G4VIK1_SCHMA Loading...

RUN domain-containing protein

AlphaFold DB , UniProt , Accession G4VIK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 823 aa.

						>G4VIK1_SCHMA|G4VIK1
MSFIQPSNQQINCTSCGEEVFSLVEENGRPKERWTPLGANASPEPGYHAFEENHIDNEFDHESELSRLAIENEHLNSLLMAFTSHIAQVQFRLGQVINAESDSRELMLKSLEEFASRGIPDLQSLAEQCGKLSSESKAYTSSLDGRPQKMIEQLKRHLDDLERFAYETGEQSEPPTQAILEKQRLVLEGLREKLELNISNVDKLPAAELQQVVDKAVNQFLNPVKVNEKLVEQLKTQVNDLERFIDFLHGSGACSDILAKALADFKRTHQQLSANNEIPSCCNYSNRSHTQNNDNNDNDNLDNSSTFSSHIHPGVQLGHSRHLHSDYQHNHTNDYVDAYLEDMTTTEEQELRCGKNRKRDVRKSRFTIINLIQRAITLLNLFAASQLGQDPDTLLTKLNMNKHSTHKVDKSNSSTVEKAKTQHWGTIRARLEIAVNMVQEKVVTLNTYKLGKTSTVNLYSTYHTMPNIIHSCTTKSEIPNTVPSGRESPDGKASMPACGSTIRSYASLRKGFSQDEVPGTQIALPVQNLHDASLRALLYGGRPDRIFSNPTLHNDKNELTSCTGDMDDTESGSCETSEFLYPEAERAVVHVVRRYLCPALRDLIEHGLIKKALQKVDENPPLGLTNKRSILLLRPILNCLDSRSRNHSEDKFECLDLNDLSSDYIDTNSFSGSRSNCIGIHAWDVLMRFYQIKNGPRYNESPVKKLCESFDLDTVDGKTITNRQKFFSAMGNVLQGHVAYKRSKDAKFKAFISIALNEGKLVPWLRMIFRNHVFVQSIYEPWSYTLSTGFNDTLQSLVKLKDFEFALPYDYSIRHLKEMHDAF
					

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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	35.3	Very low	33.9	Very low	232 Å²	232	163.3 Å²	163.3	100%	1.143	85%	0.849	S	S	*	*				0	78.9	0	-62.5	112	172.5	0	0	107.3
2	S	34.7	Very low	33.6	Very low	93 Å²	93	161.3 Å²	161.3	65%	0.65	84%	0.841	S	S	*	*				82.4	84.6	86.7	59.4	0	0	0	0	111
3	F	33.2	Very low	33.2	Very low	195 Å²	195	156.8 Å²	156.8	86%	0.855	83%	0.829	S	S	*	*				79	137.3	84.6	-70.8	-37.2	0	0	0	111.5
4	I	35.8	Very low	33.2	Very low	150 Å²	150	154.8 Å²	154.8	77%	0.769	83%	0.827	S	S	*	*			cis	-151.7	173	5.7	-117.7	159.1	0	0	0	110.6
5	Q	29.2	Very low	33.2	Very low	181 Å²	181	151.9 Å²	151.9	85%	0.846	82%	0.824	S	S	*	*			trans	-77.4	178.8	178.3	-109.5	-177.7	-97.8	0	0	114
6	P	40.2	Very low	33.1	Very low	113 Å²	113	150.7 Å²	150.7	73%	0.734	83%	0.828	S	S	*	*			trans	-92.2	171.7	-160.2	38.5	-39.9	0	0	0	115.7
7	S	37.4	Very low	33	Very low	117 Å²	117	146.2 Å²	146.2	82%	0.818	83%	0.825	S	S	*	*			trans	-145.8	139.3	170.3	-57.8	0	0	0	0	112.3
8	N	29.8	Very low	32.9	Very low	164 Å²	164	148.4 Å²	148.4	88%	0.877	83%	0.827	S	S	*	*			trans	-90.5	134.1	161	-78.9	-35.8	0	0	0	109.3
9	Q	35.2	Very low	32.8	Very low	199 Å²	199	150.1 Å²	150.1	93%	0.93	83%	0.828	S	S	*	*			trans	-164.4	156.4	156	-114.7	160.4	15.9	0	0	112.8
10	Q	27.4	Very low	33	Very low	186 Å²	186	148.3 Å²	148.3	87%	0.869	82%	0.821	S	S	*	*			trans	-100	126	-170.7	-59.6	150.8	-81.5	0	0	112.3
11	I	35.1	Very low	32.9	Very low	166 Å²	166	150.7 Å²	150.7	85%	0.851	82%	0.823	S	S	*	*			trans	-147.2	105.7	157.8	-49.5	178.7	0	0	0	104.8
12	N	29.5	Very low	32.6	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	80%	0.796	S	S	*	*			cis	85.2	131.5	43.3	-151.5	20.8	0	0	0	113.4
13	C	29.3	Very low	32.5	Very low	103 Å²	103	147 Å²	147	70%	0.696	81%	0.807	S	S	*	*			trans	68.1	144.5	176	-54.2	0	0	0	0	117.1
14	T	32.8	Very low	32.5	Very low	129 Å²	129	143.3 Å²	143.3	79%	0.791	80%	0.8	S	S	*	*			cis	-160.6	150.5	-5.8	5	0	0	0	0	112.5
15	S	32.5	Very low	32.7	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	80%	0.803	S	S	*	*			trans	47.5	121	146.8	-165.1	0	0	0	0	121.6
16	C	31.7	Very low	33.4	Very low	132 Å²	132	144.4 Å²	144.4	89%	0.892	80%	0.802	S	S	*	*				-167.1	117.6	115.4	-134	0	0	0	0	113.7
17	G	31.8	Very low	33.4	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	80%	0.797	S	S	*	*			trans	78.4	75.4	150.5	0	0	0	0	0	119.7
18	E	30.6	Very low	33.2	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	79%	0.794	S	S	*	*			trans	-90.2	111.8	155	-69	-173	135.6	0	0	110.3	V20	E18-V20 PolarHBondContact O-N 3.17Å
19	E	31.6	Very low	33.6	Very low	180 Å²	180	145.4 Å²	145.4	84%	0.841	79%	0.792	S	S	*	*			trans	-91.1	86	160.7	-77.5	-165.4	164.3	0	0	109.4	F21	E19-F21 PolarHBondContact O-N 3.42Å
20	V	36.1	Very low	33.9	Very low	114 Å²	114	141.7 Å²	141.7	69%	0.691	79%	0.786	S	S	*	*			trans	-64.1	117.4	166.4	177.4	0	0	0	0	108.1	E18 S22	E18-V20 PolarHBondContact O-N 3.17Å; V20-S22 PolarHBondContact O-N 2.82Å
21	F	31.6	Very low	34.9	Very low	199 Å²	199	142.6 Å²	142.6	87%	0.873	79%	0.787	S	S	*	*			trans	-73	74.2	172.5	-113.3	-85.6	0	0	0	110.5	E19 L23	E19-F21 PolarHBondContact O-N 3.42Å; F21-L23 PolarHBondContact O-N 3.34Å
22	S	29.8	Very low	35.6	Very low	81 Å²	81	143 Å²	143	57%	0.566	79%	0.785	S	S	*	*			trans	-61.5	117.8	173.5	178	0	0	0	0	110	V20 V24	V20-S22 PolarHBondContact O-N 2.82Å; S22-V24 PolarHBondContact O-N 3.11Å; S22-V24 WeakPolarHBondContact OG-CB 3.44Å; S22-V24 WeakPolarHBondContact OG-CG2 3.28Å; S22-V24 PolarHBondContact OG-N 3.35Å
23	L	31	Very low	36.5	Very low	168 Å²	168	147 Å²	147	88%	0.88	79%	0.789	S	S	*	*			trans	-93.7	37.7	166.4	-157.8	78.1	0	0	0	111.4	F21 E25	F21-L23 PolarHBondContact O-N 3.34Å; L23-E25 VanDerWaalsContact C-N 3.26Å; L23-E25 PolarHBondContact O-N 3.21Å
24	V	34.9	Very low	37.8	Very low	117 Å²	117	153.2 Å²	153.2	71%	0.709	80%	0.798	S	S	*	*			trans	-78.2	80.5	163.9	-177.8	0	0	0	0	108.3	S22 E26	S22-V24 PolarHBondContact O-N 3.11Å; S22-V24 WeakPolarHBondContact OG-CB 3.44Å; S22-V24 WeakPolarHBondContact OG-CG2 3.28Å; S22-V24 PolarHBondContact OG-N 3.35Å; V24-E26 PolarHBondContact O-N 2.96Å
25	E	39.9	Very low	39	Very low	180 Å²	180	152.7 Å²	152.7	84%	0.841	80%	0.795	S	S	*	*			trans	-76.7	96.5	153.7	-83.4	-150.8	137.5	0	0	108.3	L23 N27	L23-E25 VanDerWaalsContact C-N 3.26Å; L23-E25 PolarHBondContact O-N 3.21Å; E25-N27 PolarHBondContact O-N 3.27Å
26	E	43.9	Very low	40.1	Very low	173 Å²	173	152.8 Å²	152.8	81%	0.808	79%	0.793	S	S	*	*	S	Bend	trans	-59.9	71.2	174.1	-173.2	-156.2	143.7	0	0	111.7	V24	V24-E26 PolarHBondContact O-N 2.96Å
27	N	39.1	Very low	40.8	Very low	121 Å²	121	155.1 Å²	155.1	65%	0.647	80%	0.796	S	S	*	*	S	Bend	trans	-165.5	30.6	164.8	-112.5	-96.1	0	0	0	114.7	E25 R29 R359	E25-N27 PolarHBondContact O-N 3.27Å; N27-R29 PolarHBondContact O-N 3.15Å; N27-R359 PolarHBondContact OD1-NH2 3.3Å
28	G	33.5	Very low	41.7	Very low	73 Å²	73	154.8 Å²	154.8	75%	0.753	79%	0.792	S	S	*	*			trans	58.9	56.7	140	0	0	0	0	0	120.6
29	R	39.1	Very low	42.5	Very low	222 Å²	222	150.3 Å²	150.3	84%	0.838	79%	0.787	S	S	*	*			trans	-144.6	130.3	146.8	-81.8	-157.8	173.9	-155.9	-6.8	111.4	N27	N27-R29 PolarHBondContact O-N 3.15Å
30	P	39.9	Very low	42.8	Very low	121 Å²	121	149.5 Å²	149.5	79%	0.786	79%	0.788	S	S	*	*			trans	-58.8	152.7	164.5	-20.8	32.9	0	0	0	111.1
31	K	50.1	Low	43.3	Very low	205 Å²	205	148.6 Å²	148.6	89%	0.891	79%	0.793	S	S	*	*			trans	-61.5	139.3	158.3	-89.9	179.6	173.5	175.5	0	108.4	R33	K31-R33 PolarHBondContact O-N 3.48Å
32	E	48.1	Very low	43.6	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	79%	0.789	S	S	*	*			trans	-58.1	109.3	-175.1	-75.6	161.1	134.6	0	0	111.4	W34	E32-W34 PolarHBondContact O-N 3.47Å
33	R	48.3	Very low	44.2	Very low	224 Å²	224	145.9 Å²	145.9	85%	0.845	80%	0.796	S	S	*	*			trans	-77.1	104.4	166	-169.6	-178	-165.3	-137	7.5	106.2	K31 T35	K31-R33 PolarHBondContact O-N 3.48Å; R33-T35 PolarHBondContact O-N 3.46Å
34	W	57.7	Low	44.7	Very low	234 Å²	234	146.8 Å²	146.8	89%	0.886	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.7	126.5	177.7	-70.6	75.8	0	0	0	109.4	E32	E32-W34 PolarHBondContact O-N 3.47Å
35	T	57.5	Low	44.9	Very low	117 Å²	117	146.6 Å²	146.6	72%	0.718	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.4	138.9	173.5	42.6	0	0	0	0	109.8	R33 L37	R33-T35 PolarHBondContact O-N 3.46Å; T35-L37 PolarHBondContact O-N 2.78Å
36	P	55.6	Low	44.9	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-55.6	129.2	175.2	-24.8	34.4	0	0	0	111.5	G38	P36-G38 PolarHBondContact O-N 3.49Å
37	L	46.1	Very low	44.5	Very low	181 Å²	181	144.4 Å²	144.4	95%	0.948	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	117.6	174.9	-63.8	171	0	0	0	108.7	T35	T35-L37 PolarHBondContact O-N 2.78Å
38	G	51.5	Low	44.5	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	137.1	-10.7	177.2	0	0	0	0	0	116.2	P36 N40	P36-G38 PolarHBondContact O-N 3.49Å; G38-N40 VanDerWaalsContact C-N 3.34Å; G38-N40 PolarHBondContact O-N 2.84Å
39	A	47.5	Very low	44.6	Very low	92 Å²	92	147.8 Å²	147.8	76%	0.76	81%	0.805	S	S	*	*			trans	-77.4	75.6	-179.4	0	0	0	0	0	113	A41	A39-A41 PolarHBondContact O-N 3.17Å
40	N	38.1	Very low	44.5	Very low	163 Å²	163	146.4 Å²	146.4	87%	0.872	81%	0.806	S	S	*	*			trans	-76.8	108.5	171.1	-70.3	-8	0	0	0	110.5	G38	G38-N40 VanDerWaalsContact C-N 3.34Å; G38-N40 PolarHBondContact O-N 2.84Å
41	A	45.3	Very low	44.4	Very low	95 Å²	95	148.9 Å²	148.9	79%	0.785	81%	0.807	S	S	*	*			trans	-129.6	131.2	170.4	0	0	0	0	0	110.3	A39	A39-A41 PolarHBondContact O-N 3.17Å
42	S	38.6	Very low	43.7	Very low	113 Å²	113	146.7 Å²	146.7	79%	0.79	80%	0.8	S	S	*	*			trans	-70.1	146.3	-179.3	-170.8	0	0	0	0	111.5
43	P	41.9	Very low	43	Very low	110 Å²	110	144.6 Å²	144.6	71%	0.714	79%	0.794	S	S	*	*			trans	-70.3	150.5	159.7	33	-35.3	0	0	0	110.6
44	E	42.4	Very low	42.5	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	79%	0.79	S	S	*	*			trans	-170.2	158.6	143.4	-99.4	-71.9	98.1	0	0	107.3
45	P	39.7	Very low	41.6	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	79%	0.787	S	S	*	*			trans	-114.4	170.8	-154.5	42.1	-36.4	0	0	0	115.6
46	G	38.3	Very low	40.9	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	78%	0.783	S	S	*	*			trans	165.4	118.4	162.3	0	0	0	0	0	113.7
47	Y	37.1	Very low	40.4	Very low	230 Å²	230	138.8 Å²	138.8	90%	0.902	78%	0.78	S	S	*	*			trans	-72.5	138.3	165.5	-74	-104.1	0	0	0	109.7
48	H	37.8	Very low	40.3	Very low	179 Å²	179	138.7 Å²	138.7	83%	0.829	77%	0.774	S	S	*	*				-159.8	131.3	127.6	-109.7	-73.7	0	0	0	109.7
49	A	35.5	Very low	40.1	Very low	85 Å²	85	143.4 Å²	143.4	70%	0.702	78%	0.776	S	S	*	*			trans	-95.5	139.6	171.4	0	0	0	0	0	109.7
50	F	37.2	Very low	40.5	Very low	193 Å²	193	144.7 Å²	144.7	85%	0.846	77%	0.77	S	S	*	*			trans	-144.2	162.4	152.8	-92.6	-68.4	0	0	0	108.9
51	E	37.8	Very low	41.2	Very low	173 Å²	173	142.5 Å²	142.5	81%	0.808	75%	0.754	S	S	*	*			trans	-97.6	168	-152.3	-64.4	159	121.4	0	0	114.5
52	E	35.2	Very low	42.1	Very low	160 Å²	160	144.8 Å²	144.8	75%	0.748	75%	0.749	S	S	*	*			trans	75.8	145.1	148.1	-101.6	-171.8	-155.7	0	0	121.6
53	N	34.4	Very low	43.8	Very low	129 Å²	129	142.4 Å²	142.4	69%	0.69	73%	0.732	S	S	*	*			trans	53.2	102.9	155.4	-48.3	-35.6	0	0	0	117.4
54	H	38.2	Very low	45.5	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.755	72%	0.72	S	S	*	*				-160.3	162.3	69.8	-142.1	-105.6	0	0	0	113.7	D56	H54-D56 IonicContact CE1-OD2 2.72Å; H54-D56 PolarHBondContact CE1-OD2 3.37Å; H54-D56 IonicContact CG-OD2 3.53Å; H54-D56 IonicContact ND1-OD2 2.69Å; H54-D56 PolarHBondContact ND1-OD2 3.41Å
55	I	38.3	Very low	46.8	Very low	161 Å²	161	137.8 Å²	137.8	83%	0.826	70%	0.704	S	S	*	*			trans	-99.4	108.6	170.2	-60.8	167.1	0	0	0	107.7
56	D	42.4	Very low	48.7	Very low	119 Å²	119	135.6 Å²	135.6	64%	0.636	69%	0.691	S	S	*	*			trans	-160.3	-18.5	170.8	-87.9	-56.6	0	0	0	115.9	H54 E58	H54-D56 IonicContact CE1-OD2 2.72Å; H54-D56 PolarHBondContact CE1-OD2 3.37Å; H54-D56 IonicContact CG-OD2 3.53Å; H54-D56 IonicContact ND1-OD2 2.69Å; H54-D56 PolarHBondContact ND1-OD2 3.41Å; D56-E58 VanDerWaalsContact C-N 3.33Å; D56-E58 PolarHBondContact O-N 3.35Å; D56-E58 VanDerWaalsContact O-N 3.09Å
57	N	45.2	Very low	50.9	Low	125 Å²	125	138 Å²	138	67%	0.668	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-0.2	-164	-69.5	-7.1	0	0	0	117.8
58	E	43.6	Very low	52.7	Low	178 Å²	178	130.6 Å²	130.6	83%	0.832	65%	0.652	S	S	*	*	H	α-helix	trans	-74.6	-29.1	-175.5	-163.6	163.1	-152.6	0	0	112.9	D56	D56-E58 VanDerWaalsContact C-N 3.33Å; D56-E58 PolarHBondContact O-N 3.35Å; D56-E58 VanDerWaalsContact O-N 3.09Å
59	F	46.5	Very low	54.6	Low	166 Å²	166	124.8 Å²	124.8	73%	0.728	64%	0.635	S	S	*	*	H	α-helix	trans	-75.5	-28	180	-124.1	-90.6	0	0	0	113.8	S63	F59-S63 PolarHBondContact O-N 2.77Å; F59-S63 PolarHBondContact O-OG 2.85Å
60	D	57	Low	56.7	Low	119 Å²	119	125.7 Å²	125.7	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-77.4	-33.8	-175.8	-141.5	26.2	0	0	0	111	S63 E64	D60-S63 WeakPolarHBondContact O-CB 3.1Å; D60-S63 PolarHBondContact O-N 2.65Å; D60-E64 PolarHBondContact O-N 2.76Å
61	H	52.5	Low	58.5	Low	118 Å²	118	120.6 Å²	120.6	55%	0.546	61%	0.606	S	S	.	*	H	α-helix	trans	-66.9	-37.2	173.6	-75.2	-39.7	0	0	0	113.6	S63 L65	H61-S63 VanDerWaalsContact C-N 3.33Å; H61-L65 VanDerWaalsContact O-CB 3.32Å; H61-L65 WeakPolarHBondContact O-CB 3.48Å; H61-L65 WeakPolarHBondContact O-CD1 3.29Å; H61-L65 WeakPolarHBondContact O-CG 3.26Å; H61-L65 PolarHBondContact O-N 3.49Å
62	E	64.9	Low	60.6	Low	143 Å²	143	117.6 Å²	117.6	67%	0.668	60%	0.595	S	S	*	*	H	α-helix	trans	-69	-35.6	173.3	-172.2	164.4	-155.4	0	0	111.2	L65 S66	E62-L65 PolarHBondContact O-N 2.76Å; E62-S66 WeakPolarHBondContact O-CB 3.36Å; E62-S66 PolarHBondContact O-N 2.99Å
63	S	72.8	Confident	62.9	Low	63 Å²	63	116.8 Å²	116.8	44%	0.441	59%	0.592	S	S	.	*	H	α-helix	trans	-64.1	-43.5	173.8	-59	0	0	0	0	112.2	F59 D60 H61 S66 R67	F59-S63 PolarHBondContact O-N 2.77Å; F59-S63 PolarHBondContact O-OG 2.85Å; D60-S63 WeakPolarHBondContact O-CB 3.1Å; D60-S63 PolarHBondContact O-N 2.65Å; H61-S63 VanDerWaalsContact C-N 3.33Å; S63-S66 PolarHBondContact O-N 3.42Å; S63-R67 PolarHBondContact O-N 2.83Å
64	E	77.9	Confident	65	Low	98 Å²	98	114.2 Å²	114.2	46%	0.458	58%	0.575	S	S	.	*	H	α-helix	trans	-68.1	-41.7	174.7	-174.4	176	-147.3	0	0	112.3	D60 S66 R67 L68	D60-E64 PolarHBondContact O-N 2.76Å; E64-S66 VanDerWaalsContact C-N 3.28Å; E64-S66 PolarHBondContact O-N 2.81Å; E64-R67 WeakPolarHBondContact O-CB 3.2Å; E64-R67 PolarHBondContact O-N 3.45Å; E64-L68 HydrophobicContact CG-CD1 4Å; E64-L68 HydrophobicContact CG-CG 4.36Å; E64-L68 WeakPolarHBondContact O-CB 3.35Å; E64-L68 WeakPolarHBondContact O-CG 3.46Å; E64-L68 PolarHBondContact O-N 3.44Å
65	L	70.5	Confident	67.1	Low	102 Å²	102	111.4 Å²	111.4	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-60.4	-38.9	174.4	-76.7	168.2	0	0	0	111.7	H61 E62 L68 A69	H61-L65 VanDerWaalsContact O-CB 3.32Å; H61-L65 WeakPolarHBondContact O-CB 3.48Å; H61-L65 WeakPolarHBondContact O-CD1 3.29Å; H61-L65 WeakPolarHBondContact O-CG 3.26Å; H61-L65 PolarHBondContact O-N 3.49Å; E62-L65 PolarHBondContact O-N 2.76Å; L65-L68 PolarHBondContact O-N 2.82Å; L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 2.9Å
66	S	79.2	Confident	69.1	Low	67 Å²	67	107.4 Å²	107.4	47%	0.469	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-45.4	173.6	-172.9	0	0	0	0	111.8	E62 S63 E64 L68 A69 I70	E62-S66 WeakPolarHBondContact O-CB 3.36Å; E62-S66 PolarHBondContact O-N 2.99Å; S63-S66 PolarHBondContact O-N 3.42Å; E64-S66 VanDerWaalsContact C-N 3.28Å; E64-S66 PolarHBondContact O-N 2.81Å; S66-L68 PolarHBondContact O-N 3.19Å; S66-A69 WeakPolarHBondContact O-CB 3.44Å; S66-A69 PolarHBondContact O-N 2.71Å; S66-I70 WeakPolarHBondContact O-CG1 3.06Å; S66-I70 PolarHBondContact O-N 3.27Å
67	R	83.8	Confident	71	Confident	126 Å²	126	104.9 Å²	104.9	48%	0.475	54%	0.537	S	S	.	.	H	α-helix	trans	-57.3	-46.7	174.3	-167.9	-166.9	67.7	67.6	1.1	111.8	S63 E64 I70 E71	S63-R67 PolarHBondContact O-N 2.83Å; E64-R67 WeakPolarHBondContact O-CB 3.2Å; E64-R67 PolarHBondContact O-N 3.45Å; R67-I70 PolarHBondContact O-N 3.24Å; R67-E71 IonicContact CZ-OE2 3.76Å; R67-E71 IonicContact NH1-OE2 3.44Å; R67-E71 PolarHBondContact NH1-OE2 2.78Å; R67-E71 IonicContact NH2-OE2 3.79Å; R67-E71 WeakPolarHBondContact O-CB 3.26Å; R67-E71 PolarHBondContact O-N 2.73Å
68	L	76.1	Confident	72.7	Confident	75 Å²	75	100.6 Å²	100.6	39%	0.393	51%	0.514	S	S	.	.	H	α-helix	trans	-68.4	-31.4	177.9	-71.9	170.3	0	0	0	112.7	E64 L65 S66 N72	E64-L68 HydrophobicContact CG-CD1 4Å; E64-L68 HydrophobicContact CG-CG 4.36Å; E64-L68 WeakPolarHBondContact O-CB 3.35Å; E64-L68 WeakPolarHBondContact O-CG 3.46Å; E64-L68 PolarHBondContact O-N 3.44Å; L65-L68 PolarHBondContact O-N 2.82Å; S66-L68 PolarHBondContact O-N 3.19Å; L68-N72 VanDerWaalsContact O-CB 3.25Å; L68-N72 WeakPolarHBondContact O-CB 3.13Å; L68-N72 PolarHBondContact O-N 2.83Å
69	A	76.6	Confident	74.7	Confident	58 Å²	58	96.5 Å²	96.5	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-43.9	174.1	0	0	0	0	0	111.6	L65 S66 N72 E73	L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 2.9Å; S66-A69 WeakPolarHBondContact O-CB 3.44Å; S66-A69 PolarHBondContact O-N 2.71Å; A69-N72 PolarHBondContact O-N 3.3Å; A69-E73 WeakPolarHBondContact O-CB 3.4Å; A69-E73 PolarHBondContact O-N 3.47Å
70	I	79.5	Confident	76.2	Confident	103 Å²	103	91.7 Å²	91.7	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-64.7	-42.5	175	-64.5	165.3	0	0	0	110.6	S66 R67 N72 E73 H74	S66-I70 WeakPolarHBondContact O-CG1 3.06Å; S66-I70 PolarHBondContact O-N 3.27Å; R67-I70 PolarHBondContact O-N 3.24Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.92Å; I70-E73 PolarHBondContact O-N 3.2Å; I70-H74 VanDerWaalsContact O-CB 3.22Å; I70-H74 WeakPolarHBondContact O-CB 3.41Å; I70-H74 PolarHBondContact O-N 2.96Å
71	E	76.9	Confident	77.4	Confident	86 Å²	86	86.8 Å²	86.8	40%	0.402	45%	0.454	S	S	.	.	H	α-helix	trans	-61.2	-39.3	175.4	-169.3	175.8	167.9	0	0	111.8	R67 H74 L75	R67-E71 IonicContact CZ-OE2 3.76Å; R67-E71 IonicContact NH1-OE2 3.44Å; R67-E71 PolarHBondContact NH1-OE2 2.78Å; R67-E71 IonicContact NH2-OE2 3.79Å; R67-E71 WeakPolarHBondContact O-CB 3.26Å; R67-E71 PolarHBondContact O-N 2.73Å; E71-H74 PolarHBondContact O-N 2.76Å; E71-L75 HydrophobicContact CG-CD1 4.34Å; E71-L75 WeakPolarHBondContact O-CB 3.15Å; E71-L75 VanDerWaalsContact O-CG 3.28Å; E71-L75 WeakPolarHBondContact O-CG 3.21Å; E71-L75 PolarHBondContact O-N 3.32Å
72	N	81.8	Confident	78.9	Confident	110 Å²	110	86.3 Å²	86.3	59%	0.588	45%	0.451	S	S	*	.	H	α-helix	trans	-71.9	-43.4	176.8	-166	-24	0	0	0	112.5	L68 A69 I70 H74 L75 N76	L68-N72 VanDerWaalsContact O-CB 3.25Å; L68-N72 WeakPolarHBondContact O-CB 3.13Å; L68-N72 PolarHBondContact O-N 2.83Å; A69-N72 PolarHBondContact O-N 3.3Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.92Å; N72-H74 PolarHBondContact O-N 2.75Å; N72-L75 PolarHBondContact O-N 2.78Å; N72-N76 WeakPolarHBondContact O-CB 3.34Å; N72-N76 PolarHBondContact O-N 3.23Å
73	E	82.6	Confident	79.8	Confident	144 Å²	144	82.2 Å²	82.2	67%	0.673	44%	0.436	S	S	*	.	H	α-helix	trans	-56.3	-40.8	172.3	-179.3	172.6	-159.5	0	0	111.2	A69 I70 N76 S77	A69-E73 WeakPolarHBondContact O-CB 3.4Å; A69-E73 PolarHBondContact O-N 3.47Å; I70-E73 PolarHBondContact O-N 3.2Å; E73-N76 PolarHBondContact O-N 3.09Å; E73-S77 WeakPolarHBondContact O-CB 3.34Å; E73-S77 PolarHBondContact O-N 3.29Å
74	H	79	Confident	80.3	Confident	75 Å²	75	81.9 Å²	81.9	35%	0.347	43%	0.433	S	S	.	.	H	α-helix	trans	-69.1	-47.5	177.7	-172.7	-173.9	0	0	0	112.8	I70 E71 N72 N76 S77 L78 L125	I70-H74 VanDerWaalsContact O-CB 3.22Å; I70-H74 WeakPolarHBondContact O-CB 3.41Å; I70-H74 PolarHBondContact O-N 2.96Å; E71-H74 PolarHBondContact O-N 2.76Å; N72-H74 PolarHBondContact O-N 2.75Å; H74-N76 VanDerWaalsContact C-N 3.27Å; H74-N76 PolarHBondContact O-N 2.86Å; H74-S77 WeakPolarHBondContact O-CB 3.27Å; H74-S77 PolarHBondContact O-N 2.7Å; H74-S77 VanDerWaalsContact O-N 3.13Å; H74-L78 WeakPolarHBondContact O-CG 3.33Å; H74-L78 PolarHBondContact O-N 2.9Å; H74-L125 WeakPolarHBondContact CE1-CD1 3.33Å; H74-L125 WeakPolarHBondContact CE1-CD2 3.13Å; H74-L125 WeakPolarHBondContact NE2-CD1 3.49Å; H74-L125 VanDerWaalsContact NE2-CD2 3.31Å; H74-L125 WeakPolarHBondContact NE2-CD2 3.31Å
75	L	81.8	Confident	80.6	Confident	104 Å²	104	78.6 Å²	78.6	55%	0.545	42%	0.418	S	S	.	.	H	α-helix	trans	-60.5	-37.5	173.8	-73.5	168.7	0	0	0	112	E71 N72 L78 L79	E71-L75 HydrophobicContact CG-CD1 4.34Å; E71-L75 WeakPolarHBondContact O-CB 3.15Å; E71-L75 VanDerWaalsContact O-CG 3.28Å; E71-L75 WeakPolarHBondContact O-CG 3.21Å; E71-L75 PolarHBondContact O-N 3.32Å; N72-L75 PolarHBondContact O-N 2.78Å; L75-L78 PolarHBondContact O-N 3.27Å; L75-L79 WeakPolarHBondContact O-CB 3.43Å; L75-L79 PolarHBondContact O-N 2.93Å
76	N	81.2	Confident	81.3	Confident	76 Å²	76	76.7 Å²	76.7	41%	0.406	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-41.2	173.2	-177.2	51	0	0	0	111.7	N72 E73 H74 L79 M80	N72-N76 WeakPolarHBondContact O-CB 3.34Å; N72-N76 PolarHBondContact O-N 3.23Å; E73-N76 PolarHBondContact O-N 3.09Å; H74-N76 VanDerWaalsContact C-N 3.27Å; H74-N76 PolarHBondContact O-N 2.86Å; N76-L79 WeakPolarHBondContact O-CB 3.28Å; N76-L79 PolarHBondContact O-N 3.36Å; N76-M80 VanDerWaalsContact O-CG 3.32Å; N76-M80 WeakPolarHBondContact O-CG 3.18Å; N76-M80 PolarHBondContact O-N 3.06Å; N76-M80 VanDerWaalsContact OD1-CE 3.26Å; N76-M80 WeakPolarHBondContact OD1-CE 3.28Å
77	S	80.7	Confident	81.6	Confident	67 Å²	67	76 Å²	76	47%	0.469	41%	0.405	S	S	.	.	H	α-helix	trans	-59.4	-46.1	173.2	-171.5	0	0	0	0	111.9	E73 H74 L79 M80 A81	E73-S77 WeakPolarHBondContact O-CB 3.34Å; E73-S77 PolarHBondContact O-N 3.29Å; H74-S77 WeakPolarHBondContact O-CB 3.27Å; H74-S77 PolarHBondContact O-N 2.7Å; H74-S77 VanDerWaalsContact O-N 3.13Å; S77-L79 VanDerWaalsContact C-N 3.32Å; S77-L79 PolarHBondContact O-N 3.42Å; S77-M80 PolarHBondContact O-N 2.8Å; S77-M80 VanDerWaalsContact O-N 3.14Å; S77-A81 PolarHBondContact O-N 3.43Å
78	L	82.3	Confident	81.8	Confident	35 Å²	35	74 Å²	74	18%	0.183	40%	0.401	C	S	.	.	H	α-helix	trans	-60.8	-39.4	174.9	-67.3	168.3	0	0	0	112	H74 L75 A81 F82 L122 L125	H74-L78 WeakPolarHBondContact O-CG 3.33Å; H74-L78 PolarHBondContact O-N 2.9Å; L75-L78 PolarHBondContact O-N 3.27Å; L78-A81 PolarHBondContact O-N 2.96Å; L78-F82 VanDerWaalsContact O-CB 3.31Å; L78-F82 WeakPolarHBondContact O-CB 3.39Å; L78-F82 PolarHBondContact O-N 3.35Å; L78-L122 HydrophobicContact CD2-CD2 3.87Å; L78-L122 HydrophobicContact CD2-CG 3.81Å; L78-L125 HydrophobicContact CD1-CD2 4.49Å
79	L	85.8	Confident	82.3	Confident	92 Å²	92	72.2 Å²	72.2	48%	0.482	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-39.3	173.8	-179.4	63.1	0	0	0	112.2	L75 N76 S77 F82 T83	L75-L79 WeakPolarHBondContact O-CB 3.43Å; L75-L79 PolarHBondContact O-N 2.93Å; N76-L79 WeakPolarHBondContact O-CB 3.28Å; N76-L79 PolarHBondContact O-N 3.36Å; S77-L79 VanDerWaalsContact C-N 3.32Å; S77-L79 PolarHBondContact O-N 3.42Å; L79-F82 PolarHBondContact O-N 2.9Å; L79-T83 HydrophobicContact CD1-CG2 4.13Å; L79-T83 WeakPolarHBondContact O-CB 3.36Å; L79-T83 WeakPolarHBondContact O-CG2 3.3Å; L79-T83 PolarHBondContact O-N 2.81Å; L79-T83 PolarHBondContact O-OG1 2.83Å
80	M	78.2	Confident	82.7	Confident	64 Å²	64	75.5 Å²	75.5	32%	0.315	40%	0.399	S	S	.	.	H	α-helix	trans	-67	-40.1	174.8	-64.4	-58.2	149.6	0	0	111.8	N76 S77 T83 S84 W424	N76-M80 VanDerWaalsContact O-CG 3.32Å; N76-M80 WeakPolarHBondContact O-CG 3.18Å; N76-M80 PolarHBondContact O-N 3.06Å; N76-M80 VanDerWaalsContact OD1-CE 3.26Å; N76-M80 WeakPolarHBondContact OD1-CE 3.28Å; S77-M80 PolarHBondContact O-N 2.8Å; S77-M80 VanDerWaalsContact O-N 3.14Å; M80-T83 PolarHBondContact O-OG1 2.89Å; M80-S84 WeakPolarHBondContact O-CB 3.38Å; M80-S84 PolarHBondContact O-N 3.42Å; M80-W424 HydrophobicContact CE-CH2 4.18Å; M80-W424 HydrophobicContact CE-CZ2 3.84Å; M80-W424 HydrophobicContact SD-CH2 3.64Å; M80-W424 HydrophobicContact SD-CZ2 3.85Å
81	A	81.4	Confident	83	Confident	16 Å²	16	75.9 Å²	75.9	13%	0.132	40%	0.397	C	S	.	.	H	α-helix	trans	-64.9	-43.2	175.1	0	0	0	0	0	111.9	S77 L78 S84 H85 I119	S77-A81 PolarHBondContact O-N 3.43Å; L78-A81 PolarHBondContact O-N 2.96Å; A81-S84 PolarHBondContact O-N 3.32Å; A81-H85 PolarHBondContact O-N 3.28Å; A81-I119 HydrophobicContact CB-CG2 3.76Å
82	F	83.6	Confident	83.3	Confident	108 Å²	108	74.2 Å²	74.2	47%	0.474	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-47.8	177	-179.3	-111.6	0	0	0	112.9	L78 L79 S84 H85 I86 I119	L78-F82 VanDerWaalsContact O-CB 3.31Å; L78-F82 WeakPolarHBondContact O-CB 3.39Å; L78-F82 PolarHBondContact O-N 3.35Å; L79-F82 PolarHBondContact O-N 2.9Å; F82-S84 VanDerWaalsContact C-N 3.32Å; F82-S84 PolarHBondContact O-N 3.18Å; F82-H85 PolarHBondContact O-N 3.33Å; F82-I86 HydrophobicContact CD1-CD1 3.91Å; F82-I86 HydrophobicContact CD2-CD1 4.4Å; F82-I86 HydrophobicContact CE1-CD1 3.47Å; F82-I86 VanDerWaalsContact CE1-CD1 3.47Å; F82-I86 HydrophobicContact CE2-CD1 4.01Å; F82-I86 HydrophobicContact CG-CD1 4.37Å; F82-I86 HydrophobicContact CZ-CD1 3.53Å; F82-I86 WeakPolarHBondContact O-CG1 3.47Å; F82-I86 PolarHBondContact O-N 2.84Å; F82-I119 HydrophobicContact CB-CD1 4.1Å; F82-I119 HydrophobicContact CD2-CD1 3.84Å; F82-I119 HydrophobicContact CG-CD1 4.47Å
83	T	84	Confident	83.5	Confident	58 Å²	58	72.6 Å²	72.6	36%	0.356	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-33.6	176.5	52.4	0	0	0	0	112.5	L79 M80 A87	L79-T83 HydrophobicContact CD1-CG2 4.13Å; L79-T83 WeakPolarHBondContact O-CB 3.36Å; L79-T83 WeakPolarHBondContact O-CG2 3.3Å; L79-T83 PolarHBondContact O-N 2.81Å; L79-T83 PolarHBondContact O-OG1 2.83Å; M80-T83 PolarHBondContact O-OG1 2.89Å; T83-A87 WeakPolarHBondContact O-CB 3Å; T83-A87 PolarHBondContact O-N 3.27Å
84	S	83.9	Confident	83.6	Confident	56 Å²	56	67.2 Å²	67.2	39%	0.392	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-44.2	171.4	-176.8	0	0	0	0	112.4	M80 A81 F82 A87 Q88	M80-S84 WeakPolarHBondContact O-CB 3.38Å; M80-S84 PolarHBondContact O-N 3.42Å; A81-S84 PolarHBondContact O-N 3.32Å; F82-S84 VanDerWaalsContact C-N 3.32Å; F82-S84 PolarHBondContact O-N 3.18Å; S84-A87 PolarHBondContact O-N 2.85Å; S84-Q88 VanDerWaalsContact O-CG 3.28Å; S84-Q88 WeakPolarHBondContact O-CG 3.49Å; S84-Q88 PolarHBondContact O-N 2.86Å; S84-Q88 PolarHBondContact O-NE2 3.44Å; S84-Q88 PolarHBondContact OG-NE2 3.44Å
85	H	82.9	Confident	83.9	Confident	29 Å²	29	67 Å²	67	13%	0.134	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-45.3	176.9	-176	-102.7	0	0	0	111.8	A81 F82 A87 Q88 V89 F114 I119	A81-H85 PolarHBondContact O-N 3.28Å; F82-H85 PolarHBondContact O-N 3.33Å; H85-A87 PolarHBondContact O-N 2.88Å; H85-Q88 PolarHBondContact O-N 3.25Å; H85-Q88 VanDerWaalsContact O-N 3.17Å; H85-V89 WeakPolarHBondContact O-CG2 3.13Å; H85-V89 PolarHBondContact O-N 3.43Å; H85-F114 AromaticContact CD2-CE1 3.99Å; H85-F114 AromaticContact CD2-CZ 3.9Å; H85-F114 AromaticContact NE2-CE1 3.99Å; H85-F114 PolarHBondContact NE2-O 3.29Å; H85-F114 VanDerWaalsContact NE2-O 3.1Å; H85-I119 HydrophobicContact CB-CD1 4.09Å; H85-I119 HydrophobicContact CB-CG1 3.77Å
86	I	85.9	Confident	84	Confident	62 Å²	62	62.4 Å²	62.4	32%	0.318	34%	0.336	S	S	.	.	H	α-helix	trans	-58.2	-46.4	173.8	-71.7	173.1	0	0	0	111.4	F82 Q88 V89 Q90	F82-I86 HydrophobicContact CD1-CD1 3.91Å; F82-I86 HydrophobicContact CD2-CD1 4.4Å; F82-I86 HydrophobicContact CE1-CD1 3.47Å; F82-I86 VanDerWaalsContact CE1-CD1 3.47Å; F82-I86 HydrophobicContact CE2-CD1 4.01Å; F82-I86 HydrophobicContact CG-CD1 4.37Å; F82-I86 HydrophobicContact CZ-CD1 3.53Å; F82-I86 WeakPolarHBondContact O-CG1 3.47Å; F82-I86 PolarHBondContact O-N 2.84Å; I86-Q88 VanDerWaalsContact C-N 3.28Å; I86-Q88 PolarHBondContact O-N 3.45Å; I86-V89 PolarHBondContact O-N 2.89Å; I86-Q90 HydrophobicContact CG2-CG 4.24Å; I86-Q90 WeakPolarHBondContact O-CB 3.23Å; I86-Q90 WeakPolarHBondContact O-CG 3.49Å; I86-Q90 PolarHBondContact O-N 2.84Å
87	A	85.8	Confident	84.1	Confident	51 Å²	51	64.3 Å²	64.3	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-36.8	178.4	0	0	0	0	0	112.2	T83 S84 H85 F91	T83-A87 WeakPolarHBondContact O-CB 3Å; T83-A87 PolarHBondContact O-N 3.27Å; S84-A87 PolarHBondContact O-N 2.85Å; H85-A87 PolarHBondContact O-N 2.88Å; A87-F91 VanDerWaalsContact O-CB 3.31Å; A87-F91 WeakPolarHBondContact O-CB 3.35Å; A87-F91 PolarHBondContact O-N 3.06Å
88	Q	86.8	Confident	84	Confident	84 Å²	84	67.9 Å²	67.9	39%	0.393	36%	0.36	S	S	.	.	H	α-helix	trans	-70.2	-38.7	175	-69.7	173.1	55.2	0	0	112.5	S84 H85 I86 R92 F114	S84-Q88 VanDerWaalsContact O-CG 3.28Å; S84-Q88 WeakPolarHBondContact O-CG 3.49Å; S84-Q88 PolarHBondContact O-N 2.86Å; S84-Q88 PolarHBondContact O-NE2 3.44Å; S84-Q88 PolarHBondContact OG-NE2 3.44Å; H85-Q88 PolarHBondContact O-N 3.25Å; H85-Q88 VanDerWaalsContact O-N 3.17Å; I86-Q88 VanDerWaalsContact C-N 3.28Å; I86-Q88 PolarHBondContact O-N 3.45Å; Q88-R92 WeakPolarHBondContact O-CB 3.21Å; Q88-R92 WeakPolarHBondContact O-CG 3.24Å; Q88-R92 PolarHBondContact O-N 3.44Å; Q88-F114 HydrophobicContact CB-CE1 3.73Å; Q88-F114 HydrophobicContact CB-CZ 3.69Å
89	V	87.6	Confident	83.8	Confident	38 Å²	38	67 Å²	67	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-48.2	172.4	170.1	0	0	0	0	110.6	H85 I86 F91 R92 L93 L111 F114 A115	H85-V89 WeakPolarHBondContact O-CG2 3.13Å; H85-V89 PolarHBondContact O-N 3.43Å; I86-V89 PolarHBondContact O-N 2.89Å; V89-F91 PolarHBondContact O-N 3.43Å; V89-R92 PolarHBondContact O-N 2.92Å; V89-L93 WeakPolarHBondContact O-CB 3.49Å; V89-L93 PolarHBondContact O-N 2.93Å; V89-L111 HydrophobicContact CB-CD1 4.44Å; V89-L111 HydrophobicContact CG1-CD1 4.11Å; V89-L111 HydrophobicContact CG2-CD1 4.5Å; V89-F114 HydrophobicContact CG2-CD1 3.91Å; V89-F114 HydrophobicContact CG2-CE1 3.81Å; V89-A115 HydrophobicContact CG2-CB 4.39Å
90	Q	85.1	Confident	83.3	Confident	127 Å²	127	70.7 Å²	70.7	59%	0.593	37%	0.372	S	S	*	.	H	α-helix	trans	-60	-43.6	177.6	-73.9	175.7	-15.2	0	0	112.1	I86 L93 G94	I86-Q90 HydrophobicContact CG2-CG 4.24Å; I86-Q90 WeakPolarHBondContact O-CB 3.23Å; I86-Q90 WeakPolarHBondContact O-CG 3.49Å; I86-Q90 PolarHBondContact O-N 2.84Å; Q90-L93 PolarHBondContact O-N 2.87Å; Q90-G94 PolarHBondContact O-N 3.38Å
91	F	85.7	Confident	83.1	Confident	112 Å²	112	71 Å²	71	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-45.4	177.3	-178.2	-100.7	0	0	0	112.3	A87 V89 L93 G94 Q95 M465	A87-F91 VanDerWaalsContact O-CB 3.31Å; A87-F91 WeakPolarHBondContact O-CB 3.35Å; A87-F91 PolarHBondContact O-N 3.06Å; V89-F91 PolarHBondContact O-N 3.43Å; F91-L93 VanDerWaalsContact C-N 3.34Å; F91-L93 PolarHBondContact O-N 3.45Å; F91-G94 PolarHBondContact O-N 3.24Å; F91-Q95 HydrophobicContact CE1-CG 4.42Å; F91-Q95 VanDerWaalsContact CE1-NE2 3.28Å; F91-Q95 PolarHBondContact O-N 2.85Å; F91-Q95 VanDerWaalsContact O-N 3.13Å; F91-M465 HydrophobicContact CD1-CE 3.82Å; F91-M465 HydrophobicContact CE1-CE 3.57Å
92	R	83.3	Confident	82.6	Confident	51 Å²	51	77.6 Å²	77.6	19%	0.192	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-38.4	174.3	-74.2	178	-178.1	-128.9	3.3	112.2	Q88 V89 G94 Q95 V96 L111	Q88-R92 WeakPolarHBondContact O-CB 3.21Å; Q88-R92 WeakPolarHBondContact O-CG 3.24Å; Q88-R92 PolarHBondContact O-N 3.44Å; V89-R92 PolarHBondContact O-N 2.92Å; R92-G94 VanDerWaalsContact C-N 3.33Å; R92-G94 PolarHBondContact O-N 2.93Å; R92-Q95 WeakPolarHBondContact O-CB 3.49Å; R92-Q95 PolarHBondContact O-N 2.86Å; R92-Q95 VanDerWaalsContact O-N 3.11Å; R92-V96 WeakPolarHBondContact O-CG2 3.26Å; R92-V96 PolarHBondContact O-N 3.42Å; R92-L111 HydrophobicContact CB-CD1 3.62Å; R92-L111 HydrophobicContact CB-CD2 4.41Å; R92-L111 HydrophobicContact CG-CD1 4.45Å
93	L	86.6	Confident	82.3	Confident	76 Å²	76	74.5 Å²	74.5	40%	0.398	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-40	175.4	-174	61.8	0	0	0	111.5	V89 Q90 F91 Q95 V96 I97 L111	V89-L93 WeakPolarHBondContact O-CB 3.49Å; V89-L93 PolarHBondContact O-N 2.93Å; Q90-L93 PolarHBondContact O-N 2.87Å; F91-L93 VanDerWaalsContact C-N 3.34Å; F91-L93 PolarHBondContact O-N 3.45Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 2.95Å; L93-V96 WeakPolarHBondContact O-CB 3.32Å; L93-V96 PolarHBondContact O-N 2.93Å; L93-I97 HydrophobicContact CG-CD1 4.23Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 3.18Å; L93-L111 HydrophobicContact CB-CD2 3.96Å; L93-L111 HydrophobicContact CD1-CD2 3.97Å
94	G	83.7	Confident	82.2	Confident	30 Å²	30	75.7 Å²	75.7	31%	0.309	40%	0.403	S	S	.	.	H	α-helix	trans	-61.1	-35	171.3	0	0	0	0	0	113.6	Q90 F91 R92 N98	Q90-G94 PolarHBondContact O-N 3.38Å; F91-G94 PolarHBondContact O-N 3.24Å; R92-G94 VanDerWaalsContact C-N 3.33Å; R92-G94 PolarHBondContact O-N 2.93Å; G94-N98 PolarHBondContact O-N 3.36Å; G94-N98 PolarHBondContact O-ND2 3.47Å
95	Q	84.5	Confident	82.1	Confident	70 Å²	70	80.3 Å²	80.3	33%	0.327	42%	0.419	S	S	.	.	H	α-helix	trans	-68.5	-42.6	172.5	-66.3	-177.1	-28	0	0	112.1	F91 R92 L93 I97 N98 A99	F91-Q95 HydrophobicContact CE1-CG 4.42Å; F91-Q95 VanDerWaalsContact CE1-NE2 3.28Å; F91-Q95 PolarHBondContact O-N 2.85Å; F91-Q95 VanDerWaalsContact O-N 3.13Å; R92-Q95 WeakPolarHBondContact O-CB 3.49Å; R92-Q95 PolarHBondContact O-N 2.86Å; R92-Q95 VanDerWaalsContact O-N 3.11Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 2.95Å; Q95-I97 VanDerWaalsContact C-N 3.35Å; Q95-I97 PolarHBondContact O-N 3.49Å; Q95-N98 PolarHBondContact O-N 2.9Å; Q95-A99 WeakPolarHBondContact O-CB 3.44Å; Q95-A99 PolarHBondContact O-N 3.22Å
96	V	84.7	Confident	82.1	Confident	8 Å²	8	85.2 Å²	85.2	5%	0.048	45%	0.445	C	S	.	.	H	α-helix	trans	-59.7	-41.6	176.2	166.8	0	0	0	0	112.2	R92 L93 A99 R104 M107 L108 L111	R92-V96 WeakPolarHBondContact O-CG2 3.26Å; R92-V96 PolarHBondContact O-N 3.42Å; L93-V96 WeakPolarHBondContact O-CB 3.32Å; L93-V96 PolarHBondContact O-N 2.93Å; V96-A99 PolarHBondContact O-N 2.88Å; V96-R104 HydrophobicContact CG1-CG 3.83Å; V96-M107 HydrophobicContact CG2-CB 3.74Å; V96-L108 HydrophobicContact CG1-CD1 4.46Å; V96-L108 HydrophobicContact CG1-CD2 3.71Å; V96-L108 HydrophobicContact CG1-CG 3.69Å; V96-L111 HydrophobicContact CG2-CD2 4.23Å
97	I	82.8	Confident	81.9	Confident	116 Å²	116	84.7 Å²	84.7	60%	0.595	44%	0.442	S	S	*	.	H	α-helix	trans	-64.1	-40.9	178.8	-70.3	163.8	0	0	0	111.2	L93 Q95 A99	L93-I97 HydrophobicContact CG-CD1 4.23Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 3.18Å; Q95-I97 VanDerWaalsContact C-N 3.35Å; Q95-I97 PolarHBondContact O-N 3.49Å; I97-A99 VanDerWaalsContact C-N 3.31Å; I97-A99 PolarHBondContact O-N 2.92Å
98	N	78.7	Confident	81.9	Confident	143 Å²	143	86 Å²	86	77%	0.765	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-0	-178	-67.5	-26.2	0	0	0	114.3	G94 Q95	G94-N98 PolarHBondContact O-N 3.36Å; G94-N98 PolarHBondContact O-ND2 3.47Å; Q95-N98 PolarHBondContact O-N 2.9Å
99	A	78.2	Confident	81.9	Confident	17 Å²	17	89.1 Å²	89.1	14%	0.14	45%	0.454	C	S	.	.	S	Bend	trans	-85.4	153.8	-174	0	0	0	0	0	114	Q95 V96 I97 R104 M107	Q95-A99 WeakPolarHBondContact O-CB 3.44Å; Q95-A99 PolarHBondContact O-N 3.22Å; V96-A99 PolarHBondContact O-N 2.88Å; I97-A99 VanDerWaalsContact C-N 3.31Å; I97-A99 PolarHBondContact O-N 2.92Å; A99-R104 PolarHBondContact O-NH2 2.88Å; A99-M107 HydrophobicContact CB-CE 3.32Å
100	E	75.5	Confident	81.8	Confident	168 Å²	168	89.9 Å²	89.9	79%	0.785	46%	0.461	S	S	*	.			trans	-64.7	142.7	168.8	-63.8	-177.6	158.7	0	0	111	D102 S103 R104	E100-D102 VanDerWaalsContact C-N 3.33Å; E100-D102 PolarHBondContact O-N 3.46Å; E100-S103 PolarHBondContact O-N 2.86Å; E100-S103 PolarHBondContact O-OG 2.85Å; E100-R104 PolarHBondContact O-N 3.3Å
101	S	73.6	Confident	81.8	Confident	70 Å²	70	84.6 Å²	84.6	49%	0.49	44%	0.436	S	S	.	.	H	α-helix	trans	-55.6	-41.8	-165.4	-65.6	0	0	0	0	114.5	S103 R104	S101-S103 PolarHBondContact O-N 3.49Å; S101-R104 VanDerWaalsContact O-CB 3.24Å; S101-R104 WeakPolarHBondContact O-CB 3.33Å; S101-R104 PolarHBondContact O-N 3.44Å; S101-R104 PolarHBondContact OG-NH1 3Å; S101-R104 PolarHBondContact OG-NH2 2.99Å
102	D	71.4	Confident	81.7	Confident	156 Å²	156	85.6 Å²	85.6	83%	0.834	44%	0.443	S	S	*	.	H	α-helix	trans	-66.9	-27.4	-176.4	-52.4	-8.9	0	0	0	112.2	E100	E100-D102 VanDerWaalsContact C-N 3.33Å; E100-D102 PolarHBondContact O-N 3.46Å
103	S	77.1	Confident	81.7	Confident	43 Å²	43	87.6 Å²	87.6	30%	0.301	45%	0.454	S	S	.	.	H	α-helix	trans	-86.5	-17.9	175.7	74.9	0	0	0	0	113.3	E100 S101 E105 L106 M107	E100-S103 PolarHBondContact O-N 2.86Å; E100-S103 PolarHBondContact O-OG 2.85Å; S101-S103 PolarHBondContact O-N 3.49Å; S103-E105 PolarHBondContact O-N 3.39Å; S103-L106 PolarHBondContact O-N 3.05Å; S103-M107 PolarHBondContact O-N 3.39Å; S103-M107 VanDerWaalsContact O-N 3.1Å; S103-M107 VanDerWaalsContact OG-CE 3.28Å; S103-M107 WeakPolarHBondContact OG-CE 3.4Å
104	R	83.3	Confident	81.5	Confident	82 Å²	82	85.6 Å²	85.6	31%	0.309	44%	0.443	S	S	.	.	H	α-helix	trans	-65.7	-41.2	-171.5	-165	179	-61.9	116.5	6.3	112.1	V96 A99 E100 S101 M107 L108	V96-R104 HydrophobicContact CG1-CG 3.83Å; A99-R104 PolarHBondContact O-NH2 2.88Å; E100-R104 PolarHBondContact O-N 3.3Å; S101-R104 VanDerWaalsContact O-CB 3.24Å; S101-R104 WeakPolarHBondContact O-CB 3.33Å; S101-R104 PolarHBondContact O-N 3.44Å; S101-R104 PolarHBondContact OG-NH1 3Å; S101-R104 PolarHBondContact OG-NH2 2.99Å; R104-M107 PolarHBondContact O-N 2.97Å; R104-L108 HydrophobicContact CG-CD1 4.2Å; R104-L108 WeakPolarHBondContact O-CB 3.36Å; R104-L108 VanDerWaalsContact O-CG 3.3Å; R104-L108 WeakPolarHBondContact O-CG 3.44Å; R104-L108 PolarHBondContact O-N 3.48Å
105	E	81.1	Confident	81.5	Confident	154 Å²	154	86.4 Å²	86.4	72%	0.72	45%	0.446	S	S	*	.	H	α-helix	trans	-66	-39.7	178.6	-64.6	-170.1	175	0	0	112.5	S103 L108 K109	S103-E105 PolarHBondContact O-N 3.39Å; E105-L108 PolarHBondContact O-N 2.73Å; E105-K109 WeakPolarHBondContact O-CB 3.35Å; E105-K109 PolarHBondContact O-N 3.27Å
106	L	83.5	Confident	81	Confident	131 Å²	131	87.5 Å²	87.5	69%	0.686	46%	0.461	S	S	*	.	H	α-helix	trans	-66	-41.1	176.6	-67.5	174.7	0	0	0	111.7	S103 K109 S110	S103-L106 PolarHBondContact O-N 3.05Å; L106-K109 PolarHBondContact O-N 3.47Å; L106-S110 PolarHBondContact O-N 2.86Å
107	M	81.5	Confident	80.2	Confident	51 Å²	51	94.6 Å²	94.6	25%	0.251	49%	0.487	S	S	.	.	H	α-helix	trans	-73.9	-32.6	175.9	-73.2	-172.8	-78.6	0	0	113	V96 A99 S103 R104 S110 L111	V96-M107 HydrophobicContact CG2-CB 3.74Å; A99-M107 HydrophobicContact CB-CE 3.32Å; S103-M107 PolarHBondContact O-N 3.39Å; S103-M107 VanDerWaalsContact O-N 3.1Å; S103-M107 VanDerWaalsContact OG-CE 3.28Å; S103-M107 WeakPolarHBondContact OG-CE 3.4Å; R104-M107 PolarHBondContact O-N 2.97Å; M107-S110 PolarHBondContact O-N 2.78Å; M107-L111 VanDerWaalsContact O-CB 3.25Å; M107-L111 WeakPolarHBondContact O-CB 3.46Å; M107-L111 PolarHBondContact O-N 3.25Å
108	L	85.5	Confident	79.5	Confident	80 Å²	80	90.5 Å²	90.5	42%	0.419	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-47.5	168.5	-82.6	166.8	0	0	0	111	V96 R104 E105 S110 L111 E112	V96-L108 HydrophobicContact CG1-CD1 4.46Å; V96-L108 HydrophobicContact CG1-CD2 3.71Å; V96-L108 HydrophobicContact CG1-CG 3.69Å; R104-L108 HydrophobicContact CG-CD1 4.2Å; R104-L108 WeakPolarHBondContact O-CB 3.36Å; R104-L108 VanDerWaalsContact O-CG 3.3Å; R104-L108 WeakPolarHBondContact O-CG 3.44Å; R104-L108 PolarHBondContact O-N 3.48Å; E105-L108 PolarHBondContact O-N 2.73Å; L108-S110 PolarHBondContact O-N 2.8Å; L108-L111 CarbonylContact O-C 3.6Å; L108-L111 WeakPolarHBondContact O-CB 3.35Å; L108-L111 PolarHBondContact O-N 3.46Å; L108-L111 VanDerWaalsContact O-N 3.12Å; L108-E112 WeakPolarHBondContact O-CB 3.4Å; L108-E112 PolarHBondContact O-N 3.3Å
109	K	86.2	Confident	78.9	Confident	148 Å²	148	84.5 Å²	84.5	64%	0.643	44%	0.442	S	S	*	.	H	α-helix	trans	-65.2	-36.5	178.3	-166.5	169.5	-172.5	170.3	0	112.8	E105 L106 L111 E113	E105-K109 WeakPolarHBondContact O-CB 3.35Å; E105-K109 PolarHBondContact O-N 3.27Å; L106-K109 PolarHBondContact O-N 3.47Å; K109-L111 VanDerWaalsContact C-N 3.34Å; K109-E113 WeakPolarHBondContact O-CB 3.48Å; K109-E113 PolarHBondContact O-N 3.31Å
110	S	85	Confident	78	Confident	54 Å²	54	88.5 Å²	88.5	38%	0.378	47%	0.466	S	S	.	.	H	α-helix	trans	-71.3	-28	172.6	-170.3	0	0	0	0	113.1	L106 M107 L108 F114	L106-S110 PolarHBondContact O-N 2.86Å; M107-S110 PolarHBondContact O-N 2.78Å; L108-S110 PolarHBondContact O-N 2.8Å; S110-F114 VanDerWaalsContact O-CB 3.23Å; S110-F114 WeakPolarHBondContact O-CB 3.48Å; S110-F114 PolarHBondContact O-N 3.08Å
111	L	85.1	Confident	77.1	Confident	16 Å²	16	84.6 Å²	84.6	8%	0.084	45%	0.451	C	S	.	.	H	α-helix	trans	-75.5	-41.1	173.4	-179.7	54	0	0	0	111.7	V89 R92 L93 V96 M107 L108 K109 F114 A115	V89-L111 HydrophobicContact CB-CD1 4.44Å; V89-L111 HydrophobicContact CG1-CD1 4.11Å; V89-L111 HydrophobicContact CG2-CD1 4.5Å; R92-L111 HydrophobicContact CB-CD1 3.62Å; R92-L111 HydrophobicContact CB-CD2 4.41Å; R92-L111 HydrophobicContact CG-CD1 4.45Å; L93-L111 HydrophobicContact CB-CD2 3.96Å; L93-L111 HydrophobicContact CD1-CD2 3.97Å; V96-L111 HydrophobicContact CG2-CD2 4.23Å; M107-L111 VanDerWaalsContact O-CB 3.25Å; M107-L111 WeakPolarHBondContact O-CB 3.46Å; M107-L111 PolarHBondContact O-N 3.25Å; L108-L111 CarbonylContact O-C 3.6Å; L108-L111 WeakPolarHBondContact O-CB 3.35Å; L108-L111 PolarHBondContact O-N 3.46Å; L108-L111 VanDerWaalsContact O-N 3.12Å; K109-L111 VanDerWaalsContact C-N 3.34Å; L111-F114 HydrophobicContact CD1-CD1 4.45Å; L111-F114 PolarHBondContact O-N 3.49Å; L111-A115 VanDerWaalsContact O-CB 3.29Å; L111-A115 WeakPolarHBondContact O-CB 3.3Å; L111-A115 PolarHBondContact O-N 3.27Å
112	E	83.6	Confident	76.2	Confident	134 Å²	134	85 Å²	85	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-57.3	-48.2	170.2	178.9	-176.9	-153.5	0	0	110.7	L108 F114 A115 S116	L108-E112 WeakPolarHBondContact O-CB 3.4Å; L108-E112 PolarHBondContact O-N 3.3Å; E112-F114 PolarHBondContact O-N 3.28Å; E112-A115 PolarHBondContact O-N 3.23Å; E112-S116 VanDerWaalsContact O-CB 3.29Å; E112-S116 WeakPolarHBondContact O-CB 3.24Å; E112-S116 PolarHBondContact O-N 3.16Å; E112-S116 PolarHBondContact O-OG 3.29Å
113	E	84.6	Confident	75.5	Confident	92 Å²	92	83 Å²	83	43%	0.43	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-43	175.5	-163	-169	-171.2	0	0	111.9	K109 A115 S116 R117	K109-E113 WeakPolarHBondContact O-CB 3.48Å; K109-E113 PolarHBondContact O-N 3.31Å; E113-A115 PolarHBondContact O-N 3.44Å; E113-S116 WeakPolarHBondContact CA-OG 3.34Å; E113-S116 PolarHBondContact O-N 2.89Å; E113-S116 PolarHBondContact O-OG 2.84Å; E113-R117 HydrophobicContact CG-CG 4.42Å; E113-R117 WeakPolarHBondContact O-CB 3.23Å; E113-R117 WeakPolarHBondContact O-CD 3.41Å; E113-R117 WeakPolarHBondContact O-CG 3.29Å; E113-R117 PolarHBondContact O-N 3.25Å; E113-R117 IonicContact OE1-CZ 3.32Å; E113-R117 VanDerWaalsContact OE1-CZ 3.32Å; E113-R117 IonicContact OE1-NE 3.88Å; E113-R117 PolarHBondContact OE1-NE 3.4Å; E113-R117 IonicContact OE1-NH2 3.8Å; E113-R117 PolarHBondContact OE1-NH2 2.91Å; E113-R117 IonicContact OE2-CZ 3.32Å; E113-R117 IonicContact OE2-NH2 2.67Å; E113-R117 PolarHBondContact OE2-NH2 3.29Å
114	F	82.8	Confident	74.4	Confident	35 Å²	35	83.6 Å²	83.6	15%	0.154	44%	0.437	C	S	.	.	H	α-helix	trans	-66.8	-34.4	178	177.8	-100.4	0	0	0	113.4	H85 Q88 V89 S110 L111 E112	H85-F114 AromaticContact CD2-CE1 3.99Å; H85-F114 AromaticContact CD2-CZ 3.9Å; H85-F114 AromaticContact NE2-CE1 3.99Å; H85-F114 PolarHBondContact NE2-O 3.29Å; H85-F114 VanDerWaalsContact NE2-O 3.1Å; Q88-F114 HydrophobicContact CB-CE1 3.73Å; Q88-F114 HydrophobicContact CB-CZ 3.69Å; V89-F114 HydrophobicContact CG2-CD1 3.91Å; V89-F114 HydrophobicContact CG2-CE1 3.81Å; S110-F114 VanDerWaalsContact O-CB 3.23Å; S110-F114 WeakPolarHBondContact O-CB 3.48Å; S110-F114 PolarHBondContact O-N 3.08Å; L111-F114 HydrophobicContact CD1-CD1 4.45Å; L111-F114 PolarHBondContact O-N 3.49Å; E112-F114 PolarHBondContact O-N 3.28Å
115	A	82.3	Confident	72.6	Confident	46 Å²	46	81.6 Å²	81.6	38%	0.38	43%	0.432	S	S	.	.	H	α-helix	trans	-74.4	-40.2	175.9	0	0	0	0	0	112	V89 L111 E112 E113	V89-A115 HydrophobicContact CG2-CB 4.39Å; L111-A115 VanDerWaalsContact O-CB 3.29Å; L111-A115 WeakPolarHBondContact O-CB 3.3Å; L111-A115 PolarHBondContact O-N 3.27Å; E112-A115 PolarHBondContact O-N 3.23Å; E113-A115 PolarHBondContact O-N 3.44Å
116	S	74.6	Confident	71.4	Confident	93 Å²	93	77.2 Å²	77.2	65%	0.65	42%	0.422	S	S	*	.	H	α-helix	trans	-78.8	-23.4	-177.7	56.3	0	0	0	0	114.5	E112 E113 G118	E112-S116 VanDerWaalsContact O-CB 3.29Å; E112-S116 WeakPolarHBondContact O-CB 3.24Å; E112-S116 PolarHBondContact O-N 3.16Å; E112-S116 PolarHBondContact O-OG 3.29Å; E113-S116 WeakPolarHBondContact CA-OG 3.34Å; E113-S116 PolarHBondContact O-N 2.89Å; E113-S116 PolarHBondContact O-OG 2.84Å; S116-G118 PolarHBondContact O-N 3.04Å; S116-G118 VanDerWaalsContact O-N 3.12Å
117	R	68.9	Low	69.9	Low	157 Å²	157	77.7 Å²	77.7	59%	0.592	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.9	173.1	-82.9	170.9	179.7	-160.3	5.5	114.7	E113	E113-R117 HydrophobicContact CG-CG 4.42Å; E113-R117 WeakPolarHBondContact O-CB 3.23Å; E113-R117 WeakPolarHBondContact O-CD 3.41Å; E113-R117 WeakPolarHBondContact O-CG 3.29Å; E113-R117 PolarHBondContact O-N 3.25Å; E113-R117 IonicContact OE1-CZ 3.32Å; E113-R117 VanDerWaalsContact OE1-CZ 3.32Å; E113-R117 IonicContact OE1-NE 3.88Å; E113-R117 PolarHBondContact OE1-NE 3.4Å; E113-R117 IonicContact OE1-NH2 3.8Å; E113-R117 PolarHBondContact OE1-NH2 2.91Å; E113-R117 IonicContact OE2-CZ 3.32Å; E113-R117 IonicContact OE2-NH2 2.67Å; E113-R117 PolarHBondContact OE2-NH2 3.29Å
118	G	67	Low	68.3	Low	31 Å²	31	81.4 Å²	81.4	32%	0.32	44%	0.438	S	S	.	.			trans	69.5	-165	178.9	0	0	0	0	0	113.8	S116	S116-G118 PolarHBondContact O-N 3.04Å; S116-G118 VanDerWaalsContact O-N 3.12Å
119	I	65.4	Low	66.1	Low	16 Å²	16	81.9 Å²	81.9	8%	0.082	45%	0.447	C	S	.	.			trans	-107.7	121.1	-177.3	-68.2	158	0	0	0	108.2	A81 F82 H85 D121 L122 Q123	A81-I119 HydrophobicContact CB-CG2 3.76Å; F82-I119 HydrophobicContact CB-CD1 4.1Å; F82-I119 HydrophobicContact CD2-CD1 3.84Å; F82-I119 HydrophobicContact CG-CD1 4.47Å; H85-I119 HydrophobicContact CB-CD1 4.09Å; H85-I119 HydrophobicContact CB-CG1 3.77Å; I119-D121 VanDerWaalsContact C-N 3.3Å; I119-D121 HydrophobicContact CG2-CB 4.48Å; I119-D121 PolarHBondContact O-N 2.94Å; I119-L122 HydrophobicContact CB-CB 4.3Å; I119-L122 HydrophobicContact CB-CD1 3.95Å; I119-L122 HydrophobicContact CD1-CD1 3.84Å; I119-L122 HydrophobicContact CG1-CD1 4.5Å; I119-L122 HydrophobicContact CG2-CB 4.47Å; I119-L122 HydrophobicContact CG2-CD1 4.19Å; I119-L122 WeakPolarHBondContact O-CB 3.31Å; I119-L122 PolarHBondContact O-N 3.46Å; I119-L122 VanDerWaalsContact O-N 3.14Å; I119-Q123 PolarHBondContact O-N 3.06Å
120	P	60.4	Low	63.9	Low	102 Å²	102	76.9 Å²	76.9	66%	0.662	44%	0.438	S	S	*	.	H	α-helix	trans	-55.3	-38.8	-173.9	-29.6	36.3	0	0	0	114.8	L122 Q123 S124	P120-L122 PolarHBondContact O-N 3.42Å; P120-Q123 VanDerWaalsContact O-CB 3.23Å; P120-Q123 WeakPolarHBondContact O-CB 3.26Å; P120-Q123 PolarHBondContact O-N 3.46Å; P120-Q123 VanDerWaalsContact O-N 3.13Å; P120-S124 PolarHBondContact O-N 2.95Å
121	D	55.9	Low	61.9	Low	86 Å²	86	83.3 Å²	83.3	46%	0.46	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-39.2	-178.7	-55	-44.4	0	0	0	111.8	I119 Q123 S124 L125	I119-D121 VanDerWaalsContact C-N 3.3Å; I119-D121 HydrophobicContact CG2-CB 4.48Å; I119-D121 PolarHBondContact O-N 2.94Å; D121-Q123 VanDerWaalsContact C-N 3.29Å; D121-Q123 PolarHBondContact O-N 2.68Å; D121-S124 PolarHBondContact O-N 3.3Å; D121-S124 PolarHBondContact O-OG 3.49Å; D121-L125 PolarHBondContact O-N 3.08Å; D121-L125 VanDerWaalsContact O-N 3.08Å
122	L	54.4	Low	59.7	Low	78 Å²	78	90.6 Å²	90.6	41%	0.408	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-34.2	173.7	-87.9	157.9	0	0	0	112	L78 I119 P120 L125 A126	L78-L122 HydrophobicContact CD2-CD2 3.87Å; L78-L122 HydrophobicContact CD2-CG 3.81Å; I119-L122 HydrophobicContact CB-CB 4.3Å; I119-L122 HydrophobicContact CB-CD1 3.95Å; I119-L122 HydrophobicContact CD1-CD1 3.84Å; I119-L122 HydrophobicContact CG1-CD1 4.5Å; I119-L122 HydrophobicContact CG2-CB 4.47Å; I119-L122 HydrophobicContact CG2-CD1 4.19Å; I119-L122 WeakPolarHBondContact O-CB 3.31Å; I119-L122 PolarHBondContact O-N 3.46Å; I119-L122 VanDerWaalsContact O-N 3.14Å; P120-L122 PolarHBondContact O-N 3.42Å; L122-L125 PolarHBondContact O-N 2.91Å; L122-A126 WeakPolarHBondContact O-CB 3.2Å; L122-A126 PolarHBondContact O-N 3.34Å
123	Q	57.3	Low	57.4	Low	115 Å²	115	87.8 Å²	87.8	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-49	172.7	-150.3	79.6	13.9	0	0	110.8	I119 P120 D121 L125 A126 E127	I119-Q123 PolarHBondContact O-N 3.06Å; P120-Q123 VanDerWaalsContact O-CB 3.23Å; P120-Q123 WeakPolarHBondContact O-CB 3.26Å; P120-Q123 PolarHBondContact O-N 3.46Å; P120-Q123 VanDerWaalsContact O-N 3.13Å; D121-Q123 VanDerWaalsContact C-N 3.29Å; D121-Q123 PolarHBondContact O-N 2.68Å; Q123-L125 PolarHBondContact O-N 3.35Å; Q123-A126 PolarHBondContact O-N 3.05Å; Q123-E127 PolarHBondContact O-N 3.37Å; Q123-E127 VanDerWaalsContact O-N 3.16Å
124	S	53.5	Low	55.3	Low	54 Å²	54	89.7 Å²	89.7	38%	0.378	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-27.2	179.5	83.2	0	0	0	0	113.3	P120 D121 Q128	P120-S124 PolarHBondContact O-N 2.95Å; D121-S124 PolarHBondContact O-N 3.3Å; D121-S124 PolarHBondContact O-OG 3.49Å; S124-Q128 WeakPolarHBondContact O-CG 3.35Å; S124-Q128 PolarHBondContact O-N 2.88Å; S124-Q128 PolarHBondContact O-NE2 2.8Å
125	L	46.4	Very low	53.4	Low	40 Å²	40	96.6 Å²	96.6	21%	0.209	55%	0.548	C	S	.	.	H	α-helix	trans	-87.6	-33.5	178	-158.3	79.1	0	0	0	113.1	H74 L78 D121 L122 Q123 E127 Q128 C129	H74-L125 WeakPolarHBondContact CE1-CD1 3.33Å; H74-L125 WeakPolarHBondContact CE1-CD2 3.13Å; H74-L125 WeakPolarHBondContact NE2-CD1 3.49Å; H74-L125 VanDerWaalsContact NE2-CD2 3.31Å; H74-L125 WeakPolarHBondContact NE2-CD2 3.31Å; L78-L125 HydrophobicContact CD1-CD2 4.49Å; D121-L125 PolarHBondContact O-N 3.08Å; D121-L125 VanDerWaalsContact O-N 3.08Å; L122-L125 PolarHBondContact O-N 2.91Å; Q123-L125 PolarHBondContact O-N 3.35Å; L125-E127 PolarHBondContact O-N 3.09Å; L125-Q128 HydrophobicContact CD1-CB 4.48Å; L125-Q128 PolarHBondContact O-N 2.83Å; L125-C129 PolarHBondContact O-N 2.87Å
126	A	54.6	Low	51.4	Low	63 Å²	63	98.6 Å²	98.6	52%	0.521	56%	0.56	S	S	.	*	H	α-helix	trans	-57.3	-36.7	168.4	0	0	0	0	0	111.1	L122 Q123 G130	L122-A126 WeakPolarHBondContact O-CB 3.2Å; L122-A126 PolarHBondContact O-N 3.34Å; Q123-A126 PolarHBondContact O-N 3.05Å; A126-G130 PolarHBondContact O-N 3.45Å
127	E	52.6	Low	49.8	Very low	141 Å²	141	104 Å²	104	66%	0.659	57%	0.571	S	S	*	*	H	α-helix	trans	-69.2	-31.2	173.6	-69.1	179.2	-178.4	0	0	113.6	Q123 L125 G130	Q123-E127 PolarHBondContact O-N 3.37Å; Q123-E127 VanDerWaalsContact O-N 3.16Å; L125-E127 PolarHBondContact O-N 3.09Å; E127-G130 PolarHBondContact O-N 2.89Å
128	Q	48.3	Very low	48.5	Very low	129 Å²	129	100 Å²	100	60%	0.603	57%	0.572	S	S	*	*	H	α-helix	trans	-75	-42	174.7	-72.8	178.2	64.3	0	0	112.1	S124 L125 G130	S124-Q128 WeakPolarHBondContact O-CG 3.35Å; S124-Q128 PolarHBondContact O-N 2.88Å; S124-Q128 PolarHBondContact O-NE2 2.8Å; L125-Q128 HydrophobicContact CD1-CB 4.48Å; L125-Q128 PolarHBondContact O-N 2.83Å; Q128-G130 PolarHBondContact O-N 3.48Å
129	C	38.4	Very low	47	Very low	89 Å²	89	106.8 Å²	106.8	60%	0.601	59%	0.589	S	S	*	*	H	α-helix	trans	-65.4	-27.4	170	-70.9	0	0	0	0	112.6	L125 K131 L132	L125-C129 PolarHBondContact O-N 2.87Å; C129-K131 PolarHBondContact O-N 3.28Å; C129-L132 PolarHBondContact O-N 2.88Å
130	G	41.8	Very low	46	Very low	44 Å²	44	112.4 Å²	112.4	45%	0.454	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-60.5	-16.3	-179.3	0	0	0	0	0	115.3	A126 E127 Q128 L132 S133	A126-G130 PolarHBondContact O-N 3.45Å; E127-G130 PolarHBondContact O-N 2.89Å; Q128-G130 PolarHBondContact O-N 3.48Å; G130-L132 VanDerWaalsContact C-N 3.25Å; G130-L132 PolarHBondContact O-N 2.72Å; G130-S133 PolarHBondContact O-N 2.75Å
131	K	42.8	Very low	45.2	Very low	188 Å²	188	112.8 Å²	112.8	82%	0.817	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-74.8	-5.1	-179.7	-71.5	-177.2	178.5	174.5	0	115.3	C129	C129-K131 PolarHBondContact O-N 3.28Å
132	L	39.1	Very low	44.6	Very low	170 Å²	170	112.5 Å²	112.5	89%	0.89	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-110.9	6	176.3	-75.5	169.6	0	0	0	114.5	C129 G130	C129-L132 PolarHBondContact O-N 2.88Å; G130-L132 VanDerWaalsContact C-N 3.25Å; G130-L132 PolarHBondContact O-N 2.72Å
133	S	34.4	Very low	44.4	Very low	74 Å²	74	115 Å²	115	52%	0.517	65%	0.647	S	S	.	*			trans	-129.6	66	-177.1	-164.8	0	0	0	0	112.9	G130 E135	G130-S133 PolarHBondContact O-N 2.75Å; S133-E135 PolarHBondContact O-N 3.22Å
134	S	39.8	Very low	44	Very low	133 Å²	133	116.7 Å²	116.7	93%	0.93	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	48.4	177.6	58.8	0	0	0	0	113.7
135	E	42.6	Very low	44	Very low	179 Å²	179	115.8 Å²	115.8	84%	0.836	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.6	-20.9	-178	-147.5	164.8	-148.8	0	0	113.6	S133 K137	S133-E135 PolarHBondContact O-N 3.22Å; E135-K137 PolarHBondContact O-N 3.41Å
136	S	41.1	Very low	44.5	Very low	89 Å²	89	123.9 Å²	123.9	62%	0.622	69%	0.687	S	S	*	*			trans	-79.1	46.2	-172.7	-171.4	0	0	0	0	115.5
137	K	40.1	Very low	44.6	Very low	207 Å²	207	124.4 Å²	124.4	90%	0.9	68%	0.684	S	S	*	*	S	Bend	trans	-101.7	7.3	175.1	-89.1	-172.6	174.7	-179.3	0	115.3	E135	E135-K137 PolarHBondContact O-N 3.41Å
138	A	41.5	Very low	45.7	Very low	72 Å²	72	122 Å²	122	60%	0.595	67%	0.673	S	S	*	*	S	Bend	trans	-110.7	-5.3	-175.3	0	0	0	0	0	115.9
139	Y	37	Very low	47	Very low	174 Å²	174	122.7 Å²	122.7	68%	0.682	67%	0.674	S	S	*	*			trans	-122.4	59.6	-168.2	-66.8	-76.7	0	0	0	113.9
140	T	43.5	Very low	48.3	Very low	134 Å²	134	124.5 Å²	124.5	82%	0.822	68%	0.675	S	S	*	*	S	Bend	trans	-93.5	7.4	174.1	48.3	0	0	0	0	113.9
141	S	44.9	Very low	50.1	Low	110 Å²	110	126.6 Å²	126.6	77%	0.769	68%	0.675	S	S	*	*	S	Bend	trans	-120.5	10.7	-169.8	53.2	0	0	0	0	115.2
142	S	41.8	Very low	51.8	Low	79 Å²	79	122.4 Å²	122.4	55%	0.552	66%	0.659	S	S	*	*			trans	-133.6	32.1	-170.9	69.6	0	0	0	0	114.7
143	L	50.6	Low	53.7	Low	132 Å²	132	119.1 Å²	119.1	69%	0.691	64%	0.639	S	S	*	*			trans	-82.2	-17.8	-174	-80	165.7	0	0	0	114.9	G145	L143-G145 PolarHBondContact O-N 2.86Å
144	D	48.9	Very low	56	Low	150 Å²	150	120.2 Å²	120.2	80%	0.802	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	11.6	-175	-84.8	-21.7	0	0	0	116.3	Q148	D144-Q148 VanDerWaalsContact O-CD 3.26Å; D144-Q148 PolarHBondContact O-NE2 2.79Å; D144-Q148 PolarHBondContact O-OE1 3.43Å
145	G	53.2	Low	58	Low	35 Å²	35	120 Å²	120	36%	0.361	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.3	-3.4	-174.8	0	0	0	0	0	116.7	L143 K149	L143-G145 PolarHBondContact O-N 2.86Å; G145-K149 WeakPolarHBondContact O-CG 3.38Å
146	R	57.7	Low	60	Low	210 Å²	210	117.7 Å²	117.7	79%	0.792	60%	0.604	S	S	*	*	H	α-helix	trans	-81.5	-44	174.8	-86.9	-172.2	173	-173.2	-1.3	114.5	Q148 K149 M150	R146-Q148 PolarHBondContact O-N 3.16Å; R146-K149 PolarHBondContact O-N 2.89Å; R146-M150 PolarHBondContact O-N 2.83Å; R146-M150 VanDerWaalsContact O-N 3.16Å
147	P	57.1	Low	62.1	Low	73 Å²	73	118.6 Å²	118.6	47%	0.474	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-38.9	-176.6	24.1	-30.9	0	0	0	112.3	K149 M150 I151	P147-K149 PolarHBondContact O-N 3.27Å; P147-M150 PolarHBondContact O-N 3.36Å; P147-I151 WeakPolarHBondContact O-CB 3.37Å; P147-I151 WeakPolarHBondContact O-CD1 3.37Å; P147-I151 VanDerWaalsContact O-CG1 3.24Å; P147-I151 WeakPolarHBondContact O-CG1 3.32Å; P147-I151 PolarHBondContact O-N 2.99Å
148	Q	74.4	Confident	64.3	Low	90 Å²	90	113.9 Å²	113.9	42%	0.421	58%	0.583	S	S	.	*	H	α-helix	trans	-61.6	-45	177.2	-56.8	87.2	-21.4	0	0	111.3	D144 R146 M150 I151 E152	D144-Q148 VanDerWaalsContact O-CD 3.26Å; D144-Q148 PolarHBondContact O-NE2 2.79Å; D144-Q148 PolarHBondContact O-OE1 3.43Å; R146-Q148 PolarHBondContact O-N 3.16Å; Q148-M150 VanDerWaalsContact C-N 3.32Å; Q148-M150 PolarHBondContact O-N 2.98Å; Q148-I151 CarbonylContact O-C 3.44Å; Q148-I151 PolarHBondContact O-N 3.33Å; Q148-I151 VanDerWaalsContact O-N 3.15Å; Q148-E152 WeakPolarHBondContact O-CB 3.34Å; Q148-E152 VanDerWaalsContact O-CG 3.32Å; Q148-E152 WeakPolarHBondContact O-CG 3.33Å; Q148-E152 PolarHBondContact O-N 2.74Å
149	K	77.1	Confident	66.3	Low	144 Å²	144	113 Å²	113	63%	0.626	57%	0.568	S	S	*	*	H	α-helix	trans	-61.4	-38.9	176.8	-73.8	-177.4	178	-174.9	0	112.9	G145 R146 P147 Q153	G145-K149 WeakPolarHBondContact O-CG 3.38Å; R146-K149 PolarHBondContact O-N 2.89Å; P147-K149 PolarHBondContact O-N 3.27Å; K149-Q153 WeakPolarHBondContact O-CB 3.16Å; K149-Q153 PolarHBondContact O-N 3.12Å
150	M	65.7	Low	68.6	Low	127 Å²	127	109.3 Å²	109.3	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-67.2	-41.5	174.2	-171	-178.7	-70.4	0	0	111.4	R146 P147 Q148 Q153 L154	R146-M150 PolarHBondContact O-N 2.83Å; R146-M150 VanDerWaalsContact O-N 3.16Å; P147-M150 PolarHBondContact O-N 3.36Å; Q148-M150 VanDerWaalsContact C-N 3.32Å; Q148-M150 PolarHBondContact O-N 2.98Å; M150-Q153 PolarHBondContact O-N 3.13Å; M150-L154 HydrophobicContact CG-CD1 4.07Å; M150-L154 WeakPolarHBondContact O-CB 3.34Å; M150-L154 WeakPolarHBondContact O-CG 3.2Å; M150-L154 PolarHBondContact O-N 2.85Å
151	I	78.1	Confident	70.5	Confident	89 Å²	89	108.3 Å²	108.3	46%	0.456	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-41.7	175.8	-69.4	162.7	0	0	0	111.2	P147 Q148 Q153 L154 K155	P147-I151 WeakPolarHBondContact O-CB 3.37Å; P147-I151 WeakPolarHBondContact O-CD1 3.37Å; P147-I151 VanDerWaalsContact O-CG1 3.24Å; P147-I151 WeakPolarHBondContact O-CG1 3.32Å; P147-I151 PolarHBondContact O-N 2.99Å; Q148-I151 CarbonylContact O-C 3.44Å; Q148-I151 PolarHBondContact O-N 3.33Å; Q148-I151 VanDerWaalsContact O-N 3.15Å; I151-Q153 VanDerWaalsContact C-N 3.31Å; I151-Q153 PolarHBondContact O-N 2.87Å; I151-L154 PolarHBondContact O-N 3.47Å; I151-K155 HydrophobicContact CG2-CD 4.17Å; I151-K155 HydrophobicContact CG2-CG 4.47Å; I151-K155 WeakPolarHBondContact O-CB 3.32Å; I151-K155 VanDerWaalsContact O-CG 3.25Å; I151-K155 WeakPolarHBondContact O-CG 3.42Å; I151-K155 PolarHBondContact O-N 2.83Å
152	E	79.1	Confident	72.4	Confident	100 Å²	100	104.5 Å²	104.5	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-34	174.7	-74.5	168.5	-160.7	0	0	112.8	Q148 R156	Q148-E152 WeakPolarHBondContact O-CB 3.34Å; Q148-E152 VanDerWaalsContact O-CG 3.32Å; Q148-E152 WeakPolarHBondContact O-CG 3.33Å; Q148-E152 PolarHBondContact O-N 2.74Å; E152-R156 PolarHBondContact O-N 3.36Å; E152-R156 VanDerWaalsContact O-N 3.16Å; E152-R156 PolarHBondContact O-NE 3.47Å; E152-R156 IonicContact OE2-NH2 2.65Å
153	Q	79.2	Confident	74.3	Confident	101 Å²	101	107 Å²	107	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-76.8	-41.9	176.6	-173.9	167	-1.3	0	0	111.3	K149 M150 I151 K155 R156 H157	K149-Q153 WeakPolarHBondContact O-CB 3.16Å; K149-Q153 PolarHBondContact O-N 3.12Å; M150-Q153 PolarHBondContact O-N 3.13Å; I151-Q153 VanDerWaalsContact C-N 3.31Å; I151-Q153 PolarHBondContact O-N 2.87Å; Q153-K155 VanDerWaalsContact C-N 3.34Å; Q153-K155 PolarHBondContact O-N 3.38Å; Q153-R156 PolarHBondContact O-N 3.29Å; Q153-H157 WeakPolarHBondContact CG-NE2 3.42Å; Q153-H157 PolarHBondContact NE2-NE2 3.05Å; Q153-H157 PolarHBondContact O-CD2 3.32Å; Q153-H157 PolarHBondContact O-N 3.39Å
154	L	82.2	Confident	75.9	Confident	96 Å²	96	106.8 Å²	106.8	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-39.8	172.3	-74.4	166.8	0	0	0	112	M150 I151 H157 L158	M150-L154 HydrophobicContact CG-CD1 4.07Å; M150-L154 WeakPolarHBondContact O-CB 3.34Å; M150-L154 WeakPolarHBondContact O-CG 3.2Å; M150-L154 PolarHBondContact O-N 2.85Å; I151-L154 PolarHBondContact O-N 3.47Å; L154-H157 PolarHBondContact O-N 3.29Å; L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 VanDerWaalsContact O-CG 3.31Å; L154-L158 WeakPolarHBondContact O-CG 3.49Å; L154-L158 PolarHBondContact O-N 2.98Å
155	K	82.8	Confident	77.4	Confident	129 Å²	129	100.6 Å²	100.6	56%	0.561	48%	0.48	S	S	*	.	H	α-helix	trans	-59.8	-50.9	172.8	-79.5	177	176.3	-171.7	0	111.5	I151 Q153 H157 L158 D159	I151-K155 HydrophobicContact CG2-CD 4.17Å; I151-K155 HydrophobicContact CG2-CG 4.47Å; I151-K155 WeakPolarHBondContact O-CB 3.32Å; I151-K155 VanDerWaalsContact O-CG 3.25Å; I151-K155 WeakPolarHBondContact O-CG 3.42Å; I151-K155 PolarHBondContact O-N 2.83Å; Q153-K155 VanDerWaalsContact C-N 3.34Å; Q153-K155 PolarHBondContact O-N 3.38Å; K155-H157 PolarHBondContact O-N 2.95Å; K155-L158 WeakPolarHBondContact O-CB 3.44Å; K155-L158 PolarHBondContact O-N 2.82Å; K155-D159 PolarHBondContact O-N 3.17Å
156	R	84.9	Confident	78.8	Confident	131 Å²	131	104.4 Å²	104.4	49%	0.494	48%	0.484	S	S	.	.	H	α-helix	trans	-56.5	-46.9	174.7	-83.7	172.4	-81.3	160.7	-13.5	112.3	E152 Q153 L158 D159 D160	E152-R156 PolarHBondContact O-N 3.36Å; E152-R156 VanDerWaalsContact O-N 3.16Å; E152-R156 PolarHBondContact O-NE 3.47Å; E152-R156 IonicContact OE2-NH2 2.65Å; Q153-R156 PolarHBondContact O-N 3.29Å; R156-L158 PolarHBondContact O-N 2.85Å; R156-D159 PolarHBondContact O-N 2.84Å; R156-D160 WeakPolarHBondContact O-CB 3.46Å; R156-D160 PolarHBondContact O-N 2.95Å
157	H	85.2	Confident	80	Confident	107 Å²	107	101.6 Å²	101.6	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-29.6	177.7	-70	-158.5	0	0	0	112.8	Q153 L154 K155 L161	Q153-H157 WeakPolarHBondContact CG-NE2 3.42Å; Q153-H157 PolarHBondContact NE2-NE2 3.05Å; Q153-H157 PolarHBondContact O-CD2 3.32Å; Q153-H157 PolarHBondContact O-N 3.39Å; L154-H157 PolarHBondContact O-N 3.29Å; K155-H157 PolarHBondContact O-N 2.95Å; H157-L161 VanDerWaalsContact O-CB 3.28Å; H157-L161 WeakPolarHBondContact O-CB 3.39Å; H157-L161 PolarHBondContact O-N 3.15Å; H157-L161 VanDerWaalsContact O-N 3.09Å
158	L	85	Confident	81	Confident	109 Å²	109	101.6 Å²	101.6	57%	0.571	48%	0.478	S	S	*	.	H	α-helix	trans	-76.5	-43.7	173.3	-74	166.7	0	0	0	112	L154 K155 R156 D160 L161 E162	L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 VanDerWaalsContact O-CG 3.31Å; L154-L158 WeakPolarHBondContact O-CG 3.49Å; L154-L158 PolarHBondContact O-N 2.98Å; K155-L158 WeakPolarHBondContact O-CB 3.44Å; K155-L158 PolarHBondContact O-N 2.82Å; R156-L158 PolarHBondContact O-N 2.85Å; L158-D160 VanDerWaalsContact C-N 3.29Å; L158-D160 PolarHBondContact O-N 3.17Å; L158-L161 PolarHBondContact O-N 2.87Å; L158-E162 WeakPolarHBondContact O-CB 3.32Å; L158-E162 PolarHBondContact O-N 3.26Å
159	D	84.6	Confident	81.1	Confident	53 Å²	53	100.1 Å²	100.1	28%	0.283	49%	0.488	S	S	.	.	H	α-helix	trans	-58.7	-42.2	174	-66	-36.8	0	0	0	110.8	K155 R156 R163	K155-D159 PolarHBondContact O-N 3.17Å; R156-D159 PolarHBondContact O-N 2.84Å; D159-R163 WeakPolarHBondContact O-CB 3.47Å; D159-R163 WeakPolarHBondContact O-CD 3.29Å; D159-R163 WeakPolarHBondContact O-CG 3.23Å; D159-R163 PolarHBondContact O-N 2.77Å
160	D	85.3	Confident	80.7	Confident	97 Å²	97	101.5 Å²	101.5	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-67.3	-41.4	176.9	-68.1	-29.7	0	0	0	111.7	R156 L158 F164	R156-D160 WeakPolarHBondContact O-CB 3.46Å; R156-D160 PolarHBondContact O-N 2.95Å; L158-D160 VanDerWaalsContact C-N 3.29Å; L158-D160 PolarHBondContact O-N 3.17Å; D160-F164 VanDerWaalsContact O-CB 3.31Å; D160-F164 WeakPolarHBondContact O-CB 3.31Å; D160-F164 PolarHBondContact O-N 3.36Å
161	L	83.1	Confident	80.7	Confident	112 Å²	112	98.4 Å²	98.4	59%	0.586	48%	0.48	S	S	*	.	H	α-helix	trans	-65.2	-42.4	175.9	-171.6	82.9	0	0	0	111.8	H157 L158 F164 A165	H157-L161 VanDerWaalsContact O-CB 3.28Å; H157-L161 WeakPolarHBondContact O-CB 3.39Å; H157-L161 PolarHBondContact O-N 3.15Å; H157-L161 VanDerWaalsContact O-N 3.09Å; L158-L161 PolarHBondContact O-N 2.87Å; L161-F164 PolarHBondContact O-N 3.47Å; L161-A165 WeakPolarHBondContact O-CB 3.25Å; L161-A165 PolarHBondContact O-N 2.94Å
162	E	83.8	Confident	80.3	Confident	30 Å²	30	100 Å²	100	14%	0.14	50%	0.499	C	S	.	.	H	α-helix	trans	-70.1	-40.4	-179.1	-165.5	-176	-146.3	0	0	111.4	L158 F164 A165 Y166 P175 T176	L158-E162 WeakPolarHBondContact O-CB 3.32Å; L158-E162 PolarHBondContact O-N 3.26Å; E162-F164 VanDerWaalsContact C-N 3.35Å; E162-A165 PolarHBondContact O-N 2.81Å; E162-Y166 WeakPolarHBondContact O-CB 3.38Å; E162-Y166 PolarHBondContact O-N 3.27Å; E162-P175 HydrophobicContact CB-CB 4.46Å; E162-P175 VanDerWaalsContact CD-CA 3.45Å; E162-P175 HydrophobicContact CG-CB 3.96Å; E162-P175 HydrophobicContact CG-CG 4.38Å; E162-P175 WeakPolarHBondContact OE2-CA 3.47Å; E162-P175 WeakPolarHBondContact OE2-CB 3.36Å; E162-T176 VanDerWaalsContact OE1-CB 3.24Å; E162-T176 WeakPolarHBondContact OE1-CB 3.48Å; E162-T176 PolarHBondContact OE1-N 3.09Å; E162-T176 PolarHBondContact OE1-OG1 3.43Å; E162-T176 WeakPolarHBondContact OE2-CB 3.46Å; E162-T176 PolarHBondContact OE2-N 2.84Å
163	R	83	Confident	80.1	Confident	132 Å²	132	101.6 Å²	101.6	50%	0.498	51%	0.507	S	S	.	.	H	α-helix	trans	-56	-49.1	167.3	-75.1	164.2	178.4	-92.8	-0.7	111.1	D159 A165 Y166 E167 P175	D159-R163 WeakPolarHBondContact O-CB 3.47Å; D159-R163 WeakPolarHBondContact O-CD 3.29Å; D159-R163 WeakPolarHBondContact O-CG 3.23Å; D159-R163 PolarHBondContact O-N 2.77Å; R163-A165 PolarHBondContact O-N 2.84Å; R163-Y166 PolarHBondContact O-N 3.35Å; R163-E167 WeakPolarHBondContact O-CB 3.48Å; R163-E167 WeakPolarHBondContact O-CG 3.43Å; R163-E167 PolarHBondContact O-N 2.92Å; R163-P175 HydrophobicContact CG-CG 4.13Å
164	F	83	Confident	79.9	Confident	128 Å²	128	98.6 Å²	98.6	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-38.7	-179.8	-175.8	-95.3	0	0	0	112.9	D160 L161 E162 E167 T168	D160-F164 VanDerWaalsContact O-CB 3.31Å; D160-F164 WeakPolarHBondContact O-CB 3.31Å; D160-F164 PolarHBondContact O-N 3.36Å; L161-F164 PolarHBondContact O-N 3.47Å; E162-F164 VanDerWaalsContact C-N 3.35Å; F164-E167 PolarHBondContact O-N 3.29Å; F164-T168 WeakPolarHBondContact CE1-OG1 3.32Å; F164-T168 WeakPolarHBondContact CZ-OG1 3.13Å; F164-T168 WeakPolarHBondContact O-CB 3.31Å; F164-T168 PolarHBondContact O-N 2.79Å; F164-T168 PolarHBondContact O-OG1 3.35Å
165	A	81.2	Confident	79.7	Confident	20 Å²	20	94.7 Å²	94.7	17%	0.165	48%	0.476	C	S	.	.	H	α-helix	trans	-66.3	-37.5	177.2	0	0	0	0	0	112.4	L161 E162 R163 G169 E170 Q171	L161-A165 WeakPolarHBondContact O-CB 3.25Å; L161-A165 PolarHBondContact O-N 2.94Å; E162-A165 PolarHBondContact O-N 2.81Å; R163-A165 PolarHBondContact O-N 2.84Å; A165-G169 PolarHBondContact O-N 3.44Å; A165-G169 VanDerWaalsContact O-N 3.12Å; A165-E170 PolarHBondContact O-N 3.49Å; A165-Q171 HydrophobicContact CB-CB 3.92Å; A165-Q171 PolarHBondContact O-N 2.77Å; A165-Q171 VanDerWaalsContact O-N 3.13Å
166	Y	83.1	Confident	79.6	Confident	115 Å²	115	92.1 Å²	92.1	45%	0.451	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-46.5	172.9	-178.2	-113.3	0	0	0	112.3	E162 R163 T168 G169 E173 P174 P175	E162-Y166 WeakPolarHBondContact O-CB 3.38Å; E162-Y166 PolarHBondContact O-N 3.27Å; R163-Y166 PolarHBondContact O-N 3.35Å; Y166-T168 VanDerWaalsContact C-N 3.29Å; Y166-T168 PolarHBondContact O-N 2.85Å; Y166-G169 PolarHBondContact O-N 2.98Å; Y166-G169 VanDerWaalsContact O-N 3.13Å; Y166-E173 WeakPolarHBondContact CD2-O 3.39Å; Y166-P174 HydrophobicContact CD2-CB 4.43Å; Y166-P174 HydrophobicContact CE1-CB 4.49Å; Y166-P174 HydrophobicContact CE2-CB 3.99Å; Y166-P175 HydrophobicContact CG-CG 4.5Å
167	E	82.8	Confident	79.4	Confident	150 Å²	150	90.5 Å²	90.5	70%	0.701	47%	0.47	S	S	*	.	H	α-helix	trans	-65.7	-29.7	178	-73.6	174.9	-162.7	0	0	113	R163 F164	R163-E167 WeakPolarHBondContact O-CB 3.48Å; R163-E167 WeakPolarHBondContact O-CG 3.43Å; R163-E167 PolarHBondContact O-N 2.92Å; F164-E167 PolarHBondContact O-N 3.29Å
168	T	77.7	Confident	79.1	Confident	73 Å²	73	87 Å²	87	45%	0.448	46%	0.459	S	S	.	.	H	α-helix	trans	-84	-16.5	174.9	-54.1	0	0	0	0	112.5	F164 Y166 E170	F164-T168 WeakPolarHBondContact CE1-OG1 3.32Å; F164-T168 WeakPolarHBondContact CZ-OG1 3.13Å; F164-T168 WeakPolarHBondContact O-CB 3.31Å; F164-T168 PolarHBondContact O-N 2.79Å; F164-T168 PolarHBondContact O-OG1 3.35Å; Y166-T168 VanDerWaalsContact C-N 3.29Å; Y166-T168 PolarHBondContact O-N 2.85Å; T168-E170 HydrophobicContact CG2-CG 4.28Å
169	G	75.5	Confident	78.9	Confident	60 Å²	60	84.4 Å²	84.4	62%	0.619	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	16.3	-179	0	0	0	0	0	115.1	A165 Y166 Q171	A165-G169 PolarHBondContact O-N 3.44Å; A165-G169 VanDerWaalsContact O-N 3.12Å; Y166-G169 PolarHBondContact O-N 2.98Å; Y166-G169 VanDerWaalsContact O-N 3.13Å; G169-Q171 VanDerWaalsContact C-N 3.34Å
170	E	69.1	Low	78.6	Confident	173 Å²	173	86.1 Å²	86.1	81%	0.808	45%	0.454	S	S	*	.	S	Bend	trans	-77.9	-23.5	170.1	-66.9	-163.1	144.2	0	0	111.8	A165 T168	A165-E170 PolarHBondContact O-N 3.49Å; T168-E170 HydrophobicContact CG2-CG 4.28Å
171	Q	66.7	Low	78.5	Confident	62 Å²	62	87 Å²	87	29%	0.29	46%	0.455	S	S	.	.			trans	-115.6	119.9	172.9	-172	173.7	-8.4	0	0	109.9	A165 G169 E173	A165-Q171 HydrophobicContact CB-CB 3.92Å; A165-Q171 PolarHBondContact O-N 2.77Å; A165-Q171 VanDerWaalsContact O-N 3.13Å; G169-Q171 VanDerWaalsContact C-N 3.34Å; Q171-E173 VanDerWaalsContact C-N 3.32Å; Q171-E173 HydrophobicContact CG-CB 4.5Å
172	S	69.9	Low	78.4	Confident	121 Å²	121	87.8 Å²	87.8	85%	0.846	45%	0.454	S	S	*	.			trans	-76.6	-19	-179.4	-171.5	0	0	0	0	113.4
173	E	74.8	Confident	78.3	Confident	135 Å²	135	91.3 Å²	91.3	63%	0.631	47%	0.47	S	S	*	.	S	Bend	trans	-90.3	137.9	179.9	-62.3	-176.5	159	0	0	110.7	Y166 Q171	Y166-E173 WeakPolarHBondContact CD2-O 3.39Å; Q171-E173 VanDerWaalsContact C-N 3.32Å; Q171-E173 HydrophobicContact CG-CB 4.5Å
174	P	75.2	Confident	78.2	Confident	37 Å²	37	92.6 Å²	92.6	24%	0.24	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-69.2	155.6	177.2	30.5	-35	0	0	0	111	Y166 T176 I179	Y166-P174 HydrophobicContact CD2-CB 4.43Å; Y166-P174 HydrophobicContact CE1-CB 4.49Å; Y166-P174 HydrophobicContact CE2-CB 3.99Å; P174-T176 PolarHBondContact O-N 3.17Å; P174-I179 HydrophobicContact CG-CD1 4.2Å; P174-I179 HydrophobicContact CG-CG1 3.99Å; P174-I179 WeakPolarHBondContact O-CD1 3.47Å
175	P	77.3	Confident	78.2	Confident	14 Å²	14	91.8 Å²	91.8	9%	0.091	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-53.5	138	-173.5	-30.3	36.6	0	0	0	114.3	E162 R163 Y166 Q177 A178 I179	E162-P175 HydrophobicContact CB-CB 4.46Å; E162-P175 VanDerWaalsContact CD-CA 3.45Å; E162-P175 HydrophobicContact CG-CB 3.96Å; E162-P175 HydrophobicContact CG-CG 4.38Å; E162-P175 WeakPolarHBondContact OE2-CA 3.47Å; E162-P175 WeakPolarHBondContact OE2-CB 3.36Å; R163-P175 HydrophobicContact CG-CG 4.13Å; Y166-P175 HydrophobicContact CG-CG 4.5Å; P175-Q177 PolarHBondContact O-N 2.88Å; P175-Q177 VanDerWaalsContact O-N 3.17Å; P175-A178 CarbonylContact O-C 3.53Å; P175-A178 WeakPolarHBondContact O-CA 3.39Å; P175-A178 WeakPolarHBondContact O-CB 3.37Å; P175-A178 PolarHBondContact O-N 3.4Å; P175-I179 PolarHBondContact O-N 2.95Å
176	T	80.9	Confident	78.1	Confident	75 Å²	75	95.1 Å²	95.1	46%	0.46	49%	0.494	S	S	.	.	H	α-helix	trans	-47.5	-43.3	178.4	-65.6	0	0	0	0	111.6	E162 P174 A178 I179 L180	E162-T176 VanDerWaalsContact OE1-CB 3.24Å; E162-T176 WeakPolarHBondContact OE1-CB 3.48Å; E162-T176 PolarHBondContact OE1-N 3.09Å; E162-T176 PolarHBondContact OE1-OG1 3.43Å; E162-T176 WeakPolarHBondContact OE2-CB 3.46Å; E162-T176 PolarHBondContact OE2-N 2.84Å; P174-T176 PolarHBondContact O-N 3.17Å; T176-A178 VanDerWaalsContact C-N 3.31Å; T176-A178 PolarHBondContact O-N 3.33Å; T176-I179 PolarHBondContact O-N 3.26Å; T176-I179 VanDerWaalsContact O-N 3.17Å; T176-L180 HydrophobicContact CG2-CD1 3.83Å; T176-L180 HydrophobicContact CG2-CG 4.22Å; T176-L180 WeakPolarHBondContact O-CB 3.22Å; T176-L180 VanDerWaalsContact O-CG 3.28Å; T176-L180 WeakPolarHBondContact O-CG 3.26Å; T176-L180 PolarHBondContact O-N 2.92Å
177	Q	79.6	Confident	77.7	Confident	98 Å²	98	95.2 Å²	95.2	46%	0.458	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-37.5	176.7	-179.5	59.8	15.5	0	0	112.7	P175 E181	P175-Q177 PolarHBondContact O-N 2.88Å; P175-Q177 VanDerWaalsContact O-N 3.17Å; Q177-E181 WeakPolarHBondContact O-CB 3.31Å; Q177-E181 PolarHBondContact O-N 3.42Å
178	A	79	Confident	77.5	Confident	33 Å²	33	92.2 Å²	92.2	27%	0.273	49%	0.488	S	S	.	.	H	α-helix	trans	-77.7	-27.4	175.9	0	0	0	0	0	112.8	P175 T176 K182	P175-A178 CarbonylContact O-C 3.53Å; P175-A178 WeakPolarHBondContact O-CA 3.39Å; P175-A178 WeakPolarHBondContact O-CB 3.37Å; P175-A178 PolarHBondContact O-N 3.4Å; T176-A178 VanDerWaalsContact C-N 3.31Å; T176-A178 PolarHBondContact O-N 3.33Å; A178-K182 WeakPolarHBondContact O-CB 3.5Å; A178-K182 WeakPolarHBondContact O-CD 3.39Å; A178-K182 VanDerWaalsContact O-CG 3.23Å; A178-K182 WeakPolarHBondContact O-CG 3.47Å; A178-K182 PolarHBondContact O-N 2.83Å; A178-K182 VanDerWaalsContact O-N 3.15Å
179	I	80.6	Confident	77.5	Confident	55 Å²	55	90 Å²	90	28%	0.282	48%	0.479	S	S	.	.	H	α-helix	trans	-67.4	-48.6	169	-65	176.2	0	0	0	109.8	P174 P175 T176 E181 K182 Q183	P174-I179 HydrophobicContact CG-CD1 4.2Å; P174-I179 HydrophobicContact CG-CG1 3.99Å; P174-I179 WeakPolarHBondContact O-CD1 3.47Å; P175-I179 PolarHBondContact O-N 2.95Å; T176-I179 PolarHBondContact O-N 3.26Å; T176-I179 VanDerWaalsContact O-N 3.17Å; I179-E181 PolarHBondContact O-N 3.28Å; I179-K182 PolarHBondContact O-N 2.95Å; I179-Q183 HydrophobicContact CG2-CG 4.4Å; I179-Q183 WeakPolarHBondContact O-CB 3.17Å; I179-Q183 WeakPolarHBondContact O-CG 3.35Å; I179-Q183 PolarHBondContact O-N 3.4Å
180	L	80.1	Confident	77.3	Confident	88 Å²	88	91.4 Å²	91.4	46%	0.461	47%	0.472	S	S	.	.	H	α-helix	trans	-63.8	-37.8	178.6	-70.7	172.7	0	0	0	112.1	T176 Q183 R184	T176-L180 HydrophobicContact CG2-CD1 3.83Å; T176-L180 HydrophobicContact CG2-CG 4.22Å; T176-L180 WeakPolarHBondContact O-CB 3.22Å; T176-L180 VanDerWaalsContact O-CG 3.28Å; T176-L180 WeakPolarHBondContact O-CG 3.26Å; T176-L180 PolarHBondContact O-N 2.92Å; L180-Q183 PolarHBondContact O-N 2.94Å; L180-R184 VanDerWaalsContact O-CB 3.28Å; L180-R184 WeakPolarHBondContact O-CB 3.32Å; L180-R184 PolarHBondContact O-N 2.9Å
181	E	82.4	Confident	77.2	Confident	115 Å²	115	88.3 Å²	88.3	54%	0.537	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-43	174	-174.9	169.6	-146.1	0	0	112	Q177 I179 R184 L185	Q177-E181 WeakPolarHBondContact O-CB 3.31Å; Q177-E181 PolarHBondContact O-N 3.42Å; I179-E181 PolarHBondContact O-N 3.28Å; E181-R184 WeakPolarHBondContact O-CB 3.4Å; E181-R184 PolarHBondContact O-N 3.41Å; E181-L185 HydrophobicContact CG-CD1 4.45Å; E181-L185 WeakPolarHBondContact O-CG 3.41Å; E181-L185 PolarHBondContact O-N 3.33Å
182	K	80.8	Confident	77.5	Confident	130 Å²	130	92.8 Å²	92.8	57%	0.565	47%	0.474	S	S	*	.	H	α-helix	trans	-62.5	-44.2	172.8	-73.6	168.2	-175.7	172.8	0	111.9	A178 I179 R184 L185 V186	A178-K182 WeakPolarHBondContact O-CB 3.5Å; A178-K182 WeakPolarHBondContact O-CD 3.39Å; A178-K182 VanDerWaalsContact O-CG 3.23Å; A178-K182 WeakPolarHBondContact O-CG 3.47Å; A178-K182 PolarHBondContact O-N 2.83Å; A178-K182 VanDerWaalsContact O-N 3.15Å; I179-K182 PolarHBondContact O-N 2.95Å; K182-R184 VanDerWaalsContact C-N 3.34Å; K182-L185 PolarHBondContact O-N 3.24Å; K182-V186 WeakPolarHBondContact O-CG2 3.39Å; K182-V186 PolarHBondContact O-N 3.48Å
183	Q	81.3	Confident	77.3	Confident	104 Å²	104	93.8 Å²	93.8	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-62	-41.5	175.1	-73.8	176.7	1.9	0	0	111.4	I179 L180 V186 L187	I179-Q183 HydrophobicContact CG2-CG 4.4Å; I179-Q183 WeakPolarHBondContact O-CB 3.17Å; I179-Q183 WeakPolarHBondContact O-CG 3.35Å; I179-Q183 PolarHBondContact O-N 3.4Å; L180-Q183 PolarHBondContact O-N 2.94Å; Q183-V186 PolarHBondContact O-N 3.07Å; Q183-L187 WeakPolarHBondContact O-CB 3.38Å; Q183-L187 VanDerWaalsContact O-CG 3.28Å; Q183-L187 WeakPolarHBondContact O-CG 3.37Å; Q183-L187 PolarHBondContact O-N 3.4Å
184	R	82.1	Confident	76.7	Confident	158 Å²	158	88.8 Å²	88.8	60%	0.596	44%	0.44	S	S	*	.	H	α-helix	trans	-59.3	-50.2	174.3	-176.8	-167.1	169.9	110.5	7.3	111.2	L180 E181 K182 V186 L187 E188	L180-R184 VanDerWaalsContact O-CB 3.28Å; L180-R184 WeakPolarHBondContact O-CB 3.32Å; L180-R184 PolarHBondContact O-N 2.9Å; E181-R184 WeakPolarHBondContact O-CB 3.4Å; E181-R184 PolarHBondContact O-N 3.41Å; K182-R184 VanDerWaalsContact C-N 3.34Å; R184-V186 VanDerWaalsContact C-N 3.3Å; R184-V186 PolarHBondContact O-N 3.14Å; R184-L187 CarbonylContact O-C 3.54Å; R184-L187 PolarHBondContact O-N 3.07Å; R184-E188 IonicContact CZ-OE2 3.35Å; R184-E188 IonicContact NE-OE2 3.95Å; R184-E188 PolarHBondContact NE-OE2 2.83Å; R184-E188 VanDerWaalsContact NE-OE2 3.16Å; R184-E188 IonicContact NH2-OE2 2.77Å; R184-E188 PolarHBondContact NH2-OE2 3.16Å; R184-E188 VanDerWaalsContact O-CB 3.24Å; R184-E188 WeakPolarHBondContact O-CB 3.33Å; R184-E188 PolarHBondContact O-N 2.91Å
185	L	82.1	Confident	76	Confident	111 Å²	111	94.7 Å²	94.7	58%	0.581	47%	0.465	S	S	*	.	H	α-helix	trans	-61.8	-37.7	179.2	-71.2	169.2	0	0	0	112.1	E181 K182 G189	E181-L185 HydrophobicContact CG-CD1 4.45Å; E181-L185 WeakPolarHBondContact O-CG 3.41Å; E181-L185 PolarHBondContact O-N 3.33Å; K182-L185 PolarHBondContact O-N 3.24Å; L185-G189 PolarHBondContact O-N 3.07Å
186	V	79.6	Confident	75.2	Confident	91 Å²	91	95.6 Å²	95.6	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-64.7	-46.4	172.5	168.9	0	0	0	0	111.3	K182 Q183 R184 E188 L190	K182-V186 WeakPolarHBondContact O-CG2 3.39Å; K182-V186 PolarHBondContact O-N 3.48Å; Q183-V186 PolarHBondContact O-N 3.07Å; R184-V186 VanDerWaalsContact C-N 3.3Å; R184-V186 PolarHBondContact O-N 3.14Å; V186-E188 PolarHBondContact O-N 3.44Å; V186-L190 HydrophobicContact CG1-CD1 3.78Å; V186-L190 HydrophobicContact CG1-CG 4.39Å; V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.46Å; V186-L190 PolarHBondContact O-N 3.03Å
187	L	75.3	Confident	74	Confident	116 Å²	116	98.3 Å²	98.3	61%	0.607	48%	0.48	S	S	*	.	H	α-helix	trans	-65.1	-37	177.3	-72.3	169.1	0	0	0	112.5	Q183 R184 R191	Q183-L187 WeakPolarHBondContact O-CB 3.38Å; Q183-L187 VanDerWaalsContact O-CG 3.28Å; Q183-L187 WeakPolarHBondContact O-CG 3.37Å; Q183-L187 PolarHBondContact O-N 3.4Å; R184-L187 CarbonylContact O-C 3.54Å; R184-L187 PolarHBondContact O-N 3.07Å; L187-R191 WeakPolarHBondContact O-CB 3.31Å; L187-R191 PolarHBondContact O-N 3.42Å
188	E	78.8	Confident	73	Confident	88 Å²	88	97.9 Å²	97.9	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-71	-44.8	179.6	-168.8	151.4	-166.3	0	0	110.9	R184 V186 R191 E192	R184-E188 IonicContact CZ-OE2 3.35Å; R184-E188 IonicContact NE-OE2 3.95Å; R184-E188 PolarHBondContact NE-OE2 2.83Å; R184-E188 VanDerWaalsContact NE-OE2 3.16Å; R184-E188 IonicContact NH2-OE2 2.77Å; R184-E188 PolarHBondContact NH2-OE2 3.16Å; R184-E188 VanDerWaalsContact O-CB 3.24Å; R184-E188 WeakPolarHBondContact O-CB 3.33Å; R184-E188 PolarHBondContact O-N 2.91Å; V186-E188 PolarHBondContact O-N 3.44Å; E188-R191 WeakPolarHBondContact O-CB 3.32Å; E188-R191 PolarHBondContact O-N 2.88Å; E188-E192 PolarHBondContact O-N 3.21Å
189	G	76.4	Confident	72	Confident	26 Å²	26	101.2 Å²	101.2	27%	0.268	50%	0.501	S	S	.	.	H	α-helix	trans	-70.1	-29.6	173.5	0	0	0	0	0	114.5	L185 K193	L185-G189 PolarHBondContact O-N 3.07Å; G189-K193 WeakPolarHBondContact O-CB 3.28Å; G189-K193 WeakPolarHBondContact O-CG 3.34Å; G189-K193 PolarHBondContact O-N 2.97Å
190	L	71.6	Confident	71	Confident	89 Å²	89	103.5 Å²	103.5	47%	0.466	51%	0.514	S	S	.	.	H	α-helix	trans	-70.9	-43.3	169.3	-76.8	171.1	0	0	0	111.2	V186 E192 K193 L194	V186-L190 HydrophobicContact CG1-CD1 3.78Å; V186-L190 HydrophobicContact CG1-CG 4.39Å; V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.46Å; V186-L190 PolarHBondContact O-N 3.03Å; L190-E192 PolarHBondContact O-N 3.4Å; L190-K193 PolarHBondContact O-N 2.86Å; L190-L194 HydrophobicContact CB-CD1 4.45Å; L190-L194 VanDerWaalsContact O-CB 3.26Å; L190-L194 WeakPolarHBondContact O-CB 3.45Å; L190-L194 WeakPolarHBondContact O-CG 3.4Å; L190-L194 PolarHBondContact O-N 3.43Å
191	R	67.2	Low	69.9	Low	109 Å²	109	101.8 Å²	101.8	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-59.3	-45.4	177.1	-179.7	-156.6	175.1	-129.9	-6.8	111.6	L187 E188 L194 E195 L196 I198	L187-R191 WeakPolarHBondContact O-CB 3.31Å; L187-R191 PolarHBondContact O-N 3.42Å; E188-R191 WeakPolarHBondContact O-CB 3.32Å; E188-R191 PolarHBondContact O-N 2.88Å; R191-L194 PolarHBondContact O-N 2.85Å; R191-E195 PolarHBondContact O-N 3.49Å; R191-L196 HydrophobicContact CG-CB 4.21Å; R191-L196 WeakPolarHBondContact CG-O 3.34Å; R191-L196 PolarHBondContact NE-O 3.49Å; R191-L196 PolarHBondContact O-N 3.29Å; R191-I198 HydrophobicContact CB-CD1 4.35Å; R191-I198 HydrophobicContact CG-CD1 3.8Å; R191-I198 HydrophobicContact CG-CG1 4.35Å
192	E	72.6	Confident	68.8	Low	156 Å²	156	104.2 Å²	104.2	73%	0.729	52%	0.524	S	S	*	.	H	α-helix	trans	-60.5	-46.8	176.1	-174.4	179	-147.2	0	0	111.2	E188 L190 L194	E188-E192 PolarHBondContact O-N 3.21Å; L190-E192 PolarHBondContact O-N 3.4Å; E192-L194 VanDerWaalsContact C-N 3.33Å; E192-L194 PolarHBondContact O-N 3.45Å
193	K	64.9	Low	67.8	Low	141 Å²	141	106.4 Å²	106.4	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-73.9	-16.3	-179.7	-71	179.8	178.8	-178	0	115.2	G189 L190 F220	G189-K193 WeakPolarHBondContact O-CB 3.28Å; G189-K193 WeakPolarHBondContact O-CG 3.34Å; G189-K193 PolarHBondContact O-N 2.97Å; L190-K193 PolarHBondContact O-N 2.86Å; K193-F220 WeakPolarHBondContact O-CD2 3.47Å; K193-F220 VanDerWaalsContact O-CE2 3.31Å; K193-F220 WeakPolarHBondContact O-CE2 3.26Å
194	L	62.3	Low	66.8	Low	30 Å²	30	104.8 Å²	104.8	16%	0.157	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	5.6	-178.7	-66.3	167.9	0	0	0	113.4	L190 R191 E192 L196 A216 V217 F220	L190-L194 HydrophobicContact CB-CD1 4.45Å; L190-L194 VanDerWaalsContact O-CB 3.26Å; L190-L194 WeakPolarHBondContact O-CB 3.45Å; L190-L194 WeakPolarHBondContact O-CG 3.4Å; L190-L194 PolarHBondContact O-N 3.43Å; R191-L194 PolarHBondContact O-N 2.85Å; E192-L194 VanDerWaalsContact C-N 3.33Å; E192-L194 PolarHBondContact O-N 3.45Å; L194-L196 HydrophobicContact CB-CD1 3.93Å; L194-L196 HydrophobicContact CB-CG 3.8Å; L194-L196 HydrophobicContact CD1-CD1 4.13Å; L194-L196 PolarHBondContact O-N 2.98Å; L194-A216 HydrophobicContact CB-CB 4.48Å; L194-V217 HydrophobicContact CD1-CG2 4.09Å; L194-V217 HydrophobicContact CD2-CB 4.49Å; L194-V217 HydrophobicContact CD2-CG2 3.86Å; L194-F220 HydrophobicContact CD2-CB 4.01Å; L194-F220 HydrophobicContact CD2-CG 4.43Å
195	E	60.9	Low	66.1	Low	161 Å²	161	101.1 Å²	101.1	75%	0.752	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	28.7	-177.6	-60.8	-173.2	173	0	0	114.5	R191 N197	R191-E195 PolarHBondContact O-N 3.49Å; E195-N197 PolarHBondContact O-N 2.83Å; E195-N197 PolarHBondContact O-ND2 2.98Å; E195-N197 VanDerWaalsContact O-ND2 3.14Å
196	L	60	Low	65.3	Low	34 Å²	34	99.6 Å²	99.6	18%	0.178	53%	0.528	C	S	.	.			trans	-72.1	104.9	-172.6	-71.5	173	0	0	0	111.5	R191 L194 I198 V212 V213 A216	R191-L196 HydrophobicContact CG-CB 4.21Å; R191-L196 WeakPolarHBondContact CG-O 3.34Å; R191-L196 PolarHBondContact NE-O 3.49Å; R191-L196 PolarHBondContact O-N 3.29Å; L194-L196 HydrophobicContact CB-CD1 3.93Å; L194-L196 HydrophobicContact CB-CG 3.8Å; L194-L196 HydrophobicContact CD1-CD1 4.13Å; L194-L196 PolarHBondContact O-N 2.98Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 HydrophobicContact CB-CG1 4.49Å; L196-I198 PolarHBondContact O-N 3.15Å; L196-V212 HydrophobicContact CD2-CG1 4.27Å; L196-V213 HydrophobicContact CD1-CG2 4.45Å; L196-A216 HydrophobicContact CD2-CB 3.76Å; L196-A216 HydrophobicContact CG-CB 4.46Å
197	N	55.8	Low	64.6	Low	132 Å²	132	98.9 Å²	98.9	71%	0.706	53%	0.532	S	S	*	.			trans	-78.2	81.2	175.3	-83	-82	0	0	0	110.8	E195 S199	E195-N197 PolarHBondContact O-N 2.83Å; E195-N197 PolarHBondContact O-ND2 2.98Å; E195-N197 VanDerWaalsContact O-ND2 3.14Å; N197-S199 PolarHBondContact O-N 2.88Å
198	I	58.9	Low	64.1	Low	88 Å²	88	97.9 Å²	97.9	45%	0.451	52%	0.524	S	S	.	.			trans	-60	-6.1	-173.6	-74.9	178.5	0	0	0	115.5	R191 L196 N200 V201	R191-I198 HydrophobicContact CB-CD1 4.35Å; R191-I198 HydrophobicContact CG-CD1 3.8Å; R191-I198 HydrophobicContact CG-CG1 4.35Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 HydrophobicContact CB-CG1 4.49Å; L196-I198 PolarHBondContact O-N 3.15Å; I198-N200 PolarHBondContact O-N 3.26Å; I198-V201 HydrophobicContact CB-CG2 4.24Å; I198-V201 HydrophobicContact CG1-CG2 4.3Å; I198-V201 HydrophobicContact CG2-CB 4.45Å; I198-V201 HydrophobicContact CG2-CG2 3.97Å; I198-V201 WeakPolarHBondContact O-CG2 3.28Å; I198-V201 PolarHBondContact O-N 3.16Å
199	S	59.5	Low	63.6	Low	103 Å²	103	96.7 Å²	96.7	72%	0.72	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-8.1	-172.3	-42.3	0	0	0	0	117.4	N197	N197-S199 PolarHBondContact O-N 2.88Å
200	N	58.5	Low	63.2	Low	103 Å²	103	101.3 Å²	101.3	55%	0.551	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	7.9	-178.1	-68.1	-44.4	0	0	0	114.4	I198 D202 K203	I198-N200 PolarHBondContact O-N 3.26Å; N200-D202 VanDerWaalsContact C-N 3.29Å; N200-D202 PolarHBondContact O-N 3.5Å; N200-K203 PolarHBondContact O-N 3.01Å; N200-K203 VanDerWaalsContact O-N 3.12Å
201	V	57	Low	63.3	Low	53 Å²	53	103.7 Å²	103.7	32%	0.321	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-59.7	-35.1	-170.5	169.3	0	0	0	0	113.2	I198 K203 L204 L209	I198-V201 HydrophobicContact CB-CG2 4.24Å; I198-V201 HydrophobicContact CG1-CG2 4.3Å; I198-V201 HydrophobicContact CG2-CB 4.45Å; I198-V201 HydrophobicContact CG2-CG2 3.97Å; I198-V201 WeakPolarHBondContact O-CG2 3.28Å; I198-V201 PolarHBondContact O-N 3.16Å; V201-K203 PolarHBondContact O-N 3.39Å; V201-L204 PolarHBondContact O-N 2.77Å; V201-L209 HydrophobicContact CG1-CD1 4.37Å; V201-L209 HydrophobicContact CG1-CD2 4.38Å; V201-L209 HydrophobicContact CG2-CD1 4.1Å
202	D	58.6	Low	63.4	Low	166 Å²	166	102 Å²	102	89%	0.888	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-68.3	-1.9	179.9	-51.4	-48.5	0	0	0	114.8	N200	N200-D202 VanDerWaalsContact C-N 3.29Å; N200-D202 PolarHBondContact O-N 3.5Å
203	K	60.8	Low	63.3	Low	176 Å²	176	97.1 Å²	97.1	77%	0.765	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-119.7	-2.5	-173.9	-66	-176.7	178.8	176	0	114.8	N200 V201	N200-K203 PolarHBondContact O-N 3.01Å; N200-K203 VanDerWaalsContact O-N 3.12Å; V201-K203 PolarHBondContact O-N 3.39Å
204	L	60.4	Low	63.6	Low	70 Å²	70	94 Å²	94	37%	0.366	52%	0.516	S	S	.	.	S	Bend	trans	-112	129.9	-173.9	-66.9	168.7	0	0	0	110.7	V201 E208	V201-L204 PolarHBondContact O-N 2.77Å; L204-E208 WeakPolarHBondContact CD2-OE2 3.42Å
205	P	66.3	Low	64.2	Low	80 Å²	80	99.8 Å²	99.8	52%	0.519	54%	0.54	S	S	.	.			trans	-63.5	151.1	173.9	28.6	-35.1	0	0	0	110.8	A207 E208 L209	P205-A207 PolarHBondContact O-N 2.79Å; P205-E208 WeakPolarHBondContact CD-OE2 3.47Å; P205-E208 HydrophobicContact CG-CB 4.35Å; P205-E208 HydrophobicContact CG-CG 4.16Å; P205-E208 PolarHBondContact O-N 2.9Å; P205-L209 PolarHBondContact O-N 3.41Å; P205-L209 VanDerWaalsContact O-N 3.15Å
206	A	65.8	Low	64.6	Low	80 Å²	80	93 Å²	93	66%	0.661	51%	0.511	S	S	*	.	H	α-helix	trans	-53.1	-30.7	-171.9	0	0	0	0	0	114.6	L209 Q210	A206-L209 PolarHBondContact O-N 3.49Å; A206-Q210 WeakPolarHBondContact O-CB 3.28Å; A206-Q210 PolarHBondContact O-N 2.89Å
207	A	66	Low	65.1	Low	75 Å²	75	93.6 Å²	93.6	62%	0.62	52%	0.516	S	S	*	.	H	α-helix	trans	-68.5	-38	176.4	0	0	0	0	0	113.6	P205 Q211	P205-A207 PolarHBondContact O-N 2.79Å; A207-Q211 PolarHBondContact O-N 3.4Å; A207-Q211 VanDerWaalsContact O-N 3.08Å
208	E	64.3	Low	65.8	Low	96 Å²	96	92 Å²	92	45%	0.449	51%	0.508	S	S	.	.	H	α-helix	trans	-73.6	-38.1	174.1	-72.5	-169.9	129.3	0	0	110.8	L204 P205 Q210 Q211 V212	L204-E208 WeakPolarHBondContact CD2-OE2 3.42Å; P205-E208 WeakPolarHBondContact CD-OE2 3.47Å; P205-E208 HydrophobicContact CG-CB 4.35Å; P205-E208 HydrophobicContact CG-CG 4.16Å; P205-E208 PolarHBondContact O-N 2.9Å; E208-Q210 VanDerWaalsContact C-N 3.33Å; E208-Q210 PolarHBondContact O-N 2.95Å; E208-Q211 PolarHBondContact O-N 3.25Å; E208-V212 WeakPolarHBondContact O-CG2 3.2Å; E208-V212 PolarHBondContact O-N 3.44Å
209	L	67.4	Low	66.3	Low	62 Å²	62	94.2 Å²	94.2	33%	0.325	52%	0.516	S	S	.	.	H	α-helix	trans	-59	-45.1	173.6	-172.3	63.6	0	0	0	111.3	V201 P205 A206 V212 V213	V201-L209 HydrophobicContact CG1-CD1 4.37Å; V201-L209 HydrophobicContact CG1-CD2 4.38Å; V201-L209 HydrophobicContact CG2-CD1 4.1Å; P205-L209 PolarHBondContact O-N 3.41Å; P205-L209 VanDerWaalsContact O-N 3.15Å; A206-L209 PolarHBondContact O-N 3.49Å; L209-V212 PolarHBondContact O-N 3.14Å; L209-V213 WeakPolarHBondContact O-CG2 3.26Å; L209-V213 PolarHBondContact O-N 3.19Å
210	Q	68.1	Low	66.6	Low	124 Å²	124	94 Å²	94	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-46.5	174.3	-176.4	175	-2.2	0	0	111.5	A206 E208 V212 V213 D214	A206-Q210 WeakPolarHBondContact O-CB 3.28Å; A206-Q210 PolarHBondContact O-N 2.89Å; E208-Q210 VanDerWaalsContact C-N 3.33Å; E208-Q210 PolarHBondContact O-N 2.95Å; Q210-V212 VanDerWaalsContact C-N 3.32Å; Q210-V212 PolarHBondContact O-N 3.24Å; Q210-V213 PolarHBondContact O-N 3.23Å; Q210-D214 WeakPolarHBondContact O-CB 3.24Å; Q210-D214 PolarHBondContact O-N 3.47Å
211	Q	74.4	Confident	67	Low	138 Å²	138	92.7 Å²	92.7	65%	0.645	50%	0.495	S	S	*	.	H	α-helix	trans	-62.8	-36	178.5	-170.6	178.9	62.5	0	0	112.9	A207 E208 K215	A207-Q211 PolarHBondContact O-N 3.4Å; A207-Q211 VanDerWaalsContact O-N 3.08Å; E208-Q211 PolarHBondContact O-N 3.25Å; Q211-K215 VanDerWaalsContact O-CB 3.25Å; Q211-K215 WeakPolarHBondContact O-CB 3.34Å; Q211-K215 PolarHBondContact O-N 3.28Å
212	V	69.4	Low	67.6	Low	73 Å²	73	95.2 Å²	95.2	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-67.6	-43.1	174.8	170.2	0	0	0	0	111.2	L196 E208 L209 Q210 K215 A216	L196-V212 HydrophobicContact CD2-CG1 4.27Å; E208-V212 WeakPolarHBondContact O-CG2 3.2Å; E208-V212 PolarHBondContact O-N 3.44Å; L209-V212 PolarHBondContact O-N 3.14Å; Q210-V212 VanDerWaalsContact C-N 3.32Å; Q210-V212 PolarHBondContact O-N 3.24Å; V212-K215 PolarHBondContact O-N 3.33Å; V212-A216 PolarHBondContact O-N 3.42Å
213	V	69.9	Low	68.2	Low	54 Å²	54	90.3 Å²	90.3	33%	0.327	48%	0.484	S	S	.	.	H	α-helix	trans	-63.5	-49.9	175.3	171	0	0	0	0	111	L196 L209 Q210 K215 A216 V217	L196-V213 HydrophobicContact CD1-CG2 4.45Å; L209-V213 WeakPolarHBondContact O-CG2 3.26Å; L209-V213 PolarHBondContact O-N 3.19Å; Q210-V213 PolarHBondContact O-N 3.23Å; V213-K215 VanDerWaalsContact C-N 3.26Å; V213-K215 PolarHBondContact O-N 3.26Å; V213-A216 PolarHBondContact O-N 3.42Å; V213-A216 VanDerWaalsContact O-N 3.16Å; V213-V217 HydrophobicContact CG1-CG2 4.16Å; V213-V217 WeakPolarHBondContact O-CB 3.47Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.49Å; V213-V217 PolarHBondContact O-N 3.07Å
214	D	72.2	Confident	68.7	Low	77 Å²	77	85.4 Å²	85.4	41%	0.412	47%	0.468	S	S	.	.	H	α-helix	trans	-59.4	-37.6	178.4	-76.7	-27.6	0	0	0	111.7	Q210 N218	Q210-D214 WeakPolarHBondContact O-CB 3.24Å; Q210-D214 PolarHBondContact O-N 3.47Å; D214-N218 WeakPolarHBondContact O-CB 3.12Å; D214-N218 PolarHBondContact O-N 3.03Å; D214-N218 PolarHBondContact O-ND2 3.1Å
215	K	74.9	Confident	69.2	Low	150 Å²	150	88 Å²	88	65%	0.652	48%	0.477	S	S	*	.	H	α-helix	trans	-66.2	-45.7	175.4	-173.4	178.3	178.8	-176.3	0	112.1	Q211 V212 V213 N218 Q219	Q211-K215 VanDerWaalsContact O-CB 3.25Å; Q211-K215 WeakPolarHBondContact O-CB 3.34Å; Q211-K215 PolarHBondContact O-N 3.28Å; V212-K215 PolarHBondContact O-N 3.33Å; V213-K215 VanDerWaalsContact C-N 3.26Å; V213-K215 PolarHBondContact O-N 3.26Å; K215-N218 PolarHBondContact O-N 3.2Å; K215-Q219 WeakPolarHBondContact O-CB 3.08Å; K215-Q219 PolarHBondContact O-N 3.12Å
216	A	68.3	Low	69.7	Low	18 Å²	18	88.5 Å²	88.5	15%	0.149	48%	0.478	C	S	.	.	H	α-helix	trans	-64.7	-43.6	177.4	0	0	0	0	0	111.9	L194 L196 V212 V213 N218 Q219 F220	L194-A216 HydrophobicContact CB-CB 4.48Å; L196-A216 HydrophobicContact CD2-CB 3.76Å; L196-A216 HydrophobicContact CG-CB 4.46Å; V212-A216 PolarHBondContact O-N 3.42Å; V213-A216 PolarHBondContact O-N 3.42Å; V213-A216 VanDerWaalsContact O-N 3.16Å; A216-N218 PolarHBondContact O-N 3.47Å; A216-Q219 PolarHBondContact O-N 3.13Å; A216-F220 PolarHBondContact O-N 2.95Å
217	V	71	Confident	70.3	Confident	47 Å²	47	89 Å²	89	29%	0.285	47%	0.47	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.4	169.7	0	0	0	0	111.2	L194 V213 Q219 F220 L221	L194-V217 HydrophobicContact CD1-CG2 4.09Å; L194-V217 HydrophobicContact CD2-CB 4.49Å; L194-V217 HydrophobicContact CD2-CG2 3.86Å; V213-V217 HydrophobicContact CG1-CG2 4.16Å; V213-V217 WeakPolarHBondContact O-CB 3.47Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.49Å; V213-V217 PolarHBondContact O-N 3.07Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 3.46Å; V217-F220 PolarHBondContact O-N 3.47Å; V217-L221 HydrophobicContact CG1-CD1 3.7Å; V217-L221 HydrophobicContact CG1-CG 4.33Å; V217-L221 WeakPolarHBondContact O-CB 3.31Å; V217-L221 VanDerWaalsContact O-CG 3.29Å; V217-L221 WeakPolarHBondContact O-CG 3.48Å; V217-L221 PolarHBondContact O-N 3.46Å
218	N	69.8	Low	71.1	Confident	99 Å²	99	91.5 Å²	91.5	53%	0.529	47%	0.468	S	S	.	.	H	α-helix	trans	-65.2	-36.7	174.4	-82.2	-76	0	0	0	112.4	D214 K215 A216 F220 L221 N222	D214-N218 WeakPolarHBondContact O-CB 3.12Å; D214-N218 PolarHBondContact O-N 3.03Å; D214-N218 PolarHBondContact O-ND2 3.1Å; K215-N218 PolarHBondContact O-N 3.2Å; A216-N218 PolarHBondContact O-N 3.47Å; N218-F220 VanDerWaalsContact C-N 3.34Å; N218-L221 PolarHBondContact O-N 2.91Å; N218-N222 WeakPolarHBondContact O-CB 3.48Å; N218-N222 PolarHBondContact O-N 3.46Å
219	Q	69.9	Low	72	Confident	135 Å²	135	93.5 Å²	93.5	63%	0.631	48%	0.475	S	S	*	.	H	α-helix	trans	-67.8	-31.3	176.8	-172.8	165.5	-22.4	0	0	112.7	K215 A216 V217 P223	K215-Q219 WeakPolarHBondContact O-CB 3.08Å; K215-Q219 PolarHBondContact O-N 3.12Å; A216-Q219 PolarHBondContact O-N 3.13Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 3.46Å; Q219-P223 WeakPolarHBondContact O-CD 3.33Å
220	F	66	Low	72.9	Confident	99 Å²	99	94.5 Å²	94.5	43%	0.434	48%	0.481	S	S	.	.	H	α-helix	trans	-78.8	-38.4	172.7	-172.9	-93	0	0	0	113.1	K193 L194 A216 V217 N218 P223 V224	K193-F220 WeakPolarHBondContact O-CD2 3.47Å; K193-F220 VanDerWaalsContact O-CE2 3.31Å; K193-F220 WeakPolarHBondContact O-CE2 3.26Å; L194-F220 HydrophobicContact CD2-CB 4.01Å; L194-F220 HydrophobicContact CD2-CG 4.43Å; A216-F220 PolarHBondContact O-N 2.95Å; V217-F220 PolarHBondContact O-N 3.47Å; N218-F220 VanDerWaalsContact C-N 3.34Å; F220-P223 VanDerWaalsContact O-CD 3.3Å; F220-P223 WeakPolarHBondContact O-CD 3.33Å; F220-P223 WeakPolarHBondContact O-CG 3.33Å; F220-V224 HydrophobicContact CE1-CG2 4.4Å
221	L	67.1	Low	73.8	Confident	74 Å²	74	93 Å²	93	39%	0.387	48%	0.48	S	S	.	.	H	α-helix	trans	-76.2	-24.8	-178.6	-69.6	175.3	0	0	0	113.9	V217 N218 V224 K225	V217-L221 HydrophobicContact CG1-CD1 3.7Å; V217-L221 HydrophobicContact CG1-CG 4.33Å; V217-L221 WeakPolarHBondContact O-CB 3.31Å; V217-L221 VanDerWaalsContact O-CG 3.29Å; V217-L221 WeakPolarHBondContact O-CG 3.48Å; V217-L221 PolarHBondContact O-N 3.46Å; N218-L221 PolarHBondContact O-N 2.91Å; L221-V224 PolarHBondContact O-N 3.32Å; L221-K225 WeakPolarHBondContact O-CG 3.44Å; L221-K225 PolarHBondContact O-N 2.62Å; L221-K225 VanDerWaalsContact O-N 3.12Å
222	N	68.5	Low	74.5	Confident	106 Å²	106	92.5 Å²	92.5	57%	0.567	48%	0.478	S	S	*	.	H	α-helix	trans	-59.9	-54.9	176.1	-117.3	-10.2	0	0	0	113.6	N218 V224 K225 V226	N218-N222 WeakPolarHBondContact O-CB 3.48Å; N218-N222 PolarHBondContact O-N 3.46Å; N222-V224 VanDerWaalsContact C-N 3.26Å; N222-V224 PolarHBondContact O-N 3.48Å; N222-K225 PolarHBondContact O-N 2.92Å; N222-V226 WeakPolarHBondContact O-CG2 3.33Å; N222-V226 PolarHBondContact O-N 2.92Å
223	P	71	Confident	75.3	Confident	63 Å²	63	94.4 Å²	94.4	41%	0.409	48%	0.482	S	S	.	.	H	α-helix	trans	-63.7	-30.1	179	24.5	-34	0	0	0	112.6	Q219 F220 V226 N227	Q219-P223 WeakPolarHBondContact O-CD 3.33Å; F220-P223 VanDerWaalsContact O-CD 3.3Å; F220-P223 WeakPolarHBondContact O-CD 3.33Å; F220-P223 WeakPolarHBondContact O-CG 3.33Å; P223-V226 PolarHBondContact O-N 3.33Å; P223-N227 WeakPolarHBondContact O-CB 3.35Å; P223-N227 PolarHBondContact O-N 3.18Å; P223-N227 PolarHBondContact O-ND2 3.04Å
224	V	71.6	Confident	76.4	Confident	73 Å²	73	95.8 Å²	95.8	44%	0.442	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-49.1	173.1	178.7	0	0	0	0	110.8	F220 L221 N222 V226 N227 E228	F220-V224 HydrophobicContact CE1-CG2 4.4Å; L221-V224 PolarHBondContact O-N 3.32Å; N222-V224 VanDerWaalsContact C-N 3.26Å; N222-V224 PolarHBondContact O-N 3.48Å; V224-V226 PolarHBondContact O-N 3.03Å; V224-N227 PolarHBondContact O-N 3.5Å; V224-E228 WeakPolarHBondContact O-CB 3.43Å; V224-E228 PolarHBondContact O-N 3.19Å
225	K	70.5	Confident	77.1	Confident	126 Å²	126	99.4 Å²	99.4	55%	0.548	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-35.4	177.6	-70.3	173.6	179.2	177	0	113.2	L221 N222 K229	L221-K225 WeakPolarHBondContact O-CG 3.44Å; L221-K225 PolarHBondContact O-N 2.62Å; L221-K225 VanDerWaalsContact O-N 3.12Å; N222-K225 PolarHBondContact O-N 2.92Å; K225-K229 WeakPolarHBondContact O-CB 3.32Å; K225-K229 PolarHBondContact O-N 3.42Å; K225-K229 VanDerWaalsContact O-N 3.1Å
226	V	76.9	Confident	77.8	Confident	89 Å²	89	96.9 Å²	96.9	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-68.5	-42.5	174.7	172	0	0	0	0	110.8	N222 P223 V224 K229 L230	N222-V226 WeakPolarHBondContact O-CG2 3.33Å; N222-V226 PolarHBondContact O-N 2.92Å; P223-V226 PolarHBondContact O-N 3.33Å; V224-V226 PolarHBondContact O-N 3.03Å; V226-K229 PolarHBondContact O-N 2.87Å; V226-L230 WeakPolarHBondContact O-CB 3.25Å; V226-L230 PolarHBondContact O-N 3.31Å
227	N	78.8	Confident	78.8	Confident	92 Å²	92	101.4 Å²	101.4	49%	0.492	51%	0.514	S	S	.	.	H	α-helix	trans	-67.6	-39.9	176.5	-72.7	-13.4	0	0	0	112.1	P223 V224 L230 V231	P223-N227 WeakPolarHBondContact O-CB 3.35Å; P223-N227 PolarHBondContact O-N 3.18Å; P223-N227 PolarHBondContact O-ND2 3.04Å; V224-N227 PolarHBondContact O-N 3.5Å; N227-L230 PolarHBondContact O-N 2.94Å; N227-V231 WeakPolarHBondContact O-CB 3.33Å; N227-V231 VanDerWaalsContact O-CG2 3.26Å; N227-V231 WeakPolarHBondContact O-CG2 3.44Å; N227-V231 PolarHBondContact O-N 2.84Å
228	E	83.4	Confident	79.7	Confident	127 Å²	127	102.7 Å²	102.7	59%	0.593	52%	0.522	S	S	*	.	H	α-helix	trans	-58	-50	174	-177.4	170.8	-141.2	0	0	110.7	V224 L230 V231 E232	V224-E228 WeakPolarHBondContact O-CB 3.43Å; V224-E228 PolarHBondContact O-N 3.19Å; E228-L230 PolarHBondContact O-N 3.43Å; E228-V231 CarbonylContact O-C 3.58Å; E228-V231 PolarHBondContact O-N 3.32Å; E228-V231 VanDerWaalsContact O-N 3.16Å; E228-E232 PolarHBondContact O-N 2.98Å
229	K	82.2	Confident	80.6	Confident	137 Å²	137	102 Å²	102	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-63.5	-37	175.5	-171.2	171.7	-176.1	174.2	0	113.2	K225 V226 E232 Q233	K225-K229 WeakPolarHBondContact O-CB 3.32Å; K225-K229 PolarHBondContact O-N 3.42Å; K225-K229 VanDerWaalsContact O-N 3.1Å; V226-K229 PolarHBondContact O-N 2.87Å; K229-E232 PolarHBondContact O-N 2.97Å; K229-Q233 WeakPolarHBondContact O-CG 3.41Å; K229-Q233 PolarHBondContact O-N 3.48Å
230	L	87.7	Confident	81.3	Confident	84 Å²	84	100.8 Å²	100.8	44%	0.44	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-36.3	174.3	-179.1	61.6	0	0	0	111.6	V226 N227 E228 Q233 L234	V226-L230 WeakPolarHBondContact O-CB 3.25Å; V226-L230 PolarHBondContact O-N 3.31Å; N227-L230 PolarHBondContact O-N 2.94Å; E228-L230 PolarHBondContact O-N 3.43Å; L230-Q233 PolarHBondContact O-N 3.07Å; L230-L234 HydrophobicContact CD1-CD1 4.44Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 WeakPolarHBondContact O-CG 3.49Å; L230-L234 PolarHBondContact O-N 2.78Å
231	V	87.2	Confident	82.5	Confident	92 Å²	92	100.7 Å²	100.7	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-69.8	-36.9	174.1	167	0	0	0	0	111.1	N227 E228 L234 K235	N227-V231 WeakPolarHBondContact O-CB 3.33Å; N227-V231 VanDerWaalsContact O-CG2 3.26Å; N227-V231 WeakPolarHBondContact O-CG2 3.44Å; N227-V231 PolarHBondContact O-N 2.84Å; E228-V231 CarbonylContact O-C 3.58Å; E228-V231 PolarHBondContact O-N 3.32Å; E228-V231 VanDerWaalsContact O-N 3.16Å; V231-L234 PolarHBondContact O-N 3.31Å; V231-K235 WeakPolarHBondContact O-CB 3.45Å; V231-K235 PolarHBondContact O-N 3.44Å
232	E	87.2	Confident	83.3	Confident	128 Å²	128	102.3 Å²	102.3	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-61.2	-44.8	169	-71.7	-169.4	130.5	0	0	111.6	E228 K229 K235 T236	E228-E232 PolarHBondContact O-N 2.98Å; K229-E232 PolarHBondContact O-N 2.97Å; E232-K235 PolarHBondContact O-N 3.22Å; E232-T236 WeakPolarHBondContact O-CB 3.35Å; E232-T236 PolarHBondContact O-N 2.98Å; E232-T236 PolarHBondContact O-OG1 2.9Å
233	Q	87.3	Confident	83.9	Confident	112 Å²	112	105.5 Å²	105.5	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-45.8	176.2	-72.3	-173.9	-79.2	0	0	112.1	K229 L230 T236 Q237	K229-Q233 WeakPolarHBondContact O-CG 3.41Å; K229-Q233 PolarHBondContact O-N 3.48Å; L230-Q233 PolarHBondContact O-N 3.07Å; Q233-T236 WeakPolarHBondContact O-CB 3.4Å; Q233-T236 PolarHBondContact O-N 3.32Å; Q233-Q237 WeakPolarHBondContact O-CG 3.46Å; Q233-Q237 PolarHBondContact O-N 3.2Å
234	L	91.9	Very high	84.6	Confident	84 Å²	84	107.7 Å²	107.7	44%	0.44	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-41.7	176.6	-77.6	165.4	0	0	0	111.9	L230 V231 T236 Q237 V238	L230-L234 HydrophobicContact CD1-CD1 4.44Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 WeakPolarHBondContact O-CG 3.49Å; L230-L234 PolarHBondContact O-N 2.78Å; V231-L234 PolarHBondContact O-N 3.31Å; L234-T236 VanDerWaalsContact C-N 3.3Å; L234-T236 PolarHBondContact O-N 3.38Å; L234-Q237 PolarHBondContact O-N 3.41Å; L234-V238 WeakPolarHBondContact O-CB 3.34Å; L234-V238 WeakPolarHBondContact O-CG2 3.47Å; L234-V238 PolarHBondContact O-N 3.46Å
235	K	88	Confident	84.9	Confident	153 Å²	153	107.8 Å²	107.8	67%	0.665	53%	0.53	S	S	*	.	H	α-helix	trans	-64.9	-35.5	175	-174.8	179.2	-179.5	-177	0	111.8	V231 E232 N239	V231-K235 WeakPolarHBondContact O-CB 3.45Å; V231-K235 PolarHBondContact O-N 3.44Å; E232-K235 PolarHBondContact O-N 3.22Å; K235-N239 VanDerWaalsContact O-CB 3.31Å; K235-N239 WeakPolarHBondContact O-CB 3.2Å; K235-N239 PolarHBondContact O-N 3.48Å
236	T	89.8	Confident	85.3	Confident	96 Å²	96	105.6 Å²	105.6	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-66.8	-44.3	172.8	-55.5	0	0	0	0	110.7	E232 Q233 L234 N239 D240	E232-T236 WeakPolarHBondContact O-CB 3.35Å; E232-T236 PolarHBondContact O-N 2.98Å; E232-T236 PolarHBondContact O-OG1 2.9Å; Q233-T236 WeakPolarHBondContact O-CB 3.4Å; Q233-T236 PolarHBondContact O-N 3.32Å; L234-T236 VanDerWaalsContact C-N 3.3Å; L234-T236 PolarHBondContact O-N 3.38Å; T236-N239 PolarHBondContact O-N 3.18Å; T236-D240 WeakPolarHBondContact O-CB 3.43Å; T236-D240 PolarHBondContact O-N 3.05Å
237	Q	89.5	Confident	85.2	Confident	114 Å²	114	106.9 Å²	106.9	53%	0.533	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-39.9	174.7	-74.2	176	-13.4	0	0	112.6	Q233 L234 L241	Q233-Q237 WeakPolarHBondContact O-CG 3.46Å; Q233-Q237 PolarHBondContact O-N 3.2Å; L234-Q237 PolarHBondContact O-N 3.41Å; Q237-L241 VanDerWaalsContact O-CB 3.26Å; Q237-L241 WeakPolarHBondContact O-CB 3.3Å; Q237-L241 WeakPolarHBondContact O-CG 3.02Å; Q237-L241 PolarHBondContact O-N 3.27Å
238	V	88.5	Confident	84.8	Confident	74 Å²	74	107.7 Å²	107.7	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-45.5	175.5	169	0	0	0	0	110.7	L234 D240 L241 E242	L234-V238 WeakPolarHBondContact O-CB 3.34Å; L234-V238 WeakPolarHBondContact O-CG2 3.47Å; L234-V238 PolarHBondContact O-N 3.46Å; V238-D240 PolarHBondContact O-N 3.08Å; V238-L241 CarbonylContact O-C 3.54Å; V238-L241 PolarHBondContact O-N 3.16Å; V238-E242 HydrophobicContact CG1-CG 4.26Å; V238-E242 WeakPolarHBondContact O-CB 3.39Å; V238-E242 VanDerWaalsContact O-CG 3.23Å; V238-E242 WeakPolarHBondContact O-CG 3.43Å; V238-E242 PolarHBondContact O-N 3.5Å
239	N	88.4	Confident	83.9	Confident	83 Å²	83	109.2 Å²	109.2	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-36.2	177.8	-169.2	-27.4	0	0	0	112.4	K235 T236 E242 R243	K235-N239 VanDerWaalsContact O-CB 3.31Å; K235-N239 WeakPolarHBondContact O-CB 3.2Å; K235-N239 PolarHBondContact O-N 3.48Å; T236-N239 PolarHBondContact O-N 3.18Å; N239-E242 PolarHBondContact O-N 3.03Å; N239-R243 WeakPolarHBondContact O-CB 3.24Å; N239-R243 VanDerWaalsContact O-CG 3.31Å; N239-R243 WeakPolarHBondContact O-CG 3.28Å; N239-R243 PolarHBondContact O-N 2.74Å
240	D	86.3	Confident	82.7	Confident	110 Å²	110	103.4 Å²	103.4	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-69.1	-39	173.5	-166	57.2	0	0	0	111.8	T236 V238 R243 F244	T236-D240 WeakPolarHBondContact O-CB 3.43Å; T236-D240 PolarHBondContact O-N 3.05Å; V238-D240 PolarHBondContact O-N 3.08Å; D240-R243 PolarHBondContact O-N 2.75Å; D240-F244 VanDerWaalsContact O-CB 3.31Å; D240-F244 WeakPolarHBondContact O-CB 3.29Å; D240-F244 PolarHBondContact O-N 2.79Å
241	L	89.6	Confident	81.1	Confident	98 Å²	98	104.2 Å²	104.2	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-67.7	-38.3	171.6	-75.1	169	0	0	0	112.4	Q237 V238 F244 I245	Q237-L241 VanDerWaalsContact O-CB 3.26Å; Q237-L241 WeakPolarHBondContact O-CB 3.3Å; Q237-L241 WeakPolarHBondContact O-CG 3.02Å; Q237-L241 PolarHBondContact O-N 3.27Å; V238-L241 CarbonylContact O-C 3.54Å; V238-L241 PolarHBondContact O-N 3.16Å; L241-F244 CarbonylContact O-C 3.59Å; L241-F244 PolarHBondContact O-N 3.26Å; L241-I245 VanDerWaalsContact O-CB 3.27Å; L241-I245 WeakPolarHBondContact O-CB 3.34Å; L241-I245 WeakPolarHBondContact O-CD1 3.41Å; L241-I245 WeakPolarHBondContact O-CG1 3.5Å; L241-I245 PolarHBondContact O-N 3.3Å
242	E	85.6	Confident	79.4	Confident	108 Å²	108	101.7 Å²	101.7	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-45.7	173.3	-76.4	168	159.6	0	0	110	V238 N239 F244 I245 D246	V238-E242 HydrophobicContact CG1-CG 4.26Å; V238-E242 WeakPolarHBondContact O-CB 3.39Å; V238-E242 VanDerWaalsContact O-CG 3.23Å; V238-E242 WeakPolarHBondContact O-CG 3.43Å; V238-E242 PolarHBondContact O-N 3.5Å; N239-E242 PolarHBondContact O-N 3.03Å; E242-F244 VanDerWaalsContact C-N 3.34Å; E242-F244 PolarHBondContact O-N 3.16Å; E242-I245 CarbonylContact O-C 3.56Å; E242-I245 PolarHBondContact O-N 2.85Å; E242-D246 WeakPolarHBondContact O-CB 3.49Å; E242-D246 PolarHBondContact O-N 2.94Å
243	R	80.9	Confident	77.9	Confident	173 Å²	173	98.5 Å²	98.5	65%	0.653	51%	0.513	S	S	*	.	H	α-helix	trans	-60.2	-40.2	171.5	-79	171.2	159.5	-97.6	-6.3	113	N239 D240 F247	N239-R243 WeakPolarHBondContact O-CB 3.24Å; N239-R243 VanDerWaalsContact O-CG 3.31Å; N239-R243 WeakPolarHBondContact O-CG 3.28Å; N239-R243 PolarHBondContact O-N 2.74Å; D240-R243 PolarHBondContact O-N 2.75Å; R243-F247 VanDerWaalsContact O-CB 3.23Å; R243-F247 WeakPolarHBondContact O-CB 3.22Å; R243-F247 PolarHBondContact O-N 3.47Å
244	F	84.2	Confident	76.4	Confident	109 Å²	109	95.4 Å²	95.4	48%	0.478	50%	0.503	S	S	.	.	H	α-helix	trans	-69.1	-35.4	176	-177.4	-111.5	0	0	0	111.9	D240 L241 E242 F247 L248	D240-F244 VanDerWaalsContact O-CB 3.31Å; D240-F244 WeakPolarHBondContact O-CB 3.29Å; D240-F244 PolarHBondContact O-N 2.79Å; L241-F244 CarbonylContact O-C 3.59Å; L241-F244 PolarHBondContact O-N 3.26Å; E242-F244 VanDerWaalsContact C-N 3.34Å; E242-F244 PolarHBondContact O-N 3.16Å; F244-F247 HydrophobicContact CD2-CD1 4.48Å; F244-F247 WeakPolarHBondContact O-CB 3.28Å; F244-F247 PolarHBondContact O-N 2.79Å; F244-L248 HydrophobicContact CD1-CD1 3.93Å; F244-L248 HydrophobicContact CE1-CD1 3.42Å; F244-L248 VanDerWaalsContact CE1-CD1 3.42Å; F244-L248 HydrophobicContact CE1-CG 4.2Å; F244-L248 HydrophobicContact CE2-CD1 4.43Å; F244-L248 HydrophobicContact CE2-CG 4.4Å; F244-L248 HydrophobicContact CZ-CD1 3.71Å; F244-L248 HydrophobicContact CZ-CD2 4.43Å; F244-L248 HydrophobicContact CZ-CG 4.14Å; F244-L248 WeakPolarHBondContact O-CB 3.46Å; F244-L248 WeakPolarHBondContact O-CG 3.38Å; F244-L248 PolarHBondContact O-N 3Å
245	I	79.8	Confident	74.8	Confident	75 Å²	75	93.5 Å²	93.5	39%	0.385	50%	0.497	S	S	.	.	H	α-helix	trans	-70.2	-42.3	174.3	-73.7	163.9	0	0	0	110.6	L241 E242 F247 L248 H249	L241-I245 VanDerWaalsContact O-CB 3.27Å; L241-I245 WeakPolarHBondContact O-CB 3.34Å; L241-I245 WeakPolarHBondContact O-CD1 3.41Å; L241-I245 WeakPolarHBondContact O-CG1 3.5Å; L241-I245 PolarHBondContact O-N 3.3Å; E242-I245 CarbonylContact O-C 3.56Å; E242-I245 PolarHBondContact O-N 2.85Å; I245-F247 VanDerWaalsContact C-N 3.28Å; I245-F247 PolarHBondContact O-N 2.83Å; I245-L248 PolarHBondContact O-N 3.48Å; I245-H249 WeakPolarHBondContact CG2-ND1 3.37Å; I245-H249 VanDerWaalsContact O-CB 3.28Å; I245-H249 WeakPolarHBondContact O-CB 3.22Å; I245-H249 PolarHBondContact O-N 3.22Å
246	D	77.8	Confident	73.6	Confident	80 Å²	80	92 Å²	92	43%	0.428	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-34.1	172.9	-81	-25.2	0	0	0	112.3	E242 G250 S251	E242-D246 WeakPolarHBondContact O-CB 3.49Å; E242-D246 PolarHBondContact O-N 2.94Å; D246-G250 CarbonylContact O-C 3.59Å; D246-G250 WeakPolarHBondContact O-CA 3.25Å; D246-G250 PolarHBondContact O-N 2.96Å; D246-S251 PolarHBondContact O-N 3.02Å
247	F	75.1	Confident	72.5	Confident	115 Å²	115	92.8 Å²	92.8	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-69.5	-38.9	173.2	176.4	-95.3	0	0	0	112.4	R243 F244 I245 C254	R243-F247 VanDerWaalsContact O-CB 3.23Å; R243-F247 WeakPolarHBondContact O-CB 3.22Å; R243-F247 PolarHBondContact O-N 3.47Å; F244-F247 HydrophobicContact CD2-CD1 4.48Å; F244-F247 WeakPolarHBondContact O-CB 3.28Å; F244-F247 PolarHBondContact O-N 2.79Å; I245-F247 VanDerWaalsContact C-N 3.28Å; I245-F247 PolarHBondContact O-N 2.83Å; F247-C254 HydrophobicContact CD2-CB 3.99Å; F247-C254 HydrophobicContact CE2-CB 3.87Å
248	L	71.1	Confident	71.3	Confident	109 Å²	109	92.7 Å²	92.7	57%	0.571	50%	0.498	S	S	*	.	H	α-helix	trans	-79	-44.5	177.8	-75.3	-178.9	0	0	0	114	F244 I245 G250	F244-L248 HydrophobicContact CD1-CD1 3.93Å; F244-L248 HydrophobicContact CE1-CD1 3.42Å; F244-L248 VanDerWaalsContact CE1-CD1 3.42Å; F244-L248 HydrophobicContact CE1-CG 4.2Å; F244-L248 HydrophobicContact CE2-CD1 4.43Å; F244-L248 HydrophobicContact CE2-CG 4.4Å; F244-L248 HydrophobicContact CZ-CD1 3.71Å; F244-L248 HydrophobicContact CZ-CD2 4.43Å; F244-L248 HydrophobicContact CZ-CG 4.14Å; F244-L248 WeakPolarHBondContact O-CB 3.46Å; F244-L248 WeakPolarHBondContact O-CG 3.38Å; F244-L248 PolarHBondContact O-N 3Å; I245-L248 PolarHBondContact O-N 3.48Å; L248-G250 VanDerWaalsContact C-N 3.28Å
249	H	64.4	Low	70.4	Confident	159 Å²	159	91.9 Å²	91.9	74%	0.736	50%	0.499	S	S	*	.	H	α-helix	trans	-77.9	-15.8	176.6	-67.7	166.6	0	0	0	112.6	I245	I245-H249 WeakPolarHBondContact CG2-ND1 3.37Å; I245-H249 VanDerWaalsContact O-CB 3.28Å; I245-H249 WeakPolarHBondContact O-CB 3.22Å; I245-H249 PolarHBondContact O-N 3.22Å
250	G	55.7	Low	69.6	Low	15 Å²	15	94.8 Å²	94.8	16%	0.155	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	27.8	166.3	0	0	0	0	0	116.1	D246 L248 G252 S255	D246-G250 CarbonylContact O-C 3.59Å; D246-G250 WeakPolarHBondContact O-CA 3.25Å; D246-G250 PolarHBondContact O-N 2.96Å; L248-G250 VanDerWaalsContact C-N 3.28Å; G250-G252 VanDerWaalsContact C-N 3.32Å; G250-S255 WeakPolarHBondContact O-CB 3.45Å; G250-S255 PolarHBondContact O-OG 2.91Å
251	S	53.9	Low	69.1	Low	102 Å²	102	92.1 Å²	92.1	71%	0.713	50%	0.501	S	S	*	.			trans	-81.5	-11.6	176.4	-157.4	0	0	0	0	113.1	D246	D246-S251 PolarHBondContact O-N 3.02Å
252	G	53.1	Low	68.3	Low	38 Å²	38	92.9 Å²	92.9	39%	0.392	51%	0.505	S	S	.	.	S	Bend	trans	-128.8	95.1	-178	0	0	0	0	0	114.4	G250 C254	G250-G252 VanDerWaalsContact C-N 3.32Å; G252-C254 PolarHBondContact O-N 3.44Å
253	A	55.6	Low	67.9	Low	61 Å²	61	89.8 Å²	89.8	50%	0.504	50%	0.498	S	S	.	.	S	Bend	trans	55.7	-49.4	166.6	0	0	0	0	0	119	S255 D256 I257	A253-S255 VanDerWaalsContact C-N 3.25Å; A253-S255 PolarHBondContact O-N 3.34Å; A253-D256 PolarHBondContact O-N 3Å; A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.38Å
254	C	54.3	Low	67.9	Low	48 Å²	48	84.6 Å²	84.6	32%	0.324	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-25.7	-176	-69.6	0	0	0	0	113.1	F247 G252 L258	F247-C254 HydrophobicContact CD2-CB 3.99Å; F247-C254 HydrophobicContact CE2-CB 3.87Å; G252-C254 PolarHBondContact O-N 3.44Å; C254-L258 WeakPolarHBondContact O-CB 3.34Å; C254-L258 VanDerWaalsContact O-CG 3.24Å; C254-L258 WeakPolarHBondContact O-CG 3.31Å; C254-L258 PolarHBondContact O-N 2.91Å
255	S	58.8	Low	67.6	Low	44 Å²	44	85.4 Å²	85.4	31%	0.308	49%	0.487	S	S	.	.	H	α-helix	trans	-72.4	-45.5	172.6	165.3	0	0	0	0	112.9	G250 A253 I257 L258 A259	G250-S255 WeakPolarHBondContact O-CB 3.45Å; G250-S255 PolarHBondContact O-OG 2.91Å; A253-S255 VanDerWaalsContact C-N 3.25Å; A253-S255 PolarHBondContact O-N 3.34Å; S255-I257 VanDerWaalsContact C-N 3.26Å; S255-I257 PolarHBondContact O-N 3.49Å; S255-L258 PolarHBondContact O-N 3.37Å; S255-A259 WeakPolarHBondContact O-CB 3.35Å; S255-A259 PolarHBondContact O-N 3.23Å
256	D	63.9	Low	67.6	Low	121 Å²	121	88 Å²	88	65%	0.647	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-37.9	174.2	-69.7	-52.4	0	0	0	111.2	A253 K260	A253-D256 PolarHBondContact O-N 3Å; D256-K260 WeakPolarHBondContact O-CB 3.48Å; D256-K260 PolarHBondContact O-N 3.45Å
257	I	65.5	Low	67.4	Low	113 Å²	113	90.4 Å²	90.4	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-66.8	-45.3	175	-65.8	166.9	0	0	0	111.1	A253 S255 A261	A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.38Å; S255-I257 VanDerWaalsContact C-N 3.26Å; S255-I257 PolarHBondContact O-N 3.49Å; I257-A261 WeakPolarHBondContact O-CB 3.24Å; I257-A261 PolarHBondContact O-N 2.9Å
258	L	64.8	Low	67.2	Low	112 Å²	112	88.2 Å²	88.2	59%	0.586	49%	0.494	S	S	*	.	H	α-helix	trans	-68.6	-46.9	178	-80.8	165.9	0	0	0	111.8	C254 S255 K260 A261 L262	C254-L258 WeakPolarHBondContact O-CB 3.34Å; C254-L258 VanDerWaalsContact O-CG 3.24Å; C254-L258 WeakPolarHBondContact O-CG 3.31Å; C254-L258 PolarHBondContact O-N 2.91Å; S255-L258 PolarHBondContact O-N 3.37Å; L258-K260 VanDerWaalsContact C-N 3.31Å; L258-K260 PolarHBondContact O-N 2.79Å; L258-A261 CarbonylContact O-C 3.55Å; L258-A261 PolarHBondContact O-N 3.5Å; L258-L262 VanDerWaalsContact O-CB 3.31Å; L258-L262 WeakPolarHBondContact O-CB 3.39Å; L258-L262 PolarHBondContact O-N 2.87Å
259	A	68.7	Low	66.8	Low	57 Å²	57	88.2 Å²	88.2	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-37.7	177.2	0	0	0	0	0	111.5	S255 A263	S255-A259 WeakPolarHBondContact O-CB 3.35Å; S255-A259 PolarHBondContact O-N 3.23Å; A259-A263 WeakPolarHBondContact O-CB 3.35Å; A259-A263 PolarHBondContact O-N 2.95Å
260	K	73.3	Confident	66.7	Low	144 Å²	144	86.6 Å²	86.6	63%	0.626	48%	0.484	S	S	*	.	H	α-helix	trans	-68.2	-44.2	171.6	-171.3	171.5	-176.7	178.2	0	111.7	D256 L258 L262 A263 D264	D256-K260 WeakPolarHBondContact O-CB 3.48Å; D256-K260 PolarHBondContact O-N 3.45Å; L258-K260 VanDerWaalsContact C-N 3.31Å; L258-K260 PolarHBondContact O-N 2.79Å; K260-L262 VanDerWaalsContact C-N 3.34Å; K260-L262 PolarHBondContact O-N 2.93Å; K260-A263 CarbonylContact O-C 3.57Å; K260-A263 PolarHBondContact O-N 2.91Å; K260-D264 WeakPolarHBondContact O-CB 3.35Å; K260-D264 PolarHBondContact O-N 2.91Å
261	A	74.4	Confident	66.8	Low	53 Å²	53	91.6 Å²	91.6	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-36.1	174.9	0	0	0	0	0	112.8	I257 L258 F265	I257-A261 WeakPolarHBondContact O-CB 3.24Å; I257-A261 PolarHBondContact O-N 2.9Å; L258-A261 CarbonylContact O-C 3.55Å; L258-A261 PolarHBondContact O-N 3.5Å; A261-F265 WeakPolarHBondContact O-CB 3.48Å; A261-F265 PolarHBondContact O-N 3.13Å
262	L	74.2	Confident	66.8	Low	115 Å²	115	93 Å²	93	60%	0.602	50%	0.502	S	S	*	.	H	α-helix	trans	-75	-34.1	175.4	-126.6	162.7	0	0	0	111.2	L258 K260 K266	L258-L262 VanDerWaalsContact O-CB 3.31Å; L258-L262 WeakPolarHBondContact O-CB 3.39Å; L258-L262 PolarHBondContact O-N 2.87Å; K260-L262 VanDerWaalsContact C-N 3.34Å; K260-L262 PolarHBondContact O-N 2.93Å; L262-K266 WeakPolarHBondContact O-CB 3.43Å; L262-K266 PolarHBondContact O-N 3.41Å
263	A	77	Confident	66.7	Low	43 Å²	43	95.9 Å²	95.9	36%	0.355	52%	0.516	S	S	.	.	H	α-helix	trans	-69.2	-39.4	171.3	0	0	0	0	0	111.9	A259 K260 K266 R267	A259-A263 WeakPolarHBondContact O-CB 3.35Å; A259-A263 PolarHBondContact O-N 2.95Å; K260-A263 CarbonylContact O-C 3.57Å; K260-A263 PolarHBondContact O-N 2.91Å; A263-K266 PolarHBondContact O-N 3.14Å; A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 3.5Å
264	D	79.6	Confident	66.5	Low	64 Å²	64	96.4 Å²	96.4	34%	0.342	52%	0.52	S	S	.	.	H	α-helix	trans	-74.6	-35.6	176.1	-76	-35.9	0	0	0	111.9	K260 R267 T268	K260-D264 WeakPolarHBondContact O-CB 3.35Å; K260-D264 PolarHBondContact O-N 2.91Å; D264-R267 PolarHBondContact O-N 3.02Å; D264-R267 IonicContact OD1-CZ 3.17Å; D264-R267 IonicContact OD1-NH1 3.42Å; D264-R267 PolarHBondContact OD1-NH1 3.14Å; D264-T268 WeakPolarHBondContact O-CB 3.44Å; D264-T268 WeakPolarHBondContact O-CG2 3.4Å; D264-T268 PolarHBondContact O-N 2.74Å; D264-T268 PolarHBondContact O-OG1 3.03Å
265	F	78.9	Confident	65.9	Low	126 Å²	126	100.5 Å²	100.5	55%	0.553	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-47.6	167.5	-178.8	-99.9	0	0	0	110.9	A261 R267 T268 H269	A261-F265 WeakPolarHBondContact O-CB 3.48Å; A261-F265 PolarHBondContact O-N 3.13Å; F265-R267 PolarHBondContact O-N 3.12Å; F265-T268 WeakPolarHBondContact CA-OG1 3.31Å; F265-T268 PolarHBondContact O-N 3.23Å; F265-T268 PolarHBondContact O-OG1 3.43Å; F265-H269 AromaticContact CZ-CD2 3.74Å; F265-H269 WeakPolarHBondContact O-CB 3.43Å; F265-H269 PolarHBondContact O-N 3.21Å
266	K	78.6	Confident	65	Low	128 Å²	128	106.1 Å²	106.1	56%	0.557	57%	0.566	S	S	*	*	H	α-helix	trans	-65	-38.8	177.3	-171.3	173.2	-177.5	177.3	0	112	L262 A263 H269 Q270	L262-K266 WeakPolarHBondContact O-CB 3.43Å; L262-K266 PolarHBondContact O-N 3.41Å; A263-K266 PolarHBondContact O-N 3.14Å; K266-H269 PolarHBondContact O-N 3.4Å; K266-Q270 VanDerWaalsContact O-CB 3.29Å; K266-Q270 WeakPolarHBondContact O-CB 3.37Å; K266-Q270 VanDerWaalsContact O-CG 3.26Å; K266-Q270 WeakPolarHBondContact O-CG 3.38Å; K266-Q270 PolarHBondContact O-N 3.23Å
267	R	74.8	Confident	64	Low	131 Å²	131	109.6 Å²	109.6	49%	0.494	58%	0.578	S	S	.	*	H	α-helix	trans	-65.1	-47	175.9	177.1	179.9	-72.8	127.6	-0.9	111.7	A263 D264 F265 Q270 Q271	A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 3.5Å; D264-R267 PolarHBondContact O-N 3.02Å; D264-R267 IonicContact OD1-CZ 3.17Å; D264-R267 IonicContact OD1-NH1 3.42Å; D264-R267 PolarHBondContact OD1-NH1 3.14Å; F265-R267 PolarHBondContact O-N 3.12Å; R267-Q270 PolarHBondContact O-N 3.46Å; R267-Q271 WeakPolarHBondContact O-CB 3.25Å; R267-Q271 VanDerWaalsContact O-CG 3.28Å; R267-Q271 WeakPolarHBondContact O-CG 3.45Å; R267-Q271 PolarHBondContact O-N 2.99Å
268	T	70.7	Confident	62.9	Low	69 Å²	69	112.2 Å²	112.2	42%	0.423	59%	0.592	S	S	.	*	H	α-helix	trans	-65.4	-43.4	174.5	48.1	0	0	0	0	111.2	D264 F265 Q270 Q271 L272	D264-T268 WeakPolarHBondContact O-CB 3.44Å; D264-T268 WeakPolarHBondContact O-CG2 3.4Å; D264-T268 PolarHBondContact O-N 2.74Å; D264-T268 PolarHBondContact O-OG1 3.03Å; F265-T268 WeakPolarHBondContact CA-OG1 3.31Å; F265-T268 PolarHBondContact O-N 3.23Å; F265-T268 PolarHBondContact O-OG1 3.43Å; T268-Q270 VanDerWaalsContact C-N 3.34Å; T268-Q270 PolarHBondContact O-N 3.13Å; T268-Q271 PolarHBondContact O-N 3.25Å; T268-L272 WeakPolarHBondContact O-CB 3.44Å; T268-L272 VanDerWaalsContact O-CG 3.26Å; T268-L272 WeakPolarHBondContact O-CG 3.26Å; T268-L272 PolarHBondContact O-N 3.02Å
269	H	62.3	Low	61.9	Low	110 Å²	110	112.3 Å²	112.3	51%	0.509	60%	0.599	S	S	.	*	H	α-helix	trans	-69.9	-26.7	179.1	-146.6	-49.6	0	0	0	113.6	F265 K266 S273	F265-H269 AromaticContact CZ-CD2 3.74Å; F265-H269 WeakPolarHBondContact O-CB 3.43Å; F265-H269 PolarHBondContact O-N 3.21Å; K266-H269 PolarHBondContact O-N 3.4Å; H269-S273 WeakPolarHBondContact O-CB 3.32Å; H269-S273 PolarHBondContact O-N 3.44Å; H269-S273 VanDerWaalsContact O-N 3.17Å
270	Q	62.4	Low	60.6	Low	125 Å²	125	115.5 Å²	115.5	58%	0.584	62%	0.618	S	S	*	*	H	α-helix	trans	-77.5	-34.7	169.7	-75.2	-175	-74.3	0	0	112.5	K266 R267 T268 S273 A274	K266-Q270 VanDerWaalsContact O-CB 3.29Å; K266-Q270 WeakPolarHBondContact O-CB 3.37Å; K266-Q270 VanDerWaalsContact O-CG 3.26Å; K266-Q270 WeakPolarHBondContact O-CG 3.38Å; K266-Q270 PolarHBondContact O-N 3.23Å; R267-Q270 PolarHBondContact O-N 3.46Å; T268-Q270 VanDerWaalsContact C-N 3.34Å; T268-Q270 PolarHBondContact O-N 3.13Å; Q270-S273 PolarHBondContact O-N 3.25Å; Q270-A274 WeakPolarHBondContact O-CB 3.38Å; Q270-A274 PolarHBondContact O-N 3.12Å
271	Q	58.4	Low	58.8	Low	120 Å²	120	113.6 Å²	113.6	56%	0.561	62%	0.622	S	S	*	*	H	α-helix	trans	-68.4	-39.9	172.3	-73.4	172.2	-1.8	0	0	111.7	R267 T268 S273 A274 N275	R267-Q271 WeakPolarHBondContact O-CB 3.25Å; R267-Q271 VanDerWaalsContact O-CG 3.28Å; R267-Q271 WeakPolarHBondContact O-CG 3.45Å; R267-Q271 PolarHBondContact O-N 2.99Å; T268-Q271 PolarHBondContact O-N 3.25Å; Q271-S273 PolarHBondContact O-N 2.69Å; Q271-A274 PolarHBondContact O-N 3.46Å; Q271-A274 VanDerWaalsContact O-N 3.11Å; Q271-N275 PolarHBondContact O-N 2.89Å
272	L	53.8	Low	57.1	Low	130 Å²	130	116.2 Å²	116.2	68%	0.681	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-21.2	171.6	-72.6	164.4	0	0	0	113.2	T268	T268-L272 WeakPolarHBondContact O-CB 3.44Å; T268-L272 VanDerWaalsContact O-CG 3.26Å; T268-L272 WeakPolarHBondContact O-CG 3.26Å; T268-L272 PolarHBondContact O-N 3.02Å
273	S	51	Low	55.3	Low	99 Å²	99	117 Å²	117	69%	0.692	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-3.1	173.2	-172.4	0	0	0	0	113.7	H269 Q270 Q271	H269-S273 WeakPolarHBondContact O-CB 3.32Å; H269-S273 PolarHBondContact O-N 3.44Å; H269-S273 VanDerWaalsContact O-N 3.17Å; Q270-S273 PolarHBondContact O-N 3.25Å; Q271-S273 PolarHBondContact O-N 2.69Å
274	A	50.2	Low	53.5	Low	72 Å²	72	124.6 Å²	124.6	60%	0.595	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-23.6	-174.1	0	0	0	0	0	114.1	Q270 Q271	Q270-A274 WeakPolarHBondContact O-CB 3.38Å; Q270-A274 PolarHBondContact O-N 3.12Å; Q271-A274 PolarHBondContact O-N 3.46Å; Q271-A274 VanDerWaalsContact O-N 3.11Å
275	N	43.6	Very low	51.5	Low	135 Å²	135	125.6 Å²	125.6	72%	0.722	67%	0.673	S	S	*	*			trans	-121.3	85.3	-176.8	-69.9	-31.3	0	0	0	111.8	Q271 E277	Q271-N275 PolarHBondContact O-N 2.89Å; N275-E277 PolarHBondContact O-N 3.25Å; N275-E277 VanDerWaalsContact O-N 3.15Å
276	N	38	Very low	49.6	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	69%	0.685	S	S	*	*			trans	-78.2	81.3	166.3	-86	-29.6	0	0	0	110.3
277	E	43.9	Very low	47.7	Very low	193 Å²	193	131.1 Å²	131.1	90%	0.902	70%	0.698	S	S	*	*			trans	-152.5	146.4	161.9	-116.8	156.3	-133.9	0	0	112.7	N275	N275-E277 PolarHBondContact O-N 3.25Å; N275-E277 VanDerWaalsContact O-N 3.15Å
278	I	41.7	Very low	46	Very low	168 Å²	168	128.9 Å²	128.9	86%	0.862	70%	0.703	S	S	*	*			trans	-96.1	157	-150	-86	170.6	0	0	0	113.1
279	P	44.3	Very low	44.4	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	72%	0.718	S	S	*	*			trans	-105.9	-178.5	-150	41.1	-35.9	0	0	0	115.8
280	S	40.8	Very low	43.1	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	73%	0.727	S	S	*	*			trans	-146.1	172.8	161.9	-165.9	0	0	0	0	111.3
281	C	35.5	Very low	42.2	Very low	105 Å²	105	135.6 Å²	135.6	71%	0.709	74%	0.737	S	S	*	*			trans	-125.5	-178.6	-151.7	-60.9	0	0	0	0	115.2
282	C	38.2	Very low	41.2	Very low	107 Å²	107	136 Å²	136	72%	0.723	74%	0.742	S	S	*	*			trans	90.7	122	149.6	-52.7	0	0	0	0	121.2
283	N	38.1	Very low	40.6	Very low	131 Å²	131	135.1 Å²	135.1	70%	0.701	74%	0.739	S	S	*	*				107.3	108.8	120.8	-72.3	-3.3	0	0	0	124.6
284	Y	38	Very low	40.1	Very low	203 Å²	203	135.9 Å²	135.9	80%	0.796	74%	0.735	S	S	*	*				77.8	127.6	124.5	-81.3	-64.4	0	0	0	125.7
285	S	38.7	Very low	39.8	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	74%	0.741	S	S	*	*			trans	89.8	113.7	131.4	-72.5	0	0	0	0	122.9
286	N	37.5	Very low	39.7	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	74%	0.737	S	S	*	*				53.1	149.9	117.3	-54.8	-41.4	0	0	0	120.3
287	R	38.7	Very low	39.9	Very low	219 Å²	219	136.1 Å²	136.1	83%	0.826	73%	0.726	S	S	*	*			cis	-170.2	154.6	28.2	-153.1	-164.8	-178.5	-162.6	0.8	114.1
288	S	39	Very low	40	Very low	84 Å²	84	133.7 Å²	133.7	59%	0.587	72%	0.719	S	S	*	*			trans	70.4	143.3	138.8	54.2	0	0	0	0	126.7
289	H	38.8	Very low	39.9	Very low	163 Å²	163	133.3 Å²	133.3	76%	0.755	72%	0.719	S	S	*	*			trans	98.1	85.6	141.4	-80.1	-54.2	0	0	0	124.2
290	T	34.1	Very low	39.7	Very low	111 Å²	111	134.6 Å²	134.6	68%	0.681	72%	0.72	S	S	*	*				17.4	130.6	119.9	59.4	0	0	0	0	121.4
291	Q	44.3	Very low	39.7	Very low	171 Å²	171	135.1 Å²	135.1	80%	0.799	71%	0.712	S	S	*	*				179	129.5	102.3	-102	-170.4	-46.5	0	0	115.8
292	N	37.7	Very low	40	Very low	127 Å²	127	136.2 Å²	136.2	68%	0.679	71%	0.711	S	S	*	*				58.9	129.7	127	-74.8	53	0	0	0	126.4
293	N	40	Very low	39.9	Very low	113 Å²	113	137.5 Å²	137.5	60%	0.604	71%	0.711	S	S	*	*			trans	94.3	114.7	133.5	-72.6	46.3	0	0	0	122.9
294	D	41.2	Very low	39.7	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	71%	0.708	S	S	*	*				54.1	121.9	124.9	-37	-21.6	0	0	0	121.5
295	N	43.8	Very low	39.5	Very low	135 Å²	135	130.9 Å²	130.9	72%	0.722	70%	0.704	S	S	*	*				174.9	133.6	90	-90.4	-73.8	0	0	0	113.4
296	N	41.4	Very low	39.2	Very low	118 Å²	118	131.9 Å²	131.9	63%	0.631	71%	0.707	S	S	*	*			trans	57.9	116.4	132.6	-68.1	43.2	0	0	0	124.1
297	D	42.7	Very low	39.1	Very low	121 Å²	121	133.9 Å²	133.9	65%	0.647	71%	0.709	S	S	*	*				92.6	118.2	110.5	-64	-4.9	0	0	0	123.7
298	N	45	Very low	38.7	Very low	141 Å²	141	128.1 Å²	128.1	75%	0.754	70%	0.702	S	S	*	*			trans	84	130.6	134.5	-64.3	-28	0	0	0	121
299	D	39.9	Very low	38.6	Very low	161 Å²	161	128.1 Å²	128.1	86%	0.861	70%	0.702	S	S	*	*			trans	-79	136.6	-177.1	-54	-78.8	0	0	0	113.3
300	N	40.7	Very low	38.4	Very low	141 Å²	141	128 Å²	128	75%	0.754	70%	0.702	S	S	*	*			trans	-91.4	126.7	159.9	-80.6	-60.5	0	0	0	108.1
301	L	41.1	Very low	38.5	Very low	135 Å²	135	129.3 Å²	129.3	71%	0.707	70%	0.703	S	S	*	*				75	145.6	75.1	-95	173.5	0	0	0	114.4
302	D	40.7	Very low	38.4	Very low	128 Å²	128	129.6 Å²	129.6	68%	0.684	70%	0.704	S	S	*	*			trans	66.9	166	163.4	-68.3	-36.1	0	0	0	119.1
303	N	35.7	Very low	38.6	Very low	133 Å²	133	129 Å²	129	71%	0.711	71%	0.707	S	S	*	*				-173.6	162.1	-52.6	-119.8	-49.3	0	0	0	107.8
304	S	35.1	Very low	38.4	Very low	91 Å²	91	126.8 Å²	126.8	64%	0.636	71%	0.711	S	S	*	*			trans	29.2	102.3	152.2	66.1	0	0	0	0	121.3
305	S	34.4	Very low	38.3	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	72%	0.718	S	S	*	*				72.6	145.7	113.1	75.6	0	0	0	0	124.4
306	T	31.2	Very low	38.1	Very low	107 Å²	107	128.7 Å²	128.7	66%	0.656	72%	0.72	S	S	*	*			trans	87	142.7	144.8	-11.9	0	0	0	0	120.5
307	F	35.2	Very low	38	Very low	194 Å²	194	130.3 Å²	130.3	85%	0.851	73%	0.728	S	S	*	*			trans	62.9	147.2	173.4	-62.8	-83.2	0	0	0	117.4
308	S	31.7	Very low	37.7	Very low	97 Å²	97	127.2 Å²	127.2	68%	0.678	72%	0.724	S	S	*	*			cis	152.3	157.8	-24.6	176.9	0	0	0	0	108.1
309	S	35	Very low	37.6	Very low	85 Å²	85	129 Å²	129	59%	0.594	73%	0.728	S	S	*	*			trans	85.4	158.1	159	77.4	0	0	0	0	121
310	H	36.2	Very low	37.6	Very low	161 Å²	161	125.7 Å²	125.7	75%	0.745	72%	0.717	S	S	*	*			trans	75.6	96.8	-179.7	-53.5	-67.5	0	0	0	115.9
311	I	35.5	Very low	37.6	Very low	138 Å²	138	129.2 Å²	129.2	71%	0.708	72%	0.72	S	S	*	*			cis	72.1	102.7	40.2	-42.3	164.2	0	0	0	114.4
312	H	42	Very low	37.7	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.815	72%	0.724	S	S	*	*				-170	167.3	125.5	-112.9	-112.6	0	0	0	109.4
313	P	41.8	Very low	37.5	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	73%	0.728	S	S	*	*				-136.5	-175.6	-130	43.4	-25.6	0	0	0	115.9
314	G	35.9	Very low	37.4	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	73%	0.726	S	S	*	*			trans	159	127.8	144.9	0	0	0	0	0	120.4
315	V	38.9	Very low	37.4	Very low	126 Å²	126	133.5 Å²	133.5	76%	0.764	73%	0.734	S	S	*	*				78.6	102.6	123.2	-179.2	0	0	0	0	120.9
316	Q	39.9	Very low	37.4	Very low	165 Å²	165	134.1 Å²	134.1	77%	0.771	73%	0.729	S	S	*	*			trans	87	143.9	133.6	-87.6	179.1	-52.1	0	0	125.3
317	L	39.4	Very low	37.6	Very low	152 Å²	152	140.3 Å²	140.3	80%	0.796	74%	0.742	S	S	*	*			trans	70.5	139.2	157.3	-61.8	153.3	0	0	0	118.5
318	G	37.3	Very low	37.6	Very low	56 Å²	56	138.7 Å²	138.7	58%	0.577	74%	0.737	S	S	*	*			cis	159.9	148.2	-14	0	0	0	0	0	115.2
319	H	42.8	Very low	37.6	Very low	179 Å²	179	141.4 Å²	141.4	83%	0.829	74%	0.739	S	S	*	*			trans	74.3	157	171.7	-37.1	92.5	0	0	0	116.3
320	S	39.5	Very low	37.5	Very low	91 Å²	91	143.4 Å²	143.4	64%	0.636	74%	0.743	S	S	*	*			cis	-162.3	163.9	5.2	-148.7	0	0	0	0	113.8
321	R	40.8	Very low	37.2	Very low	214 Å²	214	143.7 Å²	143.7	81%	0.808	74%	0.744	S	S	*	*			trans	75.1	115.3	160.4	-63	152	-165.2	-140.8	-0	117.5
322	H	41.8	Very low	37.2	Very low	171 Å²	171	143.8 Å²	143.8	79%	0.792	75%	0.751	S	S	*	*				75.5	129.5	73.6	-71.3	-59.3	0	0	0	113
323	L	37.1	Very low	36.6	Very low	147 Å²	147	141.6 Å²	141.6	77%	0.77	75%	0.746	S	S	*	*			cis	-134.3	167.8	8.7	-67.8	174.2	0	0	0	110.1
324	H	33.7	Very low	36	Very low	146 Å²	146	143 Å²	143	68%	0.676	75%	0.747	S	S	*	*			cis	81.1	100.1	9.5	178.8	59.7	0	0	0	120.3	D326	H324-D326 IonicContact CE1-OD2 3.61Å; H324-D326 PolarHBondContact CE1-OD2 2.76Å; H324-D326 IonicContact ND1-OD2 3Å; H324-D326 PolarHBondContact ND1-OD2 2.86Å
325	S	35.5	Very low	36	Very low	114 Å²	114	149.6 Å²	149.6	80%	0.797	75%	0.753	S	S	*	*			trans	-161.8	137.8	138.3	-167.9	0	0	0	0	110.6
326	D	34.5	Very low	35.7	Very low	117 Å²	117	148.6 Å²	148.6	63%	0.626	75%	0.747	S	S	*	*			trans	-99.6	171.2	-177.1	-48.6	-90.2	0	0	0	112.1	H324	H324-D326 IonicContact CE1-OD2 3.61Å; H324-D326 PolarHBondContact CE1-OD2 2.76Å; H324-D326 IonicContact ND1-OD2 3Å; H324-D326 PolarHBondContact ND1-OD2 2.86Å
327	Y	35.5	Very low	35.4	Very low	236 Å²	236	146.7 Å²	146.7	93%	0.925	74%	0.742	S	S	*	*			trans	-160.9	168	131.9	-116.2	-77.6	0	0	0	111.4
328	Q	35.4	Very low	35.2	Very low	160 Å²	160	143 Å²	143	75%	0.748	73%	0.733	S	S	*	*			trans	-144.3	141.2	-142.7	-151.7	-174.8	15.3	0	0	114.9
329	H	31.6	Very low	35.2	Very low	155 Å²	155	151.3 Å²	151.3	72%	0.718	75%	0.749	S	S	*	*			trans	72.2	160.8	145.2	-103	42.3	0	0	0	123.1
330	N	32.6	Very low	34.9	Very low	126 Å²	126	148.9 Å²	148.9	67%	0.674	74%	0.741	S	S	*	*			trans	73.2	115.6	161.1	-60.3	-20.5	0	0	0	117.5
331	H	30.6	Very low	34.6	Very low	167 Å²	167	152.6 Å²	152.6	77%	0.773	75%	0.748	S	S	*	*				81.1	114.3	67.9	-93.5	-64	0	0	0	114.3
332	T	35.4	Very low	34.3	Very low	141 Å²	141	148.2 Å²	148.2	87%	0.865	74%	0.741	S	S	*	*				-172.6	165.4	121.1	34.6	0	0	0	0	110.7
333	N	28.4	Very low	33.9	Very low	130 Å²	130	146.8 Å²	146.8	70%	0.695	74%	0.737	S	S	*	*			trans	-99.4	174.7	-174.9	-55.3	-3.7	0	0	0	113.8
334	D	30.4	Very low	33.6	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	74%	0.735	S	S	*	*			trans	43.3	113.7	144.4	-50.7	-31.9	0	0	0	120.4
335	Y	34.5	Very low	33.6	Very low	203 Å²	203	144 Å²	144	80%	0.796	74%	0.736	S	S	*	*				-146	165.5	129.6	-155.7	-99.8	0	0	0	112.7	D337	Y335-D337 WeakPolarHBondContact CE1-OD2 3.42Å
336	V	32.3	Very low	33.5	Very low	105 Å²	105	143.8 Å²	143.8	64%	0.636	73%	0.73	S	S	*	*			trans	-96.7	-173.5	-158	-157.8	0	0	0	0	112
337	D	34.1	Very low	33.3	Very low	125 Å²	125	146.7 Å²	146.7	67%	0.668	74%	0.74	S	S	*	*			trans	91.3	151.9	156.3	-57.4	-31.5	0	0	0	118.9	Y335	Y335-D337 WeakPolarHBondContact CE1-OD2 3.42Å
338	A	34.8	Very low	33.2	Very low	73 Å²	73	143 Å²	143	60%	0.603	73%	0.731	S	S	*	*			cis	177.3	113.8	-43.9	0	0	0	0	0	108.3
339	Y	38.8	Very low	33.1	Very low	232 Å²	232	142.3 Å²	142.3	91%	0.91	73%	0.728	S	S	*	*			trans	-152.1	133.2	164.3	-78.8	-82.3	0	0	0	108.3
340	L	36.4	Very low	33	Very low	128 Å²	128	143.3 Å²	143.3	67%	0.67	73%	0.733	S	S	*	*			cis	154.6	106.5	-26.8	172.3	74.2	0	0	0	104.6
341	E	33.1	Very low	33	Very low	168 Å²	168	144.1 Å²	144.1	79%	0.785	74%	0.736	S	S	*	*			trans	60.6	160.7	159.6	-65.3	160.6	174.8	0	0	116.8
342	D	34.2	Very low	33.1	Very low	123 Å²	123	148.3 Å²	148.3	66%	0.658	75%	0.745	S	S	*	*			cis	-148.8	165.6	16.1	-164.4	10.5	0	0	0	112.6
343	M	32.9	Very low	32.8	Very low	141 Å²	141	148.1 Å²	148.1	70%	0.695	75%	0.749	S	S	*	*			trans	55.9	127.6	164.7	-51.7	-137.9	-177.3	0	0	118.6
344	T	30.6	Very low	33.2	Very low	121 Å²	121	145.1 Å²	145.1	74%	0.742	75%	0.748	S	S	*	*			cis	61.9	133.5	41.4	87.5	0	0	0	0	112.7
345	T	33.9	Very low	33.7	Very low	114 Å²	114	147.2 Å²	147.2	70%	0.699	75%	0.75	S	S	*	*			cis	-156.6	179.5	34.4	43.6	0	0	0	0	111.2
346	T	33.5	Very low	34.1	Very low	109 Å²	109	142.2 Å²	142.2	67%	0.669	74%	0.738	S	S	*	*			trans	65.4	126.3	159.4	44.3	0	0	0	0	117.7
347	E	30.8	Very low	34.6	Very low	178 Å²	178	147.4 Å²	147.4	83%	0.832	75%	0.746	S	S	*	*				65.6	129.3	73.8	-64.8	173.2	171.9	0	0	111.4
348	E	33.1	Very low	35.1	Very low	157 Å²	157	150.1 Å²	150.1	73%	0.734	75%	0.751	S	S	*	*			cis	-157.8	175.6	31.9	-128.9	-175	154	0	0	113.1
349	Q	32.5	Very low	35.6	Very low	147 Å²	147	152 Å²	152	69%	0.687	74%	0.743	S	S	*	*			trans	45.4	109.5	153.9	-62.2	170.8	34.3	0	0	120
350	E	31.5	Very low	36.2	Very low	176 Å²	176	145.2 Å²	145.2	82%	0.822	72%	0.722	S	S	*	*				94.3	146	67.1	-81.4	-134.6	121.3	0	0	117
351	L	32	Very low	37.2	Very low	142 Å²	142	143 Å²	143	74%	0.743	71%	0.714	S	S	*	*			trans	47.5	86.9	166.2	-82	77.5	0	0	0	121.1
352	R	31.5	Very low	38.3	Very low	255 Å²	255	144.6 Å²	144.6	96%	0.962	71%	0.713	S	S	*	*				-174.9	74.5	116.6	-104.2	-179.6	176.8	-153.8	0.2	115
353	C	29.6	Very low	39.5	Very low	138 Å²	138	145.3 Å²	145.3	93%	0.932	71%	0.71	S	S	*	*			trans	-77.9	148	165.6	-163.3	0	0	0	0	111.5
354	G	36.8	Very low	41.4	Very low	67 Å²	67	141.6 Å²	141.6	69%	0.691	70%	0.698	S	S	*	*			trans	165.8	-47.5	167.1	0	0	0	0	0	117.9
355	K	40.3	Very low	43.4	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	69%	0.693	S	S	*	*	S	Bend	trans	-94.6	-20.1	-166.8	-70.9	-176.9	178.5	177.7	0	116
356	N	44	Very low	45.3	Very low	99 Å²	99	145 Å²	145	53%	0.529	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	-39.4	-167.7	-69.4	-9.7	0	0	0	115	K358 R359	N356-K358 PolarHBondContact O-N 3.28Å; N356-R359 WeakPolarHBondContact O-CB 3.36Å; N356-R359 PolarHBondContact O-N 3.26Å; N356-R359 PolarHBondContact OD1-NH1 2.92Å
357	R	42.9	Very low	47.2	Very low	214 Å²	214	144.1 Å²	144.1	81%	0.808	68%	0.683	S	S	*	*	H	α-helix	trans	-52.4	-25.2	-174.8	-81	-176.7	171.8	170.6	-1.7	115.5
358	K	44.5	Very low	49.6	Very low	181 Å²	181	139.8 Å²	139.8	79%	0.787	67%	0.665	S	S	*	*	H	α-helix	trans	-78.3	-20	175.7	-78.5	-174.7	177.6	176.7	0	114.1	N356	N356-K358 PolarHBondContact O-N 3.28Å
359	R	45.1	Very low	51.7	Low	113 Å²	113	136.5 Å²	136.5	43%	0.426	65%	0.651	S	S	.	*	H	α-helix	trans	-76.3	-40.5	173.2	-60.1	-159	-163.4	103.1	-8.8	111.2	N27 N356 R362 K363	N27-R359 PolarHBondContact OD1-NH2 3.3Å; N356-R359 WeakPolarHBondContact O-CB 3.36Å; N356-R359 PolarHBondContact O-N 3.26Å; N356-R359 PolarHBondContact OD1-NH1 2.92Å; R359-R362 CarbonylContact O-C 3.59Å; R359-R362 WeakPolarHBondContact O-CA 3.37Å; R359-R362 WeakPolarHBondContact O-CB 3.45Å; R359-R362 PolarHBondContact O-N 3.08Å; R359-R362 VanDerWaalsContact O-N 3.08Å; R359-K363 PolarHBondContact O-N 3.2Å
360	D	51.6	Low	53.8	Low	89 Å²	89	133.1 Å²	133.1	48%	0.476	64%	0.638	S	S	.	*	H	α-helix	trans	-69.2	-40.2	-175.4	-50.3	-49.5	0	0	0	111.9	R362 K363 S364	D360-R362 VanDerWaalsContact C-N 3.26Å; D360-R362 PolarHBondContact O-N 3.45Å; D360-K363 PolarHBondContact O-N 3.22Å; D360-S364 VanDerWaalsContact O-CB 3.32Å; D360-S364 WeakPolarHBondContact O-CB 3.42Å; D360-S364 PolarHBondContact O-N 3.15Å
361	V	58.2	Low	56.3	Low	82 Å²	82	130.6 Å²	130.6	50%	0.497	63%	0.63	S	S	.	*	H	α-helix	trans	-62.7	-31.8	171	177.2	0	0	0	0	112.1	R365	V361-R365 WeakPolarHBondContact O-CB 3.31Å; V361-R365 VanDerWaalsContact O-CG 3.25Å; V361-R365 WeakPolarHBondContact O-CG 3.49Å; V361-R365 PolarHBondContact O-N 2.95Å
362	R	56.2	Low	58.8	Low	201 Å²	201	128.2 Å²	128.2	76%	0.758	62%	0.617	S	S	*	*	H	α-helix	trans	-73.5	-43.4	173.7	-80.9	-176.6	171	-176.1	-2.4	112.1	R359 D360 R365 F366	R359-R362 CarbonylContact O-C 3.59Å; R359-R362 WeakPolarHBondContact O-CA 3.37Å; R359-R362 WeakPolarHBondContact O-CB 3.45Å; R359-R362 PolarHBondContact O-N 3.08Å; R359-R362 VanDerWaalsContact O-N 3.08Å; D360-R362 VanDerWaalsContact C-N 3.26Å; D360-R362 PolarHBondContact O-N 3.45Å; R362-R365 PolarHBondContact O-N 3.27Å; R362-F366 PolarHBondContact O-N 3.27Å; R362-F366 VanDerWaalsContact O-N 3.09Å
363	K	57.7	Low	60.8	Low	139 Å²	139	121.4 Å²	121.4	60%	0.604	60%	0.596	S	S	*	*	H	α-helix	trans	-58.8	-52.7	173.5	-79.2	-174.8	173.2	-178.1	0	111	R359 D360 R365 F366 T367	R359-K363 PolarHBondContact O-N 3.2Å; D360-K363 PolarHBondContact O-N 3.22Å; K363-R365 VanDerWaalsContact C-N 3.32Å; K363-R365 PolarHBondContact O-N 3.46Å; K363-F366 CarbonylContact O-C 3.57Å; K363-F366 WeakPolarHBondContact O-CA 3.46Å; K363-F366 WeakPolarHBondContact O-CB 3.23Å; K363-F366 PolarHBondContact O-N 3.5Å; K363-T367 PolarHBondContact O-N 2.84Å; K363-T367 PolarHBondContact O-OG1 3.21Å; K363-T367 VanDerWaalsContact O-OG1 3.06Å
364	S	72.8	Confident	63.1	Low	63 Å²	63	123.7 Å²	123.7	44%	0.441	59%	0.585	S	S	.	*	H	α-helix	trans	-54.8	-44.1	178.4	171.9	0	0	0	0	112.3	D360 F366 T367 I368	D360-S364 VanDerWaalsContact O-CB 3.32Å; D360-S364 WeakPolarHBondContact O-CB 3.42Å; D360-S364 PolarHBondContact O-N 3.15Å; S364-F366 VanDerWaalsContact C-N 3.34Å; S364-F366 PolarHBondContact O-N 2.97Å; S364-T367 PolarHBondContact O-N 2.91Å; S364-I368 WeakPolarHBondContact O-CB 3.29Å; S364-I368 VanDerWaalsContact O-CG1 3.27Å; S364-I368 WeakPolarHBondContact O-CG1 3.29Å; S364-I368 PolarHBondContact O-N 2.97Å
365	R	74.1	Confident	65.4	Low	167 Å²	167	122.9 Å²	122.9	63%	0.63	57%	0.571	S	S	*	*	H	α-helix	trans	-60.5	-40.4	172.9	-76.2	174.8	-177.5	-158.9	-0.3	112.8	V361 R362 K363 I368 I369	V361-R365 WeakPolarHBondContact O-CB 3.31Å; V361-R365 VanDerWaalsContact O-CG 3.25Å; V361-R365 WeakPolarHBondContact O-CG 3.49Å; V361-R365 PolarHBondContact O-N 2.95Å; R362-R365 PolarHBondContact O-N 3.27Å; K363-R365 VanDerWaalsContact C-N 3.32Å; K363-R365 PolarHBondContact O-N 3.46Å; R365-I368 PolarHBondContact O-N 3.17Å; R365-I369 WeakPolarHBondContact O-CB 3.45Å; R365-I369 WeakPolarHBondContact O-CD1 3.16Å; R365-I369 VanDerWaalsContact O-CG1 3.23Å; R365-I369 WeakPolarHBondContact O-CG1 3.39Å; R365-I369 PolarHBondContact O-N 2.95Å
366	F	72.4	Confident	67.1	Low	139 Å²	139	118 Å²	118	61%	0.61	55%	0.553	S	S	*	*	H	α-helix	trans	-66.9	-40.6	176.4	-135.7	-76.4	0	0	0	111.8	R362 K363 S364 I369 N370	R362-F366 PolarHBondContact O-N 3.27Å; R362-F366 VanDerWaalsContact O-N 3.09Å; K363-F366 CarbonylContact O-C 3.57Å; K363-F366 WeakPolarHBondContact O-CA 3.46Å; K363-F366 WeakPolarHBondContact O-CB 3.23Å; K363-F366 PolarHBondContact O-N 3.5Å; S364-F366 VanDerWaalsContact C-N 3.34Å; S364-F366 PolarHBondContact O-N 2.97Å; F366-I369 PolarHBondContact O-N 2.97Å; F366-N370 WeakPolarHBondContact O-CB 3.48Å; F366-N370 PolarHBondContact O-N 3.44Å; F366-N370 PolarHBondContact O-OD1 3.36Å
367	T	74.3	Confident	68.6	Low	90 Å²	90	117.5 Å²	117.5	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-61.4	-44.1	173.4	-44.6	0	0	0	0	111.4	K363 S364 N370 L371	K363-T367 PolarHBondContact O-N 2.84Å; K363-T367 PolarHBondContact O-OG1 3.21Å; K363-T367 VanDerWaalsContact O-OG1 3.06Å; S364-T367 PolarHBondContact O-N 2.91Å; T367-N370 PolarHBondContact O-N 2.82Å; T367-L371 VanDerWaalsContact O-CB 3.29Å; T367-L371 WeakPolarHBondContact O-CB 3.17Å; T367-L371 PolarHBondContact O-N 3.29Å
368	I	80.3	Confident	70.5	Confident	87 Å²	87	112.8 Å²	112.8	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-42.4	176.9	-69.4	163.4	0	0	0	111.1	S364 R365 L371 I372	S364-I368 WeakPolarHBondContact O-CB 3.29Å; S364-I368 VanDerWaalsContact O-CG1 3.27Å; S364-I368 WeakPolarHBondContact O-CG1 3.29Å; S364-I368 PolarHBondContact O-N 2.97Å; R365-I368 PolarHBondContact O-N 3.17Å; I368-L371 PolarHBondContact O-N 3.43Å; I368-I372 HydrophobicContact CG2-CD1 3.72Å; I368-I372 HydrophobicContact CG2-CG1 4.43Å; I368-I372 WeakPolarHBondContact O-CB 3.43Å; I368-I372 VanDerWaalsContact O-CG1 3.26Å; I368-I372 WeakPolarHBondContact O-CG1 3.33Å; I368-I372 PolarHBondContact O-N 2.89Å
369	I	78.4	Confident	72.2	Confident	88 Å²	88	109.8 Å²	109.8	45%	0.451	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-48	176	-71.5	163.7	0	0	0	110.6	R365 F366 L371 I372 Q373	R365-I369 WeakPolarHBondContact O-CB 3.45Å; R365-I369 WeakPolarHBondContact O-CD1 3.16Å; R365-I369 VanDerWaalsContact O-CG1 3.23Å; R365-I369 WeakPolarHBondContact O-CG1 3.39Å; R365-I369 PolarHBondContact O-N 2.95Å; F366-I369 PolarHBondContact O-N 2.97Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.48Å; I369-I372 PolarHBondContact O-N 3.37Å; I369-Q373 HydrophobicContact CG2-CG 4.49Å; I369-Q373 WeakPolarHBondContact O-CB 3.35Å; I369-Q373 WeakPolarHBondContact O-CG 3.49Å; I369-Q373 PolarHBondContact O-N 3.1Å
370	N	75.8	Confident	73.4	Confident	76 Å²	76	108.4 Å²	108.4	41%	0.406	54%	0.537	S	S	.	.	H	α-helix	trans	-63	-35.9	177	-72	6.2	0	0	0	112.2	F366 T367 R374	F366-N370 WeakPolarHBondContact O-CB 3.48Å; F366-N370 PolarHBondContact O-N 3.44Å; F366-N370 PolarHBondContact O-OD1 3.36Å; T367-N370 PolarHBondContact O-N 2.82Å; N370-R374 WeakPolarHBondContact O-CB 3.39Å; N370-R374 PolarHBondContact O-N 3.21Å
371	L	83.9	Confident	74.5	Confident	124 Å²	124	109.9 Å²	109.9	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-68.6	-41.5	176.2	-165	75.6	0	0	0	111.4	T367 I368 I369 R374 A375	T367-L371 VanDerWaalsContact O-CB 3.29Å; T367-L371 WeakPolarHBondContact O-CB 3.17Å; T367-L371 PolarHBondContact O-N 3.29Å; I368-L371 PolarHBondContact O-N 3.43Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.48Å; L371-R374 PolarHBondContact O-N 2.67Å; L371-A375 WeakPolarHBondContact O-CB 3.39Å; L371-A375 PolarHBondContact O-N 2.91Å
372	I	84.3	Confident	75.3	Confident	92 Å²	92	112.1 Å²	112.1	47%	0.472	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-42.7	174.4	-70.9	167.3	0	0	0	110.7	I368 I369 A375 I376	I368-I372 HydrophobicContact CG2-CD1 3.72Å; I368-I372 HydrophobicContact CG2-CG1 4.43Å; I368-I372 WeakPolarHBondContact O-CB 3.43Å; I368-I372 VanDerWaalsContact O-CG1 3.26Å; I368-I372 WeakPolarHBondContact O-CG1 3.33Å; I368-I372 PolarHBondContact O-N 2.89Å; I369-I372 PolarHBondContact O-N 3.37Å; I372-A375 PolarHBondContact O-N 2.69Å; I372-I376 HydrophobicContact CG2-CD1 3.75Å; I372-I376 HydrophobicContact CG2-CG1 4.42Å; I372-I376 WeakPolarHBondContact O-CB 3.44Å; I372-I376 VanDerWaalsContact O-CG1 3.29Å; I372-I376 WeakPolarHBondContact O-CG1 3.15Å; I372-I376 PolarHBondContact O-N 3.5Å
373	Q	74.3	Confident	76	Confident	111 Å²	111	103.6 Å²	103.6	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.1	-74.3	177.4	-56.9	0	0	111.7	I369 I376 T377	I369-Q373 HydrophobicContact CG2-CG 4.49Å; I369-Q373 WeakPolarHBondContact O-CB 3.35Å; I369-Q373 WeakPolarHBondContact O-CG 3.49Å; I369-Q373 PolarHBondContact O-N 3.1Å; Q373-I376 PolarHBondContact O-N 2.99Å; Q373-T377 PolarHBondContact O-N 2.98Å; Q373-T377 PolarHBondContact O-OG1 2.8Å
374	R	77.7	Confident	76.3	Confident	186 Å²	186	99.6 Å²	99.6	70%	0.702	51%	0.514	S	S	*	.	H	α-helix	trans	-63.1	-39.6	171.5	-84.5	-176.6	157.9	-169.3	-7.2	113	N370 L371 I376 T377 L378	N370-R374 WeakPolarHBondContact O-CB 3.39Å; N370-R374 PolarHBondContact O-N 3.21Å; L371-R374 PolarHBondContact O-N 2.67Å; R374-I376 VanDerWaalsContact C-N 3.35Å; R374-T377 PolarHBondContact O-N 3.42Å; R374-T377 PolarHBondContact O-OG1 3.31Å; R374-L378 WeakPolarHBondContact O-CB 3.49Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.44Å; R374-L378 PolarHBondContact O-N 2.85Å
375	A	84	Confident	76.2	Confident	50 Å²	50	100.6 Å²	100.6	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-38.3	176.4	0	0	0	0	0	111.7	L371 I372 L379	L371-A375 WeakPolarHBondContact O-CB 3.39Å; L371-A375 PolarHBondContact O-N 2.91Å; I372-A375 PolarHBondContact O-N 2.69Å; A375-L379 WeakPolarHBondContact O-CB 3.25Å; A375-L379 PolarHBondContact O-N 3.33Å
376	I	76.6	Confident	75.9	Confident	87 Å²	87	98.9 Å²	98.9	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-68.5	-43.9	175.4	-69.5	166.6	0	0	0	111.1	I372 Q373 R374 L379 N380	I372-I376 HydrophobicContact CG2-CD1 3.75Å; I372-I376 HydrophobicContact CG2-CG1 4.42Å; I372-I376 WeakPolarHBondContact O-CB 3.44Å; I372-I376 VanDerWaalsContact O-CG1 3.29Å; I372-I376 WeakPolarHBondContact O-CG1 3.15Å; I372-I376 PolarHBondContact O-N 3.5Å; Q373-I376 PolarHBondContact O-N 2.99Å; R374-I376 VanDerWaalsContact C-N 3.35Å; I376-L379 PolarHBondContact O-N 2.99Å; I376-N380 WeakPolarHBondContact O-CB 3.48Å; I376-N380 VanDerWaalsContact O-CG 3.26Å; I376-N380 PolarHBondContact O-N 3.5Å; I376-N380 PolarHBondContact O-OD1 3.04Å
377	T	76.4	Confident	75.2	Confident	88 Å²	88	98 Å²	98	54%	0.54	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-35.4	176.3	49.9	0	0	0	0	112.5	Q373 R374 N380 L381	Q373-T377 PolarHBondContact O-N 2.98Å; Q373-T377 PolarHBondContact O-OG1 2.8Å; R374-T377 PolarHBondContact O-N 3.42Å; R374-T377 PolarHBondContact O-OG1 3.31Å; T377-N380 PolarHBondContact O-N 3.32Å; T377-L381 VanDerWaalsContact O-CB 3.24Å; T377-L381 WeakPolarHBondContact O-CB 3.48Å; T377-L381 PolarHBondContact O-N 3.18Å
378	L	81.7	Confident	74.1	Confident	116 Å²	116	97.1 Å²	97.1	61%	0.607	53%	0.53	S	S	*	.	H	α-helix	trans	-66.6	-39.2	171.5	-73.2	170.4	0	0	0	112.6	R374 L381 F382	R374-L378 WeakPolarHBondContact O-CB 3.49Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.44Å; R374-L378 PolarHBondContact O-N 2.85Å; L378-L381 PolarHBondContact O-N 3.13Å; L378-F382 VanDerWaalsContact O-CB 3.3Å; L378-F382 WeakPolarHBondContact O-CB 3.41Å; L378-F382 PolarHBondContact O-N 2.89Å
379	L	79.9	Confident	72.8	Confident	117 Å²	117	98.1 Å²	98.1	61%	0.613	53%	0.532	S	S	*	.	H	α-helix	trans	-64.3	-43.1	173.3	-99.1	161.1	0	0	0	112.1	A375 I376 F382 A383	A375-L379 WeakPolarHBondContact O-CB 3.25Å; A375-L379 PolarHBondContact O-N 3.33Å; I376-L379 PolarHBondContact O-N 2.99Å; L379-F382 PolarHBondContact O-N 2.97Å; L379-A383 VanDerWaalsContact O-CB 3.3Å; L379-A383 WeakPolarHBondContact O-CB 3.25Å; L379-A383 PolarHBondContact O-N 2.96Å
380	N	71.5	Confident	71.6	Confident	85 Å²	85	97.8 Å²	97.8	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-41.6	176.4	-70.9	2.7	0	0	0	111.3	I376 T377 A383 A384	I376-N380 WeakPolarHBondContact O-CB 3.48Å; I376-N380 VanDerWaalsContact O-CG 3.26Å; I376-N380 PolarHBondContact O-N 3.5Å; I376-N380 PolarHBondContact O-OD1 3.04Å; T377-N380 PolarHBondContact O-N 3.32Å; N380-A383 PolarHBondContact O-N 2.92Å; N380-A384 WeakPolarHBondContact O-CB 3.34Å; N380-A384 PolarHBondContact O-N 2.83Å
381	L	73.8	Confident	70.4	Confident	119 Å²	119	98.2 Å²	98.2	62%	0.623	54%	0.538	S	S	*	.	H	α-helix	trans	-65.2	-39.2	176.7	-175.2	65	0	0	0	112	T377 L378 S385	T377-L381 VanDerWaalsContact O-CB 3.24Å; T377-L381 WeakPolarHBondContact O-CB 3.48Å; T377-L381 PolarHBondContact O-N 3.18Å; L378-L381 PolarHBondContact O-N 3.13Å; L381-S385 WeakPolarHBondContact O-CB 3.06Å; L381-S385 PolarHBondContact O-N 2.9Å; L381-S385 PolarHBondContact O-OG 3.39Å
382	F	75	Confident	69.1	Low	129 Å²	129	97.3 Å²	97.3	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-71.8	-36.8	175.7	-170.2	-93.8	0	0	0	112.5	L378 L379 S385 Q386	L378-F382 VanDerWaalsContact O-CB 3.3Å; L378-F382 WeakPolarHBondContact O-CB 3.41Å; L378-F382 PolarHBondContact O-N 2.89Å; L379-F382 PolarHBondContact O-N 2.97Å; F382-S385 PolarHBondContact O-N 3.28Å; F382-S385 PolarHBondContact O-OG 3.21Å; F382-Q386 HydrophobicContact CD1-CG 4.31Å; F382-Q386 HydrophobicContact CD2-CG 4.35Å; F382-Q386 HydrophobicContact CE1-CB 4.49Å; F382-Q386 HydrophobicContact CE1-CG 3.98Å; F382-Q386 HydrophobicContact CE2-CG 4.03Å; F382-Q386 HydrophobicContact CG-CG 4.49Å; F382-Q386 HydrophobicContact CZ-CG 3.83Å; F382-Q386 WeakPolarHBondContact O-CB 3.38Å; F382-Q386 PolarHBondContact O-N 3.08Å
383	A	71.5	Confident	67.8	Low	23 Å²	23	95.6 Å²	95.6	19%	0.19	53%	0.528	C	S	.	.	H	α-helix	trans	-64.6	-43.3	172.3	0	0	0	0	0	111.4	L379 N380 S385 L387	L379-A383 VanDerWaalsContact O-CB 3.3Å; L379-A383 WeakPolarHBondContact O-CB 3.25Å; L379-A383 PolarHBondContact O-N 2.96Å; N380-A383 PolarHBondContact O-N 2.92Å; A383-S385 PolarHBondContact O-N 2.88Å; A383-L387 WeakPolarHBondContact O-CB 3.28Å; A383-L387 PolarHBondContact O-N 3.03Å
384	A	63.2	Low	66.4	Low	55 Å²	55	93.4 Å²	93.4	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-42.2	174.9	0	0	0	0	0	112.1	N380	N380-A384 WeakPolarHBondContact O-CB 3.34Å; N380-A384 PolarHBondContact O-N 2.83Å
385	S	70.4	Confident	65	Low	83 Å²	83	89 Å²	89	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-79.1	-23.5	-176.9	69.9	0	0	0	0	115.3	L381 F382 A383	L381-S385 WeakPolarHBondContact O-CB 3.06Å; L381-S385 PolarHBondContact O-N 2.9Å; L381-S385 PolarHBondContact O-OG 3.39Å; F382-S385 PolarHBondContact O-N 3.28Å; F382-S385 PolarHBondContact O-OG 3.21Å; A383-S385 PolarHBondContact O-N 2.88Å
386	Q	69.1	Low	63.6	Low	131 Å²	131	90.5 Å²	90.5	61%	0.612	51%	0.514	S	S	*	.	H	α-helix	trans	-111.5	-22.6	-175.4	-66	-75.4	17.1	0	0	115.3	F382	F382-Q386 HydrophobicContact CD1-CG 4.31Å; F382-Q386 HydrophobicContact CD2-CG 4.35Å; F382-Q386 HydrophobicContact CE1-CB 4.49Å; F382-Q386 HydrophobicContact CE1-CG 3.98Å; F382-Q386 HydrophobicContact CE2-CG 4.03Å; F382-Q386 HydrophobicContact CG-CG 4.49Å; F382-Q386 HydrophobicContact CZ-CG 3.83Å; F382-Q386 WeakPolarHBondContact O-CB 3.38Å; F382-Q386 PolarHBondContact O-N 3.08Å
387	L	58.2	Low	62.3	Low	120 Å²	120	93.3 Å²	93.3	63%	0.628	52%	0.523	S	S	*	.	H	α-helix	trans	-117.3	-7.8	-171.4	-74.9	159.5	0	0	0	114.6	A383 Q389	A383-L387 WeakPolarHBondContact O-CB 3.28Å; A383-L387 PolarHBondContact O-N 3.03Å; L387-Q389 PolarHBondContact O-N 3.28Å
388	G	49.8	Very low	60.9	Low	73 Å²	73	95.9 Å²	95.9	75%	0.753	53%	0.532	S	S	*	.			trans	59.5	19.6	176.8	0	0	0	0	0	114.4
389	Q	53.1	Low	59	Low	107 Å²	107	96.1 Å²	96.1	50%	0.5	53%	0.534	S	S	.	.			trans	-90.7	123.7	178.8	-70.5	-171.5	-3.8	0	0	110.2	L387	L387-Q389 PolarHBondContact O-N 3.28Å
390	D	53.6	Low	57.1	Low	82 Å²	82	97.2 Å²	97.2	44%	0.439	54%	0.538	S	S	.	.			trans	-50.4	126.2	171.5	156	52.7	0	0	0	111.4	D392 T393	D390-D392 VanDerWaalsContact C-N 3.28Å; D390-D392 PolarHBondContact O-N 3.19Å; D390-D392 PolarHBondContact OD1-N 3.09Å; D390-T393 WeakPolarHBondContact O-CB 3.35Å; D390-T393 PolarHBondContact O-N 3.16Å; D390-T393 PolarHBondContact OD2-N 3.37Å; D390-T393 PolarHBondContact OD2-OG1 2.66Å
391	P	51.3	Low	55.4	Low	84 Å²	84	99.8 Å²	99.8	55%	0.545	55%	0.552	S	S	.	*	H	α-helix	trans	-60.6	-32.3	-173.5	22.5	-33.9	0	0	0	114.1	T393 L394 L395	P391-T393 VanDerWaalsContact C-N 3.3Å; P391-T393 PolarHBondContact O-N 2.91Å; P391-L394 PolarHBondContact O-N 3.25Å; P391-L395 PolarHBondContact O-N 3.48Å; P391-L395 VanDerWaalsContact O-N 3.14Å
392	D	56	Low	53.7	Low	105 Å²	105	104.1 Å²	104.1	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-68.6	-31.3	-179.2	-80.1	-10.4	0	0	0	112.1	D390 L394 L395 T396	D390-D392 VanDerWaalsContact C-N 3.28Å; D390-D392 PolarHBondContact O-N 3.19Å; D390-D392 PolarHBondContact OD1-N 3.09Å; D392-L394 VanDerWaalsContact C-N 3.27Å; D392-L394 PolarHBondContact O-N 3.06Å; D392-L395 PolarHBondContact O-N 3.32Å; D392-T396 WeakPolarHBondContact O-CB 3.35Å; D392-T396 WeakPolarHBondContact O-CG2 3.34Å; D392-T396 PolarHBondContact O-N 3.41Å; D392-T396 PolarHBondContact O-OG1 3.23Å
393	T	57.3	Low	51.9	Low	56 Å²	56	106.4 Å²	106.4	34%	0.344	58%	0.578	S	S	.	*	H	α-helix	trans	-65.5	-25.8	175.8	-64.6	0	0	0	0	113.2	D390 P391 T396 K397	D390-T393 WeakPolarHBondContact O-CB 3.35Å; D390-T393 PolarHBondContact O-N 3.16Å; D390-T393 PolarHBondContact OD2-N 3.37Å; D390-T393 PolarHBondContact OD2-OG1 2.66Å; P391-T393 VanDerWaalsContact C-N 3.3Å; P391-T393 PolarHBondContact O-N 2.91Å; T393-T396 PolarHBondContact O-OG1 3.39Å; T393-K397 HydrophobicContact CG2-CD 4.5Å; T393-K397 WeakPolarHBondContact O-CD 3.28Å; T393-K397 VanDerWaalsContact O-CG 3.32Å; T393-K397 WeakPolarHBondContact O-CG 3.45Å
394	L	45	Very low	50.1	Low	65 Å²	65	110.6 Å²	110.6	34%	0.34	61%	0.605	S	S	.	*	H	α-helix	trans	-90	-38.8	173.8	-93.1	169.9	0	0	0	112.9	P391 D392 T396 K397 L398	P391-L394 PolarHBondContact O-N 3.25Å; D392-L394 VanDerWaalsContact C-N 3.27Å; D392-L394 PolarHBondContact O-N 3.06Å; L394-T396 VanDerWaalsContact C-N 3.29Å; L394-T396 PolarHBondContact O-N 3.12Å; L394-K397 PolarHBondContact O-N 2.87Å; L394-L398 HydrophobicContact CD2-CD1 4.41Å; L394-L398 HydrophobicContact CD2-CG 4.46Å; L394-L398 WeakPolarHBondContact O-CB 3.31Å; L394-L398 WeakPolarHBondContact O-CG 3.37Å; L394-L398 PolarHBondContact O-N 3.31Å
395	L	48.5	Very low	48.7	Very low	95 Å²	95	113.4 Å²	113.4	50%	0.497	62%	0.617	S	S	.	*	H	α-helix	trans	-61.8	-36.7	176.1	-87.3	169.4	0	0	0	112.8	P391 D392 N399	P391-L395 PolarHBondContact O-N 3.48Å; P391-L395 VanDerWaalsContact O-N 3.14Å; D392-L395 PolarHBondContact O-N 3.32Å; L395-N399 PolarHBondContact O-ND2 2.7Å
396	T	53.3	Low	47	Very low	81 Å²	81	118.1 Å²	118.1	50%	0.497	63%	0.63	S	S	.	*	H	α-helix	trans	-68.5	-42.8	174	48.5	0	0	0	0	112.3	D392 T393 L394 M400	D392-T396 WeakPolarHBondContact O-CB 3.35Å; D392-T396 WeakPolarHBondContact O-CG2 3.34Å; D392-T396 PolarHBondContact O-N 3.41Å; D392-T396 PolarHBondContact O-OG1 3.23Å; T393-T396 PolarHBondContact O-OG1 3.39Å; L394-T396 VanDerWaalsContact C-N 3.29Å; L394-T396 PolarHBondContact O-N 3.12Å; T396-M400 WeakPolarHBondContact O-CG 3.36Å
397	K	50.4	Low	45.4	Very low	145 Å²	145	121.4 Å²	121.4	63%	0.63	64%	0.642	S	S	*	*	H	α-helix	trans	-72.5	-37.8	-178.6	-72.8	175.1	-175.2	166.8	0	113.6	T393 L394 N399 M400	T393-K397 HydrophobicContact CG2-CD 4.5Å; T393-K397 WeakPolarHBondContact O-CD 3.28Å; T393-K397 VanDerWaalsContact O-CG 3.32Å; T393-K397 WeakPolarHBondContact O-CG 3.45Å; L394-K397 PolarHBondContact O-N 2.87Å; K397-N399 PolarHBondContact O-N 3.02Å; K397-M400 PolarHBondContact O-N 3.4Å
398	L	46	Very low	44.5	Very low	142 Å²	142	121.5 Å²	121.5	74%	0.743	65%	0.647	S	S	*	*	H	α-helix	trans	-76.1	-18.6	-177.4	-68.7	175.7	0	0	0	114.3	L394	L394-L398 HydrophobicContact CD2-CD1 4.41Å; L394-L398 HydrophobicContact CD2-CG 4.46Å; L394-L398 WeakPolarHBondContact O-CB 3.31Å; L394-L398 WeakPolarHBondContact O-CG 3.37Å; L394-L398 PolarHBondContact O-N 3.31Å
399	N	42.3	Very low	43.9	Very low	121 Å²	121	122 Å²	122	65%	0.647	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-5.9	176	-90.6	-63	0	0	0	114.5	L395 K397 N401	L395-N399 PolarHBondContact O-ND2 2.7Å; K397-N399 PolarHBondContact O-N 3.02Å; N399-N401 VanDerWaalsContact C-N 3.27Å; N399-N401 PolarHBondContact O-N 3.18Å
400	M	40.1	Very low	43.6	Very low	141 Å²	141	126.3 Å²	126.3	70%	0.695	65%	0.65	S	S	*	*			trans	-85.2	49.4	-175.2	-64.4	-60.6	139	0	0	114	T396 K397	T396-M400 WeakPolarHBondContact O-CG 3.36Å; K397-M400 PolarHBondContact O-N 3.4Å
401	N	36.2	Very low	43.2	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	65%	0.652	S	S	*	*			trans	-169.5	86.2	158.9	-107.2	-42.8	0	0	0	114.7	N399	N399-N401 VanDerWaalsContact C-N 3.27Å; N399-N401 PolarHBondContact O-N 3.18Å
402	K	37	Very low	42.8	Very low	210 Å²	210	124.3 Å²	124.3	91%	0.913	64%	0.64	S	S	*	*			trans	-167.7	113.4	148	-107.4	146	-170.2	166.3	0	112.4
403	H	38.2	Very low	42.4	Very low	178 Å²	178	122.2 Å²	122.2	82%	0.824	63%	0.634	S	S	*	*			trans	-80.6	173	176.9	-63.3	-73.1	0	0	0	113.1
404	S	33.3	Very low	42.1	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	64%	0.643	S	S	*	*			trans	71	67.7	169.3	-126.6	0	0	0	0	116
405	T	32.6	Very low	42.5	Very low	115 Å²	115	123 Å²	123	71%	0.706	64%	0.644	S	S	*	*				72.8	89.9	99.2	59.9	0	0	0	0	116.9
406	H	35.2	Very low	42.7	Very low	182 Å²	182	120.7 Å²	120.7	84%	0.843	63%	0.634	S	S	*	*			trans	-128.7	107.4	144.5	-131.1	-84	0	0	0	108	V408	H406-V408 PolarHBondContact O-N 3.4Å
407	K	35.2	Very low	42.6	Very low	199 Å²	199	120.6 Å²	120.6	87%	0.865	63%	0.628	S	S	*	*			trans	-78.3	110.9	-178.8	-72.8	-178.2	178.4	176.4	0	109.4
408	V	39.7	Very low	42.9	Very low	123 Å²	123	121 Å²	121	75%	0.745	63%	0.63	S	S	*	*			trans	-97.5	147.2	172.4	-178.1	0	0	0	0	109.6	H406 K410	H406-V408 PolarHBondContact O-N 3.4Å; V408-K410 PolarHBondContact O-N 3.03Å
409	D	38.1	Very low	43.3	Very low	83 Å²	83	114.9 Å²	114.9	44%	0.444	60%	0.6	S	S	.	*			trans	-69.5	83.8	-161.1	-57.5	-58.4	0	0	0	115.6	S411 N412 K611	D409-S411 PolarHBondContact O-N 2.88Å; D409-N412 PolarHBondContact O-N 3.35Å; D409-K611 WeakPolarHBondContact OD2-CE 3.38Å; D409-K611 IonicContact OD2-NZ 3.67Å; D409-K611 PolarHBondContact OD2-NZ 2.97Å
410	K	45.5	Very low	43.9	Very low	197 Å²	197	115.4 Å²	115.4	86%	0.857	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-16.6	165.4	-81.9	-166.1	172.7	-170.8	0	113.5	V408 N412 S413	V408-K410 PolarHBondContact O-N 3.03Å; K410-N412 VanDerWaalsContact C-N 3.27Å; K410-N412 PolarHBondContact O-N 2.67Å; K410-S413 PolarHBondContact O-N 3Å
411	S	45.6	Very low	44.6	Very low	71 Å²	71	114.1 Å²	114.1	50%	0.497	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	-21.2	179.1	56.2	0	0	0	0	114.6	D409 K610	D409-S411 PolarHBondContact O-N 2.88Å; S411-K610 PolarHBondContact O-NZ 3.26Å
412	N	44	Very low	45.9	Very low	53 Å²	53	111.8 Å²	111.8	28%	0.283	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	-41.7	177.4	-85.5	14.3	0	0	0	112	D409 K410 S414 T415 K610	D409-N412 PolarHBondContact O-N 3.35Å; K410-N412 VanDerWaalsContact C-N 3.27Å; K410-N412 PolarHBondContact O-N 2.67Å; N412-S414 PolarHBondContact O-N 3.05Å; N412-T415 PolarHBondContact O-N 3.06Å; N412-K610 PolarHBondContact O-NZ 3.27Å; N412-K610 WeakPolarHBondContact OD1-CB 3.45Å
413	S	47.5	Very low	48	Very low	62 Å²	62	106.4 Å²	106.4	43%	0.434	56%	0.559	S	S	.	*	H	α-helix	trans	-51	-48.4	-172.1	-178.1	0	0	0	0	113.4	K410 T415 V416 E417	K410-S413 PolarHBondContact O-N 3Å; S413-T415 PolarHBondContact O-N 2.96Å; S413-V416 PolarHBondContact O-N 3.36Å; S413-E417 WeakPolarHBondContact O-CG 3.45Å; S413-E417 PolarHBondContact O-N 2.99Å
414	S	51	Low	50.2	Low	76 Å²	76	100 Å²	100	53%	0.531	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-12.5	-171.1	63	0	0	0	0	117.4	N412 K418	N412-S414 PolarHBondContact O-N 3.05Å; S414-K418 WeakPolarHBondContact O-CG 3.35Å
415	T	53.1	Low	52.7	Low	61 Å²	61	95.9 Å²	95.9	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-104	-25.1	168	61.2	0	0	0	0	113	N412 S413 A419 K610	N412-T415 PolarHBondContact O-N 3.06Å; S413-T415 PolarHBondContact O-N 2.96Å; T415-A419 VanDerWaalsContact O-CB 3.25Å; T415-A419 WeakPolarHBondContact O-CB 3.23Å; T415-A419 PolarHBondContact O-N 3.4Å; T415-K610 VanDerWaalsContact CG2-NZ 3.35Å; T415-K610 WeakPolarHBondContact OG1-CE 3.39Å; T415-K610 PolarHBondContact OG1-NZ 2.93Å
416	V	53.4	Low	55.2	Low	46 Å²	46	94.2 Å²	94.2	28%	0.279	49%	0.492	S	S	.	.	H	α-helix	trans	-68.1	-44.9	172.2	177.7	0	0	0	0	109.1	S413 A419 K420	S413-V416 PolarHBondContact O-N 3.36Å; V416-A419 PolarHBondContact O-N 3.45Å; V416-K420 HydrophobicContact CG1-CD 4.38Å; V416-K420 WeakPolarHBondContact O-CG 3.44Å; V416-K420 PolarHBondContact O-N 3.49Å
417	E	51.1	Low	57.7	Low	79 Å²	79	85.8 Å²	85.8	37%	0.369	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-41.4	173.8	-56.3	-40.3	120.7	0	0	112.1	S413 A419 K420 T421	S413-E417 WeakPolarHBondContact O-CG 3.45Å; S413-E417 PolarHBondContact O-N 2.99Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.34Å; E417-K420 PolarHBondContact O-N 3.12Å; E417-K420 IonicContact OE1-NZ 3.85Å; E417-K420 PolarHBondContact OE1-NZ 2.87Å; E417-K420 WeakPolarHBondContact OE2-CD 3.25Å; E417-K420 IonicContact OE2-NZ 3.16Å; E417-K420 PolarHBondContact OE2-NZ 3.46Å; E417-T421 WeakPolarHBondContact O-CG2 3.46Å; E417-T421 PolarHBondContact O-N 3.42Å; E417-T421 PolarHBondContact O-OG1 3.34Å
418	K	56	Low	60.3	Low	153 Å²	153	79 Å²	79	67%	0.665	42%	0.423	S	S	*	.	H	α-helix	trans	-63.8	-33.8	173.9	-79.6	-169.8	173.7	-162.8	0	113.7	S414 T421 Q422	S414-K418 WeakPolarHBondContact O-CG 3.35Å; K418-T421 WeakPolarHBondContact CA-OG1 3.3Å; K418-T421 PolarHBondContact O-OG1 2.86Å; K418-Q422 PolarHBondContact O-N 3.02Å; K418-Q422 VanDerWaalsContact O-N 3.15Å
419	A	53.5	Low	62.8	Low	15 Å²	15	75.3 Å²	75.3	12%	0.124	41%	0.405	C	S	.	.	H	α-helix	trans	-76.9	-31.2	176.2	0	0	0	0	0	112.3	T415 V416 E417 Q422 W782	T415-A419 VanDerWaalsContact O-CB 3.25Å; T415-A419 WeakPolarHBondContact O-CB 3.23Å; T415-A419 PolarHBondContact O-N 3.4Å; V416-A419 PolarHBondContact O-N 3.45Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.34Å; A419-Q422 CarbonylContact O-C 3.49Å; A419-W782 HydrophobicContact CB-CH2 3.74Å; A419-W782 HydrophobicContact CB-CZ3 3.76Å
420	K	54.9	Low	65.4	Low	132 Å²	132	75.9 Å²	75.9	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-64.8	-43	167.8	-73.5	163.8	168.1	178.9	0	111.9	V416 E417 Q422	V416-K420 HydrophobicContact CG1-CD 4.38Å; V416-K420 WeakPolarHBondContact O-CG 3.44Å; V416-K420 PolarHBondContact O-N 3.49Å; E417-K420 PolarHBondContact O-N 3.12Å; E417-K420 IonicContact OE1-NZ 3.85Å; E417-K420 PolarHBondContact OE1-NZ 2.87Å; E417-K420 WeakPolarHBondContact OE2-CD 3.25Å; E417-K420 IonicContact OE2-NZ 3.16Å; E417-K420 PolarHBondContact OE2-NZ 3.46Å; K420-Q422 VanDerWaalsContact C-N 3.32Å; K420-Q422 PolarHBondContact O-N 2.98Å
421	T	55.5	Low	67.6	Low	114 Å²	114	66.5 Å²	66.5	70%	0.699	36%	0.36	S	S	*	.	H	α-helix	trans	-75.2	-18	-179	57.9	0	0	0	0	114	E417 K418	E417-T421 WeakPolarHBondContact O-CG2 3.46Å; E417-T421 PolarHBondContact O-N 3.42Å; E417-T421 PolarHBondContact O-OG1 3.34Å; K418-T421 WeakPolarHBondContact CA-OG1 3.3Å; K418-T421 PolarHBondContact O-OG1 2.86Å
422	Q	64.1	Low	69.9	Low	89 Å²	89	66 Å²	66	42%	0.416	35%	0.35	S	S	.	.	S	Bend	trans	-115.1	86.7	172	-65.7	-163.1	3.8	0	0	111.3	K418 A419 K420 W424 I427	K418-Q422 PolarHBondContact O-N 3.02Å; K418-Q422 VanDerWaalsContact O-N 3.15Å; A419-Q422 CarbonylContact O-C 3.49Å; K420-Q422 VanDerWaalsContact C-N 3.32Å; K420-Q422 PolarHBondContact O-N 2.98Å; Q422-W424 PolarHBondContact O-N 3.46Å; Q422-I427 HydrophobicContact CB-CD1 4.09Å; Q422-I427 HydrophobicContact CB-CG1 4.2Å
423	H	80.4	Confident	72.2	Confident	97 Å²	97	68.4 Å²	68.4	45%	0.449	36%	0.361	S	S	.	.			trans	-47.7	130.5	169.1	-177.6	-115.7	0	0	0	110.6	G425 T426	H423-G425 PolarHBondContact ND1-N 3.03Å; H423-G425 PolarHBondContact O-N 3.4Å; H423-T426 WeakPolarHBondContact O-CB 3.33Å; H423-T426 PolarHBondContact O-N 2.92Å
424	W	83.9	Confident	74.4	Confident	43 Å²	43	65.5 Å²	65.5	16%	0.163	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-26.7	-175.2	56.6	-93.9	0	0	0	113.6	M80 Q422 T426 I427 R428 Y784	M80-W424 HydrophobicContact CE-CH2 4.18Å; M80-W424 HydrophobicContact CE-CZ2 3.84Å; M80-W424 HydrophobicContact SD-CH2 3.64Å; M80-W424 HydrophobicContact SD-CZ2 3.85Å; Q422-W424 PolarHBondContact O-N 3.46Å; W424-T426 VanDerWaalsContact C-N 3.3Å; W424-T426 PolarHBondContact O-N 3.42Å; W424-I427 PolarHBondContact O-N 2.82Å; W424-R428 WeakPolarHBondContact O-CB 3.39Å; W424-R428 PolarHBondContact O-N 2.83Å; W424-Y784 HydrophobicContact CB-CD2 4.25Å; W424-Y784 HydrophobicContact CB-CG 4.39Å; W424-Y784 AromaticContact CD2-CD2 3.93Å; W424-Y784 HydrophobicContact CD2-CD2 3.93Å; W424-Y784 AromaticContact CE3-CD2 3.49Å; W424-Y784 HydrophobicContact CE3-CD2 3.49Å; W424-Y784 VanDerWaalsContact CE3-CD2 3.49Å; W424-Y784 AromaticContact CE3-CE2 3.9Å; W424-Y784 HydrophobicContact CE3-CE2 3.9Å; W424-Y784 HydrophobicContact CG-CD2 4.26Å; W424-Y784 HydrophobicContact CZ3-CD2 4.18Å; W424-Y784 HydrophobicContact CZ3-CE2 4.22Å
425	G	85.7	Confident	76.5	Confident	23 Å²	23	61.9 Å²	61.9	24%	0.237	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-38.7	172.6	0	0	0	0	0	112.9	H423 R428 A429	H423-G425 PolarHBondContact ND1-N 3.03Å; H423-G425 PolarHBondContact O-N 3.4Å; G425-R428 PolarHBondContact O-N 2.75Å; G425-A429 WeakPolarHBondContact O-CB 3.27Å; G425-A429 PolarHBondContact O-N 2.68Å
426	T	86.8	Confident	78.4	Confident	80 Å²	80	62.5 Å²	62.5	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-68.3	-39	175.6	-49.9	0	0	0	0	111.5	H423 W424 A429 R430	H423-T426 WeakPolarHBondContact O-CB 3.33Å; H423-T426 PolarHBondContact O-N 2.92Å; W424-T426 VanDerWaalsContact C-N 3.3Å; W424-T426 PolarHBondContact O-N 3.42Å; T426-A429 PolarHBondContact O-N 2.91Å; T426-R430 WeakPolarHBondContact O-CG 3.19Å; T426-R430 PolarHBondContact O-N 3.31Å
427	I	87.9	Confident	80.2	Confident	6 Å²	6	62.6 Å²	62.6	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-69.3	-40.8	177.8	-49.5	178.6	0	0	0	110.4	Q422 W424 R430 L431 D602 L603 H606	Q422-I427 HydrophobicContact CB-CD1 4.09Å; Q422-I427 HydrophobicContact CB-CG1 4.2Å; W424-I427 PolarHBondContact O-N 2.82Å; I427-R430 WeakPolarHBondContact O-CB 3.2Å; I427-R430 PolarHBondContact O-N 2.75Å; I427-L431 PolarHBondContact O-N 3.18Å; I427-D602 HydrophobicContact CG2-CB 3.73Å; I427-L603 HydrophobicContact CB-CD1 4.04Å; I427-L603 HydrophobicContact CG2-CB 3.82Å; I427-L603 HydrophobicContact CG2-CD1 3.95Å; I427-L603 HydrophobicContact CG2-CG 4.48Å; I427-H606 HydrophobicContact CD1-CB 4.25Å
428	R	89.2	Confident	82.2	Confident	57 Å²	57	58.9 Å²	58.9	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-46	172.5	175.5	-178.2	173.6	159.2	0.3	112	W424 G425 R430 L431 E432 D792	W424-R428 WeakPolarHBondContact O-CB 3.39Å; W424-R428 PolarHBondContact O-N 2.83Å; G425-R428 PolarHBondContact O-N 2.75Å; R428-R430 VanDerWaalsContact C-N 3.32Å; R428-R430 PolarHBondContact O-N 2.94Å; R428-L431 WeakPolarHBondContact O-CA 3.25Å; R428-L431 WeakPolarHBondContact O-CB 3.15Å; R428-L431 PolarHBondContact O-N 3.4Å; R428-E432 HydrophobicContact CG-CG 4.48Å; R428-E432 WeakPolarHBondContact CG-OE1 3.37Å; R428-E432 IonicContact CZ-OE1 2.86Å; R428-E432 IonicContact NE-OE1 2.69Å; R428-E432 PolarHBondContact NE-OE1 2.92Å; R428-E432 IonicContact NH2-OE1 3.21Å; R428-E432 PolarHBondContact O-N 3.25Å; R428-D792 IonicContact CZ-OD2 2.68Å; R428-D792 VanDerWaalsContact CZ-OD2 3.25Å; R428-D792 IonicContact NH1-OD2 2.76Å; R428-D792 PolarHBondContact NH1-OD2 3.3Å; R428-D792 IonicContact NH2-OD2 2.73Å; R428-D792 PolarHBondContact NH2-OD2 3.5Å
429	A	91.7	Very high	83.9	Confident	45 Å²	45	54 Å²	54	37%	0.372	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-41.9	176.1	0	0	0	0	0	111.6	G425 T426 L431 E432 I433	G425-A429 WeakPolarHBondContact O-CB 3.27Å; G425-A429 PolarHBondContact O-N 2.68Å; T426-A429 PolarHBondContact O-N 2.91Å; A429-L431 VanDerWaalsContact C-N 3.28Å; A429-L431 PolarHBondContact O-N 3.04Å; A429-E432 PolarHBondContact O-N 3.17Å; A429-I433 WeakPolarHBondContact O-CB 3.37Å; A429-I433 WeakPolarHBondContact O-CD1 3.46Å; A429-I433 VanDerWaalsContact O-CG1 3.25Å; A429-I433 WeakPolarHBondContact O-CG1 3.48Å; A429-I433 PolarHBondContact O-N 3.48Å
430	R	91.8	Very high	85.7	Confident	94 Å²	94	56.8 Å²	56.8	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-58.8	-37.4	171.6	-73.2	170.3	63.6	-134.9	-7.5	112.4	T426 I427 R428 A434 A599 D602	T426-R430 WeakPolarHBondContact O-CG 3.19Å; T426-R430 PolarHBondContact O-N 3.31Å; I427-R430 WeakPolarHBondContact O-CB 3.2Å; I427-R430 PolarHBondContact O-N 2.75Å; R428-R430 VanDerWaalsContact C-N 3.32Å; R428-R430 PolarHBondContact O-N 2.94Å; R430-A434 WeakPolarHBondContact O-CB 3.36Å; R430-A434 PolarHBondContact O-N 3.13Å; R430-A599 HydrophobicContact CB-CB 4.37Å; R430-D602 IonicContact CZ-OD2 2.7Å; R430-D602 VanDerWaalsContact CZ-OD2 3.28Å; R430-D602 IonicContact NH1-OD2 3.15Å; R430-D602 PolarHBondContact NH1-OD2 3.34Å; R430-D602 IonicContact NH2-OD2 3.23Å; R430-D602 PolarHBondContact NH2-OD2 3.42Å
431	L	93.7	Very high	87.3	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-43.4	175.9	-178.7	61.9	0	0	0	112.4	I427 R428 A429 A434 V435 L596 A599 L600 L603 T793	I427-L431 PolarHBondContact O-N 3.18Å; R428-L431 WeakPolarHBondContact O-CA 3.25Å; R428-L431 WeakPolarHBondContact O-CB 3.15Å; R428-L431 PolarHBondContact O-N 3.4Å; A429-L431 VanDerWaalsContact C-N 3.28Å; A429-L431 PolarHBondContact O-N 3.04Å; L431-A434 PolarHBondContact O-N 2.92Å; L431-V435 WeakPolarHBondContact O-CG2 3.35Å; L431-V435 PolarHBondContact O-N 3.15Å; L431-L596 HydrophobicContact CD1-CD1 3.81Å; L431-A599 HydrophobicContact CB-CB 4Å; L431-A599 HydrophobicContact CD1-CB 4.04Å; L431-L600 HydrophobicContact CD1-CB 4.06Å; L431-L600 HydrophobicContact CD2-CD1 4.27Å; L431-L603 HydrophobicContact CD2-CD2 3.65Å; L431-T793 HydrophobicContact CD2-CG2 3.57Å
432	E	93.2	Very high	89	Confident	61 Å²	61	48.4 Å²	48.4	29%	0.285	24%	0.242	S	C	.	.	H	α-helix	trans	-66.1	-38.8	179.3	-70	175.9	-167.8	0	0	111.6	R428 A429 V435 N436	R428-E432 HydrophobicContact CG-CG 4.48Å; R428-E432 WeakPolarHBondContact CG-OE1 3.37Å; R428-E432 IonicContact CZ-OE1 2.86Å; R428-E432 IonicContact NE-OE1 2.69Å; R428-E432 PolarHBondContact NE-OE1 2.92Å; R428-E432 IonicContact NH2-OE1 3.21Å; R428-E432 PolarHBondContact O-N 3.25Å; A429-E432 PolarHBondContact O-N 3.17Å; E432-V435 PolarHBondContact O-N 3.1Å; E432-N436 PolarHBondContact O-N 3.28Å; E432-N436 VanDerWaalsContact O-N 3.08Å; E432-N436 PolarHBondContact O-ND2 2.69Å; E432-N436 PolarHBondContact O-OD1 3.14Å
433	I	92.6	Very high	90.1	Very high	102 Å²	102	47.8 Å²	47.8	52%	0.523	24%	0.244	S	C	.	.	H	α-helix	trans	-59.7	-49	168.6	-67.8	163.9	0	0	0	110.5	A429 V435 N436 M437	A429-I433 WeakPolarHBondContact O-CB 3.37Å; A429-I433 WeakPolarHBondContact O-CD1 3.46Å; A429-I433 VanDerWaalsContact O-CG1 3.25Å; A429-I433 WeakPolarHBondContact O-CG1 3.48Å; A429-I433 PolarHBondContact O-N 3.48Å; I433-V435 VanDerWaalsContact C-N 3.33Å; I433-V435 PolarHBondContact O-N 3.07Å; I433-N436 PolarHBondContact O-N 2.82Å; I433-N436 VanDerWaalsContact O-N 3.17Å; I433-M437 HydrophobicContact CG2-CG 4.38Å; I433-M437 HydrophobicContact CG2-SD 4.01Å; I433-M437 WeakPolarHBondContact O-CG 3.07Å; I433-M437 PolarHBondContact O-N 3.41Å
434	A	93.9	Very high	90.4	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.017	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-35.6	-179.3	0	0	0	0	0	113.2	R430 L431 V438 L596 A599	R430-A434 WeakPolarHBondContact O-CB 3.36Å; R430-A434 PolarHBondContact O-N 3.13Å; L431-A434 PolarHBondContact O-N 2.92Å; A434-V438 WeakPolarHBondContact O-CG2 3.49Å; A434-V438 PolarHBondContact O-N 3.27Å; A434-V438 VanDerWaalsContact O-N 3.13Å; A434-L596 HydrophobicContact CB-CB 4.4Å; A434-L596 HydrophobicContact CB-CD1 4.37Å; A434-A599 HydrophobicContact CB-CB 4.44Å
435	V	93.7	Very high	90.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-50.8	171.3	165.5	0	0	0	0	110.4	L431 E432 I433 M437 V438 Q439 L596 S796 L797 K799 L800	L431-V435 WeakPolarHBondContact O-CG2 3.35Å; L431-V435 PolarHBondContact O-N 3.15Å; E432-V435 PolarHBondContact O-N 3.1Å; I433-V435 VanDerWaalsContact C-N 3.33Å; I433-V435 PolarHBondContact O-N 3.07Å; V435-M437 VanDerWaalsContact C-N 3.31Å; V435-M437 PolarHBondContact O-N 3.05Å; V435-V438 PolarHBondContact O-N 3.11Å; V435-V438 VanDerWaalsContact O-N 3.11Å; V435-Q439 WeakPolarHBondContact O-CG 3.23Å; V435-Q439 PolarHBondContact O-N 3.47Å; V435-L596 HydrophobicContact CG2-CD1 3.73Å; V435-S796 WeakPolarHBondContact CG1-O 3.48Å; V435-L797 HydrophobicContact CG2-CD2 4.05Å; V435-K799 HydrophobicContact CG1-CB 4.21Å; V435-K799 HydrophobicContact CG1-CD 4.17Å; V435-L800 HydrophobicContact CG1-CD2 4.1Å; V435-L800 HydrophobicContact CG1-CG 4.19Å; V435-L800 HydrophobicContact CG2-CD1 4.31Å
436	N	93.1	Very high	90.5	Very high	73 Å²	73	46.6 Å²	46.6	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-60.6	-40.5	-179.5	-63.4	-16.3	0	0	0	111.5	E432 I433 V438 Q439 E440	E432-N436 PolarHBondContact O-N 3.28Å; E432-N436 VanDerWaalsContact O-N 3.08Å; E432-N436 PolarHBondContact O-ND2 2.69Å; E432-N436 PolarHBondContact O-OD1 3.14Å; I433-N436 PolarHBondContact O-N 2.82Å; I433-N436 VanDerWaalsContact O-N 3.17Å; N436-V438 VanDerWaalsContact C-N 3.35Å; N436-V438 PolarHBondContact O-N 3.48Å; N436-Q439 PolarHBondContact O-N 3.48Å; N436-E440 PolarHBondContact O-N 3.2Å
437	M	92.4	Very high	90.4	Very high	49 Å²	49	45.6 Å²	45.6	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-37.7	174.8	-68.2	173.5	70.1	0	0	112.8	I433 V435 K441 V591 Y595	I433-M437 HydrophobicContact CG2-CG 4.38Å; I433-M437 HydrophobicContact CG2-SD 4.01Å; I433-M437 WeakPolarHBondContact O-CG 3.07Å; I433-M437 PolarHBondContact O-N 3.41Å; V435-M437 VanDerWaalsContact C-N 3.31Å; V435-M437 PolarHBondContact O-N 3.05Å; M437-K441 PolarHBondContact O-N 3.05Å; M437-V591 HydrophobicContact CB-CG1 3.6Å; M437-V591 HydrophobicContact CE-CG1 4.36Å; M437-V591 HydrophobicContact CE-CG2 4.49Å; M437-Y595 HydrophobicContact CE-CD1 4.15Å; M437-Y595 HydrophobicContact CE-CD2 3.96Å; M437-Y595 HydrophobicContact CE-CE1 4.15Å; M437-Y595 HydrophobicContact CE-CE2 3.97Å; M437-Y595 HydrophobicContact CE-CG 4.06Å; M437-Y595 HydrophobicContact SD-CD1 4.19Å; M437-Y595 HydrophobicContact SD-CG 4.26Å
438	V	92.8	Very high	89.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67	-44.3	174.5	173.8	0	0	0	0	110.4	A434 V435 N436 E440 K441 V442 V591 V592 L596 L800 F805	A434-V438 WeakPolarHBondContact O-CG2 3.49Å; A434-V438 PolarHBondContact O-N 3.27Å; A434-V438 VanDerWaalsContact O-N 3.13Å; V435-V438 PolarHBondContact O-N 3.11Å; V435-V438 VanDerWaalsContact O-N 3.11Å; N436-V438 VanDerWaalsContact C-N 3.35Å; N436-V438 PolarHBondContact O-N 3.48Å; V438-E440 VanDerWaalsContact C-N 3.33Å; V438-E440 PolarHBondContact O-N 3.45Å; V438-K441 PolarHBondContact O-N 3.5Å; V438-V442 HydrophobicContact CG1-CG2 4.09Å; V438-V442 WeakPolarHBondContact O-CB 3.36Å; V438-V442 VanDerWaalsContact O-CG2 3.25Å; V438-V442 WeakPolarHBondContact O-CG2 3.16Å; V438-V442 PolarHBondContact O-N 3.42Å; V438-V591 HydrophobicContact CG2-CB 4.41Å; V438-V591 HydrophobicContact CG2-CG1 3.64Å; V438-V592 HydrophobicContact CG1-CG2 4.04Å; V438-V592 HydrophobicContact CG2-CG2 3.7Å; V438-L596 HydrophobicContact CG2-CB 4.25Å; V438-L596 HydrophobicContact CG2-CD2 4.29Å; V438-L800 HydrophobicContact CB-CD2 4.06Å; V438-L800 HydrophobicContact CG1-CD2 3.83Å; V438-F805 HydrophobicContact CG1-CE1 3.77Å; V438-F805 HydrophobicContact CG1-CZ 3.8Å
439	Q	91.6	Very high	89.4	Confident	50 Å²	50	53 Å²	53	23%	0.234	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-45.5	176.4	-64.7	-169.8	-80.6	0	0	111.5	V435 N436 V442 V443 K799 L800 F803	V435-Q439 WeakPolarHBondContact O-CG 3.23Å; V435-Q439 PolarHBondContact O-N 3.47Å; N436-Q439 PolarHBondContact O-N 3.48Å; Q439-V442 PolarHBondContact O-N 3.04Å; Q439-V443 WeakPolarHBondContact O-CB 3.33Å; Q439-V443 VanDerWaalsContact O-CG2 3.31Å; Q439-V443 WeakPolarHBondContact O-CG2 3.37Å; Q439-V443 PolarHBondContact O-N 3.02Å; Q439-K799 PolarHBondContact NE2-O 2.77Å; Q439-K799 VanDerWaalsContact NE2-O 3.15Å; Q439-L800 HydrophobicContact CG-CD2 3.82Å; Q439-F803 HydrophobicContact CB-CE2 4.42Å; Q439-F803 HydrophobicContact CG-CE2 3.96Å
440	E	90.5	Very high	88.5	Confident	75 Å²	75	56.6 Å²	56.6	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-55.3	-55.5	177.1	-169.8	-153	133.7	0	0	111.6	N436 V438 V442 V443 T444	N436-E440 PolarHBondContact O-N 3.2Å; V438-E440 VanDerWaalsContact C-N 3.33Å; V438-E440 PolarHBondContact O-N 3.45Å; E440-V442 VanDerWaalsContact C-N 3.34Å; E440-V442 PolarHBondContact O-N 3.33Å; E440-V443 PolarHBondContact O-N 3.45Å; E440-T444 PolarHBondContact O-N 2.8Å; E440-T444 PolarHBondContact O-OG1 3.24Å; E440-T444 VanDerWaalsContact O-OG1 3.13Å
441	K	89.8	Confident	86.9	Confident	66 Å²	66	55.2 Å²	55.2	29%	0.287	29%	0.293	S	S	.	.	H	α-helix	trans	-70.1	-29	-176.3	-59	-45.2	-177.4	-167.5	0	113.4	M437 V438 T444 L445 V588 V591	M437-K441 PolarHBondContact O-N 3.05Å; V438-K441 PolarHBondContact O-N 3.5Å; K441-T444 WeakPolarHBondContact O-CB 3.3Å; K441-T444 PolarHBondContact O-N 2.82Å; K441-L445 WeakPolarHBondContact O-CB 3.44Å; K441-L445 PolarHBondContact O-N 3.07Å; K441-V588 HydrophobicContact CB-CG2 3.84Å; K441-V591 HydrophobicContact CG-CG2 4.03Å
442	V	89.2	Confident	84.8	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.024	32%	0.322	C	S	.	.	H	α-helix	trans	-72.3	-36	173	175.7	0	0	0	0	111.5	V438 Q439 E440 L445 N446 V588 F803 F805	V438-V442 HydrophobicContact CG1-CG2 4.09Å; V438-V442 WeakPolarHBondContact O-CB 3.36Å; V438-V442 VanDerWaalsContact O-CG2 3.25Å; V438-V442 WeakPolarHBondContact O-CG2 3.16Å; V438-V442 PolarHBondContact O-N 3.42Å; Q439-V442 PolarHBondContact O-N 3.04Å; E440-V442 VanDerWaalsContact C-N 3.34Å; E440-V442 PolarHBondContact O-N 3.33Å; V442-L445 PolarHBondContact O-N 3.13Å; V442-N446 WeakPolarHBondContact O-CB 3.47Å; V442-N446 PolarHBondContact O-N 2.88Å; V442-N446 PolarHBondContact O-ND2 3.01Å; V442-V588 HydrophobicContact CG2-CB 4.46Å; V442-V588 HydrophobicContact CG2-CG1 3.73Å; V442-V588 HydrophobicContact CG2-CG2 3.78Å; V442-F803 HydrophobicContact CB-CD1 4.3Å; V442-F803 HydrophobicContact CG1-CB 3.9Å; V442-F803 HydrophobicContact CG1-CD1 3.36Å; V442-F803 HydrophobicContact CG1-CE1 4.01Å; V442-F803 HydrophobicContact CG1-CG 3.73Å; V442-F805 HydrophobicContact CG2-CE1 3.72Å; V442-F805 HydrophobicContact CG2-CZ 4.23Å
443	V	88.3	Confident	82.2	Confident	75 Å²	75	65.6 Å²	65.6	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-43.9	170.2	169.4	0	0	0	0	110.4	Q439 E440 L445 N446 T447 F803	Q439-V443 WeakPolarHBondContact O-CB 3.33Å; Q439-V443 VanDerWaalsContact O-CG2 3.31Å; Q439-V443 WeakPolarHBondContact O-CG2 3.37Å; Q439-V443 PolarHBondContact O-N 3.02Å; E440-V443 PolarHBondContact O-N 3.45Å; V443-L445 PolarHBondContact O-N 3.26Å; V443-N446 PolarHBondContact O-N 3.41Å; V443-T447 PolarHBondContact O-N 2.87Å; V443-T447 PolarHBondContact O-OG1 2.9Å; V443-F803 HydrophobicContact CG2-CE1 4.23Å; V443-F803 HydrophobicContact CG2-CZ 4.4Å
444	T	86.1	Confident	79.5	Confident	46 Å²	46	65.2 Å²	65.2	28%	0.282	36%	0.355	S	S	.	.	H	α-helix	trans	-56.8	-49.3	173	-55.5	0	0	0	0	112.2	E440 K441 N446 T447 Y448	E440-T444 PolarHBondContact O-N 2.8Å; E440-T444 PolarHBondContact O-OG1 3.24Å; E440-T444 VanDerWaalsContact O-OG1 3.13Å; K441-T444 WeakPolarHBondContact O-CB 3.3Å; K441-T444 PolarHBondContact O-N 2.82Å; T444-N446 VanDerWaalsContact C-N 3.33Å; T444-N446 PolarHBondContact O-N 3.2Å; T444-T447 WeakPolarHBondContact CA-OG1 3.45Å; T444-T447 PolarHBondContact O-N 3.3Å; T444-T447 VanDerWaalsContact O-N 3.14Å; T444-T447 PolarHBondContact O-OG1 3.42Å; T444-Y448 HydrophobicContact CG2-CD2 4.09Å; T444-Y448 HydrophobicContact CG2-CE2 3.55Å; T444-Y448 WeakPolarHBondContact O-CD2 3.35Å; T444-Y448 PolarHBondContact O-N 3.11Å
445	L	86.6	Confident	76.9	Confident	23 Å²	23	71.8 Å²	71.8	12%	0.12	40%	0.395	C	S	.	.	H	α-helix	trans	-57.7	-44.5	176.4	176.1	59.4	0	0	0	111.9	K441 V442 V443 T447 Y448 K449 Y581 A584 E585 V588	K441-L445 WeakPolarHBondContact O-CB 3.44Å; K441-L445 PolarHBondContact O-N 3.07Å; V442-L445 PolarHBondContact O-N 3.13Å; V443-L445 PolarHBondContact O-N 3.26Å; L445-T447 VanDerWaalsContact C-N 3.34Å; L445-T447 PolarHBondContact O-N 3.45Å; L445-Y448 PolarHBondContact O-N 3.34Å; L445-K449 WeakPolarHBondContact O-CB 3.38Å; L445-K449 PolarHBondContact O-N 3.23Å; L445-Y581 HydrophobicContact CD1-CD2 3.95Å; L445-Y581 HydrophobicContact CD1-CE2 3.58Å; L445-A584 HydrophobicContact CB-CB 4.12Å; L445-A584 HydrophobicContact CD1-CB 3.86Å; L445-E585 HydrophobicContact CD1-CG 3.56Å; L445-E585 HydrophobicContact CD2-CG 3.99Å; L445-E585 HydrophobicContact CG-CG 4.45Å; L445-V588 HydrophobicContact CB-CG2 4.39Å; L445-V588 HydrophobicContact CD2-CG2 4.22Å
446	N	85.7	Confident	74.2	Confident	70 Å²	70	77 Å²	77	37%	0.374	43%	0.427	S	S	.	.	H	α-helix	trans	-66.1	-31.8	177	-76.7	-39.1	0	0	0	113.2	V442 V443 T444 K449 L450	V442-N446 WeakPolarHBondContact O-CB 3.47Å; V442-N446 PolarHBondContact O-N 2.88Å; V442-N446 PolarHBondContact O-ND2 3.01Å; V443-N446 PolarHBondContact O-N 3.41Å; T444-N446 VanDerWaalsContact C-N 3.33Å; T444-N446 PolarHBondContact O-N 3.2Å; N446-K449 PolarHBondContact O-N 2.99Å; N446-L450 WeakPolarHBondContact O-CB 3.39Å; N446-L450 PolarHBondContact O-N 3.45Å; N446-L450 VanDerWaalsContact O-N 3.13Å
447	T	83.8	Confident	71.3	Confident	58 Å²	58	80 Å²	80	36%	0.356	44%	0.443	S	S	.	.	H	α-helix	trans	-66.4	-38.7	173.1	49.9	0	0	0	0	112.7	V443 T444 L445 L450	V443-T447 PolarHBondContact O-N 2.87Å; V443-T447 PolarHBondContact O-OG1 2.9Å; T444-T447 WeakPolarHBondContact CA-OG1 3.45Å; T444-T447 PolarHBondContact O-N 3.3Å; T444-T447 VanDerWaalsContact O-N 3.14Å; T444-T447 PolarHBondContact O-OG1 3.42Å; L445-T447 VanDerWaalsContact C-N 3.34Å; L445-T447 PolarHBondContact O-N 3.45Å; T447-L450 PolarHBondContact O-N 2.95Å
448	Y	79.3	Confident	68.7	Low	93 Å²	93	83.2 Å²	83.2	37%	0.365	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-43.7	172.3	-66.5	-55.5	0	0	0	111.9	T444 L445 L450 G451 L580 A584	T444-Y448 HydrophobicContact CG2-CD2 4.09Å; T444-Y448 HydrophobicContact CG2-CE2 3.55Å; T444-Y448 WeakPolarHBondContact O-CD2 3.35Å; T444-Y448 PolarHBondContact O-N 3.11Å; L445-Y448 PolarHBondContact O-N 3.34Å; Y448-L450 PolarHBondContact O-N 3.34Å; Y448-L450 VanDerWaalsContact O-N 3.13Å; Y448-G451 PolarHBondContact O-N 3.48Å; Y448-G451 VanDerWaalsContact O-N 3.09Å; Y448-L580 HydrophobicContact CD1-CB 4.26Å; Y448-L580 HydrophobicContact CE1-CB 4.02Å; Y448-L580 HydrophobicContact CE1-CD1 3.92Å; Y448-L580 HydrophobicContact CE1-CG 4.44Å; Y448-L580 HydrophobicContact CE2-CB 4.5Å; Y448-A584 HydrophobicContact CD2-CB 3.72Å; Y448-A584 HydrophobicContact CE2-CB 4.07Å
449	K	77.9	Confident	65.9	Low	126 Å²	126	91.2 Å²	91.2	55%	0.548	49%	0.492	S	S	.	.	H	α-helix	trans	-57	-27.7	176.7	-164.2	175.3	178.6	-179.6	0	113.5	L445 N446 Y581	L445-K449 WeakPolarHBondContact O-CB 3.38Å; L445-K449 PolarHBondContact O-N 3.23Å; N446-K449 PolarHBondContact O-N 2.99Å; K449-Y581 HydrophobicContact CB-CD2 4.5Å; K449-Y581 HydrophobicContact CB-CE2 3.94Å; K449-Y581 HydrophobicContact CG-CE2 4.14Å
450	L	72.7	Confident	63	Low	121 Å²	121	92.5 Å²	92.5	63%	0.634	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	7.8	-178.4	-145.9	75	0	0	0	114.2	N446 T447 Y448 K452	N446-L450 WeakPolarHBondContact O-CB 3.39Å; N446-L450 PolarHBondContact O-N 3.45Å; N446-L450 VanDerWaalsContact O-N 3.13Å; T447-L450 PolarHBondContact O-N 2.95Å; Y448-L450 PolarHBondContact O-N 3.34Å; Y448-L450 VanDerWaalsContact O-N 3.13Å; L450-K452 HydrophobicContact CD2-CD 4.26Å; L450-K452 PolarHBondContact O-N 2.73Å
451	G	57.8	Low	60.3	Low	64 Å²	64	93.1 Å²	93.1	66%	0.66	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	14.8	173.8	0	0	0	0	0	115.8	Y448 T453	Y448-G451 PolarHBondContact O-N 3.48Å; Y448-G451 VanDerWaalsContact O-N 3.09Å; G451-T453 PolarHBondContact O-N 2.99Å
452	K	48.9	Very low	57.6	Low	142 Å²	142	98.2 Å²	98.2	62%	0.617	53%	0.534	S	S	*	.			trans	-98.7	93.4	-174.7	-71.8	-179.1	-175.1	178.6	0	111.5	L450 S454	L450-K452 HydrophobicContact CD2-CD 4.26Å; L450-K452 PolarHBondContact O-N 2.73Å; K452-S454 PolarHBondContact O-N 3.15Å
453	T	38.8	Very low	54.9	Low	138 Å²	138	105.2 Å²	105.2	85%	0.847	57%	0.566	S	S	*	*			trans	-72.3	50.5	171	45.5	0	0	0	0	112.8	G451 T455	G451-T453 PolarHBondContact O-N 2.99Å; T453-T455 PolarHBondContact O-N 3.08Å
454	S	36.8	Very low	52.2	Low	94 Å²	94	107.2 Å²	107.2	66%	0.657	58%	0.579	S	S	*	*			trans	-63.9	135.1	162.8	-67.3	0	0	0	0	109.3	K452 V456	K452-S454 PolarHBondContact O-N 3.15Å; S454-V456 VanDerWaalsContact C-N 3.27Å; S454-V456 PolarHBondContact O-N 3.42Å
455	T	38.5	Very low	49.6	Very low	140 Å²	140	109.7 Å²	109.7	86%	0.859	59%	0.588	S	S	*	*			trans	-71.4	76.5	-177.1	40.5	0	0	0	0	111.9	T453 N457	T453-T455 PolarHBondContact O-N 3.08Å; T455-N457 PolarHBondContact O-N 3.1Å
456	V	37.7	Very low	47.2	Very low	110 Å²	110	113.3 Å²	113.3	67%	0.667	61%	0.613	S	S	*	*			trans	-62.7	106.5	170.2	179.9	0	0	0	0	108.1	S454 L458	S454-V456 VanDerWaalsContact C-N 3.27Å; S454-V456 PolarHBondContact O-N 3.42Å; V456-L458 PolarHBondContact O-N 3.37Å
457	N	32.7	Very low	44.7	Very low	135 Å²	135	116.6 Å²	116.6	72%	0.722	63%	0.631	S	S	*	*			trans	-72.6	96.2	-173.6	-164	2.2	0	0	0	109.9	T455 Y459	T455-N457 PolarHBondContact O-N 3.1Å; N457-Y459 PolarHBondContact O-N 3.48Å
458	L	38.1	Very low	42.2	Very low	117 Å²	117	120.4 Å²	120.4	61%	0.613	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	5.9	-166.9	-88.4	161.9	0	0	0	116.2	V456 L538	V456-L458 PolarHBondContact O-N 3.37Å; L458-L538 HydrophobicContact CD1-CD2 4.3Å
459	Y	32.9	Very low	40	Very low	169 Å²	169	122.1 Å²	122.1	66%	0.663	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	4.5	-177.1	-100.5	-93	0	0	0	115.3	N457	N457-Y459 PolarHBondContact O-N 3.48Å
460	S	31.5	Very low	37.7	Very low	77 Å²	77	124.3 Å²	124.3	54%	0.538	67%	0.673	S	S	.	*			trans	-108.9	3.9	-175	-163.5	0	0	0	0	115.7	Y462	S460-Y462 VanDerWaalsContact C-N 3.3Å; S460-Y462 PolarHBondContact O-N 3.06Å
461	T	32.7	Very low	35.7	Very low	87 Å²	87	123.4 Å²	123.4	53%	0.534	68%	0.677	S	S	.	*	S	Bend	trans	-84.3	-1.4	-171.4	-42.6	0	0	0	0	114
462	Y	34.5	Very low	34.1	Very low	174 Å²	174	125.8 Å²	125.8	68%	0.682	68%	0.682	S	S	*	*	S	Bend	trans	-105	138.3	160.2	-53.2	-77.3	0	0	0	107.6	S460	S460-Y462 VanDerWaalsContact C-N 3.3Å; S460-Y462 PolarHBondContact O-N 3.06Å
463	H	31.8	Very low	33.4	Very low	150 Å²	150	125.9 Å²	125.9	69%	0.694	70%	0.695	S	S	*	*	S	Bend	trans	69.4	66.1	-176.1	-46.1	-90.9	0	0	0	116.9
464	T	31.8	Very low	33.1	Very low	117 Å²	117	125.3 Å²	125.3	72%	0.718	69%	0.692	S	S	*	*			trans	-144.4	119.1	152.5	-60.3	0	0	0	0	111.5
465	M	31.9	Very low	32.7	Very low	99 Å²	99	130.4 Å²	130.4	49%	0.488	70%	0.702	S	S	.	*			trans	-92.9	137.9	167.5	-86.3	-77.6	-178.9	0	0	109.7	F91 N467	F91-M465 HydrophobicContact CD1-CE 3.82Å; F91-M465 HydrophobicContact CE1-CE 3.57Å; M465-N467 PolarHBondContact O-N 3.29Å; M465-N467 VanDerWaalsContact O-N 3.15Å
466	P	34.9	Very low	32.4	Very low	99 Å²	99	129.1 Å²	129.1	64%	0.643	70%	0.699	S	S	*	*			trans	-75.7	102.4	175.9	30.2	-33	0	0	0	110.9	I468	P466-I468 PolarHBondContact O-N 3.38Å; P466-I468 VanDerWaalsContact O-N 3.08Å
467	N	33.3	Very low	32.1	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	71%	0.705	S	S	*	*			trans	-69.3	100.1	168.1	-81.9	-33.8	0	0	0	109.9	M465 I469	M465-N467 PolarHBondContact O-N 3.29Å; M465-N467 VanDerWaalsContact O-N 3.15Å; N467-I469 PolarHBondContact O-N 3.42Å
468	I	31.9	Very low	32.2	Very low	139 Å²	139	133 Å²	133	71%	0.713	71%	0.709	S	S	*	*			trans	-86.2	102.8	170	-62.1	164.8	0	0	0	108.4	P466	P466-I468 PolarHBondContact O-N 3.38Å; P466-I468 VanDerWaalsContact O-N 3.08Å
469	I	32.5	Very low	32	Very low	129 Å²	129	132.2 Å²	132.2	66%	0.662	71%	0.711	S	S	*	*			trans	-124.7	107.1	164.4	-60.4	-179.2	0	0	0	107.5	N467 S471	N467-I469 PolarHBondContact O-N 3.42Å; I469-S471 PolarHBondContact O-N 2.95Å
470	H	29.5	Very low	31.9	Very low	171 Å²	171	131.1 Å²	131.1	79%	0.792	72%	0.716	S	S	*	*			trans	-80.8	104.7	170.5	-90.3	-84.4	0	0	0	109.7
471	S	30.8	Very low	32	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	73%	0.73	S	S	*	*			trans	-114.6	95.6	173	-66	0	0	0	0	111	I469	I469-S471 PolarHBondContact O-N 2.95Å
472	C	25.4	Very low	32.2	Very low	114 Å²	114	136 Å²	136	77%	0.77	74%	0.743	S	S	*	*			trans	-91.9	116.4	168.4	-65.9	0	0	0	0	110.3
473	T	33.7	Very low	32.5	Very low	145 Å²	145	133.1 Å²	133.1	89%	0.89	75%	0.745	S	S	*	*			trans	-170.4	163.5	148.8	10.2	0	0	0	0	110.5
474	T	31.8	Very low	32.6	Very low	126 Å²	126	130.7 Å²	130.7	77%	0.773	75%	0.745	S	S	*	*			trans	-116.2	137.7	-160.2	51.1	0	0	0	0	115.2
475	K	29	Very low	32.6	Very low	201 Å²	201	128.4 Å²	128.4	87%	0.874	75%	0.745	S	S	*	*			trans	51.5	111.3	147.3	-64.2	-174.4	174.2	-169.8	0	119.9
476	S	33.1	Very low	32.8	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	76%	0.76	S	S	*	*				172.8	104	121.8	-171.1	0	0	0	0	107.6
477	E	30.1	Very low	32.9	Very low	172 Å²	172	135.7 Å²	135.7	80%	0.804	76%	0.76	S	S	*	*				90.1	134.1	60.1	-151.6	176.5	-94.5	0	0	113.7
478	I	36	Very low	33.2	Very low	154 Å²	154	133.7 Å²	133.7	79%	0.79	76%	0.757	S	S	*	*			trans	86.7	135.7	173.9	-52.3	-178.6	0	0	0	118
479	P	33.4	Very low	33.7	Very low	101 Å²	101	132.4 Å²	132.4	66%	0.656	76%	0.758	S	S	*	*			trans	-133	-163.8	-163.5	39.1	-16.4	0	0	0	116.2
480	N	31.3	Very low	34	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	77%	0.768	S	S	*	*			trans	90.2	119.8	163	-50.3	-41	0	0	0	118.9
481	T	32.8	Very low	34.2	Very low	136 Å²	136	128.4 Å²	128.4	83%	0.834	76%	0.755	S	S	*	*				-178.9	147.8	108.6	-69.7	0	0	0	0	111.3
482	V	37.4	Very low	34.6	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	77%	0.766	S	S	*	*			trans	-150.6	176.9	-179.8	-124.7	0	0	0	0	106.8
483	P	40.5	Very low	34.9	Very low	113 Å²	113	133 Å²	133	73%	0.734	77%	0.768	S	S	*	*			cis	-139.6	-171.9	-11.6	38.5	-18.1	0	0	0	116
484	S	33	Very low	35.1	Very low	99 Å²	99	132 Å²	132	69%	0.692	77%	0.767	S	S	*	*			trans	81.2	115.4	135.9	176.3	0	0	0	0	123.4
485	G	33.6	Very low	35.2	Very low	69 Å²	69	134.7 Å²	134.7	71%	0.711	77%	0.773	S	S	*	*				-152.1	139.9	129.7	0	0	0	0	0	109.3
486	R	34.8	Very low	35.9	Very low	211 Å²	211	130.3 Å²	130.3	80%	0.796	77%	0.765	S	S	*	*			cis	75.4	127.9	38.2	-75.7	-161	175	-135.8	10.1	113.5
487	E	37.3	Very low	35.9	Very low	140 Å²	140	129.4 Å²	129.4	65%	0.654	76%	0.764	S	S	*	*			cis	-147.4	-160.5	-10.6	-49.6	-167.3	174.6	0	0	109.3
488	S	39.5	Very low	35.8	Very low	95 Å²	95	128 Å²	128	66%	0.664	77%	0.772	S	S	*	*			cis	-157.5	173.9	-0.8	-134.3	0	0	0	0	109.8
489	P	41.7	Very low	35.7	Very low	113 Å²	113	123.6 Å²	123.6	73%	0.734	76%	0.764	S	S	*	*			trans	-112.3	168.7	-164.5	42	-35.3	0	0	0	117.1
490	D	40.4	Very low	35.6	Very low	165 Å²	165	124.2 Å²	124.2	88%	0.882	77%	0.771	S	S	*	*			trans	-171.2	154.8	154.8	-112.8	-23.9	0	0	0	110.2
491	G	33.5	Very low	35.8	Very low	51 Å²	51	123.7 Å²	123.7	53%	0.526	77%	0.773	S	S	.	*			cis	147.8	74.4	-11.3	0	0	0	0	0	116.7
492	K	39.6	Very low	35.6	Very low	214 Å²	214	124.4 Å²	124.4	93%	0.93	77%	0.771	S	S	*	*			trans	-177.1	158.7	155.5	-100.8	137.5	-157.2	151.9	0	114.5
493	A	31	Very low	35.3	Very low	99 Å²	99	128 Å²	128	82%	0.818	77%	0.77	S	S	*	*			trans	-141.7	162.8	179.1	0	0	0	0	0	112.3
494	S	38.7	Very low	34.6	Very low	124 Å²	124	127.3 Å²	127.3	87%	0.867	77%	0.767	S	S	*	*			trans	-154.2	162.3	168.3	-96.9	0	0	0	0	111.2
495	M	32.6	Very low	34.7	Very low	181 Å²	181	131.5 Å²	131.5	89%	0.892	77%	0.769	S	S	*	*			trans	-121.2	175.3	-161.6	-88.8	-88.8	95.6	0	0	114.2
496	P	44.4	Very low	34.5	Very low	109 Å²	109	132.8 Å²	132.8	71%	0.708	77%	0.773	S	S	*	*			trans	-116.7	-178.9	-151.8	44.4	-36.8	0	0	0	115.9
497	A	32.9	Very low	34.2	Very low	95 Å²	95	128.3 Å²	128.3	79%	0.785	77%	0.774	S	S	*	*			trans	-159.9	148.8	160.4	0	0	0	0	0	114.5
498	C	28	Very low	33.9	Very low	142 Å²	142	129.9 Å²	129.9	96%	0.959	79%	0.786	S	S	*	*			trans	54	148.9	160.5	-90.8	0	0	0	0	121.8
499	G	33.4	Very low	33.3	Very low	61 Å²	61	137.2 Å²	137.2	63%	0.629	80%	0.799	S	S	*	*			cis	176.5	158.7	-5.8	0	0	0	0	0	114
500	S	31.9	Very low	32.9	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	81%	0.805	S	S	*	*			trans	26.5	134.4	161.9	53.4	0	0	0	0	120.6
501	T	35	Very low	32.4	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	80%	0.796	S	S	*	*				-162.3	154.2	72.3	-65.9	0	0	0	0	113.3
502	I	29.1	Very low	32.3	Very low	152 Å²	152	143.8 Å²	143.8	78%	0.779	81%	0.813	S	S	*	*			trans	-94.3	144.8	-173.2	-62	157.2	0	0	0	111.9
503	R	30.2	Very low	32.1	Very low	208 Å²	208	139.2 Å²	139.2	79%	0.785	81%	0.808	S	S	*	*			trans	-142.6	130	139.8	-152.8	169.5	-155.4	-167.5	6.1	112.2	Y505	R503-Y505 HydrophobicContact CG-CE2 4.28Å; R503-Y505 PolarHBondContact NH1-OH 3.03Å; R503-Y505 PolarHBondContact NH2-OH 3.31Å
504	S	26.7	Very low	32.1	Very low	97 Å²	97	143 Å²	143	68%	0.678	81%	0.809	S	S	*	*			trans	-122.5	154.1	174.2	177.6	0	0	0	0	109.3
505	Y	35.1	Very low	32	Very low	188 Å²	188	144.9 Å²	144.9	74%	0.737	81%	0.809	S	S	*	*			trans	-129.7	140.6	167	-84.2	-79.1	0	0	0	109.2	R503	R503-Y505 HydrophobicContact CG-CE2 4.28Å; R503-Y505 PolarHBondContact NH1-OH 3.03Å; R503-Y505 PolarHBondContact NH2-OH 3.31Å
506	A	29.8	Very low	31.9	Very low	95 Å²	95	144.9 Å²	144.9	79%	0.785	81%	0.807	S	S	*	*			trans	-108	161.9	-156.3	0	0	0	0	0	114.5
507	S	27.2	Very low	31.8	Very low	117 Å²	117	146 Å²	146	82%	0.818	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.3	145.9	174.7	-60.8	0	0	0	0	113.5
508	L	30.7	Very low	31.8	Very low	173 Å²	173	147.6 Å²	147.6	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-96	116.7	152.2	-94.6	78	0	0	0	109.8
509	R	28.4	Very low	31.9	Very low	249 Å²	249	144.1 Å²	144.1	94%	0.94	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-95	146.5	148.8	-77.4	-169.4	178.7	-158.9	1.8	108.2
510	K	33.3	Very low	32	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	81%	0.813	S	S	*	*			trans	-123.8	120	165.9	-163.1	170.5	-174.1	177	0	107.8
511	G	28.9	Very low	31.8	Very low	67 Å²	67	151.5 Å²	151.5	69%	0.691	82%	0.817	S	S	*	*			trans	-88.7	163.7	-179.9	0	0	0	0	0	112.5
512	F	32.4	Very low	31.7	Very low	202 Å²	202	153.1 Å²	153.1	89%	0.886	82%	0.819	S	S	*	*			trans	-136.5	147.7	162.6	-97.1	-87.8	0	0	0	108.5
513	S	35.3	Very low	31.7	Very low	118 Å²	118	150.2 Å²	150.2	83%	0.825	82%	0.818	S	S	*	*			trans	-78.4	164.1	-176.7	-59.4	0	0	0	0	112.8
514	Q	30.1	Very low	31.8	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	82%	0.823	S	S	*	*			trans	-63.2	148.6	162.2	-63.7	159.4	-101.7	0	0	110.7
515	D	37.2	Very low	32.2	Very low	163 Å²	163	148.6 Å²	148.6	87%	0.872	82%	0.821	S	S	*	*				-158.7	172.6	125.6	-92.8	-27	0	0	0	108.7
516	E	30.1	Very low	32	Very low	182 Å²	182	144.8 Å²	144.8	85%	0.85	82%	0.818	S	S	*	*			trans	-80.9	151.2	-156.2	-57	175.6	107.6	0	0	116.4
517	V	41.6	Very low	32.5	Very low	133 Å²	133	148 Å²	148	81%	0.806	82%	0.816	S	S	*	*				172.7	132.2	119.6	153	0	0	0	0	109.5
518	P	33.4	Very low	33.2	Very low	127 Å²	127	149.3 Å²	149.3	83%	0.825	81%	0.814	S	S	*	*			trans	-87.8	134.7	-179.7	33.4	-33.5	0	0	0	113.2
519	G	30.2	Very low	33.6	Very low	69 Å²	69	146.6 Å²	146.6	71%	0.711	80%	0.8	S	S	*	*			trans	-170.2	109.6	175.1	0	0	0	0	0	115.8
520	T	35.8	Very low	34.5	Very low	139 Å²	139	140.9 Å²	140.9	85%	0.853	78%	0.784	S	S	*	*			trans	56.8	107.7	155.8	-44	0	0	0	0	119
521	Q	28	Very low	34.7	Very low	192 Å²	192	135.9 Å²	135.9	90%	0.897	77%	0.766	S	S	*	*			trans	-80.1	136.6	168.5	-58.8	169.9	0.7	0	0	111.7
522	I	31.8	Very low	35.3	Very low	167 Å²	167	135.5 Å²	135.5	86%	0.856	76%	0.757	S	S	*	*			trans	-138.3	136	151.7	-59	-176.6	0	0	0	106.8
523	A	28.7	Very low	35.9	Very low	91 Å²	91	129.3 Å²	129.3	75%	0.752	74%	0.739	S	S	*	*			trans	-108.5	144.2	-162.4	0	0	0	0	0	114.8
524	L	32.4	Very low	36.1	Very low	172 Å²	172	127.3 Å²	127.3	90%	0.901	72%	0.718	S	S	*	*			trans	-143.6	153.7	165.7	-83.2	-174.3	0	0	0	109.3
525	P	35.6	Very low	36.8	Very low	99 Å²	99	125.6 Å²	125.6	64%	0.643	70%	0.704	S	S	*	*				-112.6	156.1	-104.6	37.8	-36.9	0	0	0	116.4	Q527	P525-Q527 PolarHBondContact O-N 3.39Å
526	V	31.9	Very low	37.3	Very low	108 Å²	108	121.3 Å²	121.3	66%	0.655	69%	0.692	S	S	*	*			trans	-81	106.8	173.8	-179.9	0	0	0	0	110.4	L529	V526-L529 HydrophobicContact CG1-CD1 4.24Å
527	Q	40.4	Very low	38.1	Very low	162 Å²	162	119.3 Å²	119.3	76%	0.757	69%	0.686	S	S	*	*			trans	-132.2	-13.9	170.9	-68.5	-170.9	-9.7	0	0	114.9	P525	P525-Q527 PolarHBondContact O-N 3.39Å
528	N	41.6	Very low	38	Very low	145 Å²	145	117.5 Å²	117.5	78%	0.775	67%	0.671	S	S	*	*	S	Bend	trans	-111.2	7.5	-169.1	-69.1	-40.7	0	0	0	115.9
529	L	39.6	Very low	38.4	Very low	117 Å²	117	118 Å²	118	61%	0.613	66%	0.657	S	S	*	*	S	Bend	trans	-91.5	-27.7	-177.2	-79.4	166.8	0	0	0	114.6	V526 S533	V526-L529 HydrophobicContact CG1-CD1 4.24Å; L529-S533 PolarHBondContact O-N 3.49Å
530	H	45.5	Very low	38.5	Very low	128 Å²	128	117.5 Å²	117.5	59%	0.593	65%	0.653	S	S	*	*	H	α-helix	trans	-72.6	-39.4	-174.5	-74.9	-91.4	0	0	0	113.7	A532 S533 L534	H530-A532 VanDerWaalsContact C-N 3.28Å; H530-A532 PolarHBondContact O-N 3.05Å; H530-S533 PolarHBondContact O-N 3.35Å; H530-L534 WeakPolarHBondContact O-CB 3.33Å; H530-L534 WeakPolarHBondContact O-CG 3.28Å; H530-L534 PolarHBondContact O-N 3.22Å
531	D	37.8	Very low	38.1	Very low	93 Å²	93	114.6 Å²	114.6	50%	0.497	65%	0.651	S	S	.	*	H	α-helix	trans	-65.4	-30.4	179	-174.1	40.4	0	0	0	112.3	R535	D531-R535 WeakPolarHBondContact O-CD 3.46Å; D531-R535 WeakPolarHBondContact O-CG 3.48Å; D531-R535 PolarHBondContact O-N 3.29Å; D531-R535 IonicContact OD1-CZ 2.7Å; D531-R535 IonicContact OD1-NE 2.76Å; D531-R535 PolarHBondContact OD1-NE 3.45Å; D531-R535 VanDerWaalsContact OD1-NE 3.15Å; D531-R535 IonicContact OD1-NH2 2.78Å; D531-R535 IonicContact OD2-CZ 2.85Å; D531-R535 VanDerWaalsContact OD2-CZ 3.32Å; D531-R535 IonicContact OD2-NE 3.98Å; D531-R535 PolarHBondContact OD2-NE 2.88Å; D531-R535 IonicContact OD2-NH2 2.83Å; D531-R535 PolarHBondContact OD2-NH2 2.93Å
532	A	41.1	Very low	38.3	Very low	60 Å²	60	116.7 Å²	116.7	50%	0.496	65%	0.65	S	S	.	*	H	α-helix	trans	-70.2	-47.8	173.3	0	0	0	0	0	112.1	H530 R535 A536	H530-A532 VanDerWaalsContact C-N 3.28Å; H530-A532 PolarHBondContact O-N 3.05Å; A532-R535 PolarHBondContact O-N 2.85Å; A532-A536 PolarHBondContact O-N 3.43Å
533	S	45.8	Very low	38.2	Very low	71 Å²	71	114.6 Å²	114.6	50%	0.497	65%	0.647	S	S	.	*	H	α-helix	trans	-67.5	-36.3	178.7	-66.1	0	0	0	0	113	L529 H530 A536 L537	L529-S533 PolarHBondContact O-N 3.49Å; H530-S533 PolarHBondContact O-N 3.35Å; S533-A536 PolarHBondContact O-N 3.13Å; S533-L537 WeakPolarHBondContact O-CG 3.48Å; S533-L537 PolarHBondContact O-N 3.07Å
534	L	40.4	Very low	38.2	Very low	77 Å²	77	117.6 Å²	117.6	40%	0.403	65%	0.651	S	S	.	*	H	α-helix	trans	-65.6	-38.2	174.9	-77.9	168.8	0	0	0	111.8	H530 L537 L538	H530-L534 WeakPolarHBondContact O-CB 3.33Å; H530-L534 WeakPolarHBondContact O-CG 3.28Å; H530-L534 PolarHBondContact O-N 3.22Å; L534-L537 PolarHBondContact O-N 3.15Å; L534-L538 VanDerWaalsContact O-CB 3.32Å; L534-L538 WeakPolarHBondContact O-CB 3.24Å; L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.36Å; L534-L538 PolarHBondContact O-N 3.15Å
535	R	43.9	Very low	38.1	Very low	143 Å²	143	119.9 Å²	119.9	54%	0.54	65%	0.647	S	S	.	*	H	α-helix	trans	-65.1	-38.6	171.8	-69.2	167.4	-165.8	-138.5	12.7	112	D531 A532 L537 Y539	D531-R535 WeakPolarHBondContact O-CD 3.46Å; D531-R535 WeakPolarHBondContact O-CG 3.48Å; D531-R535 PolarHBondContact O-N 3.29Å; D531-R535 IonicContact OD1-CZ 2.7Å; D531-R535 IonicContact OD1-NE 2.76Å; D531-R535 PolarHBondContact OD1-NE 3.45Å; D531-R535 VanDerWaalsContact OD1-NE 3.15Å; D531-R535 IonicContact OD1-NH2 2.78Å; D531-R535 IonicContact OD2-CZ 2.85Å; D531-R535 VanDerWaalsContact OD2-CZ 3.32Å; D531-R535 IonicContact OD2-NE 3.98Å; D531-R535 PolarHBondContact OD2-NE 2.88Å; D531-R535 IonicContact OD2-NH2 2.83Å; D531-R535 PolarHBondContact OD2-NH2 2.93Å; A532-R535 PolarHBondContact O-N 2.85Å; R535-L537 VanDerWaalsContact C-N 3.3Å; R535-L537 PolarHBondContact O-N 2.83Å; R535-Y539 HydrophobicContact CB-CD2 4.38Å; R535-Y539 WeakPolarHBondContact O-CB 3.44Å; R535-Y539 WeakPolarHBondContact O-CD2 3.41Å; R535-Y539 PolarHBondContact O-N 2.78Å; R535-Y539 VanDerWaalsContact O-N 3.15Å
536	A	48.4	Very low	37.8	Very low	73 Å²	73	121.2 Å²	121.2	60%	0.603	65%	0.648	S	S	*	*	H	α-helix	trans	-65.7	-30.5	175.8	0	0	0	0	0	113.4	A532 S533	A532-A536 PolarHBondContact O-N 3.43Å; S533-A536 PolarHBondContact O-N 3.13Å
537	L	46.3	Very low	37.6	Very low	140 Å²	140	125.6 Å²	125.6	73%	0.733	66%	0.659	S	S	*	*	H	α-helix	trans	-84.8	-39.6	177.9	-75.9	164.5	0	0	0	113.5	S533 L534 R535	S533-L537 WeakPolarHBondContact O-CG 3.48Å; S533-L537 PolarHBondContact O-N 3.07Å; L534-L537 PolarHBondContact O-N 3.15Å; R535-L537 VanDerWaalsContact C-N 3.3Å; R535-L537 PolarHBondContact O-N 2.83Å
538	L	39.4	Very low	37	Very low	95 Å²	95	122.7 Å²	122.7	50%	0.497	66%	0.656	S	S	.	*	H	α-helix	trans	-80	-25.5	-176.5	-69	169.4	0	0	0	113.6	L458 L534	L458-L538 HydrophobicContact CD1-CD2 4.3Å; L534-L538 VanDerWaalsContact O-CB 3.32Å; L534-L538 WeakPolarHBondContact O-CB 3.24Å; L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.36Å; L534-L538 PolarHBondContact O-N 3.15Å
539	Y	41.8	Very low	36.4	Very low	136 Å²	136	123 Å²	123	53%	0.533	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.6	48.2	177.9	-60.8	-76.8	0	0	0	111.4	R535 G541	R535-Y539 HydrophobicContact CB-CD2 4.38Å; R535-Y539 WeakPolarHBondContact O-CB 3.44Å; R535-Y539 WeakPolarHBondContact O-CD2 3.41Å; R535-Y539 PolarHBondContact O-N 2.78Å; R535-Y539 VanDerWaalsContact O-N 3.15Å; Y539-G541 PolarHBondContact O-N 3.43Å
540	G	32.4	Very low	36.1	Very low	60 Å²	60	123.2 Å²	123.2	62%	0.619	67%	0.666	S	S	*	*			trans	-55	105	-175.6	0	0	0	0	0	113.3
541	G	28.5	Very low	35.4	Very low	78 Å²	78	123.8 Å²	123.8	80%	0.804	68%	0.679	S	S	*	*			trans	-70.3	135.4	-175.7	0	0	0	0	0	113.2	Y539	Y539-G541 PolarHBondContact O-N 3.43Å
542	R	30.3	Very low	34.9	Very low	236 Å²	236	126.4 Å²	126.4	89%	0.891	69%	0.692	S	S	*	*			trans	-131.2	113.5	172.2	-159.2	-177	-160.6	-155.2	6.2	109.8
543	P	30.6	Very low	34.6	Very low	122 Å²	122	132.2 Å²	132.2	79%	0.792	71%	0.708	S	S	*	*			trans	-80.6	122.2	174.6	31	-31.2	0	0	0	110	R545	P543-R545 PolarHBondContact O-N 3.22Å
544	D	28.2	Very low	34.1	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	72%	0.715	S	S	*	*			trans	-66.3	119.2	163	-87.4	-41.9	0	0	0	109.6
545	R	31.3	Very low	33.9	Very low	220 Å²	220	136.2 Å²	136.2	83%	0.83	73%	0.725	S	S	*	*				174.8	143.6	115.9	-97.9	171.9	-177.9	-165.8	0.4	115.7	P543	P543-R545 PolarHBondContact O-N 3.22Å
546	I	27.9	Very low	33.7	Very low	127 Å²	127	136.9 Å²	136.9	65%	0.651	73%	0.731	S	S	*	*			trans	89	134.3	136.8	-75.5	167.2	0	0	0	120.3
547	F	29.4	Very low	33.1	Very low	201 Å²	201	139.1 Å²	139.1	88%	0.882	73%	0.733	S	S	*	*			trans	70.9	117.8	169.5	-65.5	-47.8	0	0	0	122.1
548	S	27.7	Very low	32.6	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	74%	0.737	S	S	*	*			trans	-92.2	143.1	172	-33.4	0	0	0	0	111.3
549	N	28.2	Very low	32.3	Very low	151 Å²	151	144 Å²	144	81%	0.807	75%	0.754	S	S	*	*				170.4	145.2	108.1	-87.4	-20.8	0	0	0	111.9
550	P	32.6	Very low	32	Very low	121 Å²	121	144.5 Å²	144.5	79%	0.786	77%	0.772	S	S	*	*			trans	-95.6	143.7	174.1	36.2	-31.7	0	0	0	112.6
551	T	31.2	Very low	32	Very low	140 Å²	140	147 Å²	147	86%	0.859	78%	0.78	S	S	*	*			trans	-145.6	142.2	165.4	1.5	0	0	0	0	111.7
552	L	27.1	Very low	32.2	Very low	149 Å²	149	149.6 Å²	149.6	78%	0.78	78%	0.784	S	S	*	*			trans	-64.6	152	-175.9	-67.9	69.5	0	0	0	112.8
553	H	35.6	Very low	32.5	Very low	181 Å²	181	145.5 Å²	145.5	84%	0.838	79%	0.786	S	S	*	*				-151.2	153.5	115.2	-132.1	-89.8	0	0	0	113.7
554	N	34.2	Very low	32.8	Very low	120 Å²	120	143 Å²	143	64%	0.642	78%	0.782	S	S	*	*			trans	-70.5	158	173.5	-64.7	-34.9	0	0	0	110.7
555	D	37.4	Very low	33.1	Very low	112 Å²	112	142.9 Å²	142.9	60%	0.599	78%	0.781	S	S	*	*				-156.3	136.5	71.9	-97.2	-3.9	0	0	0	112.7
556	K	38.5	Very low	33.5	Very low	157 Å²	157	141 Å²	141	68%	0.683	78%	0.784	S	S	*	*				59.6	133.1	100.9	-58.4	-167.4	-158	84.8	0	114
557	N	36.8	Very low	33.9	Very low	120 Å²	120	142.3 Å²	142.3	64%	0.642	79%	0.792	S	S	*	*			cis	-157	165.9	33.7	-133.4	21.2	0	0	0	114.7
558	E	35.6	Very low	34.2	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	79%	0.791	S	S	*	*			trans	62.9	121.4	149.6	-74.4	164.9	127	0	0	122.2
559	L	32	Very low	34.6	Very low	165 Å²	165	142.2 Å²	142.2	86%	0.864	80%	0.798	S	S	*	*			trans	-109.7	128.8	173.6	175.4	88	0	0	0	108.5
560	T	36.2	Very low	35	Very low	147 Å²	147	144.5 Å²	144.5	90%	0.902	80%	0.804	S	S	*	*			trans	-139.6	136.7	158.7	29.8	0	0	0	0	111
561	S	31.9	Very low	35.1	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	80%	0.802	S	S	*	*			trans	-92.6	143.8	-174.5	54.9	0	0	0	0	112.7
562	C	34.4	Very low	35.4	Very low	133 Å²	133	140.8 Å²	140.8	90%	0.899	80%	0.799	S	S	*	*			trans	-149.2	142.9	143	-106.6	0	0	0	0	109.8
563	T	35.2	Very low	36.2	Very low	150 Å²	150	138 Å²	138	92%	0.92	79%	0.792	S	S	*	*			trans	-78.5	138.7	176.8	44.9	0	0	0	0	111.4
564	G	37.5	Very low	36.4	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	78%	0.779	S	S	*	*			trans	-158.7	137	170.7	0	0	0	0	0	109.6
565	D	33.4	Very low	36.8	Very low	151 Å²	151	135 Å²	135	81%	0.807	78%	0.783	S	S	*	*			trans	-82.4	175.8	-160.2	-50.4	-86.6	0	0	0	115.9
566	M	41.1	Very low	37.7	Very low	182 Å²	182	134 Å²	134	90%	0.897	78%	0.781	S	S	*	*			trans	99.2	131.8	163.3	-56.3	-59.5	173.2	0	0	118.8
567	D	36.4	Very low	38.6	Very low	153 Å²	153	129.6 Å²	129.6	82%	0.818	77%	0.77	S	S	*	*			trans	-61.3	152.9	166.4	-72.1	-64.8	0	0	0	112.4
568	D	35.2	Very low	39.9	Very low	160 Å²	160	130.6 Å²	130.6	86%	0.856	77%	0.771	S	S	*	*			trans	165.7	89.6	132.7	-90.9	-22.8	0	0	0	110.9
569	T	35.3	Very low	41.6	Very low	140 Å²	140	129.7 Å²	129.7	86%	0.859	76%	0.764	S	S	*	*			trans	-144.7	42.4	171.7	-35.9	0	0	0	0	114
570	E	36.7	Very low	43.7	Very low	200 Å²	200	125.3 Å²	125.3	94%	0.935	74%	0.742	S	S	*	*			trans	-111.4	87.9	165.6	-73	-155.8	142.6	0	0	111.3
571	S	36	Very low	45.8	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	71%	0.712	S	S	*	*			trans	-138.4	-7.8	178.3	60.1	0	0	0	0	115.8
572	G	37.7	Very low	48.3	Very low	78 Å²	78	118.5 Å²	118.5	80%	0.804	69%	0.688	S	S	*	*	S	Bend	trans	-88.9	-5.1	-170.5	0	0	0	0	0	117.4
573	S	42.2	Very low	50.5	Low	91 Å²	91	116.3 Å²	116.3	64%	0.636	67%	0.665	S	S	*	*	S	Bend	trans	-98.5	-27.7	-172	56.6	0	0	0	0	114.6	T576	S573-T576 PolarHBondContact O-OG1 3.47Å
574	C	41.4	Very low	52.9	Low	84 Å²	84	109.6 Å²	109.6	57%	0.568	62%	0.624	S	S	*	*	H	α-helix	trans	-64.4	-51.8	-163	-164	0	0	0	0	113.6	T576 S577	C574-T576 PolarHBondContact O-N 2.98Å; C574-T576 VanDerWaalsContact O-N 3.08Å; C574-S577 WeakPolarHBondContact O-CB 3.46Å; C574-S577 PolarHBondContact O-N 2.92Å; C574-S577 PolarHBondContact O-OG 3.36Å
575	E	42.5	Very low	55.2	Low	153 Å²	153	109.8 Å²	109.8	72%	0.715	61%	0.607	S	S	*	*	H	α-helix	trans	-53.3	-37.3	-173.5	-61.5	-174.3	142.8	0	0	113	S577 E578 F579	E575-S577 VanDerWaalsContact C-N 3.29Å; E575-S577 PolarHBondContact O-N 3.05Å; E575-E578 PolarHBondContact O-N 3.32Å; E575-F579 VanDerWaalsContact O-CD2 3.3Å; E575-F579 WeakPolarHBondContact O-CD2 3.22Å
576	T	55.5	Low	57.8	Low	92 Å²	92	109.5 Å²	109.5	56%	0.564	59%	0.594	S	S	*	*	H	α-helix	trans	-65.8	-31.2	-178.9	66.9	0	0	0	0	113	S573 C574 L580	S573-T576 PolarHBondContact O-OG1 3.47Å; C574-T576 PolarHBondContact O-N 2.98Å; C574-T576 VanDerWaalsContact O-N 3.08Å; T576-L580 WeakPolarHBondContact O-CD1 3.19Å; T576-L580 VanDerWaalsContact O-CG 3.25Å; T576-L580 WeakPolarHBondContact O-CG 3.38Å
577	S	58.5	Low	60.1	Low	64 Å²	64	102.3 Å²	102.3	45%	0.448	56%	0.564	S	S	.	*	H	α-helix	trans	-74.3	-34.4	-178	71.6	0	0	0	0	112.6	C574 E575 F579 L580 Y581	C574-S577 WeakPolarHBondContact O-CB 3.46Å; C574-S577 PolarHBondContact O-N 2.92Å; C574-S577 PolarHBondContact O-OG 3.36Å; E575-S577 VanDerWaalsContact C-N 3.29Å; E575-S577 PolarHBondContact O-N 3.05Å; S577-F579 PolarHBondContact O-N 3.38Å; S577-L580 PolarHBondContact O-N 2.94Å; S577-Y581 PolarHBondContact O-N 3.46Å
578	E	64	Low	62.7	Low	141 Å²	141	95.4 Å²	95.4	66%	0.659	53%	0.527	S	S	*	.	H	α-helix	trans	-69.2	-32.7	-176.3	-168.6	170.9	-169.7	0	0	112.5	E575 P582	E575-E578 PolarHBondContact O-N 3.32Å; E578-P582 WeakPolarHBondContact O-CD 3.46Å; E578-P582 WeakPolarHBondContact O-CG 3.4Å
579	F	70.9	Confident	65.4	Low	154 Å²	154	88.8 Å²	88.8	68%	0.675	49%	0.493	S	S	*	.	H	α-helix	trans	-78.8	-31.7	173.2	-69.4	-72.9	0	0	0	113.8	E575 S577	E575-F579 VanDerWaalsContact O-CD2 3.3Å; E575-F579 WeakPolarHBondContact O-CD2 3.22Å; S577-F579 PolarHBondContact O-N 3.38Å
580	L	76.5	Confident	68.1	Low	73 Å²	73	86.4 Å²	86.4	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-72.6	-37.9	-174.7	-74.7	169.9	0	0	0	113.1	Y448 T576 S577 E583 A584	Y448-L580 HydrophobicContact CD1-CB 4.26Å; Y448-L580 HydrophobicContact CE1-CB 4.02Å; Y448-L580 HydrophobicContact CE1-CD1 3.92Å; Y448-L580 HydrophobicContact CE1-CG 4.44Å; Y448-L580 HydrophobicContact CE2-CB 4.5Å; T576-L580 WeakPolarHBondContact O-CD1 3.19Å; T576-L580 VanDerWaalsContact O-CG 3.25Å; T576-L580 WeakPolarHBondContact O-CG 3.38Å; S577-L580 PolarHBondContact O-N 2.94Å; L580-E583 PolarHBondContact O-N 3.48Å; L580-A584 PolarHBondContact O-N 2.86Å
581	Y	79.8	Confident	70.8	Confident	73 Å²	73	77.3 Å²	77.3	29%	0.286	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-52.2	-178.4	177.2	-82.5	0	0	0	113	L445 K449 S577 E583 A584 E585	L445-Y581 HydrophobicContact CD1-CD2 3.95Å; L445-Y581 HydrophobicContact CD1-CE2 3.58Å; K449-Y581 HydrophobicContact CB-CD2 4.5Å; K449-Y581 HydrophobicContact CB-CE2 3.94Å; K449-Y581 HydrophobicContact CG-CE2 4.14Å; S577-Y581 PolarHBondContact O-N 3.46Å; Y581-E583 PolarHBondContact O-N 3.29Å; Y581-A584 PolarHBondContact O-N 3.19Å; Y581-E585 HydrophobicContact CD1-CG 4.49Å; Y581-E585 HydrophobicContact CE1-CG 3.89Å; Y581-E585 WeakPolarHBondContact CE1-OE1 3.49Å; Y581-E585 VanDerWaalsContact CZ-OE1 3.23Å; Y581-E585 PolarHBondContact O-N 3.04Å; Y581-E585 VanDerWaalsContact O-N 3.11Å; Y581-E585 PolarHBondContact OH-OE1 3Å
582	P	83	Confident	73.6	Confident	43 Å²	43	72.3 Å²	72.3	28%	0.279	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-28.8	177	-22.8	34.8	0	0	0	113.3	E578 E585 R586	E578-P582 WeakPolarHBondContact O-CD 3.46Å; E578-P582 WeakPolarHBondContact O-CG 3.4Å; P582-E585 PolarHBondContact O-N 2.94Å; P582-R586 WeakPolarHBondContact O-CG 3.31Å; P582-R586 PolarHBondContact O-N 3.34Å
583	E	80.9	Confident	76.2	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-75.4	-34.2	177.3	-163	53.8	-146	0	0	112.2	L580 Y581 E585 R586 A587	L580-E583 PolarHBondContact O-N 3.48Å; Y581-E583 PolarHBondContact O-N 3.29Å; E583-E585 VanDerWaalsContact C-N 3.33Å; E583-E585 PolarHBondContact O-N 3.23Å; E583-R586 PolarHBondContact O-N 3.5Å; E583-R586 WeakPolarHBondContact OE2-CD 3.48Å; E583-R586 IonicContact OE2-CZ 2.64Å; E583-R586 IonicContact OE2-NE 2.68Å; E583-R586 IonicContact OE2-NH1 3.52Å; E583-R586 PolarHBondContact OE2-NH1 3.47Å; E583-A587 WeakPolarHBondContact O-CB 3.39Å; E583-A587 PolarHBondContact O-N 3.08Å
584	A	85.7	Confident	78.5	Confident	9 Å²	9	72.7 Å²	72.7	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-38.2	168.8	0	0	0	0	0	112	L445 Y448 L580 Y581 A587 V588	L445-A584 HydrophobicContact CB-CB 4.12Å; L445-A584 HydrophobicContact CD1-CB 3.86Å; Y448-A584 HydrophobicContact CD2-CB 3.72Å; Y448-A584 HydrophobicContact CE2-CB 4.07Å; L580-A584 PolarHBondContact O-N 2.86Å; Y581-A584 PolarHBondContact O-N 3.19Å; A584-A587 PolarHBondContact O-N 3.37Å; A584-V588 WeakPolarHBondContact O-CG2 3.23Å; A584-V588 PolarHBondContact O-N 3.45Å; A584-V588 VanDerWaalsContact O-N 3.09Å
585	E	87.1	Confident	81	Confident	74 Å²	74	73.5 Å²	73.5	35%	0.346	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-47	171.6	-67.5	-169.1	149.5	0	0	111.7	L445 Y581 P582 E583 A587 V588 V589	L445-E585 HydrophobicContact CD1-CG 3.56Å; L445-E585 HydrophobicContact CD2-CG 3.99Å; L445-E585 HydrophobicContact CG-CG 4.45Å; Y581-E585 HydrophobicContact CD1-CG 4.49Å; Y581-E585 HydrophobicContact CE1-CG 3.89Å; Y581-E585 WeakPolarHBondContact CE1-OE1 3.49Å; Y581-E585 VanDerWaalsContact CZ-OE1 3.23Å; Y581-E585 PolarHBondContact O-N 3.04Å; Y581-E585 VanDerWaalsContact O-N 3.11Å; Y581-E585 PolarHBondContact OH-OE1 3Å; P582-E585 PolarHBondContact O-N 2.94Å; E583-E585 VanDerWaalsContact C-N 3.33Å; E583-E585 PolarHBondContact O-N 3.23Å; E585-A587 VanDerWaalsContact C-N 3.31Å; E585-A587 PolarHBondContact O-N 3.07Å; E585-V588 PolarHBondContact O-N 3.42Å; E585-V589 WeakPolarHBondContact O-CG2 3.46Å; E585-V589 PolarHBondContact O-N 3.19Å
586	R	88	Confident	83.5	Confident	145 Å²	145	66.2 Å²	66.2	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-59.3	-40.3	175.1	-71.7	-174.9	-159.6	96.1	10.3	112.2	P582 E583 V589 H590	P582-R586 WeakPolarHBondContact O-CG 3.31Å; P582-R586 PolarHBondContact O-N 3.34Å; E583-R586 PolarHBondContact O-N 3.5Å; E583-R586 WeakPolarHBondContact OE2-CD 3.48Å; E583-R586 IonicContact OE2-CZ 2.64Å; E583-R586 IonicContact OE2-NE 2.68Å; E583-R586 IonicContact OE2-NH1 3.52Å; E583-R586 PolarHBondContact OE2-NH1 3.47Å; R586-V589 PolarHBondContact O-N 2.73Å; R586-H590 WeakPolarHBondContact O-CB 3.38Å; R586-H590 PolarHBondContact O-N 3.05Å
587	A	89.2	Confident	85.3	Confident	31 Å²	31	61.9 Å²	61.9	26%	0.256	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-44.2	176.5	0	0	0	0	0	112	E583 A584 E585 H590 V591	E583-A587 WeakPolarHBondContact O-CB 3.39Å; E583-A587 PolarHBondContact O-N 3.08Å; A584-A587 PolarHBondContact O-N 3.37Å; E585-A587 VanDerWaalsContact C-N 3.31Å; E585-A587 PolarHBondContact O-N 3.07Å; A587-H590 PolarHBondContact O-N 3.22Å; A587-V591 WeakPolarHBondContact O-CG2 3.46Å; A587-V591 PolarHBondContact O-N 3.15Å
588	V	91.4	Very high	87	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-46	174.7	172.9	0	0	0	0	111.1	K441 V442 L445 A584 E585 H590 V591 V592 F805 L807	K441-V588 HydrophobicContact CB-CG2 3.84Å; V442-V588 HydrophobicContact CG2-CB 4.46Å; V442-V588 HydrophobicContact CG2-CG1 3.73Å; V442-V588 HydrophobicContact CG2-CG2 3.78Å; L445-V588 HydrophobicContact CB-CG2 4.39Å; L445-V588 HydrophobicContact CD2-CG2 4.22Å; A584-V588 WeakPolarHBondContact O-CG2 3.23Å; A584-V588 PolarHBondContact O-N 3.45Å; A584-V588 VanDerWaalsContact O-N 3.09Å; E585-V588 PolarHBondContact O-N 3.42Å; V588-H590 VanDerWaalsContact C-N 3.34Å; V588-H590 PolarHBondContact O-N 3.38Å; V588-V591 PolarHBondContact O-N 3.4Å; V588-V592 WeakPolarHBondContact O-CG2 3.33Å; V588-V592 PolarHBondContact O-N 3.16Å; V588-F805 HydrophobicContact CG1-CD1 4.33Å; V588-F805 HydrophobicContact CG1-CE1 4.23Å; V588-L807 HydrophobicContact CG1-CD2 4.17Å
589	V	91.9	Very high	88.4	Confident	22 Å²	22	53 Å²	53	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-43	176.3	176.7	0	0	0	0	111.5	E585 R586 R593 L807 P808 Y811	E585-V589 WeakPolarHBondContact O-CG2 3.46Å; E585-V589 PolarHBondContact O-N 3.19Å; R586-V589 PolarHBondContact O-N 2.73Å; V589-R593 HydrophobicContact CG1-CG 4.45Å; V589-R593 WeakPolarHBondContact O-CB 3.26Å; V589-R593 WeakPolarHBondContact O-CG 3.49Å; V589-R593 PolarHBondContact O-N 2.7Å; V589-L807 HydrophobicContact CB-CD2 4.48Å; V589-L807 HydrophobicContact CG2-CD2 3.9Å; V589-P808 HydrophobicContact CG1-CG 3.96Å; V589-P808 HydrophobicContact CG2-CG 4.14Å; V589-Y811 HydrophobicContact CG1-CD2 4.25Å; V589-Y811 HydrophobicContact CG1-CE2 4.25Å
590	H	91.4	Very high	89.5	Confident	89 Å²	89	45.7 Å²	45.7	41%	0.412	21%	0.21	S	C	.	.	H	α-helix	trans	-63.2	-49.2	178.8	-168.8	95.9	0	0	0	111.5	R586 A587 V588 V592 R593 R594	R586-H590 WeakPolarHBondContact O-CB 3.38Å; R586-H590 PolarHBondContact O-N 3.05Å; A587-H590 PolarHBondContact O-N 3.22Å; V588-H590 VanDerWaalsContact C-N 3.34Å; V588-H590 PolarHBondContact O-N 3.38Å; H590-V592 PolarHBondContact O-N 3.39Å; H590-R593 PolarHBondContact O-N 3.11Å; H590-R594 PolarHBondContact CE1-NH1 3.39Å; H590-R594 WeakPolarHBondContact NE2-CD 3.46Å; H590-R594 PolarHBondContact NE2-NH1 3.41Å; H590-R594 WeakPolarHBondContact O-CB 3.4Å; H590-R594 PolarHBondContact O-N 2.94Å
591	V	93.2	Very high	90.3	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-44.4	-178.7	176.5	0	0	0	0	111.2	M437 V438 K441 A587 V588 R593 Y595 L596	M437-V591 HydrophobicContact CB-CG1 3.6Å; M437-V591 HydrophobicContact CE-CG1 4.36Å; M437-V591 HydrophobicContact CE-CG2 4.49Å; V438-V591 HydrophobicContact CG2-CB 4.41Å; V438-V591 HydrophobicContact CG2-CG1 3.64Å; K441-V591 HydrophobicContact CG-CG2 4.03Å; A587-V591 WeakPolarHBondContact O-CG2 3.46Å; A587-V591 PolarHBondContact O-N 3.15Å; V588-V591 PolarHBondContact O-N 3.4Å; V591-R593 PolarHBondContact O-N 2.83Å; V591-Y595 HydrophobicContact CG1-CD2 4.42Å; V591-Y595 WeakPolarHBondContact O-CB 3.17Å; V591-Y595 PolarHBondContact O-N 2.79Å; V591-L596 PolarHBondContact O-N 3.18Å
592	V	93.7	Very high	90.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-60.2	-47.9	176.3	171.1	0	0	0	0	111.2	V438 V588 H590 L596 C597 L756 L807	V438-V592 HydrophobicContact CG1-CG2 4.04Å; V438-V592 HydrophobicContact CG2-CG2 3.7Å; V588-V592 WeakPolarHBondContact O-CG2 3.33Å; V588-V592 PolarHBondContact O-N 3.16Å; H590-V592 PolarHBondContact O-N 3.39Å; V592-L596 HydrophobicContact CG1-CD2 4.4Å; V592-L596 HydrophobicContact CG2-CD2 4.49Å; V592-L596 PolarHBondContact O-N 2.85Å; V592-C597 PolarHBondContact O-N 2.93Å; V592-C597 PolarHBondContact O-SG 3.28Å; V592-C597 VanDerWaalsContact O-SG 3.33Å; V592-L756 HydrophobicContact CG1-CD1 3.74Å; V592-L756 HydrophobicContact CG2-CD1 4.37Å; V592-L807 HydrophobicContact CB-CD2 4.36Å; V592-L807 HydrophobicContact CG1-CD1 4Å; V592-L807 HydrophobicContact CG2-CD1 4.26Å; V592-L807 HydrophobicContact CG2-CD2 4.21Å
593	R	92.7	Very high	91.2	Very high	24 Å²	24	40.6 Å²	40.6	9%	0.091	18%	0.182	C	C	.	.	I	π-helix	trans	-79	-25.8	-173.4	-66	-179.1	67.8	87	1.6	114.2	V589 H590 V591 K749 S812	V589-R593 HydrophobicContact CG1-CG 4.45Å; V589-R593 WeakPolarHBondContact O-CB 3.26Å; V589-R593 WeakPolarHBondContact O-CG 3.49Å; V589-R593 PolarHBondContact O-N 2.7Å; H590-R593 PolarHBondContact O-N 3.11Å; V591-R593 PolarHBondContact O-N 2.83Å; R593-K749 VanDerWaalsContact O-CE 3.29Å; R593-K749 WeakPolarHBondContact O-CE 3.35Å; R593-S812 PolarHBondContact NH2-OG 3.09Å
594	R	91.9	Very high	91.7	Very high	154 Å²	154	36.5 Å²	36.5	58%	0.581	16%	0.163	S	C	*	.	I	π-helix	trans	-99.5	-28.9	-177.3	-166.2	175.4	-171.7	174.9	3.9	114.6	H590 P598	H590-R594 PolarHBondContact CE1-NH1 3.39Å; H590-R594 WeakPolarHBondContact NE2-CD 3.46Å; H590-R594 PolarHBondContact NE2-NH1 3.41Å; H590-R594 WeakPolarHBondContact O-CB 3.4Å; H590-R594 PolarHBondContact O-N 2.94Å; R594-P598 WeakPolarHBondContact O-CG 3.35Å
595	Y	93.3	Very high	91.9	Very high	100 Å²	100	38.6 Å²	38.6	39%	0.392	17%	0.171	S	C	.	.	I	π-helix	trans	-115.2	-55.8	-178.4	-59.2	-93.1	0	0	0	112.1	M437 V591 A599	M437-Y595 HydrophobicContact CE-CD1 4.15Å; M437-Y595 HydrophobicContact CE-CD2 3.96Å; M437-Y595 HydrophobicContact CE-CE1 4.15Å; M437-Y595 HydrophobicContact CE-CE2 3.97Å; M437-Y595 HydrophobicContact CE-CG 4.06Å; M437-Y595 HydrophobicContact SD-CD1 4.19Å; M437-Y595 HydrophobicContact SD-CG 4.26Å; V591-Y595 HydrophobicContact CG1-CD2 4.42Å; V591-Y595 WeakPolarHBondContact O-CB 3.17Å; V591-Y595 PolarHBondContact O-N 2.79Å; Y595-A599 VanDerWaalsContact O-CB 3.29Å; Y595-A599 WeakPolarHBondContact O-CB 3.26Å; Y595-A599 PolarHBondContact O-N 3.45Å
596	L	94.4	Very high	92	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-64.8	-50.4	-174.7	-173	71.9	0	0	0	112.1	L431 A434 V435 V438 V591 V592 A599 L600 L756 L797 L800	L431-L596 HydrophobicContact CD1-CD1 3.81Å; A434-L596 HydrophobicContact CB-CB 4.4Å; A434-L596 HydrophobicContact CB-CD1 4.37Å; V435-L596 HydrophobicContact CG2-CD1 3.73Å; V438-L596 HydrophobicContact CG2-CB 4.25Å; V438-L596 HydrophobicContact CG2-CD2 4.29Å; V591-L596 PolarHBondContact O-N 3.18Å; V592-L596 HydrophobicContact CG1-CD2 4.4Å; V592-L596 HydrophobicContact CG2-CD2 4.49Å; V592-L596 PolarHBondContact O-N 2.85Å; L596-A599 PolarHBondContact O-N 2.87Å; L596-L600 VanDerWaalsContact O-CB 3.28Å; L596-L600 WeakPolarHBondContact O-CB 3.41Å; L596-L600 PolarHBondContact O-N 2.84Å; L596-L756 HydrophobicContact CD2-CD1 3.99Å; L596-L797 HydrophobicContact CD1-CD2 4.21Å; L596-L800 HydrophobicContact CD1-CD1 4.23Å; L596-L800 HydrophobicContact CD2-CD1 3.72Å
597	C	94.5	Very high	91.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-63.1	-46.7	-179.1	-69.7	0	0	0	0	112.8	V592 R601 K749 I752	V592-C597 PolarHBondContact O-N 2.93Å; V592-C597 PolarHBondContact O-SG 3.28Å; V592-C597 VanDerWaalsContact O-SG 3.33Å; C597-R601 VanDerWaalsContact O-CB 3.26Å; C597-R601 WeakPolarHBondContact O-CB 3.32Å; C597-R601 PolarHBondContact O-N 2.87Å; C597-K749 HydrophobicContact CB-CG 3.71Å; C597-I752 VanDerWaalsContact SG-CG2 3.55Å
598	P	93.3	Very high	91.6	Very high	16 Å²	16	28.3 Å²	28.3	10%	0.104	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-44	174.2	-29.8	41.4	0	0	0	113.9	R594 L600 R601 D602	R594-P598 WeakPolarHBondContact O-CG 3.35Å; P598-L600 VanDerWaalsContact C-N 3.34Å; P598-L600 PolarHBondContact O-N 3.36Å; P598-R601 PolarHBondContact O-N 2.88Å; P598-D602 WeakPolarHBondContact O-CB 3.47Å; P598-D602 PolarHBondContact O-N 3.18Å; P598-D602 VanDerWaalsContact O-OD1 3.11Å
599	A	93.1	Very high	91.2	Very high	3 Å²	3	30 Å²	30	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-40.2	179.1	0	0	0	0	0	112.3	R430 L431 A434 Y595 L596 L603	R430-A599 HydrophobicContact CB-CB 4.37Å; L431-A599 HydrophobicContact CB-CB 4Å; L431-A599 HydrophobicContact CD1-CB 4.04Å; A434-A599 HydrophobicContact CB-CB 4.44Å; Y595-A599 VanDerWaalsContact O-CB 3.29Å; Y595-A599 WeakPolarHBondContact O-CB 3.26Å; Y595-A599 PolarHBondContact O-N 3.45Å; L596-A599 PolarHBondContact O-N 2.87Å; A599-L603 WeakPolarHBondContact O-CB 3.25Å; A599-L603 PolarHBondContact O-N 2.83Å; A599-L603 VanDerWaalsContact O-N 3.15Å
600	L	94.4	Very high	90.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-39.4	175.5	-177.9	60.3	0	0	0	112.1	L431 L596 P598 I604 F748 I752 L765 F790 T793 L797	L431-L600 HydrophobicContact CD1-CB 4.06Å; L431-L600 HydrophobicContact CD2-CD1 4.27Å; L596-L600 VanDerWaalsContact O-CB 3.28Å; L596-L600 WeakPolarHBondContact O-CB 3.41Å; L596-L600 PolarHBondContact O-N 2.84Å; P598-L600 VanDerWaalsContact C-N 3.34Å; P598-L600 PolarHBondContact O-N 3.36Å; L600-I604 HydrophobicContact CD1-CD1 3.96Å; L600-I604 HydrophobicContact CD1-CG1 4.39Å; L600-I604 HydrophobicContact CG-CD1 3.96Å; L600-I604 WeakPolarHBondContact O-CB 3.37Å; L600-I604 VanDerWaalsContact O-CG1 3.23Å; L600-I604 WeakPolarHBondContact O-CG1 3.43Å; L600-I604 PolarHBondContact O-N 3.01Å; L600-F748 HydrophobicContact CG-CZ 4.38Å; L600-I752 HydrophobicContact CD2-CD1 3.73Å; L600-I752 HydrophobicContact CD2-CG1 4.42Å; L600-L765 HydrophobicContact CD1-CD1 4.24Å; L600-L765 HydrophobicContact CD2-CD1 4.22Å; L600-F790 HydrophobicContact CD1-CZ 4.03Å; L600-T793 HydrophobicContact CD1-CG2 4.16Å; L600-L797 HydrophobicContact CD1-CD1 4.13Å
601	R	93	Very high	89.2	Confident	53 Å²	53	32 Å²	32	20%	0.2	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-54	173.8	175.5	-159.3	63.3	-154.2	3.4	110.9	C597 P598 L603 I604 E605 H681 A682 D745 F748	C597-R601 VanDerWaalsContact O-CB 3.26Å; C597-R601 WeakPolarHBondContact O-CB 3.32Å; C597-R601 PolarHBondContact O-N 2.87Å; P598-R601 PolarHBondContact O-N 2.88Å; R601-L603 PolarHBondContact O-N 3.19Å; R601-I604 CarbonylContact O-C 3.5Å; R601-I604 PolarHBondContact O-N 2.78Å; R601-I604 VanDerWaalsContact O-N 3.07Å; R601-E605 WeakPolarHBondContact CD-OE1 3.31Å; R601-E605 HydrophobicContact CG-CG 4.42Å; R601-E605 WeakPolarHBondContact CG-OE1 3.48Å; R601-E605 WeakPolarHBondContact O-CB 3.35Å; R601-E605 WeakPolarHBondContact O-CG 3.46Å; R601-E605 PolarHBondContact O-N 3.43Å; R601-H681 WeakPolarHBondContact CD-NE2 3.39Å; R601-A682 HydrophobicContact CB-CB 4.38Å; R601-A682 HydrophobicContact CG-CB 3.94Å; R601-D745 IonicContact CZ-OD1 3.93Å; R601-D745 IonicContact NH1-OD1 3.4Å; R601-D745 PolarHBondContact NH1-OD1 2.9Å; R601-F748 HydrophobicContact CB-CD1 4.28Å; R601-F748 HydrophobicContact CB-CE1 3.76Å; R601-F748 HydrophobicContact CB-CZ 4.25Å
602	D	90.9	Very high	88	Confident	29 Å²	29	33 Å²	33	16%	0.155	15%	0.149	C	C	.	.	H	α-helix	trans	-56.7	-37.4	-177.6	-63.7	-5.7	0	0	0	110.7	I427 R430 P598 E605 H606	I427-D602 HydrophobicContact CG2-CB 3.73Å; R430-D602 IonicContact CZ-OD2 2.7Å; R430-D602 VanDerWaalsContact CZ-OD2 3.28Å; R430-D602 IonicContact NH1-OD2 3.15Å; R430-D602 PolarHBondContact NH1-OD2 3.34Å; R430-D602 IonicContact NH2-OD2 3.23Å; R430-D602 PolarHBondContact NH2-OD2 3.42Å; P598-D602 WeakPolarHBondContact O-CB 3.47Å; P598-D602 PolarHBondContact O-N 3.18Å; P598-D602 VanDerWaalsContact O-OD1 3.11Å; D602-E605 PolarHBondContact O-N 3.24Å; D602-H606 PolarHBondContact O-N 3.06Å; D602-H606 VanDerWaalsContact O-N 3.14Å
603	L	91	Very high	86.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-74.2	-35.3	178	-165	61.5	0	0	0	113.5	I427 L431 A599 R601 E605 Y784 F790 T793	I427-L603 HydrophobicContact CB-CD1 4.04Å; I427-L603 HydrophobicContact CG2-CB 3.82Å; I427-L603 HydrophobicContact CG2-CD1 3.95Å; I427-L603 HydrophobicContact CG2-CG 4.48Å; L431-L603 HydrophobicContact CD2-CD2 3.65Å; A599-L603 WeakPolarHBondContact O-CB 3.25Å; A599-L603 PolarHBondContact O-N 2.83Å; A599-L603 VanDerWaalsContact O-N 3.15Å; R601-L603 PolarHBondContact O-N 3.19Å; L603-E605 VanDerWaalsContact C-N 3.32Å; L603-Y784 HydrophobicContact CD1-CD1 3.55Å; L603-Y784 HydrophobicContact CD1-CD2 4.22Å; L603-Y784 HydrophobicContact CD1-CE1 3.99Å; L603-Y784 HydrophobicContact CD1-CG 3.69Å; L603-Y784 HydrophobicContact CD2-CD1 4.02Å; L603-Y784 HydrophobicContact CD2-CE1 3.65Å; L603-Y784 HydrophobicContact CG-CD1 3.57Å; L603-Y784 HydrophobicContact CG-CE1 3.77Å; L603-Y784 HydrophobicContact CG-CG 4.25Å; L603-F790 HydrophobicContact CG-CE2 4.46Å; L603-T793 HydrophobicContact CD2-CG2 4.33Å; L603-T793 WeakPolarHBondContact CD2-OG1 3.47Å
604	I	92.1	Very high	85.1	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-72.4	-26.5	173.3	-69.9	172.2	0	0	0	111.4	L600 R601 A682 V685 F748 L765 F769 Y779 F790	L600-I604 HydrophobicContact CD1-CD1 3.96Å; L600-I604 HydrophobicContact CD1-CG1 4.39Å; L600-I604 HydrophobicContact CG-CD1 3.96Å; L600-I604 WeakPolarHBondContact O-CB 3.37Å; L600-I604 VanDerWaalsContact O-CG1 3.23Å; L600-I604 WeakPolarHBondContact O-CG1 3.43Å; L600-I604 PolarHBondContact O-N 3.01Å; R601-I604 CarbonylContact O-C 3.5Å; R601-I604 PolarHBondContact O-N 2.78Å; R601-I604 VanDerWaalsContact O-N 3.07Å; I604-A682 HydrophobicContact CB-CB 4.04Å; I604-A682 HydrophobicContact CG2-CB 3.65Å; I604-V685 HydrophobicContact CG2-CG2 4.39Å; I604-F748 HydrophobicContact CD1-CE2 4.41Å; I604-F748 HydrophobicContact CD1-CZ 4.26Å; I604-L765 HydrophobicContact CD1-CD2 4.32Å; I604-F769 HydrophobicContact CD1-CE2 4.26Å; I604-F769 HydrophobicContact CD1-CZ 4.05Å; I604-F769 HydrophobicContact CG1-CE2 4.26Å; I604-F769 HydrophobicContact CG1-CZ 3.85Å; I604-F769 HydrophobicContact CG2-CZ 4.1Å; I604-Y779 VanDerWaalsContact O-CE1 3.23Å; I604-Y779 WeakPolarHBondContact O-CE1 3.4Å; I604-Y779 PolarHBondContact O-OH 2.99Å; I604-F790 HydrophobicContact CD1-CZ 4.21Å; I604-F790 HydrophobicContact CG1-CE2 3.84Å; I604-F790 HydrophobicContact CG1-CZ 3.71Å
605	E	90.4	Very high	83.2	Confident	53 Å²	53	41 Å²	41	25%	0.248	19%	0.192	C	C	.	.	H	α-helix	trans	-84.7	-20.3	178.1	-74.2	174	-160.8	0	0	113.9	R601 D602 L603 G607 L608 H681 A682	R601-E605 WeakPolarHBondContact CD-OE1 3.31Å; R601-E605 HydrophobicContact CG-CG 4.42Å; R601-E605 WeakPolarHBondContact CG-OE1 3.48Å; R601-E605 WeakPolarHBondContact O-CB 3.35Å; R601-E605 WeakPolarHBondContact O-CG 3.46Å; R601-E605 PolarHBondContact O-N 3.43Å; D602-E605 PolarHBondContact O-N 3.24Å; L603-E605 VanDerWaalsContact C-N 3.32Å; E605-G607 PolarHBondContact O-N 3.44Å; E605-L608 HydrophobicContact CB-CD1 4.4Å; E605-L608 HydrophobicContact CG-CD1 4.13Å; E605-L608 PolarHBondContact O-N 2.85Å; E605-L608 VanDerWaalsContact O-N 3.13Å; E605-H681 WeakPolarHBondContact OE1-CA 3.31Å; E605-H681 IonicContact OE1-CD2 3.62Å; E605-H681 PolarHBondContact OE1-CD2 3.11Å; E605-H681 IonicContact OE1-CG 3.64Å; E605-H681 IonicContact OE1-NE2 2.67Å; E605-A682 HydrophobicContact CG-CB 4.21Å; E605-A682 PolarHBondContact OE1-N 3.13Å
606	H	88.1	Confident	81.3	Confident	11 Å²	11	37.6 Å²	37.6	5%	0.051	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	110.1	179.4	177.2	-70.8	0	0	0	112	I427 D602 W782 S783 Y784	I427-H606 HydrophobicContact CD1-CB 4.25Å; D602-H606 PolarHBondContact O-N 3.06Å; D602-H606 VanDerWaalsContact O-N 3.14Å; H606-W782 AromaticContact CE1-CE3 3.73Å; H606-W782 AromaticContact CE1-CZ3 3.77Å; H606-S783 WeakPolarHBondContact O-CB 3.19Å; H606-S783 PolarHBondContact O-OG 2.86Å; H606-Y784 PolarHBondContact ND1-N 3.2Å
607	G	82.9	Confident	79.3	Confident	4 Å²	4	42.9 Å²	42.9	4%	0.041	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	22	178.8	0	0	0	0	0	115.2	E605 Y779 E780	E605-G607 PolarHBondContact O-N 3.44Å; G607-Y779 WeakPolarHBondContact O-CA 3.29Å; G607-E780 PolarHBondContact O-N 3.3Å
608	L	86.7	Confident	77.4	Confident	18 Å²	18	45 Å²	45	9%	0.094	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-68.1	128.7	170.2	-79.7	176.9	0	0	0	112.4	E605 K610 L613 I680 V685 I778 Y779	E605-L608 HydrophobicContact CB-CD1 4.4Å; E605-L608 HydrophobicContact CG-CD1 4.13Å; E605-L608 PolarHBondContact O-N 2.85Å; E605-L608 VanDerWaalsContact O-N 3.13Å; L608-K610 PolarHBondContact O-N 2.94Å; L608-L613 HydrophobicContact CD1-CD1 4.31Å; L608-L613 HydrophobicContact CD2-CD1 4.1Å; L608-I680 HydrophobicContact CB-CG2 4.27Å; L608-I680 HydrophobicContact CD1-CG2 3.67Å; L608-V685 HydrophobicContact CD1-CG2 3.72Å; L608-V685 HydrophobicContact CD2-CG2 3.74Å; L608-V685 HydrophobicContact CG-CG2 4.39Å; L608-I778 HydrophobicContact CD2-CD1 4.35Å; L608-I778 HydrophobicContact CD2-CG1 4.25Å; L608-Y779 HydrophobicContact CD2-CD1 3.75Å; L608-Y779 HydrophobicContact CD2-CD2 4.36Å; L608-Y779 HydrophobicContact CD2-CE1 3.33Å; L608-Y779 HydrophobicContact CD2-CE2 3.98Å; L608-Y779 HydrophobicContact CD2-CG 4.26Å; L608-Y779 VanDerWaalsContact CD2-CZ 3.44Å; L608-Y779 HydrophobicContact CG-CD1 4.19Å; L608-Y779 HydrophobicContact CG-CE1 3.66Å
609	I	83	Confident	75.2	Confident	42 Å²	42	49.8 Å²	49.8	22%	0.215	24%	0.244	C	C	.	.			trans	-69.8	109.9	178.2	-57.8	173.3	0	0	0	109.4	K611 A612 I778 E780	I609-K611 PolarHBondContact O-N 3.42Å; I609-A612 HydrophobicContact CB-CB 3.9Å; I609-A612 HydrophobicContact CG2-CB 4.06Å; I609-A612 PolarHBondContact O-N 3.46Å; I609-I778 WeakPolarHBondContact CG1-O 3.38Å; I609-I778 PolarHBondContact N-O 2.99Å; I609-E780 HydrophobicContact CG1-CG 3.87Å
610	K	72.4	Confident	72.6	Confident	36 Å²	36	53.8 Å²	53.8	16%	0.157	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-24.3	-177.2	-85.9	-106.9	179.5	72.8	0	115.7	S411 N412 T415 L608 I680	S411-K610 PolarHBondContact O-NZ 3.26Å; N412-K610 PolarHBondContact O-NZ 3.27Å; N412-K610 WeakPolarHBondContact OD1-CB 3.45Å; T415-K610 VanDerWaalsContact CG2-NZ 3.35Å; T415-K610 WeakPolarHBondContact OG1-CE 3.39Å; T415-K610 PolarHBondContact OG1-NZ 2.93Å; L608-K610 PolarHBondContact O-N 2.94Å; K610-I680 WeakPolarHBondContact O-CD1 3.13Å
611	K	69.1	Low	69.9	Low	117 Å²	117	58.3 Å²	58.3	51%	0.509	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-14.1	-177.4	-63.2	-169.3	172.5	-169	0	114.3	D409 I609	D409-K611 WeakPolarHBondContact OD2-CE 3.38Å; D409-K611 IonicContact OD2-NZ 3.67Å; D409-K611 PolarHBondContact OD2-NZ 2.97Å; I609-K611 PolarHBondContact O-N 3.42Å
612	A	67.5	Low	67.1	Low	32 Å²	32	64 Å²	64	26%	0.264	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-26.6	-174.6	0	0	0	0	0	114.4	I609 S777 I778	I609-A612 HydrophobicContact CB-CB 3.9Å; I609-A612 HydrophobicContact CG2-CB 4.06Å; I609-A612 PolarHBondContact O-N 3.46Å; A612-S777 VanDerWaalsContact CB-O 3.25Å; A612-S777 WeakPolarHBondContact CB-O 3.25Å; A612-I778 HydrophobicContact CB-CB 4.26Å; A612-I778 HydrophobicContact CB-CG2 4.12Å
613	L	66.6	Low	64.2	Low	10 Å²	10	65.7 Å²	65.7	5%	0.052	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	8.5	-175.9	-67	170.7	0	0	0	114	L608 I680 D684 V685 R688 I778	L608-L613 HydrophobicContact CD1-CD1 4.31Å; L608-L613 HydrophobicContact CD2-CD1 4.1Å; L613-I680 HydrophobicContact CB-CD1 4.19Å; L613-I680 HydrophobicContact CB-CG1 4.31Å; L613-I680 HydrophobicContact CD1-CG2 3.72Å; L613-D684 HydrophobicContact CD1-CB 4.25Å; L613-V685 HydrophobicContact CD1-CG2 4.04Å; L613-R688 HydrophobicContact CD2-CB 3.82Å; L613-R688 HydrophobicContact CD2-CG 3.91Å; L613-I778 HydrophobicContact CD2-CG2 3.97Å; L613-I778 HydrophobicContact CG-CG2 4.37Å
614	Q	58.4	Low	61.2	Low	143 Å²	143	74 Å²	74	67%	0.668	40%	0.401	S	S	*	.			trans	-71.3	132.1	173.2	-80.8	-172.5	-28.6	0	0	111.3
615	K	52.3	Low	58.5	Low	192 Å²	192	80.2 Å²	80.2	84%	0.835	44%	0.439	S	S	*	.			trans	72.4	72.2	-171.8	-54.6	-179.1	-179.7	178.5	0	114.7	R688	K615-R688 PolarHBondContact O-NH1 3Å
616	V	53.8	Low	55.4	Low	29 Å²	29	85 Å²	85	18%	0.176	47%	0.466	C	S	.	.			trans	-106.9	112.9	148.4	171.1	0	0	0	0	105.4	M687 R688	V616-M687 HydrophobicContact CG1-CB 4Å; V616-R688 HydrophobicContact CG2-CB 4.32Å
617	D	52.8	Low	52.8	Low	110 Å²	110	93.1 Å²	93.1	59%	0.588	50%	0.501	S	S	*	.			trans	-84.7	129.2	169.4	-161	-23.8	0	0	0	108.5	N619 Q691	D617-N619 PolarHBondContact OD1-N 2.85Å; D617-N619 VanDerWaalsContact OD1-N 3.15Å; D617-N619 PolarHBondContact OD1-ND2 3.27Å; D617-Q691 PolarHBondContact O-NE2 3.34Å
618	E	54.4	Low	50.3	Low	45 Å²	45	104 Å²	104	21%	0.21	54%	0.541	C	S	.	.			trans	-92.3	-5.8	-175.7	-64.8	-85.9	108.3	0	0	112.1	W683 M687 K747	E618-W683 PolarHBondContact OE2-NE1 2.92Å; E618-W683 VanDerWaalsContact OE2-NE1 3.15Å; E618-M687 VanDerWaalsContact OE1-CE 3.24Å; E618-M687 WeakPolarHBondContact OE1-CE 3.26Å; E618-M687 WeakPolarHBondContact OE1-CG 3.24Å; E618-K747 IonicContact OE2-NZ 3.68Å; E618-K747 PolarHBondContact OE2-NZ 3.25Å
619	N	47	Very low	47.7	Very low	117 Å²	117	107.9 Å²	107.9	63%	0.626	57%	0.569	S	S	*	*	S	Bend	trans	-79.3	129.1	-179	-64.5	-76.2	0	0	0	111.2	D617	D617-N619 PolarHBondContact OD1-N 2.85Å; D617-N619 VanDerWaalsContact OD1-N 3.15Å; D617-N619 PolarHBondContact OD1-ND2 3.27Å
620	P	37.4	Very low	45.5	Very low	88 Å²	88	113.5 Å²	113.5	57%	0.571	60%	0.598	S	S	*	*			trans	-66.7	137.9	168.6	29	-33.3	0	0	0	109.7	L622	P620-L622 PolarHBondContact O-N 3.32Å
621	P	37.5	Very low	43.6	Very low	95 Å²	95	119 Å²	119	62%	0.617	63%	0.629	S	S	*	*			trans	-70.7	95.5	178.9	29.2	-34.5	0	0	0	110.6	G623	P621-G623 PolarHBondContact O-N 2.9Å
622	L	35.1	Very low	42.1	Very low	171 Å²	171	121.1 Å²	121.1	90%	0.895	65%	0.645	S	S	*	*			trans	-52.7	126.1	167.1	-76.9	172.5	0	0	0	109.4	P620	P620-L622 PolarHBondContact O-N 3.32Å
623	G	29.3	Very low	40.7	Very low	66 Å²	66	128.1 Å²	128.1	68%	0.68	68%	0.677	S	S	*	*			trans	-67.2	138.8	-160.3	0	0	0	0	0	114.8	P621	P621-G623 PolarHBondContact O-N 2.9Å
624	L	29.3	Very low	39.1	Very low	174 Å²	174	138.8 Å²	138.8	91%	0.911	72%	0.716	S	S	*	*			trans	46.2	79.1	141.8	-59.9	173.2	0	0	0	117.7
625	T	33.8	Very low	38.2	Very low	131 Å²	131	136.8 Å²	136.8	80%	0.804	72%	0.716	S	S	*	*				-134.6	126.1	125.5	45.8	0	0	0	0	111.3	K627	T625-K627 PolarHBondContact O-N 3.14Å
626	N	26.5	Very low	37.8	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	72%	0.715	S	S	*	*			trans	-80.5	108.1	177.4	170.4	22.5	0	0	0	110.3
627	K	33.7	Very low	37.1	Very low	181 Å²	181	142 Å²	142	79%	0.787	75%	0.749	S	S	*	*			trans	-140.1	78.6	169.8	-69.4	-168	178.5	179	0	113	T625	T625-K627 PolarHBondContact O-N 3.14Å
628	R	29.3	Very low	36	Very low	233 Å²	233	144 Å²	144	88%	0.879	76%	0.76	S	S	*	*			trans	-80.9	134.3	144	-83.5	-177.1	169	178.3	-3	107.5
629	S	33.4	Very low	35.1	Very low	98 Å²	98	147.7 Å²	147.7	69%	0.685	79%	0.789	S	S	*	*			trans	63.7	151.1	-158.6	81	0	0	0	0	112.1
630	I	36.9	Very low	34.6	Very low	160 Å²	160	150 Å²	150	82%	0.821	80%	0.801	S	S	*	*			cis	-124.2	158	17.3	-65.6	170.9	0	0	0	110.2
631	L	32.4	Very low	34.4	Very low	152 Å²	152	152.8 Å²	152.8	80%	0.796	81%	0.811	S	S	*	*			trans	-72.8	175.7	175.2	-70.6	165.4	0	0	0	112.3
632	L	36.2	Very low	34	Very low	161 Å²	161	153.2 Å²	153.2	84%	0.843	82%	0.816	S	S	*	*			trans	70.6	92.1	168.3	-44.9	179.7	0	0	0	116
633	L	38.3	Very low	33.6	Very low	180 Å²	180	156.9 Å²	156.9	94%	0.942	82%	0.818	S	S	*	*				-173.6	137.4	106.3	-95	162.9	0	0	0	111.1
634	R	33.4	Very low	33.6	Very low	233 Å²	233	159.2 Å²	159.2	88%	0.879	82%	0.824	S	S	*	*			trans	-162.1	152.7	-174.6	-174.2	-174.4	-176.2	-179.1	3.6	107.3
635	P	39.7	Very low	33.6	Very low	101 Å²	101	161.9 Å²	161.9	66%	0.656	82%	0.822	S	S	*	*			cis	-122.9	172.9	-38	37.9	-24.1	0	0	0	111.7
636	I	42.9	Very low	33.3	Very low	161 Å²	161	162.9 Å²	162.9	83%	0.826	82%	0.822	S	S	*	*	S	Bend	trans	-136.1	152.6	154.5	-52.4	-179.2	0	0	0	107.5
637	L	40.5	Very low	33.4	Very low	170 Å²	170	164 Å²	164	89%	0.89	82%	0.822	S	S	*	*			trans	68.3	79.8	-176.5	-54.9	-176.4	0	0	0	115.5
638	N	29.7	Very low	33.2	Very low	153 Å²	153	160 Å²	160	82%	0.818	82%	0.817	S	S	*	*			trans	-135.4	81.4	157	-176.1	98.7	0	0	0	108.5
639	C	35.8	Very low	33.2	Very low	121 Å²	121	157.1 Å²	157.1	82%	0.818	81%	0.813	S	S	*	*			trans	-166.6	155.9	172.6	-101.2	0	0	0	0	109.1
640	L	36.1	Very low	33.1	Very low	166 Å²	166	160.1 Å²	160.1	87%	0.869	82%	0.822	S	S	*	*			trans	67.7	130	-174.5	-53.1	172	0	0	0	114.4
641	D	32.1	Very low	32.9	Very low	147 Å²	147	162.3 Å²	162.3	79%	0.786	83%	0.826	S	S	*	*			cis	-148.1	170.9	-19.7	-156.1	-1.5	0	0	0	110.6
642	S	28.9	Very low	32.7	Very low	104 Å²	104	164.1 Å²	164.1	73%	0.727	83%	0.827	S	S	*	*			trans	-102.1	161.1	-170.7	-59.8	0	0	0	0	114
643	R	28	Very low	32.4	Very low	248 Å²	248	165.3 Å²	165.3	94%	0.936	83%	0.829	S	S	*	*			trans	72.3	74	144.5	-162.5	-169	-171.5	-171.1	3.5	117.9
644	S	29.5	Very low	32.1	Very low	115 Å²	115	162.3 Å²	162.3	80%	0.804	82%	0.821	S	S	*	*			trans	-139	101.5	143.4	-160.7	0	0	0	0	107.5
645	R	29.1	Very low	31.9	Very low	230 Å²	230	158.8 Å²	158.8	87%	0.868	82%	0.819	S	S	*	*				89.9	120.5	75.1	-175.4	175.8	178.6	162.8	-1.4	110.4
646	N	26.4	Very low	31.7	Very low	152 Å²	152	161.4 Å²	161.4	81%	0.813	83%	0.827	S	S	*	*			trans	-62.3	140.2	-170.4	-45.2	-24.6	0	0	0	112.6
647	H	29.9	Very low	31.2	Very low	177 Å²	177	160.7 Å²	160.7	82%	0.819	83%	0.825	S	S	*	*			trans	-144.6	157.9	144.6	-116.6	-88.1	0	0	0	109.5
648	S	28.6	Very low	30.9	Very low	97 Å²	97	160.6 Å²	160.6	68%	0.678	83%	0.825	S	S	*	*			trans	-139.9	103.7	-162.9	56.5	0	0	0	0	113.5
649	E	29.7	Very low	31.1	Very low	173 Å²	173	161.1 Å²	161.1	81%	0.808	83%	0.828	S	S	*	*			trans	-151.8	146.7	159.5	-83.9	111.6	-138	0	0	104.7
650	D	32.1	Very low	30.9	Very low	161 Å²	161	163.2 Å²	163.2	86%	0.861	83%	0.83	S	S	*	*			cis	-116.4	146.7	13.3	-63.4	-61.4	0	0	0	113.9
651	K	31.8	Very low	31	Very low	207 Å²	207	160.8 Å²	160.8	90%	0.9	83%	0.827	S	S	*	*			trans	-142	89.7	165.6	-175.5	-169.5	173.9	-170.9	0	109.8
652	F	29	Very low	31	Very low	189 Å²	189	158.1 Å²	158.1	83%	0.829	82%	0.82	S	S	*	*			trans	-130.5	170.1	173.1	-131.4	-104.7	0	0	0	111.1
653	E	29.7	Very low	31.2	Very low	187 Å²	187	160 Å²	160	87%	0.874	82%	0.821	S	S	*	*	S	Bend	trans	61.9	54.1	-172.6	-59.2	-161.3	159.3	0	0	116.1
654	C	32.1	Very low	31.6	Very low	116 Å²	116	157.7 Å²	157.7	78%	0.784	81%	0.814	S	S	*	*			trans	-149.4	97.1	138.5	-163.6	0	0	0	0	110.5
655	L	28.8	Very low	32.1	Very low	160 Å²	160	160.1 Å²	160.1	84%	0.838	82%	0.816	S	S	*	*			trans	-121.8	96.2	161	-75.9	176.5	0	0	0	107.1
656	D	35.8	Very low	32.1	Very low	155 Å²	155	154.3 Å²	154.3	83%	0.829	80%	0.803	S	S	*	*			trans	-123	106.6	158	-140.9	-15.2	0	0	0	105
657	L	32.3	Very low	32.4	Very low	147 Å²	147	153.8 Å²	153.8	77%	0.77	81%	0.805	S	S	*	*			trans	-88.7	110.2	-177.6	-79.8	167.2	0	0	0	108.1
658	N	34.5	Very low	32.4	Very low	167 Å²	167	153 Å²	153	89%	0.893	81%	0.807	S	S	*	*			trans	166	91.8	147.6	-83.7	-21.6	0	0	0	110
659	D	33.5	Very low	32.5	Very low	164 Å²	164	153.3 Å²	153.3	88%	0.877	81%	0.809	S	S	*	*				-173.8	151.3	107.5	-147.1	-24.8	0	0	0	109.4
660	L	30.7	Very low	32.5	Very low	166 Å²	166	154.4 Å²	154.4	87%	0.869	81%	0.812	S	S	*	*			trans	-153.3	83.5	-169.3	-153.2	166.4	0	0	0	114
661	S	37.7	Very low	32.4	Very low	114 Å²	114	152.7 Å²	152.7	80%	0.797	81%	0.812	S	S	*	*			trans	-171.6	144.2	167.3	178.7	0	0	0	0	110
662	S	31.8	Very low	32.2	Very low	91 Å²	91	145.8 Å²	145.8	64%	0.636	80%	0.8	S	S	*	*			cis	-155.8	173.6	-35.5	-155.4	0	0	0	0	109.3
663	D	34.8	Very low	32.2	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	81%	0.805	S	S	*	*			trans	67.7	87.1	153.1	-54.4	-10.3	0	0	0	120.4
664	Y	35.8	Very low	32.1	Very low	200 Å²	200	146.1 Å²	146.1	78%	0.784	81%	0.808	S	S	*	*				23.7	132.4	121.2	-107.1	-102.6	0	0	0	120.6	D666	Y664-D666 VanDerWaalsContact CE1-OD2 3.31Å; Y664-D666 WeakPolarHBondContact CE1-OD2 3.49Å
665	I	39.1	Very low	32	Very low	166 Å²	166	145.2 Å²	145.2	85%	0.851	80%	0.803	S	S	*	*				-156.2	138.8	104.3	-79.7	-144.2	0	0	0	109.3
666	D	29	Very low	32.1	Very low	108 Å²	108	144.2 Å²	144.2	58%	0.578	80%	0.799	S	S	*	*			trans	-81.8	157.5	177	-84.4	-55.9	0	0	0	114.2	Y664	Y664-D666 VanDerWaalsContact CE1-OD2 3.31Å; Y664-D666 WeakPolarHBondContact CE1-OD2 3.49Å
667	T	33.9	Very low	31.7	Very low	141 Å²	141	142.9 Å²	142.9	87%	0.865	80%	0.8	S	S	*	*				-179.3	156.9	111.2	28.5	0	0	0	0	114.4
668	N	30	Very low	32.5	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	79%	0.794	S	S	*	*			trans	-75.7	147.9	-174.3	-74.9	-65.1	0	0	0	114.7
669	S	29.5	Very low	33.9	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	78%	0.776	S	S	*	*				-179	170.7	123	48.8	0	0	0	0	113.1
670	F	31.5	Very low	36	Very low	197 Å²	197	130.4 Å²	130.4	86%	0.864	75%	0.745	S	S	*	*			trans	66.3	88.1	175.3	-74.5	-83.5	0	0	0	118
671	S	28.3	Very low	38.7	Very low	125 Å²	125	123.5 Å²	123.5	87%	0.874	71%	0.708	S	S	*	*			trans	-59.5	137.9	152.8	43.2	0	0	0	0	111.3
672	G	29.2	Very low	41.2	Very low	62 Å²	62	118.1 Å²	118.1	64%	0.639	67%	0.67	S	S	*	*			trans	175.2	92.2	-179.8	0	0	0	0	0	112.4	R674	G672-R674 PolarHBondContact O-N 3.02Å; G672-R674 VanDerWaalsContact O-N 3.15Å
673	S	28.8	Very low	44.1	Very low	134 Å²	134	113.8 Å²	113.8	94%	0.937	64%	0.64	S	S	*	*			trans	38.3	55.8	165.7	-58.6	0	0	0	0	117.2
674	R	27.5	Very low	46.8	Very low	248 Å²	248	107.6 Å²	107.6	94%	0.936	61%	0.606	S	S	*	*			trans	-85.7	106.8	166.9	-76.9	-175	171.3	-174.9	-1.5	110.5	G672	G672-R674 PolarHBondContact O-N 3.02Å; G672-R674 VanDerWaalsContact O-N 3.15Å
675	S	29.7	Very low	49.4	Very low	97 Å²	97	98 Å²	98	68%	0.678	57%	0.569	S	S	*	*			trans	-145	147.4	168.6	-176	0	0	0	0	110.2
676	N	29.8	Very low	52	Low	139 Å²	139	90.1 Å²	90.1	74%	0.743	53%	0.528	S	S	*	.			trans	61.7	37.4	173.8	-62.5	-16.9	0	0	0	118.1	I678	N676-I678 VanDerWaalsContact C-N 3.27Å; N676-I678 PolarHBondContact O-N 3.17Å; N676-I678 VanDerWaalsContact O-N 3.16Å
677	C	28	Very low	55	Low	127 Å²	127	85.2 Å²	85.2	86%	0.858	50%	0.502	S	S	*	.			trans	-81.8	71.7	157.2	58.9	0	0	0	0	110.9
678	I	50.3	Low	57.5	Low	125 Å²	125	82.4 Å²	82.4	64%	0.641	48%	0.475	S	S	*	.			trans	-116.5	139.4	177.6	-61.4	171.5	0	0	0	108.8	N676	N676-I678 VanDerWaalsContact C-N 3.27Å; N676-I678 PolarHBondContact O-N 3.17Å; N676-I678 VanDerWaalsContact O-N 3.16Å
679	G	62.6	Low	60.4	Low	51 Å²	51	75 Å²	75	53%	0.526	44%	0.436	S	S	.	.			trans	-56.4	153.2	-179.1	0	0	0	0	0	114.1	K744	G679-K744 PolarHBondContact O-NZ 3.01Å; G679-K744 VanDerWaalsContact O-NZ 3.11Å
680	I	77.1	Confident	63.4	Low	41 Å²	41	70.5 Å²	70.5	21%	0.21	40%	0.403	C	S	.	.			trans	-67.9	139.2	161.2	-79.5	159.4	0	0	0	107.9	L608 K610 L613 D684	L608-I680 HydrophobicContact CB-CG2 4.27Å; L608-I680 HydrophobicContact CD1-CG2 3.67Å; K610-I680 WeakPolarHBondContact O-CD1 3.13Å; L613-I680 HydrophobicContact CB-CD1 4.19Å; L613-I680 HydrophobicContact CB-CG1 4.31Å; L613-I680 HydrophobicContact CD1-CG2 3.72Å; I680-D684 WeakPolarHBondContact CA-OD2 3.47Å
681	H	87.9	Confident	66.2	Low	21 Å²	21	63.6 Å²	63.6	10%	0.097	37%	0.373	C	S	.	.			trans	-133.7	156	-172.1	-172.9	-102.8	0	0	0	110.1	R601 E605 W683 D684 K744 D745	R601-H681 WeakPolarHBondContact CD-NE2 3.39Å; E605-H681 WeakPolarHBondContact OE1-CA 3.31Å; E605-H681 IonicContact OE1-CD2 3.62Å; E605-H681 PolarHBondContact OE1-CD2 3.11Å; E605-H681 IonicContact OE1-CG 3.64Å; E605-H681 IonicContact OE1-NE2 2.67Å; H681-W683 VanDerWaalsContact ND1-CB 3.3Å; H681-W683 WeakPolarHBondContact ND1-CB 3.46Å; H681-W683 PolarHBondContact ND1-N 3.15Å; H681-W683 VanDerWaalsContact ND1-N 3.19Å; H681-W683 PolarHBondContact O-N 2.93Å; H681-D684 PolarHBondContact N-OD2 2.75Å; H681-D684 WeakPolarHBondContact O-CB 3.17Å; H681-D684 PolarHBondContact O-N 2.94Å; H681-K744 HydrophobicContact CB-CB 3.96Å; H681-K744 HydrophobicContact CB-CD 3.65Å; H681-K744 HydrophobicContact CB-CG 4.49Å; H681-K744 PolarHBondContact CE1-O 3.37Å; H681-K744 VanDerWaalsContact CE1-O 3.24Å; H681-K744 WeakPolarHBondContact ND1-CB 3.49Å; H681-K744 PolarHBondContact ND1-O 3Å; H681-D745 WeakPolarHBondContact CE1-CA 3.3Å; H681-D745 PolarHBondContact CE1-N 3.38Å; H681-D745 IonicContact NE2-OD1 3.05Å
682	A	91.5	Very high	69	Low	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-52.4	-29.7	175.9	0	0	0	0	0	113.1	R601 I604 E605 D684 V685 L686 F748	R601-A682 HydrophobicContact CB-CB 4.38Å; R601-A682 HydrophobicContact CG-CB 3.94Å; I604-A682 HydrophobicContact CB-CB 4.04Å; I604-A682 HydrophobicContact CG2-CB 3.65Å; E605-A682 HydrophobicContact CG-CB 4.21Å; E605-A682 PolarHBondContact OE1-N 3.13Å; A682-D684 VanDerWaalsContact C-N 3.33Å; A682-D684 PolarHBondContact O-N 3.25Å; A682-V685 WeakPolarHBondContact O-CB 3.5Å; A682-V685 PolarHBondContact O-N 3.15Å; A682-L686 PolarHBondContact O-N 3.07Å; A682-F748 HydrophobicContact CB-CD2 3.89Å; A682-F748 HydrophobicContact CB-CE2 3.57Å; A682-F748 HydrophobicContact CB-CZ 4Å
683	W	92.8	Very high	71.7	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-57.2	-39.6	171.7	-176.9	-100.9	0	0	0	113.9	E618 H681 V685 L686 M687 M730 V733 L734 K744 K747 F748 F751	E618-W683 PolarHBondContact OE2-NE1 2.92Å; E618-W683 VanDerWaalsContact OE2-NE1 3.15Å; H681-W683 VanDerWaalsContact ND1-CB 3.3Å; H681-W683 WeakPolarHBondContact ND1-CB 3.46Å; H681-W683 PolarHBondContact ND1-N 3.15Å; H681-W683 VanDerWaalsContact ND1-N 3.19Å; H681-W683 PolarHBondContact O-N 2.93Å; W683-V685 PolarHBondContact O-N 2.95Å; W683-L686 HydrophobicContact CE3-CD1 4.17Å; W683-L686 HydrophobicContact CZ3-CD1 4.46Å; W683-L686 WeakPolarHBondContact O-CB 3.18Å; W683-L686 PolarHBondContact O-N 3.43Å; W683-M687 HydrophobicContact CD2-CG 4.27Å; W683-M687 VanDerWaalsContact CE2-CG 3.5Å; W683-M687 HydrophobicContact CG-CG 4.46Å; W683-M687 HydrophobicContact CZ2-CG 3.82Å; W683-M687 HydrophobicContact CZ2-SD 3.86Å; W683-M687 PolarHBondContact O-N 3.2Å; W683-M730 HydrophobicContact CE3-CE 4.39Å; W683-M730 HydrophobicContact CH2-CE 3.29Å; W683-M730 HydrophobicContact CZ2-CE 4.16Å; W683-M730 HydrophobicContact CZ3-CE 3.43Å; W683-M730 VanDerWaalsContact CZ3-CE 3.43Å; W683-V733 HydrophobicContact CH2-CB 4.2Å; W683-V733 HydrophobicContact CH2-CG1 3.52Å; W683-V733 HydrophobicContact CZ2-CG1 4.43Å; W683-V733 HydrophobicContact CZ3-CG1 3.98Å; W683-L734 HydrophobicContact CZ2-CD2 3.95Å; W683-L734 HydrophobicContact CZ2-CG 4.37Å; W683-K744 HydrophobicContact CB-CB 3.99Å; W683-K744 HydrophobicContact CG-CB 4.35Å; W683-K747 HydrophobicContact CD2-CB 3.64Å; W683-K747 HydrophobicContact CD2-CD 4.15Å; W683-K747 HydrophobicContact CE3-CB 3.61Å; W683-K747 HydrophobicContact CG-CB 4.38Å; W683-K747 HydrophobicContact CH2-CB 3.79Å; W683-K747 HydrophobicContact CH2-CD 4.47Å; W683-K747 HydrophobicContact CZ2-CB 3.85Å; W683-K747 HydrophobicContact CZ2-CD 3.73Å; W683-K747 HydrophobicContact CZ2-CG 4.26Å; W683-K747 VanDerWaalsContact CZ3-C 3.47Å; W683-K747 HydrophobicContact CZ3-CB 3.67Å; W683-K747 VanDerWaalsContact CZ3-O 3.3Å; W683-K747 WeakPolarHBondContact CZ3-O 3.43Å; W683-F748 HydrophobicContact CB-CB 4.49Å; W683-F748 HydrophobicContact CE3-CB 4.22Å; W683-F751 HydrophobicContact CZ3-CB 3.98Å
684	D	91	Very high	74.5	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.064	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-30.9	-177.7	-56	-44	0	0	0	110.9	L613 I680 H681 A682 R688 K744	L613-D684 HydrophobicContact CD1-CB 4.25Å; I680-D684 WeakPolarHBondContact CA-OD2 3.47Å; H681-D684 PolarHBondContact N-OD2 2.75Å; H681-D684 WeakPolarHBondContact O-CB 3.17Å; H681-D684 PolarHBondContact O-N 2.94Å; A682-D684 VanDerWaalsContact C-N 3.33Å; A682-D684 PolarHBondContact O-N 3.25Å; D684-R688 WeakPolarHBondContact O-CB 3.47Å; D684-R688 PolarHBondContact O-N 3.38Å; D684-K744 WeakPolarHBondContact OD1-CD 3.49Å; D684-K744 WeakPolarHBondContact OD1-CE 3.04Å; D684-K744 IonicContact OD1-NZ 3.38Å; D684-K744 PolarHBondContact OD1-NZ 3.41Å; D684-K744 IonicContact OD2-NZ 3.25Å; D684-K744 PolarHBondContact OD2-NZ 3.38Å
685	V	90.8	Very high	77.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-49	172.3	-177.3	0	0	0	0	110.5	I604 L608 L613 A682 W683 M687 R688 F689 F769 F774 I778	I604-V685 HydrophobicContact CG2-CG2 4.39Å; L608-V685 HydrophobicContact CD1-CG2 3.72Å; L608-V685 HydrophobicContact CD2-CG2 3.74Å; L608-V685 HydrophobicContact CG-CG2 4.39Å; L613-V685 HydrophobicContact CD1-CG2 4.04Å; A682-V685 WeakPolarHBondContact O-CB 3.5Å; A682-V685 PolarHBondContact O-N 3.15Å; W683-V685 PolarHBondContact O-N 2.95Å; V685-M687 PolarHBondContact O-N 2.64Å; V685-R688 PolarHBondContact O-N 3.15Å; V685-F689 PolarHBondContact O-N 3.16Å; V685-F769 HydrophobicContact CG1-CE1 4.37Å; V685-F774 HydrophobicContact CG1-CE1 4.03Å; V685-F774 HydrophobicContact CG1-CZ 3.98Å; V685-I778 HydrophobicContact CB-CD1 4.49Å; V685-I778 HydrophobicContact CG1-CD1 3.75Å; V685-I778 HydrophobicContact CG2-CD1 4.28Å
686	L	92.9	Very high	80.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-48.1	177.4	-57.3	-177.3	0	0	0	111.1	A682 W683 F689 Y690 M730 F748 F751 I768	A682-L686 PolarHBondContact O-N 3.07Å; W683-L686 HydrophobicContact CE3-CD1 4.17Å; W683-L686 HydrophobicContact CZ3-CD1 4.46Å; W683-L686 WeakPolarHBondContact O-CB 3.18Å; W683-L686 PolarHBondContact O-N 3.43Å; L686-F689 PolarHBondContact O-N 2.88Å; L686-Y690 VanDerWaalsContact O-CB 3.31Å; L686-Y690 WeakPolarHBondContact O-CB 3.21Å; L686-Y690 PolarHBondContact O-N 3.29Å; L686-M730 HydrophobicContact CB-CE 4.44Å; L686-M730 HydrophobicContact CB-SD 4.1Å; L686-M730 HydrophobicContact CD1-CE 4.43Å; L686-F748 HydrophobicContact CD1-CD2 3.76Å; L686-F748 HydrophobicContact CD1-CE2 4.04Å; L686-F751 HydrophobicContact CD1-CD1 3.45Å; L686-F751 VanDerWaalsContact CD1-CD1 3.45Å; L686-F751 HydrophobicContact CD1-CE1 3.7Å; L686-F751 HydrophobicContact CD1-CG 4.19Å; L686-F751 HydrophobicContact CD2-CE1 4.26Å; L686-I768 HydrophobicContact CD2-CD1 3.6Å
687	M	91.3	Very high	82.8	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-37.9	-179.8	-79	-60.3	-69	0	0	112.9	V616 E618 W683 V685 Y690 Q691 L734	V616-M687 HydrophobicContact CG1-CB 4Å; E618-M687 VanDerWaalsContact OE1-CE 3.24Å; E618-M687 WeakPolarHBondContact OE1-CE 3.26Å; E618-M687 WeakPolarHBondContact OE1-CG 3.24Å; W683-M687 HydrophobicContact CD2-CG 4.27Å; W683-M687 VanDerWaalsContact CE2-CG 3.5Å; W683-M687 HydrophobicContact CG-CG 4.46Å; W683-M687 HydrophobicContact CZ2-CG 3.82Å; W683-M687 HydrophobicContact CZ2-SD 3.86Å; W683-M687 PolarHBondContact O-N 3.2Å; V685-M687 PolarHBondContact O-N 2.64Å; M687-Y690 HydrophobicContact CE-CD1 3.89Å; M687-Y690 HydrophobicContact CE-CE1 4.12Å; M687-Y690 PolarHBondContact O-N 2.94Å; M687-Y690 HydrophobicContact SD-CD1 3.78Å; M687-Y690 HydrophobicContact SD-CE1 4.28Å; M687-Y690 HydrophobicContact SD-CG 4.46Å; M687-Q691 WeakPolarHBondContact O-CB 3.49Å; M687-Q691 WeakPolarHBondContact O-CG 3.49Å; M687-Q691 PolarHBondContact O-N 3Å; M687-L734 HydrophobicContact CE-CD1 3.83Å; M687-L734 HydrophobicContact CE-CD2 3.84Å; M687-L734 HydrophobicContact CE-CG 4.43Å; M687-L734 HydrophobicContact SD-CD1 3.89Å; M687-L734 HydrophobicContact SD-CD2 3.97Å; M687-L734 HydrophobicContact SD-CG 4.27Å
688	R	87.8	Confident	85.7	Confident	82 Å²	82	44.8 Å²	44.8	31%	0.309	22%	0.22	S	C	.	.	H	α-helix	trans	-64.3	-40.9	174.7	-169.2	65.3	175.4	-178.7	-3.2	111.4	L613 K615 V616 D684 V685 I692 F774	L613-R688 HydrophobicContact CD2-CB 3.82Å; L613-R688 HydrophobicContact CD2-CG 3.91Å; K615-R688 PolarHBondContact O-NH1 3Å; V616-R688 HydrophobicContact CG2-CB 4.32Å; D684-R688 WeakPolarHBondContact O-CB 3.47Å; D684-R688 PolarHBondContact O-N 3.38Å; V685-R688 PolarHBondContact O-N 3.15Å; R688-I692 HydrophobicContact CG-CD1 3.93Å; R688-I692 WeakPolarHBondContact O-CB 3.4Å; R688-I692 WeakPolarHBondContact O-CD1 3.19Å; R688-I692 WeakPolarHBondContact O-CG1 3.36Å; R688-I692 PolarHBondContact O-N 3.33Å; R688-F774 HydrophobicContact CB-CE2 4.08Å; R688-F774 HydrophobicContact CB-CZ 4.38Å; R688-F774 HydrophobicContact CG-CE2 3.82Å
689	F	90.6	Very high	87.4	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-44.6	174	-175.7	-89.3	0	0	0	112.3	V685 L686 Q691 I692 K693 F726 M767 I768 N771 F774	V685-F689 PolarHBondContact O-N 3.16Å; L686-F689 PolarHBondContact O-N 2.88Å; F689-Q691 VanDerWaalsContact C-N 3.35Å; F689-Q691 PolarHBondContact O-N 3.47Å; F689-I692 PolarHBondContact O-N 3.01Å; F689-K693 HydrophobicContact CD1-CG 4.11Å; F689-K693 HydrophobicContact CD2-CG 4.47Å; F689-K693 HydrophobicContact CE1-CG 3.7Å; F689-K693 HydrophobicContact CE2-CG 4.1Å; F689-K693 HydrophobicContact CG-CG 4.48Å; F689-K693 HydrophobicContact CZ-CD 4.34Å; F689-K693 HydrophobicContact CZ-CG 3.7Å; F689-K693 WeakPolarHBondContact O-CG 3.35Å; F689-K693 PolarHBondContact O-N 3Å; F689-F726 AromaticContact CD1-CE1 3.88Å; F689-F726 HydrophobicContact CD1-CE1 3.88Å; F689-F726 HydrophobicContact CD1-CZ 4.13Å; F689-F726 HydrophobicContact CE1-CE1 4.12Å; F689-M767 HydrophobicContact CE1-CE 4.2Å; F689-M767 HydrophobicContact CE1-CG 4.28Å; F689-M767 WeakPolarHBondContact CE2-O 3.28Å; F689-M767 HydrophobicContact CZ-CG 3.95Å; F689-M767 VanDerWaalsContact CZ-O 3.31Å; F689-M767 WeakPolarHBondContact CZ-O 3.29Å; F689-I768 HydrophobicContact CB-CG1 4.42Å; F689-I768 HydrophobicContact CB-CG2 4.37Å; F689-I768 HydrophobicContact CD1-CG1 3.72Å; F689-I768 HydrophobicContact CD2-CB 4.32Å; F689-I768 HydrophobicContact CD2-CG1 4.19Å; F689-I768 HydrophobicContact CD2-CG2 4.15Å; F689-I768 HydrophobicContact CE1-CG1 3.93Å; F689-I768 HydrophobicContact CE2-CB 4.47Å; F689-I768 HydrophobicContact CE2-CG1 4.37Å; F689-I768 HydrophobicContact CG-CB 4.42Å; F689-I768 HydrophobicContact CG-CG1 3.85Å; F689-I768 HydrophobicContact CG-CG2 4.26Å; F689-I768 HydrophobicContact CZ-CG1 4.25Å; F689-N771 HydrophobicContact CE2-CB 4.13Å; F689-F774 HydrophobicContact CB-CE1 4.01Å; F689-F774 HydrophobicContact CB-CE2 4.44Å; F689-F774 HydrophobicContact CB-CZ 3.84Å; F689-F774 AromaticContact CD2-CD1 3.96Å; F689-F774 HydrophobicContact CD2-CD1 3.96Å; F689-F774 HydrophobicContact CD2-CE1 4.02Å; F689-F774 HydrophobicContact CD2-CG 4.43Å; F689-F774 HydrophobicContact CG-CE1 4.49Å
690	Y	91.6	Very high	88.5	Confident	11 Å²	11	41 Å²	41	4%	0.043	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-43.9	176	169.3	-104	0	0	0	111.8	L686 M687 N694 G695 P696 N699 F727 M730 L734	L686-Y690 VanDerWaalsContact O-CB 3.31Å; L686-Y690 WeakPolarHBondContact O-CB 3.21Å; L686-Y690 PolarHBondContact O-N 3.29Å; M687-Y690 HydrophobicContact CE-CD1 3.89Å; M687-Y690 HydrophobicContact CE-CE1 4.12Å; M687-Y690 PolarHBondContact O-N 2.94Å; M687-Y690 HydrophobicContact SD-CD1 3.78Å; M687-Y690 HydrophobicContact SD-CE1 4.28Å; M687-Y690 HydrophobicContact SD-CG 4.46Å; Y690-N694 PolarHBondContact O-N 3.34Å; Y690-G695 VanDerWaalsContact CE2-C 3.47Å; Y690-G695 WeakPolarHBondContact O-CA 3.49Å; Y690-G695 PolarHBondContact O-N 3.43Å; Y690-P696 HydrophobicContact CD1-CG 4.22Å; Y690-P696 HydrophobicContact CE1-CG 3.63Å; Y690-N699 PolarHBondContact OH-ND2 3.24Å; Y690-F727 AromaticContact CD2-CD1 3.83Å; Y690-F727 HydrophobicContact CD2-CD1 3.83Å; Y690-F727 HydrophobicContact CD2-CE1 4.36Å; Y690-F727 HydrophobicContact CE2-CB 4.44Å; Y690-F727 HydrophobicContact CE2-CD1 4.25Å; Y690-M730 HydrophobicContact CD2-CB 3.66Å; Y690-M730 HydrophobicContact CD2-CG 3.96Å; Y690-M730 HydrophobicContact CE2-CB 3.68Å; Y690-M730 HydrophobicContact CE2-CG 4.47Å; Y690-M730 HydrophobicContact CG-CB 4.31Å; Y690-M730 HydrophobicContact CG-CG 4.47Å; Y690-L734 HydrophobicContact CD1-CD1 4.49Å; Y690-L734 HydrophobicContact CE1-CD1 3.68Å
691	Q	90.4	Very high	89	Confident	51 Å²	51	40.8 Å²	40.8	24%	0.238	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-52.3	171.9	-74.6	-178.7	-13.7	0	0	112.1	D617 M687 F689 K693 N694	D617-Q691 PolarHBondContact O-NE2 3.34Å; M687-Q691 WeakPolarHBondContact O-CB 3.49Å; M687-Q691 WeakPolarHBondContact O-CG 3.49Å; M687-Q691 PolarHBondContact O-N 3Å; F689-Q691 VanDerWaalsContact C-N 3.35Å; F689-Q691 PolarHBondContact O-N 3.47Å; Q691-K693 PolarHBondContact O-N 3.39Å; Q691-N694 PolarHBondContact O-N 3.12Å
692	I	87.5	Confident	88.9	Confident	81 Å²	81	44.2 Å²	44.2	42%	0.415	21%	0.213	S	C	.	.	H	α-helix	trans	-57.6	-33.1	-179.2	-74.6	167.5	0	0	0	112.4	R688 F689 F774	R688-I692 HydrophobicContact CG-CD1 3.93Å; R688-I692 WeakPolarHBondContact O-CB 3.4Å; R688-I692 WeakPolarHBondContact O-CD1 3.19Å; R688-I692 WeakPolarHBondContact O-CG1 3.36Å; R688-I692 PolarHBondContact O-N 3.33Å; F689-I692 PolarHBondContact O-N 3.01Å; I692-F774 HydrophobicContact CD1-CD2 3.62Å; I692-F774 HydrophobicContact CD1-CE2 3.86Å
693	K	86.8	Confident	88.5	Confident	69 Å²	69	47.5 Å²	47.5	30%	0.3	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	14.4	177.9	-57.9	-62.2	-175.2	-177.1	0	113.6	F689 Q691 G695 R723 F727	F689-K693 HydrophobicContact CD1-CG 4.11Å; F689-K693 HydrophobicContact CD2-CG 4.47Å; F689-K693 HydrophobicContact CE1-CG 3.7Å; F689-K693 HydrophobicContact CE2-CG 4.1Å; F689-K693 HydrophobicContact CG-CG 4.48Å; F689-K693 HydrophobicContact CZ-CD 4.34Å; F689-K693 HydrophobicContact CZ-CG 3.7Å; F689-K693 WeakPolarHBondContact O-CG 3.35Å; F689-K693 PolarHBondContact O-N 3Å; Q691-K693 PolarHBondContact O-N 3.39Å; K693-G695 VanDerWaalsContact C-N 3.32Å; K693-G695 PolarHBondContact O-N 2.87Å; K693-R723 PolarHBondContact O-NH2 3.41Å; K693-F727 HydrophobicContact CB-CE1 4.04Å; K693-F727 HydrophobicContact CB-CZ 3.71Å; K693-F727 VanDerWaalsContact O-CZ 3.24Å; K693-F727 WeakPolarHBondContact O-CZ 3.42Å
694	N	87.1	Confident	88.1	Confident	109 Å²	109	47.9 Å²	47.9	58%	0.583	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	33.5	178.4	-66.1	-43	0	0	0	114.9	Y690 Q691 R697 Y698	Y690-N694 PolarHBondContact O-N 3.34Å; Q691-N694 PolarHBondContact O-N 3.12Å; N694-R697 PolarHBondContact O-N 3.36Å; N694-Y698 PolarHBondContact O-N 2.68Å
695	G	86.6	Confident	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.3	-40.3	176.6	0	0	0	0	0	115.7	Y690 K693 R697 Y698 N699	Y690-G695 VanDerWaalsContact CE2-C 3.47Å; Y690-G695 WeakPolarHBondContact O-CA 3.49Å; Y690-G695 PolarHBondContact O-N 3.43Å; K693-G695 VanDerWaalsContact C-N 3.32Å; K693-G695 PolarHBondContact O-N 2.87Å; G695-R697 VanDerWaalsContact C-N 3.34Å; G695-R697 PolarHBondContact O-N 3.48Å; G695-Y698 WeakPolarHBondContact O-CB 3.24Å; G695-Y698 PolarHBondContact O-N 2.68Å; G695-N699 PolarHBondContact O-N 2.91Å; G695-N699 VanDerWaalsContact O-N 3.16Å
696	P	87.5	Confident	87.5	Confident	36 Å²	36	56.9 Å²	56.9	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-55	-47.4	175.3	-26.8	34.2	0	0	0	112.7	Y690 Y698 N699 E700	Y690-P696 HydrophobicContact CD1-CG 4.22Å; Y690-P696 HydrophobicContact CE1-CG 3.63Å; P696-Y698 PolarHBondContact O-N 3.35Å; P696-N699 PolarHBondContact O-N 2.86Å; P696-E700 WeakPolarHBondContact O-CB 3.31Å; P696-E700 WeakPolarHBondContact O-CG 3.33Å; P696-E700 PolarHBondContact O-N 3.43Å
697	R	87.2	Confident	87	Confident	201 Å²	201	57.6 Å²	57.6	76%	0.758	28%	0.282	S	S	*	.	H	α-helix	trans	-63.2	-24.8	178.6	-172.7	174.4	178.4	175.2	0.3	113.2	N694 G695 S701	N694-R697 PolarHBondContact O-N 3.36Å; G695-R697 VanDerWaalsContact C-N 3.34Å; G695-R697 PolarHBondContact O-N 3.48Å; R697-S701 PolarHBondContact O-N 2.93Å
698	Y	87.6	Confident	86.6	Confident	42 Å²	42	61 Å²	61	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-73.1	-47.5	171	176	-100.6	0	0	0	111.5	N694 G695 P696 E700 S701 K704 Q724 F727	N694-Y698 PolarHBondContact O-N 2.68Å; G695-Y698 WeakPolarHBondContact O-CB 3.24Å; G695-Y698 PolarHBondContact O-N 2.68Å; P696-Y698 PolarHBondContact O-N 3.35Å; Y698-E700 PolarHBondContact O-N 3.11Å; Y698-S701 WeakPolarHBondContact O-CB 3.21Å; Y698-S701 PolarHBondContact O-N 2.88Å; Y698-K704 HydrophobicContact CD1-CG 4.23Å; Y698-K704 HydrophobicContact CE1-CB 4.33Å; Y698-K704 HydrophobicContact CE1-CG 3.7Å; Y698-K704 VanDerWaalsContact O-CB 3.25Å; Y698-K704 WeakPolarHBondContact O-CB 3.36Å; Y698-Q724 HydrophobicContact CD2-CG 4.23Å; Y698-Q724 HydrophobicContact CE1-CB 4.2Å; Y698-Q724 HydrophobicContact CE2-CB 4.15Å; Y698-Q724 HydrophobicContact CE2-CG 3.66Å; Y698-F727 HydrophobicContact CD1-CB 3.49Å; Y698-F727 VanDerWaalsContact CD1-CB 3.49Å; Y698-F727 AromaticContact CD1-CD2 3.98Å; Y698-F727 HydrophobicContact CD1-CD2 3.98Å; Y698-F727 HydrophobicContact CD1-CG 4.25Å; Y698-F727 HydrophobicContact CE1-CB 4.12Å; Y698-F727 HydrophobicContact CG-CB 4.24Å; Y698-F727 AromaticContact CG-CD2 3.87Å; Y698-F727 HydrophobicContact CG-CD2 3.87Å
699	N	86.7	Confident	86.4	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.102	31%	0.312	C	S	.	.	H	α-helix	trans	-73.2	-26.3	-178.7	-70.9	-32.5	0	0	0	113.7	Y690 G695 P696 S701 K704 K705 F727 G731	Y690-N699 PolarHBondContact OH-ND2 3.24Å; G695-N699 PolarHBondContact O-N 2.91Å; G695-N699 VanDerWaalsContact O-N 3.16Å; P696-N699 PolarHBondContact O-N 2.86Å; N699-S701 VanDerWaalsContact C-N 3.3Å; N699-K704 WeakPolarHBondContact OD1-CE 3.41Å; N699-K705 WeakPolarHBondContact O-CE 3.37Å; N699-F727 PolarHBondContact ND2-O 2.97Å; N699-F727 PolarHBondContact OD1-O 3.49Å; N699-G731 VanDerWaalsContact ND2-CA 3.29Å; N699-G731 WeakPolarHBondContact ND2-CA 3.31Å; N699-G731 PolarHBondContact ND2-N 3.08Å
700	E	86.3	Confident	86.1	Confident	78 Å²	78	67.8 Å²	67.8	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-73.7	-22.8	171.7	-73.6	160.9	-159.3	0	0	112.7	P696 Y698 K705	P696-E700 WeakPolarHBondContact O-CB 3.31Å; P696-E700 WeakPolarHBondContact O-CG 3.33Å; P696-E700 PolarHBondContact O-N 3.43Å; Y698-E700 PolarHBondContact O-N 3.11Å; E700-K705 PolarHBondContact O-NZ 3.42Å
701	S	86.6	Confident	85.4	Confident	36 Å²	36	74.5 Å²	74.5	25%	0.252	38%	0.378	S	S	.	.	S	Bend	trans	-56	132.9	-175.6	-174.9	0	0	0	0	112.2	R697 Y698 N699 V703 K704 K705	R697-S701 PolarHBondContact O-N 2.93Å; Y698-S701 WeakPolarHBondContact O-CB 3.21Å; Y698-S701 PolarHBondContact O-N 2.88Å; N699-S701 VanDerWaalsContact C-N 3.3Å; S701-V703 PolarHBondContact O-N 3.43Å; S701-V703 PolarHBondContact OG-N 3.26Å; S701-K704 PolarHBondContact O-N 3.3Å; S701-K704 VanDerWaalsContact O-N 3.12Å; S701-K705 PolarHBondContact O-N 3.44Å
702	P	85.6	Confident	84.8	Confident	93 Å²	93	76 Å²	76	60%	0.604	39%	0.387	S	S	*	.	H	α-helix	trans	-53.2	-35.7	172	-26.4	35.1	0	0	0	112.6	K705 L706	P702-K705 PolarHBondContact O-N 3.46Å; P702-L706 WeakPolarHBondContact O-CB 3.3Å; P702-L706 VanDerWaalsContact O-CG 3.28Å; P702-L706 WeakPolarHBondContact O-CG 3.48Å; P702-L706 PolarHBondContact O-N 2.96Å
703	V	82.9	Confident	83.9	Confident	68 Å²	68	77 Å²	77	41%	0.412	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-44.2	179.3	-175.3	0	0	0	0	111.6	S701 K705 L706 C707 V715	S701-V703 PolarHBondContact O-N 3.43Å; S701-V703 PolarHBondContact OG-N 3.26Å; V703-K705 VanDerWaalsContact C-N 3.33Å; V703-K705 PolarHBondContact O-N 3.33Å; V703-L706 PolarHBondContact O-N 2.87Å; V703-C707 PolarHBondContact O-N 2.9Å; V703-C707 PolarHBondContact O-SG 3.01Å; V703-V715 HydrophobicContact CG1-CG1 3.39Å
704	K	84.8	Confident	82.9	Confident	9 Å²	9	77.2 Å²	77.2	4%	0.039	40%	0.4	C	S	.	.	H	α-helix	trans	-60.1	-46.1	176.7	-173.1	-87.2	-176.1	178.6	0	110.6	Y698 N699 S701 C707 E708 S728 N732	Y698-K704 HydrophobicContact CD1-CG 4.23Å; Y698-K704 HydrophobicContact CE1-CB 4.33Å; Y698-K704 HydrophobicContact CE1-CG 3.7Å; Y698-K704 VanDerWaalsContact O-CB 3.25Å; Y698-K704 WeakPolarHBondContact O-CB 3.36Å; N699-K704 WeakPolarHBondContact OD1-CE 3.41Å; S701-K704 PolarHBondContact O-N 3.3Å; S701-K704 VanDerWaalsContact O-N 3.12Å; K704-C707 PolarHBondContact O-N 3.49Å; K704-E708 WeakPolarHBondContact CD-OE2 3.4Å; K704-E708 WeakPolarHBondContact CE-OE2 3.29Å; K704-E708 IonicContact NZ-OE1 3.74Å; K704-E708 PolarHBondContact NZ-OE1 2.98Å; K704-E708 IonicContact NZ-OE2 3.73Å; K704-E708 PolarHBondContact NZ-OE2 2.97Å; K704-E708 VanDerWaalsContact O-CB 3.23Å; K704-E708 WeakPolarHBondContact O-CB 3.46Å; K704-E708 PolarHBondContact O-N 3.32Å; K704-S728 WeakPolarHBondContact CE-OG 3.4Å; K704-N732 PolarHBondContact NZ-OD1 2.99Å; K704-N732 VanDerWaalsContact NZ-OD1 3.11Å
705	K	85.1	Confident	81.7	Confident	105 Å²	105	73 Å²	73	46%	0.457	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-36.8	-179.1	-67.3	170.9	178.7	162.5	0	112.5	N699 E700 S701 P702 V703 S709	N699-K705 WeakPolarHBondContact O-CE 3.37Å; E700-K705 PolarHBondContact O-NZ 3.42Å; S701-K705 PolarHBondContact O-N 3.44Å; P702-K705 PolarHBondContact O-N 3.46Å; V703-K705 VanDerWaalsContact C-N 3.33Å; V703-K705 PolarHBondContact O-N 3.33Å; K705-S709 WeakPolarHBondContact O-CB 3.37Å; K705-S709 PolarHBondContact O-N 3.37Å; K705-S709 PolarHBondContact O-OG 3.04Å
706	L	84.1	Confident	80.4	Confident	96 Å²	96	80 Å²	80	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-66.6	-49.4	173.5	-74.3	166.5	0	0	0	111.1	P702 V703 E708 S709 F710	P702-L706 WeakPolarHBondContact O-CB 3.3Å; P702-L706 VanDerWaalsContact O-CG 3.28Å; P702-L706 WeakPolarHBondContact O-CG 3.48Å; P702-L706 PolarHBondContact O-N 2.96Å; V703-L706 PolarHBondContact O-N 2.87Å; L706-E708 VanDerWaalsContact C-N 3.26Å; L706-E708 PolarHBondContact O-N 3.25Å; L706-S709 PolarHBondContact O-N 3.35Å; L706-F710 HydrophobicContact CD2-CE2 4.16Å; L706-F710 VanDerWaalsContact O-CD2 3.28Å; L706-F710 WeakPolarHBondContact O-CD2 3.38Å; L706-F710 PolarHBondContact O-N 3.12Å
707	C	83.2	Confident	79.3	Confident	16 Å²	16	82 Å²	82	11%	0.108	44%	0.443	C	S	.	.	H	α-helix	trans	-60.1	-36.9	177.1	-63.6	0	0	0	0	112.4	V703 K704 F710 D711 L712	V703-C707 PolarHBondContact O-N 2.9Å; V703-C707 PolarHBondContact O-SG 3.01Å; K704-C707 PolarHBondContact O-N 3.49Å; C707-F710 PolarHBondContact O-N 3.48Å; C707-D711 WeakPolarHBondContact O-CA 3.13Å; C707-D711 PolarHBondContact O-N 3.49Å; C707-L712 HydrophobicContact CB-CB 4.16Å; C707-L712 PolarHBondContact O-N 3Å
708	E	82	Confident	78.5	Confident	74 Å²	74	79.8 Å²	79.8	35%	0.346	44%	0.439	S	S	.	.	H	α-helix	trans	-72	-22.4	173.6	179.5	167.5	-121.6	0	0	114.1	K704 L706 N732	K704-E708 WeakPolarHBondContact CD-OE2 3.4Å; K704-E708 WeakPolarHBondContact CE-OE2 3.29Å; K704-E708 IonicContact NZ-OE1 3.74Å; K704-E708 PolarHBondContact NZ-OE1 2.98Å; K704-E708 IonicContact NZ-OE2 3.73Å; K704-E708 PolarHBondContact NZ-OE2 2.97Å; K704-E708 VanDerWaalsContact O-CB 3.23Å; K704-E708 WeakPolarHBondContact O-CB 3.46Å; K704-E708 PolarHBondContact O-N 3.32Å; L706-E708 VanDerWaalsContact C-N 3.26Å; L706-E708 PolarHBondContact O-N 3.25Å; E708-N732 PolarHBondContact OE1-OD1 3.16Å
709	S	84.5	Confident	77.9	Confident	88 Å²	88	83 Å²	83	62%	0.615	46%	0.463	S	S	*	.	H	α-helix	trans	-87.9	-8.3	175.8	-56.2	0	0	0	0	113.4	K705 L706	K705-S709 WeakPolarHBondContact O-CB 3.37Å; K705-S709 PolarHBondContact O-N 3.37Å; K705-S709 PolarHBondContact O-OG 3.04Å; L706-S709 PolarHBondContact O-N 3.35Å
710	F	83.6	Confident	77.6	Confident	142 Å²	142	83.9 Å²	83.9	62%	0.623	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.1	11.6	-176.1	-70	-65.3	0	0	0	112.6	L706 C707 L712	L706-F710 HydrophobicContact CD2-CE2 4.16Å; L706-F710 VanDerWaalsContact O-CD2 3.28Å; L706-F710 WeakPolarHBondContact O-CD2 3.38Å; L706-F710 PolarHBondContact O-N 3.12Å; C707-F710 PolarHBondContact O-N 3.48Å; F710-L712 HydrophobicContact CB-CD1 3.87Å; F710-L712 HydrophobicContact CB-CD2 4.34Å; F710-L712 HydrophobicContact CB-CG 3.69Å; F710-L712 WeakPolarHBondContact O-CG 3.48Å; F710-L712 PolarHBondContact O-N 2.93Å; F710-L712 VanDerWaalsContact O-N 3.17Å
711	D	78.1	Confident	77.7	Confident	152 Å²	152	83.6 Å²	83.6	81%	0.813	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	39.1	-176.8	-65.4	-51.6	0	0	0	114.7	C707 D713	C707-D711 WeakPolarHBondContact O-CA 3.13Å; C707-D711 PolarHBondContact O-N 3.49Å; D711-D713 PolarHBondContact O-N 3.48Å
712	L	76.6	Confident	77.8	Confident	82 Å²	82	85.8 Å²	85.8	43%	0.429	48%	0.48	S	S	.	.			trans	-87	100.3	-174.4	-59.9	176.6	0	0	0	112.2	C707 F710 T714	C707-L712 HydrophobicContact CB-CB 4.16Å; C707-L712 PolarHBondContact O-N 3Å; F710-L712 HydrophobicContact CB-CD1 3.87Å; F710-L712 HydrophobicContact CB-CD2 4.34Å; F710-L712 HydrophobicContact CB-CG 3.69Å; F710-L712 WeakPolarHBondContact O-CG 3.48Å; F710-L712 PolarHBondContact O-N 2.93Å; F710-L712 VanDerWaalsContact O-N 3.17Å; L712-T714 PolarHBondContact O-N 3.32Å; L712-T714 VanDerWaalsContact O-N 3.1Å
713	D	68.4	Low	78	Confident	101 Å²	101	86.9 Å²	86.9	54%	0.54	47%	0.472	S	S	.	.	S	Bend	trans	-70.2	3.3	171.8	-117.3	-17.3	0	0	0	113.9	D711 I720 K725	D711-D713 PolarHBondContact O-N 3.48Å; D713-I720 WeakPolarHBondContact O-CG1 3.35Å; D713-I720 PolarHBondContact O-N 3.42Å; D713-K725 WeakPolarHBondContact OD1-CE 3.47Å; D713-K725 IonicContact OD1-NZ 3.14Å
714	T	66.7	Low	78.4	Confident	75 Å²	75	86.1 Å²	86.1	46%	0.46	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	144.3	175	61.8	0	0	0	0	111.8	L712 K718 T719	L712-T714 PolarHBondContact O-N 3.32Å; L712-T714 VanDerWaalsContact O-N 3.1Å; T714-K718 WeakPolarHBondContact CA-O 3.29Å; T714-T719 HydrophobicContact CG2-CG2 4.28Å
715	V	62.1	Low	78.7	Confident	21 Å²	21	87.7 Å²	87.7	13%	0.127	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.3	-176.2	-165.5	0	0	0	0	108.3	V703 G717 K718 I720	V703-V715 HydrophobicContact CG1-CG1 3.39Å; V715-G717 PolarHBondContact O-N 3.45Å; V715-K718 PolarHBondContact N-O 3.42Å; V715-K718 WeakPolarHBondContact O-CA 3.49Å; V715-K718 WeakPolarHBondContact O-CB 3.49Å; V715-K718 PolarHBondContact O-N 3.19Å; V715-I720 HydrophobicContact CG2-CD1 4.5Å; V715-I720 HydrophobicContact CG2-CG1 3.94Å
716	D	60	Low	79	Confident	146 Å²	146	82.7 Å²	82.7	78%	0.781	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.1	-174.7	-55	-28.9	0	0	0	113.7	K718	D716-K718 PolarHBondContact O-N 3.36Å
717	G	63.3	Low	79.5	Confident	79 Å²	79	78.4 Å²	78.4	81%	0.814	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	6.1	-176.4	0	0	0	0	0	115.2	V715	V715-G717 PolarHBondContact O-N 3.45Å
718	K	69.5	Low	79.8	Confident	154 Å²	154	79.1 Å²	79.1	67%	0.67	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	138.1	176.7	-64.1	161.6	-172.5	162.1	0	109.4	T714 V715 D716	T714-K718 WeakPolarHBondContact CA-O 3.29Å; V715-K718 PolarHBondContact N-O 3.42Å; V715-K718 WeakPolarHBondContact O-CA 3.49Å; V715-K718 WeakPolarHBondContact O-CB 3.49Å; V715-K718 PolarHBondContact O-N 3.19Å; D716-K718 PolarHBondContact O-N 3.36Å
719	T	76.5	Confident	80.3	Confident	110 Å²	110	75.9 Å²	75.9	68%	0.675	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	144.2	173.9	46.6	0	0	0	0	110.7	T714 T721	T714-T719 HydrophobicContact CG2-CG2 4.28Å; T719-T721 PolarHBondContact O-N 2.93Å; T719-T721 VanDerWaalsContact O-N 3.12Å
720	I	80.6	Confident	80.7	Confident	37 Å²	37	71.7 Å²	71.7	19%	0.19	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-60	118.9	178.9	-65.7	174.9	0	0	0	109.6	D713 V715 Q724 K725	D713-I720 WeakPolarHBondContact O-CG1 3.35Å; D713-I720 PolarHBondContact O-N 3.42Å; V715-I720 HydrophobicContact CG2-CD1 4.5Å; V715-I720 HydrophobicContact CG2-CG1 3.94Å; I720-Q724 HydrophobicContact CG2-CB 3.55Å; I720-K725 HydrophobicContact CB-CG 4.36Å; I720-K725 HydrophobicContact CG2-CB 4.46Å; I720-K725 HydrophobicContact CG2-CG 3.57Å
721	T	87.7	Confident	81.1	Confident	72 Å²	72	65.3 Å²	65.3	44%	0.442	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-65.9	152	-178.2	65	0	0	0	0	111.4	T719 R723 Q724 K725	T719-T721 PolarHBondContact O-N 2.93Å; T719-T721 VanDerWaalsContact O-N 3.12Å; T721-R723 PolarHBondContact O-N 3.13Å; T721-Q724 WeakPolarHBondContact O-CA 3.19Å; T721-Q724 WeakPolarHBondContact O-CB 3.11Å; T721-Q724 PolarHBondContact O-N 3.21Å; T721-Q724 WeakPolarHBondContact OG1-CG 3.42Å; T721-Q724 PolarHBondContact OG1-N 3.41Å; T721-Q724 PolarHBondContact OG1-OE1 2.96Å; T721-K725 PolarHBondContact O-N 2.97Å
722	N	88.8	Confident	81.6	Confident	82 Å²	82	60.5 Å²	60.5	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-53.9	-28.3	177.8	-67.9	-47.9	0	0	0	113.1	F726 K760 W764	N722-F726 PolarHBondContact O-N 3.22Å; N722-F726 VanDerWaalsContact O-N 3.11Å; N722-K760 PolarHBondContact OD1-NZ 3.39Å; N722-W764 PolarHBondContact O-NE1 3.45Å; N722-W764 VanDerWaalsContact O-NE1 3.08Å
723	R	89.9	Confident	82.4	Confident	116 Å²	116	56.6 Å²	56.6	44%	0.438	32%	0.317	S	S	.	.	H	α-helix	trans	-71.2	-41.2	173.4	177.3	-178.6	169.3	-163.5	-2.2	112.7	K693 T721 F726 F727 M767	K693-R723 PolarHBondContact O-NH2 3.41Å; T721-R723 PolarHBondContact O-N 3.13Å; R723-F726 WeakPolarHBondContact O-CB 3.36Å; R723-F726 PolarHBondContact O-N 2.93Å; R723-F727 HydrophobicContact CG-CD2 4.33Å; R723-F727 HydrophobicContact CG-CE1 4.34Å; R723-F727 HydrophobicContact CG-CE2 3.82Å; R723-F727 HydrophobicContact CG-CZ 3.83Å; R723-F727 VanDerWaalsContact NE-CZ 3.28Å; R723-F727 WeakPolarHBondContact O-CG 3.45Å; R723-F727 PolarHBondContact O-N 3.38Å; R723-M767 HydrophobicContact CB-SD 3.92Å; R723-M767 HydrophobicContact CG-SD 4.18Å
724	Q	90.4	Very high	83.4	Confident	51 Å²	51	52.9 Å²	52.9	24%	0.238	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-39.6	175.9	-73.4	164.1	-68.8	0	0	111.4	Y698 I720 T721 F727 S728	Y698-Q724 HydrophobicContact CD2-CG 4.23Å; Y698-Q724 HydrophobicContact CE1-CB 4.2Å; Y698-Q724 HydrophobicContact CE2-CB 4.15Å; Y698-Q724 HydrophobicContact CE2-CG 3.66Å; I720-Q724 HydrophobicContact CG2-CB 3.55Å; T721-Q724 WeakPolarHBondContact O-CA 3.19Å; T721-Q724 WeakPolarHBondContact O-CB 3.11Å; T721-Q724 PolarHBondContact O-N 3.21Å; T721-Q724 WeakPolarHBondContact OG1-CG 3.42Å; T721-Q724 PolarHBondContact OG1-N 3.41Å; T721-Q724 PolarHBondContact OG1-OE1 2.96Å; Q724-F727 PolarHBondContact O-N 3.2Å; Q724-S728 PolarHBondContact O-N 2.78Å
725	K	90.8	Very high	84.4	Confident	42 Å²	42	56 Å²	56	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-44.6	170.9	-76.5	-139.1	168.5	-160.7	0	112.1	D713 I720 T721 F727 S728 A729 E758 W764	D713-K725 WeakPolarHBondContact OD1-CE 3.47Å; D713-K725 IonicContact OD1-NZ 3.14Å; I720-K725 HydrophobicContact CB-CG 4.36Å; I720-K725 HydrophobicContact CG2-CB 4.46Å; I720-K725 HydrophobicContact CG2-CG 3.57Å; T721-K725 PolarHBondContact O-N 2.97Å; K725-F727 PolarHBondContact O-N 3.44Å; K725-S728 PolarHBondContact O-N 3.45Å; K725-A729 WeakPolarHBondContact O-CB 3.4Å; K725-A729 PolarHBondContact O-N 3.41Å; K725-E758 WeakPolarHBondContact CD-OE1 3.44Å; K725-E758 WeakPolarHBondContact CD-OE2 3.37Å; K725-E758 VanDerWaalsContact NZ-CD 3.26Å; K725-E758 IonicContact NZ-OE1 2.77Å; K725-E758 PolarHBondContact NZ-OE1 3Å; K725-E758 IonicContact NZ-OE2 2.8Å; K725-E758 PolarHBondContact NZ-OE2 2.81Å; K725-W764 HydrophobicContact CB-CZ2 4.04Å
726	F	93.3	Very high	85.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.8	-45.4	172.6	167.3	-104.8	0	0	0	112.6	F689 N722 R723 A729 M730 F751 W764 M767 I768	F689-F726 AromaticContact CD1-CE1 3.88Å; F689-F726 HydrophobicContact CD1-CE1 3.88Å; F689-F726 HydrophobicContact CD1-CZ 4.13Å; F689-F726 HydrophobicContact CE1-CE1 4.12Å; N722-F726 PolarHBondContact O-N 3.22Å; N722-F726 VanDerWaalsContact O-N 3.11Å; R723-F726 WeakPolarHBondContact O-CB 3.36Å; R723-F726 PolarHBondContact O-N 2.93Å; F726-A729 PolarHBondContact O-N 3.01Å; F726-M730 HydrophobicContact CD2-CG 4.18Å; F726-M730 HydrophobicContact CE1-CG 4.17Å; F726-M730 HydrophobicContact CE2-CG 3.74Å; F726-M730 HydrophobicContact CE2-SD 3.82Å; F726-M730 HydrophobicContact CZ-CG 3.73Å; F726-M730 HydrophobicContact CZ-SD 3.7Å; F726-M730 WeakPolarHBondContact O-CG 3.37Å; F726-M730 PolarHBondContact O-N 2.93Å; F726-F751 AromaticContact CD2-CE2 3.82Å; F726-F751 HydrophobicContact CD2-CE2 3.82Å; F726-F751 AromaticContact CD2-CZ 3.76Å; F726-F751 HydrophobicContact CD2-CZ 3.76Å; F726-F751 AromaticContact CE2-CE2 3.83Å; F726-F751 HydrophobicContact CE2-CE2 3.83Å; F726-F751 AromaticContact CE2-CZ 3.59Å; F726-F751 HydrophobicContact CE2-CZ 3.59Å; F726-W764 HydrophobicContact CB-CD2 4.01Å; F726-W764 HydrophobicContact CB-CG 4.01Å; F726-W764 HydrophobicContact CB-CZ2 4.44Å; F726-W764 HydrophobicContact CD2-CB 4.13Å; F726-W764 HydrophobicContact CD2-CD2 4.03Å; F726-W764 HydrophobicContact CD2-CE3 4.23Å; F726-W764 AromaticContact CD2-CG 3.99Å; F726-W764 HydrophobicContact CD2-CG 3.99Å; F726-W764 HydrophobicContact CG-CG 4.4Å; F726-M767 HydrophobicContact CB-CE 3.72Å; F726-M767 HydrophobicContact CD1-CE 3.54Å; F726-M767 HydrophobicContact CD2-CE 4.29Å; F726-M767 HydrophobicContact CE1-CE 4.25Å; F726-M767 HydrophobicContact CG-CE 3.57Å; F726-I768 HydrophobicContact CE2-CD1 4.07Å; F726-I768 HydrophobicContact CZ-CD1 4.2Å
727	F	92.9	Very high	86.6	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176.6	-66.4	-22.2	0	0	0	112.3	Y690 K693 Y698 N699 R723 Q724 K725 M730 G731	Y690-F727 AromaticContact CD2-CD1 3.83Å; Y690-F727 HydrophobicContact CD2-CD1 3.83Å; Y690-F727 HydrophobicContact CD2-CE1 4.36Å; Y690-F727 HydrophobicContact CE2-CB 4.44Å; Y690-F727 HydrophobicContact CE2-CD1 4.25Å; K693-F727 HydrophobicContact CB-CE1 4.04Å; K693-F727 HydrophobicContact CB-CZ 3.71Å; K693-F727 VanDerWaalsContact O-CZ 3.24Å; K693-F727 WeakPolarHBondContact O-CZ 3.42Å; Y698-F727 HydrophobicContact CD1-CB 3.49Å; Y698-F727 VanDerWaalsContact CD1-CB 3.49Å; Y698-F727 AromaticContact CD1-CD2 3.98Å; Y698-F727 HydrophobicContact CD1-CD2 3.98Å; Y698-F727 HydrophobicContact CD1-CG 4.25Å; Y698-F727 HydrophobicContact CE1-CB 4.12Å; Y698-F727 HydrophobicContact CG-CB 4.24Å; Y698-F727 AromaticContact CG-CD2 3.87Å; Y698-F727 HydrophobicContact CG-CD2 3.87Å; N699-F727 PolarHBondContact ND2-O 2.97Å; N699-F727 PolarHBondContact OD1-O 3.49Å; R723-F727 HydrophobicContact CG-CD2 4.33Å; R723-F727 HydrophobicContact CG-CE1 4.34Å; R723-F727 HydrophobicContact CG-CE2 3.82Å; R723-F727 HydrophobicContact CG-CZ 3.83Å; R723-F727 VanDerWaalsContact NE-CZ 3.28Å; R723-F727 WeakPolarHBondContact O-CG 3.45Å; R723-F727 PolarHBondContact O-N 3.38Å; Q724-F727 PolarHBondContact O-N 3.2Å; K725-F727 PolarHBondContact O-N 3.44Å; F727-M730 PolarHBondContact O-N 2.85Å; F727-G731 PolarHBondContact O-N 3.06Å
728	S	90.9	Very high	87.5	Confident	31 Å²	31	47.2 Å²	47.2	22%	0.217	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-48.4	176.8	-150.9	0	0	0	0	110.9	K704 Q724 K725 M730 G731 N732	K704-S728 WeakPolarHBondContact CE-OG 3.4Å; Q724-S728 PolarHBondContact O-N 2.78Å; K725-S728 PolarHBondContact O-N 3.45Å; S728-M730 VanDerWaalsContact C-N 3.34Å; S728-M730 PolarHBondContact O-N 3.21Å; S728-G731 WeakPolarHBondContact O-CA 3.49Å; S728-G731 PolarHBondContact O-N 2.97Å; S728-N732 VanDerWaalsContact O-CG 3.29Å; S728-N732 PolarHBondContact O-N 2.83Å; S728-N732 PolarHBondContact O-OD1 2.83Å
729	A	92.5	Very high	87.9	Confident	7 Å²	7	43.3 Å²	43.3	6%	0.058	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-43.1	175.9	0	0	0	0	0	112.9	K725 F726 V733 F751 I754 W764	K725-A729 WeakPolarHBondContact O-CB 3.4Å; K725-A729 PolarHBondContact O-N 3.41Å; F726-A729 PolarHBondContact O-N 3.01Å; A729-V733 WeakPolarHBondContact O-CG2 3.35Å; A729-V733 PolarHBondContact O-N 3.14Å; A729-V733 VanDerWaalsContact O-N 3.13Å; A729-F751 HydrophobicContact CB-CD2 4.43Å; A729-F751 HydrophobicContact CB-CE2 4.38Å; A729-I754 HydrophobicContact CB-CG2 3.74Å; A729-W764 HydrophobicContact CB-CH2 3.51Å; A729-W764 HydrophobicContact CB-CZ2 4.4Å; A729-W764 HydrophobicContact CB-CZ3 3.76Å
730	M	92.9	Very high	88.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-42.2	173.8	-66.1	-97.6	65.5	0	0	111.8	W683 L686 Y690 F726 F727 S728 L734 F751	W683-M730 HydrophobicContact CE3-CE 4.39Å; W683-M730 HydrophobicContact CH2-CE 3.29Å; W683-M730 HydrophobicContact CZ2-CE 4.16Å; W683-M730 HydrophobicContact CZ3-CE 3.43Å; W683-M730 VanDerWaalsContact CZ3-CE 3.43Å; L686-M730 HydrophobicContact CB-CE 4.44Å; L686-M730 HydrophobicContact CB-SD 4.1Å; L686-M730 HydrophobicContact CD1-CE 4.43Å; Y690-M730 HydrophobicContact CD2-CB 3.66Å; Y690-M730 HydrophobicContact CD2-CG 3.96Å; Y690-M730 HydrophobicContact CE2-CB 3.68Å; Y690-M730 HydrophobicContact CE2-CG 4.47Å; Y690-M730 HydrophobicContact CG-CB 4.31Å; Y690-M730 HydrophobicContact CG-CG 4.47Å; F726-M730 HydrophobicContact CD2-CG 4.18Å; F726-M730 HydrophobicContact CE1-CG 4.17Å; F726-M730 HydrophobicContact CE2-CG 3.74Å; F726-M730 HydrophobicContact CE2-SD 3.82Å; F726-M730 HydrophobicContact CZ-CG 3.73Å; F726-M730 HydrophobicContact CZ-SD 3.7Å; F726-M730 WeakPolarHBondContact O-CG 3.37Å; F726-M730 PolarHBondContact O-N 2.93Å; F727-M730 PolarHBondContact O-N 2.85Å; S728-M730 VanDerWaalsContact C-N 3.34Å; S728-M730 PolarHBondContact O-N 3.21Å; M730-L734 WeakPolarHBondContact O-CB 3.42Å; M730-L734 VanDerWaalsContact O-CG 3.25Å; M730-L734 WeakPolarHBondContact O-CG 3.38Å; M730-L734 PolarHBondContact O-N 3.03Å; M730-F751 HydrophobicContact CE-CB 4.24Å; M730-F751 HydrophobicContact CE-CD2 3.65Å; M730-F751 HydrophobicContact CE-CE2 4.13Å; M730-F751 HydrophobicContact CE-CG 3.91Å; M730-F751 HydrophobicContact CG-CD2 4.49Å; M730-F751 HydrophobicContact CG-CE2 4.24Å; M730-F751 HydrophobicContact SD-CD2 4.49Å; M730-F751 HydrophobicContact SD-CE2 4.4Å
731	G	90.7	Very high	88.1	Confident	8 Å²	8	48.6 Å²	48.6	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-45.9	177.4	0	0	0	0	0	112.7	N699 F727 S728 L734 Q735	N699-G731 VanDerWaalsContact ND2-CA 3.29Å; N699-G731 WeakPolarHBondContact ND2-CA 3.31Å; N699-G731 PolarHBondContact ND2-N 3.08Å; F727-G731 PolarHBondContact O-N 3.06Å; S728-G731 WeakPolarHBondContact O-CA 3.49Å; S728-G731 PolarHBondContact O-N 2.97Å; G731-L734 PolarHBondContact O-N 3.33Å; G731-Q735 WeakPolarHBondContact O-CB 3.25Å; G731-Q735 PolarHBondContact O-N 3.33Å
732	N	90.1	Very high	88	Confident	51 Å²	51	48.9 Å²	48.9	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-70.2	-36.4	-176.5	-63.9	21	0	0	0	111	K704 E708 S728 G736	K704-N732 PolarHBondContact NZ-OD1 2.99Å; K704-N732 VanDerWaalsContact NZ-OD1 3.11Å; E708-N732 PolarHBondContact OE1-OD1 3.16Å; S728-N732 VanDerWaalsContact O-CG 3.29Å; S728-N732 PolarHBondContact O-N 2.83Å; S728-N732 PolarHBondContact O-OD1 2.83Å; N732-G736 PolarHBondContact O-N 3.38Å
733	V	92	Very high	88	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-45.1	169.6	174.8	0	0	0	0	111.2	W683 A729 H737 K747 A750 F751 I754	W683-V733 HydrophobicContact CH2-CB 4.2Å; W683-V733 HydrophobicContact CH2-CG1 3.52Å; W683-V733 HydrophobicContact CZ2-CG1 4.43Å; W683-V733 HydrophobicContact CZ3-CG1 3.98Å; A729-V733 WeakPolarHBondContact O-CG2 3.35Å; A729-V733 PolarHBondContact O-N 3.14Å; A729-V733 VanDerWaalsContact O-N 3.13Å; V733-H737 VanDerWaalsContact O-CB 3.26Å; V733-H737 WeakPolarHBondContact O-CB 3.23Å; V733-H737 PolarHBondContact O-N 2.96Å; V733-H737 PolarHBondContact O-ND1 2.87Å; V733-K747 HydrophobicContact CG1-CB 4.12Å; V733-K747 HydrophobicContact CG1-CG 4.48Å; V733-K747 WeakPolarHBondContact CG1-O 3.39Å; V733-A750 HydrophobicContact CG1-CB 4.16Å; V733-A750 HydrophobicContact CG2-CB 4.11Å; V733-F751 HydrophobicContact CG2-CB 4.22Å; V733-I754 HydrophobicContact CG2-CD1 3.57Å
734	L	90.8	Very high	88	Confident	22 Å²	22	45.7 Å²	45.7	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-61	-51.1	178.3	-75.4	166.6	0	0	0	111.5	W683 M687 Y690 M730 G731 G736 H737 V738	W683-L734 HydrophobicContact CZ2-CD2 3.95Å; W683-L734 HydrophobicContact CZ2-CG 4.37Å; M687-L734 HydrophobicContact CE-CD1 3.83Å; M687-L734 HydrophobicContact CE-CD2 3.84Å; M687-L734 HydrophobicContact CE-CG 4.43Å; M687-L734 HydrophobicContact SD-CD1 3.89Å; M687-L734 HydrophobicContact SD-CD2 3.97Å; M687-L734 HydrophobicContact SD-CG 4.27Å; Y690-L734 HydrophobicContact CD1-CD1 4.49Å; Y690-L734 HydrophobicContact CE1-CD1 3.68Å; M730-L734 WeakPolarHBondContact O-CB 3.42Å; M730-L734 VanDerWaalsContact O-CG 3.25Å; M730-L734 WeakPolarHBondContact O-CG 3.38Å; M730-L734 PolarHBondContact O-N 3.03Å; G731-L734 PolarHBondContact O-N 3.33Å; L734-G736 VanDerWaalsContact C-N 3.34Å; L734-G736 PolarHBondContact O-N 3.25Å; L734-H737 PolarHBondContact O-N 2.88Å; L734-V738 HydrophobicContact CB-CG2 4.31Å; L734-V738 HydrophobicContact CD2-CG2 3.7Å; L734-V738 WeakPolarHBondContact O-CB 3.15Å; L734-V738 VanDerWaalsContact O-CG2 3.23Å; L734-V738 WeakPolarHBondContact O-CG2 3.08Å; L734-V738 PolarHBondContact O-N 3.13Å
735	Q	85.9	Confident	88	Confident	140 Å²	140	45 Å²	45	65%	0.654	24%	0.237	S	C	*	.	H	α-helix	trans	-55.9	-46.4	-179.6	-174.7	176.1	-0.2	0	0	111.9	G731	G731-Q735 WeakPolarHBondContact O-CB 3.25Å; G731-Q735 PolarHBondContact O-N 3.33Å
736	G	83.5	Confident	88	Confident	16 Å²	16	43.3 Å²	43.3	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-72	-52.1	176.6	0	0	0	0	0	113.8	N732 L734 Y740	N732-G736 PolarHBondContact O-N 3.38Å; L734-G736 VanDerWaalsContact C-N 3.34Å; L734-G736 PolarHBondContact O-N 3.25Å; G736-Y740 VanDerWaalsContact O-CD2 3.22Å; G736-Y740 WeakPolarHBondContact O-CD2 3.43Å
737	H	86.4	Confident	87.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-87.2	-22.2	-166.9	-69.9	75.3	0	0	0	114.6	V733 L734 K741 R742 K747 A750 Y809	V733-H737 VanDerWaalsContact O-CB 3.26Å; V733-H737 WeakPolarHBondContact O-CB 3.23Å; V733-H737 PolarHBondContact O-N 2.96Å; V733-H737 PolarHBondContact O-ND1 2.87Å; L734-H737 PolarHBondContact O-N 2.88Å; H737-K741 PolarHBondContact O-N 2.88Å; H737-R742 HydrophobicContact CB-CB 4.28Å; H737-R742 PolarHBondContact O-N 3.29Å; H737-K747 HydrophobicContact CB-CG 3.76Å; H737-A750 VanDerWaalsContact CE1-CB 3.42Å; H737-A750 WeakPolarHBondContact CE1-CB 3.14Å; H737-Y809 PolarHBondContact CE1-O 3.28Å
738	V	81.1	Confident	88	Confident	45 Å²	45	43.8 Å²	43.8	27%	0.273	23%	0.233	S	C	.	.	H	α-helix	trans	-74.8	-39.1	173.6	179.6	0	0	0	0	110.6	L734 Y740 K741	L734-V738 HydrophobicContact CB-CG2 4.31Å; L734-V738 HydrophobicContact CD2-CG2 3.7Å; L734-V738 WeakPolarHBondContact O-CB 3.15Å; L734-V738 VanDerWaalsContact O-CG2 3.23Å; L734-V738 WeakPolarHBondContact O-CG2 3.08Å; L734-V738 PolarHBondContact O-N 3.13Å; V738-Y740 VanDerWaalsContact C-N 3.33Å; V738-Y740 PolarHBondContact O-N 3.33Å; V738-K741 PolarHBondContact O-N 2.95Å
739	A	77.9	Confident	88.2	Confident	72 Å²	72	44 Å²	44	60%	0.595	23%	0.23	S	C	*	.	H	α-helix	trans	-54.1	-48.9	175.5	0	0	0	0	0	111.7	K741	A739-K741 VanDerWaalsContact C-N 3.28Å; A739-K741 PolarHBondContact O-N 2.87Å
740	Y	81.3	Confident	88.2	Confident	66 Å²	66	43.7 Å²	43.7	26%	0.259	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	17.9	176	-58.5	-68.8	0	0	0	114.5	G736 V738 R742 I813 L816 K817	G736-Y740 VanDerWaalsContact O-CD2 3.22Å; G736-Y740 WeakPolarHBondContact O-CD2 3.43Å; V738-Y740 VanDerWaalsContact C-N 3.33Å; V738-Y740 PolarHBondContact O-N 3.33Å; Y740-R742 PolarHBondContact O-N 3.07Å; Y740-I813 HydrophobicContact CD2-CB 3.83Å; Y740-I813 HydrophobicContact CD2-CD1 4.5Å; Y740-I813 HydrophobicContact CD2-CG2 3.72Å; Y740-I813 HydrophobicContact CE2-CB 4.27Å; Y740-I813 HydrophobicContact CG-CG2 4.29Å; Y740-L816 HydrophobicContact CD1-CB 3.74Å; Y740-L816 HydrophobicContact CD1-CD1 3.89Å; Y740-L816 HydrophobicContact CD1-CG 4.46Å; Y740-L816 HydrophobicContact CE1-CB 3.83Å; Y740-L816 HydrophobicContact CG-CB 4.17Å; Y740-L816 HydrophobicContact CG-CD1 3.94Å; Y740-K817 HydrophobicContact CE2-CG 4.03Å
741	K	81	Confident	88.4	Confident	193 Å²	193	43.7 Å²	43.7	84%	0.839	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	32.1	175.1	-59.9	176.8	-177.7	169.3	0	115.1	H737 V738 A739	H737-K741 PolarHBondContact O-N 2.88Å; V738-K741 PolarHBondContact O-N 2.95Å; A739-K741 VanDerWaalsContact C-N 3.28Å; A739-K741 PolarHBondContact O-N 2.87Å
742	R	85	Confident	88.5	Confident	78 Å²	78	43.3 Å²	43.3	29%	0.294	22%	0.223	S	C	.	.			trans	-73.3	156	-172.3	-67.6	-55.4	-151.1	175.4	7.4	113.2	H737 Y740 A746 S812 I813 H815 L816	H737-R742 HydrophobicContact CB-CB 4.28Å; H737-R742 PolarHBondContact O-N 3.29Å; Y740-R742 PolarHBondContact O-N 3.07Å; R742-A746 HydrophobicContact CB-CB 4.12Å; R742-S812 PolarHBondContact NE-O 3.34Å; R742-S812 PolarHBondContact NH2-O 3.31Å; R742-I813 HydrophobicContact CG-CG2 3.82Å; R742-H815 PolarHBondContact NH2-NE2 3.29Å; R742-L816 VanDerWaalsContact CZ-CD1 3.48Å
743	S	87.9	Confident	88.7	Confident	68 Å²	68	40.9 Å²	40.9	48%	0.476	21%	0.21	S	C	.	.			trans	-62.2	157.6	-175.6	69.7	0	0	0	0	113.1	D745 A746 K747	S743-D745 PolarHBondContact O-N 3.06Å; S743-A746 PolarHBondContact O-N 3.22Å; S743-A746 VanDerWaalsContact O-N 3.16Å; S743-A746 WeakPolarHBondContact OG-CB 3.25Å; S743-A746 PolarHBondContact OG-N 2.88Å; S743-A746 VanDerWaalsContact OG-N 3.14Å; S743-K747 WeakPolarHBondContact O-CG 3.48Å; S743-K747 PolarHBondContact O-N 3.19Å
744	K	89.8	Confident	88.7	Confident	62 Å²	62	42 Å²	42	27%	0.27	22%	0.216	S	C	.	.	H	α-helix	trans	-57.9	-34.9	174.8	-60.8	-174.2	-176.8	179.9	0	112.5	G679 H681 W683 D684 F748	G679-K744 PolarHBondContact O-NZ 3.01Å; G679-K744 VanDerWaalsContact O-NZ 3.11Å; H681-K744 HydrophobicContact CB-CB 3.96Å; H681-K744 HydrophobicContact CB-CD 3.65Å; H681-K744 HydrophobicContact CB-CG 4.49Å; H681-K744 PolarHBondContact CE1-O 3.37Å; H681-K744 VanDerWaalsContact CE1-O 3.24Å; H681-K744 WeakPolarHBondContact ND1-CB 3.49Å; H681-K744 PolarHBondContact ND1-O 3Å; W683-K744 HydrophobicContact CB-CB 3.99Å; W683-K744 HydrophobicContact CG-CB 4.35Å; D684-K744 WeakPolarHBondContact OD1-CD 3.49Å; D684-K744 WeakPolarHBondContact OD1-CE 3.04Å; D684-K744 IonicContact OD1-NZ 3.38Å; D684-K744 PolarHBondContact OD1-NZ 3.41Å; D684-K744 IonicContact OD2-NZ 3.25Å; D684-K744 PolarHBondContact OD2-NZ 3.38Å; K744-F748 VanDerWaalsContact O-CB 3.31Å; K744-F748 WeakPolarHBondContact O-CB 3.25Å; K744-F748 PolarHBondContact O-N 3.2Å
745	D	90.2	Very high	88.9	Confident	37 Å²	37	41 Å²	41	20%	0.198	21%	0.211	C	C	.	.	H	α-helix	trans	-68.2	-42	175.5	178.6	86	0	0	0	112.2	R601 H681 S743 F748 K749	R601-D745 IonicContact CZ-OD1 3.93Å; R601-D745 IonicContact NH1-OD1 3.4Å; R601-D745 PolarHBondContact NH1-OD1 2.9Å; H681-D745 WeakPolarHBondContact CE1-CA 3.3Å; H681-D745 PolarHBondContact CE1-N 3.38Å; H681-D745 IonicContact NE2-OD1 3.05Å; S743-D745 PolarHBondContact O-N 3.06Å; D745-F748 PolarHBondContact O-N 3Å; D745-K749 WeakPolarHBondContact O-CB 3.29Å; D745-K749 WeakPolarHBondContact O-CG 3.46Å; D745-K749 PolarHBondContact O-N 3.08Å; D745-K749 WeakPolarHBondContact OD1-CE 3.38Å; D745-K749 IonicContact OD1-NZ 3.28Å; D745-K749 WeakPolarHBondContact OD2-CD 3.43Å; D745-K749 WeakPolarHBondContact OD2-CE 3.4Å; D745-K749 IonicContact OD2-NZ 2.82Å; D745-K749 PolarHBondContact OD2-NZ 3.29Å
746	A	91.3	Very high	89.2	Confident	6 Å²	6	34.7 Å²	34.7	5%	0.05	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-46.1	173.6	0	0	0	0	0	112	R742 S743 F748 K749 A750	R742-A746 HydrophobicContact CB-CB 4.12Å; S743-A746 PolarHBondContact O-N 3.22Å; S743-A746 VanDerWaalsContact O-N 3.16Å; S743-A746 WeakPolarHBondContact OG-CB 3.25Å; S743-A746 PolarHBondContact OG-N 2.88Å; S743-A746 VanDerWaalsContact OG-N 3.14Å; A746-F748 PolarHBondContact O-N 2.72Å; A746-K749 PolarHBondContact O-N 2.91Å; A746-A750 WeakPolarHBondContact O-CB 3.42Å; A746-A750 PolarHBondContact O-N 3.01Å
747	K	92.6	Very high	89.6	Confident	16 Å²	16	36.5 Å²	36.5	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-46.4	174	-68.8	179.2	178.7	178	0	111.7	E618 W683 V733 H737 S743 A750 F751	E618-K747 IonicContact OE2-NZ 3.68Å; E618-K747 PolarHBondContact OE2-NZ 3.25Å; W683-K747 HydrophobicContact CD2-CB 3.64Å; W683-K747 HydrophobicContact CD2-CD 4.15Å; W683-K747 HydrophobicContact CE3-CB 3.61Å; W683-K747 HydrophobicContact CG-CB 4.38Å; W683-K747 HydrophobicContact CH2-CB 3.79Å; W683-K747 HydrophobicContact CH2-CD 4.47Å; W683-K747 HydrophobicContact CZ2-CB 3.85Å; W683-K747 HydrophobicContact CZ2-CD 3.73Å; W683-K747 HydrophobicContact CZ2-CG 4.26Å; W683-K747 VanDerWaalsContact CZ3-C 3.47Å; W683-K747 HydrophobicContact CZ3-CB 3.67Å; W683-K747 VanDerWaalsContact CZ3-O 3.3Å; W683-K747 WeakPolarHBondContact CZ3-O 3.43Å; V733-K747 HydrophobicContact CG1-CB 4.12Å; V733-K747 HydrophobicContact CG1-CG 4.48Å; V733-K747 WeakPolarHBondContact CG1-O 3.39Å; H737-K747 HydrophobicContact CB-CG 3.76Å; S743-K747 WeakPolarHBondContact O-CG 3.48Å; S743-K747 PolarHBondContact O-N 3.19Å; K747-A750 PolarHBondContact O-N 3.34Å; K747-F751 PolarHBondContact O-N 2.85Å
748	F	94.5	Very high	89.7	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-49.7	178	-178.3	-98.2	0	0	0	111.9	L600 R601 I604 A682 W683 L686 K744 D745 A746 A750 F751 I752	L600-F748 HydrophobicContact CG-CZ 4.38Å; R601-F748 HydrophobicContact CB-CD1 4.28Å; R601-F748 HydrophobicContact CB-CE1 3.76Å; R601-F748 HydrophobicContact CB-CZ 4.25Å; I604-F748 HydrophobicContact CD1-CE2 4.41Å; I604-F748 HydrophobicContact CD1-CZ 4.26Å; A682-F748 HydrophobicContact CB-CD2 3.89Å; A682-F748 HydrophobicContact CB-CE2 3.57Å; A682-F748 HydrophobicContact CB-CZ 4Å; W683-F748 HydrophobicContact CB-CB 4.49Å; W683-F748 HydrophobicContact CE3-CB 4.22Å; L686-F748 HydrophobicContact CD1-CD2 3.76Å; L686-F748 HydrophobicContact CD1-CE2 4.04Å; K744-F748 VanDerWaalsContact O-CB 3.31Å; K744-F748 WeakPolarHBondContact O-CB 3.25Å; K744-F748 PolarHBondContact O-N 3.2Å; D745-F748 PolarHBondContact O-N 3Å; A746-F748 PolarHBondContact O-N 2.72Å; F748-A750 VanDerWaalsContact C-N 3.3Å; F748-A750 PolarHBondContact O-N 3.31Å; F748-F751 PolarHBondContact O-N 2.97Å; F748-F751 VanDerWaalsContact O-N 3.12Å; F748-I752 HydrophobicContact CD1-CG1 4.1Å; F748-I752 HydrophobicContact CE1-CD1 4.32Å; F748-I752 HydrophobicContact CE1-CG1 3.76Å; F748-I752 HydrophobicContact CE2-CD1 4.21Å; F748-I752 HydrophobicContact CE2-CG1 4.32Å; F748-I752 HydrophobicContact CZ-CD1 3.93Å; F748-I752 HydrophobicContact CZ-CG1 3.89Å; F748-I752 WeakPolarHBondContact O-CG1 3.26Å; F748-I752 PolarHBondContact O-N 3.05Å
749	K	94.2	Very high	90.1	Very high	36 Å²	36	39.3 Å²	39.3	16%	0.157	21%	0.206	C	C	.	.	H	α-helix	trans	-57.1	-42	176.2	-76.2	168.9	177.8	167.4	0	112	R593 C597 D745 A746 I752 S753	R593-K749 VanDerWaalsContact O-CE 3.29Å; R593-K749 WeakPolarHBondContact O-CE 3.35Å; C597-K749 HydrophobicContact CB-CG 3.71Å; D745-K749 WeakPolarHBondContact O-CB 3.29Å; D745-K749 WeakPolarHBondContact O-CG 3.46Å; D745-K749 PolarHBondContact O-N 3.08Å; D745-K749 WeakPolarHBondContact OD1-CE 3.38Å; D745-K749 IonicContact OD1-NZ 3.28Å; D745-K749 WeakPolarHBondContact OD2-CD 3.43Å; D745-K749 WeakPolarHBondContact OD2-CE 3.4Å; D745-K749 IonicContact OD2-NZ 2.82Å; D745-K749 PolarHBondContact OD2-NZ 3.29Å; A746-K749 PolarHBondContact O-N 2.91Å; K749-I752 PolarHBondContact O-N 3.44Å; K749-S753 PolarHBondContact O-N 2.92Å; K749-S753 PolarHBondContact O-OG 2.83Å
750	A	94	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.8	-46.6	174.4	0	0	0	0	0	112.4	V733 H737 A746 K747 F748 S753 I754 Y809	V733-A750 HydrophobicContact CG1-CB 4.16Å; V733-A750 HydrophobicContact CG2-CB 4.11Å; H737-A750 VanDerWaalsContact CE1-CB 3.42Å; H737-A750 WeakPolarHBondContact CE1-CB 3.14Å; A746-A750 WeakPolarHBondContact O-CB 3.42Å; A746-A750 PolarHBondContact O-N 3.01Å; K747-A750 PolarHBondContact O-N 3.34Å; F748-A750 VanDerWaalsContact C-N 3.3Å; F748-A750 PolarHBondContact O-N 3.31Å; A750-S753 WeakPolarHBondContact O-CB 3.49Å; A750-S753 PolarHBondContact O-N 3.03Å; A750-I754 WeakPolarHBondContact O-CG1 3.37Å; A750-I754 PolarHBondContact O-N 3.31Å; A750-Y809 WeakPolarHBondContact CB-O 3.49Å
751	F	95.2	Very high	91.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-42.4	176.4	170.6	-102.3	0	0	0	112.9	W683 L686 F726 A729 M730 V733 K747 F748 S753 I754 A755 W764	W683-F751 HydrophobicContact CZ3-CB 3.98Å; L686-F751 HydrophobicContact CD1-CD1 3.45Å; L686-F751 VanDerWaalsContact CD1-CD1 3.45Å; L686-F751 HydrophobicContact CD1-CE1 3.7Å; L686-F751 HydrophobicContact CD1-CG 4.19Å; L686-F751 HydrophobicContact CD2-CE1 4.26Å; F726-F751 AromaticContact CD2-CE2 3.82Å; F726-F751 HydrophobicContact CD2-CE2 3.82Å; F726-F751 AromaticContact CD2-CZ 3.76Å; F726-F751 HydrophobicContact CD2-CZ 3.76Å; F726-F751 AromaticContact CE2-CE2 3.83Å; F726-F751 HydrophobicContact CE2-CE2 3.83Å; F726-F751 AromaticContact CE2-CZ 3.59Å; F726-F751 HydrophobicContact CE2-CZ 3.59Å; A729-F751 HydrophobicContact CB-CD2 4.43Å; A729-F751 HydrophobicContact CB-CE2 4.38Å; M730-F751 HydrophobicContact CE-CB 4.24Å; M730-F751 HydrophobicContact CE-CD2 3.65Å; M730-F751 HydrophobicContact CE-CE2 4.13Å; M730-F751 HydrophobicContact CE-CG 3.91Å; M730-F751 HydrophobicContact CG-CD2 4.49Å; M730-F751 HydrophobicContact CG-CE2 4.24Å; M730-F751 HydrophobicContact SD-CD2 4.49Å; M730-F751 HydrophobicContact SD-CE2 4.4Å; V733-F751 HydrophobicContact CG2-CB 4.22Å; K747-F751 PolarHBondContact O-N 2.85Å; F748-F751 PolarHBondContact O-N 2.97Å; F748-F751 VanDerWaalsContact O-N 3.12Å; F751-S753 VanDerWaalsContact C-N 3.32Å; F751-S753 PolarHBondContact O-N 3.29Å; F751-I754 PolarHBondContact O-N 3.42Å; F751-A755 VanDerWaalsContact O-CB 3.29Å; F751-A755 WeakPolarHBondContact O-CB 3.5Å; F751-A755 PolarHBondContact O-N 2.69Å; F751-W764 HydrophobicContact CD2-CZ3 4.4Å; F751-W764 AromaticContact CE2-CE3 3.55Å; F751-W764 HydrophobicContact CE2-CE3 3.55Å; F751-W764 AromaticContact CE2-CZ3 3.66Å; F751-W764 HydrophobicContact CE2-CZ3 3.66Å; F751-W764 HydrophobicContact CZ-CD2 4.44Å; F751-W764 AromaticContact CZ-CE3 3.51Å; F751-W764 HydrophobicContact CZ-CE3 3.51Å; F751-W764 HydrophobicContact CZ-CZ3 4.09Å
752	I	94.6	Very high	91.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-38.7	176.2	-60.9	-59.7	0	0	0	111	C597 L600 F748 K749 A755 L756 L761	C597-I752 VanDerWaalsContact SG-CG2 3.55Å; L600-I752 HydrophobicContact CD2-CD1 3.73Å; L600-I752 HydrophobicContact CD2-CG1 4.42Å; F748-I752 HydrophobicContact CD1-CG1 4.1Å; F748-I752 HydrophobicContact CE1-CD1 4.32Å; F748-I752 HydrophobicContact CE1-CG1 3.76Å; F748-I752 HydrophobicContact CE2-CD1 4.21Å; F748-I752 HydrophobicContact CE2-CG1 4.32Å; F748-I752 HydrophobicContact CZ-CD1 3.93Å; F748-I752 HydrophobicContact CZ-CG1 3.89Å; F748-I752 WeakPolarHBondContact O-CG1 3.26Å; F748-I752 PolarHBondContact O-N 3.05Å; K749-I752 PolarHBondContact O-N 3.44Å; I752-A755 PolarHBondContact O-N 3.23Å; I752-L756 HydrophobicContact CG2-CD1 4Å; I752-L756 HydrophobicContact CG2-CG 4.43Å; I752-L756 WeakPolarHBondContact O-CG 3.32Å; I752-L756 PolarHBondContact O-N 3.41Å; I752-L761 HydrophobicContact CD1-CD1 3.66Å
753	S	93	Very high	92.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-47.8	172	-65.9	0	0	0	0	112.4	K749 A750 F751 A755 L756 N757	K749-S753 PolarHBondContact O-N 2.92Å; K749-S753 PolarHBondContact O-OG 2.83Å; A750-S753 WeakPolarHBondContact O-CB 3.49Å; A750-S753 PolarHBondContact O-N 3.03Å; F751-S753 VanDerWaalsContact C-N 3.32Å; F751-S753 PolarHBondContact O-N 3.29Å; S753-A755 VanDerWaalsContact C-N 3.32Å; S753-A755 PolarHBondContact O-N 3.09Å; S753-L756 PolarHBondContact O-N 2.92Å; S753-N757 PolarHBondContact O-N 2.94Å; S753-N757 PolarHBondContact O-OD1 3.25Å; S753-N757 VanDerWaalsContact O-OD1 3.05Å
754	I	93.3	Very high	92.5	Very high	24 Å²	24	23 Å²	23	12%	0.123	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-42.6	175.7	-59.4	174.6	0	0	0	111	A729 V733 A750 F751 L756 N757 E758 W764 Y809	A729-I754 HydrophobicContact CB-CG2 3.74Å; V733-I754 HydrophobicContact CG2-CD1 3.57Å; A750-I754 WeakPolarHBondContact O-CG1 3.37Å; A750-I754 PolarHBondContact O-N 3.31Å; F751-I754 PolarHBondContact O-N 3.42Å; I754-L756 VanDerWaalsContact C-N 3.29Å; I754-L756 PolarHBondContact O-N 3.49Å; I754-N757 PolarHBondContact O-N 3.17Å; I754-E758 WeakPolarHBondContact O-CB 3.39Å; I754-E758 PolarHBondContact O-N 2.86Å; I754-W764 HydrophobicContact CG2-CH2 4.33Å; I754-Y809 HydrophobicContact CD1-CD2 4.02Å; I754-Y809 HydrophobicContact CD1-CG 3.98Å; I754-Y809 VanDerWaalsContact CG1-CB 3.47Å; I754-Y809 HydrophobicContact CG1-CD1 4.16Å; I754-Y809 HydrophobicContact CG1-CD2 4.28Å; I754-Y809 HydrophobicContact CG1-CG 3.73Å
755	A	93.4	Very high	92.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.9	-29.4	-177.7	0	0	0	0	0	113.6	F751 I752 S753 K760 L761 W764	F751-A755 VanDerWaalsContact O-CB 3.29Å; F751-A755 WeakPolarHBondContact O-CB 3.5Å; F751-A755 PolarHBondContact O-N 2.69Å; I752-A755 PolarHBondContact O-N 3.23Å; S753-A755 VanDerWaalsContact C-N 3.32Å; S753-A755 PolarHBondContact O-N 3.09Å; A755-K760 PolarHBondContact O-N 2.97Å; A755-L761 HydrophobicContact CB-CB 3.93Å; A755-L761 HydrophobicContact CB-CD1 3.8Å; A755-L761 HydrophobicContact CB-CG 4.46Å; A755-L761 PolarHBondContact O-N 3.33Å; A755-W764 VanDerWaalsContact CA-CZ3 3.47Å; A755-W764 HydrophobicContact CB-CE3 3.52Å; A755-W764 HydrophobicContact CB-CZ3 3.52Å
756	L	93.1	Very high	92.8	Very high	8 Å²	8	21.8 Å²	21.8	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-75.9	-47.5	171.3	-73.4	167.8	0	0	0	111.3	V592 L596 I752 S753 I754 E758 G759 L761 L800 F805 L807	V592-L756 HydrophobicContact CG1-CD1 3.74Å; V592-L756 HydrophobicContact CG2-CD1 4.37Å; L596-L756 HydrophobicContact CD2-CD1 3.99Å; I752-L756 HydrophobicContact CG2-CD1 4Å; I752-L756 HydrophobicContact CG2-CG 4.43Å; I752-L756 WeakPolarHBondContact O-CG 3.32Å; I752-L756 PolarHBondContact O-N 3.41Å; S753-L756 PolarHBondContact O-N 2.92Å; I754-L756 VanDerWaalsContact C-N 3.29Å; I754-L756 PolarHBondContact O-N 3.49Å; L756-E758 VanDerWaalsContact C-N 3.29Å; L756-E758 PolarHBondContact O-N 2.97Å; L756-G759 PolarHBondContact O-N 3.39Å; L756-L761 HydrophobicContact CD2-CD2 3.74Å; L756-L761 HydrophobicContact CG-CD2 4.12Å; L756-L800 HydrophobicContact CD2-CB 4.44Å; L756-L800 HydrophobicContact CD2-CD1 4.15Å; L756-F805 HydrophobicContact CB-CB 4.33Å; L756-F805 HydrophobicContact CB-CD2 4Å; L756-F805 HydrophobicContact CB-CE2 4.5Å; L756-F805 HydrophobicContact CB-CG 4.14Å; L756-F805 HydrophobicContact CD2-CD2 4.44Å; L756-F805 HydrophobicContact CD2-CE2 4.12Å; L756-L807 HydrophobicContact CB-CD1 3.81Å; L756-L807 HydrophobicContact CD1-CD1 3.65Å; L756-L807 HydrophobicContact CG-CD1 4.39Å
757	N	91.8	Very high	92.8	Very high	55 Å²	55	24 Å²	24	29%	0.294	12%	0.124	S	C	.	.	H	α-helix	trans	-58.2	-38.8	178.3	-63	2.7	0	0	0	112.7	S753 I754 G759 F805 L807	S753-N757 PolarHBondContact O-N 2.94Å; S753-N757 PolarHBondContact O-OD1 3.25Å; S753-N757 VanDerWaalsContact O-OD1 3.05Å; I754-N757 PolarHBondContact O-N 3.17Å; N757-G759 VanDerWaalsContact C-N 3.3Å; N757-G759 PolarHBondContact O-N 3.35Å; N757-F805 WeakPolarHBondContact CA-O 3.39Å; N757-F805 WeakPolarHBondContact CB-O 3.46Å; N757-F805 WeakPolarHBondContact OD1-CB 3.44Å; N757-F805 PolarHBondContact OD1-O 3.43Å; N757-F805 VanDerWaalsContact OD1-O 3.08Å; N757-L807 PolarHBondContact ND2-N 3.44Å; N757-L807 PolarHBondContact ND2-O 2.92Å; N757-L807 VanDerWaalsContact OD1-CB 3.27Å; N757-L807 WeakPolarHBondContact OD1-CB 3.1Å; N757-L807 PolarHBondContact OD1-N 2.69Å
758	E	88.2	Confident	92.8	Very high	73 Å²	73	23.2 Å²	23.2	34%	0.341	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.1	175.5	-86	-89.3	178.3	0	0	113.8	K725 I754 L756 K760 W764	K725-E758 WeakPolarHBondContact CD-OE1 3.44Å; K725-E758 WeakPolarHBondContact CD-OE2 3.37Å; K725-E758 VanDerWaalsContact NZ-CD 3.26Å; K725-E758 IonicContact NZ-OE1 2.77Å; K725-E758 PolarHBondContact NZ-OE1 3Å; K725-E758 IonicContact NZ-OE2 2.8Å; K725-E758 PolarHBondContact NZ-OE2 2.81Å; I754-E758 WeakPolarHBondContact O-CB 3.39Å; I754-E758 PolarHBondContact O-N 2.86Å; L756-E758 VanDerWaalsContact C-N 3.29Å; L756-E758 PolarHBondContact O-N 2.97Å; E758-K760 HydrophobicContact CB-CB 4.25Å; E758-K760 HydrophobicContact CB-CG 3.82Å; E758-K760 WeakPolarHBondContact O-CG 3.27Å; E758-K760 PolarHBondContact O-N 2.88Å; E758-W764 HydrophobicContact CB-CH2 4.37Å; E758-W764 HydrophobicContact CG-CH2 4.42Å
759	G	90.2	Very high	92.6	Very high	31 Å²	31	23.7 Å²	23.7	32%	0.32	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	17.5	-171.3	0	0	0	0	0	114	L756 N757	L756-G759 PolarHBondContact O-N 3.39Å; N757-G759 VanDerWaalsContact C-N 3.3Å; N757-G759 PolarHBondContact O-N 3.35Å
760	K	91.1	Very high	92.3	Very high	59 Å²	59	31.9 Å²	31.9	26%	0.257	15%	0.153	S	C	.	.			trans	-104.7	-0.5	-171.9	-57.2	-63.4	174.7	165.2	0	114.9	N722 A755 E758 V762 P763 W764	N722-K760 PolarHBondContact OD1-NZ 3.39Å; A755-K760 PolarHBondContact O-N 2.97Å; E758-K760 HydrophobicContact CB-CB 4.25Å; E758-K760 HydrophobicContact CB-CG 3.82Å; E758-K760 WeakPolarHBondContact O-CG 3.27Å; E758-K760 PolarHBondContact O-N 2.88Å; K760-V762 PolarHBondContact O-N 3.12Å; K760-P763 WeakPolarHBondContact O-CB 3.38Å; K760-P763 WeakPolarHBondContact O-CD 3.4Å; K760-W764 HydrophobicContact CB-CD2 3.79Å; K760-W764 HydrophobicContact CB-CE3 4.42Å; K760-W764 HydrophobicContact CB-CG 4.12Å; K760-W764 HydrophobicContact CB-CH2 4.34Å; K760-W764 HydrophobicContact CB-CZ2 3.68Å; K760-W764 HydrophobicContact CG-CZ2 4.03Å; K760-W764 WeakPolarHBondContact O-CB 3.35Å; K760-W764 PolarHBondContact O-N 3.26Å
761	L	93.1	Very high	91.9	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.037	16%	0.163	C	C	.	.	H	α-helix	trans	-48.8	-51.8	-178.9	-179	62.7	0	0	0	112.9	I752 A755 L756 W764 L765 L797	I752-L761 HydrophobicContact CD1-CD1 3.66Å; A755-L761 HydrophobicContact CB-CB 3.93Å; A755-L761 HydrophobicContact CB-CD1 3.8Å; A755-L761 HydrophobicContact CB-CG 4.46Å; A755-L761 PolarHBondContact O-N 3.33Å; L756-L761 HydrophobicContact CD2-CD2 3.74Å; L756-L761 HydrophobicContact CG-CD2 4.12Å; L761-W764 PolarHBondContact O-N 2.97Å; L761-L765 HydrophobicContact CD1-CD1 3.75Å; L761-L765 HydrophobicContact CD1-CG 3.96Å; L761-L765 HydrophobicContact CG-CD1 4.03Å; L761-L765 WeakPolarHBondContact O-CB 3.34Å; L761-L765 WeakPolarHBondContact O-CG 3.42Å; L761-L765 PolarHBondContact O-N 3.36Å; L761-L797 HydrophobicContact CD2-CD1 4.3Å; L761-L797 HydrophobicContact CD2-CD2 4.14Å
762	V	92.7	Very high	91.4	Very high	15 Å²	15	39 Å²	39	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-52	177.8	170.1	0	0	0	0	112.2	K760 W764 R766 L794 L797 V798	K760-V762 PolarHBondContact O-N 3.12Å; V762-W764 VanDerWaalsContact C-N 3.31Å; V762-W764 PolarHBondContact O-N 3.17Å; V762-R766 WeakPolarHBondContact O-CB 3.43Å; V762-R766 PolarHBondContact O-N 3.18Å; V762-L794 HydrophobicContact CG1-CB 4.24Å; V762-L794 HydrophobicContact CG1-CD2 4.3Å; V762-L797 HydrophobicContact CG2-CB 3.53Å; V762-V798 HydrophobicContact CB-CG2 4.48Å; V762-V798 HydrophobicContact CG1-CG2 3.94Å; V762-V798 HydrophobicContact CG2-CG2 4.14Å
763	P	92.3	Very high	91	Very high	52 Å²	52	44.2 Å²	44.2	34%	0.338	22%	0.219	S	C	.	.	H	α-helix	trans	-50.4	-42.6	170.9	-31.3	33.6	0	0	0	115.4	K760 M767	K760-P763 WeakPolarHBondContact O-CB 3.38Å; K760-P763 WeakPolarHBondContact O-CD 3.4Å; P763-M767 WeakPolarHBondContact O-CB 3.48Å; P763-M767 PolarHBondContact O-N 2.73Å
764	W	94.5	Very high	90.7	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-73.6	-46.5	-177.2	-67.1	-9.5	0	0	0	112.5	N722 K725 F726 A729 F751 I754 A755 E758 K760 L761 V762 R766 M767 I768	N722-W764 PolarHBondContact O-NE1 3.45Å; N722-W764 VanDerWaalsContact O-NE1 3.08Å; K725-W764 HydrophobicContact CB-CZ2 4.04Å; F726-W764 HydrophobicContact CB-CD2 4.01Å; F726-W764 HydrophobicContact CB-CG 4.01Å; F726-W764 HydrophobicContact CB-CZ2 4.44Å; F726-W764 HydrophobicContact CD2-CB 4.13Å; F726-W764 HydrophobicContact CD2-CD2 4.03Å; F726-W764 HydrophobicContact CD2-CE3 4.23Å; F726-W764 AromaticContact CD2-CG 3.99Å; F726-W764 HydrophobicContact CD2-CG 3.99Å; F726-W764 HydrophobicContact CG-CG 4.4Å; A729-W764 HydrophobicContact CB-CH2 3.51Å; A729-W764 HydrophobicContact CB-CZ2 4.4Å; A729-W764 HydrophobicContact CB-CZ3 3.76Å; F751-W764 HydrophobicContact CD2-CZ3 4.4Å; F751-W764 AromaticContact CE2-CE3 3.55Å; F751-W764 HydrophobicContact CE2-CE3 3.55Å; F751-W764 AromaticContact CE2-CZ3 3.66Å; F751-W764 HydrophobicContact CE2-CZ3 3.66Å; F751-W764 HydrophobicContact CZ-CD2 4.44Å; F751-W764 AromaticContact CZ-CE3 3.51Å; F751-W764 HydrophobicContact CZ-CE3 3.51Å; F751-W764 HydrophobicContact CZ-CZ3 4.09Å; I754-W764 HydrophobicContact CG2-CH2 4.33Å; A755-W764 VanDerWaalsContact CA-CZ3 3.47Å; A755-W764 HydrophobicContact CB-CE3 3.52Å; A755-W764 HydrophobicContact CB-CZ3 3.52Å; E758-W764 HydrophobicContact CB-CH2 4.37Å; E758-W764 HydrophobicContact CG-CH2 4.42Å; K760-W764 HydrophobicContact CB-CD2 3.79Å; K760-W764 HydrophobicContact CB-CE3 4.42Å; K760-W764 HydrophobicContact CB-CG 4.12Å; K760-W764 HydrophobicContact CB-CH2 4.34Å; K760-W764 HydrophobicContact CB-CZ2 3.68Å; K760-W764 HydrophobicContact CG-CZ2 4.03Å; K760-W764 WeakPolarHBondContact O-CB 3.35Å; K760-W764 PolarHBondContact O-N 3.26Å; L761-W764 PolarHBondContact O-N 2.97Å; V762-W764 VanDerWaalsContact C-N 3.31Å; V762-W764 PolarHBondContact O-N 3.17Å; W764-R766 VanDerWaalsContact C-N 3.33Å; W764-R766 PolarHBondContact O-N 2.8Å; W764-M767 WeakPolarHBondContact O-CB 3.48Å; W764-M767 PolarHBondContact O-N 2.83Å; W764-I768 WeakPolarHBondContact O-CD1 3.49Å; W764-I768 WeakPolarHBondContact O-CG1 3.45Å; W764-I768 PolarHBondContact O-N 2.87Å; W764-I768 VanDerWaalsContact O-N 3.15Å
765	L	93.1	Very high	90.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-40.5	174.6	-64.8	178.9	0	0	0	111.2	L600 I604 L761 M767 I768 F769 F790 L794 L797	L600-L765 HydrophobicContact CD1-CD1 4.24Å; L600-L765 HydrophobicContact CD2-CD1 4.22Å; I604-L765 HydrophobicContact CD1-CD2 4.32Å; L761-L765 HydrophobicContact CD1-CD1 3.75Å; L761-L765 HydrophobicContact CD1-CG 3.96Å; L761-L765 HydrophobicContact CG-CD1 4.03Å; L761-L765 WeakPolarHBondContact O-CB 3.34Å; L761-L765 WeakPolarHBondContact O-CG 3.42Å; L761-L765 PolarHBondContact O-N 3.36Å; L765-M767 VanDerWaalsContact C-N 3.33Å; L765-M767 PolarHBondContact O-N 3.34Å; L765-I768 PolarHBondContact O-N 3.24Å; L765-I768 VanDerWaalsContact O-N 3.13Å; L765-F769 HydrophobicContact CB-CD2 4.28Å; L765-F769 HydrophobicContact CB-CE2 4.26Å; L765-F769 HydrophobicContact CD2-CE2 4.08Å; L765-F769 VanDerWaalsContact O-CD2 3.26Å; L765-F769 WeakPolarHBondContact O-CD2 3.46Å; L765-F769 PolarHBondContact O-N 3.34Å; L765-F790 HydrophobicContact CD1-CE1 4.3Å; L765-L794 HydrophobicContact CB-CD2 3.68Å; L765-L797 HydrophobicContact CD1-CD1 3.76Å
766	R	92.7	Very high	90.1	Very high	74 Å²	74	48.4 Å²	48.4	28%	0.279	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-37.9	174.7	-165.5	179.9	-66.2	-92.1	9.4	112.1	V762 W764 I768 R770 N791 L794	V762-R766 WeakPolarHBondContact O-CB 3.43Å; V762-R766 PolarHBondContact O-N 3.18Å; W764-R766 VanDerWaalsContact C-N 3.33Å; W764-R766 PolarHBondContact O-N 2.8Å; R766-I768 VanDerWaalsContact C-N 3.27Å; R766-I768 PolarHBondContact O-N 2.96Å; R766-R770 WeakPolarHBondContact O-CB 3.22Å; R766-R770 PolarHBondContact O-N 2.93Å; R766-R770 VanDerWaalsContact O-N 3.07Å; R766-N791 PolarHBondContact NH1-OD1 3.3Å; R766-L794 HydrophobicContact CB-CD1 3.75Å; R766-L794 HydrophobicContact CB-CD2 4.33Å; R766-L794 HydrophobicContact CG-CD1 3.81Å
767	M	91.1	Very high	89.8	Confident	52 Å²	52	51.1 Å²	51.1	26%	0.256	26%	0.258	S	S	.	.	H	α-helix	trans	-65	-30.3	175.2	178.1	178	62.3	0	0	112.7	F689 R723 F726 P763 W764 L765	F689-M767 HydrophobicContact CE1-CE 4.2Å; F689-M767 HydrophobicContact CE1-CG 4.28Å; F689-M767 WeakPolarHBondContact CE2-O 3.28Å; F689-M767 HydrophobicContact CZ-CG 3.95Å; F689-M767 VanDerWaalsContact CZ-O 3.31Å; F689-M767 WeakPolarHBondContact CZ-O 3.29Å; R723-M767 HydrophobicContact CB-SD 3.92Å; R723-M767 HydrophobicContact CG-SD 4.18Å; F726-M767 HydrophobicContact CB-CE 3.72Å; F726-M767 HydrophobicContact CD1-CE 3.54Å; F726-M767 HydrophobicContact CD2-CE 4.29Å; F726-M767 HydrophobicContact CE1-CE 4.25Å; F726-M767 HydrophobicContact CG-CE 3.57Å; P763-M767 WeakPolarHBondContact O-CB 3.48Å; P763-M767 PolarHBondContact O-N 2.73Å; W764-M767 WeakPolarHBondContact O-CB 3.48Å; W764-M767 PolarHBondContact O-N 2.83Å; L765-M767 VanDerWaalsContact C-N 3.33Å; L765-M767 PolarHBondContact O-N 3.34Å
768	I	91.8	Very high	89.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-79.3	-57.2	178.1	-65.5	160.3	0	0	0	110.6	L686 F689 F726 W764 L765 R766 N771 F774	L686-I768 HydrophobicContact CD2-CD1 3.6Å; F689-I768 HydrophobicContact CB-CG1 4.42Å; F689-I768 HydrophobicContact CB-CG2 4.37Å; F689-I768 HydrophobicContact CD1-CG1 3.72Å; F689-I768 HydrophobicContact CD2-CB 4.32Å; F689-I768 HydrophobicContact CD2-CG1 4.19Å; F689-I768 HydrophobicContact CD2-CG2 4.15Å; F689-I768 HydrophobicContact CE1-CG1 3.93Å; F689-I768 HydrophobicContact CE2-CB 4.47Å; F689-I768 HydrophobicContact CE2-CG1 4.37Å; F689-I768 HydrophobicContact CG-CB 4.42Å; F689-I768 HydrophobicContact CG-CG1 3.85Å; F689-I768 HydrophobicContact CG-CG2 4.26Å; F689-I768 HydrophobicContact CZ-CG1 4.25Å; F726-I768 HydrophobicContact CE2-CD1 4.07Å; F726-I768 HydrophobicContact CZ-CD1 4.2Å; W764-I768 WeakPolarHBondContact O-CD1 3.49Å; W764-I768 WeakPolarHBondContact O-CG1 3.45Å; W764-I768 PolarHBondContact O-N 2.87Å; W764-I768 VanDerWaalsContact O-N 3.15Å; L765-I768 PolarHBondContact O-N 3.24Å; L765-I768 VanDerWaalsContact O-N 3.13Å; R766-I768 VanDerWaalsContact C-N 3.27Å; R766-I768 PolarHBondContact O-N 2.96Å; I768-N771 WeakPolarHBondContact O-CB 3.28Å; I768-N771 PolarHBondContact O-N 3.43Å; I768-F774 HydrophobicContact CG2-CD1 4.45Å; I768-F774 HydrophobicContact CG2-CE1 3.83Å
769	F	90.9	Very high	89.7	Confident	11 Å²	11	45.4 Å²	45.4	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-78.3	-20.3	-171.2	-60.3	-57.2	0	0	0	114.5	I604 V685 L765 N771 V775 Y779 T785 F790	I604-F769 HydrophobicContact CD1-CE2 4.26Å; I604-F769 HydrophobicContact CD1-CZ 4.05Å; I604-F769 HydrophobicContact CG1-CE2 4.26Å; I604-F769 HydrophobicContact CG1-CZ 3.85Å; I604-F769 HydrophobicContact CG2-CZ 4.1Å; V685-F769 HydrophobicContact CG1-CE1 4.37Å; L765-F769 HydrophobicContact CB-CD2 4.28Å; L765-F769 HydrophobicContact CB-CE2 4.26Å; L765-F769 HydrophobicContact CD2-CE2 4.08Å; L765-F769 VanDerWaalsContact O-CD2 3.26Å; L765-F769 WeakPolarHBondContact O-CD2 3.46Å; L765-F769 PolarHBondContact O-N 3.34Å; F769-N771 PolarHBondContact O-N 3.4Å; F769-V775 HydrophobicContact CD1-CG2 4.24Å; F769-V775 WeakPolarHBondContact O-CG2 3.49Å; F769-Y779 HydrophobicContact CE1-CE2 4.16Å; F769-T785 HydrophobicContact CB-CG2 4.42Å; F769-T785 HydrophobicContact CD1-CG2 3.38Å; F769-T785 HydrophobicContact CE1-CG2 3.8Å; F769-T785 HydrophobicContact CG-CG2 4.01Å; F769-F790 HydrophobicContact CB-CB 4.11Å; F769-F790 HydrophobicContact CD2-CB 4.19Å; F769-F790 AromaticContact CD2-CD1 3.41Å; F769-F790 HydrophobicContact CD2-CD1 3.41Å; F769-F790 VanDerWaalsContact CD2-CD1 3.41Å; F769-F790 HydrophobicContact CD2-CD2 4.23Å; F769-F790 AromaticContact CD2-CE1 3.71Å; F769-F790 HydrophobicContact CD2-CE1 3.71Å; F769-F790 HydrophobicContact CD2-CE2 4.48Å; F769-F790 AromaticContact CD2-CG 3.71Å; F769-F790 HydrophobicContact CD2-CG 3.71Å; F769-F790 HydrophobicContact CD2-CZ 4.24Å; F769-F790 AromaticContact CE2-CD1 3.76Å; F769-F790 HydrophobicContact CE2-CD1 3.76Å; F769-F790 HydrophobicContact CE2-CD2 4.23Å; F769-F790 AromaticContact CE2-CE1 3.55Å; F769-F790 HydrophobicContact CE2-CE1 3.55Å; F769-F790 HydrophobicContact CE2-CE2 4.05Å; F769-F790 HydrophobicContact CE2-CG 4.1Å; F769-F790 AromaticContact CE2-CZ 3.71Å; F769-F790 HydrophobicContact CE2-CZ 3.71Å; F769-F790 HydrophobicContact CG-CB 4.21Å; F769-F790 HydrophobicContact CG-CD1 4.26Å; F769-F790 HydrophobicContact CG-CG 4.15Å; F769-F790 HydrophobicContact CZ-CE2 4.4Å; F769-F790 HydrophobicContact CZ-CZ 4.37Å
770	R	87.8	Confident	89.4	Confident	207 Å²	207	46.9 Å²	46.9	78%	0.781	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-6.8	171.4	-161.7	171.8	-174.7	174.6	4	113.2	R766 H772	R766-R770 WeakPolarHBondContact O-CB 3.22Å; R766-R770 PolarHBondContact O-N 2.93Å; R766-R770 VanDerWaalsContact O-N 3.07Å; R770-H772 PolarHBondContact O-N 3.11Å; R770-H772 VanDerWaalsContact O-N 3.09Å
771	N	85.8	Confident	89.1	Confident	38 Å²	38	48.8 Å²	48.8	20%	0.203	25%	0.246	C	C	.	.			trans	-82.5	78	174.1	-173.4	14.9	0	0	0	110.6	F689 I768 F769 V773 F774 V775	F689-N771 HydrophobicContact CE2-CB 4.13Å; I768-N771 WeakPolarHBondContact O-CB 3.28Å; I768-N771 PolarHBondContact O-N 3.43Å; F769-N771 PolarHBondContact O-N 3.4Å; N771-V773 VanDerWaalsContact C-N 3.34Å; N771-V773 PolarHBondContact O-N 2.7Å; N771-F774 HydrophobicContact CB-CB 4.12Å; N771-F774 VanDerWaalsContact ND2-CB 3.27Å; N771-F774 WeakPolarHBondContact ND2-CB 3.45Å; N771-F774 WeakPolarHBondContact O-CA 3.43Å; N771-F774 WeakPolarHBondContact O-CB 3.23Å; N771-F774 PolarHBondContact O-N 2.98Å; N771-V775 PolarHBondContact O-N 3.37Å; N771-V775 VanDerWaalsContact O-N 3.1Å
772	H	84.3	Confident	88.7	Confident	111 Å²	111	53.3 Å²	53.3	51%	0.514	26%	0.263	S	S	.	.	H	α-helix	trans	-48.2	-47.8	-170.8	-168.7	-113.3	0	0	0	114.3	R770 F774 V775 Q776	R770-H772 PolarHBondContact O-N 3.11Å; R770-H772 VanDerWaalsContact O-N 3.09Å; H772-F774 VanDerWaalsContact C-N 3.28Å; H772-F774 PolarHBondContact O-N 2.78Å; H772-V775 PolarHBondContact O-N 2.73Å; H772-V775 VanDerWaalsContact O-N 3.16Å; H772-Q776 PolarHBondContact CE1-NE2 3.03Å; H772-Q776 PolarHBondContact CE1-OE1 3.33Å; H772-Q776 VanDerWaalsContact CE1-OE1 3.28Å; H772-Q776 PolarHBondContact ND1-OE1 3.1Å; H772-Q776 PolarHBondContact O-N 3.36Å
773	V	85.9	Confident	88.4	Confident	111 Å²	111	52.6 Å²	52.6	67%	0.673	26%	0.259	S	S	*	.	H	α-helix	trans	-60.3	-36.2	179	-177.4	0	0	0	0	112.3	N771 S777	N771-V773 VanDerWaalsContact C-N 3.34Å; N771-V773 PolarHBondContact O-N 2.7Å; V773-S777 WeakPolarHBondContact O-CB 3.19Å; V773-S777 PolarHBondContact O-N 3.45Å; V773-S777 PolarHBondContact O-OG 2.76Å
774	F	88.2	Confident	88.2	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-70.7	-45.9	175.7	167.8	-109.2	0	0	0	111.2	V685 R688 F689 I692 I768 N771 H772 S777 I778	V685-F774 HydrophobicContact CG1-CE1 4.03Å; V685-F774 HydrophobicContact CG1-CZ 3.98Å; R688-F774 HydrophobicContact CB-CE2 4.08Å; R688-F774 HydrophobicContact CB-CZ 4.38Å; R688-F774 HydrophobicContact CG-CE2 3.82Å; F689-F774 HydrophobicContact CB-CE1 4.01Å; F689-F774 HydrophobicContact CB-CE2 4.44Å; F689-F774 HydrophobicContact CB-CZ 3.84Å; F689-F774 AromaticContact CD2-CD1 3.96Å; F689-F774 HydrophobicContact CD2-CD1 3.96Å; F689-F774 HydrophobicContact CD2-CE1 4.02Å; F689-F774 HydrophobicContact CD2-CG 4.43Å; F689-F774 HydrophobicContact CG-CE1 4.49Å; I692-F774 HydrophobicContact CD1-CD2 3.62Å; I692-F774 HydrophobicContact CD1-CE2 3.86Å; I768-F774 HydrophobicContact CG2-CD1 4.45Å; I768-F774 HydrophobicContact CG2-CE1 3.83Å; N771-F774 HydrophobicContact CB-CB 4.12Å; N771-F774 VanDerWaalsContact ND2-CB 3.27Å; N771-F774 WeakPolarHBondContact ND2-CB 3.45Å; N771-F774 WeakPolarHBondContact O-CA 3.43Å; N771-F774 WeakPolarHBondContact O-CB 3.23Å; N771-F774 PolarHBondContact O-N 2.98Å; H772-F774 VanDerWaalsContact C-N 3.28Å; H772-F774 PolarHBondContact O-N 2.78Å; F774-S777 PolarHBondContact O-N 2.89Å; F774-S777 PolarHBondContact O-OG 3.23Å; F774-I778 HydrophobicContact CD1-CD1 4.39Å; F774-I778 HydrophobicContact CE1-CD1 3.76Å; F774-I778 HydrophobicContact CE2-CD1 3.91Å; F774-I778 HydrophobicContact CE2-CG2 4.41Å; F774-I778 HydrophobicContact CZ-CD1 3.5Å; F774-I778 VanDerWaalsContact CZ-CD1 3.5Å; F774-I778 PolarHBondContact O-N 3.31Å
775	V	88.3	Confident	87.9	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-51.2	179.8	175.8	0	0	0	0	111.1	F769 N771 H772 S777 I778 Y779 T785 L786	F769-V775 HydrophobicContact CD1-CG2 4.24Å; F769-V775 WeakPolarHBondContact O-CG2 3.49Å; N771-V775 PolarHBondContact O-N 3.37Å; N771-V775 VanDerWaalsContact O-N 3.1Å; H772-V775 PolarHBondContact O-N 2.73Å; H772-V775 VanDerWaalsContact O-N 3.16Å; V775-S777 PolarHBondContact O-N 3.36Å; V775-S777 VanDerWaalsContact O-N 3.13Å; V775-I778 PolarHBondContact O-N 3.27Å; V775-I778 VanDerWaalsContact O-N 3.08Å; V775-Y779 HydrophobicContact CB-CD2 4.35Å; V775-Y779 HydrophobicContact CG1-CD2 3.64Å; V775-Y779 HydrophobicContact CG1-CE2 4.35Å; V775-Y779 HydrophobicContact CG1-CG 4.37Å; V775-Y779 WeakPolarHBondContact O-CB 3.47Å; V775-Y779 PolarHBondContact O-N 3.15Å; V775-T785 HydrophobicContact CG1-CG2 3.9Å; V775-L786 HydrophobicContact CG1-CD1 3.81Å
776	Q	85.6	Confident	87.6	Confident	101 Å²	101	52.6 Å²	52.6	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-58.3	-26.4	176.2	-72.8	-172.6	-48.9	0	0	113.6	H772 L786	H772-Q776 PolarHBondContact CE1-NE2 3.03Å; H772-Q776 PolarHBondContact CE1-OE1 3.33Å; H772-Q776 VanDerWaalsContact CE1-OE1 3.28Å; H772-Q776 PolarHBondContact ND1-OE1 3.1Å; H772-Q776 PolarHBondContact O-N 3.36Å; Q776-L786 HydrophobicContact CG-CD1 3.77Å
777	S	86.1	Confident	87.2	Confident	66 Å²	66	52.5 Å²	52.5	46%	0.462	27%	0.266	S	S	.	.	H	α-helix	trans	-78.8	-15.8	179.1	76.6	0	0	0	0	114.5	A612 V773 F774 V775	A612-S777 VanDerWaalsContact CB-O 3.25Å; A612-S777 WeakPolarHBondContact CB-O 3.25Å; V773-S777 WeakPolarHBondContact O-CB 3.19Å; V773-S777 PolarHBondContact O-N 3.45Å; V773-S777 PolarHBondContact O-OG 2.76Å; F774-S777 PolarHBondContact O-N 2.89Å; F774-S777 PolarHBondContact O-OG 3.23Å; V775-S777 PolarHBondContact O-N 3.36Å; V775-S777 VanDerWaalsContact O-N 3.13Å
778	I	87.7	Confident	87	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-127.3	-11.4	-174.2	70.9	179.4	0	0	0	115	L608 I609 A612 L613 V685 F774 V775	L608-I778 HydrophobicContact CD2-CD1 4.35Å; L608-I778 HydrophobicContact CD2-CG1 4.25Å; I609-I778 WeakPolarHBondContact CG1-O 3.38Å; I609-I778 PolarHBondContact N-O 2.99Å; A612-I778 HydrophobicContact CB-CB 4.26Å; A612-I778 HydrophobicContact CB-CG2 4.12Å; L613-I778 HydrophobicContact CD2-CG2 3.97Å; L613-I778 HydrophobicContact CG-CG2 4.37Å; V685-I778 HydrophobicContact CB-CD1 4.49Å; V685-I778 HydrophobicContact CG1-CD1 3.75Å; V685-I778 HydrophobicContact CG2-CD1 4.28Å; F774-I778 HydrophobicContact CD1-CD1 4.39Å; F774-I778 HydrophobicContact CE1-CD1 3.76Å; F774-I778 HydrophobicContact CE2-CD1 3.91Å; F774-I778 HydrophobicContact CE2-CG2 4.41Å; F774-I778 HydrophobicContact CZ-CD1 3.5Å; F774-I778 VanDerWaalsContact CZ-CD1 3.5Å; F774-I778 PolarHBondContact O-N 3.31Å; V775-I778 PolarHBondContact O-N 3.27Å; V775-I778 VanDerWaalsContact O-N 3.08Å
779	Y	90.2	Very high	86.7	Confident	4 Å²	4	53 Å²	53	2%	0.016	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-114.5	136.7	180	-75	-76.5	0	0	0	112.1	I604 G607 L608 F769 V775 S783 T785	I604-Y779 VanDerWaalsContact O-CE1 3.23Å; I604-Y779 WeakPolarHBondContact O-CE1 3.4Å; I604-Y779 PolarHBondContact O-OH 2.99Å; G607-Y779 WeakPolarHBondContact O-CA 3.29Å; L608-Y779 HydrophobicContact CD2-CD1 3.75Å; L608-Y779 HydrophobicContact CD2-CD2 4.36Å; L608-Y779 HydrophobicContact CD2-CE1 3.33Å; L608-Y779 HydrophobicContact CD2-CE2 3.98Å; L608-Y779 HydrophobicContact CD2-CG 4.26Å; L608-Y779 VanDerWaalsContact CD2-CZ 3.44Å; L608-Y779 HydrophobicContact CG-CD1 4.19Å; L608-Y779 HydrophobicContact CG-CE1 3.66Å; F769-Y779 HydrophobicContact CE1-CE2 4.16Å; V775-Y779 HydrophobicContact CB-CD2 4.35Å; V775-Y779 HydrophobicContact CG1-CD2 3.64Å; V775-Y779 HydrophobicContact CG1-CE2 4.35Å; V775-Y779 HydrophobicContact CG1-CG 4.37Å; V775-Y779 WeakPolarHBondContact O-CB 3.47Å; V775-Y779 PolarHBondContact O-N 3.15Å; Y779-S783 WeakPolarHBondContact CD1-OG 3.48Å; Y779-T785 HydrophobicContact CD2-CG2 4.05Å; Y779-T785 HydrophobicContact CE1-CG2 4.49Å; Y779-T785 WeakPolarHBondContact CE1-OG1 3.31Å; Y779-T785 HydrophobicContact CE2-CG2 3.72Å
780	E	85.4	Confident	86.7	Confident	63 Å²	63	52.5 Å²	52.5	29%	0.294	28%	0.277	S	S	.	.			trans	-63.3	151.7	169.9	-64.3	-71	172.9	0	0	110.5	G607 I609 W782 S783	G607-E780 PolarHBondContact O-N 3.3Å; I609-E780 HydrophobicContact CG1-CG 3.87Å; E780-W782 HydrophobicContact CB-CD2 4.15Å; E780-W782 HydrophobicContact CB-CG 4.38Å; E780-W782 HydrophobicContact CB-CZ2 3.91Å; E780-W782 HydrophobicContact CG-CZ2 3.82Å; E780-W782 PolarHBondContact O-N 3.39Å; E780-S783 VanDerWaalsContact O-CB 3.25Å; E780-S783 WeakPolarHBondContact O-CB 3.33Å; E780-S783 PolarHBondContact O-N 3.11Å
781	P	83.8	Confident	86.7	Confident	98 Å²	98	46.2 Å²	46.2	64%	0.636	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.5	-176.2	-27.9	36	0	0	0	115.6
782	W	84.7	Confident	86.8	Confident	103 Å²	103	47.4 Å²	47.4	39%	0.39	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	4.6	179.2	52.1	-95.4	0	0	0	113.6	A419 H606 E780	A419-W782 HydrophobicContact CB-CH2 3.74Å; A419-W782 HydrophobicContact CB-CZ3 3.76Å; H606-W782 AromaticContact CE1-CE3 3.73Å; H606-W782 AromaticContact CE1-CZ3 3.77Å; E780-W782 HydrophobicContact CB-CD2 4.15Å; E780-W782 HydrophobicContact CB-CG 4.38Å; E780-W782 HydrophobicContact CB-CZ2 3.91Å; E780-W782 HydrophobicContact CG-CZ2 3.82Å; E780-W782 PolarHBondContact O-N 3.39Å
783	S	87.1	Confident	87.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.			trans	-65.2	134.1	175.2	175.8	0	0	0	0	111.6	H606 Y779 E780 T785 L786 S787	H606-S783 WeakPolarHBondContact O-CB 3.19Å; H606-S783 PolarHBondContact O-OG 2.86Å; Y779-S783 WeakPolarHBondContact CD1-OG 3.48Å; E780-S783 VanDerWaalsContact O-CB 3.25Å; E780-S783 WeakPolarHBondContact O-CB 3.33Å; E780-S783 PolarHBondContact O-N 3.11Å; S783-T785 PolarHBondContact O-N 3.43Å; S783-T785 PolarHBondContact OG-N 3Å; S783-L786 PolarHBondContact O-N 3.24Å; S783-S787 PolarHBondContact O-N 3.5Å; S783-S787 PolarHBondContact O-OG 3.37Å; S783-S787 VanDerWaalsContact O-OG 3.12Å
784	Y	87.3	Confident	87.4	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-41	-43.7	167.7	174.8	-102.5	0	0	0	113.7	W424 L603 H606 L786 T788 F790 T793	W424-Y784 HydrophobicContact CB-CD2 4.25Å; W424-Y784 HydrophobicContact CB-CG 4.39Å; W424-Y784 AromaticContact CD2-CD2 3.93Å; W424-Y784 HydrophobicContact CD2-CD2 3.93Å; W424-Y784 AromaticContact CE3-CD2 3.49Å; W424-Y784 HydrophobicContact CE3-CD2 3.49Å; W424-Y784 VanDerWaalsContact CE3-CD2 3.49Å; W424-Y784 AromaticContact CE3-CE2 3.9Å; W424-Y784 HydrophobicContact CE3-CE2 3.9Å; W424-Y784 HydrophobicContact CG-CD2 4.26Å; W424-Y784 HydrophobicContact CZ3-CD2 4.18Å; W424-Y784 HydrophobicContact CZ3-CE2 4.22Å; L603-Y784 HydrophobicContact CD1-CD1 3.55Å; L603-Y784 HydrophobicContact CD1-CD2 4.22Å; L603-Y784 HydrophobicContact CD1-CE1 3.99Å; L603-Y784 HydrophobicContact CD1-CG 3.69Å; L603-Y784 HydrophobicContact CD2-CD1 4.02Å; L603-Y784 HydrophobicContact CD2-CE1 3.65Å; L603-Y784 HydrophobicContact CG-CD1 3.57Å; L603-Y784 HydrophobicContact CG-CE1 3.77Å; L603-Y784 HydrophobicContact CG-CG 4.25Å; H606-Y784 PolarHBondContact ND1-N 3.2Å; Y784-L786 VanDerWaalsContact C-N 3.29Å; Y784-L786 PolarHBondContact O-N 3.05Å; Y784-T788 HydrophobicContact CD2-CG2 3.74Å; Y784-T788 HydrophobicContact CE2-CG2 3.58Å; Y784-T788 WeakPolarHBondContact CE2-OG1 3.32Å; Y784-T788 PolarHBondContact O-N 3.43Å; Y784-T788 PolarHBondContact O-OG1 2.88Å; Y784-F790 AromaticContact CD1-CD2 3.8Å; Y784-F790 HydrophobicContact CD1-CD2 3.8Å; Y784-F790 HydrophobicContact CD1-CE2 4.14Å; Y784-F790 AromaticContact CE1-CD2 3.57Å; Y784-F790 HydrophobicContact CE1-CD2 3.57Å; Y784-F790 AromaticContact CE1-CE2 3.95Å; Y784-F790 HydrophobicContact CE1-CE2 3.95Å; Y784-F790 HydrophobicContact CE1-CG 4.24Å; Y784-T793 WeakPolarHBondContact CE1-OG1 3.42Å; Y784-T793 PolarHBondContact OH-N 2.92Å; Y784-T793 PolarHBondContact OH-OG1 2.67Å
785	T	88.9	Confident	87.5	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-35.6	-178.5	-50.7	0	0	0	0	112.6	F769 V775 Y779 S783 G789 F790	F769-T785 HydrophobicContact CB-CG2 4.42Å; F769-T785 HydrophobicContact CD1-CG2 3.38Å; F769-T785 HydrophobicContact CE1-CG2 3.8Å; F769-T785 HydrophobicContact CG-CG2 4.01Å; V775-T785 HydrophobicContact CG1-CG2 3.9Å; Y779-T785 HydrophobicContact CD2-CG2 4.05Å; Y779-T785 HydrophobicContact CE1-CG2 4.49Å; Y779-T785 WeakPolarHBondContact CE1-OG1 3.31Å; Y779-T785 HydrophobicContact CE2-CG2 3.72Å; S783-T785 PolarHBondContact O-N 3.43Å; S783-T785 PolarHBondContact OG-N 3Å; T785-G789 CarbonylContact O-C 3.56Å; T785-G789 VanDerWaalsContact O-CA 3.28Å; T785-G789 WeakPolarHBondContact O-CA 3.47Å; T785-G789 PolarHBondContact O-N 2.99Å; T785-F790 HydrophobicContact CG2-CB 4.32Å; T785-F790 HydrophobicContact CG2-CD2 4.2Å; T785-F790 PolarHBondContact O-N 3.23Å
786	L	87.1	Confident	87.6	Confident	50 Å²	50	42.9 Å²	42.9	26%	0.262	24%	0.238	S	C	.	.	H	α-helix	trans	-86.5	-48.5	177.4	-160.5	77	0	0	0	110.8	V775 Q776 S783 Y784 T788 G789	V775-L786 HydrophobicContact CG1-CD1 3.81Å; Q776-L786 HydrophobicContact CG-CD1 3.77Å; S783-L786 PolarHBondContact O-N 3.24Å; Y784-L786 VanDerWaalsContact C-N 3.29Å; Y784-L786 PolarHBondContact O-N 3.05Å; L786-T788 VanDerWaalsContact C-N 3.28Å; L786-T788 PolarHBondContact O-N 3.15Å; L786-G789 PolarHBondContact O-N 3.13Å
787	S	84.5	Confident	87.8	Confident	73 Å²	73	38.3 Å²	38.3	51%	0.51	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-27.5	-176.3	-51.5	0	0	0	0	114.5	S783	S783-S787 PolarHBondContact O-N 3.5Å; S783-S787 PolarHBondContact O-OG 3.37Å; S783-S787 VanDerWaalsContact O-OG 3.12Å
788	T	85.4	Confident	88	Confident	31 Å²	31	37.7 Å²	37.7	19%	0.19	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-0.6	179.6	69.4	0	0	0	0	113.5	Y784 L786 F790 N791	Y784-T788 HydrophobicContact CD2-CG2 3.74Å; Y784-T788 HydrophobicContact CE2-CG2 3.58Å; Y784-T788 WeakPolarHBondContact CE2-OG1 3.32Å; Y784-T788 PolarHBondContact O-N 3.43Å; Y784-T788 PolarHBondContact O-OG1 2.88Å; L786-T788 VanDerWaalsContact C-N 3.28Å; L786-T788 PolarHBondContact O-N 3.15Å; T788-F790 PolarHBondContact O-N 3.44Å; T788-F790 PolarHBondContact OG1-N 3.33Å; T788-N791 PolarHBondContact O-N 3.36Å; T788-N791 PolarHBondContact O-ND2 3.4Å
789	G	85.8	Confident	88	Confident	32 Å²	32	42 Å²	42	33%	0.33	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	15.9	-166.3	0	0	0	0	0	114.3	T785 L786 N791	T785-G789 CarbonylContact O-C 3.56Å; T785-G789 VanDerWaalsContact O-CA 3.28Å; T785-G789 WeakPolarHBondContact O-CA 3.47Å; T785-G789 PolarHBondContact O-N 2.99Å; L786-G789 PolarHBondContact O-N 3.13Å; G789-N791 PolarHBondContact O-N 3.47Å; G789-N791 VanDerWaalsContact O-N 3.11Å; G789-N791 PolarHBondContact O-ND2 3.13Å
790	F	90	Very high	87.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	9.5	-173.8	-153.7	-97.9	0	0	0	114.7	L600 L603 I604 L765 F769 Y784 T785 T788 D792 T793 L794	L600-F790 HydrophobicContact CD1-CZ 4.03Å; L603-F790 HydrophobicContact CG-CE2 4.46Å; I604-F790 HydrophobicContact CD1-CZ 4.21Å; I604-F790 HydrophobicContact CG1-CE2 3.84Å; I604-F790 HydrophobicContact CG1-CZ 3.71Å; L765-F790 HydrophobicContact CD1-CE1 4.3Å; F769-F790 HydrophobicContact CB-CB 4.11Å; F769-F790 HydrophobicContact CD2-CB 4.19Å; F769-F790 AromaticContact CD2-CD1 3.41Å; F769-F790 HydrophobicContact CD2-CD1 3.41Å; F769-F790 VanDerWaalsContact CD2-CD1 3.41Å; F769-F790 HydrophobicContact CD2-CD2 4.23Å; F769-F790 AromaticContact CD2-CE1 3.71Å; F769-F790 HydrophobicContact CD2-CE1 3.71Å; F769-F790 HydrophobicContact CD2-CE2 4.48Å; F769-F790 AromaticContact CD2-CG 3.71Å; F769-F790 HydrophobicContact CD2-CG 3.71Å; F769-F790 HydrophobicContact CD2-CZ 4.24Å; F769-F790 AromaticContact CE2-CD1 3.76Å; F769-F790 HydrophobicContact CE2-CD1 3.76Å; F769-F790 HydrophobicContact CE2-CD2 4.23Å; F769-F790 AromaticContact CE2-CE1 3.55Å; F769-F790 HydrophobicContact CE2-CE1 3.55Å; F769-F790 HydrophobicContact CE2-CE2 4.05Å; F769-F790 HydrophobicContact CE2-CG 4.1Å; F769-F790 AromaticContact CE2-CZ 3.71Å; F769-F790 HydrophobicContact CE2-CZ 3.71Å; F769-F790 HydrophobicContact CG-CB 4.21Å; F769-F790 HydrophobicContact CG-CD1 4.26Å; F769-F790 HydrophobicContact CG-CG 4.15Å; F769-F790 HydrophobicContact CZ-CE2 4.4Å; F769-F790 HydrophobicContact CZ-CZ 4.37Å; Y784-F790 AromaticContact CD1-CD2 3.8Å; Y784-F790 HydrophobicContact CD1-CD2 3.8Å; Y784-F790 HydrophobicContact CD1-CE2 4.14Å; Y784-F790 AromaticContact CE1-CD2 3.57Å; Y784-F790 HydrophobicContact CE1-CD2 3.57Å; Y784-F790 AromaticContact CE1-CE2 3.95Å; Y784-F790 HydrophobicContact CE1-CE2 3.95Å; Y784-F790 HydrophobicContact CE1-CG 4.24Å; T785-F790 HydrophobicContact CG2-CB 4.32Å; T785-F790 HydrophobicContact CG2-CD2 4.2Å; T785-F790 PolarHBondContact O-N 3.23Å; T788-F790 PolarHBondContact O-N 3.44Å; T788-F790 PolarHBondContact OG1-N 3.33Å; F790-D792 PolarHBondContact O-N 3.17Å; F790-T793 HydrophobicContact CD1-CG2 4.04Å; F790-T793 HydrophobicContact CE1-CG2 3.35Å; F790-T793 HydrophobicContact CE2-CG2 4.28Å; F790-T793 HydrophobicContact CZ-CG2 3.5Å; F790-T793 VanDerWaalsContact CZ-CG2 3.5Å; F790-T793 PolarHBondContact O-N 2.92Å; F790-L794 HydrophobicContact CD1-CD2 4.2Å; F790-L794 HydrophobicContact CD1-CG 4.07Å; F790-L794 HydrophobicContact CE1-CD2 4.4Å; F790-L794 WeakPolarHBondContact O-CG 3.46Å; F790-L794 PolarHBondContact O-N 3.27Å
791	N	88.5	Confident	87.8	Confident	75 Å²	75	44.8 Å²	44.8	40%	0.401	24%	0.24	S	C	.	.	H	α-helix	trans	-65.3	-41	-168.7	-74	-69.4	0	0	0	113.4	R766 T788 G789 T793 L794 Q795	R766-N791 PolarHBondContact NH1-OD1 3.3Å; T788-N791 PolarHBondContact O-N 3.36Å; T788-N791 PolarHBondContact O-ND2 3.4Å; G789-N791 PolarHBondContact O-N 3.47Å; G789-N791 VanDerWaalsContact O-N 3.11Å; G789-N791 PolarHBondContact O-ND2 3.13Å; N791-T793 VanDerWaalsContact C-N 3.35Å; N791-T793 PolarHBondContact O-N 3.18Å; N791-L794 WeakPolarHBondContact O-CA 3.32Å; N791-L794 VanDerWaalsContact O-CB 3.3Å; N791-L794 WeakPolarHBondContact O-CB 3.42Å; N791-L794 PolarHBondContact O-N 3.44Å; N791-Q795 PolarHBondContact O-N 3.14Å
792	D	88	Confident	87.6	Confident	62 Å²	62	45.8 Å²	45.8	33%	0.332	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-38.7	-176.5	-62.8	2.5	0	0	0	112.1	R428 F790 L794 Q795 S796	R428-D792 IonicContact CZ-OD2 2.68Å; R428-D792 VanDerWaalsContact CZ-OD2 3.25Å; R428-D792 IonicContact NH1-OD2 2.76Å; R428-D792 PolarHBondContact NH1-OD2 3.3Å; R428-D792 IonicContact NH2-OD2 2.73Å; R428-D792 PolarHBondContact NH2-OD2 3.5Å; F790-D792 PolarHBondContact O-N 3.17Å; D792-L794 VanDerWaalsContact C-N 3.25Å; D792-L794 PolarHBondContact O-N 2.97Å; D792-Q795 WeakPolarHBondContact O-CB 3.42Å; D792-Q795 PolarHBondContact O-N 2.86Å; D792-S796 PolarHBondContact O-N 3.5Å
793	T	90.6	Very high	87.5	Confident	1 Å²	1	43 Å²	43	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-38.6	171.6	-73.5	0	0	0	0	111.3	L431 L600 L603 Y784 F790 N791 Q795 S796 L797	L431-T793 HydrophobicContact CD2-CG2 3.57Å; L600-T793 HydrophobicContact CD1-CG2 4.16Å; L603-T793 HydrophobicContact CD2-CG2 4.33Å; L603-T793 WeakPolarHBondContact CD2-OG1 3.47Å; Y784-T793 WeakPolarHBondContact CE1-OG1 3.42Å; Y784-T793 PolarHBondContact OH-N 2.92Å; Y784-T793 PolarHBondContact OH-OG1 2.67Å; F790-T793 HydrophobicContact CD1-CG2 4.04Å; F790-T793 HydrophobicContact CE1-CG2 3.35Å; F790-T793 HydrophobicContact CE2-CG2 4.28Å; F790-T793 HydrophobicContact CZ-CG2 3.5Å; F790-T793 VanDerWaalsContact CZ-CG2 3.5Å; F790-T793 PolarHBondContact O-N 2.92Å; N791-T793 VanDerWaalsContact C-N 3.35Å; N791-T793 PolarHBondContact O-N 3.18Å; T793-Q795 VanDerWaalsContact C-N 3.33Å; T793-Q795 PolarHBondContact O-N 3.39Å; T793-S796 PolarHBondContact O-N 2.92Å; T793-L797 HydrophobicContact CG2-CD1 3.83Å; T793-L797 HydrophobicContact CG2-CG 4.38Å; T793-L797 WeakPolarHBondContact O-CB 3.35Å; T793-L797 VanDerWaalsContact O-CG 3.26Å; T793-L797 WeakPolarHBondContact O-CG 3.28Å; T793-L797 PolarHBondContact O-N 3.12Å
794	L	91.3	Very high	87.2	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-36.1	174.6	-60.3	170.1	0	0	0	111.6	V762 L765 R766 F790 N791 D792 L797 V798	V762-L794 HydrophobicContact CG1-CB 4.24Å; V762-L794 HydrophobicContact CG1-CD2 4.3Å; L765-L794 HydrophobicContact CB-CD2 3.68Å; R766-L794 HydrophobicContact CB-CD1 3.75Å; R766-L794 HydrophobicContact CB-CD2 4.33Å; R766-L794 HydrophobicContact CG-CD1 3.81Å; F790-L794 HydrophobicContact CD1-CD2 4.2Å; F790-L794 HydrophobicContact CD1-CG 4.07Å; F790-L794 HydrophobicContact CE1-CD2 4.4Å; F790-L794 WeakPolarHBondContact O-CG 3.46Å; F790-L794 PolarHBondContact O-N 3.27Å; N791-L794 WeakPolarHBondContact O-CA 3.32Å; N791-L794 VanDerWaalsContact O-CB 3.3Å; N791-L794 WeakPolarHBondContact O-CB 3.42Å; N791-L794 PolarHBondContact O-N 3.44Å; D792-L794 VanDerWaalsContact C-N 3.25Å; D792-L794 PolarHBondContact O-N 2.97Å; L794-L797 PolarHBondContact O-N 3Å; L794-V798 WeakPolarHBondContact O-CG2 3.41Å; L794-V798 PolarHBondContact O-N 3.14Å
795	Q	90.9	Very high	87.1	Confident	121 Å²	121	52.4 Å²	52.4	57%	0.565	28%	0.275	S	S	*	.	H	α-helix	trans	-68.3	-45.7	174.8	-60	-68	37.2	0	0	112.1	N791 D792 T793 L797 V798	N791-Q795 PolarHBondContact O-N 3.14Å; D792-Q795 WeakPolarHBondContact O-CB 3.42Å; D792-Q795 PolarHBondContact O-N 2.86Å; T793-Q795 VanDerWaalsContact C-N 3.33Å; T793-Q795 PolarHBondContact O-N 3.39Å; Q795-L797 VanDerWaalsContact C-N 3.27Å; Q795-L797 PolarHBondContact O-N 3.19Å; Q795-V798 WeakPolarHBondContact O-CB 3.49Å; Q795-V798 PolarHBondContact O-N 2.8Å; Q795-V798 VanDerWaalsContact O-N 3.07Å
796	S	90.3	Very high	87	Confident	14 Å²	14	56.7 Å²	56.7	10%	0.098	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-37.2	175	-69.8	0	0	0	0	111.7	V435 D792 T793 K799	V435-S796 WeakPolarHBondContact CG1-O 3.48Å; D792-S796 PolarHBondContact O-N 3.5Å; T793-S796 PolarHBondContact O-N 2.92Å; S796-K799 WeakPolarHBondContact O-CB 3.37Å; S796-K799 WeakPolarHBondContact O-CG 3.13Å; S796-K799 PolarHBondContact O-N 3.04Å
797	L	91	Very high	87	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-75.3	-19.3	174.5	-69.5	172.5	0	0	0	114.3	V435 L596 L600 L761 V762 L765 T793 L794 Q795 K799 L800	V435-L797 HydrophobicContact CG2-CD2 4.05Å; L596-L797 HydrophobicContact CD1-CD2 4.21Å; L600-L797 HydrophobicContact CD1-CD1 4.13Å; L761-L797 HydrophobicContact CD2-CD1 4.3Å; L761-L797 HydrophobicContact CD2-CD2 4.14Å; V762-L797 HydrophobicContact CG2-CB 3.53Å; L765-L797 HydrophobicContact CD1-CD1 3.76Å; T793-L797 HydrophobicContact CG2-CD1 3.83Å; T793-L797 HydrophobicContact CG2-CG 4.38Å; T793-L797 WeakPolarHBondContact O-CB 3.35Å; T793-L797 VanDerWaalsContact O-CG 3.26Å; T793-L797 WeakPolarHBondContact O-CG 3.28Å; T793-L797 PolarHBondContact O-N 3.12Å; L794-L797 PolarHBondContact O-N 3Å; Q795-L797 VanDerWaalsContact C-N 3.27Å; Q795-L797 PolarHBondContact O-N 3.19Å; L797-K799 PolarHBondContact O-N 3.46Å; L797-L800 HydrophobicContact CD2-CD1 4.1Å; L797-L800 PolarHBondContact O-N 2.9Å; L797-L800 VanDerWaalsContact O-N 3.14Å
798	V	89.3	Confident	87.2	Confident	53 Å²	53	52.1 Å²	52.1	32%	0.321	28%	0.282	S	S	.	.	H	α-helix	trans	-61.2	-31.9	172.4	161.5	0	0	0	0	110.8	V762 L794 Q795 L800 K801	V762-V798 HydrophobicContact CB-CG2 4.48Å; V762-V798 HydrophobicContact CG1-CG2 3.94Å; V762-V798 HydrophobicContact CG2-CG2 4.14Å; L794-V798 WeakPolarHBondContact O-CG2 3.41Å; L794-V798 PolarHBondContact O-N 3.14Å; Q795-V798 WeakPolarHBondContact O-CB 3.49Å; Q795-V798 PolarHBondContact O-N 2.8Å; Q795-V798 VanDerWaalsContact O-N 3.07Å; V798-L800 PolarHBondContact O-N 3.17Å; V798-K801 WeakPolarHBondContact O-CB 3.41Å; V798-K801 PolarHBondContact O-N 2.65Å
799	K	87.9	Confident	87.3	Confident	95 Å²	95	55 Å²	55	41%	0.413	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-18.5	175.1	-60.2	-179	177.2	179.6	0	114.6	V435 Q439 S796 L797 F803	V435-K799 HydrophobicContact CG1-CB 4.21Å; V435-K799 HydrophobicContact CG1-CD 4.17Å; Q439-K799 PolarHBondContact NE2-O 2.77Å; Q439-K799 VanDerWaalsContact NE2-O 3.15Å; S796-K799 WeakPolarHBondContact O-CB 3.37Å; S796-K799 WeakPolarHBondContact O-CG 3.13Å; S796-K799 PolarHBondContact O-N 3.04Å; L797-K799 PolarHBondContact O-N 3.46Å; K799-F803 WeakPolarHBondContact O-CE2 3.48Å
800	L	87.7	Confident	87.3	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.031	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-12	176.5	-59.7	-178.1	0	0	0	113.2	V435 V438 Q439 L596 L756 L797 V798 D802 F803 F805	V435-L800 HydrophobicContact CG1-CD2 4.1Å; V435-L800 HydrophobicContact CG1-CG 4.19Å; V435-L800 HydrophobicContact CG2-CD1 4.31Å; V438-L800 HydrophobicContact CB-CD2 4.06Å; V438-L800 HydrophobicContact CG1-CD2 3.83Å; Q439-L800 HydrophobicContact CG-CD2 3.82Å; L596-L800 HydrophobicContact CD1-CD1 4.23Å; L596-L800 HydrophobicContact CD2-CD1 3.72Å; L756-L800 HydrophobicContact CD2-CB 4.44Å; L756-L800 HydrophobicContact CD2-CD1 4.15Å; L797-L800 HydrophobicContact CD2-CD1 4.1Å; L797-L800 PolarHBondContact O-N 2.9Å; L797-L800 VanDerWaalsContact O-N 3.14Å; V798-L800 PolarHBondContact O-N 3.17Å; L800-D802 VanDerWaalsContact C-N 3.29Å; L800-D802 PolarHBondContact O-N 3.35Å; L800-F803 PolarHBondContact O-N 3.32Å; L800-F805 HydrophobicContact CB-CE2 4.4Å; L800-F805 WeakPolarHBondContact O-CE2 3.42Å
801	K	84.1	Confident	87.1	Confident	118 Å²	118	60.9 Å²	60.9	51%	0.513	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.4	-171.9	-170.9	-169.2	126.8	-74.2	0	113.4	V798 F803	V798-K801 WeakPolarHBondContact O-CB 3.41Å; V798-K801 PolarHBondContact O-N 2.65Å; K801-F803 PolarHBondContact O-N 2.76Å
802	D	79.7	Confident	86.6	Confident	120 Å²	120	58.3 Å²	58.3	64%	0.642	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	11.9	-170.8	-51.2	-40.3	0	0	0	112.7	L800	L800-D802 VanDerWaalsContact C-N 3.29Å; L800-D802 PolarHBondContact O-N 3.35Å
803	F	82.7	Confident	86.4	Confident	43 Å²	43	55.5 Å²	55.5	19%	0.189	28%	0.277	C	S	.	.	S	Bend	trans	-114.3	134.8	174.6	-60.5	-73.5	0	0	0	111.3	Q439 V442 V443 K799 L800 K801 F805	Q439-F803 HydrophobicContact CB-CE2 4.42Å; Q439-F803 HydrophobicContact CG-CE2 3.96Å; V442-F803 HydrophobicContact CB-CD1 4.3Å; V442-F803 HydrophobicContact CG1-CB 3.9Å; V442-F803 HydrophobicContact CG1-CD1 3.36Å; V442-F803 HydrophobicContact CG1-CE1 4.01Å; V442-F803 HydrophobicContact CG1-CG 3.73Å; V443-F803 HydrophobicContact CG2-CE1 4.23Å; V443-F803 HydrophobicContact CG2-CZ 4.4Å; K799-F803 WeakPolarHBondContact O-CE2 3.48Å; L800-F803 PolarHBondContact O-N 3.32Å; K801-F803 PolarHBondContact O-N 2.76Å; F803-F805 HydrophobicContact CB-CD2 4.47Å; F803-F805 HydrophobicContact CB-CE2 3.92Å; F803-F805 HydrophobicContact CB-CZ 4.19Å; F803-F805 WeakPolarHBondContact O-CD2 3.16Å
804	E	81	Confident	85.9	Confident	179 Å²	179	60.4 Å²	60.4	84%	0.836	30%	0.296	S	S	*	.			trans	-80.1	126.4	171.8	-63	179.1	162.7	0	0	110
805	F	85.3	Confident	85.2	Confident	20 Å²	20	64.7 Å²	64.7	9%	0.088	32%	0.316	C	S	.	.			trans	-113.1	132.6	-178.4	-73.1	-82.1	0	0	0	111.9	V438 V442 V588 L756 N757 L800 F803 L807	V438-F805 HydrophobicContact CG1-CE1 3.77Å; V438-F805 HydrophobicContact CG1-CZ 3.8Å; V442-F805 HydrophobicContact CG2-CE1 3.72Å; V442-F805 HydrophobicContact CG2-CZ 4.23Å; V588-F805 HydrophobicContact CG1-CD1 4.33Å; V588-F805 HydrophobicContact CG1-CE1 4.23Å; L756-F805 HydrophobicContact CB-CB 4.33Å; L756-F805 HydrophobicContact CB-CD2 4Å; L756-F805 HydrophobicContact CB-CE2 4.5Å; L756-F805 HydrophobicContact CB-CG 4.14Å; L756-F805 HydrophobicContact CD2-CD2 4.44Å; L756-F805 HydrophobicContact CD2-CE2 4.12Å; N757-F805 WeakPolarHBondContact CA-O 3.39Å; N757-F805 WeakPolarHBondContact CB-O 3.46Å; N757-F805 WeakPolarHBondContact OD1-CB 3.44Å; N757-F805 PolarHBondContact OD1-O 3.43Å; N757-F805 VanDerWaalsContact OD1-O 3.08Å; L800-F805 HydrophobicContact CB-CE2 4.4Å; L800-F805 WeakPolarHBondContact O-CE2 3.42Å; F803-F805 HydrophobicContact CB-CD2 4.47Å; F803-F805 HydrophobicContact CB-CE2 3.92Å; F803-F805 HydrophobicContact CB-CZ 4.19Å; F803-F805 WeakPolarHBondContact O-CD2 3.16Å; F805-L807 HydrophobicContact CB-CD1 4.12Å; F805-L807 HydrophobicContact CB-CG 4.12Å; F805-L807 HydrophobicContact CD1-CD1 3.91Å; F805-L807 HydrophobicContact CD1-CD2 4.46Å; F805-L807 HydrophobicContact CD1-CG 4.1Å; F805-L807 HydrophobicContact CG-CD1 4.21Å
806	A	85.1	Confident	84.6	Confident	92 Å²	92	61 Å²	61	76%	0.76	30%	0.3	S	S	*	.			trans	-111.4	41.9	174.4	0	0	0	0	0	111.8
807	L	87.7	Confident	84	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.031	31%	0.311	C	S	.	.			trans	-73.1	135.4	-171.1	-61	163.3	0	0	0	112	V588 V589 V592 L756 N757 F805 Y809	V588-L807 HydrophobicContact CG1-CD2 4.17Å; V589-L807 HydrophobicContact CB-CD2 4.48Å; V589-L807 HydrophobicContact CG2-CD2 3.9Å; V592-L807 HydrophobicContact CB-CD2 4.36Å; V592-L807 HydrophobicContact CG1-CD1 4Å; V592-L807 HydrophobicContact CG2-CD1 4.26Å; V592-L807 HydrophobicContact CG2-CD2 4.21Å; L756-L807 HydrophobicContact CB-CD1 3.81Å; L756-L807 HydrophobicContact CD1-CD1 3.65Å; L756-L807 HydrophobicContact CG-CD1 4.39Å; N757-L807 PolarHBondContact ND2-N 3.44Å; N757-L807 PolarHBondContact ND2-O 2.92Å; N757-L807 VanDerWaalsContact OD1-CB 3.27Å; N757-L807 WeakPolarHBondContact OD1-CB 3.1Å; N757-L807 PolarHBondContact OD1-N 2.69Å; F805-L807 HydrophobicContact CB-CD1 4.12Å; F805-L807 HydrophobicContact CB-CG 4.12Å; F805-L807 HydrophobicContact CD1-CD1 3.91Å; F805-L807 HydrophobicContact CD1-CD2 4.46Å; F805-L807 HydrophobicContact CD1-CG 4.1Å; F805-L807 HydrophobicContact CG-CD1 4.21Å; L807-Y809 PolarHBondContact O-N 3.4Å
808	P	88.1	Confident	83.3	Confident	21 Å²	21	69.5 Å²	69.5	14%	0.136	34%	0.336	C	S	.	.			trans	-73.2	98.2	176.5	29.9	-33.6	0	0	0	110.7	V589 D810 Y811	V589-P808 HydrophobicContact CG1-CG 3.96Å; V589-P808 HydrophobicContact CG2-CG 4.14Å; P808-D810 WeakPolarHBondContact CB-OD1 3.42Å; P808-D810 PolarHBondContact O-N 3.27Å; P808-Y811 HydrophobicContact CG-CD2 3.87Å; P808-Y811 HydrophobicContact CG-CG 4.49Å; P808-Y811 VanDerWaalsContact O-CB 3.29Å; P808-Y811 WeakPolarHBondContact O-CB 3.43Å; P808-Y811 PolarHBondContact O-N 3.3Å
809	Y	87.6	Confident	82.4	Confident	92 Å²	92	72 Å²	72	36%	0.361	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.7	173.2	71.9	-91.7	0	0	0	112.1	H737 A750 I754 L807 Y811	H737-Y809 PolarHBondContact CE1-O 3.28Å; A750-Y809 WeakPolarHBondContact CB-O 3.49Å; I754-Y809 HydrophobicContact CD1-CD2 4.02Å; I754-Y809 HydrophobicContact CD1-CG 3.98Å; I754-Y809 VanDerWaalsContact CG1-CB 3.47Å; I754-Y809 HydrophobicContact CG1-CD1 4.16Å; I754-Y809 HydrophobicContact CG1-CD2 4.28Å; I754-Y809 HydrophobicContact CG1-CG 3.73Å; L807-Y809 PolarHBondContact O-N 3.4Å; Y809-Y811 VanDerWaalsContact C-N 3.32Å
810	D	86.7	Confident	81.5	Confident	22 Å²	22	73 Å²	73	12%	0.118	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-0.8	178.4	71.5	-50.2	0	0	0	113.4	P808 S812 I813 R814	P808-D810 WeakPolarHBondContact CB-OD1 3.42Å; P808-D810 PolarHBondContact O-N 3.27Å; D810-S812 PolarHBondContact O-N 3Å; D810-I813 HydrophobicContact CB-CD1 4.41Å; D810-I813 HydrophobicContact CB-CG1 4.01Å; D810-I813 CarbonylContact O-C 3.57Å; D810-I813 WeakPolarHBondContact O-CA 3.4Å; D810-I813 VanDerWaalsContact O-CG1 3.25Å; D810-I813 WeakPolarHBondContact O-CG1 3.49Å; D810-I813 PolarHBondContact O-N 2.86Å; D810-R814 PolarHBondContact O-N 2.88Å; D810-R814 IonicContact OD1-CZ 3.72Å; D810-R814 IonicContact OD1-NE 2.85Å; D810-R814 IonicContact OD1-NH2 3.06Å; D810-R814 PolarHBondContact OD1-NH2 2.99Å; D810-R814 IonicContact OD2-CZ 3.46Å; D810-R814 IonicContact OD2-NE 3.96Å; D810-R814 PolarHBondContact OD2-NE 2.74Å; D810-R814 IonicContact OD2-NH2 3.95Å; D810-R814 PolarHBondContact OD2-NH2 2.84Å; D810-R814 VanDerWaalsContact OD2-NH2 3.14Å
811	Y	84.7	Confident	80.6	Confident	132 Å²	132	78.7 Å²	78.7	52%	0.518	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-35	-175.5	-171.8	-84.4	0	0	0	114.2	V589 P808 Y809	V589-Y811 HydrophobicContact CG1-CD2 4.25Å; V589-Y811 HydrophobicContact CG1-CE2 4.25Å; P808-Y811 HydrophobicContact CG-CD2 3.87Å; P808-Y811 HydrophobicContact CG-CG 4.49Å; P808-Y811 VanDerWaalsContact O-CB 3.29Å; P808-Y811 WeakPolarHBondContact O-CB 3.43Å; P808-Y811 PolarHBondContact O-N 3.3Å; Y809-Y811 VanDerWaalsContact C-N 3.32Å
812	S	79.7	Confident	79.7	Confident	22 Å²	22	76.9 Å²	76.9	15%	0.154	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.3	177.5	-70.4	0	0	0	0	114.8	R593 R742 D810	R593-S812 PolarHBondContact NH2-OG 3.09Å; R742-S812 PolarHBondContact NE-O 3.34Å; R742-S812 PolarHBondContact NH2-O 3.31Å; D810-S812 PolarHBondContact O-N 3Å
813	I	82.2	Confident	78.4	Confident	2 Å²	2	82 Å²	82	1%	0.01	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-11.5	176.4	58.5	172.6	0	0	0	113.3	Y740 R742 D810 H815 L816 K817	Y740-I813 HydrophobicContact CD2-CB 3.83Å; Y740-I813 HydrophobicContact CD2-CD1 4.5Å; Y740-I813 HydrophobicContact CD2-CG2 3.72Å; Y740-I813 HydrophobicContact CE2-CB 4.27Å; Y740-I813 HydrophobicContact CG-CG2 4.29Å; R742-I813 HydrophobicContact CG-CG2 3.82Å; D810-I813 HydrophobicContact CB-CD1 4.41Å; D810-I813 HydrophobicContact CB-CG1 4.01Å; D810-I813 CarbonylContact O-C 3.57Å; D810-I813 WeakPolarHBondContact O-CA 3.4Å; D810-I813 VanDerWaalsContact O-CG1 3.25Å; D810-I813 WeakPolarHBondContact O-CG1 3.49Å; D810-I813 PolarHBondContact O-N 2.86Å; I813-H815 PolarHBondContact O-N 3.14Å; I813-L816 CarbonylContact O-C 3.59Å; I813-L816 WeakPolarHBondContact O-CA 3.23Å; I813-L816 WeakPolarHBondContact O-CB 3.43Å; I813-L816 PolarHBondContact O-N 3.15Å; I813-K817 PolarHBondContact O-N 3.13Å
814	R	80.5	Confident	78.2	Confident	105 Å²	105	84 Å²	84	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-50.6	-55.6	-176.5	-177.6	170.1	-61.5	-170.7	0.6	112.8	D810 L816 K817 E818	D810-R814 PolarHBondContact O-N 2.88Å; D810-R814 IonicContact OD1-CZ 3.72Å; D810-R814 IonicContact OD1-NE 2.85Å; D810-R814 IonicContact OD1-NH2 3.06Å; D810-R814 PolarHBondContact OD1-NH2 2.99Å; D810-R814 IonicContact OD2-CZ 3.46Å; D810-R814 IonicContact OD2-NE 3.96Å; D810-R814 PolarHBondContact OD2-NE 2.74Å; D810-R814 IonicContact OD2-NH2 3.95Å; D810-R814 PolarHBondContact OD2-NH2 2.84Å; D810-R814 VanDerWaalsContact OD2-NH2 3.14Å; R814-L816 PolarHBondContact O-N 3.38Å; R814-L816 VanDerWaalsContact O-N 3.12Å; R814-K817 WeakPolarHBondContact O-CA 3.42Å; R814-K817 WeakPolarHBondContact O-CB 3.47Å; R814-K817 PolarHBondContact O-N 3.48Å; R814-E818 WeakPolarHBondContact CD-OE1 3.25Å; R814-E818 VanDerWaalsContact CG-CD 3.47Å; R814-E818 HydrophobicContact CG-CG 4.28Å; R814-E818 WeakPolarHBondContact CG-OE1 2.97Å; R814-E818 WeakPolarHBondContact O-CG 3.36Å; R814-E818 PolarHBondContact O-N 2.72Å
815	H	77.8	Confident	78	Confident	92 Å²	92	79 Å²	79	43%	0.426	40%	0.395	S	S	.	.	H	α-helix	trans	-62.7	-22.3	177.9	81.5	86	0	0	0	114	R742 I813 E818 M819	R742-H815 PolarHBondContact NH2-NE2 3.29Å; I813-H815 PolarHBondContact O-N 3.14Å; H815-E818 WeakPolarHBondContact CA-OE2 3.34Å; H815-M819 WeakPolarHBondContact O-CB 3.39Å; H815-M819 WeakPolarHBondContact O-CG 3.39Å; H815-M819 PolarHBondContact O-N 2.95Å; H815-M819 VanDerWaalsContact O-N 3.13Å
816	L	78.7	Confident	77.6	Confident	44 Å²	44	82.3 Å²	82.3	23%	0.23	41%	0.412	C	S	.	.	H	α-helix	trans	-84.8	-26.1	174.4	-63.5	-179.2	0	0	0	112.7	Y740 R742 I813 R814 H820	Y740-L816 HydrophobicContact CD1-CB 3.74Å; Y740-L816 HydrophobicContact CD1-CD1 3.89Å; Y740-L816 HydrophobicContact CD1-CG 4.46Å; Y740-L816 HydrophobicContact CE1-CB 3.83Å; Y740-L816 HydrophobicContact CG-CB 4.17Å; Y740-L816 HydrophobicContact CG-CD1 3.94Å; R742-L816 VanDerWaalsContact CZ-CD1 3.48Å; I813-L816 CarbonylContact O-C 3.59Å; I813-L816 WeakPolarHBondContact O-CA 3.23Å; I813-L816 WeakPolarHBondContact O-CB 3.43Å; I813-L816 PolarHBondContact O-N 3.15Å; R814-L816 PolarHBondContact O-N 3.38Å; R814-L816 VanDerWaalsContact O-N 3.12Å; L816-H820 VanDerWaalsContact O-CB 3.23Å; L816-H820 WeakPolarHBondContact O-CB 3.49Å; L816-H820 PolarHBondContact O-N 3.08Å; L816-H820 VanDerWaalsContact O-N 3.14Å
817	K	76.4	Confident	77.2	Confident	79 Å²	79	81.7 Å²	81.7	34%	0.343	39%	0.392	S	S	.	.	H	α-helix	trans	-69.8	-55	165.9	-72.1	-175.3	165.1	-163.5	0	109.8	Y740 I813 R814 M819 H820 D821	Y740-K817 HydrophobicContact CE2-CG 4.03Å; I813-K817 PolarHBondContact O-N 3.13Å; R814-K817 WeakPolarHBondContact O-CA 3.42Å; R814-K817 WeakPolarHBondContact O-CB 3.47Å; R814-K817 PolarHBondContact O-N 3.48Å; K817-M819 PolarHBondContact O-N 3.35Å; K817-M819 VanDerWaalsContact O-N 3.15Å; K817-H820 CarbonylContact O-C 3.59Å; K817-H820 WeakPolarHBondContact O-CA 3.3Å; K817-H820 PolarHBondContact O-N 2.95Å; K817-D821 WeakPolarHBondContact O-CB 3.13Å; K817-D821 PolarHBondContact O-N 3.43Å
818	E	75.7	Confident	76.5	Confident	116 Å²	116	86.4 Å²	86.4	54%	0.542	41%	0.414	S	S	.	.	H	α-helix	trans	-54.4	-36.9	179	-68.3	162.2	166.3	0	0	112.6	R814 H815 A822	R814-E818 WeakPolarHBondContact CD-OE1 3.25Å; R814-E818 VanDerWaalsContact CG-CD 3.47Å; R814-E818 HydrophobicContact CG-CG 4.28Å; R814-E818 WeakPolarHBondContact CG-OE1 2.97Å; R814-E818 WeakPolarHBondContact O-CG 3.36Å; R814-E818 PolarHBondContact O-N 2.72Å; H815-E818 WeakPolarHBondContact CA-OE2 3.34Å; E818-A822 WeakPolarHBondContact O-CB 3.03Å
819	M	72	Confident	75.7	Confident	105 Å²	105	90.8 Å²	90.8	52%	0.517	43%	0.433	S	S	.	.	H	α-helix	trans	-70.9	-43.2	170.5	-73.4	174.3	78.1	0	0	113.2	H815 K817 A822 F823	H815-M819 WeakPolarHBondContact O-CB 3.39Å; H815-M819 WeakPolarHBondContact O-CG 3.39Å; H815-M819 PolarHBondContact O-N 2.95Å; H815-M819 VanDerWaalsContact O-N 3.13Å; K817-M819 PolarHBondContact O-N 3.35Å; K817-M819 VanDerWaalsContact O-N 3.15Å; M819-A822 PolarHBondContact O-N 3.36Å; M819-F823 WeakPolarHBondContact O-CD2 3.42Å
820	H	67.7	Low	74.9	Confident	117 Å²	117	90.7 Å²	90.7	54%	0.542	44%	0.438	S	S	.	.	H	α-helix	trans	-68.6	-34.3	179.2	-177.1	-60.8	0	0	0	112.5	L816 K817 A822 F823	L816-H820 VanDerWaalsContact O-CB 3.23Å; L816-H820 WeakPolarHBondContact O-CB 3.49Å; L816-H820 PolarHBondContact O-N 3.08Å; L816-H820 VanDerWaalsContact O-N 3.14Å; K817-H820 CarbonylContact O-C 3.59Å; K817-H820 WeakPolarHBondContact O-CA 3.3Å; K817-H820 PolarHBondContact O-N 2.95Å; H820-A822 PolarHBondContact O-N 3.33Å; H820-F823 PolarHBondContact O-N 3.31Å
821	D	70	Confident	74	Confident	125 Å²	125	96 Å²	96	67%	0.668	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.1	178.7	-58.6	-29.9	0	0	0	111.7	K817	K817-D821 WeakPolarHBondContact O-CB 3.13Å; K817-D821 PolarHBondContact O-N 3.43Å
822	A	64.6	Low	73.1	Confident	80 Å²	80	93 Å²	93	66%	0.661	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	5.2	173.9	0	0	0	0	0	114	E818 M819 H820	E818-A822 WeakPolarHBondContact O-CB 3.03Å; M819-A822 PolarHBondContact O-N 3.36Å; H820-A822 PolarHBondContact O-N 3.33Å
823	F	51.9	Low	72.5	Confident	229 Å²	229	99.5 Å²	99.5	100%	1.004	49%	0.486	S	S	*	.			trans	-121.5	0	178.7	-75.3	-56.5	0	0	0	112.6	M819 H820	M819-F823 WeakPolarHBondContact O-CD2 3.42Å; H820-F823 PolarHBondContact O-N 3.31Å

Retrieved 823 of 823 residues in 202.8 ms (Link to these results)

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