD2-CB 3.89Å; F259-E267 HydrophobicContact CE1-CB 4.06Å; F259-E267 HydrophobicContact CE2-CB 4.1Å; F259-E267 HydrophobicContact CG-CB 3.75Å; F259-E267 HydrophobicContact CZ-CB 4.2Å; F259-A268 HydrophobicContact CB-CB 3.78Å
260	F	95.3	Very high	94	Very high	9 Å²	9	31 Å²	31	4%	0.039	15%	0.145	C	C	.	.	H	α-helix	trans	-59.3	-48.5	179.6	176.5	-94	0	0	0	111.6	G256 L257 R262 G263 L265 A268 F272 Q291 A292 E295	G256-F260 WeakPolarHBondContact O-CB 3.39Å; G256-F260 PolarHBondContact O-N 3.45Å; L257-F260 WeakPolarHBondContact O-CB 3.49Å; L257-F260 PolarHBondContact O-N 3.34Å; F260-R262 VanDerWaalsContact C-N 3.27Å; F260-R262 PolarHBondContact O-N 3.02Å; F260-G263 PolarHBondContact O-N 3.01Å; F260-L265 HydrophobicContact CD2-CD2 3.68Å; F260-L265 HydrophobicContact CE2-CD2 3.92Å; F260-A268 HydrophobicContact CB-CB 3.9Å; F260-F272 HydrophobicContact CB-CE2 4.49Å; F260-F272 HydrophobicContact CB-CZ 4.3Å; F260-Q291 HydrophobicContact CE2-CG 4.07Å; F260-Q291 HydrophobicContact CZ-CG 3.7Å; F260-A292 HydrophobicContact CD2-CB 3.96Å; F260-A292 HydrophobicContact CE2-CB 4.3Å; F260-E295 HydrophobicContact CE2-CB 4.23Å; F260-E295 HydrophobicContact CE2-CG 3.71Å; F260-E295 HydrophobicContact CZ-CG 3.79Å
261	H	90.8	Very high	94.4	Very high	15 Å²	15	29.2 Å²	29.2	7%	0.069	14%	0.137	C	C	.	.	H	α-helix	trans	-67.6	-26	178.8	-76.5	-68.5	0	0	0	113.1	T30 F226 Y231 L257 F259 G263 I574	T30-H261 WeakPolarHBondContact CG2-CE1 3.36Å; T30-H261 WeakPolarHBondContact CG2-NE2 3.31Å; F226-H261 AromaticContact CE2-CD2 3.64Å; F226-H261 AromaticContact CZ-CD2 3.5Å; F226-H261 AromaticContact CZ-NE2 3.84Å; Y231-H261 HydrophobicContact CD1-CB 3.99Å; Y231-H261 HydrophobicContact CD2-CB 4.39Å; Y231-H261 HydrophobicContact CE1-CB 3.62Å; Y231-H261 AromaticContact CE1-CG 4Å; Y231-H261 HydrophobicContact CE2-CB 4.05Å; Y231-H261 HydrophobicContact CG-CB 4.36Å; L257-H261 PolarHBondContact O-CD2 3.15Å; L257-H261 PolarHBondContact O-N 2.9Å; F259-H261 PolarHBondContact O-N 2.68Å; H261-G263 PolarHBondContact O-N 3.11Å; H261-I574 VanDerWaalsContact O-CG1 3.3Å; H261-I574 WeakPolarHBondContact O-CG1 3.47Å
262	R	90.6	Very high	94.8	Very high	44 Å²	44	29.2 Å²	29.2	17%	0.166	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.5	169.8	-68.1	-174.7	68	-158.2	-0.4	114	Y231 T258 F259 F260 M264 Q573 I575	Y231-R262 HydrophobicContact CD2-CG 4.45Å; Y231-R262 HydrophobicContact CG-CG 4.23Å; T258-R262 WeakPolarHBondContact O-CG 2.98Å; T258-R262 PolarHBondContact O-N 2.89Å; T258-R262 VanDerWaalsContact O-N 3.17Å; F259-R262 CarbonylContact O-C 3.58Å; F259-R262 PolarHBondContact O-N 2.98Å; F260-R262 VanDerWaalsContact C-N 3.27Å; F260-R262 PolarHBondContact O-N 3.02Å; R262-M264 VanDerWaalsContact C-N 3.26Å; R262-M264 HydrophobicContact CB-CG 4.28Å; R262-M264 PolarHBondContact O-N 3.02Å; R262-Q573 HydrophobicContact CG-CB 4.48Å; R262-I575 PolarHBondContact O-N 3.45Å
263	G	89.7	Confident	95	Very high	7 Å²	7	32.3 Å²	32.3	7%	0.072	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	9.2	-175.7	0	0	0	0	0	114.4	F259 F260 H261 L265 I575	F259-G263 PolarHBondContact O-N 2.98Å; F260-G263 PolarHBondContact O-N 3.01Å; H261-G263 PolarHBondContact O-N 3.11Å; G263-L265 PolarHBondContact O-N 3.13Å; G263-I575 WeakPolarHBondContact CA-O 3.38Å
264	M	93	Very high	95.1	Very high	42 Å²	42	35.8 Å²	35.8	21%	0.207	17%	0.166	C	C	.	.			trans	-82.1	67.2	174.7	-64	-179.1	65.3	0	0	109.7	F259 R262 K266 E267 A268	F259-M264 HydrophobicContact CB-CB 4.12Å; F259-M264 HydrophobicContact CD1-CB 3.94Å; F259-M264 HydrophobicContact CD1-CE 3.88Å; F259-M264 HydrophobicContact CD1-CG 4.47Å; F259-M264 HydrophobicContact CD1-SD 3.79Å; F259-M264 HydrophobicContact CE1-CE 3.81Å; F259-M264 HydrophobicContact CE1-SD 4.12Å; F259-M264 HydrophobicContact CG-CB 4.45Å; F259-M264 PolarHBondContact O-N 3.07Å; R262-M264 VanDerWaalsContact C-N 3.26Å; R262-M264 HydrophobicContact CB-CG 4.28Å; R262-M264 PolarHBondContact O-N 3.02Å; M264-K266 VanDerWaalsContact C-N 3.34Å; M264-K266 PolarHBondContact O-N 3.15Å; M264-E267 HydrophobicContact CB-CB 4.35Å; M264-E267 HydrophobicContact CE-CB 4.49Å; M264-E267 HydrophobicContact CE-CG 3.91Å; M264-E267 WeakPolarHBondContact CE-OE1 3.46Å; M264-E267 PolarHBondContact O-N 2.81Å; M264-A268 WeakPolarHBondContact O-CB 3.27Å; M264-A268 PolarHBondContact O-N 3.41Å
265	L	93.6	Very high	95.2	Very high	6 Å²	6	33 Å²	33	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-31.1	-166.7	-59.3	-176.8	0	0	0	113.9	F260 G263 A268 I269 E295 L296 I577	F260-L265 HydrophobicContact CD2-CD2 3.68Å; F260-L265 HydrophobicContact CE2-CD2 3.92Å; G263-L265 PolarHBondContact O-N 3.13Å; L265-A268 PolarHBondContact O-N 2.51Å; L265-I269 WeakPolarHBondContact O-CB 3.02Å; L265-I269 WeakPolarHBondContact O-CD1 3.36Å; L265-I269 WeakPolarHBondContact O-CG1 3.38Å; L265-I269 PolarHBondContact O-N 2.87Å; L265-E295 HydrophobicContact CD1-CB 3.51Å; L265-E295 WeakPolarHBondContact CD1-O 3.26Å; L265-E295 HydrophobicContact CD2-CB 4.02Å; L265-E295 HydrophobicContact CG-CB 4.44Å; L265-L296 HydrophobicContact CB-CD1 4.46Å; L265-L296 HydrophobicContact CD1-CB 4.36Å; L265-I577 HydrophobicContact CB-CD1 3.99Å; L265-I577 HydrophobicContact CD1-CB 4.43Å; L265-I577 HydrophobicContact CD1-CD1 3.84Å; L265-I577 HydrophobicContact CD1-CG2 3.86Å; L265-I577 HydrophobicContact CG-CD1 4.03Å
266	K	94.8	Very high	95.3	Very high	132 Å²	132	32.5 Å²	32.5	57%	0.574	15%	0.154	S	C	*	.	H	α-helix	trans	-69.9	-46.9	-179.4	-67.2	-179.8	-177.9	173.4	0	110.4	M264 A268 I269 D270	M264-K266 VanDerWaalsContact C-N 3.34Å; M264-K266 PolarHBondContact O-N 3.15Å; K266-A268 VanDerWaalsContact C-N 3.29Å; K266-A268 PolarHBondContact O-N 2.89Å; K266-I269 WeakPolarHBondContact O-CB 3.46Å; K266-I269 PolarHBondContact O-N 3.04Å; K266-D270 PolarHBondContact O-N 3.49Å
267	E	96.3	Very high	95.3	Very high	80 Å²	80	40.6 Å²	40.6	37%	0.374	19%	0.189	S	C	.	.	H	α-helix	trans	-62.3	-38.5	175.6	-61.3	87.5	159.1	0	0	111	F259 M264 D270 A271	F259-E267 HydrophobicContact CB-CB 4.24Å; F259-E267 HydrophobicContact CD1-CB 3.82Å; F259-E267 HydrophobicContact CD2-CB 3.89Å; F259-E267 HydrophobicContact CE1-CB 4.06Å; F259-E267 HydrophobicContact CE2-CB 4.1Å; F259-E267 HydrophobicContact CG-CB 3.75Å; F259-E267 HydrophobicContact CZ-CB 4.2Å; M264-E267 HydrophobicContact CB-CB 4.35Å; M264-E267 HydrophobicContact CE-CB 4.49Å; M264-E267 HydrophobicContact CE-CG 3.91Å; M264-E267 WeakPolarHBondContact CE-OE1 3.46Å; M264-E267 PolarHBondContact O-N 2.81Å; E267-D270 PolarHBondContact O-N 2.79Å; E267-A271 WeakPolarHBondContact O-CB 3.42Å; E267-A271 PolarHBondContact O-N 3.36Å
268	A	97	Very high	95.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-47.8	172.8	0	0	0	0	0	112.2	G256 F259 F260 M264 L265 K266 D270 A271 F272	G256-A268 WeakPolarHBondContact O-CB 3.33Å; F259-A268 HydrophobicContact CB-CB 3.78Å; F260-A268 HydrophobicContact CB-CB 3.9Å; M264-A268 WeakPolarHBondContact O-CB 3.27Å; M264-A268 PolarHBondContact O-N 3.41Å; L265-A268 PolarHBondContact O-N 2.51Å; K266-A268 VanDerWaalsContact C-N 3.29Å; K266-A268 PolarHBondContact O-N 2.89Å; A268-D270 VanDerWaalsContact C-N 3.32Å; A268-D270 PolarHBondContact O-N 2.8Å; A268-A271 PolarHBondContact O-N 3.04Å; A268-F272 HydrophobicContact CB-CE2 3.98Å; A268-F272 HydrophobicContact CB-CZ 4.49Å; A268-F272 WeakPolarHBondContact O-CD2 3.46Å; A268-F272 VanDerWaalsContact O-CG 3.23Å; A268-F272 WeakPolarHBondContact O-CG 3.22Å; A268-F272 PolarHBondContact O-N 2.7Å
269	I	98.1	Very high	95.3	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-58.2	-44.9	177.6	-75.3	162.8	0	0	0	110.9	L265 K266 F272 K273 L289 A292 Y293 L296	L265-I269 WeakPolarHBondContact O-CB 3.02Å; L265-I269 WeakPolarHBondContact O-CD1 3.36Å; L265-I269 WeakPolarHBondContact O-CG1 3.38Å; L265-I269 PolarHBondContact O-N 2.87Å; K266-I269 WeakPolarHBondContact O-CB 3.46Å; K266-I269 PolarHBondContact O-N 3.04Å; I269-F272 PolarHBondContact O-N 3.46Å; I269-K273 HydrophobicContact CG2-CD 4.12Å; I269-K273 WeakPolarHBondContact O-CG 3.5Å; I269-K273 PolarHBondContact O-N 3.44Å; I269-L289 HydrophobicContact CB-CD1 4.21Å; I269-L289 HydrophobicContact CG1-CD1 4.14Å; I269-L289 HydrophobicContact CG2-CD1 3.86Å; I269-A292 HydrophobicContact CD1-CB 4.33Å; I269-A292 HydrophobicContact CG1-CB 3.67Å; I269-Y293 HydrophobicContact CD1-CD1 3.8Å; I269-Y293 HydrophobicContact CD1-CE1 3.79Å; I269-Y293 HydrophobicContact CD1-CG 4.41Å; I269-Y293 HydrophobicContact CG1-CE1 4.41Å; I269-Y293 HydrophobicContact CG2-CE1 4.26Å; I269-Y293 HydrophobicContact CG2-CE2 4.48Å; I269-L296 HydrophobicContact CD1-CD2 3.86Å
270	D	97.8	Very high	95.2	Very high	90 Å²	90	47.8 Å²	47.8	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-64.6	-44.9	179.7	-70.2	-22.7	0	0	0	111.1	K266 E267 A268 F272 K273 E274	K266-D270 PolarHBondContact O-N 3.49Å; E267-D270 PolarHBondContact O-N 2.79Å; A268-D270 VanDerWaalsContact C-N 3.32Å; A268-D270 PolarHBondContact O-N 2.8Å; D270-F272 PolarHBondContact O-N 3.04Å; D270-K273 PolarHBondContact O-N 3.45Å; D270-E274 WeakPolarHBondContact O-CG 3.36Å; D270-E274 PolarHBondContact O-N 3.21Å
271	A	97.4	Very high	95.1	Very high	5 Å²	5	51.6 Å²	51.6	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-43	175.2	0	0	0	0	0	112.5	M252 E267 A268 K273 E274 A275	M252-A271 VanDerWaalsContact CG-O 3.27Å; M252-A271 WeakPolarHBondContact CG-O 3.18Å; M252-A271 HydrophobicContact SD-CB 4.38Å; E267-A271 WeakPolarHBondContact O-CB 3.42Å; E267-A271 PolarHBondContact O-N 3.36Å; A268-A271 PolarHBondContact O-N 3.04Å; A271-K273 VanDerWaalsContact C-N 3.35Å; A271-K273 PolarHBondContact O-N 3.39Å; A271-E274 PolarHBondContact O-N 2.88Å; A271-A275 PolarHBondContact O-N 3.35Å
272	F	98.1	Very high	95.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-38.4	176.3	-62.8	-39.8	0	0	0	112.5	L253 G256 L257 F260 A268 I269 D270 E274 A275 L276 L289 A292	L253-F272 HydrophobicContact CD1-CD1 3.79Å; L253-F272 HydrophobicContact CD1-CE1 3.78Å; L253-F272 WeakPolarHBondContact O-CE1 3.34Å; G256-F272 WeakPolarHBondContact O-CZ 3.47Å; L257-F272 HydrophobicContact CD2-CE1 4.22Å; L257-F272 HydrophobicContact CD2-CZ 4Å; L257-F272 HydrophobicContact CG-CE1 4.06Å; L257-F272 HydrophobicContact CG-CZ 4.24Å; F260-F272 HydrophobicContact CB-CE2 4.49Å; F260-F272 HydrophobicContact CB-CZ 4.3Å; A268-F272 HydrophobicContact CB-CE2 3.98Å; A268-F272 HydrophobicContact CB-CZ 4.49Å; A268-F272 WeakPolarHBondContact O-CD2 3.46Å; A268-F272 VanDerWaalsContact O-CG 3.23Å; A268-F272 WeakPolarHBondContact O-CG 3.22Å; A268-F272 PolarHBondContact O-N 2.7Å; I269-F272 PolarHBondContact O-N 3.46Å; D270-F272 PolarHBondContact O-N 3.04Å; F272-E274 VanDerWaalsContact C-N 3.33Å; F272-A275 WeakPolarHBondContact O-CB 3.37Å; F272-A275 PolarHBondContact O-N 3.49Å; F272-L276 WeakPolarHBondContact O-CG 3.29Å; F272-L276 PolarHBondContact O-N 2.92Å; F272-L289 HydrophobicContact CB-CB 4.06Å; F272-L289 HydrophobicContact CB-CD1 4.14Å; F272-L289 HydrophobicContact CD2-CB 4.38Å; F272-A292 HydrophobicContact CD2-CB 4.3Å; F272-A292 HydrophobicContact CE2-CB 4.06Å
273	K	98.3	Very high	95.3	Very high	81 Å²	81	51 Å²	51	35%	0.352	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.2	-75.1	173.1	179	171.9	0	111.8	I269 D270 A271 L276 K277 L289 Y293	I269-K273 HydrophobicContact CG2-CD 4.12Å; I269-K273 WeakPolarHBondContact O-CG 3.5Å; I269-K273 PolarHBondContact O-N 3.44Å; D270-K273 PolarHBondContact O-N 3.45Å; A271-K273 VanDerWaalsContact C-N 3.35Å; A271-K273 PolarHBondContact O-N 3.39Å; K273-L276 PolarHBondContact O-N 2.02Å; K273-K277 WeakPolarHBondContact O-CG 3.37Å; K273-K277 PolarHBondContact O-N 3.41Å; K273-L289 HydrophobicContact CG-CD1 4.28Å; K273-L289 HydrophobicContact CG-CD2 4.32Å; K273-Y293 WeakPolarHBondContact CE-OH 3.07Å; K273-Y293 PolarHBondContact NZ-OH 2.91Å
274	E	96.8	Very high	95.3	Very high	85 Å²	85	53.2 Å²	53.2	40%	0.397	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-42.5	173.5	-72.8	-175.5	175.5	0	0	111.9	M252 D270 A271 F272 L276 K277 L278	M252-E274 HydrophobicContact CE-CB 4.13Å; M252-E274 VanDerWaalsContact CE-OE2 3.24Å; M252-E274 WeakPolarHBondContact CE-OE2 3.26Å; M252-E274 HydrophobicContact CG-CB 3.91Å; M252-E274 HydrophobicContact SD-CB 4.12Å; D270-E274 WeakPolarHBondContact O-CG 3.36Å; D270-E274 PolarHBondContact O-N 3.21Å; A271-E274 PolarHBondContact O-N 2.88Å; F272-E274 VanDerWaalsContact C-N 3.33Å; E274-L276 VanDerWaalsContact C-N 3.26Å; E274-L276 PolarHBondContact O-N 2.95Å; E274-K277 WeakPolarHBondContact O-CB 3.38Å; E274-K277 PolarHBondContact O-N 3.3Å; E274-K277 VanDerWaalsContact O-N 3.08Å; E274-L278 WeakPolarHBondContact O-CG 3.21Å; E274-L278 PolarHBondContact O-N 3.07Å; E274-L278 VanDerWaalsContact O-N 3.12Å
275	A	95.5	Very high	95.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-41.2	173.7	0	0	0	0	0	111.5	M252 A271 F272 K277 L278 K279 F282 A285	M252-A275 HydrophobicContact CB-CB 4Å; M252-A275 HydrophobicContact CG-CB 3.97Å; A271-A275 PolarHBondContact O-N 3.35Å; F272-A275 WeakPolarHBondContact O-CB 3.37Å; F272-A275 PolarHBondContact O-N 3.49Å; A275-K277 PolarHBondContact O-N 3.21Å; A275-L278 PolarHBondContact O-N 3Å; A275-K279 PolarHBondContact O-N 3.42Å; A275-F282 HydrophobicContact CB-CD1 4.44Å; A275-A285 HydrophobicContact CB-CB 4.29Å
276	L	96.4	Very high	95.6	Very high	20 Å²	20	53 Å²	53	11%	0.105	26%	0.261	C	S	.	.	H	α-helix	trans	-69.9	-26.4	176.4	-72.3	167.2	0	0	0	114.1	F272 K273 E274 L278 K279 S280 F282 A285 Y286 L289	F272-L276 WeakPolarHBondContact O-CG 3.29Å; F272-L276 PolarHBondContact O-N 2.92Å; K273-L276 PolarHBondContact O-N 2.02Å; E274-L276 VanDerWaalsContact C-N 3.26Å; E274-L276 PolarHBondContact O-N 2.95Å; L276-L278 VanDerWaalsContact C-N 3.35Å; L276-K279 WeakPolarHBondContact CA-O 3.29Å; L276-K279 CarbonylContact O-C 3.57Å; L276-K279 VanDerWaalsContact O-C 3.31Å; L276-S280 WeakPolarHBondContact O-CA 3.12Å; L276-S280 PolarHBondContact O-N 3.13Å; L276-F282 HydrophobicContact CD2-CB 4.16Å; L276-A285 HydrophobicContact CD1-CB 4.45Å; L276-A285 HydrophobicContact CD2-CB 3.76Å; L276-A285 HydrophobicContact CG-CB 3.75Å; L276-Y286 HydrophobicContact CD1-CD1 3.65Å; L276-Y286 HydrophobicContact CD1-CE1 3.56Å; L276-Y286 HydrophobicContact CD1-CG 4.23Å; L276-Y286 HydrophobicContact CD2-CD1 4.05Å; L276-Y286 HydrophobicContact CD2-CD2 3.64Å; L276-Y286 HydrophobicContact CD2-CE1 3.91Å; L276-Y286 HydrophobicContact CD2-CE2 3.53Å; L276-Y286 HydrophobicContact CD2-CG 3.9Å; L276-Y286 HydrophobicContact CG-CE1 4.35Å; L276-L289 HydrophobicContact CD1-CD2 3.8Å
277	K	96.9	Very high	95.6	Very high	170 Å²	170	47.5 Å²	47.5	74%	0.739	24%	0.237	S	C	*	.	H	α-helix	trans	-70.3	-34.6	170.8	-71.7	172.1	-173.3	171.4	0	111.5	K273 E274 A275	K273-K277 WeakPolarHBondContact O-CG 3.37Å; K273-K277 PolarHBondContact O-N 3.41Å; E274-K277 WeakPolarHBondContact O-CB 3.38Å; E274-K277 PolarHBondContact O-N 3.3Å; E274-K277 VanDerWaalsContact O-N 3.08Å; A275-K277 PolarHBondContact O-N 3.21Å
278	L	93.7	Very high	95.6	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.366	22%	0.222	S	C	.	.	H	α-helix	trans	-76.5	-39	177.3	-63.2	176.3	0	0	0	111.8	P249 M252 E274 A275 L276	P249-L278 HydrophobicContact CB-CB 4.03Å; M252-L278 HydrophobicContact CB-CD1 4.47Å; E274-L278 WeakPolarHBondContact O-CG 3.21Å; E274-L278 PolarHBondContact O-N 3.07Å; E274-L278 VanDerWaalsContact O-N 3.12Å; A275-L278 PolarHBondContact O-N 3Å; L276-L278 VanDerWaalsContact C-N 3.35Å
279	K	94.8	Very high	95.7	Very high	50 Å²	50	44.5 Å²	44.5	22%	0.217	22%	0.224	C	C	.	.			trans	-137.1	105.1	177.3	-176.5	176.8	179.2	169.7	0	110.2	Y52 P249 A275 L276 D281 F282	Y52-K279 PolarHBondContact OH-NZ 2.9Å; P249-K279 HydrophobicContact CB-CB 3.88Å; P249-K279 HydrophobicContact CG-CB 4.17Å; A275-K279 PolarHBondContact O-N 3.42Å; L276-K279 WeakPolarHBondContact CA-O 3.29Å; L276-K279 CarbonylContact O-C 3.57Å; L276-K279 VanDerWaalsContact O-C 3.31Å; K279-D281 WeakPolarHBondContact CE-OD1 3.32Å; K279-D281 WeakPolarHBondContact CG-OD1 3.33Å; K279-D281 PolarHBondContact O-N 3.13Å; K279-F282 HydrophobicContact CB-CB 4.15Å; K279-F282 HydrophobicContact CB-CD1 4.41Å; K279-F282 HydrophobicContact CD-CB 4.09Å; K279-F282 HydrophobicContact CD-CD1 4.48Å; K279-F282 HydrophobicContact CD-CD2 4.47Å; K279-F282 HydrophobicContact CD-CG 4.14Å; K279-F282 HydrophobicContact CG-CB 3.95Å; K279-F282 HydrophobicContact CG-CG 4.47Å; K279-F282 WeakPolarHBondContact O-CB 3.45Å
280	S	94.1	Very high	95.6	Very high	89 Å²	89	44.1 Å²	44.1	62%	0.622	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-25.7	-173.5	54.1	0	0	0	0	114.5	L276 F282 Y286	L276-S280 WeakPolarHBondContact O-CA 3.12Å; L276-S280 PolarHBondContact O-N 3.13Å; S280-F282 VanDerWaalsContact C-N 3.3Å; S280-F282 PolarHBondContact O-N 3.42Å; S280-Y286 WeakPolarHBondContact O-CE2 3.45Å
281	D	94.1	Very high	95.5	Very high	90 Å²	90	40.9 Å²	40.9	48%	0.481	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	27.8	179.2	63.1	-21.3	0	0	0	112.2	K279 I283 L312	K279-D281 WeakPolarHBondContact CE-OD1 3.32Å; K279-D281 WeakPolarHBondContact CG-OD1 3.33Å; K279-D281 PolarHBondContact O-N 3.13Å; D281-I283 PolarHBondContact O-N 2.74Å; D281-L312 HydrophobicContact CB-CD2 4.25Å
282	F	92.7	Very high	95.5	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.026	20%	0.202	C	C	.	.			trans	-88.3	91.5	-175.8	-158.7	-178.7	0	0	0	112.4	P249 I250 L253 A275 L276 K279 S280 D284 A285 Y286	P249-F282 HydrophobicContact CB-CD1 4.25Å; P249-F282 HydrophobicContact CB-CE1 4.11Å; I250-F282 HydrophobicContact CG1-CZ 4.37Å; L253-F282 HydrophobicContact CB-CE1 3.87Å; L253-F282 HydrophobicContact CB-CZ 4.17Å; L253-F282 HydrophobicContact CD2-CE1 3.94Å; L253-F282 HydrophobicContact CD2-CE2 4.06Å; L253-F282 HydrophobicContact CD2-CZ 3.42Å; L253-F282 VanDerWaalsContact CD2-CZ 3.42Å; L253-F282 HydrophobicContact CG-CE1 4.4Å; L253-F282 HydrophobicContact CG-CZ 4.34Å; A275-F282 HydrophobicContact CB-CD1 4.44Å; L276-F282 HydrophobicContact CD2-CB 4.16Å; K279-F282 HydrophobicContact CB-CB 4.15Å; K279-F282 HydrophobicContact CB-CD1 4.41Å; K279-F282 HydrophobicContact CD-CB 4.09Å; K279-F282 HydrophobicContact CD-CD1 4.48Å; K279-F282 HydrophobicContact CD-CD2 4.47Å; K279-F282 HydrophobicContact CD-CG 4.14Å; K279-F282 HydrophobicContact CG-CB 3.95Å; K279-F282 HydrophobicContact CG-CG 4.47Å; K279-F282 WeakPolarHBondContact O-CB 3.45Å; S280-F282 VanDerWaalsContact C-N 3.3Å; S280-F282 PolarHBondContact O-N 3.42Å; F282-D284 VanDerWaalsContact C-N 3.33Å; F282-D284 HydrophobicContact CD2-CB 4.24Å; F282-D284 HydrophobicContact CE2-CB 3.93Å; F282-D284 PolarHBondContact O-N 3.2Å; F282-A285 HydrophobicContact CB-CB 3.99Å; F282-A285 HydrophobicContact CD1-CB 3.71Å; F282-A285 HydrophobicContact CE1-CB 4.4Å; F282-A285 HydrophobicContact CG-CB 3.86Å; F282-A285 PolarHBondContact O-N 3.46Å; F282-A285 VanDerWaalsContact O-N 3.15Å; F282-Y286 PolarHBondContact O-N 3.47Å; F282-Y286 VanDerWaalsContact O-N 3.15Å
283	I	93.2	Very high	95.4	Very high	39 Å²	39	42 Å²	42	20%	0.2	21%	0.208	C	C	.	.	H	α-helix	trans	-54.9	-45.5	-177.4	-63.5	165.6	0	0	0	112	D281 A285 Y286 K287 A309 L312 N313	D281-I283 PolarHBondContact O-N 2.74Å; I283-A285 VanDerWaalsContact C-N 3.31Å; I283-A285 PolarHBondContact O-N 3.34Å; I283-Y286 PolarHBondContact O-N 2.91Å; I283-K287 WeakPolarHBondContact O-CB 3.31Å; I283-K287 PolarHBondContact O-N 3.4Å; I283-A309 HydrophobicContact CG2-CB 4.27Å; I283-L312 HydrophobicContact CD1-CB 4.15Å; I283-L312 HydrophobicContact CG1-CB 3.72Å; I283-L312 HydrophobicContact CG1-CD1 3.88Å; I283-L312 HydrophobicContact CG1-CG 4.48Å; I283-N313 HydrophobicContact CD1-CB 3.57Å
284	D	89.7	Confident	95.2	Very high	55 Å²	55	39.1 Å²	39.1	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-64.3	-34.3	-179.5	-73.7	-53.5	0	0	0	113.6	L253 F282 K287 S288	L253-D284 HydrophobicContact CD2-CB 3.88Å; F282-D284 VanDerWaalsContact C-N 3.33Å; F282-D284 HydrophobicContact CD2-CB 4.24Å; F282-D284 HydrophobicContact CE2-CB 3.93Å; F282-D284 PolarHBondContact O-N 3.2Å; D284-K287 IonicContact OD1-NZ 3.33Å; D284-K287 PolarHBondContact OD1-NZ 2.92Å; D284-S288 VanDerWaalsContact O-CB 3.28Å; D284-S288 WeakPolarHBondContact O-CB 3.36Å; D284-S288 PolarHBondContact O-N 3.17Å; D284-S288 PolarHBondContact O-OG 2.98Å
285	A	93.2	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-69.4	-40.7	175.1	0	0	0	0	0	111.2	L253 A275 L276 F282 I283 S288 L289	L253-A285 HydrophobicContact CD1-CB 4.12Å; A275-A285 HydrophobicContact CB-CB 4.29Å; L276-A285 HydrophobicContact CD1-CB 4.45Å; L276-A285 HydrophobicContact CD2-CB 3.76Å; L276-A285 HydrophobicContact CG-CB 3.75Å; F282-A285 HydrophobicContact CB-CB 3.99Å; F282-A285 HydrophobicContact CD1-CB 3.71Å; F282-A285 HydrophobicContact CE1-CB 4.4Å; F282-A285 HydrophobicContact CG-CB 3.86Å; F282-A285 PolarHBondContact O-N 3.46Å; F282-A285 VanDerWaalsContact O-N 3.15Å; I283-A285 VanDerWaalsContact C-N 3.31Å; I283-A285 PolarHBondContact O-N 3.34Å; A285-S288 PolarHBondContact O-N 2.89Å; A285-L289 WeakPolarHBondContact O-CB 3.26Å; A285-L289 PolarHBondContact O-N 2.84Å
286	Y	97.8	Very high	94.8	Very high	42 Å²	42	38.1 Å²	38.1	17%	0.165	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-42.3	172.7	-80.2	-57.6	0	0	0	112.9	L276 S280 F282 I283 L289 G290 K308 L312	L276-Y286 HydrophobicContact CD1-CD1 3.65Å; L276-Y286 HydrophobicContact CD1-CE1 3.56Å; L276-Y286 HydrophobicContact CD1-CG 4.23Å; L276-Y286 HydrophobicContact CD2-CD1 4.05Å; L276-Y286 HydrophobicContact CD2-CD2 3.64Å; L276-Y286 HydrophobicContact CD2-CE1 3.91Å; L276-Y286 HydrophobicContact CD2-CE2 3.53Å; L276-Y286 HydrophobicContact CD2-CG 3.9Å; L276-Y286 HydrophobicContact CG-CE1 4.35Å; S280-Y286 WeakPolarHBondContact O-CE2 3.45Å; F282-Y286 PolarHBondContact O-N 3.47Å; F282-Y286 VanDerWaalsContact O-N 3.15Å; I283-Y286 PolarHBondContact O-N 2.91Å; Y286-L289 PolarHBondContact O-N 3.36Å; Y286-G290 PolarHBondContact O-N 3.25Å; Y286-K308 HydrophobicContact CD1-CB 3.89Å; Y286-K308 HydrophobicContact CD1-CD 4.15Å; Y286-K308 HydrophobicContact CD2-CB 4.34Å; Y286-K308 HydrophobicContact CE1-CB 3.96Å; Y286-K308 HydrophobicContact CE1-CD 3.57Å; Y286-K308 HydrophobicContact CE1-CG 4.38Å; Y286-K308 HydrophobicContact CE2-CB 4.36Å; Y286-K308 HydrophobicContact CG-CB 4.11Å; Y286-L312 HydrophobicContact CD2-CD1 3.72Å; Y286-L312 HydrophobicContact CE2-CD1 3.82Å
287	K	96.1	Very high	94.6	Very high	18 Å²	18	37.9 Å²	37.9	8%	0.078	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-51.7	174.1	178.2	-164.4	69	-158.1	0	110.7	I283 D284 G290 Q291 F306 Q318 L322	I283-K287 WeakPolarHBondContact O-CB 3.31Å; I283-K287 PolarHBondContact O-N 3.4Å; D284-K287 IonicContact OD1-NZ 3.33Å; D284-K287 PolarHBondContact OD1-NZ 2.92Å; K287-G290 PolarHBondContact O-N 3.06Å; K287-Q291 PolarHBondContact O-N 2.91Å; K287-F306 WeakPolarHBondContact O-CE1 3.36Å; K287-Q318 HydrophobicContact CD-CB 3.89Å; K287-L322 HydrophobicContact CD-CD1 4.42Å; K287-L322 HydrophobicContact CG-CD1 3.76Å
288	S	96.5	Very high	94.5	Very high	8 Å²	8	32.3 Å²	32.3	6%	0.056	17%	0.171	C	C	.	.	H	α-helix	trans	-67.5	-38	-177.1	-52.8	0	0	0	0	111.9	D284 A285 Q291 A292	D284-S288 VanDerWaalsContact O-CB 3.28Å; D284-S288 WeakPolarHBondContact O-CB 3.36Å; D284-S288 PolarHBondContact O-N 3.17Å; D284-S288 PolarHBondContact O-OG 2.98Å; A285-S288 PolarHBondContact O-N 2.89Å; S288-Q291 PolarHBondContact O-N 3.24Å; S288-A292 WeakPolarHBondContact O-CB 3.49Å; S288-A292 PolarHBondContact O-N 3.47Å
289	L	97.8	Very high	94.5	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.047	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-46.1	172.5	-178.7	62.4	0	0	0	111.6	I269 F272 K273 L276 A285 Y286 Q291 A292 Y293	I269-L289 HydrophobicContact CB-CD1 4.21Å; I269-L289 HydrophobicContact CG1-CD1 4.14Å; I269-L289 HydrophobicContact CG2-CD1 3.86Å; F272-L289 HydrophobicContact CB-CB 4.06Å; F272-L289 HydrophobicContact CB-CD1 4.14Å; F272-L289 HydrophobicContact CD2-CB 4.38Å; K273-L289 HydrophobicContact CG-CD1 4.28Å; K273-L289 HydrophobicContact CG-CD2 4.32Å; L276-L289 HydrophobicContact CD1-CD2 3.8Å; A285-L289 WeakPolarHBondContact O-CB 3.26Å; A285-L289 PolarHBondContact O-N 2.84Å; Y286-L289 PolarHBondContact O-N 3.36Å; L289-Q291 VanDerWaalsContact C-N 3.31Å; L289-Q291 PolarHBondContact O-N 2.96Å; L289-A292 PolarHBondContact O-N 3.49Å; L289-Y293 HydrophobicContact CD1-CD2 3.91Å; L289-Y293 HydrophobicContact CD1-CE2 3.43Å; L289-Y293 VanDerWaalsContact CD1-CE2 3.43Å; L289-Y293 HydrophobicContact CD2-CE2 4.16Å; L289-Y293 HydrophobicContact CG-CD2 3.86Å; L289-Y293 HydrophobicContact CG-CE2 3.6Å; L289-Y293 WeakPolarHBondContact O-CD2 3.23Å; L289-Y293 PolarHBondContact O-N 3.42Å
290	G	97.1	Very high	94.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-39.1	176.5	0	0	0	0	0	112.7	Y286 K287 Y293 R294 A302 S305	Y286-G290 PolarHBondContact O-N 3.25Å; K287-G290 PolarHBondContact O-N 3.06Å; G290-Y293 PolarHBondContact O-N 2.99Å; G290-R294 PolarHBondContact O-N 3.25Å; G290-A302 WeakPolarHBondContact O-CB 3.36Å; G290-S305 VanDerWaalsContact CA-CB 3.47Å
291	Q	95.6	Very high	94.7	Very high	22 Å²	22	31.3 Å²	31.3	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-67.1	-40.8	175.4	-171.2	173.6	-23.7	0	0	112.2	F260 K287 S288 L289 Y293 R294 E295	F260-Q291 HydrophobicContact CE2-CG 4.07Å; F260-Q291 HydrophobicContact CZ-CG 3.7Å; K287-Q291 PolarHBondContact O-N 2.91Å; S288-Q291 PolarHBondContact O-N 3.24Å; L289-Q291 VanDerWaalsContact C-N 3.31Å; L289-Q291 PolarHBondContact O-N 2.96Å; Q291-Y293 VanDerWaalsContact C-N 3.34Å; Q291-Y293 PolarHBondContact O-N 3.1Å; Q291-R294 WeakPolarHBondContact O-CB 3.28Å; Q291-R294 PolarHBondContact O-N 3.33Å; Q291-E295 PolarHBondContact O-N 3.26Å
292	A	96.3	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-40.6	174.5	0	0	0	0	0	112.2	F260 I269 F272 S288 L289 E295 L296	F260-A292 HydrophobicContact CD2-CB 3.96Å; F260-A292 HydrophobicContact CE2-CB 4.3Å; I269-A292 HydrophobicContact CD1-CB 4.33Å; I269-A292 HydrophobicContact CG1-CB 3.67Å; F272-A292 HydrophobicContact CD2-CB 4.3Å; F272-A292 HydrophobicContact CE2-CB 4.06Å; S288-A292 WeakPolarHBondContact O-CB 3.49Å; S288-A292 PolarHBondContact O-N 3.47Å; L289-A292 PolarHBondContact O-N 3.49Å; A292-E295 PolarHBondContact O-N 2.79Å; A292-L296 WeakPolarHBondContact O-CB 3.3Å; A292-L296 PolarHBondContact O-N 3.37Å
293	Y	97.1	Very high	95.1	Very high	28 Å²	28	28 Å²	28	11%	0.11	14%	0.14	C	C	.	.	H	α-helix	trans	-65.2	-38.5	172.6	-78.6	-57.8	0	0	0	113	I269 K273 L289 G290 Q291 L296 G297 D298	I269-Y293 HydrophobicContact CD1-CD1 3.8Å; I269-Y293 HydrophobicContact CD1-CE1 3.79Å; I269-Y293 HydrophobicContact CD1-CG 4.41Å; I269-Y293 HydrophobicContact CG1-CE1 4.41Å; I269-Y293 HydrophobicContact CG2-CE1 4.26Å; I269-Y293 HydrophobicContact CG2-CE2 4.48Å; K273-Y293 WeakPolarHBondContact CE-OH 3.07Å; K273-Y293 PolarHBondContact NZ-OH 2.91Å; L289-Y293 HydrophobicContact CD1-CD2 3.91Å; L289-Y293 HydrophobicContact CD1-CE2 3.43Å; L289-Y293 VanDerWaalsContact CD1-CE2 3.43Å; L289-Y293 HydrophobicContact CD2-CE2 4.16Å; L289-Y293 HydrophobicContact CG-CD2 3.86Å; L289-Y293 HydrophobicContact CG-CE2 3.6Å; L289-Y293 WeakPolarHBondContact O-CD2 3.23Å; L289-Y293 PolarHBondContact O-N 3.42Å; G290-Y293 PolarHBondContact O-N 2.99Å; Q291-Y293 VanDerWaalsContact C-N 3.34Å; Q291-Y293 PolarHBondContact O-N 3.1Å; Y293-L296 HydrophobicContact CD1-CD2 4.31Å; Y293-L296 CarbonylContact O-C 3.48Å; Y293-L296 WeakPolarHBondContact O-CB 3.45Å; Y293-L296 PolarHBondContact O-N 2.98Å; Y293-G297 PolarHBondContact O-N 3.4Å; Y293-D298 HydrophobicContact CD1-CB 3.95Å; Y293-D298 PolarHBondContact O-N 3.48Å
294	R	94.2	Very high	95.4	Very high	21 Å²	21	31 Å²	31	8%	0.079	15%	0.154	C	C	.	.	H	α-helix	trans	-58	-50.2	172.2	169.7	177.2	174	-81.3	-5.8	111.2	E26 G290 Q291 L296 G297 A302 M326	E26-R294 IonicContact OE2-NH2 3.2Å; G290-R294 PolarHBondContact O-N 3.25Å; Q291-R294 WeakPolarHBondContact O-CB 3.28Å; Q291-R294 PolarHBondContact O-N 3.33Å; R294-L296 PolarHBondContact O-N 2.94Å; R294-G297 PolarHBondContact O-N 2.97Å; R294-A302 HydrophobicContact CB-CB 4.39Å; R294-M326 HydrophobicContact CB-CE 4.19Å; R294-M326 HydrophobicContact CB-SD 3.73Å; R294-M326 HydrophobicContact CG-CE 4.36Å; R294-M326 HydrophobicContact CG-SD 3.54Å; R294-M326 VanDerWaalsContact CG-SD 3.54Å
295	E	91.6	Very high	95.7	Very high	27 Å²	27	28.7 Å²	28.7	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-67.3	-23.2	178	-66.9	-53.9	146.2	0	0	112.9	F260 L265 Q291 A292 G297 G486	F260-E295 HydrophobicContact CE2-CB 4.23Å; F260-E295 HydrophobicContact CE2-CG 3.71Å; F260-E295 HydrophobicContact CZ-CG 3.79Å; L265-E295 HydrophobicContact CD1-CB 3.51Å; L265-E295 WeakPolarHBondContact CD1-O 3.26Å; L265-E295 HydrophobicContact CD2-CB 4.02Å; L265-E295 HydrophobicContact CG-CB 4.44Å; Q291-E295 PolarHBondContact O-N 3.26Å; A292-E295 PolarHBondContact O-N 2.79Å; E295-G297 VanDerWaalsContact C-N 3.3Å; E295-G486 WeakPolarHBondContact O-CA 3.41Å
296	L	92.4	Very high	95.9	Very high	36 Å²	36	28.7 Å²	28.7	19%	0.188	14%	0.142	C	C	.	.	H	α-helix	trans	-77.3	-17.6	171.2	-167.3	71	0	0	0	112.1	L265 I269 A292 Y293 R294 P485 G486 I577	L265-L296 HydrophobicContact CB-CD1 4.46Å; L265-L296 HydrophobicContact CD1-CB 4.36Å; I269-L296 HydrophobicContact CD1-CD2 3.86Å; A292-L296 WeakPolarHBondContact O-CB 3.3Å; A292-L296 PolarHBondContact O-N 3.37Å; Y293-L296 HydrophobicContact CD1-CD2 4.31Å; Y293-L296 CarbonylContact O-C 3.48Å; Y293-L296 WeakPolarHBondContact O-CB 3.45Å; Y293-L296 PolarHBondContact O-N 2.98Å; R294-L296 PolarHBondContact O-N 2.94Å; L296-P485 HydrophobicContact CD1-CB 3.94Å; L296-P485 HydrophobicContact CD1-CG 4.48Å; L296-P485 CarbonylContact O-C 3.57Å; L296-P485 WeakPolarHBondContact O-CA 3.01Å; L296-G486 VanDerWaalsContact C-N 3.31Å; L296-G486 PolarHBondContact O-N 2.92Å; L296-I577 HydrophobicContact CD1-CD1 3.84Å
297	G	91.7	Very high	95.9	Very high	15 Å²	15	29.9 Å²	29.9	16%	0.155	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	14.5	-174.3	0	0	0	0	0	114.4	Y293 R294 E295 F299	Y293-G297 PolarHBondContact O-N 3.4Å; R294-G297 PolarHBondContact O-N 2.97Å; E295-G297 VanDerWaalsContact C-N 3.3Å; G297-F299 PolarHBondContact O-N 3.42Å
298	D	94.8	Very high	96	Very high	53 Å²	53	32.7 Å²	32.7	28%	0.283	16%	0.161	S	C	.	.			trans	-91.5	97.6	177.6	-173.1	-14.5	0	0	0	110.5	Y293 E300 S301 A302	Y293-D298 HydrophobicContact CD1-CB 3.95Å; Y293-D298 PolarHBondContact O-N 3.48Å; D298-E300 PolarHBondContact OD1-N 3.4Å; D298-S301 VanDerWaalsContact CG-CB 3.46Å; D298-S301 VanDerWaalsContact CG-OG 3.22Å; D298-S301 PolarHBondContact OD1-N 2.99Å; D298-S301 VanDerWaalsContact OD1-N 3.17Å; D298-S301 PolarHBondContact OD1-OG 3.41Å; D298-S301 VanDerWaalsContact OD2-CB 3.23Å; D298-S301 WeakPolarHBondContact OD2-CB 3.46Å; D298-S301 PolarHBondContact OD2-OG 3.21Å; D298-A302 VanDerWaalsContact O-CB 3.24Å; D298-A302 WeakPolarHBondContact O-CB 3.14Å; D298-A302 PolarHBondContact O-N 3.47Å
299	F	94.4	Very high	96	Very high	24 Å²	24	32.3 Å²	32.3	11%	0.105	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-49.9	-177.2	179.9	-99.5	0	0	0	113.3	G297 A302 M303 M326 L327 H330 L488	G297-F299 PolarHBondContact O-N 3.42Å; F299-A302 PolarHBondContact O-N 3.48Å; F299-M303 HydrophobicContact CD1-CG 4.31Å; F299-M303 HydrophobicContact CD2-CG 4.25Å; F299-M303 HydrophobicContact CE1-CG 3.88Å; F299-M303 HydrophobicContact CE2-CG 3.78Å; F299-M303 HydrophobicContact CE2-SD 4.22Å; F299-M303 HydrophobicContact CG-CG 4.49Å; F299-M303 HydrophobicContact CZ-CG 3.58Å; F299-M303 HydrophobicContact CZ-SD 4.22Å; F299-M303 WeakPolarHBondContact O-CB 3.45Å; F299-M303 WeakPolarHBondContact O-CG 3.48Å; F299-M303 PolarHBondContact O-N 3.24Å; F299-M326 VanDerWaalsContact CA-CE 3.49Å; F299-M326 HydrophobicContact CB-CE 4.11Å; F299-M326 HydrophobicContact CD2-CE 3.72Å; F299-M326 HydrophobicContact CD2-CG 3.91Å; F299-M326 HydrophobicContact CE2-CG 3.94Å; F299-M326 HydrophobicContact CG-CE 4.32Å; F299-L327 HydrophobicContact CZ-CD2 4.2Å; F299-H330 HydrophobicContact CD2-CB 3.61Å; F299-H330 AromaticContact CD2-CG 3.58Å; F299-H330 AromaticContact CD2-ND1 3.75Å; F299-H330 AromaticContact CE1-CD2 3.87Å; F299-H330 AromaticContact CE1-NE2 3.99Å; F299-H330 HydrophobicContact CE2-CB 3.3Å; F299-H330 AromaticContact CE2-CD2 3.73Å; F299-H330 AromaticContact CE2-CG 3.4Å; F299-H330 AromaticContact CG-ND1 3.89Å; F299-H330 HydrophobicContact CZ-CB 4.02Å; F299-H330 AromaticContact CZ-CD2 3.53Å; F299-H330 AromaticContact CZ-CG 3.72Å; F299-L488 HydrophobicContact CB-CD1 3.97Å
300	E	95.9	Very high	95.9	Very high	136 Å²	136	32.2 Å²	32.2	64%	0.636	16%	0.158	S	C	*	.	H	α-helix	trans	-67.4	-48.4	-171.5	-61.3	-61.4	155.3	0	0	110.7	D298 A302 M303 E304	D298-E300 PolarHBondContact OD1-N 3.4Å; E300-A302 VanDerWaalsContact C-N 3.31Å; E300-A302 PolarHBondContact O-N 3.03Å; E300-M303 PolarHBondContact O-N 2.88Å; E300-E304 PolarHBondContact O-N 3.27Å
301	S	97.4	Very high	95.9	Very high	28 Å²	28	38.5 Å²	38.5	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-34.8	179.9	-58.5	0	0	0	0	112.4	D298 S305	D298-S301 VanDerWaalsContact CG-CB 3.46Å; D298-S301 VanDerWaalsContact CG-OG 3.22Å; D298-S301 PolarHBondContact OD1-N 2.99Å; D298-S301 VanDerWaalsContact OD1-N 3.17Å; D298-S301 PolarHBondContact OD1-OG 3.41Å; D298-S301 VanDerWaalsContact OD2-CB 3.23Å; D298-S301 WeakPolarHBondContact OD2-CB 3.46Å; D298-S301 PolarHBondContact OD2-OG 3.21Å; S301-S305 WeakPolarHBondContact O-CB 3.33Å; S301-S305 PolarHBondContact O-N 3.38Å; S301-S305 VanDerWaalsContact O-N 3.1Å; S301-S305 PolarHBondContact O-OG 3.19Å
302	A	97.1	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-48.2	174.4	0	0	0	0	0	111.5	G290 R294 D298 F299 E300 E304 S305 F306 M326	G290-A302 WeakPolarHBondContact O-CB 3.36Å; R294-A302 HydrophobicContact CB-CB 4.39Å; D298-A302 VanDerWaalsContact O-CB 3.24Å; D298-A302 WeakPolarHBondContact O-CB 3.14Å; D298-A302 PolarHBondContact O-N 3.47Å; F299-A302 PolarHBondContact O-N 3.48Å; E300-A302 VanDerWaalsContact C-N 3.31Å; E300-A302 PolarHBondContact O-N 3.03Å; A302-E304 PolarHBondContact O-N 3.42Å; A302-S305 PolarHBondContact O-N 3.04Å; A302-F306 HydrophobicContact CB-CE2 4.18Å; A302-F306 WeakPolarHBondContact O-CD2 3.45Å; A302-F306 WeakPolarHBondContact O-CG 3.22Å; A302-F306 PolarHBondContact O-N 3.09Å; A302-M326 HydrophobicContact CB-CE 3.8Å; A302-M326 HydrophobicContact CB-SD 4.39Å
303	M	97.8	Very high	95.8	Very high	26 Å²	26	43.6 Å²	43.6	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-42.4	178.7	-74.3	-61.1	-62.6	0	0	112.2	F299 E300 S305 F306 Q307 R323 M326 L327	F299-M303 HydrophobicContact CD1-CG 4.31Å; F299-M303 HydrophobicContact CD2-CG 4.25Å; F299-M303 HydrophobicContact CE1-CG 3.88Å; F299-M303 HydrophobicContact CE2-CG 3.78Å; F299-M303 HydrophobicContact CE2-SD 4.22Å; F299-M303 HydrophobicContact CG-CG 4.49Å; F299-M303 HydrophobicContact CZ-CG 3.58Å; F299-M303 HydrophobicContact CZ-SD 4.22Å; F299-M303 WeakPolarHBondContact O-CB 3.45Å; F299-M303 WeakPolarHBondContact O-CG 3.48Å; F299-M303 PolarHBondContact O-N 3.24Å; E300-M303 PolarHBondContact O-N 2.88Å; M303-S305 VanDerWaalsContact C-N 3.33Å; M303-S305 PolarHBondContact O-N 2.98Å; M303-F306 PolarHBondContact O-N 2.97Å; M303-Q307 VanDerWaalsContact O-CB 3.23Å; M303-Q307 WeakPolarHBondContact O-CB 3.08Å; M303-Q307 PolarHBondContact O-N 2.95Å; M303-R323 HydrophobicContact CE-CG 3.72Å; M303-R323 HydrophobicContact SD-CG 4.02Å; M303-M326 HydrophobicContact CG-CG 4.32Å; M303-M326 HydrophobicContact SD-CB 4.04Å; M303-M326 HydrophobicContact SD-CG 3.98Å; M303-L327 HydrophobicContact CE-CD1 4.2Å; M303-L327 HydrophobicContact CE-CD2 3.85Å; M303-L327 HydrophobicContact CE-CG 3.97Å; M303-L327 HydrophobicContact SD-CD2 4.31Å; M303-L327 HydrophobicContact SD-CG 4.15Å
304	E	97.9	Very high	95.6	Very high	102 Å²	102	48 Å²	48	48%	0.477	24%	0.238	S	C	.	.	H	α-helix	trans	-59.3	-45.6	175.2	-171	-169.6	157.6	0	0	111.2	E300 A302 Q307 K308	E300-E304 PolarHBondContact O-N 3.27Å; A302-E304 PolarHBondContact O-N 3.42Å; E304-Q307 PolarHBondContact O-N 3.49Å; E304-K308 HydrophobicContact CG-CD 4.41Å; E304-K308 WeakPolarHBondContact O-CG 3.45Å; E304-K308 PolarHBondContact O-N 3.05Å; E304-K308 VanDerWaalsContact OE1-CE 3.26Å; E304-K308 WeakPolarHBondContact OE1-CE 3.15Å; E304-K308 IonicContact OE1-NZ 3.23Å; E304-K308 PolarHBondContact OE1-NZ 3.34Å
305	S	98	Very high	95.6	Very high	7 Å²	7	51.3 Å²	51.3	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-45	-179.4	-58.4	0	0	0	0	111.9	G290 S301 A302 M303 Q307 K308 A309	G290-S305 VanDerWaalsContact CA-CB 3.47Å; S301-S305 WeakPolarHBondContact O-CB 3.33Å; S301-S305 PolarHBondContact O-N 3.38Å; S301-S305 VanDerWaalsContact O-N 3.1Å; S301-S305 PolarHBondContact O-OG 3.19Å; A302-S305 PolarHBondContact O-N 3.04Å; M303-S305 VanDerWaalsContact C-N 3.33Å; M303-S305 PolarHBondContact O-N 2.98Å; S305-Q307 VanDerWaalsContact C-N 3.32Å; S305-Q307 PolarHBondContact O-N 2.85Å; S305-K308 PolarHBondContact O-N 2.81Å; S305-A309 PolarHBondContact O-N 3.26Å
306	F	97.4	Very high	95.7	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-37.9	174.5	-62.1	-41.6	0	0	0	112.2	K287 A302 M303 A309 L310 L322 R323 M326	K287-F306 WeakPolarHBondContact O-CE1 3.36Å; A302-F306 HydrophobicContact CB-CE2 4.18Å; A302-F306 WeakPolarHBondContact O-CD2 3.45Å; A302-F306 WeakPolarHBondContact O-CG 3.22Å; A302-F306 PolarHBondContact O-N 3.09Å; M303-F306 PolarHBondContact O-N 2.97Å; F306-A309 PolarHBondContact O-N 3.49Å; F306-L310 VanDerWaalsContact O-CG 3.29Å; F306-L310 WeakPolarHBondContact O-CG 3.41Å; F306-L310 PolarHBondContact O-N 3.03Å; F306-L322 HydrophobicContact CD1-CB 4.15Å; F306-L322 HydrophobicContact CE1-CB 3.61Å; F306-L322 HydrophobicContact CE1-CD1 3.79Å; F306-L322 HydrophobicContact CE1-CG 4.32Å; F306-L322 HydrophobicContact CE2-CB 4.06Å; F306-L322 HydrophobicContact CZ-CB 3.57Å; F306-L322 HydrophobicContact CZ-CD1 4.28Å; F306-L322 HydrophobicContact CZ-CG 4.43Å; F306-R323 HydrophobicContact CB-CB 4.16Å; F306-R323 HydrophobicContact CD2-CB 4.34Å; F306-R323 HydrophobicContact CG-CB 4.48Å; F306-M326 HydrophobicContact CE2-CB 4.32Å
307	Q	97.1	Very high	95.7	Very high	67 Å²	67	50.5 Å²	50.5	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-65.4	-41.3	176.8	-177.5	60.3	49.3	0	0	111.3	M303 E304 S305 L310 M311	M303-Q307 VanDerWaalsContact O-CB 3.23Å; M303-Q307 WeakPolarHBondContact O-CB 3.08Å; M303-Q307 PolarHBondContact O-N 2.95Å; E304-Q307 PolarHBondContact O-N 3.49Å; S305-Q307 VanDerWaalsContact C-N 3.32Å; S305-Q307 PolarHBondContact O-N 2.85Å; Q307-L310 CarbonylContact O-C 3.56Å; Q307-L310 PolarHBondContact O-N 3.32Å; Q307-M311 HydrophobicContact CG-CE 3.82Å; Q307-M311 WeakPolarHBondContact O-CG 3.37Å; Q307-M311 PolarHBondContact O-N 3.46Å
308	K	97.6	Very high	95.6	Very high	77 Å²	77	52.7 Å²	52.7	34%	0.335	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-44.7	174	-77.3	174.6	171.4	168.4	0	112	Y286 E304 S305 L310 M311 L312	Y286-K308 HydrophobicContact CD1-CB 3.89Å; Y286-K308 HydrophobicContact CD1-CD 4.15Å; Y286-K308 HydrophobicContact CD2-CB 4.34Å; Y286-K308 HydrophobicContact CE1-CB 3.96Å; Y286-K308 HydrophobicContact CE1-CD 3.57Å; Y286-K308 HydrophobicContact CE1-CG 4.38Å; Y286-K308 HydrophobicContact CE2-CB 4.36Å; Y286-K308 HydrophobicContact CG-CB 4.11Å; E304-K308 HydrophobicContact CG-CD 4.41Å; E304-K308 WeakPolarHBondContact O-CG 3.45Å; E304-K308 PolarHBondContact O-N 3.05Å; E304-K308 VanDerWaalsContact OE1-CE 3.26Å; E304-K308 WeakPolarHBondContact OE1-CE 3.15Å; E304-K308 IonicContact OE1-NZ 3.23Å; E304-K308 PolarHBondContact OE1-NZ 3.34Å; S305-K308 PolarHBondContact O-N 2.81Å; K308-L310 VanDerWaalsContact C-N 3.28Å; K308-L310 PolarHBondContact O-N 3.26Å; K308-M311 PolarHBondContact O-N 2.9Å; K308-M311 VanDerWaalsContact O-N 3.12Å; K308-L312 PolarHBondContact O-N 3.11Å
309	A	96.1	Very high	95.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-41.9	173.2	0	0	0	0	0	112.1	I283 S305 F306 L312 N313 S319	I283-A309 HydrophobicContact CG2-CB 4.27Å; S305-A309 PolarHBondContact O-N 3.26Å; F306-A309 PolarHBondContact O-N 3.49Å; A309-L312 PolarHBondContact O-N 3.32Å; A309-N313 PolarHBondContact O-N 2.98Å; A309-S319 WeakPolarHBondContact CB-OG 3.34Å
310	L	95.8	Very high	95.6	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-74.4	-21.1	177.7	-67.7	169.9	0	0	0	114.2	F306 Q307 K308 N313 Q314 L320	F306-L310 VanDerWaalsContact O-CG 3.29Å; F306-L310 WeakPolarHBondContact O-CG 3.41Å; F306-L310 PolarHBondContact O-N 3.03Å; Q307-L310 CarbonylContact O-C 3.56Å; Q307-L310 PolarHBondContact O-N 3.32Å; K308-L310 VanDerWaalsContact C-N 3.28Å; K308-L310 PolarHBondContact O-N 3.26Å; L310-N313 WeakPolarHBondContact CA-O 3.42Å; L310-N313 CarbonylContact O-C 3.44Å; L310-Q314 WeakPolarHBondContact O-CA 3.46Å; L310-Q314 WeakPolarHBondContact O-CG 3.3Å; L310-Q314 PolarHBondContact O-N 3.08Å; L310-L320 HydrophobicContact CD1-CD2 3.9Å; L310-L320 HydrophobicContact CD2-CD2 3.71Å; L310-L320 HydrophobicContact CD2-CG 3.73Å; L310-L320 HydrophobicContact CG-CD2 4.48Å
311	M	97.1	Very high	95.5	Very high	133 Å²	133	44.1 Å²	44.1	66%	0.655	22%	0.218	S	C	*	.	H	α-helix	trans	-71.9	-38.1	170.7	-71.9	-174.4	-168.4	0	0	111	Q307 K308	Q307-M311 HydrophobicContact CG-CE 3.82Å; Q307-M311 WeakPolarHBondContact O-CG 3.37Å; Q307-M311 PolarHBondContact O-N 3.46Å; K308-M311 PolarHBondContact O-N 2.9Å; K308-M311 VanDerWaalsContact O-N 3.12Å
312	L	95.4	Very high	95.4	Very high	80 Å²	80	43.4 Å²	43.4	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-70.7	-46.6	175.7	-65.9	174.7	0	0	0	111.7	D281 I283 Y286 K308 A309	D281-L312 HydrophobicContact CB-CD2 4.25Å; I283-L312 HydrophobicContact CD1-CB 4.15Å; I283-L312 HydrophobicContact CG1-CB 3.72Å; I283-L312 HydrophobicContact CG1-CD1 3.88Å; I283-L312 HydrophobicContact CG1-CG 4.48Å; Y286-L312 HydrophobicContact CD2-CD1 3.72Å; Y286-L312 HydrophobicContact CE2-CD1 3.82Å; K308-L312 PolarHBondContact O-N 3.11Å; A309-L312 PolarHBondContact O-N 3.32Å
313	N	94.7	Very high	95.4	Very high	49 Å²	49	46.1 Å²	46.1	26%	0.262	22%	0.222	S	C	.	.			trans	-135.2	104	172.9	-179	-5.2	0	0	0	110.9	I283 A309 L310 N315 H316	I283-N313 HydrophobicContact CD1-CB 3.57Å; A309-N313 PolarHBondContact O-N 2.98Å; L310-N313 WeakPolarHBondContact CA-O 3.42Å; L310-N313 CarbonylContact O-C 3.44Å; N313-N315 PolarHBondContact O-N 2.97Å; N313-N315 PolarHBondContact OD1-N 2.8Å; N313-H316 HydrophobicContact CB-CB 4.01Å; N313-H316 VanDerWaalsContact O-CB 3.32Å; N313-H316 WeakPolarHBondContact O-CB 3.29Å; N313-H316 PolarHBondContact O-N 3.43Å; N313-H316 VanDerWaalsContact O-N 3.16Å; N313-H316 PolarHBondContact OD1-N 3.42Å
314	Q	93.8	Very high	95.3	Very high	121 Å²	121	44.9 Å²	44.9	57%	0.565	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.6	-179.4	-74.8	-166.4	29.2	0	0	114.5	L310 R342	L310-Q314 WeakPolarHBondContact O-CA 3.46Å; L310-Q314 WeakPolarHBondContact O-CG 3.3Å; L310-Q314 PolarHBondContact O-N 3.08Å; Q314-R342 PolarHBondContact O-NE 3.25Å; Q314-R342 PolarHBondContact O-NH2 3.3Å
315	N	94.3	Very high	95.2	Very high	90 Å²	90	40.7 Å²	40.7	48%	0.481	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	13.5	-178.1	-64.8	-20.4	0	0	0	112.3	N313 I317 L346	N313-N315 PolarHBondContact O-N 2.97Å; N313-N315 PolarHBondContact OD1-N 2.8Å; N315-I317 WeakPolarHBondContact O-CG1 3.39Å; N315-I317 PolarHBondContact O-N 2.84Å; N315-I317 VanDerWaalsContact O-N 3.14Å; N315-L346 HydrophobicContact CB-CD1 3.89Å; N315-L346 HydrophobicContact CB-CD2 4.04Å; N315-L346 WeakPolarHBondContact O-CD1 3.27Å
316	H	92.6	Very high	95.1	Very high	21 Å²	21	40.3 Å²	40.3	10%	0.097	19%	0.194	C	C	.	.			trans	-71.5	108.4	178.6	-174.5	-115.2	0	0	0	111.7	N313 Q318 S319 L320	N313-H316 HydrophobicContact CB-CB 4.01Å; N313-H316 VanDerWaalsContact O-CB 3.32Å; N313-H316 WeakPolarHBondContact O-CB 3.29Å; N313-H316 PolarHBondContact O-N 3.43Å; N313-H316 VanDerWaalsContact O-N 3.16Å; N313-H316 PolarHBondContact OD1-N 3.42Å; H316-Q318 PolarHBondContact NE2-OE1 3.49Å; H316-Q318 VanDerWaalsContact NE2-OE1 3.15Å; H316-S319 PolarHBondContact CE1-OG 3.39Å; H316-S319 VanDerWaalsContact ND1-CB 3.33Å; H316-S319 WeakPolarHBondContact ND1-CB 3.21Å; H316-S319 PolarHBondContact ND1-N 3.32Å; H316-S319 PolarHBondContact ND1-OG 3.36Å; H316-S319 PolarHBondContact O-N 3.45Å; H316-L320 PolarHBondContact O-N 3.48Å
317	I	92.3	Very high	95.1	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.128	20%	0.195	C	C	.	.	H	α-helix	trans	-69.9	-43	-165.5	-61.3	179.6	0	0	0	111.9	N315 S319 L320 Q321 L346 E347	N315-I317 WeakPolarHBondContact O-CG1 3.39Å; N315-I317 PolarHBondContact O-N 2.84Å; N315-I317 VanDerWaalsContact O-N 3.14Å; I317-S319 VanDerWaalsContact C-N 3.29Å; I317-S319 PolarHBondContact O-N 3.48Å; I317-L320 PolarHBondContact O-N 3.49Å; I317-Q321 WeakPolarHBondContact O-CG 3.44Å; I317-Q321 PolarHBondContact O-N 3.11Å; I317-L346 HydrophobicContact CD1-CB 3.99Å; I317-L346 HydrophobicContact CG1-CB 4.19Å; I317-L346 HydrophobicContact CG1-CD1 4.1Å; I317-E347 HydrophobicContact CD1-CB 4.13Å; I317-E347 HydrophobicContact CD1-CG 3.37Å; I317-E347 WeakPolarHBondContact CD1-OE1 3.16Å
318	Q	90.9	Very high	95	Very high	61 Å²	61	37.8 Å²	37.8	29%	0.285	18%	0.182	S	C	.	.	H	α-helix	trans	-62.9	-36.8	179.3	-60.4	95.3	-24.3	0	0	111.5	K287 H316 Q321 L322	K287-Q318 HydrophobicContact CD-CB 3.89Å; H316-Q318 PolarHBondContact NE2-OE1 3.49Å; H316-Q318 VanDerWaalsContact NE2-OE1 3.15Å; Q318-Q321 WeakPolarHBondContact O-CB 3.36Å; Q318-Q321 PolarHBondContact O-N 2.96Å; Q318-L322 WeakPolarHBondContact O-CB 3.3Å; Q318-L322 VanDerWaalsContact O-CG 3.27Å; Q318-L322 WeakPolarHBondContact O-CG 3.35Å; Q318-L322 PolarHBondContact O-N 3.48Å
319	S	93	Very high	94.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.3	-36.8	175.8	-68.7	0	0	0	0	112.6	A309 H316 I317 R323	A309-S319 WeakPolarHBondContact CB-OG 3.34Å; H316-S319 PolarHBondContact CE1-OG 3.39Å; H316-S319 VanDerWaalsContact ND1-CB 3.33Å; H316-S319 WeakPolarHBondContact ND1-CB 3.21Å; H316-S319 PolarHBondContact ND1-N 3.32Å; H316-S319 PolarHBondContact ND1-OG 3.36Å; H316-S319 PolarHBondContact O-N 3.45Å; I317-S319 VanDerWaalsContact C-N 3.29Å; I317-S319 PolarHBondContact O-N 3.48Å; S319-R323 WeakPolarHBondContact O-CB 3.19Å; S319-R323 PolarHBondContact O-N 3.37Å
320	L	95.1	Very high	94.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-42.7	173.7	-70	172.6	0	0	0	111.8	L310 H316 I317 G324 R342 C343 L346	L310-L320 HydrophobicContact CD1-CD2 3.9Å; L310-L320 HydrophobicContact CD2-CD2 3.71Å; L310-L320 HydrophobicContact CD2-CG 3.73Å; L310-L320 HydrophobicContact CG-CD2 4.48Å; H316-L320 PolarHBondContact O-N 3.48Å; I317-L320 PolarHBondContact O-N 3.49Å; L320-G324 PolarHBondContact O-N 2.7Å; L320-R342 HydrophobicContact CD1-CB 4.25Å; L320-R342 HydrophobicContact CD1-CG 3.78Å; L320-R342 HydrophobicContact CD2-CG 4.32Å; L320-C343 HydrophobicContact CB-CB 4.31Å; L320-L346 HydrophobicContact CD1-CD1 3.72Å
321	Q	94.4	Very high	94.5	Very high	30 Å²	30	37.6 Å²	37.6	14%	0.14	19%	0.188	C	C	.	.	H	α-helix	trans	-56.7	-58.2	174.1	-81	174.2	-20.9	0	0	111.5	I317 Q318 R323 G324 M325 N350 C353	I317-Q321 WeakPolarHBondContact O-CG 3.44Å; I317-Q321 PolarHBondContact O-N 3.11Å; Q318-Q321 WeakPolarHBondContact O-CB 3.36Å; Q318-Q321 PolarHBondContact O-N 2.96Å; Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 3.38Å; Q321-G324 PolarHBondContact O-N 3.02Å; Q321-G324 VanDerWaalsContact O-N 3.13Å; Q321-M325 WeakPolarHBondContact O-CG 3.33Å; Q321-M325 PolarHBondContact O-N 3.43Å; Q321-N350 PolarHBondContact NE2-ND2 3.39Å; Q321-N350 PolarHBondContact NE2-OD1 3.21Å; Q321-C353 WeakPolarHBondContact CG-SG 3.24Å
322	L	94.9	Very high	94.3	Very high	12 Å²	12	32.2 Å²	32.2	6%	0.063	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-39.7	-174.7	-69.5	169.6	0	0	0	111.7	K287 F306 Q318 M325 M326	K287-L322 HydrophobicContact CD-CD1 4.42Å; K287-L322 HydrophobicContact CG-CD1 3.76Å; F306-L322 HydrophobicContact CD1-CB 4.15Å; F306-L322 HydrophobicContact CE1-CB 3.61Å; F306-L322 HydrophobicContact CE1-CD1 3.79Å; F306-L322 HydrophobicContact CE1-CG 4.32Å; F306-L322 HydrophobicContact CE2-CB 4.06Å; F306-L322 HydrophobicContact CZ-CB 3.57Å; F306-L322 HydrophobicContact CZ-CD1 4.28Å; F306-L322 HydrophobicContact CZ-CG 4.43Å; Q318-L322 WeakPolarHBondContact O-CB 3.3Å; Q318-L322 VanDerWaalsContact O-CG 3.27Å; Q318-L322 WeakPolarHBondContact O-CG 3.35Å; Q318-L322 PolarHBondContact O-N 3.48Å; L322-M325 PolarHBondContact O-N 3Å; L322-M326 WeakPolarHBondContact O-CB 3.47Å; L322-M326 PolarHBondContact O-N 3.24Å
323	R	96.9	Very high	94.3	Very high	58 Å²	58	29 Å²	29	22%	0.219	15%	0.146	C	C	.	.	H	α-helix	trans	-60.3	-47	172	-179	-176.2	167.6	168.8	4.2	111.8	M303 F306 S319 Q321 M325 M326 L327	M303-R323 HydrophobicContact CE-CG 3.72Å; M303-R323 HydrophobicContact SD-CG 4.02Å; F306-R323 HydrophobicContact CB-CB 4.16Å; F306-R323 HydrophobicContact CD2-CB 4.34Å; F306-R323 HydrophobicContact CG-CB 4.48Å; S319-R323 WeakPolarHBondContact O-CB 3.19Å; S319-R323 PolarHBondContact O-N 3.37Å; Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 3.38Å; R323-M325 PolarHBondContact O-N 3.25Å; R323-M326 WeakPolarHBondContact O-CB 3.29Å; R323-M326 PolarHBondContact O-N 2.84Å; R323-L327 HydrophobicContact CG-CD1 4.03Å; R323-L327 WeakPolarHBondContact O-CG 3.31Å; R323-L327 PolarHBondContact O-N 3.5Å
324	G	96.8	Very high	94.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-44	178	0	0	0	0	0	112.4	L320 Q321 M326 L327 Y328 A336 F340	L320-G324 PolarHBondContact O-N 2.7Å; Q321-G324 PolarHBondContact O-N 3.02Å; Q321-G324 VanDerWaalsContact O-N 3.13Å; G324-M326 VanDerWaalsContact C-N 3.33Å; G324-M326 PolarHBondContact O-N 3.42Å; G324-L327 PolarHBondContact O-N 2.99Å; G324-Y328 PolarHBondContact O-N 3.27Å; G324-A336 WeakPolarHBondContact O-CB 3.41Å; G324-F340 WeakPolarHBondContact O-CZ 3.26Å
325	M	95.3	Very high	94.3	Very high	13 Å²	13	31.9 Å²	31.9	6%	0.064	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-42.2	175.4	-68.8	175.4	68.7	0	0	111.4	F28 Q321 L322 R323 L327 Y328 H329 F340 V352 M356	F28-M325 HydrophobicContact CE2-CE 4.13Å; F28-M325 HydrophobicContact CZ-CE 3.98Å; F28-M325 HydrophobicContact CZ-SD 4.12Å; Q321-M325 WeakPolarHBondContact O-CG 3.33Å; Q321-M325 PolarHBondContact O-N 3.43Å; L322-M325 PolarHBondContact O-N 3Å; R323-M325 PolarHBondContact O-N 3.25Å; M325-L327 VanDerWaalsContact C-N 3.34Å; M325-L327 PolarHBondContact O-N 3.1Å; M325-Y328 WeakPolarHBondContact O-CB 3.39Å; M325-Y328 PolarHBondContact O-N 2.94Å; M325-H329 PolarHBondContact O-CD2 3.11Å; M325-H329 PolarHBondContact O-N 3.13Å; M325-F340 HydrophobicContact CG-CE1 4.29Å; M325-F340 HydrophobicContact CG-CZ 4.22Å; M325-V352 HydrophobicContact SD-CG1 4.42Å; M325-M356 HydrophobicContact CG-CE 4.16Å; M325-M356 HydrophobicContact CG-CG 4.22Å
326	M	95.6	Very high	94.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-45.7	177.9	-163.7	63.5	-178.5	0	0	111.9	R294 F299 A302 M303 F306 L322 R323 G324 H329 H330 L488	R294-M326 HydrophobicContact CB-CE 4.19Å; R294-M326 HydrophobicContact CB-SD 3.73Å; R294-M326 HydrophobicContact CG-CE 4.36Å; R294-M326 HydrophobicContact CG-SD 3.54Å; R294-M326 VanDerWaalsContact CG-SD 3.54Å; F299-M326 VanDerWaalsContact CA-CE 3.49Å; F299-M326 HydrophobicContact CB-CE 4.11Å; F299-M326 HydrophobicContact CD2-CE 3.72Å; F299-M326 HydrophobicContact CD2-CG 3.91Å; F299-M326 HydrophobicContact CE2-CG 3.94Å; F299-M326 HydrophobicContact CG-CE 4.32Å; A302-M326 HydrophobicContact CB-CE 3.8Å; A302-M326 HydrophobicContact CB-SD 4.39Å; M303-M326 HydrophobicContact CG-CG 4.32Å; M303-M326 HydrophobicContact SD-CB 4.04Å; M303-M326 HydrophobicContact SD-CG 3.98Å; F306-M326 HydrophobicContact CE2-CB 4.32Å; L322-M326 WeakPolarHBondContact O-CB 3.47Å; L322-M326 PolarHBondContact O-N 3.24Å; R323-M326 WeakPolarHBondContact O-CB 3.29Å; R323-M326 PolarHBondContact O-N 2.84Å; G324-M326 VanDerWaalsContact C-N 3.33Å; G324-M326 PolarHBondContact O-N 3.42Å; M326-H329 PolarHBondContact O-N 3.41Å; M326-H330 WeakPolarHBondContact O-CB 3.5Å; M326-H330 PolarHBondContact O-N 3.27Å; M326-L488 HydrophobicContact CE-CD1 3.27Å; M326-L488 HydrophobicContact CE-CD2 3.75Å; M326-L488 HydrophobicContact CE-CG 4.17Å; M326-L488 HydrophobicContact SD-CD1 4.45Å; M326-L488 HydrophobicContact SD-CD2 3.93Å
327	L	96.7	Very high	94.7	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-41.3	175.8	-71.3	163.6	0	0	0	111.8	F299 M303 R323 G324 M325 H330 G331 S332 E335 A336	F299-L327 HydrophobicContact CZ-CD2 4.2Å; M303-L327 HydrophobicContact CE-CD1 4.2Å; M303-L327 HydrophobicContact CE-CD2 3.85Å; M303-L327 HydrophobicContact CE-CG 3.97Å; M303-L327 HydrophobicContact SD-CD2 4.31Å; M303-L327 HydrophobicContact SD-CG 4.15Å; R323-L327 HydrophobicContact CG-CD1 4.03Å; R323-L327 WeakPolarHBondContact O-CG 3.31Å; R323-L327 PolarHBondContact O-N 3.5Å; G324-L327 PolarHBondContact O-N 2.99Å; M325-L327 VanDerWaalsContact C-N 3.34Å; M325-L327 PolarHBondContact O-N 3.1Å; L327-H330 PolarHBondContact O-N 3.19Å; L327-G331 PolarHBondContact O-N 3.01Å; L327-G331 VanDerWaalsContact O-N 3.1Å; L327-S332 PolarHBondContact O-N 2.68Å; L327-E335 HydrophobicContact CD1-CB 3.81Å; L327-E335 HydrophobicContact CD2-CB 4.07Å; L327-E335 HydrophobicContact CG-CB 4.42Å; L327-A336 HydrophobicContact CB-CB 3.78Å
328	Y	95.9	Very high	94.9	Very high	11 Å²	11	27.4 Å²	27.4	4%	0.043	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-52.3	174.6	175.6	-92.7	0	0	0	111.5	G324 M325 H330 G331 L333 M356 L359 A363 D543	G324-Y328 PolarHBondContact O-N 3.27Å; M325-Y328 WeakPolarHBondContact O-CB 3.39Å; M325-Y328 PolarHBondContact O-N 2.94Å; Y328-H330 PolarHBondContact O-N 3.23Å; Y328-G331 PolarHBondContact O-N 2.91Å; Y328-L333 HydrophobicContact CD2-CD2 3.4Å; Y328-L333 HydrophobicContact CE2-CD2 3.68Å; Y328-L333 HydrophobicContact CG-CD2 4.32Å; Y328-M356 HydrophobicContact CD1-CE 3.7Å; Y328-M356 HydrophobicContact CD2-CE 4.47Å; Y328-M356 HydrophobicContact CE1-CE 4.33Å; Y328-M356 HydrophobicContact CG-CE 3.8Å; Y328-L359 HydrophobicContact CE1-CD2 3.86Å; Y328-L359 HydrophobicContact CE1-CG 4.45Å; Y328-L359 HydrophobicContact CE2-CD2 4.03Å; Y328-L359 HydrophobicContact CE2-CG 3.77Å; Y328-L359 WeakPolarHBondContact OH-CG 3.47Å; Y328-A363 HydrophobicContact CE2-CB 4.3Å; Y328-D543 PolarHBondContact OH-OD1 2.92Å
329	H	93.2	Very high	95.2	Very high	43 Å²	43	25 Å²	25	20%	0.199	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-20.8	-179	-68.1	-65.6	0	0	0	113.5	M325 M326 L488 N490	M325-H329 PolarHBondContact O-CD2 3.11Å; M325-H329 PolarHBondContact O-N 3.13Å; M326-H329 PolarHBondContact O-N 3.41Å; H329-L488 HydrophobicContact CB-CD2 3.66Å; H329-N490 VanDerWaalsContact O-CB 3.22Å; H329-N490 WeakPolarHBondContact O-CB 3.18Å; H329-N490 VanDerWaalsContact O-CG 3.25Å; H329-N490 PolarHBondContact O-ND2 3.31Å
330	H	93	Very high	95.4	Very high	16 Å²	16	25 Å²	25	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-80.6	-19.6	170.8	-172.3	60.6	0	0	0	113.5	F299 M326 L327 Y328 P489 K491	F299-H330 HydrophobicContact CD2-CB 3.61Å; F299-H330 AromaticContact CD2-CG 3.58Å; F299-H330 AromaticContact CD2-ND1 3.75Å; F299-H330 AromaticContact CE1-CD2 3.87Å; F299-H330 AromaticContact CE1-NE2 3.99Å; F299-H330 HydrophobicContact CE2-CB 3.3Å; F299-H330 AromaticContact CE2-CD2 3.73Å; F299-H330 AromaticContact CE2-CG 3.4Å; F299-H330 AromaticContact CG-ND1 3.89Å; F299-H330 HydrophobicContact CZ-CB 4.02Å; F299-H330 AromaticContact CZ-CD2 3.53Å; F299-H330 AromaticContact CZ-CG 3.72Å; M326-H330 WeakPolarHBondContact O-CB 3.5Å; M326-H330 PolarHBondContact O-N 3.27Å; L327-H330 PolarHBondContact O-N 3.19Å; Y328-H330 PolarHBondContact O-N 3.23Å; H330-P489 PolarHBondContact ND1-O 3.25Å; H330-P489 VanDerWaalsContact ND1-O 3.09Å; H330-K491 WeakPolarHBondContact NE2-CE 3.46Å; H330-K491 PolarHBondContact NE2-NZ 3.36Å; H330-K491 PolarHBondContact O-N 3.13Å
331	G	92.4	Very high	95.5	Very high	21 Å²	21	30.1 Å²	30.1	22%	0.216	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	3.1	-176.2	0	0	0	0	0	114.9	L327 Y328 L333	L327-G331 PolarHBondContact O-N 3.01Å; L327-G331 VanDerWaalsContact O-N 3.1Å; Y328-G331 PolarHBondContact O-N 2.91Å; G331-L333 VanDerWaalsContact C-N 3.26Å; G331-L333 PolarHBondContact O-N 3.05Å
332	S	93.6	Very high	95.6	Very high	21 Å²	21	33.2 Å²	33.2	15%	0.147	17%	0.167	C	C	.	.			trans	-80.9	64.3	174.6	-68.2	0	0	0	0	111.9	L327 Q334 E335 A336	L327-S332 PolarHBondContact O-N 2.68Å; S332-Q334 PolarHBondContact O-N 3.39Å; S332-E335 PolarHBondContact O-N 3.07Å; S332-A336 PolarHBondContact O-N 2.61Å
333	L	94.8	Very high	95.7	Very high	11 Å²	11	32.6 Å²	32.6	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-40.2	-170.3	-60.2	178.8	0	0	0	113.8	Y328 G331 A336 I337 A363 M364 N815	Y328-L333 HydrophobicContact CD2-CD2 3.4Å; Y328-L333 HydrophobicContact CE2-CD2 3.68Å; Y328-L333 HydrophobicContact CG-CD2 4.32Å; G331-L333 VanDerWaalsContact C-N 3.26Å; G331-L333 PolarHBondContact O-N 3.05Å; L333-A336 WeakPolarHBondContact O-CB 3.29Å; L333-A336 PolarHBondContact O-N 3.02Å; L333-I337 WeakPolarHBondContact O-CG1 3.47Å; L333-I337 PolarHBondContact O-N 2.6Å; L333-A363 HydrophobicContact CD1-CB 3.61Å; L333-A363 HydrophobicContact CD2-CB 4.21Å; L333-M364 HydrophobicContact CB-CG 3.84Å; L333-M364 HydrophobicContact CB-SD 4.05Å; L333-M364 HydrophobicContact CD1-CG 3.71Å; L333-M364 HydrophobicContact CG-CG 4.45Å; L333-N815 WeakPolarHBondContact CD1-OD1 3.49Å
334	Q	93.5	Very high	95.6	Very high	122 Å²	122	30.8 Å²	30.8	57%	0.57	16%	0.158	S	C	*	.	H	α-helix	trans	-65.7	-42.8	-178.1	-173	66.8	16.1	0	0	112	S332 A336 I337 G338	S332-Q334 PolarHBondContact O-N 3.39Å; Q334-A336 VanDerWaalsContact C-N 3.35Å; Q334-I337 PolarHBondContact O-N 3Å; Q334-G338 PolarHBondContact O-N 2.99Å
335	E	95.1	Very high	95.6	Very high	109 Å²	109	38.3 Å²	38.3	51%	0.509	19%	0.194	S	C	.	.	H	α-helix	trans	-67.6	-37.1	175.7	-63.8	177.8	-111.4	0	0	111.5	L327 S332 G338 S339	L327-E335 HydrophobicContact CD1-CB 3.81Å; L327-E335 HydrophobicContact CD2-CB 4.07Å; L327-E335 HydrophobicContact CG-CB 4.42Å; S332-E335 PolarHBondContact O-N 3.07Å; E335-G338 PolarHBondContact O-N 3.26Å; E335-S339 PolarHBondContact O-N 2.92Å; E335-S339 VanDerWaalsContact O-N 3.11Å; E335-S339 PolarHBondContact O-OG 3.42Å
336	A	97.2	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-47.7	174.3	0	0	0	0	0	111.1	G324 L327 S332 L333 Q334 G338 S339 F340	G324-A336 WeakPolarHBondContact O-CB 3.41Å; L327-A336 HydrophobicContact CB-CB 3.78Å; S332-A336 PolarHBondContact O-N 2.61Å; L333-A336 WeakPolarHBondContact O-CB 3.29Å; L333-A336 PolarHBondContact O-N 3.02Å; Q334-A336 VanDerWaalsContact C-N 3.35Å; A336-G338 VanDerWaalsContact C-N 3.27Å; A336-G338 PolarHBondContact O-N 3.35Å; A336-S339 WeakPolarHBondContact O-CB 3.41Å; A336-S339 PolarHBondContact O-N 3.32Å; A336-S339 VanDerWaalsContact O-N 3.08Å; A336-F340 HydrophobicContact CB-CD2 4.46Å; A336-F340 HydrophobicContact CB-CE2 3.97Å; A336-F340 WeakPolarHBondContact O-CD2 3.46Å; A336-F340 WeakPolarHBondContact O-CG 3.42Å; A336-F340 PolarHBondContact O-N 2.86Å
337	I	97.3	Very high	95.4	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-39.5	175.5	-69.8	166	0	0	0	111.3	L333 Q334 S339 F340 K341 S360 M364	L333-I337 WeakPolarHBondContact O-CG1 3.47Å; L333-I337 PolarHBondContact O-N 2.6Å; Q334-I337 PolarHBondContact O-N 3Å; I337-S339 VanDerWaalsContact C-N 3.34Å; I337-S339 PolarHBondContact O-N 3.46Å; I337-F340 PolarHBondContact O-N 3.39Å; I337-K341 HydrophobicContact CG2-CD 3.92Å; I337-K341 HydrophobicContact CG2-CG 4.18Å; I337-K341 WeakPolarHBondContact O-CB 3.48Å; I337-K341 VanDerWaalsContact O-CG 3.29Å; I337-K341 WeakPolarHBondContact O-CG 3.23Å; I337-K341 PolarHBondContact O-N 3.12Å; I337-S360 VanDerWaalsContact CG1-CB 3.47Å; I337-M364 HydrophobicContact CD1-SD 3.4Å; I337-M364 WeakPolarHBondContact CD1-SD 3.2Å
338	G	96.8	Very high	95.1	Very high	41 Å²	41	45.4 Å²	45.4	42%	0.423	23%	0.233	S	C	.	.	H	α-helix	trans	-57.8	-46.1	174.6	0	0	0	0	0	112.4	Q334 E335 A336 K341 R342	Q334-G338 PolarHBondContact O-N 2.99Å; E335-G338 PolarHBondContact O-N 3.26Å; A336-G338 VanDerWaalsContact C-N 3.27Å; A336-G338 PolarHBondContact O-N 3.35Å; G338-K341 PolarHBondContact O-N 2.68Å; G338-R342 PolarHBondContact O-N 2.82Å; G338-R342 VanDerWaalsContact O-N 3.13Å
339	S	97.3	Very high	94.6	Very high	9 Å²	9	53.2 Å²	53.2	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-45	177.5	-57	0	0	0	0	111.9	E335 A336 I337 R342 C343	E335-S339 PolarHBondContact O-N 2.92Å; E335-S339 VanDerWaalsContact O-N 3.11Å; E335-S339 PolarHBondContact O-OG 3.42Å; A336-S339 WeakPolarHBondContact O-CB 3.41Å; A336-S339 PolarHBondContact O-N 3.32Å; A336-S339 VanDerWaalsContact O-N 3.08Å; I337-S339 VanDerWaalsContact C-N 3.34Å; I337-S339 PolarHBondContact O-N 3.46Å; S339-R342 PolarHBondContact O-N 2.63Å; S339-C343 PolarHBondContact O-N 3.44Å
340	F	97.6	Very high	94.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69	-35.6	178.5	-60	-49.9	0	0	0	113.2	G324 M325 A336 I337 R342 C343 L344 C353 M356 K357	G324-F340 WeakPolarHBondContact O-CZ 3.26Å; M325-F340 HydrophobicContact CG-CE1 4.29Å; M325-F340 HydrophobicContact CG-CZ 4.22Å; A336-F340 HydrophobicContact CB-CD2 4.46Å; A336-F340 HydrophobicContact CB-CE2 3.97Å; A336-F340 WeakPolarHBondContact O-CD2 3.46Å; A336-F340 WeakPolarHBondContact O-CG 3.42Å; A336-F340 PolarHBondContact O-N 2.86Å; I337-F340 PolarHBondContact O-N 3.39Å; F340-R342 VanDerWaalsContact C-N 3.32Å; F340-R342 PolarHBondContact O-N 2.89Å; F340-C343 WeakPolarHBondContact O-CB 3.49Å; F340-C343 PolarHBondContact O-N 3.32Å; F340-L344 WeakPolarHBondContact O-CB 3.4Å; F340-L344 WeakPolarHBondContact O-CD1 3.32Å; F340-L344 VanDerWaalsContact O-CG 3.28Å; F340-L344 WeakPolarHBondContact O-CG 3.33Å; F340-L344 PolarHBondContact O-N 3.32Å; F340-C353 HydrophobicContact CD1-CB 4.32Å; F340-M356 HydrophobicContact CD1-CB 4.13Å; F340-M356 HydrophobicContact CD2-CB 4.05Å; F340-M356 HydrophobicContact CE1-CB 3.59Å; F340-M356 HydrophobicContact CE1-CG 4.21Å; F340-M356 HydrophobicContact CE2-CB 3.5Å; F340-M356 HydrophobicContact CG-CB 4.34Å; F340-M356 HydrophobicContact CZ-CB 3.25Å; F340-M356 HydrophobicContact CZ-CE 4.29Å; F340-M356 HydrophobicContact CZ-CG 3.98Å; F340-K357 HydrophobicContact CB-CB 3.92Å; F340-K357 HydrophobicContact CD2-CB 4.48Å; F340-K357 HydrophobicContact CG-CB 4.48Å
341	K	97.4	Very high	94.1	Very high	111 Å²	111	53.4 Å²	53.4	48%	0.483	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-42.2	172.7	-79.3	177	177.2	177.4	0	111.4	I337 G338 L344 H345	I337-K341 HydrophobicContact CG2-CD 3.92Å; I337-K341 HydrophobicContact CG2-CG 4.18Å; I337-K341 WeakPolarHBondContact O-CB 3.48Å; I337-K341 VanDerWaalsContact O-CG 3.29Å; I337-K341 WeakPolarHBondContact O-CG 3.23Å; I337-K341 PolarHBondContact O-N 3.12Å; G338-K341 PolarHBondContact O-N 2.68Å; K341-L344 PolarHBondContact O-N 3.4Å; K341-H345 PolarHBondContact O-N 3.43Å
342	R	96.7	Very high	94.1	Very high	95 Å²	95	53.4 Å²	53.4	36%	0.358	26%	0.261	S	S	.	.	H	α-helix	trans	-65.6	-43.5	175.8	-170.6	176.9	175.1	162.2	11.5	111.7	Q314 L320 G338 S339 F340 L344 H345 L346	Q314-R342 PolarHBondContact O-NE 3.25Å; Q314-R342 PolarHBondContact O-NH2 3.3Å; L320-R342 HydrophobicContact CD1-CB 4.25Å; L320-R342 HydrophobicContact CD1-CG 3.78Å; L320-R342 HydrophobicContact CD2-CG 4.32Å; G338-R342 PolarHBondContact O-N 2.82Å; G338-R342 VanDerWaalsContact O-N 3.13Å; S339-R342 PolarHBondContact O-N 2.63Å; F340-R342 VanDerWaalsContact C-N 3.32Å; F340-R342 PolarHBondContact O-N 2.89Å; R342-L344 VanDerWaalsContact C-N 3.34Å; R342-L344 PolarHBondContact O-N 2.89Å; R342-H345 WeakPolarHBondContact O-CB 3.32Å; R342-H345 PolarHBondContact O-N 3.5Å; R342-L346 PolarHBondContact O-N 3.36Å
343	C	95.8	Very high	94	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.3	-48.4	172.8	169.9	0	0	0	0	112	L320 S339 F340 H345 L346 E347 C353	L320-C343 HydrophobicContact CB-CB 4.31Å; S339-C343 PolarHBondContact O-N 3.44Å; F340-C343 WeakPolarHBondContact O-CB 3.49Å; F340-C343 PolarHBondContact O-N 3.32Å; C343-H345 VanDerWaalsContact C-N 3.27Å; C343-H345 PolarHBondContact O-N 3.05Å; C343-L346 PolarHBondContact O-N 3.17Å; C343-L346 VanDerWaalsContact O-N 3.17Å; C343-E347 PolarHBondContact O-N 3.2Å; C343-C353 HydrophobicContact CB-CB 3.85Å; C343-C353 WeakPolarHBondContact CB-SG 3.34Å; C343-C353 WeakPolarHBondContact SG-CB 3.15Å; C343-C353 CovalentContact SG-SG 2.02Å; C343-C353 PolarHBondContact SG-SG 3.36Å
344	L	94.9	Very high	94	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.099	26%	0.255	C	S	.	.	H	α-helix	trans	-71.9	-19.3	-179.4	-68.7	164.7	0	0	0	113.9	F340 K341 R342 E347 P348 N350 C353 Q354 K357	F340-L344 WeakPolarHBondContact O-CB 3.4Å; F340-L344 WeakPolarHBondContact O-CD1 3.32Å; F340-L344 VanDerWaalsContact O-CG 3.28Å; F340-L344 WeakPolarHBondContact O-CG 3.33Å; F340-L344 PolarHBondContact O-N 3.32Å; K341-L344 PolarHBondContact O-N 3.4Å; R342-L344 VanDerWaalsContact C-N 3.34Å; R342-L344 PolarHBondContact O-N 2.89Å; L344-E347 WeakPolarHBondContact CA-O 3.38Å; L344-E347 CarbonylContact O-C 3.48Å; L344-P348 VanDerWaalsContact O-CA 3.27Å; L344-P348 WeakPolarHBondContact O-CA 3.3Å; L344-N350 HydrophobicContact CD2-CB 4.35Å; L344-C353 HydrophobicContact CD1-CB 4.44Å; L344-C353 HydrophobicContact CD2-CB 3.89Å; L344-C353 HydrophobicContact CG-CB 3.81Å; L344-Q354 HydrophobicContact CD2-CB 3.99Å; L344-K357 HydrophobicContact CD1-CB 4.33Å; L344-K357 HydrophobicContact CD1-CD 3.67Å
345	H	96.6	Very high	94.1	Very high	159 Å²	159	47 Å²	47	74%	0.736	23%	0.228	S	C	*	.	H	α-helix	trans	-70.5	-37.9	170.8	-178.2	67	0	0	0	111.2	K341 R342 C343	K341-H345 PolarHBondContact O-N 3.43Å; R342-H345 WeakPolarHBondContact O-CB 3.32Å; R342-H345 PolarHBondContact O-N 3.5Å; C343-H345 VanDerWaalsContact C-N 3.27Å; C343-H345 PolarHBondContact O-N 3.05Å
346	L	94.8	Very high	94.2	Very high	56 Å²	56	42.3 Å²	42.3	29%	0.293	21%	0.207	S	C	.	.	H	α-helix	trans	-78.8	-42.7	177.4	-60.9	169.8	0	0	0	111.6	N315 I317 L320 R342 C343	N315-L346 HydrophobicContact CB-CD1 3.89Å; N315-L346 HydrophobicContact CB-CD2 4.04Å; N315-L346 WeakPolarHBondContact O-CD1 3.27Å; I317-L346 HydrophobicContact CD1-CB 3.99Å; I317-L346 HydrophobicContact CG1-CB 4.19Å; I317-L346 HydrophobicContact CG1-CD1 4.1Å; L320-L346 HydrophobicContact CD1-CD1 3.72Å; R342-L346 PolarHBondContact O-N 3.36Å; C343-L346 PolarHBondContact O-N 3.17Å; C343-L346 VanDerWaalsContact O-N 3.17Å
347	E	92.4	Very high	94.1	Very high	44 Å²	44	43.8 Å²	43.8	21%	0.206	21%	0.213	C	C	.	.			trans	-128.8	93.5	176.9	-83.2	178.9	-176.6	0	0	111.7	K40 I317 C343 L344 Y349 N350	K40-E347 WeakPolarHBondContact CE-OE1 3.34Å; K40-E347 IonicContact NZ-OE1 3.66Å; K40-E347 PolarHBondContact NZ-OE1 3.44Å; K40-E347 IonicContact NZ-OE2 2.92Å; K40-E347 PolarHBondContact NZ-OE2 3.14Å; I317-E347 HydrophobicContact CD1-CB 4.13Å; I317-E347 HydrophobicContact CD1-CG 3.37Å; I317-E347 WeakPolarHBondContact CD1-OE1 3.16Å; C343-E347 PolarHBondContact O-N 3.2Å; L344-E347 WeakPolarHBondContact CA-O 3.38Å; L344-E347 CarbonylContact O-C 3.48Å; E347-Y349 PolarHBondContact O-N 3.36Å; E347-Y349 VanDerWaalsContact O-N 3.07Å; E347-N350 HydrophobicContact CB-CB 3.88Å; E347-N350 WeakPolarHBondContact O-CB 3.44Å; E347-N350 PolarHBondContact O-N 3.05Å; E347-N350 VanDerWaalsContact O-N 3.13Å; E347-N350 PolarHBondContact OE2-ND2 3.17Å
348	P	89.9	Confident	94.1	Very high	63 Å²	63	43.7 Å²	43.7	41%	0.409	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.4	-176.3	-27.8	36.4	0	0	0	115.8	L344 K376	L344-P348 VanDerWaalsContact O-CA 3.27Å; L344-P348 WeakPolarHBondContact O-CA 3.3Å; P348-K376 WeakPolarHBondContact O-CE 3.45Å; P348-K376 PolarHBondContact O-NZ 3.44Å
349	Y	86.1	Confident	94.1	Very high	175 Å²	175	41.8 Å²	41.8	69%	0.686	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.1	10.2	-178.1	-57.6	-76.5	0	0	0	113.2	E347 E351	E347-Y349 PolarHBondContact O-N 3.36Å; E347-Y349 VanDerWaalsContact O-N 3.07Å; Y349-E351 PolarHBondContact O-N 3.19Å
350	N	88	Confident	94.1	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.064	19%	0.19	C	C	.	.			trans	-65.9	106.5	179	-168.5	-70.8	0	0	0	111.2	Q321 L344 E347 V352 C353 Q354	Q321-N350 PolarHBondContact NE2-ND2 3.39Å; Q321-N350 PolarHBondContact NE2-OD1 3.21Å; L344-N350 HydrophobicContact CD2-CB 4.35Å; E347-N350 HydrophobicContact CB-CB 3.88Å; E347-N350 WeakPolarHBondContact O-CB 3.44Å; E347-N350 PolarHBondContact O-N 3.05Å; E347-N350 VanDerWaalsContact O-N 3.13Å; E347-N350 PolarHBondContact OE2-ND2 3.17Å; N350-V352 PolarHBondContact O-N 3.12Å; N350-V352 PolarHBondContact OD1-N 2.9Å; N350-C353 HydrophobicContact CB-CB 4.23Å; N350-C353 PolarHBondContact O-N 2.99Å; N350-C353 WeakPolarHBondContact OD1-CB 3.37Å; N350-C353 PolarHBondContact OD1-N 3.45Å; N350-C353 PolarHBondContact OD1-SG 3.3Å; N350-C353 VanDerWaalsContact OD1-SG 3.36Å; N350-Q354 WeakPolarHBondContact O-CB 3.37Å; N350-Q354 PolarHBondContact O-N 3.47Å
351	E	89	Confident	94.1	Very high	51 Å²	51	41.8 Å²	41.8	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-49.5	-175.3	168.9	167.4	-144.3	0	0	112.7	Y349 C353 Q354 Y355 V377 S389 E391 Y392	Y349-E351 PolarHBondContact O-N 3.19Å; E351-C353 PolarHBondContact O-N 3.44Å; E351-Q354 PolarHBondContact O-N 3.14Å; E351-Q354 VanDerWaalsContact O-N 3.15Å; E351-Y355 WeakPolarHBondContact O-CB 3.37Å; E351-Y355 PolarHBondContact O-N 3.02Å; E351-V377 HydrophobicContact CG-CG1 3.81Å; E351-V377 VanDerWaalsContact OE1-CG1 3.25Å; E351-V377 WeakPolarHBondContact OE1-CG1 3.28Å; E351-S389 PolarHBondContact OE1-OG 2.97Å; E351-S389 WeakPolarHBondContact OE2-CB 3.49Å; E351-S389 PolarHBondContact OE2-OG 3.4Å; E351-E391 HydrophobicContact CG-CB 4.21Å; E351-Y392 WeakPolarHBondContact OE1-CA 3.41Å; E351-Y392 WeakPolarHBondContact OE1-CB 3.07Å; E351-Y392 PolarHBondContact OE1-N 2.79Å
352	V	90.3	Very high	94.1	Very high	22 Å²	22	36.6 Å²	36.6	13%	0.133	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-46.1	-176.2	178.4	0	0	0	0	110.7	M325 N350 Q354 Y355 M356 E391	M325-V352 HydrophobicContact SD-CG1 4.42Å; N350-V352 PolarHBondContact O-N 3.12Å; N350-V352 PolarHBondContact OD1-N 2.9Å; V352-Q354 VanDerWaalsContact C-N 3.32Å; V352-Q354 PolarHBondContact O-N 2.77Å; V352-Y355 PolarHBondContact O-N 3.23Å; V352-M356 HydrophobicContact CG1-CG 4.34Å; V352-M356 WeakPolarHBondContact O-CB 3.42Å; V352-M356 VanDerWaalsContact O-CG 3.29Å; V352-M356 WeakPolarHBondContact O-CG 3.47Å; V352-M356 PolarHBondContact O-N 3.16Å; V352-E391 HydrophobicContact CG2-CG 4.35Å
353	C	93.2	Very high	94.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-38.1	177.3	-69.7	0	0	0	0	112.3	Q321 F340 C343 L344 N350 E351 K357	Q321-C353 WeakPolarHBondContact CG-SG 3.24Å; F340-C353 HydrophobicContact CD1-CB 4.32Å; C343-C353 HydrophobicContact CB-CB 3.85Å; C343-C353 WeakPolarHBondContact CB-SG 3.34Å; C343-C353 WeakPolarHBondContact SG-CB 3.15Å; C343-C353 CovalentContact SG-SG 2.02Å; C343-C353 PolarHBondContact SG-SG 3.36Å; L344-C353 HydrophobicContact CD1-CB 4.44Å; L344-C353 HydrophobicContact CD2-CB 3.89Å; L344-C353 HydrophobicContact CG-CB 3.81Å; N350-C353 HydrophobicContact CB-CB 4.23Å; N350-C353 PolarHBondContact O-N 2.99Å; N350-C353 WeakPolarHBondContact OD1-CB 3.37Å; N350-C353 PolarHBondContact OD1-N 3.45Å; N350-C353 PolarHBondContact OD1-SG 3.3Å; N350-C353 VanDerWaalsContact OD1-SG 3.36Å; E351-C353 PolarHBondContact O-N 3.44Å; C353-K357 WeakPolarHBondContact O-CB 3.32Å; C353-K357 PolarHBondContact O-N 2.99Å
354	Q	94.9	Very high	94.1	Very high	15 Å²	15	33.2 Å²	33.2	7%	0.07	16%	0.158	C	C	.	.	H	α-helix	trans	-68.6	-43.6	179	-171.3	68.2	19.3	0	0	111.4	L344 N350 E351 V352 G358 A373 K376 V377	L344-Q354 HydrophobicContact CD2-CB 3.99Å; N350-Q354 WeakPolarHBondContact O-CB 3.37Å; N350-Q354 PolarHBondContact O-N 3.47Å; E351-Q354 PolarHBondContact O-N 3.14Å; E351-Q354 VanDerWaalsContact O-N 3.15Å; V352-Q354 VanDerWaalsContact C-N 3.32Å; V352-Q354 PolarHBondContact O-N 2.77Å; Q354-G358 PolarHBondContact O-N 3.49Å; Q354-A373 WeakPolarHBondContact CG-O 3.39Å; Q354-A373 PolarHBondContact NE2-O 3.43Å; Q354-K376 HydrophobicContact CG-CB 4.26Å; Q354-K376 HydrophobicContact CG-CD 4.39Å; Q354-K376 HydrophobicContact CG-CG 4.5Å; Q354-V377 HydrophobicContact CB-CG2 3.77Å; Q354-V377 HydrophobicContact CG-CG2 3.57Å
355	Y	94.8	Very high	94.1	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.016	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-55.7	174.1	179.2	-92.7	0	0	0	111.2	E351 V352 K357 G358 L359 E391 K394 V395 L398 D545	E351-Y355 WeakPolarHBondContact O-CB 3.37Å; E351-Y355 PolarHBondContact O-N 3.02Å; V352-Y355 PolarHBondContact O-N 3.23Å; Y355-K357 VanDerWaalsContact C-N 3.32Å; Y355-K357 PolarHBondContact O-N 2.96Å; Y355-G358 WeakPolarHBondContact O-CA 3.45Å; Y355-G358 PolarHBondContact O-N 2.94Å; Y355-L359 HydrophobicContact CE1-CD2 4.13Å; Y355-L359 WeakPolarHBondContact O-CB 3.26Å; Y355-L359 PolarHBondContact O-N 3.21Å; Y355-E391 HydrophobicContact CD1-CB 4.27Å; Y355-E391 HydrophobicContact CD1-CG 3.91Å; Y355-E391 HydrophobicContact CD2-CB 4.06Å; Y355-E391 HydrophobicContact CE1-CG 4.48Å; Y355-E391 HydrophobicContact CG-CB 3.87Å; Y355-E391 HydrophobicContact CG-CG 3.99Å; Y355-K394 HydrophobicContact CE2-CB 3.99Å; Y355-K394 WeakPolarHBondContact OH-CB 3.43Å; Y355-V395 HydrophobicContact CD2-CB 3.85Å; Y355-V395 HydrophobicContact CD2-CG2 3.88Å; Y355-V395 HydrophobicContact CE2-CB 3.96Å; Y355-V395 HydrophobicContact CE2-CG2 4.24Å; Y355-L398 HydrophobicContact CE2-CD2 3.93Å; Y355-D545 PolarHBondContact OH-OD1 3.39Å
356	M	96.3	Very high	94.1	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.049	13%	0.128	C	C	.	.	H	α-helix	trans	-68	-30.1	-176.4	-67.1	-60.5	-61.7	0	0	113.1	M325 Y328 F340 V352 L359 S360	M325-M356 HydrophobicContact CG-CE 4.16Å; M325-M356 HydrophobicContact CG-CG 4.22Å; Y328-M356 HydrophobicContact CD1-CE 3.7Å; Y328-M356 HydrophobicContact CD2-CE 4.47Å; Y328-M356 HydrophobicContact CE1-CE 4.33Å; Y328-M356 HydrophobicContact CG-CE 3.8Å; F340-M356 HydrophobicContact CD1-CB 4.13Å; F340-M356 HydrophobicContact CD2-CB 4.05Å; F340-M356 HydrophobicContact CE1-CB 3.59Å; F340-M356 HydrophobicContact CE1-CG 4.21Å; F340-M356 HydrophobicContact CE2-CB 3.5Å; F340-M356 HydrophobicContact CG-CB 4.34Å; F340-M356 HydrophobicContact CZ-CB 3.25Å; F340-M356 HydrophobicContact CZ-CE 4.29Å; F340-M356 HydrophobicContact CZ-CG 3.98Å; V352-M356 HydrophobicContact CG1-CG 4.34Å; V352-M356 WeakPolarHBondContact O-CB 3.42Å; V352-M356 VanDerWaalsContact O-CG 3.29Å; V352-M356 WeakPolarHBondContact O-CG 3.47Å; V352-M356 PolarHBondContact O-N 3.16Å; M356-L359 HydrophobicContact CE-CD2 4.17Å; M356-L359 HydrophobicContact SD-CD2 4.05Å; M356-S360 WeakPolarHBondContact O-CB 3.25Å; M356-S360 PolarHBondContact O-N 3.09Å; M356-S360 PolarHBondContact O-OG 3.37Å
357	K	96.9	Very high	94.2	Very high	31 Å²	31	24 Å²	24	14%	0.135	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-48.3	168.4	-179.1	-172.3	166	-162.5	0	110.7	F340 L344 C353 Y355 S360 H361	F340-K357 HydrophobicContact CB-CB 3.92Å; F340-K357 HydrophobicContact CD2-CB 4.48Å; F340-K357 HydrophobicContact CG-CB 4.48Å; L344-K357 HydrophobicContact CD1-CB 4.33Å; L344-K357 HydrophobicContact CD1-CD 3.67Å; C353-K357 WeakPolarHBondContact O-CB 3.32Å; C353-K357 PolarHBondContact O-N 2.99Å; Y355-K357 VanDerWaalsContact C-N 3.32Å; Y355-K357 PolarHBondContact O-N 2.96Å; K357-S360 PolarHBondContact O-N 3.03Å; K357-H361 VanDerWaalsContact CE-NE2 3.33Å; K357-H361 WeakPolarHBondContact CE-NE2 3.23Å; K357-H361 PolarHBondContact O-CD2 3.35Å; K357-H361 PolarHBondContact O-N 3.37Å
358	G	96.7	Very high	94.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-46.3	178.1	0	0	0	0	0	112.1	Q354 Y355 H361 V362	Q354-G358 PolarHBondContact O-N 3.49Å; Y355-G358 WeakPolarHBondContact O-CA 3.45Å; Y355-G358 PolarHBondContact O-N 2.94Å; G358-H361 PolarHBondContact O-N 3.43Å; G358-V362 WeakPolarHBondContact O-CG2 3.44Å; G358-V362 PolarHBondContact O-N 3.2Å
359	L	96.9	Very high	94.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-59.7	-45.8	175.9	179.6	62.5	0	0	0	112.4	Y328 Y355 M356 H361 V362 A363 L398 P544 D545	Y328-L359 HydrophobicContact CE1-CD2 3.86Å; Y328-L359 HydrophobicContact CE1-CG 4.45Å; Y328-L359 HydrophobicContact CE2-CD2 4.03Å; Y328-L359 HydrophobicContact CE2-CG 3.77Å; Y328-L359 WeakPolarHBondContact OH-CG 3.47Å; Y355-L359 HydrophobicContact CE1-CD2 4.13Å; Y355-L359 WeakPolarHBondContact O-CB 3.26Å; Y355-L359 PolarHBondContact O-N 3.21Å; M356-L359 HydrophobicContact CE-CD2 4.17Å; M356-L359 HydrophobicContact SD-CD2 4.05Å; L359-H361 VanDerWaalsContact C-N 3.33Å; L359-H361 PolarHBondContact O-N 3.44Å; L359-V362 PolarHBondContact O-N 3.02Å; L359-A363 PolarHBondContact O-N 3.41Å; L359-L398 HydrophobicContact CB-CD2 3.93Å; L359-L398 HydrophobicContact CD1-CD1 3.69Å; L359-L398 HydrophobicContact CD1-CD2 3.84Å; L359-L398 HydrophobicContact CD1-CG 4.43Å; L359-L398 HydrophobicContact CG-CD2 4.45Å; L359-P544 HydrophobicContact CD1-CG 3.91Å; L359-D545 HydrophobicContact CD1-CB 3.82Å; L359-D545 HydrophobicContact CD2-CB 3.81Å; L359-D545 HydrophobicContact CG-CB 4.46Å
360	S	97.3	Very high	95.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59	-42.8	175.5	-59.6	0	0	0	0	112.2	I337 M356 K357 A363 M364	I337-S360 VanDerWaalsContact CG1-CB 3.47Å; M356-S360 WeakPolarHBondContact O-CB 3.25Å; M356-S360 PolarHBondContact O-N 3.09Å; M356-S360 PolarHBondContact O-OG 3.37Å; K357-S360 PolarHBondContact O-N 3.03Å; S360-A363 PolarHBondContact O-N 3.04Å; S360-M364 WeakPolarHBondContact O-CG 3.3Å; S360-M364 PolarHBondContact O-N 3.42Å
361	H	97.6	Very high	95.5	Very high	9 Å²	9	19.8 Å²	19.8	4%	0.042	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-42.4	176.2	-80.8	-59.5	0	0	0	112.2	K357 G358 L359 M364 G365 Q366 E369	K357-H361 VanDerWaalsContact CE-NE2 3.33Å; K357-H361 WeakPolarHBondContact CE-NE2 3.23Å; K357-H361 PolarHBondContact O-CD2 3.35Å; K357-H361 PolarHBondContact O-N 3.37Å; G358-H361 PolarHBondContact O-N 3.43Å; L359-H361 VanDerWaalsContact C-N 3.33Å; L359-H361 PolarHBondContact O-N 3.44Å; H361-M364 CarbonylContact O-C 3.6Å; H361-M364 WeakPolarHBondContact O-CA 3.4Å; H361-M364 WeakPolarHBondContact O-CB 3.43Å; H361-M364 PolarHBondContact O-N 3.29Å; H361-M364 VanDerWaalsContact O-N 3.14Å; H361-G365 PolarHBondContact O-N 3.09Å; H361-G365 VanDerWaalsContact O-N 3.09Å; H361-Q366 HydrophobicContact CB-CB 4.16Å; H361-Q366 PolarHBondContact CE1-OE1 3.35Å; H361-Q366 PolarHBondContact ND1-OE1 2.98Å; H361-Q366 PolarHBondContact O-N 2.88Å; H361-E369 HydrophobicContact CB-CB 4.46Å
362	V	97.1	Very high	95.8	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-64.4	-42.6	176.5	175.4	0	0	0	0	111.5	G358 L359 M364 G365 F367 S402 L405 P544	G358-V362 WeakPolarHBondContact O-CG2 3.44Å; G358-V362 PolarHBondContact O-N 3.2Å; L359-V362 PolarHBondContact O-N 3.02Å; V362-M364 PolarHBondContact O-N 3.35Å; V362-G365 WeakPolarHBondContact O-CA 3.34Å; V362-G365 PolarHBondContact O-N 3.29Å; V362-F367 HydrophobicContact CG1-CD1 4.36Å; V362-F367 HydrophobicContact CG1-CE1 4.03Å; V362-S402 WeakPolarHBondContact CG2-OG 3.49Å; V362-L405 HydrophobicContact CG1-CD1 4.44Å; V362-P544 HydrophobicContact CB-CG 4.48Å; V362-P544 HydrophobicContact CG1-CB 3.97Å; V362-P544 HydrophobicContact CG1-CG 3.95Å
363	A	96.6	Very high	96	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.017	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-30	174.5	0	0	0	0	0	112.2	Y328 L333 L359 S360 G365 R492 P544 N815	Y328-A363 HydrophobicContact CE2-CB 4.3Å; L333-A363 HydrophobicContact CD1-CB 3.61Å; L333-A363 HydrophobicContact CD2-CB 4.21Å; L359-A363 PolarHBondContact O-N 3.41Å; S360-A363 PolarHBondContact O-N 3.04Å; A363-G365 VanDerWaalsContact C-N 3.31Å; A363-R492 PolarHBondContact O-NH2 3.46Å; A363-P544 HydrophobicContact CB-CG 4.08Å; A363-N815 PolarHBondContact O-ND2 3.32Å; A363-N815 PolarHBondContact O-OD1 3.23Å
364	M	95.6	Very high	96.1	Very high	21 Å²	21	21.6 Å²	21.6	10%	0.103	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-9.3	171	-72.1	-175.1	73.3	0	0	114.6	L333 I337 S360 H361 V362 Q366 N815	L333-M364 HydrophobicContact CB-CG 3.84Å; L333-M364 HydrophobicContact CB-SD 4.05Å; L333-M364 HydrophobicContact CD1-CG 3.71Å; L333-M364 HydrophobicContact CG-CG 4.45Å; I337-M364 HydrophobicContact CD1-SD 3.4Å; I337-M364 WeakPolarHBondContact CD1-SD 3.2Å; S360-M364 WeakPolarHBondContact O-CG 3.3Å; S360-M364 PolarHBondContact O-N 3.42Å; H361-M364 CarbonylContact O-C 3.6Å; H361-M364 WeakPolarHBondContact O-CA 3.4Å; H361-M364 WeakPolarHBondContact O-CB 3.43Å; H361-M364 PolarHBondContact O-N 3.29Å; H361-M364 VanDerWaalsContact O-N 3.14Å; V362-M364 PolarHBondContact O-N 3.35Å; M364-Q366 VanDerWaalsContact C-N 3.34Å; M364-Q366 HydrophobicContact CB-CG 4.26Å; M364-N815 VanDerWaalsContact CA-ND2 3.33Å; M364-N815 WeakPolarHBondContact CA-ND2 3.38Å
365	G	95.9	Very high	96	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	19.1	-173.5	0	0	0	0	0	114.6	H361 V362 A363 F367 V454	H361-G365 PolarHBondContact O-N 3.09Å; H361-G365 VanDerWaalsContact O-N 3.09Å; V362-G365 WeakPolarHBondContact O-CA 3.34Å; V362-G365 PolarHBondContact O-N 3.29Å; A363-G365 VanDerWaalsContact C-N 3.31Å; G365-F367 VanDerWaalsContact O-CD2 3.27Å; G365-F367 WeakPolarHBondContact O-CD2 3.16Å; G365-F367 PolarHBondContact O-N 3.46Å; G365-V454 PolarHBondContact O-N 3.3Å
366	Q	96.6	Very high	95.9	Very high	42 Å²	42	26.3 Å²	26.3	20%	0.196	12%	0.12	C	C	.	.			trans	-93.7	72.6	175	-64	174.5	-9.4	0	0	109.4	H361 M364 Y368 G370 D453	H361-Q366 HydrophobicContact CB-CB 4.16Å; H361-Q366 PolarHBondContact CE1-OE1 3.35Å; H361-Q366 PolarHBondContact ND1-OE1 2.98Å; H361-Q366 PolarHBondContact O-N 2.88Å; M364-Q366 VanDerWaalsContact C-N 3.34Å; M364-Q366 HydrophobicContact CB-CG 4.26Å; Q366-Y368 VanDerWaalsContact C-N 3.34Å; Q366-Y368 PolarHBondContact O-N 3.25Å; Q366-G370 PolarHBondContact O-N 3.26Å; Q366-G370 VanDerWaalsContact O-N 3.07Å; Q366-D453 WeakPolarHBondContact CA-OD2 3.33Å
367	F	96.4	Very high	95.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-69.7	-30.6	-168.2	-64	-81.8	0	0	0	112.9	V362 G365 G370 I371 S402 L405 H406 L409 L447 D453 I811	V362-F367 HydrophobicContact CG1-CD1 4.36Å; V362-F367 HydrophobicContact CG1-CE1 4.03Å; G365-F367 VanDerWaalsContact O-CD2 3.27Å; G365-F367 WeakPolarHBondContact O-CD2 3.16Å; G365-F367 PolarHBondContact O-N 3.46Å; F367-G370 PolarHBondContact O-N 2.97Å; F367-I371 WeakPolarHBondContact O-CB 3.39Å; F367-I371 WeakPolarHBondContact O-CG1 3.33Å; F367-I371 PolarHBondContact O-N 3.33Å; F367-S402 VanDerWaalsContact CD1-O 3.28Å; F367-S402 WeakPolarHBondContact CD1-O 3.28Å; F367-L405 HydrophobicContact CE1-CB 3.56Å; F367-L405 HydrophobicContact CE1-CD1 4.31Å; F367-L405 HydrophobicContact CZ-CB 3.86Å; F367-H406 HydrophobicContact CB-CB 4.08Å; F367-H406 HydrophobicContact CD1-CB 4.1Å; F367-H406 HydrophobicContact CD2-CB 4.16Å; F367-H406 AromaticContact CD2-CD2 3.83Å; F367-H406 HydrophobicContact CG-CB 3.84Å; F367-H406 AromaticContact CG-CD2 4Å; F367-L409 HydrophobicContact CD2-CD2 4.23Å; F367-L409 HydrophobicContact CE2-CD1 3.83Å; F367-L409 HydrophobicContact CE2-CD2 3.85Å; F367-L409 HydrophobicContact CE2-CG 4.4Å; F367-L409 HydrophobicContact CZ-CD1 4.32Å; F367-L447 HydrophobicContact CB-CD2 3.96Å; F367-D453 VanDerWaalsContact N-CG 3.33Å; F367-D453 PolarHBondContact N-OD1 3.24Å; F367-D453 PolarHBondContact N-OD2 3.13Å; F367-I811 HydrophobicContact CE2-CD1 4.5Å; F367-I811 HydrophobicContact CZ-CD1 4.06Å
368	Y	95.4	Very high	95.2	Very high	132 Å²	132	26.3 Å²	26.3	52%	0.518	12%	0.121	S	C	.	.	H	α-helix	trans	-61.4	-54.2	177.5	177.2	-98.6	0	0	0	112.1	Q366 G370 K372 L447 D453	Q366-Y368 VanDerWaalsContact C-N 3.34Å; Q366-Y368 PolarHBondContact O-N 3.25Å; Y368-G370 VanDerWaalsContact C-N 3.3Å; Y368-G370 PolarHBondContact O-N 3.26Å; Y368-K372 HydrophobicContact CE1-CD 4.33Å; Y368-K372 WeakPolarHBondContact O-CB 3.49Å; Y368-K372 PolarHBondContact O-N 3.49Å; Y368-L447 HydrophobicContact CD2-CD1 3.86Å; Y368-L447 HydrophobicContact CG-CD1 4.5Å; Y368-D453 PolarHBondContact N-OD2 3.02Å
369	E	95.4	Very high	94.8	Very high	55 Å²	55	32.6 Å²	32.6	26%	0.257	15%	0.154	S	C	.	.	H	α-helix	trans	-68.1	-31.9	178.1	-74.4	-64.5	128.8	0	0	111.8	H361 K372 A373	H361-E369 HydrophobicContact CB-CB 4.46Å; E369-K372 IonicContact OE1-NZ 2.68Å; E369-K372 PolarHBondContact OE1-NZ 3.19Å; E369-K372 IonicContact OE2-NZ 2.98Å; E369-A373 VanDerWaalsContact O-CB 3.29Å; E369-A373 WeakPolarHBondContact O-CB 3.32Å; E369-A373 PolarHBondContact O-N 3.44Å
370	G	96.4	Very high	93.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-57.4	173.4	0	0	0	0	0	113.3	Q366 F367 Y368 K372 A373 Q374	Q366-G370 PolarHBondContact O-N 3.26Å; Q366-G370 VanDerWaalsContact O-N 3.07Å; F367-G370 PolarHBondContact O-N 2.97Å; Y368-G370 VanDerWaalsContact C-N 3.3Å; Y368-G370 PolarHBondContact O-N 3.26Å; G370-K372 PolarHBondContact O-N 2.92Å; G370-A373 WeakPolarHBondContact O-CB 3.4Å; G370-A373 PolarHBondContact O-N 3.12Å; G370-A373 VanDerWaalsContact O-N 3.1Å; G370-Q374 VanDerWaalsContact O-CD 3.26Å; G370-Q374 VanDerWaalsContact O-CG 3.26Å; G370-Q374 WeakPolarHBondContact O-CG 3.28Å; G370-Q374 PolarHBondContact O-N 3.33Å
371	I	96.2	Very high	92.5	Very high	18 Å²	18	40.6 Å²	40.6	9%	0.092	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-38.9	-178.6	-69.9	165.9	0	0	0	111.4	F367 A373 Q374 T375 R399 R403 L447	F367-I371 WeakPolarHBondContact O-CB 3.39Å; F367-I371 WeakPolarHBondContact O-CG1 3.33Å; F367-I371 PolarHBondContact O-N 3.33Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.42Å; I371-Q374 PolarHBondContact O-N 3.45Å; I371-T375 WeakPolarHBondContact O-CB 3.4Å; I371-T375 PolarHBondContact O-N 3.26Å; I371-T375 PolarHBondContact O-OG1 2.88Å; I371-R399 HydrophobicContact CG2-CG 4.4Å; I371-R403 HydrophobicContact CD1-CG 3.66Å; I371-R403 HydrophobicContact CG1-CG 4.46Å; I371-L447 HydrophobicContact CD1-CD1 4.16Å; I371-L447 HydrophobicContact CD1-CD2 3.63Å; I371-L447 HydrophobicContact CD1-CG 3.8Å
372	K	95.3	Very high	91	Very high	110 Å²	110	42.3 Å²	42.3	48%	0.478	21%	0.208	S	C	.	.	H	α-helix	trans	-57.3	-43.1	171.8	178.3	-178.9	173.2	-172.4	0	111.1	Y368 E369 G370 K376	Y368-K372 HydrophobicContact CE1-CD 4.33Å; Y368-K372 WeakPolarHBondContact O-CB 3.49Å; Y368-K372 PolarHBondContact O-N 3.49Å; E369-K372 IonicContact OE1-NZ 2.68Å; E369-K372 PolarHBondContact OE1-NZ 3.19Å; E369-K372 IonicContact OE2-NZ 2.98Å; G370-K372 PolarHBondContact O-N 2.92Å; K372-K376 PolarHBondContact O-N 3.47Å
373	A	95.2	Very high	89.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-44.8	-179.3	0	0	0	0	0	112.5	Q354 E369 G370 I371 K376 V377	Q354-A373 WeakPolarHBondContact CG-O 3.39Å; Q354-A373 PolarHBondContact NE2-O 3.43Å; E369-A373 VanDerWaalsContact O-CB 3.29Å; E369-A373 WeakPolarHBondContact O-CB 3.32Å; E369-A373 PolarHBondContact O-N 3.44Å; G370-A373 WeakPolarHBondContact O-CB 3.4Å; G370-A373 PolarHBondContact O-N 3.12Å; G370-A373 VanDerWaalsContact O-N 3.1Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.42Å; A373-K376 WeakPolarHBondContact O-CB 3.26Å; A373-K376 PolarHBondContact O-N 3.1Å; A373-V377 PolarHBondContact O-N 3.17Å
374	Q	94.5	Very high	87.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-43.5	176.6	-67.7	153.7	1.3	0	0	112.2	G370 I371 K376 V377 M378 V395 L398 R399 S402	G370-Q374 VanDerWaalsContact O-CD 3.26Å; G370-Q374 VanDerWaalsContact O-CG 3.26Å; G370-Q374 WeakPolarHBondContact O-CG 3.28Å; G370-Q374 PolarHBondContact O-N 3.33Å; I371-Q374 PolarHBondContact O-N 3.45Å; Q374-K376 VanDerWaalsContact C-N 3.25Å; Q374-K376 PolarHBondContact O-N 2.91Å; Q374-V377 WeakPolarHBondContact O-CB 3.12Å; Q374-V377 PolarHBondContact O-N 3.41Å; Q374-V377 VanDerWaalsContact O-N 3.08Å; Q374-M378 WeakPolarHBondContact O-CG 3.46Å; Q374-M378 PolarHBondContact O-N 3.18Å; Q374-V395 HydrophobicContact CB-CG2 3.64Å; Q374-V395 HydrophobicContact CG-CG2 3.88Å; Q374-L398 HydrophobicContact CG-CD2 4.26Å; Q374-R399 HydrophobicContact CB-CB 4.22Å; Q374-S402 PolarHBondContact NE2-OG 3.12Å; Q374-S402 VanDerWaalsContact NE2-OG 3.12Å
375	T	93.1	Very high	85.1	Confident	46 Å²	46	60.1 Å²	60.1	28%	0.282	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-38.1	177.2	-55.2	0	0	0	0	110.8	I371 V377 M378 L379	I371-T375 WeakPolarHBondContact O-CB 3.4Å; I371-T375 PolarHBondContact O-N 3.26Å; I371-T375 PolarHBondContact O-OG1 2.88Å; T375-V377 VanDerWaalsContact C-N 3.33Å; T375-V377 PolarHBondContact O-N 2.98Å; T375-M378 PolarHBondContact O-N 2.88Å; T375-L379 HydrophobicContact CG2-CD1 4.26Å; T375-L379 HydrophobicContact CG2-CG 4.45Å; T375-L379 VanDerWaalsContact O-CG 3.31Å; T375-L379 WeakPolarHBondContact O-CG 3.42Å; T375-L379 PolarHBondContact O-N 3.49Å
376	K	92.3	Very high	83.3	Confident	71 Å²	71	64 Å²	64	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-36.6	175.5	-171	177.4	173.8	-165.7	0	112.8	P348 Q354 K372 A373 Q374 L379 N380	P348-K376 WeakPolarHBondContact O-CE 3.45Å; P348-K376 PolarHBondContact O-NZ 3.44Å; Q354-K376 HydrophobicContact CG-CB 4.26Å; Q354-K376 HydrophobicContact CG-CD 4.39Å; Q354-K376 HydrophobicContact CG-CG 4.5Å; K372-K376 PolarHBondContact O-N 3.47Å; A373-K376 WeakPolarHBondContact O-CB 3.26Å; A373-K376 PolarHBondContact O-N 3.1Å; Q374-K376 VanDerWaalsContact C-N 3.25Å; Q374-K376 PolarHBondContact O-N 2.91Å; K376-L379 PolarHBondContact O-N 3.01Å; K376-N380 PolarHBondContact O-N 3.37Å
377	V	91.1	Very high	81.6	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-45.3	173.6	179	0	0	0	0	110.3	E351 Q354 A373 Q374 T375 L379 N380 V395	E351-V377 HydrophobicContact CG-CG1 3.81Å; E351-V377 VanDerWaalsContact OE1-CG1 3.25Å; E351-V377 WeakPolarHBondContact OE1-CG1 3.28Å; Q354-V377 HydrophobicContact CB-CG2 3.77Å; Q354-V377 HydrophobicContact CG-CG2 3.57Å; A373-V377 PolarHBondContact O-N 3.17Å; Q374-V377 WeakPolarHBondContact O-CB 3.12Å; Q374-V377 PolarHBondContact O-N 3.41Å; Q374-V377 VanDerWaalsContact O-N 3.08Å; T375-V377 VanDerWaalsContact C-N 3.33Å; T375-V377 PolarHBondContact O-N 2.98Å; V377-L379 VanDerWaalsContact C-N 3.25Å; V377-L379 PolarHBondContact O-N 3.32Å; V377-N380 PolarHBondContact O-N 2.62Å; V377-N380 VanDerWaalsContact O-N 3.11Å; V377-V395 HydrophobicContact CB-CG1 4.31Å; V377-V395 HydrophobicContact CB-CG2 4.01Å; V377-V395 HydrophobicContact CG1-CB 4.25Å; V377-V395 HydrophobicContact CG1-CG1 3.95Å; V377-V395 HydrophobicContact CG1-CG2 4.27Å; V377-V395 HydrophobicContact CG2-CG2 4.42Å
378	M	88.2	Confident	80.3	Confident	41 Å²	41	72.2 Å²	72.2	20%	0.202	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-28.1	179.3	-67.5	173.2	54.3	0	0	113.9	Q374 T375 N380 V395 K396 R399	Q374-M378 WeakPolarHBondContact O-CG 3.46Å; Q374-M378 PolarHBondContact O-N 3.18Å; T375-M378 PolarHBondContact O-N 2.88Å; M378-N380 VanDerWaalsContact C-N 3.33Å; M378-V395 HydrophobicContact CG-CG1 3.52Å; M378-K396 HydrophobicContact CE-CG 3.89Å; M378-K396 HydrophobicContact CG-CG 4.13Å; M378-K396 HydrophobicContact SD-CG 3.98Å; M378-R399 HydrophobicContact SD-CB 4.35Å; M378-R399 WeakPolarHBondContact SD-CD 3.22Å
379	L	87.4	Confident	79.4	Confident	132 Å²	132	66.9 Å²	66.9	69%	0.691	36%	0.363	S	S	*	.	H	α-helix	trans	-78.1	-19.3	177.3	-70.1	172.1	0	0	0	112.9	T375 K376 V377 D381	T375-L379 HydrophobicContact CG2-CD1 4.26Å; T375-L379 HydrophobicContact CG2-CG 4.45Å; T375-L379 VanDerWaalsContact O-CG 3.31Å; T375-L379 WeakPolarHBondContact O-CG 3.42Å; T375-L379 PolarHBondContact O-N 3.49Å; K376-L379 PolarHBondContact O-N 3.01Å; V377-L379 VanDerWaalsContact C-N 3.25Å; V377-L379 PolarHBondContact O-N 3.32Å; L379-D381 VanDerWaalsContact C-N 3.25Å; L379-D381 PolarHBondContact O-N 3.17Å; L379-D381 VanDerWaalsContact O-N 3.16Å
380	N	79	Confident	78.8	Confident	64 Å²	64	66.5 Å²	66.5	34%	0.342	37%	0.366	S	S	.	.	S	Bend	trans	-88.5	62.3	176.5	-67.5	-10.8	0	0	0	109.8	K376 V377 M378	K376-N380 PolarHBondContact O-N 3.37Å; V377-N380 PolarHBondContact O-N 2.62Å; V377-N380 VanDerWaalsContact O-N 3.11Å; M378-N380 VanDerWaalsContact C-N 3.33Å
381	D	66.8	Low	78.3	Confident	105 Å²	105	68 Å²	68	56%	0.561	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-59.5	130.6	-177	-87.6	-17.7	0	0	0	111.5	L379 L383 Y392	L379-D381 VanDerWaalsContact C-N 3.25Å; L379-D381 PolarHBondContact O-N 3.17Å; L379-D381 VanDerWaalsContact O-N 3.16Å; D381-L383 PolarHBondContact O-N 3.45Å; D381-Y392 PolarHBondContact OD1-OH 3.11Å
382	P	67.3	Low	77.7	Confident	44 Å²	44	68.5 Å²	68.5	29%	0.286	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.2	138.7	174.9	24.6	-31.2	0	0	0	109.8	Q386 A388 Y392	P382-Q386 HydrophobicContact CB-CB 4.17Å; P382-A388 HydrophobicContact CG-CB 4.36Å; P382-Y392 HydrophobicContact CG-CD1 4.45Å; P382-Y392 HydrophobicContact CG-CE1 4.24Å; P382-Y392 HydrophobicContact CG-CE2 4.33Å
383	L	60	Low	77.2	Confident	126 Å²	126	65.1 Å²	65.1	66%	0.66	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-60.1	151.9	179	-68.1	169.8	0	0	0	110.6	D381 G385 Q386	D381-L383 PolarHBondContact O-N 3.45Å; L383-G385 PolarHBondContact O-N 2.81Å; L383-Q386 HydrophobicContact CB-CG 4.33Å; L383-Q386 WeakPolarHBondContact O-CB 3.26Å; L383-Q386 PolarHBondContact O-N 3.1Å
384	L	52.7	Low	76.9	Confident	192 Å²	192	67.1 Å²	67.1	100%	1.005	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	116.6	179	-151.9	99.9	0	0	0	110.2
385	G	52	Low	76.9	Confident	82 Å²	82	67.1 Å²	67.1	85%	0.845	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	-12.2	-177	0	0	0	0	0	115.2	L383	L383-G385 PolarHBondContact O-N 2.81Å
386	Q	58.9	Low	76.8	Confident	81 Å²	81	67.6 Å²	67.6	38%	0.379	37%	0.368	S	S	.	.	S	Bend	trans	-78.2	134.1	167.9	-70.9	-179.7	-21.8	0	0	110.1	P382 L383 A388	P382-Q386 HydrophobicContact CB-CB 4.17Å; L383-Q386 HydrophobicContact CB-CG 4.33Å; L383-Q386 WeakPolarHBondContact O-CB 3.26Å; L383-Q386 PolarHBondContact O-N 3.1Å; Q386-A388 PolarHBondContact O-N 3.2Å
387	K	58.9	Low	76.9	Confident	180 Å²	180	64.2 Å²	64.2	78%	0.783	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-66.9	123	171	-71.9	-177.6	-178.8	175.8	0	108.4	S389	K387-S389 PolarHBondContact O-N 3.32Å
388	A	69.4	Low	77.1	Confident	36 Å²	36	64.2 Å²	64.2	30%	0.298	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-57.3	135.3	170.2	0	0	0	0	0	110.4	P382 Q386 Y392 L393	P382-A388 HydrophobicContact CG-CB 4.36Å; Q386-A388 PolarHBondContact O-N 3.2Å; A388-Y392 HydrophobicContact CB-CD1 3.61Å; A388-Y392 HydrophobicContact CB-CE1 4.34Å; A388-Y392 HydrophobicContact CB-CG 4.24Å; A388-L393 HydrophobicContact CB-CD2 4.05Å; A388-L393 HydrophobicContact CB-CG 4.26Å
389	S	77.8	Confident	77.5	Confident	20 Å²	20	64.1 Å²	64.1	14%	0.14	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-66.1	162.3	173.3	70.1	0	0	0	0	110.8	E351 K387 E391 Y392 L393	E351-S389 PolarHBondContact OE1-OG 2.97Å; E351-S389 WeakPolarHBondContact OE2-CB 3.49Å; E351-S389 PolarHBondContact OE2-OG 3.4Å; K387-S389 PolarHBondContact O-N 3.32Å; S389-E391 PolarHBondContact O-N 2.91Å; S389-Y392 WeakPolarHBondContact O-CB 3.35Å; S389-Y392 PolarHBondContact O-N 3.06Å; S389-Y392 WeakPolarHBondContact OG-CB 3.4Å; S389-Y392 PolarHBondContact OG-N 3.38Å; S389-L393 WeakPolarHBondContact O-CG 3.49Å; S389-L393 PolarHBondContact O-N 3.32Å; S389-L393 VanDerWaalsContact O-N 3.13Å
390	S	81.3	Confident	77.9	Confident	47 Å²	47	58.1 Å²	58.1	33%	0.329	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-39.7	175.1	179.2	0	0	0	0	110.9	L393 K394	S390-L393 PolarHBondContact O-N 3.47Å; S390-K394 WeakPolarHBondContact O-CG 3.36Å; S390-K394 PolarHBondContact O-N 2.72Å
391	E	86	Confident	78.7	Confident	32 Å²	32	55.2 Å²	55.2	15%	0.15	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-44.3	176.9	-66.8	67.4	-149.2	0	0	110.8	E351 V352 Y355 S389 L393 K394 V395	E351-E391 HydrophobicContact CG-CB 4.21Å; V352-E391 HydrophobicContact CG2-CG 4.35Å; Y355-E391 HydrophobicContact CD1-CB 4.27Å; Y355-E391 HydrophobicContact CD1-CG 3.91Å; Y355-E391 HydrophobicContact CD2-CB 4.06Å; Y355-E391 HydrophobicContact CE1-CG 4.48Å; Y355-E391 HydrophobicContact CG-CB 3.87Å; Y355-E391 HydrophobicContact CG-CG 3.99Å; S389-E391 PolarHBondContact O-N 2.91Å; E391-L393 VanDerWaalsContact C-N 3.33Å; E391-L393 PolarHBondContact O-N 3.35Å; E391-K394 PolarHBondContact O-N 2.98Å; E391-V395 WeakPolarHBondContact O-CB 3.48Å; E391-V395 PolarHBondContact O-N 3.27Å
392	Y	84.8	Confident	80.1	Confident	28 Å²	28	50.2 Å²	50.2	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-59.3	-43.3	174.9	-173.4	-94.4	0	0	0	111.8	E351 D381 P382 A388 S389 K394 V395	E351-Y392 WeakPolarHBondContact OE1-CA 3.41Å; E351-Y392 WeakPolarHBondContact OE1-CB 3.07Å; E351-Y392 PolarHBondContact OE1-N 2.79Å; D381-Y392 PolarHBondContact OD1-OH 3.11Å; P382-Y392 HydrophobicContact CG-CD1 4.45Å; P382-Y392 HydrophobicContact CG-CE1 4.24Å; P382-Y392 HydrophobicContact CG-CE2 4.33Å; A388-Y392 HydrophobicContact CB-CD1 3.61Å; A388-Y392 HydrophobicContact CB-CE1 4.34Å; A388-Y392 HydrophobicContact CB-CG 4.24Å; S389-Y392 WeakPolarHBondContact O-CB 3.35Å; S389-Y392 PolarHBondContact O-N 3.06Å; S389-Y392 WeakPolarHBondContact OG-CB 3.4Å; S389-Y392 PolarHBondContact OG-N 3.38Å; Y392-K394 VanDerWaalsContact C-N 3.34Å; Y392-K394 PolarHBondContact O-N 2.95Å; Y392-V395 WeakPolarHBondContact O-CG1 3.42Å
393	L	84.8	Confident	81.5	Confident	39 Å²	39	49.3 Å²	49.3	20%	0.204	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-39.4	179.6	-65.1	174.1	0	0	0	111.4	A388 S389 S390 E391 Y397 P435	A388-L393 HydrophobicContact CB-CD2 4.05Å; A388-L393 HydrophobicContact CB-CG 4.26Å; S389-L393 WeakPolarHBondContact O-CG 3.49Å; S389-L393 PolarHBondContact O-N 3.32Å; S389-L393 VanDerWaalsContact O-N 3.13Å; S390-L393 PolarHBondContact O-N 3.47Å; E391-L393 VanDerWaalsContact C-N 3.33Å; E391-L393 PolarHBondContact O-N 3.35Å; L393-Y397 WeakPolarHBondContact O-CD2 3.33Å; L393-Y397 WeakPolarHBondContact O-CE2 3.14Å; L393-P435 HydrophobicContact CD2-CB 4.09Å; L393-P435 HydrophobicContact CD2-CG 4.03Å
394	K	89.5	Confident	83.2	Confident	42 Å²	42	43.4 Å²	43.4	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-77.7	-31.1	-177.5	-71.4	179.1	176.5	-170.3	0	113.7	Y355 S390 E391 Y392 K396 Y397 L398 N433 D545	Y355-K394 HydrophobicContact CE2-CB 3.99Å; Y355-K394 WeakPolarHBondContact OH-CB 3.43Å; S390-K394 WeakPolarHBondContact O-CG 3.36Å; S390-K394 PolarHBondContact O-N 2.72Å; E391-K394 PolarHBondContact O-N 2.98Å; Y392-K394 VanDerWaalsContact C-N 3.34Å; Y392-K394 PolarHBondContact O-N 2.95Å; K394-K396 PolarHBondContact O-N 3.39Å; K394-K396 VanDerWaalsContact O-N 3.15Å; K394-Y397 PolarHBondContact O-N 3.5Å; K394-L398 PolarHBondContact O-N 3.01Å; K394-N433 WeakPolarHBondContact CG-OD1 3.44Å; K394-D545 IonicContact NZ-OD2 2.69Å; K394-D545 PolarHBondContact NZ-OD2 2.97Å
395	V	92.7	Very high	85.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-32.8	-167.5	78.2	0	0	0	0	113.6	Y355 Q374 V377 M378 E391 Y392 L398 R399	Y355-V395 HydrophobicContact CD2-CB 3.85Å; Y355-V395 HydrophobicContact CD2-CG2 3.88Å; Y355-V395 HydrophobicContact CE2-CB 3.96Å; Y355-V395 HydrophobicContact CE2-CG2 4.24Å; Q374-V395 HydrophobicContact CB-CG2 3.64Å; Q374-V395 HydrophobicContact CG-CG2 3.88Å; V377-V395 HydrophobicContact CB-CG1 4.31Å; V377-V395 HydrophobicContact CB-CG2 4.01Å; V377-V395 HydrophobicContact CG1-CB 4.25Å; V377-V395 HydrophobicContact CG1-CG1 3.95Å; V377-V395 HydrophobicContact CG1-CG2 4.27Å; V377-V395 HydrophobicContact CG2-CG2 4.42Å; M378-V395 HydrophobicContact CG-CG1 3.52Å; E391-V395 WeakPolarHBondContact O-CB 3.48Å; E391-V395 PolarHBondContact O-N 3.27Å; Y392-V395 WeakPolarHBondContact O-CG1 3.42Å; V395-L398 PolarHBondContact O-N 3.44Å; V395-R399 WeakPolarHBondContact O-CB 3.49Å; V395-R399 PolarHBondContact O-N 3.26Å
396	K	92.3	Very high	87.4	Confident	56 Å²	56	30.9 Å²	30.9	24%	0.243	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-45	176.2	-69.4	178.2	178.3	179	0	111.3	M378 K394 R399 E400 F436	M378-K396 HydrophobicContact CE-CG 3.89Å; M378-K396 HydrophobicContact CG-CG 4.13Å; M378-K396 HydrophobicContact SD-CG 3.98Å; K394-K396 PolarHBondContact O-N 3.39Å; K394-K396 VanDerWaalsContact O-N 3.15Å; K396-R399 PolarHBondContact O-N 3.49Å; K396-E400 WeakPolarHBondContact O-CG 3.46Å; K396-E400 PolarHBondContact O-N 3.02Å; K396-E400 VanDerWaalsContact O-N 3.13Å; K396-F436 HydrophobicContact CB-CB 3.95Å; K396-F436 HydrophobicContact CB-CD1 4.44Å; K396-F436 HydrophobicContact CB-CD2 3.64Å; K396-F436 HydrophobicContact CB-CE2 4.26Å; K396-F436 HydrophobicContact CB-CG 3.76Å; K396-F436 HydrophobicContact CD-CB 3.61Å; K396-F436 HydrophobicContact CD-CD1 4.17Å; K396-F436 HydrophobicContact CD-CG 3.91Å; K396-F436 HydrophobicContact CG-CB 4.39Å; K396-F436 HydrophobicContact CG-CG 4.45Å
397	Y	94.4	Very high	89.1	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-43.9	174.7	-57.7	-74.4	0	0	0	111.5	L393 K394 R399 E400 Y401 F426 H429 W430 L434 P435 F436	L393-Y397 WeakPolarHBondContact O-CD2 3.33Å; L393-Y397 WeakPolarHBondContact O-CE2 3.14Å; K394-Y397 PolarHBondContact O-N 3.5Å; Y397-R399 VanDerWaalsContact C-N 3.32Å; Y397-R399 PolarHBondContact O-N 3.26Å; Y397-E400 PolarHBondContact O-N 2.93Å; Y397-Y401 VanDerWaalsContact O-CB 3.3Å; Y397-Y401 WeakPolarHBondContact O-CB 3.08Å; Y397-Y401 PolarHBondContact O-N 2.85Å; Y397-F426 AromaticContact CD1-CD2 3.98Å; Y397-F426 HydrophobicContact CD1-CD2 3.98Å; Y397-F426 HydrophobicContact CD1-CE1 4.36Å; Y397-F426 AromaticContact CD1-CE2 3.67Å; Y397-F426 HydrophobicContact CD1-CE2 3.67Å; Y397-F426 HydrophobicContact CD1-CG 4.47Å; Y397-F426 AromaticContact CD1-CZ 3.87Å; Y397-F426 HydrophobicContact CD1-CZ 3.87Å; Y397-F426 HydrophobicContact CE1-CD2 4.38Å; Y397-F426 HydrophobicContact CE1-CE2 4.48Å; Y397-H429 HydrophobicContact CE1-CB 4.08Å; Y397-H429 WeakPolarHBondContact OH-CB 3.49Å; Y397-W430 HydrophobicContact CD1-CB 3.53Å; Y397-W430 AromaticContact CD1-CG 3.87Å; Y397-W430 HydrophobicContact CD1-CG 3.87Å; Y397-W430 AromaticContact CD2-CD1 4Å; Y397-W430 HydrophobicContact CD2-CG 4.43Å; Y397-W430 HydrophobicContact CE1-CB 3.88Å; Y397-W430 HydrophobicContact CG-CB 3.9Å; Y397-W430 AromaticContact CG-CD1 3.66Å; Y397-W430 AromaticContact CG-CG 3.77Å; Y397-W430 HydrophobicContact CG-CG 3.77Å; Y397-L434 WeakPolarHBondContact CE2-O 3.26Å; Y397-L434 PolarHBondContact OH-O 3.26Å; Y397-P435 PolarHBondContact OH-O 2.97Å; Y397-F436 AromaticContact CD1-CD2 3.65Å; Y397-F436 HydrophobicContact CD1-CD2 3.65Å; Y397-F436 AromaticContact CD1-CE2 3.81Å; Y397-F436 HydrophobicContact CD1-CE2 3.81Å; Y397-F436 HydrophobicContact CD2-CD2 4.33Å; Y397-F436 AromaticContact CE1-CD2 3.36Å; Y397-F436 HydrophobicContact CE1-CD2 3.36Å; Y397-F436 AromaticContact CE1-CE2 3.78Å; Y397-F436 HydrophobicContact CE1-CE2 3.78Å; Y397-F436 HydrophobicContact CE1-CG 4.4Å; Y397-F436 HydrophobicContact CE2-CB 4.38Å; Y397-F436 HydrophobicContact CE2-CD2 4.1Å; Y397-F436 HydrophobicContact CG-CD2 4.12Å; Y397-F436 AromaticContact CZ-CD2 3.6Å; Y397-F436 WeakPolarHBondContact OH-CA 3.43Å; Y397-F436 PolarHBondContact OH-N 2.9Å
398	L	95.5	Very high	90.8	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-40.4	179	-177.1	64	0	0	0	111.4	Y355 L359 Q374 K394 V395 Y401 S402 P544	Y355-L398 HydrophobicContact CE2-CD2 3.93Å; L359-L398 HydrophobicContact CB-CD2 3.93Å; L359-L398 HydrophobicContact CD1-CD1 3.69Å; L359-L398 HydrophobicContact CD1-CD2 3.84Å; L359-L398 HydrophobicContact CD1-CG 4.43Å; L359-L398 HydrophobicContact CG-CD2 4.45Å; Q374-L398 HydrophobicContact CG-CD2 4.26Å; K394-L398 PolarHBondContact O-N 3.01Å; V395-L398 PolarHBondContact O-N 3.44Å; L398-Y401 PolarHBondContact O-N 3.29Å; L398-S402 VanDerWaalsContact O-CB 3.28Å; L398-S402 WeakPolarHBondContact O-CB 3.39Å; L398-S402 PolarHBondContact O-N 3.2Å; L398-S402 PolarHBondContact O-OG 3.47Å; L398-P544 HydrophobicContact CD1-CB 4.43Å
399	R	95.8	Very high	92.1	Very high	38 Å²	38	19.4 Å²	19.4	14%	0.143	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-51.4	175.4	178.5	-175.9	171.3	-109.1	11.7	112.4	I371 Q374 M378 V395 K396 Y397 Y401 S402 R403 E443	I371-R399 HydrophobicContact CG2-CG 4.4Å; Q374-R399 HydrophobicContact CB-CB 4.22Å; M378-R399 HydrophobicContact SD-CB 4.35Å; M378-R399 WeakPolarHBondContact SD-CD 3.22Å; V395-R399 WeakPolarHBondContact O-CB 3.49Å; V395-R399 PolarHBondContact O-N 3.26Å; K396-R399 PolarHBondContact O-N 3.49Å; Y397-R399 VanDerWaalsContact C-N 3.32Å; Y397-R399 PolarHBondContact O-N 3.26Å; R399-Y401 VanDerWaalsContact C-N 3.32Å; R399-Y401 PolarHBondContact O-N 2.98Å; R399-S402 WeakPolarHBondContact O-CB 3.25Å; R399-S402 PolarHBondContact O-N 3.28Å; R399-R403 VanDerWaalsContact CZ-NH1 3.3Å; R399-R403 VanDerWaalsContact NH1-NH1 3.15Å; R399-R403 WeakPolarHBondContact O-CG 3.31Å; R399-R403 PolarHBondContact O-N 3.07Å; R399-E443 IonicContact CZ-OE1 3.55Å; R399-E443 IonicContact NH1-OE1 2.94Å; R399-E443 PolarHBondContact NH1-OE1 3.49Å; R399-E443 IonicContact NH2-OE1 3.13Å; R399-E443 PolarHBondContact NH2-OE1 3.29Å; R399-E443 IonicContact NH2-OE2 2.68Å
400	E	95.6	Very high	92.8	Very high	6 Å²	6	22.3 Å²	22.3	3%	0.028	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-38.4	-179.4	-65	-52	117	0	0	111.6	K396 Y397 S402 R403 Y404 F426 Y441 E443 Q444	K396-E400 WeakPolarHBondContact O-CG 3.46Å; K396-E400 PolarHBondContact O-N 3.02Å; K396-E400 VanDerWaalsContact O-N 3.13Å; Y397-E400 PolarHBondContact O-N 2.93Å; E400-S402 VanDerWaalsContact C-N 3.35Å; E400-S402 PolarHBondContact O-N 3.48Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 3.24Å; E400-R403 IonicContact OE1-CZ 3.51Å; E400-R403 IonicContact OE1-NH1 3.95Å; E400-R403 PolarHBondContact OE1-NH1 3.38Å; E400-R403 VanDerWaalsContact OE1-NH1 3.09Å; E400-R403 IonicContact OE2-NH1 3.85Å; E400-Y404 WeakPolarHBondContact O-CB 3.24Å; E400-Y404 PolarHBondContact O-N 2.96Å; E400-F426 HydrophobicContact CB-CE2 3.69Å; E400-F426 HydrophobicContact CB-CZ 4.02Å; E400-F426 HydrophobicContact CG-CE2 4.26Å; E400-Y441 WeakPolarHBondContact CB-OH 3.47Å; E400-Y441 HydrophobicContact CG-CE1 3.82Å; E400-E443 WeakPolarHBondContact OE2-CA 3.42Å; E400-Q444 HydrophobicContact CB-CG 4.12Å; E400-Q444 WeakPolarHBondContact O-CG 3.24Å; E400-Q444 PolarHBondContact OE2-N 3.43Å
401	Y	96.1	Very high	93.3	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-66.7	-35.9	173.8	-172.7	-126.4	0	0	0	112.5	Y397 L398 R399 Y404 L405 Y416 V418 L422 W430 P544	Y397-Y401 VanDerWaalsContact O-CB 3.3Å; Y397-Y401 WeakPolarHBondContact O-CB 3.08Å; Y397-Y401 PolarHBondContact O-N 2.85Å; L398-Y401 PolarHBondContact O-N 3.29Å; R399-Y401 VanDerWaalsContact C-N 3.32Å; R399-Y401 PolarHBondContact O-N 2.98Å; Y401-Y404 HydrophobicContact CD2-CD1 4.02Å; Y401-Y404 HydrophobicContact CE2-CD1 4.03Å; Y401-Y404 HydrophobicContact CE2-CE1 4.4Å; Y401-Y404 PolarHBondContact O-N 3.43Å; Y401-L405 HydrophobicContact CD1-CD1 3.93Å; Y401-L405 HydrophobicContact CD1-CG 4.46Å; Y401-L405 HydrophobicContact CD2-CG 4.42Å; Y401-L405 HydrophobicContact CE1-CD1 3.62Å; Y401-L405 HydrophobicContact CE1-CG 4.18Å; Y401-L405 HydrophobicContact CE2-CD1 4.47Å; Y401-L405 HydrophobicContact CE2-CD2 4.26Å; Y401-L405 HydrophobicContact CE2-CG 4.13Å; Y401-L405 HydrophobicContact CG-CD1 4.49Å; Y401-L405 WeakPolarHBondContact O-CB 3.32Å; Y401-L405 WeakPolarHBondContact O-CG 3.38Å; Y401-L405 PolarHBondContact O-N 3.25Å; Y401-Y416 PolarHBondContact OH-OH 2.94Å; Y401-Y416 VanDerWaalsContact OH-OH 3.07Å; Y401-V418 HydrophobicContact CE2-CG1 4.35Å; Y401-V418 HydrophobicContact CE2-CG2 4.09Å; Y401-L422 HydrophobicContact CD2-CD1 4.3Å; Y401-W430 AromaticContact CD1-CH2 3.63Å; Y401-W430 HydrophobicContact CD1-CH2 3.63Å; Y401-W430 HydrophobicContact CD1-CZ2 4.23Å; Y401-W430 AromaticContact CD2-CH2 3.97Å; Y401-W430 HydrophobicContact CD2-CH2 3.97Å; Y401-W430 HydrophobicContact CD2-CZ3 4.14Å; Y401-W430 HydrophobicContact CE1-CH2 4Å; Y401-W430 HydrophobicContact CE2-CH2 4.33Å; Y401-W430 AromaticContact CG-CH2 3.6Å; Y401-W430 HydrophobicContact CG-CH2 3.6Å; Y401-W430 HydrophobicContact CG-CZ2 4.42Å; Y401-W430 HydrophobicContact CG-CZ3 4.15Å; Y401-P544 HydrophobicContact CD1-CB 4.26Å; Y401-P544 HydrophobicContact CE1-CB 4.03Å
402	S	96.9	Very high	93.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-41.2	174.9	-58.4	0	0	0	0	111.8	V362 F367 Q374 L398 R399 E400 L405 H406	V362-S402 WeakPolarHBondContact CG2-OG 3.49Å; F367-S402 VanDerWaalsContact CD1-O 3.28Å; F367-S402 WeakPolarHBondContact CD1-O 3.28Å; Q374-S402 PolarHBondContact NE2-OG 3.12Å; Q374-S402 VanDerWaalsContact NE2-OG 3.12Å; L398-S402 VanDerWaalsContact O-CB 3.28Å; L398-S402 WeakPolarHBondContact O-CB 3.39Å; L398-S402 PolarHBondContact O-N 3.2Å; L398-S402 PolarHBondContact O-OG 3.47Å; R399-S402 WeakPolarHBondContact O-CB 3.25Å; R399-S402 PolarHBondContact O-N 3.28Å; E400-S402 VanDerWaalsContact C-N 3.35Å; E400-S402 PolarHBondContact O-N 3.48Å; S402-L405 PolarHBondContact O-N 2.89Å; S402-H406 WeakPolarHBondContact O-CB 3.41Å; S402-H406 PolarHBondContact O-N 3.01Å
403	R	96.3	Very high	93.9	Very high	25 Å²	25	23.7 Å²	23.7	9%	0.094	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-46.5	174.3	-75.7	171.5	77.1	165.4	8	111.8	I371 R399 E400 H406 S407 E443 Q444 P445	I371-R403 HydrophobicContact CD1-CG 3.66Å; I371-R403 HydrophobicContact CG1-CG 4.46Å; R399-R403 VanDerWaalsContact CZ-NH1 3.3Å; R399-R403 VanDerWaalsContact NH1-NH1 3.15Å; R399-R403 WeakPolarHBondContact O-CG 3.31Å; R399-R403 PolarHBondContact O-N 3.07Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 3.24Å; E400-R403 IonicContact OE1-CZ 3.51Å; E400-R403 IonicContact OE1-NH1 3.95Å; E400-R403 PolarHBondContact OE1-NH1 3.38Å; E400-R403 VanDerWaalsContact OE1-NH1 3.09Å; E400-R403 IonicContact OE2-NH1 3.85Å; R403-H406 PolarHBondContact O-N 3.15Å; R403-S407 PolarHBondContact O-N 3.32Å; R403-S407 PolarHBondContact O-OG 3.42Å; R403-E443 IonicContact CZ-OE2 2.92Å; R403-E443 IonicContact NH1-OE1 3.64Å; R403-E443 IonicContact NH1-OE2 2.78Å; R403-E443 PolarHBondContact NH1-OE2 2.8Å; R403-E443 IonicContact NH2-OE2 3.02Å; R403-E443 PolarHBondContact NH2-OE2 3.5Å; R403-Q444 HydrophobicContact CB-CB 3.79Å; R403-Q444 PolarHBondContact NE-O 2.68Å; R403-Q444 PolarHBondContact NH2-O 2.64Å; R403-P445 WeakPolarHBondContact CB-O 3.46Å; R403-P445 PolarHBondContact NE-O 2.94Å
404	Y	95.6	Very high	93.9	Very high	2 Å²	2	24 Å²	24	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-58.2	-50.1	174.8	170.9	-95.9	0	0	0	111.4	E400 Y401 H406 S407 H408 Y416 V418 D421 L422	E400-Y404 WeakPolarHBondContact O-CB 3.24Å; E400-Y404 PolarHBondContact O-N 2.96Å; Y401-Y404 HydrophobicContact CD2-CD1 4.02Å; Y401-Y404 HydrophobicContact CE2-CD1 4.03Å; Y401-Y404 HydrophobicContact CE2-CE1 4.4Å; Y401-Y404 PolarHBondContact O-N 3.43Å; Y404-H406 VanDerWaalsContact C-N 3.34Å; Y404-H406 PolarHBondContact O-N 2.92Å; Y404-S407 PolarHBondContact O-N 2.87Å; Y404-S407 PolarHBondContact O-OG 2.64Å; Y404-H408 AromaticContact CD2-CE1 3.57Å; Y404-H408 AromaticContact CD2-ND1 3.69Å; Y404-H408 AromaticContact CE2-CE1 3.23Å; Y404-H408 WeakPolarHBondContact CE2-CE1 3.23Å; Y404-H408 AromaticContact CE2-ND1 3.53Å; Y404-H408 AromaticContact CE2-NE2 3.82Å; Y404-H408 AromaticContact CZ-CE1 3.94Å; Y404-H408 AromaticContact CZ-ND1 3.92Å; Y404-H408 PolarHBondContact O-N 2.78Å; Y404-H408 PolarHBondContact O-ND1 3.37Å; Y404-Y416 HydrophobicContact CE1-CD2 4.07Å; Y404-Y416 AromaticContact CE1-CE2 3.62Å; Y404-Y416 HydrophobicContact CE1-CE2 3.62Å; Y404-V418 HydrophobicContact CE1-CG2 3.77Å; Y404-D421 HydrophobicContact CE2-CB 3.6Å; Y404-D421 PolarHBondContact OH-OD2 2.81Å; Y404-L422 HydrophobicContact CD2-CD2 3.89Å; Y404-L422 HydrophobicContact CE2-CD2 4.41Å; Y404-L422 HydrophobicContact CG-CD2 3.97Å
405	L	95.5	Very high	93.8	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-41.1	176.8	-74.5	175.1	0	0	0	112.7	V362 F367 Y401 S402 H408 L409 Y416 P544	V362-L405 HydrophobicContact CG1-CD1 4.44Å; F367-L405 HydrophobicContact CE1-CB 3.56Å; F367-L405 HydrophobicContact CE1-CD1 4.31Å; F367-L405 HydrophobicContact CZ-CB 3.86Å; Y401-L405 HydrophobicContact CD1-CD1 3.93Å; Y401-L405 HydrophobicContact CD1-CG 4.46Å; Y401-L405 HydrophobicContact CD2-CG 4.42Å; Y401-L405 HydrophobicContact CE1-CD1 3.62Å; Y401-L405 HydrophobicContact CE1-CG 4.18Å; Y401-L405 HydrophobicContact CE2-CD1 4.47Å; Y401-L405 HydrophobicContact CE2-CD2 4.26Å; Y401-L405 HydrophobicContact CE2-CG 4.13Å; Y401-L405 HydrophobicContact CG-CD1 4.49Å; Y401-L405 WeakPolarHBondContact O-CB 3.32Å; Y401-L405 WeakPolarHBondContact O-CG 3.38Å; Y401-L405 PolarHBondContact O-N 3.25Å; S402-L405 PolarHBondContact O-N 2.89Å; L405-H408 CarbonylContact O-C 3.57Å; L405-H408 PolarHBondContact O-N 2.82Å; L405-L409 PolarHBondContact O-N 3.27Å; L405-L409 VanDerWaalsContact O-N 3.1Å; L405-Y416 HydrophobicContact CD2-CE2 4Å; L405-P544 HydrophobicContact CD1-CB 4.44Å
406	H	96.8	Very high	93.6	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.019	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-48	175.7	179.8	-98.5	0	0	0	111.4	F367 S402 R403 Y404 H408 L409 L447 Q448 I451	F367-H406 HydrophobicContact CB-CB 4.08Å; F367-H406 HydrophobicContact CD1-CB 4.1Å; F367-H406 HydrophobicContact CD2-CB 4.16Å; F367-H406 AromaticContact CD2-CD2 3.83Å; F367-H406 HydrophobicContact CG-CB 3.84Å; F367-H406 AromaticContact CG-CD2 4Å; S402-H406 WeakPolarHBondContact O-CB 3.41Å; S402-H406 PolarHBondContact O-N 3.01Å; R403-H406 PolarHBondContact O-N 3.15Å; Y404-H406 VanDerWaalsContact C-N 3.34Å; Y404-H406 PolarHBondContact O-N 2.92Å; H406-H408 PolarHBondContact O-N 3.47Å; H406-H408 VanDerWaalsContact O-N 3.16Å; H406-L409 VanDerWaalsContact O-CB 3.24Å; H406-L409 WeakPolarHBondContact O-CB 3.46Å; H406-L409 PolarHBondContact O-N 3.31Å; H406-L409 VanDerWaalsContact O-N 3.14Å; H406-L447 HydrophobicContact CB-CD2 4.06Å; H406-L447 VanDerWaalsContact CG-CD2 3.44Å; H406-Q448 PolarHBondContact CE1-N 3.5Å; H406-I451 PolarHBondContact NE2-O 3.37Å
407	S	95.4	Very high	93.5	Very high	19 Å²	19	27.1 Å²	27.1	13%	0.133	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-21.9	179.3	65.8	0	0	0	0	114.2	R403 Y404	R403-S407 PolarHBondContact O-N 3.32Å; R403-S407 PolarHBondContact O-OG 3.42Å; Y404-S407 PolarHBondContact O-N 2.87Å; Y404-S407 PolarHBondContact O-OG 2.64Å
408	H	94.9	Very high	93.4	Very high	38 Å²	38	27.1 Å²	27.1	18%	0.176	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	7.1	179.2	-65.5	76.7	0	0	0	113.6	Y404 L405 H406 D410 I411 I807	Y404-H408 AromaticContact CD2-CE1 3.57Å; Y404-H408 AromaticContact CD2-ND1 3.69Å; Y404-H408 AromaticContact CE2-CE1 3.23Å; Y404-H408 WeakPolarHBondContact CE2-CE1 3.23Å; Y404-H408 AromaticContact CE2-ND1 3.53Å; Y404-H408 AromaticContact CE2-NE2 3.82Å; Y404-H408 AromaticContact CZ-CE1 3.94Å; Y404-H408 AromaticContact CZ-ND1 3.92Å; Y404-H408 PolarHBondContact O-N 2.78Å; Y404-H408 PolarHBondContact O-ND1 3.37Å; L405-H408 CarbonylContact O-C 3.57Å; L405-H408 PolarHBondContact O-N 2.82Å; H406-H408 PolarHBondContact O-N 3.47Å; H406-H408 VanDerWaalsContact O-N 3.16Å; H408-D410 VanDerWaalsContact C-N 3.31Å; H408-D410 PolarHBondContact O-N 3.37Å; H408-I411 HydrophobicContact CB-CD1 4.41Å; H408-I411 PolarHBondContact O-N 3.44Å; H408-I807 HydrophobicContact CB-CD1 3.75Å; H408-I807 WeakPolarHBondContact O-CD1 3.37Å
409	L	95.4	Very high	93.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-40.5	-168.6	-170.9	58.7	0	0	0	113.1	F367 L405 H406 I451 K452 V454 I807 R808 I811	F367-L409 HydrophobicContact CD2-CD2 4.23Å; F367-L409 HydrophobicContact CE2-CD1 3.83Å; F367-L409 HydrophobicContact CE2-CD2 3.85Å; F367-L409 HydrophobicContact CE2-CG 4.4Å; F367-L409 HydrophobicContact CZ-CD1 4.32Å; L405-L409 PolarHBondContact O-N 3.27Å; L405-L409 VanDerWaalsContact O-N 3.1Å; H406-L409 VanDerWaalsContact O-CB 3.24Å; H406-L409 WeakPolarHBondContact O-CB 3.46Å; H406-L409 PolarHBondContact O-N 3.31Å; H406-L409 VanDerWaalsContact O-N 3.14Å; L409-I451 HydrophobicContact CB-CG2 3.94Å; L409-I451 HydrophobicContact CD2-CG2 4.01Å; L409-K452 WeakPolarHBondContact CD2-O 3.06Å; L409-V454 HydrophobicContact CD1-CG2 3.75Å; L409-V454 HydrophobicContact CD2-CG2 3.96Å; L409-V454 HydrophobicContact CG-CG2 4.34Å; L409-I807 HydrophobicContact CD1-CB 4.46Å; L409-I807 HydrophobicContact CD1-CG2 4.16Å; L409-I807 PolarHBondContact O-N 3.31Å; L409-R808 HydrophobicContact CD1-CB 4.03Å; L409-R808 VanDerWaalsContact CD2-NH2 3.33Å; L409-R808 HydrophobicContact CG-CB 4.04Å; L409-R808 WeakPolarHBondContact O-CB 3.37Å; L409-R808 PolarHBondContact O-N 3.08Å; L409-I811 HydrophobicContact CD1-CD1 4.06Å
410	D	94.1	Very high	92.9	Very high	81 Å²	81	32.3 Å²	32.3	43%	0.433	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	6.2	-177.4	-64.7	-46.2	0	0	0	113.4	H408 R808	H408-D410 VanDerWaalsContact C-N 3.31Å; H408-D410 PolarHBondContact O-N 3.37Å; D410-R808 VanDerWaalsContact CG-NH2 3.33Å; D410-R808 IonicContact OD1-CZ 3.91Å; D410-R808 VanDerWaalsContact OD1-CZ 3.25Å; D410-R808 IonicContact OD1-NE 3.25Å; D410-R808 PolarHBondContact OD1-NE 3.4Å; D410-R808 IonicContact OD1-NH2 2.92Å; D410-R808 PolarHBondContact OD1-NH2 3.35Å; D410-R808 IonicContact OD2-CZ 3.54Å; D410-R808 IonicContact OD2-NH2 2.62Å; D410-R808 PolarHBondContact OD2-NH2 3.15Å
411	I	91.9	Very high	92.7	Very high	53 Å²	53	35.2 Å²	35.2	27%	0.272	19%	0.187	S	C	.	.	S	Bend	trans	-86	144.1	178.1	-58.3	-176.1	0	0	0	109.1	H408 V413 E415	H408-I411 HydrophobicContact CB-CD1 4.41Å; H408-I411 PolarHBondContact O-N 3.44Å; I411-V413 PolarHBondContact O-N 3.03Å; I411-E415 HydrophobicContact CG2-CB 3.86Å
412	P	92.6	Very high	92.5	Very high	63 Å²	63	35.3 Å²	35.3	41%	0.409	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-54	135.5	174.1	-26.9	35.6	0	0	0	112.7	A414 E415 P805	P412-A414 PolarHBondContact O-N 3.44Å; P412-E415 PolarHBondContact O-N 2.82Å; P412-P805 CarbonylContact C-O 3.57Å; P412-P805 WeakPolarHBondContact CA-O 3.45Å
413	V	90.7	Very high	92.3	Very high	19 Å²	19	37.8 Å²	37.8	12%	0.115	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.2	-179.9	175.3	0	0	0	0	112.6	I411 E415 Y416 K537 P805 S806 M810	I411-V413 PolarHBondContact O-N 3.03Å; V413-E415 PolarHBondContact O-N 3.37Å; V413-Y416 PolarHBondContact O-N 2.84Å; V413-K537 HydrophobicContact CG1-CD 3.92Å; V413-K537 PolarHBondContact O-NZ 3.21Å; V413-P805 WeakPolarHBondContact CG2-O 3.44Å; V413-P805 PolarHBondContact N-O 3.24Å; V413-S806 VanDerWaalsContact CG2-C 3.44Å; V413-M810 HydrophobicContact CB-SD 4.32Å; V413-M810 HydrophobicContact CG1-SD 3.89Å; V413-M810 HydrophobicContact CG2-CG 4.25Å; V413-M810 HydrophobicContact CG2-SD 3.39Å; V413-M810 WeakPolarHBondContact CG2-SD 3.26Å
414	A	84.4	Confident	92	Very high	47 Å²	47	38 Å²	38	39%	0.388	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.6	173.9	0	0	0	0	0	113.5	P412	P412-A414 PolarHBondContact O-N 3.44Å
415	E	87.1	Confident	91.7	Very high	128 Å²	128	42.2 Å²	42.2	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-17	-179.4	-64.7	174.7	-145	0	0	112.4	I411 P412 V413 N417	I411-E415 HydrophobicContact CG2-CB 3.86Å; P412-E415 PolarHBondContact O-N 2.82Å; V413-E415 PolarHBondContact O-N 3.37Å; E415-N417 PolarHBondContact O-N 3.2Å
416	Y	89.1	Confident	91.6	Very high	3 Å²	3	42 Å²	42	1%	0.012	24%	0.235	C	C	.	.			trans	-67.1	114.8	176.5	171.7	-105.8	0	0	0	112.4	Y401 Y404 L405 V413 V418 K537 I541 I807	Y401-Y416 PolarHBondContact OH-OH 2.94Å; Y401-Y416 VanDerWaalsContact OH-OH 3.07Å; Y404-Y416 HydrophobicContact CE1-CD2 4.07Å; Y404-Y416 AromaticContact CE1-CE2 3.62Å; Y404-Y416 HydrophobicContact CE1-CE2 3.62Å; L405-Y416 HydrophobicContact CD2-CE2 4Å; V413-Y416 PolarHBondContact O-N 2.84Å; Y416-V418 HydrophobicContact CD2-CG2 4.48Å; Y416-V418 HydrophobicContact CE1-CG2 4.07Å; Y416-V418 HydrophobicContact CE2-CG2 3.64Å; Y416-V418 VanDerWaalsContact OH-CG2 3.22Å; Y416-V418 WeakPolarHBondContact OH-CG2 3.4Å; Y416-K537 HydrophobicContact CD1-CD 4.39Å; Y416-K537 HydrophobicContact CD1-CG 4.07Å; Y416-K537 HydrophobicContact CE1-CG 4.24Å; Y416-I541 HydrophobicContact CE1-CD1 4.49Å; Y416-I807 HydrophobicContact CD2-CD1 3.36Å; Y416-I807 HydrophobicContact CD2-CG1 4.39Å; Y416-I807 HydrophobicContact CE2-CD1 3.71Å; Y416-I807 HydrophobicContact CG-CD1 3.92Å
417	N	90.1	Very high	91.3	Very high	31 Å²	31	42.1 Å²	42.1	17%	0.166	24%	0.236	C	C	.	.			trans	-146.3	79.2	179.7	-167	-8.4	0	0	0	114.3	E415 D419 Q420 D421	E415-N417 PolarHBondContact O-N 3.2Å; N417-D419 PolarHBondContact O-N 2.7Å; N417-D419 PolarHBondContact OD1-N 2.96Å; N417-Q420 HydrophobicContact CB-CB 4.44Å; N417-Q420 WeakPolarHBondContact ND2-CG 3.48Å; N417-Q420 PolarHBondContact ND2-OE1 2.98Å; N417-Q420 VanDerWaalsContact ND2-OE1 3.14Å; N417-Q420 PolarHBondContact O-N 3.35Å; N417-D421 WeakPolarHBondContact CA-OD2 3.35Å; N417-D421 PolarHBondContact N-OD2 3.35Å; N417-D421 VanDerWaalsContact N-OD2 3.13Å; N417-D421 WeakPolarHBondContact O-CB 3.22Å; N417-D421 PolarHBondContact O-N 2.82Å
418	V	91.3	Very high	91	Very high	1 Å²	1	42 Å²	42	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-48.7	-35.8	178.1	-178	0	0	0	0	114.1	Y401 Y404 Y416 Q420 L422 L549	Y401-V418 HydrophobicContact CE2-CG1 4.35Å; Y401-V418 HydrophobicContact CE2-CG2 4.09Å; Y404-V418 HydrophobicContact CE1-CG2 3.77Å; Y416-V418 HydrophobicContact CD2-CG2 4.48Å; Y416-V418 HydrophobicContact CE1-CG2 4.07Å; Y416-V418 HydrophobicContact CE2-CG2 3.64Å; Y416-V418 VanDerWaalsContact OH-CG2 3.22Å; Y416-V418 WeakPolarHBondContact OH-CG2 3.4Å; V418-Q420 VanDerWaalsContact C-N 3.32Å; V418-Q420 PolarHBondContact O-N 3.28Å; V418-L422 HydrophobicContact CG1-CD1 3.52Å; V418-L422 HydrophobicContact CG1-CG 4.03Å; V418-L422 WeakPolarHBondContact O-CB 3.34Å; V418-L422 PolarHBondContact O-N 2.63Å; V418-L549 HydrophobicContact CG1-CD2 3.71Å
419	D	90.4	Very high	90.8	Very high	7 Å²	7	42 Å²	42	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-72.5	-26.1	-177.6	-54	-80.7	0	0	0	112.9	N417 K427 R540 W550 Q553	N417-D419 PolarHBondContact O-N 2.7Å; N417-D419 PolarHBondContact OD1-N 2.96Å; D419-K427 PolarHBondContact O-NZ 2.88Å; D419-R540 IonicContact OD1-NH2 3.88Å; D419-R540 PolarHBondContact OD1-NH2 3.39Å; D419-R540 IonicContact OD2-CZ 3.71Å; D419-R540 IonicContact OD2-NH1 3.09Å; D419-R540 PolarHBondContact OD2-NH1 3.33Å; D419-R540 IonicContact OD2-NH2 3.9Å; D419-R540 PolarHBondContact OD2-NH2 3.48Å; D419-W550 PolarHBondContact OD1-N 3.21Å; D419-Q553 HydrophobicContact CB-CB 4.41Å
420	Q	89.9	Confident	90.5	Very high	141 Å²	141	42.8 Å²	42.8	66%	0.659	24%	0.237	S	C	*	.	H	α-helix	trans	-94.2	-37.3	175.7	-70	-178.4	-4.6	0	0	111.8	N417 V418	N417-Q420 HydrophobicContact CB-CB 4.44Å; N417-Q420 WeakPolarHBondContact ND2-CG 3.48Å; N417-Q420 PolarHBondContact ND2-OE1 2.98Å; N417-Q420 VanDerWaalsContact ND2-OE1 3.14Å; N417-Q420 PolarHBondContact O-N 3.35Å; V418-Q420 VanDerWaalsContact C-N 3.32Å; V418-Q420 PolarHBondContact O-N 3.28Å
421	D	91.9	Very high	90.3	Very high	68 Å²	68	39.1 Å²	39.1	36%	0.364	22%	0.218	S	C	.	.	H	α-helix	trans	-79.1	-32.2	-169.4	-56.3	-27.5	0	0	0	112.3	Y404 N417	Y404-D421 HydrophobicContact CE2-CB 3.6Å; Y404-D421 PolarHBondContact OH-OD2 2.81Å; N417-D421 WeakPolarHBondContact CA-OD2 3.35Å; N417-D421 PolarHBondContact N-OD2 3.35Å; N417-D421 VanDerWaalsContact N-OD2 3.13Å; N417-D421 WeakPolarHBondContact O-CB 3.22Å; N417-D421 PolarHBondContact O-N 2.82Å
422	L	92.6	Very high	90	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	22%	0.221	C	C	.	.	S	Bend	trans	-89.6	140.9	-179.8	-63.2	-173.2	0	0	0	113.2	Y401 Y404 V418 F426 K427 W430	Y401-L422 HydrophobicContact CD2-CD1 4.3Å; Y404-L422 HydrophobicContact CD2-CD2 3.89Å; Y404-L422 HydrophobicContact CE2-CD2 4.41Å; Y404-L422 HydrophobicContact CG-CD2 3.97Å; V418-L422 HydrophobicContact CG1-CD1 3.52Å; V418-L422 HydrophobicContact CG1-CG 4.03Å; V418-L422 WeakPolarHBondContact O-CB 3.34Å; V418-L422 PolarHBondContact O-N 2.63Å; L422-F426 HydrophobicContact CB-CD1 4.36Å; L422-F426 HydrophobicContact CD1-CD1 4.03Å; L422-F426 HydrophobicContact CD1-CE1 3.73Å; L422-K427 HydrophobicContact CB-CD 4.32Å; L422-K427 HydrophobicContact CB-CG 4.02Å; L422-K427 WeakPolarHBondContact O-CE 3.45Å; L422-W430 HydrophobicContact CD1-CZ3 4.41Å
423	P	92.3	Very high	89.6	Confident	53 Å²	53	39 Å²	39	34%	0.344	21%	0.21	S	C	.	.			trans	-56.1	141.9	179	-26.9	35.2	0	0	0	113.7	N425 F426 K427 Y441	P423-N425 PolarHBondContact O-N 3.1Å; P423-F426 HydrophobicContact CB-CB 4.12Å; P423-F426 WeakPolarHBondContact O-CB 3.17Å; P423-F426 PolarHBondContact O-N 3.08Å; P423-F426 VanDerWaalsContact O-N 3.16Å; P423-K427 PolarHBondContact O-N 3.33Å; P423-Y441 HydrophobicContact CG-CE2 4.02Å
424	G	89.9	Confident	89.4	Confident	29 Å²	29	41.3 Å²	41.3	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-58.5	-42.5	-177.4	0	0	0	0	0	114.4	K427 N428 P555	G424-K427 PolarHBondContact O-N 3.38Å; G424-N428 WeakPolarHBondContact O-CB 3.33Å; G424-N428 PolarHBondContact O-N 3.21Å; G424-P555 VanDerWaalsContact C-CG 3.42Å; G424-P555 WeakPolarHBondContact O-CD 3.32Å; G424-P555 WeakPolarHBondContact O-CG 3.04Å
425	N	89.4	Confident	89.5	Confident	91 Å²	91	41.9 Å²	41.9	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-66.5	-39	177.6	-73.2	-19.9	0	0	0	111.9	P423 N428 H429 I438	P423-N425 PolarHBondContact O-N 3.1Å; N425-N428 PolarHBondContact O-N 2.73Å; N425-H429 PolarHBondContact O-CD2 2.94Å; N425-H429 PolarHBondContact O-N 2.9Å; N425-I438 HydrophobicContact CB-CG2 4.14Å
426	F	92.5	Very high	89.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-53.2	174.1	177.8	-82.9	0	0	0	110.8	Y397 E400 L422 P423 N428 H429 W430 F436 I438 Y441	Y397-F426 AromaticContact CD1-CD2 3.98Å; Y397-F426 HydrophobicContact CD1-CD2 3.98Å; Y397-F426 HydrophobicContact CD1-CE1 4.36Å; Y397-F426 AromaticContact CD1-CE2 3.67Å; Y397-F426 HydrophobicContact CD1-CE2 3.67Å; Y397-F426 HydrophobicContact CD1-CG 4.47Å; Y397-F426 AromaticContact CD1-CZ 3.87Å; Y397-F426 HydrophobicContact CD1-CZ 3.87Å; Y397-F426 HydrophobicContact CE1-CD2 4.38Å; Y397-F426 HydrophobicContact CE1-CE2 4.48Å; E400-F426 HydrophobicContact CB-CE2 3.69Å; E400-F426 HydrophobicContact CB-CZ 4.02Å; E400-F426 HydrophobicContact CG-CE2 4.26Å; L422-F426 HydrophobicContact CB-CD1 4.36Å; L422-F426 HydrophobicContact CD1-CD1 4.03Å; L422-F426 HydrophobicContact CD1-CE1 3.73Å; P423-F426 HydrophobicContact CB-CB 4.12Å; P423-F426 WeakPolarHBondContact O-CB 3.17Å; P423-F426 PolarHBondContact O-N 3.08Å; P423-F426 VanDerWaalsContact O-N 3.16Å; F426-N428 PolarHBondContact O-N 2.87Å; F426-H429 PolarHBondContact O-N 3.1Å; F426-W430 HydrophobicContact CD1-CE3 4.3Å; F426-W430 HydrophobicContact CE1-CD2 4.22Å; F426-W430 AromaticContact CE1-CE3 3.52Å; F426-W430 HydrophobicContact CE1-CE3 3.52Å; F426-W430 HydrophobicContact CE1-CZ3 4.06Å; F426-W430 HydrophobicContact CZ-CE3 4.3Å; F426-W430 VanDerWaalsContact O-CB 3.27Å; F426-W430 WeakPolarHBondContact O-CB 3.3Å; F426-W430 PolarHBondContact O-N 3.22Å; F426-F436 AromaticContact CD2-CE2 3.74Å; F426-F436 HydrophobicContact CD2-CE2 3.74Å; F426-F436 HydrophobicContact CD2-CZ 4.21Å; F426-F436 AromaticContact CE2-CE2 3.75Å; F426-F436 HydrophobicContact CE2-CE2 3.75Å; F426-F436 HydrophobicContact CE2-CZ 4.42Å; F426-I438 HydrophobicContact CB-CD1 4.13Å; F426-I438 HydrophobicContact CD2-CD1 4.49Å; F426-Y441 HydrophobicContact CB-CE2 4.03Å; F426-Y441 AromaticContact CD2-CE2 3.58Å; F426-Y441 HydrophobicContact CD2-CE2 3.58Å; F426-Y441 AromaticContact CD2-CZ 3.73Å; F426-Y441 WeakPolarHBondContact CD2-OH 3.37Å; F426-Y441 HydrophobicContact CE2-CE2 4.43Å; F426-Y441 HydrophobicContact CG-CE2 4.15Å
427	K	91.7	Very high	89.4	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.035	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-45.9	178.2	-70.2	-172.3	-60.4	167.9	0	112.5	D419 L422 P423 G424 A431 L549 Q553 M554	D419-K427 PolarHBondContact O-NZ 2.88Å; L422-K427 HydrophobicContact CB-CD 4.32Å; L422-K427 HydrophobicContact CB-CG 4.02Å; L422-K427 WeakPolarHBondContact O-CE 3.45Å; P423-K427 PolarHBondContact O-N 3.33Å; G424-K427 PolarHBondContact O-N 3.38Å; K427-A431 VanDerWaalsContact O-CB 3.3Å; K427-A431 WeakPolarHBondContact O-CB 3.39Å; K427-A431 PolarHBondContact O-N 3.31Å; K427-L549 HydrophobicContact CB-CD1 3.87Å; K427-L549 HydrophobicContact CD-CD1 4.48Å; K427-L549 HydrophobicContact CD-CD2 4.36Å; K427-L549 HydrophobicContact CG-CD1 4.04Å; K427-Q553 PolarHBondContact NZ-O 2.62Å; K427-M554 HydrophobicContact CB-CE 4.12Å; K427-M554 HydrophobicContact CB-SD 3.76Å
428	N	89	Confident	89.4	Confident	16 Å²	16	44 Å²	44	9%	0.086	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-45.7	-179.2	173.9	54.9	0	0	0	112.5	G424 N425 F426 K432 S558	G424-N428 WeakPolarHBondContact O-CB 3.33Å; G424-N428 PolarHBondContact O-N 3.21Å; N425-N428 PolarHBondContact O-N 2.73Å; F426-N428 PolarHBondContact O-N 2.87Å; N428-K432 WeakPolarHBondContact O-CB 3.42Å; N428-K432 WeakPolarHBondContact O-CG 3.23Å; N428-K432 PolarHBondContact O-N 3.45Å; N428-K432 WeakPolarHBondContact OD1-CD 3.49Å; N428-K432 VanDerWaalsContact OD1-CE 3.23Å; N428-K432 WeakPolarHBondContact OD1-CE 3.35Å; N428-K432 PolarHBondContact OD1-NZ 2.93Å; N428-S558 PolarHBondContact ND2-OG 3.08Å; N428-S558 WeakPolarHBondContact OD1-CB 3.42Å; N428-S558 PolarHBondContact OD1-OG 3.12Å
429	H	89.8	Confident	89.1	Confident	39 Å²	39	52.3 Å²	52.3	18%	0.181	27%	0.273	C	S	.	.	H	α-helix	trans	-70.1	-40.3	-179.8	-73.5	-134.1	0	0	0	111.5	Y397 N425 F426 K432 N433 L434 P435	Y397-H429 HydrophobicContact CE1-CB 4.08Å; Y397-H429 WeakPolarHBondContact OH-CB 3.49Å; N425-H429 PolarHBondContact O-CD2 2.94Å; N425-H429 PolarHBondContact O-N 2.9Å; F426-H429 PolarHBondContact O-N 3.1Å; H429-K432 CarbonylContact O-C 3.6Å; H429-K432 PolarHBondContact O-N 3Å; H429-N433 PolarHBondContact O-N 3.27Å; H429-L434 HydrophobicContact CB-CB 4.07Å; H429-L434 PolarHBondContact O-N 3.5Å; H429-P435 PolarHBondContact ND1-O 3.19Å
430	W	90.3	Very high	88.9	Confident	15 Å²	15	59.8 Å²	59.8	6%	0.057	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177.8	-171.9	18.7	0	0	0	111.9	Y397 Y401 L422 F426 K432 N433 P547 L549	Y397-W430 HydrophobicContact CD1-CB 3.53Å; Y397-W430 AromaticContact CD1-CG 3.87Å; Y397-W430 HydrophobicContact CD1-CG 3.87Å; Y397-W430 AromaticContact CD2-CD1 4Å; Y397-W430 HydrophobicContact CD2-CG 4.43Å; Y397-W430 HydrophobicContact CE1-CB 3.88Å; Y397-W430 HydrophobicContact CG-CB 3.9Å; Y397-W430 AromaticContact CG-CD1 3.66Å; Y397-W430 AromaticContact CG-CG 3.77Å; Y397-W430 HydrophobicContact CG-CG 3.77Å; Y401-W430 AromaticContact CD1-CH2 3.63Å; Y401-W430 HydrophobicContact CD1-CH2 3.63Å; Y401-W430 HydrophobicContact CD1-CZ2 4.23Å; Y401-W430 AromaticContact CD2-CH2 3.97Å; Y401-W430 HydrophobicContact CD2-CH2 3.97Å; Y401-W430 HydrophobicContact CD2-CZ3 4.14Å; Y401-W430 HydrophobicContact CE1-CH2 4Å; Y401-W430 HydrophobicContact CE2-CH2 4.33Å; Y401-W430 AromaticContact CG-CH2 3.6Å; Y401-W430 HydrophobicContact CG-CH2 3.6Å; Y401-W430 HydrophobicContact CG-CZ2 4.42Å; Y401-W430 HydrophobicContact CG-CZ3 4.15Å; L422-W430 HydrophobicContact CD1-CZ3 4.41Å; F426-W430 HydrophobicContact CD1-CE3 4.3Å; F426-W430 HydrophobicContact CE1-CD2 4.22Å; F426-W430 AromaticContact CE1-CE3 3.52Å; F426-W430 HydrophobicContact CE1-CE3 3.52Å; F426-W430 HydrophobicContact CE1-CZ3 4.06Å; F426-W430 HydrophobicContact CZ-CE3 4.3Å; F426-W430 VanDerWaalsContact O-CB 3.27Å; F426-W430 WeakPolarHBondContact O-CB 3.3Å; F426-W430 PolarHBondContact O-N 3.22Å; W430-K432 PolarHBondContact O-N 3.15Å; W430-N433 PolarHBondContact O-N 3.43Å; W430-N433 VanDerWaalsContact O-N 3.1Å; W430-P547 HydrophobicContact CD2-CB 3.55Å; W430-P547 HydrophobicContact CD2-CG 4Å; W430-P547 HydrophobicContact CE3-CB 3.73Å; W430-P547 HydrophobicContact CG-CB 4.02Å; W430-P547 HydrophobicContact CG-CG 4.03Å; W430-P547 HydrophobicContact CH2-CB 4.12Å; W430-P547 HydrophobicContact CZ2-CB 3.96Å; W430-P547 HydrophobicContact CZ2-CG 4.44Å; W430-P547 HydrophobicContact CZ3-CB 4.01Å; W430-L549 HydrophobicContact CE3-CD1 4.49Å
431	A	88.8	Confident	89	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-26.9	178.8	0	0	0	0	0	113.4	K427 M554 F563	K427-A431 VanDerWaalsContact O-CB 3.3Å; K427-A431 WeakPolarHBondContact O-CB 3.39Å; K427-A431 PolarHBondContact O-N 3.31Å; A431-M554 HydrophobicContact CB-CE 4.13Å; A431-F563 HydrophobicContact CB-CE2 4.12Å; A431-F563 HydrophobicContact CB-CZ 4.24Å
432	K	85.5	Confident	89	Confident	77 Å²	77	59.5 Å²	59.5	34%	0.335	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	0.3	179.1	-70	174.7	176.2	164.9	0	113.9	N428 H429 W430 L434 F563	N428-K432 WeakPolarHBondContact O-CB 3.42Å; N428-K432 WeakPolarHBondContact O-CG 3.23Å; N428-K432 PolarHBondContact O-N 3.45Å; N428-K432 WeakPolarHBondContact OD1-CD 3.49Å; N428-K432 VanDerWaalsContact OD1-CE 3.23Å; N428-K432 WeakPolarHBondContact OD1-CE 3.35Å; N428-K432 PolarHBondContact OD1-NZ 2.93Å; H429-K432 CarbonylContact O-C 3.6Å; H429-K432 PolarHBondContact O-N 3Å; W430-K432 PolarHBondContact O-N 3.15Å; K432-L434 VanDerWaalsContact C-N 3.25Å; K432-L434 HydrophobicContact CB-CD1 4Å; K432-L434 HydrophobicContact CB-CD2 4.46Å; K432-L434 HydrophobicContact CB-CG 3.73Å; K432-L434 HydrophobicContact CD-CD1 4.2Å; K432-L434 PolarHBondContact O-N 3.42Å; K432-F563 HydrophobicContact CG-CE2 3.94Å
433	N	85.3	Confident	89	Confident	36 Å²	36	64.6 Å²	64.6	19%	0.193	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	40.4	-174.1	-159.9	39.2	0	0	0	113.2	K394 H429 W430	K394-N433 WeakPolarHBondContact CG-OD1 3.44Å; H429-N433 PolarHBondContact O-N 3.27Å; W430-N433 PolarHBondContact O-N 3.43Å; W430-N433 VanDerWaalsContact O-N 3.1Å
434	L	86.6	Confident	89.1	Confident	68 Å²	68	63.2 Å²	63.2	36%	0.356	32%	0.321	S	S	.	.			trans	-84.5	154.4	178.9	-63.5	176.7	0	0	0	111.1	Y397 H429 K432 F436	Y397-L434 WeakPolarHBondContact CE2-O 3.26Å; Y397-L434 PolarHBondContact OH-O 3.26Å; H429-L434 HydrophobicContact CB-CB 4.07Å; H429-L434 PolarHBondContact O-N 3.5Å; K432-L434 VanDerWaalsContact C-N 3.25Å; K432-L434 HydrophobicContact CB-CD1 4Å; K432-L434 HydrophobicContact CB-CD2 4.46Å; K432-L434 HydrophobicContact CB-CG 3.73Å; K432-L434 HydrophobicContact CD-CD1 4.2Å; K432-L434 PolarHBondContact O-N 3.42Å; L434-F436 PolarHBondContact O-N 3.04Å
435	P	86.5	Confident	89.2	Confident	60 Å²	60	65 Å²	65	39%	0.39	33%	0.327	S	S	.	.			trans	-51.3	141.2	170.6	-26	34.5	0	0	0	112.3	L393 Y397 H429 L437	L393-P435 HydrophobicContact CD2-CB 4.09Å; L393-P435 HydrophobicContact CD2-CG 4.03Å; Y397-P435 PolarHBondContact OH-O 2.97Å; H429-P435 PolarHBondContact ND1-O 3.19Å; P435-L437 HydrophobicContact CB-CD1 4Å; P435-L437 HydrophobicContact CB-CG 3.99Å; P435-L437 PolarHBondContact O-N 3.46Å
436	F	87.6	Confident	89.3	Confident	38 Å²	38	61.9 Å²	61.9	17%	0.167	32%	0.317	C	S	.	.			trans	-73.7	77.2	176.5	-161.5	-78.2	0	0	0	109.9	K396 Y397 F426 L434 I438 Y441	K396-F436 HydrophobicContact CB-CB 3.95Å; K396-F436 HydrophobicContact CB-CD1 4.44Å; K396-F436 HydrophobicContact CB-CD2 3.64Å; K396-F436 HydrophobicContact CB-CE2 4.26Å; K396-F436 HydrophobicContact CB-CG 3.76Å; K396-F436 HydrophobicContact CD-CB 3.61Å; K396-F436 HydrophobicContact CD-CD1 4.17Å; K396-F436 HydrophobicContact CD-CG 3.91Å; K396-F436 HydrophobicContact CG-CB 4.39Å; K396-F436 HydrophobicContact CG-CG 4.45Å; Y397-F436 AromaticContact CD1-CD2 3.65Å; Y397-F436 HydrophobicContact CD1-CD2 3.65Å; Y397-F436 AromaticContact CD1-CE2 3.81Å; Y397-F436 HydrophobicContact CD1-CE2 3.81Å; Y397-F436 HydrophobicContact CD2-CD2 4.33Å; Y397-F436 AromaticContact CE1-CD2 3.36Å; Y397-F436 HydrophobicContact CE1-CD2 3.36Å; Y397-F436 AromaticContact CE1-CE2 3.78Å; Y397-F436 HydrophobicContact CE1-CE2 3.78Å; Y397-F436 HydrophobicContact CE1-CG 4.4Å; Y397-F436 HydrophobicContact CE2-CB 4.38Å; Y397-F436 HydrophobicContact CE2-CD2 4.1Å; Y397-F436 HydrophobicContact CG-CD2 4.12Å; Y397-F436 AromaticContact CZ-CD2 3.6Å; Y397-F436 WeakPolarHBondContact OH-CA 3.43Å; Y397-F436 PolarHBondContact OH-N 2.9Å; F426-F436 AromaticContact CD2-CE2 3.74Å; F426-F436 HydrophobicContact CD2-CE2 3.74Å; F426-F436 HydrophobicContact CD2-CZ 4.21Å; F426-F436 AromaticContact CE2-CE2 3.75Å; F426-F436 HydrophobicContact CE2-CE2 3.75Å; F426-F436 HydrophobicContact CE2-CZ 4.42Å; L434-F436 PolarHBondContact O-N 3.04Å; F436-I438 HydrophobicContact CE1-CD1 4.47Å; F436-I438 HydrophobicContact CE2-CD1 4.18Å; F436-I438 HydrophobicContact CZ-CD1 4.15Å; F436-Y441 HydrophobicContact CE1-CD1 4.05Å; F436-Y441 HydrophobicContact CE1-CE1 4.49Å; F436-Y441 HydrophobicContact CE1-CG 4.27Å; F436-Y441 AromaticContact CZ-CD1 3.72Å; F436-Y441 HydrophobicContact CZ-CD1 3.72Å; F436-Y441 HydrophobicContact CZ-CD2 4.32Å; F436-Y441 AromaticContact CZ-CE1 3.76Å; F436-Y441 HydrophobicContact CZ-CE1 3.76Å; F436-Y441 HydrophobicContact CZ-CE2 4.37Å; F436-Y441 HydrophobicContact CZ-CG 4.01Å
437	L	86.9	Confident	89.4	Confident	140 Å²	140	64.8 Å²	64.8	73%	0.733	33%	0.332	S	S	*	.			trans	-121.6	72.2	178.7	-61.7	175.3	0	0	0	107.8	P435	P435-L437 HydrophobicContact CB-CD1 4Å; P435-L437 HydrophobicContact CB-CG 3.99Å; P435-L437 PolarHBondContact O-N 3.46Å
438	I	88.4	Confident	89.4	Confident	28 Å²	28	67.9 Å²	67.9	14%	0.144	35%	0.347	C	S	.	.			trans	-113.2	115	-177.8	-55	173.7	0	0	0	107.2	N425 F426 F436 Y441	N425-I438 HydrophobicContact CB-CG2 4.14Å; F426-I438 HydrophobicContact CB-CD1 4.13Å; F426-I438 HydrophobicContact CD2-CD1 4.49Å; F436-I438 HydrophobicContact CE1-CD1 4.47Å; F436-I438 HydrophobicContact CE2-CD1 4.18Å; F436-I438 HydrophobicContact CZ-CD1 4.15Å; I438-Y441 HydrophobicContact CD1-CD2 4.48Å; I438-Y441 HydrophobicContact CG2-CD2 4.27Å
439	E	86.1	Confident	89.5	Confident	175 Å²	175	73.2 Å²	73.2	82%	0.818	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	141.9	174.5	-65	176	178.5	0	0	110	Y441	E439-Y441 PolarHBondContact O-N 3.41Å; E439-Y441 VanDerWaalsContact O-N 3.17Å
440	D	86.5	Confident	89.6	Confident	164 Å²	164	78.1 Å²	78.1	88%	0.877	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	33.4	178.1	-53.3	-38.8	0	0	0	114.8	E442	D440-E442 PolarHBondContact O-N 2.83Å
441	Y	91.3	Very high	89.8	Confident	39 Å²	39	78.3 Å²	78.3	15%	0.153	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-72.2	118.5	176.3	-177.4	-100.1	0	0	0	111.6	E400 P423 F426 F436 I438 E439	E400-Y441 WeakPolarHBondContact CB-OH 3.47Å; E400-Y441 HydrophobicContact CG-CE1 3.82Å; P423-Y441 HydrophobicContact CG-CE2 4.02Å; F426-Y441 HydrophobicContact CB-CE2 4.03Å; F426-Y441 AromaticContact CD2-CE2 3.58Å; F426-Y441 HydrophobicContact CD2-CE2 3.58Å; F426-Y441 AromaticContact CD2-CZ 3.73Å; F426-Y441 WeakPolarHBondContact CD2-OH 3.37Å; F426-Y441 HydrophobicContact CE2-CE2 4.43Å; F426-Y441 HydrophobicContact CG-CE2 4.15Å; F436-Y441 HydrophobicContact CE1-CD1 4.05Å; F436-Y441 HydrophobicContact CE1-CE1 4.49Å; F436-Y441 HydrophobicContact CE1-CG 4.27Å; F436-Y441 AromaticContact CZ-CD1 3.72Å; F436-Y441 HydrophobicContact CZ-CD1 3.72Å; F436-Y441 HydrophobicContact CZ-CD2 4.32Å; F436-Y441 AromaticContact CZ-CE1 3.76Å; F436-Y441 HydrophobicContact CZ-CE1 3.76Å; F436-Y441 HydrophobicContact CZ-CE2 4.37Å; F436-Y441 HydrophobicContact CZ-CG 4.01Å; I438-Y441 HydrophobicContact CD1-CD2 4.48Å; I438-Y441 HydrophobicContact CG2-CD2 4.27Å; E439-Y441 PolarHBondContact O-N 3.41Å; E439-Y441 VanDerWaalsContact O-N 3.17Å
442	E	92	Very high	90.1	Very high	165 Å²	165	86 Å²	86	77%	0.771	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-81.2	122.7	168.9	-65.8	-173.6	168.9	0	0	110.5	D440	D440-E442 PolarHBondContact O-N 2.83Å
443	E	92.5	Very high	90.5	Very high	111 Å²	111	84.4 Å²	84.4	52%	0.519	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-62.6	144	176.6	-66.8	-162.2	145	0	0	111.8	R399 E400 R403	R399-E443 IonicContact CZ-OE1 3.55Å; R399-E443 IonicContact NH1-OE1 2.94Å; R399-E443 PolarHBondContact NH1-OE1 3.49Å; R399-E443 IonicContact NH2-OE1 3.13Å; R399-E443 PolarHBondContact NH2-OE1 3.29Å; R399-E443 IonicContact NH2-OE2 2.68Å; E400-E443 WeakPolarHBondContact OE2-CA 3.42Å; R403-E443 IonicContact CZ-OE2 2.92Å; R403-E443 IonicContact NH1-OE1 3.64Å; R403-E443 IonicContact NH1-OE2 2.78Å; R403-E443 PolarHBondContact NH1-OE2 2.8Å; R403-E443 IonicContact NH2-OE2 3.02Å; R403-E443 PolarHBondContact NH2-OE2 3.5Å
444	Q	94.5	Very high	90.9	Very high	25 Å²	25	82.9 Å²	82.9	12%	0.117	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-62.2	159.7	174.7	-63.9	-58.1	-63.2	0	0	111.4	E400 R403 G446	E400-Q444 HydrophobicContact CB-CG 4.12Å; E400-Q444 WeakPolarHBondContact O-CG 3.24Å; E400-Q444 PolarHBondContact OE2-N 3.43Å; R403-Q444 HydrophobicContact CB-CB 3.79Å; R403-Q444 PolarHBondContact NE-O 2.68Å; R403-Q444 PolarHBondContact NH2-O 2.64Å; Q444-G446 PolarHBondContact O-N 2.99Å
445	P	92.9	Very high	91	Very high	65 Å²	65	85.3 Å²	85.3	42%	0.422	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-52	131.1	178.7	-27.6	35.5	0	0	0	112.1	R403	R403-P445 WeakPolarHBondContact CB-O 3.46Å; R403-P445 PolarHBondContact NE-O 2.94Å
446	G	91.8	Very high	91	Very high	26 Å²	26	87 Å²	87	27%	0.268	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-64.6	171.9	175.4	0	0	0	0	0	112	Q444 Q448	Q444-G446 PolarHBondContact O-N 2.99Å; G446-Q448 PolarHBondContact O-N 2.78Å; G446-Q448 VanDerWaalsContact O-N 3.1Å; G446-Q448 PolarHBondContact O-NE2 3.32Å
447	L	93.6	Very high	91	Very high	62 Å²	62	88.3 Å²	88.3	33%	0.325	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-57.7	116.8	176.4	-71.1	175.8	0	0	0	111.1	F367 Y368 I371 H406	F367-L447 HydrophobicContact CB-CD2 3.96Å; Y368-L447 HydrophobicContact CD2-CD1 3.86Å; Y368-L447 HydrophobicContact CG-CD1 4.5Å; I371-L447 HydrophobicContact CD1-CD1 4.16Å; I371-L447 HydrophobicContact CD1-CD2 3.63Å; I371-L447 HydrophobicContact CD1-CG 3.8Å; H406-L447 HydrophobicContact CB-CD2 4.06Å; H406-L447 VanDerWaalsContact CG-CD2 3.44Å
448	Q	92.3	Very high	91.2	Very high	72 Å²	72	86.2 Å²	86.2	34%	0.336	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-85.7	126.2	178.6	-60.6	-56	-54.4	0	0	111.6	H406 G446 H450 I451	H406-Q448 PolarHBondContact CE1-N 3.5Å; G446-Q448 PolarHBondContact O-N 2.78Å; G446-Q448 VanDerWaalsContact O-N 3.1Å; G446-Q448 PolarHBondContact O-NE2 3.32Å; Q448-H450 VanDerWaalsContact CB-CE1 3.47Å; Q448-H450 WeakPolarHBondContact CB-CE1 3.47Å; Q448-H450 PolarHBondContact O-N 2.97Å; Q448-H450 VanDerWaalsContact O-N 3.1Å; Q448-I451 HydrophobicContact CB-CB 4.44Å; Q448-I451 HydrophobicContact CB-CD1 4Å; Q448-I451 HydrophobicContact CB-CG1 4.06Å; Q448-I451 HydrophobicContact CG-CD1 4.24Å; Q448-I451 PolarHBondContact O-N 2.67Å; Q448-I451 VanDerWaalsContact O-N 3.08Å
449	P	90.3	Very high	91.4	Very high	128 Å²	128	85.1 Å²	85.1	83%	0.831	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.5	-176.8	-25.9	33.8	0	0	0	115.1
450	H	92.6	Very high	91.7	Very high	143 Å²	143	81.1 Å²	81.1	66%	0.662	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-19.3	-179.4	62.1	-88.7	0	0	0	113.2	Q448	Q448-H450 VanDerWaalsContact CB-CE1 3.47Å; Q448-H450 WeakPolarHBondContact CB-CE1 3.47Å; Q448-H450 PolarHBondContact O-N 2.97Å; Q448-H450 VanDerWaalsContact O-N 3.1Å
451	I	94.3	Very high	92	Very high	18 Å²	18	76.8 Å²	76.8	9%	0.092	41%	0.407	C	S	.	.	S	Bend	trans	-94.6	108.2	177.8	-56.1	177.6	0	0	0	108.5	H406 L409 Q448	H406-I451 PolarHBondContact NE2-O 3.37Å; L409-I451 HydrophobicContact CB-CG2 3.94Å; L409-I451 HydrophobicContact CD2-CG2 4.01Å; Q448-I451 HydrophobicContact CB-CB 4.44Å; Q448-I451 HydrophobicContact CB-CD1 4Å; Q448-I451 HydrophobicContact CB-CG1 4.06Å; Q448-I451 HydrophobicContact CG-CD1 4.24Å; Q448-I451 PolarHBondContact O-N 2.67Å; Q448-I451 VanDerWaalsContact O-N 3.08Å
452	K	93.8	Very high	92.2	Very high	165 Å²	165	76.6 Å²	76.6	72%	0.717	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-80.7	149.8	-179.5	-64.8	-176.3	-180	179.2	0	111.6	L409 R808	L409-K452 WeakPolarHBondContact CD2-O 3.06Å; K452-R808 VanDerWaalsContact O-CZ 3.28Å; K452-R808 PolarHBondContact O-NH1 3.06Å; K452-R808 PolarHBondContact O-NH2 3.31Å
453	D	94.3	Very high	92.3	Very high	44 Å²	44	71.4 Å²	71.4	24%	0.235	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-59.1	158.7	170.7	-81.9	-12.7	0	0	0	111.9	Q366 F367 Y368 R808	Q366-D453 WeakPolarHBondContact CA-OD2 3.33Å; F367-D453 VanDerWaalsContact N-CG 3.33Å; F367-D453 PolarHBondContact N-OD1 3.24Å; F367-D453 PolarHBondContact N-OD2 3.13Å; Y368-D453 PolarHBondContact N-OD2 3.02Å; D453-R808 PolarHBondContact O-NH1 3.32Å
454	V	94.9	Very high	92.4	Very high	4 Å²	4	70.8 Å²	70.8	2%	0.024	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-71.4	134.1	177.9	-175.9	0	0	0	0	110.1	G365 L409 R808 I811 E812	G365-V454 PolarHBondContact O-N 3.3Å; L409-V454 HydrophobicContact CD1-CG2 3.75Å; L409-V454 HydrophobicContact CD2-CG2 3.96Å; L409-V454 HydrophobicContact CG-CG2 4.34Å; V454-R808 HydrophobicContact CG2-CG 4.26Å; V454-I811 HydrophobicContact CB-CG2 4.28Å; V454-I811 HydrophobicContact CG1-CB 4.49Å; V454-I811 HydrophobicContact CG1-CG2 4.06Å; V454-I811 HydrophobicContact CG2-CB 4.3Å; V454-I811 HydrophobicContact CG2-CD1 4.48Å; V454-I811 HydrophobicContact CG2-CG2 4.07Å; V454-E812 HydrophobicContact CG1-CB 4.44Å; V454-E812 HydrophobicContact CG1-CG 3.36Å
455	L	88.4	Confident	92.4	Very high	119 Å²	119	74.1 Å²	74.1	62%	0.623	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-95.1	140.4	177.2	-61.9	179.7	0	0	0	110.1	Q457	L455-Q457 PolarHBondContact O-N 3.42Å
456	P	85.5	Confident	92.5	Very high	97 Å²	97	71.8 Å²	71.8	63%	0.63	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-59.3	131.7	173.1	-21.6	32.5	0	0	0	111
457	Q	88.6	Confident	92.7	Very high	64 Å²	64	72.7 Å²	72.7	30%	0.299	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-101	137.5	174.2	-63.7	-60.8	-23.3	0	0	110.2	L455 Y462 E812	L455-Q457 PolarHBondContact O-N 3.42Å; Q457-Y462 HydrophobicContact CB-CE2 4.1Å; Q457-Y462 WeakPolarHBondContact CB-OH 3.31Å; Q457-E812 HydrophobicContact CG-CB 3.82Å; Q457-E812 HydrophobicContact CG-CG 3.91Å; Q457-E812 PolarHBondContact NE2-OE1 3.21Å
458	N	90.1	Very high	92.7	Very high	96 Å²	96	73.9 Å²	73.9	51%	0.513	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-82.5	140.4	170.7	-171.4	-4.7	0	0	0	109.1	D460 S461	N458-D460 PolarHBondContact O-N 2.61Å; N458-D460 PolarHBondContact OD1-N 2.96Å; N458-S461 WeakPolarHBondContact O-CB 3.21Å; N458-S461 PolarHBondContact O-N 3.36Å; N458-S461 PolarHBondContact O-OG 2.9Å
459	F	92.7	Very high	92.9	Very high	5 Å²	5	70.5 Å²	70.5	2%	0.022	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-52.9	-41.1	176.1	-172.7	-93.6	0	0	0	112.4	S461 Y462 Q467 I470 T816 D817 H821	F459-S461 PolarHBondContact O-N 3.15Å; F459-S461 VanDerWaalsContact O-N 3.16Å; F459-Y462 WeakPolarHBondContact O-CD2 3.28Å; F459-Y462 PolarHBondContact O-N 3.32Å; F459-Q467 HydrophobicContact CD1-CG 4.13Å; F459-Q467 HydrophobicContact CE1-CB 3.77Å; F459-Q467 HydrophobicContact CE1-CG 3.61Å; F459-Q467 HydrophobicContact CE2-CB 4.43Å; F459-Q467 HydrophobicContact CE2-CG 4.49Å; F459-Q467 HydrophobicContact CZ-CB 3.59Å; F459-Q467 HydrophobicContact CZ-CG 3.82Å; F459-Q467 PolarHBondContact O-NE2 3.36Å; F459-I470 HydrophobicContact CD2-CD1 4.47Å; F459-I470 HydrophobicContact CD2-CG2 4.44Å; F459-I470 HydrophobicContact CE2-CB 4.07Å; F459-I470 HydrophobicContact CE2-CD1 4.27Å; F459-I470 HydrophobicContact CE2-CG2 3.86Å; F459-T816 HydrophobicContact CB-CG2 3.82Å; F459-T816 HydrophobicContact CD2-CG2 3.98Å; F459-T816 HydrophobicContact CG-CG2 4.41Å; F459-D817 WeakPolarHBondContact CB-O 3.4Å; F459-H821 HydrophobicContact CD1-CB 3.61Å; F459-H821 AromaticContact CD1-CG 3.52Å; F459-H821 AromaticContact CD1-ND1 3.79Å; F459-H821 HydrophobicContact CE1-CB 3.43Å; F459-H821 VanDerWaalsContact CE1-CB 3.43Å; F459-H821 AromaticContact CE1-CG 3.87Å; F459-H821 HydrophobicContact CG-CB 4.36Å; F459-H821 HydrophobicContact CZ-CB 4.04Å
460	D	92.8	Very high	93.2	Very high	92 Å²	92	64.4 Å²	64.4	49%	0.492	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-66.7	-16.6	-179.4	-60.8	-42.8	0	0	0	114	N458 Y462 H821	N458-D460 PolarHBondContact O-N 2.61Å; N458-D460 PolarHBondContact OD1-N 2.96Å; D460-Y462 VanDerWaalsContact C-N 3.3Å; D460-H821 IonicContact OD1-CD2 3.43Å; D460-H821 IonicContact OD1-NE2 2.7Å
461	S	93.2	Very high	93.3	Very high	72 Å²	72	58.8 Å²	58.8	50%	0.503	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-76.3	-19.2	178.9	72.2	0	0	0	0	113.3	N458 F459	N458-S461 WeakPolarHBondContact O-CB 3.21Å; N458-S461 PolarHBondContact O-N 3.36Å; N458-S461 PolarHBondContact O-OG 2.9Å; F459-S461 PolarHBondContact O-N 3.15Å; F459-S461 VanDerWaalsContact O-N 3.16Å
462	Y	94.6	Very high	93.3	Very high	35 Å²	35	58.6 Å²	58.6	14%	0.137	31%	0.313	C	S	.	.	S	Bend	trans	-77.3	151.1	177	-67.9	-70.7	0	0	0	111.3	Q457 F459 D460 V466 Q467 I470 F804 T816	Q457-Y462 HydrophobicContact CB-CE2 4.1Å; Q457-Y462 WeakPolarHBondContact CB-OH 3.31Å; F459-Y462 WeakPolarHBondContact O-CD2 3.28Å; F459-Y462 PolarHBondContact O-N 3.32Å; D460-Y462 VanDerWaalsContact C-N 3.3Å; Y462-V466 HydrophobicContact CD1-CB 4.41Å; Y462-V466 HydrophobicContact CD1-CG1 3.59Å; Y462-V466 HydrophobicContact CE1-CG1 4.34Å; Y462-V466 HydrophobicContact CG-CG1 3.91Å; Y462-Q467 PolarHBondContact O-NE2 2.97Å; Y462-I470 HydrophobicContact CD2-CD1 3.82Å; Y462-I470 HydrophobicContact CE2-CD1 4.02Å; Y462-I470 HydrophobicContact CG-CD1 4.16Å; Y462-F804 HydrophobicContact CE1-CE1 4.46Å; Y462-T816 HydrophobicContact CD2-CG2 4.49Å; Y462-T816 HydrophobicContact CE2-CG2 3.9Å; Y462-T816 PolarHBondContact OH-OG1 3.23Å
463	S	95.2	Very high	93.4	Very high	57 Å²	57	50.7 Å²	50.7	40%	0.399	28%	0.279	S	S	.	.			trans	-62.2	158.1	171.8	88.2	0	0	0	0	111.1	E465 V466 Q467	S463-E465 VanDerWaalsContact CB-OE2 3.31Å; S463-E465 WeakPolarHBondContact CB-OE2 3.4Å; S463-E465 PolarHBondContact O-N 2.75Å; S463-E465 VanDerWaalsContact O-N 3.14Å; S463-E465 PolarHBondContact OG-N 2.76Å; S463-E465 PolarHBondContact OG-OE2 3.25Å; S463-V466 PolarHBondContact O-N 3.4Å; S463-V466 PolarHBondContact OG-N 2.84Å; S463-Q467 WeakPolarHBondContact O-CG 3.4Å; S463-Q467 PolarHBondContact O-N 3.22Å
464	T	93.9	Very high	93.5	Very high	98 Å²	98	50 Å²	50	60%	0.601	28%	0.275	S	S	*	.	H	α-helix	trans	-54.6	-34.8	179	36.7	0	0	0	0	113.1	K468	T464-K468 WeakPolarHBondContact O-CB 3.39Å; T464-K468 PolarHBondContact O-N 3.5Å; T464-K468 VanDerWaalsContact O-N 3.09Å
465	E	94	Very high	93.4	Very high	95 Å²	95	52.3 Å²	52.3	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-70.9	-40	178.3	-57.4	68.1	-141.7	0	0	111.5	S463 K468 L469 P798	S463-E465 VanDerWaalsContact CB-OE2 3.31Å; S463-E465 WeakPolarHBondContact CB-OE2 3.4Å; S463-E465 PolarHBondContact O-N 2.75Å; S463-E465 VanDerWaalsContact O-N 3.14Å; S463-E465 PolarHBondContact OG-N 2.76Å; S463-E465 PolarHBondContact OG-OE2 3.25Å; E465-K468 PolarHBondContact O-N 2.94Å; E465-L469 PolarHBondContact O-N 2.79Å; E465-P798 HydrophobicContact CB-CG 4.12Å
466	V	95.7	Very high	93.7	Very high	15 Å²	15	46.7 Å²	46.7	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-73.8	-38.2	178.3	178	0	0	0	0	110.9	Y462 S463 K468 L469 I470 P798 T803 F804	Y462-V466 HydrophobicContact CD1-CB 4.41Å; Y462-V466 HydrophobicContact CD1-CG1 3.59Å; Y462-V466 HydrophobicContact CE1-CG1 4.34Å; Y462-V466 HydrophobicContact CG-CG1 3.91Å; S463-V466 PolarHBondContact O-N 3.4Å; S463-V466 PolarHBondContact OG-N 2.84Å; V466-K468 VanDerWaalsContact C-N 3.3Å; V466-K468 PolarHBondContact O-N 3.08Å; V466-L469 VanDerWaalsContact O-CB 3.32Å; V466-L469 WeakPolarHBondContact O-CB 3.4Å; V466-L469 PolarHBondContact O-N 2.72Å; V466-L469 VanDerWaalsContact O-N 3.12Å; V466-I470 HydrophobicContact CG1-CD1 4.08Å; V466-I470 HydrophobicContact CG1-CG1 4.44Å; V466-I470 VanDerWaalsContact O-CG1 3.31Å; V466-I470 WeakPolarHBondContact O-CG1 3.3Å; V466-I470 PolarHBondContact O-N 2.87Å; V466-P798 HydrophobicContact CG2-CG 4.39Å; V466-T803 HydrophobicContact CG1-CG2 4.03Å; V466-T803 HydrophobicContact CG2-CG2 3.72Å; V466-F804 HydrophobicContact CG1-CZ 4.07Å
467	Q	95.4	Very high	94.1	Very high	46 Å²	46	42 Å²	42	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-45.1	171.2	-69.8	179.3	12.5	0	0	111.1	F459 Y462 S463 L469 I470 C471	F459-Q467 HydrophobicContact CD1-CG 4.13Å; F459-Q467 HydrophobicContact CE1-CB 3.77Å; F459-Q467 HydrophobicContact CE1-CG 3.61Å; F459-Q467 HydrophobicContact CE2-CB 4.43Å; F459-Q467 HydrophobicContact CE2-CG 4.49Å; F459-Q467 HydrophobicContact CZ-CB 3.59Å; F459-Q467 HydrophobicContact CZ-CG 3.82Å; F459-Q467 PolarHBondContact O-NE2 3.36Å; Y462-Q467 PolarHBondContact O-NE2 2.97Å; S463-Q467 WeakPolarHBondContact O-CG 3.4Å; S463-Q467 PolarHBondContact O-N 3.22Å; Q467-L469 VanDerWaalsContact C-N 3.33Å; Q467-L469 PolarHBondContact O-N 3.34Å; Q467-I470 PolarHBondContact O-N 3.19Å; Q467-C471 PolarHBondContact O-N 2.96Å; Q467-C471 PolarHBondContact O-SG 3.19Å
468	K	94.3	Very high	94.4	Very high	87 Å²	87	40.7 Å²	40.7	38%	0.378	23%	0.226	S	C	.	.	H	α-helix	trans	-62.1	-40.4	174.5	-172.4	179.8	-179.5	-175.7	0	111.9	T464 E465 V466 T472 L797	T464-K468 WeakPolarHBondContact O-CB 3.39Å; T464-K468 PolarHBondContact O-N 3.5Å; T464-K468 VanDerWaalsContact O-N 3.09Å; E465-K468 PolarHBondContact O-N 2.94Å; V466-K468 VanDerWaalsContact C-N 3.3Å; V466-K468 PolarHBondContact O-N 3.08Å; K468-T472 VanDerWaalsContact O-CB 3.31Å; K468-T472 WeakPolarHBondContact O-CB 3.46Å; K468-T472 PolarHBondContact O-N 2.83Å; K468-T472 PolarHBondContact O-OG1 3.17Å; K468-L797 HydrophobicContact CD-CD2 4.33Å; K468-L797 HydrophobicContact CG-CD2 4.22Å
469	L	95.9	Very high	94.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-48.2	174.9	-177.9	75.2	0	0	0	111.2	E465 V466 Q467 T472 A473 L499 L502 L797 P798 V800 F804	E465-L469 PolarHBondContact O-N 2.79Å; V466-L469 VanDerWaalsContact O-CB 3.32Å; V466-L469 WeakPolarHBondContact O-CB 3.4Å; V466-L469 PolarHBondContact O-N 2.72Å; V466-L469 VanDerWaalsContact O-N 3.12Å; Q467-L469 VanDerWaalsContact C-N 3.33Å; Q467-L469 PolarHBondContact O-N 3.34Å; L469-T472 WeakPolarHBondContact O-CB 3.2Å; L469-T472 PolarHBondContact O-N 2.92Å; L469-A473 PolarHBondContact O-N 2.69Å; L469-L499 HydrophobicContact CD2-CD2 4.34Å; L469-L499 HydrophobicContact CG-CD2 4.3Å; L469-L502 HydrophobicContact CD1-CD1 3.68Å; L469-L502 HydrophobicContact CG-CD1 4.46Å; L469-L797 HydrophobicContact CD1-CB 4.21Å; L469-L797 HydrophobicContact CD1-CD1 4.25Å; L469-L797 HydrophobicContact CD1-CD2 4.42Å; L469-P798 HydrophobicContact CB-CG 4.34Å; L469-P798 HydrophobicContact CD2-CG 4.27Å; L469-V800 HydrophobicContact CD1-CG2 4.06Å; L469-V800 HydrophobicContact CD2-CG2 4.27Å; L469-F804 HydrophobicContact CD2-CE2 3.82Å; L469-F804 HydrophobicContact CD2-CZ 4.41Å
470	I	96.4	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-49.9	179.4	-66.1	165.4	0	0	0	110.8	F459 Y462 V466 Q467 T472 A473 D474 V813	F459-I470 HydrophobicContact CD2-CD1 4.47Å; F459-I470 HydrophobicContact CD2-CG2 4.44Å; F459-I470 HydrophobicContact CE2-CB 4.07Å; F459-I470 HydrophobicContact CE2-CD1 4.27Å; F459-I470 HydrophobicContact CE2-CG2 3.86Å; Y462-I470 HydrophobicContact CD2-CD1 3.82Å; Y462-I470 HydrophobicContact CE2-CD1 4.02Å; Y462-I470 HydrophobicContact CG-CD1 4.16Å; V466-I470 HydrophobicContact CG1-CD1 4.08Å; V466-I470 HydrophobicContact CG1-CG1 4.44Å; V466-I470 VanDerWaalsContact O-CG1 3.31Å; V466-I470 WeakPolarHBondContact O-CG1 3.3Å; V466-I470 PolarHBondContact O-N 2.87Å; Q467-I470 PolarHBondContact O-N 3.19Å; I470-T472 PolarHBondContact O-N 3.4Å; I470-A473 WeakPolarHBondContact O-CB 3.46Å; I470-A473 PolarHBondContact O-N 3.12Å; I470-A473 VanDerWaalsContact O-N 3.12Å; I470-D474 PolarHBondContact O-N 2.69Å; I470-V813 HydrophobicContact CD1-CG2 3.83Å; I470-V813 HydrophobicContact CG1-CG2 3.7Å
471	C	95.1	Very high	94.6	Very high	26 Å²	26	34.7 Å²	34.7	18%	0.176	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-34.8	178.9	-66.7	0	0	0	0	113.1	Q467 H475 C822	Q467-C471 PolarHBondContact O-N 2.96Å; Q467-C471 PolarHBondContact O-SG 3.19Å; C471-H475 PolarHBondContact O-N 3.48Å; C471-H475 VanDerWaalsContact O-N 3.15Å; C471-C822 WeakPolarHBondContact CA-SG 3.43Å; C471-C822 HydrophobicContact CB-CB 3.7Å; C471-C822 WeakPolarHBondContact CB-SG 3.4Å; C471-C822 WeakPolarHBondContact SG-CA 3.25Å; C471-C822 WeakPolarHBondContact SG-CB 3.05Å; C471-C822 CovalentContact SG-SG 2.04Å; C471-C822 PolarHBondContact SG-SG 3.06Å
472	T	94.4	Very high	94.5	Very high	13 Å²	13	32.8 Å²	32.8	8%	0.08	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-43.6	175.7	-58.3	0	0	0	0	110.7	K468 L469 I470 H475 L476 L502 W793 Y794 L797	K468-T472 VanDerWaalsContact O-CB 3.31Å; K468-T472 WeakPolarHBondContact O-CB 3.46Å; K468-T472 PolarHBondContact O-N 2.83Å; K468-T472 PolarHBondContact O-OG1 3.17Å; L469-T472 WeakPolarHBondContact O-CB 3.2Å; L469-T472 PolarHBondContact O-N 2.92Å; I470-T472 PolarHBondContact O-N 3.4Å; T472-H475 PolarHBondContact O-N 3.46Å; T472-L476 HydrophobicContact CG2-CD1 4Å; T472-L476 HydrophobicContact CG2-CG 4.5Å; T472-L476 VanDerWaalsContact O-CG 3.32Å; T472-L476 WeakPolarHBondContact O-CG 3.07Å; T472-L476 PolarHBondContact O-N 3.33Å; T472-L502 HydrophobicContact CG2-CD1 4.13Å; T472-L502 HydrophobicContact CG2-CD2 4.19Å; T472-W793 HydrophobicContact CG2-CH2 4.09Å; T472-W793 HydrophobicContact CG2-CZ3 4.44Å; T472-Y794 HydrophobicContact CG2-CD1 4.38Å; T472-Y794 HydrophobicContact CG2-CE1 3.5Å; T472-L797 HydrophobicContact CG2-CD1 4.31Å
473	A	96.3	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-46.6	175.7	0	0	0	0	0	112	L469 I470 H475 L476 G477 G498 L499 L502	L469-A473 PolarHBondContact O-N 2.69Å; I470-A473 WeakPolarHBondContact O-CB 3.46Å; I470-A473 PolarHBondContact O-N 3.12Å; I470-A473 VanDerWaalsContact O-N 3.12Å; A473-H475 VanDerWaalsContact C-N 3.27Å; A473-H475 PolarHBondContact O-N 2.82Å; A473-L476 PolarHBondContact O-N 2.72Å; A473-G477 PolarHBondContact O-N 2.93Å; A473-G498 WeakPolarHBondContact O-CA 3.43Å; A473-L499 HydrophobicContact CB-CB 4.47Å; A473-L499 HydrophobicContact CB-CD2 3.78Å; A473-L499 HydrophobicContact CB-CG 3.7Å; A473-L502 HydrophobicContact CB-CD1 4.14Å
474	D	95.3	Very high	94.1	Very high	29 Å²	29	33.4 Å²	33.4	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-57.6	-42.3	177.8	-69.8	-21.8	0	0	0	111.5	I470 A478 R495 S818	I470-D474 PolarHBondContact O-N 2.69Å; D474-A478 WeakPolarHBondContact O-CB 3.32Å; D474-A478 PolarHBondContact O-N 3.34Å; D474-R495 VanDerWaalsContact OD1-CB 3.22Å; D474-R495 WeakPolarHBondContact OD1-CB 3.13Å; D474-R495 VanDerWaalsContact OD1-CG 3.31Å; D474-R495 WeakPolarHBondContact OD1-CG 3.34Å; D474-R495 IonicContact OD1-CZ 3.63Å; D474-R495 IonicContact OD1-NE 3.99Å; D474-R495 PolarHBondContact OD1-NE 2.85Å; D474-R495 IonicContact OD1-NH2 2.84Å; D474-R495 IonicContact OD2-CZ 2.71Å; D474-R495 IonicContact OD2-NE 3.51Å; D474-R495 IonicContact OD2-NH2 3.41Å; D474-R495 PolarHBondContact OD2-NH2 2.89Å; D474-S818 WeakPolarHBondContact OD2-CB 3.23Å; D474-S818 PolarHBondContact OD2-OG 3.35Å
475	H	93.4	Very high	93.9	Very high	53 Å²	53	30.8 Å²	30.8	25%	0.245	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-50.4	176.2	178.5	61.5	0	0	0	112.6	C471 T472 A473 G477 A478 L479	C471-H475 PolarHBondContact O-N 3.48Å; C471-H475 VanDerWaalsContact O-N 3.15Å; T472-H475 PolarHBondContact O-N 3.46Å; A473-H475 VanDerWaalsContact C-N 3.27Å; A473-H475 PolarHBondContact O-N 2.82Å; H475-G477 VanDerWaalsContact C-N 3.33Å; H475-G477 PolarHBondContact O-N 2.89Å; H475-A478 PolarHBondContact O-N 3.48Å; H475-L479 PolarHBondContact O-N 3.05Å
476	L	94.8	Very high	93.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-42	-179.6	-69.5	170	0	0	0	111.5	T472 A473 A478 L479 T501 L502 M744 M748	T472-L476 HydrophobicContact CG2-CD1 4Å; T472-L476 HydrophobicContact CG2-CG 4.5Å; T472-L476 VanDerWaalsContact O-CG 3.32Å; T472-L476 WeakPolarHBondContact O-CG 3.07Å; T472-L476 PolarHBondContact O-N 3.33Å; A473-L476 PolarHBondContact O-N 2.72Å; L476-A478 PolarHBondContact O-N 3.05Å; L476-L479 WeakPolarHBondContact O-CB 3.5Å; L476-L479 PolarHBondContact O-N 3.04Å; L476-T501 HydrophobicContact CD1-CG2 4.04Å; L476-L502 HydrophobicContact CD1-CD1 4.32Å; L476-L502 HydrophobicContact CD1-CD2 3.65Å; L476-L502 HydrophobicContact CD1-CG 3.81Å; L476-M744 HydrophobicContact CB-CE 4.32Å; L476-M744 HydrophobicContact CD2-CE 3.87Å; L476-M748 HydrophobicContact CD1-CE 4.12Å; L476-M748 HydrophobicContact CD1-SD 4.09Å; L476-M748 HydrophobicContact CD2-CE 4.5Å; L476-M748 HydrophobicContact CD2-SD 4.09Å
477	G	95	Very high	93.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-40.7	175.8	0	0	0	0	0	113.4	A473 H475 L479 M480 H494	A473-G477 PolarHBondContact O-N 2.93Å; H475-G477 VanDerWaalsContact C-N 3.33Å; H475-G477 PolarHBondContact O-N 2.89Å; G477-L479 PolarHBondContact O-N 3.31Å; G477-M480 WeakPolarHBondContact O-CB 3.37Å; G477-M480 PolarHBondContact O-N 2.8Å; G477-H494 VanDerWaalsContact CA-O 3.23Å; G477-H494 WeakPolarHBondContact CA-O 3.15Å
478	A	93.4	Very high	93.2	Very high	35 Å²	35	27.4 Å²	27.4	29%	0.289	15%	0.146	S	C	.	.	H	α-helix	trans	-64.5	-27.3	178	0	0	0	0	0	113.1	D474 H475 L476 M480 Q481	D474-A478 WeakPolarHBondContact O-CB 3.32Å; D474-A478 PolarHBondContact O-N 3.34Å; H475-A478 PolarHBondContact O-N 3.48Å; L476-A478 PolarHBondContact O-N 3.05Å; A478-M480 PolarHBondContact O-N 2.82Å; A478-Q481 WeakPolarHBondContact O-CB 3.21Å; A478-Q481 PolarHBondContact O-N 3.21Å
479	L	93.8	Very high	93.1	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.8	173.6	-63.4	176.1	0	0	0	113	H475 L476 G477 Q481 M744 V754 R757	H475-L479 PolarHBondContact O-N 3.05Å; L476-L479 WeakPolarHBondContact O-CB 3.5Å; L476-L479 PolarHBondContact O-N 3.04Å; G477-L479 PolarHBondContact O-N 3.31Å; L479-Q481 VanDerWaalsContact C-N 3.35Å; L479-M744 HydrophobicContact CB-CE 4.15Å; L479-M744 HydrophobicContact CD1-CE 3.97Å; L479-V754 VanDerWaalsContact CD1-O 3.3Å; L479-V754 WeakPolarHBondContact CD1-O 3.32Å; L479-R757 HydrophobicContact CD2-CG 3.79Å
480	M	93.1	Very high	92.9	Very high	13 Å²	13	26 Å²	26	6%	0.064	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.9	178.2	-44.9	-172	-170.9	0	0	113.1	G477 A478 Y482 M497 T501 Y740 M744	G477-M480 WeakPolarHBondContact O-CB 3.37Å; G477-M480 PolarHBondContact O-N 2.8Å; A478-M480 PolarHBondContact O-N 2.82Å; M480-Y482 PolarHBondContact O-N 3.15Å; M480-M497 HydrophobicContact CE-CB 4.26Å; M480-M497 HydrophobicContact SD-CB 3.72Å; M480-T501 WeakPolarHBondContact CE-OG1 3.49Å; M480-Y740 HydrophobicContact CB-CD1 3.79Å; M480-Y740 HydrophobicContact CB-CE1 4.14Å; M480-Y740 HydrophobicContact CG-CD1 3.6Å; M480-Y740 HydrophobicContact CG-CE1 3.88Å; M480-Y740 HydrophobicContact SD-CD1 4.2Å; M480-M744 HydrophobicContact CE-CE 4.37Å; M480-M744 HydrophobicContact CE-SD 3.52Å; M480-M744 VanDerWaalsContact CE-SD 3.52Å; M480-M744 HydrophobicContact CG-SD 3.78Å; M480-M744 HydrophobicContact SD-SD 4.34Å
481	Q	92.8	Very high	92.8	Very high	49 Å²	49	30.7 Å²	30.7	23%	0.229	17%	0.165	C	C	.	.			trans	-67.2	128.1	178.8	-179.8	57.4	43.9	0	0	110.4	A478 L479 D483 F487 H494	A478-Q481 WeakPolarHBondContact O-CB 3.21Å; A478-Q481 PolarHBondContact O-N 3.21Å; L479-Q481 VanDerWaalsContact C-N 3.35Å; Q481-D483 PolarHBondContact O-N 3.18Å; Q481-F487 PolarHBondContact NE2-O 3.22Å; Q481-H494 PolarHBondContact OE1-NE2 2.68Å
482	Y	92.8	Very high	92.7	Very high	32 Å²	32	30 Å²	30	13%	0.125	16%	0.158	C	C	.	.			trans	-70	127.4	169.4	-67	-49.9	0	0	0	111	M480 T484 F487 S736 I758 L763 V764	M480-Y482 PolarHBondContact O-N 3.15Å; Y482-T484 VanDerWaalsContact C-N 3.27Å; Y482-T484 PolarHBondContact O-N 2.69Å; Y482-F487 AromaticContact CD2-CD1 3.63Å; Y482-F487 HydrophobicContact CD2-CD1 3.63Å; Y482-F487 HydrophobicContact CD2-CD2 4.38Å; Y482-F487 AromaticContact CD2-CE1 3.63Å; Y482-F487 HydrophobicContact CD2-CE1 3.63Å; Y482-F487 HydrophobicContact CD2-CE2 4.38Å; Y482-F487 HydrophobicContact CD2-CG 4Å; Y482-F487 HydrophobicContact CD2-CZ 4.01Å; Y482-F487 HydrophobicContact CE2-CD1 4.47Å; Y482-F487 HydrophobicContact CE2-CE1 4.11Å; Y482-F487 HydrophobicContact CE2-CZ 4.48Å; Y482-F487 HydrophobicContact CG-CD1 4.47Å; Y482-F487 HydrophobicContact CG-CG 4.42Å; Y482-S736 PolarHBondContact OH-OG 3.13Å; Y482-I758 HydrophobicContact CD1-CD1 3.81Å; Y482-I758 HydrophobicContact CD1-CG2 4.07Å; Y482-I758 HydrophobicContact CE1-CD1 3.69Å; Y482-I758 HydrophobicContact CE1-CG2 4.33Å; Y482-L763 HydrophobicContact CD1-CD2 3.69Å; Y482-L763 HydrophobicContact CD2-CD2 3.76Å; Y482-L763 HydrophobicContact CE1-CB 4.33Å; Y482-L763 HydrophobicContact CE1-CD2 3.96Å; Y482-L763 HydrophobicContact CE2-CD2 4.01Å; Y482-L763 HydrophobicContact CG-CD2 3.6Å; Y482-V764 HydrophobicContact CE1-CG2 4.12Å
483	D	90.3	Very high	92.8	Very high	93 Å²	93	30.9 Å²	30.9	50%	0.497	16%	0.162	S	C	.	.			trans	-90.2	63.2	167.4	-175.4	20.3	0	0	0	109.5	Q481 K760 G761	Q481-D483 PolarHBondContact O-N 3.18Å; D483-K760 VanDerWaalsContact O-CA 3.26Å; D483-K760 WeakPolarHBondContact O-CA 3.11Å; D483-K760 WeakPolarHBondContact O-CG 3.38Å; D483-K760 WeakPolarHBondContact OD2-CB 3.37Å; D483-G761 PolarHBondContact O-N 2.81Å
484	T	89.9	Confident	92.8	Very high	13 Å²	13	32.3 Å²	32.3	8%	0.08	17%	0.169	C	C	.	.	S	Bend	trans	-139.1	142.6	179.8	-60.2	0	0	0	0	108.6	Y482 G486 F487 R578 G761	Y482-T484 VanDerWaalsContact C-N 3.27Å; Y482-T484 PolarHBondContact O-N 2.69Å; T484-G486 PolarHBondContact O-N 3.18Å; T484-F487 HydrophobicContact CG2-CD2 4.38Å; T484-F487 HydrophobicContact CG2-CE2 4.33Å; T484-F487 PolarHBondContact O-N 3.24Å; T484-R578 WeakPolarHBondContact CG2-O 3.28Å; T484-G761 WeakPolarHBondContact OG1-CA 3.49Å; T484-G761 PolarHBondContact OG1-N 3.23Å
485	P	90.1	Very high	92.8	Very high	43 Å²	43	31.5 Å²	31.5	28%	0.279	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	140.5	173.8	-30.6	37.6	0	0	0	113.2	L296 I577 R578	L296-P485 HydrophobicContact CD1-CB 3.94Å; L296-P485 HydrophobicContact CD1-CG 4.48Å; L296-P485 CarbonylContact O-C 3.57Å; L296-P485 WeakPolarHBondContact O-CA 3.01Å; P485-I577 HydrophobicContact CB-CD1 3.89Å; P485-I577 HydrophobicContact CB-CG1 3.92Å; P485-I577 HydrophobicContact CB-CG2 4.38Å; P485-R578 WeakPolarHBondContact O-CA 3.46Å
486	G	89.1	Confident	93	Very high	5 Å²	5	29 Å²	29	5%	0.052	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	5.2	178	0	0	0	0	0	116	E295 L296 T484 R578	E295-G486 WeakPolarHBondContact O-CA 3.41Å; L296-G486 VanDerWaalsContact C-N 3.31Å; L296-G486 PolarHBondContact O-N 2.92Å; T484-G486 PolarHBondContact O-N 3.18Å; G486-R578 PolarHBondContact O-NE 3.47Å; G486-R578 PolarHBondContact O-NH2 3.27Å
487	F	91.1	Very high	93.2	Very high	44 Å²	44	29 Å²	29	19%	0.193	15%	0.152	C	C	.	.			trans	-108.5	104.4	170.8	-67.3	-84.9	0	0	0	110.9	Q481 Y482 T484 R578 L763	Q481-F487 PolarHBondContact NE2-O 3.22Å; Y482-F487 AromaticContact CD2-CD1 3.63Å; Y482-F487 HydrophobicContact CD2-CD1 3.63Å; Y482-F487 HydrophobicContact CD2-CD2 4.38Å; Y482-F487 AromaticContact CD2-CE1 3.63Å; Y482-F487 HydrophobicContact CD2-CE1 3.63Å; Y482-F487 HydrophobicContact CD2-CE2 4.38Å; Y482-F487 HydrophobicContact CD2-CG 4Å; Y482-F487 HydrophobicContact CD2-CZ 4.01Å; Y482-F487 HydrophobicContact CE2-CD1 4.47Å; Y482-F487 HydrophobicContact CE2-CE1 4.11Å; Y482-F487 HydrophobicContact CE2-CZ 4.48Å; Y482-F487 HydrophobicContact CG-CD1 4.47Å; Y482-F487 HydrophobicContact CG-CG 4.42Å; T484-F487 HydrophobicContact CG2-CD2 4.38Å; T484-F487 HydrophobicContact CG2-CE2 4.33Å; T484-F487 PolarHBondContact O-N 3.24Å; F487-R578 HydrophobicContact CD2-CB 4.49Å; F487-R578 HydrophobicContact CD2-CG 4.28Å; F487-R578 HydrophobicContact CE2-CB 3.67Å; F487-R578 HydrophobicContact CE2-CG 3.86Å; F487-R578 HydrophobicContact CZ-CB 4.02Å; F487-R578 HydrophobicContact CZ-CG 4.2Å; F487-L763 HydrophobicContact CD2-CD2 4.32Å; F487-L763 HydrophobicContact CE2-CD1 4.33Å; F487-L763 HydrophobicContact CE2-CD2 3.53Å; F487-L763 HydrophobicContact CZ-CD1 4.21Å; F487-L763 HydrophobicContact CZ-CD2 3.69Å
488	L	90.7	Very high	93.3	Very high	36 Å²	36	29 Å²	29	19%	0.188	15%	0.152	C	C	.	.			trans	-78.9	134.1	177.8	-168	73	0	0	0	111.3	F299 M326 H329 N490	F299-L488 HydrophobicContact CB-CD1 3.97Å; M326-L488 HydrophobicContact CE-CD1 3.27Å; M326-L488 HydrophobicContact CE-CD2 3.75Å; M326-L488 HydrophobicContact CE-CG 4.17Å; M326-L488 HydrophobicContact SD-CD1 4.45Å; M326-L488 HydrophobicContact SD-CD2 3.93Å; H329-L488 HydrophobicContact CB-CD2 3.66Å; L488-N490 PolarHBondContact O-N 3.12Å
489	P	91.3	Very high	93.5	Very high	40 Å²	40	27.3 Å²	27.3	26%	0.26	14%	0.138	S	C	.	.			trans	-68.7	131.7	173	27.9	-33.9	0	0	0	111.5	H330	H330-P489 PolarHBondContact ND1-O 3.25Å; H330-P489 VanDerWaalsContact ND1-O 3.09Å
490	N	92.9	Very high	93.8	Very high	18 Å²	18	27.1 Å²	27.1	10%	0.096	14%	0.137	C	C	.	.			trans	-123.5	111.3	178.1	-176.4	-49	0	0	0	110.2	H329 L488 R492 I493 H494	H329-N490 VanDerWaalsContact O-CB 3.22Å; H329-N490 WeakPolarHBondContact O-CB 3.18Å; H329-N490 VanDerWaalsContact O-CG 3.25Å; H329-N490 PolarHBondContact O-ND2 3.31Å; L488-N490 PolarHBondContact O-N 3.12Å; N490-R492 VanDerWaalsContact C-N 3.29Å; N490-R492 PolarHBondContact O-N 3.27Å; N490-R492 WeakPolarHBondContact OD1-CA 3.04Å; N490-R492 WeakPolarHBondContact OD1-CB 3.37Å; N490-R492 PolarHBondContact OD1-N 3.38Å; N490-I493 HydrophobicContact CB-CB 4.07Å; N490-I493 HydrophobicContact CB-CD1 3.98Å; N490-I493 HydrophobicContact CB-CG1 4.11Å; N490-I493 PolarHBondContact O-N 3.33Å; N490-I493 PolarHBondContact OD1-N 3.33Å; N490-H494 PolarHBondContact O-CD2 3.31Å; N490-H494 VanDerWaalsContact O-CG 3.24Å; N490-H494 PolarHBondContact O-N 3.25Å
491	K	93	Very high	94	Very high	98 Å²	98	26.5 Å²	26.5	43%	0.426	13%	0.134	S	C	.	.	H	α-helix	trans	-59.8	-39	-176.9	-68.2	169.6	172.8	159.6	0	112.4	H330 H494 R495	H330-K491 WeakPolarHBondContact NE2-CE 3.46Å; H330-K491 PolarHBondContact NE2-NZ 3.36Å; H330-K491 PolarHBondContact O-N 3.13Å; K491-H494 PolarHBondContact O-N 3.09Å; K491-R495 PolarHBondContact O-N 2.89Å
492	R	94.4	Very high	94.2	Very high	10 Å²	10	24.1 Å²	24.1	4%	0.038	12%	0.123	C	C	.	.	H	α-helix	trans	-67.6	-42.7	-179.1	-167.5	171.7	-171.2	-90.9	-10	111.4	A363 N490 A496 I541 A542 L814 N815	A363-R492 PolarHBondContact O-NH2 3.46Å; N490-R492 VanDerWaalsContact C-N 3.29Å; N490-R492 PolarHBondContact O-N 3.27Å; N490-R492 WeakPolarHBondContact OD1-CA 3.04Å; N490-R492 WeakPolarHBondContact OD1-CB 3.37Å; N490-R492 PolarHBondContact OD1-N 3.38Å; R492-A496 WeakPolarHBondContact O-CB 3.37Å; R492-A496 PolarHBondContact O-N 2.93Å; R492-I541 PolarHBondContact NH1-O 3.49Å; R492-I541 PolarHBondContact NH2-O 2.87Å; R492-I541 VanDerWaalsContact NH2-O 3.11Å; R492-A542 PolarHBondContact NH1-O 2.88Å; R492-L814 HydrophobicContact CG-CB 4.03Å; R492-N815 PolarHBondContact NE-OD1 3.48Å
493	I	95.3	Very high	94.4	Very high	32 Å²	32	24.2 Å²	24.2	16%	0.164	13%	0.125	C	C	.	.	H	α-helix	trans	-67.6	-43.2	175.1	-64.4	176.1	0	0	0	110.4	N490 R495 A496 M497 A542	N490-I493 HydrophobicContact CB-CB 4.07Å; N490-I493 HydrophobicContact CB-CD1 3.98Å; N490-I493 HydrophobicContact CB-CG1 4.11Å; N490-I493 PolarHBondContact O-N 3.33Å; N490-I493 PolarHBondContact OD1-N 3.33Å; I493-R495 VanDerWaalsContact C-N 3.35Å; I493-R495 PolarHBondContact O-N 2.86Å; I493-A496 PolarHBondContact O-N 3.26Å; I493-M497 HydrophobicContact CG2-CG 3.98Å; I493-M497 VanDerWaalsContact O-CG 3.28Å; I493-M497 WeakPolarHBondContact O-CG 3.5Å; I493-M497 PolarHBondContact O-N 3.15Å; I493-A542 HydrophobicContact CG1-CB 4.4Å
494	H	95.6	Very high	94.7	Very high	30 Å²	30	19.8 Å²	19.8	14%	0.139	10%	0.101	C	C	.	.	H	α-helix	trans	-54.8	-51.8	175.9	-66	164	0	0	0	110.8	G477 Q481 N490 K491 A496 M497 G498	G477-H494 VanDerWaalsContact CA-O 3.23Å; G477-H494 WeakPolarHBondContact CA-O 3.15Å; Q481-H494 PolarHBondContact OE1-NE2 2.68Å; N490-H494 PolarHBondContact O-CD2 3.31Å; N490-H494 VanDerWaalsContact O-CG 3.24Å; N490-H494 PolarHBondContact O-N 3.25Å; K491-H494 PolarHBondContact O-N 3.09Å; H494-A496 PolarHBondContact O-N 2.85Å; H494-M497 PolarHBondContact O-N 3.46Å; H494-G498 PolarHBondContact O-N 3.2Å
495	R	96.9	Very high	94.9	Very high	12 Å²	12	20 Å²	20	5%	0.045	10%	0.101	C	C	.	.	H	α-helix	trans	-58.2	-48	177.3	-170.7	171.6	-61.2	141.8	2.4	112.7	D474 K491 I493 M497 G498 L499 V813 L814 T816 S818	D474-R495 VanDerWaalsContact OD1-CB 3.22Å; D474-R495 WeakPolarHBondContact OD1-CB 3.13Å; D474-R495 VanDerWaalsContact OD1-CG 3.31Å; D474-R495 WeakPolarHBondContact OD1-CG 3.34Å; D474-R495 IonicContact OD1-CZ 3.63Å; D474-R495 IonicContact OD1-NE 3.99Å; D474-R495 PolarHBondContact OD1-NE 2.85Å; D474-R495 IonicContact OD1-NH2 2.84Å; D474-R495 IonicContact OD2-CZ 2.71Å; D474-R495 IonicContact OD2-NE 3.51Å; D474-R495 IonicContact OD2-NH2 3.41Å; D474-R495 PolarHBondContact OD2-NH2 2.89Å; K491-R495 PolarHBondContact O-N 2.89Å; I493-R495 VanDerWaalsContact C-N 3.35Å; I493-R495 PolarHBondContact O-N 2.86Å; R495-M497 VanDerWaalsContact C-N 3.31Å; R495-M497 PolarHBondContact O-N 2.59Å; R495-G498 PolarHBondContact O-N 2.87Å; R495-L499 HydrophobicContact CG-CD1 3.96Å; R495-L499 HydrophobicContact CG-CG 4.35Å; R495-L499 WeakPolarHBondContact O-CB 3.39Å; R495-L499 WeakPolarHBondContact O-CG 3.4Å; R495-L499 PolarHBondContact O-N 3.15Å; R495-V813 WeakPolarHBondContact CD-O 3.4Å; R495-V813 PolarHBondContact NH1-O 3.46Å; R495-L814 HydrophobicContact CB-CD2 4.23Å; R495-L814 HydrophobicContact CG-CD2 4.29Å; R495-L814 PolarHBondContact NH1-O 3.14Å; R495-T816 PolarHBondContact NH1-O 3.39Å; R495-T816 PolarHBondContact NH2-O 3.43Å; R495-S818 PolarHBondContact NH2-OG 2.93Å
496	A	97.8	Very high	95.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.2	-45.9	-179.5	0	0	0	0	0	111.9	R492 I493 H494 L499 A500 W538 A542 L814	R492-A496 WeakPolarHBondContact O-CB 3.37Å; R492-A496 PolarHBondContact O-N 2.93Å; I493-A496 PolarHBondContact O-N 3.26Å; H494-A496 PolarHBondContact O-N 2.85Å; A496-L499 PolarHBondContact O-N 3.22Å; A496-A500 WeakPolarHBondContact O-CB 3.27Å; A496-A500 PolarHBondContact O-N 3.48Å; A496-W538 HydrophobicContact CB-CB 4.35Å; A496-W538 HydrophobicContact CB-CE3 4.33Å; A496-A542 HydrophobicContact CB-CB 3.5Å; A496-L814 HydrophobicContact CB-CD2 3.58Å
497	M	97.8	Very high	95.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-75.7	-30.1	-177.6	-58	-49.2	-46.6	0	0	112.4	M480 I493 H494 R495 A500 T501 A535 R539 V737 V738 S741	M480-M497 HydrophobicContact CE-CB 4.26Å; M480-M497 HydrophobicContact SD-CB 3.72Å; I493-M497 HydrophobicContact CG2-CG 3.98Å; I493-M497 VanDerWaalsContact O-CG 3.28Å; I493-M497 WeakPolarHBondContact O-CG 3.5Å; I493-M497 PolarHBondContact O-N 3.15Å; H494-M497 PolarHBondContact O-N 3.46Å; R495-M497 VanDerWaalsContact C-N 3.31Å; R495-M497 PolarHBondContact O-N 2.59Å; M497-A500 HydrophobicContact CE-CB 4.19Å; M497-A500 WeakPolarHBondContact O-CB 3.47Å; M497-A500 PolarHBondContact O-N 2.91Å; M497-T501 WeakPolarHBondContact O-CB 3.48Å; M497-T501 PolarHBondContact O-N 3.02Å; M497-T501 PolarHBondContact O-OG1 2.78Å; M497-A535 HydrophobicContact CE-CB 4.19Å; M497-R539 HydrophobicContact SD-CB 3.96Å; M497-V737 HydrophobicContact CB-CG2 4.43Å; M497-V737 HydrophobicContact CE-CG2 4.48Å; M497-V737 HydrophobicContact CG-CG2 3.72Å; M497-V737 HydrophobicContact SD-CG1 4.46Å; M497-V737 HydrophobicContact SD-CG2 4.42Å; M497-V738 HydrophobicContact CE-CG2 4.49Å; M497-S741 WeakPolarHBondContact CE-OG 3.36Å
498	G	97.5	Very high	95.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.3	-42.2	169.7	0	0	0	0	0	113.3	A473 H494 R495 T501 L502	A473-G498 WeakPolarHBondContact O-CA 3.43Å; H494-G498 PolarHBondContact O-N 3.2Å; R495-G498 PolarHBondContact O-N 2.87Å; G498-T501 WeakPolarHBondContact O-CB 3.39Å; G498-T501 PolarHBondContact O-N 3.25Å; G498-L502 WeakPolarHBondContact O-CG 3.3Å; G498-L502 PolarHBondContact O-N 3.32Å
499	L	98.4	Very high	95.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.9	-42.1	173.3	-73.3	171.1	0	0	0	110.8	L469 A473 R495 A496 T501 L502 E503 W538 V800 F804 V813	L469-L499 HydrophobicContact CD2-CD2 4.34Å; L469-L499 HydrophobicContact CG-CD2 4.3Å; A473-L499 HydrophobicContact CB-CB 4.47Å; A473-L499 HydrophobicContact CB-CD2 3.78Å; A473-L499 HydrophobicContact CB-CG 3.7Å; R495-L499 HydrophobicContact CG-CD1 3.96Å; R495-L499 HydrophobicContact CG-CG 4.35Å; R495-L499 WeakPolarHBondContact O-CB 3.39Å; R495-L499 WeakPolarHBondContact O-CG 3.4Å; R495-L499 PolarHBondContact O-N 3.15Å; A496-L499 PolarHBondContact O-N 3.22Å; L499-T501 PolarHBondContact O-N 3.08Å; L499-L502 PolarHBondContact O-N 3.38Å; L499-E503 WeakPolarHBondContact O-CB 3.24Å; L499-E503 PolarHBondContact O-N 3.39Å; L499-W538 HydrophobicContact CB-CD2 4.15Å; L499-W538 HydrophobicContact CB-CE3 4.36Å; L499-W538 HydrophobicContact CB-CH2 4.17Å; L499-W538 HydrophobicContact CB-CZ2 3.92Å; L499-W538 HydrophobicContact CB-CZ3 4.37Å; L499-W538 HydrophobicContact CD1-CE3 4.29Å; L499-W538 HydrophobicContact CD1-CH2 3.54Å; L499-W538 HydrophobicContact CD1-CZ2 4.13Å; L499-W538 HydrophobicContact CD1-CZ3 3.63Å; L499-W538 HydrophobicContact CG-CH2 4.42Å; L499-V800 HydrophobicContact CB-CG1 4.43Å; L499-V800 HydrophobicContact CD2-CG1 4.34Å; L499-F804 HydrophobicContact CD2-CE2 4Å; L499-V813 HydrophobicContact CD1-CG1 3.8Å; L499-V813 HydrophobicContact CD1-CG2 4.21Å
500	A	98.2	Very high	95.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-57.8	-45.6	172.6	0	0	0	0	0	112.3	A496 M497 L502 E503 V504 A535 W538	A496-A500 WeakPolarHBondContact O-CB 3.27Å; A496-A500 PolarHBondContact O-N 3.48Å; M497-A500 HydrophobicContact CE-CB 4.19Å; M497-A500 WeakPolarHBondContact O-CB 3.47Å; M497-A500 PolarHBondContact O-N 2.91Å; A500-L502 PolarHBondContact O-N 3Å; A500-E503 PolarHBondContact O-N 2.95Å; A500-V504 WeakPolarHBondContact O-CB 3.25Å; A500-V504 VanDerWaalsContact O-CG2 3.26Å; A500-V504 WeakPolarHBondContact O-CG2 3.3Å; A500-V504 PolarHBondContact O-N 3.1Å; A500-A535 HydrophobicContact CB-CB 4.06Å; A500-W538 HydrophobicContact CB-CB 3.99Å; A500-W538 HydrophobicContact CB-CG 4Å
501	T	97.8	Very high	95	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.9	-46.1	175.9	-76.7	0	0	0	0	112	L476 M480 M497 G498 L499 V504 M505 S741 M744 G745 M748	L476-T501 HydrophobicContact CD1-CG2 4.04Å; M480-T501 WeakPolarHBondContact CE-OG1 3.49Å; M497-T501 WeakPolarHBondContact O-CB 3.48Å; M497-T501 PolarHBondContact O-N 3.02Å; M497-T501 PolarHBondContact O-OG1 2.78Å; G498-T501 WeakPolarHBondContact O-CB 3.39Å; G498-T501 PolarHBondContact O-N 3.25Å; L499-T501 PolarHBondContact O-N 3.08Å; T501-V504 PolarHBondContact O-N 3.11Å; T501-M505 WeakPolarHBondContact O-CB 3.45Å; T501-M505 PolarHBondContact O-N 3.48Å; T501-S741 WeakPolarHBondContact OG1-CA 3.39Å; T501-S741 PolarHBondContact OG1-O 3.39Å; T501-M744 HydrophobicContact CG2-CB 3.71Å; T501-G745 VanDerWaalsContact O-CA 3.25Å; T501-G745 WeakPolarHBondContact O-CA 3.44Å; T501-M748 HydrophobicContact CG2-SD 3.79Å
502	L	97.5	Very high	94.8	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.6	-38.8	178.5	-68.4	171.6	0	0	0	112	L469 T472 A473 L476 G498 L499 A500 M505 Q506 M748 Y794 L797 V800	L469-L502 HydrophobicContact CD1-CD1 3.68Å; L469-L502 HydrophobicContact CG-CD1 4.46Å; T472-L502 HydrophobicContact CG2-CD1 4.13Å; T472-L502 HydrophobicContact CG2-CD2 4.19Å; A473-L502 HydrophobicContact CB-CD1 4.14Å; L476-L502 HydrophobicContact CD1-CD1 4.32Å; L476-L502 HydrophobicContact CD1-CD2 3.65Å; L476-L502 HydrophobicContact CD1-CG 3.81Å; G498-L502 WeakPolarHBondContact O-CG 3.3Å; G498-L502 PolarHBondContact O-N 3.32Å; L499-L502 PolarHBondContact O-N 3.38Å; A500-L502 PolarHBondContact O-N 3Å; L502-M505 HydrophobicContact CD2-CE 4.26Å; L502-M505 WeakPolarHBondContact O-CB 3.37Å; L502-M505 PolarHBondContact O-N 2.96Å; L502-Q506 VanDerWaalsContact O-CG 3.25Å; L502-Q506 WeakPolarHBondContact O-CG 3.2Å; L502-Q506 PolarHBondContact O-N 3.48Å; L502-M748 HydrophobicContact CD2-CE 4.06Å; L502-Y794 HydrophobicContact CD2-CD1 4.38Å; L502-Y794 HydrophobicContact CD2-CE1 4.46Å; L502-L797 HydrophobicContact CD2-CD1 4.04Å; L502-V800 HydrophobicContact CB-CG2 3.84Å
503	E	96.8	Very high	94.4	Very high	34 Å²	34	19.1 Å²	19.1	16%	0.159	10%	0.096	C	C	.	.	H	α-helix	trans	-68.7	-42.5	177.3	-168.1	177	165.2	0	0	111.9	L499 A500 M505 Q506 A507 I534 W538 V800	L499-E503 WeakPolarHBondContact O-CB 3.24Å; L499-E503 PolarHBondContact O-N 3.39Å; A500-E503 PolarHBondContact O-N 2.95Å; E503-M505 VanDerWaalsContact C-N 3.34Å; E503-M505 PolarHBondContact O-N 3.41Å; E503-Q506 PolarHBondContact O-N 2.82Å; E503-A507 WeakPolarHBondContact O-CB 3.4Å; E503-A507 PolarHBondContact O-N 2.65Å; E503-I534 HydrophobicContact CB-CG2 3.69Å; E503-I534 VanDerWaalsContact CD-CG2 3.48Å; E503-I534 HydrophobicContact CG-CG2 3.63Å; E503-W538 PolarHBondContact OE2-NE1 3.44Å; E503-V800 HydrophobicContact CB-CB 3.87Å; E503-V800 HydrophobicContact CB-CG1 3.97Å; E503-V800 HydrophobicContact CB-CG2 4.26Å; E503-V800 HydrophobicContact CG-CB 4.16Å; E503-V800 HydrophobicContact CG-CG1 4.37Å
504	V	96.4	Very high	93.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-45.6	172.8	168.6	0	0	0	0	110.4	A500 T501 Q506 A507 M508 M531 I534 V742	A500-V504 WeakPolarHBondContact O-CB 3.25Å; A500-V504 VanDerWaalsContact O-CG2 3.26Å; A500-V504 WeakPolarHBondContact O-CG2 3.3Å; A500-V504 PolarHBondContact O-N 3.1Å; T501-V504 PolarHBondContact O-N 3.11Å; V504-Q506 PolarHBondContact O-N 3.13Å; V504-A507 PolarHBondContact O-N 3.01Å; V504-M508 HydrophobicContact CG1-CG 4.25Å; V504-M508 HydrophobicContact CG1-SD 4.05Å; V504-M508 WeakPolarHBondContact O-CB 3.41Å; V504-M508 WeakPolarHBondContact O-CG 3.41Å; V504-M508 PolarHBondContact O-N 3.22Å; V504-M531 HydrophobicContact CG1-CG 3.78Å; V504-M531 HydrophobicContact CG1-SD 4.3Å; V504-M531 HydrophobicContact CG2-CG 4.48Å; V504-I534 HydrophobicContact CG2-CB 4.05Å; V504-I534 HydrophobicContact CG2-CD1 4.39Å; V504-I534 HydrophobicContact CG2-CG2 3.9Å; V504-V742 HydrophobicContact CG2-CG2 4.26Å
505	M	95.3	Very high	92.2	Very high	16 Å²	16	22.5 Å²	22.5	8%	0.079	13%	0.126	C	C	.	.	H	α-helix	trans	-55.1	-50.6	174.8	176.4	-159.3	69.5	0	0	111.1	T501 L502 E503 M508 H509 G745 M748 A749	T501-M505 WeakPolarHBondContact O-CB 3.45Å; T501-M505 PolarHBondContact O-N 3.48Å; L502-M505 HydrophobicContact CD2-CE 4.26Å; L502-M505 WeakPolarHBondContact O-CB 3.37Å; L502-M505 PolarHBondContact O-N 2.96Å; E503-M505 VanDerWaalsContact C-N 3.34Å; E503-M505 PolarHBondContact O-N 3.41Å; M505-M508 PolarHBondContact O-N 2.86Å; M505-H509 VanDerWaalsContact O-CB 3.25Å; M505-H509 WeakPolarHBondContact O-CB 3.27Å; M505-H509 PolarHBondContact O-N 2.79Å; M505-G745 VanDerWaalsContact CA-O 3.31Å; M505-G745 WeakPolarHBondContact CA-O 3.17Å; M505-G745 WeakPolarHBondContact CB-O 3.23Å; M505-M748 HydrophobicContact CB-CB 4.15Å; M505-M748 HydrophobicContact CG-CB 3.67Å; M505-M748 HydrophobicContact SD-CB 3.73Å; M505-M748 HydrophobicContact SD-CE 3.82Å; M505-A749 HydrophobicContact CG-CB 4.39Å
506	Q	93.8	Very high	90.8	Very high	20 Å²	20	29.2 Å²	29.2	9%	0.093	16%	0.155	C	C	.	.	H	α-helix	trans	-63	-42.3	180	-71.8	172.1	-4.5	0	0	111.9	L502 E503 V504 R510 P798 S799	L502-Q506 VanDerWaalsContact O-CG 3.25Å; L502-Q506 WeakPolarHBondContact O-CG 3.2Å; L502-Q506 PolarHBondContact O-N 3.48Å; E503-Q506 PolarHBondContact O-N 2.82Å; V504-Q506 PolarHBondContact O-N 3.13Å; Q506-R510 WeakPolarHBondContact O-CB 3.47Å; Q506-R510 VanDerWaalsContact O-CG 3.23Å; Q506-R510 WeakPolarHBondContact O-CG 3.44Å; Q506-R510 PolarHBondContact O-N 2.94Å; Q506-P798 PolarHBondContact NE2-O 2.71Å; Q506-S799 VanDerWaalsContact OE1-CA 3.31Å; Q506-S799 PolarHBondContact OE1-OG 3.26Å
507	A	92.4	Very high	89.4	Confident	13 Å²	13	30.2 Å²	30.2	11%	0.107	16%	0.161	C	C	.	.	H	α-helix	trans	-66.1	-43.8	179.3	0	0	0	0	0	112.4	E503 V504 T511 M526 I534	E503-A507 WeakPolarHBondContact O-CB 3.4Å; E503-A507 PolarHBondContact O-N 2.65Å; V504-A507 PolarHBondContact O-N 3.01Å; A507-T511 WeakPolarHBondContact O-CB 3.43Å; A507-T511 PolarHBondContact O-N 2.84Å; A507-T511 PolarHBondContact O-OG1 2.86Å; A507-M526 HydrophobicContact CB-SD 4.11Å; A507-I534 HydrophobicContact CB-CD1 3.72Å
508	M	91.6	Very high	87.9	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-68.4	-43.5	177.3	-72.5	-167.4	79.6	0	0	112.1	V504 M505 R510 T511 W512 M526 M531 L695 A746 A749	V504-M508 HydrophobicContact CG1-CG 4.25Å; V504-M508 HydrophobicContact CG1-SD 4.05Å; V504-M508 WeakPolarHBondContact O-CB 3.41Å; V504-M508 WeakPolarHBondContact O-CG 3.41Å; V504-M508 PolarHBondContact O-N 3.22Å; M505-M508 PolarHBondContact O-N 2.86Å; M508-R510 VanDerWaalsContact C-N 3.32Å; M508-R510 PolarHBondContact O-N 2.74Å; M508-T511 CarbonylContact O-C 3.58Å; M508-T511 WeakPolarHBondContact O-CA 3.42Å; M508-T511 WeakPolarHBondContact O-CB 3.5Å; M508-T511 PolarHBondContact O-N 3.42Å; M508-W512 HydrophobicContact CE-CH2 3.95Å; M508-W512 HydrophobicContact CE-CZ2 3.32Å; M508-W512 PolarHBondContact O-N 2.8Å; M508-M526 HydrophobicContact CG-CE 3.96Å; M508-M531 HydrophobicContact CE-SD 3.87Å; M508-M531 HydrophobicContact CG-CG 4.43Å; M508-M531 HydrophobicContact CG-SD 3.99Å; M508-M531 HydrophobicContact SD-CG 4.33Å; M508-M531 HydrophobicContact SD-SD 3.31Å; M508-L695 HydrophobicContact CE-CD2 4.06Å; M508-A746 HydrophobicContact CE-CB 3.9Å; M508-A746 WeakPolarHBondContact SD-CA 3.34Å; M508-A746 HydrophobicContact SD-CB 3.31Å; M508-A746 WeakPolarHBondContact SD-CB 3.48Å; M508-A749 HydrophobicContact CB-CB 3.72Å
509	H	89.9	Confident	86.4	Confident	55 Å²	55	40 Å²	40	26%	0.255	20%	0.2	S	C	.	.	H	α-helix	trans	-57.3	-47.1	175.8	-172.7	66.1	0	0	0	111	M505 T511 W512 S513	M505-H509 VanDerWaalsContact O-CB 3.25Å; M505-H509 WeakPolarHBondContact O-CB 3.27Å; M505-H509 PolarHBondContact O-N 2.79Å; H509-T511 VanDerWaalsContact C-N 3.3Å; H509-T511 PolarHBondContact O-N 2.94Å; H509-W512 PolarHBondContact O-N 2.82Å; H509-S513 WeakPolarHBondContact O-CB 3.33Å; H509-S513 PolarHBondContact O-N 3.42Å; H509-S513 PolarHBondContact O-OG 2.81Å; H509-S513 VanDerWaalsContact O-OG 3.06Å
510	R	88.8	Confident	84.7	Confident	99 Å²	99	43.7 Å²	43.7	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-58.2	-40	173.5	-72.3	169	-176.4	161.3	-2.2	112.5	Q506 M508 S514 V517 S799	Q506-R510 WeakPolarHBondContact O-CB 3.47Å; Q506-R510 VanDerWaalsContact O-CG 3.23Å; Q506-R510 WeakPolarHBondContact O-CG 3.44Å; Q506-R510 PolarHBondContact O-N 2.94Å; M508-R510 VanDerWaalsContact C-N 3.32Å; M508-R510 PolarHBondContact O-N 2.74Å; R510-S514 WeakPolarHBondContact O-CA 3.44Å; R510-S514 WeakPolarHBondContact O-CB 3.31Å; R510-S514 PolarHBondContact O-N 3.24Å; R510-S514 PolarHBondContact O-OG 3.14Å; R510-V517 HydrophobicContact CB-CG2 4.35Å; R510-S799 PolarHBondContact NH2-OG 3.04Å
511	T	89.3	Confident	83.2	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-69.1	-32	179.7	-58.3	0	0	0	0	112.9	A507 M508 H509 S514 M526	A507-T511 WeakPolarHBondContact O-CB 3.43Å; A507-T511 PolarHBondContact O-N 2.84Å; A507-T511 PolarHBondContact O-OG1 2.86Å; M508-T511 CarbonylContact O-C 3.58Å; M508-T511 WeakPolarHBondContact O-CA 3.42Å; M508-T511 WeakPolarHBondContact O-CB 3.5Å; M508-T511 PolarHBondContact O-N 3.42Å; H509-T511 VanDerWaalsContact C-N 3.3Å; H509-T511 PolarHBondContact O-N 2.94Å; T511-S514 CarbonylContact C-O 3.57Å; T511-M526 HydrophobicContact CG2-CB 4.09Å
512	W	89.2	Confident	81.9	Confident	8 Å²	8	53 Å²	53	3%	0.03	27%	0.272	C	S	.	.	H	α-helix	trans	-83.9	-31.4	176.4	-63.4	-16.6	0	0	0	112.5	M508 H509 L695 K700 M703 V714 A749	M508-W512 HydrophobicContact CE-CH2 3.95Å; M508-W512 HydrophobicContact CE-CZ2 3.32Å; M508-W512 PolarHBondContact O-N 2.8Å; H509-W512 PolarHBondContact O-N 2.82Å; W512-L695 HydrophobicContact CH2-CD1 4.49Å; W512-L695 HydrophobicContact CZ2-CD1 3.95Å; W512-L695 HydrophobicContact CZ2-CG 4.14Å; W512-K700 WeakPolarHBondContact O-CG 3.42Å; W512-M703 HydrophobicContact CB-CG 3.69Å; W512-M703 HydrophobicContact CE3-CE 3.73Å; W512-M703 HydrophobicContact CZ3-CE 4.38Å; W512-V714 HydrophobicContact CH2-CG1 3.89Å; W512-A749 HydrophobicContact CE3-CB 4.29Å; W512-A749 HydrophobicContact CH2-CB 4.29Å; W512-A749 HydrophobicContact CZ3-CB 3.82Å
513	S	86.1	Confident	80.8	Confident	76 Å²	76	57.7 Å²	57.7	53%	0.531	30%	0.3	S	S	.	.	H	α-helix	trans	-79.1	-29.2	174.5	-55.5	0	0	0	0	113.4	H509	H509-S513 WeakPolarHBondContact O-CB 3.33Å; H509-S513 PolarHBondContact O-N 3.42Å; H509-S513 PolarHBondContact O-OG 2.81Å; H509-S513 VanDerWaalsContact O-OG 3.06Å
514	S	79.2	Confident	80.2	Confident	48 Å²	48	60.2 Å²	60.2	34%	0.336	31%	0.308	S	S	.	.			trans	-130.1	134.8	-177.8	73.5	0	0	0	0	111.2	R510 T511 K516	R510-S514 WeakPolarHBondContact O-CA 3.44Å; R510-S514 WeakPolarHBondContact O-CB 3.31Å; R510-S514 PolarHBondContact O-N 3.24Å; R510-S514 PolarHBondContact O-OG 3.14Å; T511-S514 CarbonylContact C-O 3.57Å; S514-K516 PolarHBondContact O-N 3.45Å; S514-K516 PolarHBondContact OG-O 2.88Å
515	S	65.6	Low	79.4	Confident	84 Å²	84	64.4 Å²	64.4	59%	0.587	33%	0.328	S	S	*	.	S	Bend	trans	-73.2	-10.7	-176.1	-74.2	0	0	0	0	114.7	K700	S515-K700 PolarHBondContact OG-NZ 2.64Å; S515-K700 VanDerWaalsContact OG-NZ 3.08Å
516	K	66.8	Low	79.1	Confident	153 Å²	153	64 Å²	64	67%	0.665	33%	0.326	S	S	*	.			trans	-138.7	128.5	177.8	-64.4	-175.5	-179.5	179.5	0	109.9	S514 T523	S514-K516 PolarHBondContact O-N 3.45Å; S514-K516 PolarHBondContact OG-O 2.88Å; K516-T523 HydrophobicContact CB-CG2 3.79Å; K516-T523 HydrophobicContact CD-CG2 4.41Å
517	V	69.5	Low	79	Confident	22 Å²	22	66.3 Å²	66.3	13%	0.133	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	150.1	-179.8	-175.3	0	0	0	0	109.1	R510 V519 T523 R524	R510-V517 HydrophobicContact CB-CG2 4.35Å; V517-V519 PolarHBondContact O-N 3.26Å; V517-T523 CarbonylContact O-C 3.55Å; V517-T523 WeakPolarHBondContact O-CA 3.17Å; V517-R524 PolarHBondContact N-O 3.45Å; V517-R524 VanDerWaalsContact N-O 3.08Å; V517-R524 PolarHBondContact O-N 2.87Å
518	R	65.6	Low	79	Confident	190 Å²	190	66.5 Å²	66.5	72%	0.717	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.4	173.3	-164.5	176.1	-174.1	-171.8	-4	109	G521 K522	R518-G521 PolarHBondContact NE-O 3.31Å; R518-K522 CarbonylContact C-O 3.6Å; R518-K522 WeakPolarHBondContact CA-O 3.47Å
519	V	66.1	Low	79.1	Confident	15 Å²	15	68.3 Å²	68.3	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.6	179.2	-178.1	0	0	0	0	108.3	V517 G521 K522 R524 M526 D530	V517-V519 PolarHBondContact O-N 3.26Å; V519-G521 PolarHBondContact O-N 2.83Å; V519-K522 PolarHBondContact N-O 3.09Å; V519-K522 PolarHBondContact O-N 2.92Å; V519-K522 VanDerWaalsContact O-O 3.09Å; V519-R524 HydrophobicContact CB-CG 4.4Å; V519-M526 HydrophobicContact CG2-CB 4.23Å; V519-M526 HydrophobicContact CG2-CG 4.3Å; V519-D530 HydrophobicContact CG1-CB 3.93Å
520	N	62.9	Low	79.2	Confident	79 Å²	79	66.5 Å²	66.5	42%	0.422	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	48.1	-175.7	-59.3	-10.7	0	0	0	112.2	K522	N520-K522 PolarHBondContact O-N 3.45Å; N520-K522 VanDerWaalsContact O-N 3.13Å
521	G	65.7	Low	79.4	Confident	40 Å²	40	61.9 Å²	61.9	41%	0.412	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-14.3	179.9	0	0	0	0	0	116.1	R518 V519	R518-G521 PolarHBondContact NE-O 3.31Å; V519-G521 PolarHBondContact O-N 2.83Å
522	K	70.8	Confident	79.7	Confident	156 Å²	156	61.6 Å²	61.6	68%	0.678	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	137.2	-177.6	-64.1	-179.7	-177.7	176	0	112.4	R518 V519 N520 R524	R518-K522 CarbonylContact C-O 3.6Å; R518-K522 WeakPolarHBondContact CA-O 3.47Å; V519-K522 PolarHBondContact N-O 3.09Å; V519-K522 PolarHBondContact O-N 2.92Å; V519-K522 VanDerWaalsContact O-O 3.09Å; N520-K522 PolarHBondContact O-N 3.45Å; N520-K522 VanDerWaalsContact O-N 3.13Å; K522-R524 PolarHBondContact O-N 3.49Å
523	T	75.6	Confident	80	Confident	98 Å²	98	62.6 Å²	62.6	60%	0.601	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	100.7	176.4	-55.6	0	0	0	0	110.5	K516 V517	K516-T523 HydrophobicContact CB-CG2 3.79Å; K516-T523 HydrophobicContact CD-CG2 4.41Å; V517-T523 CarbonylContact O-C 3.55Å; V517-T523 WeakPolarHBondContact O-CA 3.17Å
524	R	83.6	Confident	80.4	Confident	87 Å²	87	60 Å²	60	33%	0.328	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	171.4	178.9	65	176.3	175.6	91.2	-3.1	111.7	V517 V519 K522 M526 D530	V517-R524 PolarHBondContact N-O 3.45Å; V517-R524 VanDerWaalsContact N-O 3.08Å; V517-R524 PolarHBondContact O-N 2.87Å; V519-R524 HydrophobicContact CB-CG 4.4Å; K522-R524 PolarHBondContact O-N 3.49Å; R524-M526 PolarHBondContact O-N 2.9Å; R524-D530 IonicContact CZ-OD1 3.06Å; R524-D530 IonicContact CZ-OD2 3.35Å; R524-D530 IonicContact NH1-OD1 2.65Å; R524-D530 IonicContact NH1-OD2 2.62Å; R524-D530 PolarHBondContact NH1-OD2 3.2Å; R524-D530 VanDerWaalsContact NH2-CG 3.34Å; R524-D530 IonicContact NH2-OD1 3.29Å; R524-D530 PolarHBondContact NH2-OD1 3.18Å; R524-D530 IonicContact NH2-OD2 3.82Å; R524-D530 PolarHBondContact NH2-OD2 2.88Å
525	Q	80.1	Confident	81.3	Confident	88 Å²	88	57.8 Å²	57.8	41%	0.411	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-70.1	129.2	169.3	-173.4	174.1	-7.5	0	0	109.3	Q527	Q525-Q527 PolarHBondContact O-N 3.29Å; Q525-Q527 PolarHBondContact O-NE2 3.43Å; Q525-Q527 VanDerWaalsContact O-NE2 3.12Å
526	M	88.3	Confident	82.8	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.03	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-62.6	129.2	175.5	-167.7	-179.6	91.8	0	0	109.5	A507 M508 T511 V519 R524 D530 M531 Y692	A507-M526 HydrophobicContact CB-SD 4.11Å; M508-M526 HydrophobicContact CG-CE 3.96Å; T511-M526 HydrophobicContact CG2-CB 4.09Å; V519-M526 HydrophobicContact CG2-CB 4.23Å; V519-M526 HydrophobicContact CG2-CG 4.3Å; R524-M526 PolarHBondContact O-N 2.9Å; M526-D530 HydrophobicContact CG-CB 3.67Å; M526-M531 HydrophobicContact CE-CB 3.72Å; M526-M531 HydrophobicContact CE-CG 4.12Å; M526-M531 HydrophobicContact CE-SD 4.5Å; M526-Y692 WeakPolarHBondContact CE-OH 3.48Å; M526-Y692 WeakPolarHBondContact O-CE1 3.28Å; M526-Y692 PolarHBondContact O-OH 3.33Å
527	Q	91.8	Very high	84.1	Confident	69 Å²	69	47.7 Å²	47.7	32%	0.322	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-91.8	164.6	174.1	-57.5	-56.1	-54.7	0	0	110.4	Q525 R529 D530 M531	Q525-Q527 PolarHBondContact O-N 3.29Å; Q525-Q527 PolarHBondContact O-NE2 3.43Å; Q525-Q527 VanDerWaalsContact O-NE2 3.12Å; Q527-R529 PolarHBondContact O-N 3.47Å; Q527-D530 WeakPolarHBondContact CB-OD2 3.43Å; Q527-D530 PolarHBondContact N-OD2 3.17Å; Q527-D530 WeakPolarHBondContact O-CB 3.44Å; Q527-D530 PolarHBondContact O-N 3.19Å; Q527-D530 VanDerWaalsContact O-N 3.14Å; Q527-M531 PolarHBondContact O-N 3.3Å
528	W	93.4	Very high	85.5	Confident	18 Å²	18	46.8 Å²	46.8	7%	0.068	22%	0.224	C	C	.	.	H	α-helix	trans	-55.1	-40.9	176.6	71.1	-96.8	0	0	0	111.4	D530 M531 F532 W550 Q685 I688 Y692 F725	W528-D530 VanDerWaalsContact C-N 3.33Å; W528-D530 PolarHBondContact O-N 3.36Å; W528-M531 WeakPolarHBondContact O-CB 3.5Å; W528-M531 PolarHBondContact O-N 3.01Å; W528-M531 VanDerWaalsContact O-N 3.15Å; W528-F532 AromaticContact CE3-CD2 3.68Å; W528-F532 HydrophobicContact CE3-CD2 3.68Å; W528-F532 AromaticContact CE3-CE2 3.95Å; W528-F532 HydrophobicContact CE3-CE2 3.95Å; W528-F532 HydrophobicContact CZ3-CD2 4.13Å; W528-F532 VanDerWaalsContact O-CD2 3.31Å; W528-F532 WeakPolarHBondContact O-CD2 3.43Å; W528-F532 PolarHBondContact O-N 2.89Å; W528-W550 HydrophobicContact CH2-CZ3 4.43Å; W528-W550 HydrophobicContact CZ3-CH2 4.13Å; W528-W550 HydrophobicContact CZ3-CZ3 4.34Å; W528-Q685 HydrophobicContact CZ2-CG 4.04Å; W528-I688 HydrophobicContact CB-CG2 4.13Å; W528-I688 HydrophobicContact CD2-CG2 3.56Å; W528-I688 HydrophobicContact CE3-CG2 3.87Å; W528-I688 HydrophobicContact CG-CG2 3.67Å; W528-Y692 HydrophobicContact CB-CD1 4.09Å; W528-Y692 HydrophobicContact CB-CD2 3.68Å; W528-Y692 HydrophobicContact CB-CE2 4.23Å; W528-Y692 HydrophobicContact CB-CG 3.6Å; W528-F725 HydrophobicContact CZ3-CE2 4.39Å
529	R	93.1	Very high	86.9	Confident	39 Å²	39	38.2 Å²	38.2	15%	0.147	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-38.6	-179.2	-175.6	170.5	-65.5	-111.5	5.1	112.7	Q527 M531 F532 D533 W550 D552	Q527-R529 PolarHBondContact O-N 3.47Å; R529-M531 PolarHBondContact O-N 3.3Å; R529-F532 PolarHBondContact O-N 2.94Å; R529-F532 VanDerWaalsContact O-N 3.14Å; R529-D533 WeakPolarHBondContact O-CB 3.4Å; R529-D533 PolarHBondContact O-N 3.31Å; R529-W550 HydrophobicContact CG-CZ2 4.19Å; R529-W550 VanDerWaalsContact NH1-CE3 3.26Å; R529-D552 IonicContact CZ-OD1 2.64Å; R529-D552 IonicContact CZ-OD2 3.86Å; R529-D552 IonicContact NH1-OD1 3.14Å; R529-D552 PolarHBondContact NH1-OD1 3.23Å; R529-D552 IonicContact NH1-OD2 2.79Å; R529-D552 IonicContact NH2-OD1 3.69Å; R529-D552 PolarHBondContact NH2-OD1 3.25Å; R529-D552 IonicContact NH2-OD2 3.88Å; R529-D552 PolarHBondContact NH2-OD2 3.12Å
530	D	92.3	Very high	88.3	Confident	17 Å²	17	37.9 Å²	37.9	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-33.8	178.7	-57.2	-48.3	0	0	0	111.1	V519 R524 M526 Q527 W528 I534	V519-D530 HydrophobicContact CG1-CB 3.93Å; R524-D530 IonicContact CZ-OD1 3.06Å; R524-D530 IonicContact CZ-OD2 3.35Å; R524-D530 IonicContact NH1-OD1 2.65Å; R524-D530 IonicContact NH1-OD2 2.62Å; R524-D530 PolarHBondContact NH1-OD2 3.2Å; R524-D530 VanDerWaalsContact NH2-CG 3.34Å; R524-D530 IonicContact NH2-OD1 3.29Å; R524-D530 PolarHBondContact NH2-OD1 3.18Å; R524-D530 IonicContact NH2-OD2 3.82Å; R524-D530 PolarHBondContact NH2-OD2 2.88Å; M526-D530 HydrophobicContact CG-CB 3.67Å; Q527-D530 WeakPolarHBondContact CB-OD2 3.43Å; Q527-D530 PolarHBondContact N-OD2 3.17Å; Q527-D530 WeakPolarHBondContact O-CB 3.44Å; Q527-D530 PolarHBondContact O-N 3.19Å; Q527-D530 VanDerWaalsContact O-N 3.14Å; W528-D530 VanDerWaalsContact C-N 3.33Å; W528-D530 PolarHBondContact O-N 3.36Å; D530-I534 PolarHBondContact O-N 3.14Å
531	M	92.5	Very high	89.8	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-46.5	175.3	-172.3	177.9	54.2	0	0	112.2	V504 M508 M526 Q527 W528 R529 Y692 L721 V742	V504-M531 HydrophobicContact CG1-CG 3.78Å; V504-M531 HydrophobicContact CG1-SD 4.3Å; V504-M531 HydrophobicContact CG2-CG 4.48Å; M508-M531 HydrophobicContact CE-SD 3.87Å; M508-M531 HydrophobicContact CG-CG 4.43Å; M508-M531 HydrophobicContact CG-SD 3.99Å; M508-M531 HydrophobicContact SD-CG 4.33Å; M508-M531 HydrophobicContact SD-SD 3.31Å; M526-M531 HydrophobicContact CE-CB 3.72Å; M526-M531 HydrophobicContact CE-CG 4.12Å; M526-M531 HydrophobicContact CE-SD 4.5Å; Q527-M531 PolarHBondContact O-N 3.3Å; W528-M531 WeakPolarHBondContact O-CB 3.5Å; W528-M531 PolarHBondContact O-N 3.01Å; W528-M531 VanDerWaalsContact O-N 3.15Å; R529-M531 PolarHBondContact O-N 3.3Å; M531-Y692 HydrophobicContact CE-CD2 4.46Å; M531-Y692 HydrophobicContact CE-CE2 4.35Å; M531-L721 HydrophobicContact CE-CD2 3.55Å; M531-V742 HydrophobicContact CE-CG1 3.55Å; M531-V742 HydrophobicContact CG-CG1 3.84Å; M531-V742 HydrophobicContact SD-CG1 3.71Å
532	F	95.9	Very high	91.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-71.4	-33.4	178.4	-74.4	-89.6	0	0	0	111.8	W528 R529 I534 A535 V536 W550 L721 I722 F725 V738 V742	W528-F532 AromaticContact CE3-CD2 3.68Å; W528-F532 HydrophobicContact CE3-CD2 3.68Å; W528-F532 AromaticContact CE3-CE2 3.95Å; W528-F532 HydrophobicContact CE3-CE2 3.95Å; W528-F532 HydrophobicContact CZ3-CD2 4.13Å; W528-F532 VanDerWaalsContact O-CD2 3.31Å; W528-F532 WeakPolarHBondContact O-CD2 3.43Å; W528-F532 PolarHBondContact O-N 2.89Å; R529-F532 PolarHBondContact O-N 2.94Å; R529-F532 VanDerWaalsContact O-N 3.14Å; F532-I534 PolarHBondContact O-N 3.28Å; F532-A535 PolarHBondContact O-N 3.16Å; F532-V536 WeakPolarHBondContact O-CG2 3.48Å; F532-V536 PolarHBondContact O-N 3.39Å; F532-W550 HydrophobicContact CB-CH2 3.83Å; F532-W550 HydrophobicContact CB-CZ2 3.96Å; F532-L721 HydrophobicContact CE2-CD2 3.74Å; F532-L721 HydrophobicContact CE2-CG 4.49Å; F532-L721 HydrophobicContact CZ-CD2 3.77Å; F532-I722 HydrophobicContact CE1-CD1 4.03Å; F532-I722 HydrophobicContact CZ-CD1 3.95Å; F532-F725 HydrophobicContact CB-CE2 4.41Å; F532-F725 AromaticContact CD1-CD2 3.82Å; F532-F725 HydrophobicContact CD1-CD2 3.82Å; F532-F725 HydrophobicContact CD1-CE1 4.14Å; F532-F725 AromaticContact CD1-CE2 3.34Å; F532-F725 HydrophobicContact CD1-CE2 3.34Å; F532-F725 HydrophobicContact CD1-CG 4.39Å; F532-F725 AromaticContact CD1-CZ 3.51Å; F532-F725 HydrophobicContact CD1-CZ 3.51Å; F532-F725 HydrophobicContact CD2-CD2 4.34Å; F532-F725 HydrophobicContact CD2-CE2 4.15Å; F532-F725 HydrophobicContact CE1-CB 4.4Å; F532-F725 AromaticContact CE1-CD1 3.96Å; F532-F725 HydrophobicContact CE1-CD1 3.96Å; F532-F725 AromaticContact CE1-CD2 3.39Å; F532-F725 HydrophobicContact CE1-CD2 3.39Å; F532-F725 AromaticContact CE1-CE1 4Å; F532-F725 HydrophobicContact CE1-CE1 4Å; F532-F725 AromaticContact CE1-CE2 3.44Å; F532-F725 HydrophobicContact CE1-CE2 3.44Å; F532-F725 VanDerWaalsContact CE1-CE2 3.44Å; F532-F725 AromaticContact CE1-CG 3.65Å; F532-F725 HydrophobicContact CE1-CG 3.65Å; F532-F725 AromaticContact CE1-CZ 3.74Å; F532-F725 HydrophobicContact CE1-CZ 3.74Å; F532-F725 AromaticContact CE2-CD2 3.96Å; F532-F725 HydrophobicContact CE2-CD2 3.96Å; F532-F725 HydrophobicContact CE2-CE2 4.23Å; F532-F725 HydrophobicContact CG-CD2 4.28Å; F532-F725 AromaticContact CG-CE2 3.72Å; F532-F725 HydrophobicContact CG-CE2 3.72Å; F532-F725 HydrophobicContact CG-CZ 4.22Å; F532-F725 HydrophobicContact CZ-CB 4.22Å; F532-F725 AromaticContact CZ-CD2 3.48Å; F532-F725 HydrophobicContact CZ-CD2 3.48Å; F532-F725 VanDerWaalsContact CZ-CD2 3.48Å; F532-F725 AromaticContact CZ-CE2 3.9Å; F532-F725 HydrophobicContact CZ-CE2 3.9Å; F532-F725 AromaticContact CZ-CG 3.86Å; F532-F725 HydrophobicContact CZ-CG 3.86Å; F532-V738 HydrophobicContact CD1-CG1 4.03Å; F532-V742 HydrophobicContact CD1-CB 4.25Å; F532-V742 HydrophobicContact CD1-CG1 4.32Å; F532-V742 HydrophobicContact CD1-CG2 3.76Å; F532-V742 HydrophobicContact CE1-CB 4.08Å; F532-V742 HydrophobicContact CE1-CG1 4Å; F532-V742 HydrophobicContact CE1-CG2 4.11Å; F532-V742 HydrophobicContact CE2-CG1 4.33Å; F532-V742 HydrophobicContact CG-CG2 4.22Å; F532-V742 HydrophobicContact CZ-CG1 4.01Å
533	D	94.8	Very high	92.3	Very high	28 Å²	28	25.9 Å²	25.9	15%	0.15	12%	0.123	C	C	.	.	H	α-helix	trans	-58.3	-35.3	177.5	-91.1	1.1	0	0	0	112.4	R529 A535 V536 K537 W550	R529-D533 WeakPolarHBondContact O-CB 3.4Å; R529-D533 PolarHBondContact O-N 3.31Å; D533-A535 PolarHBondContact O-N 3.3Å; D533-V536 PolarHBondContact O-N 3.21Å; D533-K537 WeakPolarHBondContact O-CB 3.43Å; D533-K537 VanDerWaalsContact O-CG 3.26Å; D533-K537 WeakPolarHBondContact O-CG 3.27Å; D533-K537 PolarHBondContact O-N 3.31Å; D533-W550 WeakPolarHBondContact OD1-CZ2 3.21Å; D533-W550 PolarHBondContact OD1-NE1 2.87Å
534	I	95.4	Very high	93.1	Very high	23 Å²	23	21.4 Å²	21.4	12%	0.118	10%	0.096	C	C	.	.	H	α-helix	trans	-55.2	-53.5	172.8	-67.3	166.2	0	0	0	110.1	E503 V504 A507 D530 F532 K537 W538	E503-I534 HydrophobicContact CB-CG2 3.69Å; E503-I534 VanDerWaalsContact CD-CG2 3.48Å; E503-I534 HydrophobicContact CG-CG2 3.63Å; V504-I534 HydrophobicContact CG2-CB 4.05Å; V504-I534 HydrophobicContact CG2-CD1 4.39Å; V504-I534 HydrophobicContact CG2-CG2 3.9Å; A507-I534 HydrophobicContact CB-CD1 3.72Å; D530-I534 PolarHBondContact O-N 3.14Å; F532-I534 PolarHBondContact O-N 3.28Å; I534-K537 PolarHBondContact O-N 3.42Å; I534-W538 PolarHBondContact O-N 3.49Å
535	A	97.1	Very high	93.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.8	-36.2	-179.8	0	0	0	0	0	112.9	M497 A500 F532 D533 W538 R539 V738 S741 V742	M497-A535 HydrophobicContact CE-CB 4.19Å; A500-A535 HydrophobicContact CB-CB 4.06Å; F532-A535 PolarHBondContact O-N 3.16Å; D533-A535 PolarHBondContact O-N 3.3Å; A535-W538 PolarHBondContact O-N 2.98Å; A535-R539 WeakPolarHBondContact O-CB 3.47Å; A535-R539 PolarHBondContact O-N 3.35Å; A535-V738 HydrophobicContact CB-CG1 3.96Å; A535-S741 WeakPolarHBondContact CB-OG 3.48Å; A535-V742 HydrophobicContact CB-CG2 3.83Å
536	V	96.8	Very high	93.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.9	-42.9	175	168.5	0	0	0	0	111.2	F532 D533 R539 R540 V548 W550 L731 V738	F532-V536 WeakPolarHBondContact O-CG2 3.48Å; F532-V536 PolarHBondContact O-N 3.39Å; D533-V536 PolarHBondContact O-N 3.21Å; V536-R539 PolarHBondContact O-N 2.96Å; V536-R540 HydrophobicContact CG1-CG 4.31Å; V536-R540 WeakPolarHBondContact O-CB 3.45Å; V536-R540 VanDerWaalsContact O-CG 3.28Å; V536-R540 WeakPolarHBondContact O-CG 3.39Å; V536-R540 PolarHBondContact O-N 3.46Å; V536-V548 HydrophobicContact CG1-CG1 4.13Å; V536-W550 HydrophobicContact CG2-CZ2 4.02Å; V536-L731 HydrophobicContact CG2-CD1 3.73Å; V536-L731 HydrophobicContact CG2-CD2 4.15Å; V536-V738 HydrophobicContact CG2-CG1 3.95Å; V536-V738 HydrophobicContact CG2-CG2 4.33Å
537	K	95.6	Very high	93.9	Very high	25 Å²	25	17.1 Å²	17.1	11%	0.109	8%	0.082	C	C	.	.	H	α-helix	trans	-60.7	-48.2	178.5	-74.6	175.9	-179	-169	0	111.8	V413 Y416 D533 I534 R539 R540 I541	V413-K537 HydrophobicContact CG1-CD 3.92Å; V413-K537 PolarHBondContact O-NZ 3.21Å; Y416-K537 HydrophobicContact CD1-CD 4.39Å; Y416-K537 HydrophobicContact CD1-CG 4.07Å; Y416-K537 HydrophobicContact CE1-CG 4.24Å; D533-K537 WeakPolarHBondContact O-CB 3.43Å; D533-K537 VanDerWaalsContact O-CG 3.26Å; D533-K537 WeakPolarHBondContact O-CG 3.27Å; D533-K537 PolarHBondContact O-N 3.31Å; I534-K537 PolarHBondContact O-N 3.42Å; K537-R539 PolarHBondContact O-N 2.9Å; K537-R540 PolarHBondContact O-N 3.15Å; K537-I541 WeakPolarHBondContact O-CG1 3.38Å; K537-I541 PolarHBondContact O-N 3.36Å; K537-I541 VanDerWaalsContact O-N 3.17Å
538	W	97.2	Very high	94	Very high	3 Å²	3	13.9 Å²	13.9	1%	0.011	7%	0.067	C	C	.	.	H	α-helix	trans	-59.7	-45.8	174.1	-79.7	105.7	0	0	0	111.8	A496 L499 A500 E503 I534 A535 R540 I541 A542 V800 F804 M810 V813 L814	A496-W538 HydrophobicContact CB-CB 4.35Å; A496-W538 HydrophobicContact CB-CE3 4.33Å; L499-W538 HydrophobicContact CB-CD2 4.15Å; L499-W538 HydrophobicContact CB-CE3 4.36Å; L499-W538 HydrophobicContact CB-CH2 4.17Å; L499-W538 HydrophobicContact CB-CZ2 3.92Å; L499-W538 HydrophobicContact CB-CZ3 4.37Å; L499-W538 HydrophobicContact CD1-CE3 4.29Å; L499-W538 HydrophobicContact CD1-CH2 3.54Å; L499-W538 HydrophobicContact CD1-CZ2 4.13Å; L499-W538 HydrophobicContact CD1-CZ3 3.63Å; L499-W538 HydrophobicContact CG-CH2 4.42Å; A500-W538 HydrophobicContact CB-CB 3.99Å; A500-W538 HydrophobicContact CB-CG 4Å; E503-W538 PolarHBondContact OE2-NE1 3.44Å; I534-W538 PolarHBondContact O-N 3.49Å; A535-W538 PolarHBondContact O-N 2.98Å; W538-R540 VanDerWaalsContact C-N 3.34Å; W538-R540 PolarHBondContact O-N 3.36Å; W538-I541 PolarHBondContact O-N 3.21Å; W538-A542 WeakPolarHBondContact O-CB 3.27Å; W538-A542 PolarHBondContact O-N 3.12Å; W538-V800 HydrophobicContact CZ2-CG1 3.82Å; W538-F804 HydrophobicContact CH2-CB 4.34Å; W538-F804 HydrophobicContact CH2-CD2 4.22Å; W538-F804 HydrophobicContact CH2-CG 4.43Å; W538-F804 HydrophobicContact CZ2-CD2 4.42Å; W538-M810 HydrophobicContact CD2-CE 3.37Å; W538-M810 VanDerWaalsContact CE2-CE 3.49Å; W538-M810 HydrophobicContact CE3-CE 3.5Å; W538-M810 VanDerWaalsContact CE3-CE 3.5Å; W538-M810 HydrophobicContact CG-CE 3.93Å; W538-M810 HydrophobicContact CH2-CB 3.98Å; W538-M810 HydrophobicContact CH2-CE 3.83Å; W538-M810 HydrophobicContact CH2-CG 3.69Å; W538-M810 HydrophobicContact CZ2-CE 3.73Å; W538-M810 HydrophobicContact CZ2-CG 4.16Å; W538-M810 HydrophobicContact CZ3-CB 3.87Å; W538-M810 HydrophobicContact CZ3-CE 3.72Å; W538-M810 HydrophobicContact CZ3-CG 4.02Å; W538-V813 HydrophobicContact CH2-CG1 4.04Å; W538-V813 HydrophobicContact CZ3-CG1 4.14Å; W538-L814 HydrophobicContact CE3-CD1 4.3Å; W538-L814 HydrophobicContact CE3-CD2 4.24Å; W538-L814 HydrophobicContact CE3-CG 4.45Å; W538-L814 HydrophobicContact CZ3-CD1 4.25Å; W538-L814 HydrophobicContact CZ3-CD2 4.11Å; W538-L814 HydrophobicContact CZ3-CG 4.07Å
539	R	96.7	Very high	94	Very high	11 Å²	11	13.1 Å²	13.1	4%	0.042	6%	0.064	C	C	.	.	H	α-helix	trans	-62	-38.8	179.4	179.9	63.7	-162.8	100.1	-5.7	112.6	M497 A535 V536 K537 A542 D543 V548 V738	M497-R539 HydrophobicContact SD-CB 3.96Å; A535-R539 WeakPolarHBondContact O-CB 3.47Å; A535-R539 PolarHBondContact O-N 3.35Å; V536-R539 PolarHBondContact O-N 2.96Å; K537-R539 PolarHBondContact O-N 2.9Å; R539-A542 PolarHBondContact O-N 3.08Å; R539-D543 IonicContact NH2-OD2 2.71Å; R539-V548 HydrophobicContact CG-CG1 4.3Å; R539-V548 HydrophobicContact CG-CG2 3.93Å; R539-V738 HydrophobicContact CB-CG2 4.02Å; R539-V738 HydrophobicContact CG-CG2 4.2Å
540	R	94.8	Very high	94	Very high	7 Å²	7	11.3 Å²	11.3	3%	0.026	6%	0.057	C	C	.	.	H	α-helix	trans	-63.2	-45.4	176.7	-77.1	170.5	176.8	170.3	2.8	112.6	D419 V536 K537 W538 A542 V548	D419-R540 IonicContact OD1-NH2 3.88Å; D419-R540 PolarHBondContact OD1-NH2 3.39Å; D419-R540 IonicContact OD2-CZ 3.71Å; D419-R540 IonicContact OD2-NH1 3.09Å; D419-R540 PolarHBondContact OD2-NH1 3.33Å; D419-R540 IonicContact OD2-NH2 3.9Å; D419-R540 PolarHBondContact OD2-NH2 3.48Å; V536-R540 HydrophobicContact CG1-CG 4.31Å; V536-R540 WeakPolarHBondContact O-CB 3.45Å; V536-R540 VanDerWaalsContact O-CG 3.28Å; V536-R540 WeakPolarHBondContact O-CG 3.39Å; V536-R540 PolarHBondContact O-N 3.46Å; K537-R540 PolarHBondContact O-N 3.15Å; W538-R540 VanDerWaalsContact C-N 3.34Å; W538-R540 PolarHBondContact O-N 3.36Å; R540-A542 VanDerWaalsContact C-N 3.31Å; R540-V548 HydrophobicContact CG-CB 3.91Å; R540-V548 HydrophobicContact CG-CG1 4.37Å; R540-V548 PolarHBondContact NE-O 2.9Å; R540-V548 PolarHBondContact NH2-O 3Å
541	I	94.8	Very high	93.9	Very high	7 Å²	7	10.6 Å²	10.6	4%	0.036	5%	0.053	C	C	.	.	H	α-helix	trans	-74.9	-28.5	-177.9	-64.6	166.2	0	0	0	110.4	Y416 R492 K537 W538 D543 I807 M810 I811 L814	Y416-I541 HydrophobicContact CE1-CD1 4.49Å; R492-I541 PolarHBondContact NH1-O 3.49Å; R492-I541 PolarHBondContact NH2-O 2.87Å; R492-I541 VanDerWaalsContact NH2-O 3.11Å; K537-I541 WeakPolarHBondContact O-CG1 3.38Å; K537-I541 PolarHBondContact O-N 3.36Å; K537-I541 VanDerWaalsContact O-N 3.17Å; W538-I541 PolarHBondContact O-N 3.21Å; I541-D543 VanDerWaalsContact C-N 3.31Å; I541-D543 PolarHBondContact O-N 3.2Å; I541-I807 HydrophobicContact CD1-CG1 4.39Å; I541-I807 HydrophobicContact CD1-CG2 4.3Å; I541-M810 HydrophobicContact CD1-CB 4.38Å; I541-M810 HydrophobicContact CD1-CE 3.51Å; I541-M810 HydrophobicContact CD1-SD 3.4Å; I541-M810 WeakPolarHBondContact CD1-SD 3.4Å; I541-M810 HydrophobicContact CG2-CB 4.4Å; I541-I811 HydrophobicContact CG2-CG1 3.66Å; I541-L814 HydrophobicContact CG2-CD1 3.91Å
542	A	95.2	Very high	93.8	Very high	4 Å²	4	12.6 Å²	12.6	3%	0.033	6%	0.064	C	C	.	.	H	α-helix	trans	-68.2	-19.9	178.8	0	0	0	0	0	115.2	R492 I493 A496 W538 R539 R540	R492-A542 PolarHBondContact NH1-O 2.88Å; I493-A542 HydrophobicContact CG1-CB 4.4Å; A496-A542 HydrophobicContact CB-CB 3.5Å; W538-A542 WeakPolarHBondContact O-CB 3.27Å; W538-A542 PolarHBondContact O-N 3.12Å; R539-A542 PolarHBondContact O-N 3.08Å; R540-A542 VanDerWaalsContact C-N 3.31Å
543	D	92.8	Very high	93.4	Very high	12 Å²	12	15.7 Å²	15.7	6%	0.064	8%	0.078	C	C	.	.			trans	-155.3	97	174.6	-171.2	3.4	0	0	0	110.5	Y328 R539 I541 D545 Q546	Y328-D543 PolarHBondContact OH-OD1 2.92Å; R539-D543 IonicContact NH2-OD2 2.71Å; I541-D543 VanDerWaalsContact C-N 3.31Å; I541-D543 PolarHBondContact O-N 3.2Å; D543-D545 PolarHBondContact O-N 3.46Å; D543-D545 PolarHBondContact OD1-N 3.26Å; D543-Q546 PolarHBondContact O-N 3.47Å; D543-Q546 WeakPolarHBondContact OD2-CG 3.5Å
544	P	92.6	Very high	93	Very high	4 Å²	4	14.9 Å²	14.9	3%	0.026	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.4	-176.3	26.5	-32	0	0	0	114	L359 V362 A363 L398 Y401 L405 Q546	L359-P544 HydrophobicContact CD1-CG 3.91Å; V362-P544 HydrophobicContact CB-CG 4.48Å; V362-P544 HydrophobicContact CG1-CB 3.97Å; V362-P544 HydrophobicContact CG1-CG 3.95Å; A363-P544 HydrophobicContact CB-CG 4.08Å; L398-P544 HydrophobicContact CD1-CB 4.43Å; Y401-P544 HydrophobicContact CD1-CB 4.26Å; Y401-P544 HydrophobicContact CE1-CB 4.03Å; L405-P544 HydrophobicContact CD1-CB 4.44Å; P544-Q546 VanDerWaalsContact C-N 3.35Å
545	D	90.1	Very high	92.3	Very high	21 Å²	21	15.4 Å²	15.4	11%	0.112	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-29.7	175.2	-163.3	63	0	0	0	112.4	Y355 L359 K394 D543 P547	Y355-D545 PolarHBondContact OH-OD1 3.39Å; L359-D545 HydrophobicContact CD1-CB 3.82Å; L359-D545 HydrophobicContact CD2-CB 3.81Å; L359-D545 HydrophobicContact CG-CB 4.46Å; K394-D545 IonicContact NZ-OD2 2.69Å; K394-D545 PolarHBondContact NZ-OD2 2.97Å; D543-D545 PolarHBondContact O-N 3.46Å; D543-D545 PolarHBondContact OD1-N 3.26Å; D545-P547 WeakPolarHBondContact O-CD 3.49Å
546	Q	89	Confident	91.2	Very high	58 Å²	58	19 Å²	19	27%	0.271	11%	0.108	S	C	.	.	S	Bend	trans	-100	116.1	-170.9	-67.4	-158.8	1.4	0	0	112.4	D543 P544 V548	D543-Q546 PolarHBondContact O-N 3.47Å; D543-Q546 WeakPolarHBondContact OD2-CG 3.5Å; P544-Q546 VanDerWaalsContact C-N 3.35Å; Q546-V548 PolarHBondContact O-N 3.41Å
547	P	90.4	Very high	90.1	Very high	13 Å²	13	27.6 Å²	27.6	8%	0.084	14%	0.141	C	C	.	.			trans	-71.4	104.2	173	26.1	-30.4	0	0	0	110.1	W430 D545 L549 S732	W430-P547 HydrophobicContact CD2-CB 3.55Å; W430-P547 HydrophobicContact CD2-CG 4Å; W430-P547 HydrophobicContact CE3-CB 3.73Å; W430-P547 HydrophobicContact CG-CB 4.02Å; W430-P547 HydrophobicContact CG-CG 4.03Å; W430-P547 HydrophobicContact CH2-CB 4.12Å; W430-P547 HydrophobicContact CZ2-CB 3.96Å; W430-P547 HydrophobicContact CZ2-CG 4.44Å; W430-P547 HydrophobicContact CZ3-CB 4.01Å; D545-P547 WeakPolarHBondContact O-CD 3.49Å; P547-L549 HydrophobicContact CB-CD1 3.88Å; P547-L549 HydrophobicContact CB-CG 4.17Å; P547-S732 PolarHBondContact O-OG 3.47Å
548	V	94.5	Very high	88.9	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	14%	0.138	C	C	.	.			trans	-97.9	94.5	173.3	176.6	0	0	0	0	107.2	V536 R539 R540 Q546 L731 R733	V536-V548 HydrophobicContact CG1-CG1 4.13Å; R539-V548 HydrophobicContact CG-CG1 4.3Å; R539-V548 HydrophobicContact CG-CG2 3.93Å; R540-V548 HydrophobicContact CG-CB 3.91Å; R540-V548 HydrophobicContact CG-CG1 4.37Å; R540-V548 PolarHBondContact NE-O 2.9Å; R540-V548 PolarHBondContact NH2-O 3Å; Q546-V548 PolarHBondContact O-N 3.41Å; V548-L731 HydrophobicContact CG1-CD1 4.11Å; V548-R733 WeakPolarHBondContact CG1-O 3.35Å; V548-R733 HydrophobicContact CG2-CB 4.17Å
549	L	93.5	Very high	87.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.143	C	C	.	.			trans	-126.4	144.1	-169.4	-59.8	171.2	0	0	0	110.3	V418 K427 W430 P547 L551 M554 L731 S732	V418-L549 HydrophobicContact CG1-CD2 3.71Å; K427-L549 HydrophobicContact CB-CD1 3.87Å; K427-L549 HydrophobicContact CD-CD1 4.48Å; K427-L549 HydrophobicContact CD-CD2 4.36Å; K427-L549 HydrophobicContact CG-CD1 4.04Å; W430-L549 HydrophobicContact CE3-CD1 4.49Å; P547-L549 HydrophobicContact CB-CD1 3.88Å; P547-L549 HydrophobicContact CB-CG 4.17Å; L549-L551 PolarHBondContact O-N 3.13Å; L549-M554 HydrophobicContact CB-CE 3.46Å; L549-M554 VanDerWaalsContact CB-CE 3.46Å; L549-M554 HydrophobicContact CD1-CE 3.6Å; L549-M554 HydrophobicContact CG-CE 4.16Å; L549-L731 WeakPolarHBondContact O-CA 3.43Å; L549-S732 PolarHBondContact N-OG 3.45Å; L549-S732 PolarHBondContact O-N 3.29Å; L549-S732 PolarHBondContact O-OG 2.9Å
550	W	93.3	Very high	86	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.008	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-70.9	117.5	173.9	-74.2	110.7	0	0	0	109.7	D419 W528 R529 F532 D533 V536 D552 Q553 F725 P730 L731	D419-W550 PolarHBondContact OD1-N 3.21Å; W528-W550 HydrophobicContact CH2-CZ3 4.43Å; W528-W550 HydrophobicContact CZ3-CH2 4.13Å; W528-W550 HydrophobicContact CZ3-CZ3 4.34Å; R529-W550 HydrophobicContact CG-CZ2 4.19Å; R529-W550 VanDerWaalsContact NH1-CE3 3.26Å; F532-W550 HydrophobicContact CB-CH2 3.83Å; F532-W550 HydrophobicContact CB-CZ2 3.96Å; D533-W550 WeakPolarHBondContact OD1-CZ2 3.21Å; D533-W550 PolarHBondContact OD1-NE1 2.87Å; V536-W550 HydrophobicContact CG2-CZ2 4.02Å; W550-D552 VanDerWaalsContact C-N 3.27Å; W550-D552 PolarHBondContact O-N 3Å; W550-Q553 HydrophobicContact CB-CB 4.25Å; W550-Q553 HydrophobicContact CB-CG 4.15Å; W550-Q553 PolarHBondContact O-N 3.01Å; W550-Q553 VanDerWaalsContact O-N 3.13Å; W550-F725 AromaticContact CH2-CE2 3.88Å; W550-F725 HydrophobicContact CH2-CE2 3.88Å; W550-F725 HydrophobicContact CH2-CZ 4.19Å; W550-F725 HydrophobicContact CZ3-CE2 4.01Å; W550-F725 HydrophobicContact CZ3-CZ 4.32Å; W550-P730 HydrophobicContact CE3-CB 3.99Å; W550-P730 HydrophobicContact CE3-CG 4.44Å; W550-P730 HydrophobicContact CZ3-CB 3.77Å; W550-P730 HydrophobicContact CZ3-CG 3.8Å; W550-L731 HydrophobicContact CD2-CD2 3.44Å; W550-L731 VanDerWaalsContact CD2-CD2 3.44Å; W550-L731 HydrophobicContact CE3-CD2 3.45Å; W550-L731 VanDerWaalsContact CE3-CD2 3.45Å; W550-L731 HydrophobicContact CE3-CG 4.49Å; W550-L731 HydrophobicContact CG-CD2 4Å; W550-L731 HydrophobicContact CH2-CD2 4.18Å; W550-L731 HydrophobicContact CZ2-CD2 4.17Å; W550-L731 HydrophobicContact CZ3-CD2 3.84Å
551	L	90.2	Very high	84.5	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-66.5	-33.1	-174.3	-65.3	179.5	0	0	0	111.9	L549 Q553 M554 L559 F563 T676 P730	L549-L551 PolarHBondContact O-N 3.13Å; L551-Q553 PolarHBondContact O-N 2.9Å; L551-M554 HydrophobicContact CD2-CE 4.47Å; L551-M554 WeakPolarHBondContact O-CB 3.47Å; L551-M554 VanDerWaalsContact O-CG 3.29Å; L551-M554 WeakPolarHBondContact O-CG 3.48Å; L551-M554 PolarHBondContact O-N 3.16Å; L551-M554 VanDerWaalsContact O-N 3.11Å; L551-L559 WeakPolarHBondContact O-CD2 3.18Å; L551-F563 HydrophobicContact CD1-CD1 3.61Å; L551-F563 HydrophobicContact CD1-CE1 3.91Å; L551-F563 HydrophobicContact CD1-CG 4.42Å; L551-F563 HydrophobicContact CD2-CD1 3.54Å; L551-F563 HydrophobicContact CD2-CD2 4.09Å; L551-F563 HydrophobicContact CD2-CE1 3.47Å; L551-F563 VanDerWaalsContact CD2-CE1 3.47Å; L551-F563 HydrophobicContact CD2-CE2 4.02Å; L551-F563 HydrophobicContact CD2-CG 3.87Å; L551-F563 HydrophobicContact CD2-CZ 3.72Å; L551-F563 HydrophobicContact CG-CD1 4.19Å; L551-F563 HydrophobicContact CG-CE1 4.36Å; L551-T676 HydrophobicContact CB-CG2 3.89Å; L551-T676 HydrophobicContact CD1-CG2 4.35Å; L551-T676 WeakPolarHBondContact CD1-OG1 3.32Å; L551-P730 WeakPolarHBondContact CB-O 3.36Å; L551-P730 WeakPolarHBondContact CG-O 3.45Å; L551-P730 PolarHBondContact N-O 2.76Å
552	D	88.5	Confident	82.9	Confident	44 Å²	44	41 Å²	41	24%	0.235	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-70.3	-11.3	177.6	71	-50.8	0	0	0	114	R529 W550 T681 Q685	R529-D552 IonicContact CZ-OD1 2.64Å; R529-D552 IonicContact CZ-OD2 3.86Å; R529-D552 IonicContact NH1-OD1 3.14Å; R529-D552 PolarHBondContact NH1-OD1 3.23Å; R529-D552 IonicContact NH1-OD2 2.79Å; R529-D552 IonicContact NH2-OD1 3.69Å; R529-D552 PolarHBondContact NH2-OD1 3.25Å; R529-D552 IonicContact NH2-OD2 3.88Å; R529-D552 PolarHBondContact NH2-OD2 3.12Å; W550-D552 VanDerWaalsContact C-N 3.27Å; W550-D552 PolarHBondContact O-N 3Å; D552-T681 HydrophobicContact CB-CG2 3.86Å; D552-Q685 PolarHBondContact OD2-NE2 3.39Å
553	Q	88.8	Confident	81.6	Confident	65 Å²	65	41.4 Å²	41.4	30%	0.304	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-102	13.9	174.1	-61.6	-175.5	-25.3	0	0	112.5	D419 K427 W550 L551	D419-Q553 HydrophobicContact CB-CB 4.41Å; K427-Q553 PolarHBondContact NZ-O 2.62Å; W550-Q553 HydrophobicContact CB-CB 4.25Å; W550-Q553 HydrophobicContact CB-CG 4.15Å; W550-Q553 PolarHBondContact O-N 3.01Å; W550-Q553 VanDerWaalsContact O-N 3.13Å; L551-Q553 PolarHBondContact O-N 2.9Å
554	M	86	Confident	80.6	Confident	11 Å²	11	42.9 Å²	42.9	5%	0.054	22%	0.222	C	C	.	.	S	Bend	trans	-81.4	158.3	171.6	-67.2	-67.1	-179.5	0	0	111.7	K427 A431 L549 L551 A556	K427-M554 HydrophobicContact CB-CE 4.12Å; K427-M554 HydrophobicContact CB-SD 3.76Å; A431-M554 HydrophobicContact CB-CE 4.13Å; L549-M554 HydrophobicContact CB-CE 3.46Å; L549-M554 VanDerWaalsContact CB-CE 3.46Å; L549-M554 HydrophobicContact CD1-CE 3.6Å; L549-M554 HydrophobicContact CG-CE 4.16Å; L551-M554 HydrophobicContact CD2-CE 4.47Å; L551-M554 WeakPolarHBondContact O-CB 3.47Å; L551-M554 VanDerWaalsContact O-CG 3.29Å; L551-M554 WeakPolarHBondContact O-CG 3.48Å; L551-M554 PolarHBondContact O-N 3.16Å; L551-M554 VanDerWaalsContact O-N 3.11Å; M554-A556 PolarHBondContact O-N 3.35Å
555	P	81.4	Confident	80	Confident	34 Å²	34	44 Å²	44	22%	0.221	23%	0.228	C	C	.	.			trans	-54.5	140	176.5	-25.4	33.6	0	0	0	112.9	G424 R557 S558 L559	G424-P555 VanDerWaalsContact C-CG 3.42Å; G424-P555 WeakPolarHBondContact O-CD 3.32Å; G424-P555 WeakPolarHBondContact O-CG 3.04Å; P555-R557 VanDerWaalsContact C-N 3.26Å; P555-R557 PolarHBondContact O-N 2.88Å; P555-R557 VanDerWaalsContact O-N 3.11Å; P555-S558 WeakPolarHBondContact O-CA 3.41Å; P555-S558 WeakPolarHBondContact O-CB 3.3Å; P555-S558 PolarHBondContact O-N 3.21Å; P555-L559 PolarHBondContact O-N 3.39Å
556	A	72.7	Confident	79.6	Confident	75 Å²	75	47.1 Å²	47.1	62%	0.62	24%	0.242	S	C	*	.	H	α-helix	trans	-52.9	-38.3	-174.7	0	0	0	0	0	114	M554 S558 L559 S560	M554-A556 PolarHBondContact O-N 3.35Å; A556-S558 PolarHBondContact O-N 3.07Å; A556-L559 PolarHBondContact O-N 3.34Å; A556-L559 VanDerWaalsContact O-N 3.1Å; A556-S560 WeakPolarHBondContact O-CB 3.02Å; A556-S560 PolarHBondContact O-N 3.44Å; A556-S560 PolarHBondContact O-OG 3.42Å
557	R	73.5	Confident	79.6	Confident	181 Å²	181	45 Å²	45	68%	0.683	23%	0.232	S	C	*	.	H	α-helix	trans	-60.2	-28.9	176.5	-170.2	177.9	-175.7	-175.8	2.8	113.3	P555 S560	P555-R557 VanDerWaalsContact C-N 3.26Å; P555-R557 PolarHBondContact O-N 2.88Å; P555-R557 VanDerWaalsContact O-N 3.11Å; R557-S560 WeakPolarHBondContact CA-OG 3.19Å; R557-S560 PolarHBondContact O-OG 3.39Å
558	S	70.6	Confident	79.6	Confident	8 Å²	8	45.8 Å²	45.8	6%	0.056	24%	0.236	C	C	.	.	H	α-helix	trans	-76.8	-36.2	177.7	-54.1	0	0	0	0	111.5	N428 P555 A556 G562 F563	N428-S558 PolarHBondContact ND2-OG 3.08Å; N428-S558 WeakPolarHBondContact OD1-CB 3.42Å; N428-S558 PolarHBondContact OD1-OG 3.12Å; P555-S558 WeakPolarHBondContact O-CA 3.41Å; P555-S558 WeakPolarHBondContact O-CB 3.3Å; P555-S558 PolarHBondContact O-N 3.21Å; A556-S558 PolarHBondContact O-N 3.07Å; S558-G562 CarbonylContact O-C 3.54Å; S558-F563 PolarHBondContact O-N 3.02Å
559	L	68.6	Low	79.5	Confident	22 Å²	22	45.8 Å²	45.8	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-76.1	-37	176.2	-70.8	169.7	0	0	0	112	L551 P555 A556 R561 G562 T676	L551-L559 WeakPolarHBondContact O-CD2 3.18Å; P555-L559 PolarHBondContact O-N 3.39Å; A556-L559 PolarHBondContact O-N 3.34Å; A556-L559 VanDerWaalsContact O-N 3.1Å; L559-R561 VanDerWaalsContact C-N 3.29Å; L559-R561 PolarHBondContact O-N 3.36Å; L559-G562 WeakPolarHBondContact O-CA 3.36Å; L559-G562 PolarHBondContact O-N 3.24Å; L559-T676 HydrophobicContact CD2-CG2 3.98Å
560	S	64.1	Low	79.4	Confident	97 Å²	97	46 Å²	46	68%	0.678	24%	0.236	S	C	*	.	H	α-helix	trans	-68.5	-26.7	-178.5	72.9	0	0	0	0	113.3	A556 R557 G562	A556-S560 WeakPolarHBondContact O-CB 3.02Å; A556-S560 PolarHBondContact O-N 3.44Å; A556-S560 PolarHBondContact O-OG 3.42Å; R557-S560 WeakPolarHBondContact CA-OG 3.19Å; R557-S560 PolarHBondContact O-OG 3.39Å; S560-G562 VanDerWaalsContact C-N 3.31Å
561	R	63.2	Low	79.2	Confident	190 Å²	190	50.2 Å²	50.2	72%	0.717	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.7	171.8	-71.6	-174.9	172.9	-175.2	-3.9	112.9	L559	L559-R561 VanDerWaalsContact C-N 3.29Å; L559-R561 PolarHBondContact O-N 3.36Å
562	G	61.6	Low	79.1	Confident	18 Å²	18	51.3 Å²	51.3	19%	0.186	26%	0.264	C	S	.	.			trans	76.6	111.4	-168.2	0	0	0	0	0	110.8	S558 L559 S560 N564	S558-G562 CarbonylContact O-C 3.54Å; L559-G562 WeakPolarHBondContact O-CA 3.36Å; L559-G562 PolarHBondContact O-N 3.24Å; S560-G562 VanDerWaalsContact C-N 3.31Å; G562-N564 PolarHBondContact O-N 3.11Å
563	F	68.9	Low	78.9	Confident	12 Å²	12	50.8 Å²	50.8	5%	0.053	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	110.9	157.5	-170.1	-76.8	0	0	0	105.9	A431 K432 L551 S558 T676	A431-F563 HydrophobicContact CB-CE2 4.12Å; A431-F563 HydrophobicContact CB-CZ 4.24Å; K432-F563 HydrophobicContact CG-CE2 3.94Å; L551-F563 HydrophobicContact CD1-CD1 3.61Å; L551-F563 HydrophobicContact CD1-CE1 3.91Å; L551-F563 HydrophobicContact CD1-CG 4.42Å; L551-F563 HydrophobicContact CD2-CD1 3.54Å; L551-F563 HydrophobicContact CD2-CD2 4.09Å; L551-F563 HydrophobicContact CD2-CE1 3.47Å; L551-F563 VanDerWaalsContact CD2-CE1 3.47Å; L551-F563 HydrophobicContact CD2-CE2 4.02Å; L551-F563 HydrophobicContact CD2-CG 3.87Å; L551-F563 HydrophobicContact CD2-CZ 3.72Å; L551-F563 HydrophobicContact CG-CD1 4.19Å; L551-F563 HydrophobicContact CG-CE1 4.36Å; S558-F563 PolarHBondContact O-N 3.02Å; F563-T676 WeakPolarHBondContact O-CB 3.49Å; F563-T676 PolarHBondContact O-N 3.48Å; F563-T676 PolarHBondContact O-OG1 2.76Å
564	N	72.1	Confident	78.9	Confident	42 Å²	42	49.7 Å²	49.7	23%	0.225	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.1	-177.1	-69.6	-6.3	0	0	0	109.1	G562 H566	G562-N564 PolarHBondContact O-N 3.11Å; N564-H566 WeakPolarHBondContact CB-NE2 3.35Å; N564-H566 PolarHBondContact O-CD2 2.82Å; N564-H566 PolarHBondContact O-N 2.84Å
565	N	78.3	Confident	79.1	Confident	28 Å²	28	51 Å²	51	15%	0.15	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	109.3	166.2	-171.8	12.1	0	0	0	108	E673 T674	N565-E673 WeakPolarHBondContact O-CA 3.45Å; N565-T674 PolarHBondContact N-O 3.32Å; N565-T674 PolarHBondContact O-N 3.09Å
566	H	82.9	Confident	79.5	Confident	87 Å²	87	50.9 Å²	50.9	40%	0.403	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.4	-178.6	-64.7	-84.3	0	0	0	110.7	N564 E673	N564-H566 WeakPolarHBondContact CB-NE2 3.35Å; N564-H566 PolarHBondContact O-CD2 2.82Å; N564-H566 PolarHBondContact O-N 2.84Å; H566-E673 IonicContact CE1-OE1 2.69Å; H566-E673 PolarHBondContact CE1-OE1 3.16Å; H566-E673 IonicContact CE1-OE2 3.37Å; H566-E673 WeakPolarHBondContact ND1-CG 3.22Å; H566-E673 IonicContact ND1-OE1 3.78Å; H566-E673 PolarHBondContact ND1-OE1 3.45Å; H566-E673 IonicContact ND1-OE2 3.6Å
567	I	89.1	Confident	80.4	Confident	14 Å²	14	48.4 Å²	48.4	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	104.5	170.7	-56.1	177.6	0	0	0	107.4	L569 Y579 S671 V672 F766	I567-L569 HydrophobicContact CG2-CD2 4.42Å; I567-L569 PolarHBondContact O-N 3.3Å; I567-Y579 HydrophobicContact CG2-CD2 3.92Å; I567-Y579 HydrophobicContact CG2-CE1 4.09Å; I567-Y579 HydrophobicContact CG2-CE2 3.39Å; I567-Y579 HydrophobicContact CG2-CG 4.46Å; I567-Y579 VanDerWaalsContact CG2-CZ 3.48Å; I567-S671 CarbonylContact O-C 3.51Å; I567-S671 VanDerWaalsContact O-CA 3.25Å; I567-S671 WeakPolarHBondContact O-CA 3.37Å; I567-S671 WeakPolarHBondContact O-CB 3.25Å; I567-V672 HydrophobicContact CB-CB 4.32Å; I567-V672 PolarHBondContact N-O 3.3Å; I567-V672 PolarHBondContact O-N 2.79Å; I567-F766 HydrophobicContact CD1-CE2 3.86Å; I567-F766 HydrophobicContact CD1-CZ 4.13Å; I567-F766 HydrophobicContact CG2-CZ 4.19Å
568	N	90.7	Very high	81.2	Confident	29 Å²	29	43.8 Å²	43.8	16%	0.155	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	115.7	175.6	-63.3	-43.4	0	0	0	109.3	R571 N576	N568-R571 HydrophobicContact CB-CB 4.39Å; N568-N576 VanDerWaalsContact O-CB 3.3Å; N568-N576 WeakPolarHBondContact O-CB 3.34Å; N568-N576 PolarHBondContact O-ND2 3.16Å
569	L	91.9	Very high	82.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-46.9	173.4	-60.3	174.3	0	0	0	109.8	I567 N576 Y579 F583 I586 F670 V672 F766	I567-L569 HydrophobicContact CG2-CD2 4.42Å; I567-L569 PolarHBondContact O-N 3.3Å; L569-N576 WeakPolarHBondContact O-CB 3.41Å; L569-N576 PolarHBondContact O-N 3.45Å; L569-Y579 HydrophobicContact CD2-CD1 4.47Å; L569-Y579 HydrophobicContact CD2-CD2 3.87Å; L569-Y579 HydrophobicContact CD2-CG 3.63Å; L569-F583 HydrophobicContact CB-CE1 3.82Å; L569-F583 HydrophobicContact CB-CZ 4.04Å; L569-F583 HydrophobicContact CD2-CE1 4.13Å; L569-F583 HydrophobicContact CG-CE1 4.43Å; L569-I586 HydrophobicContact CD1-CD1 3.77Å; L569-F670 WeakPolarHBondContact CA-O 3.28Å; L569-F670 HydrophobicContact CB-CD1 3.59Å; L569-F670 HydrophobicContact CB-CE1 3.9Å; L569-F670 HydrophobicContact CB-CG 4.05Å; L569-F670 WeakPolarHBondContact CB-O 3.46Å; L569-F670 HydrophobicContact CD1-CD1 3.81Å; L569-F670 HydrophobicContact CD1-CD2 4.09Å; L569-F670 HydrophobicContact CD1-CE1 3.36Å; L569-F670 HydrophobicContact CD1-CE2 3.68Å; L569-F670 HydrophobicContact CD1-CG 4.16Å; L569-F670 HydrophobicContact CD1-CZ 3.31Å; L569-F670 HydrophobicContact CG-CD1 4.35Å; L569-F670 HydrophobicContact CG-CE1 4.28Å; L569-F670 PolarHBondContact N-O 2.85Å; L569-V672 HydrophobicContact CD1-CG2 3.78Å; L569-V672 HydrophobicContact CG-CG2 4.39Å; L569-F766 HydrophobicContact CD2-CZ 4.5Å
570	I	91.1	Very high	83.2	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.7	169.4	-55.9	169.5	0	0	0	108.1	I574 I575 F583 M668 L669 F670	I570-I574 WeakPolarHBondContact CA-O 3.31Å; I570-I575 HydrophobicContact CG1-CG1 4.47Å; I570-F583 HydrophobicContact CD1-CE2 3.73Å; I570-F583 HydrophobicContact CD1-CZ 4.24Å; I570-F583 HydrophobicContact CG1-CE2 3.82Å; I570-F583 HydrophobicContact CG1-CZ 3.83Å; I570-M668 HydrophobicContact CB-CE 4.12Å; I570-M668 HydrophobicContact CD1-CE 3.27Å; I570-M668 HydrophobicContact CG1-CE 4.27Å; I570-M668 HydrophobicContact CG2-CE 4Å; I570-L669 WeakPolarHBondContact O-CA 3.37Å; I570-F670 HydrophobicContact CB-CB 3.95Å; I570-F670 HydrophobicContact CD1-CB 4.43Å; I570-F670 HydrophobicContact CD1-CD1 4.04Å; I570-F670 HydrophobicContact CG1-CB 4.34Å; I570-F670 HydrophobicContact CG1-CD1 4.17Å; I570-F670 PolarHBondContact N-O 3.39Å; I570-F670 PolarHBondContact O-N 2.84Å
571	R	89.4	Confident	84.4	Confident	92 Å²	92	46.4 Å²	46.4	35%	0.347	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	112.8	173.1	-178.3	-178	176.5	163.8	5.1	109.7	I22 N568 Q573 I574 M668	I22-R571 VanDerWaalsContact O-CZ 3.25Å; I22-R571 PolarHBondContact O-NH1 2.98Å; I22-R571 PolarHBondContact O-NH2 3.31Å; N568-R571 HydrophobicContact CB-CB 4.39Å; R571-Q573 PolarHBondContact O-N 3.24Å; R571-I574 PolarHBondContact N-O 2.89Å; R571-I574 WeakPolarHBondContact O-CB 3.38Å; R571-I574 PolarHBondContact O-N 3.4Å; R571-M668 CarbonylContact C-O 3.47Å; R571-M668 WeakPolarHBondContact CA-O 3.37Å
572	G	87.5	Confident	85.8	Confident	24 Å²	24	37.6 Å²	37.6	25%	0.247	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.3	-113.3	-171.2	0	0	0	0	0	110.1	M668	G572-M668 PolarHBondContact N-O 3.27Å; G572-M668 PolarHBondContact O-N 3.15Å
573	Q	84.6	Confident	87.2	Confident	32 Å²	32	37.9 Å²	37.9	15%	0.15	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	1.3	177.3	-51.1	-176.2	22	0	0	112.8	Y231 R262 R571	Y231-Q573 HydrophobicContact CD2-CB 4.47Å; Y231-Q573 VanDerWaalsContact N-OE1 3.09Å; R262-Q573 HydrophobicContact CG-CB 4.48Å; R571-Q573 PolarHBondContact O-N 3.24Å
574	I	87.7	Confident	88.1	Confident	43 Å²	43	42.9 Å²	42.9	22%	0.221	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	122	-172	-46.9	-173.3	0	0	0	110.2	F27 H261 I570 R571	F27-I574 HydrophobicContact CE1-CG2 3.79Å; F27-I574 HydrophobicContact CE2-CG2 3.92Å; F27-I574 HydrophobicContact CZ-CG2 3.46Å; F27-I574 VanDerWaalsContact CZ-CG2 3.46Å; H261-I574 VanDerWaalsContact O-CG1 3.3Å; H261-I574 WeakPolarHBondContact O-CG1 3.47Å; I570-I574 WeakPolarHBondContact CA-O 3.31Å; R571-I574 PolarHBondContact N-O 2.89Å; R571-I574 WeakPolarHBondContact O-CB 3.38Å; R571-I574 PolarHBondContact O-N 3.4Å
575	I	90.3	Very high	88.9	Confident	37 Å²	37	43.7 Å²	43.7	19%	0.19	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.5	177.4	-57.5	173.5	0	0	0	109.5	R262 G263 I570 I577 L580 F583	R262-I575 PolarHBondContact O-N 3.45Å; G263-I575 WeakPolarHBondContact CA-O 3.38Å; I570-I575 HydrophobicContact CG1-CG1 4.47Å; I575-I577 PolarHBondContact O-N 3.37Å; I575-L580 HydrophobicContact CG2-CD1 4.24Å; I575-F583 HydrophobicContact CG2-CE2 4.07Å; I575-F583 HydrophobicContact CG2-CZ 3.95Å
576	N	91.3	Very high	89.5	Confident	33 Å²	33	42.5 Å²	42.5	18%	0.176	22%	0.224	C	C	.	.			trans	-84.6	103.2	176	-167.4	-24.7	0	0	0	111.1	N568 L569 R578 Y579	N568-N576 VanDerWaalsContact O-CB 3.3Å; N568-N576 WeakPolarHBondContact O-CB 3.34Å; N568-N576 PolarHBondContact O-ND2 3.16Å; L569-N576 WeakPolarHBondContact O-CB 3.41Å; L569-N576 PolarHBondContact O-N 3.45Å; N576-R578 PolarHBondContact O-N 2.87Å; N576-R578 VanDerWaalsContact O-N 3.12Å; N576-R578 WeakPolarHBondContact OD1-CB 3.38Å; N576-R578 PolarHBondContact OD1-N 3.27Å; N576-Y579 HydrophobicContact CB-CD2 4.15Å; N576-Y579 WeakPolarHBondContact ND2-CE2 3.5Å; N576-Y579 PolarHBondContact O-N 2.99Å
577	I	90.3	Very high	89.9	Confident	22 Å²	22	38.6 Å²	38.6	11%	0.113	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-59.7	-26.8	-175.7	-158.6	172.4	0	0	0	113.7	L265 L296 P485 I575 Y579 L580	L265-I577 HydrophobicContact CB-CD1 3.99Å; L265-I577 HydrophobicContact CD1-CB 4.43Å; L265-I577 HydrophobicContact CD1-CD1 3.84Å; L265-I577 HydrophobicContact CD1-CG2 3.86Å; L265-I577 HydrophobicContact CG-CD1 4.03Å; L296-I577 HydrophobicContact CD1-CD1 3.84Å; P485-I577 HydrophobicContact CB-CD1 3.89Å; P485-I577 HydrophobicContact CB-CG1 3.92Å; P485-I577 HydrophobicContact CB-CG2 4.38Å; I575-I577 PolarHBondContact O-N 3.37Å; I577-Y579 PolarHBondContact O-N 3.02Å; I577-L580 WeakPolarHBondContact O-CB 3.42Å; I577-L580 PolarHBondContact O-N 3.28Å
578	R	90.8	Very high	89.9	Confident	85 Å²	85	43.1 Å²	43.1	32%	0.321	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-61.1	-27.6	-178.1	-66.8	-178.6	-175.2	165	7.2	113	T484 P485 G486 F487 N576	T484-R578 WeakPolarHBondContact CG2-O 3.28Å; P485-R578 WeakPolarHBondContact O-CA 3.46Å; G486-R578 PolarHBondContact O-NE 3.47Å; G486-R578 PolarHBondContact O-NH2 3.27Å; F487-R578 HydrophobicContact CD2-CB 4.49Å; F487-R578 HydrophobicContact CD2-CG 4.28Å; F487-R578 HydrophobicContact CE2-CB 3.67Å; F487-R578 HydrophobicContact CE2-CG 3.86Å; F487-R578 HydrophobicContact CZ-CB 4.02Å; F487-R578 HydrophobicContact CZ-CG 4.2Å; N576-R578 PolarHBondContact O-N 2.87Å; N576-R578 VanDerWaalsContact O-N 3.12Å; N576-R578 WeakPolarHBondContact OD1-CB 3.38Å; N576-R578 PolarHBondContact OD1-N 3.27Å
579	Y	91.4	Very high	89.8	Confident	30 Å²	30	44 Å²	44	12%	0.118	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-113.4	5.3	-174.6	-54.5	-71	0	0	0	113.1	I567 L569 N576 I577 A581 Y582 F583 L763 F766	I567-Y579 HydrophobicContact CG2-CD2 3.92Å; I567-Y579 HydrophobicContact CG2-CE1 4.09Å; I567-Y579 HydrophobicContact CG2-CE2 3.39Å; I567-Y579 HydrophobicContact CG2-CG 4.46Å; I567-Y579 VanDerWaalsContact CG2-CZ 3.48Å; L569-Y579 HydrophobicContact CD2-CD1 4.47Å; L569-Y579 HydrophobicContact CD2-CD2 3.87Å; L569-Y579 HydrophobicContact CD2-CG 3.63Å; N576-Y579 HydrophobicContact CB-CD2 4.15Å; N576-Y579 WeakPolarHBondContact ND2-CE2 3.5Å; N576-Y579 PolarHBondContact O-N 2.99Å; I577-Y579 PolarHBondContact O-N 3.02Å; Y579-A581 PolarHBondContact O-N 3.17Å; Y579-A581 VanDerWaalsContact O-N 3.16Å; Y579-Y582 WeakPolarHBondContact O-CB 3.45Å; Y579-Y582 PolarHBondContact O-N 3.12Å; Y579-F583 VanDerWaalsContact O-CD1 3.31Å; Y579-F583 WeakPolarHBondContact O-CD1 3.31Å; Y579-L763 HydrophobicContact CD1-CD1 3.52Å; Y579-L763 HydrophobicContact CE1-CD1 3.55Å; Y579-F766 HydrophobicContact CD1-CD2 4.04Å; Y579-F766 HydrophobicContact CD1-CE1 4.29Å; Y579-F766 AromaticContact CD1-CE2 3.45Å; Y579-F766 HydrophobicContact CD1-CE2 3.45Å; Y579-F766 VanDerWaalsContact CD1-CE2 3.45Å; Y579-F766 AromaticContact CD1-CZ 3.59Å; Y579-F766 HydrophobicContact CD1-CZ 3.59Å; Y579-F766 AromaticContact CE1-CD2 3.95Å; Y579-F766 HydrophobicContact CE1-CD2 3.95Å; Y579-F766 AromaticContact CE1-CE2 3.26Å; Y579-F766 HydrophobicContact CE1-CE2 3.26Å; Y579-F766 AromaticContact CE1-CZ 3.79Å; Y579-F766 HydrophobicContact CE1-CZ 3.79Å; Y579-F766 HydrophobicContact CG-CZ 4.33Å
580	L	89.4	Confident	89.8	Confident	90 Å²	90	44 Å²	44	47%	0.471	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-55.7	-37.5	-174.7	-173.1	66.6	0	0	0	112.5	I575 I577 Y582 F583	I575-L580 HydrophobicContact CG2-CD1 4.24Å; I577-L580 WeakPolarHBondContact O-CB 3.42Å; I577-L580 PolarHBondContact O-N 3.28Å; L580-Y582 PolarHBondContact O-N 3.18Å; L580-Y582 VanDerWaalsContact O-N 3.15Å; L580-F583 HydrophobicContact CD1-CD2 4.23Å; L580-F583 HydrophobicContact CD1-CE2 4.28Å; L580-F583 HydrophobicContact CD1-CG 4.48Å; L580-F583 PolarHBondContact O-N 2.96Å
581	A	90.7	Very high	89.8	Confident	62 Å²	62	44.9 Å²	44.9	51%	0.512	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-64.2	-16.7	177.9	0	0	0	0	0	114.2	Y579 G761	Y579-A581 PolarHBondContact O-N 3.17Å; Y579-A581 VanDerWaalsContact O-N 3.16Å; A581-G761 WeakPolarHBondContact CB-O 3.44Å
582	Y	91.1	Very high	89.7	Confident	5 Å²	5	44.9 Å²	44.9	2%	0.02	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-98.4	-6.5	179.4	-74.8	-83.8	0	0	0	113.6	Y579 L580 D584 S585 I586 K762 L763 F766 E767	Y579-Y582 WeakPolarHBondContact O-CB 3.45Å; Y579-Y582 PolarHBondContact O-N 3.12Å; L580-Y582 PolarHBondContact O-N 3.18Å; L580-Y582 VanDerWaalsContact O-N 3.15Å; Y582-D584 VanDerWaalsContact C-N 3.34Å; Y582-D584 PolarHBondContact O-N 3.25Å; Y582-S585 PolarHBondContact O-N 2.76Å; Y582-I586 WeakPolarHBondContact O-CB 3.45Å; Y582-I586 WeakPolarHBondContact O-CG1 3.47Å; Y582-I586 PolarHBondContact O-N 2.9Å; Y582-K762 WeakPolarHBondContact OH-CA 3.47Å; Y582-L763 HydrophobicContact CD2-CD1 4.46Å; Y582-L763 HydrophobicContact CE2-CB 4.06Å; Y582-L763 HydrophobicContact CE2-CD1 4.17Å; Y582-L763 HydrophobicContact CE2-CG 3.9Å; Y582-L763 PolarHBondContact OH-N 2.8Å; Y582-L763 PolarHBondContact OH-O 3.1Å; Y582-F766 HydrophobicContact CD1-CB 3.9Å; Y582-F766 AromaticContact CD1-CD1 3.99Å; Y582-F766 HydrophobicContact CD1-CD1 3.99Å; Y582-F766 HydrophobicContact CD1-CG 4.34Å; Y582-F766 HydrophobicContact CD2-CB 4.25Å; Y582-F766 HydrophobicContact CD2-CD1 4.32Å; Y582-F766 HydrophobicContact CD2-CG 4.34Å; Y582-F766 HydrophobicContact CE1-CB 3.56Å; Y582-F766 HydrophobicContact CE1-CG 4.44Å; Y582-F766 HydrophobicContact CE2-CB 3.94Å; Y582-F766 HydrophobicContact CE2-CG 4.45Å; Y582-F766 HydrophobicContact CG-CB 4.23Å; Y582-F766 AromaticContact CG-CD1 3.88Å; Y582-F766 HydrophobicContact CG-CD1 3.88Å; Y582-F766 HydrophobicContact CG-CG 4.29Å; Y582-E767 WeakPolarHBondContact CE1-OE1 3.43Å; Y582-E767 VanDerWaalsContact CZ-OE1 3.29Å; Y582-E767 WeakPolarHBondContact OH-CG 3.26Å; Y582-E767 PolarHBondContact OH-OE1 3.04Å
583	F	90.9	Very high	89.7	Confident	24 Å²	24	47.2 Å²	47.2	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-46.9	-175.9	-84.3	32.1	0	0	0	111.6	L569 I570 I575 Y579 L580 I586 L587	L569-F583 HydrophobicContact CB-CE1 3.82Å; L569-F583 HydrophobicContact CB-CZ 4.04Å; L569-F583 HydrophobicContact CD2-CE1 4.13Å; L569-F583 HydrophobicContact CG-CE1 4.43Å; I570-F583 HydrophobicContact CD1-CE2 3.73Å; I570-F583 HydrophobicContact CD1-CZ 4.24Å; I570-F583 HydrophobicContact CG1-CE2 3.82Å; I570-F583 HydrophobicContact CG1-CZ 3.83Å; I575-F583 HydrophobicContact CG2-CE2 4.07Å; I575-F583 HydrophobicContact CG2-CZ 3.95Å; Y579-F583 VanDerWaalsContact O-CD1 3.31Å; Y579-F583 WeakPolarHBondContact O-CD1 3.31Å; L580-F583 HydrophobicContact CD1-CD2 4.23Å; L580-F583 HydrophobicContact CD1-CE2 4.28Å; L580-F583 HydrophobicContact CD1-CG 4.48Å; L580-F583 PolarHBondContact O-N 2.96Å; F583-I586 PolarHBondContact O-N 2.98Å; F583-L587 VanDerWaalsContact O-CB 3.24Å; F583-L587 WeakPolarHBondContact O-CB 3.37Å; F583-L587 PolarHBondContact O-N 2.87Å
584	D	89.4	Confident	89.9	Confident	116 Å²	116	46.1 Å²	46.1	62%	0.62	24%	0.236	S	C	*	.	H	α-helix	trans	-64.4	-45	179.7	-60.6	-23.7	0	0	0	111.7	Y582 I586 L587 E588	Y582-D584 VanDerWaalsContact C-N 3.34Å; Y582-D584 PolarHBondContact O-N 3.25Å; D584-I586 VanDerWaalsContact C-N 3.32Å; D584-I586 PolarHBondContact O-N 2.97Å; D584-L587 WeakPolarHBondContact O-CB 3.32Å; D584-L587 PolarHBondContact O-N 2.76Å; D584-E588 WeakPolarHBondContact O-CG 3.47Å; D584-E588 PolarHBondContact O-N 2.87Å
585	S	88.3	Confident	89.9	Confident	60 Å²	60	45.5 Å²	45.5	42%	0.42	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-38.6	179	-176.6	0	0	0	0	112.2	Y582 F589	Y582-S585 PolarHBondContact O-N 2.76Å; S585-F589 WeakPolarHBondContact O-CB 3.47Å; S585-F589 PolarHBondContact O-N 2.9Å; S585-F589 VanDerWaalsContact O-N 3.13Å
586	I	90.5	Very high	89.8	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-73.1	-38.1	178	-64.6	168.5	0	0	0	110	L569 Y582 F583 D584 F589 I590 I658 F670 F766	L569-I586 HydrophobicContact CD1-CD1 3.77Å; Y582-I586 WeakPolarHBondContact O-CB 3.45Å; Y582-I586 WeakPolarHBondContact O-CG1 3.47Å; Y582-I586 PolarHBondContact O-N 2.9Å; F583-I586 PolarHBondContact O-N 2.98Å; D584-I586 VanDerWaalsContact C-N 3.32Å; D584-I586 PolarHBondContact O-N 2.97Å; I586-F589 WeakPolarHBondContact O-CB 3.49Å; I586-F589 PolarHBondContact O-N 2.84Å; I586-I590 HydrophobicContact CG2-CD1 3.88Å; I586-I590 HydrophobicContact CG2-CG1 4.36Å; I586-I590 WeakPolarHBondContact O-CD1 3.46Å; I586-I590 VanDerWaalsContact O-CG1 3.22Å; I586-I590 WeakPolarHBondContact O-CG1 3.05Å; I586-I590 PolarHBondContact O-N 3.08Å; I586-I658 HydrophobicContact CG2-CD1 3.52Å; I586-I658 HydrophobicContact CG2-CG1 4.42Å; I586-F670 HydrophobicContact CB-CZ 4.29Å; I586-F670 HydrophobicContact CG2-CE2 3.98Å; I586-F670 HydrophobicContact CG2-CZ 3.59Å; I586-F766 HydrophobicContact CD1-CD1 4.26Å; I586-F766 HydrophobicContact CD1-CE1 3.8Å
587	L	91	Very high	89.5	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-47.5	175.1	177.6	57.7	0	0	0	111.5	F583 D584 F589 I590 K591 V616 N617 V619 L622	F583-L587 VanDerWaalsContact O-CB 3.24Å; F583-L587 WeakPolarHBondContact O-CB 3.37Å; F583-L587 PolarHBondContact O-N 2.87Å; D584-L587 WeakPolarHBondContact O-CB 3.32Å; D584-L587 PolarHBondContact O-N 2.76Å; L587-F589 VanDerWaalsContact C-N 3.33Å; L587-F589 PolarHBondContact O-N 3.3Å; L587-I590 WeakPolarHBondContact O-CB 3.37Å; L587-I590 PolarHBondContact O-N 3.44Å; L587-K591 WeakPolarHBondContact O-CG 3.34Å; L587-K591 PolarHBondContact O-N 3.49Å; L587-V616 HydrophobicContact CD1-CG1 3.9Å; L587-V616 HydrophobicContact CD2-CG1 4.37Å; L587-N617 WeakPolarHBondContact CD2-O 3.32Å; L587-V619 HydrophobicContact CB-CG2 4.38Å; L587-V619 HydrophobicContact CD1-CG2 4.19Å; L587-L622 HydrophobicContact CD1-CD1 3.52Å; L587-L622 HydrophobicContact CD1-CD2 4.32Å; L587-L622 HydrophobicContact CD1-CG 3.96Å
588	E	90.1	Very high	89.2	Confident	108 Å²	108	51 Å²	51	51%	0.505	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-40.6	175.7	-71.1	-55.1	127.2	0	0	112.1	D584 I590 K591 D592	D584-E588 WeakPolarHBondContact O-CG 3.47Å; D584-E588 PolarHBondContact O-N 2.87Å; E588-I590 PolarHBondContact O-N 3.42Å; E588-K591 PolarHBondContact O-N 2.88Å; E588-K591 WeakPolarHBondContact OE1-CD 2.98Å; E588-K591 IonicContact OE1-NZ 3.39Å; E588-K591 PolarHBondContact OE1-NZ 2.83Å; E588-D592 PolarHBondContact O-N 2.97Å
589	F	88.9	Confident	88.8	Confident	48 Å²	48	48.5 Å²	48.5	21%	0.211	26%	0.257	C	S	.	.	H	α-helix	trans	-59.8	-44.3	172.6	171.2	-94.6	0	0	0	112.2	S585 I586 L587 K591 D592 R593 V639 F656 I658	S585-F589 WeakPolarHBondContact O-CB 3.47Å; S585-F589 PolarHBondContact O-N 2.9Å; S585-F589 VanDerWaalsContact O-N 3.13Å; I586-F589 WeakPolarHBondContact O-CB 3.49Å; I586-F589 PolarHBondContact O-N 2.84Å; L587-F589 VanDerWaalsContact C-N 3.33Å; L587-F589 PolarHBondContact O-N 3.3Å; F589-K591 PolarHBondContact O-N 3.19Å; F589-D592 PolarHBondContact O-N 3.19Å; F589-R593 HydrophobicContact CD1-CG 4.39Å; F589-R593 HydrophobicContact CD2-CG 4.37Å; F589-R593 HydrophobicContact CE1-CG 3.94Å; F589-R593 HydrophobicContact CE2-CG 3.91Å; F589-R593 HydrophobicContact CZ-CG 3.67Å; F589-R593 WeakPolarHBondContact O-CG 2.9Å; F589-R593 PolarHBondContact O-N 2.79Å; F589-V639 HydrophobicContact CE1-CG1 3.97Å; F589-F656 HydrophobicContact CD1-CZ 4.4Å; F589-F656 HydrophobicContact CE1-CE2 4.05Å; F589-F656 HydrophobicContact CE1-CZ 4Å; F589-F656 HydrophobicContact CZ-CZ 4.17Å; F589-I658 HydrophobicContact CD1-CD1 3.59Å; F589-I658 HydrophobicContact CE1-CD1 3.74Å
590	I	90.3	Very high	88.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-46.8	177.2	-68.2	154.8	0	0	0	110.4	I586 L587 E588 D592 R593 I594 L622 F637 V639 I658 I660 F670	I586-I590 HydrophobicContact CG2-CD1 3.88Å; I586-I590 HydrophobicContact CG2-CG1 4.36Å; I586-I590 WeakPolarHBondContact O-CD1 3.46Å; I586-I590 VanDerWaalsContact O-CG1 3.22Å; I586-I590 WeakPolarHBondContact O-CG1 3.05Å; I586-I590 PolarHBondContact O-N 3.08Å; L587-I590 WeakPolarHBondContact O-CB 3.37Å; L587-I590 PolarHBondContact O-N 3.44Å; E588-I590 PolarHBondContact O-N 3.42Å; I590-D592 PolarHBondContact O-N 2.99Å; I590-R593 PolarHBondContact O-N 2.74Å; I590-I594 HydrophobicContact CG2-CD1 3.61Å; I590-I594 HydrophobicContact CG2-CG1 4.24Å; I590-I594 VanDerWaalsContact O-CG1 3.28Å; I590-I594 WeakPolarHBondContact O-CG1 3.43Å; I590-I594 PolarHBondContact O-N 3.04Å; I590-L622 HydrophobicContact CB-CD1 4.43Å; I590-L622 HydrophobicContact CD1-CD1 4.31Å; I590-L622 HydrophobicContact CG2-CD1 3.72Å; I590-F637 HydrophobicContact CG2-CE2 4.16Å; I590-F637 HydrophobicContact CG2-CZ 4.36Å; I590-V639 HydrophobicContact CG2-CG2 4.33Å; I590-I658 HydrophobicContact CD1-CD1 4.08Å; I590-I658 HydrophobicContact CD1-CG2 4.16Å; I590-I658 HydrophobicContact CG1-CD1 3.57Å; I590-I658 HydrophobicContact CG1-CG2 4.34Å; I590-I660 HydrophobicContact CD1-CD1 3.79Å; I590-I660 HydrophobicContact CG2-CD1 4.46Å; I590-F670 HydrophobicContact CD1-CE2 4Å; I590-F670 HydrophobicContact CD1-CZ 4.25Å
591	K	90.9	Very high	88.2	Confident	24 Å²	24	54.4 Å²	54.4	10%	0.104	29%	0.289	C	S	.	.	H	α-helix	trans	-56.7	-48.2	178.2	-71.3	173.7	-179.8	174.7	0	111.3	L587 E588 F589 R593 I594 L595 L613 V616	L587-K591 WeakPolarHBondContact O-CG 3.34Å; L587-K591 PolarHBondContact O-N 3.49Å; E588-K591 PolarHBondContact O-N 2.88Å; E588-K591 WeakPolarHBondContact OE1-CD 2.98Å; E588-K591 IonicContact OE1-NZ 3.39Å; E588-K591 PolarHBondContact OE1-NZ 2.83Å; F589-K591 PolarHBondContact O-N 3.19Å; K591-R593 PolarHBondContact O-N 3.37Å; K591-I594 PolarHBondContact O-N 2.85Å; K591-L595 WeakPolarHBondContact O-CG 3.36Å; K591-L595 PolarHBondContact O-N 3.08Å; K591-L613 HydrophobicContact CB-CD1 4.36Å; K591-L613 WeakPolarHBondContact CE-O 3.31Å; K591-L613 HydrophobicContact CG-CB 4.44Å; K591-L613 HydrophobicContact CG-CD2 4.34Å; K591-V616 VanDerWaalsContact CE-O 3.3Å; K591-V616 WeakPolarHBondContact CE-O 3.43Å; K591-V616 PolarHBondContact NZ-O 3.35Å
592	D	89.1	Confident	87.7	Confident	91 Å²	91	54.9 Å²	54.9	49%	0.487	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-46.4	178.1	-177.7	62.1	0	0	0	111.7	E588 F589 I590 I594 L595 V596	E588-D592 PolarHBondContact O-N 2.97Å; F589-D592 PolarHBondContact O-N 3.19Å; I590-D592 PolarHBondContact O-N 2.99Å; D592-I594 PolarHBondContact O-N 3.29Å; D592-L595 WeakPolarHBondContact O-CB 3.35Å; D592-L595 PolarHBondContact O-N 2.9Å; D592-L595 VanDerWaalsContact O-N 3.13Å; D592-V596 WeakPolarHBondContact O-CG2 3.4Å; D592-V596 PolarHBondContact O-N 2.85Å
593	R	87.8	Confident	87	Confident	74 Å²	74	58.9 Å²	58.9	28%	0.279	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-35.2	179.3	-64.5	-59.9	-64.6	163.2	-1.4	113.3	F589 I590 K591 L595 V596 Y597 V639 N640	F589-R593 HydrophobicContact CD1-CG 4.39Å; F589-R593 HydrophobicContact CD2-CG 4.37Å; F589-R593 HydrophobicContact CE1-CG 3.94Å; F589-R593 HydrophobicContact CE2-CG 3.91Å; F589-R593 HydrophobicContact CZ-CG 3.67Å; F589-R593 WeakPolarHBondContact O-CG 2.9Å; F589-R593 PolarHBondContact O-N 2.79Å; I590-R593 PolarHBondContact O-N 2.74Å; K591-R593 PolarHBondContact O-N 3.37Å; R593-L595 VanDerWaalsContact C-N 3.33Å; R593-V596 PolarHBondContact O-N 2.89Å; R593-Y597 WeakPolarHBondContact O-CB 3.24Å; R593-Y597 PolarHBondContact O-N 2.69Å; R593-V639 HydrophobicContact CB-CG1 3.32Å; R593-V639 HydrophobicContact CG-CG1 3.58Å; R593-N640 PolarHBondContact NE-O 2.93Å
594	I	87.5	Confident	86.4	Confident	9 Å²	9	69.1 Å²	69.1	5%	0.046	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-45.8	171.9	-69.5	165.5	0	0	0	109.5	I590 K591 D592 V596 Y597 H598 V609 L613 L622 M626 F637	I590-I594 HydrophobicContact CG2-CD1 3.61Å; I590-I594 HydrophobicContact CG2-CG1 4.24Å; I590-I594 VanDerWaalsContact O-CG1 3.28Å; I590-I594 WeakPolarHBondContact O-CG1 3.43Å; I590-I594 PolarHBondContact O-N 3.04Å; K591-I594 PolarHBondContact O-N 2.85Å; D592-I594 PolarHBondContact O-N 3.29Å; I594-V596 PolarHBondContact O-N 2.93Å; I594-Y597 PolarHBondContact O-N 3.35Å; I594-H598 PolarHBondContact O-CD2 3.12Å; I594-H598 VanDerWaalsContact O-CD2 3.29Å; I594-H598 PolarHBondContact O-N 2.98Å; I594-V609 HydrophobicContact CG2-CG1 3.96Å; I594-L613 HydrophobicContact CB-CD1 4.2Å; I594-L613 HydrophobicContact CD1-CD2 4.29Å; I594-L613 HydrophobicContact CG2-CD1 3.91Å; I594-L622 HydrophobicContact CD1-CD2 4.2Å; I594-M626 HydrophobicContact CD1-CG 4.38Å; I594-M626 HydrophobicContact CD1-SD 3.83Å; I594-M626 HydrophobicContact CG1-SD 4.25Å; I594-M626 HydrophobicContact CG2-CE 4.16Å; I594-M626 HydrophobicContact CG2-SD 3.77Å; I594-F637 HydrophobicContact CD1-CE2 4.16Å; I594-F637 HydrophobicContact CD1-CZ 4.2Å; I594-F637 HydrophobicContact CG1-CE2 4.46Å
595	L	88.9	Confident	86	Confident	30 Å²	30	64 Å²	64	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-62.6	-41.5	178.2	-67.3	175	0	0	0	112.3	K591 D592 R593 H598 G599 L606 V609 R610 L613	K591-L595 WeakPolarHBondContact O-CG 3.36Å; K591-L595 PolarHBondContact O-N 3.08Å; D592-L595 WeakPolarHBondContact O-CB 3.35Å; D592-L595 PolarHBondContact O-N 2.9Å; D592-L595 VanDerWaalsContact O-N 3.13Å; R593-L595 VanDerWaalsContact C-N 3.33Å; L595-H598 PolarHBondContact O-N 3.49Å; L595-G599 PolarHBondContact O-N 3.06Å; L595-L606 HydrophobicContact CB-CD1 4.46Å; L595-L606 HydrophobicContact CD2-CD1 3.91Å; L595-V609 HydrophobicContact CD2-CG1 4.31Å; L595-R610 HydrophobicContact CD2-CB 3.99Å; L595-L613 HydrophobicContact CD2-CD1 3.96Å; L595-L613 HydrophobicContact CG-CD1 4Å
596	V	86.9	Confident	85.9	Confident	70 Å²	70	63.3 Å²	63.3	42%	0.424	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-46.1	175.3	172.4	0	0	0	0	111	D592 R593 I594 G599 A600	D592-V596 WeakPolarHBondContact O-CG2 3.4Å; D592-V596 PolarHBondContact O-N 2.85Å; R593-V596 PolarHBondContact O-N 2.89Å; I594-V596 PolarHBondContact O-N 2.93Å; V596-G599 PolarHBondContact O-N 3.14Å; V596-A600 PolarHBondContact O-N 3.3Å; V596-A600 VanDerWaalsContact O-N 3.13Å
597	Y	85.1	Confident	85.7	Confident	121 Å²	121	68.6 Å²	68.6	48%	0.475	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-50.9	178	179.7	-91.4	0	0	0	111.7	R593 I594 G599 A600 Y601	R593-Y597 WeakPolarHBondContact O-CB 3.24Å; R593-Y597 PolarHBondContact O-N 2.69Å; I594-Y597 PolarHBondContact O-N 3.35Å; Y597-G599 VanDerWaalsContact C-N 3.3Å; Y597-G599 PolarHBondContact O-N 3.41Å; Y597-A600 PolarHBondContact O-N 2.93Å; Y597-Y601 HydrophobicContact CD1-CD2 4.32Å; Y597-Y601 AromaticContact CD2-CD2 3.59Å; Y597-Y601 HydrophobicContact CD2-CD2 3.59Å; Y597-Y601 AromaticContact CD2-CE2 3.64Å; Y597-Y601 HydrophobicContact CD2-CE2 3.64Å; Y597-Y601 HydrophobicContact CE1-CD2 4.2Å; Y597-Y601 AromaticContact CE2-CD2 3.46Å; Y597-Y601 HydrophobicContact CE2-CD2 3.46Å; Y597-Y601 VanDerWaalsContact CE2-CD2 3.46Å; Y597-Y601 AromaticContact CE2-CE2 3.51Å; Y597-Y601 HydrophobicContact CE2-CE2 3.51Å; Y597-Y601 HydrophobicContact CE2-CG 4.4Å; Y597-Y601 HydrophobicContact CG-CD2 4.03Å; Y597-Y601 HydrophobicContact CG-CE2 4.46Å; Y597-Y601 AromaticContact CZ-CD2 3.78Å; Y597-Y601 VanDerWaalsContact O-CD2 3.25Å; Y597-Y601 WeakPolarHBondContact O-CD2 3.44Å; Y597-Y601 PolarHBondContact O-N 3.29Å
598	H	83.3	Confident	85.4	Confident	17 Å²	17	74.1 Å²	74.1	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-32.5	179.3	-80.8	-93.5	0	0	0	112.4	I594 L595 A600 N602 L606	I594-H598 PolarHBondContact O-CD2 3.12Å; I594-H598 VanDerWaalsContact O-CD2 3.29Å; I594-H598 PolarHBondContact O-N 2.98Å; L595-H598 PolarHBondContact O-N 3.49Å; H598-A600 VanDerWaalsContact C-N 3.32Å; H598-A600 PolarHBondContact O-N 2.84Å; H598-N602 CarbonylContact O-C 3.31Å; H598-N602 VanDerWaalsContact O-CA 3.29Å; H598-N602 WeakPolarHBondContact O-CA 3.2Å; H598-N602 PolarHBondContact O-N 2.84Å; H598-N602 VanDerWaalsContact O-O 3.08Å; H598-L606 HydrophobicContact CB-CD1 4.14Å
599	G	84.1	Confident	85.3	Confident	31 Å²	31	69 Å²	69	32%	0.32	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-38.5	173.2	0	0	0	0	0	112.8	L595 V596 Y597	L595-G599 PolarHBondContact O-N 3.06Å; V596-G599 PolarHBondContact O-N 3.14Å; Y597-G599 VanDerWaalsContact C-N 3.3Å; Y597-G599 PolarHBondContact O-N 3.41Å
600	A	84.8	Confident	85.3	Confident	72 Å²	72	72.3 Å²	72.3	60%	0.595	35%	0.354	S	S	*	.	H	α-helix	trans	-76.3	-39.8	179	0	0	0	0	0	113.4	V596 Y597 H598	V596-A600 PolarHBondContact O-N 3.3Å; V596-A600 VanDerWaalsContact O-N 3.13Å; Y597-A600 PolarHBondContact O-N 2.93Å; H598-A600 VanDerWaalsContact C-N 3.32Å; H598-A600 PolarHBondContact O-N 2.84Å
601	Y	81.9	Confident	85.3	Confident	172 Å²	172	77.3 Å²	77.3	68%	0.675	38%	0.378	S	S	*	.	H	α-helix	trans	-107.7	-21.5	-169.9	-64	-76.6	0	0	0	115	Y597	Y597-Y601 HydrophobicContact CD1-CD2 4.32Å; Y597-Y601 AromaticContact CD2-CD2 3.59Å; Y597-Y601 HydrophobicContact CD2-CD2 3.59Å; Y597-Y601 AromaticContact CD2-CE2 3.64Å; Y597-Y601 HydrophobicContact CD2-CE2 3.64Å; Y597-Y601 HydrophobicContact CE1-CD2 4.2Å; Y597-Y601 AromaticContact CE2-CD2 3.46Å; Y597-Y601 HydrophobicContact CE2-CD2 3.46Å; Y597-Y601 VanDerWaalsContact CE2-CD2 3.46Å; Y597-Y601 AromaticContact CE2-CE2 3.51Å; Y597-Y601 HydrophobicContact CE2-CE2 3.51Å; Y597-Y601 HydrophobicContact CE2-CG 4.4Å; Y597-Y601 HydrophobicContact CG-CD2 4.03Å; Y597-Y601 HydrophobicContact CG-CE2 4.46Å; Y597-Y601 AromaticContact CZ-CD2 3.78Å; Y597-Y601 VanDerWaalsContact O-CD2 3.25Å; Y597-Y601 WeakPolarHBondContact O-CD2 3.44Å; Y597-Y601 PolarHBondContact O-N 3.29Å
602	N	80.7	Confident	85.1	Confident	72 Å²	72	77.2 Å²	77.2	39%	0.385	38%	0.381	S	S	.	.			trans	-147	69.2	179.1	-173.3	11.1	0	0	0	112.5	H598 R604 G605	H598-N602 CarbonylContact O-C 3.31Å; H598-N602 VanDerWaalsContact O-CA 3.29Å; H598-N602 WeakPolarHBondContact O-CA 3.2Å; H598-N602 PolarHBondContact O-N 2.84Å; H598-N602 VanDerWaalsContact O-O 3.08Å; N602-R604 PolarHBondContact O-N 3.37Å; N602-G605 PolarHBondContact O-N 3.2Å; N602-G605 PolarHBondContact OD1-N 3.26Å
603	P	77.8	Confident	85.1	Confident	90 Å²	90	73.2 Å²	73.2	58%	0.584	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.8	-174.1	24.2	-34.1	0	0	0	113.9	L606	P603-L606 WeakPolarHBondContact O-CB 3.41Å
604	R	78.2	Confident	85.2	Confident	239 Å²	239	76 Å²	76	90%	0.902	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-33.4	179.7	-65.6	-177	-175.7	174.7	1.6	112.8	N602	N602-R604 PolarHBondContact O-N 3.37Å
605	G	80.6	Confident	85.1	Confident	8 Å²	8	81.6 Å²	81.6	8%	0.082	41%	0.406	C	S	.	.	S	Bend	trans	-88.8	-0.2	177.6	0	0	0	0	0	114.4	N602 L607 E608 V609	N602-G605 PolarHBondContact O-N 3.2Å; N602-G605 PolarHBondContact OD1-N 3.26Å; G605-L607 VanDerWaalsContact C-N 3.31Å; G605-L607 PolarHBondContact O-N 3.27Å; G605-E608 PolarHBondContact O-N 3.4Å; G605-V609 WeakPolarHBondContact O-CG2 3.47Å; G605-V609 PolarHBondContact O-N 3.27Å; G605-V609 VanDerWaalsContact O-N 3.08Å
606	L	84.9	Confident	85.1	Confident	45 Å²	45	80.2 Å²	80.2	24%	0.236	40%	0.399	C	S	.	.	H	α-helix	trans	-61.8	-36.1	-173.2	-177.9	63.7	0	0	0	113.1	L595 H598 P603 R610	L595-L606 HydrophobicContact CB-CD1 4.46Å; L595-L606 HydrophobicContact CD2-CD1 3.91Å; H598-L606 HydrophobicContact CB-CD1 4.14Å; P603-L606 WeakPolarHBondContact O-CB 3.41Å; L606-R610 WeakPolarHBondContact O-CB 3.5Å; L606-R610 PolarHBondContact O-N 3.32Å
607	L	86.1	Confident	85.1	Confident	114 Å²	114	82.8 Å²	82.8	60%	0.597	41%	0.41	S	S	*	.	H	α-helix	trans	-67.9	-42.2	-179.9	-172.4	67.1	0	0	0	111.6	G605 R610 Q611	G605-L607 VanDerWaalsContact C-N 3.31Å; G605-L607 PolarHBondContact O-N 3.27Å; L607-R610 PolarHBondContact O-N 3.07Å; L607-Q611 WeakPolarHBondContact O-CG 3.28Å; L607-Q611 PolarHBondContact O-N 3.02Å
608	E	86.6	Confident	85.2	Confident	122 Å²	122	83.3 Å²	83.3	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-65	-43.5	176.9	-64.1	174.6	-177.7	0	0	111.1	G605 R610 Q611 A612 F629	G605-E608 PolarHBondContact O-N 3.4Å; E608-R610 VanDerWaalsContact C-N 3.34Å; E608-R610 PolarHBondContact O-N 3.3Å; E608-Q611 PolarHBondContact O-N 2.9Å; E608-A612 WeakPolarHBondContact O-CB 3.35Å; E608-A612 PolarHBondContact O-N 2.94Å; E608-F629 HydrophobicContact CB-CE1 4.04Å; E608-F629 HydrophobicContact CB-CZ 4.45Å
609	V	86.6	Confident	85.3	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-61.4	-44.2	175.4	175	0	0	0	0	110.6	I594 L595 G605 A612 L613 F629	I594-V609 HydrophobicContact CG2-CG1 3.96Å; L595-V609 HydrophobicContact CD2-CG1 4.31Å; G605-V609 WeakPolarHBondContact O-CG2 3.47Å; G605-V609 PolarHBondContact O-N 3.27Å; G605-V609 VanDerWaalsContact O-N 3.08Å; V609-A612 PolarHBondContact O-N 3.36Å; V609-L613 HydrophobicContact CG1-CD1 3.97Å; V609-L613 HydrophobicContact CG1-CG 4.29Å; V609-L613 VanDerWaalsContact O-CG 3.29Å; V609-L613 WeakPolarHBondContact O-CG 3.39Å; V609-L613 PolarHBondContact O-N 3.13Å; V609-F629 HydrophobicContact CG2-CD1 3.58Å; V609-F629 HydrophobicContact CG2-CD2 4.14Å; V609-F629 HydrophobicContact CG2-CE1 3.68Å; V609-F629 HydrophobicContact CG2-CE2 4.23Å; V609-F629 HydrophobicContact CG2-CG 3.82Å; V609-F629 HydrophobicContact CG2-CZ 4.01Å
610	R	89.4	Confident	85.3	Confident	117 Å²	117	85.2 Å²	85.2	44%	0.442	42%	0.416	S	S	.	.	H	α-helix	trans	-58.6	-49.5	176.9	-178.6	-177	-67.6	-90	-1.5	111.7	L595 L606 L607 E608 A612 L613 E614	L595-R610 HydrophobicContact CD2-CB 3.99Å; L606-R610 WeakPolarHBondContact O-CB 3.5Å; L606-R610 PolarHBondContact O-N 3.32Å; L607-R610 PolarHBondContact O-N 3.07Å; E608-R610 VanDerWaalsContact C-N 3.34Å; E608-R610 PolarHBondContact O-N 3.3Å; R610-A612 VanDerWaalsContact C-N 3.3Å; R610-A612 PolarHBondContact O-N 2.96Å; R610-L613 PolarHBondContact O-N 3.5Å; R610-E614 WeakPolarHBondContact O-CG 3.5Å; R610-E614 PolarHBondContact O-N 3.06Å; R610-E614 VanDerWaalsContact O-N 3.08Å
611	Q	89.6	Confident	85.4	Confident	106 Å²	106	84.8 Å²	84.8	50%	0.495	40%	0.403	S	S	.	.	H	α-helix	trans	-61.6	-37.9	177.8	-72.6	175.1	-10.2	0	0	112.3	L607 E608 E614 N615	L607-Q611 WeakPolarHBondContact O-CG 3.28Å; L607-Q611 PolarHBondContact O-N 3.02Å; E608-Q611 PolarHBondContact O-N 2.9Å; Q611-E614 PolarHBondContact O-N 3.24Å; Q611-N615 PolarHBondContact O-ND2 3.08Å
612	A	87.8	Confident	85.6	Confident	21 Å²	21	76.6 Å²	76.6	17%	0.174	37%	0.371	C	S	.	.	H	α-helix	trans	-67.2	-39.7	176.8	0	0	0	0	0	112	E608 V609 R610 E614 N615 I625 F629	E608-A612 WeakPolarHBondContact O-CB 3.35Å; E608-A612 PolarHBondContact O-N 2.94Å; V609-A612 PolarHBondContact O-N 3.36Å; R610-A612 VanDerWaalsContact C-N 3.3Å; R610-A612 PolarHBondContact O-N 2.96Å; A612-E614 VanDerWaalsContact C-N 3.33Å; A612-E614 PolarHBondContact O-N 3.14Å; A612-N615 PolarHBondContact O-N 3Å; A612-I625 HydrophobicContact CB-CG2 3.83Å; A612-F629 HydrophobicContact CB-CE2 3.8Å; A612-F629 HydrophobicContact CB-CZ 3.91Å
613	L	89.8	Confident	85.8	Confident	7 Å²	7	73.7 Å²	73.7	4%	0.037	36%	0.356	C	S	.	.	H	α-helix	trans	-70.7	-24.4	178.2	-68.6	177.7	0	0	0	113.6	K591 I594 L595 V609 R610 N615 V616 L622 M626	K591-L613 HydrophobicContact CB-CD1 4.36Å; K591-L613 WeakPolarHBondContact CE-O 3.31Å; K591-L613 HydrophobicContact CG-CB 4.44Å; K591-L613 HydrophobicContact CG-CD2 4.34Å; I594-L613 HydrophobicContact CB-CD1 4.2Å; I594-L613 HydrophobicContact CD1-CD2 4.29Å; I594-L613 HydrophobicContact CG2-CD1 3.91Å; L595-L613 HydrophobicContact CD2-CD1 3.96Å; L595-L613 HydrophobicContact CG-CD1 4Å; V609-L613 HydrophobicContact CG1-CD1 3.97Å; V609-L613 HydrophobicContact CG1-CG 4.29Å; V609-L613 VanDerWaalsContact O-CG 3.29Å; V609-L613 WeakPolarHBondContact O-CG 3.39Å; V609-L613 PolarHBondContact O-N 3.13Å; R610-L613 PolarHBondContact O-N 3.5Å; L613-N615 PolarHBondContact O-N 3.23Å; L613-V616 HydrophobicContact CD2-CG2 4.38Å; L613-V616 WeakPolarHBondContact O-CB 3.24Å; L613-V616 PolarHBondContact O-N 3.48Å; L613-L622 HydrophobicContact CD2-CD2 3.79Å; L613-M626 HydrophobicContact CD2-CE 4.08Å
614	E	88.4	Confident	86	Confident	134 Å²	134	72.9 Å²	72.9	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-29.3	174	-76.9	171.4	-171.3	0	0	112.3	R610 Q611 A612 V616	R610-E614 WeakPolarHBondContact O-CG 3.5Å; R610-E614 PolarHBondContact O-N 3.06Å; R610-E614 VanDerWaalsContact O-N 3.08Å; Q611-E614 PolarHBondContact O-N 3.24Å; A612-E614 VanDerWaalsContact C-N 3.33Å; A612-E614 PolarHBondContact O-N 3.14Å; E614-V616 VanDerWaalsContact C-N 3.32Å
615	N	86.3	Confident	86.2	Confident	126 Å²	126	62.8 Å²	62.8	67%	0.674	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-3.1	178.2	-64.4	-47.1	0	0	0	113.7	Q611 A612 L613 N617	Q611-N615 PolarHBondContact O-ND2 3.08Å; A612-N615 PolarHBondContact O-N 3Å; L613-N615 PolarHBondContact O-N 3.23Å; N615-N617 PolarHBondContact O-N 2.71Å; N615-N617 PolarHBondContact O-ND2 2.94Å
616	V	88.3	Confident	86.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.312	C	S	.	.			trans	-85.8	113.6	-177.7	174.3	0	0	0	0	110.2	L587 K591 L613 E614 K618 D621 L622 I625	L587-V616 HydrophobicContact CD1-CG1 3.9Å; L587-V616 HydrophobicContact CD2-CG1 4.37Å; K591-V616 VanDerWaalsContact CE-O 3.3Å; K591-V616 WeakPolarHBondContact CE-O 3.43Å; K591-V616 PolarHBondContact NZ-O 3.35Å; L613-V616 HydrophobicContact CD2-CG2 4.38Å; L613-V616 WeakPolarHBondContact O-CB 3.24Å; L613-V616 PolarHBondContact O-N 3.48Å; E614-V616 VanDerWaalsContact C-N 3.32Å; V616-K618 WeakPolarHBondContact CG1-O 3.45Å; V616-D621 HydrophobicContact CG1-CB 4.24Å; V616-D621 HydrophobicContact CG2-CB 4.41Å; V616-L622 HydrophobicContact CB-CD2 4.49Å; V616-L622 HydrophobicContact CG1-CD2 3.73Å; V616-L622 HydrophobicContact CG1-CG 3.83Å; V616-L622 HydrophobicContact CG2-CD2 4.26Å; V616-I625 HydrophobicContact CG2-CD1 3.18Å
617	N	87.1	Confident	86.1	Confident	124 Å²	124	65 Å²	65	66%	0.663	32%	0.32	S	S	*	.			trans	-109.1	-18	176.2	-62.8	-65.1	0	0	0	112.4	L587 N615	L587-N617 WeakPolarHBondContact CD2-O 3.32Å; N615-N617 PolarHBondContact O-N 2.71Å; N615-N617 PolarHBondContact O-ND2 2.94Å
618	K	87.6	Confident	85.8	Confident	133 Å²	133	66.7 Å²	66.7	58%	0.578	33%	0.325	S	S	*	.	S	Bend	trans	-131.5	156.6	179.8	-61.5	-175.4	179.6	178.8	0	111.4	V616 E620 D621	V616-K618 WeakPolarHBondContact CG1-O 3.45Å; K618-E620 WeakPolarHBondContact CB-OE2 3.39Å; K618-E620 PolarHBondContact O-N 3.22Å; K618-D621 PolarHBondContact N-OD2 2.94Å; K618-D621 VanDerWaalsContact N-OD2 3.11Å; K618-D621 WeakPolarHBondContact O-CB 3.26Å; K618-D621 PolarHBondContact O-N 3.43Å
619	V	85.4	Confident	85.3	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-32.3	-179	177.2	0	0	0	0	110.8	L587 D621 L622 I660 M668 F670	L587-V619 HydrophobicContact CB-CG2 4.38Å; L587-V619 HydrophobicContact CD1-CG2 4.19Å; V619-D621 PolarHBondContact O-N 3.38Å; V619-L622 HydrophobicContact CG1-CD1 4.38Å; V619-L622 WeakPolarHBondContact O-CB 3.47Å; V619-L622 PolarHBondContact O-N 2.71Å; V619-L622 VanDerWaalsContact O-N 3.1Å; V619-I660 HydrophobicContact CG1-CD1 3.89Å; V619-I660 HydrophobicContact CG1-CG1 4.34Å; V619-I660 HydrophobicContact CG1-CG2 4.46Å; V619-M668 HydrophobicContact CG1-CE 4.4Å; V619-M668 HydrophobicContact CG1-SD 4.25Å; V619-F670 HydrophobicContact CB-CD1 4.3Å; V619-F670 HydrophobicContact CB-CE1 4.31Å; V619-F670 HydrophobicContact CG1-CB 4.38Å; V619-F670 HydrophobicContact CG1-CD1 3.89Å; V619-F670 HydrophobicContact CG1-CD2 4.12Å; V619-F670 HydrophobicContact CG1-CE1 4.13Å; V619-F670 HydrophobicContact CG1-CE2 4.33Å; V619-F670 HydrophobicContact CG1-CG 3.88Å; V619-F670 HydrophobicContact CG1-CZ 4.31Å; V619-F670 HydrophobicContact CG2-CD1 4.14Å; V619-F670 HydrophobicContact CG2-CE1 3.66Å; V619-F670 HydrophobicContact CG2-CZ 3.96Å
620	E	84.6	Confident	84.6	Confident	84 Å²	84	66 Å²	66	39%	0.393	32%	0.322	S	S	.	.	H	α-helix	trans	-56.1	-33	174.5	-66	83.1	165.2	0	0	112.4	K618 L622 P624 M668	K618-E620 WeakPolarHBondContact CB-OE2 3.39Å; K618-E620 PolarHBondContact O-N 3.22Å; E620-L622 VanDerWaalsContact C-N 3.32Å; E620-L622 PolarHBondContact O-N 2.89Å; E620-P624 WeakPolarHBondContact O-CD 3.44Å; E620-M668 HydrophobicContact CB-CE 4.49Å; E620-M668 HydrophobicContact CG-CE 3.57Å; E620-M668 HydrophobicContact CG-SD 4.18Å
621	D	86.2	Confident	83.2	Confident	62 Å²	62	65.6 Å²	65.6	33%	0.332	34%	0.337	S	S	.	.	H	α-helix	trans	-75.7	-21.3	-178.4	-52.5	-35.4	0	0	0	112.1	V616 K618 V619 P624 I625	V616-D621 HydrophobicContact CG1-CB 4.24Å; V616-D621 HydrophobicContact CG2-CB 4.41Å; K618-D621 PolarHBondContact N-OD2 2.94Å; K618-D621 VanDerWaalsContact N-OD2 3.11Å; K618-D621 WeakPolarHBondContact O-CB 3.26Å; K618-D621 PolarHBondContact O-N 3.43Å; V619-D621 PolarHBondContact O-N 3.38Å; D621-P624 WeakPolarHBondContact O-CD 3.28Å; D621-I625 WeakPolarHBondContact O-CD1 3.38Å; D621-I625 WeakPolarHBondContact O-CG1 3.28Å
622	L	86.4	Confident	82.1	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-43.4	-176.1	-74.8	171.8	0	0	0	112.6	L587 I590 I594 L613 V616 V619 E620 I625 M626 F637 I660	L587-L622 HydrophobicContact CD1-CD1 3.52Å; L587-L622 HydrophobicContact CD1-CD2 4.32Å; L587-L622 HydrophobicContact CD1-CG 3.96Å; I590-L622 HydrophobicContact CB-CD1 4.43Å; I590-L622 HydrophobicContact CD1-CD1 4.31Å; I590-L622 HydrophobicContact CG2-CD1 3.72Å; I594-L622 HydrophobicContact CD1-CD2 4.2Å; L613-L622 HydrophobicContact CD2-CD2 3.79Å; V616-L622 HydrophobicContact CB-CD2 4.49Å; V616-L622 HydrophobicContact CG1-CD2 3.73Å; V616-L622 HydrophobicContact CG1-CG 3.83Å; V616-L622 HydrophobicContact CG2-CD2 4.26Å; V619-L622 HydrophobicContact CG1-CD1 4.38Å; V619-L622 WeakPolarHBondContact O-CB 3.47Å; V619-L622 PolarHBondContact O-N 2.71Å; V619-L622 VanDerWaalsContact O-N 3.1Å; E620-L622 VanDerWaalsContact C-N 3.32Å; E620-L622 PolarHBondContact O-N 2.89Å; L622-I625 PolarHBondContact O-N 3.08Å; L622-M626 WeakPolarHBondContact O-CB 3.4Å; L622-M626 VanDerWaalsContact O-CG 3.3Å; L622-M626 WeakPolarHBondContact O-CG 3.06Å; L622-M626 PolarHBondContact O-N 2.94Å; L622-F637 HydrophobicContact CB-CZ 4.38Å; L622-I660 HydrophobicContact CD1-CD1 3.96Å
623	L	83.5	Confident	81	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-50.1	-175.5	-81.8	173.3	0	0	0	112.4	I625 M626 K627 F637 I660 M668	L623-I625 VanDerWaalsContact C-N 3.28Å; L623-I625 PolarHBondContact O-N 2.96Å; L623-M626 PolarHBondContact O-N 3.24Å; L623-K627 VanDerWaalsContact O-CG 3.29Å; L623-K627 WeakPolarHBondContact O-CG 3.49Å; L623-K627 PolarHBondContact O-N 3.43Å; L623-K627 VanDerWaalsContact O-N 3.09Å; L623-F637 HydrophobicContact CD2-CD1 4Å; L623-F637 HydrophobicContact CD2-CE1 4.01Å; L623-I660 HydrophobicContact CD1-CG2 3.75Å; L623-I660 HydrophobicContact CD2-CG2 3.9Å; L623-I660 HydrophobicContact CG-CG2 3.57Å; L623-M668 HydrophobicContact CD1-CG 4.34Å; L623-M668 HydrophobicContact CD1-SD 4.45Å
624	P	82.8	Confident	79.8	Confident	72 Å²	72	76.5 Å²	76.5	47%	0.468	38%	0.376	S	S	.	.	H	α-helix	trans	-54.9	-41.7	174.5	-27	34.3	0	0	0	113.4	E620 D621	E620-P624 WeakPolarHBondContact O-CD 3.44Å; D621-P624 WeakPolarHBondContact O-CD 3.28Å
625	I	82.9	Confident	78.9	Confident	28 Å²	28	75.8 Å²	75.8	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-68.5	-47.9	-179.4	-69	170.6	0	0	0	110.6	A612 V616 D621 L622 L623 K627 Q628 F629	A612-I625 HydrophobicContact CB-CG2 3.83Å; V616-I625 HydrophobicContact CG2-CD1 3.18Å; D621-I625 WeakPolarHBondContact O-CD1 3.38Å; D621-I625 WeakPolarHBondContact O-CG1 3.28Å; L622-I625 PolarHBondContact O-N 3.08Å; L623-I625 VanDerWaalsContact C-N 3.28Å; L623-I625 PolarHBondContact O-N 2.96Å; I625-K627 PolarHBondContact O-N 2.97Å; I625-Q628 WeakPolarHBondContact O-CB 3.48Å; I625-Q628 PolarHBondContact O-N 3.12Å; I625-F629 HydrophobicContact CG2-CD2 4.2Å; I625-F629 HydrophobicContact CG2-CE2 3.8Å; I625-F629 VanDerWaalsContact O-CD2 3.25Å; I625-F629 WeakPolarHBondContact O-CD2 3.48Å
626	M	82.2	Confident	78.9	Confident	9 Å²	9	70.7 Å²	70.7	4%	0.044	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-27.7	-179.9	-68.7	-59.6	94.8	0	0	113.2	I594 L613 L622 L623 Q628 F629 N630 T633 F637	I594-M626 HydrophobicContact CD1-CG 4.38Å; I594-M626 HydrophobicContact CD1-SD 3.83Å; I594-M626 HydrophobicContact CG1-SD 4.25Å; I594-M626 HydrophobicContact CG2-CE 4.16Å; I594-M626 HydrophobicContact CG2-SD 3.77Å; L613-M626 HydrophobicContact CD2-CE 4.08Å; L622-M626 WeakPolarHBondContact O-CB 3.4Å; L622-M626 VanDerWaalsContact O-CG 3.3Å; L622-M626 WeakPolarHBondContact O-CG 3.06Å; L622-M626 PolarHBondContact O-N 2.94Å; L623-M626 PolarHBondContact O-N 3.24Å; M626-Q628 VanDerWaalsContact C-N 3.26Å; M626-Q628 PolarHBondContact O-N 3.39Å; M626-F629 HydrophobicContact CE-CD2 4.04Å; M626-F629 PolarHBondContact O-N 2.87Å; M626-N630 PolarHBondContact O-N 3.39Å; M626-N630 VanDerWaalsContact O-N 3.13Å; M626-T633 PolarHBondContact O-OG1 2.94Å; M626-F637 HydrophobicContact CB-CD1 4.22Å; M626-F637 HydrophobicContact CB-CE1 4.06Å; M626-F637 HydrophobicContact CG-CD1 4.19Å; M626-F637 HydrophobicContact CG-CE1 3.67Å; M626-F637 HydrophobicContact CG-CZ 3.99Å
627	K	80.8	Confident	78.8	Confident	90 Å²	90	72.1 Å²	72.1	39%	0.391	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-29.1	172.6	-74.2	173.6	-171.9	-169.8	0	112.8	L623 I625 R634	L623-K627 VanDerWaalsContact O-CG 3.29Å; L623-K627 WeakPolarHBondContact O-CG 3.49Å; L623-K627 PolarHBondContact O-N 3.43Å; L623-K627 VanDerWaalsContact O-N 3.09Å; I625-K627 PolarHBondContact O-N 2.97Å; K627-R634 WeakPolarHBondContact CE-O 3.49Å; K627-R634 PolarHBondContact NZ-O 3.4Å
628	Q	79.7	Confident	78.9	Confident	150 Å²	150	70.4 Å²	70.4	70%	0.701	35%	0.353	S	S	*	.	H	α-helix	trans	-70.7	-36.8	177.8	-61.4	175.3	5	0	0	111.6	I625 M626	I625-Q628 WeakPolarHBondContact O-CB 3.48Å; I625-Q628 PolarHBondContact O-N 3.12Å; M626-Q628 VanDerWaalsContact C-N 3.26Å; M626-Q628 PolarHBondContact O-N 3.39Å
629	F	76.2	Confident	79	Confident	57 Å²	57	64.7 Å²	64.7	25%	0.25	33%	0.33	C	S	.	.	H	α-helix	trans	-90.3	-20	-175	-64	-74.1	0	0	0	114.2	E608 V609 A612 I625 M626	E608-F629 HydrophobicContact CB-CE1 4.04Å; E608-F629 HydrophobicContact CB-CZ 4.45Å; V609-F629 HydrophobicContact CG2-CD1 3.58Å; V609-F629 HydrophobicContact CG2-CD2 4.14Å; V609-F629 HydrophobicContact CG2-CE1 3.68Å; V609-F629 HydrophobicContact CG2-CE2 4.23Å; V609-F629 HydrophobicContact CG2-CG 3.82Å; V609-F629 HydrophobicContact CG2-CZ 4.01Å; A612-F629 HydrophobicContact CB-CE2 3.8Å; A612-F629 HydrophobicContact CB-CZ 3.91Å; I625-F629 HydrophobicContact CG2-CD2 4.2Å; I625-F629 HydrophobicContact CG2-CE2 3.8Å; I625-F629 VanDerWaalsContact O-CD2 3.25Å; I625-F629 WeakPolarHBondContact O-CD2 3.48Å; M626-F629 HydrophobicContact CE-CD2 4.04Å; M626-F629 PolarHBondContact O-N 2.87Å
630	N	71.6	Confident	79.2	Confident	49 Å²	49	67.7 Å²	67.7	26%	0.262	35%	0.346	S	S	.	.			trans	-149.5	115	179.7	-174.6	-5.1	0	0	0	112.1	M626 K632 T633	M626-N630 PolarHBondContact O-N 3.39Å; M626-N630 VanDerWaalsContact O-N 3.13Å; N630-K632 PolarHBondContact O-N 3.34Å; N630-K632 VanDerWaalsContact O-N 3.12Å; N630-K632 WeakPolarHBondContact OD1-CB 3.39Å; N630-K632 PolarHBondContact OD1-N 2.98Å; N630-T633 HydrophobicContact CB-CG2 4Å; N630-T633 PolarHBondContact O-N 3.38Å; N630-T633 VanDerWaalsContact O-N 3.15Å; N630-T633 PolarHBondContact O-OG1 2.92Å
631	S	60.9	Low	79.5	Confident	110 Å²	110	64.1 Å²	64.1	77%	0.769	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.3	-16.2	179.6	59.5	0	0	0	0	114.5	T633	S631-T633 VanDerWaalsContact C-N 3.34Å
632	K	65.3	Low	79.7	Confident	187 Å²	187	64.9 Å²	64.9	81%	0.813	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-78.6	-11.5	175.9	-64.6	-175.6	178.3	-179.9	0	113.8	N630 R634	N630-K632 PolarHBondContact O-N 3.34Å; N630-K632 VanDerWaalsContact O-N 3.12Å; N630-K632 WeakPolarHBondContact OD1-CB 3.39Å; N630-K632 PolarHBondContact OD1-N 2.98Å; K632-R634 PolarHBondContact O-N 3.07Å
633	T	64.9	Low	80.1	Confident	14 Å²	14	64.9 Å²	64.9	9%	0.086	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-86.9	17.8	177.4	61.6	0	0	0	0	112.8	M626 N630 S631 D635 G636 F637	M626-T633 PolarHBondContact O-OG1 2.94Å; N630-T633 HydrophobicContact CB-CG2 4Å; N630-T633 PolarHBondContact O-N 3.38Å; N630-T633 VanDerWaalsContact O-N 3.15Å; N630-T633 PolarHBondContact O-OG1 2.92Å; S631-T633 VanDerWaalsContact C-N 3.34Å; T633-D635 PolarHBondContact O-N 3.26Å; T633-D635 VanDerWaalsContact O-N 3.13Å; T633-G636 WeakPolarHBondContact CA-O 3.37Å; T633-G636 PolarHBondContact O-N 3.3Å; T633-G636 VanDerWaalsContact O-N 3.13Å; T633-F637 HydrophobicContact CG2-CB 4.15Å
634	R	64.4	Low	80.6	Confident	162 Å²	162	66.1 Å²	66.1	61%	0.611	34%	0.339	S	S	*	.	S	Bend	trans	-52	-40.7	-172.5	-170.7	-179.7	-176.9	177.5	2.2	113.2	K627 K632	K627-R634 WeakPolarHBondContact CE-O 3.49Å; K627-R634 PolarHBondContact NZ-O 3.4Å; K632-R634 PolarHBondContact O-N 3.07Å
635	D	70.8	Confident	81.2	Confident	119 Å²	119	63.2 Å²	63.2	64%	0.636	32%	0.321	S	S	*	.	S	Bend	trans	-106	-8.8	-176.9	-55	-35.1	0	0	0	112.5	T633 T661 G662	T633-D635 PolarHBondContact O-N 3.26Å; T633-D635 VanDerWaalsContact O-N 3.13Å; D635-T661 VanDerWaalsContact O-CA 3.28Å; D635-T661 WeakPolarHBondContact O-CA 3.41Å; D635-T661 WeakPolarHBondContact O-CB 3.36Å; D635-G662 PolarHBondContact O-N 2.87Å
636	G	84.3	Confident	81.6	Confident	18 Å²	18	65.2 Å²	65.2	19%	0.186	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.5	-176.9	178.5	0	0	0	0	0	114.6	T633 I660	T633-G636 WeakPolarHBondContact CA-O 3.37Å; T633-G636 PolarHBondContact O-N 3.3Å; T633-G636 VanDerWaalsContact O-N 3.13Å; G636-I660 CarbonylContact C-O 3.58Å; G636-I660 WeakPolarHBondContact CA-O 3.46Å
637	F	86.8	Confident	82.1	Confident	30 Å²	30	68.6 Å²	68.6	13%	0.132	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	163.2	174.1	66.6	-85.7	0	0	0	111.7	I590 I594 L622 L623 M626 T633 V639 I660	I590-F637 HydrophobicContact CG2-CE2 4.16Å; I590-F637 HydrophobicContact CG2-CZ 4.36Å; I594-F637 HydrophobicContact CD1-CE2 4.16Å; I594-F637 HydrophobicContact CD1-CZ 4.2Å; I594-F637 HydrophobicContact CG1-CE2 4.46Å; L622-F637 HydrophobicContact CB-CZ 4.38Å; L623-F637 HydrophobicContact CD2-CD1 4Å; L623-F637 HydrophobicContact CD2-CE1 4.01Å; M626-F637 HydrophobicContact CB-CD1 4.22Å; M626-F637 HydrophobicContact CB-CE1 4.06Å; M626-F637 HydrophobicContact CG-CD1 4.19Å; M626-F637 HydrophobicContact CG-CE1 3.67Å; M626-F637 HydrophobicContact CG-CZ 3.99Å; T633-F637 HydrophobicContact CG2-CB 4.15Å; F637-V639 HydrophobicContact CD2-CG2 3.93Å; F637-V639 HydrophobicContact CE2-CG2 3.79Å; F637-I660 HydrophobicContact CE1-CB 4.34Å; F637-I660 HydrophobicContact CE1-CD1 4.48Å; F637-I660 HydrophobicContact CE2-CD1 4.23Å; F637-I660 HydrophobicContact CZ-CB 4.44Å; F637-I660 HydrophobicContact CZ-CD1 3.83Å; F637-I660 PolarHBondContact N-O 3.34Å; F637-I660 PolarHBondContact O-N 3.31Å
638	T	89.2	Confident	82.6	Confident	88 Å²	88	67 Å²	67	54%	0.54	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.1	178.8	57.8	0	0	0	0	111.5	T657 I658 T659	T638-T657 HydrophobicContact CG2-CG2 4.32Å; T638-I658 CarbonylContact C-O 3.29Å; T638-I658 WeakPolarHBondContact CA-O 3.48Å; T638-T659 HydrophobicContact CG2-CG2 4.23Å
639	V	89.9	Confident	83.1	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.8	176.5	177.4	0	0	0	0	109.5	F589 I590 R593 F637 T657 I658	F589-V639 HydrophobicContact CE1-CG1 3.97Å; I590-V639 HydrophobicContact CG2-CG2 4.33Å; R593-V639 HydrophobicContact CB-CG1 3.32Å; R593-V639 HydrophobicContact CG-CG1 3.58Å; F637-V639 HydrophobicContact CD2-CG2 3.93Å; F637-V639 HydrophobicContact CE2-CG2 3.79Å; V639-T657 CarbonylContact O-C 3.58Å; V639-T657 WeakPolarHBondContact O-CA 3.04Å; V639-I658 HydrophobicContact CB-CB 4.36Å; V639-I658 PolarHBondContact N-O 3.31Å; V639-I658 PolarHBondContact O-N 2.97Å
640	N	89.9	Confident	83.7	Confident	67 Å²	67	67 Å²	67	36%	0.358	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.4	179.2	-64.1	-18.7	0	0	0	111.4	R593 T657	R593-N640 PolarHBondContact NE-O 2.93Å; N640-T657 WeakPolarHBondContact OD1-CB 3.17Å; N640-T657 WeakPolarHBondContact OD1-CG2 3.45Å; N640-T657 PolarHBondContact OD1-OG1 3.44Å
641	S	91.1	Very high	84.7	Confident	10 Å²	10	69 Å²	69	7%	0.07	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	153.1	166.7	-173.4	0	0	0	0	111.4	G655 F656	S641-G655 PolarHBondContact O-N 3.42Å; S641-F656 VanDerWaalsContact CB-CE1 3.48Å; S641-F656 WeakPolarHBondContact CB-O 3.28Å; S641-F656 PolarHBondContact N-O 3.27Å
642	K	90.9	Very high	86.3	Confident	77 Å²	77	69.3 Å²	69.3	34%	0.335	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.8	177.4	-66.9	-62.6	-172.1	177.1	0	109.1	E652 Y653 D654	K642-E652 HydrophobicContact CB-CB 4.34Å; K642-Y653 WeakPolarHBondContact CA-O 3.12Å; K642-D654 IonicContact NZ-OD1 3.61Å; K642-D654 PolarHBondContact NZ-OD1 3.12Å
643	V	94	Very high	87.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.1	-177.5	178.2	0	0	0	0	108.1	E652 Y653 Y684 Y723 Y724 N727	V643-E652 CarbonylContact O-C 3.42Å; V643-E652 WeakPolarHBondContact O-CA 3.39Å; V643-Y653 PolarHBondContact N-O 2.9Å; V643-Y653 PolarHBondContact O-N 3.21Å; V643-Y684 WeakPolarHBondContact CB-OH 3.47Å; V643-Y684 HydrophobicContact CG1-CE1 4.38Å; V643-Y684 VanDerWaalsContact CG2-OH 3.26Å; V643-Y684 WeakPolarHBondContact CG2-OH 3.44Å; V643-Y723 HydrophobicContact CG1-CE1 3.53Å; V643-Y724 HydrophobicContact CG1-CD1 4.13Å; V643-Y724 HydrophobicContact CG1-CE1 3.78Å; V643-N727 HydrophobicContact CG2-CB 4.34Å; V643-N727 WeakPolarHBondContact CG2-OD1 3.23Å
644	P	94.9	Very high	88.8	Confident	38 Å²	38	63.5 Å²	63.5	25%	0.247	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	143.6	-178.9	28.4	-34.6	0	0	0	110.6	Y724 P772	P644-Y724 PolarHBondContact O-OH 3.11Å; P644-P772 WeakPolarHBondContact CD-O 3.44Å; P644-P772 WeakPolarHBondContact CG-O 3.49Å
645	S	95.1	Very high	90.1	Very high	12 Å²	12	56 Å²	56	8%	0.084	33%	0.325	C	S	.	.			trans	-83.8	137.7	171.5	177.6	0	0	0	0	110.8	K647 D648 K651 Y653 E687	S645-K647 PolarHBondContact OG-N 3.31Å; S645-D648 PolarHBondContact OG-N 3.28Å; S645-K651 WeakPolarHBondContact CB-O 3.46Å; S645-K651 PolarHBondContact N-O 2.97Å; S645-Y653 PolarHBondContact OG-OH 3.3Å; S645-E687 PolarHBondContact OG-OE1 3.5Å; S645-E687 PolarHBondContact OG-OE2 2.7Å
646	V	91.6	Very high	91.1	Very high	69 Å²	69	50.6 Å²	50.6	42%	0.418	30%	0.296	S	S	.	.	S	Bend	trans	-88.5	-31.1	171	170.1	0	0	0	0	110.3	E687 Y724 P774	V646-E687 WeakPolarHBondContact CA-OE1 3.35Å; V646-E687 WeakPolarHBondContact CB-OE1 3.48Å; V646-E687 PolarHBondContact N-OE1 2.9Å; V646-Y724 HydrophobicContact CG2-CE2 4.29Å; V646-Y724 VanDerWaalsContact CG2-OH 3.31Å; V646-Y724 WeakPolarHBondContact CG2-OH 3.31Å; V646-Y724 PolarHBondContact N-OH 3.33Å; V646-P774 HydrophobicContact CG2-CG 3.63Å
647	K	91.9	Very high	91.5	Very high	81 Å²	81	50.6 Å²	50.6	35%	0.352	29%	0.292	S	S	.	.	S	Bend	trans	-70	-46.2	177.3	-176.7	-171.2	175.4	-173.4	0	112.8	S645 P649 S686 E687 N690	S645-K647 PolarHBondContact OG-N 3.31Å; K647-P649 WeakPolarHBondContact O-CD 3.29Å; K647-S686 PolarHBondContact NZ-OG 3.38Å; K647-E687 WeakPolarHBondContact CB-OE1 3.39Å; K647-E687 WeakPolarHBondContact CB-OE2 3.48Å; K647-E687 PolarHBondContact N-OE1 3.4Å; K647-N690 HydrophobicContact CB-CB 4.45Å; K647-N690 HydrophobicContact CD-CB 4.11Å; K647-N690 HydrophobicContact CG-CB 4.23Å
648	D	91.4	Very high	91.7	Very high	55 Å²	55	49.2 Å²	49.2	29%	0.294	29%	0.286	S	S	.	.	S	Bend	trans	-117.1	91.9	-174.2	-63.7	-27.7	0	0	0	109.6	S645 G650 K651	S645-D648 PolarHBondContact OG-N 3.28Å; D648-G650 PolarHBondContact O-N 3.37Å; D648-K651 HydrophobicContact CB-CB 3.83Å; D648-K651 HydrophobicContact CB-CD 3.7Å; D648-K651 HydrophobicContact CB-CG 4.48Å; D648-K651 VanDerWaalsContact O-CB 3.24Å; D648-K651 WeakPolarHBondContact O-CB 3.47Å; D648-K651 PolarHBondContact O-N 2.89Å; D648-K651 WeakPolarHBondContact OD2-CD 3.32Å; D648-K651 IonicContact OD2-NZ 3.58Å; D648-K651 PolarHBondContact OD2-NZ 3.12Å
649	P	89.8	Confident	91.8	Very high	123 Å²	123	45.9 Å²	45.9	80%	0.799	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.4	-176.8	-26.4	34.6	0	0	0	113.1	K647 K651	K647-P649 WeakPolarHBondContact O-CD 3.29Å; P649-K651 VanDerWaalsContact C-N 3.31Å
650	G	88.6	Confident	91.9	Very high	86 Å²	86	45.2 Å²	45.2	89%	0.887	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-2.2	-178.3	0	0	0	0	0	114.8	D648	D648-G650 PolarHBondContact O-N 3.37Å
651	K	93.8	Very high	91.8	Very high	89 Å²	89	44.3 Å²	44.3	39%	0.387	26%	0.258	S	S	.	.			trans	-91.1	140.5	171.1	-165.7	-178	-174.7	-172.7	0	110.3	S645 D648 P649 Y653	S645-K651 WeakPolarHBondContact CB-O 3.46Å; S645-K651 PolarHBondContact N-O 2.97Å; D648-K651 HydrophobicContact CB-CB 3.83Å; D648-K651 HydrophobicContact CB-CD 3.7Å; D648-K651 HydrophobicContact CB-CG 4.48Å; D648-K651 VanDerWaalsContact O-CB 3.24Å; D648-K651 WeakPolarHBondContact O-CB 3.47Å; D648-K651 PolarHBondContact O-N 2.89Å; D648-K651 WeakPolarHBondContact OD2-CD 3.32Å; D648-K651 IonicContact OD2-NZ 3.58Å; D648-K651 PolarHBondContact OD2-NZ 3.12Å; P649-K651 VanDerWaalsContact C-N 3.31Å; K651-Y653 HydrophobicContact CD-CE1 3.87Å; K651-Y653 HydrophobicContact CG-CE1 4.22Å
652	E	92.8	Very high	91.5	Very high	118 Å²	118	44.6 Å²	44.6	55%	0.551	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.8	175.5	-63.3	-177.3	159.9	0	0	110.2	K642 V643	K642-E652 HydrophobicContact CB-CB 4.34Å; V643-E652 CarbonylContact O-C 3.42Å; V643-E652 WeakPolarHBondContact O-CA 3.39Å
653	Y	93	Very high	90.9	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	159.1	173.8	-51.1	-48.5	0	0	0	110.8	K642 V643 S645 K651 G655 Q683 Y684 E687	K642-Y653 WeakPolarHBondContact CA-O 3.12Å; V643-Y653 PolarHBondContact N-O 2.9Å; V643-Y653 PolarHBondContact O-N 3.21Å; S645-Y653 PolarHBondContact OG-OH 3.3Å; K651-Y653 HydrophobicContact CD-CE1 3.87Å; K651-Y653 HydrophobicContact CG-CE1 4.22Å; Y653-G655 PolarHBondContact O-N 2.92Å; Y653-Q683 HydrophobicContact CD1-CB 3.98Å; Y653-Q683 HydrophobicContact CD1-CG 4.3Å; Y653-Q683 HydrophobicContact CE1-CB 3.97Å; Y653-Q683 HydrophobicContact CE1-CG 4.28Å; Y653-Q683 HydrophobicContact CG-CB 4.5Å; Y653-Y684 HydrophobicContact CG-CE2 4.43Å; Y653-E687 HydrophobicContact CE2-CB 4.21Å; Y653-E687 HydrophobicContact CE2-CG 4.15Å; Y653-E687 VanDerWaalsContact CE2-OE2 3.26Å; Y653-E687 WeakPolarHBondContact CE2-OE2 3.27Å; Y653-E687 PolarHBondContact OH-OE2 2.86Å
654	D	91.1	Very high	89.6	Confident	77 Å²	77	55.2 Å²	55.2	41%	0.412	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	121.5	172.6	-72.2	-36.3	0	0	0	111	K642 R680 Y684	K642-D654 IonicContact NZ-OD1 3.61Å; K642-D654 PolarHBondContact NZ-OD1 3.12Å; D654-R680 PolarHBondContact O-NE 3.28Å; D654-R680 PolarHBondContact O-NH2 3Å; D654-Y684 PolarHBondContact O-OH 3.08Å
655	G	91.4	Very high	88.2	Confident	5 Å²	5	58.7 Å²	58.7	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-126.9	175	0	0	0	0	0	111.9	S641 Y653 R680	S641-G655 PolarHBondContact O-N 3.42Å; Y653-G655 PolarHBondContact O-N 2.92Å; G655-R680 PolarHBondContact O-NH2 3.49Å
656	F	91.6	Very high	87	Confident	5 Å²	5	61.1 Å²	61.1	2%	0.022	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	156.3	173.5	65.2	-88	0	0	0	111.9	F589 S641 I658 V672 E673 M769	F589-F656 HydrophobicContact CD1-CZ 4.4Å; F589-F656 HydrophobicContact CE1-CE2 4.05Å; F589-F656 HydrophobicContact CE1-CZ 4Å; F589-F656 HydrophobicContact CZ-CZ 4.17Å; S641-F656 VanDerWaalsContact CB-CE1 3.48Å; S641-F656 WeakPolarHBondContact CB-O 3.28Å; S641-F656 PolarHBondContact N-O 3.27Å; F656-I658 HydrophobicContact CD2-CG1 3.92Å; F656-I658 HydrophobicContact CE2-CD1 3.82Å; F656-I658 HydrophobicContact CE2-CG1 3.62Å; F656-V672 HydrophobicContact CB-CG1 3.91Å; F656-V672 HydrophobicContact CD2-CG1 3.69Å; F656-V672 HydrophobicContact CE2-CG1 4.49Å; F656-V672 HydrophobicContact CG-CG1 3.98Å; F656-E673 CarbonylContact C-O 3.35Å; F656-E673 WeakPolarHBondContact CA-O 3.37Å; F656-M769 HydrophobicContact CB-CE 3.53Å; F656-M769 HydrophobicContact CD1-CB 3.96Å; F656-M769 HydrophobicContact CD1-CE 3.89Å; F656-M769 HydrophobicContact CE1-CB 4.09Å; F656-M769 VanDerWaalsContact CE1-O 3.27Å; F656-M769 WeakPolarHBondContact CE1-O 3.48Å; F656-M769 HydrophobicContact CG-CE 3.82Å
657	T	91.8	Very high	86.5	Confident	17 Å²	17	60.2 Å²	60.2	10%	0.104	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.3	173.8	-64.5	0	0	0	0	109	T638 V639 N640 V672 E673	T638-T657 HydrophobicContact CG2-CG2 4.32Å; V639-T657 CarbonylContact O-C 3.58Å; V639-T657 WeakPolarHBondContact O-CA 3.04Å; N640-T657 WeakPolarHBondContact OD1-CB 3.17Å; N640-T657 WeakPolarHBondContact OD1-CG2 3.45Å; N640-T657 PolarHBondContact OD1-OG1 3.44Å; T657-V672 CarbonylContact O-C 3.56Å; T657-E673 PolarHBondContact N-O 3.33Å; T657-E673 PolarHBondContact O-N 2.87Å
658	I	92.5	Very high	86.3	Confident	1 Å²	1	57 Å²	57	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.3	167.6	-61.5	170.8	0	0	0	107.8	I586 F589 I590 T638 V639 F656 I660 F670 S671 V672	I586-I658 HydrophobicContact CG2-CD1 3.52Å; I586-I658 HydrophobicContact CG2-CG1 4.42Å; F589-I658 HydrophobicContact CD1-CD1 3.59Å; F589-I658 HydrophobicContact CE1-CD1 3.74Å; I590-I658 HydrophobicContact CD1-CD1 4.08Å; I590-I658 HydrophobicContact CD1-CG2 4.16Å; I590-I658 HydrophobicContact CG1-CD1 3.57Å; I590-I658 HydrophobicContact CG1-CG2 4.34Å; T638-I658 CarbonylContact C-O 3.29Å; T638-I658 WeakPolarHBondContact CA-O 3.48Å; V639-I658 HydrophobicContact CB-CB 4.36Å; V639-I658 PolarHBondContact N-O 3.31Å; V639-I658 PolarHBondContact O-N 2.97Å; F656-I658 HydrophobicContact CD2-CG1 3.92Å; F656-I658 HydrophobicContact CE2-CD1 3.82Å; F656-I658 HydrophobicContact CE2-CG1 3.62Å; I658-I660 HydrophobicContact CG2-CD1 4.31Å; I658-I660 HydrophobicContact CG2-CG1 4.01Å; I658-F670 HydrophobicContact CG2-CD2 4.01Å; I658-F670 HydrophobicContact CG2-CE2 3.64Å; I658-S671 CarbonylContact C-O 3.54Å; I658-S671 VanDerWaalsContact CA-O 3.31Å; I658-S671 WeakPolarHBondContact CA-O 3.48Å; I658-V672 HydrophobicContact CG1-CG2 4.38Å
659	T	91.1	Very high	86.2	Confident	18 Å²	18	56.9 Å²	56.9	11%	0.11	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.6	173.1	-60.4	0	0	0	0	109.2	T638 T661 F670 S671	T638-T659 HydrophobicContact CG2-CG2 4.23Å; T659-T661 HydrophobicContact CG2-CG2 3.92Å; T659-F670 WeakPolarHBondContact O-CA 3.47Å; T659-S671 PolarHBondContact N-O 2.98Å; T659-S671 PolarHBondContact O-N 2.87Å
660	I	90.8	Very high	86.3	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.7	173	-57.2	170.9	0	0	0	107.8	I590 V619 L622 L623 G636 F637 I658 M668 L669 F670	I590-I660 HydrophobicContact CD1-CD1 3.79Å; I590-I660 HydrophobicContact CG2-CD1 4.46Å; V619-I660 HydrophobicContact CG1-CD1 3.89Å; V619-I660 HydrophobicContact CG1-CG1 4.34Å; V619-I660 HydrophobicContact CG1-CG2 4.46Å; L622-I660 HydrophobicContact CD1-CD1 3.96Å; L623-I660 HydrophobicContact CD1-CG2 3.75Å; L623-I660 HydrophobicContact CD2-CG2 3.9Å; L623-I660 HydrophobicContact CG-CG2 3.57Å; G636-I660 CarbonylContact C-O 3.58Å; G636-I660 WeakPolarHBondContact CA-O 3.46Å; F637-I660 HydrophobicContact CE1-CB 4.34Å; F637-I660 HydrophobicContact CE1-CD1 4.48Å; F637-I660 HydrophobicContact CE2-CD1 4.23Å; F637-I660 HydrophobicContact CZ-CB 4.44Å; F637-I660 HydrophobicContact CZ-CD1 3.83Å; F637-I660 PolarHBondContact N-O 3.34Å; F637-I660 PolarHBondContact O-N 3.31Å; I658-I660 HydrophobicContact CG2-CD1 4.31Å; I658-I660 HydrophobicContact CG2-CG1 4.01Å; I660-M668 HydrophobicContact CG2-SD 4.36Å; I660-L669 CarbonylContact C-O 3.5Å; I660-L669 VanDerWaalsContact CA-O 3.28Å; I660-L669 WeakPolarHBondContact CA-O 3.28Å; I660-F670 HydrophobicContact CD1-CD2 4.37Å; I660-F670 HydrophobicContact CD1-CE2 4.49Å; I660-F670 HydrophobicContact CG1-CD2 3.82Å; I660-F670 HydrophobicContact CG1-CE2 4.35Å
661	T	89.3	Confident	86.5	Confident	47 Å²	47	47 Å²	47	29%	0.288	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.4	175.2	61.1	0	0	0	0	109.5	D635 T659 M668 L669	D635-T661 VanDerWaalsContact O-CA 3.28Å; D635-T661 WeakPolarHBondContact O-CA 3.41Å; D635-T661 WeakPolarHBondContact O-CB 3.36Å; T659-T661 HydrophobicContact CG2-CG2 3.92Å; T661-M668 CarbonylContact O-C 3.59Å; T661-M668 WeakPolarHBondContact O-CA 3.36Å; T661-M668 WeakPolarHBondContact O-CG 3.38Å; T661-L669 PolarHBondContact N-O 3.45Å; T661-L669 PolarHBondContact O-N 2.93Å; T661-L669 WeakPolarHBondContact OG1-CB 3.34Å
662	G	84.6	Confident	86.4	Confident	16 Å²	16	42.8 Å²	42.8	17%	0.165	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	137.7	179.6	0	0	0	0	0	111.1	D635 N667	D635-G662 PolarHBondContact O-N 2.87Å; G662-N667 CarbonylContact C-O 2.96Å; G662-N667 VanDerWaalsContact CA-O 3.27Å; G662-N667 WeakPolarHBondContact CA-O 3.4Å
663	D	78.2	Confident	86.3	Confident	74 Å²	74	38.5 Å²	38.5	40%	0.396	21%	0.214	S	C	.	.			trans	-89.5	-176.1	177.5	77.8	7.2	0	0	0	112.2	V665 G666 N667	D663-V665 VanDerWaalsContact C-N 3.29Å; D663-V665 WeakPolarHBondContact OD1-CA 3.29Å; D663-V665 PolarHBondContact OD1-N 3.24Å; D663-G666 PolarHBondContact OD1-N 2.89Å; D663-N667 PolarHBondContact N-O 3.41Å; D663-N667 WeakPolarHBondContact OD1-CB 3.47Å; D663-N667 PolarHBondContact OD1-N 2.67Å; D663-N667 VanDerWaalsContact OD2-CB 3.32Å; D663-N667 WeakPolarHBondContact OD2-CB 3.27Å; D663-N667 PolarHBondContact OD2-ND2 2.76Å
664	R	66.9	Low	86.1	Confident	226 Å²	226	38.4 Å²	38.4	85%	0.853	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-13.8	179.2	-61.4	-176.3	-173.7	-179.8	4	113.5
665	V	65.9	Low	85.8	Confident	111 Å²	111	38.7 Å²	38.7	67%	0.673	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.4	-176.1	-165.9	0	0	0	0	110.4	D663	D663-V665 VanDerWaalsContact C-N 3.29Å; D663-V665 WeakPolarHBondContact OD1-CA 3.29Å; D663-V665 PolarHBondContact OD1-N 3.24Å
666	G	68.8	Low	85.4	Confident	64 Å²	64	38.5 Å²	38.5	66%	0.66	21%	0.211	S	C	*	.	S	Bend	trans	91.1	5.5	179.6	0	0	0	0	0	113.7	D663	D663-G666 PolarHBondContact OD1-N 2.89Å
667	N	81.2	Confident	85.2	Confident	50 Å²	50	40.5 Å²	40.5	27%	0.267	22%	0.223	S	C	.	.			trans	-71.6	136.8	171.3	-65.7	-50.8	0	0	0	109.7	G662 D663	G662-N667 CarbonylContact C-O 2.96Å; G662-N667 VanDerWaalsContact CA-O 3.27Å; G662-N667 WeakPolarHBondContact CA-O 3.4Å; D663-N667 PolarHBondContact N-O 3.41Å; D663-N667 WeakPolarHBondContact OD1-CB 3.47Å; D663-N667 PolarHBondContact OD1-N 2.67Å; D663-N667 VanDerWaalsContact OD2-CB 3.32Å; D663-N667 WeakPolarHBondContact OD2-CB 3.27Å; D663-N667 PolarHBondContact OD2-ND2 2.76Å
668	M	86.9	Confident	85	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.069	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.1	178.9	-173	173.5	60.1	0	0	110.6	I570 R571 G572 V619 E620 L623 I660 T661 F670	I570-M668 HydrophobicContact CB-CE 4.12Å; I570-M668 HydrophobicContact CD1-CE 3.27Å; I570-M668 HydrophobicContact CG1-CE 4.27Å; I570-M668 HydrophobicContact CG2-CE 4Å; R571-M668 CarbonylContact C-O 3.47Å; R571-M668 WeakPolarHBondContact CA-O 3.37Å; G572-M668 PolarHBondContact N-O 3.27Å; G572-M668 PolarHBondContact O-N 3.15Å; V619-M668 HydrophobicContact CG1-CE 4.4Å; V619-M668 HydrophobicContact CG1-SD 4.25Å; E620-M668 HydrophobicContact CB-CE 4.49Å; E620-M668 HydrophobicContact CG-CE 3.57Å; E620-M668 HydrophobicContact CG-SD 4.18Å; L623-M668 HydrophobicContact CD1-CG 4.34Å; L623-M668 HydrophobicContact CD1-SD 4.45Å; I660-M668 HydrophobicContact CG2-SD 4.36Å; T661-M668 CarbonylContact O-C 3.59Å; T661-M668 WeakPolarHBondContact O-CA 3.36Å; T661-M668 WeakPolarHBondContact O-CG 3.38Å; M668-F670 HydrophobicContact CE-CB 4.41Å
669	L	90.2	Very high	84.8	Confident	52 Å²	52	52.2 Å²	52.2	27%	0.272	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.9	162.2	170.9	71.9	0	0	0	107.4	I570 I660 T661	I570-L669 WeakPolarHBondContact O-CA 3.37Å; I660-L669 CarbonylContact C-O 3.5Å; I660-L669 VanDerWaalsContact CA-O 3.28Å; I660-L669 WeakPolarHBondContact CA-O 3.28Å; T661-L669 PolarHBondContact N-O 3.45Å; T661-L669 PolarHBondContact O-N 2.93Å; T661-L669 WeakPolarHBondContact OG1-CB 3.34Å
670	F	92.4	Very high	84.8	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.1	169.1	175	-148.5	0	0	0	107.5	L569 I570 I586 I590 V619 I658 T659 I660 M668	L569-F670 WeakPolarHBondContact CA-O 3.28Å; L569-F670 HydrophobicContact CB-CD1 3.59Å; L569-F670 HydrophobicContact CB-CE1 3.9Å; L569-F670 HydrophobicContact CB-CG 4.05Å; L569-F670 WeakPolarHBondContact CB-O 3.46Å; L569-F670 HydrophobicContact CD1-CD1 3.81Å; L569-F670 HydrophobicContact CD1-CD2 4.09Å; L569-F670 HydrophobicContact CD1-CE1 3.36Å; L569-F670 HydrophobicContact CD1-CE2 3.68Å; L569-F670 HydrophobicContact CD1-CG 4.16Å; L569-F670 HydrophobicContact CD1-CZ 3.31Å; L569-F670 HydrophobicContact CG-CD1 4.35Å; L569-F670 HydrophobicContact CG-CE1 4.28Å; L569-F670 PolarHBondContact N-O 2.85Å; I570-F670 HydrophobicContact CB-CB 3.95Å; I570-F670 HydrophobicContact CD1-CB 4.43Å; I570-F670 HydrophobicContact CD1-CD1 4.04Å; I570-F670 HydrophobicContact CG1-CB 4.34Å; I570-F670 HydrophobicContact CG1-CD1 4.17Å; I570-F670 PolarHBondContact N-O 3.39Å; I570-F670 PolarHBondContact O-N 2.84Å; I586-F670 HydrophobicContact CB-CZ 4.29Å; I586-F670 HydrophobicContact CG2-CE2 3.98Å; I586-F670 HydrophobicContact CG2-CZ 3.59Å; I590-F670 HydrophobicContact CD1-CE2 4Å; I590-F670 HydrophobicContact CD1-CZ 4.25Å; V619-F670 HydrophobicContact CB-CD1 4.3Å; V619-F670 HydrophobicContact CB-CE1 4.31Å; V619-F670 HydrophobicContact CG1-CB 4.38Å; V619-F670 HydrophobicContact CG1-CD1 3.89Å; V619-F670 HydrophobicContact CG1-CD2 4.12Å; V619-F670 HydrophobicContact CG1-CE1 4.13Å; V619-F670 HydrophobicContact CG1-CE2 4.33Å; V619-F670 HydrophobicContact CG1-CG 3.88Å; V619-F670 HydrophobicContact CG1-CZ 4.31Å; V619-F670 HydrophobicContact CG2-CD1 4.14Å; V619-F670 HydrophobicContact CG2-CE1 3.66Å; V619-F670 HydrophobicContact CG2-CZ 3.96Å; I658-F670 HydrophobicContact CG2-CD2 4.01Å; I658-F670 HydrophobicContact CG2-CE2 3.64Å; T659-F670 WeakPolarHBondContact O-CA 3.47Å; I660-F670 HydrophobicContact CD1-CD2 4.37Å; I660-F670 HydrophobicContact CD1-CE2 4.49Å; I660-F670 HydrophobicContact CG1-CD2 3.82Å; I660-F670 HydrophobicContact CG1-CE2 4.35Å; M668-F670 HydrophobicContact CE-CB 4.41Å
671	S	92.4	Very high	84.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	152.3	-173.7	60.5	0	0	0	0	112.3	I567 I658 T659	I567-S671 CarbonylContact O-C 3.51Å; I567-S671 VanDerWaalsContact O-CA 3.25Å; I567-S671 WeakPolarHBondContact O-CA 3.37Å; I567-S671 WeakPolarHBondContact O-CB 3.25Å; I658-S671 CarbonylContact C-O 3.54Å; I658-S671 VanDerWaalsContact CA-O 3.31Å; I658-S671 WeakPolarHBondContact CA-O 3.48Å; T659-S671 PolarHBondContact N-O 2.98Å; T659-S671 PolarHBondContact O-N 2.87Å
672	V	91.6	Very high	85	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.9	170.6	176.6	0	0	0	0	107.6	I567 L569 F656 T657 I658 M769	I567-V672 HydrophobicContact CB-CB 4.32Å; I567-V672 PolarHBondContact N-O 3.3Å; I567-V672 PolarHBondContact O-N 2.79Å; L569-V672 HydrophobicContact CD1-CG2 3.78Å; L569-V672 HydrophobicContact CG-CG2 4.39Å; F656-V672 HydrophobicContact CB-CG1 3.91Å; F656-V672 HydrophobicContact CD2-CG1 3.69Å; F656-V672 HydrophobicContact CE2-CG1 4.49Å; F656-V672 HydrophobicContact CG-CG1 3.98Å; T657-V672 CarbonylContact O-C 3.56Å; I658-V672 HydrophobicContact CG1-CG2 4.38Å; V672-M769 HydrophobicContact CG1-CE 3.87Å
673	E	90.4	Very high	85.4	Confident	27 Å²	27	57 Å²	57	13%	0.126	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.3	-176.3	-53.9	-170.3	167.8	0	0	110.1	N565 H566 F656 T657	N565-E673 WeakPolarHBondContact O-CA 3.45Å; H566-E673 IonicContact CE1-OE1 2.69Å; H566-E673 PolarHBondContact CE1-OE1 3.16Å; H566-E673 IonicContact CE1-OE2 3.37Å; H566-E673 WeakPolarHBondContact ND1-CG 3.22Å; H566-E673 IonicContact ND1-OE1 3.78Å; H566-E673 PolarHBondContact ND1-OE1 3.45Å; H566-E673 IonicContact ND1-OE2 3.6Å; F656-E673 CarbonylContact C-O 3.35Å; F656-E673 WeakPolarHBondContact CA-O 3.37Å; T657-E673 PolarHBondContact N-O 3.33Å; T657-E673 PolarHBondContact O-N 2.87Å
674	T	88.2	Confident	86.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.3	169	-53.2	0	0	0	0	108.3	N565 R680 N727 M729	N565-T674 PolarHBondContact N-O 3.32Å; N565-T674 PolarHBondContact O-N 3.09Å; T674-R680 VanDerWaalsContact CG2-NH1 3.32Å; T674-N727 WeakPolarHBondContact CG2-O 3.34Å; T674-M729 HydrophobicContact CG2-CB 4.06Å; T674-M729 HydrophobicContact CG2-CG 4.27Å
675	Q	84.6	Confident	87.5	Confident	82 Å²	82	44.8 Å²	44.8	38%	0.383	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	135.2	-179.3	-60.1	-173.6	-2.9	0	0	110.2	R680	Q675-R680 VanDerWaalsContact O-CD 3.3Å; Q675-R680 WeakPolarHBondContact O-CD 3.37Å; Q675-R680 PolarHBondContact O-NH1 2.91Å
676	T	84.3	Confident	88.9	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	84.2	171.3	-48.5	0	0	0	0	109.2	L551 L559 F563	L551-T676 HydrophobicContact CB-CG2 3.89Å; L551-T676 HydrophobicContact CD1-CG2 4.35Å; L551-T676 WeakPolarHBondContact CD1-OG1 3.32Å; L559-T676 HydrophobicContact CD2-CG2 3.98Å; F563-T676 WeakPolarHBondContact O-CB 3.49Å; F563-T676 PolarHBondContact O-N 3.48Å; F563-T676 PolarHBondContact O-OG1 2.76Å
677	T	87.3	Confident	90.2	Very high	46 Å²	46	38.2 Å²	38.2	28%	0.282	19%	0.19	S	C	.	.			trans	-95.3	157.4	169.3	66.2	0	0	0	0	110.1	R680 T681	T677-R680 WeakPolarHBondContact OG1-CB 3.41Å; T677-R680 PolarHBondContact OG1-N 2.96Å; T677-T681 VanDerWaalsContact O-CB 3.3Å; T677-T681 WeakPolarHBondContact O-CB 3.28Å; T677-T681 PolarHBondContact O-N 3.14Å; T677-T681 PolarHBondContact O-OG1 3.25Å
678	E	86.4	Confident	90.9	Very high	131 Å²	131	35.9 Å²	35.9	61%	0.612	18%	0.177	S	C	*	.	H	α-helix	trans	-60.5	-47.5	178.9	-175.7	174.6	-179.1	0	0	111.7	R680 T681 Q682	E678-R680 PolarHBondContact O-N 3.46Å; E678-T681 PolarHBondContact O-N 3.46Å; E678-Q682 WeakPolarHBondContact O-CG 3.41Å; E678-Q682 PolarHBondContact O-N 3.07Å; E678-Q682 PolarHBondContact OE1-NE2 3.38Å
679	E	89.1	Confident	91.3	Very high	134 Å²	134	38.7 Å²	38.7	63%	0.626	19%	0.19	S	C	*	.	H	α-helix	trans	-59.3	-50.6	179.3	-177.5	179.9	-178.3	0	0	112	T681 Q682 Q683	E679-T681 VanDerWaalsContact C-N 3.3Å; E679-T681 PolarHBondContact O-N 3.23Å; E679-Q682 PolarHBondContact O-N 3.44Å; E679-Q683 WeakPolarHBondContact O-CG 3.38Å; E679-Q683 PolarHBondContact O-N 3.02Å
680	R	90.6	Very high	91.6	Very high	12 Å²	12	38.4 Å²	38.4	5%	0.045	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-43.3	178.2	-176.4	178.2	179.3	-88.8	-11.1	111	D654 G655 T674 Q675 T677 E678 Q682 Q683 Y684 N727 L728	D654-R680 PolarHBondContact O-NE 3.28Å; D654-R680 PolarHBondContact O-NH2 3Å; G655-R680 PolarHBondContact O-NH2 3.49Å; T674-R680 VanDerWaalsContact CG2-NH1 3.32Å; Q675-R680 VanDerWaalsContact O-CD 3.3Å; Q675-R680 WeakPolarHBondContact O-CD 3.37Å; Q675-R680 PolarHBondContact O-NH1 2.91Å; T677-R680 WeakPolarHBondContact OG1-CB 3.41Å; T677-R680 PolarHBondContact OG1-N 2.96Å; E678-R680 PolarHBondContact O-N 3.46Å; R680-Q682 VanDerWaalsContact C-N 3.34Å; R680-Q682 PolarHBondContact O-N 3.44Å; R680-Q683 PolarHBondContact O-N 3.48Å; R680-Y684 HydrophobicContact CG-CD2 3.88Å; R680-Y684 HydrophobicContact CG-CE2 3.85Å; R680-Y684 PolarHBondContact NH2-OH 2.99Å; R680-Y684 WeakPolarHBondContact O-CD2 3.4Å; R680-Y684 PolarHBondContact O-N 2.83Å; R680-Y684 VanDerWaalsContact O-N 3.07Å; R680-N727 PolarHBondContact NH2-O 2.87Å; R680-L728 PolarHBondContact NH1-O 2.96Å
681	T	91.3	Very high	91.7	Very high	10 Å²	10	38.6 Å²	38.6	6%	0.061	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-44	179.9	-57.8	0	0	0	0	111.3	D552 T677 E678 E679 Q683 Y684 Q685	D552-T681 HydrophobicContact CB-CG2 3.86Å; T677-T681 VanDerWaalsContact O-CB 3.3Å; T677-T681 WeakPolarHBondContact O-CB 3.28Å; T677-T681 PolarHBondContact O-N 3.14Å; T677-T681 PolarHBondContact O-OG1 3.25Å; E678-T681 PolarHBondContact O-N 3.46Å; E679-T681 VanDerWaalsContact C-N 3.3Å; E679-T681 PolarHBondContact O-N 3.23Å; T681-Q683 PolarHBondContact O-N 3.31Å; T681-Y684 PolarHBondContact O-N 3.45Å; T681-Q685 HydrophobicContact CG2-CG 4.22Å; T681-Q685 VanDerWaalsContact O-CB 3.31Å; T681-Q685 WeakPolarHBondContact O-CB 3.33Å; T681-Q685 WeakPolarHBondContact O-CG 3.35Å; T681-Q685 PolarHBondContact O-N 3.39Å
682	Q	92.7	Very high	91.9	Very high	108 Å²	108	38.8 Å²	38.8	51%	0.505	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-40.9	176.5	-70.7	174.5	7.1	0	0	112.4	E678 E679 R680 Q685 S686	E678-Q682 WeakPolarHBondContact O-CG 3.41Å; E678-Q682 PolarHBondContact O-N 3.07Å; E678-Q682 PolarHBondContact OE1-NE2 3.38Å; E679-Q682 PolarHBondContact O-N 3.44Å; R680-Q682 VanDerWaalsContact C-N 3.34Å; R680-Q682 PolarHBondContact O-N 3.44Å; Q682-Q685 PolarHBondContact O-N 2.91Å; Q682-S686 WeakPolarHBondContact O-CB 3.41Å; Q682-S686 PolarHBondContact O-N 3.37Å
683	Q	94.1	Very high	92	Very high	50 Å²	50	43.6 Å²	43.6	23%	0.234	21%	0.211	C	C	.	.	H	α-helix	trans	-59.1	-52.4	176.7	-71.4	172.8	-0.9	0	0	111.6	Y653 E679 R680 T681 S686 E687	Y653-Q683 HydrophobicContact CD1-CB 3.98Å; Y653-Q683 HydrophobicContact CD1-CG 4.3Å; Y653-Q683 HydrophobicContact CE1-CB 3.97Å; Y653-Q683 HydrophobicContact CE1-CG 4.28Å; Y653-Q683 HydrophobicContact CG-CB 4.5Å; E679-Q683 WeakPolarHBondContact O-CG 3.38Å; E679-Q683 PolarHBondContact O-N 3.02Å; R680-Q683 PolarHBondContact O-N 3.48Å; T681-Q683 PolarHBondContact O-N 3.31Å; Q683-S686 PolarHBondContact O-N 3.11Å; Q683-E687 PolarHBondContact O-N 2.88Å; Q683-E687 VanDerWaalsContact O-N 3.15Å
684	Y	95.1	Very high	92.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-37.9	178.7	-83.4	-99.9	0	0	0	112.6	V643 Y653 D654 R680 T681 E687 I688 Y724 N727 L728	V643-Y684 WeakPolarHBondContact CB-OH 3.47Å; V643-Y684 HydrophobicContact CG1-CE1 4.38Å; V643-Y684 VanDerWaalsContact CG2-OH 3.26Å; V643-Y684 WeakPolarHBondContact CG2-OH 3.44Å; Y653-Y684 HydrophobicContact CG-CE2 4.43Å; D654-Y684 PolarHBondContact O-OH 3.08Å; R680-Y684 HydrophobicContact CG-CD2 3.88Å; R680-Y684 HydrophobicContact CG-CE2 3.85Å; R680-Y684 PolarHBondContact NH2-OH 2.99Å; R680-Y684 WeakPolarHBondContact O-CD2 3.4Å; R680-Y684 PolarHBondContact O-N 2.83Å; R680-Y684 VanDerWaalsContact O-N 3.07Å; T681-Y684 PolarHBondContact O-N 3.45Å; Y684-E687 WeakPolarHBondContact O-CB 3.46Å; Y684-E687 PolarHBondContact O-N 3.33Å; Y684-I688 VanDerWaalsContact O-CG1 3.28Å; Y684-I688 WeakPolarHBondContact O-CG1 3.4Å; Y684-I688 PolarHBondContact O-N 2.96Å; Y684-Y724 AromaticContact CD1-CD1 3.99Å; Y684-Y724 HydrophobicContact CD1-CD1 3.99Å; Y684-Y724 WeakPolarHBondContact CD1-O 3.46Å; Y684-Y724 AromaticContact CE1-CD1 3.97Å; Y684-Y724 HydrophobicContact CE1-CD1 3.97Å; Y684-N727 HydrophobicContact CE1-CB 3.67Å; Y684-L728 HydrophobicContact CD1-CB 3.91Å; Y684-L728 HydrophobicContact CD2-CD1 4.42Å; Y684-L728 HydrophobicContact CG-CB 4.12Å; Y684-L728 HydrophobicContact CG-CD1 4.13Å
685	Q	94.6	Very high	92.5	Very high	45 Å²	45	45.9 Å²	45.9	21%	0.21	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-42.1	176.4	-76.7	-178.4	1.2	0	0	112	W528 D552 T681 Q682 E687 I688 E689	W528-Q685 HydrophobicContact CZ2-CG 4.04Å; D552-Q685 PolarHBondContact OD2-NE2 3.39Å; T681-Q685 HydrophobicContact CG2-CG 4.22Å; T681-Q685 VanDerWaalsContact O-CB 3.31Å; T681-Q685 WeakPolarHBondContact O-CB 3.33Å; T681-Q685 WeakPolarHBondContact O-CG 3.35Å; T681-Q685 PolarHBondContact O-N 3.39Å; Q682-Q685 PolarHBondContact O-N 2.91Å; Q685-E687 VanDerWaalsContact C-N 3.28Å; Q685-E687 PolarHBondContact O-N 3.46Å; Q685-I688 PolarHBondContact O-N 3.19Å; Q685-E689 VanDerWaalsContact O-CB 3.29Å; Q685-E689 WeakPolarHBondContact O-CB 3.46Å; Q685-E689 PolarHBondContact O-N 2.85Å
686	S	95	Very high	92.8	Very high	37 Å²	37	42.1 Å²	42.1	26%	0.259	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-39.3	174.4	156	0	0	0	0	111.9	K647 Q682 Q683 N690	K647-S686 PolarHBondContact NZ-OG 3.38Å; Q682-S686 WeakPolarHBondContact O-CB 3.41Å; Q682-S686 PolarHBondContact O-N 3.37Å; Q683-S686 PolarHBondContact O-N 3.11Å; S686-N690 WeakPolarHBondContact O-CB 3.43Å; S686-N690 PolarHBondContact O-N 3.04Å; S686-N690 VanDerWaalsContact O-N 3.12Å
687	E	95.7	Very high	93.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-50.5	176.8	-164.8	70.6	-146.7	0	0	111.7	S645 V646 K647 Y653 Q683 Y684 Q685 E689 N690 I691 Y724	S645-E687 PolarHBondContact OG-OE1 3.5Å; S645-E687 PolarHBondContact OG-OE2 2.7Å; V646-E687 WeakPolarHBondContact CA-OE1 3.35Å; V646-E687 WeakPolarHBondContact CB-OE1 3.48Å; V646-E687 PolarHBondContact N-OE1 2.9Å; K647-E687 WeakPolarHBondContact CB-OE1 3.39Å; K647-E687 WeakPolarHBondContact CB-OE2 3.48Å; K647-E687 PolarHBondContact N-OE1 3.4Å; Y653-E687 HydrophobicContact CE2-CB 4.21Å; Y653-E687 HydrophobicContact CE2-CG 4.15Å; Y653-E687 VanDerWaalsContact CE2-OE2 3.26Å; Y653-E687 WeakPolarHBondContact CE2-OE2 3.27Å; Y653-E687 PolarHBondContact OH-OE2 2.86Å; Q683-E687 PolarHBondContact O-N 2.88Å; Q683-E687 VanDerWaalsContact O-N 3.15Å; Y684-E687 WeakPolarHBondContact O-CB 3.46Å; Y684-E687 PolarHBondContact O-N 3.33Å; Q685-E687 VanDerWaalsContact C-N 3.28Å; Q685-E687 PolarHBondContact O-N 3.46Å; E687-E689 VanDerWaalsContact C-N 3.31Å; E687-E689 PolarHBondContact O-N 3.03Å; E687-N690 WeakPolarHBondContact O-CB 3.46Å; E687-N690 PolarHBondContact O-N 3.4Å; E687-I691 HydrophobicContact CG-CD1 4.28Å; E687-I691 WeakPolarHBondContact O-CG1 3.26Å; E687-I691 PolarHBondContact O-N 2.97Å; E687-Y724 HydrophobicContact CB-CD1 4.49Å; E687-Y724 HydrophobicContact CG-CD1 3.82Å; E687-Y724 HydrophobicContact CG-CD2 3.92Å; E687-Y724 HydrophobicContact CG-CE1 3.55Å; E687-Y724 HydrophobicContact CG-CE2 3.68Å; E687-Y724 HydrophobicContact CG-CG 3.98Å; E687-Y724 VanDerWaalsContact CG-CZ 3.45Å; E687-Y724 PolarHBondContact OE1-OH 2.88Å
688	I	96.1	Very high	93.3	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-41.5	177.9	-68.9	168.8	0	0	0	110.8	W528 Y684 Q685 N690 I691 Y692 L721 L728	W528-I688 HydrophobicContact CB-CG2 4.13Å; W528-I688 HydrophobicContact CD2-CG2 3.56Å; W528-I688 HydrophobicContact CE3-CG2 3.87Å; W528-I688 HydrophobicContact CG-CG2 3.67Å; Y684-I688 VanDerWaalsContact O-CG1 3.28Å; Y684-I688 WeakPolarHBondContact O-CG1 3.4Å; Y684-I688 PolarHBondContact O-N 2.96Å; Q685-I688 PolarHBondContact O-N 3.19Å; I688-N690 PolarHBondContact O-N 3.49Å; I688-I691 PolarHBondContact O-N 3.2Å; I688-Y692 VanDerWaalsContact O-CB 3.25Å; I688-Y692 WeakPolarHBondContact O-CB 3.41Å; I688-Y692 PolarHBondContact O-N 2.67Å; I688-L721 HydrophobicContact CG2-CD1 3.75Å; I688-L721 HydrophobicContact CG2-CG 4.38Å; I688-L728 HydrophobicContact CD1-CD2 4.4Å
689	E	95.7	Very high	93.5	Very high	73 Å²	73	42.9 Å²	42.9	34%	0.341	21%	0.212	S	C	.	.	H	α-helix	trans	-64.1	-40.1	177.8	-167.3	-171.2	156.5	0	0	111.8	Q685 E687 Y692 K693	Q685-E689 VanDerWaalsContact O-CB 3.29Å; Q685-E689 WeakPolarHBondContact O-CB 3.46Å; Q685-E689 PolarHBondContact O-N 2.85Å; E687-E689 VanDerWaalsContact C-N 3.31Å; E687-E689 PolarHBondContact O-N 3.03Å; E689-Y692 PolarHBondContact O-N 2.9Å; E689-K693 WeakPolarHBondContact O-CG 3.41Å; E689-K693 PolarHBondContact O-N 3.48Å; E689-K693 WeakPolarHBondContact OE1-CE 3.47Å; E689-K693 IonicContact OE1-NZ 2.72Å; E689-K693 PolarHBondContact OE1-NZ 3.32Å
690	N	95.7	Very high	93.5	Very high	46 Å²	46	39 Å²	39	25%	0.246	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-50	175.9	-170	66.6	0	0	0	111.5	K647 S686 E687 I688 Y692 K693 D694	K647-N690 HydrophobicContact CB-CB 4.45Å; K647-N690 HydrophobicContact CD-CB 4.11Å; K647-N690 HydrophobicContact CG-CB 4.23Å; S686-N690 WeakPolarHBondContact O-CB 3.43Å; S686-N690 PolarHBondContact O-N 3.04Å; S686-N690 VanDerWaalsContact O-N 3.12Å; E687-N690 WeakPolarHBondContact O-CB 3.46Å; E687-N690 PolarHBondContact O-N 3.4Å; I688-N690 PolarHBondContact O-N 3.49Å; N690-Y692 VanDerWaalsContact C-N 3.29Å; N690-Y692 PolarHBondContact O-N 3.42Å; N690-K693 WeakPolarHBondContact O-CB 3.39Å; N690-K693 PolarHBondContact O-N 3.23Å; N690-D694 PolarHBondContact O-N 2.91Å
691	I	95.9	Very high	93.4	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-40.8	178	-66	165.2	0	0	0	111	E687 I688 D694 L695 L717 L721 Y724	E687-I691 HydrophobicContact CG-CD1 4.28Å; E687-I691 WeakPolarHBondContact O-CG1 3.26Å; E687-I691 PolarHBondContact O-N 2.97Å; I688-I691 PolarHBondContact O-N 3.2Å; I691-D694 PolarHBondContact O-N 3.26Å; I691-L695 VanDerWaalsContact O-CB 3.27Å; I691-L695 WeakPolarHBondContact O-CB 3.35Å; I691-L695 PolarHBondContact O-N 3.42Å; I691-L717 HydrophobicContact CG2-CB 4.47Å; I691-L717 HydrophobicContact CG2-CD2 4.22Å; I691-L717 WeakPolarHBondContact CG2-O 3.4Å; I691-L721 HydrophobicContact CG2-CB 4.15Å; I691-L721 HydrophobicContact CG2-CD1 4.19Å; I691-Y724 HydrophobicContact CD1-CD2 3.37Å; I691-Y724 HydrophobicContact CD1-CE2 3.39Å
692	Y	95.4	Very high	93.2	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-68.1	-34.9	179.7	-177.5	-97.2	0	0	0	113	M526 W528 M531 I688 E689 N690 L695 T696	M526-Y692 WeakPolarHBondContact CE-OH 3.48Å; M526-Y692 WeakPolarHBondContact O-CE1 3.28Å; M526-Y692 PolarHBondContact O-OH 3.33Å; W528-Y692 HydrophobicContact CB-CD1 4.09Å; W528-Y692 HydrophobicContact CB-CD2 3.68Å; W528-Y692 HydrophobicContact CB-CE2 4.23Å; W528-Y692 HydrophobicContact CB-CG 3.6Å; M531-Y692 HydrophobicContact CE-CD2 4.46Å; M531-Y692 HydrophobicContact CE-CE2 4.35Å; I688-Y692 VanDerWaalsContact O-CB 3.25Å; I688-Y692 WeakPolarHBondContact O-CB 3.41Å; I688-Y692 PolarHBondContact O-N 2.67Å; E689-Y692 PolarHBondContact O-N 2.9Å; N690-Y692 VanDerWaalsContact C-N 3.29Å; N690-Y692 PolarHBondContact O-N 3.42Å; Y692-L695 HydrophobicContact CD2-CD2 4.39Å; Y692-L695 PolarHBondContact O-N 3.46Å; Y692-T696 WeakPolarHBondContact O-CB 3.32Å; Y692-T696 PolarHBondContact O-N 3.5Å; Y692-T696 PolarHBondContact O-OG1 3.15Å
693	K	94	Very high	92.7	Very high	103 Å²	103	38.6 Å²	38.6	45%	0.448	20%	0.2	S	C	.	.	H	α-helix	trans	-60.4	-49.6	172.1	-76.8	168.8	-177.1	163.5	0	110.4	E689 N690 L695 T696 V697	E689-K693 WeakPolarHBondContact O-CG 3.41Å; E689-K693 PolarHBondContact O-N 3.48Å; E689-K693 WeakPolarHBondContact OE1-CE 3.47Å; E689-K693 IonicContact OE1-NZ 2.72Å; E689-K693 PolarHBondContact OE1-NZ 3.32Å; N690-K693 WeakPolarHBondContact O-CB 3.39Å; N690-K693 PolarHBondContact O-N 3.23Å; K693-L695 PolarHBondContact O-N 3.09Å; K693-T696 PolarHBondContact O-N 2.81Å; K693-V697 WeakPolarHBondContact O-CG2 3.5Å; K693-V697 PolarHBondContact O-N 3.04Å
694	D	94.1	Very high	92	Very high	75 Å²	75	43.9 Å²	43.9	40%	0.401	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-41.9	177.7	-71.2	-12.5	0	0	0	112.1	N690 I691 T696 V697 K698 L717	N690-D694 PolarHBondContact O-N 2.91Å; I691-D694 PolarHBondContact O-N 3.26Å; D694-T696 VanDerWaalsContact C-N 3.29Å; D694-T696 PolarHBondContact O-N 3.05Å; D694-V697 PolarHBondContact O-N 3.3Å; D694-K698 PolarHBondContact O-N 3.01Å; D694-L717 HydrophobicContact CB-CD1 4.13Å; D694-L717 HydrophobicContact CB-CD2 4.37Å
695	L	93.9	Very high	90.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-41.7	175.5	176.4	60.5	0	0	0	111.3	M508 W512 I691 Y692 K693 G699 V714 L717 I718	M508-L695 HydrophobicContact CE-CD2 4.06Å; W512-L695 HydrophobicContact CH2-CD1 4.49Å; W512-L695 HydrophobicContact CZ2-CD1 3.95Å; W512-L695 HydrophobicContact CZ2-CG 4.14Å; I691-L695 VanDerWaalsContact O-CB 3.27Å; I691-L695 WeakPolarHBondContact O-CB 3.35Å; I691-L695 PolarHBondContact O-N 3.42Å; Y692-L695 HydrophobicContact CD2-CD2 4.39Å; Y692-L695 PolarHBondContact O-N 3.46Å; K693-L695 PolarHBondContact O-N 3.09Å; L695-G699 WeakPolarHBondContact O-CA 3.44Å; L695-G699 PolarHBondContact O-N 3.31Å; L695-V714 HydrophobicContact CD1-CG1 3.84Å; L695-L717 HydrophobicContact CB-CB 4.33Å; L695-L717 HydrophobicContact CB-CD1 4.39Å; L695-L717 HydrophobicContact CD1-CB 4.12Å; L695-I718 HydrophobicContact CD1-CD1 4.33Å; L695-I718 HydrophobicContact CD1-CG1 3.72Å; L695-I718 HydrophobicContact CD2-CG1 4.05Å
696	T	91.7	Very high	89	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-41	178.6	-58	0	0	0	0	111.5	Y692 K693 D694 K700	Y692-T696 WeakPolarHBondContact O-CB 3.32Å; Y692-T696 PolarHBondContact O-N 3.5Å; Y692-T696 PolarHBondContact O-OG1 3.15Å; K693-T696 PolarHBondContact O-N 2.81Å; D694-T696 VanDerWaalsContact C-N 3.29Å; D694-T696 PolarHBondContact O-N 3.05Å; T696-K700 VanDerWaalsContact O-CG 3.3Å; T696-K700 WeakPolarHBondContact O-CG 3.37Å; T696-K700 PolarHBondContact O-N 3.12Å
697	V	91.4	Very high	87.3	Confident	101 Å²	101	55.5 Å²	55.5	61%	0.612	29%	0.294	S	S	*	.	H	α-helix	trans	-64.5	-51.5	177.6	172.8	0	0	0	0	110.6	K693 D694 G699 K700 A701	K693-V697 WeakPolarHBondContact O-CG2 3.5Å; K693-V697 PolarHBondContact O-N 3.04Å; D694-V697 PolarHBondContact O-N 3.3Å; V697-G699 PolarHBondContact O-N 2.95Å; V697-K700 PolarHBondContact O-N 3.1Å; V697-A701 PolarHBondContact O-N 3.07Å; V697-A701 VanDerWaalsContact O-N 3.07Å
698	K	91.4	Very high	85.4	Confident	93 Å²	93	62.5 Å²	62.5	40%	0.404	33%	0.331	S	S	.	.	H	α-helix	trans	-67	-36.2	179.3	-70	-169.1	-175.3	-101.1	0	112.7	D694 A701 L702 A713 V714 L717	D694-K698 PolarHBondContact O-N 3.01Å; K698-A701 PolarHBondContact O-N 2.92Å; K698-L702 WeakPolarHBondContact O-CB 3.2Å; K698-L702 PolarHBondContact O-N 3.46Å; K698-A713 HydrophobicContact CD-CB 4.18Å; K698-V714 HydrophobicContact CB-CG2 3.82Å; K698-L717 HydrophobicContact CD-CD1 3.71Å; K698-L717 HydrophobicContact CG-CD1 4.41Å
699	G	90.4	Very high	83.7	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-40.6	175.2	0	0	0	0	0	112.8	L695 V697 L702 M703	L695-G699 WeakPolarHBondContact O-CA 3.44Å; L695-G699 PolarHBondContact O-N 3.31Å; V697-G699 PolarHBondContact O-N 2.95Å; G699-L702 PolarHBondContact O-N 3.5Å; G699-M703 WeakPolarHBondContact O-CG 3.46Å; G699-M703 PolarHBondContact O-N 3.15Å; G699-M703 VanDerWaalsContact O-N 3.15Å
700	K	88.9	Confident	82.6	Confident	53 Å²	53	63.8 Å²	63.8	23%	0.23	35%	0.352	C	S	.	.	H	α-helix	trans	-64.3	-42	172.1	-74.1	-179.7	179.9	-171	0	112.2	W512 S515 T696 V697 L702 M703	W512-K700 WeakPolarHBondContact O-CG 3.42Å; S515-K700 PolarHBondContact OG-NZ 2.64Å; S515-K700 VanDerWaalsContact OG-NZ 3.08Å; T696-K700 VanDerWaalsContact O-CG 3.3Å; T696-K700 WeakPolarHBondContact O-CG 3.37Å; T696-K700 PolarHBondContact O-N 3.12Å; V697-K700 PolarHBondContact O-N 3.1Å; K700-L702 VanDerWaalsContact C-N 3.35Å; K700-M703 PolarHBondContact O-N 3.31Å
701	A	88.5	Confident	81.8	Confident	44 Å²	44	62 Å²	62	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-43.7	175.6	0	0	0	0	0	111.5	V697 K698 M703 L704 S705	V697-A701 PolarHBondContact O-N 3.07Å; V697-A701 VanDerWaalsContact O-N 3.07Å; K698-A701 PolarHBondContact O-N 2.92Å; A701-M703 VanDerWaalsContact C-N 3.25Å; A701-M703 PolarHBondContact O-N 3.28Å; A701-L704 CarbonylContact O-C 3.58Å; A701-L704 WeakPolarHBondContact O-CA 3.36Å; A701-L704 WeakPolarHBondContact O-CB 3.09Å; A701-L704 PolarHBondContact O-N 3.02Å; A701-S705 PolarHBondContact O-N 3.29Å; A701-S705 PolarHBondContact O-OG 2.93Å
702	L	86.4	Confident	81.3	Confident	23 Å²	23	66 Å²	66	12%	0.12	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-29.7	176.6	-177.7	68.1	0	0	0	113.1	K698 G699 K700 L704 S705 D710 V714	K698-L702 WeakPolarHBondContact O-CB 3.2Å; K698-L702 PolarHBondContact O-N 3.46Å; G699-L702 PolarHBondContact O-N 3.5Å; K700-L702 VanDerWaalsContact C-N 3.35Å; L702-L704 PolarHBondContact O-N 3.41Å; L702-S705 VanDerWaalsContact O-O 3.09Å; L702-D710 HydrophobicContact CD1-CB 3.78Å; L702-V714 HydrophobicContact CD2-CB 4.41Å; L702-V714 HydrophobicContact CD2-CG1 4.46Å; L702-V714 HydrophobicContact CD2-CG2 4.15Å
703	M	82.6	Confident	81	Confident	54 Å²	54	67.1 Å²	67.1	27%	0.266	38%	0.375	S	S	.	.	H	α-helix	trans	-71.5	-19.8	173.8	-71.2	-63.2	141	0	0	113	W512 G699 K700 A701 A749	W512-M703 HydrophobicContact CB-CG 3.69Å; W512-M703 HydrophobicContact CE3-CE 3.73Å; W512-M703 HydrophobicContact CZ3-CE 4.38Å; G699-M703 WeakPolarHBondContact O-CG 3.46Å; G699-M703 PolarHBondContact O-N 3.15Å; G699-M703 VanDerWaalsContact O-N 3.15Å; K700-M703 PolarHBondContact O-N 3.31Å; A701-M703 VanDerWaalsContact C-N 3.25Å; A701-M703 PolarHBondContact O-N 3.28Å; M703-A749 WeakPolarHBondContact CE-O 3.48Å
704	L	79.4	Confident	80.9	Confident	162 Å²	162	62.2 Å²	62.2	85%	0.848	35%	0.354	S	S	*	.	H	α-helix	trans	-102.3	-25.3	-179.3	-61.2	170.7	0	0	0	112.5	A701 L702	A701-L704 CarbonylContact O-C 3.58Å; A701-L704 WeakPolarHBondContact O-CA 3.36Å; A701-L704 WeakPolarHBondContact O-CB 3.09Å; A701-L704 PolarHBondContact O-N 3.02Å; L702-L704 PolarHBondContact O-N 3.41Å
705	S	69.7	Low	80.8	Confident	36 Å²	36	58.8 Å²	58.8	25%	0.252	34%	0.336	S	S	.	.			trans	-101.1	151	-178.4	73.9	0	0	0	0	112.6	A701 L702 D710	A701-S705 PolarHBondContact O-N 3.29Å; A701-S705 PolarHBondContact O-OG 2.93Å; L702-S705 VanDerWaalsContact O-O 3.09Å; S705-D710 PolarHBondContact OG-OD2 3.49Å
706	T	56.8	Low	80.8	Confident	151 Å²	151	61.4 Å²	61.4	93%	0.926	35%	0.35	S	S	*	.			trans	-102.3	10.5	172.4	38	0	0	0	0	112.9
707	E	59.4	Low	81	Confident	139 Å²	139	62.6 Å²	62.6	65%	0.65	36%	0.356	S	S	*	.			trans	-82.1	132.1	-173.5	-66	-168.9	-177.9	0	0	112.7	G709 D710	E707-G709 VanDerWaalsContact C-N 3.27Å; E707-G709 PolarHBondContact O-N 2.96Å; E707-D710 PolarHBondContact O-N 3.42Å
708	L	56.3	Low	81.2	Confident	147 Å²	147	57.9 Å²	57.9	77%	0.77	33%	0.327	S	S	*	.	H	α-helix	trans	-64.7	-26.6	-179.2	-81.2	149.3	0	0	0	113.6	S711	L708-S711 PolarHBondContact O-N 2.94Å
709	G	60.5	Low	81.4	Confident	54 Å²	54	53.4 Å²	53.4	56%	0.557	31%	0.308	S	S	*	.	H	α-helix	trans	-68.9	-32.2	-178.4	0	0	0	0	0	113.9	E707 S711 A713	E707-G709 VanDerWaalsContact C-N 3.27Å; E707-G709 PolarHBondContact O-N 2.96Å; G709-S711 VanDerWaalsContact C-N 3.3Å; G709-S711 PolarHBondContact O-N 2.69Å; G709-A713 PolarHBondContact O-N 3.07Å
710	D	71.9	Confident	81.7	Confident	46 Å²	46	54 Å²	54	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-32.1	178.7	-72.9	-28.2	0	0	0	111.9	L702 S705 E707 V714	L702-D710 HydrophobicContact CD1-CB 3.78Å; S705-D710 PolarHBondContact OG-OD2 3.49Å; E707-D710 PolarHBondContact O-N 3.42Å; D710-V714 VanDerWaalsContact O-CG2 3.31Å; D710-V714 WeakPolarHBondContact O-CG2 3.41Å; D710-V714 PolarHBondContact O-N 3.23Å; D710-V714 VanDerWaalsContact O-N 3.08Å
711	S	78.6	Confident	82	Confident	10 Å²	10	51.6 Å²	51.6	7%	0.07	30%	0.302	C	S	.	.	H	α-helix	trans	-67.6	-41.9	-179.9	-173.7	0	0	0	0	112.3	L708 G709 V714 C715 K752	L708-S711 PolarHBondContact O-N 2.94Å; G709-S711 VanDerWaalsContact C-N 3.3Å; G709-S711 PolarHBondContact O-N 2.69Å; S711-V714 PolarHBondContact O-N 2.94Å; S711-C715 PolarHBondContact O-N 3.33Å; S711-C715 PolarHBondContact O-SG 3.41Å; S711-K752 WeakPolarHBondContact OG-CE 3.45Å
712	D	85.1	Confident	82.3	Confident	86 Å²	86	49.6 Å²	49.6	46%	0.46	28%	0.284	S	S	.	.	H	α-helix	trans	-69	-38.6	179.2	-169.1	69	0	0	0	112.1	C715 N716 K782	D712-C715 WeakPolarHBondContact O-CB 3.25Å; D712-C715 PolarHBondContact O-N 3.45Å; D712-N716 PolarHBondContact O-N 3.2Å; D712-N716 PolarHBondContact O-ND2 3.36Å; D712-N716 VanDerWaalsContact O-ND2 3.12Å; D712-N716 PolarHBondContact OD2-ND2 2.69Å; D712-K782 IonicContact OD1-NZ 3.92Å; D712-K782 PolarHBondContact OD1-NZ 3.44Å; D712-K782 IonicContact OD2-NZ 3.64Å; D712-K782 PolarHBondContact OD2-NZ 3.32Å
713	A	89.1	Confident	82.7	Confident	27 Å²	27	48.5 Å²	48.5	22%	0.223	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-44	174.7	0	0	0	0	0	111.9	K698 G709 C715 N716 L717	K698-A713 HydrophobicContact CD-CB 4.18Å; G709-A713 PolarHBondContact O-N 3.07Å; A713-C715 VanDerWaalsContact C-N 3.35Å; A713-N716 PolarHBondContact O-N 2.96Å; A713-L717 PolarHBondContact O-N 3.17Å; A713-L717 VanDerWaalsContact O-N 3.09Å
714	V	92.6	Very high	83.4	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-43	173.5	168.6	0	0	0	0	110.9	W512 L695 K698 L702 D710 S711 N716 L717 I718	W512-V714 HydrophobicContact CH2-CG1 3.89Å; L695-V714 HydrophobicContact CD1-CG1 3.84Å; K698-V714 HydrophobicContact CB-CG2 3.82Å; L702-V714 HydrophobicContact CD2-CB 4.41Å; L702-V714 HydrophobicContact CD2-CG1 4.46Å; L702-V714 HydrophobicContact CD2-CG2 4.15Å; D710-V714 VanDerWaalsContact O-CG2 3.31Å; D710-V714 WeakPolarHBondContact O-CG2 3.41Å; D710-V714 PolarHBondContact O-N 3.23Å; D710-V714 VanDerWaalsContact O-N 3.08Å; S711-V714 PolarHBondContact O-N 2.94Å; V714-N716 PolarHBondContact O-N 2.92Å; V714-L717 PolarHBondContact O-N 3.15Å; V714-I718 HydrophobicContact CG1-CD1 3.81Å; V714-I718 HydrophobicContact CG1-CG1 4.49Å; V714-I718 VanDerWaalsContact O-CG1 3.29Å; V714-I718 WeakPolarHBondContact O-CG1 3.43Å; V714-I718 PolarHBondContact O-N 2.96Å
715	C	92.6	Very high	84.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-42.8	176.5	-66.7	0	0	0	0	112.5	S711 D712 A713 I718 L719 L747	S711-C715 PolarHBondContact O-N 3.33Å; S711-C715 PolarHBondContact O-SG 3.41Å; D712-C715 WeakPolarHBondContact O-CB 3.25Å; D712-C715 PolarHBondContact O-N 3.45Å; A713-C715 VanDerWaalsContact C-N 3.35Å; C715-I718 PolarHBondContact O-N 3.17Å; C715-L719 WeakPolarHBondContact O-CG 3.12Å; C715-L719 PolarHBondContact O-N 2.92Å; C715-L719 VanDerWaalsContact O-N 3.09Å; C715-L747 HydrophobicContact CB-CD2 3.94Å; C715-L747 VanDerWaalsContact SG-CD2 3.55Å
716	N	93.9	Very high	85.3	Confident	56 Å²	56	36.5 Å²	36.5	30%	0.299	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-43.6	177.2	-69	-40.5	0	0	0	111.4	D712 A713 V714 I718 L719 S720 K782	D712-N716 PolarHBondContact O-N 3.2Å; D712-N716 PolarHBondContact O-ND2 3.36Å; D712-N716 VanDerWaalsContact O-ND2 3.12Å; D712-N716 PolarHBondContact OD2-ND2 2.69Å; A713-N716 PolarHBondContact O-N 2.96Å; V714-N716 PolarHBondContact O-N 2.92Å; N716-I718 VanDerWaalsContact C-N 3.34Å; N716-I718 PolarHBondContact O-N 2.83Å; N716-L719 PolarHBondContact O-N 2.85Å; N716-S720 PolarHBondContact O-N 2.94Å; N716-S720 PolarHBondContact O-OG 3.17Å; N716-S720 VanDerWaalsContact O-OG 3.08Å; N716-K782 VanDerWaalsContact CG-NZ 3.34Å; N716-K782 VanDerWaalsContact OD1-CE 3.31Å; N716-K782 WeakPolarHBondContact OD1-CE 3.42Å; N716-K782 PolarHBondContact OD1-NZ 3.47Å
717	L	95.7	Very high	87.1	Confident	29 Å²	29	29.4 Å²	29.4	15%	0.152	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-39.6	176.8	-72	174	0	0	0	112.8	I691 D694 L695 K698 A713 V714 L719 S720 L721	I691-L717 HydrophobicContact CG2-CB 4.47Å; I691-L717 HydrophobicContact CG2-CD2 4.22Å; I691-L717 WeakPolarHBondContact CG2-O 3.4Å; D694-L717 HydrophobicContact CB-CD1 4.13Å; D694-L717 HydrophobicContact CB-CD2 4.37Å; L695-L717 HydrophobicContact CB-CB 4.33Å; L695-L717 HydrophobicContact CB-CD1 4.39Å; L695-L717 HydrophobicContact CD1-CB 4.12Å; K698-L717 HydrophobicContact CD-CD1 3.71Å; K698-L717 HydrophobicContact CG-CD1 4.41Å; A713-L717 PolarHBondContact O-N 3.17Å; A713-L717 VanDerWaalsContact O-N 3.09Å; V714-L717 PolarHBondContact O-N 3.15Å; L717-L719 VanDerWaalsContact C-N 3.34Å; L717-S720 PolarHBondContact O-N 3.4Å; L717-L721 PolarHBondContact O-N 3.13Å
718	I	95.8	Very high	88.7	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-44	175.4	-67.8	163.3	0	0	0	110.6	L695 V714 C715 N716 L721 I722 V743 A746 L747	L695-I718 HydrophobicContact CD1-CD1 4.33Å; L695-I718 HydrophobicContact CD1-CG1 3.72Å; L695-I718 HydrophobicContact CD2-CG1 4.05Å; V714-I718 HydrophobicContact CG1-CD1 3.81Å; V714-I718 HydrophobicContact CG1-CG1 4.49Å; V714-I718 VanDerWaalsContact O-CG1 3.29Å; V714-I718 WeakPolarHBondContact O-CG1 3.43Å; V714-I718 PolarHBondContact O-N 2.96Å; C715-I718 PolarHBondContact O-N 3.17Å; N716-I718 VanDerWaalsContact C-N 3.34Å; N716-I718 PolarHBondContact O-N 2.83Å; I718-L721 WeakPolarHBondContact O-CB 3.49Å; I718-L721 PolarHBondContact O-N 3.13Å; I718-I722 VanDerWaalsContact O-CG1 3.3Å; I718-I722 WeakPolarHBondContact O-CG1 3.26Å; I718-I722 PolarHBondContact O-N 3.32Å; I718-V743 HydrophobicContact CG2-CG1 4.08Å; I718-A746 HydrophobicContact CD1-CB 3.74Å; I718-A746 HydrophobicContact CG1-CB 3.91Å; I718-A746 HydrophobicContact CG2-CB 3.8Å; I718-L747 HydrophobicContact CD1-CD2 3.95Å; I718-L747 HydrophobicContact CD1-CG 4.38Å; I718-L747 HydrophobicContact CG2-CD2 4.45Å; I718-L747 HydrophobicContact CG2-CG 4.33Å
719	L	95.9	Very high	90.4	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-71.3	-36.1	179.9	-66.2	171.2	0	0	0	112.1	C715 N716 L717 I722 Y723 V743 F777 S778 A781 K782 M785	C715-L719 WeakPolarHBondContact O-CG 3.12Å; C715-L719 PolarHBondContact O-N 2.92Å; C715-L719 VanDerWaalsContact O-N 3.09Å; N716-L719 PolarHBondContact O-N 2.85Å; L717-L719 VanDerWaalsContact C-N 3.34Å; L719-I722 PolarHBondContact O-N 3.14Å; L719-Y723 PolarHBondContact O-N 2.88Å; L719-V743 HydrophobicContact CD2-CG1 3.97Å; L719-F777 HydrophobicContact CB-CE1 4.43Å; L719-F777 HydrophobicContact CD2-CE1 4.47Å; L719-F777 WeakPolarHBondContact O-CE1 3.5Å; L719-S778 VanDerWaalsContact CB-OG 3.25Å; L719-S778 WeakPolarHBondContact CB-OG 3.37Å; L719-A781 HydrophobicContact CD1-CB 4.41Å; L719-A781 HydrophobicContact CD2-CB 4.05Å; L719-K782 HydrophobicContact CD1-CD 4.25Å; L719-K782 HydrophobicContact CD1-CG 3.7Å; L719-M785 HydrophobicContact CD2-CE 3.75Å; L719-M785 HydrophobicContact CD2-SD 4.03Å
720	S	96.1	Very high	91.9	Very high	12 Å²	12	13.8 Å²	13.8	8%	0.084	8%	0.079	C	C	.	.	H	α-helix	trans	-62.1	-42.7	172.5	-62.4	0	0	0	0	112.1	N716 L717 I722 Y723 Y724	N716-S720 PolarHBondContact O-N 2.94Å; N716-S720 PolarHBondContact O-OG 3.17Å; N716-S720 VanDerWaalsContact O-OG 3.08Å; L717-S720 PolarHBondContact O-N 3.4Å; S720-I722 PolarHBondContact O-N 3.41Å; S720-I722 VanDerWaalsContact O-N 3.14Å; S720-Y723 WeakPolarHBondContact O-CB 3.44Å; S720-Y723 PolarHBondContact O-N 3.48Å; S720-Y724 WeakPolarHBondContact O-CD2 3.36Å; S720-Y724 PolarHBondContact O-N 2.82Å
721	L	95.6	Very high	92.9	Very high	3 Å²	3	11.6 Å²	11.6	2%	0.016	7%	0.068	C	C	.	.	H	α-helix	trans	-52.9	-38.2	175.2	-171.1	97.5	0	0	0	111.5	M531 F532 I688 I691 L717 I718 F725	M531-L721 HydrophobicContact CE-CD2 3.55Å; F532-L721 HydrophobicContact CE2-CD2 3.74Å; F532-L721 HydrophobicContact CE2-CG 4.49Å; F532-L721 HydrophobicContact CZ-CD2 3.77Å; I688-L721 HydrophobicContact CG2-CD1 3.75Å; I688-L721 HydrophobicContact CG2-CG 4.38Å; I691-L721 HydrophobicContact CG2-CB 4.15Å; I691-L721 HydrophobicContact CG2-CD1 4.19Å; L717-L721 PolarHBondContact O-N 3.13Å; I718-L721 WeakPolarHBondContact O-CB 3.49Å; I718-L721 PolarHBondContact O-N 3.13Å; L721-F725 WeakPolarHBondContact O-CB 3.3Å; L721-F725 PolarHBondContact O-N 3.1Å
722	I	93.8	Very high	93.5	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-84.4	-35.1	-172.8	-66.2	-80.9	0	0	0	111.4	F532 I718 L719 S720 Y724 F725 C726 A739 V743 F777	F532-I722 HydrophobicContact CE1-CD1 4.03Å; F532-I722 HydrophobicContact CZ-CD1 3.95Å; I718-I722 VanDerWaalsContact O-CG1 3.3Å; I718-I722 WeakPolarHBondContact O-CG1 3.26Å; I718-I722 PolarHBondContact O-N 3.32Å; L719-I722 PolarHBondContact O-N 3.14Å; S720-I722 PolarHBondContact O-N 3.41Å; S720-I722 VanDerWaalsContact O-N 3.14Å; I722-Y724 VanDerWaalsContact C-N 3.26Å; I722-Y724 PolarHBondContact O-N 3.48Å; I722-F725 PolarHBondContact O-N 2.92Å; I722-C726 WeakPolarHBondContact O-CB 3.45Å; I722-C726 PolarHBondContact O-N 3.35Å; I722-C726 PolarHBondContact O-SG 3.35Å; I722-A739 HydrophobicContact CD1-CB 3.83Å; I722-A739 VanDerWaalsContact CD1-O 3.23Å; I722-A739 WeakPolarHBondContact CD1-O 3.46Å; I722-A739 HydrophobicContact CG2-CB 4.3Å; I722-V743 HydrophobicContact CB-CG2 3.92Å; I722-V743 HydrophobicContact CD1-CG2 3.39Å; I722-V743 HydrophobicContact CG1-CG2 3.25Å; I722-V743 HydrophobicContact CG2-CG2 3.8Å; I722-F777 HydrophobicContact CG2-CE1 4.23Å; I722-F777 HydrophobicContact CG2-CZ 4.29Å
723	Y	96.4	Very high	93.8	Very high	1 Å²	1	11.7 Å²	11.7	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-50.7	-49.2	166.8	174.7	-100	0	0	0	111.1	V643 L719 S720 N727 A768 A771 P774 F777	V643-Y723 HydrophobicContact CG1-CE1 3.53Å; L719-Y723 PolarHBondContact O-N 2.88Å; S720-Y723 WeakPolarHBondContact O-CB 3.44Å; S720-Y723 PolarHBondContact O-N 3.48Å; Y723-N727 WeakPolarHBondContact O-CB 3.5Å; Y723-N727 PolarHBondContact O-N 3.02Å; Y723-N727 PolarHBondContact O-ND2 3.38Å; Y723-A768 HydrophobicContact CD2-CB 4.42Å; Y723-A768 WeakPolarHBondContact CD2-O 3.44Å; Y723-A768 WeakPolarHBondContact CE2-O 3.46Å; Y723-A771 HydrophobicContact CE2-CB 4.08Å; Y723-A771 PolarHBondContact OH-O 3.16Å; Y723-P774 HydrophobicContact CD1-CB 3.72Å; Y723-P774 HydrophobicContact CD1-CG 4.25Å; Y723-P774 HydrophobicContact CE1-CB 4.25Å; Y723-P774 HydrophobicContact CE1-CG 4.36Å; Y723-P774 HydrophobicContact CG-CB 3.93Å; Y723-F777 HydrophobicContact CD2-CB 3.82Å; Y723-F777 HydrophobicContact CD2-CD1 4.41Å; Y723-F777 HydrophobicContact CD2-CG 4.17Å; Y723-F777 HydrophobicContact CE2-CB 4.5Å
724	Y	96.3	Very high	93.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-71.4	-37.2	177.4	-69.5	-71.7	0	0	0	113.4	V643 P644 V646 Y684 E687 I691 S720 I722 N727 L728	V643-Y724 HydrophobicContact CG1-CD1 4.13Å; V643-Y724 HydrophobicContact CG1-CE1 3.78Å; P644-Y724 PolarHBondContact O-OH 3.11Å; V646-Y724 HydrophobicContact CG2-CE2 4.29Å; V646-Y724 VanDerWaalsContact CG2-OH 3.31Å; V646-Y724 WeakPolarHBondContact CG2-OH 3.31Å; V646-Y724 PolarHBondContact N-OH 3.33Å; Y684-Y724 AromaticContact CD1-CD1 3.99Å; Y684-Y724 HydrophobicContact CD1-CD1 3.99Å; Y684-Y724 WeakPolarHBondContact CD1-O 3.46Å; Y684-Y724 AromaticContact CE1-CD1 3.97Å; Y684-Y724 HydrophobicContact CE1-CD1 3.97Å; E687-Y724 HydrophobicContact CB-CD1 4.49Å; E687-Y724 HydrophobicContact CG-CD1 3.82Å; E687-Y724 HydrophobicContact CG-CD2 3.92Å; E687-Y724 HydrophobicContact CG-CE1 3.55Å; E687-Y724 HydrophobicContact CG-CE2 3.68Å; E687-Y724 HydrophobicContact CG-CG 3.98Å; E687-Y724 VanDerWaalsContact CG-CZ 3.45Å; E687-Y724 PolarHBondContact OE1-OH 2.88Å; I691-Y724 HydrophobicContact CD1-CD2 3.37Å; I691-Y724 HydrophobicContact CD1-CE2 3.39Å; S720-Y724 WeakPolarHBondContact O-CD2 3.36Å; S720-Y724 PolarHBondContact O-N 2.82Å; I722-Y724 VanDerWaalsContact C-N 3.26Å; I722-Y724 PolarHBondContact O-N 3.48Å; Y724-N727 PolarHBondContact O-N 2.89Å; Y724-L728 VanDerWaalsContact O-CB 3.28Å; Y724-L728 WeakPolarHBondContact O-CB 3.26Å; Y724-L728 PolarHBondContact O-N 3.33Å
725	F	95.1	Very high	93.8	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.4	-45.3	176.8	-169.4	-85.4	0	0	0	112.2	W528 F532 W550 L721 I722 L728 M729 P730 V738 A739	W528-F725 HydrophobicContact CZ3-CE2 4.39Å; F532-F725 HydrophobicContact CB-CE2 4.41Å; F532-F725 AromaticContact CD1-CD2 3.82Å; F532-F725 HydrophobicContact CD1-CD2 3.82Å; F532-F725 HydrophobicContact CD1-CE1 4.14Å; F532-F725 AromaticContact CD1-CE2 3.34Å; F532-F725 HydrophobicContact CD1-CE2 3.34Å; F532-F725 HydrophobicContact CD1-CG 4.39Å; F532-F725 AromaticContact CD1-CZ 3.51Å; F532-F725 HydrophobicContact CD1-CZ 3.51Å; F532-F725 HydrophobicContact CD2-CD2 4.34Å; F532-F725 HydrophobicContact CD2-CE2 4.15Å; F532-F725 HydrophobicContact CE1-CB 4.4Å; F532-F725 AromaticContact CE1-CD1 3.96Å; F532-F725 HydrophobicContact CE1-CD1 3.96Å; F532-F725 AromaticContact CE1-CD2 3.39Å; F532-F725 HydrophobicContact CE1-CD2 3.39Å; F532-F725 AromaticContact CE1-CE1 4Å; F532-F725 HydrophobicContact CE1-CE1 4Å; F532-F725 AromaticContact CE1-CE2 3.44Å; F532-F725 HydrophobicContact CE1-CE2 3.44Å; F532-F725 VanDerWaalsContact CE1-CE2 3.44Å; F532-F725 AromaticContact CE1-CG 3.65Å; F532-F725 HydrophobicContact CE1-CG 3.65Å; F532-F725 AromaticContact CE1-CZ 3.74Å; F532-F725 HydrophobicContact CE1-CZ 3.74Å; F532-F725 AromaticContact CE2-CD2 3.96Å; F532-F725 HydrophobicContact CE2-CD2 3.96Å; F532-F725 HydrophobicContact CE2-CE2 4.23Å; F532-F725 HydrophobicContact CG-CD2 4.28Å; F532-F725 AromaticContact CG-CE2 3.72Å; F532-F725 HydrophobicContact CG-CE2 3.72Å; F532-F725 HydrophobicContact CG-CZ 4.22Å; F532-F725 HydrophobicContact CZ-CB 4.22Å; F532-F725 AromaticContact CZ-CD2 3.48Å; F532-F725 HydrophobicContact CZ-CD2 3.48Å; F532-F725 VanDerWaalsContact CZ-CD2 3.48Å; F532-F725 AromaticContact CZ-CE2 3.9Å; F532-F725 HydrophobicContact CZ-CE2 3.9Å; F532-F725 AromaticContact CZ-CG 3.86Å; F532-F725 HydrophobicContact CZ-CG 3.86Å; W550-F725 AromaticContact CH2-CE2 3.88Å; W550-F725 HydrophobicContact CH2-CE2 3.88Å; W550-F725 HydrophobicContact CH2-CZ 4.19Å; W550-F725 HydrophobicContact CZ3-CE2 4.01Å; W550-F725 HydrophobicContact CZ3-CZ 4.32Å; L721-F725 WeakPolarHBondContact O-CB 3.3Å; L721-F725 PolarHBondContact O-N 3.1Å; I722-F725 PolarHBondContact O-N 2.92Å; F725-L728 PolarHBondContact O-N 3.01Å; F725-M729 PolarHBondContact O-N 3.49Å; F725-P730 HydrophobicContact CD1-CG 4.23Å; F725-P730 HydrophobicContact CD2-CG 3.84Å; F725-P730 HydrophobicContact CE1-CG 3.8Å; F725-P730 HydrophobicContact CE2-CG 3.35Å; F725-P730 HydrophobicContact CG-CG 4.26Å; F725-P730 HydrophobicContact CZ-CG 3.34Å; F725-P730 VanDerWaalsContact O-CD 3.29Å; F725-P730 WeakPolarHBondContact O-CD 3.28Å; F725-V738 HydrophobicContact CZ-CG1 4.45Å; F725-A739 HydrophobicContact CD1-CB 3.66Å; F725-A739 HydrophobicContact CE1-CB 4.02Å
726	C	94.4	Very high	93.8	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-66.8	-38.9	176.4	-71.7	0	0	0	0	111.8	I722 L728 M729 A768	I722-C726 WeakPolarHBondContact O-CB 3.45Å; I722-C726 PolarHBondContact O-N 3.35Å; I722-C726 PolarHBondContact O-SG 3.35Å; C726-L728 VanDerWaalsContact C-N 3.34Å; C726-M729 WeakPolarHBondContact O-CE 3.42Å; C726-M729 VanDerWaalsContact O-CG 3.26Å; C726-M729 WeakPolarHBondContact O-CG 3.26Å; C726-A768 HydrophobicContact CB-CB 3.63Å
727	N	93.9	Very high	93.9	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.063	C	C	.	.	H	α-helix	trans	-67.6	-34.8	174.2	-85.3	-80.2	0	0	0	112.1	V643 T674 R680 Y684 Y723 Y724 A768	V643-N727 HydrophobicContact CG2-CB 4.34Å; V643-N727 WeakPolarHBondContact CG2-OD1 3.23Å; T674-N727 WeakPolarHBondContact CG2-O 3.34Å; R680-N727 PolarHBondContact NH2-O 2.87Å; Y684-N727 HydrophobicContact CE1-CB 3.67Å; Y723-N727 WeakPolarHBondContact O-CB 3.5Å; Y723-N727 PolarHBondContact O-N 3.02Å; Y723-N727 PolarHBondContact O-ND2 3.38Å; Y724-N727 PolarHBondContact O-N 2.89Å; N727-A768 PolarHBondContact ND2-O 3.02Å
728	L	92.9	Very high	93.9	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-69.4	-39.4	177.4	177.9	58.3	0	0	0	112.5	R680 Y684 I688 Y724 F725 C726 P730	R680-L728 PolarHBondContact NH1-O 2.96Å; Y684-L728 HydrophobicContact CD1-CB 3.91Å; Y684-L728 HydrophobicContact CD2-CD1 4.42Å; Y684-L728 HydrophobicContact CG-CB 4.12Å; Y684-L728 HydrophobicContact CG-CD1 4.13Å; I688-L728 HydrophobicContact CD1-CD2 4.4Å; Y724-L728 VanDerWaalsContact O-CB 3.28Å; Y724-L728 WeakPolarHBondContact O-CB 3.26Å; Y724-L728 PolarHBondContact O-N 3.33Å; F725-L728 PolarHBondContact O-N 3.01Å; C726-L728 VanDerWaalsContact C-N 3.34Å; L728-P730 HydrophobicContact CD2-CB 3.88Å; L728-P730 HydrophobicContact CD2-CG 4.33Å; L728-P730 HydrophobicContact CG-CB 4.03Å; L728-P730 HydrophobicContact CG-CG 4.47Å
729	M	92.3	Very high	93.9	Very high	4 Å²	4	9.8 Å²	9.8	2%	0.02	6%	0.055	C	C	.	.			trans	50.5	62.8	-169.3	-69.2	-63.7	171	0	0	113	T674 F725 C726 L731 D765 M769	T674-M729 HydrophobicContact CG2-CB 4.06Å; T674-M729 HydrophobicContact CG2-CG 4.27Å; F725-M729 PolarHBondContact O-N 3.49Å; C726-M729 WeakPolarHBondContact O-CE 3.42Å; C726-M729 VanDerWaalsContact O-CG 3.26Å; C726-M729 WeakPolarHBondContact O-CG 3.26Å; M729-L731 VanDerWaalsContact C-N 3.29Å; M729-L731 PolarHBondContact O-N 2.98Å; M729-D765 HydrophobicContact CE-CB 3.51Å; M729-M769 HydrophobicContact CE-SD 3.68Å
730	P	92.8	Very high	93.9	Very high	7 Å²	7	10 Å²	10	5%	0.045	6%	0.056	C	C	.	.			trans	-78	-7.3	-167.6	31.5	-36.2	0	0	0	115.1	W550 L551 F725 L728	W550-P730 HydrophobicContact CE3-CB 3.99Å; W550-P730 HydrophobicContact CE3-CG 4.44Å; W550-P730 HydrophobicContact CZ3-CB 3.77Å; W550-P730 HydrophobicContact CZ3-CG 3.8Å; L551-P730 WeakPolarHBondContact CB-O 3.36Å; L551-P730 WeakPolarHBondContact CG-O 3.45Å; L551-P730 PolarHBondContact N-O 2.76Å; F725-P730 HydrophobicContact CD1-CG 4.23Å; F725-P730 HydrophobicContact CD2-CG 3.84Å; F725-P730 HydrophobicContact CE1-CG 3.8Å; F725-P730 HydrophobicContact CE2-CG 3.35Å; F725-P730 HydrophobicContact CG-CG 4.26Å; F725-P730 HydrophobicContact CZ-CG 3.34Å; F725-P730 VanDerWaalsContact O-CD 3.29Å; F725-P730 WeakPolarHBondContact O-CD 3.28Å; L728-P730 HydrophobicContact CD2-CB 3.88Å; L728-P730 HydrophobicContact CD2-CG 4.33Å; L728-P730 HydrophobicContact CG-CB 4.03Å; L728-P730 HydrophobicContact CG-CG 4.47Å
731	L	92.9	Very high	93.9	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	5%	0.052	C	C	.	.	B	Isolated β-bridge	trans	-108.6	146.3	179.6	-53	176.6	0	0	0	111.5	V536 V548 L549 W550 M729 R733 S735 V738	V536-L731 HydrophobicContact CG2-CD1 3.73Å; V536-L731 HydrophobicContact CG2-CD2 4.15Å; V548-L731 HydrophobicContact CG1-CD1 4.11Å; L549-L731 WeakPolarHBondContact O-CA 3.43Å; W550-L731 HydrophobicContact CD2-CD2 3.44Å; W550-L731 VanDerWaalsContact CD2-CD2 3.44Å; W550-L731 HydrophobicContact CE3-CD2 3.45Å; W550-L731 VanDerWaalsContact CE3-CD2 3.45Å; W550-L731 HydrophobicContact CE3-CG 4.49Å; W550-L731 HydrophobicContact CG-CD2 4Å; W550-L731 HydrophobicContact CH2-CD2 4.18Å; W550-L731 HydrophobicContact CZ2-CD2 4.17Å; W550-L731 HydrophobicContact CZ3-CD2 3.84Å; M729-L731 VanDerWaalsContact C-N 3.29Å; M729-L731 PolarHBondContact O-N 2.98Å; L731-R733 PolarHBondContact O-N 3.28Å; L731-S735 WeakPolarHBondContact CB-OG 3.19Å; L731-S735 PolarHBondContact N-OG 3.31Å; L731-S735 PolarHBondContact O-OG 3.18Å; L731-V738 HydrophobicContact CD1-CB 4.17Å; L731-V738 HydrophobicContact CD1-CG1 4.13Å; L731-V738 HydrophobicContact CD1-CG2 4.03Å
732	S	91.2	Very high	94	Very high	3 Å²	3	9.3 Å²	9.3	2%	0.021	5%	0.052	C	C	.	.	S	Bend	trans	-60	-33.2	174.1	50.5	0	0	0	0	113.5	P547 L549	P547-S732 PolarHBondContact O-OG 3.47Å; L549-S732 PolarHBondContact N-OG 3.45Å; L549-S732 PolarHBondContact O-N 3.29Å; L549-S732 PolarHBondContact O-OG 2.9Å
733	R	90.9	Very high	94	Very high	94 Å²	94	9.3 Å²	9.3	36%	0.355	5%	0.052	S	C	.	.	S	Bend	trans	-148.9	149.7	177.9	-63	-64.7	177.7	-112.8	6.1	109.6	V548 L731 S735	V548-R733 WeakPolarHBondContact CG1-O 3.35Å; V548-R733 HydrophobicContact CG2-CB 4.17Å; L731-R733 PolarHBondContact O-N 3.28Å; R733-S735 PolarHBondContact O-N 3.49Å
734	G	89.8	Confident	94	Very high	25 Å²	25	9.2 Å²	9.2	26%	0.258	5%	0.051	S	C	.	.			trans	78.5	10	168.8	0	0	0	0	0	116.9	S736 V737 V738	G734-S736 VanDerWaalsContact C-N 3.26Å; G734-S736 PolarHBondContact O-N 3Å; G734-V737 WeakPolarHBondContact O-CG1 3.33Å; G734-V737 PolarHBondContact O-N 3.41Å; G734-V738 WeakPolarHBondContact O-CB 3.38Å; G734-V738 WeakPolarHBondContact O-CG2 3.44Å; G734-V738 PolarHBondContact O-N 2.69Å; G734-V738 VanDerWaalsContact O-N 3.12Å
735	S	92.6	Very high	94	Very high	7 Å²	7	9.2 Å²	9.2	5%	0.049	5%	0.051	C	C	.	.	H	α-helix	trans	-48.4	-46.3	178.3	-59.2	0	0	0	0	113.1	L731 R733 A739	L731-S735 WeakPolarHBondContact CB-OG 3.19Å; L731-S735 PolarHBondContact N-OG 3.31Å; L731-S735 PolarHBondContact O-OG 3.18Å; R733-S735 PolarHBondContact O-N 3.49Å; S735-A739 VanDerWaalsContact O-CB 3.26Å; S735-A739 WeakPolarHBondContact O-CB 3.34Å; S735-A739 PolarHBondContact O-N 3.39Å
736	S	92.5	Very high	93.9	Very high	14 Å²	14	9.3 Å²	9.3	10%	0.098	5%	0.052	C	C	.	.	H	α-helix	trans	-65.2	-49.7	-175.1	-173.7	0	0	0	0	113.6	Y482 G734 V738 A739 Y740	Y482-S736 PolarHBondContact OH-OG 3.13Å; G734-S736 VanDerWaalsContact C-N 3.26Å; G734-S736 PolarHBondContact O-N 3Å; S736-V738 PolarHBondContact O-N 2.75Å; S736-A739 PolarHBondContact O-N 3.29Å; S736-Y740 PolarHBondContact O-N 3.42Å
737	V	94.2	Very high	93.9	Very high	32 Å²	32	9.3 Å²	9.3	19%	0.194	5%	0.052	C	C	.	.	H	α-helix	trans	-68.6	-36.2	-179.4	72.3	0	0	0	0	111.8	M497 G734 Y740 S741	M497-V737 HydrophobicContact CB-CG2 4.43Å; M497-V737 HydrophobicContact CE-CG2 4.48Å; M497-V737 HydrophobicContact CG-CG2 3.72Å; M497-V737 HydrophobicContact SD-CG1 4.46Å; M497-V737 HydrophobicContact SD-CG2 4.42Å; G734-V737 WeakPolarHBondContact O-CG1 3.33Å; G734-V737 PolarHBondContact O-N 3.41Å; V737-Y740 PolarHBondContact O-N 3.15Å; V737-S741 WeakPolarHBondContact O-CB 3.47Å; V737-S741 PolarHBondContact O-N 3.38Å; V737-S741 PolarHBondContact O-OG 2.91Å
738	V	96.8	Very high	93.9	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.1	-50	173.1	165.9	0	0	0	0	109.9	M497 F532 A535 V536 R539 F725 L731 G734 S736 Y740 S741 V742	M497-V738 HydrophobicContact CE-CG2 4.49Å; F532-V738 HydrophobicContact CD1-CG1 4.03Å; A535-V738 HydrophobicContact CB-CG1 3.96Å; V536-V738 HydrophobicContact CG2-CG1 3.95Å; V536-V738 HydrophobicContact CG2-CG2 4.33Å; R539-V738 HydrophobicContact CB-CG2 4.02Å; R539-V738 HydrophobicContact CG-CG2 4.2Å; F725-V738 HydrophobicContact CZ-CG1 4.45Å; L731-V738 HydrophobicContact CD1-CB 4.17Å; L731-V738 HydrophobicContact CD1-CG1 4.13Å; L731-V738 HydrophobicContact CD1-CG2 4.03Å; G734-V738 WeakPolarHBondContact O-CB 3.38Å; G734-V738 WeakPolarHBondContact O-CG2 3.44Å; G734-V738 PolarHBondContact O-N 2.69Å; G734-V738 VanDerWaalsContact O-N 3.12Å; S736-V738 PolarHBondContact O-N 2.75Å; V738-Y740 PolarHBondContact O-N 2.72Å; V738-S741 PolarHBondContact O-N 3.18Å; V738-S741 PolarHBondContact O-OG 3.24Å; V738-V742 WeakPolarHBondContact O-CG2 3.38Å; V738-V742 PolarHBondContact O-N 3.48Å; V738-V742 VanDerWaalsContact O-N 3.13Å
739	A	95.8	Very high	93.8	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-57.1	-49.4	178	0	0	0	0	0	111.6	I722 F725 S735 S736 S741 V742 V743	I722-A739 HydrophobicContact CD1-CB 3.83Å; I722-A739 VanDerWaalsContact CD1-O 3.23Å; I722-A739 WeakPolarHBondContact CD1-O 3.46Å; I722-A739 HydrophobicContact CG2-CB 4.3Å; F725-A739 HydrophobicContact CD1-CB 3.66Å; F725-A739 HydrophobicContact CE1-CB 4.02Å; S735-A739 VanDerWaalsContact O-CB 3.26Å; S735-A739 WeakPolarHBondContact O-CB 3.34Å; S735-A739 PolarHBondContact O-N 3.39Å; S736-A739 PolarHBondContact O-N 3.29Å; A739-S741 PolarHBondContact O-N 3.13Å; A739-V742 PolarHBondContact O-N 2.93Å; A739-V743 WeakPolarHBondContact O-CG2 3.44Å; A739-V743 PolarHBondContact O-N 3.06Å
740	Y	95.5	Very high	93.7	Very high	3 Å²	3	10.2 Å²	10.2	1%	0.012	6%	0.058	C	C	.	.	H	α-helix	trans	-64.5	-38.7	-178.1	-163.6	-112	0	0	0	113	M480 S736 V737 V738 V742 V743 M744 I758 V764 W784 M785	M480-Y740 HydrophobicContact CB-CD1 3.79Å; M480-Y740 HydrophobicContact CB-CE1 4.14Å; M480-Y740 HydrophobicContact CG-CD1 3.6Å; M480-Y740 HydrophobicContact CG-CE1 3.88Å; M480-Y740 HydrophobicContact SD-CD1 4.2Å; S736-Y740 PolarHBondContact O-N 3.42Å; V737-Y740 PolarHBondContact O-N 3.15Å; V738-Y740 PolarHBondContact O-N 2.72Å; Y740-V742 VanDerWaalsContact C-N 3.32Å; Y740-V742 PolarHBondContact O-N 3.21Å; Y740-V743 WeakPolarHBondContact O-CB 3.31Å; Y740-V743 PolarHBondContact O-N 3.1Å; Y740-M744 HydrophobicContact CD1-CG 4.5Å; Y740-M744 HydrophobicContact CD1-SD 3.96Å; Y740-M744 HydrophobicContact CE1-CG 4.19Å; Y740-M744 HydrophobicContact CE1-SD 3.52Å; Y740-M744 VanDerWaalsContact CE1-SD 3.52Å; Y740-M744 WeakPolarHBondContact O-CG 3.35Å; Y740-M744 PolarHBondContact O-N 3.03Å; Y740-I758 HydrophobicContact CD1-CD1 4.41Å; Y740-I758 HydrophobicContact CE1-CD1 4.11Å; Y740-I758 HydrophobicContact CE1-CG1 4.39Å; Y740-V764 HydrophobicContact CD2-CB 4.47Å; Y740-V764 HydrophobicContact CD2-CG1 3.97Å; Y740-V764 HydrophobicContact CD2-CG2 3.79Å; Y740-V764 HydrophobicContact CE2-CG2 4.06Å; Y740-V764 HydrophobicContact CG-CG2 4.29Å; Y740-W784 AromaticContact CE2-CH2 3.72Å; Y740-W784 HydrophobicContact CE2-CH2 3.72Å; Y740-W784 AromaticContact CE2-CZ3 3.73Å; Y740-W784 HydrophobicContact CE2-CZ3 3.73Å; Y740-W784 AromaticContact CZ-CZ3 3.86Å; Y740-W784 WeakPolarHBondContact OH-CZ3 3.39Å; Y740-M785 HydrophobicContact CD2-CE 4.34Å; Y740-M785 HydrophobicContact CE2-CE 3.58Å
741	S	96.9	Very high	93.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.1	-37.5	175.1	71.5	0	0	0	0	113.3	M497 T501 A535 V737 V738 A739 M744 G745	M497-S741 WeakPolarHBondContact CE-OG 3.36Å; T501-S741 WeakPolarHBondContact OG1-CA 3.39Å; T501-S741 PolarHBondContact OG1-O 3.39Å; A535-S741 WeakPolarHBondContact CB-OG 3.48Å; V737-S741 WeakPolarHBondContact O-CB 3.47Å; V737-S741 PolarHBondContact O-N 3.38Å; V737-S741 PolarHBondContact O-OG 2.91Å; V738-S741 PolarHBondContact O-N 3.18Å; V738-S741 PolarHBondContact O-OG 3.24Å; A739-S741 PolarHBondContact O-N 3.13Å; S741-M744 PolarHBondContact O-N 3.29Å; S741-G745 PolarHBondContact O-N 3.42Å
742	V	96.8	Very high	93.3	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-68.1	-40.1	176.2	169.1	0	0	0	0	110.6	V504 M531 F532 A535 V738 A739 Y740 G745 A746	V504-V742 HydrophobicContact CG2-CG2 4.26Å; M531-V742 HydrophobicContact CE-CG1 3.55Å; M531-V742 HydrophobicContact CG-CG1 3.84Å; M531-V742 HydrophobicContact SD-CG1 3.71Å; F532-V742 HydrophobicContact CD1-CB 4.25Å; F532-V742 HydrophobicContact CD1-CG1 4.32Å; F532-V742 HydrophobicContact CD1-CG2 3.76Å; F532-V742 HydrophobicContact CE1-CB 4.08Å; F532-V742 HydrophobicContact CE1-CG1 4Å; F532-V742 HydrophobicContact CE1-CG2 4.11Å; F532-V742 HydrophobicContact CE2-CG1 4.33Å; F532-V742 HydrophobicContact CG-CG2 4.22Å; F532-V742 HydrophobicContact CZ-CG1 4.01Å; A535-V742 HydrophobicContact CB-CG2 3.83Å; V738-V742 WeakPolarHBondContact O-CG2 3.38Å; V738-V742 PolarHBondContact O-N 3.48Å; V738-V742 VanDerWaalsContact O-N 3.13Å; A739-V742 PolarHBondContact O-N 2.93Å; Y740-V742 VanDerWaalsContact C-N 3.32Å; Y740-V742 PolarHBondContact O-N 3.21Å; V742-G745 PolarHBondContact O-N 3.46Å; V742-A746 VanDerWaalsContact O-CB 3.26Å; V742-A746 WeakPolarHBondContact O-CB 3.26Å; V742-A746 PolarHBondContact O-N 3.13Å
743	V	94.8	Very high	93.3	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-56.7	-53.2	173.9	-178.8	0	0	0	0	110.4	I718 L719 I722 A739 Y740 G745 A746 L747 M785	I718-V743 HydrophobicContact CG2-CG1 4.08Å; L719-V743 HydrophobicContact CD2-CG1 3.97Å; I722-V743 HydrophobicContact CB-CG2 3.92Å; I722-V743 HydrophobicContact CD1-CG2 3.39Å; I722-V743 HydrophobicContact CG1-CG2 3.25Å; I722-V743 HydrophobicContact CG2-CG2 3.8Å; A739-V743 WeakPolarHBondContact O-CG2 3.44Å; A739-V743 PolarHBondContact O-N 3.06Å; Y740-V743 WeakPolarHBondContact O-CB 3.31Å; Y740-V743 PolarHBondContact O-N 3.1Å; V743-G745 VanDerWaalsContact C-N 3.29Å; V743-G745 PolarHBondContact O-N 3.35Å; V743-A746 PolarHBondContact O-N 3.44Å; V743-L747 HydrophobicContact CG1-CD1 3.65Å; V743-L747 HydrophobicContact CG1-CG 4.2Å; V743-L747 WeakPolarHBondContact O-CB 3.21Å; V743-L747 VanDerWaalsContact O-CG 3.26Å; V743-L747 WeakPolarHBondContact O-CG 3.48Å; V743-L747 PolarHBondContact O-N 3.15Å; V743-M785 HydrophobicContact CG1-CE 3.77Å
744	M	95.3	Very high	93.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.8	-43.7	-177.9	-70.8	-177.5	67.7	0	0	110.6	L476 L479 M480 T501 Y740 S741 L747 M748 V754	L476-M744 HydrophobicContact CB-CE 4.32Å; L476-M744 HydrophobicContact CD2-CE 3.87Å; L479-M744 HydrophobicContact CB-CE 4.15Å; L479-M744 HydrophobicContact CD1-CE 3.97Å; M480-M744 HydrophobicContact CE-CE 4.37Å; M480-M744 HydrophobicContact CE-SD 3.52Å; M480-M744 VanDerWaalsContact CE-SD 3.52Å; M480-M744 HydrophobicContact CG-SD 3.78Å; M480-M744 HydrophobicContact SD-SD 4.34Å; T501-M744 HydrophobicContact CG2-CB 3.71Å; Y740-M744 HydrophobicContact CD1-CG 4.5Å; Y740-M744 HydrophobicContact CD1-SD 3.96Å; Y740-M744 HydrophobicContact CE1-CG 4.19Å; Y740-M744 HydrophobicContact CE1-SD 3.52Å; Y740-M744 VanDerWaalsContact CE1-SD 3.52Å; Y740-M744 WeakPolarHBondContact O-CG 3.35Å; Y740-M744 PolarHBondContact O-N 3.03Å; S741-M744 PolarHBondContact O-N 3.29Å; M744-L747 PolarHBondContact O-N 3.21Å; M744-M748 WeakPolarHBondContact O-CB 3.46Å; M744-M748 WeakPolarHBondContact O-CG 3.34Å; M744-M748 PolarHBondContact O-N 3.06Å; M744-V754 HydrophobicContact CE-CB 4.12Å; M744-V754 HydrophobicContact CE-CG1 4.38Å; M744-V754 HydrophobicContact CG-CB 4.34Å; M744-V754 HydrophobicContact CG-CG2 4.07Å
745	G	95.8	Very high	93.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-64.3	-43.4	178.7	0	0	0	0	0	112.6	T501 M505 S741 V742 V743 M748 A749	T501-G745 VanDerWaalsContact O-CA 3.25Å; T501-G745 WeakPolarHBondContact O-CA 3.44Å; M505-G745 VanDerWaalsContact CA-O 3.31Å; M505-G745 WeakPolarHBondContact CA-O 3.17Å; M505-G745 WeakPolarHBondContact CB-O 3.23Å; S741-G745 PolarHBondContact O-N 3.42Å; V742-G745 PolarHBondContact O-N 3.46Å; V743-G745 VanDerWaalsContact C-N 3.29Å; V743-G745 PolarHBondContact O-N 3.35Å; G745-M748 PolarHBondContact O-N 3.25Å; G745-A749 PolarHBondContact O-N 2.95Å
746	A	94.8	Very high	93.4	Very high	2 Å²	2	10.4 Å²	10.4	2%	0.017	6%	0.064	C	C	.	.	H	α-helix	trans	-65.9	-40.2	178.8	0	0	0	0	0	113.1	M508 I718 V742 V743 A749 S750	M508-A746 HydrophobicContact CE-CB 3.9Å; M508-A746 WeakPolarHBondContact SD-CA 3.34Å; M508-A746 HydrophobicContact SD-CB 3.31Å; M508-A746 WeakPolarHBondContact SD-CB 3.48Å; I718-A746 HydrophobicContact CD1-CB 3.74Å; I718-A746 HydrophobicContact CG1-CB 3.91Å; I718-A746 HydrophobicContact CG2-CB 3.8Å; V742-A746 VanDerWaalsContact O-CB 3.26Å; V742-A746 WeakPolarHBondContact O-CB 3.26Å; V742-A746 PolarHBondContact O-N 3.13Å; V743-A746 PolarHBondContact O-N 3.44Å; A746-A749 PolarHBondContact O-N 2.86Å; A746-S750 PolarHBondContact O-N 3.11Å
747	L	93.9	Very high	93.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.2	-42.6	174.2	-69.5	172.1	0	0	0	110.8	C715 I718 V743 M744 A749 S750 G751 K752 V754 M785 L787	C715-L747 HydrophobicContact CB-CD2 3.94Å; C715-L747 VanDerWaalsContact SG-CD2 3.55Å; I718-L747 HydrophobicContact CD1-CD2 3.95Å; I718-L747 HydrophobicContact CD1-CG 4.38Å; I718-L747 HydrophobicContact CG2-CD2 4.45Å; I718-L747 HydrophobicContact CG2-CG 4.33Å; V743-L747 HydrophobicContact CG1-CD1 3.65Å; V743-L747 HydrophobicContact CG1-CG 4.2Å; V743-L747 WeakPolarHBondContact O-CB 3.21Å; V743-L747 VanDerWaalsContact O-CG 3.26Å; V743-L747 WeakPolarHBondContact O-CG 3.48Å; V743-L747 PolarHBondContact O-N 3.15Å; M744-L747 PolarHBondContact O-N 3.21Å; L747-A749 VanDerWaalsContact C-N 3.27Å; L747-A749 PolarHBondContact O-N 3.2Å; L747-S750 CarbonylContact O-C 3.54Å; L747-S750 WeakPolarHBondContact O-CA 3.3Å; L747-S750 PolarHBondContact O-N 3.49Å; L747-S750 PolarHBondContact O-OG 3.24Å; L747-G751 PolarHBondContact O-N 3.37Å; L747-K752 CarbonylContact C-O 3.59Å; L747-K752 HydrophobicContact CB-CB 4.49Å; L747-K752 PolarHBondContact O-N 3.16Å; L747-V754 HydrophobicContact CD1-CG2 3.76Å; L747-M785 HydrophobicContact CD1-SD 4.12Å; L747-L787 HydrophobicContact CD1-CD2 3.84Å
748	M	92.9	Very high	93.3	Very high	9 Å²	9	15.9 Å²	15.9	4%	0.044	8%	0.079	C	C	.	.	H	α-helix	trans	-62.8	-37	176.7	-71.1	175.3	75.3	0	0	111.6	L476 T501 L502 M505 M744 G745 S750 G751 K752 Y794	L476-M748 HydrophobicContact CD1-CE 4.12Å; L476-M748 HydrophobicContact CD1-SD 4.09Å; L476-M748 HydrophobicContact CD2-CE 4.5Å; L476-M748 HydrophobicContact CD2-SD 4.09Å; T501-M748 HydrophobicContact CG2-SD 3.79Å; L502-M748 HydrophobicContact CD2-CE 4.06Å; M505-M748 HydrophobicContact CB-CB 4.15Å; M505-M748 HydrophobicContact CG-CB 3.67Å; M505-M748 HydrophobicContact SD-CB 3.73Å; M505-M748 HydrophobicContact SD-CE 3.82Å; M744-M748 WeakPolarHBondContact O-CB 3.46Å; M744-M748 WeakPolarHBondContact O-CG 3.34Å; M744-M748 PolarHBondContact O-N 3.06Å; G745-M748 PolarHBondContact O-N 3.25Å; M748-S750 PolarHBondContact O-N 2.77Å; M748-G751 PolarHBondContact O-N 3.19Å; M748-K752 WeakPolarHBondContact CA-O 3.43Å; M748-K752 PolarHBondContact N-O 3.27Å; M748-Y794 HydrophobicContact CE-CD1 3.56Å; M748-Y794 HydrophobicContact CE-CD2 4.3Å; M748-Y794 HydrophobicContact CE-CE1 3.45Å; M748-Y794 VanDerWaalsContact CE-CE1 3.45Å; M748-Y794 HydrophobicContact CE-CE2 4.21Å; M748-Y794 HydrophobicContact CE-CG 4.01Å
749	A	91.3	Very high	93.1	Very high	6 Å²	6	18.1 Å²	18.1	5%	0.05	9%	0.093	C	C	.	.	H	α-helix	trans	-63.1	-28.9	173.6	0	0	0	0	0	112.6	M505 M508 W512 M703 G745 A746 L747 G751	M505-A749 HydrophobicContact CG-CB 4.39Å; M508-A749 HydrophobicContact CB-CB 3.72Å; W512-A749 HydrophobicContact CE3-CB 4.29Å; W512-A749 HydrophobicContact CH2-CB 4.29Å; W512-A749 HydrophobicContact CZ3-CB 3.82Å; M703-A749 WeakPolarHBondContact CE-O 3.48Å; G745-A749 PolarHBondContact O-N 2.95Å; A746-A749 PolarHBondContact O-N 2.86Å; L747-A749 VanDerWaalsContact C-N 3.27Å; L747-A749 PolarHBondContact O-N 3.2Å; A749-G751 PolarHBondContact O-N 2.8Å
750	S	89.9	Confident	93	Very high	9 Å²	9	26 Å²	26	6%	0.063	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	3	175.8	82.3	0	0	0	0	113.6	A746 L747 M748	A746-S750 PolarHBondContact O-N 3.11Å; L747-S750 CarbonylContact O-C 3.54Å; L747-S750 WeakPolarHBondContact O-CA 3.3Å; L747-S750 PolarHBondContact O-N 3.49Å; L747-S750 PolarHBondContact O-OG 3.24Å; M748-S750 PolarHBondContact O-N 2.77Å
751	G	88.1	Confident	92.8	Very high	20 Å²	20	26.6 Å²	26.6	21%	0.206	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	17.2	-178.7	0	0	0	0	0	113.9	L747 M748 A749 S790	L747-G751 PolarHBondContact O-N 3.37Å; M748-G751 PolarHBondContact O-N 3.19Å; A749-G751 PolarHBondContact O-N 2.8Å; G751-S790 VanDerWaalsContact C-OG 3.27Å; G751-S790 VanDerWaalsContact CA-OG 3.26Å; G751-S790 WeakPolarHBondContact CA-OG 3.25Å; G751-S790 PolarHBondContact O-N 2.96Å; G751-S790 PolarHBondContact O-OG 3.09Å
752	K	90.1	Very high	92.6	Very high	42 Å²	42	30.2 Å²	30.2	18%	0.183	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.9	177.5	-63.4	-64.7	-175.7	178.1	0	111	S711 L747 M748 K788	S711-K752 WeakPolarHBondContact OG-CE 3.45Å; L747-K752 CarbonylContact C-O 3.59Å; L747-K752 HydrophobicContact CB-CB 4.49Å; L747-K752 PolarHBondContact O-N 3.16Å; M748-K752 WeakPolarHBondContact CA-O 3.43Å; M748-K752 PolarHBondContact N-O 3.27Å; K752-K788 CarbonylContact C-O 3.47Å; K752-K788 VanDerWaalsContact CA-O 3.28Å; K752-K788 WeakPolarHBondContact CA-O 3.42Å
753	E	90.9	Very high	92.4	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.065	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.7	175.8	-175	179.6	-169.1	0	0	110.5	I755 L787 K788 P791 Y794	E753-I755 HydrophobicContact CG-CG2 4.29Å; E753-L787 WeakPolarHBondContact O-CA 3.49Å; E753-K788 PolarHBondContact N-O 3.33Å; E753-K788 PolarHBondContact O-N 3.36Å; E753-P791 WeakPolarHBondContact OE2-CD 3.33Å; E753-Y794 WeakPolarHBondContact OE1-CE2 3.35Å; E753-Y794 VanDerWaalsContact OE1-CZ 3.31Å; E753-Y794 PolarHBondContact OE1-OH 3.42Å; E753-Y794 WeakPolarHBondContact OE2-CE2 3.5Å
754	V	92.5	Very high	92.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.9	170.4	177.8	0	0	0	0	107.8	L479 M744 L747 M785 L787	L479-V754 VanDerWaalsContact CD1-O 3.3Å; L479-V754 WeakPolarHBondContact CD1-O 3.32Å; M744-V754 HydrophobicContact CE-CB 4.12Å; M744-V754 HydrophobicContact CE-CG1 4.38Å; M744-V754 HydrophobicContact CG-CB 4.34Å; M744-V754 HydrophobicContact CG-CG2 4.07Å; L747-V754 HydrophobicContact CD1-CG2 3.76Å; V754-M785 HydrophobicContact CG1-CB 4.11Å; V754-M785 HydrophobicContact CG1-CG 4.24Å; V754-M785 WeakPolarHBondContact CG1-O 3.36Å; V754-M785 HydrophobicContact CG2-CB 4.38Å; V754-M785 HydrophobicContact CG2-CG 4.43Å; V754-L787 HydrophobicContact CG2-CD2 3.72Å
755	I	91.5	Very high	92.2	Very high	56 Å²	56	31 Å²	31	29%	0.287	16%	0.155	S	C	.	.			trans	-113.1	-12.4	175.1	58.7	143.4	0	0	0	112.7	E753 M785 N786 K788	E753-I755 HydrophobicContact CG-CG2 4.29Å; I755-M785 PolarHBondContact N-O 3.21Å; I755-N786 HydrophobicContact CD1-CB 4.42Å; I755-N786 VanDerWaalsContact CD1-ND2 3.26Å; I755-N786 WeakPolarHBondContact CD1-ND2 3.4Å; I755-N786 HydrophobicContact CG1-CB 4.04Å; I755-N786 WeakPolarHBondContact CG1-O 3.24Å; I755-K788 HydrophobicContact CD1-CD 3.51Å; I755-K788 HydrophobicContact CD1-CG 4.05Å; I755-K788 HydrophobicContact CG1-CD 4.1Å; I755-K788 HydrophobicContact CG1-CG 4.19Å
756	G	90.9	Very high	92	Very high	10 Å²	10	31.2 Å²	31.2	10%	0.103	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-81.5	158.3	176.9	0	0	0	0	0	112.3	W784 M785	G756-W784 WeakPolarHBondContact CA-O 3.48Å; G756-M785 PolarHBondContact N-O 2.95Å
757	R	91.9	Very high	92	Very high	155 Å²	155	32 Å²	32	59%	0.585	16%	0.159	S	C	*	.	P	Polyproline II helix	trans	-101.2	156.3	173.4	-64.6	-173.7	-175.5	-157.5	3.9	110	L479	L479-R757 HydrophobicContact CD2-CG 3.79Å
758	I	93.3	Very high	92	Very high	6 Å²	6	32 Å²	32	3%	0.031	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-61.2	128.1	170.8	-58.8	161.4	0	0	0	107.9	Y482 Y740 K762 V764 W784	Y482-I758 HydrophobicContact CD1-CD1 3.81Å; Y482-I758 HydrophobicContact CD1-CG2 4.07Å; Y482-I758 HydrophobicContact CE1-CD1 3.69Å; Y482-I758 HydrophobicContact CE1-CG2 4.33Å; Y740-I758 HydrophobicContact CD1-CD1 4.41Å; Y740-I758 HydrophobicContact CE1-CD1 4.11Å; Y740-I758 HydrophobicContact CE1-CG1 4.39Å; I758-K762 HydrophobicContact CG2-CB 4.19Å; I758-K762 VanDerWaalsContact CG2-O 3.28Å; I758-K762 WeakPolarHBondContact CG2-O 3.36Å; I758-V764 HydrophobicContact CD1-CG2 3.78Å; I758-V764 HydrophobicContact CG1-CG2 4.1Å; I758-W784 HydrophobicContact CB-CZ3 4.44Å; I758-W784 HydrophobicContact CG1-CE3 4.3Å; I758-W784 HydrophobicContact CG1-CH2 4.31Å; I758-W784 HydrophobicContact CG1-CZ3 3.71Å
759	P	93.4	Very high	91.9	Very high	47 Å²	47	31.8 Å²	31.8	31%	0.305	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-63.1	157.2	-176.7	-22.4	32.9	0	0	0	112.7	G761 K762 W784	P759-G761 PolarHBondContact O-N 3.43Å; P759-K762 HydrophobicContact CB-CB 4.36Å; P759-K762 HydrophobicContact CB-CG 3.99Å; P759-K762 HydrophobicContact CG-CG 4.44Å; P759-K762 WeakPolarHBondContact O-CB 3.41Å; P759-K762 PolarHBondContact O-N 2.94Å; P759-K762 VanDerWaalsContact O-N 3.15Å; P759-W784 HydrophobicContact CG-CB 3.43Å; P759-W784 VanDerWaalsContact CG-CB 3.43Å; P759-W784 HydrophobicContact CG-CD2 4.31Å; P759-W784 HydrophobicContact CG-CG 3.61Å
760	K	92.3	Very high	91.8	Very high	165 Å²	165	33.6 Å²	33.6	72%	0.717	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	132.1	177.1	-171.6	175	-177.4	173.7	0	111.7	D483 K762	D483-K760 VanDerWaalsContact O-CA 3.26Å; D483-K760 WeakPolarHBondContact O-CA 3.11Å; D483-K760 WeakPolarHBondContact O-CG 3.38Å; D483-K760 WeakPolarHBondContact OD2-CB 3.37Å; K760-K762 VanDerWaalsContact C-N 3.28Å; K760-K762 PolarHBondContact O-N 3.43Å
761	G	91.1	Very high	91.9	Very high	15 Å²	15	33.8 Å²	33.8	16%	0.155	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	9.6	179.6	0	0	0	0	0	115.1	D483 T484 A581 P759	D483-G761 PolarHBondContact O-N 2.81Å; T484-G761 WeakPolarHBondContact OG1-CA 3.49Å; T484-G761 PolarHBondContact OG1-N 3.23Å; A581-G761 WeakPolarHBondContact CB-O 3.44Å; P759-G761 PolarHBondContact O-N 3.43Å
762	K	92.4	Very high	92	Very high	76 Å²	76	36.9 Å²	36.9	33%	0.33	19%	0.187	S	C	.	.			trans	-110.8	139.9	-178.5	-65	-73.4	-174.9	167.8	0	111.6	Y582 I758 P759 K760 E767	Y582-K762 WeakPolarHBondContact OH-CA 3.47Å; I758-K762 HydrophobicContact CG2-CB 4.19Å; I758-K762 VanDerWaalsContact CG2-O 3.28Å; I758-K762 WeakPolarHBondContact CG2-O 3.36Å; P759-K762 HydrophobicContact CB-CB 4.36Å; P759-K762 HydrophobicContact CB-CG 3.99Å; P759-K762 HydrophobicContact CG-CG 4.44Å; P759-K762 WeakPolarHBondContact O-CB 3.41Å; P759-K762 PolarHBondContact O-N 2.94Å; P759-K762 VanDerWaalsContact O-N 3.15Å; K760-K762 VanDerWaalsContact C-N 3.28Å; K760-K762 PolarHBondContact O-N 3.43Å; K762-E767 HydrophobicContact CD-CG 4.21Å; K762-E767 WeakPolarHBondContact CD-OE1 3.49Å; K762-E767 VanDerWaalsContact NZ-CD 3.26Å; K762-E767 IonicContact NZ-OE1 3.2Å; K762-E767 PolarHBondContact NZ-OE1 3.17Å; K762-E767 IonicContact NZ-OE2 2.94Å; K762-E767 PolarHBondContact NZ-OE2 3.47Å
763	L	93.8	Very high	92.2	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.185	C	C	.	.			trans	-124.3	129.2	176.3	-53.7	175.5	0	0	0	109.3	Y482 F487 Y579 Y582 D765 F766 E767	Y482-L763 HydrophobicContact CD1-CD2 3.69Å; Y482-L763 HydrophobicContact CD2-CD2 3.76Å; Y482-L763 HydrophobicContact CE1-CB 4.33Å; Y482-L763 HydrophobicContact CE1-CD2 3.96Å; Y482-L763 HydrophobicContact CE2-CD2 4.01Å; Y482-L763 HydrophobicContact CG-CD2 3.6Å; F487-L763 HydrophobicContact CD2-CD2 4.32Å; F487-L763 HydrophobicContact CE2-CD1 4.33Å; F487-L763 HydrophobicContact CE2-CD2 3.53Å; F487-L763 HydrophobicContact CZ-CD1 4.21Å; F487-L763 HydrophobicContact CZ-CD2 3.69Å; Y579-L763 HydrophobicContact CD1-CD1 3.52Å; Y579-L763 HydrophobicContact CE1-CD1 3.55Å; Y582-L763 HydrophobicContact CD2-CD1 4.46Å; Y582-L763 HydrophobicContact CE2-CB 4.06Å; Y582-L763 HydrophobicContact CE2-CD1 4.17Å; Y582-L763 HydrophobicContact CE2-CG 3.9Å; Y582-L763 PolarHBondContact OH-N 2.8Å; Y582-L763 PolarHBondContact OH-O 3.1Å; L763-D765 VanDerWaalsContact C-N 3.32Å; L763-D765 WeakPolarHBondContact CB-OD1 3.48Å; L763-D765 PolarHBondContact O-N 3.22Å; L763-F766 HydrophobicContact CB-CB 4.24Å; L763-F766 HydrophobicContact CD1-CD2 4.15Å; L763-F766 PolarHBondContact O-N 2.96Å; L763-E767 WeakPolarHBondContact O-CG 3.48Å; L763-E767 PolarHBondContact O-N 3.43Å
764	V	93.1	Very high	92.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-40.8	-172.2	175.9	0	0	0	0	112.4	Y482 Y740 I758 A768 F777 W784	Y482-V764 HydrophobicContact CE1-CG2 4.12Å; Y740-V764 HydrophobicContact CD2-CB 4.47Å; Y740-V764 HydrophobicContact CD2-CG1 3.97Å; Y740-V764 HydrophobicContact CD2-CG2 3.79Å; Y740-V764 HydrophobicContact CE2-CG2 4.06Å; Y740-V764 HydrophobicContact CG-CG2 4.29Å; I758-V764 HydrophobicContact CD1-CG2 3.78Å; I758-V764 HydrophobicContact CG1-CG2 4.1Å; V764-A768 WeakPolarHBondContact O-CB 3.38Å; V764-A768 PolarHBondContact O-N 3.37Å; V764-A768 VanDerWaalsContact O-N 3.1Å; V764-F777 HydrophobicContact CG1-CZ 4.46Å; V764-W784 HydrophobicContact CG2-CH2 3.78Å; V764-W784 HydrophobicContact CG2-CZ2 4.46Å
765	D	92.4	Very high	92.4	Very high	18 Å²	18	40.4 Å²	40.4	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-46.3	176.9	49.3	-3.9	0	0	0	112	M729 L763 A768 M769	M729-D765 HydrophobicContact CE-CB 3.51Å; L763-D765 VanDerWaalsContact C-N 3.32Å; L763-D765 WeakPolarHBondContact CB-OD1 3.48Å; L763-D765 PolarHBondContact O-N 3.22Å; D765-A768 WeakPolarHBondContact O-CB 3.43Å; D765-A768 PolarHBondContact O-N 3.41Å; D765-M769 WeakPolarHBondContact O-CB 3.33Å; D765-M769 VanDerWaalsContact O-CG 3.24Å; D765-M769 WeakPolarHBondContact O-CG 3.5Å; D765-M769 PolarHBondContact O-N 3.43Å
766	F	92.6	Very high	92.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-41.2	176.2	-87.7	-106	0	0	0	112.2	I567 L569 Y579 Y582 I586 L763 A768 M769 T770	I567-F766 HydrophobicContact CD1-CE2 3.86Å; I567-F766 HydrophobicContact CD1-CZ 4.13Å; I567-F766 HydrophobicContact CG2-CZ 4.19Å; L569-F766 HydrophobicContact CD2-CZ 4.5Å; Y579-F766 HydrophobicContact CD1-CD2 4.04Å; Y579-F766 HydrophobicContact CD1-CE1 4.29Å; Y579-F766 AromaticContact CD1-CE2 3.45Å; Y579-F766 HydrophobicContact CD1-CE2 3.45Å; Y579-F766 VanDerWaalsContact CD1-CE2 3.45Å; Y579-F766 AromaticContact CD1-CZ 3.59Å; Y579-F766 HydrophobicContact CD1-CZ 3.59Å; Y579-F766 AromaticContact CE1-CD2 3.95Å; Y579-F766 HydrophobicContact CE1-CD2 3.95Å; Y579-F766 AromaticContact CE1-CE2 3.26Å; Y579-F766 HydrophobicContact CE1-CE2 3.26Å; Y579-F766 AromaticContact CE1-CZ 3.79Å; Y579-F766 HydrophobicContact CE1-CZ 3.79Å; Y579-F766 HydrophobicContact CG-CZ 4.33Å; Y582-F766 HydrophobicContact CD1-CB 3.9Å; Y582-F766 AromaticContact CD1-CD1 3.99Å; Y582-F766 HydrophobicContact CD1-CD1 3.99Å; Y582-F766 HydrophobicContact CD1-CG 4.34Å; Y582-F766 HydrophobicContact CD2-CB 4.25Å; Y582-F766 HydrophobicContact CD2-CD1 4.32Å; Y582-F766 HydrophobicContact CD2-CG 4.34Å; Y582-F766 HydrophobicContact CE1-CB 3.56Å; Y582-F766 HydrophobicContact CE1-CG 4.44Å; Y582-F766 HydrophobicContact CE2-CB 3.94Å; Y582-F766 HydrophobicContact CE2-CG 4.45Å; Y582-F766 HydrophobicContact CG-CB 4.23Å; Y582-F766 AromaticContact CG-CD1 3.88Å; Y582-F766 HydrophobicContact CG-CD1 3.88Å; Y582-F766 HydrophobicContact CG-CG 4.29Å; I586-F766 HydrophobicContact CD1-CD1 4.26Å; I586-F766 HydrophobicContact CD1-CE1 3.8Å; L763-F766 HydrophobicContact CB-CB 4.24Å; L763-F766 HydrophobicContact CD1-CD2 4.15Å; L763-F766 PolarHBondContact O-N 2.96Å; F766-A768 PolarHBondContact O-N 3.03Å; F766-M769 PolarHBondContact O-N 3.37Å; F766-T770 WeakPolarHBondContact O-CG2 3.21Å; F766-T770 PolarHBondContact O-N 2.96Å; F766-T770 PolarHBondContact O-OG1 2.75Å
767	E	94	Very high	92.7	Very high	19 Å²	19	41.4 Å²	41.4	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-59.7	-33.7	173.8	-67.9	-58.4	111.5	0	0	112.1	Y582 K762 L763 A771 F777 T780	Y582-E767 WeakPolarHBondContact CE1-OE1 3.43Å; Y582-E767 VanDerWaalsContact CZ-OE1 3.29Å; Y582-E767 WeakPolarHBondContact OH-CG 3.26Å; Y582-E767 PolarHBondContact OH-OE1 3.04Å; K762-E767 HydrophobicContact CD-CG 4.21Å; K762-E767 WeakPolarHBondContact CD-OE1 3.49Å; K762-E767 VanDerWaalsContact NZ-CD 3.26Å; K762-E767 IonicContact NZ-OE1 3.2Å; K762-E767 PolarHBondContact NZ-OE1 3.17Å; K762-E767 IonicContact NZ-OE2 2.94Å; K762-E767 PolarHBondContact NZ-OE2 3.47Å; L763-E767 WeakPolarHBondContact O-CG 3.48Å; L763-E767 PolarHBondContact O-N 3.43Å; E767-A771 WeakPolarHBondContact O-CB 3.43Å; E767-A771 PolarHBondContact O-N 2.79Å; E767-F777 HydrophobicContact CB-CD2 4.39Å; E767-F777 HydrophobicContact CB-CE2 4.27Å; E767-T780 WeakPolarHBondContact OE2-CG2 3.5Å
768	A	93.6	Very high	92.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-74.6	-43.3	174.9	0	0	0	0	0	112.3	Y723 C726 N727 V764 D765 F766 F777	Y723-A768 HydrophobicContact CD2-CB 4.42Å; Y723-A768 WeakPolarHBondContact CD2-O 3.44Å; Y723-A768 WeakPolarHBondContact CE2-O 3.46Å; C726-A768 HydrophobicContact CB-CB 3.63Å; N727-A768 PolarHBondContact ND2-O 3.02Å; V764-A768 WeakPolarHBondContact O-CB 3.38Å; V764-A768 PolarHBondContact O-N 3.37Å; V764-A768 VanDerWaalsContact O-N 3.1Å; D765-A768 WeakPolarHBondContact O-CB 3.43Å; D765-A768 PolarHBondContact O-N 3.41Å; F766-A768 PolarHBondContact O-N 3.03Å; A768-F777 VanDerWaalsContact CA-CD2 3.5Å; A768-F777 HydrophobicContact CB-CD2 3.86Å; A768-F777 HydrophobicContact CB-CE2 3.68Å; A768-F777 HydrophobicContact CB-CG 4.37Å; A768-F777 HydrophobicContact CB-CZ 4.05Å
769	M	90.9	Very high	92.9	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.02	22%	0.215	C	C	.	.	H	α-helix	trans	-68.2	-42	-177.9	-70.7	171.3	75.5	0	0	111.6	F656 V672 M729 D765 F766 A771	F656-M769 HydrophobicContact CB-CE 3.53Å; F656-M769 HydrophobicContact CD1-CB 3.96Å; F656-M769 HydrophobicContact CD1-CE 3.89Å; F656-M769 HydrophobicContact CE1-CB 4.09Å; F656-M769 VanDerWaalsContact CE1-O 3.27Å; F656-M769 WeakPolarHBondContact CE1-O 3.48Å; F656-M769 HydrophobicContact CG-CE 3.82Å; V672-M769 HydrophobicContact CG1-CE 3.87Å; M729-M769 HydrophobicContact CE-SD 3.68Å; D765-M769 WeakPolarHBondContact O-CB 3.33Å; D765-M769 VanDerWaalsContact O-CG 3.24Å; D765-M769 WeakPolarHBondContact O-CG 3.5Å; D765-M769 PolarHBondContact O-N 3.43Å; F766-M769 PolarHBondContact O-N 3.37Å; M769-A771 VanDerWaalsContact C-N 3.33Å
770	T	90	Very high	92.9	Very high	43 Å²	43	42 Å²	42	26%	0.264	22%	0.216	S	C	.	.	S	Bend	trans	-84.4	-6.4	-178.4	65.8	0	0	0	0	113.4	F766	F766-T770 WeakPolarHBondContact O-CG2 3.21Å; F766-T770 PolarHBondContact O-N 2.96Å; F766-T770 PolarHBondContact O-OG1 2.75Å
771	A	91.8	Very high	93	Very high	13 Å²	13	34.1 Å²	34.1	11%	0.107	18%	0.182	C	C	.	.			trans	-75	133.8	175.4	0	0	0	0	0	111.1	Y723 E767 M769 S773 F777	Y723-A771 HydrophobicContact CE2-CB 4.08Å; Y723-A771 PolarHBondContact OH-O 3.16Å; E767-A771 WeakPolarHBondContact O-CB 3.43Å; E767-A771 PolarHBondContact O-N 2.79Å; M769-A771 VanDerWaalsContact C-N 3.33Å; A771-S773 VanDerWaalsContact C-N 3.26Å; A771-S773 PolarHBondContact O-N 2.66Å; A771-F777 HydrophobicContact CB-CB 3.77Å
772	P	89.9	Confident	93	Very high	86 Å²	86	35.5 Å²	35.5	56%	0.558	18%	0.184	S	C	*	.	S	Bend	trans	-71.7	-20.7	-176.5	30.1	-36.9	0	0	0	113.2	P644 N776	P644-P772 WeakPolarHBondContact CD-O 3.44Å; P644-P772 WeakPolarHBondContact CG-O 3.49Å; P772-N776 HydrophobicContact CG-CB 4.04Å; P772-N776 VanDerWaalsContact CG-ND2 3.28Å; P772-N776 WeakPolarHBondContact CG-ND2 3.4Å
773	S	93.4	Very high	93	Very high	20 Å²	20	36.3 Å²	36.3	14%	0.14	20%	0.199	C	C	.	.	S	Bend	trans	-153.3	159.6	179.8	91.6	0	0	0	0	110.9	A771 E775 N776 F777	A771-S773 VanDerWaalsContact C-N 3.26Å; A771-S773 PolarHBondContact O-N 2.66Å; S773-E775 VanDerWaalsContact CB-OE2 3.25Å; S773-E775 WeakPolarHBondContact CB-OE2 3.4Å; S773-E775 PolarHBondContact O-N 2.99Å; S773-E775 PolarHBondContact OG-N 3.42Å; S773-E775 PolarHBondContact OG-OE2 3.2Å; S773-N776 PolarHBondContact O-N 3Å; S773-N776 PolarHBondContact OG-N 3.02Å; S773-F777 PolarHBondContact O-N 3.12Å; S773-F777 VanDerWaalsContact O-N 3.09Å
774	P	94.5	Very high	93	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-29.2	176.1	21.2	-29.4	0	0	0	113.3	V646 Y723 S778	V646-P774 HydrophobicContact CG2-CG 3.63Å; Y723-P774 HydrophobicContact CD1-CB 3.72Å; Y723-P774 HydrophobicContact CD1-CG 4.25Å; Y723-P774 HydrophobicContact CE1-CB 4.25Å; Y723-P774 HydrophobicContact CE1-CG 4.36Å; Y723-P774 HydrophobicContact CG-CB 3.93Å; P774-S778 VanDerWaalsContact O-CB 3.3Å; P774-S778 WeakPolarHBondContact O-CB 3.1Å; P774-S778 PolarHBondContact O-N 3.3Å; P774-S778 PolarHBondContact O-OG 2.98Å
775	E	93.9	Very high	93	Very high	108 Å²	108	37.6 Å²	37.6	51%	0.505	20%	0.204	S	C	.	.	H	α-helix	trans	-67.9	-42.6	176	-59.8	71.6	-153.9	0	0	111.3	S773 S778 K779	S773-E775 VanDerWaalsContact CB-OE2 3.25Å; S773-E775 WeakPolarHBondContact CB-OE2 3.4Å; S773-E775 PolarHBondContact O-N 2.99Å; S773-E775 PolarHBondContact OG-N 3.42Å; S773-E775 PolarHBondContact OG-OE2 3.2Å; E775-S778 PolarHBondContact O-N 3Å; E775-K779 PolarHBondContact O-N 2.63Å
776	N	94.1	Very high	93	Very high	85 Å²	85	40.6 Å²	40.6	46%	0.455	22%	0.22	S	C	.	.	H	α-helix	trans	-64.6	-44.4	177	-77.7	31.6	0	0	0	110.8	P772 S773 S778 K779 T780	P772-N776 HydrophobicContact CG-CB 4.04Å; P772-N776 VanDerWaalsContact CG-ND2 3.28Å; P772-N776 WeakPolarHBondContact CG-ND2 3.4Å; S773-N776 PolarHBondContact O-N 3Å; S773-N776 PolarHBondContact OG-N 3.02Å; N776-S778 VanDerWaalsContact C-N 3.33Å; N776-S778 PolarHBondContact O-N 2.86Å; N776-K779 PolarHBondContact O-N 3.47Å; N776-T780 PolarHBondContact O-N 3.04Å; N776-T780 VanDerWaalsContact O-N 3.08Å; N776-T780 PolarHBondContact O-OG1 3.13Å
777	F	95.2	Very high	92.9	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-46.8	172.2	172.5	-112.1	0	0	0	111.3	L719 I722 Y723 V764 E767 A768 A771 S773 K779 T780 A781	L719-F777 HydrophobicContact CB-CE1 4.43Å; L719-F777 HydrophobicContact CD2-CE1 4.47Å; L719-F777 WeakPolarHBondContact O-CE1 3.5Å; I722-F777 HydrophobicContact CG2-CE1 4.23Å; I722-F777 HydrophobicContact CG2-CZ 4.29Å; Y723-F777 HydrophobicContact CD2-CB 3.82Å; Y723-F777 HydrophobicContact CD2-CD1 4.41Å; Y723-F777 HydrophobicContact CD2-CG 4.17Å; Y723-F777 HydrophobicContact CE2-CB 4.5Å; V764-F777 HydrophobicContact CG1-CZ 4.46Å; E767-F777 HydrophobicContact CB-CD2 4.39Å; E767-F777 HydrophobicContact CB-CE2 4.27Å; A768-F777 VanDerWaalsContact CA-CD2 3.5Å; A768-F777 HydrophobicContact CB-CD2 3.86Å; A768-F777 HydrophobicContact CB-CE2 3.68Å; A768-F777 HydrophobicContact CB-CG 4.37Å; A768-F777 HydrophobicContact CB-CZ 4.05Å; A771-F777 HydrophobicContact CB-CB 3.77Å; S773-F777 PolarHBondContact O-N 3.12Å; S773-F777 VanDerWaalsContact O-N 3.09Å; F777-K779 VanDerWaalsContact C-N 3.33Å; F777-K779 PolarHBondContact O-N 3.32Å; F777-T780 PolarHBondContact O-N 2.76Å; F777-A781 HydrophobicContact CE2-CB 4.37Å; F777-A781 HydrophobicContact CZ-CB 4.27Å; F777-A781 VanDerWaalsContact O-CB 3.31Å; F777-A781 WeakPolarHBondContact O-CB 3.24Å; F777-A781 PolarHBondContact O-N 2.79Å
778	S	94.8	Very high	92.7	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.014	25%	0.25	C	S	.	.	H	α-helix	trans	-60	-42.6	-179.4	-63.8	0	0	0	0	112.2	L719 P774 E775 N776 A781 K782	L719-S778 VanDerWaalsContact CB-OG 3.25Å; L719-S778 WeakPolarHBondContact CB-OG 3.37Å; P774-S778 VanDerWaalsContact O-CB 3.3Å; P774-S778 WeakPolarHBondContact O-CB 3.1Å; P774-S778 PolarHBondContact O-N 3.3Å; P774-S778 PolarHBondContact O-OG 2.98Å; E775-S778 PolarHBondContact O-N 3Å; N776-S778 VanDerWaalsContact C-N 3.33Å; N776-S778 PolarHBondContact O-N 2.86Å; S778-A781 PolarHBondContact O-N 3.03Å; S778-K782 VanDerWaalsContact O-CB 3.32Å; S778-K782 WeakPolarHBondContact O-CB 3.36Å; S778-K782 VanDerWaalsContact O-CG 3.24Å; S778-K782 WeakPolarHBondContact O-CG 3.31Å; S778-K782 PolarHBondContact O-N 3.37Å
779	K	93.8	Very high	92.3	Very high	165 Å²	165	51.6 Å²	51.6	72%	0.717	28%	0.281	S	S	*	.	H	α-helix	trans	-61.9	-47.5	176.5	-175.9	-179.5	178.7	-177.9	0	111.4	E775 N776 F777 S783	E775-K779 PolarHBondContact O-N 2.63Å; N776-K779 PolarHBondContact O-N 3.47Å; F777-K779 VanDerWaalsContact C-N 3.33Å; F777-K779 PolarHBondContact O-N 3.32Å; K779-S783 PolarHBondContact O-N 2.61Å
780	T	93.2	Very high	91.8	Very high	54 Å²	54	52.8 Å²	52.8	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-51	177.3	-60.5	0	0	0	0	110.7	E767 N776 F777 K782 S783 W784	E767-T780 WeakPolarHBondContact OE2-CG2 3.5Å; N776-T780 PolarHBondContact O-N 3.04Å; N776-T780 VanDerWaalsContact O-N 3.08Å; N776-T780 PolarHBondContact O-OG1 3.13Å; F777-T780 PolarHBondContact O-N 2.76Å; T780-K782 PolarHBondContact O-N 3.25Å; T780-S783 WeakPolarHBondContact O-CB 3.29Å; T780-S783 PolarHBondContact O-N 3.22Å; T780-S783 VanDerWaalsContact O-N 3.13Å; T780-S783 PolarHBondContact O-OG 3.15Å; T780-W784 PolarHBondContact O-NE1 3.12Å
781	A	93.7	Very high	91.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-47.8	-179.3	0	0	0	0	0	112.9	L719 F777 S778 S783 W784 M785	L719-A781 HydrophobicContact CD1-CB 4.41Å; L719-A781 HydrophobicContact CD2-CB 4.05Å; F777-A781 HydrophobicContact CE2-CB 4.37Å; F777-A781 HydrophobicContact CZ-CB 4.27Å; F777-A781 VanDerWaalsContact O-CB 3.31Å; F777-A781 WeakPolarHBondContact O-CB 3.24Å; F777-A781 PolarHBondContact O-N 2.79Å; S778-A781 PolarHBondContact O-N 3.03Å; A781-S783 PolarHBondContact O-N 3.31Å; A781-W784 HydrophobicContact CB-CZ2 4.01Å; A781-W784 PolarHBondContact O-N 3.28Å; A781-M785 HydrophobicContact CB-CE 4.1Å; A781-M785 HydrophobicContact CB-SD 4.36Å; A781-M785 WeakPolarHBondContact O-CB 3.23Å; A781-M785 VanDerWaalsContact O-CG 3.25Å; A781-M785 WeakPolarHBondContact O-CG 3.49Å; A781-M785 PolarHBondContact O-N 3.37Å
782	K	92.7	Very high	90.6	Very high	44 Å²	44	57.1 Å²	57.1	19%	0.191	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-34	178	-76.3	178	175.3	-174.2	0	112.9	D712 N716 L719 S778 T780 W784 L787	D712-K782 IonicContact OD1-NZ 3.92Å; D712-K782 PolarHBondContact OD1-NZ 3.44Å; D712-K782 IonicContact OD2-NZ 3.64Å; D712-K782 PolarHBondContact OD2-NZ 3.32Å; N716-K782 VanDerWaalsContact CG-NZ 3.34Å; N716-K782 VanDerWaalsContact OD1-CE 3.31Å; N716-K782 WeakPolarHBondContact OD1-CE 3.42Å; N716-K782 PolarHBondContact OD1-NZ 3.47Å; L719-K782 HydrophobicContact CD1-CD 4.25Å; L719-K782 HydrophobicContact CD1-CG 3.7Å; S778-K782 VanDerWaalsContact O-CB 3.32Å; S778-K782 WeakPolarHBondContact O-CB 3.36Å; S778-K782 VanDerWaalsContact O-CG 3.24Å; S778-K782 WeakPolarHBondContact O-CG 3.31Å; S778-K782 PolarHBondContact O-N 3.37Å; T780-K782 PolarHBondContact O-N 3.25Å; K782-W784 VanDerWaalsContact C-N 3.26Å; K782-W784 PolarHBondContact O-N 3.33Å; K782-L787 HydrophobicContact CG-CD1 4.27Å
783	S	92.8	Very high	90.2	Very high	93 Å²	93	56.5 Å²	56.5	65%	0.65	31%	0.307	S	S	*	.	H	α-helix	trans	-61.6	-33.7	-176.7	75.6	0	0	0	0	113.3	K779 T780 A781	K779-S783 PolarHBondContact O-N 2.61Å; T780-S783 WeakPolarHBondContact O-CB 3.29Å; T780-S783 PolarHBondContact O-N 3.22Å; T780-S783 VanDerWaalsContact O-N 3.13Å; T780-S783 PolarHBondContact O-OG 3.15Å; A781-S783 PolarHBondContact O-N 3.31Å
784	W	92.8	Very high	89.7	Confident	26 Å²	26	56 Å²	56	10%	0.098	30%	0.302	C	S	.	.	H	α-helix	trans	-108	-19.5	-178.8	50.3	-99	0	0	0	114.2	Y740 G756 I758 P759 V764 T780 A781 K782 N786	Y740-W784 AromaticContact CE2-CH2 3.72Å; Y740-W784 HydrophobicContact CE2-CH2 3.72Å; Y740-W784 AromaticContact CE2-CZ3 3.73Å; Y740-W784 HydrophobicContact CE2-CZ3 3.73Å; Y740-W784 AromaticContact CZ-CZ3 3.86Å; Y740-W784 WeakPolarHBondContact OH-CZ3 3.39Å; G756-W784 WeakPolarHBondContact CA-O 3.48Å; I758-W784 HydrophobicContact CB-CZ3 4.44Å; I758-W784 HydrophobicContact CG1-CE3 4.3Å; I758-W784 HydrophobicContact CG1-CH2 4.31Å; I758-W784 HydrophobicContact CG1-CZ3 3.71Å; P759-W784 HydrophobicContact CG-CB 3.43Å; P759-W784 VanDerWaalsContact CG-CB 3.43Å; P759-W784 HydrophobicContact CG-CD2 4.31Å; P759-W784 HydrophobicContact CG-CG 3.61Å; V764-W784 HydrophobicContact CG2-CH2 3.78Å; V764-W784 HydrophobicContact CG2-CZ2 4.46Å; T780-W784 PolarHBondContact O-NE1 3.12Å; A781-W784 HydrophobicContact CB-CZ2 4.01Å; A781-W784 PolarHBondContact O-N 3.28Å; K782-W784 VanDerWaalsContact C-N 3.26Å; K782-W784 PolarHBondContact O-N 3.33Å; W784-N786 PolarHBondContact O-N 2.83Å
785	M	92.8	Very high	88.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-26.3	170.3	-75.9	175.7	176.2	0	0	113.2	L719 Y740 V743 L747 V754 I755 G756 A781 L787	L719-M785 HydrophobicContact CD2-CE 3.75Å; L719-M785 HydrophobicContact CD2-SD 4.03Å; Y740-M785 HydrophobicContact CD2-CE 4.34Å; Y740-M785 HydrophobicContact CE2-CE 3.58Å; V743-M785 HydrophobicContact CG1-CE 3.77Å; L747-M785 HydrophobicContact CD1-SD 4.12Å; V754-M785 HydrophobicContact CG1-CB 4.11Å; V754-M785 HydrophobicContact CG1-CG 4.24Å; V754-M785 WeakPolarHBondContact CG1-O 3.36Å; V754-M785 HydrophobicContact CG2-CB 4.38Å; V754-M785 HydrophobicContact CG2-CG 4.43Å; I755-M785 PolarHBondContact N-O 3.21Å; G756-M785 PolarHBondContact N-O 2.95Å; A781-M785 HydrophobicContact CB-CE 4.1Å; A781-M785 HydrophobicContact CB-SD 4.36Å; A781-M785 WeakPolarHBondContact O-CB 3.23Å; A781-M785 VanDerWaalsContact O-CG 3.25Å; A781-M785 WeakPolarHBondContact O-CG 3.49Å; A781-M785 PolarHBondContact O-N 3.37Å; M785-L787 HydrophobicContact CB-CD2 3.82Å; M785-L787 HydrophobicContact CB-CG 4.23Å; M785-L787 PolarHBondContact O-N 3.5Å; M785-L787 HydrophobicContact SD-CD2 4.44Å
786	N	91.7	Very high	88.6	Confident	81 Å²	81	63.5 Å²	63.5	43%	0.433	34%	0.338	S	S	.	.			trans	50.6	60	178.3	-171.1	10.9	0	0	0	112.2	I755 W784 K788	I755-N786 HydrophobicContact CD1-CB 4.42Å; I755-N786 VanDerWaalsContact CD1-ND2 3.26Å; I755-N786 WeakPolarHBondContact CD1-ND2 3.4Å; I755-N786 HydrophobicContact CG1-CB 4.04Å; I755-N786 WeakPolarHBondContact CG1-O 3.24Å; W784-N786 PolarHBondContact O-N 2.83Å; N786-K788 PolarHBondContact O-N 3.08Å
787	L	91.3	Very high	88.5	Confident	46 Å²	46	60.2 Å²	60.2	24%	0.241	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	125.9	-171.5	-58.1	179.2	0	0	0	112.1	L747 E753 V754 K782 M785	L747-L787 HydrophobicContact CD1-CD2 3.84Å; E753-L787 WeakPolarHBondContact O-CA 3.49Å; V754-L787 HydrophobicContact CG2-CD2 3.72Å; K782-L787 HydrophobicContact CG-CD1 4.27Å; M785-L787 HydrophobicContact CB-CD2 3.82Å; M785-L787 HydrophobicContact CB-CG 4.23Å; M785-L787 PolarHBondContact O-N 3.5Å; M785-L787 HydrophobicContact SD-CD2 4.44Å
788	K	89.3	Confident	88.5	Confident	116 Å²	116	61.7 Å²	61.7	50%	0.504	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	162.8	173.7	-72.9	-170.8	176.5	167.8	0	111.5	K752 E753 I755 N786 S790	K752-K788 CarbonylContact C-O 3.47Å; K752-K788 VanDerWaalsContact CA-O 3.28Å; K752-K788 WeakPolarHBondContact CA-O 3.42Å; E753-K788 PolarHBondContact N-O 3.33Å; E753-K788 PolarHBondContact O-N 3.36Å; I755-K788 HydrophobicContact CD1-CD 3.51Å; I755-K788 HydrophobicContact CD1-CG 4.05Å; I755-K788 HydrophobicContact CG1-CD 4.1Å; I755-K788 HydrophobicContact CG1-CG 4.19Å; N786-K788 PolarHBondContact O-N 3.08Å; K788-S790 PolarHBondContact O-N 3.33Å
789	S	86.5	Confident	88.5	Confident	92 Å²	92	62.1 Å²	62.1	64%	0.643	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.2	172.2	-60.5	0	0	0	0	109.9
790	S	80.4	Confident	88.6	Confident	30 Å²	30	54.2 Å²	54.2	21%	0.21	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-67.8	133.3	-178.3	65.4	0	0	0	0	110.7	G751 K788	G751-S790 VanDerWaalsContact C-OG 3.27Å; G751-S790 VanDerWaalsContact CA-OG 3.26Å; G751-S790 WeakPolarHBondContact CA-OG 3.25Å; G751-S790 PolarHBondContact O-N 2.96Å; G751-S790 PolarHBondContact O-OG 3.09Å; K788-S790 PolarHBondContact O-N 3.33Å
791	P	80.6	Confident	88.6	Confident	44 Å²	44	53.5 Å²	53.5	29%	0.286	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-53.4	140.7	169.3	-24.8	29.6	0	0	0	113.5	E753 W793 Y794	E753-P791 WeakPolarHBondContact OE2-CD 3.33Å; P791-W793 HydrophobicContact CB-CG 4.15Å; P791-W793 PolarHBondContact O-N 3.26Å; P791-Y794 HydrophobicContact CB-CD2 4.05Å; P791-Y794 HydrophobicContact CB-CE2 4.26Å; P791-Y794 HydrophobicContact CG-CD2 4.1Å; P791-Y794 HydrophobicContact CG-CE2 3.85Å; P791-Y794 WeakPolarHBondContact O-CD2 3.48Å; P791-Y794 PolarHBondContact O-N 2.87Å
792	S	76.3	Confident	88.7	Confident	103 Å²	103	60.5 Å²	60.5	72%	0.72	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-62.8	-26.7	179.4	55.1	0	0	0	0	113.6	Y794 R795	S792-Y794 PolarHBondContact O-N 3.38Å; S792-R795 WeakPolarHBondContact O-CB 3.29Å; S792-R795 PolarHBondContact O-N 3.01Å
793	W	81.2	Confident	88.8	Confident	72 Å²	72	60.2 Å²	60.2	27%	0.273	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-67.5	-17.3	-178.5	68.9	-101.1	0	0	0	113.8	T472 P791 R795 S796 L797	T472-W793 HydrophobicContact CG2-CH2 4.09Å; T472-W793 HydrophobicContact CG2-CZ3 4.44Å; P791-W793 HydrophobicContact CB-CG 4.15Å; P791-W793 PolarHBondContact O-N 3.26Å; W793-R795 PolarHBondContact O-N 2.81Å; W793-S796 PolarHBondContact O-N 3.45Å; W793-S796 PolarHBondContact O-OG 3Å; W793-L797 HydrophobicContact CE3-CD2 4.41Å; W793-L797 HydrophobicContact CE3-CG 4.35Å; W793-L797 HydrophobicContact CZ3-CD1 4.02Å; W793-L797 HydrophobicContact CZ3-CD2 4.07Å; W793-L797 HydrophobicContact CZ3-CG 4.14Å
794	Y	83.2	Confident	89	Confident	9 Å²	9	56.1 Å²	56.1	4%	0.035	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-57.6	-31.3	172.4	-83.5	-67.8	0	0	0	112	T472 L502 M748 E753 P791 S792 S796 L797	T472-Y794 HydrophobicContact CG2-CD1 4.38Å; T472-Y794 HydrophobicContact CG2-CE1 3.5Å; L502-Y794 HydrophobicContact CD2-CD1 4.38Å; L502-Y794 HydrophobicContact CD2-CE1 4.46Å; M748-Y794 HydrophobicContact CE-CD1 3.56Å; M748-Y794 HydrophobicContact CE-CD2 4.3Å; M748-Y794 HydrophobicContact CE-CE1 3.45Å; M748-Y794 VanDerWaalsContact CE-CE1 3.45Å; M748-Y794 HydrophobicContact CE-CE2 4.21Å; M748-Y794 HydrophobicContact CE-CG 4.01Å; E753-Y794 WeakPolarHBondContact OE1-CE2 3.35Å; E753-Y794 VanDerWaalsContact OE1-CZ 3.31Å; E753-Y794 PolarHBondContact OE1-OH 3.42Å; E753-Y794 WeakPolarHBondContact OE2-CE2 3.5Å; P791-Y794 HydrophobicContact CB-CD2 4.05Å; P791-Y794 HydrophobicContact CB-CE2 4.26Å; P791-Y794 HydrophobicContact CG-CD2 4.1Å; P791-Y794 HydrophobicContact CG-CE2 3.85Å; P791-Y794 WeakPolarHBondContact O-CD2 3.48Å; P791-Y794 PolarHBondContact O-N 2.87Å; S792-Y794 PolarHBondContact O-N 3.38Å; Y794-S796 PolarHBondContact O-N 3.35Å; Y794-L797 HydrophobicContact CD1-CD1 3.76Å; Y794-L797 HydrophobicContact CE1-CD1 4.38Å; Y794-L797 WeakPolarHBondContact O-CB 3.44Å; Y794-L797 PolarHBondContact O-N 3.36Å
795	R	77.6	Confident	89.1	Confident	185 Å²	185	58 Å²	58	70%	0.698	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-72.4	-17	176.4	-58.6	-176.4	-177.5	-178.1	-0.6	113.4	S792 W793 L797	S792-R795 WeakPolarHBondContact O-CB 3.29Å; S792-R795 PolarHBondContact O-N 3.01Å; W793-R795 PolarHBondContact O-N 2.81Å; R795-L797 VanDerWaalsContact C-N 3.35Å
796	S	86.1	Confident	89.3	Confident	82 Å²	82	58.7 Å²	58.7	57%	0.573	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-91.1	1.4	176.8	83.2	0	0	0	0	112.9	W793 Y794	W793-S796 PolarHBondContact O-N 3.45Å; W793-S796 PolarHBondContact O-OG 3Å; Y794-S796 PolarHBondContact O-N 3.35Å
797	L	92.3	Very high	89.5	Confident	16 Å²	16	54.9 Å²	54.9	8%	0.084	30%	0.303	C	S	.	.	S	Bend	trans	-71.2	143.4	174.5	-70.7	174.5	0	0	0	110.6	K468 L469 T472 L502 W793 Y794 R795	K468-L797 HydrophobicContact CD-CD2 4.33Å; K468-L797 HydrophobicContact CG-CD2 4.22Å; L469-L797 HydrophobicContact CD1-CB 4.21Å; L469-L797 HydrophobicContact CD1-CD1 4.25Å; L469-L797 HydrophobicContact CD1-CD2 4.42Å; T472-L797 HydrophobicContact CG2-CD1 4.31Å; L502-L797 HydrophobicContact CD2-CD1 4.04Å; W793-L797 HydrophobicContact CE3-CD2 4.41Å; W793-L797 HydrophobicContact CE3-CG 4.35Å; W793-L797 HydrophobicContact CZ3-CD1 4.02Å; W793-L797 HydrophobicContact CZ3-CD2 4.07Å; W793-L797 HydrophobicContact CZ3-CG 4.14Å; Y794-L797 HydrophobicContact CD1-CD1 3.76Å; Y794-L797 HydrophobicContact CE1-CD1 4.38Å; Y794-L797 WeakPolarHBondContact O-CB 3.44Å; Y794-L797 PolarHBondContact O-N 3.36Å; R795-L797 VanDerWaalsContact C-N 3.35Å
798	P	95.2	Very high	89.7	Confident	34 Å²	34	54.4 Å²	54.4	22%	0.221	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-64.5	156.3	176.2	26.9	-32.4	0	0	0	111	E465 V466 L469 Q506 V800	E465-P798 HydrophobicContact CB-CG 4.12Å; V466-P798 HydrophobicContact CG2-CG 4.39Å; L469-P798 HydrophobicContact CB-CG 4.34Å; L469-P798 HydrophobicContact CD2-CG 4.27Å; Q506-P798 PolarHBondContact NE2-O 2.71Å; P798-V800 PolarHBondContact O-N 3.08Å
799	S	95	Very high	90.1	Very high	10 Å²	10	50.2 Å²	50.2	7%	0.07	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-68.2	125.2	179.7	-175.1	0	0	0	0	110.8	Q506 R510 A801 E802 T803	Q506-S799 VanDerWaalsContact OE1-CA 3.31Å; Q506-S799 PolarHBondContact OE1-OG 3.26Å; R510-S799 PolarHBondContact NH2-OG 3.04Å; S799-A801 PolarHBondContact O-N 3.49Å; S799-E802 WeakPolarHBondContact CB-OE2 3.19Å; S799-E802 PolarHBondContact O-N 3.16Å; S799-T803 VanDerWaalsContact O-CB 3.3Å; S799-T803 WeakPolarHBondContact O-CB 3.43Å; S799-T803 PolarHBondContact O-N 3.42Å; S799-T803 PolarHBondContact O-OG1 3.36Å
800	V	96.6	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-48.4	179.6	179.7	0	0	0	0	110.5	L469 L499 L502 E503 W538 P798 E802 T803 F804	L469-V800 HydrophobicContact CD1-CG2 4.06Å; L469-V800 HydrophobicContact CD2-CG2 4.27Å; L499-V800 HydrophobicContact CB-CG1 4.43Å; L499-V800 HydrophobicContact CD2-CG1 4.34Å; L502-V800 HydrophobicContact CB-CG2 3.84Å; E503-V800 HydrophobicContact CB-CB 3.87Å; E503-V800 HydrophobicContact CB-CG1 3.97Å; E503-V800 HydrophobicContact CB-CG2 4.26Å; E503-V800 HydrophobicContact CG-CB 4.16Å; E503-V800 HydrophobicContact CG-CG1 4.37Å; W538-V800 HydrophobicContact CZ2-CG1 3.82Å; P798-V800 PolarHBondContact O-N 3.08Å; V800-E802 VanDerWaalsContact C-N 3.31Å; V800-E802 PolarHBondContact O-N 2.88Å; V800-T803 PolarHBondContact O-N 2.9Å; V800-F804 HydrophobicContact CG1-CD2 4.09Å; V800-F804 PolarHBondContact O-N 3.05Å
801	A	93.6	Very high	91.4	Very high	39 Å²	39	44.7 Å²	44.7	32%	0.322	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-31.5	-179.7	0	0	0	0	0	114	S799 P805	S799-A801 PolarHBondContact O-N 3.49Å; A801-P805 WeakPolarHBondContact O-CA 3.29Å
802	E	94	Very high	92.1	Very high	146 Å²	146	43.9 Å²	43.9	68%	0.682	24%	0.236	S	C	*	.	H	α-helix	trans	-83.9	-30.8	176.7	-62	171.9	175	0	0	111.9	S799 V800	S799-E802 WeakPolarHBondContact CB-OE2 3.19Å; S799-E802 PolarHBondContact O-N 3.16Å; V800-E802 VanDerWaalsContact C-N 3.31Å; V800-E802 PolarHBondContact O-N 2.88Å
803	T	96.5	Very high	93.1	Very high	38 Å²	38	39 Å²	39	23%	0.233	20%	0.202	C	C	.	.	H	α-helix	trans	-72.7	-37.3	177.3	-53.1	0	0	0	0	111.1	V466 S799 V800 P805	V466-T803 HydrophobicContact CG1-CG2 4.03Å; V466-T803 HydrophobicContact CG2-CG2 3.72Å; S799-T803 VanDerWaalsContact O-CB 3.3Å; S799-T803 WeakPolarHBondContact O-CB 3.43Å; S799-T803 PolarHBondContact O-N 3.42Å; S799-T803 PolarHBondContact O-OG1 3.36Å; V800-T803 PolarHBondContact O-N 2.9Å; T803-P805 VanDerWaalsContact C-CD 3.43Å; T803-P805 WeakPolarHBondContact O-CD 3.37Å
804	F	96.2	Very high	93.8	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.035	19%	0.19	C	C	.	.	S	Bend	trans	-124.2	67.6	-179.7	-48.8	-65	0	0	0	111.3	Y462 V466 L469 L499 W538 V800 S806 T809 M810 V813	Y462-F804 HydrophobicContact CE1-CE1 4.46Å; V466-F804 HydrophobicContact CG1-CZ 4.07Å; L469-F804 HydrophobicContact CD2-CE2 3.82Å; L469-F804 HydrophobicContact CD2-CZ 4.41Å; L499-F804 HydrophobicContact CD2-CE2 4Å; W538-F804 HydrophobicContact CH2-CB 4.34Å; W538-F804 HydrophobicContact CH2-CD2 4.22Å; W538-F804 HydrophobicContact CH2-CG 4.43Å; W538-F804 HydrophobicContact CZ2-CD2 4.42Å; V800-F804 HydrophobicContact CG1-CD2 4.09Å; V800-F804 PolarHBondContact O-N 3.05Å; F804-S806 VanDerWaalsContact C-N 3.32Å; F804-S806 PolarHBondContact O-N 3.48Å; F804-T809 VanDerWaalsContact CA-OG1 3.26Å; F804-T809 WeakPolarHBondContact CA-OG1 3.33Å; F804-M810 HydrophobicContact CB-CG 4.21Å; F804-V813 HydrophobicContact CD1-CB 4.06Å; F804-V813 HydrophobicContact CD1-CG1 3.94Å; F804-V813 HydrophobicContact CD2-CG1 4.38Å; F804-V813 HydrophobicContact CE1-CB 3.56Å; F804-V813 HydrophobicContact CE1-CG1 3.89Å; F804-V813 HydrophobicContact CE1-CG2 3.79Å; F804-V813 HydrophobicContact CE2-CG1 4.32Å; F804-V813 HydrophobicContact CE2-CG2 4.25Å; F804-V813 HydrophobicContact CG-CG1 4.2Å; F804-V813 HydrophobicContact CZ-CB 3.85Å; F804-V813 HydrophobicContact CZ-CG1 4.09Å; F804-V813 HydrophobicContact CZ-CG2 3.56Å
805	P	95.1	Very high	94.3	Very high	65 Å²	65	37.8 Å²	37.8	42%	0.422	20%	0.201	S	C	.	.			trans	-77.3	-13.8	-169.6	31.7	-37.1	0	0	0	114.5	P412 V413 A801 T803	P412-P805 CarbonylContact C-O 3.57Å; P412-P805 WeakPolarHBondContact CA-O 3.45Å; V413-P805 WeakPolarHBondContact CG2-O 3.44Å; V413-P805 PolarHBondContact N-O 3.24Å; A801-P805 WeakPolarHBondContact O-CA 3.29Å; T803-P805 VanDerWaalsContact C-CD 3.43Å; T803-P805 WeakPolarHBondContact O-CD 3.37Å
806	S	96.3	Very high	95	Very high	17 Å²	17	29.1 Å²	29.1	12%	0.119	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-126.2	159.2	-176.1	65.3	0	0	0	0	111.8	V413 F804 R808 T809 M810	V413-S806 VanDerWaalsContact CG2-C 3.44Å; F804-S806 VanDerWaalsContact C-N 3.32Å; F804-S806 PolarHBondContact O-N 3.48Å; S806-R808 PolarHBondContact O-N 3.22Å; S806-T809 PolarHBondContact N-OG1 3.35Å; S806-T809 VanDerWaalsContact N-OG1 3.09Å; S806-T809 PolarHBondContact O-N 2.95Å; S806-T809 VanDerWaalsContact O-N 3.15Å; S806-T809 PolarHBondContact O-OG1 3.26Å; S806-T809 PolarHBondContact OG-N 3.32Å; S806-T809 PolarHBondContact OG-OG1 2.91Å; S806-T809 VanDerWaalsContact OG-OG1 3.13Å; S806-M810 WeakPolarHBondContact O-CG 3.36Å; S806-M810 PolarHBondContact O-N 2.94Å; S806-M810 VanDerWaalsContact O-N 3.09Å
807	I	95.6	Very high	95.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.6	-36.7	174.9	-60.3	178.9	0	0	0	110.5	H408 L409 Y416 I541 T809 M810 I811	H408-I807 HydrophobicContact CB-CD1 3.75Å; H408-I807 WeakPolarHBondContact O-CD1 3.37Å; L409-I807 HydrophobicContact CD1-CB 4.46Å; L409-I807 HydrophobicContact CD1-CG2 4.16Å; L409-I807 PolarHBondContact O-N 3.31Å; Y416-I807 HydrophobicContact CD2-CD1 3.36Å; Y416-I807 HydrophobicContact CD2-CG1 4.39Å; Y416-I807 HydrophobicContact CE2-CD1 3.71Å; Y416-I807 HydrophobicContact CG-CD1 3.92Å; I541-I807 HydrophobicContact CD1-CG1 4.39Å; I541-I807 HydrophobicContact CD1-CG2 4.3Å; I807-T809 PolarHBondContact O-N 3.43Å; I807-M810 PolarHBondContact O-N 3.48Å; I807-I811 HydrophobicContact CG2-CD1 3.78Å; I807-I811 HydrophobicContact CG2-CG1 4.21Å; I807-I811 WeakPolarHBondContact O-CG1 3.29Å; I807-I811 PolarHBondContact O-N 3.46Å
808	R	97	Very high	94.9	Very high	36 Å²	36	29.8 Å²	29.8	14%	0.136	17%	0.167	C	C	.	.	H	α-helix	trans	-51.9	-58.2	173.4	179.3	178.4	-57.7	-76.9	-3.8	111.3	L409 D410 K452 D453 V454 S806 M810 I811 E812	L409-R808 HydrophobicContact CD1-CB 4.03Å; L409-R808 VanDerWaalsContact CD2-NH2 3.33Å; L409-R808 HydrophobicContact CG-CB 4.04Å; L409-R808 WeakPolarHBondContact O-CB 3.37Å; L409-R808 PolarHBondContact O-N 3.08Å; D410-R808 VanDerWaalsContact CG-NH2 3.33Å; D410-R808 IonicContact OD1-CZ 3.91Å; D410-R808 VanDerWaalsContact OD1-CZ 3.25Å; D410-R808 IonicContact OD1-NE 3.25Å; D410-R808 PolarHBondContact OD1-NE 3.4Å; D410-R808 IonicContact OD1-NH2 2.92Å; D410-R808 PolarHBondContact OD1-NH2 3.35Å; D410-R808 IonicContact OD2-CZ 3.54Å; D410-R808 IonicContact OD2-NH2 2.62Å; D410-R808 PolarHBondContact OD2-NH2 3.15Å; K452-R808 VanDerWaalsContact O-CZ 3.28Å; K452-R808 PolarHBondContact O-NH1 3.06Å; K452-R808 PolarHBondContact O-NH2 3.31Å; D453-R808 PolarHBondContact O-NH1 3.32Å; V454-R808 HydrophobicContact CG2-CG 4.26Å; S806-R808 PolarHBondContact O-N 3.22Å; R808-M810 PolarHBondContact O-N 3.35Å; R808-I811 PolarHBondContact O-N 3.33Å; R808-I811 VanDerWaalsContact O-N 3.08Å; R808-E812 HydrophobicContact CG-CG 4.37Å; R808-E812 WeakPolarHBondContact O-CG 3.46Å; R808-E812 PolarHBondContact O-N 3.16Å
809	T	96.5	Very high	94.2	Very high	28 Å²	28	31.4 Å²	31.4	17%	0.172	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-30.9	-176.3	51.4	0	0	0	0	112.7	F804 S806 I807 V813	F804-T809 VanDerWaalsContact CA-OG1 3.26Å; F804-T809 WeakPolarHBondContact CA-OG1 3.33Å; S806-T809 PolarHBondContact N-OG1 3.35Å; S806-T809 VanDerWaalsContact N-OG1 3.09Å; S806-T809 PolarHBondContact O-N 2.95Å; S806-T809 VanDerWaalsContact O-N 3.15Å; S806-T809 PolarHBondContact O-OG1 3.26Å; S806-T809 PolarHBondContact OG-N 3.32Å; S806-T809 PolarHBondContact OG-OG1 2.91Å; S806-T809 VanDerWaalsContact OG-OG1 3.13Å; I807-T809 PolarHBondContact O-N 3.43Å; T809-V813 WeakPolarHBondContact O-CG1 3.44Å; T809-V813 PolarHBondContact O-N 3.25Å; T809-V813 VanDerWaalsContact O-N 3.16Å
810	M	97.1	Very high	93.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-45.8	171.7	-63.9	176.8	79.9	0	0	111.5	V413 W538 I541 F804 S806 I807 R808 E812 V813 L814	V413-M810 HydrophobicContact CB-SD 4.32Å; V413-M810 HydrophobicContact CG1-SD 3.89Å; V413-M810 HydrophobicContact CG2-CG 4.25Å; V413-M810 HydrophobicContact CG2-SD 3.39Å; V413-M810 WeakPolarHBondContact CG2-SD 3.26Å; W538-M810 HydrophobicContact CD2-CE 3.37Å; W538-M810 VanDerWaalsContact CE2-CE 3.49Å; W538-M810 HydrophobicContact CE3-CE 3.5Å; W538-M810 VanDerWaalsContact CE3-CE 3.5Å; W538-M810 HydrophobicContact CG-CE 3.93Å; W538-M810 HydrophobicContact CH2-CB 3.98Å; W538-M810 HydrophobicContact CH2-CE 3.83Å; W538-M810 HydrophobicContact CH2-CG 3.69Å; W538-M810 HydrophobicContact CZ2-CE 3.73Å; W538-M810 HydrophobicContact CZ2-CG 4.16Å; W538-M810 HydrophobicContact CZ3-CB 3.87Å; W538-M810 HydrophobicContact CZ3-CE 3.72Å; W538-M810 HydrophobicContact CZ3-CG 4.02Å; I541-M810 HydrophobicContact CD1-CB 4.38Å; I541-M810 HydrophobicContact CD1-CE 3.51Å; I541-M810 HydrophobicContact CD1-SD 3.4Å; I541-M810 WeakPolarHBondContact CD1-SD 3.4Å; I541-M810 HydrophobicContact CG2-CB 4.4Å; F804-M810 HydrophobicContact CB-CG 4.21Å; S806-M810 WeakPolarHBondContact O-CG 3.36Å; S806-M810 PolarHBondContact O-N 2.94Å; S806-M810 VanDerWaalsContact O-N 3.09Å; I807-M810 PolarHBondContact O-N 3.48Å; R808-M810 PolarHBondContact O-N 3.35Å; M810-E812 VanDerWaalsContact C-N 3.34Å; M810-V813 VanDerWaalsContact O-CG1 3.29Å; M810-V813 WeakPolarHBondContact O-CG1 3.28Å; M810-L814 WeakPolarHBondContact O-CB 3.48Å; M810-L814 WeakPolarHBondContact O-CG 3.32Å; M810-L814 PolarHBondContact O-N 3.09Å; M810-L814 VanDerWaalsContact O-N 3.14Å
811	I	97.1	Very high	92.8	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-41.3	177.4	-67.8	173.5	0	0	0	110.6	F367 L409 V454 I541 I807 R808 L814 N815	F367-I811 HydrophobicContact CE2-CD1 4.5Å; F367-I811 HydrophobicContact CZ-CD1 4.06Å; L409-I811 HydrophobicContact CD1-CD1 4.06Å; V454-I811 HydrophobicContact CB-CG2 4.28Å; V454-I811 HydrophobicContact CG1-CB 4.49Å; V454-I811 HydrophobicContact CG1-CG2 4.06Å; V454-I811 HydrophobicContact CG2-CB 4.3Å; V454-I811 HydrophobicContact CG2-CD1 4.48Å; V454-I811 HydrophobicContact CG2-CG2 4.07Å; I541-I811 HydrophobicContact CG2-CG1 3.66Å; I807-I811 HydrophobicContact CG2-CD1 3.78Å; I807-I811 HydrophobicContact CG2-CG1 4.21Å; I807-I811 WeakPolarHBondContact O-CG1 3.29Å; I807-I811 PolarHBondContact O-N 3.46Å; R808-I811 PolarHBondContact O-N 3.33Å; R808-I811 VanDerWaalsContact O-N 3.08Å; I811-L814 PolarHBondContact O-N 2.82Å; I811-N815 VanDerWaalsContact CG2-ND2 3.28Å; I811-N815 WeakPolarHBondContact CG2-ND2 3.42Å; I811-N815 VanDerWaalsContact O-CG 3.3Å; I811-N815 PolarHBondContact O-N 3.44Å; I811-N815 PolarHBondContact O-ND2 2.76Å
812	E	96	Very high	92.4	Very high	28 Å²	28	38.5 Å²	38.5	13%	0.131	22%	0.216	C	C	.	.	H	α-helix	trans	-54.7	-57.1	176.2	-72.9	174.2	162.4	0	0	111.3	V454 Q457 R808 M810 L814 N815 T816	V454-E812 HydrophobicContact CG1-CB 4.44Å; V454-E812 HydrophobicContact CG1-CG 3.36Å; Q457-E812 HydrophobicContact CG-CB 3.82Å; Q457-E812 HydrophobicContact CG-CG 3.91Å; Q457-E812 PolarHBondContact NE2-OE1 3.21Å; R808-E812 HydrophobicContact CG-CG 4.37Å; R808-E812 WeakPolarHBondContact O-CG 3.46Å; R808-E812 PolarHBondContact O-N 3.16Å; M810-E812 VanDerWaalsContact C-N 3.34Å; E812-L814 VanDerWaalsContact C-N 3.28Å; E812-L814 PolarHBondContact O-N 3.11Å; E812-N815 PolarHBondContact O-N 3.33Å; E812-T816 PolarHBondContact O-N 3.26Å; E812-T816 PolarHBondContact O-OG1 3.08Å; E812-T816 VanDerWaalsContact O-OG1 3.06Å
813	V	96.6	Very high	91.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-32.9	-177.1	69.2	0	0	0	0	112.8	I470 R495 L499 W538 F804 T809 M810 N815 T816	I470-V813 HydrophobicContact CD1-CG2 3.83Å; I470-V813 HydrophobicContact CG1-CG2 3.7Å; R495-V813 WeakPolarHBondContact CD-O 3.4Å; R495-V813 PolarHBondContact NH1-O 3.46Å; L499-V813 HydrophobicContact CD1-CG1 3.8Å; L499-V813 HydrophobicContact CD1-CG2 4.21Å; W538-V813 HydrophobicContact CH2-CG1 4.04Å; W538-V813 HydrophobicContact CZ3-CG1 4.14Å; F804-V813 HydrophobicContact CD1-CB 4.06Å; F804-V813 HydrophobicContact CD1-CG1 3.94Å; F804-V813 HydrophobicContact CD2-CG1 4.38Å; F804-V813 HydrophobicContact CE1-CB 3.56Å; F804-V813 HydrophobicContact CE1-CG1 3.89Å; F804-V813 HydrophobicContact CE1-CG2 3.79Å; F804-V813 HydrophobicContact CE2-CG1 4.32Å; F804-V813 HydrophobicContact CE2-CG2 4.25Å; F804-V813 HydrophobicContact CG-CG1 4.2Å; F804-V813 HydrophobicContact CZ-CB 3.85Å; F804-V813 HydrophobicContact CZ-CG1 4.09Å; F804-V813 HydrophobicContact CZ-CG2 3.56Å; T809-V813 WeakPolarHBondContact O-CG1 3.44Å; T809-V813 PolarHBondContact O-N 3.25Å; T809-V813 VanDerWaalsContact O-N 3.16Å; M810-V813 VanDerWaalsContact O-CG1 3.29Å; M810-V813 WeakPolarHBondContact O-CG1 3.28Å; V813-N815 PolarHBondContact O-N 3.09Å; V813-T816 PolarHBondContact O-N 3.17Å
814	L	96.1	Very high	89.7	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-68.1	-23.8	177.2	-71.4	178.3	0	0	0	113.2	R492 R495 A496 W538 I541 M810 I811 E812	R492-L814 HydrophobicContact CG-CB 4.03Å; R495-L814 HydrophobicContact CB-CD2 4.23Å; R495-L814 HydrophobicContact CG-CD2 4.29Å; R495-L814 PolarHBondContact NH1-O 3.14Å; A496-L814 HydrophobicContact CB-CD2 3.58Å; W538-L814 HydrophobicContact CE3-CD1 4.3Å; W538-L814 HydrophobicContact CE3-CD2 4.24Å; W538-L814 HydrophobicContact CE3-CG 4.45Å; W538-L814 HydrophobicContact CZ3-CD1 4.25Å; W538-L814 HydrophobicContact CZ3-CD2 4.11Å; W538-L814 HydrophobicContact CZ3-CG 4.07Å; I541-L814 HydrophobicContact CG2-CD1 3.91Å; M810-L814 WeakPolarHBondContact O-CB 3.48Å; M810-L814 WeakPolarHBondContact O-CG 3.32Å; M810-L814 PolarHBondContact O-N 3.09Å; M810-L814 VanDerWaalsContact O-N 3.14Å; I811-L814 PolarHBondContact O-N 2.82Å; E812-L814 VanDerWaalsContact C-N 3.28Å; E812-L814 PolarHBondContact O-N 3.11Å
815	N	94.1	Very high	87.6	Confident	50 Å²	50	49.9 Å²	49.9	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-101.6	-4.3	-177.8	-63.7	-35.7	0	0	0	113.6	L333 A363 M364 R492 I811 E812 V813	L333-N815 WeakPolarHBondContact CD1-OD1 3.49Å; A363-N815 PolarHBondContact O-ND2 3.32Å; A363-N815 PolarHBondContact O-OD1 3.23Å; M364-N815 VanDerWaalsContact CA-ND2 3.33Å; M364-N815 WeakPolarHBondContact CA-ND2 3.38Å; R492-N815 PolarHBondContact NE-OD1 3.48Å; I811-N815 VanDerWaalsContact CG2-ND2 3.28Å; I811-N815 WeakPolarHBondContact CG2-ND2 3.42Å; I811-N815 VanDerWaalsContact O-CG 3.3Å; I811-N815 PolarHBondContact O-N 3.44Å; I811-N815 PolarHBondContact O-ND2 2.76Å; E812-N815 PolarHBondContact O-N 3.33Å; V813-N815 PolarHBondContact O-N 3.09Å
816	T	92.4	Very high	84.7	Confident	3 Å²	3	55 Å²	55	2%	0.018	31%	0.308	C	S	.	.			trans	-66.7	130	176	-56.4	0	0	0	0	111.7	F459 Y462 R495 E812 V813 S818	F459-T816 HydrophobicContact CB-CG2 3.82Å; F459-T816 HydrophobicContact CD2-CG2 3.98Å; F459-T816 HydrophobicContact CG-CG2 4.41Å; Y462-T816 HydrophobicContact CD2-CG2 4.49Å; Y462-T816 HydrophobicContact CE2-CG2 3.9Å; Y462-T816 PolarHBondContact OH-OG1 3.23Å; R495-T816 PolarHBondContact NH1-O 3.39Å; R495-T816 PolarHBondContact NH2-O 3.43Å; E812-T816 PolarHBondContact O-N 3.26Å; E812-T816 PolarHBondContact O-OG1 3.08Å; E812-T816 VanDerWaalsContact O-OG1 3.06Å; V813-T816 PolarHBondContact O-N 3.17Å; T816-S818 PolarHBondContact O-N 2.72Å
817	D	88.8	Confident	84.1	Confident	106 Å²	106	56.9 Å²	56.9	57%	0.567	32%	0.318	S	S	*	.			trans	-81.7	116.6	171.6	-171.1	3.1	0	0	0	110.7	F459 S819	F459-D817 WeakPolarHBondContact CB-O 3.4Å; D817-S819 VanDerWaalsContact OD1-CB 3.27Å; D817-S819 WeakPolarHBondContact OD1-CB 3.47Å; D817-S819 PolarHBondContact OD1-N 3.46Å; D817-S819 PolarHBondContact OD1-OG 3.3Å
818	S	87.8	Confident	83.5	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.049	33%	0.334	C	S	.	.			trans	-110.6	-0.5	180	66.2	0	0	0	0	112.8	D474 R495 T816 S820 H821 C822	D474-S818 WeakPolarHBondContact OD2-CB 3.23Å; D474-S818 PolarHBondContact OD2-OG 3.35Å; R495-S818 PolarHBondContact NH2-OG 2.93Å; T816-S818 PolarHBondContact O-N 2.72Å; S818-S820 VanDerWaalsContact C-N 3.31Å; S818-S820 PolarHBondContact O-N 3.08Å; S818-H821 PolarHBondContact O-N 3.37Å; S818-C822 PolarHBondContact O-N 2.94Å
819	S	79.9	Confident	82.7	Confident	67 Å²	67	61.2 Å²	61.2	47%	0.469	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.8	-164.1	61.3	0	0	0	0	114.5	D817	D817-S819 VanDerWaalsContact OD1-CB 3.27Å; D817-S819 WeakPolarHBondContact OD1-CB 3.47Å; D817-S819 PolarHBondContact OD1-N 3.46Å; D817-S819 PolarHBondContact OD1-OG 3.3Å
820	S	79.5	Confident	81.9	Confident	96 Å²	96	63.1 Å²	63.1	67%	0.671	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-16.7	176.1	52.4	0	0	0	0	114.2	S818	S818-S820 VanDerWaalsContact C-N 3.31Å; S818-S820 PolarHBondContact O-N 3.08Å
821	H	82.9	Confident	81	Confident	82 Å²	82	66.9 Å²	66.9	38%	0.38	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-34	-171.2	-62.9	94.8	0	0	0	112.9	F459 D460 S818	F459-H821 HydrophobicContact CD1-CB 3.61Å; F459-H821 AromaticContact CD1-CG 3.52Å; F459-H821 AromaticContact CD1-ND1 3.79Å; F459-H821 HydrophobicContact CE1-CB 3.43Å; F459-H821 VanDerWaalsContact CE1-CB 3.43Å; F459-H821 AromaticContact CE1-CG 3.87Å; F459-H821 HydrophobicContact CG-CB 4.36Å; F459-H821 HydrophobicContact CZ-CB 4.04Å; D460-H821 IonicContact OD1-CD2 3.43Å; D460-H821 IonicContact OD1-NE2 2.7Å; S818-H821 PolarHBondContact O-N 3.37Å
822	C	85.9	Confident	79.9	Confident	20 Å²	20	71.1 Å²	71.1	14%	0.135	40%	0.401	C	S	.	.	S	Bend	trans	-82.6	124.2	179.9	-61.5	0	0	0	0	110.6	C471 S818 K824	C471-C822 WeakPolarHBondContact CA-SG 3.43Å; C471-C822 HydrophobicContact CB-CB 3.7Å; C471-C822 WeakPolarHBondContact CB-SG 3.4Å; C471-C822 WeakPolarHBondContact SG-CA 3.25Å; C471-C822 WeakPolarHBondContact SG-CB 3.05Å; C471-C822 CovalentContact SG-SG 2.04Å; C471-C822 PolarHBondContact SG-SG 3.06Å; S818-C822 PolarHBondContact O-N 2.94Å; C822-K824 PolarHBondContact O-N 3.31Å
823	P	71.1	Confident	78.7	Confident	105 Å²	105	74.2 Å²	74.2	68%	0.682	42%	0.42	S	S	*	.			trans	-62.6	126.6	178.6	24	-31.6	0	0	0	109.7	K825	P823-K825 VanDerWaalsContact C-N 3.3Å; P823-K825 PolarHBondContact O-N 3.4Å
824	K	62.1	Low	77.4	Confident	201 Å²	201	79.9 Å²	79.9	87%	0.874	45%	0.453	S	S	*	.			trans	-65	93.9	167.5	-67.5	-177.1	-178.8	179.5	0	107.4	C822 S826	C822-K824 PolarHBondContact O-N 3.31Å; K824-S826 PolarHBondContact O-N 3.01Å
825	K	52.1	Low	75.8	Confident	125 Å²	125	86.2 Å²	86.2	54%	0.543	49%	0.488	S	S	.	.			trans	-65.2	107.8	168.6	-79.4	-173.8	178.1	177.8	0	107.3	P823	P823-K825 VanDerWaalsContact C-N 3.3Å; P823-K825 PolarHBondContact O-N 3.4Å
826	S	33.3	Very low	74.2	Confident	172 Å²	172	89.5 Å²	89.5	100%	1.203	51%	0.508	S	S	*	.			trans	-58.3	0	174.6	56.1	0	0	0	0	111.6	K824	K824-S826 PolarHBondContact O-N 3.01Å

Retrieved 826 of 826 residues in 178.6 ms (Link to these results)

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