A0A3Q0KFE7_SCHMA Loading...

Putative m-phase inducer phosphatase(Cdc25) AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KFE7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 895 aa.

						>A0A3Q0KFE7_SCHMA|A0A3Q0KFE7
MNMGDLSSDTPVTRLSKILSKANFLEVSKTKTAPKLHQISEIIPPDIDESANQEPPTTSVWSEAPEFFVRESSNSCSSGYYSGATTHSAPASSICERFFEINADHDPPISLIRSVYETTESTAPGDITLRRAHSCSSRGWLAKRHIRQQWPRISGISRERETSLVGIANTDTNSCPAAIVHDNNPCNLRRYSLPPVGESGSGSTSEASPPRDHLVSFLTSTKSPSFEKRMECSSSLLHPIPKKQRIESPREIDCNSTIPTEELTENSEHDNIGSLFSNPNGGPKPFFELLRHHSTPMPSSYSYKHCPSSPVEVFNDENSNKPRISRCLSEMHSVSYDAIARCIGSLSNHSLCSDGRRVRALPVVDRTGSGLHCVSTDTVSDLISGSKRNINYVIVDCRFPYEYEGGHIKGAINIFTHCDLVQEIFNRVPAQRPPGTSGPPRFLGEDLARRLATTQREPLSAPCELISDDEDEDEFPENTTSEISDSDLAYANDEVILEKNIHNDSPKSEPDLSYVSSGLSNISESSNQDPPFVVIFHCEFSSQRAPALAAFLRSVDRVSNYHRYPFLYFPEIYIMKGGYSAFYRKFPHLCTPQEYVKMFHRDYRNHLRLYKRLTRRVSSACMACIKPQQTEVDKSQIPVSEVDSYCQLPLNLKVGVHGMLTTHKPPTYQFRSNHDLCMHEDNSISDLVNYENKENYSPSGPELCSKSQSHHSCPSHNVNEEPKNAMPASPSVEGCDQVSSSVVDSPLGLAEVVVRVGRRVIAATLGSTNNNCSEVARALDRIKYHHSPQSIQPLEGKPPVRCLKRSLTTNSLDIRHQLIRPKVFNPFCGGNSYSQNTPSIRRVRTNSNTDLLSVDNTVNSILAPTPSTTSNQIHQVQSSPQKEHLSYHSLSTCSE
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	32.5	Very low	49	Very low	243 Å²	243	128.5 Å²	128.5	100%	1.197	75%	0.749	S	S	*	*				0	150.6	0	-77.3	-178.1	163.9	0	0	109.7
2	N	37.3	Very low	50.9	Low	166 Å²	166	127.1 Å²	127.1	89%	0.888	74%	0.743	S	S	*	*			trans	49.7	80.9	-178.8	-73.1	16.9	0	0	0	117.1
3	M	33.6	Very low	52.7	Low	196 Å²	196	121.7 Å²	121.7	97%	0.966	71%	0.713	S	S	*	*			trans	-75.3	138.1	151.7	-72.8	-88.5	-85.3	0	0	109.6
4	G	36	Very low	54.2	Low	63 Å²	63	122.8 Å²	122.8	65%	0.649	70%	0.699	S	S	*	*			trans	179.2	149.6	175.3	0	0	0	0	0	114.2
5	D	40.8	Very low	55	Low	169 Å²	169	121.9 Å²	121.9	90%	0.904	69%	0.69	S	S	*	*			trans	52.1	70.2	159.2	-57.8	-18.3	0	0	0	119.8
6	L	45.4	Very low	56	Low	121 Å²	121	119.1 Å²	119.1	63%	0.634	68%	0.681	S	S	*	*			trans	-135.1	39.9	169.4	-101.2	166.8	0	0	0	114.1
7	S	46.7	Very low	57	Low	128 Å²	128	118.5 Å²	118.5	90%	0.895	67%	0.669	S	S	*	*	S	Bend	trans	-91.3	-15.6	-167.3	-160.4	0	0	0	0	116.6
8	S	58.4	Low	57.8	Low	113 Å²	113	117.8 Å²	117.8	79%	0.79	66%	0.662	S	S	*	*			trans	-130.7	6.2	-163.1	56.2	0	0	0	0	117.1	T10	S8-T10 PolarHBondContact O-N 3.24Å
9	D	62.4	Low	58.2	Low	39 Å²	39	117.6 Å²	117.6	21%	0.209	66%	0.658	C	S	.	*			trans	-76.6	124	179.7	-91.4	-50.4	0	0	0	113.6	T13 R14 K17	D9-T13 VanDerWaalsContact OD1-CB 3.32Å; D9-T13 WeakPolarHBondContact OD1-CB 3.4Å; D9-T13 PolarHBondContact OD1-OG1 2.88Å; D9-R14 HydrophobicContact CB-CG 3.83Å; D9-K17 IonicContact OD1-NZ 2.76Å; D9-K17 PolarHBondContact OD1-NZ 2.99Å; D9-K17 IonicContact OD2-NZ 3.74Å; D9-K17 PolarHBondContact OD2-NZ 3.33Å
10	T	77.4	Confident	58.6	Low	74 Å²	74	115.3 Å²	115.3	45%	0.454	65%	0.65	S	S	.	*			trans	-63.3	157.5	166	69.3	0	0	0	0	111.5	S8 V12 T13 R14	S8-T10 PolarHBondContact O-N 3.24Å; T10-V12 PolarHBondContact O-N 3.34Å; T10-T13 PolarHBondContact N-OG1 2.64Å; T10-T13 PolarHBondContact O-N 3.37Å; T10-T13 VanDerWaalsContact O-N 3.12Å; T10-T13 PolarHBondContact O-OG1 3.04Å; T10-T13 VanDerWaalsContact O-OG1 3.09Å; T10-T13 PolarHBondContact OG1-N 3.22Å; T10-T13 VanDerWaalsContact OG1-N 3.09Å; T10-T13 PolarHBondContact OG1-OG1 3.33Å; T10-R14 PolarHBondContact O-N 3.42Å
11	P	68.8	Low	58.6	Low	101 Å²	101	118 Å²	118	66%	0.656	66%	0.655	S	S	*	*	H	α-helix	trans	-59	-29.9	175.5	21.9	-33.3	0	0	0	113.4	L15	P11-L15 WeakPolarHBondContact O-CG 3.18Å; P11-L15 PolarHBondContact O-N 2.78Å
12	V	71.5	Confident	59.5	Low	112 Å²	112	109.7 Å²	109.7	68%	0.679	63%	0.625	S	S	*	*	H	α-helix	trans	-70.8	-42.7	175.8	-176.8	0	0	0	0	111.1	T10 L15 S16	T10-V12 PolarHBondContact O-N 3.34Å; V12-L15 PolarHBondContact O-N 2.81Å; V12-S16 WeakPolarHBondContact O-CB 3.36Å; V12-S16 PolarHBondContact O-N 3.09Å
13	T	74.9	Confident	59.9	Low	57 Å²	57	108.4 Å²	108.4	35%	0.35	62%	0.618	S	S	.	*	H	α-helix	trans	-71.3	-31.1	175.9	55.2	0	0	0	0	112.5	D9 T10 K17	D9-T13 VanDerWaalsContact OD1-CB 3.32Å; D9-T13 WeakPolarHBondContact OD1-CB 3.4Å; D9-T13 PolarHBondContact OD1-OG1 2.88Å; T10-T13 PolarHBondContact N-OG1 2.64Å; T10-T13 PolarHBondContact O-N 3.37Å; T10-T13 VanDerWaalsContact O-N 3.12Å; T10-T13 PolarHBondContact O-OG1 3.04Å; T10-T13 VanDerWaalsContact O-OG1 3.09Å; T10-T13 PolarHBondContact OG1-N 3.22Å; T10-T13 VanDerWaalsContact OG1-N 3.09Å; T10-T13 PolarHBondContact OG1-OG1 3.33Å; T13-K17 WeakPolarHBondContact O-CB 3.47Å; T13-K17 VanDerWaalsContact O-CG 3.31Å; T13-K17 WeakPolarHBondContact O-CG 3.46Å; T13-K17 PolarHBondContact O-N 3.34Å
14	R	73.8	Confident	60.2	Low	137 Å²	137	107.7 Å²	107.7	52%	0.517	61%	0.61	S	S	.	*	H	α-helix	trans	-60.6	-52	167.5	-78	-165.2	174.1	-179.2	-1.8	111.9	D9 T10 S16 K17 I18	D9-R14 HydrophobicContact CB-CG 3.83Å; T10-R14 PolarHBondContact O-N 3.42Å; R14-S16 VanDerWaalsContact C-N 3.32Å; R14-S16 PolarHBondContact O-N 3.46Å; R14-K17 PolarHBondContact O-N 2.84Å; R14-K17 VanDerWaalsContact O-N 3.15Å; R14-I18 VanDerWaalsContact O-CG1 3.29Å; R14-I18 WeakPolarHBondContact O-CG1 3.28Å; R14-I18 PolarHBondContact O-N 3.41Å
15	L	65.5	Low	60.2	Low	109 Å²	109	112.8 Å²	112.8	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-60.4	-41.8	178.3	-76.5	169.2	0	0	0	111.9	P11 V12 K17 I18 L19	P11-L15 WeakPolarHBondContact O-CG 3.18Å; P11-L15 PolarHBondContact O-N 2.78Å; V12-L15 PolarHBondContact O-N 2.81Å; L15-K17 PolarHBondContact O-N 3.07Å; L15-I18 PolarHBondContact O-N 3.4Å; L15-L19 WeakPolarHBondContact O-CB 3.37Å; L15-L19 WeakPolarHBondContact O-CG 3.29Å; L15-L19 PolarHBondContact O-N 3.2Å
16	S	71.5	Confident	59.9	Low	77 Å²	77	113.3 Å²	113.3	54%	0.538	62%	0.619	S	S	.	*	H	α-helix	trans	-60.5	-41.8	174.4	-169.1	0	0	0	0	112.6	V12 R14 S20	V12-S16 WeakPolarHBondContact O-CB 3.36Å; V12-S16 PolarHBondContact O-N 3.09Å; R14-S16 VanDerWaalsContact C-N 3.32Å; R14-S16 PolarHBondContact O-N 3.46Å; S16-S20 WeakPolarHBondContact O-CB 3.5Å; S16-S20 PolarHBondContact O-N 2.67Å; S16-S20 PolarHBondContact O-OG 3.42Å
17	K	73.4	Confident	59.2	Low	109 Å²	109	113.6 Å²	113.6	47%	0.474	63%	0.625	S	S	.	*	H	α-helix	trans	-70.2	-31.3	177.9	-79.4	168.5	168.2	167.7	0	113.3	D9 T13 R14 L15 S20 K21	D9-K17 IonicContact OD1-NZ 2.76Å; D9-K17 PolarHBondContact OD1-NZ 2.99Å; D9-K17 IonicContact OD2-NZ 3.74Å; D9-K17 PolarHBondContact OD2-NZ 3.33Å; T13-K17 WeakPolarHBondContact O-CB 3.47Å; T13-K17 VanDerWaalsContact O-CG 3.31Å; T13-K17 WeakPolarHBondContact O-CG 3.46Å; T13-K17 PolarHBondContact O-N 3.34Å; R14-K17 PolarHBondContact O-N 2.84Å; R14-K17 VanDerWaalsContact O-N 3.15Å; L15-K17 PolarHBondContact O-N 3.07Å; K17-S20 WeakPolarHBondContact CA-OG 3.14Å; K17-S20 PolarHBondContact O-OG 3.32Å; K17-S20 VanDerWaalsContact O-OG 3.12Å; K17-K21 WeakPolarHBondContact O-CB 3.29Å; K17-K21 WeakPolarHBondContact O-CG 3.3Å; K17-K21 PolarHBondContact O-N 2.99Å
18	I	70.7	Confident	58.7	Low	106 Å²	106	112.8 Å²	112.8	54%	0.544	62%	0.62	S	S	.	*	H	α-helix	trans	-70.6	-50.7	174.6	-69.2	162.6	0	0	0	109.6	R14 L15 S20 K21 A22	R14-I18 VanDerWaalsContact O-CG1 3.29Å; R14-I18 WeakPolarHBondContact O-CG1 3.28Å; R14-I18 PolarHBondContact O-N 3.41Å; L15-I18 PolarHBondContact O-N 3.4Å; I18-S20 VanDerWaalsContact C-N 3.35Å; I18-S20 PolarHBondContact O-N 2.85Å; I18-K21 PolarHBondContact O-N 2.99Å; I18-K21 VanDerWaalsContact O-N 3.07Å; I18-A22 PolarHBondContact O-N 3.14Å
19	L	65.7	Low	57.6	Low	114 Å²	114	116.5 Å²	116.5	60%	0.597	62%	0.621	S	S	*	*	H	α-helix	trans	-63.6	-37.2	179.1	-67.2	169.7	0	0	0	112.4	L15 K21 A22	L15-L19 WeakPolarHBondContact O-CB 3.37Å; L15-L19 WeakPolarHBondContact O-CG 3.29Å; L15-L19 PolarHBondContact O-N 3.2Å; L19-K21 VanDerWaalsContact C-N 3.28Å; L19-K21 PolarHBondContact O-N 2.89Å; L19-A22 PolarHBondContact O-N 3.41Å
20	S	65.8	Low	56.4	Low	71 Å²	71	121.5 Å²	121.5	50%	0.497	65%	0.654	S	S	.	*	H	α-helix	trans	-69.5	-22.1	174.2	66.3	0	0	0	0	114	S16 K17 I18	S16-S20 WeakPolarHBondContact O-CB 3.5Å; S16-S20 PolarHBondContact O-N 2.67Å; S16-S20 PolarHBondContact O-OG 3.42Å; K17-S20 WeakPolarHBondContact CA-OG 3.14Å; K17-S20 PolarHBondContact O-OG 3.32Å; K17-S20 VanDerWaalsContact O-OG 3.12Å; I18-S20 VanDerWaalsContact C-N 3.35Å; I18-S20 PolarHBondContact O-N 2.85Å
21	K	59.2	Low	54.2	Low	173 Å²	173	127.5 Å²	127.5	75%	0.752	67%	0.673	S	S	*	*	H	α-helix	trans	-87.2	-27.5	174.5	-81.2	-172.1	171.2	-169.4	0	113.1	K17 I18 L19 N23	K17-K21 WeakPolarHBondContact O-CB 3.29Å; K17-K21 WeakPolarHBondContact O-CG 3.3Å; K17-K21 PolarHBondContact O-N 2.99Å; I18-K21 PolarHBondContact O-N 2.99Å; I18-K21 VanDerWaalsContact O-N 3.07Å; L19-K21 VanDerWaalsContact C-N 3.28Å; L19-K21 PolarHBondContact O-N 2.89Å; K21-N23 VanDerWaalsContact C-N 3.32Å
22	A	51.9	Low	52.8	Low	69 Å²	69	129.8 Å²	129.8	57%	0.57	69%	0.686	S	S	*	*	H	α-helix	trans	-65.7	-34.8	175.9	0	0	0	0	0	112.3	I18 L19 F24	I18-A22 PolarHBondContact O-N 3.14Å; L19-A22 PolarHBondContact O-N 3.41Å; A22-F24 PolarHBondContact O-N 3.18Å; A22-F24 VanDerWaalsContact O-N 3.08Å
23	N	44.6	Very low	50.9	Low	139 Å²	139	128.9 Å²	128.9	74%	0.743	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	29.3	-176	-68.2	5.8	0	0	0	114.6	K21	K21-N23 VanDerWaalsContact C-N 3.32Å
24	F	39.5	Very low	49	Very low	181 Å²	181	132.4 Å²	132.4	79%	0.794	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	20.3	-173.1	-121.1	-77	0	0	0	116.3	A22	A22-F24 PolarHBondContact O-N 3.18Å; A22-F24 VanDerWaalsContact O-N 3.08Å
25	L	35.7	Very low	47	Very low	170 Å²	170	134.8 Å²	134.8	89%	0.89	73%	0.728	S	S	*	*			trans	-115.6	96.4	167.8	-106.2	77	0	0	0	110.8
26	E	34.8	Very low	45.5	Very low	180 Å²	180	138.1 Å²	138.1	84%	0.841	75%	0.746	S	S	*	*			trans	-100.9	130.8	163.7	-90.8	-154.3	111	0	0	112
27	V	32.3	Very low	43.7	Very low	126 Å²	126	142.2 Å²	142.2	76%	0.764	76%	0.756	S	S	*	*			trans	43.4	108.1	137.8	-170	0	0	0	0	118.5
28	S	35.8	Very low	41.8	Very low	112 Å²	112	146 Å²	146	78%	0.783	78%	0.775	S	S	*	*			trans	-143.1	115.2	137.2	67.6	0	0	0	0	113
29	K	34.8	Very low	40	Very low	190 Å²	190	149.1 Å²	149.1	83%	0.826	79%	0.791	S	S	*	*			trans	31.3	127.1	148.5	-58.6	161.8	-173.3	169.2	0	117.3
30	T	37.2	Very low	38.6	Very low	145 Å²	145	148.7 Å²	148.7	89%	0.89	80%	0.798	S	S	*	*				-160	175.7	72.5	33.8	0	0	0	0	113.6
31	K	32.2	Very low	37	Very low	199 Å²	199	153.2 Å²	153.2	87%	0.865	81%	0.811	S	S	*	*			trans	-89.2	139.9	-176.2	-57.3	170.7	177.8	176.5	0	112.9
32	T	37.7	Very low	36.1	Very low	149 Å²	149	152.6 Å²	152.6	91%	0.914	81%	0.814	S	S	*	*				-167.4	156.4	123.1	22	0	0	0	0	109.8
33	A	31.3	Very low	35.6	Very low	94 Å²	94	155.8 Å²	155.8	78%	0.777	82%	0.82	S	S	*	*			trans	-152.9	142.2	177.4	0	0	0	0	0	111.9
34	P	35.9	Very low	35.5	Very low	131 Å²	131	154 Å²	154	85%	0.851	82%	0.816	S	S	*	*			trans	-103.7	170	151.9	35.5	-27.2	0	0	0	111.5
35	K	31.1	Very low	35.5	Very low	187 Å²	187	151.1 Å²	151.1	81%	0.813	82%	0.816	S	S	*	*			trans	-104.5	144.2	-170.2	-54.4	167.9	-176.1	173.5	0	111.8
36	L	34.9	Very low	35.8	Very low	179 Å²	179	150.4 Å²	150.4	94%	0.937	81%	0.813	S	S	*	*			trans	-131.5	139.9	147.6	-82.6	174.6	0	0	0	109.4
37	H	32.9	Very low	36.2	Very low	162 Å²	162	149.3 Å²	149.3	75%	0.75	81%	0.811	S	S	*	*			trans	-113.6	155.7	176.2	-91.4	-84.9	0	0	0	109.1
38	Q	33.5	Very low	36.8	Very low	188 Å²	188	148.8 Å²	148.8	88%	0.879	80%	0.804	S	S	*	*			trans	67.5	134.6	-175.6	-56.1	166.1	-24.1	0	0	110.9
39	I	34.1	Very low	37.2	Very low	173 Å²	173	151.4 Å²	151.4	89%	0.887	80%	0.804	S	S	*	*			cis	-119.1	138.2	28.2	-66.4	147.3	0	0	0	111
40	S	35.3	Very low	37.7	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	79%	0.794	S	S	*	*			trans	-96.5	147.3	172.6	53.5	0	0	0	0	111.6
41	E	32.8	Very low	38.2	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	78%	0.778	S	S	*	*			trans	-65.3	147.5	-173.2	-59.6	151.5	117.5	0	0	114
42	I	39.2	Very low	39.1	Very low	160 Å²	160	140.7 Å²	140.7	82%	0.821	78%	0.776	S	S	*	*			trans	-133.7	97.6	153.5	-57.2	-179.7	0	0	0	107.3
43	I	42.1	Very low	39.4	Very low	135 Å²	135	142.2 Å²	142.2	69%	0.692	77%	0.773	S	S	*	*			trans	-102.3	113.4	170.6	-61	174.9	0	0	0	107.3	P45	I43-P45 WeakPolarHBondContact O-CD 3.47Å
44	P	43.2	Very low	40.2	Very low	101 Å²	101	144.6 Å²	144.6	66%	0.656	77%	0.768	S	S	*	*			trans	-68.7	126.3	177.5	-20.1	33.4	0	0	0	111.6	D46	P44-D46 PolarHBondContact O-N 3.01Å
45	P	38.8	Very low	40.4	Very low	122 Å²	122	143.4 Å²	143.4	79%	0.792	76%	0.76	S	S	*	*			trans	-90.4	64.3	-177.3	37	-36	0	0	0	112.6	I43	I43-P45 WeakPolarHBondContact O-CD 3.47Å
46	D	42.5	Very low	40.8	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	76%	0.759	S	S	*	*			trans	-118.7	88.4	173.2	-87.3	-52.4	0	0	0	111.2	P44	P44-D46 PolarHBondContact O-N 3.01Å
47	I	42.5	Very low	41.1	Very low	156 Å²	156	138.2 Å²	138.2	80%	0.8	75%	0.754	S	S	*	*			trans	-99.9	90.8	171.7	-58.9	177.2	0	0	0	108.4	E49	I47-E49 PolarHBondContact O-N 3.01Å
48	D	45.3	Very low	41.4	Very low	116 Å²	116	136.8 Å²	136.8	62%	0.62	76%	0.757	S	S	*	*			trans	-79.9	92.8	165.6	-177.8	17	0	0	0	110.3	S50	D48-S50 PolarHBondContact O-N 3.04Å; D48-S50 VanDerWaalsContact O-N 3.15Å; D48-S50 WeakPolarHBondContact OD1-CB 3.18Å; D48-S50 PolarHBondContact OD1-N 2.72Å; D48-S50 PolarHBondContact OD1-OG 3.01Å
49	E	44.2	Very low	41.6	Very low	166 Å²	166	132.3 Å²	132.3	78%	0.776	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	6.7	179.1	-143.5	-176.6	162.9	0	0	113.4	I47	I47-E49 PolarHBondContact O-N 3.01Å
50	S	45.9	Very low	41.5	Very low	88 Å²	88	130 Å²	130	62%	0.615	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-25.1	-168.4	-45.1	0	0	0	0	115.3	D48 N52	D48-S50 PolarHBondContact O-N 3.04Å; D48-S50 VanDerWaalsContact O-N 3.15Å; D48-S50 WeakPolarHBondContact OD1-CB 3.18Å; D48-S50 PolarHBondContact OD1-N 2.72Å; D48-S50 PolarHBondContact OD1-OG 3.01Å; S50-N52 PolarHBondContact O-N 3.32Å
51	A	46.4	Very low	41.3	Very low	67 Å²	67	136.4 Å²	136.4	55%	0.554	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	8	-161.6	0	0	0	0	0	117.2
52	N	52.3	Low	41.3	Very low	154 Å²	154	133.4 Å²	133.4	82%	0.824	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	17.5	-173.4	-83.8	-57	0	0	0	115.2	S50	S50-N52 PolarHBondContact O-N 3.32Å
53	Q	43.2	Very low	41	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	75%	0.751	S	S	*	*			trans	-125.7	105.7	170.4	-63.8	-168.9	40.2	0	0	111.4
54	E	48.3	Very low	40.6	Very low	145 Å²	145	132.9 Å²	132.9	68%	0.678	75%	0.752	S	S	*	*			trans	-67.8	132.4	158.2	-70.6	-175.2	-165.4	0	0	108.7	G370	E54-G370 WeakPolarHBondContact OE2-CA 3.4Å; E54-G370 PolarHBondContact OE2-N 3.03Å
55	P	40.7	Very low	40.4	Very low	106 Å²	106	134.4 Å²	134.4	69%	0.688	76%	0.761	S	S	*	*			trans	-68.4	140.3	-179.3	27.8	-34.2	0	0	0	110.7	T57	P55-T57 PolarHBondContact O-N 2.98Å
56	P	39.7	Very low	40.1	Very low	123 Å²	123	136.2 Å²	136.2	80%	0.799	76%	0.759	S	S	*	*			trans	-66.1	110.4	174.5	27.7	-33.3	0	0	0	109.4	T58	P56-T58 PolarHBondContact O-N 2.99Å
57	T	40.8	Very low	39.5	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	77%	0.765	S	S	*	*			trans	-66.3	103.8	177.2	45.2	0	0	0	0	110.3	P55	P55-T57 PolarHBondContact O-N 2.98Å
58	T	38.4	Very low	38.9	Very low	131 Å²	131	139.4 Å²	139.4	80%	0.804	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.8	139.1	167.8	43.3	0	0	0	0	109.8	P56 V60	P56-T58 PolarHBondContact O-N 2.99Å; T58-V60 PolarHBondContact O-N 3.26Å
59	S	37.7	Very low	38.4	Very low	94 Å²	94	141.2 Å²	141.2	66%	0.657	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-56.3	135.1	175.4	50.8	0	0	0	0	110.9	W61	S59-W61 PolarHBondContact O-N 3.3Å
60	V	32.8	Very low	37.7	Very low	126 Å²	126	144 Å²	144	76%	0.764	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-53.4	121.9	175.7	176.6	0	0	0	0	109.9	T58	T58-V60 PolarHBondContact O-N 3.26Å
61	W	30.1	Very low	37.2	Very low	238 Å²	238	149.1 Å²	149.1	90%	0.902	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-93.9	119	154.9	-79.4	68.5	0	0	0	106.7	S59	S59-W61 PolarHBondContact O-N 3.3Å
62	S	33.8	Very low	36.6	Very low	103 Å²	103	150.8 Å²	150.8	72%	0.72	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-88.5	118.2	170.2	-64	0	0	0	0	108.3	A64	S62-A64 PolarHBondContact O-N 3.15Å
63	E	31.6	Very low	35.8	Very low	200 Å²	200	148.7 Å²	148.7	94%	0.935	80%	0.798	S	S	*	*			trans	-76.1	111.5	168.5	-67.6	-177.2	152.7	0	0	108.9
64	A	35.2	Very low	35.4	Very low	85 Å²	85	147.1 Å²	147.1	70%	0.702	80%	0.796	S	S	*	*			trans	-130.8	121.9	164.8	0	0	0	0	0	106.8	S62	S62-A64 PolarHBondContact O-N 3.15Å
65	P	38.4	Very low	34.9	Very low	133 Å²	133	144.9 Å²	144.9	86%	0.864	80%	0.796	S	S	*	*			trans	-69.1	154.5	-174	26.9	-33.5	0	0	0	112.6
66	E	31.4	Very low	34.6	Very low	160 Å²	160	146.3 Å²	146.3	75%	0.748	81%	0.807	S	S	*	*			trans	-68	150.1	-162.5	-52.5	178.9	144	0	0	115.2
67	F	31.4	Very low	34.3	Very low	216 Å²	216	146.3 Å²	146.3	95%	0.947	81%	0.81	S	S	*	*			trans	-140.6	144.9	135.2	-120.9	-87	0	0	0	110.4
68	F	30.4	Very low	34.3	Very low	161 Å²	161	145.7 Å²	145.7	71%	0.706	81%	0.811	S	S	*	*			trans	-79.3	129.6	-161.8	-85.7	-128.8	0	0	0	115.1
69	V	33.5	Very low	34	Very low	154 Å²	154	142.1 Å²	142.1	93%	0.933	80%	0.8	S	S	*	*			trans	-139	150.4	131.3	-177.7	0	0	0	0	107.9
70	R	30.1	Very low	34	Very low	224 Å²	224	148.5 Å²	148.5	85%	0.845	81%	0.812	S	S	*	*			trans	-131.3	120.7	-161.1	172.7	-171.5	-178.8	177.9	1.8	112
71	E	35.2	Very low	33.9	Very low	197 Å²	197	152.9 Å²	152.9	92%	0.921	82%	0.816	S	S	*	*			trans	-145.9	158	166.6	-152.6	159.6	-128.8	0	0	111.3
72	S	32.7	Very low	34.3	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	82%	0.815	S	S	*	*			trans	-149.5	130.4	-149.4	58	0	0	0	0	117.5
73	S	37.3	Very low	34.5	Very low	110 Å²	110	145.8 Å²	145.8	77%	0.769	81%	0.813	S	S	*	*			trans	-167.9	136.6	151.2	-82	0	0	0	0	108.6
74	N	33.1	Very low	34.7	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	81%	0.805	S	S	*	*				63.7	132.6	57.4	-65.1	-18.7	0	0	0	113.1
75	S	38.5	Very low	34.7	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	81%	0.809	S	S	*	*			cis	-168.1	156.3	-7.7	-112.7	0	0	0	0	113.8
76	C	35.4	Very low	34.5	Very low	135 Å²	135	141.8 Å²	141.8	91%	0.912	80%	0.801	S	S	*	*			trans	64.6	168.3	149.3	-64.2	0	0	0	0	121.7
77	S	32.6	Very low	34.9	Very low	123 Å²	123	142.8 Å²	142.8	86%	0.86	81%	0.805	S	S	*	*			trans	-137.2	125.5	-174.1	162.6	0	0	0	0	112
78	S	40.1	Very low	35.2	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	80%	0.796	S	S	*	*			trans	-171.5	157	166.4	-165.5	0	0	0	0	107.1
79	G	33.2	Very low	35.6	Very low	57 Å²	57	134.2 Å²	134.2	59%	0.588	80%	0.798	S	S	*	*			cis	147.6	129.4	-3.8	0	0	0	0	0	110.8
80	Y	36.5	Very low	35.7	Very low	228 Å²	228	133.3 Å²	133.3	89%	0.894	80%	0.795	S	S	*	*			trans	72.6	137.4	169.1	-67	-88.6	0	0	0	122
81	Y	32.3	Very low	35.8	Very low	217 Å²	217	127.4 Å²	127.4	85%	0.851	79%	0.794	S	S	*	*			trans	-2.9	127.7	146.6	-81.8	-105.2	0	0	0	119.9
82	S	37.3	Very low	35.8	Very low	126 Å²	126	123.9 Å²	123.9	88%	0.881	79%	0.791	S	S	*	*				178.8	168.6	120.6	-85.8	0	0	0	0	110.2
83	G	37.9	Very low	35.9	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	79%	0.794	S	S	*	*			cis	145.9	38.1	-2.9	0	0	0	0	0	114.7
84	A	36.4	Very low	35.7	Very low	94 Å²	94	127 Å²	127	78%	0.777	80%	0.798	S	S	*	*			trans	74.3	178.8	175.9	0	0	0	0	0	117.8
85	T	35.5	Very low	35.8	Very low	126 Å²	126	125 Å²	125	77%	0.773	80%	0.795	S	S	*	*			trans	60.4	94.8	176.3	53.9	0	0	0	0	119.1
86	T	34.5	Very low	35.7	Very low	115 Å²	115	127 Å²	127	71%	0.706	79%	0.793	S	S	*	*				19.8	125.2	127.9	51.4	0	0	0	0	119.6
87	H	38.9	Very low	35.6	Very low	180 Å²	180	128.4 Å²	128.4	83%	0.833	78%	0.78	S	S	*	*				-167.7	166.7	101.6	-100.7	-75.4	0	0	0	112.5
88	S	38.5	Very low	35.6	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	77%	0.767	S	S	*	*			trans	-37.7	147.1	-175.6	39.7	0	0	0	0	120.5
89	A	38.1	Very low	35.2	Very low	90 Å²	90	132.7 Å²	132.7	74%	0.744	77%	0.768	S	S	*	*			trans	-78.7	174.9	158.8	0	0	0	0	0	111.9
90	P	36.5	Very low	35	Very low	135 Å²	135	137.4 Å²	137.4	88%	0.877	78%	0.775	S	S	*	*				-142.4	-167	94.6	40.2	-25.2	0	0	0	114.1
91	A	31	Very low	35.1	Very low	101 Å²	101	134.6 Å²	134.6	84%	0.835	77%	0.774	S	S	*	*			trans	-114.8	172.3	-173.7	0	0	0	0	0	113.5
92	S	36.6	Very low	35.1	Very low	122 Å²	122	131.1 Å²	131.1	85%	0.853	77%	0.77	S	S	*	*			trans	-145.3	160	164.9	56	0	0	0	0	111
93	S	33.1	Very low	35.2	Very low	109 Å²	109	129.1 Å²	129.1	76%	0.762	76%	0.76	S	S	*	*			trans	-159.7	137.5	-167.6	54.7	0	0	0	0	112.7
94	I	34.4	Very low	35.1	Very low	168 Å²	168	132.7 Å²	132.7	86%	0.862	76%	0.764	S	S	*	*			trans	-173.8	130	176.3	-108.1	148.4	0	0	0	105.9
95	C	33.7	Very low	35.3	Very low	108 Å²	108	137.5 Å²	137.5	73%	0.73	77%	0.77	S	S	*	*			cis	64.2	121.3	23.7	-86.6	0	0	0	0	113.8
96	E	37.5	Very low	35.3	Very low	138 Å²	138	138.5 Å²	138.5	65%	0.645	77%	0.771	S	S	*	*			cis	-159.1	173.8	23.6	-81.9	-132.4	128.3	0	0	109.3
97	R	33	Very low	35.5	Very low	166 Å²	166	138.4 Å²	138.4	63%	0.626	77%	0.772	S	S	*	*			cis	175.1	176.3	-18.3	177.7	169.5	154.2	-161.7	-6.9	109
98	F	33	Very low	35.7	Very low	138 Å²	138	134.7 Å²	134.7	61%	0.605	76%	0.764	S	S	*	*			trans	74.6	157.9	171.5	-49.9	-76.2	0	0	0	116.1
99	F	32.2	Very low	35.6	Very low	195 Å²	195	136.6 Å²	136.6	86%	0.855	76%	0.764	S	S	*	*			cis	-127.6	160.7	11.4	-111.9	-83.8	0	0	0	113.9
100	E	28	Very low	35.4	Very low	156 Å²	156	136.9 Å²	136.9	73%	0.729	76%	0.761	S	S	*	*			trans	-100.1	160.3	176.1	-57.8	164.6	129	0	0	112
101	I	38.1	Very low	35.3	Very low	170 Å²	170	137.6 Å²	137.6	87%	0.872	76%	0.756	S	S	*	*			trans	-162.4	152.8	144.5	-101	151.2	0	0	0	108.3
102	N	33.4	Very low	35.6	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	75%	0.752	S	S	*	*			trans	-112.2	173.9	-156.2	-65.2	-64.1	0	0	0	115.8
103	A	38.7	Very low	35.4	Very low	83 Å²	83	145 Å²	145	69%	0.686	75%	0.753	S	S	*	*			trans	99.4	105.5	145	0	0	0	0	0	119.7
104	D	35.7	Very low	35.5	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	75%	0.748	S	S	*	*				42.7	117.6	124.3	-48.4	-18.9	0	0	0	120.6
105	H	41.6	Very low	35.5	Very low	194 Å²	194	141.1 Å²	141.1	90%	0.898	74%	0.737	S	S	*	*				-175.9	132.6	104.8	-98.8	-70	0	0	0	113.9
106	D	34.3	Very low	35.6	Very low	148 Å²	148	145.7 Å²	145.7	79%	0.791	74%	0.74	S	S	*	*			trans	-84.6	175.5	165.9	-100	-42.7	0	0	0	111.5
107	P	39.9	Very low	35.4	Very low	112 Å²	112	147 Å²	147	73%	0.727	75%	0.746	S	S	*	*			cis	-130.5	-111.8	-8.9	24.4	3.3	0	0	0	115.8
108	P	41.8	Very low	35.6	Very low	103 Å²	103	144.8 Å²	144.8	67%	0.669	75%	0.751	S	S	*	*				-137.4	-166.2	-116.2	46	-26.8	0	0	0	118.6
109	I	37.4	Very low	35.8	Very low	147 Å²	147	144.3 Å²	144.3	75%	0.754	76%	0.76	S	S	*	*			trans	92.7	93.8	153.9	-69.7	166.3	0	0	0	120.1
110	S	33.9	Very low	36	Very low	96 Å²	96	142.6 Å²	142.6	67%	0.671	76%	0.755	S	S	*	*				79.7	150.5	126.4	84	0	0	0	0	125.9
111	L	35	Very low	36.4	Very low	149 Å²	149	139.1 Å²	139.1	78%	0.78	75%	0.747	S	S	*	*			trans	84.3	142.1	141.2	-83.5	164.5	0	0	0	123
112	I	36.5	Very low	36.3	Very low	147 Å²	147	137.4 Å²	137.4	75%	0.754	75%	0.745	S	S	*	*			trans	67.6	119.5	161.1	-62	155.3	0	0	0	115.1
113	R	32.6	Very low	36.4	Very low	232 Å²	232	134.7 Å²	134.7	88%	0.875	74%	0.743	S	S	*	*			cis	91.5	124.8	33.1	-164.6	-166.5	-177.7	175.3	1.4	114.1
114	S	34	Very low	36.5	Very low	94 Å²	94	137 Å²	137	66%	0.657	75%	0.751	S	S	*	*			trans	101.8	122.6	147.3	118.6	0	0	0	0	121.8
115	V	34.4	Very low	36.7	Very low	101 Å²	101	133.5 Å²	133.5	61%	0.612	75%	0.748	S	S	*	*			trans	87.5	157.5	131.9	179.7	0	0	0	0	119.9
116	Y	36.8	Very low	36.4	Very low	205 Å²	205	132.3 Å²	132.3	80%	0.804	75%	0.749	S	S	*	*			trans	78.2	104.9	-177.7	-47.5	-67.2	0	0	0	115.1
117	E	33	Very low	36.5	Very low	164 Å²	164	133 Å²	133	77%	0.766	75%	0.751	S	S	*	*			cis	92.9	146.6	20.3	-156	175.1	-126.8	0	0	115.6
118	T	37.1	Very low	36.5	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	75%	0.752	S	S	*	*			trans	71.1	148.8	-177.1	73.4	0	0	0	0	115.2
119	T	37.1	Very low	36	Very low	127 Å²	127	137.3 Å²	137.3	78%	0.779	77%	0.765	S	S	*	*			cis	-162.7	159.3	-5.6	15.2	0	0	0	0	107.4
120	E	37.4	Very low	36	Very low	160 Å²	160	141.4 Å²	141.4	75%	0.748	77%	0.771	S	S	*	*			cis	-162.1	-169.4	-12.8	-147.1	-119	-89	0	0	108.7
121	S	35.7	Very low	35.8	Very low	83 Å²	83	148.9 Å²	148.9	58%	0.58	79%	0.785	S	S	*	*			trans	41.9	136.1	155	-95.2	0	0	0	0	122.4
122	T	36.8	Very low	35.8	Very low	133 Å²	133	145.5 Å²	145.5	82%	0.816	78%	0.778	S	S	*	*			cis	-152.9	154	19.7	-29.4	0	0	0	0	111.4
123	A	34.3	Very low	35.8	Very low	88 Å²	88	147.7 Å²	147.7	73%	0.727	79%	0.785	S	S	*	*			trans	-134.8	-169.1	174.6	0	0	0	0	0	109
124	P	40.9	Very low	35.9	Very low	131 Å²	131	141.9 Å²	141.9	85%	0.851	78%	0.78	S	S	*	*			cis	-132.4	-171.8	-6.3	42.3	-24.8	0	0	0	114.1
125	G	39.9	Very low	35.9	Very low	69 Å²	69	143.6 Å²	143.6	71%	0.711	79%	0.791	S	S	*	*			trans	174.4	119.7	167.4	0	0	0	0	0	114
126	D	35.5	Very low	36.1	Very low	169 Å²	169	144.8 Å²	144.8	90%	0.904	80%	0.803	S	S	*	*			trans	-65.5	127.9	-168.7	-63.6	-58.5	0	0	0	115.4
127	I	37.4	Very low	36.3	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	80%	0.803	S	S	*	*			trans	-132.5	128.4	160.7	-61.5	-176.9	0	0	0	109.6
128	T	38.5	Very low	36.6	Very low	122 Å²	122	144.9 Å²	144.9	75%	0.748	81%	0.813	S	S	*	*			trans	-82.3	122.3	-175.8	47.9	0	0	0	0	112.4	R130	T128-R130 PolarHBondContact O-N 3.11Å; T128-R130 VanDerWaalsContact O-N 3.09Å
129	L	32.5	Very low	36.4	Very low	182 Å²	182	142.2 Å²	142.2	95%	0.953	81%	0.809	S	S	*	*			trans	-69.9	104.1	-179.7	-73.8	173.8	0	0	0	112.3
130	R	36.4	Very low	36.4	Very low	234 Å²	234	148.5 Å²	148.5	88%	0.883	82%	0.819	S	S	*	*			trans	-82.5	124.3	167.1	-75.9	-170.6	175.5	-169.5	0.6	111.2	T128 A132	T128-R130 PolarHBondContact O-N 3.11Å; T128-R130 VanDerWaalsContact O-N 3.09Å; R130-A132 PolarHBondContact O-N 3.44Å
131	R	30.6	Very low	36.5	Very low	253 Å²	253	149.2 Å²	149.2	96%	0.955	83%	0.827	S	S	*	*			trans	-57.2	120.5	173.1	177.2	-177.9	-66.6	143.2	1.2	111.8
132	A	35.4	Very low	36.5	Very low	78 Å²	78	150.4 Å²	150.4	65%	0.645	84%	0.841	S	S	*	*			trans	-142.8	127.8	177.4	0	0	0	0	0	112.9	R130	R130-A132 PolarHBondContact O-N 3.44Å
133	H	34.5	Very low	36.6	Very low	193 Å²	193	153.8 Å²	153.8	89%	0.894	85%	0.845	S	S	*	*			trans	29.6	118.1	156.2	-52.8	-71.5	0	0	0	122
134	S	36.5	Very low	36.8	Very low	110 Å²	110	161 Å²	161	77%	0.769	85%	0.853	S	S	*	*			trans	-143.1	134.5	151.5	61.8	0	0	0	0	112.1
135	C	33.9	Very low	36.5	Very low	130 Å²	130	164 Å²	164	88%	0.878	86%	0.855	S	S	*	*			trans	57	101.2	159.4	-59.8	0	0	0	0	119.5
136	S	36.9	Very low	36.6	Very low	125 Å²	125	168.3 Å²	168.3	87%	0.874	86%	0.86	S	S	*	*			trans	-103.2	123.9	157.2	-173.4	0	0	0	0	110.2
137	S	42.5	Very low	36.4	Very low	115 Å²	115	171.6 Å²	171.6	80%	0.804	86%	0.86	S	S	*	*			trans	-140.4	125.8	175.3	-78.1	0	0	0	0	111.3
138	R	38.6	Very low	36.3	Very low	257 Å²	257	171.8 Å²	171.8	97%	0.97	86%	0.858	S	S	*	*			trans	-61.2	143.4	-176.2	-60.3	153.7	168.2	156.4	-7.8	111.1
139	G	33.6	Very low	36.3	Very low	64 Å²	64	175.2 Å²	175.2	66%	0.66	87%	0.865	S	S	*	*			cis	151.9	125.1	-7.1	0	0	0	0	0	112.9
140	W	35.6	Very low	36.2	Very low	260 Å²	260	177 Å²	177	99%	0.985	86%	0.859	S	S	*	*	S	Bend	trans	-136.7	-1.3	174.3	-101.4	85.9	0	0	0	115
141	L	39.8	Very low	36.5	Very low	175 Å²	175	171.3 Å²	171.3	92%	0.916	85%	0.852	S	S	*	*			trans	-101.2	-2.7	-172.6	-81.2	161.8	0	0	0	115.4	K143	L141-K143 PolarHBondContact O-N 2.82Å; L141-K143 VanDerWaalsContact O-N 3.11Å
142	A	35.5	Very low	36.7	Very low	107 Å²	107	170.6 Å²	170.6	88%	0.884	85%	0.85	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	53.1	-171.3	0	0	0	0	0	114.5
143	K	39.4	Very low	36.8	Very low	205 Å²	205	174.7 Å²	174.7	89%	0.891	86%	0.859	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.9	27.6	172.3	-139.8	170.7	-175.1	174.5	0	117.9	L141	L141-K143 PolarHBondContact O-N 2.82Å; L141-K143 VanDerWaalsContact O-N 3.11Å
144	R	38.3	Very low	37	Very low	239 Å²	239	171 Å²	171	90%	0.902	86%	0.855	S	S	*	*			trans	-137.6	76.4	162.3	-81.5	-169.5	172.9	-177.6	-3.8	111.1
145	H	34.9	Very low	37	Very low	194 Å²	194	169.2 Å²	169.2	90%	0.898	85%	0.854	S	S	*	*			trans	-149.3	46.3	167	-135.6	-86.8	0	0	0	113
146	I	41.9	Very low	37	Very low	160 Å²	160	171.7 Å²	171.7	82%	0.821	86%	0.856	S	S	*	*	S	Bend	trans	-116.8	106.4	168.8	-60.3	-177.1	0	0	0	108
147	R	31.9	Very low	37.1	Very low	237 Å²	237	171.2 Å²	171.2	89%	0.894	85%	0.853	S	S	*	*			trans	43.3	87.7	160.9	-60.3	-175.7	177.6	-140.9	-0.5	117.2
148	Q	36	Very low	36.8	Very low	168 Å²	168	177.1 Å²	177.1	79%	0.785	86%	0.858	S	S	*	*			trans	-124.7	128.3	136.9	-79.1	-173	-33.7	0	0	108.6
149	Q	36.9	Very low	36.4	Very low	194 Å²	194	173.7 Å²	173.7	91%	0.907	85%	0.853	S	S	*	*			trans	-93	107	176.6	-72.1	172.2	-43.8	0	0	107.8	P151	Q149-P151 WeakPolarHBondContact O-CD 3.38Å
150	W	31.9	Very low	36.5	Very low	220 Å²	220	181.6 Å²	181.6	83%	0.833	86%	0.863	S	S	*	*			trans	-78.9	122.7	170.1	-73.5	87.2	0	0	0	109.5	R152	W150-R152 PolarHBondContact O-N 3.12Å
151	P	42.2	Very low	36.3	Very low	113 Å²	113	176.7 Å²	176.7	73%	0.734	85%	0.851	S	S	*	*			trans	-63.7	124.2	175.8	-20.9	33.4	0	0	0	110.8	Q149 I153	Q149-P151 WeakPolarHBondContact O-CD 3.38Å; P151-I153 PolarHBondContact O-N 3.13Å
152	R	35.6	Very low	36.1	Very low	239 Å²	239	174.6 Å²	174.6	90%	0.902	85%	0.845	S	S	*	*			trans	-83.9	99.4	172	-80.5	-176.4	168.4	152.5	-2.8	109.8	W150 S154	W150-R152 PolarHBondContact O-N 3.12Å; R152-S154 PolarHBondContact O-N 3.11Å
153	I	37.4	Very low	36.1	Very low	164 Å²	164	174.5 Å²	174.5	84%	0.841	84%	0.838	S	S	*	*			trans	-71.5	99	169.2	-58.5	178.6	0	0	0	108.1	P151	P151-I153 PolarHBondContact O-N 3.13Å
154	S	37.6	Very low	35.7	Very low	115 Å²	115	172 Å²	172	80%	0.804	83%	0.834	S	S	*	*			trans	-160.1	77.1	176.7	-69.4	0	0	0	0	108.3	R152	R152-S154 PolarHBondContact O-N 3.11Å
155	G	36.2	Very low	35.4	Very low	72 Å²	72	166.7 Å²	166.7	74%	0.742	83%	0.828	S	S	*	*			trans	-160.3	65.7	-168.4	0	0	0	0	0	113.5	S157	G155-S157 PolarHBondContact O-N 3Å
156	I	34.3	Very low	35.2	Very low	182 Å²	182	160.9 Å²	160.9	93%	0.933	82%	0.82	S	S	*	*			trans	-73.1	112.6	161.9	-60.5	171.4	0	0	0	107
157	S	39	Very low	34.7	Very low	115 Å²	115	160.8 Å²	160.8	80%	0.804	82%	0.819	S	S	*	*			trans	-145.6	148.2	165	-172.7	0	0	0	0	109.6	G155	G155-S157 PolarHBondContact O-N 3Å
158	R	36.7	Very low	34.6	Very low	240 Å²	240	153.1 Å²	153.1	91%	0.906	81%	0.807	S	S	*	*			trans	-70.6	149.9	-172.3	-76.2	171	158.9	149.3	-8.7	113.1
159	E	29.9	Very low	34.3	Very low	185 Å²	185	152 Å²	152	86%	0.864	81%	0.806	S	S	*	*			trans	-63.3	153.8	161.6	-57.6	157.4	120.1	0	0	111.7
160	R	35.9	Very low	34.1	Very low	230 Å²	230	148 Å²	148	87%	0.868	80%	0.795	S	S	*	*			trans	-148.9	141.3	132.5	-173.2	163.3	-70.8	175.1	-2.7	108.4
161	E	31.5	Very low	34.1	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.734	79%	0.79	S	S	*	*			trans	-72.3	159	-173.9	-40.7	97	116.2	0	0	112.2
162	T	34.8	Very low	34	Very low	130 Å²	130	144.8 Å²	144.8	80%	0.798	79%	0.793	S	S	*	*				-172.4	138.6	109.5	19.3	0	0	0	0	113.3
163	S	35.1	Very low	34	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	79%	0.787	S	S	*	*			trans	12.9	154.6	145.1	58.3	0	0	0	0	122.5
164	L	32.1	Very low	34	Very low	153 Å²	153	138.1 Å²	138.1	80%	0.801	79%	0.786	S	S	*	*			cis	176.2	160.6	-15.6	-170.7	72.5	0	0	0	106.3
165	V	32.3	Very low	34	Very low	127 Å²	127	138.3 Å²	138.3	77%	0.77	79%	0.786	S	S	*	*			trans	69	144.4	167.5	-164.3	0	0	0	0	116
166	G	31.1	Very low	34.2	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	79%	0.788	S	S	*	*			trans	166	37	160.6	0	0	0	0	0	122.2
167	I	31.5	Very low	34.2	Very low	158 Å²	158	136.4 Å²	136.4	81%	0.81	78%	0.78	S	S	*	*			trans	24.6	119.4	149.1	-61.1	169.1	0	0	0	119
168	A	29.2	Very low	33.9	Very low	76 Å²	76	134.6 Å²	134.6	63%	0.628	77%	0.772	S	S	*	*			trans	-49.1	156	167.2	0	0	0	0	0	116.8
169	N	29.7	Very low	33.6	Very low	145 Å²	145	131 Å²	131	78%	0.775	77%	0.769	S	S	*	*				172.9	159.4	112.9	-94.3	-22.2	0	0	0	116
170	T	33.3	Very low	33.7	Very low	110 Å²	110	128.2 Å²	128.2	68%	0.675	76%	0.764	S	S	*	*			trans	62.6	111.9	151	49.2	0	0	0	0	121.6
171	D	30.8	Very low	33.5	Very low	138 Å²	138	125.4 Å²	125.4	74%	0.738	76%	0.761	S	S	*	*				65.5	122.1	123.3	-49.5	-20.4	0	0	0	122
172	T	39.2	Very low	33.5	Very low	127 Å²	127	124.9 Å²	124.9	78%	0.779	76%	0.763	S	S	*	*				-168.7	125.9	97.2	19.5	0	0	0	0	114.3
173	N	36.6	Very low	33.4	Very low	145 Å²	145	125 Å²	125	78%	0.775	76%	0.759	S	S	*	*			trans	23.4	122.3	142.1	-54.5	-36	0	0	0	120.6
174	S	37.5	Very low	33.3	Very low	118 Å²	118	127.6 Å²	127.6	83%	0.825	76%	0.764	S	S	*	*				-178.1	112.6	88.3	-102.8	0	0	0	0	114.6
175	C	36.9	Very low	33.6	Very low	119 Å²	119	125.4 Å²	125.4	80%	0.804	76%	0.759	S	S	*	*			trans	-109.5	173.3	147.8	-68.5	0	0	0	0	108.2
176	P	41	Very low	33.6	Very low	122 Å²	122	125 Å²	125	79%	0.792	76%	0.761	S	S	*	*				-140.2	163.7	92.4	43	-30.2	0	0	0	111.8
177	A	34.5	Very low	33.6	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	76%	0.762	S	S	*	*			cis	71	157.6	30.6	0	0	0	0	0	114.7
178	A	32.2	Very low	33.8	Very low	77 Å²	77	129.1 Å²	129.1	64%	0.636	77%	0.767	S	S	*	*			cis	-173.2	135.2	-39.4	0	0	0	0	0	109.8
179	I	29.9	Very low	34	Very low	165 Å²	165	135.3 Å²	135.3	85%	0.846	77%	0.774	S	S	*	*			trans	70.8	161.2	155.4	-49.4	150.2	0	0	0	117.8
180	V	33.1	Very low	34.2	Very low	126 Å²	126	136.4 Å²	136.4	76%	0.764	77%	0.767	S	S	*	*			trans	103.4	135.1	164.3	-168.4	0	0	0	0	117
181	H	31.3	Very low	34.4	Very low	172 Å²	172	139.7 Å²	139.7	80%	0.796	77%	0.769	S	S	*	*			trans	-53.9	147.2	-174.1	-64.7	-123.9	0	0	0	115.2
182	D	32.4	Very low	34.5	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	77%	0.771	S	S	*	*				-164.5	172.2	100.6	-125.1	-32.4	0	0	0	116.1
183	N	32.5	Very low	34.7	Very low	133 Å²	133	140.2 Å²	140.2	71%	0.711	77%	0.774	S	S	*	*			trans	-48.6	145.3	-167.3	-73.9	-78.1	0	0	0	121.7
184	N	33	Very low	35.1	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	77%	0.771	S	S	*	*			trans	73.3	161.3	147.4	-91.9	-15.6	0	0	0	121.3
185	P	37.9	Very low	35.3	Very low	107 Å²	107	139 Å²	139	70%	0.695	77%	0.772	S	S	*	*			trans	-113.6	154.8	-150.4	40.6	-34	0	0	0	116
186	C	31.9	Very low	35.8	Very low	120 Å²	120	140.7 Å²	140.7	81%	0.811	78%	0.778	S	S	*	*			trans	-161.1	150.8	132.7	-111	0	0	0	0	115.6
187	N	30.9	Very low	35.7	Very low	140 Å²	140	138 Å²	138	75%	0.749	77%	0.773	S	S	*	*			trans	-28.9	140.1	167.6	-53.8	-85.2	0	0	0	117.5
188	L	36.8	Very low	35.9	Very low	175 Å²	175	143.4 Å²	143.4	92%	0.916	78%	0.782	S	S	*	*				-156.9	147.5	105.9	-129.4	73.5	0	0	0	114.7
189	R	33.3	Very low	36.2	Very low	205 Å²	205	145.5 Å²	145.5	77%	0.774	79%	0.792	S	S	*	*			trans	-67.4	163	170	-78.6	172	167.3	171.1	-3.1	110.6
190	R	33.4	Very low	36.5	Very low	169 Å²	169	141.7 Å²	141.7	64%	0.638	79%	0.794	S	S	*	*			cis	-165.4	-168.9	10.4	-121	163.4	173.4	-170	4.8	105.7
191	Y	37.3	Very low	36.8	Very low	178 Å²	178	141.7 Å²	141.7	70%	0.698	80%	0.799	S	S	*	*			cis	-143.6	154.3	12.9	-89	-83.5	0	0	0	110.1
192	S	33	Very low	37.1	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	80%	0.803	S	S	*	*			trans	-146.1	154.9	152.3	55.5	0	0	0	0	108.2
193	L	43.5	Very low	37.3	Very low	164 Å²	164	136 Å²	136	86%	0.859	80%	0.804	S	S	*	*			trans	-116.8	123.5	-171.6	-71.2	175.9	0	0	0	112.7
194	P	44.1	Very low	37.5	Very low	109 Å²	109	136.8 Å²	136.8	71%	0.708	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.5	169.6	173	37.3	-34.3	0	0	0	112.7
195	P	42.4	Very low	37.7	Very low	130 Å²	130	134.5 Å²	134.5	84%	0.844	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.7	164.9	178.3	31.7	-36.4	0	0	0	114.1
196	V	46.6	Very low	37.8	Very low	153 Å²	153	139.2 Å²	139.2	93%	0.927	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-94.3	142.3	-172.6	174.7	0	0	0	0	112.3
197	G	39.9	Very low	38.2	Very low	67 Å²	67	137.5 Å²	137.5	69%	0.691	82%	0.818	S	S	*	*			trans	149	78.3	150	0	0	0	0	0	117.5
198	E	38.5	Very low	38.7	Very low	204 Å²	204	136.5 Å²	136.5	95%	0.953	82%	0.822	S	S	*	*			trans	-157.4	157.2	149.6	-127.1	165.3	-140.7	0	0	110.8
199	S	39.1	Very low	39.2	Very low	121 Å²	121	133.6 Å²	133.6	85%	0.846	81%	0.813	S	S	*	*			trans	-135.4	122.7	-165.2	57.4	0	0	0	0	113
200	G	36.6	Very low	39.7	Very low	85 Å²	85	129 Å²	129	88%	0.876	81%	0.81	S	S	*	*			trans	176.2	104.5	173.2	0	0	0	0	0	112.2
201	S	38.1	Very low	40	Very low	126 Å²	126	131.1 Å²	131.1	88%	0.881	82%	0.818	S	S	*	*			trans	-120.7	124.9	178.6	56.9	0	0	0	0	110.5
202	G	37	Very low	40.1	Very low	85 Å²	85	128.1 Å²	128.1	88%	0.876	81%	0.814	S	S	*	*			trans	172.9	48.2	-177.6	0	0	0	0	0	115
203	S	36.7	Very low	40.4	Very low	113 Å²	113	130.4 Å²	130.4	79%	0.79	81%	0.812	S	S	*	*			trans	-107.6	119.2	177.7	57.5	0	0	0	0	111.7
204	T	38.2	Very low	40.1	Very low	150 Å²	150	129.2 Å²	129.2	92%	0.92	81%	0.806	S	S	*	*			trans	-128.3	113.7	162.7	51.5	0	0	0	0	109
205	S	36.8	Very low	39.8	Very low	111 Å²	111	129.9 Å²	129.9	78%	0.776	81%	0.807	S	S	*	*			trans	-129.6	122.3	174.1	56.6	0	0	0	0	108.9
206	E	39.1	Very low	39.5	Very low	206 Å²	206	127.1 Å²	127.1	96%	0.963	79%	0.791	S	S	*	*			trans	-156.8	165.1	143	-126.2	169.1	-149.7	0	0	110.2
207	A	41.4	Very low	39	Very low	85 Å²	85	128.3 Å²	128.3	70%	0.702	78%	0.784	S	S	*	*			trans	-129.3	135.9	-159.7	0	0	0	0	0	113.5
208	S	40.6	Very low	38.9	Very low	119 Å²	119	132.3 Å²	132.3	83%	0.832	79%	0.789	S	S	*	*			trans	75.1	155.3	154.2	-61.6	0	0	0	0	118.8
209	P	47.5	Very low	38.7	Very low	113 Å²	113	128.2 Å²	128.2	73%	0.734	78%	0.778	S	S	*	*			trans	-105.1	-171	-168.5	45.5	-35.1	0	0	0	110.4
210	P	44.6	Very low	38.4	Very low	108 Å²	108	126.8 Å²	126.8	70%	0.701	77%	0.768	S	S	*	*			cis	-148.4	-173	16.8	45.4	-25.1	0	0	0	119
211	R	39.4	Very low	38.3	Very low	214 Å²	214	128.3 Å²	128.3	81%	0.808	76%	0.761	S	S	*	*			trans	96.5	122.2	149.6	-81.6	-170.5	-178.4	170	2.6	120
212	D	38.4	Very low	38.4	Very low	116 Å²	116	131.3 Å²	131.3	62%	0.62	76%	0.758	S	S	*	*				90.6	94.8	129.2	-60.6	-2.4	0	0	0	120.6
213	H	39.4	Very low	38.3	Very low	159 Å²	159	132.4 Å²	132.4	74%	0.736	75%	0.752	S	S	*	*				98.2	116.1	123	-85	-65.2	0	0	0	121.3
214	L	37.9	Very low	38.7	Very low	140 Å²	140	132.8 Å²	132.8	73%	0.733	75%	0.752	S	S	*	*			trans	93.3	105.2	140	-64.7	168.9	0	0	0	120.6
215	V	37	Very low	38.5	Very low	122 Å²	122	131 Å²	131	74%	0.739	75%	0.746	S	S	*	*				70	129.3	115.1	161.3	0	0	0	0	118.2
216	S	36.2	Very low	38.2	Very low	73 Å²	73	135 Å²	135	51%	0.51	75%	0.749	S	S	.	*			cis	-176.7	178.1	0.3	51.7	0	0	0	0	114.4
217	F	35.7	Very low	37.9	Very low	178 Å²	178	131.1 Å²	131.1	78%	0.781	73%	0.731	S	S	*	*			trans	72.1	112.3	158	-56.9	-48.3	0	0	0	118.1
218	L	37.8	Very low	37.6	Very low	151 Å²	151	135 Å²	135	79%	0.791	73%	0.732	S	S	*	*				76.1	142.4	73.1	-73.2	-169.2	0	0	0	113
219	T	36.1	Very low	37.1	Very low	117 Å²	117	139.6 Å²	139.6	72%	0.718	73%	0.731	S	S	*	*			cis	-146.4	152	17.1	11.7	0	0	0	0	109.7
220	S	32.9	Very low	36.4	Very low	92 Å²	92	139.9 Å²	139.9	64%	0.643	72%	0.724	S	S	*	*				64.2	134.2	69.3	-155.5	0	0	0	0	114.4
221	T	34.4	Very low	35.8	Very low	117 Å²	117	142.5 Å²	142.5	72%	0.718	73%	0.727	S	S	*	*			cis	-167.3	-178.1	-6	18.5	0	0	0	0	110.9
222	K	38.6	Very low	35.3	Very low	189 Å²	189	137.6 Å²	137.6	82%	0.822	72%	0.724	S	S	*	*			trans	77.8	124.4	163.1	-67.2	175.8	-177.5	176.2	0	116.7
223	S	36.4	Very low	35.3	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	73%	0.732	S	S	*	*			cis	99.4	149.4	40	77.2	0	0	0	0	113.1
224	P	44.9	Very low	35.1	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	73%	0.734	S	S	*	*			trans	-122.7	175.9	-131.4	43.6	-36.1	0	0	0	117.2
225	S	34	Very low	35.1	Very low	113 Å²	113	133.2 Å²	133.2	79%	0.79	73%	0.732	S	S	*	*			trans	175	149.4	135	43.3	0	0	0	0	117.2
226	F	30.3	Very low	35.1	Very low	194 Å²	194	134.8 Å²	134.8	85%	0.851	74%	0.736	S	S	*	*			trans	68.6	174.2	146.7	-96.6	-98.1	0	0	0	124.7
227	E	32.5	Very low	35.1	Very low	125 Å²	125	139.1 Å²	139.1	58%	0.584	75%	0.752	S	S	*	*			trans	-97.2	165.3	-144.7	-65.3	-171.8	97.6	0	0	118.6
228	K	34.2	Very low	35.3	Very low	165 Å²	165	138.1 Å²	138.1	72%	0.717	75%	0.75	S	S	*	*			trans	63.5	111.1	143.1	-77.7	158	-177	148.2	0	119.7
229	R	31	Very low	35.4	Very low	217 Å²	217	136.3 Å²	136.3	82%	0.819	75%	0.747	S	S	*	*				149.2	121.6	94.3	-172.5	170.8	-174.5	173.1	2.4	115.3
230	M	32.7	Very low	35.5	Very low	118 Å²	118	135.8 Å²	135.8	58%	0.581	74%	0.739	S	S	*	*			trans	57.2	142.3	151.8	-66.1	164.3	65.6	0	0	122.6
231	E	33	Very low	35.8	Very low	164 Å²	164	137.6 Å²	137.6	77%	0.766	75%	0.748	S	S	*	*			trans	68.3	145.8	146.7	-75.8	161	-160.4	0	0	120.5
232	C	29	Very low	36.1	Very low	110 Å²	110	140.9 Å²	140.9	74%	0.743	75%	0.753	S	S	*	*			cis	-163.8	165.7	-21	-153.5	0	0	0	0	111.1
233	S	36.8	Very low	36.2	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	76%	0.756	S	S	*	*			trans	69.7	158	173.7	-41.4	0	0	0	0	115.2
234	S	36.1	Very low	36.2	Very low	111 Å²	111	145 Å²	145	78%	0.776	76%	0.76	S	S	*	*			cis	-177.9	160.1	-9.4	40.5	0	0	0	0	107.9
235	S	36.6	Very low	35.7	Very low	99 Å²	99	150 Å²	150	69%	0.692	76%	0.763	S	S	*	*			cis	-171.8	-171.4	-15.9	60.4	0	0	0	0	108.9
236	L	37.5	Very low	36	Very low	155 Å²	155	151.9 Å²	151.9	81%	0.812	76%	0.762	S	S	*	*			trans	70.6	138.1	177.3	-52.8	-178.3	0	0	0	115.2
237	L	37	Very low	36.2	Very low	164 Å²	164	150.9 Å²	150.9	86%	0.859	76%	0.76	S	S	*	*			cis	-142.9	179	3.4	-106.6	150.4	0	0	0	111.4
238	H	39.9	Very low	36.4	Very low	158 Å²	158	150.3 Å²	150.3	73%	0.731	77%	0.77	S	S	*	*			trans	-107.9	-177.2	-165.3	-95.6	-35.6	0	0	0	114.6
239	P	39.5	Very low	36.6	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	77%	0.769	S	S	*	*			cis	-130	140.2	10.4	23.7	1.5	0	0	0	117.8
240	I	38.6	Very low	36.9	Very low	105 Å²	105	147.3 Å²	147.3	54%	0.538	77%	0.768	S	S	.	*				73.6	115.7	93.5	-59.8	164.4	0	0	0	116	K242	I240-K242 HydrophobicContact CG2-CG 4.14Å
241	P	39.2	Very low	37	Very low	130 Å²	130	148.7 Å²	148.7	84%	0.844	77%	0.774	S	S	*	*				-117.7	162.2	105.4	35	-35.7	0	0	0	114.2
242	K	41.5	Very low	37.3	Very low	187 Å²	187	149 Å²	149	81%	0.813	78%	0.778	S	S	*	*			trans	-118.3	163.4	179.3	-66.3	179.2	-179.1	177	0	111.5	I240	I240-K242 HydrophobicContact CG2-CG 4.14Å
243	K	39.2	Very low	37.5	Very low	205 Å²	205	150.7 Å²	150.7	89%	0.891	78%	0.78	S	S	*	*			cis	-166.6	153.6	-47.8	-151.3	-178.6	-178.5	-176.3	0	107.3
244	Q	37.4	Very low	37.5	Very low	179 Å²	179	151.4 Å²	151.4	84%	0.836	78%	0.784	S	S	*	*			trans	-107.7	170.3	175.4	-164.5	-176	14.6	0	0	110.7
245	R	33.9	Very low	37.4	Very low	224 Å²	224	153.4 Å²	153.4	85%	0.845	79%	0.786	S	S	*	*			trans	103.5	153.1	141.5	-157.7	-167.3	-175.3	147.6	2.9	119.1
246	I	40.6	Very low	37.4	Very low	153 Å²	153	153.9 Å²	153.9	79%	0.785	79%	0.789	S	S	*	*			trans	114.8	144.6	154.7	-57.7	-179.9	0	0	0	114.4
247	E	34.6	Very low	37.3	Very low	173 Å²	173	152.3 Å²	152.3	81%	0.808	79%	0.786	S	S	*	*			trans	-128.2	167.3	-162.5	-57.1	163.6	107.5	0	0	112.6
248	S	35.2	Very low	37.6	Very low	113 Å²	113	152 Å²	152	79%	0.79	78%	0.783	S	S	*	*			trans	73.9	166.1	155.1	84.3	0	0	0	0	117.7
249	P	40.3	Very low	37.6	Very low	108 Å²	108	149.8 Å²	149.8	70%	0.701	78%	0.784	S	S	*	*			cis	-135.6	156.2	3.5	40.3	-22.8	0	0	0	118.8
250	R	37	Very low	37.5	Very low	211 Å²	211	150.2 Å²	150.2	80%	0.796	78%	0.784	S	S	*	*			trans	57.8	126.8	140.8	-71.5	-174.7	172.8	-174.2	0.3	124.7
251	E	35.3	Very low	37.5	Very low	148 Å²	148	153.3 Å²	153.3	69%	0.692	80%	0.796	S	S	*	*				63.6	117	127.5	-62.9	161.3	-144.6	0	0	121.2
252	I	37.3	Very low	37.5	Very low	169 Å²	169	154.1 Å²	154.1	87%	0.867	79%	0.789	S	S	*	*				-179.7	148.8	110	-90.1	159.5	0	0	0	110
253	D	33.6	Very low	37.5	Very low	147 Å²	147	152 Å²	152	79%	0.786	79%	0.786	S	S	*	*			trans	-77.1	153.1	177.7	-71.3	-63.1	0	0	0	114.1
254	C	36.8	Very low	37.3	Very low	127 Å²	127	147.7 Å²	147.7	86%	0.858	78%	0.777	S	S	*	*				163.3	144.4	124.6	-82.8	0	0	0	0	112.7
255	N	34.4	Very low	37.3	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	77%	0.77	S	S	*	*			trans	-75	154	174.1	-49.4	-71.4	0	0	0	112.1
256	S	37.8	Very low	37.5	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	76%	0.763	S	S	*	*				166	148.1	111.7	-71.5	0	0	0	0	114.8
257	T	34.8	Very low	37.4	Very low	123 Å²	123	139.3 Å²	139.3	76%	0.755	76%	0.759	S	S	*	*			trans	62.3	93.8	149.4	-48.5	0	0	0	0	120.4
258	I	43.7	Very low	37.6	Very low	156 Å²	156	138.7 Å²	138.7	80%	0.8	76%	0.756	S	S	*	*				52.9	139.4	111.8	-68.6	173.6	0	0	0	120.2
259	P	39.6	Very low	37.9	Very low	113 Å²	113	140.4 Å²	140.4	73%	0.734	75%	0.751	S	S	*	*			trans	-107.7	-175.5	-167	43.9	-36.7	0	0	0	115.6
260	T	36.1	Very low	37.7	Very low	122 Å²	122	141 Å²	141	75%	0.748	75%	0.749	S	S	*	*			trans	-150.2	123.4	165.6	-38.5	0	0	0	0	103.7
261	E	38.5	Very low	37.7	Very low	169 Å²	169	136.9 Å²	136.9	79%	0.79	74%	0.742	S	S	*	*				56.3	139.5	81.4	-78.5	165.7	-160	0	0	112.2
262	E	39.5	Very low	37.7	Very low	147 Å²	147	137.6 Å²	137.6	69%	0.687	75%	0.749	S	S	*	*			cis	-164.8	167.4	23.2	-139.5	-169.8	167.2	0	0	111.9
263	L	41.1	Very low	37.3	Very low	143 Å²	143	133.2 Å²	133.2	75%	0.749	75%	0.746	S	S	*	*			trans	61.9	164.4	158.5	-56.3	167.8	0	0	0	116.8
264	T	36.3	Very low	37.3	Very low	114 Å²	114	131.3 Å²	131.3	70%	0.699	74%	0.744	S	S	*	*			cis	-147	161.1	2.9	33.5	0	0	0	0	106.7
265	E	37.9	Very low	37.1	Very low	150 Å²	150	131.7 Å²	131.7	70%	0.701	74%	0.737	S	S	*	*			cis	-162.2	176.4	1.5	-126.8	-174	-91.7	0	0	111.6
266	N	37.3	Very low	37	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	74%	0.736	S	S	*	*			trans	-0.3	145	136.3	-56.8	-21.8	0	0	0	117.9
267	S	39.1	Very low	36.8	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	74%	0.738	S	S	*	*			cis	-173.6	-173.1	7.1	55	0	0	0	0	108.3
268	E	38.7	Very low	36.9	Very low	160 Å²	160	134.2 Å²	134.2	75%	0.748	74%	0.738	S	S	*	*			cis	-161.4	175.6	0.7	-140.5	166	-121.9	0	0	112.4
269	H	41.4	Very low	36.8	Very low	150 Å²	150	131.4 Å²	131.4	69%	0.694	73%	0.73	S	S	*	*			trans	32.2	118.5	153.9	-81.1	-53	0	0	0	125.1
270	D	36.1	Very low	36.7	Very low	120 Å²	120	133.3 Å²	133.3	64%	0.642	73%	0.733	S	S	*	*				82.4	108.3	120.5	-77.6	38.9	0	0	0	125.5
271	N	35.9	Very low	36.6	Very low	125 Å²	125	131.6 Å²	131.6	67%	0.668	74%	0.74	S	S	*	*				78.5	129.1	119.5	-83.7	-50.5	0	0	0	124
272	I	35.7	Very low	36.5	Very low	163 Å²	163	127 Å²	127	84%	0.836	74%	0.738	S	S	*	*			trans	71.7	133.3	148.7	-60.4	164.2	0	0	0	116.9
273	G	30.1	Very low	36.6	Very low	77 Å²	77	126.4 Å²	126.4	79%	0.794	75%	0.747	S	S	*	*			trans	-112.5	164.2	-169.3	0	0	0	0	0	116.5
274	S	33.8	Very low	36.4	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	75%	0.753	S	S	*	*			trans	-140.7	118.3	170.2	178.1	0	0	0	0	106.7
275	L	32.1	Very low	36.7	Very low	135 Å²	135	129.4 Å²	129.4	71%	0.707	76%	0.757	S	S	*	*				57.4	117	84	-67.7	172.8	0	0	0	114.5
276	F	30.9	Very low	36.5	Very low	184 Å²	184	130.7 Å²	130.7	81%	0.807	76%	0.76	S	S	*	*			trans	53.3	125.8	162.4	-49	-67.1	0	0	0	118.4
277	S	35.2	Very low	36.5	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	77%	0.765	S	S	*	*				-173.9	159.3	71.2	-68.7	0	0	0	0	113.6
278	N	36.6	Very low	36.1	Very low	139 Å²	139	137.6 Å²	137.6	74%	0.743	78%	0.775	S	S	*	*			trans	-82.9	160.7	168.9	-163.9	19.1	0	0	0	110.7
279	P	40.8	Very low	36.1	Very low	97 Å²	97	136.1 Å²	136.1	63%	0.63	77%	0.771	S	S	*	*				-151	179.4	104.5	39.7	-22.9	0	0	0	116.4
280	N	38.8	Very low	36	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	77%	0.771	S	S	*	*			trans	82.5	130.5	170.9	-47.8	-34	0	0	0	116
281	G	33.9	Very low	36.2	Very low	86 Å²	86	138.8 Å²	138.8	89%	0.887	78%	0.776	S	S	*	*			cis	142.9	83.1	-9.3	0	0	0	0	0	114.1
282	G	36.3	Very low	36.6	Very low	73 Å²	73	139 Å²	139	75%	0.753	77%	0.772	S	S	*	*			trans	-168.8	144.1	176.5	0	0	0	0	0	114.1
283	P	39.7	Very low	36.7	Very low	135 Å²	135	139 Å²	139	88%	0.877	77%	0.768	S	S	*	*			trans	-99.2	172	-170.3	38.3	-36.2	0	0	0	116.1
284	K	37.3	Very low	37.1	Very low	200 Å²	200	141.2 Å²	141.2	87%	0.87	77%	0.771	S	S	*	*			trans	-85.1	156.2	-174.5	-51.7	174.3	-177.6	176.9	0	114.4
285	P	42.9	Very low	37.5	Very low	119 Å²	119	142.2 Å²	142.2	77%	0.773	77%	0.773	S	S	*	*				-110.5	144.7	124.8	34.6	-29.9	0	0	0	109.7
286	F	33.5	Very low	37.9	Very low	178 Å²	178	141.6 Å²	141.6	78%	0.781	78%	0.777	S	S	*	*			cis	79.7	86.8	34	-153.5	-74.6	0	0	0	114
287	F	37.7	Very low	38.2	Very low	182 Å²	182	141 Å²	141	80%	0.798	78%	0.779	S	S	*	*			trans	-169.4	110.8	141	-104.4	-65.5	0	0	0	110.4	L289	F287-L289 HydrophobicContact CD1-CD1 4.35Å; F287-L289 HydrophobicContact CE1-CD1 4.16Å
288	E	31.3	Very low	38.5	Very low	192 Å²	192	140.7 Å²	140.7	90%	0.897	77%	0.774	S	S	*	*			trans	-139.5	109.7	168.2	-179.4	173.4	-152.5	0	0	107.4
289	L	38.9	Very low	38.5	Very low	130 Å²	130	139.2 Å²	139.2	68%	0.681	78%	0.775	S	S	*	*			trans	-154.8	140.7	-173.2	-95.1	177.1	0	0	0	111.9	F287	F287-L289 HydrophobicContact CD1-CD1 4.35Å; F287-L289 HydrophobicContact CE1-CD1 4.16Å
290	L	39.2	Very low	38.1	Very low	130 Å²	130	139.8 Å²	139.8	68%	0.681	78%	0.781	S	S	*	*			trans	67.8	128.9	174.4	-77.8	75.6	0	0	0	114.9
291	R	40.5	Very low	38	Very low	196 Å²	196	143.2 Å²	143.2	74%	0.74	79%	0.785	S	S	*	*			cis	-141.2	137.9	17.2	-80.2	-162.3	159.6	98.6	4.8	114.5
292	H	43.5	Very low	38.2	Very low	129 Å²	129	143.8 Å²	143.8	60%	0.597	78%	0.775	S	S	*	*			trans	50.4	110.6	147	-44.2	-43	0	0	0	118.6
293	H	36.7	Very low	38.2	Very low	164 Å²	164	151.2 Å²	151.2	76%	0.759	78%	0.782	S	S	*	*				62.2	127.6	75.7	-47.2	-33.5	0	0	0	112
294	S	39.1	Very low	38.1	Very low	122 Å²	122	154.2 Å²	154.2	85%	0.853	78%	0.781	S	S	*	*			cis	-132.4	154.1	39.5	-62.6	0	0	0	0	117
295	T	42.4	Very low	38	Very low	128 Å²	128	153.4 Å²	153.4	79%	0.785	78%	0.78	S	S	*	*			trans	-79.7	-179.6	177.5	39.3	0	0	0	0	113.7
296	P	40.3	Very low	37.5	Very low	121 Å²	121	153.1 Å²	153.1	79%	0.786	78%	0.779	S	S	*	*			cis	-133.3	168.7	7.2	25.7	-0.8	0	0	0	118.4
297	M	38.1	Very low	37.8	Very low	171 Å²	171	150.2 Å²	150.2	84%	0.842	78%	0.778	S	S	*	*			trans	-95.2	-162.2	160.5	-74.9	-127.6	75.5	0	0	110
298	P	41.7	Very low	37.6	Very low	110 Å²	110	147.7 Å²	147.7	71%	0.714	78%	0.783	S	S	*	*			cis	-122.9	-177.7	-46.8	30.2	-13.6	0	0	0	111.8
299	S	35.7	Very low	38	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	78%	0.777	S	S	*	*			trans	-144.8	147.9	131.9	61.9	0	0	0	0	111.4
300	S	32.8	Very low	38.1	Very low	109 Å²	109	143 Å²	143	76%	0.762	78%	0.78	S	S	*	*			trans	-86.7	136.6	-178	50	0	0	0	0	111.6
301	Y	37.6	Very low	38.1	Very low	224 Å²	224	142.6 Å²	142.6	88%	0.878	78%	0.783	S	S	*	*			trans	-124.8	125.3	157.4	-96	-84.2	0	0	0	111.5
302	S	38.1	Very low	38	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	78%	0.782	S	S	*	*			trans	-71.5	150.8	-179.8	-174.9	0	0	0	0	111.1	K304	S302-K304 PolarHBondContact O-N 3.11Å
303	Y	34.9	Very low	37.6	Very low	230 Å²	230	140.1 Å²	140.1	90%	0.902	79%	0.787	S	S	*	*			trans	-52.2	126.6	152.3	-93.1	-104.3	0	0	0	108.6
304	K	39	Very low	37.7	Very low	198 Å²	198	140.7 Å²	140.7	86%	0.861	79%	0.788	S	S	*	*			trans	-126.5	140.4	161.8	-80.2	-163.6	173.3	-173	0	108.7	S302	S302-K304 PolarHBondContact O-N 3.11Å
305	H	34.3	Very low	37.5	Very low	183 Å²	183	142 Å²	142	85%	0.847	79%	0.785	S	S	*	*			trans	-102.8	176.7	-176.9	-141.6	26.4	0	0	0	109.5
306	C	31.5	Very low	37.6	Very low	113 Å²	113	143.7 Å²	143.7	76%	0.764	79%	0.789	S	S	*	*			trans	69.2	164.4	171.4	-52.6	0	0	0	0	116.2
307	P	39.9	Very low	37.8	Very low	117 Å²	117	145 Å²	145	76%	0.76	79%	0.785	S	S	*	*			cis	-114.6	160.9	-7.6	37.1	-24.6	0	0	0	113.9
308	S	34.1	Very low	37.8	Very low	129 Å²	129	143.4 Å²	143.4	90%	0.902	78%	0.78	S	S	*	*			trans	-89.2	134.5	157.5	-54.4	0	0	0	0	109.1
309	S	40.5	Very low	38.1	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	78%	0.781	S	S	*	*			trans	-140.4	145	163.4	59.2	0	0	0	0	110.2
310	P	39.7	Very low	38.9	Very low	113 Å²	113	146 Å²	146	73%	0.734	79%	0.787	S	S	*	*			trans	-100.6	-168.6	-171.1	39.7	-34.5	0	0	0	113.3
311	V	39.2	Very low	40.1	Very low	123 Å²	123	149.8 Å²	149.8	75%	0.745	79%	0.79	S	S	*	*			trans	67.4	140.1	174.5	-123.3	0	0	0	0	113.2
312	E	38	Very low	40.6	Very low	155 Å²	155	145.1 Å²	145.1	72%	0.724	79%	0.787	S	S	*	*			cis	-120.8	166.1	11.8	-58.4	-116.6	106.9	0	0	114.1
313	V	36.6	Very low	41.9	Very low	117 Å²	117	152.1 Å²	152.1	71%	0.709	80%	0.799	S	S	*	*			trans	-103.9	120.6	172.9	174.6	0	0	0	0	109.4
314	F	38.6	Very low	43.5	Very low	177 Å²	177	149.2 Å²	149.2	78%	0.776	80%	0.797	S	S	*	*			trans	-127	120.6	156.9	-81.5	-86.9	0	0	0	108.8
315	N	35.6	Very low	45.1	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	79%	0.79	S	S	*	*			trans	-84.4	130	170.8	-68.9	-33.3	0	0	0	108
316	D	44.3	Very low	46.5	Very low	164 Å²	164	146.4 Å²	146.4	88%	0.877	79%	0.789	S	S	*	*			trans	-139.1	143.1	160.8	-110.5	-42.4	0	0	0	111.8
317	E	43.2	Very low	47.8	Very low	150 Å²	150	147.2 Å²	147.2	70%	0.701	80%	0.795	S	S	*	*			trans	-60.8	147.6	-160.2	-87.3	-77.6	110.3	0	0	117.4
318	N	38.2	Very low	48.9	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	80%	0.799	S	S	*	*			trans	13.6	107.7	145.7	-74	-55.7	0	0	0	119.6
319	S	49.1	Very low	50.6	Low	104 Å²	104	148.4 Å²	148.4	73%	0.727	79%	0.792	S	S	*	*			trans	-144.4	101	148.3	46.5	0	0	0	0	113.5	K321	S319-K321 PolarHBondContact O-N 2.64Å
320	N	50.7	Low	51.5	Low	168 Å²	168	152.2 Å²	152.2	90%	0.898	80%	0.798	S	S	*	*			trans	18.2	81.9	151.4	-60.7	-20.1	0	0	0	118.4
321	K	58.3	Low	52.3	Low	190 Å²	190	154.3 Å²	154.3	83%	0.826	80%	0.8	S	S	*	*			trans	-90.2	128.1	154.7	-70	170.9	-176.6	166	0	108.5	S319 R323	S319-K321 PolarHBondContact O-N 2.64Å; K321-R323 PolarHBondContact O-N 2.77Å
322	P	49.8	Very low	53.2	Low	125 Å²	125	156.6 Å²	156.6	81%	0.812	80%	0.802	S	S	*	*			trans	-64.6	111	-178	25.2	-33.2	0	0	0	110.5	I324	P322-I324 PolarHBondContact O-N 3.48Å
323	R	63.8	Low	54.3	Low	245 Å²	245	155 Å²	155	93%	0.925	81%	0.808	S	S	*	*			trans	-71	112.2	166.5	-82.3	-176.1	170.9	174.4	-1.7	107.9	K321 S325	K321-R323 PolarHBondContact O-N 2.77Å; R323-S325 VanDerWaalsContact C-N 3.31Å; R323-S325 PolarHBondContact O-N 2.84Å
324	I	68.5	Low	55.5	Low	168 Å²	168	153.3 Å²	153.3	86%	0.862	80%	0.798	S	S	*	*			trans	-66.1	95.8	167.3	-59	173.7	0	0	0	107.2	P322	P322-I324 PolarHBondContact O-N 3.48Å
325	S	72.3	Confident	57.2	Low	102 Å²	102	147.3 Å²	147.3	71%	0.713	78%	0.778	S	S	*	*			trans	-70.2	138.2	166.8	-166.7	0	0	0	0	108.6	R323	R323-S325 VanDerWaalsContact C-N 3.31Å; R323-S325 PolarHBondContact O-N 2.84Å
326	R	65	Low	59.2	Low	220 Å²	220	149.2 Å²	149.2	83%	0.83	78%	0.775	S	S	*	*			trans	-76.6	127.3	163.1	-74.2	-178.5	175.1	143.9	-2.3	107.6	L328	R326-L328 PolarHBondContact O-N 2.96Å; R326-L328 VanDerWaalsContact O-N 3.14Å
327	C	59.2	Low	60.8	Low	130 Å²	130	146.1 Å²	146.1	88%	0.878	76%	0.758	S	S	*	*			trans	-61.6	115.4	160.6	-60	0	0	0	0	107.4	S329	C327-S329 PolarHBondContact O-N 3.03Å
328	L	61.5	Low	62.2	Low	163 Å²	163	140.2 Å²	140.2	85%	0.853	74%	0.735	S	S	*	*			trans	-79.8	107	162	-67.6	172.9	0	0	0	105.7	R326 E330	R326-L328 PolarHBondContact O-N 2.96Å; R326-L328 VanDerWaalsContact O-N 3.14Å; L328-E330 PolarHBondContact O-N 3.2Å
329	S	69.8	Low	64	Low	108 Å²	108	136.9 Å²	136.9	76%	0.755	72%	0.717	S	S	*	*			trans	-65.6	122	158.2	36.9	0	0	0	0	107.2	C327 M331	C327-S329 PolarHBondContact O-N 3.03Å; S329-M331 PolarHBondContact O-N 3.22Å
330	E	59.6	Low	65.1	Low	189 Å²	189	134 Å²	134	88%	0.883	70%	0.699	S	S	*	*			trans	-62.4	113	166.3	-74.4	-173.8	120.6	0	0	107.6	L328 H332	L328-E330 PolarHBondContact O-N 3.2Å; E330-H332 PolarHBondContact O-N 2.99Å; E330-H332 VanDerWaalsContact O-N 3.08Å
331	M	56.7	Low	65.9	Low	158 Å²	158	133.5 Å²	133.5	78%	0.778	69%	0.685	S	S	*	*			trans	-63.5	112.8	163	-73	179	62.6	0	0	106.6	S329 S333	S329-M331 PolarHBondContact O-N 3.22Å; M331-S333 PolarHBondContact O-N 3.28Å
332	H	58.5	Low	66.1	Low	171 Å²	171	128.1 Å²	128.1	79%	0.792	67%	0.67	S	S	*	*			trans	-43.6	143.5	156.4	-107.5	-106.2	0	0	0	108.5	E330 V334	E330-H332 PolarHBondContact O-N 2.99Å; E330-H332 VanDerWaalsContact O-N 3.08Å; H332-V334 PolarHBondContact O-N 3.25Å
333	S	61.8	Low	66.9	Low	120 Å²	120	127.4 Å²	127.4	84%	0.839	66%	0.658	S	S	*	*			trans	-71.3	69.5	-177.6	59.7	0	0	0	0	111.6	M331 S335	M331-S333 PolarHBondContact O-N 3.28Å; S333-S335 PolarHBondContact O-N 2.99Å
334	V	61.4	Low	66.7	Low	82 Å²	82	116.8 Å²	116.8	50%	0.497	63%	0.626	S	S	.	*			trans	-61.9	107.1	169.9	-174.2	0	0	0	0	106.1	H332 Y336 A338 I339	H332-V334 PolarHBondContact O-N 3.25Å; V334-Y336 PolarHBondContact O-N 3.21Å; V334-A338 HydrophobicContact CG1-CB 3.94Å; V334-I339 HydrophobicContact CB-CG1 4.38Å; V334-I339 HydrophobicContact CG1-CD1 4.35Å; V334-I339 HydrophobicContact CG1-CG1 3.7Å
335	S	74.4	Confident	66.3	Low	52 Å²	52	111.1 Å²	111.1	36%	0.364	60%	0.6	S	S	.	*			trans	-49.8	141.6	179.8	169	0	0	0	0	109.9	S333 D337 A338 I339	S333-S335 PolarHBondContact O-N 2.99Å; S335-D337 PolarHBondContact O-N 3.29Å; S335-D337 VanDerWaalsContact O-N 3.12Å; S335-D337 WeakPolarHBondContact OG-CB 3.2Å; S335-D337 PolarHBondContact OG-N 2.94Å; S335-D337 PolarHBondContact OG-OD2 3.2Å; S335-A338 WeakPolarHBondContact O-CA 3.43Å; S335-A338 WeakPolarHBondContact O-CB 3.1Å; S335-A338 PolarHBondContact O-N 3.2Å; S335-I339 PolarHBondContact O-N 3.26Å; S335-I339 VanDerWaalsContact O-N 3.09Å
336	Y	77.5	Confident	65.6	Low	188 Å²	188	111.9 Å²	111.9	74%	0.737	60%	0.596	S	S	*	*	H	α-helix	trans	-51.6	-34.1	170.9	-175	-93	0	0	0	111	V334 A338 I339 A340	V334-Y336 PolarHBondContact O-N 3.21Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; Y336-A338 PolarHBondContact O-N 2.73Å; Y336-I339 PolarHBondContact O-N 2.9Å; Y336-A340 HydrophobicContact CE1-CB 4.41Å; Y336-A340 WeakPolarHBondContact O-CB 3.41Å; Y336-A340 PolarHBondContact O-N 2.88Å
337	D	77	Confident	65.1	Low	98 Å²	98	104.4 Å²	104.4	52%	0.524	58%	0.578	S	S	.	*	H	α-helix	trans	-65.1	-32.6	174.8	-49.2	-48.4	0	0	0	113.2	S335 R341	S335-D337 PolarHBondContact O-N 3.29Å; S335-D337 VanDerWaalsContact O-N 3.12Å; S335-D337 WeakPolarHBondContact OG-CB 3.2Å; S335-D337 PolarHBondContact OG-N 2.94Å; S335-D337 PolarHBondContact OG-OD2 3.2Å; D337-R341 WeakPolarHBondContact O-CB 3.48Å; D337-R341 WeakPolarHBondContact O-CG 3.35Å; D337-R341 PolarHBondContact O-N 3.07Å; D337-R341 PolarHBondContact O-NE 2.83Å
338	A	73.6	Confident	65	Low	26 Å²	26	102.6 Å²	102.6	22%	0.215	56%	0.559	C	S	.	*	H	α-helix	trans	-74.5	-40.7	176.9	0	0	0	0	0	110.3	V334 S335 Y336 R341 C342	V334-A338 HydrophobicContact CG1-CB 3.94Å; S335-A338 WeakPolarHBondContact O-CA 3.43Å; S335-A338 WeakPolarHBondContact O-CB 3.1Å; S335-A338 PolarHBondContact O-N 3.2Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; Y336-A338 PolarHBondContact O-N 2.73Å; A338-R341 PolarHBondContact O-N 2.75Å; A338-C342 WeakPolarHBondContact O-CB 3.36Å; A338-C342 PolarHBondContact O-N 3.23Å; A338-C342 PolarHBondContact O-SG 2.72Å; A338-C342 VanDerWaalsContact O-SG 3.37Å
339	I	74.9	Confident	65.1	Low	68 Å²	68	98.5 Å²	98.5	35%	0.349	54%	0.535	S	S	.	.	H	α-helix	trans	-62.9	-45.7	171.7	-57.1	-179.5	0	0	0	110.1	V334 S335 Y336 C342 I343	V334-I339 HydrophobicContact CB-CG1 4.38Å; V334-I339 HydrophobicContact CG1-CD1 4.35Å; V334-I339 HydrophobicContact CG1-CG1 3.7Å; S335-I339 PolarHBondContact O-N 3.26Å; S335-I339 VanDerWaalsContact O-N 3.09Å; Y336-I339 PolarHBondContact O-N 2.9Å; I339-C342 WeakPolarHBondContact O-CB 3.43Å; I339-C342 PolarHBondContact O-N 3.5Å; I339-I343 HydrophobicContact CG2-CD1 3.85Å; I339-I343 HydrophobicContact CG2-CG1 4.44Å; I339-I343 WeakPolarHBondContact O-CG1 3.27Å; I339-I343 PolarHBondContact O-N 3.28Å
340	A	73	Confident	64.8	Low	42 Å²	42	96.2 Å²	96.2	35%	0.347	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-38	177.5	0	0	0	0	0	112.5	Y336 I343 G344	Y336-A340 HydrophobicContact CE1-CB 4.41Å; Y336-A340 WeakPolarHBondContact O-CB 3.41Å; Y336-A340 PolarHBondContact O-N 2.88Å; A340-I343 PolarHBondContact O-N 2.71Å; A340-G344 PolarHBondContact O-N 2.83Å
341	R	67.5	Low	65	Low	158 Å²	158	89.5 Å²	89.5	60%	0.596	49%	0.49	S	S	*	.	H	α-helix	trans	-66	-38.1	171.1	-82.4	174.2	-81.7	136.6	-10.5	112.1	D337 A338 S345	D337-R341 WeakPolarHBondContact O-CB 3.48Å; D337-R341 WeakPolarHBondContact O-CG 3.35Å; D337-R341 PolarHBondContact O-N 3.07Å; D337-R341 PolarHBondContact O-NE 2.83Å; A338-R341 PolarHBondContact O-N 2.75Å; R341-S345 VanDerWaalsContact O-CB 3.22Å; R341-S345 WeakPolarHBondContact O-CB 3.45Å; R341-S345 PolarHBondContact O-N 2.66Å
342	C	61.6	Low	65.3	Low	78 Å²	78	82.5 Å²	82.5	53%	0.527	46%	0.456	S	S	.	.	H	α-helix	trans	-65.2	-47.9	172.1	-75.7	0	0	0	0	111.7	A338 I339 G344 S345 L346	A338-C342 WeakPolarHBondContact O-CB 3.36Å; A338-C342 PolarHBondContact O-N 3.23Å; A338-C342 PolarHBondContact O-SG 2.72Å; A338-C342 VanDerWaalsContact O-SG 3.37Å; I339-C342 WeakPolarHBondContact O-CB 3.43Å; I339-C342 PolarHBondContact O-N 3.5Å; C342-G344 VanDerWaalsContact C-N 3.33Å; C342-G344 PolarHBondContact O-N 2.82Å; C342-S345 CarbonylContact O-C 3.52Å; C342-S345 WeakPolarHBondContact O-CB 3.21Å; C342-S345 PolarHBondContact O-N 2.81Å; C342-L346 WeakPolarHBondContact O-CD1 3.41Å; C342-L346 PolarHBondContact O-N 3.44Å
343	I	66.2	Low	65.4	Low	109 Å²	109	76.1 Å²	76.1	56%	0.559	43%	0.431	S	S	*	.	H	α-helix	trans	-60.1	-43.8	175.7	-68.5	168.8	0	0	0	110.5	I339 A340 S345 L346 S347	I339-I343 HydrophobicContact CG2-CD1 3.85Å; I339-I343 HydrophobicContact CG2-CG1 4.44Å; I339-I343 WeakPolarHBondContact O-CG1 3.27Å; I339-I343 PolarHBondContact O-N 3.28Å; A340-I343 PolarHBondContact O-N 2.71Å; I343-S345 PolarHBondContact O-N 3.04Å; I343-L346 CarbonylContact O-C 3.48Å; I343-L346 PolarHBondContact O-N 3.32Å; I343-S347 PolarHBondContact O-N 3.28Å; I343-S347 PolarHBondContact O-OG 3.05Å; I343-S347 VanDerWaalsContact O-OG 3.07Å
344	G	60.5	Low	65.3	Low	23 Å²	23	73.8 Å²	73.8	24%	0.237	41%	0.409	C	S	.	.	H	α-helix	trans	-58	-45.3	173.2	0	0	0	0	0	112.6	A340 C342 S347 N348	A340-G344 PolarHBondContact O-N 2.83Å; C342-G344 VanDerWaalsContact C-N 3.33Å; C342-G344 PolarHBondContact O-N 2.82Å; G344-S347 VanDerWaalsContact CA-OG 3.29Å; G344-S347 WeakPolarHBondContact CA-OG 3.49Å; G344-S347 CarbonylContact O-C 3.59Å; G344-S347 PolarHBondContact O-N 2.99Å; G344-S347 PolarHBondContact O-OG 3.35Å; G344-N348 WeakPolarHBondContact O-CB 3.26Å; G344-N348 PolarHBondContact O-N 2.71Å; G344-N348 PolarHBondContact O-ND2 3.18Å
345	S	59.8	Low	65.2	Low	48 Å²	48	72.2 Å²	72.2	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-65.2	-36.4	174.6	-170.7	0	0	0	0	112.6	R341 C342 I343 N348 L351	R341-S345 VanDerWaalsContact O-CB 3.22Å; R341-S345 WeakPolarHBondContact O-CB 3.45Å; R341-S345 PolarHBondContact O-N 2.66Å; C342-S345 CarbonylContact O-C 3.52Å; C342-S345 WeakPolarHBondContact O-CB 3.21Å; C342-S345 PolarHBondContact O-N 2.81Å; I343-S345 PolarHBondContact O-N 3.04Å; S345-N348 PolarHBondContact O-N 3.41Å; S345-L351 WeakPolarHBondContact OG-CD1 3.2Å
346	L	57.1	Low	64.8	Low	118 Å²	118	79 Å²	79	62%	0.618	43%	0.427	S	S	*	.	H	α-helix	trans	-69.4	-37.2	173	-92.7	76	0	0	0	111.9	C342 I343 R366	C342-L346 WeakPolarHBondContact O-CD1 3.41Å; C342-L346 PolarHBondContact O-N 3.44Å; I343-L346 CarbonylContact O-C 3.48Å; I343-L346 PolarHBondContact O-N 3.32Å; L346-R366 VanDerWaalsContact O-CZ 3.23Å; L346-R366 PolarHBondContact O-NH1 3.2Å; L346-R366 PolarHBondContact O-NH2 3.19Å
347	S	54.5	Low	64.5	Low	64 Å²	64	76.2 Å²	76.2	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-74.3	-25.9	173.1	50.4	0	0	0	0	113.1	I343 G344 H349	I343-S347 PolarHBondContact O-N 3.28Å; I343-S347 PolarHBondContact O-OG 3.05Å; I343-S347 VanDerWaalsContact O-OG 3.07Å; G344-S347 VanDerWaalsContact CA-OG 3.29Å; G344-S347 WeakPolarHBondContact CA-OG 3.49Å; G344-S347 CarbonylContact O-C 3.59Å; G344-S347 PolarHBondContact O-N 2.99Å; G344-S347 PolarHBondContact O-OG 3.35Å; S347-H349 VanDerWaalsContact C-N 3.34Å; S347-H349 PolarHBondContact O-CD2 3.37Å; S347-H349 PolarHBondContact O-N 2.79Å
348	N	58.1	Low	64.7	Low	91 Å²	91	76.7 Å²	76.7	49%	0.487	42%	0.421	S	S	.	.			trans	-67.7	90.6	171.9	-77.8	-24.1	0	0	0	110.1	G344 S345 S350 L351	G344-N348 WeakPolarHBondContact O-CB 3.26Å; G344-N348 PolarHBondContact O-N 2.71Å; G344-N348 PolarHBondContact O-ND2 3.18Å; S345-N348 PolarHBondContact O-N 3.41Å; N348-S350 PolarHBondContact O-N 3.3Å; N348-L351 PolarHBondContact O-N 3.13Å
349	H	63.7	Low	65.3	Low	77 Å²	77	76.4 Å²	76.4	36%	0.356	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-7.9	-179.6	-55.2	-83.4	0	0	0	114.4	S347 R359 V363 R366	S347-H349 VanDerWaalsContact C-N 3.34Å; S347-H349 PolarHBondContact O-CD2 3.37Å; S347-H349 PolarHBondContact O-N 2.79Å; H349-R359 WeakPolarHBondContact O-CD 3.32Å; H349-V363 HydrophobicContact CB-CB 3.75Å; H349-V363 HydrophobicContact CB-CG1 3.74Å; H349-R366 PolarHBondContact ND1-NE 2.83Å
350	S	63.5	Low	66.1	Low	61 Å²	61	74.3 Å²	74.3	43%	0.427	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-19.2	179.5	52	0	0	0	0	115.2	N348 V358 R359	N348-S350 PolarHBondContact O-N 3.3Å; S350-V358 CarbonylContact O-C 3.35Å; S350-V358 WeakPolarHBondContact O-CA 3.44Å; S350-R359 WeakPolarHBondContact O-CB 3.44Å; S350-R359 PolarHBondContact O-N 2.91Å
351	L	63.5	Low	67	Low	48 Å²	48	72.5 Å²	72.5	25%	0.251	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-94.2	140.8	-175.3	-66.5	178.6	0	0	0	113.9	S345 N348 R359	S345-L351 WeakPolarHBondContact OG-CD1 3.2Å; N348-L351 PolarHBondContact O-N 3.13Å; L351-R359 VanDerWaalsContact O-CZ 3.26Å; L351-R359 PolarHBondContact O-NE 3.11Å; L351-R359 PolarHBondContact O-NH2 2.78Å
352	C	62.8	Low	68.2	Low	10 Å²	10	68.3 Å²	68.3	7%	0.068	39%	0.385	C	S	.	.			trans	-71.1	170.8	177.8	-159	0	0	0	0	111.4	D354 G355 R357 R359 E571	C352-D354 PolarHBondContact O-N 3.13Å; C352-G355 PolarHBondContact O-N 3.24Å; C352-R357 HydrophobicContact CB-CB 4.12Å; C352-R357 WeakPolarHBondContact CB-O 3.28Å; C352-R357 PolarHBondContact N-O 2.95Å; C352-R359 HydrophobicContact CB-CG 4.41Å; C352-E571 PolarHBondContact SG-OE1 2.69Å
353	S	60.1	Low	69.7	Low	38 Å²	38	65.8 Å²	65.8	27%	0.266	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-3.3	-173	-42.5	0	0	0	0	114.1	P570	S353-P570 PolarHBondContact OG-O 3.32Å
354	D	61	Low	70.9	Confident	70 Å²	70	63.8 Å²	63.8	37%	0.374	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-7.2	174.4	66.2	-2.5	0	0	0	113.4	C352 R356 R357	C352-D354 PolarHBondContact O-N 3.13Å; D354-R356 PolarHBondContact O-N 2.79Å; D354-R356 VanDerWaalsContact O-N 3.13Å; D354-R356 PolarHBondContact OD1-N 2.99Å; D354-R357 PolarHBondContact OD1-N 2.69Å; D354-R357 VanDerWaalsContact OD1-N 3.15Å
355	G	59.5	Low	72.4	Confident	49 Å²	49	65.9 Å²	65.9	51%	0.505	37%	0.366	S	S	.	.	S	Bend	trans	67.4	-2.3	-173.3	0	0	0	0	0	115.5	C352	C352-G355 PolarHBondContact O-N 3.24Å
356	R	64.5	Low	73.8	Confident	195 Å²	195	67.4 Å²	67.4	74%	0.736	36%	0.364	S	S	*	.	S	Bend	trans	-104.4	-22.9	-171.7	-66.6	179.4	-176.6	-135.3	-0.6	113.5	D354	D354-R356 PolarHBondContact O-N 2.79Å; D354-R356 VanDerWaalsContact O-N 3.13Å; D354-R356 PolarHBondContact OD1-N 2.99Å
357	R	72.2	Confident	75.4	Confident	129 Å²	129	63.4 Å²	63.4	49%	0.487	34%	0.344	S	S	.	.	S	Bend	trans	-117.6	143	-176.7	-56.7	-175.8	76.1	120.3	8.5	111.3	C352 D354	C352-R357 HydrophobicContact CB-CB 4.12Å; C352-R357 WeakPolarHBondContact CB-O 3.28Å; C352-R357 PolarHBondContact N-O 2.95Å; D354-R357 PolarHBondContact OD1-N 2.69Å; D354-R357 VanDerWaalsContact OD1-N 3.15Å
358	V	81.7	Confident	76.9	Confident	109 Å²	109	64.7 Å²	64.7	66%	0.661	37%	0.368	S	S	*	.	B	Isolated β-bridge	trans	-70.2	141.2	165.3	-178.3	0	0	0	0	108.6	S350	S350-V358 CarbonylContact O-C 3.35Å; S350-V358 WeakPolarHBondContact O-CA 3.44Å
359	R	86.6	Confident	78.1	Confident	20 Å²	20	62.9 Å²	62.9	8%	0.075	36%	0.363	C	S	.	.			trans	-62.2	141.1	177.7	-84.2	-171.6	-169.8	-76.1	-16.1	112.3	H349 S350 L351 C352 L361 H372 E571 Y573	H349-R359 WeakPolarHBondContact O-CD 3.32Å; S350-R359 WeakPolarHBondContact O-CB 3.44Å; S350-R359 PolarHBondContact O-N 2.91Å; L351-R359 VanDerWaalsContact O-CZ 3.26Å; L351-R359 PolarHBondContact O-NE 3.11Å; L351-R359 PolarHBondContact O-NH2 2.78Å; C352-R359 HydrophobicContact CB-CG 4.41Å; R359-L361 PolarHBondContact O-N 3.3Å; R359-H372 PolarHBondContact NE-CD2 2.67Å; R359-H372 VanDerWaalsContact NE-CD2 3.31Å; R359-H372 PolarHBondContact NE-NE2 3.34Å; R359-H372 PolarHBondContact NH2-CE1 3.42Å; R359-H372 PolarHBondContact NH2-NE2 3.26Å; R359-E571 IonicContact NH1-OE2 2.78Å; R359-Y573 VanDerWaalsContact CB-OH 3.27Å; R359-Y573 WeakPolarHBondContact CB-OH 3.29Å; R359-Y573 WeakPolarHBondContact CD-OH 3.48Å; R359-Y573 WeakPolarHBondContact CG-OH 3.24Å
360	A	89.7	Confident	79.2	Confident	23 Å²	23	60 Å²	60	19%	0.19	35%	0.354	C	S	.	.	S	Bend	trans	-61.3	-27.4	176.5	0	0	0	0	0	113.5	I390 P531 V533	A360-I390 VanDerWaalsContact O-CD1 3.26Å; A360-I390 WeakPolarHBondContact O-CD1 3.4Å; A360-P531 HydrophobicContact CB-CB 4.11Å; A360-P531 HydrophobicContact CB-CG 3.95Å; A360-V533 HydrophobicContact CB-CG2 3.63Å
361	L	92.8	Very high	80.5	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	34%	0.336	C	S	.	.	S	Bend	trans	-128.8	145.1	-177.6	-59.6	179.4	0	0	0	112.8	R359 V363 V374 T378 L382 I390 V533 I535 Y573	R359-L361 PolarHBondContact O-N 3.3Å; L361-V363 PolarHBondContact O-N 2.85Å; L361-V374 HydrophobicContact CB-CG1 3.83Å; L361-V374 HydrophobicContact CD1-CG1 3.95Å; L361-T378 HydrophobicContact CB-CG2 4.25Å; L361-T378 HydrophobicContact CD1-CG2 4.4Å; L361-T378 HydrophobicContact CD2-CG2 4.1Å; L361-T378 HydrophobicContact CG-CG2 4.49Å; L361-L382 HydrophobicContact CD1-CD1 3.87Å; L361-L382 HydrophobicContact CD2-CD1 3.81Å; L361-L382 HydrophobicContact CD2-CD2 4.05Å; L361-L382 HydrophobicContact CD2-CG 4.26Å; L361-I390 HydrophobicContact CD2-CD1 3.84Å; L361-V533 HydrophobicContact CD1-CG1 3.77Å; L361-V533 HydrophobicContact CG-CG1 4.42Å; L361-I535 HydrophobicContact CD1-CD1 3.79Å; L361-I535 HydrophobicContact CD1-CG1 4.33Å; L361-Y573 HydrophobicContact CB-CE1 4.06Å; L361-Y573 HydrophobicContact CD1-CD2 4.35Å; L361-Y573 HydrophobicContact CD1-CE2 4.42Å
362	P	92.3	Very high	82	Confident	70 Å²	70	56.3 Å²	56.3	46%	0.455	33%	0.329	S	S	.	.			trans	-67.3	129.1	174.7	28.9	-35	0	0	0	111	T378	P362-T378 HydrophobicContact CG-CG2 4.17Å
363	V	92.7	Very high	83.5	Confident	26 Å²	26	56.2 Å²	56.2	16%	0.158	33%	0.328	C	S	.	.			trans	-96	134.9	-177.5	176.5	0	0	0	0	110.1	H349 L361 D365 H372 C373 Y573	H349-V363 HydrophobicContact CB-CB 3.75Å; H349-V363 HydrophobicContact CB-CG1 3.74Å; L361-V363 PolarHBondContact O-N 2.85Å; V363-D365 WeakPolarHBondContact CG1-O 3.38Å; V363-H372 HydrophobicContact CG1-CB 3.93Å; V363-H372 HydrophobicContact CG2-CB 3.83Å; V363-C373 CarbonylContact C-O 3.56Å; V363-C373 WeakPolarHBondContact CA-O 3.43Å; V363-Y573 HydrophobicContact CG2-CD1 4.31Å; V363-Y573 HydrophobicContact CG2-CE1 3.76Å
364	V	93	Very high	85.3	Confident	66 Å²	66	54.4 Å²	54.4	40%	0.4	32%	0.315	S	S	.	.			trans	-118.3	-1.5	-176.3	-58.1	0	0	0	0	114	C373 K576	V364-C373 PolarHBondContact N-O 3.29Å; V364-K576 HydrophobicContact CG2-CB 4.35Å; V364-K576 HydrophobicContact CG2-CD 3.85Å; V364-K576 PolarHBondContact O-NZ 3.24Å
365	D	91.1	Very high	87	Confident	68 Å²	68	52.2 Å²	52.2	36%	0.364	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	174.5	177.8	-144.2	-27.2	0	0	0	111.1	V363 C373 K576	V363-D365 WeakPolarHBondContact CG1-O 3.38Å; D365-C373 HydrophobicContact CB-CB 3.65Å; D365-C373 PolarHBondContact O-N 3.37Å; D365-K576 HydrophobicContact CB-CD 3.98Å; D365-K576 VanDerWaalsContact OD2-CE 3.29Å; D365-K576 WeakPolarHBondContact OD2-CE 3.44Å; D365-K576 IonicContact OD2-NZ 2.67Å; D365-K576 PolarHBondContact OD2-NZ 3Å
366	R	90.5	Very high	88.8	Confident	79 Å²	79	50.3 Å²	50.3	30%	0.298	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	144.2	157.8	-72.4	-175.7	-176.4	140.9	5.2	110.8	L346 H349 G370 L371 H372	L346-R366 VanDerWaalsContact O-CZ 3.23Å; L346-R366 PolarHBondContact O-NH1 3.2Å; L346-R366 PolarHBondContact O-NH2 3.19Å; H349-R366 PolarHBondContact ND1-NE 2.83Å; R366-G370 WeakPolarHBondContact CD-O 3.45Å; R366-L371 CarbonylContact C-O 3.58Å; R366-L371 WeakPolarHBondContact CA-O 3.13Å; R366-H372 PolarHBondContact NE-NE2 3.11Å; R366-H372 PolarHBondContact NH2-NE2 3.05Å
367	T	90.1	Very high	90.4	Very high	34 Å²	34	43.6 Å²	43.6	21%	0.209	26%	0.263	C	S	.	.			trans	-71.4	153.1	166.7	-51.9	0	0	0	0	109.2	S369 G370 L371 P546	T367-S369 PolarHBondContact O-N 3.45Å; T367-G370 PolarHBondContact O-N 2.87Å; T367-G370 VanDerWaalsContact O-N 3.07Å; T367-L371 PolarHBondContact N-O 3.17Å; T367-P546 HydrophobicContact CG2-CB 3.88Å; T367-P546 HydrophobicContact CG2-CG 3.85Å
368	G	85.8	Confident	91.6	Very high	91 Å²	91	37.8 Å²	37.8	94%	0.938	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	21.8	174.5	0	0	0	0	0	116.1
369	S	82.8	Confident	92.3	Very high	54 Å²	54	32.6 Å²	32.6	38%	0.378	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	35.3	172.2	70.8	0	0	0	0	110.3	T367 L371	T367-S369 PolarHBondContact O-N 3.45Å; S369-L371 PolarHBondContact O-N 3.14Å
370	G	86.5	Confident	92.8	Very high	16 Å²	16	32 Å²	32	17%	0.165	21%	0.209	C	C	.	.	S	Bend	trans	76	-29.8	178.7	0	0	0	0	0	116.8	E54 R366 T367 H372	E54-G370 WeakPolarHBondContact OE2-CA 3.4Å; E54-G370 PolarHBondContact OE2-N 3.03Å; R366-G370 WeakPolarHBondContact CD-O 3.45Å; T367-G370 PolarHBondContact O-N 2.87Å; T367-G370 VanDerWaalsContact O-N 3.07Å; G370-H372 PolarHBondContact O-N 3.13Å
371	L	91.1	Very high	93.1	Very high	10 Å²	10	33.6 Å²	33.6	5%	0.052	21%	0.214	C	C	.	.			trans	-61.3	126.3	-167.8	-61.9	173.8	0	0	0	113.5	R366 T367 S369 A549 A550 I574	R366-L371 CarbonylContact C-O 3.58Å; R366-L371 WeakPolarHBondContact CA-O 3.13Å; T367-L371 PolarHBondContact N-O 3.17Å; S369-L371 PolarHBondContact O-N 3.14Å; L371-A549 HydrophobicContact CD1-CB 3.59Å; L371-A550 HydrophobicContact CD1-CB 4.23Å; L371-I574 HydrophobicContact CB-CG1 4.09Å; L371-I574 HydrophobicContact CD1-CD1 4.15Å; L371-I574 HydrophobicContact CD1-CG1 4.4Å
372	H	94.3	Very high	93.2	Very high	22 Å²	22	33.6 Å²	33.6	10%	0.102	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.6	-178.1	-57.5	67.8	0	0	0	112.1	R359 V363 R366 G370 Y573 I574	R359-H372 PolarHBondContact NE-CD2 2.67Å; R359-H372 VanDerWaalsContact NE-CD2 3.31Å; R359-H372 PolarHBondContact NE-NE2 3.34Å; R359-H372 PolarHBondContact NH2-CE1 3.42Å; R359-H372 PolarHBondContact NH2-NE2 3.26Å; V363-H372 HydrophobicContact CG1-CB 3.93Å; V363-H372 HydrophobicContact CG2-CB 3.83Å; R366-H372 PolarHBondContact NE-NE2 3.11Å; R366-H372 PolarHBondContact NH2-NE2 3.05Å; G370-H372 PolarHBondContact O-N 3.13Å; H372-Y573 HydrophobicContact CB-CD1 4.04Å; H372-Y573 HydrophobicContact CB-CE1 4.29Å; H372-Y573 CarbonylContact O-C 3.58Å; H372-Y573 VanDerWaalsContact O-CA 3.27Å; H372-Y573 WeakPolarHBondContact O-CA 3.37Å; H372-I574 PolarHBondContact O-N 2.71Å
373	C	95.9	Very high	93.3	Very high	7 Å²	7	31.9 Å²	31.9	5%	0.047	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.6	-178.2	-60.1	0	0	0	0	112	V363 V364 D365 I574 K576	V363-C373 CarbonylContact C-O 3.56Å; V363-C373 WeakPolarHBondContact CA-O 3.43Å; V364-C373 PolarHBondContact N-O 3.29Å; D365-C373 HydrophobicContact CB-CB 3.65Å; D365-C373 PolarHBondContact O-N 3.37Å; C373-I574 CarbonylContact C-O 3.59Å; C373-I574 WeakPolarHBondContact CA-O 3.46Å; C373-K576 HydrophobicContact CB-CB 4.39Å
374	V	96.8	Very high	93.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	154	171.6	-65.8	0	0	0	0	111.4	L361 T378 V379 I535 Y573 I574 M575 K576	L361-V374 HydrophobicContact CB-CG1 3.83Å; L361-V374 HydrophobicContact CD1-CG1 3.95Å; V374-T378 HydrophobicContact CB-CG2 4.11Å; V374-T378 HydrophobicContact CG1-CG2 4.26Å; V374-V379 HydrophobicContact CG2-CG2 3.77Å; V374-I535 HydrophobicContact CG2-CG2 4.13Å; V374-Y573 HydrophobicContact CG1-CD1 3.46Å; V374-Y573 VanDerWaalsContact CG1-CD1 3.46Å; V374-Y573 HydrophobicContact CG1-CE1 4.07Å; V374-Y573 HydrophobicContact CG1-CG 3.92Å; V374-I574 PolarHBondContact N-O 3.38Å; V374-M575 HydrophobicContact CG2-CB 4.42Å; V374-K576 WeakPolarHBondContact O-CB 3.43Å; V374-K576 PolarHBondContact O-N 2.93Å
375	S	97.2	Very high	93.2	Very high	25 Å²	25	32.8 Å²	32.8	18%	0.175	22%	0.218	C	C	.	.			trans	-69.8	154.4	172.3	59.7	0	0	0	0	111.7	D377 T378 V379	S375-D377 PolarHBondContact O-N 3.45Å; S375-T378 PolarHBondContact O-N 2.94Å; S375-T378 WeakPolarHBondContact OG-CB 3.18Å; S375-T378 PolarHBondContact OG-N 2.84Å; S375-T378 PolarHBondContact OG-OG1 3.21Å; S375-V379 PolarHBondContact O-N 3.2Å
376	T	97.6	Very high	93	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.055	23%	0.227	C	C	.	.	H	α-helix	trans	-51.9	-35	166.5	40.7	0	0	0	0	112.2	V379 S380 M575 A581 F582	T376-V379 PolarHBondContact O-N 3.28Å; T376-S380 PolarHBondContact O-N 2.77Å; T376-S380 PolarHBondContact O-OG 3.43Å; T376-M575 HydrophobicContact CG2-CG 4.37Å; T376-M575 HydrophobicContact CG2-SD 4.25Å; T376-A581 HydrophobicContact CG2-CB 3.94Å; T376-F582 HydrophobicContact CG2-CB 4.01Å; T376-F582 HydrophobicContact CG2-CD2 4.42Å
377	D	97.6	Very high	92.7	Very high	54 Å²	54	32.3 Å²	32.3	29%	0.289	23%	0.225	S	C	.	.	H	α-helix	trans	-74.1	-38.5	-174.1	-45.5	-95.9	0	0	0	110.4	S375 V379 S380 D381 K585 F586	S375-D377 PolarHBondContact O-N 3.45Å; D377-V379 PolarHBondContact O-N 2.86Å; D377-S380 VanDerWaalsContact CA-OG 3.29Å; D377-S380 WeakPolarHBondContact CA-OG 3.17Å; D377-S380 PolarHBondContact O-N 3.07Å; D377-S380 PolarHBondContact O-OG 3.17Å; D377-D381 PolarHBondContact O-N 3.32Å; D377-K585 WeakPolarHBondContact OD1-CD 3.38Å; D377-K585 IonicContact OD1-NZ 2.69Å; D377-K585 PolarHBondContact OD1-NZ 3.29Å; D377-K585 IonicContact OD2-NZ 2.78Å; D377-K585 PolarHBondContact OD2-NZ 2.96Å; D377-F586 HydrophobicContact CB-CZ 4.49Å
378	T	96.7	Very high	92.1	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-32.1	169.6	-69.7	0	0	0	0	112.5	L361 P362 V374 S375 L382	L361-T378 HydrophobicContact CB-CG2 4.25Å; L361-T378 HydrophobicContact CD1-CG2 4.4Å; L361-T378 HydrophobicContact CD2-CG2 4.1Å; L361-T378 HydrophobicContact CG-CG2 4.49Å; P362-T378 HydrophobicContact CG-CG2 4.17Å; V374-T378 HydrophobicContact CB-CG2 4.11Å; V374-T378 HydrophobicContact CG1-CG2 4.26Å; S375-T378 PolarHBondContact O-N 2.94Å; S375-T378 WeakPolarHBondContact OG-CB 3.18Å; S375-T378 PolarHBondContact OG-N 2.84Å; S375-T378 PolarHBondContact OG-OG1 3.21Å; T378-L382 WeakPolarHBondContact O-CG 3.41Å; T378-L382 PolarHBondContact O-N 3.32Å
379	V	97.3	Very high	92.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-76.7	-37.6	176.5	177	0	0	0	0	111.3	V374 S375 T376 D377 L382 I383 I394 I535 M575 F582	V374-V379 HydrophobicContact CG2-CG2 3.77Å; S375-V379 PolarHBondContact O-N 3.2Å; T376-V379 PolarHBondContact O-N 3.28Å; D377-V379 PolarHBondContact O-N 2.86Å; V379-L382 PolarHBondContact O-N 3.41Å; V379-I383 HydrophobicContact CG1-CD1 3.81Å; V379-I383 WeakPolarHBondContact O-CD1 3.44Å; V379-I383 VanDerWaalsContact O-CG1 3.3Å; V379-I383 WeakPolarHBondContact O-CG1 3.07Å; V379-I383 PolarHBondContact O-N 2.81Å; V379-I394 HydrophobicContact CG1-CD1 3.91Å; V379-I535 HydrophobicContact CG2-CD1 4.28Å; V379-I535 HydrophobicContact CG2-CG2 4.13Å; V379-M575 HydrophobicContact CB-CG 4.45Å; V379-M575 HydrophobicContact CB-SD 3.86Å; V379-M575 HydrophobicContact CG1-SD 3.92Å; V379-M575 HydrophobicContact CG2-CB 4.27Å; V379-M575 HydrophobicContact CG2-CG 3.8Å; V379-M575 HydrophobicContact CG2-SD 3.8Å; V379-F582 HydrophobicContact CB-CE2 4.25Å; V379-F582 HydrophobicContact CG1-CD2 4.44Å; V379-F582 HydrophobicContact CG1-CE2 3.96Å
380	S	96.9	Very high	92.5	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-38.8	170.7	48.6	0	0	0	0	112.4	T376 D377 L382 I383 S384 F586	T376-S380 PolarHBondContact O-N 2.77Å; T376-S380 PolarHBondContact O-OG 3.43Å; D377-S380 VanDerWaalsContact CA-OG 3.29Å; D377-S380 WeakPolarHBondContact CA-OG 3.17Å; D377-S380 PolarHBondContact O-N 3.07Å; D377-S380 PolarHBondContact O-OG 3.17Å; S380-L382 VanDerWaalsContact C-N 3.25Å; S380-L382 PolarHBondContact O-N 3.41Å; S380-I383 PolarHBondContact O-N 3.19Å; S380-S384 VanDerWaalsContact O-CB 3.31Å; S380-S384 WeakPolarHBondContact O-CB 3.44Å; S380-S384 PolarHBondContact O-N 2.85Å; S380-S384 PolarHBondContact O-OG 3.22Å; S380-F586 VanDerWaalsContact OG-CE2 3.28Å; S380-F586 WeakPolarHBondContact OG-CE2 3.38Å; S380-F586 WeakPolarHBondContact OG-CZ 3.33Å
381	D	95.9	Very high	92.8	Very high	55 Å²	55	44.9 Å²	44.9	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-59.9	-33.7	176.6	-66.5	-27.6	0	0	0	113.5	D377 G385 S386 K387	D377-D381 PolarHBondContact O-N 3.32Å; D381-G385 PolarHBondContact O-N 2.81Å; D381-S386 WeakPolarHBondContact O-CB 3.04Å; D381-S386 PolarHBondContact O-N 2.83Å; D381-K387 HydrophobicContact CB-CD 3.73Å; D381-K387 HydrophobicContact CB-CG 4.09Å; D381-K387 PolarHBondContact O-N 3.31Å; D381-K387 VanDerWaalsContact O-N 3.15Å; D381-K387 IonicContact OD2-NZ 3.59Å; D381-K387 PolarHBondContact OD2-NZ 3.43Å
382	L	95	Very high	93	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-72.6	-46.6	176.2	-73.2	165.6	0	0	0	110.9	L361 T378 V379 S380 S384 G385 K387 I390 Y392 I535	L361-L382 HydrophobicContact CD1-CD1 3.87Å; L361-L382 HydrophobicContact CD2-CD1 3.81Å; L361-L382 HydrophobicContact CD2-CD2 4.05Å; L361-L382 HydrophobicContact CD2-CG 4.26Å; T378-L382 WeakPolarHBondContact O-CG 3.41Å; T378-L382 PolarHBondContact O-N 3.32Å; V379-L382 PolarHBondContact O-N 3.41Å; S380-L382 VanDerWaalsContact C-N 3.25Å; S380-L382 PolarHBondContact O-N 3.41Å; L382-S384 PolarHBondContact O-N 2.76Å; L382-G385 PolarHBondContact O-N 3.44Å; L382-G385 VanDerWaalsContact O-N 3.15Å; L382-K387 HydrophobicContact CD2-CB 3.85Å; L382-K387 HydrophobicContact CG-CB 4.44Å; L382-K387 HydrophobicContact CG-CD 4.49Å; L382-I390 HydrophobicContact CD2-CB 4.12Å; L382-I390 HydrophobicContact CD2-CD1 4.34Å; L382-I390 HydrophobicContact CD2-CG2 4.11Å; L382-Y392 HydrophobicContact CB-CD1 4.12Å; L382-Y392 HydrophobicContact CB-CE1 3.91Å; L382-Y392 HydrophobicContact CD2-CD1 4.08Å; L382-Y392 HydrophobicContact CD2-CE1 4.49Å; L382-Y392 PolarHBondContact O-OH 2.86Å; L382-I535 HydrophobicContact CD1-CD1 3.58Å
383	I	95.2	Very high	93.1	Very high	33 Å²	33	47.4 Å²	47.4	17%	0.169	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-37	-179.2	-62.7	160.3	0	0	0	111.6	V379 S380 G385 I394 I408 F582 L589	V379-I383 HydrophobicContact CG1-CD1 3.81Å; V379-I383 WeakPolarHBondContact O-CD1 3.44Å; V379-I383 VanDerWaalsContact O-CG1 3.3Å; V379-I383 WeakPolarHBondContact O-CG1 3.07Å; V379-I383 PolarHBondContact O-N 2.81Å; S380-I383 PolarHBondContact O-N 3.19Å; I383-G385 PolarHBondContact O-N 3.18Å; I383-I394 HydrophobicContact CD1-CD1 3.84Å; I383-I394 HydrophobicContact CG1-CD1 3.96Å; I383-I408 HydrophobicContact CD1-CG2 3.35Å; I383-F582 HydrophobicContact CD1-CE2 4.23Å; I383-F582 HydrophobicContact CD1-CZ 3.77Å; I383-L589 HydrophobicContact CB-CD1 4.37Å; I383-L589 HydrophobicContact CG2-CD1 4.29Å; I383-L589 HydrophobicContact CG2-CD2 4.08Å
384	S	93.1	Very high	93.2	Very high	74 Å²	74	47.1 Å²	47.1	52%	0.517	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-5	175.6	-66.3	0	0	0	0	113.7	S380 L382 S386	S380-S384 VanDerWaalsContact O-CB 3.31Å; S380-S384 WeakPolarHBondContact O-CB 3.44Å; S380-S384 PolarHBondContact O-N 2.85Å; S380-S384 PolarHBondContact O-OG 3.22Å; L382-S384 PolarHBondContact O-N 2.76Å; S384-S386 VanDerWaalsContact C-N 3.25Å; S384-S386 PolarHBondContact O-N 2.75Å
385	G	89.9	Confident	93.3	Very high	38 Å²	38	47.1 Å²	47.1	39%	0.392	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	13.8	-179	0	0	0	0	0	114.9	D381 L382 I383 K387 R388	D381-G385 PolarHBondContact O-N 2.81Å; L382-G385 PolarHBondContact O-N 3.44Å; L382-G385 VanDerWaalsContact O-N 3.15Å; I383-G385 PolarHBondContact O-N 3.18Å; G385-K387 VanDerWaalsContact C-N 3.34Å; G385-R388 WeakPolarHBondContact O-CG 3.41Å
386	S	86.9	Confident	93.3	Very high	80 Å²	80	46 Å²	46	56%	0.559	24%	0.244	S	C	*	.			trans	-63.3	-43.6	173.8	-47.7	0	0	0	0	110.4	D381 S384 R388	D381-S386 WeakPolarHBondContact O-CB 3.04Å; D381-S386 PolarHBondContact O-N 2.83Å; S384-S386 VanDerWaalsContact C-N 3.25Å; S384-S386 PolarHBondContact O-N 2.75Å; S386-R388 PolarHBondContact O-N 2.79Å
387	K	83.7	Confident	93.3	Very high	57 Å²	57	45.6 Å²	45.6	25%	0.248	24%	0.242	C	C	.	.	S	Bend	trans	-88.7	80.7	176.1	-78.3	170.1	177.3	144.5	0	110.6	D381 L382 G385	D381-K387 HydrophobicContact CB-CD 3.73Å; D381-K387 HydrophobicContact CB-CG 4.09Å; D381-K387 PolarHBondContact O-N 3.31Å; D381-K387 VanDerWaalsContact O-N 3.15Å; D381-K387 IonicContact OD2-NZ 3.59Å; D381-K387 PolarHBondContact OD2-NZ 3.43Å; L382-K387 HydrophobicContact CD2-CB 3.85Å; L382-K387 HydrophobicContact CG-CB 4.44Å; L382-K387 HydrophobicContact CG-CD 4.49Å; G385-K387 VanDerWaalsContact C-N 3.34Å
388	R	77.4	Confident	93.4	Very high	213 Å²	213	43 Å²	43	80%	0.804	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	159.9	172.9	-59.7	180	-176.1	167	2.2	110.9	G385 S386 I390	G385-R388 WeakPolarHBondContact O-CG 3.41Å; S386-R388 PolarHBondContact O-N 2.79Å; R388-I390 VanDerWaalsContact C-N 3.35Å; R388-I390 PolarHBondContact O-N 3.49Å
389	N	86.2	Confident	93.4	Very high	140 Å²	140	43.2 Å²	43.2	75%	0.749	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	23.9	177.2	-49.3	-11.1	0	0	0	115.7	P530	N389-P530 WeakPolarHBondContact O-CB 3.47Å
390	I	90.6	Very high	93.4	Very high	32 Å²	32	43.9 Å²	43.9	16%	0.164	23%	0.233	C	C	.	.			trans	-125.5	124.3	170.6	-57.9	177.7	0	0	0	108.8	A360 L361 L382 R388 V533	A360-I390 VanDerWaalsContact O-CD1 3.26Å; A360-I390 WeakPolarHBondContact O-CD1 3.4Å; L361-I390 HydrophobicContact CD2-CD1 3.84Å; L382-I390 HydrophobicContact CD2-CB 4.12Å; L382-I390 HydrophobicContact CD2-CD1 4.34Å; L382-I390 HydrophobicContact CD2-CG2 4.11Å; R388-I390 VanDerWaalsContact C-N 3.35Å; R388-I390 PolarHBondContact O-N 3.49Å; I390-V533 HydrophobicContact CG2-CG2 3.73Å
391	N	92.9	Very high	93.4	Very high	74 Å²	74	43.6 Å²	43.6	40%	0.396	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	143	169.5	-71.7	-33.3	0	0	0	109.1	P531 F532 V533	N391-P531 PolarHBondContact N-O 3.22Å; N391-P531 VanDerWaalsContact O-O 3.14Å; N391-F532 HydrophobicContact CB-CB 4.23Å; N391-F532 HydrophobicContact CB-CD2 3.37Å; N391-F532 HydrophobicContact CB-CE2 3.81Å; N391-F532 HydrophobicContact CB-CG 3.86Å; N391-F532 CarbonylContact O-C 3.54Å; N391-F532 WeakPolarHBondContact O-CA 3.19Å; N391-V533 PolarHBondContact O-N 2.92Å
392	Y	95.3	Very high	93.5	Very high	72 Å²	72	41 Å²	41	28%	0.282	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.5	-178.7	66.1	-94.2	0	0	0	113.9	L382 I394 V533	L382-Y392 HydrophobicContact CB-CD1 4.12Å; L382-Y392 HydrophobicContact CB-CE1 3.91Å; L382-Y392 HydrophobicContact CD2-CD1 4.08Å; L382-Y392 HydrophobicContact CD2-CE1 4.49Å; L382-Y392 PolarHBondContact O-OH 2.86Å; Y392-I394 HydrophobicContact CD2-CD1 4.3Å; Y392-I394 HydrophobicContact CD2-CG1 3.94Å; Y392-I394 HydrophobicContact CE2-CD1 4.02Å; Y392-I394 HydrophobicContact CE2-CG1 4.13Å; Y392-V533 CarbonylContact C-O 3.58Å; Y392-V533 VanDerWaalsContact CA-O 3.25Å; Y392-V533 WeakPolarHBondContact CA-O 3.47Å
393	V	96.6	Very high	93.7	Very high	13 Å²	13	42 Å²	42	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.1	164.1	67.8	0	0	0	0	109.7	V395 I412 I424 V428 F532 V533 V534 I535	V393-V395 HydrophobicContact CG1-CG2 4.46Å; V393-I412 HydrophobicContact CG2-CD1 3.63Å; V393-I412 HydrophobicContact CG2-CG1 4.05Å; V393-I424 HydrophobicContact CG1-CD1 4.24Å; V393-V428 HydrophobicContact CG1-CG2 3.87Å; V393-F532 HydrophobicContact CB-CE1 4.06Å; V393-F532 HydrophobicContact CG1-CE1 4.01Å; V393-V533 PolarHBondContact N-O 2.68Å; V393-V534 HydrophobicContact CG1-CB 4.26Å; V393-V534 HydrophobicContact CG1-CG1 3.91Å; V393-V534 HydrophobicContact CG1-CG2 4.11Å; V393-I535 PolarHBondContact O-N 2.89Å
394	I	98	Very high	93.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.1	177.2	-58.9	176	0	0	0	108.4	V379 I383 Y392 I408 A411 I412 I535	V379-I394 HydrophobicContact CG1-CD1 3.91Å; I383-I394 HydrophobicContact CD1-CD1 3.84Å; I383-I394 HydrophobicContact CG1-CD1 3.96Å; Y392-I394 HydrophobicContact CD2-CD1 4.3Å; Y392-I394 HydrophobicContact CD2-CG1 3.94Å; Y392-I394 HydrophobicContact CE2-CD1 4.02Å; Y392-I394 HydrophobicContact CE2-CG1 4.13Å; I394-I408 HydrophobicContact CD1-CG2 4.16Å; I394-A411 HydrophobicContact CB-CB 3.99Å; I394-A411 HydrophobicContact CG2-CB 3.74Å; I394-A411 CarbonylContact O-C 3.57Å; I394-A411 VanDerWaalsContact O-CA 3.26Å; I394-A411 WeakPolarHBondContact O-CA 3.15Å; I394-I412 PolarHBondContact O-N 2.92Å; I394-I535 CarbonylContact C-O 3.6Å; I394-I535 WeakPolarHBondContact CA-O 3.01Å
395	V	98.3	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	106.1	-175.7	-174	0	0	0	0	109.8	V393 C397 I414 L420 I424 V534 I535 F536 H537	V393-V395 HydrophobicContact CG1-CG2 4.46Å; V395-C397 PolarHBondContact O-N 3Å; V395-I414 HydrophobicContact CG1-CB 3.89Å; V395-I414 HydrophobicContact CG1-CD1 4.11Å; V395-I414 HydrophobicContact CG1-CG1 4.23Å; V395-L420 HydrophobicContact CG1-CD1 4.19Å; V395-I424 HydrophobicContact CG2-CD1 3.99Å; V395-V534 HydrophobicContact CG2-CG1 3.95Å; V395-I535 PolarHBondContact N-O 2.93Å; V395-F536 HydrophobicContact CB-CD1 3.97Å; V395-F536 HydrophobicContact CB-CE1 4.26Å; V395-F536 HydrophobicContact CB-CG 4.3Å; V395-F536 HydrophobicContact CG1-CD1 3.96Å; V395-F536 HydrophobicContact CG1-CE1 4.03Å; V395-F536 HydrophobicContact CG2-CE1 4.48Å; V395-H537 PolarHBondContact O-N 3.36Å
396	D	98.5	Very high	94.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	108	175.2	-165.3	-22.1	0	0	0	110.6	R398 Y403 A411 I412 N413 I414 H537	D396-R398 VanDerWaalsContact C-N 3.26Å; D396-R398 PolarHBondContact O-N 2.9Å; D396-R398 WeakPolarHBondContact OD1-CB 3.39Å; D396-R398 WeakPolarHBondContact OD1-CG 3.44Å; D396-R398 PolarHBondContact OD1-N 2.84Å; D396-R398 IonicContact OD1-NE 3.98Å; D396-R398 PolarHBondContact OD1-NE 2.97Å; D396-R398 VanDerWaalsContact OD1-NE 3.13Å; D396-R398 IonicContact OD2-CZ 3.48Å; D396-R398 VanDerWaalsContact OD2-CZ 3.24Å; D396-R398 IonicContact OD2-NE 2.79Å; D396-R398 PolarHBondContact OD2-NE 2.92Å; D396-R398 IonicContact OD2-NH2 3.32Å; D396-R398 PolarHBondContact OD2-NH2 2.86Å; D396-Y403 HydrophobicContact CB-CD2 3.82Å; D396-Y403 HydrophobicContact CB-CE2 4.22Å; D396-A411 HydrophobicContact CB-CB 4.49Å; D396-I412 PolarHBondContact N-O 3.27Å; D396-N413 PolarHBondContact O-ND2 3.37Å; D396-I414 PolarHBondContact O-N 2.91Å; D396-H537 WeakPolarHBondContact CB-NE2 3.35Å; D396-H537 IonicContact OD1-CE1 3.6Å; D396-H537 IonicContact OD1-ND1 2.72Å; D396-H537 IonicContact OD2-CE1 2.69Å; D396-H537 PolarHBondContact OD2-CE1 3.14Å; D396-H537 IonicContact OD2-NE2 3.13Å
397	C	98.1	Very high	94.8	Very high	2 Å²	2	37 Å²	37	1%	0.014	17%	0.171	C	C	.	.			trans	-86	11.9	-178.5	-56.1	0	0	0	0	113.5	V395 I414 H537 C538 R544 A545 L548	V395-C397 PolarHBondContact O-N 3Å; C397-I414 WeakPolarHBondContact CA-O 3.18Å; C397-H537 WeakPolarHBondContact CB-O 3.5Å; C397-H537 PolarHBondContact N-O 3.43Å; C397-H537 PolarHBondContact SG-O 3.47Å; C397-C538 HydrophobicContact CB-CB 4Å; C397-R544 HydrophobicContact CB-CB 4.24Å; C397-A545 HydrophobicContact CB-CB 4.27Å; C397-L548 HydrophobicContact CB-CD1 3.81Å
398	R	98.2	Very high	95.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-77.4	164.6	172	-65.2	-177.9	-63.2	152.1	1.2	111.6	D396 E402 G406 N413 F415 C538 E539	D396-R398 VanDerWaalsContact C-N 3.26Å; D396-R398 PolarHBondContact O-N 2.9Å; D396-R398 WeakPolarHBondContact OD1-CB 3.39Å; D396-R398 WeakPolarHBondContact OD1-CG 3.44Å; D396-R398 PolarHBondContact OD1-N 2.84Å; D396-R398 IonicContact OD1-NE 3.98Å; D396-R398 PolarHBondContact OD1-NE 2.97Å; D396-R398 VanDerWaalsContact OD1-NE 3.13Å; D396-R398 IonicContact OD2-CZ 3.48Å; D396-R398 VanDerWaalsContact OD2-CZ 3.24Å; D396-R398 IonicContact OD2-NE 2.79Å; D396-R398 PolarHBondContact OD2-NE 2.92Å; D396-R398 IonicContact OD2-NH2 3.32Å; D396-R398 PolarHBondContact OD2-NH2 2.86Å; R398-E402 HydrophobicContact CB-CB 3.76Å; R398-E402 HydrophobicContact CB-CG 4.36Å; R398-E402 WeakPolarHBondContact CB-OE1 3.48Å; R398-E402 HydrophobicContact CG-CB 4.4Å; R398-E402 WeakPolarHBondContact CG-OE1 3.35Å; R398-E402 PolarHBondContact NH1-O 3.21Å; R398-G406 PolarHBondContact NH1-O 3.4Å; R398-G406 PolarHBondContact NH2-O 2.99Å; R398-N413 PolarHBondContact O-ND2 2.81Å; R398-F415 WeakPolarHBondContact O-CB 3.2Å; R398-C538 HydrophobicContact CG-CB 4.16Å; R398-E539 HydrophobicContact CG-CB 4.46Å
399	F	97.9	Very high	96.5	Very high	10 Å²	10	28.1 Å²	28.1	4%	0.044	14%	0.138	C	C	.	.			trans	-74.3	156.8	174.9	-58	-49.9	0	0	0	111	Y401 E402 Y403 F415 M598 L607 Y610 K611	F399-Y401 VanDerWaalsContact C-N 3.31Å; F399-Y401 HydrophobicContact CB-CD1 3.9Å; F399-Y401 HydrophobicContact CB-CE1 3.5Å; F399-Y401 AromaticContact CD2-CE1 3.93Å; F399-Y401 HydrophobicContact CD2-CE1 3.93Å; F399-Y401 HydrophobicContact CG-CE1 4.16Å; F399-Y401 PolarHBondContact O-N 3.38Å; F399-Y401 VanDerWaalsContact O-N 3.11Å; F399-E402 WeakPolarHBondContact CB-OE2 3.1Å; F399-E402 WeakPolarHBondContact CD2-OE2 3.34Å; F399-E402 WeakPolarHBondContact CG-OE2 3.49Å; F399-E402 PolarHBondContact N-OE2 3.43Å; F399-E402 WeakPolarHBondContact O-CB 3.15Å; F399-E402 PolarHBondContact O-N 3.44Å; F399-Y403 PolarHBondContact O-N 3.42Å; F399-F415 HydrophobicContact CD1-CB 4.22Å; F399-F415 AromaticContact CD1-CD2 3.99Å; F399-F415 HydrophobicContact CD1-CD2 3.99Å; F399-F415 HydrophobicContact CD1-CG 4.29Å; F399-F415 HydrophobicContact CE1-CD2 4.48Å; F399-M598 HydrophobicContact CD2-CG 4.38Å; F399-M598 HydrophobicContact CE2-CE 4.03Å; F399-M598 HydrophobicContact CE2-CG 4.25Å; F399-L607 HydrophobicContact CD2-CD1 4.32Å; F399-L607 HydrophobicContact CE2-CD1 3.92Å; F399-Y610 HydrophobicContact CB-CD2 3.97Å; F399-Y610 HydrophobicContact CB-CG 4.13Å; F399-Y610 VanDerWaalsContact CD1-CB 3.48Å; F399-Y610 HydrophobicContact CD1-CG 4.11Å; F399-Y610 HydrophobicContact CG-CD2 4.33Å; F399-Y610 HydrophobicContact CG-CG 4.14Å; F399-K611 HydrophobicContact CE2-CG 4.25Å; F399-K611 HydrophobicContact CZ-CG 4.13Å
400	P	96.9	Very high	96.9	Very high	13 Å²	13	24.1 Å²	24.1	8%	0.084	13%	0.13	C	C	.	.	H	α-helix	trans	-51.3	-42	-172.2	-32.7	37.3	0	0	0	115	E402 Y403 E404 F415 Y610	P400-E402 VanDerWaalsContact C-N 3.29Å; P400-E402 PolarHBondContact O-N 2.97Å; P400-Y403 PolarHBondContact O-N 2.84Å; P400-Y403 VanDerWaalsContact O-N 3.13Å; P400-E404 WeakPolarHBondContact O-CB 3.27Å; P400-E404 WeakPolarHBondContact O-CG 3.35Å; P400-E404 PolarHBondContact O-N 2.9Å; P400-F415 HydrophobicContact CG-CD1 3.82Å; P400-F415 HydrophobicContact CG-CE1 3.44Å; P400-F415 VanDerWaalsContact CG-CE1 3.44Å; P400-F415 HydrophobicContact CG-CZ 4.05Å; P400-Y610 HydrophobicContact CG-CE1 3.86Å; P400-Y610 HydrophobicContact CG-CE2 4.46Å
401	Y	96.8	Very high	97.2	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-67.5	-24.4	179.5	70.4	-89	0	0	0	114.5	F399 G405 V596 M598 Y603 H606 Y610	F399-Y401 VanDerWaalsContact C-N 3.31Å; F399-Y401 HydrophobicContact CB-CD1 3.9Å; F399-Y401 HydrophobicContact CB-CE1 3.5Å; F399-Y401 AromaticContact CD2-CE1 3.93Å; F399-Y401 HydrophobicContact CD2-CE1 3.93Å; F399-Y401 HydrophobicContact CG-CE1 4.16Å; F399-Y401 PolarHBondContact O-N 3.38Å; F399-Y401 VanDerWaalsContact O-N 3.11Å; Y401-G405 PolarHBondContact O-N 3.43Å; Y401-V596 HydrophobicContact CD2-CG1 4.03Å; Y401-V596 HydrophobicContact CE2-CG1 4.36Å; Y401-M598 PolarHBondContact OH-O 3.09Å; Y401-Y603 AromaticContact CD2-CD1 3.82Å; Y401-Y603 HydrophobicContact CD2-CD1 3.82Å; Y401-Y603 AromaticContact CD2-CD2 3.49Å; Y401-Y603 HydrophobicContact CD2-CD2 3.49Å; Y401-Y603 VanDerWaalsContact CD2-CD2 3.49Å; Y401-Y603 HydrophobicContact CD2-CE1 4.49Å; Y401-Y603 HydrophobicContact CD2-CE2 4.22Å; Y401-Y603 AromaticContact CD2-CG 3.26Å; Y401-Y603 HydrophobicContact CD2-CG 3.26Å; Y401-Y603 VanDerWaalsContact CE2-CB 3.47Å; Y401-Y603 HydrophobicContact CE2-CD2 4.11Å; Y401-Y603 AromaticContact CE2-CG 3.9Å; Y401-Y603 HydrophobicContact CE2-CG 3.9Å; Y401-Y603 AromaticContact CG-CD1 3.82Å; Y401-Y603 HydrophobicContact CG-CD1 3.82Å; Y401-Y603 HydrophobicContact CG-CD2 4.32Å; Y401-Y603 HydrophobicContact CG-CE1 4.45Å; Y401-Y603 AromaticContact CG-CG 3.74Å; Y401-Y603 HydrophobicContact CG-CG 3.74Å; Y401-H606 HydrophobicContact CD1-CB 3.73Å; Y401-H606 HydrophobicContact CE1-CB 4.07Å; Y401-H606 HydrophobicContact CG-CB 4.36Å; Y401-Y610 AromaticContact CD1-CD2 3.89Å; Y401-Y610 HydrophobicContact CD1-CD2 3.89Å; Y401-Y610 AromaticContact CD1-CE2 3.86Å; Y401-Y610 HydrophobicContact CD1-CE2 3.86Å; Y401-Y610 AromaticContact CE1-CD2 3.92Å; Y401-Y610 HydrophobicContact CE1-CD2 3.92Å; Y401-Y610 HydrophobicContact CE1-CE2 4.37Å
402	E	98.1	Very high	97.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-76.6	-35.1	173.3	-60.5	167.3	67	0	0	110.6	R398 F399 P400 G405 R544 M598	R398-E402 HydrophobicContact CB-CB 3.76Å; R398-E402 HydrophobicContact CB-CG 4.36Å; R398-E402 WeakPolarHBondContact CB-OE1 3.48Å; R398-E402 HydrophobicContact CG-CB 4.4Å; R398-E402 WeakPolarHBondContact CG-OE1 3.35Å; R398-E402 PolarHBondContact NH1-O 3.21Å; F399-E402 WeakPolarHBondContact CB-OE2 3.1Å; F399-E402 WeakPolarHBondContact CD2-OE2 3.34Å; F399-E402 WeakPolarHBondContact CG-OE2 3.49Å; F399-E402 PolarHBondContact N-OE2 3.43Å; F399-E402 WeakPolarHBondContact O-CB 3.15Å; F399-E402 PolarHBondContact O-N 3.44Å; P400-E402 VanDerWaalsContact C-N 3.29Å; P400-E402 PolarHBondContact O-N 2.97Å; E402-G405 CarbonylContact O-C 3.58Å; E402-R544 IonicContact OE1-CZ 2.86Å; E402-R544 IonicContact OE1-NH1 3.67Å; E402-R544 PolarHBondContact OE1-NH1 3.13Å; E402-R544 IonicContact OE1-NH2 3.75Å; E402-R544 PolarHBondContact OE1-NH2 3.02Å; E402-R544 IonicContact OE2-CZ 3.24Å; E402-R544 IonicContact OE2-NH1 2.66Å; E402-R544 PolarHBondContact OE2-NH1 3.14Å; E402-R544 IonicContact OE2-NH2 2.64Å; E402-M598 WeakPolarHBondContact OE1-CB 3.44Å
403	Y	98.4	Very high	97.5	Very high	25 Å²	25	19.2 Å²	19.2	10%	0.098	11%	0.109	C	C	.	.	H	α-helix	trans	-75.4	-45.1	178.4	173.7	-85.1	0	0	0	111.8	D396 F399 P400 G405 G406 H407 A411 N413	D396-Y403 HydrophobicContact CB-CD2 3.82Å; D396-Y403 HydrophobicContact CB-CE2 4.22Å; F399-Y403 PolarHBondContact O-N 3.42Å; P400-Y403 PolarHBondContact O-N 2.84Å; P400-Y403 VanDerWaalsContact O-N 3.13Å; Y403-G405 PolarHBondContact O-N 3.44Å; Y403-G406 CarbonylContact O-C 3.59Å; Y403-G406 PolarHBondContact O-N 2.81Å; Y403-H407 AromaticContact CD1-ND1 3.7Å; Y403-H407 HydrophobicContact CD2-CB 3.32Å; Y403-H407 AromaticContact CD2-CG 3.62Å; Y403-H407 AromaticContact CE1-CE1 3.62Å; Y403-H407 AromaticContact CE1-CG 3.87Å; Y403-H407 AromaticContact CE1-ND1 3.53Å; Y403-H407 AromaticContact CE1-NE2 3.99Å; Y403-H407 HydrophobicContact CE2-CB 3.47Å; Y403-H407 VanDerWaalsContact CE2-CB 3.47Å; Y403-H407 AromaticContact CE2-CD2 3.57Å; Y403-H407 AromaticContact CE2-CG 3.36Å; Y403-H407 AromaticContact CE2-ND1 3.9Å; Y403-H407 HydrophobicContact CG-CB 3.9Å; Y403-H407 AromaticContact CG-ND1 3.94Å; Y403-H407 AromaticContact CZ-CD2 3.45Å; Y403-H407 VanDerWaalsContact CZ-CD2 3.45Å; Y403-H407 AromaticContact CZ-CE1 3.73Å; Y403-H407 AromaticContact CZ-CG 3.48Å; Y403-H407 VanDerWaalsContact CZ-CG 3.48Å; Y403-H407 AromaticContact CZ-ND1 3.63Å; Y403-H407 AromaticContact CZ-NE2 3.64Å; Y403-H407 PolarHBondContact O-ND1 3.47Å; Y403-H407 PolarHBondContact OH-CD2 2.82Å; Y403-H407 PolarHBondContact OH-NE2 3.2Å; Y403-A411 HydrophobicContact CE2-CB 4.47Å; Y403-A411 PolarHBondContact OH-O 2.76Å; Y403-N413 HydrophobicContact CD1-CB 3.91Å; Y403-N413 HydrophobicContact CD2-CB 3.63Å; Y403-N413 HydrophobicContact CE1-CB 4.13Å; Y403-N413 HydrophobicContact CE2-CB 3.83Å; Y403-N413 HydrophobicContact CG-CB 3.67Å
404	E	96.8	Very high	97.6	Very high	81 Å²	81	18.9 Å²	18.9	38%	0.379	11%	0.107	S	C	.	.	H	α-helix	trans	-56.6	-40.6	171	-72.1	178.7	178.7	0	0	110.7	P400 G406 P592 R781	P400-E404 WeakPolarHBondContact O-CB 3.27Å; P400-E404 WeakPolarHBondContact O-CG 3.35Å; P400-E404 PolarHBondContact O-N 2.9Å; E404-G406 PolarHBondContact O-N 2.91Å; E404-P592 WeakPolarHBondContact O-CD 3.22Å; E404-R781 WeakPolarHBondContact OE1-CD 3.42Å; E404-R781 IonicContact OE1-CZ 3.32Å; E404-R781 IonicContact OE1-NE 2.64Å; E404-R781 IonicContact OE1-NH1 2.98Å; E404-R781 PolarHBondContact OE1-NH1 3.23Å; E404-R781 IonicContact OE2-NH1 3.21Å; E404-R781 PolarHBondContact OE2-NH1 3.31Å
405	G	96.5	Very high	97.5	Very high	7 Å²	7	19.5 Å²	19.5	7%	0.072	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	37.3	173.1	0	0	0	0	0	115.5	Y401 E402 Y403 E594 V596	Y401-G405 PolarHBondContact O-N 3.43Å; E402-G405 CarbonylContact O-C 3.58Å; Y403-G405 PolarHBondContact O-N 3.44Å; G405-E594 CarbonylContact O-C 3.47Å; G405-V596 PolarHBondContact O-N 3.35Å
406	G	97.7	Very high	97.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.			trans	102.3	119.4	177	0	0	0	0	0	113.7	R398 Y403 E404 Y579 P592	R398-G406 PolarHBondContact NH1-O 3.4Å; R398-G406 PolarHBondContact NH2-O 2.99Å; Y403-G406 CarbonylContact O-C 3.59Å; Y403-G406 PolarHBondContact O-N 2.81Å; E404-G406 PolarHBondContact O-N 2.91Å; G406-Y579 WeakPolarHBondContact O-CE1 3.48Å; G406-Y579 PolarHBondContact O-OH 3.25Å; G406-P592 WeakPolarHBondContact CA-O 3.22Å
407	H	98.5	Very high	97.3	Very high	32 Å²	32	20 Å²	20	15%	0.148	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	167	176.1	56.9	-87.6	0	0	0	112.1	Y403 Y579 C590 T591	Y403-H407 AromaticContact CD1-ND1 3.7Å; Y403-H407 HydrophobicContact CD2-CB 3.32Å; Y403-H407 AromaticContact CD2-CG 3.62Å; Y403-H407 AromaticContact CE1-CE1 3.62Å; Y403-H407 AromaticContact CE1-CG 3.87Å; Y403-H407 AromaticContact CE1-ND1 3.53Å; Y403-H407 AromaticContact CE1-NE2 3.99Å; Y403-H407 HydrophobicContact CE2-CB 3.47Å; Y403-H407 VanDerWaalsContact CE2-CB 3.47Å; Y403-H407 AromaticContact CE2-CD2 3.57Å; Y403-H407 AromaticContact CE2-CG 3.36Å; Y403-H407 AromaticContact CE2-ND1 3.9Å; Y403-H407 HydrophobicContact CG-CB 3.9Å; Y403-H407 AromaticContact CG-ND1 3.94Å; Y403-H407 AromaticContact CZ-CD2 3.45Å; Y403-H407 VanDerWaalsContact CZ-CD2 3.45Å; Y403-H407 AromaticContact CZ-CE1 3.73Å; Y403-H407 AromaticContact CZ-CG 3.48Å; Y403-H407 VanDerWaalsContact CZ-CG 3.48Å; Y403-H407 AromaticContact CZ-ND1 3.63Å; Y403-H407 AromaticContact CZ-NE2 3.64Å; Y403-H407 PolarHBondContact O-ND1 3.47Å; Y403-H407 PolarHBondContact OH-CD2 2.82Å; Y403-H407 PolarHBondContact OH-NE2 3.2Å; H407-Y579 PolarHBondContact N-OH 2.83Å; H407-C590 CarbonylContact O-C 3.55Å; H407-C590 WeakPolarHBondContact O-CA 3.34Å; H407-C590 WeakPolarHBondContact O-CB 3.43Å; H407-T591 PolarHBondContact CE1-O 3.2Å; H407-T591 PolarHBondContact N-O 2.99Å; H407-T591 PolarHBondContact ND1-O 3.47Å; H407-T591 PolarHBondContact O-N 3.03Å
408	I	98.4	Very high	97.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	135.1	177.7	-53.3	-177	0	0	0	109.5	I383 I394 G410 A411 M575 Y579 F582	I383-I408 HydrophobicContact CD1-CG2 3.35Å; I394-I408 HydrophobicContact CD1-CG2 4.16Å; I408-G410 PolarHBondContact O-N 3.01Å; I408-A411 HydrophobicContact CB-CB 4.2Å; I408-A411 VanDerWaalsContact O-CB 3.24Å; I408-A411 WeakPolarHBondContact O-CB 3.47Å; I408-A411 PolarHBondContact O-N 3.08Å; I408-M575 HydrophobicContact CD1-CE 3.74Å; I408-M575 HydrophobicContact CD1-SD 4.16Å; I408-Y579 HydrophobicContact CD1-CD2 4.44Å; I408-Y579 HydrophobicContact CG1-CD2 3.77Å; I408-Y579 HydrophobicContact CG1-CE2 3.97Å; I408-F582 HydrophobicContact CB-CE1 4.34Å; I408-F582 HydrophobicContact CD1-CB 4.41Å; I408-F582 HydrophobicContact CD1-CD1 3.8Å; I408-F582 HydrophobicContact CD1-CD2 4.24Å; I408-F582 HydrophobicContact CD1-CE1 4.08Å; I408-F582 HydrophobicContact CD1-CE2 4.5Å; I408-F582 HydrophobicContact CD1-CG 3.88Å; I408-F582 HydrophobicContact CD1-CZ 4.42Å; I408-F582 HydrophobicContact CG1-CD1 3.76Å; I408-F582 HydrophobicContact CG1-CE1 3.87Å; I408-F582 HydrophobicContact CG1-CG 4.36Å; I408-F582 HydrophobicContact CG2-CE1 3.82Å; I408-F582 HydrophobicContact CG2-CZ 3.89Å
409	K	96.9	Very high	97	Very high	84 Å²	84	21 Å²	21	37%	0.365	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	125.9	177.4	-76	171	-176.8	175.7	0	111.2	A411 H588 L589 C590 T591	K409-A411 VanDerWaalsContact C-N 3.33Å; K409-H588 PolarHBondContact NZ-O 3.39Å; K409-L589 WeakPolarHBondContact CB-O 3.21Å; K409-L589 VanDerWaalsContact CG-O 3.3Å; K409-L589 WeakPolarHBondContact CG-O 3.25Å; K409-L589 PolarHBondContact N-O 2.92Å; K409-C590 WeakPolarHBondContact CE-O 3.46Å; K409-T591 VanDerWaalsContact CE-OG1 3.3Å; K409-T591 WeakPolarHBondContact CE-OG1 3.31Å; K409-T591 VanDerWaalsContact CG-OG1 3.31Å; K409-T591 WeakPolarHBondContact CG-OG1 3.41Å
410	G	95.1	Very high	96.9	Very high	57 Å²	57	20.6 Å²	20.6	59%	0.588	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	3.6	-178.2	0	0	0	0	0	115.4	I408	I408-G410 PolarHBondContact O-N 3.01Å
411	A	97.6	Very high	96.8	Very high	4 Å²	4	20 Å²	20	3%	0.033	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	156.1	170	0	0	0	0	0	112.1	I394 D396 Y403 I408 K409	I394-A411 HydrophobicContact CB-CB 3.99Å; I394-A411 HydrophobicContact CG2-CB 3.74Å; I394-A411 CarbonylContact O-C 3.57Å; I394-A411 VanDerWaalsContact O-CA 3.26Å; I394-A411 WeakPolarHBondContact O-CA 3.15Å; D396-A411 HydrophobicContact CB-CB 4.49Å; Y403-A411 HydrophobicContact CE2-CB 4.47Å; Y403-A411 PolarHBondContact OH-O 2.76Å; I408-A411 HydrophobicContact CB-CB 4.2Å; I408-A411 VanDerWaalsContact O-CB 3.24Å; I408-A411 WeakPolarHBondContact O-CB 3.47Å; I408-A411 PolarHBondContact O-N 3.08Å; K409-A411 VanDerWaalsContact C-N 3.33Å
412	I	97	Very high	96.7	Very high	29 Å²	29	20.4 Å²	20.4	15%	0.149	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.2	171.6	61.5	178.3	0	0	0	110	V393 I394 D396 I414	V393-I412 HydrophobicContact CG2-CD1 3.63Å; V393-I412 HydrophobicContact CG2-CG1 4.05Å; I394-I412 PolarHBondContact O-N 2.92Å; D396-I412 PolarHBondContact N-O 3.27Å; I412-I414 HydrophobicContact CD1-CD1 3.74Å; I412-I414 HydrophobicContact CD1-CG1 4.42Å; I412-I414 HydrophobicContact CG1-CD1 4.1Å; I412-I414 HydrophobicContact CG1-CG1 4.31Å
413	N	98	Very high	96.5	Very high	42 Å²	42	21.3 Å²	21.3	23%	0.225	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.2	178.8	-171	-126	0	0	0	111.7	D396 R398 Y403	D396-N413 PolarHBondContact O-ND2 3.37Å; R398-N413 PolarHBondContact O-ND2 2.81Å; Y403-N413 HydrophobicContact CD1-CB 3.91Å; Y403-N413 HydrophobicContact CD2-CB 3.63Å; Y403-N413 HydrophobicContact CE1-CB 4.13Å; Y403-N413 HydrophobicContact CE2-CB 3.83Å; Y403-N413 HydrophobicContact CG-CB 3.67Å
414	I	97.2	Very high	96.3	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.031	11%	0.113	C	C	.	.			trans	-140.8	109.6	177	-56.6	-179.2	0	0	0	109.3	V395 D396 C397 I412 D419 L420 E423 L548	V395-I414 HydrophobicContact CG1-CB 3.89Å; V395-I414 HydrophobicContact CG1-CD1 4.11Å; V395-I414 HydrophobicContact CG1-CG1 4.23Å; D396-I414 PolarHBondContact O-N 2.91Å; C397-I414 WeakPolarHBondContact CA-O 3.18Å; I412-I414 HydrophobicContact CD1-CD1 3.74Å; I412-I414 HydrophobicContact CD1-CG1 4.42Å; I412-I414 HydrophobicContact CG1-CD1 4.1Å; I412-I414 HydrophobicContact CG1-CG1 4.31Å; I414-D419 HydrophobicContact CG2-CB 4.38Å; I414-L420 HydrophobicContact CD1-CD1 4.15Å; I414-L420 HydrophobicContact CG2-CB 3.67Å; I414-L420 HydrophobicContact CG2-CD1 3.92Å; I414-L420 HydrophobicContact CG2-CG 4.41Å; I414-E423 HydrophobicContact CD1-CB 3.76Å; I414-L548 WeakPolarHBondContact O-CD1 3.35Å
415	F	96.3	Very high	96.1	Very high	14 Å²	14	16.2 Å²	16.2	6%	0.061	10%	0.095	C	C	.	.			trans	-121.1	6.4	-175.2	70.6	-84.3	0	0	0	114.1	R398 F399 P400 Y610 L613 T614 I782	R398-F415 WeakPolarHBondContact O-CB 3.2Å; F399-F415 HydrophobicContact CD1-CB 4.22Å; F399-F415 AromaticContact CD1-CD2 3.99Å; F399-F415 HydrophobicContact CD1-CD2 3.99Å; F399-F415 HydrophobicContact CD1-CG 4.29Å; F399-F415 HydrophobicContact CE1-CD2 4.48Å; P400-F415 HydrophobicContact CG-CD1 3.82Å; P400-F415 HydrophobicContact CG-CE1 3.44Å; P400-F415 VanDerWaalsContact CG-CE1 3.44Å; P400-F415 HydrophobicContact CG-CZ 4.05Å; F415-Y610 HydrophobicContact CD2-CD1 4.23Å; F415-Y610 AromaticContact CE2-CD1 3.53Å; F415-Y610 HydrophobicContact CE2-CD1 3.53Å; F415-Y610 AromaticContact CE2-CE1 3.97Å; F415-Y610 HydrophobicContact CE2-CE1 3.97Å; F415-Y610 AromaticContact CZ-CD1 3.85Å; F415-Y610 HydrophobicContact CZ-CD1 3.85Å; F415-Y610 AromaticContact CZ-CE1 3.77Å; F415-Y610 HydrophobicContact CZ-CE1 3.77Å; F415-L613 HydrophobicContact CE2-CD2 4.04Å; F415-L613 HydrophobicContact CZ-CD2 4.39Å; F415-T614 WeakPolarHBondContact O-CG2 3.29Å; F415-T614 PolarHBondContact O-OG1 3.31Å; F415-T614 VanDerWaalsContact O-OG1 3.08Å; F415-I782 HydrophobicContact CZ-CD1 4.42Å
416	T	96.5	Very high	95.8	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	11%	0.106	C	C	.	.	S	Bend	trans	-125.5	165.4	175.3	98.2	0	0	0	0	111.5	C418 D419 L420 I761	T416-C418 PolarHBondContact OG1-SG 3.02Å; T416-C418 VanDerWaalsContact OG1-SG 3.37Å; T416-D419 WeakPolarHBondContact CB-OD2 3.37Å; T416-D419 WeakPolarHBondContact CG2-OD2 3.35Å; T416-D419 PolarHBondContact OG1-N 2.8Å; T416-D419 PolarHBondContact OG1-OD1 3.21Å; T416-D419 PolarHBondContact OG1-OD2 3Å; T416-L420 WeakPolarHBondContact O-CB 3.45Å; T416-L420 PolarHBondContact O-N 2.84Å; T416-I761 HydrophobicContact CG2-CD1 4.45Å
417	H	96.2	Very high	95.4	Very high	9 Å²	9	22 Å²	22	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-82	-39.2	-174.4	-73	27	0	0	0	113.2	V421 L548 F551 V617 S618 C621	H417-V421 PolarHBondContact O-N 2.98Å; H417-L548 WeakPolarHBondContact ND1-CD2 3.47Å; H417-F551 HydrophobicContact CB-CD1 3.94Å; H417-F551 HydrophobicContact CB-CE1 3.51Å; H417-F551 HydrophobicContact CB-CE2 4.44Å; H417-F551 HydrophobicContact CB-CZ 3.79Å; H417-F551 AromaticContact CD2-CD1 3.79Å; H417-F551 AromaticContact CD2-CD2 3.56Å; H417-F551 AromaticContact CD2-CE1 3.98Å; H417-F551 AromaticContact CD2-CE2 3.7Å; H417-F551 AromaticContact CD2-CG 3.59Å; H417-F551 AromaticContact CD2-CZ 3.93Å; H417-F551 AromaticContact CG-CD1 3.85Å; H417-F551 AromaticContact CG-CE1 3.9Å; H417-F551 WeakPolarHBondContact O-CE1 3.46Å; H417-V617 HydrophobicContact CB-CG1 4.48Å; H417-S618 VanDerWaalsContact CE1-CB 3.5Å; H417-S618 WeakPolarHBondContact CE1-CB 3.34Å; H417-S618 PolarHBondContact CE1-OG 3.35Å; H417-S618 VanDerWaalsContact CE1-OG 3.31Å; H417-S618 VanDerWaalsContact NE2-CB 3.35Å; H417-S618 WeakPolarHBondContact NE2-CB 3.27Å; H417-S618 PolarHBondContact NE2-OG 3.12Å; H417-C621 HydrophobicContact CB-CB 3.52Å
418	C	95.3	Very high	95.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.9	-43.5	176.5	45.5	0	0	0	0	111.9	T416 L420 V421 Q422 I761	T416-C418 PolarHBondContact OG1-SG 3.02Å; T416-C418 VanDerWaalsContact OG1-SG 3.37Å; C418-L420 PolarHBondContact O-N 3.36Å; C418-V421 PolarHBondContact O-N 3.18Å; C418-Q422 PolarHBondContact O-N 3.48Å; C418-Q422 VanDerWaalsContact O-N 3.07Å; C418-I761 VanDerWaalsContact SG-CD1 3.5Å
419	D	95.2	Very high	94.6	Very high	24 Å²	24	22 Å²	22	13%	0.128	12%	0.121	C	C	.	.	H	α-helix	trans	-65.9	-35	-177.8	-45.4	-25	0	0	0	109.5	I414 T416 E423	I414-D419 HydrophobicContact CG2-CB 4.38Å; T416-D419 WeakPolarHBondContact CB-OD2 3.37Å; T416-D419 WeakPolarHBondContact CG2-OD2 3.35Å; T416-D419 PolarHBondContact OG1-N 2.8Å; T416-D419 PolarHBondContact OG1-OD1 3.21Å; T416-D419 PolarHBondContact OG1-OD2 3Å; D419-E423 WeakPolarHBondContact O-CB 3.36Å; D419-E423 WeakPolarHBondContact O-CG 3.3Å; D419-E423 PolarHBondContact O-N 3.37Å
420	L	96.6	Very high	94.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-49.2	174	-175.4	66.2	0	0	0	113.2	V395 I414 T416 C418 I424 F536 L548 F551 L552	V395-L420 HydrophobicContact CG1-CD1 4.19Å; I414-L420 HydrophobicContact CD1-CD1 4.15Å; I414-L420 HydrophobicContact CG2-CB 3.67Å; I414-L420 HydrophobicContact CG2-CD1 3.92Å; I414-L420 HydrophobicContact CG2-CG 4.41Å; T416-L420 WeakPolarHBondContact O-CB 3.45Å; T416-L420 PolarHBondContact O-N 2.84Å; C418-L420 PolarHBondContact O-N 3.36Å; L420-I424 HydrophobicContact CD1-CD1 4.36Å; L420-I424 HydrophobicContact CD1-CG1 3.66Å; L420-I424 HydrophobicContact CG-CG1 4.29Å; L420-I424 VanDerWaalsContact O-CB 3.22Å; L420-I424 WeakPolarHBondContact O-CB 3.3Å; L420-I424 WeakPolarHBondContact O-CG1 3.4Å; L420-I424 PolarHBondContact O-N 3.3Å; L420-F536 HydrophobicContact CD1-CE1 3.62Å; L420-F536 HydrophobicContact CD1-CZ 3.95Å; L420-F536 HydrophobicContact CD2-CE1 3.95Å; L420-F536 HydrophobicContact CD2-CZ 4.29Å; L420-F536 HydrophobicContact CG-CE1 4.44Å; L420-L548 HydrophobicContact CD2-CB 3.96Å; L420-L548 HydrophobicContact CD2-CD2 4.11Å; L420-L548 VanDerWaalsContact CD2-O 3.23Å; L420-L548 WeakPolarHBondContact CD2-O 3.47Å; L420-F551 HydrophobicContact CD2-CD1 4.36Å; L420-L552 HydrophobicContact CD2-CB 3.95Å
421	V	94.9	Very high	93.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.1	-48.3	-179.5	169.7	0	0	0	0	110.4	H417 C418 F425 F551 V555 A750 V753 V754	H417-V421 PolarHBondContact O-N 2.98Å; C418-V421 PolarHBondContact O-N 3.18Å; V421-F425 HydrophobicContact CG1-CD2 4.21Å; V421-F425 HydrophobicContact CG1-CE2 4.03Å; V421-F425 HydrophobicContact CG1-CZ 4.28Å; V421-F425 VanDerWaalsContact O-CB 3.27Å; V421-F425 WeakPolarHBondContact O-CB 3.33Å; V421-F425 WeakPolarHBondContact O-CD2 3.43Å; V421-F425 VanDerWaalsContact O-CG 3.31Å; V421-F425 WeakPolarHBondContact O-CG 3.16Å; V421-F425 PolarHBondContact O-N 2.92Å; V421-F425 VanDerWaalsContact O-N 3.09Å; V421-F551 HydrophobicContact CG2-CE1 3.86Å; V421-V555 HydrophobicContact CG2-CB 4.49Å; V421-V555 HydrophobicContact CG2-CG1 4.25Å; V421-V555 HydrophobicContact CG2-CG2 3.97Å; V421-A750 HydrophobicContact CG1-CB 3.55Å; V421-V753 HydrophobicContact CB-CG1 4.36Å; V421-V753 HydrophobicContact CG2-CG1 3.95Å; V421-V754 HydrophobicContact CB-CG2 4.27Å; V421-V754 HydrophobicContact CG1-CG2 4.13Å
422	Q	93.7	Very high	92.7	Very high	13 Å²	13	23 Å²	23	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-58.2	-56.6	176.8	176.9	-174.8	-47.9	0	0	112	C418 I424 F425 N426 L447 V754 H786	C418-Q422 PolarHBondContact O-N 3.48Å; C418-Q422 VanDerWaalsContact O-N 3.07Å; Q422-I424 VanDerWaalsContact C-N 3.35Å; Q422-I424 PolarHBondContact O-N 3.4Å; Q422-F425 PolarHBondContact O-N 3.1Å; Q422-N426 WeakPolarHBondContact O-CB 3.3Å; Q422-N426 PolarHBondContact O-N 3.08Å; Q422-N426 PolarHBondContact O-ND2 3.17Å; Q422-N426 PolarHBondContact O-OD1 3.22Å; Q422-L447 HydrophobicContact CB-CD2 4.38Å; Q422-V754 HydrophobicContact CB-CG2 4.08Å; Q422-H786 PolarHBondContact NE2-CE1 3.46Å; Q422-H786 PolarHBondContact NE2-ND1 2.97Å
423	E	93.7	Very high	91.7	Very high	19 Å²	19	23.3 Å²	23.3	9%	0.089	11%	0.113	C	C	.	.	H	α-helix	trans	-75.5	-22.7	-167.3	-65.6	-63.6	123.5	0	0	113.2	I414 D419 R427 H786	I414-E423 HydrophobicContact CD1-CB 3.76Å; D419-E423 WeakPolarHBondContact O-CB 3.36Å; D419-E423 WeakPolarHBondContact O-CG 3.3Å; D419-E423 PolarHBondContact O-N 3.37Å; E423-R427 PolarHBondContact O-N 2.96Å; E423-R427 PolarHBondContact O-NH1 3.01Å; E423-R427 IonicContact OE2-CZ 3.75Å; E423-R427 IonicContact OE2-NH1 2.67Å; E423-R427 PolarHBondContact OE2-NH1 3.1Å; E423-R427 IonicContact OE2-NH2 3.6Å; E423-R427 PolarHBondContact OE2-NH2 2.75Å; E423-H786 IonicContact OE1-CE1 3.21Å; E423-H786 PolarHBondContact OE1-CE1 2.8Å; E423-H786 IonicContact OE1-ND1 2.97Å; E423-H786 PolarHBondContact OE1-ND1 3.08Å
424	I	94.3	Very high	90.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-78.1	-47.3	169	-67.5	-66.9	0	0	0	111.1	V393 V395 L420 Q422 N426 R427 V428 V534 L552 F569	V393-I424 HydrophobicContact CG1-CD1 4.24Å; V395-I424 HydrophobicContact CG2-CD1 3.99Å; L420-I424 HydrophobicContact CD1-CD1 4.36Å; L420-I424 HydrophobicContact CD1-CG1 3.66Å; L420-I424 HydrophobicContact CG-CG1 4.29Å; L420-I424 VanDerWaalsContact O-CB 3.22Å; L420-I424 WeakPolarHBondContact O-CB 3.3Å; L420-I424 WeakPolarHBondContact O-CG1 3.4Å; L420-I424 PolarHBondContact O-N 3.3Å; Q422-I424 VanDerWaalsContact C-N 3.35Å; Q422-I424 PolarHBondContact O-N 3.4Å; I424-N426 PolarHBondContact O-N 2.99Å; I424-R427 PolarHBondContact O-N 3.47Å; I424-R427 VanDerWaalsContact O-N 3.12Å; I424-V428 HydrophobicContact CD1-CG2 4.17Å; I424-V428 HydrophobicContact CG2-CB 4.19Å; I424-V428 HydrophobicContact CG2-CG2 3.9Å; I424-V428 WeakPolarHBondContact O-CB 3.24Å; I424-V428 PolarHBondContact O-N 3.47Å; I424-V534 HydrophobicContact CD1-CG1 3.86Å; I424-L552 HydrophobicContact CG1-CD2 4.29Å; I424-L552 HydrophobicContact CG2-CD1 4.2Å; I424-L552 HydrophobicContact CG2-CD2 4.01Å; I424-F569 HydrophobicContact CG2-CD2 4.38Å; I424-F569 HydrophobicContact CG2-CE1 4.27Å; I424-F569 HydrophobicContact CG2-CE2 4.11Å; I424-F569 HydrophobicContact CG2-CZ 4.04Å
425	F	92	Very high	89.3	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62	-29.1	178.5	-77.3	-137.5	0	0	0	111.1	V421 Q422 L443 G444 L447 L552 V555 F569 L747 A750	V421-F425 HydrophobicContact CG1-CD2 4.21Å; V421-F425 HydrophobicContact CG1-CE2 4.03Å; V421-F425 HydrophobicContact CG1-CZ 4.28Å; V421-F425 VanDerWaalsContact O-CB 3.27Å; V421-F425 WeakPolarHBondContact O-CB 3.33Å; V421-F425 WeakPolarHBondContact O-CD2 3.43Å; V421-F425 VanDerWaalsContact O-CG 3.31Å; V421-F425 WeakPolarHBondContact O-CG 3.16Å; V421-F425 PolarHBondContact O-N 2.92Å; V421-F425 VanDerWaalsContact O-N 3.09Å; Q422-F425 PolarHBondContact O-N 3.1Å; F425-L443 HydrophobicContact CB-CB 4.11Å; F425-L443 HydrophobicContact CD1-CB 3.56Å; F425-L443 HydrophobicContact CD1-CD1 3.82Å; F425-L443 HydrophobicContact CD1-CG 4.36Å; F425-L443 HydrophobicContact CE1-CB 4.34Å; F425-L443 HydrophobicContact CE1-CD1 3.84Å; F425-L443 HydrophobicContact CG-CB 4.12Å; F425-L443 HydrophobicContact CG-CD1 4.46Å; F425-L443 HydrophobicContact CZ-CD1 4.5Å; F425-L443 PolarHBondContact O-N 2.93Å; F425-G444 WeakPolarHBondContact O-CA 3.48Å; F425-G444 PolarHBondContact O-N 3.15Å; F425-L447 HydrophobicContact CB-CD2 4.37Å; F425-L552 HydrophobicContact CE2-CD1 4.29Å; F425-V555 HydrophobicContact CZ-CG1 4.25Å; F425-F569 AromaticContact CD2-CE2 3.82Å; F425-F569 HydrophobicContact CD2-CE2 3.82Å; F425-F569 HydrophobicContact CD2-CZ 4.02Å; F425-F569 AromaticContact CE2-CE2 3.6Å; F425-F569 HydrophobicContact CE2-CE2 3.6Å; F425-F569 HydrophobicContact CE2-CZ 4.24Å; F425-F569 HydrophobicContact CZ-CE2 4.26Å; F425-L747 HydrophobicContact CD1-CD2 3.99Å; F425-L747 HydrophobicContact CE1-CD2 3.76Å; F425-A750 HydrophobicContact CD1-CB 4.27Å; F425-A750 HydrophobicContact CE1-CB 3.64Å; F425-A750 HydrophobicContact CZ-CB 3.99Å
426	N	90.7	Very high	88.1	Confident	57 Å²	57	33.5 Å²	33.5	31%	0.305	20%	0.198	S	C	.	.	H	α-helix	trans	-72.6	-38.6	173	-70.3	-4.9	0	0	0	114.5	Q422 I424 F442 G444	Q422-N426 WeakPolarHBondContact O-CB 3.3Å; Q422-N426 PolarHBondContact O-N 3.08Å; Q422-N426 PolarHBondContact O-ND2 3.17Å; Q422-N426 PolarHBondContact O-OD1 3.22Å; I424-N426 PolarHBondContact O-N 2.99Å; N426-F442 WeakPolarHBondContact O-CD1 3.39Å; N426-G444 WeakPolarHBondContact OD1-CA 3.48Å
427	R	89.9	Confident	86.5	Confident	71 Å²	71	39.2 Å²	39.2	27%	0.268	24%	0.238	S	C	.	.	H	α-helix	trans	-104.3	-22.6	-171.7	-76	-173.9	-163	70	1.7	115.6	E423 I424	E423-R427 PolarHBondContact O-N 2.96Å; E423-R427 PolarHBondContact O-NH1 3.01Å; E423-R427 IonicContact OE2-CZ 3.75Å; E423-R427 IonicContact OE2-NH1 2.67Å; E423-R427 PolarHBondContact OE2-NH1 3.1Å; E423-R427 IonicContact OE2-NH2 3.6Å; E423-R427 PolarHBondContact OE2-NH2 2.75Å; I424-R427 PolarHBondContact O-N 3.47Å; I424-R427 VanDerWaalsContact O-N 3.12Å
428	V	90.9	Very high	85.1	Confident	4 Å²	4	41 Å²	41	2%	0.024	26%	0.258	C	S	.	.	S	Bend	trans	-102.6	118.8	-175.8	-175.1	0	0	0	0	108.4	V393 I424 A430 F532 V534 F569	V393-V428 HydrophobicContact CG1-CG2 3.87Å; I424-V428 HydrophobicContact CD1-CG2 4.17Å; I424-V428 HydrophobicContact CG2-CB 4.19Å; I424-V428 HydrophobicContact CG2-CG2 3.9Å; I424-V428 WeakPolarHBondContact O-CB 3.24Å; I424-V428 PolarHBondContact O-N 3.47Å; V428-A430 PolarHBondContact O-N 3.4Å; V428-F532 HydrophobicContact CB-CD1 4.4Å; V428-F532 HydrophobicContact CB-CE1 4.36Å; V428-F532 HydrophobicContact CG1-CD1 3.68Å; V428-F532 HydrophobicContact CG1-CE1 4.13Å; V428-F532 HydrophobicContact CG1-CG 4.14Å; V428-F532 HydrophobicContact CG2-CD1 4.23Å; V428-F532 HydrophobicContact CG2-CE1 3.86Å; V428-V534 HydrophobicContact CG1-CG2 4.28Å; V428-V534 HydrophobicContact CG2-CG2 4Å; V428-F569 HydrophobicContact CB-CD1 4.08Å; V428-F569 HydrophobicContact CB-CE1 3.71Å; V428-F569 HydrophobicContact CG1-CD1 3.48Å; V428-F569 VanDerWaalsContact CG1-CD1 3.48Å; V428-F569 HydrophobicContact CG1-CE1 3.55Å
429	P	89.2	Confident	83.6	Confident	27 Å²	27	45.4 Å²	45.4	18%	0.175	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-64.7	120.6	173.2	27.8	-31.9	0	0	0	108.1	P440 F442 F532	P429-P440 HydrophobicContact CB-CB 3.79Å; P429-F442 HydrophobicContact CB-CE1 4.03Å; P429-F442 HydrophobicContact CB-CZ 4.1Å; P429-F442 HydrophobicContact CG-CE1 4.4Å; P429-F532 HydrophobicContact CG-CB 4.21Å; P429-F532 HydrophobicContact CG-CD2 3.58Å; P429-F532 HydrophobicContact CG-CE2 4.25Å; P429-F532 HydrophobicContact CG-CG 4.09Å
430	A	87.3	Confident	82.2	Confident	5 Å²	5	46.7 Å²	46.7	4%	0.041	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-70.3	139.5	179.5	0	0	0	0	0	110.1	V428 R441 L443 Y568 F569	V428-A430 PolarHBondContact O-N 3.4Å; A430-R441 PolarHBondContact N-O 3.41Å; A430-L443 HydrophobicContact CB-CD1 3.69Å; A430-L443 HydrophobicContact CB-CD2 4.08Å; A430-L443 HydrophobicContact CB-CG 3.62Å; A430-Y568 HydrophobicContact CB-CD1 3.76Å; A430-Y568 HydrophobicContact CB-CG 4.05Å; A430-F569 HydrophobicContact CB-CE1 4.28Å; A430-F569 HydrophobicContact CB-CZ 4.47Å
431	Q	83.9	Confident	81.3	Confident	85 Å²	85	54.5 Å²	54.5	40%	0.397	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-61.2	152.8	170.3	-64.9	-161.6	1.5	0	0	110.5	F566 Y568 P570	Q431-F566 HydrophobicContact CB-CE2 4.47Å; Q431-F566 WeakPolarHBondContact O-CZ 3.45Å; Q431-Y568 PolarHBondContact N-O 2.94Å; Q431-Y568 VanDerWaalsContact N-O 3.13Å; Q431-P570 VanDerWaalsContact CD-CG 3.49Å; Q431-P570 HydrophobicContact CG-CG 4.45Å; Q431-P570 VanDerWaalsContact NE2-CG 3.34Å
432	R	78.6	Confident	80.6	Confident	78 Å²	78	59.5 Å²	59.5	29%	0.294	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-99.3	141.2	179.2	-109.9	179.4	-67.7	93.5	12.2	109.8	T436 G438 P439	R432-T436 VanDerWaalsContact CB-OG1 3.31Å; R432-T436 WeakPolarHBondContact CB-OG1 3.47Å; R432-T436 WeakPolarHBondContact CD-O 3.31Å; R432-T436 WeakPolarHBondContact CG-OG1 3.27Å; R432-T436 PolarHBondContact NH1-O 3.25Å; R432-G438 PolarHBondContact NE-O 3.17Å; R432-G438 PolarHBondContact NH1-O 3.32Å; R432-G438 PolarHBondContact NH2-O 3.23Å; R432-P439 PolarHBondContact NE-O 3.15Å; R432-P439 VanDerWaalsContact NH2-C 3.34Å
433	P	76.2	Confident	80.2	Confident	35 Å²	35	59.5 Å²	59.5	23%	0.227	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-55.1	145.2	173	-26.1	34.9	0	0	0	111.7	G435 T436 F566	P433-G435 PolarHBondContact O-N 3.29Å; P433-T436 HydrophobicContact CB-CG2 4.31Å; P433-T436 PolarHBondContact O-N 2.87Å; P433-T436 VanDerWaalsContact O-N 3.09Å; P433-T436 PolarHBondContact O-OG1 3.44Å; P433-F566 HydrophobicContact CB-CE2 4.46Å; P433-F566 HydrophobicContact CB-CZ 4.47Å; P433-F566 HydrophobicContact CG-CE1 3.96Å; P433-F566 HydrophobicContact CG-CE2 4.32Å; P433-F566 HydrophobicContact CG-CZ 3.85Å
434	P	72	Confident	79.7	Confident	123 Å²	123	58.8 Å²	58.8	80%	0.799	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	137.7	173.4	-27.7	35.6	0	0	0	111.9
435	G	71.7	Confident	79.3	Confident	87 Å²	87	64.8 Å²	64.8	90%	0.897	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-8.4	-175.6	0	0	0	0	0	116	P433	P433-G435 PolarHBondContact O-N 3.29Å
436	T	71.8	Confident	78.9	Confident	65 Å²	65	67 Å²	67	40%	0.399	39%	0.386	S	S	.	.			trans	-94.4	107.6	-179.9	62.4	0	0	0	0	113.6	R432 P433	R432-T436 VanDerWaalsContact CB-OG1 3.31Å; R432-T436 WeakPolarHBondContact CB-OG1 3.47Å; R432-T436 WeakPolarHBondContact CD-O 3.31Å; R432-T436 WeakPolarHBondContact CG-OG1 3.27Å; R432-T436 PolarHBondContact NH1-O 3.25Å; P433-T436 HydrophobicContact CB-CG2 4.31Å; P433-T436 PolarHBondContact O-N 2.87Å; P433-T436 VanDerWaalsContact O-N 3.09Å; P433-T436 PolarHBondContact O-OG1 3.44Å
437	S	63.2	Low	78.8	Confident	121 Å²	121	64.3 Å²	64.3	85%	0.846	37%	0.372	S	S	*	.			trans	-77.3	146.5	173.7	53.8	0	0	0	0	112.9
438	G	65.9	Low	78.8	Confident	46 Å²	46	63.4 Å²	63.4	47%	0.474	38%	0.379	S	S	.	.	S	Bend	trans	142.1	-177.3	177.3	0	0	0	0	0	112.2	R432	R432-G438 PolarHBondContact NE-O 3.17Å; R432-G438 PolarHBondContact NH1-O 3.32Å; R432-G438 PolarHBondContact NH2-O 3.23Å
439	P	64.1	Low	78.6	Confident	94 Å²	94	70 Å²	70	61%	0.61	40%	0.404	S	S	*	.	S	Bend	trans	-72.8	158.3	170.7	31.1	-34.8	0	0	0	111.5	R432	R432-P439 PolarHBondContact NE-O 3.15Å; R432-P439 VanDerWaalsContact NH2-C 3.34Å
440	P	66.5	Low	78.6	Confident	50 Å²	50	72.4 Å²	72.4	33%	0.325	41%	0.409	S	S	.	.			trans	-57.1	140.7	166.4	-20.6	33	0	0	0	110.8	P429 D529	P429-P440 HydrophobicContact CB-CB 3.79Å; P440-D529 WeakPolarHBondContact CG-OD2 3.41Å
441	R	76.2	Confident	78.6	Confident	164 Å²	164	73.1 Å²	73.1	62%	0.619	41%	0.412	S	S	*	.	B	Isolated β-bridge	trans	-108.4	132.3	-176	-67	-169.6	179.6	-144.2	2.4	111.4	A430 L443	A430-R441 PolarHBondContact N-O 3.41Å; R441-L443 PolarHBondContact O-N 3.35Å
442	F	80.9	Confident	78.8	Confident	105 Å²	105	72.8 Å²	72.8	46%	0.461	42%	0.424	S	S	.	.			trans	-82.8	107.1	166.8	-65.7	-82.3	0	0	0	108.7	N426 P429 G444 E445	N426-F442 WeakPolarHBondContact O-CD1 3.39Å; P429-F442 HydrophobicContact CB-CE1 4.03Å; P429-F442 HydrophobicContact CB-CZ 4.1Å; P429-F442 HydrophobicContact CG-CE1 4.4Å; F442-G444 PolarHBondContact O-N 3.4Å; F442-G444 VanDerWaalsContact O-N 3.09Å; F442-E445 PolarHBondContact O-N 3.37Å
443	L	84.4	Confident	78.7	Confident	14 Å²	14	74.4 Å²	74.4	7%	0.073	44%	0.443	C	S	.	.	H	α-helix	trans	-61.3	-19.1	179.1	-58.5	179.4	0	0	0	112.5	F425 A430 R441 E445 D446 L447 Y568 F569 L747	F425-L443 HydrophobicContact CB-CB 4.11Å; F425-L443 HydrophobicContact CD1-CB 3.56Å; F425-L443 HydrophobicContact CD1-CD1 3.82Å; F425-L443 HydrophobicContact CD1-CG 4.36Å; F425-L443 HydrophobicContact CE1-CB 4.34Å; F425-L443 HydrophobicContact CE1-CD1 3.84Å; F425-L443 HydrophobicContact CG-CB 4.12Å; F425-L443 HydrophobicContact CG-CD1 4.46Å; F425-L443 HydrophobicContact CZ-CD1 4.5Å; F425-L443 PolarHBondContact O-N 2.93Å; A430-L443 HydrophobicContact CB-CD1 3.69Å; A430-L443 HydrophobicContact CB-CD2 4.08Å; A430-L443 HydrophobicContact CB-CG 3.62Å; R441-L443 PolarHBondContact O-N 3.35Å; L443-E445 PolarHBondContact O-N 3.49Å; L443-D446 PolarHBondContact O-N 3.43Å; L443-L447 WeakPolarHBondContact O-CB 3.34Å; L443-L447 PolarHBondContact O-N 2.92Å; L443-Y568 HydrophobicContact CD1-CD1 4.13Å; L443-Y568 HydrophobicContact CD1-CD2 3.63Å; L443-Y568 HydrophobicContact CD1-CE1 4.28Å; L443-Y568 HydrophobicContact CD1-CE2 3.81Å; L443-Y568 HydrophobicContact CD1-CG 3.8Å; L443-F569 HydrophobicContact CD1-CZ 4.39Å; L443-L747 HydrophobicContact CB-CD2 3.94Å; L443-L747 HydrophobicContact CD1-CD2 4.11Å; L443-L747 HydrophobicContact CD2-CD2 4.28Å; L443-L747 HydrophobicContact CG-CD2 4.32Å
444	G	83.6	Confident	77.7	Confident	3 Å²	3	76.5 Å²	76.5	3%	0.031	46%	0.455	C	S	.	.	H	α-helix	trans	-62	-31.6	179.4	0	0	0	0	0	115.4	F425 N426 F442 A448	F425-G444 WeakPolarHBondContact O-CA 3.48Å; F425-G444 PolarHBondContact O-N 3.15Å; N426-G444 WeakPolarHBondContact OD1-CA 3.48Å; F442-G444 PolarHBondContact O-N 3.4Å; F442-G444 VanDerWaalsContact O-N 3.09Å; G444-A448 WeakPolarHBondContact O-CB 3.17Å; G444-A448 PolarHBondContact O-N 2.83Å
445	E	85.5	Confident	76.6	Confident	126 Å²	126	79.6 Å²	79.6	59%	0.589	46%	0.459	S	S	*	.	H	α-helix	trans	-69.4	-46.3	176.6	-168.9	-173.7	152.8	0	0	110.7	F442 L443 L447 A448 R449	F442-E445 PolarHBondContact O-N 3.37Å; L443-E445 PolarHBondContact O-N 3.49Å; E445-L447 VanDerWaalsContact C-N 3.35Å; E445-L447 PolarHBondContact O-N 2.82Å; E445-A448 PolarHBondContact O-N 3.18Å; E445-R449 WeakPolarHBondContact O-CG 3.49Å; E445-R449 PolarHBondContact O-N 2.94Å; E445-R449 IonicContact OE1-CZ 3.91Å; E445-R449 IonicContact OE1-NH1 3.96Å
446	D	84.6	Confident	75	Confident	47 Å²	47	86.9 Å²	86.9	25%	0.251	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-40.6	175.4	-68.8	-29.9	0	0	0	111.7	L443 R449 R450 L747	L443-D446 PolarHBondContact O-N 3.43Å; D446-R449 IonicContact OD1-CZ 3.61Å; D446-R449 IonicContact OD1-NE 3.74Å; D446-R449 IonicContact OD1-NH2 2.68Å; D446-R449 PolarHBondContact OD1-NH2 3.12Å; D446-R450 WeakPolarHBondContact O-CB 2.99Å; D446-R450 VanDerWaalsContact O-CG 3.29Å; D446-R450 WeakPolarHBondContact O-CG 3.18Å; D446-R450 PolarHBondContact O-N 3.04Å; D446-L747 HydrophobicContact CB-CD1 3.33Å
447	L	88.5	Confident	73.1	Confident	1 Å²	1	92.6 Å²	92.6	1%	0.005	48%	0.481	C	S	.	.	H	α-helix	trans	-62	-45	172.9	-172.7	84.2	0	0	0	111.6	Q422 F425 L443 E445 R450 L451 A750 E751	Q422-L447 HydrophobicContact CB-CD2 4.38Å; F425-L447 HydrophobicContact CB-CD2 4.37Å; L443-L447 WeakPolarHBondContact O-CB 3.34Å; L443-L447 PolarHBondContact O-N 2.92Å; E445-L447 VanDerWaalsContact C-N 3.35Å; E445-L447 PolarHBondContact O-N 2.82Å; L447-R450 PolarHBondContact O-N 3.42Å; L447-L451 HydrophobicContact CD2-CD1 4.18Å; L447-L451 HydrophobicContact CG-CD1 3.89Å; L447-L451 HydrophobicContact CG-CG 4.47Å; L447-L451 WeakPolarHBondContact O-CB 3.43Å; L447-L451 WeakPolarHBondContact O-CG 3.46Å; L447-L451 PolarHBondContact O-N 2.92Å; L447-A750 HydrophobicContact CD1-CB 3.7Å; L447-E751 HydrophobicContact CD1-CB 4.33Å
448	A	89.2	Confident	71.7	Confident	52 Å²	52	91.4 Å²	91.4	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-66.2	-42.8	-180	0	0	0	0	0	111.6	G444 E445 L451 A452	G444-A448 WeakPolarHBondContact O-CB 3.17Å; G444-A448 PolarHBondContact O-N 2.83Å; E445-A448 PolarHBondContact O-N 3.18Å; A448-L451 PolarHBondContact O-N 2.79Å; A448-A452 WeakPolarHBondContact O-CB 3.44Å; A448-A452 PolarHBondContact O-N 3.47Å
449	R	88.1	Confident	70.4	Confident	141 Å²	141	96.7 Å²	96.7	53%	0.532	49%	0.488	S	S	.	.	H	α-helix	trans	-57.1	-52.1	172.7	-72.7	-168.5	-70.8	-165.2	-0.7	110.8	E445 D446 L451 A452 T453	E445-R449 WeakPolarHBondContact O-CG 3.49Å; E445-R449 PolarHBondContact O-N 2.94Å; E445-R449 IonicContact OE1-CZ 3.91Å; E445-R449 IonicContact OE1-NH1 3.96Å; D446-R449 IonicContact OD1-CZ 3.61Å; D446-R449 IonicContact OD1-NE 3.74Å; D446-R449 IonicContact OD1-NH2 2.68Å; D446-R449 PolarHBondContact OD1-NH2 3.12Å; R449-L451 PolarHBondContact O-N 3.24Å; R449-A452 WeakPolarHBondContact O-CB 3.31Å; R449-A452 PolarHBondContact O-N 3.02Å; R449-A452 VanDerWaalsContact O-N 3.07Å; R449-T453 PolarHBondContact O-N 3.49Å; R449-T453 PolarHBondContact O-OG1 3.38Å
450	R	87.9	Confident	68.7	Low	79 Å²	79	98.2 Å²	98.2	30%	0.298	50%	0.501	S	S	.	.	H	α-helix	trans	-55.1	-47.9	175.4	-79.2	168.7	164.3	-79.3	-14.3	113.1	D446 L447 A452 T453 S745 E751 R755	D446-R450 WeakPolarHBondContact O-CB 2.99Å; D446-R450 VanDerWaalsContact O-CG 3.29Å; D446-R450 WeakPolarHBondContact O-CG 3.18Å; D446-R450 PolarHBondContact O-N 3.04Å; L447-R450 PolarHBondContact O-N 3.42Å; R450-A452 PolarHBondContact O-N 3.09Å; R450-T453 PolarHBondContact O-N 2.83Å; R450-S745 VanDerWaalsContact NH2-CB 3.3Å; R450-S745 PolarHBondContact NH2-OG 2.95Å; R450-S745 VanDerWaalsContact NH2-OG 3.07Å; R450-E751 HydrophobicContact CB-CG 4.33Å; R450-E751 WeakPolarHBondContact CB-OE2 3.34Å; R450-E751 VanDerWaalsContact CD-OE2 3.29Å; R450-E751 WeakPolarHBondContact CD-OE2 3.41Å; R450-E751 IonicContact CZ-OE2 2.74Å; R450-E751 IonicContact NE-OE2 2.71Å; R450-E751 IonicContact NH1-OE2 3.91Å; R450-E751 PolarHBondContact NH1-OE2 2.96Å; R450-R755 PolarHBondContact O-NH2 3.43Å
451	L	88	Confident	67.4	Low	19 Å²	19	99.2 Å²	99.2	10%	0.099	51%	0.513	C	S	.	.	H	α-helix	trans	-63.9	-27.8	178.1	-72.5	169.3	0	0	0	112.9	L447 A448 R449 T454 E751 V754 R755	L447-L451 HydrophobicContact CD2-CD1 4.18Å; L447-L451 HydrophobicContact CG-CD1 3.89Å; L447-L451 HydrophobicContact CG-CG 4.47Å; L447-L451 WeakPolarHBondContact O-CB 3.43Å; L447-L451 WeakPolarHBondContact O-CG 3.46Å; L447-L451 PolarHBondContact O-N 2.92Å; A448-L451 PolarHBondContact O-N 2.79Å; R449-L451 PolarHBondContact O-N 3.24Å; L451-T454 PolarHBondContact O-OG1 2.88Å; L451-E751 HydrophobicContact CD2-CG 4.4Å; L451-V754 HydrophobicContact CD1-CB 4.27Å; L451-V754 HydrophobicContact CD1-CG1 3.67Å; L451-V754 HydrophobicContact CD2-CB 4.15Å; L451-V754 HydrophobicContact CD2-CG1 3.86Å; L451-V754 HydrophobicContact CG-CG1 4.45Å; L451-R755 HydrophobicContact CD2-CG 3.68Å
452	A	87.1	Confident	65.4	Low	78 Å²	78	96.6 Å²	96.6	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-81.1	-30.7	175	0	0	0	0	0	113.6	A448 R449 R450 T454	A448-A452 WeakPolarHBondContact O-CB 3.44Å; A448-A452 PolarHBondContact O-N 3.47Å; R449-A452 WeakPolarHBondContact O-CB 3.31Å; R449-A452 PolarHBondContact O-N 3.02Å; R449-A452 VanDerWaalsContact O-N 3.07Å; R450-A452 PolarHBondContact O-N 3.09Å; A452-T454 PolarHBondContact O-N 3.37Å
453	T	77.3	Confident	63.2	Low	112 Å²	112	97.7 Å²	97.7	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-58.5	-22	-178.9	-49.1	0	0	0	0	113.7	R449 R450 Q455	R449-T453 PolarHBondContact O-N 3.49Å; R449-T453 PolarHBondContact O-OG1 3.38Å; R450-T453 PolarHBondContact O-N 2.83Å; T453-Q455 VanDerWaalsContact C-N 3.29Å; T453-Q455 PolarHBondContact O-N 3.43Å
454	T	56	Low	61	Low	80 Å²	80	104.9 Å²	104.9	49%	0.491	57%	0.57	S	S	.	*			trans	-79.6	61.3	179.6	40.9	0	0	0	0	115.1	L451 A452 R755	L451-T454 PolarHBondContact O-OG1 2.88Å; A452-T454 PolarHBondContact O-N 3.37Å; T454-R755 VanDerWaalsContact CG2-CZ 3.44Å; T454-R755 VanDerWaalsContact CG2-NH2 3.28Å; T454-R755 PolarHBondContact OG1-NE 3.09Å; T454-R755 PolarHBondContact OG1-NH2 3.38Å
455	Q	48.7	Very low	58.8	Low	188 Å²	188	112.5 Å²	112.5	88%	0.879	61%	0.609	S	S	*	*			trans	-156	91.1	144.6	-83.3	-145.8	-37.2	0	0	111.6	T453	T453-Q455 VanDerWaalsContact C-N 3.29Å; T453-Q455 PolarHBondContact O-N 3.43Å
456	R	37.4	Very low	56.5	Low	240 Å²	240	114 Å²	114	91%	0.906	62%	0.62	S	S	*	*			trans	-151.2	78.9	149.2	-155.8	177.2	-164.1	-172	4.5	110.4
457	E	33	Very low	54.4	Low	184 Å²	184	116.6 Å²	116.6	86%	0.86	64%	0.641	S	S	*	*			trans	-66.6	127	157.1	-160.3	168.8	-139.8	0	0	106.8
458	P	32.3	Very low	52	Low	97 Å²	97	123 Å²	123	63%	0.63	68%	0.675	S	S	*	*			trans	-72.5	-178.1	164.8	32.6	-33.3	0	0	0	109.7
459	L	38.2	Very low	50.2	Low	157 Å²	157	127.6 Å²	127.6	82%	0.822	69%	0.692	S	S	*	*			trans	74.3	47.3	175	-44.1	-177.3	0	0	0	116.1	A461	L459-A461 PolarHBondContact O-N 2.81Å
460	S	29.3	Very low	48.1	Very low	126 Å²	126	129.2 Å²	129.2	88%	0.881	71%	0.706	S	S	*	*				-64.3	83.5	129.7	-61.3	0	0	0	0	108.3
461	A	39.4	Very low	46.1	Very low	71 Å²	71	131.8 Å²	131.8	59%	0.587	73%	0.726	S	S	*	*			trans	-81.7	121	170.3	0	0	0	0	0	108.6	L459 C463	L459-A461 PolarHBondContact O-N 2.81Å; A461-C463 PolarHBondContact O-N 3.4Å
462	P	34.2	Very low	44.2	Very low	108 Å²	108	138.3 Å²	138.3	70%	0.701	76%	0.756	S	S	*	*			trans	-66.7	124.4	176.5	-20	33.2	0	0	0	110.7	E464	P462-E464 HydrophobicContact CB-CG 4.38Å; P462-E464 PolarHBondContact O-N 3.38Å; P462-E464 VanDerWaalsContact O-N 3.17Å
463	C	34.1	Very low	42.1	Very low	129 Å²	129	141.5 Å²	141.5	87%	0.872	76%	0.762	S	S	*	*			trans	-84.2	70.8	163.3	-66.1	0	0	0	0	109.1	A461	A461-C463 PolarHBondContact O-N 3.4Å
464	E	38.1	Very low	40.6	Very low	165 Å²	165	144.9 Å²	144.9	77%	0.771	77%	0.77	S	S	*	*			trans	-67.4	132.4	163	-71.7	-57.9	152.8	0	0	108.9	P462 I466	P462-E464 HydrophobicContact CB-CG 4.38Å; P462-E464 PolarHBondContact O-N 3.38Å; P462-E464 VanDerWaalsContact O-N 3.17Å; E464-I466 PolarHBondContact O-N 2.98Å
465	L	38.8	Very low	39.6	Very low	162 Å²	162	150.4 Å²	150.4	85%	0.848	79%	0.788	S	S	*	*			trans	-82.8	106	178.8	-81.9	160.6	0	0	0	108.8	S467	L465-S467 PolarHBondContact O-N 3.25Å; L465-S467 VanDerWaalsContact O-N 3.13Å
466	I	36.5	Very low	39.4	Very low	159 Å²	159	146.4 Å²	146.4	82%	0.815	78%	0.778	S	S	*	*			trans	-71.2	103.4	160.2	-57.4	175.2	0	0	0	106.6	E464	E464-I466 PolarHBondContact O-N 2.98Å
467	S	40.9	Very low	39.3	Very low	100 Å²	100	142 Å²	142	70%	0.699	77%	0.768	S	S	*	*			trans	-92.5	148.9	152.8	55.1	0	0	0	0	108.8	L465	L465-S467 PolarHBondContact O-N 3.25Å; L465-S467 VanDerWaalsContact O-N 3.13Å
468	D	38.6	Very low	39.3	Very low	137 Å²	137	138.9 Å²	138.9	73%	0.733	76%	0.757	S	S	*	*			trans	-74.6	-167.4	-172.9	-47.6	-94.3	0	0	0	113.6
469	D	50.7	Low	39.4	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	76%	0.758	S	S	*	*			trans	99.6	80.4	163.8	-51.3	-19.3	0	0	0	118.7
470	E	44.8	Very low	39.2	Very low	175 Å²	175	137.6 Å²	137.6	82%	0.818	75%	0.754	S	S	*	*				66.2	142	124.2	-62.8	-170.6	153.9	0	0	124.1
471	D	44.6	Very low	39.6	Very low	134 Å²	134	137 Å²	137	72%	0.717	75%	0.75	S	S	*	*			trans	79.4	113.3	145.5	-67.6	5.6	0	0	0	125.2
472	E	47.8	Very low	39.7	Very low	156 Å²	156	141.2 Å²	141.2	73%	0.729	76%	0.758	S	S	*	*			trans	72.5	126.3	132.2	-51.3	-59.7	64.7	0	0	125.1
473	D	44.3	Very low	40	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	76%	0.755	S	S	*	*				97.1	149.6	127.8	-88.8	-27.9	0	0	0	126.1
474	E	45.2	Very low	40.3	Very low	183 Å²	183	141 Å²	141	86%	0.855	75%	0.749	S	S	*	*			trans	60.4	79.5	165	-65.8	-165	122	0	0	122.1
475	F	35.8	Very low	40.4	Very low	195 Å²	195	140.4 Å²	140.4	86%	0.855	75%	0.751	S	S	*	*				-55.9	178	125.3	-97.6	-95.3	0	0	0	112
476	P	43.2	Very low	40.5	Very low	105 Å²	105	137.3 Å²	137.3	68%	0.682	74%	0.743	S	S	*	*			cis	-130.4	-146.6	0.3	37.8	-14.3	0	0	0	111.1
477	E	36.4	Very low	40.8	Very low	147 Å²	147	136.8 Å²	136.8	69%	0.687	74%	0.742	S	S	*	*			cis	-159.8	167.6	-9.8	-145.7	-170	105.7	0	0	110.3
478	N	31.3	Very low	40.5	Very low	119 Å²	119	140.5 Å²	140.5	64%	0.636	75%	0.753	S	S	*	*			trans	51.8	167.3	142.9	76.8	31.4	0	0	0	122.2
479	T	35.6	Very low	40.3	Very low	106 Å²	106	138.9 Å²	138.9	65%	0.65	76%	0.758	S	S	*	*			cis	-146.1	149.4	2.1	-26.1	0	0	0	0	112.4
480	T	32.9	Very low	39.4	Very low	120 Å²	120	142.1 Å²	142.1	74%	0.736	76%	0.761	S	S	*	*			trans	10.3	129.1	155.4	55.9	0	0	0	0	122.3
481	S	38.9	Very low	39.2	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	76%	0.76	S	S	*	*				162.7	154.9	120.6	47.9	0	0	0	0	113.8
482	E	40.8	Very low	38.6	Very low	160 Å²	160	138.7 Å²	138.7	75%	0.748	76%	0.762	S	S	*	*			cis	-156	168.3	-26.7	-107.8	-63.7	42.3	0	0	112.5
483	I	40.8	Very low	38.5	Very low	127 Å²	127	139.4 Å²	139.4	65%	0.651	77%	0.771	S	S	*	*			trans	-19.9	127.9	171.1	-64.6	151.7	0	0	0	120.6
484	S	39.6	Very low	38.2	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	77%	0.773	S	S	*	*				164.9	126.7	120.3	39	0	0	0	0	109.7
485	D	40.3	Very low	37.8	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	76%	0.761	S	S	*	*				56.6	123.8	63.1	-71.1	-30.3	0	0	0	113.8
486	S	42	Very low	38	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	76%	0.764	S	S	*	*			cis	-154.9	172.9	-3.9	56.3	0	0	0	0	110.5
487	D	42	Very low	37.7	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	77%	0.765	S	S	*	*			trans	156.2	115.9	131.6	-79.8	2.1	0	0	0	113.1
488	L	35.1	Very low	37.7	Very low	178 Å²	178	136.8 Å²	136.8	93%	0.932	76%	0.762	S	S	*	*			trans	-111.2	131.6	166.7	-71.7	173.2	0	0	0	108.7
489	A	35	Very low	38.1	Very low	103 Å²	103	138 Å²	138	85%	0.851	76%	0.761	S	S	*	*			trans	-129.9	108.7	171.9	0	0	0	0	0	110.8
490	Y	31	Very low	38.2	Very low	214 Å²	214	140 Å²	140	84%	0.839	77%	0.768	S	S	*	*			trans	-70.7	144.5	159.6	-92.5	-110.8	0	0	0	109.2
491	A	40.8	Very low	38.6	Very low	97 Å²	97	140.6 Å²	140.6	80%	0.802	77%	0.765	S	S	*	*			trans	-119.6	89.8	166.3	0	0	0	0	0	109.4
492	N	31.6	Very low	38.6	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	76%	0.762	S	S	*	*			trans	-92	132.9	156.3	-62.8	-32.9	0	0	0	106.6
493	D	45.3	Very low	38.5	Very low	170 Å²	170	142.7 Å²	142.7	91%	0.909	77%	0.767	S	S	*	*			trans	-132.2	136.3	164.5	-99.4	-44.4	0	0	0	108.9
494	E	38.4	Very low	38.3	Very low	176 Å²	176	144.7 Å²	144.7	82%	0.822	78%	0.779	S	S	*	*			trans	-139.7	163.5	-172.8	-157.3	-164	-148	0	0	110.1
495	V	37.5	Very low	38.2	Very low	100 Å²	100	145.2 Å²	145.2	61%	0.606	78%	0.783	S	S	*	*			trans	67	103.6	166.3	-166	0	0	0	0	116.9	L497	V495-L497 HydrophobicContact CG1-CB 4.21Å
496	I	39.5	Very low	38	Very low	179 Å²	179	143.2 Å²	143.2	92%	0.918	78%	0.778	S	S	*	*				-121.7	133.4	123.8	-64.5	-174.8	0	0	0	107.9
497	L	37	Very low	37.8	Very low	136 Å²	136	148.3 Å²	148.3	71%	0.712	79%	0.788	S	S	*	*			trans	-114.8	139.9	-172.8	-171	80	0	0	0	109.6	V495	V495-L497 HydrophobicContact CG1-CB 4.21Å
498	E	37.3	Very low	37.7	Very low	130 Å²	130	146.4 Å²	146.4	61%	0.607	79%	0.786	S	S	*	*				153.9	130.3	124.3	-79.5	-155.1	153.1	0	0	116
499	K	38.7	Very low	37.9	Very low	144 Å²	144	145.9 Å²	145.9	63%	0.626	78%	0.779	S	S	*	*			trans	52.5	106.1	139.1	-58.8	167.7	-169.4	152.8	0	120.1
500	N	37.4	Very low	38.1	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	77%	0.774	S	S	*	*				-173.7	109.9	106.6	-87	-29.5	0	0	0	109.1
501	I	42	Very low	38.2	Very low	132 Å²	132	142.4 Å²	142.4	68%	0.677	77%	0.767	S	S	*	*				89.9	103.5	74.1	-77.5	178	0	0	0	113
502	H	38.2	Very low	38.4	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.727	77%	0.768	S	S	*	*			trans	59.6	110.9	149.3	-66.1	55.4	0	0	0	120.1
503	N	38.2	Very low	38.7	Very low	161 Å²	161	142.3 Å²	142.3	86%	0.861	76%	0.758	S	S	*	*				-173.2	106.6	100.7	-90.7	-26.9	0	0	0	111.5
504	D	37.7	Very low	38.4	Very low	169 Å²	169	143.3 Å²	143.3	90%	0.904	75%	0.751	S	S	*	*			trans	-88.8	138.9	170.5	-72.7	-66.4	0	0	0	111.4
505	S	37.1	Very low	38.4	Very low	117 Å²	117	140.5 Å²	140.5	82%	0.818	75%	0.746	S	S	*	*			trans	-150.2	118.1	166.4	-173.4	0	0	0	0	111
506	P	37.2	Very low	38.6	Very low	110 Å²	110	140.9 Å²	140.9	71%	0.714	75%	0.753	S	S	*	*			trans	-97.8	166.5	-175.8	37.9	-35.9	0	0	0	114.1
507	K	36.1	Very low	38.5	Very low	204 Å²	204	138 Å²	138	89%	0.887	75%	0.748	S	S	*	*			trans	78.2	112.5	166.4	-54.6	179.7	178.5	-178.7	0	119.3
508	S	41.2	Very low	38.4	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	75%	0.746	S	S	*	*			trans	-167.9	109.5	130.6	52.1	0	0	0	0	106.7
509	E	38.5	Very low	38.6	Very low	168 Å²	168	137.2 Å²	137.2	79%	0.785	76%	0.763	S	S	*	*				43	109.3	90.5	-65.3	-54	148.8	0	0	113.5	D511	E509-D511 PolarHBondContact O-N 2.79Å
510	P	39.3	Very low	38.5	Very low	114 Å²	114	135 Å²	135	74%	0.74	77%	0.766	S	S	*	*			trans	-78.7	86.7	177.4	32.8	-32.9	0	0	0	110.1	L512	P510-L512 PolarHBondContact O-N 2.52Å
511	D	33.3	Very low	38.3	Very low	129 Å²	129	135.1 Å²	135.1	69%	0.69	77%	0.767	S	S	*	*			trans	-54	134.8	-176	-175.5	35.9	0	0	0	113.1	E509 S513	E509-D511 PolarHBondContact O-N 2.79Å; D511-S513 PolarHBondContact O-N 2.9Å; D511-S513 PolarHBondContact OD2-OG 3.27Å
512	L	44	Very low	38.3	Very low	158 Å²	158	137.5 Å²	137.5	83%	0.827	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	40.1	-166.5	-69.6	175.1	0	0	0	113	P510	P510-L512 PolarHBondContact O-N 2.52Å
513	S	39.8	Very low	38.1	Very low	78 Å²	78	133.8 Å²	133.8	55%	0.545	77%	0.771	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.5	-11.8	-173	47.9	0	0	0	0	114.8	D511 V515	D511-S513 PolarHBondContact O-N 2.9Å; D511-S513 PolarHBondContact OD2-OG 3.27Å; S513-V515 PolarHBondContact O-N 2.8Å
514	Y	37.4	Very low	37.8	Very low	191 Å²	191	134.6 Å²	134.6	75%	0.749	77%	0.769	S	S	*	*			trans	-70.5	6.6	-179.4	-160	-97.7	0	0	0	115
515	V	40	Very low	37.5	Very low	118 Å²	118	132.3 Å²	132.3	72%	0.715	77%	0.766	S	S	*	*	S	Bend	trans	-104.7	36.1	-171.7	-65.1	0	0	0	0	113.9	S513	S513-V515 PolarHBondContact O-N 2.8Å
516	S	40.6	Very low	37.6	Very low	108 Å²	108	130.8 Å²	130.8	76%	0.755	76%	0.755	S	S	*	*	S	Bend	trans	-147.7	-14.7	177.6	-72.8	0	0	0	0	117.7
517	S	38.1	Very low	38	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	77%	0.768	S	S	*	*			trans	-116.3	94.3	-171.4	-57.5	0	0	0	0	112.6
518	G	34.4	Very low	39.2	Very low	65 Å²	65	129.8 Å²	129.8	67%	0.67	75%	0.75	S	S	*	*			trans	-167.8	-1.5	179.1	0	0	0	0	0	117.7	S520	G518-S520 VanDerWaalsContact C-N 3.27Å; G518-S520 PolarHBondContact O-N 2.91Å
519	L	42.3	Very low	40.7	Very low	186 Å²	186	129.9 Å²	129.9	97%	0.974	74%	0.743	S	S	*	*	S	Bend	trans	-88.8	36	-178.4	-95.3	73.8	0	0	0	113.8
520	S	35.5	Very low	42.9	Very low	97 Å²	97	124.6 Å²	124.6	68%	0.678	72%	0.722	S	S	*	*			trans	-162.5	95.6	171.5	57.1	0	0	0	0	111.4	G518	G518-S520 VanDerWaalsContact C-N 3.27Å; G518-S520 PolarHBondContact O-N 2.91Å
521	N	34.2	Very low	45.2	Very low	151 Å²	151	121.7 Å²	121.7	81%	0.807	70%	0.704	S	S	*	*			trans	179.5	84.2	151.6	-92.8	-14.4	0	0	0	108.7	S523	N521-S523 PolarHBondContact O-N 2.86Å
522	I	40.7	Very low	48	Very low	181 Å²	181	117.7 Å²	117.7	93%	0.928	68%	0.68	S	S	*	*			trans	-96.2	68.7	174.2	-54	-179.7	0	0	0	108
523	S	34.3	Very low	50.4	Low	80 Å²	80	110.2 Å²	110.2	56%	0.559	64%	0.641	S	S	*	*			trans	-158.2	140.2	174	50	0	0	0	0	112.5	N521	N521-S523 PolarHBondContact O-N 2.86Å
524	E	32.4	Very low	53.1	Low	178 Å²	178	106.6 Å²	106.6	83%	0.832	62%	0.616	S	S	*	*			trans	64.7	104.4	147.1	-65	171.1	160.6	0	0	120.7
525	S	30.8	Very low	56	Low	121 Å²	121	97.5 Å²	97.5	85%	0.846	58%	0.58	S	S	*	*			trans	47.4	92.8	143.8	56.8	0	0	0	0	119.4
526	S	38.6	Very low	58.8	Low	84 Å²	84	91.9 Å²	91.9	59%	0.587	55%	0.546	S	S	*	.			trans	-124.2	140.4	142.1	58.5	0	0	0	0	109.8	Q528	S526-Q528 VanDerWaalsContact C-N 3.31Å; S526-Q528 PolarHBondContact O-N 2.99Å; S526-Q528 PolarHBondContact OG-NE2 2.97Å
527	N	45.6	Very low	61.6	Low	181 Å²	181	86.8 Å²	86.8	97%	0.968	51%	0.51	S	S	*	.			trans	-74.1	81.1	-177.8	-70.3	-49.3	0	0	0	110.6
528	Q	62	Low	64.4	Low	112 Å²	112	81.4 Å²	81.4	52%	0.523	47%	0.473	S	S	.	.			trans	-109	132.7	175.3	-61.9	-171.2	45	0	0	110.3	S526	S526-Q528 VanDerWaalsContact C-N 3.31Å; S526-Q528 PolarHBondContact O-N 2.99Å; S526-Q528 PolarHBondContact OG-NE2 2.97Å
529	D	73.7	Confident	67.5	Low	111 Å²	111	78.6 Å²	78.6	59%	0.594	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-55.9	137.1	177	-64.5	-49	0	0	0	110.8	P440	P440-D529 WeakPolarHBondContact CG-OD2 3.41Å
530	P	84.1	Confident	70.1	Confident	56 Å²	56	75 Å²	75	36%	0.364	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-59.9	133	-179.9	21.1	-30.8	0	0	0	111	N389 F532	N389-P530 WeakPolarHBondContact O-CB 3.47Å; P530-F532 PolarHBondContact O-N 3.42Å
531	P	88.1	Confident	73	Confident	54 Å²	54	70.7 Å²	70.7	35%	0.351	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-59.5	136.2	-172	24.4	-35	0	0	0	111.2	A360 N391	A360-P531 HydrophobicContact CB-CB 4.11Å; A360-P531 HydrophobicContact CB-CG 3.95Å; N391-P531 PolarHBondContact N-O 3.22Å; N391-P531 VanDerWaalsContact O-O 3.14Å
532	F	92.1	Very high	75.9	Confident	45 Å²	45	67.2 Å²	67.2	20%	0.197	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.8	176.1	-151.7	-65.3	0	0	0	110.6	N391 V393 V428 P429 P530	N391-F532 HydrophobicContact CB-CB 4.23Å; N391-F532 HydrophobicContact CB-CD2 3.37Å; N391-F532 HydrophobicContact CB-CE2 3.81Å; N391-F532 HydrophobicContact CB-CG 3.86Å; N391-F532 CarbonylContact O-C 3.54Å; N391-F532 WeakPolarHBondContact O-CA 3.19Å; V393-F532 HydrophobicContact CB-CE1 4.06Å; V393-F532 HydrophobicContact CG1-CE1 4.01Å; V428-F532 HydrophobicContact CB-CD1 4.4Å; V428-F532 HydrophobicContact CB-CE1 4.36Å; V428-F532 HydrophobicContact CG1-CD1 3.68Å; V428-F532 HydrophobicContact CG1-CE1 4.13Å; V428-F532 HydrophobicContact CG1-CG 4.14Å; V428-F532 HydrophobicContact CG2-CD1 4.23Å; V428-F532 HydrophobicContact CG2-CE1 3.86Å; P429-F532 HydrophobicContact CG-CB 4.21Å; P429-F532 HydrophobicContact CG-CD2 3.58Å; P429-F532 HydrophobicContact CG-CE2 4.25Å; P429-F532 HydrophobicContact CG-CG 4.09Å; P530-F532 PolarHBondContact O-N 3.42Å
533	V	94.1	Very high	78.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.1	-172.7	-174.5	0	0	0	0	111.9	A360 L361 I390 N391 Y392 V393 I535 E571 Y573	A360-V533 HydrophobicContact CB-CG2 3.63Å; L361-V533 HydrophobicContact CD1-CG1 3.77Å; L361-V533 HydrophobicContact CG-CG1 4.42Å; I390-V533 HydrophobicContact CG2-CG2 3.73Å; N391-V533 PolarHBondContact O-N 2.92Å; Y392-V533 CarbonylContact C-O 3.58Å; Y392-V533 VanDerWaalsContact CA-O 3.25Å; Y392-V533 WeakPolarHBondContact CA-O 3.47Å; V393-V533 PolarHBondContact N-O 2.68Å; V533-I535 HydrophobicContact CG1-CD1 4.5Å; V533-I535 HydrophobicContact CG1-CG1 3.94Å; V533-E571 HydrophobicContact CG2-CB 4.28Å; V533-Y573 HydrophobicContact CG1-CD2 3.35Å; V533-Y573 HydrophobicContact CG1-CE2 3.48Å; V533-Y573 VanDerWaalsContact CG1-CE2 3.48Å
534	V	96.9	Very high	81.5	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.7	175.8	-169.2	0	0	0	0	109.9	V393 V395 I424 V428 F536 E571 I572 Y573	V393-V534 HydrophobicContact CG1-CB 4.26Å; V393-V534 HydrophobicContact CG1-CG1 3.91Å; V393-V534 HydrophobicContact CG1-CG2 4.11Å; V395-V534 HydrophobicContact CG2-CG1 3.95Å; I424-V534 HydrophobicContact CD1-CG1 3.86Å; V428-V534 HydrophobicContact CG1-CG2 4.28Å; V428-V534 HydrophobicContact CG2-CG2 4Å; V534-F536 HydrophobicContact CB-CE2 4.2Å; V534-F536 HydrophobicContact CG1-CD2 3.94Å; V534-F536 HydrophobicContact CG1-CE2 3.35Å; V534-F536 HydrophobicContact CG1-CZ 3.94Å; V534-E571 PolarHBondContact N-O 3.01Å; V534-I572 HydrophobicContact CB-CG1 4.28Å; V534-I572 WeakPolarHBondContact O-CA 3.33Å; V534-Y573 PolarHBondContact O-N 3.04Å
535	I	97.9	Very high	84.6	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	109.4	-176.2	-51.3	179.9	0	0	0	109.8	L361 V374 V379 L382 V393 I394 V395 V533 M575	L361-I535 HydrophobicContact CD1-CD1 3.79Å; L361-I535 HydrophobicContact CD1-CG1 4.33Å; V374-I535 HydrophobicContact CG2-CG2 4.13Å; V379-I535 HydrophobicContact CG2-CD1 4.28Å; V379-I535 HydrophobicContact CG2-CG2 4.13Å; L382-I535 HydrophobicContact CD1-CD1 3.58Å; V393-I535 PolarHBondContact O-N 2.89Å; I394-I535 CarbonylContact C-O 3.6Å; I394-I535 WeakPolarHBondContact CA-O 3.01Å; V395-I535 PolarHBondContact N-O 2.93Å; V533-I535 HydrophobicContact CG1-CD1 4.5Å; V533-I535 HydrophobicContact CG1-CG1 3.94Å; I535-M575 HydrophobicContact CG2-CB 4.22Å
536	F	98.5	Very high	87.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	140.6	177.6	-68	-104.8	0	0	0	111.4	V395 L420 V534 A545 L548 A549 L552 I572 Y573 I574 M575	V395-F536 HydrophobicContact CB-CD1 3.97Å; V395-F536 HydrophobicContact CB-CE1 4.26Å; V395-F536 HydrophobicContact CB-CG 4.3Å; V395-F536 HydrophobicContact CG1-CD1 3.96Å; V395-F536 HydrophobicContact CG1-CE1 4.03Å; V395-F536 HydrophobicContact CG2-CE1 4.48Å; L420-F536 HydrophobicContact CD1-CE1 3.62Å; L420-F536 HydrophobicContact CD1-CZ 3.95Å; L420-F536 HydrophobicContact CD2-CE1 3.95Å; L420-F536 HydrophobicContact CD2-CZ 4.29Å; L420-F536 HydrophobicContact CG-CE1 4.44Å; V534-F536 HydrophobicContact CB-CE2 4.2Å; V534-F536 HydrophobicContact CG1-CD2 3.94Å; V534-F536 HydrophobicContact CG1-CE2 3.35Å; V534-F536 HydrophobicContact CG1-CZ 3.94Å; F536-A545 HydrophobicContact CB-CB 3.99Å; F536-L548 HydrophobicContact CD1-CB 4.31Å; F536-L548 HydrophobicContact CE1-CB 4.17Å; F536-A549 HydrophobicContact CB-CB 4.37Å; F536-A549 HydrophobicContact CD1-CB 4.12Å; F536-A549 HydrophobicContact CD2-CB 3.69Å; F536-A549 HydrophobicContact CE1-CB 4.31Å; F536-A549 HydrophobicContact CE2-CB 3.89Å; F536-A549 HydrophobicContact CG-CB 3.82Å; F536-A549 HydrophobicContact CZ-CB 4.2Å; F536-L552 HydrophobicContact CE2-CD2 4.15Å; F536-L552 HydrophobicContact CZ-CB 4.38Å; F536-L552 HydrophobicContact CZ-CD2 3.73Å; F536-I572 HydrophobicContact CD2-CG2 3.86Å; F536-I572 HydrophobicContact CE2-CG2 3.7Å; F536-Y573 PolarHBondContact N-O 3.32Å; F536-I574 HydrophobicContact CB-CD1 3.91Å; F536-I574 CarbonylContact O-C 3.53Å; F536-I574 WeakPolarHBondContact O-CA 3.03Å; F536-M575 PolarHBondContact O-N 3.38Å
537	H	98.5	Very high	90.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	163	166.9	76	97.1	0	0	0	112	V395 D396 C397 S541 M575	V395-H537 PolarHBondContact O-N 3.36Å; D396-H537 WeakPolarHBondContact CB-NE2 3.35Å; D396-H537 IonicContact OD1-CE1 3.6Å; D396-H537 IonicContact OD1-ND1 2.72Å; D396-H537 IonicContact OD2-CE1 2.69Å; D396-H537 PolarHBondContact OD2-CE1 3.14Å; D396-H537 IonicContact OD2-NE2 3.13Å; C397-H537 WeakPolarHBondContact CB-O 3.5Å; C397-H537 PolarHBondContact N-O 3.43Å; C397-H537 PolarHBondContact SG-O 3.47Å; H537-S541 WeakPolarHBondContact CA-OG 3.39Å; H537-M575 HydrophobicContact CB-CB 4Å; H537-M575 HydrophobicContact CB-CE 3.8Å
538	C	98.1	Very high	92.9	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.027	22%	0.218	C	C	.	.			trans	-135.1	-152	162.1	75.8	0	0	0	0	109.4	C397 R398 S541 R544 A545 G578 Y579	C397-C538 HydrophobicContact CB-CB 4Å; R398-C538 HydrophobicContact CG-CB 4.16Å; C538-S541 PolarHBondContact N-OG 3.37Å; C538-S541 VanDerWaalsContact SG-CA 3.55Å; C538-S541 PolarHBondContact SG-N 3.42Å; C538-R544 HydrophobicContact CB-CB 3.9Å; C538-A545 HydrophobicContact CB-CB 4.33Å; C538-G578 CarbonylContact O-C 3.46Å; C538-G578 WeakPolarHBondContact O-CA 3.19Å; C538-Y579 PolarHBondContact O-N 3.35Å
539	E	98.3	Very high	94.6	Very high	7 Å²	7	35 Å²	35	3%	0.033	19%	0.194	C	C	.	.	S	Bend	trans	-58.6	-48.8	176.8	-171.6	174	-171.8	0	0	112.2	R398 G578 Y579 S580 Y595 K597 M598	R398-E539 HydrophobicContact CG-CB 4.46Å; E539-G578 CarbonylContact O-C 3.52Å; E539-Y579 PolarHBondContact O-N 2.59Å; E539-S580 WeakPolarHBondContact O-CB 3.15Å; E539-S580 PolarHBondContact O-N 3.32Å; E539-Y595 HydrophobicContact CG-CE2 3.9Å; E539-Y595 WeakPolarHBondContact CG-OH 3.33Å; E539-Y595 WeakPolarHBondContact OE1-CE2 3.3Å; E539-Y595 PolarHBondContact OE1-OH 3.08Å; E539-K597 WeakPolarHBondContact OE1-CA 3.36Å; E539-K597 VanDerWaalsContact OE1-CB 3.29Å; E539-K597 WeakPolarHBondContact OE1-CB 3.17Å; E539-K597 WeakPolarHBondContact OE1-CG 3.4Å; E539-M598 WeakPolarHBondContact OE2-CB 3.26Å; E539-M598 PolarHBondContact OE2-N 2.58Å
540	F	97.7	Very high	95.7	Very high	109 Å²	109	31.5 Å²	31.5	48%	0.478	18%	0.179	S	C	.	.	S	Bend	trans	-122.8	1.6	179.6	-54.3	-71.3	0	0	0	113.6	S542 S580	F540-S542 PolarHBondContact O-N 3.44Å; F540-S580 WeakPolarHBondContact CE1-OG 3.39Å
541	S	96.8	Very high	96.2	Very high	7 Å²	7	29 Å²	29	5%	0.049	16%	0.163	C	C	.	.	S	Bend	trans	54.3	11.2	-174.3	-64.5	0	0	0	0	117.2	H537 C538 P546 M575 G578	H537-S541 WeakPolarHBondContact CA-OG 3.39Å; C538-S541 PolarHBondContact N-OG 3.37Å; C538-S541 VanDerWaalsContact SG-CA 3.55Å; C538-S541 PolarHBondContact SG-N 3.42Å; S541-P546 WeakPolarHBondContact O-CD 3.34Å; S541-P546 WeakPolarHBondContact O-CG 3.27Å; S541-M575 WeakPolarHBondContact CB-O 3.47Å; S541-M575 PolarHBondContact OG-O 3.42Å; S541-G578 WeakPolarHBondContact OG-CA 3.4Å; S541-G578 PolarHBondContact OG-N 3.04Å
542	S	94.7	Very high	96.6	Very high	79 Å²	79	26.4 Å²	26.4	55%	0.552	15%	0.146	S	C	*	.	S	Bend	trans	-85	-12.2	-174.3	56.7	0	0	0	0	116	F540	F540-S542 PolarHBondContact O-N 3.44Å
543	Q	95	Very high	96.7	Very high	146 Å²	146	26.3 Å²	26.3	68%	0.682	15%	0.145	S	C	*	.	S	Bend	trans	-145.1	-69.8	-172.6	-71.1	-65.8	-42.8	0	0	112.6	A545 P546 A547	Q543-A545 PolarHBondContact O-N 3.31Å; Q543-P546 WeakPolarHBondContact O-CD 3.09Å; Q543-A547 WeakPolarHBondContact O-CB 3.27Å; Q543-A547 PolarHBondContact O-N 2.98Å
544	R	96.8	Very high	96.7	Very high	42 Å²	42	28 Å²	28	16%	0.158	16%	0.156	C	C	.	.	H	α-helix	trans	-59.7	-42.6	-172.2	-67	-176.9	-79.9	179.5	-1.7	113.8	C397 E402 C538 L548 M598	C397-R544 HydrophobicContact CB-CB 4.24Å; E402-R544 IonicContact OE1-CZ 2.86Å; E402-R544 IonicContact OE1-NH1 3.67Å; E402-R544 PolarHBondContact OE1-NH1 3.13Å; E402-R544 IonicContact OE1-NH2 3.75Å; E402-R544 PolarHBondContact OE1-NH2 3.02Å; E402-R544 IonicContact OE2-CZ 3.24Å; E402-R544 IonicContact OE2-NH1 2.66Å; E402-R544 PolarHBondContact OE2-NH1 3.14Å; E402-R544 IonicContact OE2-NH2 2.64Å; C538-R544 HydrophobicContact CB-CB 3.9Å; R544-L548 PolarHBondContact O-N 3.42Å; R544-M598 PolarHBondContact NH2-SD 3.18Å; R544-M598 VanDerWaalsContact NH2-SD 3.41Å
545	A	97.6	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-71	-51.3	179.8	0	0	0	0	0	112.7	C397 F536 C538 Q543 A547 L548 A549 I574	C397-A545 HydrophobicContact CB-CB 4.27Å; F536-A545 HydrophobicContact CB-CB 3.99Å; C538-A545 HydrophobicContact CB-CB 4.33Å; Q543-A545 PolarHBondContact O-N 3.31Å; A545-A547 VanDerWaalsContact C-N 3.3Å; A545-A547 PolarHBondContact O-N 3.01Å; A545-L548 PolarHBondContact O-N 2.9Å; A545-A549 WeakPolarHBondContact O-CB 3.38Å; A545-A549 PolarHBondContact O-N 3.46Å; A545-I574 HydrophobicContact CB-CD1 4.46Å
546	P	97.2	Very high	96.4	Very high	10 Å²	10	27.8 Å²	27.8	7%	0.065	16%	0.155	C	C	.	.	H	α-helix	trans	-51.5	-44.6	170.4	-32.7	36.8	0	0	0	114.2	T367 S541 Q543 L548 A549 A550 I574	T367-P546 HydrophobicContact CG2-CB 3.88Å; T367-P546 HydrophobicContact CG2-CG 3.85Å; S541-P546 WeakPolarHBondContact O-CD 3.34Å; S541-P546 WeakPolarHBondContact O-CG 3.27Å; Q543-P546 WeakPolarHBondContact O-CD 3.09Å; P546-L548 PolarHBondContact O-N 3.02Å; P546-A549 PolarHBondContact O-N 3.43Å; P546-A550 WeakPolarHBondContact O-CB 3.47Å; P546-A550 PolarHBondContact O-N 3.43Å; P546-I574 HydrophobicContact CG-CD1 4.43Å; P546-I574 HydrophobicContact CG-CG1 4.46Å; P546-I574 HydrophobicContact CG-CG2 4.5Å
547	A	96.5	Very high	96.1	Very high	55 Å²	55	30.5 Å²	30.5	46%	0.455	17%	0.165	S	C	.	.	H	α-helix	trans	-63.1	-42	-179.8	0	0	0	0	0	112.8	Q543 A545 F551	Q543-A547 WeakPolarHBondContact O-CB 3.27Å; Q543-A547 PolarHBondContact O-N 2.98Å; A545-A547 VanDerWaalsContact C-N 3.3Å; A545-A547 PolarHBondContact O-N 3.01Å; A547-F551 VanDerWaalsContact O-CB 3.31Å; A547-F551 WeakPolarHBondContact O-CB 3.19Å; A547-F551 PolarHBondContact O-N 2.86Å
548	L	97.2	Very high	95.8	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-73.2	-39.2	177.6	-76.4	173.2	0	0	0	112.5	C397 I414 H417 L420 F536 R544 A545 P546 F551 L552	C397-L548 HydrophobicContact CB-CD1 3.81Å; I414-L548 WeakPolarHBondContact O-CD1 3.35Å; H417-L548 WeakPolarHBondContact ND1-CD2 3.47Å; L420-L548 HydrophobicContact CD2-CB 3.96Å; L420-L548 HydrophobicContact CD2-CD2 4.11Å; L420-L548 VanDerWaalsContact CD2-O 3.23Å; L420-L548 WeakPolarHBondContact CD2-O 3.47Å; F536-L548 HydrophobicContact CD1-CB 4.31Å; F536-L548 HydrophobicContact CE1-CB 4.17Å; R544-L548 PolarHBondContact O-N 3.42Å; A545-L548 PolarHBondContact O-N 2.9Å; P546-L548 PolarHBondContact O-N 3.02Å; L548-F551 PolarHBondContact O-N 3.37Å; L548-L552 PolarHBondContact O-N 3.5Å
549	A	97.3	Very high	95.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-41.9	175.7	0	0	0	0	0	112.3	L371 F536 A545 P546 L552 R553 I572 I574	L371-A549 HydrophobicContact CD1-CB 3.59Å; F536-A549 HydrophobicContact CB-CB 4.37Å; F536-A549 HydrophobicContact CD1-CB 4.12Å; F536-A549 HydrophobicContact CD2-CB 3.69Å; F536-A549 HydrophobicContact CE1-CB 4.31Å; F536-A549 HydrophobicContact CE2-CB 3.89Å; F536-A549 HydrophobicContact CG-CB 3.82Å; F536-A549 HydrophobicContact CZ-CB 4.2Å; A545-A549 WeakPolarHBondContact O-CB 3.38Å; A545-A549 PolarHBondContact O-N 3.46Å; P546-A549 PolarHBondContact O-N 3.43Å; A549-L552 PolarHBondContact O-N 3.37Å; A549-R553 WeakPolarHBondContact O-CB 3.21Å; A549-R553 PolarHBondContact O-N 3.4Å; A549-I572 HydrophobicContact CB-CG2 3.98Å; A549-I574 HydrophobicContact CB-CD1 3.68Å
550	A	95.9	Very high	95	Very high	36 Å²	36	33.4 Å²	33.4	30%	0.298	18%	0.184	S	C	.	.	H	α-helix	trans	-65.5	-39.2	173.9	0	0	0	0	0	111.4	L371 P546 R553 S554	L371-A550 HydrophobicContact CD1-CB 4.23Å; P546-A550 WeakPolarHBondContact O-CB 3.47Å; P546-A550 PolarHBondContact O-N 3.43Å; A550-R553 PolarHBondContact O-N 2.88Å; A550-S554 PolarHBondContact O-N 3.2Å
551	F	96.1	Very high	94.5	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-50.3	172.9	176	-105.7	0	0	0	111.9	H417 L420 V421 A547 L548 R553 S554 V555 C621 M622 I625 V753	H417-F551 HydrophobicContact CB-CD1 3.94Å; H417-F551 HydrophobicContact CB-CE1 3.51Å; H417-F551 HydrophobicContact CB-CE2 4.44Å; H417-F551 HydrophobicContact CB-CZ 3.79Å; H417-F551 AromaticContact CD2-CD1 3.79Å; H417-F551 AromaticContact CD2-CD2 3.56Å; H417-F551 AromaticContact CD2-CE1 3.98Å; H417-F551 AromaticContact CD2-CE2 3.7Å; H417-F551 AromaticContact CD2-CG 3.59Å; H417-F551 AromaticContact CD2-CZ 3.93Å; H417-F551 AromaticContact CG-CD1 3.85Å; H417-F551 AromaticContact CG-CE1 3.9Å; H417-F551 WeakPolarHBondContact O-CE1 3.46Å; L420-F551 HydrophobicContact CD2-CD1 4.36Å; V421-F551 HydrophobicContact CG2-CE1 3.86Å; A547-F551 VanDerWaalsContact O-CB 3.31Å; A547-F551 WeakPolarHBondContact O-CB 3.19Å; A547-F551 PolarHBondContact O-N 2.86Å; L548-F551 PolarHBondContact O-N 3.37Å; F551-R553 VanDerWaalsContact C-N 3.31Å; F551-R553 PolarHBondContact O-N 3.21Å; F551-S554 PolarHBondContact O-N 2.82Å; F551-S554 PolarHBondContact O-OG 3.47Å; F551-V555 HydrophobicContact CE1-CG2 4.02Å; F551-V555 HydrophobicContact CE2-CG2 4.19Å; F551-V555 HydrophobicContact CZ-CG2 3.83Å; F551-V555 PolarHBondContact O-N 3.12Å; F551-C621 HydrophobicContact CE2-CB 4.14Å; F551-C621 HydrophobicContact CZ-CB 3.81Å; F551-M622 HydrophobicContact CD2-CG 4.45Å; F551-M622 HydrophobicContact CD2-SD 3.47Å; F551-M622 WeakPolarHBondContact CD2-SD 3.33Å; F551-M622 HydrophobicContact CE2-SD 4.05Å; F551-M622 HydrophobicContact CG-SD 4.46Å; F551-I625 HydrophobicContact CD2-CD1 3.79Å; F551-I625 HydrophobicContact CE2-CD1 3.31Å; F551-I625 HydrophobicContact CE2-CG1 4.32Å; F551-I625 HydrophobicContact CZ-CD1 4.05Å; F551-V753 HydrophobicContact CE1-CG1 4.31Å; F551-V753 HydrophobicContact CZ-CG1 3.82Å; F551-V753 HydrophobicContact CZ-CG2 4.48Å
552	L	96	Very high	94.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.8	-45	175.5	177	64.3	0	0	0	111.5	L420 I424 F425 F536 L548 A549 S554 V555 D556 F569 I572	L420-L552 HydrophobicContact CD2-CB 3.95Å; I424-L552 HydrophobicContact CG1-CD2 4.29Å; I424-L552 HydrophobicContact CG2-CD1 4.2Å; I424-L552 HydrophobicContact CG2-CD2 4.01Å; F425-L552 HydrophobicContact CE2-CD1 4.29Å; F536-L552 HydrophobicContact CE2-CD2 4.15Å; F536-L552 HydrophobicContact CZ-CB 4.38Å; F536-L552 HydrophobicContact CZ-CD2 3.73Å; L548-L552 PolarHBondContact O-N 3.5Å; A549-L552 PolarHBondContact O-N 3.37Å; L552-S554 VanDerWaalsContact C-N 3.28Å; L552-S554 PolarHBondContact O-N 3.41Å; L552-V555 PolarHBondContact O-N 3.37Å; L552-D556 WeakPolarHBondContact O-CB 3.45Å; L552-D556 PolarHBondContact O-N 3.03Å; L552-F569 HydrophobicContact CD1-CD2 4.34Å; L552-I572 HydrophobicContact CD2-CD1 3.82Å; L552-I572 HydrophobicContact CG-CD1 4.17Å
553	R	94.7	Very high	93.7	Very high	43 Å²	43	41 Å²	41	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-33.9	176.8	-178.4	54	58.1	80.3	-9.5	112.4	A549 A550 F551 R557 F569 P570	A549-R553 WeakPolarHBondContact O-CB 3.21Å; A549-R553 PolarHBondContact O-N 3.4Å; A550-R553 PolarHBondContact O-N 2.88Å; F551-R553 VanDerWaalsContact C-N 3.31Å; F551-R553 PolarHBondContact O-N 3.21Å; R553-R557 WeakPolarHBondContact O-CB 3.39Å; R553-R557 VanDerWaalsContact O-CG 3.3Å; R553-R557 WeakPolarHBondContact O-CG 3.27Å; R553-R557 PolarHBondContact O-N 2.86Å; R553-F569 PolarHBondContact NH2-O 3.37Å; R553-P570 VanDerWaalsContact NH2-C 3.33Å; R553-P570 PolarHBondContact NH2-O 3.35Å
554	S	93.9	Very high	93.2	Very high	34 Å²	34	41 Å²	41	24%	0.238	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-38.6	174.4	72.1	0	0	0	0	113.1	A550 F551 L552 V558 I625	A550-S554 PolarHBondContact O-N 3.2Å; F551-S554 PolarHBondContact O-N 2.82Å; F551-S554 PolarHBondContact O-OG 3.47Å; L552-S554 VanDerWaalsContact C-N 3.28Å; L552-S554 PolarHBondContact O-N 3.41Å; S554-V558 WeakPolarHBondContact O-CG2 3.18Å; S554-V558 PolarHBondContact O-N 2.91Å; S554-I625 WeakPolarHBondContact OG-CD1 3.22Å
555	V	94	Very high	92.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-49.2	172	176.7	0	0	0	0	110.2	V421 F425 F551 L552 R557 V558 S559 I625 L749	V421-V555 HydrophobicContact CG2-CB 4.49Å; V421-V555 HydrophobicContact CG2-CG1 4.25Å; V421-V555 HydrophobicContact CG2-CG2 3.97Å; F425-V555 HydrophobicContact CZ-CG1 4.25Å; F551-V555 HydrophobicContact CE1-CG2 4.02Å; F551-V555 HydrophobicContact CE2-CG2 4.19Å; F551-V555 HydrophobicContact CZ-CG2 3.83Å; F551-V555 PolarHBondContact O-N 3.12Å; L552-V555 PolarHBondContact O-N 3.37Å; V555-R557 PolarHBondContact O-N 3.26Å; V555-V558 PolarHBondContact O-N 3.43Å; V555-S559 WeakPolarHBondContact O-CB 3.26Å; V555-S559 PolarHBondContact O-N 2.64Å; V555-I625 HydrophobicContact CG2-CD1 3.48Å; V555-I625 VanDerWaalsContact CG2-CD1 3.48Å; V555-I625 HydrophobicContact CG2-CG1 4.46Å; V555-L749 HydrophobicContact CG1-CD2 4.32Å
556	D	93.6	Very high	92.4	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-43.3	179.7	-170.1	6.2	0	0	0	111.9	L552 N560 L567 Y568 F569	L552-D556 WeakPolarHBondContact O-CB 3.45Å; L552-D556 PolarHBondContact O-N 3.03Å; D556-N560 WeakPolarHBondContact O-CB 3.43Å; D556-N560 PolarHBondContact O-N 2.8Å; D556-N560 PolarHBondContact O-ND2 3.22Å; D556-N560 PolarHBondContact OD1-ND2 3.31Å; D556-L567 HydrophobicContact CB-CD2 4.19Å; D556-Y568 WeakPolarHBondContact OD1-CB 3.45Å; D556-Y568 PolarHBondContact OD1-N 2.88Å; D556-Y568 PolarHBondContact OD2-N 2.8Å; D556-F569 PolarHBondContact OD2-N 3.06Å
557	R	92.2	Very high	92.1	Very high	56 Å²	56	43.8 Å²	43.8	21%	0.211	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-46.1	175.1	-80.9	-69.3	-172.1	-141.7	7.3	113	R553 V555 N560 Y561 P565 F566 L567	R553-R557 WeakPolarHBondContact O-CB 3.39Å; R553-R557 VanDerWaalsContact O-CG 3.3Å; R553-R557 WeakPolarHBondContact O-CG 3.27Å; R553-R557 PolarHBondContact O-N 2.86Å; V555-R557 PolarHBondContact O-N 3.26Å; R557-N560 CarbonylContact O-C 3.27Å; R557-N560 VanDerWaalsContact O-C 3.27Å; R557-N560 PolarHBondContact O-N 2.99Å; R557-Y561 PolarHBondContact O-N 3.45Å; R557-P565 VanDerWaalsContact NH1-C 3.3Å; R557-P565 PolarHBondContact NH1-O 2.69Å; R557-F566 PolarHBondContact NH1-O 3.45Å; R557-L567 HydrophobicContact CG-CD2 3.96Å
558	V	92.1	Very high	91.8	Very high	65 Å²	65	42 Å²	42	39%	0.394	20%	0.198	S	C	.	.	H	α-helix	trans	-74	-38.5	-177.7	178.2	0	0	0	0	111.7	S554 V555 N560 Y561 I625 L749	S554-V558 WeakPolarHBondContact O-CG2 3.18Å; S554-V558 PolarHBondContact O-N 2.91Å; V555-V558 PolarHBondContact O-N 3.43Å; V558-N560 PolarHBondContact O-N 3.04Å; V558-N560 VanDerWaalsContact O-N 3.12Å; V558-Y561 PolarHBondContact O-N 2.81Å; V558-I625 HydrophobicContact CG2-CG2 3.92Å; V558-L749 HydrophobicContact CB-CD2 3.7Å; V558-L749 HydrophobicContact CG1-CD2 3.71Å
559	S	89.6	Confident	91.6	Very high	7 Å²	7	42 Å²	42	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-17.6	169.4	-83.9	0	0	0	0	113.9	V555 P746	V555-S559 WeakPolarHBondContact O-CB 3.26Å; V555-S559 PolarHBondContact O-N 2.64Å; S559-P746 VanDerWaalsContact CB-O 3.27Å; S559-P746 WeakPolarHBondContact CB-O 3.38Å; S559-P746 PolarHBondContact OG-O 2.9Å
560	N	89.7	Confident	91.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	20.7	179.2	-70.3	-65.1	0	0	0	113.7	D556 R557 V558 H562 R563 Y564 F566 Y568	D556-N560 WeakPolarHBondContact O-CB 3.43Å; D556-N560 PolarHBondContact O-N 2.8Å; D556-N560 PolarHBondContact O-ND2 3.22Å; D556-N560 PolarHBondContact OD1-ND2 3.31Å; R557-N560 CarbonylContact O-C 3.27Å; R557-N560 VanDerWaalsContact O-C 3.27Å; R557-N560 PolarHBondContact O-N 2.99Å; V558-N560 PolarHBondContact O-N 3.04Å; V558-N560 VanDerWaalsContact O-N 3.12Å; N560-H562 VanDerWaalsContact C-N 3.31Å; N560-H562 PolarHBondContact O-N 3.05Å; N560-R563 CarbonylContact O-C 3.43Å; N560-R563 WeakPolarHBondContact O-CA 3.46Å; N560-R563 PolarHBondContact O-N 3.06Å; N560-R563 PolarHBondContact OD1-NE 3.13Å; N560-R563 PolarHBondContact OD1-NH2 3.04Å; N560-Y564 PolarHBondContact O-N 2.93Å; N560-F566 HydrophobicContact CB-CD1 4.21Å; N560-F566 VanDerWaalsContact OD1-CD1 3.27Å; N560-F566 WeakPolarHBondContact OD1-CD1 3.41Å; N560-F566 WeakPolarHBondContact OD1-CE1 3.13Å; N560-Y568 WeakPolarHBondContact ND2-CD2 3.43Å; N560-Y568 VanDerWaalsContact ND2-CE2 3.25Å; N560-Y568 WeakPolarHBondContact ND2-CE2 3.13Å
561	Y	88.6	Confident	91.2	Very high	179 Å²	179	41.4 Å²	41.4	70%	0.702	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-56.5	-46.1	-173.5	93.3	-89.5	0	0	0	112	R557 V558 R563 Y564	R557-Y561 PolarHBondContact O-N 3.45Å; V558-Y561 PolarHBondContact O-N 2.81Å; Y561-R563 PolarHBondContact O-N 2.96Å; Y561-Y564 PolarHBondContact O-N 2.85Å
562	H	88	Confident	91.1	Very high	103 Å²	103	41.3 Å²	41.3	48%	0.477	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-68.7	3.5	175.6	65.4	-75.4	0	0	0	114.9	N560	N560-H562 VanDerWaalsContact C-N 3.31Å; N560-H562 PolarHBondContact O-N 3.05Å
563	R	85.4	Confident	91.2	Very high	73 Å²	73	41.3 Å²	41.3	28%	0.275	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-130.5	12.9	175.8	-68.5	-171.6	-71.6	-96.3	-7.4	112.7	N560 Y561 F566 Y568	N560-R563 CarbonylContact O-C 3.43Å; N560-R563 WeakPolarHBondContact O-CA 3.46Å; N560-R563 PolarHBondContact O-N 3.06Å; N560-R563 PolarHBondContact OD1-NE 3.13Å; N560-R563 PolarHBondContact OD1-NH2 3.04Å; Y561-R563 PolarHBondContact O-N 2.96Å; R563-F566 HydrophobicContact CB-CB 3.97Å; R563-F566 HydrophobicContact CB-CD1 4.25Å; R563-F566 HydrophobicContact CB-CG 4.5Å; R563-F566 WeakPolarHBondContact O-CB 3.49Å; R563-F566 PolarHBondContact O-N 3.48Å; R563-Y568 PolarHBondContact NH2-OH 3.08Å; R563-Y568 VanDerWaalsContact NH2-OH 3.11Å
564	Y	85.2	Confident	91.3	Very high	145 Å²	145	39.4 Å²	39.4	57%	0.569	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	133.6	-179.4	-172	-81.1	0	0	0	111	N560 Y561	N560-Y564 PolarHBondContact O-N 2.93Å; Y561-Y564 PolarHBondContact O-N 2.85Å
565	P	88.5	Confident	91.5	Very high	76 Å²	76	37.9 Å²	37.9	49%	0.494	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	cis	-93.6	18.1	12.6	38.2	-37.9	0	0	0	115.5	R557	R557-P565 VanDerWaalsContact NH1-C 3.3Å; R557-P565 PolarHBondContact NH1-O 2.69Å
566	F	88.6	Confident	91.7	Very high	29 Å²	29	42.2 Å²	42.2	13%	0.127	19%	0.191	C	C	.	.			trans	-57.9	153.8	179.3	-180	-105.6	0	0	0	113.6	Q431 P433 R557 N560 R563 Y568	Q431-F566 HydrophobicContact CB-CE2 4.47Å; Q431-F566 WeakPolarHBondContact O-CZ 3.45Å; P433-F566 HydrophobicContact CB-CE2 4.46Å; P433-F566 HydrophobicContact CB-CZ 4.47Å; P433-F566 HydrophobicContact CG-CE1 3.96Å; P433-F566 HydrophobicContact CG-CE2 4.32Å; P433-F566 HydrophobicContact CG-CZ 3.85Å; R557-F566 PolarHBondContact NH1-O 3.45Å; N560-F566 HydrophobicContact CB-CD1 4.21Å; N560-F566 VanDerWaalsContact OD1-CD1 3.27Å; N560-F566 WeakPolarHBondContact OD1-CD1 3.41Å; N560-F566 WeakPolarHBondContact OD1-CE1 3.13Å; R563-F566 HydrophobicContact CB-CB 3.97Å; R563-F566 HydrophobicContact CB-CD1 4.25Å; R563-F566 HydrophobicContact CB-CG 4.5Å; R563-F566 WeakPolarHBondContact O-CB 3.49Å; R563-F566 PolarHBondContact O-N 3.48Å; F566-Y568 AromaticContact CE1-CD1 3.79Å; F566-Y568 HydrophobicContact CE1-CD1 3.79Å; F566-Y568 AromaticContact CE1-CE1 3.8Å; F566-Y568 HydrophobicContact CE1-CE1 3.8Å; F566-Y568 HydrophobicContact CZ-CD1 4.01Å; F566-Y568 HydrophobicContact CZ-CE1 4.26Å
567	L	90.9	Very high	91.8	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	21%	0.206	C	C	.	.			trans	-147.2	144.1	177.7	-71	173.8	0	0	0	109	D556 R557 F569 P570	D556-L567 HydrophobicContact CB-CD2 4.19Å; R557-L567 HydrophobicContact CG-CD2 3.96Å; L567-F569 VanDerWaalsContact C-N 3.35Å; L567-P570 HydrophobicContact CB-CB 4.24Å; L567-P570 HydrophobicContact CD1-CB 4.15Å
568	Y	91.3	Very high	92.1	Very high	18 Å²	18	41 Å²	41	7%	0.071	20%	0.196	C	C	.	.	S	Bend	trans	-71.3	-33.2	165.9	-65.9	-51.4	0	0	0	111.8	A430 Q431 L443 D556 N560 R563 F566 P746	A430-Y568 HydrophobicContact CB-CD1 3.76Å; A430-Y568 HydrophobicContact CB-CG 4.05Å; Q431-Y568 PolarHBondContact N-O 2.94Å; Q431-Y568 VanDerWaalsContact N-O 3.13Å; L443-Y568 HydrophobicContact CD1-CD1 4.13Å; L443-Y568 HydrophobicContact CD1-CD2 3.63Å; L443-Y568 HydrophobicContact CD1-CE1 4.28Å; L443-Y568 HydrophobicContact CD1-CE2 3.81Å; L443-Y568 HydrophobicContact CD1-CG 3.8Å; D556-Y568 WeakPolarHBondContact OD1-CB 3.45Å; D556-Y568 PolarHBondContact OD1-N 2.88Å; D556-Y568 PolarHBondContact OD2-N 2.8Å; N560-Y568 WeakPolarHBondContact ND2-CD2 3.43Å; N560-Y568 VanDerWaalsContact ND2-CE2 3.25Å; N560-Y568 WeakPolarHBondContact ND2-CE2 3.13Å; R563-Y568 PolarHBondContact NH2-OH 3.08Å; R563-Y568 VanDerWaalsContact NH2-OH 3.11Å; F566-Y568 AromaticContact CE1-CD1 3.79Å; F566-Y568 HydrophobicContact CE1-CD1 3.79Å; F566-Y568 AromaticContact CE1-CE1 3.8Å; F566-Y568 HydrophobicContact CE1-CE1 3.8Å; F566-Y568 HydrophobicContact CZ-CD1 4.01Å; F566-Y568 HydrophobicContact CZ-CE1 4.26Å; Y568-P746 WeakPolarHBondContact OH-CB 3.41Å
569	F	92.8	Very high	92.4	Very high	6 Å²	6	38 Å²	38	3%	0.026	18%	0.177	C	C	.	.			trans	-130.3	71.5	-174.8	-45.1	-63.6	0	0	0	111.5	I424 F425 V428 A430 L443 L552 R553 D556 L567 I572	I424-F569 HydrophobicContact CG2-CD2 4.38Å; I424-F569 HydrophobicContact CG2-CE1 4.27Å; I424-F569 HydrophobicContact CG2-CE2 4.11Å; I424-F569 HydrophobicContact CG2-CZ 4.04Å; F425-F569 AromaticContact CD2-CE2 3.82Å; F425-F569 HydrophobicContact CD2-CE2 3.82Å; F425-F569 HydrophobicContact CD2-CZ 4.02Å; F425-F569 AromaticContact CE2-CE2 3.6Å; F425-F569 HydrophobicContact CE2-CE2 3.6Å; F425-F569 HydrophobicContact CE2-CZ 4.24Å; F425-F569 HydrophobicContact CZ-CE2 4.26Å; V428-F569 HydrophobicContact CB-CD1 4.08Å; V428-F569 HydrophobicContact CB-CE1 3.71Å; V428-F569 HydrophobicContact CG1-CD1 3.48Å; V428-F569 VanDerWaalsContact CG1-CD1 3.48Å; V428-F569 HydrophobicContact CG1-CE1 3.55Å; A430-F569 HydrophobicContact CB-CE1 4.28Å; A430-F569 HydrophobicContact CB-CZ 4.47Å; L443-F569 HydrophobicContact CD1-CZ 4.39Å; L552-F569 HydrophobicContact CD1-CD2 4.34Å; R553-F569 PolarHBondContact NH2-O 3.37Å; D556-F569 PolarHBondContact OD2-N 3.06Å; L567-F569 VanDerWaalsContact C-N 3.35Å; F569-I572 HydrophobicContact CB-CD1 4.17Å; F569-I572 HydrophobicContact CB-CG1 4.37Å; F569-I572 WeakPolarHBondContact O-CD1 3.44Å; F569-I572 WeakPolarHBondContact O-CG1 3.26Å
570	P	91.2	Very high	92.8	Very high	13 Å²	13	38.2 Å²	38.2	8%	0.084	18%	0.179	C	C	.	.			trans	-70	-30.4	179.6	27.6	-33.9	0	0	0	113.5	S353 Q431 R553 L567 I572	S353-P570 PolarHBondContact OG-O 3.32Å; Q431-P570 VanDerWaalsContact CD-CG 3.49Å; Q431-P570 HydrophobicContact CG-CG 4.45Å; Q431-P570 VanDerWaalsContact NE2-CG 3.34Å; R553-P570 VanDerWaalsContact NH2-C 3.33Å; R553-P570 PolarHBondContact NH2-O 3.35Å; L567-P570 HydrophobicContact CB-CB 4.24Å; L567-P570 HydrophobicContact CD1-CB 4.15Å; P570-I572 PolarHBondContact O-N 3.4Å
571	E	92	Very high	93.2	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.056	19%	0.189	C	C	.	.			trans	-91	75.7	-177	-67.2	-65.3	176.9	0	0	112.1	C352 R359 V533 V534 Y573	C352-E571 PolarHBondContact SG-OE1 2.69Å; R359-E571 IonicContact NH1-OE2 2.78Å; V533-E571 HydrophobicContact CG2-CB 4.28Å; V534-E571 PolarHBondContact N-O 3.01Å; E571-Y573 HydrophobicContact CB-CE2 4.17Å; E571-Y573 WeakPolarHBondContact OE2-CE2 3.23Å; E571-Y573 PolarHBondContact OE2-OH 2.79Å
572	I	95.4	Very high	93.7	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.9	175.5	-65.3	174.4	0	0	0	109.6	V534 F536 A549 L552 F569 P570	V534-I572 HydrophobicContact CB-CG1 4.28Å; V534-I572 WeakPolarHBondContact O-CA 3.33Å; F536-I572 HydrophobicContact CD2-CG2 3.86Å; F536-I572 HydrophobicContact CE2-CG2 3.7Å; A549-I572 HydrophobicContact CB-CG2 3.98Å; L552-I572 HydrophobicContact CD2-CD1 3.82Å; L552-I572 HydrophobicContact CG-CD1 4.17Å; F569-I572 HydrophobicContact CB-CD1 4.17Å; F569-I572 HydrophobicContact CB-CG1 4.37Å; F569-I572 WeakPolarHBondContact O-CD1 3.44Å; F569-I572 WeakPolarHBondContact O-CG1 3.26Å; P570-I572 PolarHBondContact O-N 3.4Å
573	Y	97	Very high	94.2	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	158.6	-178.2	-61.4	-98.9	0	0	0	113	R359 L361 V363 H372 V374 V533 V534 F536 E571	R359-Y573 VanDerWaalsContact CB-OH 3.27Å; R359-Y573 WeakPolarHBondContact CB-OH 3.29Å; R359-Y573 WeakPolarHBondContact CD-OH 3.48Å; R359-Y573 WeakPolarHBondContact CG-OH 3.24Å; L361-Y573 HydrophobicContact CB-CE1 4.06Å; L361-Y573 HydrophobicContact CD1-CD2 4.35Å; L361-Y573 HydrophobicContact CD1-CE2 4.42Å; V363-Y573 HydrophobicContact CG2-CD1 4.31Å; V363-Y573 HydrophobicContact CG2-CE1 3.76Å; H372-Y573 HydrophobicContact CB-CD1 4.04Å; H372-Y573 HydrophobicContact CB-CE1 4.29Å; H372-Y573 CarbonylContact O-C 3.58Å; H372-Y573 VanDerWaalsContact O-CA 3.27Å; H372-Y573 WeakPolarHBondContact O-CA 3.37Å; V374-Y573 HydrophobicContact CG1-CD1 3.46Å; V374-Y573 VanDerWaalsContact CG1-CD1 3.46Å; V374-Y573 HydrophobicContact CG1-CE1 4.07Å; V374-Y573 HydrophobicContact CG1-CG 3.92Å; V533-Y573 HydrophobicContact CG1-CD2 3.35Å; V533-Y573 HydrophobicContact CG1-CE2 3.48Å; V533-Y573 VanDerWaalsContact CG1-CE2 3.48Å; V534-Y573 PolarHBondContact O-N 3.04Å; F536-Y573 PolarHBondContact N-O 3.32Å; E571-Y573 HydrophobicContact CB-CE2 4.17Å; E571-Y573 WeakPolarHBondContact OE2-CE2 3.23Å; E571-Y573 PolarHBondContact OE2-OH 2.79Å
574	I	98	Very high	94.8	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.1	169.3	-52.4	-56.2	0	0	0	110	L371 H372 C373 V374 F536 A545 P546 A549 K576	L371-I574 HydrophobicContact CB-CG1 4.09Å; L371-I574 HydrophobicContact CD1-CD1 4.15Å; L371-I574 HydrophobicContact CD1-CG1 4.4Å; H372-I574 PolarHBondContact O-N 2.71Å; C373-I574 CarbonylContact C-O 3.59Å; C373-I574 WeakPolarHBondContact CA-O 3.46Å; V374-I574 PolarHBondContact N-O 3.38Å; F536-I574 HydrophobicContact CB-CD1 3.91Å; F536-I574 CarbonylContact O-C 3.53Å; F536-I574 WeakPolarHBondContact O-CA 3.03Å; A545-I574 HydrophobicContact CB-CD1 4.46Å; P546-I574 HydrophobicContact CG-CD1 4.43Å; P546-I574 HydrophobicContact CG-CG1 4.46Å; P546-I574 HydrophobicContact CG-CG2 4.5Å; A549-I574 HydrophobicContact CB-CD1 3.68Å; I574-K576 PolarHBondContact O-N 3.45Å
575	M	98.1	Very high	95.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	112.7	170.8	-172.7	-176.4	64.3	0	0	110.5	V374 T376 V379 I408 I535 F536 H537 S541 G578 F582	V374-M575 HydrophobicContact CG2-CB 4.42Å; T376-M575 HydrophobicContact CG2-CG 4.37Å; T376-M575 HydrophobicContact CG2-SD 4.25Å; V379-M575 HydrophobicContact CB-CG 4.45Å; V379-M575 HydrophobicContact CB-SD 3.86Å; V379-M575 HydrophobicContact CG1-SD 3.92Å; V379-M575 HydrophobicContact CG2-CB 4.27Å; V379-M575 HydrophobicContact CG2-CG 3.8Å; V379-M575 HydrophobicContact CG2-SD 3.8Å; I408-M575 HydrophobicContact CD1-CE 3.74Å; I408-M575 HydrophobicContact CD1-SD 4.16Å; I535-M575 HydrophobicContact CG2-CB 4.22Å; F536-M575 PolarHBondContact O-N 3.38Å; H537-M575 HydrophobicContact CB-CB 4Å; H537-M575 HydrophobicContact CB-CE 3.8Å; S541-M575 WeakPolarHBondContact CB-O 3.47Å; S541-M575 PolarHBondContact OG-O 3.42Å; M575-G578 VanDerWaalsContact CE-C 3.46Å; M575-G578 WeakPolarHBondContact CE-O 3.14Å; M575-G578 PolarHBondContact O-N 3.38Å; M575-F582 HydrophobicContact CE-CB 3.7Å; M575-F582 HydrophobicContact CE-CD2 4.34Å; M575-F582 HydrophobicContact CE-CG 4.22Å; M575-F582 HydrophobicContact SD-CB 4.09Å; M575-F582 HydrophobicContact SD-CD2 3.68Å; M575-F582 HydrophobicContact SD-CG 4.17Å
576	K	97	Very high	95.8	Very high	92 Å²	92	31.2 Å²	31.2	40%	0.4	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	135	-178.5	-173.8	163.8	174.6	166	0	111	V364 D365 C373 V374 I574 G578	V364-K576 HydrophobicContact CG2-CB 4.35Å; V364-K576 HydrophobicContact CG2-CD 3.85Å; V364-K576 PolarHBondContact O-NZ 3.24Å; D365-K576 HydrophobicContact CB-CD 3.98Å; D365-K576 VanDerWaalsContact OD2-CE 3.29Å; D365-K576 WeakPolarHBondContact OD2-CE 3.44Å; D365-K576 IonicContact OD2-NZ 2.67Å; D365-K576 PolarHBondContact OD2-NZ 3Å; C373-K576 HydrophobicContact CB-CB 4.39Å; V374-K576 WeakPolarHBondContact O-CB 3.43Å; V374-K576 PolarHBondContact O-N 2.93Å; I574-K576 PolarHBondContact O-N 3.45Å; K576-G578 PolarHBondContact O-N 2.92Å
577	G	96.5	Very high	96.2	Very high	31 Å²	31	32 Å²	32	32%	0.32	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	-12.7	-178.2	0	0	0	0	0	116	A581	G577-A581 WeakPolarHBondContact O-CB 3.36Å; G577-A581 PolarHBondContact O-N 3.16Å
578	G	97.9	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	63.5	-165.2	175	0	0	0	0	0	115.1	C538 E539 S541 M575 K576 S580 A581 F582	C538-G578 CarbonylContact O-C 3.46Å; C538-G578 WeakPolarHBondContact O-CA 3.19Å; E539-G578 CarbonylContact O-C 3.52Å; S541-G578 WeakPolarHBondContact OG-CA 3.4Å; S541-G578 PolarHBondContact OG-N 3.04Å; M575-G578 VanDerWaalsContact CE-C 3.46Å; M575-G578 WeakPolarHBondContact CE-O 3.14Å; M575-G578 PolarHBondContact O-N 3.38Å; K576-G578 PolarHBondContact O-N 2.92Å; G578-S580 PolarHBondContact O-N 3.07Å; G578-A581 PolarHBondContact O-N 2.98Å; G578-A581 VanDerWaalsContact O-N 3.14Å; G578-F582 PolarHBondContact O-N 3.25Å
579	Y	98.6	Very high	96.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-34.3	-178.4	-170.7	-103.5	0	0	0	112.2	G406 H407 I408 C538 E539 A581 F582 Y583 C590 E594 Y595	G406-Y579 WeakPolarHBondContact O-CE1 3.48Å; G406-Y579 PolarHBondContact O-OH 3.25Å; H407-Y579 PolarHBondContact N-OH 2.83Å; I408-Y579 HydrophobicContact CD1-CD2 4.44Å; I408-Y579 HydrophobicContact CG1-CD2 3.77Å; I408-Y579 HydrophobicContact CG1-CE2 3.97Å; C538-Y579 PolarHBondContact O-N 3.35Å; E539-Y579 PolarHBondContact O-N 2.59Å; Y579-A581 VanDerWaalsContact C-N 3.28Å; Y579-A581 PolarHBondContact O-N 3.43Å; Y579-F582 PolarHBondContact O-N 2.94Å; Y579-Y583 HydrophobicContact CE1-CD2 4.31Å; Y579-Y583 HydrophobicContact CE1-CG 4.21Å; Y579-Y583 WeakPolarHBondContact O-CB 3.46Å; Y579-Y583 PolarHBondContact O-N 3.15Å; Y579-C590 HydrophobicContact CE2-CB 4.37Å; Y579-C590 WeakPolarHBondContact OH-CB 3.47Å; Y579-E594 PolarHBondContact OH-O 3.35Å; Y579-Y595 AromaticContact CD1-CD2 3.75Å; Y579-Y595 HydrophobicContact CD1-CD2 3.75Å; Y579-Y595 HydrophobicContact CD1-CE2 4.35Å; Y579-Y595 HydrophobicContact CD1-CG 4.18Å; Y579-Y595 AromaticContact CE1-CD2 3.93Å; Y579-Y595 HydrophobicContact CE1-CD2 3.93Å; Y579-Y595 HydrophobicContact CE1-CG 4.06Å
580	S	98.2	Very high	97	Very high	12 Å²	12	36.2 Å²	36.2	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-30.2	178.5	-159.7	0	0	0	0	113.6	E539 F540 G578 Y595	E539-S580 WeakPolarHBondContact O-CB 3.15Å; E539-S580 PolarHBondContact O-N 3.32Å; F540-S580 WeakPolarHBondContact CE1-OG 3.39Å; G578-S580 PolarHBondContact O-N 3.07Å; S580-Y595 WeakPolarHBondContact CB-OH 3.42Å; S580-Y595 VanDerWaalsContact OG-CE1 3.28Å; S580-Y595 WeakPolarHBondContact OG-CE1 3.21Å; S580-Y595 PolarHBondContact OG-OH 2.87Å
581	A	98.1	Very high	97.3	Very high	28 Å²	28	38.7 Å²	38.7	23%	0.231	19%	0.19	C	C	.	.	H	α-helix	trans	-85.4	-43.3	172.6	0	0	0	0	0	111.8	T376 G577 G578 Y579 R584 K585	T376-A581 HydrophobicContact CG2-CB 3.94Å; G577-A581 WeakPolarHBondContact O-CB 3.36Å; G577-A581 PolarHBondContact O-N 3.16Å; G578-A581 PolarHBondContact O-N 2.98Å; G578-A581 VanDerWaalsContact O-N 3.14Å; Y579-A581 VanDerWaalsContact C-N 3.28Å; Y579-A581 PolarHBondContact O-N 3.43Å; A581-R584 PolarHBondContact O-N 3.21Å; A581-K585 PolarHBondContact O-N 3.23Å
582	F	98.5	Very high	97.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-51	-179	-174.8	-89	0	0	0	112.1	T376 V379 I383 I408 M575 G578 Y579 R584 K585 F586 L589	T376-F582 HydrophobicContact CG2-CB 4.01Å; T376-F582 HydrophobicContact CG2-CD2 4.42Å; V379-F582 HydrophobicContact CB-CE2 4.25Å; V379-F582 HydrophobicContact CG1-CD2 4.44Å; V379-F582 HydrophobicContact CG1-CE2 3.96Å; I383-F582 HydrophobicContact CD1-CE2 4.23Å; I383-F582 HydrophobicContact CD1-CZ 3.77Å; I408-F582 HydrophobicContact CB-CE1 4.34Å; I408-F582 HydrophobicContact CD1-CB 4.41Å; I408-F582 HydrophobicContact CD1-CD1 3.8Å; I408-F582 HydrophobicContact CD1-CD2 4.24Å; I408-F582 HydrophobicContact CD1-CE1 4.08Å; I408-F582 HydrophobicContact CD1-CE2 4.5Å; I408-F582 HydrophobicContact CD1-CG 3.88Å; I408-F582 HydrophobicContact CD1-CZ 4.42Å; I408-F582 HydrophobicContact CG1-CD1 3.76Å; I408-F582 HydrophobicContact CG1-CE1 3.87Å; I408-F582 HydrophobicContact CG1-CG 4.36Å; I408-F582 HydrophobicContact CG2-CE1 3.82Å; I408-F582 HydrophobicContact CG2-CZ 3.89Å; M575-F582 HydrophobicContact CE-CB 3.7Å; M575-F582 HydrophobicContact CE-CD2 4.34Å; M575-F582 HydrophobicContact CE-CG 4.22Å; M575-F582 HydrophobicContact SD-CB 4.09Å; M575-F582 HydrophobicContact SD-CD2 3.68Å; M575-F582 HydrophobicContact SD-CG 4.17Å; G578-F582 PolarHBondContact O-N 3.25Å; Y579-F582 PolarHBondContact O-N 2.94Å; F582-R584 PolarHBondContact O-N 3.07Å; F582-K585 PolarHBondContact O-N 3.25Å; F582-F586 AromaticContact CD2-CD2 3.97Å; F582-F586 HydrophobicContact CD2-CD2 3.97Å; F582-F586 HydrophobicContact CE1-CB 4.1Å; F582-F586 HydrophobicContact CE2-CB 4.45Å; F582-F586 AromaticContact CE2-CD2 3.87Å; F582-F586 HydrophobicContact CE2-CD2 3.87Å; F582-F586 HydrophobicContact CZ-CB 4.06Å; F582-F586 HydrophobicContact CZ-CD2 4.33Å; F582-F586 PolarHBondContact O-N 3.49Å; F582-L589 HydrophobicContact CE1-CB 3.85Å; F582-L589 HydrophobicContact CZ-CB 3.79Å; F582-L589 HydrophobicContact CZ-CD1 3.92Å
583	Y	98.3	Very high	97.6	Very high	61 Å²	61	46 Å²	46	24%	0.239	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-31.4	178.5	176.8	-100.7	0	0	0	112.9	Y579 P587 C590 Q593 E594 Y595	Y579-Y583 HydrophobicContact CE1-CD2 4.31Å; Y579-Y583 HydrophobicContact CE1-CG 4.21Å; Y579-Y583 WeakPolarHBondContact O-CB 3.46Å; Y579-Y583 PolarHBondContact O-N 3.15Å; Y583-P587 HydrophobicContact CD2-CB 4.2Å; Y583-P587 HydrophobicContact CE2-CB 3.96Å; Y583-P587 WeakPolarHBondContact O-CB 3.34Å; Y583-P587 VanDerWaalsContact O-CD 3.3Å; Y583-P587 WeakPolarHBondContact O-CD 3.43Å; Y583-C590 HydrophobicContact CD2-CB 4.25Å; Y583-Q593 PolarHBondContact OH-O 2.98Å; Y583-E594 WeakPolarHBondContact CE2-O 3.35Å; Y583-Y595 AromaticContact CD1-CD1 3.95Å; Y583-Y595 HydrophobicContact CD1-CD1 3.95Å; Y583-Y595 HydrophobicContact CD1-CG 4.18Å; Y583-Y595 HydrophobicContact CE1-CD1 4.46Å
584	R	98	Very high	97.6	Very high	198 Å²	198	51.3 Å²	51.3	75%	0.747	25%	0.253	S	S	*	.	H	α-helix	trans	-69.4	-32.3	177.4	-166.2	-173.7	-51.3	170.4	7.2	113	A581 F582	A581-R584 PolarHBondContact O-N 3.21Å; F582-R584 PolarHBondContact O-N 3.07Å
585	K	97.6	Very high	97.6	Very high	107 Å²	107	53.4 Å²	53.4	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-90.2	-43.1	177.8	-70.8	-171.6	172.9	-168.8	0	112.5	D377 A581 F582 P587	D377-K585 WeakPolarHBondContact OD1-CD 3.38Å; D377-K585 IonicContact OD1-NZ 2.69Å; D377-K585 PolarHBondContact OD1-NZ 3.29Å; D377-K585 IonicContact OD2-NZ 2.78Å; D377-K585 PolarHBondContact OD2-NZ 2.96Å; A581-K585 PolarHBondContact O-N 3.23Å; F582-K585 PolarHBondContact O-N 3.25Å; K585-P587 VanDerWaalsContact C-CD 3.44Å; K585-P587 WeakPolarHBondContact O-CD 3.44Å
586	F	97.5	Very high	97.6	Very high	36 Å²	36	54.1 Å²	54.1	16%	0.158	27%	0.265	C	S	.	.			trans	-129.4	55.1	-166.2	-49.1	-66	0	0	0	112.5	D377 S380 F582 H588 L589	D377-F586 HydrophobicContact CB-CZ 4.49Å; S380-F586 VanDerWaalsContact OG-CE2 3.28Å; S380-F586 WeakPolarHBondContact OG-CE2 3.38Å; S380-F586 WeakPolarHBondContact OG-CZ 3.33Å; F582-F586 AromaticContact CD2-CD2 3.97Å; F582-F586 HydrophobicContact CD2-CD2 3.97Å; F582-F586 HydrophobicContact CE1-CB 4.1Å; F582-F586 HydrophobicContact CE2-CB 4.45Å; F582-F586 AromaticContact CE2-CD2 3.87Å; F582-F586 HydrophobicContact CE2-CD2 3.87Å; F582-F586 HydrophobicContact CZ-CB 4.06Å; F582-F586 HydrophobicContact CZ-CD2 4.33Å; F582-F586 PolarHBondContact O-N 3.49Å; F586-H588 PolarHBondContact O-N 2.86Å; F586-L589 HydrophobicContact CB-CB 4.15Å; F586-L589 HydrophobicContact CB-CD1 3.98Å; F586-L589 HydrophobicContact CB-CG 4.08Å; F586-L589 HydrophobicContact CG-CD1 4.35Å; F586-L589 PolarHBondContact O-N 3.32Å
587	P	97.2	Very high	97.6	Very high	45 Å²	45	55.1 Å²	55.1	29%	0.292	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-60.9	-31.3	-179.3	26.2	-33.8	0	0	0	111.8	Y583 K585 L589 C590 Q593	Y583-P587 HydrophobicContact CD2-CB 4.2Å; Y583-P587 HydrophobicContact CE2-CB 3.96Å; Y583-P587 WeakPolarHBondContact O-CB 3.34Å; Y583-P587 VanDerWaalsContact O-CD 3.3Å; Y583-P587 WeakPolarHBondContact O-CD 3.43Å; K585-P587 VanDerWaalsContact C-CD 3.44Å; K585-P587 WeakPolarHBondContact O-CD 3.44Å; P587-L589 PolarHBondContact O-N 3Å; P587-C590 WeakPolarHBondContact O-CB 3.37Å; P587-C590 PolarHBondContact O-N 3.09Å; P587-Q593 WeakPolarHBondContact O-CG 3.12Å
588	H	97	Very high	97.6	Very high	103 Å²	103	55 Å²	55	48%	0.477	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-65.6	-14.9	174.6	66	-95.5	0	0	0	114.1	K409 F586	K409-H588 PolarHBondContact NZ-O 3.39Å; F586-H588 PolarHBondContact O-N 2.86Å
589	L	97.4	Very high	97.6	Very high	16 Å²	16	62 Å²	62	8%	0.084	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-93.5	9.1	171.7	-61.4	-174.4	0	0	0	113.1	I383 K409 F582 F586 P587	I383-L589 HydrophobicContact CB-CD1 4.37Å; I383-L589 HydrophobicContact CG2-CD1 4.29Å; I383-L589 HydrophobicContact CG2-CD2 4.08Å; K409-L589 WeakPolarHBondContact CB-O 3.21Å; K409-L589 VanDerWaalsContact CG-O 3.3Å; K409-L589 WeakPolarHBondContact CG-O 3.25Å; K409-L589 PolarHBondContact N-O 2.92Å; F582-L589 HydrophobicContact CE1-CB 3.85Å; F582-L589 HydrophobicContact CZ-CB 3.79Å; F582-L589 HydrophobicContact CZ-CD1 3.92Å; F586-L589 HydrophobicContact CB-CB 4.15Å; F586-L589 HydrophobicContact CB-CD1 3.98Å; F586-L589 HydrophobicContact CB-CG 4.08Å; F586-L589 HydrophobicContact CG-CD1 4.35Å; F586-L589 PolarHBondContact O-N 3.32Å; P587-L589 PolarHBondContact O-N 3Å
590	C	98	Very high	97.4	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.007	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	156.5	178.1	-56.7	0	0	0	0	112.5	H407 K409 Y579 Y583 P587 P592	H407-C590 CarbonylContact O-C 3.55Å; H407-C590 WeakPolarHBondContact O-CA 3.34Å; H407-C590 WeakPolarHBondContact O-CB 3.43Å; K409-C590 WeakPolarHBondContact CE-O 3.46Å; Y579-C590 HydrophobicContact CE2-CB 4.37Å; Y579-C590 WeakPolarHBondContact OH-CB 3.47Å; Y583-C590 HydrophobicContact CD2-CB 4.25Å; P587-C590 WeakPolarHBondContact O-CB 3.37Å; P587-C590 PolarHBondContact O-N 3.09Å; C590-P592 CarbonylContact C-O 3.49Å
591	T	96.1	Very high	97.3	Very high	65 Å²	65	74 Å²	74	40%	0.399	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	125.9	176.1	-59.6	0	0	0	0	110.1	H407 K409	H407-T591 PolarHBondContact CE1-O 3.2Å; H407-T591 PolarHBondContact N-O 2.99Å; H407-T591 PolarHBondContact ND1-O 3.47Å; H407-T591 PolarHBondContact O-N 3.03Å; K409-T591 VanDerWaalsContact CE-OG1 3.3Å; K409-T591 WeakPolarHBondContact CE-OG1 3.31Å; K409-T591 VanDerWaalsContact CG-OG1 3.31Å; K409-T591 WeakPolarHBondContact CG-OG1 3.41Å
592	P	97.4	Very high	97.2	Very high	50 Å²	50	77.8 Å²	77.8	33%	0.325	36%	0.355	S	S	.	.	S	Bend	cis	-50	166.9	-28.9	27	-36.6	0	0	0	111.6	E404 G406 C590 E594	E404-P592 WeakPolarHBondContact O-CD 3.22Å; G406-P592 WeakPolarHBondContact CA-O 3.22Å; C590-P592 CarbonylContact C-O 3.49Å; P592-E594 HydrophobicContact CB-CG 4.33Å; P592-E594 HydrophobicContact CG-CB 4.3Å; P592-E594 PolarHBondContact O-N 2.81Å
593	Q	97	Very high	97	Very high	117 Å²	117	81.1 Å²	81.1	55%	0.547	37%	0.368	S	S	.	.	S	Bend	trans	-78.9	57.6	176.2	-59.8	-168.3	41.5	0	0	110.6	Y583 P587	Y583-Q593 PolarHBondContact OH-O 2.98Å; P587-Q593 WeakPolarHBondContact O-CG 3.12Å
594	E	96.8	Very high	96.8	Very high	111 Å²	111	85.9 Å²	85.9	52%	0.519	39%	0.385	S	S	.	.			trans	-132.1	171.4	-176.8	-69.2	-178.3	-146	0	0	111.4	G405 Y579 Y583 P592	G405-E594 CarbonylContact O-C 3.47Å; Y579-E594 PolarHBondContact OH-O 3.35Å; Y583-E594 WeakPolarHBondContact CE2-O 3.35Å; P592-E594 HydrophobicContact CB-CG 4.33Å; P592-E594 HydrophobicContact CG-CB 4.3Å; P592-E594 PolarHBondContact O-N 2.81Å
595	Y	97.9	Very high	96.6	Very high	48 Å²	48	81.5 Å²	81.5	19%	0.188	38%	0.377	C	S	.	.			trans	-145.8	90.4	176.5	170.4	-155.8	0	0	0	111.7	E539 Y579 S580 Y583 K597	E539-Y595 HydrophobicContact CG-CE2 3.9Å; E539-Y595 WeakPolarHBondContact CG-OH 3.33Å; E539-Y595 WeakPolarHBondContact OE1-CE2 3.3Å; E539-Y595 PolarHBondContact OE1-OH 3.08Å; Y579-Y595 AromaticContact CD1-CD2 3.75Å; Y579-Y595 HydrophobicContact CD1-CD2 3.75Å; Y579-Y595 HydrophobicContact CD1-CE2 4.35Å; Y579-Y595 HydrophobicContact CD1-CG 4.18Å; Y579-Y595 AromaticContact CE1-CD2 3.93Å; Y579-Y595 HydrophobicContact CE1-CD2 3.93Å; Y579-Y595 HydrophobicContact CE1-CG 4.06Å; S580-Y595 WeakPolarHBondContact CB-OH 3.42Å; S580-Y595 VanDerWaalsContact OG-CE1 3.28Å; S580-Y595 WeakPolarHBondContact OG-CE1 3.21Å; S580-Y595 PolarHBondContact OG-OH 2.87Å; Y583-Y595 AromaticContact CD1-CD1 3.95Å; Y583-Y595 HydrophobicContact CD1-CD1 3.95Å; Y583-Y595 HydrophobicContact CD1-CG 4.18Å; Y583-Y595 HydrophobicContact CE1-CD1 4.46Å; Y595-K597 HydrophobicContact CD2-CG 4.37Å; Y595-K597 HydrophobicContact CE1-CG 4.43Å; Y595-K597 HydrophobicContact CE2-CB 4.47Å; Y595-K597 HydrophobicContact CE2-CG 3.71Å
596	V	97.5	Very high	96.4	Very high	15 Å²	15	78 Å²	78	9%	0.091	36%	0.362	C	S	.	.			trans	-77.2	126.8	166.8	173.8	0	0	0	0	110.8	Y401 G405 H600 Y603	Y401-V596 HydrophobicContact CD2-CG1 4.03Å; Y401-V596 HydrophobicContact CE2-CG1 4.36Å; G405-V596 PolarHBondContact O-N 3.35Å; V596-H600 HydrophobicContact CG1-CB 4.03Å; V596-Y603 HydrophobicContact CG1-CD2 3.82Å; V596-Y603 HydrophobicContact CG1-CE2 3.77Å; V596-Y603 HydrophobicContact CG2-CE2 4.37Å
597	K	97.8	Very high	96.3	Very high	114 Å²	114	77 Å²	77	50%	0.496	36%	0.358	S	S	.	.			trans	-85.7	151.7	179.6	-59.3	-171.4	176	174.4	0	112.3	E539 Y595 F599 H600	E539-K597 WeakPolarHBondContact OE1-CA 3.36Å; E539-K597 VanDerWaalsContact OE1-CB 3.29Å; E539-K597 WeakPolarHBondContact OE1-CB 3.17Å; E539-K597 WeakPolarHBondContact OE1-CG 3.4Å; Y595-K597 HydrophobicContact CD2-CG 4.37Å; Y595-K597 HydrophobicContact CE1-CG 4.43Å; Y595-K597 HydrophobicContact CE2-CB 4.47Å; Y595-K597 HydrophobicContact CE2-CG 3.71Å; K597-F599 PolarHBondContact O-N 3.18Å; K597-H600 WeakPolarHBondContact O-CB 3.32Å; K597-H600 PolarHBondContact O-N 3.12Å
598	M	97.1	Very high	96.2	Very high	29 Å²	29	83.3 Å²	83.3	14%	0.143	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-18	177.5	-174.2	-176.6	155.4	0	0	114.4	F399 Y401 E402 E539 R544 L607	F399-M598 HydrophobicContact CD2-CG 4.38Å; F399-M598 HydrophobicContact CE2-CE 4.03Å; F399-M598 HydrophobicContact CE2-CG 4.25Å; Y401-M598 PolarHBondContact OH-O 3.09Å; E402-M598 WeakPolarHBondContact OE1-CB 3.44Å; E539-M598 WeakPolarHBondContact OE2-CB 3.26Å; E539-M598 PolarHBondContact OE2-N 2.58Å; R544-M598 PolarHBondContact NH2-SD 3.18Å; R544-M598 VanDerWaalsContact NH2-SD 3.41Å; M598-L607 HydrophobicContact CE-CD1 4.19Å; M598-L607 HydrophobicContact CG-CD1 4.03Å; M598-L607 VanDerWaalsContact O-CD1 3.27Å; M598-L607 WeakPolarHBondContact O-CD1 3.38Å; M598-L607 WeakPolarHBondContact O-CD2 3.37Å
599	F	96.9	Very high	96	Very high	145 Å²	145	79.3 Å²	79.3	64%	0.636	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	22.4	178.9	-67.9	-93.3	0	0	0	113.2	K597 L607	K597-F599 PolarHBondContact O-N 3.18Å; F599-L607 HydrophobicContact CD1-CD2 3.9Å; F599-L607 HydrophobicContact CE1-CD2 4.31Å; F599-L607 HydrophobicContact CG-CD2 4.48Å
600	H	95.9	Very high	96	Very high	75 Å²	75	78.9 Å²	78.9	35%	0.347	36%	0.356	S	S	.	.			trans	-55	143.9	175.7	-164.1	-104.4	0	0	0	112	V596 K597 D602 Y603	V596-H600 HydrophobicContact CG1-CB 4.03Å; K597-H600 WeakPolarHBondContact O-CB 3.32Å; K597-H600 PolarHBondContact O-N 3.12Å; H600-D602 VanDerWaalsContact C-N 3.34Å; H600-D602 IonicContact CE1-OD2 3.04Å; H600-D602 PolarHBondContact CE1-OD2 2.98Å; H600-D602 IonicContact ND1-OD2 3.42Å; H600-D602 PolarHBondContact ND1-OD2 2.92Å; H600-D602 PolarHBondContact O-N 3.05Å; H600-Y603 HydrophobicContact CB-CD2 4.04Å; H600-Y603 AromaticContact ND1-CD2 3.66Å; H600-Y603 AromaticContact ND1-CE2 3.9Å
601	R	95.9	Very high	95.8	Very high	190 Å²	190	82.1 Å²	82.1	72%	0.717	37%	0.37	S	S	*	.	S	Bend	trans	-59.2	-43.8	-168.3	175.1	179	164.6	160.1	-4.7	112.5	R604	R601-R604 WeakPolarHBondContact O-CD 3.33Å; R601-R604 WeakPolarHBondContact O-CG 3.41Å
602	D	95	Very high	95.8	Very high	107 Å²	107	85.7 Å²	85.7	57%	0.572	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-30.7	-165.2	-45.2	-52.5	0	0	0	111.3	H600 R604	H600-D602 VanDerWaalsContact C-N 3.34Å; H600-D602 IonicContact CE1-OD2 3.04Å; H600-D602 PolarHBondContact CE1-OD2 2.98Å; H600-D602 IonicContact ND1-OD2 3.42Å; H600-D602 PolarHBondContact ND1-OD2 2.92Å; H600-D602 PolarHBondContact O-N 3.05Å; D602-R604 PolarHBondContact O-N 3.09Å; D602-R604 VanDerWaalsContact O-N 3.11Å
603	Y	94.7	Very high	95.7	Very high	71 Å²	71	83.5 Å²	83.5	28%	0.278	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	15	176.3	-59.1	-69.6	0	0	0	114.4	Y401 V596 H600 N605 H606 L607	Y401-Y603 AromaticContact CD2-CD1 3.82Å; Y401-Y603 HydrophobicContact CD2-CD1 3.82Å; Y401-Y603 AromaticContact CD2-CD2 3.49Å; Y401-Y603 HydrophobicContact CD2-CD2 3.49Å; Y401-Y603 VanDerWaalsContact CD2-CD2 3.49Å; Y401-Y603 HydrophobicContact CD2-CE1 4.49Å; Y401-Y603 HydrophobicContact CD2-CE2 4.22Å; Y401-Y603 AromaticContact CD2-CG 3.26Å; Y401-Y603 HydrophobicContact CD2-CG 3.26Å; Y401-Y603 VanDerWaalsContact CE2-CB 3.47Å; Y401-Y603 HydrophobicContact CE2-CD2 4.11Å; Y401-Y603 AromaticContact CE2-CG 3.9Å; Y401-Y603 HydrophobicContact CE2-CG 3.9Å; Y401-Y603 AromaticContact CG-CD1 3.82Å; Y401-Y603 HydrophobicContact CG-CD1 3.82Å; Y401-Y603 HydrophobicContact CG-CD2 4.32Å; Y401-Y603 HydrophobicContact CG-CE1 4.45Å; Y401-Y603 AromaticContact CG-CG 3.74Å; Y401-Y603 HydrophobicContact CG-CG 3.74Å; V596-Y603 HydrophobicContact CG1-CD2 3.82Å; V596-Y603 HydrophobicContact CG1-CE2 3.77Å; V596-Y603 HydrophobicContact CG2-CE2 4.37Å; H600-Y603 HydrophobicContact CB-CD2 4.04Å; H600-Y603 AromaticContact ND1-CD2 3.66Å; H600-Y603 AromaticContact ND1-CE2 3.9Å; Y603-N605 PolarHBondContact O-N 2.76Å; Y603-N605 VanDerWaalsContact O-N 3.13Å; Y603-H606 AromaticContact CD1-CD2 3.99Å; Y603-H606 PolarHBondContact O-N 3.4Å; Y603-H606 VanDerWaalsContact O-N 3.12Å; Y603-L607 WeakPolarHBondContact O-CB 3.4Å; Y603-L607 PolarHBondContact O-N 3.12Å
604	R	94.6	Very high	95.6	Very high	161 Å²	161	79.4 Å²	79.4	61%	0.608	34%	0.344	S	S	*	.	H	α-helix	trans	-53	-34.5	179.2	-85.2	171.7	178.1	-165.2	-1.2	114	R601 D602 R608	R601-R604 WeakPolarHBondContact O-CD 3.33Å; R601-R604 WeakPolarHBondContact O-CG 3.41Å; D602-R604 PolarHBondContact O-N 3.09Å; D602-R604 VanDerWaalsContact O-N 3.11Å; R604-R608 WeakPolarHBondContact O-CD 3.32Å; R604-R608 VanDerWaalsContact O-CG 3.32Å; R604-R608 WeakPolarHBondContact O-CG 3.26Å; R604-R608 PolarHBondContact O-N 2.97Å
605	N	93.3	Very high	95.6	Very high	106 Å²	106	82.9 Å²	82.9	57%	0.567	35%	0.353	S	S	*	.	H	α-helix	trans	-76.4	-44.1	177.5	-71.6	-23.2	0	0	0	112	Y603 L607 R608 L609	Y603-N605 PolarHBondContact O-N 2.76Å; Y603-N605 VanDerWaalsContact O-N 3.13Å; N605-L607 VanDerWaalsContact C-N 3.34Å; N605-L607 PolarHBondContact O-N 2.74Å; N605-R608 WeakPolarHBondContact O-CB 3.32Å; N605-R608 PolarHBondContact O-N 3.15Å; N605-R608 VanDerWaalsContact O-N 3.15Å; N605-R608 PolarHBondContact OD1-NH1 3.35Å; N605-L609 PolarHBondContact O-N 3.48Å
606	H	93.9	Very high	95.5	Very high	32 Å²	32	86 Å²	86	15%	0.148	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-45.5	171.8	-67.9	-92.5	0	0	0	111.4	Y401 Y603 R608 L609 Y610	Y401-H606 HydrophobicContact CD1-CB 3.73Å; Y401-H606 HydrophobicContact CE1-CB 4.07Å; Y401-H606 HydrophobicContact CG-CB 4.36Å; Y603-H606 AromaticContact CD1-CD2 3.99Å; Y603-H606 PolarHBondContact O-N 3.4Å; Y603-H606 VanDerWaalsContact O-N 3.12Å; H606-R608 VanDerWaalsContact C-N 3.29Å; H606-R608 PolarHBondContact O-N 3.43Å; H606-L609 WeakPolarHBondContact O-CB 3.47Å; H606-L609 PolarHBondContact O-N 3.24Å; H606-L609 VanDerWaalsContact O-N 3.11Å; H606-Y610 HydrophobicContact CB-CD2 4.02Å; H606-Y610 HydrophobicContact CB-CE2 3.86Å; H606-Y610 AromaticContact ND1-CE2 3.98Å; H606-Y610 WeakPolarHBondContact O-CD2 3.25Å; H606-Y610 PolarHBondContact O-N 2.89Å
607	L	95.4	Very high	95.4	Very high	16 Å²	16	85.3 Å²	85.3	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-56.4	-39.4	175.2	178.3	61	0	0	0	112.8	F399 M598 F599 Y603 N605 K611	F399-L607 HydrophobicContact CD2-CD1 4.32Å; F399-L607 HydrophobicContact CE2-CD1 3.92Å; M598-L607 HydrophobicContact CE-CD1 4.19Å; M598-L607 HydrophobicContact CG-CD1 4.03Å; M598-L607 VanDerWaalsContact O-CD1 3.27Å; M598-L607 WeakPolarHBondContact O-CD1 3.38Å; M598-L607 WeakPolarHBondContact O-CD2 3.37Å; F599-L607 HydrophobicContact CD1-CD2 3.9Å; F599-L607 HydrophobicContact CE1-CD2 4.31Å; F599-L607 HydrophobicContact CG-CD2 4.48Å; Y603-L607 WeakPolarHBondContact O-CB 3.4Å; Y603-L607 PolarHBondContact O-N 3.12Å; N605-L607 VanDerWaalsContact C-N 3.34Å; N605-L607 PolarHBondContact O-N 2.74Å; L607-K611 HydrophobicContact CD1-CD 3.79Å; L607-K611 VanDerWaalsContact CD1-CE 3.42Å; L607-K611 HydrophobicContact CD1-CG 4.13Å; L607-K611 HydrophobicContact CG-CD 4.12Å; L607-K611 WeakPolarHBondContact O-CB 3.44Å; L607-K611 VanDerWaalsContact O-CG 3.26Å; L607-K611 WeakPolarHBondContact O-CG 3.12Å; L607-K611 PolarHBondContact O-N 2.82Å; L607-K611 VanDerWaalsContact O-N 3.11Å
608	R	94.9	Very high	95.4	Very high	177 Å²	177	81.5 Å²	81.5	67%	0.668	35%	0.347	S	S	*	.	H	α-helix	trans	-67.8	-43.8	174.9	-73.9	164.3	168.9	175.9	-7.4	111.6	R604 N605 H606 R612	R604-R608 WeakPolarHBondContact O-CD 3.32Å; R604-R608 VanDerWaalsContact O-CG 3.32Å; R604-R608 WeakPolarHBondContact O-CG 3.26Å; R604-R608 PolarHBondContact O-N 2.97Å; N605-R608 WeakPolarHBondContact O-CB 3.32Å; N605-R608 PolarHBondContact O-N 3.15Å; N605-R608 VanDerWaalsContact O-N 3.15Å; N605-R608 PolarHBondContact OD1-NH1 3.35Å; H606-R608 VanDerWaalsContact C-N 3.29Å; H606-R608 PolarHBondContact O-N 3.43Å; R608-R612 WeakPolarHBondContact O-CB 3.33Å; R608-R612 PolarHBondContact O-N 2.85Å; R608-R612 VanDerWaalsContact O-N 3.17Å
609	L	93.3	Very high	95.3	Very high	20 Å²	20	84 Å²	84	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-62.5	-57	178.1	-179.6	63.2	0	0	0	111.2	N605 H606 K611 R612 L613 L765 V775	N605-L609 PolarHBondContact O-N 3.48Å; H606-L609 WeakPolarHBondContact O-CB 3.47Å; H606-L609 PolarHBondContact O-N 3.24Å; H606-L609 VanDerWaalsContact O-N 3.11Å; L609-K611 PolarHBondContact O-N 3.13Å; L609-R612 WeakPolarHBondContact O-CB 3.49Å; L609-R612 PolarHBondContact O-N 2.83Å; L609-L613 WeakPolarHBondContact O-CB 3.19Å; L609-L613 PolarHBondContact O-N 3.13Å; L609-L765 HydrophobicContact CD1-CD2 3.78Å; L609-L765 HydrophobicContact CG-CD2 4.45Å; L609-V775 HydrophobicContact CD2-CG1 3.8Å; L609-V775 HydrophobicContact CD2-CG2 4Å
610	Y	96.2	Very high	95.3	Very high	6 Å²	6	78.1 Å²	78.1	2%	0.024	35%	0.346	C	S	.	.	H	α-helix	trans	-65	-37.4	-177	-65.6	-62.3	0	0	0	112.5	F399 P400 Y401 F415 H606 R612 L613 T614 I782	F399-Y610 HydrophobicContact CB-CD2 3.97Å; F399-Y610 HydrophobicContact CB-CG 4.13Å; F399-Y610 VanDerWaalsContact CD1-CB 3.48Å; F399-Y610 HydrophobicContact CD1-CG 4.11Å; F399-Y610 HydrophobicContact CG-CD2 4.33Å; F399-Y610 HydrophobicContact CG-CG 4.14Å; P400-Y610 HydrophobicContact CG-CE1 3.86Å; P400-Y610 HydrophobicContact CG-CE2 4.46Å; Y401-Y610 AromaticContact CD1-CD2 3.89Å; Y401-Y610 HydrophobicContact CD1-CD2 3.89Å; Y401-Y610 AromaticContact CD1-CE2 3.86Å; Y401-Y610 HydrophobicContact CD1-CE2 3.86Å; Y401-Y610 AromaticContact CE1-CD2 3.92Å; Y401-Y610 HydrophobicContact CE1-CD2 3.92Å; Y401-Y610 HydrophobicContact CE1-CE2 4.37Å; F415-Y610 HydrophobicContact CD2-CD1 4.23Å; F415-Y610 AromaticContact CE2-CD1 3.53Å; F415-Y610 HydrophobicContact CE2-CD1 3.53Å; F415-Y610 AromaticContact CE2-CE1 3.97Å; F415-Y610 HydrophobicContact CE2-CE1 3.97Å; F415-Y610 AromaticContact CZ-CD1 3.85Å; F415-Y610 HydrophobicContact CZ-CD1 3.85Å; F415-Y610 AromaticContact CZ-CE1 3.77Å; F415-Y610 HydrophobicContact CZ-CE1 3.77Å; H606-Y610 HydrophobicContact CB-CD2 4.02Å; H606-Y610 HydrophobicContact CB-CE2 3.86Å; H606-Y610 AromaticContact ND1-CE2 3.98Å; H606-Y610 WeakPolarHBondContact O-CD2 3.25Å; H606-Y610 PolarHBondContact O-N 2.89Å; Y610-R612 VanDerWaalsContact C-N 3.31Å; Y610-R612 PolarHBondContact O-N 2.9Å; Y610-L613 HydrophobicContact CD1-CD2 4.39Å; Y610-L613 PolarHBondContact O-N 2.93Å; Y610-T614 WeakPolarHBondContact O-CB 3.42Å; Y610-T614 PolarHBondContact O-N 2.74Å; Y610-T614 PolarHBondContact O-OG1 2.86Å; Y610-I782 HydrophobicContact CE1-CD1 4Å
611	K	95.2	Very high	95.3	Very high	69 Å²	69	74.6 Å²	74.6	30%	0.3	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-34.4	171.1	-80.2	176.3	171.4	166.2	0	113.3	F399 L607 L609 R615	F399-K611 HydrophobicContact CE2-CG 4.25Å; F399-K611 HydrophobicContact CZ-CG 4.13Å; L607-K611 HydrophobicContact CD1-CD 3.79Å; L607-K611 VanDerWaalsContact CD1-CE 3.42Å; L607-K611 HydrophobicContact CD1-CG 4.13Å; L607-K611 HydrophobicContact CG-CD 4.12Å; L607-K611 WeakPolarHBondContact O-CB 3.44Å; L607-K611 VanDerWaalsContact O-CG 3.26Å; L607-K611 WeakPolarHBondContact O-CG 3.12Å; L607-K611 PolarHBondContact O-N 2.82Å; L607-K611 VanDerWaalsContact O-N 3.11Å; L609-K611 PolarHBondContact O-N 3.13Å; K611-R615 VanDerWaalsContact O-CB 3.27Å; K611-R615 WeakPolarHBondContact O-CB 3.44Å; K611-R615 PolarHBondContact O-N 3.21Å
612	R	94.8	Very high	95.2	Very high	140 Å²	140	69 Å²	69	53%	0.528	31%	0.313	S	S	.	.	H	α-helix	trans	-72	-44.7	174.7	-177.2	-173.8	-70	176	-3.6	110.9	R608 L609 Y610 R616 T764	R608-R612 WeakPolarHBondContact O-CB 3.33Å; R608-R612 PolarHBondContact O-N 2.85Å; R608-R612 VanDerWaalsContact O-N 3.17Å; L609-R612 WeakPolarHBondContact O-CB 3.49Å; L609-R612 PolarHBondContact O-N 2.83Å; Y610-R612 VanDerWaalsContact C-N 3.31Å; Y610-R612 PolarHBondContact O-N 2.9Å; R612-R616 WeakPolarHBondContact O-CG 3.27Å; R612-R616 PolarHBondContact O-N 2.9Å; R612-T764 HydrophobicContact CG-CG2 4.43Å
613	L	95.1	Very high	95.2	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-60.8	-179	-175	62.7	0	0	0	111.7	F415 L609 Y610 R615 R616 V617 I761 T764 L765	F415-L613 HydrophobicContact CE2-CD2 4.04Å; F415-L613 HydrophobicContact CZ-CD2 4.39Å; L609-L613 WeakPolarHBondContact O-CB 3.19Å; L609-L613 PolarHBondContact O-N 3.13Å; Y610-L613 HydrophobicContact CD1-CD2 4.39Å; Y610-L613 PolarHBondContact O-N 2.93Å; L613-R615 VanDerWaalsContact C-N 3.26Å; L613-R615 PolarHBondContact O-N 3.22Å; L613-R616 PolarHBondContact O-N 3.29Å; L613-R616 VanDerWaalsContact O-N 3.08Å; L613-V617 HydrophobicContact CD1-CG2 4.05Å; L613-V617 HydrophobicContact CG-CG2 4.4Å; L613-V617 WeakPolarHBondContact O-CG2 3.33Å; L613-V617 PolarHBondContact O-N 2.92Å; L613-I761 HydrophobicContact CD1-CB 4.48Å; L613-I761 HydrophobicContact CD1-CG1 4.15Å; L613-T764 HydrophobicContact CB-CG2 4.48Å; L613-T764 HydrophobicContact CD1-CG2 3.85Å; L613-L765 HydrophobicContact CD1-CD1 3.96Å; L613-L765 HydrophobicContact CD1-CD2 4.11Å; L613-L765 HydrophobicContact CD1-CG 4.02Å; L613-L765 HydrophobicContact CD2-CD1 3.95Å; L613-L765 HydrophobicContact CD2-CD2 4.26Å
614	T	95.9	Very high	95.1	Very high	31 Å²	31	64.8 Å²	64.8	19%	0.19	31%	0.305	C	S	.	.	H	α-helix	trans	-57.1	-37.9	-179.5	-60.8	0	0	0	0	111.8	F415 Y610 S618	F415-T614 WeakPolarHBondContact O-CG2 3.29Å; F415-T614 PolarHBondContact O-OG1 3.31Å; F415-T614 VanDerWaalsContact O-OG1 3.08Å; Y610-T614 WeakPolarHBondContact O-CB 3.42Å; Y610-T614 PolarHBondContact O-N 2.74Å; Y610-T614 PolarHBondContact O-OG1 2.86Å; T614-S618 WeakPolarHBondContact O-CB 3.02Å; T614-S618 PolarHBondContact O-N 2.91Å
615	R	95.9	Very high	94.8	Very high	184 Å²	184	58.6 Å²	58.6	69%	0.694	28%	0.283	S	S	*	.	H	α-helix	trans	-63.1	-46.9	175.9	-173.8	-171.6	-60.9	146.6	0.1	112.4	K611 L613 S619	K611-R615 VanDerWaalsContact O-CB 3.27Å; K611-R615 WeakPolarHBondContact O-CB 3.44Å; K611-R615 PolarHBondContact O-N 3.21Å; L613-R615 VanDerWaalsContact C-N 3.26Å; L613-R615 PolarHBondContact O-N 3.22Å; R615-S619 VanDerWaalsContact O-CB 3.27Å; R615-S619 WeakPolarHBondContact O-CB 3.31Å; R615-S619 PolarHBondContact O-N 3.21Å
616	R	96.4	Very high	94.2	Very high	115 Å²	115	60.3 Å²	60.3	43%	0.434	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-48	179.5	-76.6	-179.6	168.7	-173.3	-5.5	111.3	R612 L613 S619 A620 V760 T764	R612-R616 WeakPolarHBondContact O-CG 3.27Å; R612-R616 PolarHBondContact O-N 2.9Å; L613-R616 PolarHBondContact O-N 3.29Å; L613-R616 VanDerWaalsContact O-N 3.08Å; R616-S619 PolarHBondContact O-N 2.96Å; R616-A620 PolarHBondContact O-N 2.8Å; R616-A620 VanDerWaalsContact O-N 3.1Å; R616-V760 HydrophobicContact CB-CG1 3.7Å; R616-T764 WeakPolarHBondContact CD-OG1 3.41Å; R616-T764 PolarHBondContact NH1-OG1 3.43Å; R616-T764 VanDerWaalsContact NH1-OG1 3.1Å
617	V	96.3	Very high	92.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-47.1	-179.9	178.6	0	0	0	0	110.8	H417 L613 S619 A620 C621 V760 I761	H417-V617 HydrophobicContact CB-CG1 4.48Å; L613-V617 HydrophobicContact CD1-CG2 4.05Å; L613-V617 HydrophobicContact CG-CG2 4.4Å; L613-V617 WeakPolarHBondContact O-CG2 3.33Å; L613-V617 PolarHBondContact O-N 2.92Å; V617-S619 PolarHBondContact O-N 3Å; V617-A620 PolarHBondContact O-N 3.25Å; V617-C621 WeakPolarHBondContact O-CB 3.28Å; V617-C621 PolarHBondContact O-N 3.12Å; V617-C621 PolarHBondContact O-SG 2.9Å; V617-C621 VanDerWaalsContact O-SG 3.37Å; V617-V760 HydrophobicContact CG2-CB 4.46Å; V617-V760 HydrophobicContact CG2-CG1 3.99Å; V617-I761 HydrophobicContact CG2-CD1 4.41Å; V617-I761 HydrophobicContact CG2-CG1 3.54Å
618	S	96.1	Very high	90.6	Very high	33 Å²	33	71.8 Å²	71.8	23%	0.231	35%	0.349	C	S	.	.	H	α-helix	trans	-57.4	-49.7	175.3	176.8	0	0	0	0	111.6	H417 T614 A620 C621 M622	H417-S618 VanDerWaalsContact CE1-CB 3.5Å; H417-S618 WeakPolarHBondContact CE1-CB 3.34Å; H417-S618 PolarHBondContact CE1-OG 3.35Å; H417-S618 VanDerWaalsContact CE1-OG 3.31Å; H417-S618 VanDerWaalsContact NE2-CB 3.35Å; H417-S618 WeakPolarHBondContact NE2-CB 3.27Å; H417-S618 PolarHBondContact NE2-OG 3.12Å; T614-S618 WeakPolarHBondContact O-CB 3.02Å; T614-S618 PolarHBondContact O-N 2.91Å; S618-A620 PolarHBondContact O-N 2.96Å; S618-C621 PolarHBondContact O-N 3.09Å; S618-M622 WeakPolarHBondContact O-CB 3.3Å; S618-M622 WeakPolarHBondContact O-CG 3.46Å; S618-M622 PolarHBondContact O-N 2.71Å
619	S	96	Very high	88.1	Confident	83 Å²	83	71.9 Å²	71.9	58%	0.58	36%	0.357	S	S	*	.	H	α-helix	trans	-59.9	-31.2	179.4	-170.5	0	0	0	0	113.5	R615 R616 V617	R615-S619 VanDerWaalsContact O-CB 3.27Å; R615-S619 WeakPolarHBondContact O-CB 3.31Å; R615-S619 PolarHBondContact O-N 3.21Å; R616-S619 PolarHBondContact O-N 2.96Å; V617-S619 PolarHBondContact O-N 3Å
620	A	96.1	Very high	85.5	Confident	21 Å²	21	76.6 Å²	76.6	17%	0.174	39%	0.387	C	S	.	.	H	α-helix	trans	-82.8	-47.4	178.9	0	0	0	0	0	112.1	R616 V617 S618 M622 A623 C624 V756 V760	R616-A620 PolarHBondContact O-N 2.8Å; R616-A620 VanDerWaalsContact O-N 3.1Å; V617-A620 PolarHBondContact O-N 3.25Å; S618-A620 PolarHBondContact O-N 2.96Å; A620-M622 VanDerWaalsContact C-N 3.33Å; A620-M622 PolarHBondContact O-N 3.07Å; A620-A623 WeakPolarHBondContact O-CB 3.31Å; A620-A623 PolarHBondContact O-N 3.42Å; A620-C624 PolarHBondContact O-N 3.23Å; A620-C624 PolarHBondContact O-SG 3.18Å; A620-V756 HydrophobicContact CB-CG1 3.73Å; A620-V760 HydrophobicContact CB-CB 4.49Å; A620-V760 HydrophobicContact CB-CG2 3.75Å
621	C	96.4	Very high	82.7	Confident	0 Å²	0	84 Å²	84	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-64.7	-35.1	177.1	-64.9	0	0	0	0	112.4	H417 F551 V617 S618 A623 C624 V753	H417-C621 HydrophobicContact CB-CB 3.52Å; F551-C621 HydrophobicContact CE2-CB 4.14Å; F551-C621 HydrophobicContact CZ-CB 3.81Å; V617-C621 WeakPolarHBondContact O-CB 3.28Å; V617-C621 PolarHBondContact O-N 3.12Å; V617-C621 PolarHBondContact O-SG 2.9Å; V617-C621 VanDerWaalsContact O-SG 3.37Å; S618-C621 PolarHBondContact O-N 3.09Å; C621-A623 VanDerWaalsContact C-N 3.26Å; C621-A623 PolarHBondContact O-N 3.16Å; C621-C624 WeakPolarHBondContact O-CB 3.47Å; C621-C624 PolarHBondContact O-N 2.86Å; C621-V753 HydrophobicContact CB-CG1 4.13Å; C621-V753 PolarHBondContact SG-O 3.32Å
622	M	94.5	Very high	80	Confident	74 Å²	74	87.4 Å²	87.4	37%	0.365	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-65.9	-27.3	171.3	-71.2	-67.8	-64.2	0	0	112.6	F551 S618 A620 C624 I625	F551-M622 HydrophobicContact CD2-CG 4.45Å; F551-M622 HydrophobicContact CD2-SD 3.47Å; F551-M622 WeakPolarHBondContact CD2-SD 3.33Å; F551-M622 HydrophobicContact CE2-SD 4.05Å; F551-M622 HydrophobicContact CG-SD 4.46Å; S618-M622 WeakPolarHBondContact O-CB 3.3Å; S618-M622 WeakPolarHBondContact O-CG 3.46Å; S618-M622 PolarHBondContact O-N 2.71Å; A620-M622 VanDerWaalsContact C-N 3.33Å; A620-M622 PolarHBondContact O-N 3.07Å; M622-C624 VanDerWaalsContact C-N 3.3Å; M622-I625 PolarHBondContact O-N 3.25Å
623	A	94.4	Very high	77.1	Confident	56 Å²	56	86.4 Å²	86.4	46%	0.463	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-75	-19.4	176.2	0	0	0	0	0	112.6	A620 C621 I625	A620-A623 WeakPolarHBondContact O-CB 3.31Å; A620-A623 PolarHBondContact O-N 3.42Å; C621-A623 VanDerWaalsContact C-N 3.26Å; C621-A623 PolarHBondContact O-N 3.16Å; A623-I625 VanDerWaalsContact C-N 3.3Å
624	C	92.5	Very high	74.2	Confident	32 Å²	32	94.4 Å²	94.4	22%	0.216	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-72.1	-20.9	173.1	-54.7	0	0	0	0	113.7	A620 C621 M622 L749 V752 V753	A620-C624 PolarHBondContact O-N 3.23Å; A620-C624 PolarHBondContact O-SG 3.18Å; C621-C624 WeakPolarHBondContact O-CB 3.47Å; C621-C624 PolarHBondContact O-N 2.86Å; M622-C624 VanDerWaalsContact C-N 3.3Å; C624-L749 HydrophobicContact CB-CD1 4.31Å; C624-L749 VanDerWaalsContact O-CD1 3.31Å; C624-L749 WeakPolarHBondContact O-CD1 3.37Å; C624-V752 HydrophobicContact CB-CG1 4.23Å; C624-V753 HydrophobicContact CB-CG2 3.66Å
625	I	88	Confident	71.5	Confident	31 Å²	31	97.6 Å²	97.6	16%	0.159	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-23.8	-174.8	-54.3	-177.8	0	0	0	111.6	F551 S554 V555 V558 M622 A623 L749	F551-I625 HydrophobicContact CD2-CD1 3.79Å; F551-I625 HydrophobicContact CE2-CD1 3.31Å; F551-I625 HydrophobicContact CE2-CG1 4.32Å; F551-I625 HydrophobicContact CZ-CD1 4.05Å; S554-I625 WeakPolarHBondContact OG-CD1 3.22Å; V555-I625 HydrophobicContact CG2-CD1 3.48Å; V555-I625 VanDerWaalsContact CG2-CD1 3.48Å; V555-I625 HydrophobicContact CG2-CG1 4.46Å; V558-I625 HydrophobicContact CG2-CG2 3.92Å; M622-I625 PolarHBondContact O-N 3.25Å; A623-I625 VanDerWaalsContact C-N 3.3Å; I625-L749 HydrophobicContact CG1-CD1 4.27Å
626	K	80.6	Confident	68.6	Low	143 Å²	143	98.4 Å²	98.4	62%	0.622	52%	0.523	S	S	*	.	S	Bend	trans	-69.7	134.9	176.6	-70.9	-179.7	178.7	-170.7	0	109.8	Q628	K626-Q628 PolarHBondContact O-N 3.32Å
627	P	62.6	Low	65.6	Low	113 Å²	113	99.3 Å²	99.3	73%	0.734	54%	0.535	S	S	*	.			trans	-57.8	128.4	167.9	26	-33	0	0	0	108.3	Q629	P627-Q629 PolarHBondContact O-N 2.96Å
628	Q	51.8	Low	62.5	Low	176 Å²	176	104.3 Å²	104.3	82%	0.822	57%	0.567	S	S	*	*			trans	-71.7	112.1	167.4	-66.1	-168.4	21.9	0	0	106.8	K626 T630	K626-Q628 PolarHBondContact O-N 3.32Å; Q628-T630 VanDerWaalsContact C-N 3.34Å; Q628-T630 PolarHBondContact O-N 3.48Å
629	Q	42.7	Very low	59.5	Low	178 Å²	178	109.9 Å²	109.9	83%	0.832	60%	0.6	S	S	*	*			trans	-63.7	102.9	162.4	-70.9	179.6	-35.2	0	0	106.5	P627 E631	P627-Q629 PolarHBondContact O-N 2.96Å; Q629-E631 PolarHBondContact O-N 3.44Å; Q629-E631 VanDerWaalsContact O-N 3.08Å
630	T	38.5	Very low	56.5	Low	119 Å²	119	110.1 Å²	110.1	73%	0.73	60%	0.601	S	S	*	*			trans	-63.7	106.2	171.4	24.9	0	0	0	0	107.9	Q628 V632	Q628-T630 VanDerWaalsContact C-N 3.34Å; Q628-T630 PolarHBondContact O-N 3.48Å; T630-V632 PolarHBondContact O-N 3.34Å
631	E	36	Very low	53.7	Low	163 Å²	163	118.1 Å²	118.1	76%	0.762	64%	0.635	S	S	*	*			trans	-69.1	82.4	169.8	-75	-160.5	-177.4	0	0	109.4	Q629 D633 K634	Q629-E631 PolarHBondContact O-N 3.44Å; Q629-E631 VanDerWaalsContact O-N 3.08Å; E631-D633 PolarHBondContact O-N 2.85Å; E631-K634 IonicContact OE2-NZ 3.71Å
632	V	40.1	Very low	51	Low	140 Å²	140	124.8 Å²	124.8	85%	0.848	68%	0.676	S	S	*	*			trans	-73.8	61	165.3	-170.6	0	0	0	0	108.5	T630	T630-V632 PolarHBondContact O-N 3.34Å
633	D	32.4	Very low	47.9	Very low	118 Å²	118	129.1 Å²	129.1	63%	0.631	70%	0.7	S	S	*	*			trans	-156	61.4	-174.9	-170.5	16	0	0	0	111.2	E631	E631-D633 PolarHBondContact O-N 2.85Å
634	K	34	Very low	45	Very low	172 Å²	172	131 Å²	131	75%	0.748	71%	0.71	S	S	*	*			trans	-176.9	64	159.5	-103.8	161.4	-117.7	74.4	0	113.2	E631	E631-K634 IonicContact OE2-NZ 3.71Å
635	S	39.3	Very low	42.1	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	74%	0.743	S	S	*	*			trans	-139.1	109.6	157.5	46.8	0	0	0	0	110	I637	S635-I637 PolarHBondContact O-N 3.46Å; S635-I637 VanDerWaalsContact O-N 3.09Å
636	Q	34.8	Very low	39.5	Very low	202 Å²	202	145.2 Å²	145.2	94%	0.944	78%	0.778	S	S	*	*			trans	-79.2	88.3	173.8	-72.5	177	-32	0	0	108.9
637	I	34.1	Very low	37.2	Very low	133 Å²	133	147.2 Å²	147.2	68%	0.682	79%	0.789	S	S	*	*			trans	-84	118.9	167.2	-58.8	177.8	0	0	0	107.2	S635 V639	S635-I637 PolarHBondContact O-N 3.46Å; S635-I637 VanDerWaalsContact O-N 3.09Å; I637-V639 PolarHBondContact O-N 3.42Å; I637-V639 VanDerWaalsContact O-N 3.16Å
638	P	30.7	Very low	35.6	Very low	106 Å²	106	150 Å²	150	69%	0.688	80%	0.797	S	S	*	*			trans	-71.8	109	178.5	28.8	-32.6	0	0	0	109.9	S640	P638-S640 PolarHBondContact O-N 3.27Å
639	V	34.7	Very low	34.7	Very low	150 Å²	150	146.7 Å²	146.7	91%	0.909	79%	0.791	S	S	*	*			trans	-77.7	85.7	174.2	-80.4	0	0	0	0	110.9	I637	I637-V639 PolarHBondContact O-N 3.42Å; I637-V639 VanDerWaalsContact O-N 3.16Å
640	S	33.3	Very low	34.2	Very low	88 Å²	88	146.8 Å²	146.8	62%	0.615	80%	0.796	S	S	*	*			trans	-133.3	141.5	163.2	51.1	0	0	0	0	108.7	P638	P638-S640 PolarHBondContact O-N 3.27Å
641	E	36	Very low	33.9	Very low	188 Å²	188	147 Å²	147	88%	0.879	79%	0.793	S	S	*	*	S	Bend	trans	67.2	58.9	178.8	-57	-167.2	106	0	0	117.8
642	V	39.2	Very low	33.7	Very low	141 Å²	141	147.3 Å²	147.3	86%	0.855	80%	0.799	S	S	*	*			trans	-140	48.4	149.4	-141.8	0	0	0	0	113.7	S644	V642-S644 PolarHBondContact O-N 2.97Å
643	D	31	Very low	33.4	Very low	165 Å²	165	148.9 Å²	148.9	88%	0.882	79%	0.794	S	S	*	*			trans	-73	85.4	171.4	-86.3	-51.2	0	0	0	112
644	S	33.5	Very low	33.6	Very low	96 Å²	96	149.5 Å²	149.5	67%	0.671	80%	0.802	S	S	*	*			trans	-175.4	156.3	152.9	-85.7	0	0	0	0	112.9	V642	V642-S644 PolarHBondContact O-N 2.97Å
645	Y	31.9	Very low	33.5	Very low	229 Å²	229	144.6 Å²	144.6	90%	0.898	80%	0.8	S	S	*	*			trans	65.8	54.4	173.2	-72.6	-81.7	0	0	0	117.9
646	C	31.5	Very low	33.1	Very low	132 Å²	132	146.4 Å²	146.4	89%	0.892	81%	0.807	S	S	*	*			trans	-124.3	59	157	-86	0	0	0	0	112.2
647	Q	32.6	Very low	33.1	Very low	185 Å²	185	145.9 Å²	145.9	86%	0.864	80%	0.804	S	S	*	*			trans	-141.6	77.5	173.3	-72	-168.7	-0.3	0	0	112.9
648	L	29.2	Very low	33	Very low	170 Å²	170	142.7 Å²	142.7	89%	0.89	80%	0.804	S	S	*	*			trans	-140.4	110.2	156.8	-79.7	-177.5	0	0	0	110
649	P	33	Very low	33.1	Very low	107 Å²	107	145.6 Å²	145.6	70%	0.695	81%	0.81	S	S	*	*			trans	-85	125.8	177.7	32	-31.5	0	0	0	111.1	N651	P649-N651 PolarHBondContact O-N 3.16Å
650	L	32	Very low	33	Very low	181 Å²	181	145.3 Å²	145.3	95%	0.948	80%	0.803	S	S	*	*			trans	-75.2	62.5	171.4	-72.2	176.1	0	0	0	112.3	L652	L650-L652 PolarHBondContact O-N 2.93Å
651	N	32.2	Very low	33.1	Very low	123 Å²	123	146.6 Å²	146.6	66%	0.658	81%	0.807	S	S	*	*			trans	-88.3	87.7	157.9	-105.4	-81.3	0	0	0	107.9	P649 K653	P649-N651 PolarHBondContact O-N 3.16Å; N651-K653 PolarHBondContact O-N 3.09Å
652	L	31.2	Very low	32.9	Very low	170 Å²	170	143.4 Å²	143.4	89%	0.89	80%	0.8	S	S	*	*			trans	-75.7	65	173.9	-165.4	71.1	0	0	0	110.7	L650 V654	L650-L652 PolarHBondContact O-N 2.93Å; L652-V654 PolarHBondContact O-N 3.3Å
653	K	35.6	Very low	32.7	Very low	173 Å²	173	146 Å²	146	75%	0.752	80%	0.803	S	S	*	*			trans	-92.4	99.3	-177.7	-148.8	164.8	-169.3	169.1	0	107.8	N651 G655	N651-K653 PolarHBondContact O-N 3.09Å; K653-G655 PolarHBondContact O-N 3.44Å
654	V	35.1	Very low	32.9	Very low	131 Å²	131	147.2 Å²	147.2	79%	0.794	80%	0.8	S	S	*	*			trans	-57.7	107.3	-179.2	177.9	0	0	0	0	109.3	L652 V656	L652-V654 PolarHBondContact O-N 3.3Å; V654-V656 PolarHBondContact O-N 2.95Å; V654-V656 VanDerWaalsContact O-N 3.13Å
655	G	32.3	Very low	32.8	Very low	69 Å²	69	148 Å²	148	71%	0.711	80%	0.803	S	S	*	*			trans	-77.6	96.3	-171.5	0	0	0	0	0	112.4	K653 H657	K653-G655 PolarHBondContact O-N 3.44Å; G655-H657 PolarHBondContact O-N 3.4Å; G655-H657 VanDerWaalsContact O-N 3.11Å
656	V	30.5	Very low	33.2	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	80%	0.797	S	S	*	*			trans	-76.7	93.3	167.7	-176	0	0	0	0	108.8	V654	V654-V656 PolarHBondContact O-N 2.95Å; V654-V656 VanDerWaalsContact O-N 3.13Å
657	H	35.4	Very low	33.2	Very low	190 Å²	190	141.9 Å²	141.9	88%	0.88	79%	0.788	S	S	*	*			trans	-101.3	112.2	166.5	-121.4	-82	0	0	0	109.2	G655	G655-H657 PolarHBondContact O-N 3.4Å; G655-H657 VanDerWaalsContact O-N 3.11Å
658	G	31.7	Very low	33.1	Very low	66 Å²	66	143.5 Å²	143.5	68%	0.68	79%	0.788	S	S	*	*			trans	-83.5	146.9	-171.4	0	0	0	0	0	114
659	M	33.4	Very low	33.1	Very low	168 Å²	168	141.7 Å²	141.7	83%	0.828	78%	0.775	S	S	*	*			trans	-128.9	123.1	152.4	-76.2	-158.9	72.8	0	0	110.3
660	L	32.2	Very low	32.9	Very low	143 Å²	143	146.7 Å²	146.7	75%	0.749	79%	0.786	S	S	*	*			trans	53.1	140.8	151.4	-88	61.4	0	0	0	121.8
661	T	35.3	Very low	32.6	Very low	115 Å²	115	147.5 Å²	147.5	71%	0.706	78%	0.776	S	S	*	*			trans	59.7	96	149.9	53.2	0	0	0	0	119
662	T	31.2	Very low	32.6	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	78%	0.778	S	S	*	*				41.5	103.4	126.6	55.7	0	0	0	0	118.6
663	H	35.9	Very low	32.6	Very low	195 Å²	195	144.4 Å²	144.4	90%	0.903	77%	0.768	S	S	*	*				-163.6	173.8	124.1	-101.9	-68.1	0	0	0	110.7
664	K	35.6	Very low	32.5	Very low	192 Å²	192	143.3 Å²	143.3	84%	0.835	77%	0.766	S	S	*	*			trans	-79.3	150.9	-167.5	-64.5	176.7	179.5	176.9	0	113
665	P	30.7	Very low	32.5	Very low	112 Å²	112	142.7 Å²	142.7	73%	0.727	76%	0.758	S	S	*	*			trans	-74.6	143.3	168.9	32.2	-34.6	0	0	0	111.6	T667	P665-T667 PolarHBondContact O-N 3.02Å
666	P	41	Very low	32.2	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	77%	0.766	S	S	*	*			trans	-81.3	105.7	171.2	31.2	-31.6	0	0	0	110.9
667	T	30.7	Very low	32.2	Very low	115 Å²	115	147 Å²	147	71%	0.706	77%	0.768	S	S	*	*			trans	-70.3	129.3	162.9	-54.9	0	0	0	0	109.6	P665 Q669	P665-T667 PolarHBondContact O-N 3.02Å; T667-Q669 HydrophobicContact CG2-CG 4.13Å
668	Y	31.2	Very low	31.8	Very low	218 Å²	218	145.9 Å²	145.9	86%	0.855	77%	0.765	S	S	*	*			trans	-107.9	106.6	157.2	-93.6	-81.3	0	0	0	109.4
669	Q	28.8	Very low	31.8	Very low	133 Å²	133	151.7 Å²	151.7	62%	0.621	77%	0.774	S	S	*	*			trans	-95.8	141.4	154.2	-71.3	-171.5	-3.9	0	0	107.7	T667	T667-Q669 HydrophobicContact CG2-CG 4.13Å
670	F	28.5	Very low	31.6	Very low	212 Å²	212	152 Å²	152	93%	0.93	77%	0.774	S	S	*	*			trans	-108.8	135.7	139.3	-120.7	-92.3	0	0	0	107.4
671	R	26.5	Very low	31.7	Very low	197 Å²	197	152.3 Å²	152.3	74%	0.743	78%	0.776	S	S	*	*			trans	-146.2	167.3	-171.8	-158.9	-176.2	-175.2	-156.7	0.6	107.5
672	S	31	Very low	31.5	Very low	101 Å²	101	153.4 Å²	153.4	71%	0.706	78%	0.777	S	S	*	*			trans	68.9	143.6	177.7	71.4	0	0	0	0	115.6
673	N	31.6	Very low	31.6	Very low	127 Å²	127	152.9 Å²	152.9	68%	0.679	78%	0.779	S	S	*	*			cis	-153.1	171.6	-17.5	-91.9	-6.5	0	0	0	105
674	H	35	Very low	31.4	Very low	150 Å²	150	150.7 Å²	150.7	69%	0.694	77%	0.772	S	S	*	*			cis	-146.1	142	23.2	-98.9	-73.7	0	0	0	111.9
675	D	33.2	Very low	31.2	Very low	118 Å²	118	145.7 Å²	145.7	63%	0.631	76%	0.761	S	S	*	*			trans	24.3	110.9	132.2	-47.4	-43.9	0	0	0	121
676	L	27	Very low	31.2	Very low	167 Å²	167	146.1 Å²	146.1	87%	0.874	76%	0.758	S	S	*	*				30.3	117.3	114.3	-63.7	166.7	0	0	0	118.8
677	C	29.7	Very low	30.8	Very low	128 Å²	128	148 Å²	148	87%	0.865	76%	0.76	S	S	*	*				-151.8	149.8	110.8	-141.2	0	0	0	0	112
678	M	26.9	Very low	30.9	Very low	167 Å²	167	148.8 Å²	148.8	82%	0.823	77%	0.765	S	S	*	*			trans	-95	136.4	160.8	-70.1	-74.5	-177.5	0	0	107.4
679	H	33	Very low	30.8	Very low	188 Å²	188	144.8 Å²	144.8	87%	0.87	76%	0.758	S	S	*	*				-168.4	150.5	127.6	-109.5	-74.5	0	0	0	110.7
680	E	28.6	Very low	31.1	Very low	175 Å²	175	149 Å²	149	82%	0.818	77%	0.77	S	S	*	*			trans	-74.3	148.4	171	-54.2	172	127.9	0	0	109.4
681	D	35.4	Very low	31.4	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	76%	0.757	S	S	*	*				-166.1	178.1	106.4	-131.6	-44.7	0	0	0	113.1
682	N	30.2	Very low	31.6	Very low	138 Å²	138	142 Å²	142	74%	0.738	75%	0.753	S	S	*	*			trans	-86.7	-177	-168.8	-66.7	-93.5	0	0	0	114.3
683	S	34.2	Very low	31.9	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	75%	0.753	S	S	*	*			trans	88.2	149.5	161.5	85.7	0	0	0	0	117.4
684	I	31.6	Very low	32	Very low	149 Å²	149	145.6 Å²	145.6	76%	0.764	75%	0.751	S	S	*	*			cis	-167.2	143.9	-36.1	-114	153.1	0	0	0	107.9
685	S	29.6	Very low	31.9	Very low	87 Å²	87	143.8 Å²	143.8	61%	0.608	75%	0.747	S	S	*	*			trans	57	167.8	159	69.9	0	0	0	0	123
686	D	32.5	Very low	32	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	76%	0.757	S	S	*	*			trans	77.3	109.3	156.7	-52.6	-42.8	0	0	0	118.6
687	L	31.3	Very low	32	Very low	156 Å²	156	145.5 Å²	145.5	82%	0.817	75%	0.751	S	S	*	*				73.2	140.4	90.7	-66.9	167.1	0	0	0	112.3
688	V	33.4	Very low	32.4	Very low	132 Å²	132	144.8 Å²	144.8	80%	0.8	74%	0.744	S	S	*	*			cis	-145.4	164.4	30.4	-171.1	0	0	0	0	111
689	N	28.6	Very low	32.7	Very low	135 Å²	135	142.5 Å²	142.5	72%	0.722	75%	0.745	S	S	*	*			trans	-65.4	155.1	170	-63.5	-30.8	0	0	0	114.8
690	Y	34.7	Very low	32.6	Very low	222 Å²	222	137 Å²	137	87%	0.871	74%	0.739	S	S	*	*			trans	-158.9	100.1	142	-105.2	-77.2	0	0	0	107.3
691	E	34.9	Very low	33.1	Very low	142 Å²	142	135.3 Å²	135.3	66%	0.664	74%	0.743	S	S	*	*				75.3	111	72.3	-75.5	-135.8	117.2	0	0	116.6
692	N	31.8	Very low	32.9	Very low	120 Å²	120	136.5 Å²	136.5	64%	0.642	74%	0.744	S	S	*	*			trans	62.1	122.8	135.9	-50.9	-27.8	0	0	0	121.8
693	K	36.7	Very low	33.1	Very low	166 Å²	166	137.7 Å²	137.7	72%	0.722	75%	0.749	S	S	*	*				173.6	124.1	109.5	-93.6	177.2	-177.3	-72.9	0	111.7
694	E	34.1	Very low	32.8	Very low	136 Å²	136	137.7 Å²	137.7	64%	0.636	75%	0.748	S	S	*	*				70.8	138	96	-71.2	-175.3	-131.7	0	0	114.5
695	N	33.6	Very low	32.9	Very low	113 Å²	113	136.1 Å²	136.1	60%	0.604	75%	0.751	S	S	*	*			cis	-161.9	177.9	3.4	-93.6	-29.7	0	0	0	112.1
696	Y	33.4	Very low	33.1	Very low	216 Å²	216	140.7 Å²	140.7	85%	0.847	76%	0.76	S	S	*	*			trans	85.8	120.6	153	-72.4	-68.6	0	0	0	123.6
697	S	27.2	Very low	33.2	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	77%	0.765	S	S	*	*			trans	-117.1	-173.1	141.3	-60.6	0	0	0	0	106.9
698	P	38.3	Very low	33.3	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	77%	0.766	S	S	*	*			cis	-144.6	-162.3	6.4	44.9	-24.2	0	0	0	116.3
699	S	33.9	Very low	33.4	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	76%	0.755	S	S	*	*			trans	83	155.5	152.9	69.8	0	0	0	0	121.7
700	G	30.2	Very low	33.7	Very low	73 Å²	73	139.8 Å²	139.8	75%	0.753	76%	0.755	S	S	*	*			trans	-103.3	-146	-173	0	0	0	0	0	115
701	P	39.3	Very low	33.7	Very low	139 Å²	139	136.7 Å²	136.7	90%	0.903	75%	0.748	S	S	*	*			cis	-140.4	-130.4	25.5	43.9	-21.5	0	0	0	116.5
702	E	31.3	Very low	33.6	Very low	173 Å²	173	134.6 Å²	134.6	81%	0.808	75%	0.749	S	S	*	*			trans	-81.3	179.1	-154.2	-53.2	-173.8	129	0	0	120.6
703	L	33.8	Very low	33.5	Very low	163 Å²	163	134.5 Å²	134.5	85%	0.853	76%	0.757	S	S	*	*			trans	110.1	154.4	152.8	-62.3	160.6	0	0	0	117.3
704	C	28.7	Very low	33.4	Very low	110 Å²	110	132.9 Å²	132.9	74%	0.743	76%	0.763	S	S	*	*				170.1	121.1	-50.5	170.9	0	0	0	0	110.5
705	S	34.3	Very low	33.2	Very low	117 Å²	117	131.6 Å²	131.6	82%	0.818	77%	0.769	S	S	*	*			trans	162.5	170.4	148.6	43.4	0	0	0	0	115
706	K	33.6	Very low	33.2	Very low	183 Å²	183	135.4 Å²	135.4	80%	0.796	78%	0.783	S	S	*	*			cis	179.7	108.3	-43.6	-175.9	179.6	-175.3	-178.4	0	113.8
707	S	34.3	Very low	33	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	78%	0.781	S	S	*	*			trans	-178.7	137.9	154.3	47.1	0	0	0	0	109.6
708	Q	34.1	Very low	33.3	Very low	178 Å²	178	133.3 Å²	133.3	83%	0.832	78%	0.782	S	S	*	*			cis	76.5	134.2	43.4	-75	-171.2	-25.7	0	0	113.7
709	S	35	Very low	32.8	Very low	82 Å²	82	134.5 Å²	134.5	57%	0.573	78%	0.783	S	S	*	*			cis	-167.7	167.2	18.5	51.7	0	0	0	0	115.9
710	H	35.3	Very low	32.8	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.718	79%	0.785	S	S	*	*			trans	66	155.8	156.4	-55.7	-51.4	0	0	0	117.8
711	H	34.6	Very low	32.7	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.727	79%	0.789	S	S	*	*			cis	-169.1	164.5	-19.1	-108.5	-44	0	0	0	107.7
712	S	31.7	Very low	32.6	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	77%	0.772	S	S	*	*			cis	-163.3	-175.9	-13.6	-140.8	0	0	0	0	110
713	C	29.7	Very low	32.6	Very low	119 Å²	119	140.6 Å²	140.6	80%	0.804	77%	0.771	S	S	*	*			trans	-130.4	165.3	166	-54.6	0	0	0	0	110.8
714	P	35.3	Very low	32.4	Very low	131 Å²	131	140.4 Å²	140.4	85%	0.851	77%	0.771	S	S	*	*				-150.3	175.6	95.7	40.6	-23.4	0	0	0	116.4
715	S	29.5	Very low	32.5	Very low	109 Å²	109	140 Å²	140	76%	0.762	78%	0.776	S	S	*	*			trans	-96.3	161.3	178	53.8	0	0	0	0	114.2
716	H	34.5	Very low	32.4	Very low	194 Å²	194	142.8 Å²	142.8	90%	0.898	78%	0.778	S	S	*	*			trans	-143.7	149.4	164.2	-115.8	-95.8	0	0	0	113.4
717	N	28.6	Very low	32.5	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	78%	0.779	S	S	*	*			trans	-81.1	162.9	175.3	-66.2	-29.9	0	0	0	111.2
718	V	33.3	Very low	32.5	Very low	127 Å²	127	139.3 Å²	139.3	77%	0.77	78%	0.779	S	S	*	*				-176.3	157.3	82.7	157.2	0	0	0	0	110.5
719	N	27.2	Very low	32.3	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	78%	0.777	S	S	*	*			trans	-31.8	161.4	167.2	-32.9	-20.3	0	0	0	116.1
720	E	33.7	Very low	32.2	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	79%	0.785	S	S	*	*			cis	-153.4	-179.1	42.2	-67.9	-169.2	139	0	0	114.9
721	E	28.7	Very low	32.1	Very low	180 Å²	180	135.7 Å²	135.7	84%	0.841	79%	0.788	S	S	*	*			trans	-89.9	-177.8	174.6	-107.6	-165	108.2	0	0	112.7
722	P	37.5	Very low	31.9	Very low	85 Å²	85	135 Å²	135	55%	0.552	79%	0.794	S	S	*	*			cis	-138.3	-171.4	-30.2	31.3	-9.4	0	0	0	114.6
723	K	30.7	Very low	32	Very low	178 Å²	178	139.5 Å²	139.5	77%	0.774	81%	0.805	S	S	*	*			trans	108.4	122	151.4	-61.6	161.4	-177.2	172.6	0	120.1
724	N	29.3	Very low	32.1	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	81%	0.807	S	S	*	*			trans	41.3	124.8	137.7	-50.6	-1.2	0	0	0	119.4
725	A	32.2	Very low	31.6	Very low	102 Å²	102	136.9 Å²	136.9	84%	0.843	80%	0.803	S	S	*	*				-167.5	173.3	60.9	0	0	0	0	0	113.5
726	M	32	Very low	31.6	Very low	175 Å²	175	139.5 Å²	139.5	86%	0.862	81%	0.808	S	S	*	*			trans	-100.4	153.1	174.2	-70.2	-179.6	63.4	0	0	112.4
727	P	35.8	Very low	31.4	Very low	127 Å²	127	138.4 Å²	138.4	83%	0.825	80%	0.803	S	S	*	*				-142.5	178.5	105.2	34.3	-18.1	0	0	0	112.2
728	A	33.2	Very low	31.3	Very low	93 Å²	93	137.4 Å²	137.4	77%	0.769	80%	0.803	S	S	*	*			cis	-155.9	171.7	-28.1	0	0	0	0	0	108
729	S	30.3	Very low	31.3	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	81%	0.808	S	S	*	*			trans	-91.8	161.8	-171.1	53.4	0	0	0	0	115.4
730	P	34	Very low	31.9	Very low	113 Å²	113	134.1 Å²	134.1	73%	0.734	80%	0.796	S	S	*	*			trans	-114	141.1	146.4	36	-28.1	0	0	0	113.5
731	S	32.6	Very low	32.2	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	79%	0.785	S	S	*	*			trans	44.5	121.4	148.8	60.1	0	0	0	0	121.2
732	V	30.1	Very low	33.1	Very low	143 Å²	143	124.5 Å²	124.5	87%	0.867	77%	0.766	S	S	*	*			trans	-117.3	128.5	163.8	174.9	0	0	0	0	109.7
733	E	33.9	Very low	33.6	Very low	192 Å²	192	125.8 Å²	125.8	90%	0.897	77%	0.772	S	S	*	*			trans	-130.3	152.6	166.4	-70.9	-166.2	132.8	0	0	110.6
734	G	31.3	Very low	34.6	Very low	83 Å²	83	123.8 Å²	123.8	86%	0.856	77%	0.77	S	S	*	*			trans	80.6	63.9	163.1	0	0	0	0	0	117.6
735	C	25.2	Very low	36.4	Very low	113 Å²	113	117.5 Å²	117.5	76%	0.764	74%	0.739	S	S	*	*			trans	-113.2	75.5	171.4	-165.7	0	0	0	0	112.2
736	D	29.8	Very low	38.2	Very low	163 Å²	163	114.6 Å²	114.6	87%	0.872	71%	0.711	S	S	*	*			trans	-147.2	37.1	-179.7	-108.3	-37.7	0	0	0	113.6
737	Q	29.4	Very low	40.8	Very low	171 Å²	171	106.6 Å²	106.6	80%	0.799	67%	0.672	S	S	*	*			trans	-137.5	71.3	176	-67.7	-165.5	24.5	0	0	113.3
738	V	27.9	Very low	43.3	Very low	130 Å²	130	100.7 Å²	100.7	79%	0.788	63%	0.634	S	S	*	*			trans	-123.9	67.2	176.4	-167.4	0	0	0	0	111
739	S	33.4	Very low	46.1	Very low	125 Å²	125	97.6 Å²	97.6	87%	0.874	60%	0.604	S	S	*	*	S	Bend	trans	-154.1	-17.8	173.7	-78.8	0	0	0	0	116.9
740	S	38.5	Very low	49	Very low	71 Å²	71	92.2 Å²	92.2	50%	0.497	57%	0.567	S	S	.	*	S	Bend	trans	-100.9	-47.1	-174.8	48.7	0	0	0	0	114.9	V742 V743	S740-V742 PolarHBondContact O-N 2.96Å; S740-V743 WeakPolarHBondContact O-CG2 3.32Å; S740-V743 PolarHBondContact O-N 3.14Å
741	S	41.2	Very low	51.9	Low	92 Å²	92	87.5 Å²	87.5	64%	0.643	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-5.1	-165	59.5	0	0	0	0	117.3
742	V	47.5	Very low	54.8	Low	73 Å²	73	84.8 Å²	84.8	44%	0.442	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-24.6	-177.1	-177.4	0	0	0	0	112.4	S740	S740-V742 PolarHBondContact O-N 2.96Å
743	V	47.7	Very low	57.9	Low	113 Å²	113	78 Å²	78	69%	0.685	47%	0.472	S	S	*	.	S	Bend	trans	-87.3	-24.8	-174.1	-68.6	0	0	0	0	114.9	S740 S745	S740-V743 WeakPolarHBondContact O-CG2 3.32Å; S740-V743 PolarHBondContact O-N 3.14Å; V743-S745 VanDerWaalsContact C-N 3.27Å; V743-S745 PolarHBondContact O-N 3.15Å
744	D	50.3	Low	60.8	Low	136 Å²	136	68.9 Å²	68.9	73%	0.727	43%	0.43	S	S	*	.	S	Bend	trans	-76.8	-7.7	-173.3	-63.1	-44.2	0	0	0	114.8
745	S	67.9	Low	63.8	Low	28 Å²	28	67.2 Å²	67.2	20%	0.196	40%	0.398	C	S	.	.	S	Bend	trans	-80.4	136.1	171.6	-171.8	0	0	0	0	110.7	R450 V743 L747 G748	R450-S745 VanDerWaalsContact NH2-CB 3.3Å; R450-S745 PolarHBondContact NH2-OG 2.95Å; R450-S745 VanDerWaalsContact NH2-OG 3.07Å; V743-S745 VanDerWaalsContact C-N 3.27Å; V743-S745 PolarHBondContact O-N 3.15Å; S745-L747 PolarHBondContact O-N 3.41Å; S745-G748 PolarHBondContact O-N 2.92Å
746	P	70.1	Confident	67.1	Low	41 Å²	41	64 Å²	64	27%	0.266	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.1	175.8	23.4	-34.6	0	0	0	114	S559 Y568	S559-P746 VanDerWaalsContact CB-O 3.27Å; S559-P746 WeakPolarHBondContact CB-O 3.38Å; S559-P746 PolarHBondContact OG-O 2.9Å; Y568-P746 WeakPolarHBondContact OH-CB 3.41Å
747	L	85.7	Confident	70.3	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.037	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-6.4	176.1	-56.1	-177.9	0	0	0	114.1	F425 L443 D446 S745 L749 A750 E751	F425-L747 HydrophobicContact CD1-CD2 3.99Å; F425-L747 HydrophobicContact CE1-CD2 3.76Å; L443-L747 HydrophobicContact CB-CD2 3.94Å; L443-L747 HydrophobicContact CD1-CD2 4.11Å; L443-L747 HydrophobicContact CD2-CD2 4.28Å; L443-L747 HydrophobicContact CG-CD2 4.32Å; D446-L747 HydrophobicContact CB-CD1 3.33Å; S745-L747 PolarHBondContact O-N 3.41Å; L747-L749 PolarHBondContact O-N 2.9Å; L747-A750 PolarHBondContact O-N 3.01Å; L747-A750 VanDerWaalsContact O-N 3.16Å; L747-E751 VanDerWaalsContact O-CB 3.22Å; L747-E751 WeakPolarHBondContact O-CB 3.47Å; L747-E751 PolarHBondContact O-N 2.95Å
748	G	88.6	Confident	73.4	Confident	3 Å²	3	53.3 Å²	53.3	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-43.3	-178.4	0	0	0	0	0	112.6	S745 E751 V752	S745-G748 PolarHBondContact O-N 2.92Å; G748-E751 PolarHBondContact O-N 2.93Å; G748-V752 WeakPolarHBondContact O-CB 3.29Å; G748-V752 VanDerWaalsContact O-CG2 3.3Å; G748-V752 WeakPolarHBondContact O-CG2 3.44Å; G748-V752 PolarHBondContact O-N 3.44Å
749	L	92.1	Very high	76.5	Confident	28 Å²	28	56 Å²	56	15%	0.147	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-47	173.5	176.9	61.6	0	0	0	112.2	V555 V558 C624 I625 L747 E751 V752 V753	V555-L749 HydrophobicContact CG1-CD2 4.32Å; V558-L749 HydrophobicContact CB-CD2 3.7Å; V558-L749 HydrophobicContact CG1-CD2 3.71Å; C624-L749 HydrophobicContact CB-CD1 4.31Å; C624-L749 VanDerWaalsContact O-CD1 3.31Å; C624-L749 WeakPolarHBondContact O-CD1 3.37Å; I625-L749 HydrophobicContact CG1-CD1 4.27Å; L747-L749 PolarHBondContact O-N 2.9Å; L749-E751 VanDerWaalsContact C-N 3.34Å; L749-E751 PolarHBondContact O-N 2.64Å; L749-V752 PolarHBondContact O-N 2.77Å; L749-V753 HydrophobicContact CD1-CG2 4.11Å; L749-V753 HydrophobicContact CG-CG2 4.44Å; L749-V753 WeakPolarHBondContact O-CB 3.49Å; L749-V753 VanDerWaalsContact O-CG2 3.32Å; L749-V753 WeakPolarHBondContact O-CG2 3.05Å; L749-V753 PolarHBondContact O-N 3.4Å
750	A	92.7	Very high	79.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-43	-179.7	0	0	0	0	0	111.5	V421 F425 L447 L747 V753 V754	V421-A750 HydrophobicContact CG1-CB 3.55Å; F425-A750 HydrophobicContact CD1-CB 4.27Å; F425-A750 HydrophobicContact CE1-CB 3.64Å; F425-A750 HydrophobicContact CZ-CB 3.99Å; L447-A750 HydrophobicContact CD1-CB 3.7Å; L747-A750 PolarHBondContact O-N 3.01Å; L747-A750 VanDerWaalsContact O-N 3.16Å; A750-V753 PolarHBondContact O-N 2.88Å; A750-V754 VanDerWaalsContact O-CG2 3.28Å; A750-V754 WeakPolarHBondContact O-CG2 3.43Å; A750-V754 PolarHBondContact O-N 3.19Å
751	E	93	Very high	82.1	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.065	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-46.9	174.2	174.5	-177.7	173.3	0	0	112	L447 R450 L451 L747 G748 L749 V754 R755	L447-E751 HydrophobicContact CD1-CB 4.33Å; R450-E751 HydrophobicContact CB-CG 4.33Å; R450-E751 WeakPolarHBondContact CB-OE2 3.34Å; R450-E751 VanDerWaalsContact CD-OE2 3.29Å; R450-E751 WeakPolarHBondContact CD-OE2 3.41Å; R450-E751 IonicContact CZ-OE2 2.74Å; R450-E751 IonicContact NE-OE2 2.71Å; R450-E751 IonicContact NH1-OE2 3.91Å; R450-E751 PolarHBondContact NH1-OE2 2.96Å; L451-E751 HydrophobicContact CD2-CG 4.4Å; L747-E751 VanDerWaalsContact O-CB 3.22Å; L747-E751 WeakPolarHBondContact O-CB 3.47Å; L747-E751 PolarHBondContact O-N 2.95Å; G748-E751 PolarHBondContact O-N 2.93Å; L749-E751 VanDerWaalsContact C-N 3.34Å; L749-E751 PolarHBondContact O-N 2.64Å; E751-V754 PolarHBondContact O-N 3.21Å; E751-R755 PolarHBondContact O-N 3.18Å; E751-R755 IonicContact OE1-CZ 3.17Å; E751-R755 IonicContact OE1-NH1 3.99Å; E751-R755 PolarHBondContact OE1-NH1 2.84Å; E751-R755 IonicContact OE1-NH2 2.73Å; E751-R755 PolarHBondContact OE1-NH2 3.48Å
752	V	94	Very high	84.4	Confident	55 Å²	55	48.3 Å²	48.3	33%	0.333	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-48.3	175.3	168.1	0	0	0	0	111.3	C624 G748 L749 V754 R755 V756	C624-V752 HydrophobicContact CB-CG1 4.23Å; G748-V752 WeakPolarHBondContact O-CB 3.29Å; G748-V752 VanDerWaalsContact O-CG2 3.3Å; G748-V752 WeakPolarHBondContact O-CG2 3.44Å; G748-V752 PolarHBondContact O-N 3.44Å; L749-V752 PolarHBondContact O-N 2.77Å; V752-V754 VanDerWaalsContact C-N 3.29Å; V752-V754 PolarHBondContact O-N 3.11Å; V752-R755 PolarHBondContact O-N 2.76Å; V752-V756 HydrophobicContact CG1-CG2 4.18Å; V752-V756 WeakPolarHBondContact O-CB 3.27Å; V752-V756 WeakPolarHBondContact O-CG2 3.31Å; V752-V756 PolarHBondContact O-N 3.45Å
753	V	95.2	Very high	86.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55.7	-43.9	177.3	162.2	0	0	0	0	111.3	V421 F551 C621 C624 L749 A750 G757	V421-V753 HydrophobicContact CB-CG1 4.36Å; V421-V753 HydrophobicContact CG2-CG1 3.95Å; F551-V753 HydrophobicContact CE1-CG1 4.31Å; F551-V753 HydrophobicContact CZ-CG1 3.82Å; F551-V753 HydrophobicContact CZ-CG2 4.48Å; C621-V753 HydrophobicContact CB-CG1 4.13Å; C621-V753 PolarHBondContact SG-O 3.32Å; C624-V753 HydrophobicContact CB-CG2 3.66Å; L749-V753 HydrophobicContact CD1-CG2 4.11Å; L749-V753 HydrophobicContact CG-CG2 4.44Å; L749-V753 WeakPolarHBondContact O-CB 3.49Å; L749-V753 VanDerWaalsContact O-CG2 3.32Å; L749-V753 WeakPolarHBondContact O-CG2 3.05Å; L749-V753 PolarHBondContact O-N 3.4Å; A750-V753 PolarHBondContact O-N 2.88Å; V753-G757 PolarHBondContact O-N 2.87Å
754	V	95.1	Very high	88.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-46	179	173.9	0	0	0	0	111.5	V421 Q422 L451 A750 E751 V752 G757 R758	V421-V754 HydrophobicContact CB-CG2 4.27Å; V421-V754 HydrophobicContact CG1-CG2 4.13Å; Q422-V754 HydrophobicContact CB-CG2 4.08Å; L451-V754 HydrophobicContact CD1-CB 4.27Å; L451-V754 HydrophobicContact CD1-CG1 3.67Å; L451-V754 HydrophobicContact CD2-CB 4.15Å; L451-V754 HydrophobicContact CD2-CG1 3.86Å; L451-V754 HydrophobicContact CG-CG1 4.45Å; A750-V754 VanDerWaalsContact O-CG2 3.28Å; A750-V754 WeakPolarHBondContact O-CG2 3.43Å; A750-V754 PolarHBondContact O-N 3.19Å; E751-V754 PolarHBondContact O-N 3.21Å; V752-V754 VanDerWaalsContact C-N 3.29Å; V752-V754 PolarHBondContact O-N 3.11Å; V754-G757 PolarHBondContact O-N 3.27Å; V754-R758 HydrophobicContact CG1-CG 4.26Å; V754-R758 VanDerWaalsContact O-CB 3.32Å; V754-R758 WeakPolarHBondContact O-CB 3.05Å; V754-R758 VanDerWaalsContact O-CG 3.26Å; V754-R758 WeakPolarHBondContact O-CG 3.13Å; V754-R758 PolarHBondContact O-N 3.49Å
755	R	94.4	Very high	90.2	Very high	49 Å²	49	36.7 Å²	36.7	19%	0.185	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-42.2	177.4	-69.5	-154.4	-167.7	89.6	6.6	112.6	R450 L451 T454 E751 V752 R759	R450-R755 PolarHBondContact O-NH2 3.43Å; L451-R755 HydrophobicContact CD2-CG 3.68Å; T454-R755 VanDerWaalsContact CG2-CZ 3.44Å; T454-R755 VanDerWaalsContact CG2-NH2 3.28Å; T454-R755 PolarHBondContact OG1-NE 3.09Å; T454-R755 PolarHBondContact OG1-NH2 3.38Å; E751-R755 PolarHBondContact O-N 3.18Å; E751-R755 IonicContact OE1-CZ 3.17Å; E751-R755 IonicContact OE1-NH1 3.99Å; E751-R755 PolarHBondContact OE1-NH1 2.84Å; E751-R755 IonicContact OE1-NH2 2.73Å; E751-R755 PolarHBondContact OE1-NH2 3.48Å; V752-R755 PolarHBondContact O-N 2.76Å; R755-R759 WeakPolarHBondContact O-CB 3.36Å; R755-R759 WeakPolarHBondContact O-CG 3.38Å; R755-R759 PolarHBondContact O-N 2.79Å
756	V	95.5	Very high	90.6	Very high	45 Å²	45	38.5 Å²	38.5	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-47.9	177.6	168.9	0	0	0	0	110.9	A620 V752 R759 V760	A620-V756 HydrophobicContact CB-CG1 3.73Å; V752-V756 HydrophobicContact CG1-CG2 4.18Å; V752-V756 WeakPolarHBondContact O-CB 3.27Å; V752-V756 WeakPolarHBondContact O-CG2 3.31Å; V752-V756 PolarHBondContact O-N 3.45Å; V756-R759 PolarHBondContact O-N 3.27Å; V756-V760 WeakPolarHBondContact O-CG2 3.39Å; V756-V760 PolarHBondContact O-N 3.06Å
757	G	95.7	Very high	90.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-47.1	177.7	0	0	0	0	0	112.6	V753 V754 R759 V760 I761	V753-G757 PolarHBondContact O-N 2.87Å; V754-G757 PolarHBondContact O-N 3.27Å; G757-R759 PolarHBondContact O-N 3.27Å; G757-V760 PolarHBondContact O-N 2.93Å; G757-V760 VanDerWaalsContact O-N 3.09Å; G757-I761 WeakPolarHBondContact O-CG1 3.29Å; G757-I761 PolarHBondContact O-N 2.87Å
758	R	94.6	Very high	88.9	Confident	109 Å²	109	42.1 Å²	42.1	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-57.1	-43.4	174.9	-74.8	176.2	177.1	-169.1	0.7	112.5	V754 V760 I761 A762	V754-R758 HydrophobicContact CG1-CG 4.26Å; V754-R758 VanDerWaalsContact O-CB 3.32Å; V754-R758 WeakPolarHBondContact O-CB 3.05Å; V754-R758 VanDerWaalsContact O-CG 3.26Å; V754-R758 WeakPolarHBondContact O-CG 3.13Å; V754-R758 PolarHBondContact O-N 3.49Å; R758-V760 VanDerWaalsContact C-N 3.35Å; R758-V760 PolarHBondContact O-N 3.42Å; R758-I761 PolarHBondContact O-N 2.92Å; R758-A762 WeakPolarHBondContact O-CB 3.32Å; R758-A762 PolarHBondContact O-N 3.31Å
759	R	93.8	Very high	86.9	Confident	188 Å²	188	48.3 Å²	48.3	71%	0.709	28%	0.277	S	S	*	.	H	α-helix	trans	-60.6	-41.4	174.4	-76.7	176.7	177	-175.1	-0.4	112	R755 V756 G757 A762 A763	R755-R759 WeakPolarHBondContact O-CB 3.36Å; R755-R759 WeakPolarHBondContact O-CG 3.38Å; R755-R759 PolarHBondContact O-N 2.79Å; V756-R759 PolarHBondContact O-N 3.27Å; G757-R759 PolarHBondContact O-N 3.27Å; R759-A762 PolarHBondContact O-N 3.34Å; R759-A763 WeakPolarHBondContact O-CB 3.47Å; R759-A763 PolarHBondContact O-N 3.42Å
760	V	94.6	Very high	85	Confident	33 Å²	33	54.7 Å²	54.7	20%	0.2	31%	0.311	C	S	.	.	H	α-helix	trans	-74.8	-32	179.9	173.3	0	0	0	0	112.9	R616 V617 A620 V756 G757 R758 T764	R616-V760 HydrophobicContact CB-CG1 3.7Å; V617-V760 HydrophobicContact CG2-CB 4.46Å; V617-V760 HydrophobicContact CG2-CG1 3.99Å; A620-V760 HydrophobicContact CB-CB 4.49Å; A620-V760 HydrophobicContact CB-CG2 3.75Å; V756-V760 WeakPolarHBondContact O-CG2 3.39Å; V756-V760 PolarHBondContact O-N 3.06Å; G757-V760 PolarHBondContact O-N 2.93Å; G757-V760 VanDerWaalsContact O-N 3.09Å; R758-V760 VanDerWaalsContact C-N 3.35Å; R758-V760 PolarHBondContact O-N 3.42Å; V760-T764 WeakPolarHBondContact O-CB 3.36Å; V760-T764 PolarHBondContact O-N 3.4Å; V760-T764 PolarHBondContact O-OG1 2.71Å
761	I	93.9	Very high	82.8	Confident	29 Å²	29	62.4 Å²	62.4	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-60.1	-57.3	167.1	-72	176.9	0	0	0	109.1	T416 C418 L613 V617 G757 R758 A763 T764 L765	T416-I761 HydrophobicContact CG2-CD1 4.45Å; C418-I761 VanDerWaalsContact SG-CD1 3.5Å; L613-I761 HydrophobicContact CD1-CB 4.48Å; L613-I761 HydrophobicContact CD1-CG1 4.15Å; V617-I761 HydrophobicContact CG2-CD1 4.41Å; V617-I761 HydrophobicContact CG2-CG1 3.54Å; G757-I761 WeakPolarHBondContact O-CG1 3.29Å; G757-I761 PolarHBondContact O-N 2.87Å; R758-I761 PolarHBondContact O-N 2.92Å; I761-A763 PolarHBondContact O-N 2.74Å; I761-T764 PolarHBondContact O-N 2.96Å; I761-T764 VanDerWaalsContact O-N 3.12Å; I761-L765 HydrophobicContact CG2-CD1 3.64Å; I761-L765 WeakPolarHBondContact O-CB 3.22Å; I761-L765 VanDerWaalsContact O-CG 3.27Å; I761-L765 WeakPolarHBondContact O-CG 3.48Å; I761-L765 PolarHBondContact O-N 3.07Å
762	A	91.2	Very high	80.7	Confident	64 Å²	64	64.4 Å²	64.4	53%	0.529	37%	0.367	S	S	.	.	H	α-helix	trans	-55.8	-48.1	-179.8	0	0	0	0	0	112.2	R758 R759 T764 L765 G766	R758-A762 WeakPolarHBondContact O-CB 3.32Å; R758-A762 PolarHBondContact O-N 3.31Å; R759-A762 PolarHBondContact O-N 3.34Å; A762-T764 PolarHBondContact O-N 3.17Å; A762-L765 PolarHBondContact O-N 2.73Å; A762-G766 PolarHBondContact O-N 2.86Å
763	A	90.4	Very high	78.8	Confident	59 Å²	59	65.4 Å²	65.4	49%	0.488	38%	0.376	S	S	.	.	H	α-helix	trans	-63.1	-39.7	177.4	0	0	0	0	0	112.8	R759 I761 L765 S767	R759-A763 WeakPolarHBondContact O-CB 3.47Å; R759-A763 PolarHBondContact O-N 3.42Å; I761-A763 PolarHBondContact O-N 2.74Å; A763-L765 VanDerWaalsContact C-N 3.33Å; A763-L765 PolarHBondContact O-N 3.3Å; A763-S767 WeakPolarHBondContact O-CB 3.21Å; A763-S767 PolarHBondContact O-N 2.81Å; A763-S767 VanDerWaalsContact O-N 3.17Å; A763-S767 PolarHBondContact O-OG 3.42Å
764	T	89.2	Confident	76.7	Confident	4 Å²	4	70.5 Å²	70.5	3%	0.025	40%	0.4	C	S	.	.	H	α-helix	trans	-72.2	-27.8	-178	-62.2	0	0	0	0	113.2	R612 L613 R616 V760 I761 A762	R612-T764 HydrophobicContact CG-CG2 4.43Å; L613-T764 HydrophobicContact CB-CG2 4.48Å; L613-T764 HydrophobicContact CD1-CG2 3.85Å; R616-T764 WeakPolarHBondContact CD-OG1 3.41Å; R616-T764 PolarHBondContact NH1-OG1 3.43Å; R616-T764 VanDerWaalsContact NH1-OG1 3.1Å; V760-T764 WeakPolarHBondContact O-CB 3.36Å; V760-T764 PolarHBondContact O-N 3.4Å; V760-T764 PolarHBondContact O-OG1 2.71Å; I761-T764 PolarHBondContact O-N 2.96Å; I761-T764 VanDerWaalsContact O-N 3.12Å; A762-T764 PolarHBondContact O-N 3.17Å
765	L	86.4	Confident	74.6	Confident	15 Å²	15	71.5 Å²	71.5	8%	0.079	41%	0.406	C	S	.	.	H	α-helix	trans	-102	-28.8	-174	-56.2	174	0	0	0	111.6	L609 L613 I761 A762 A763 S767 T768 L779	L609-L765 HydrophobicContact CD1-CD2 3.78Å; L609-L765 HydrophobicContact CG-CD2 4.45Å; L613-L765 HydrophobicContact CD1-CD1 3.96Å; L613-L765 HydrophobicContact CD1-CD2 4.11Å; L613-L765 HydrophobicContact CD1-CG 4.02Å; L613-L765 HydrophobicContact CD2-CD1 3.95Å; L613-L765 HydrophobicContact CD2-CD2 4.26Å; I761-L765 HydrophobicContact CG2-CD1 3.64Å; I761-L765 WeakPolarHBondContact O-CB 3.22Å; I761-L765 VanDerWaalsContact O-CG 3.27Å; I761-L765 WeakPolarHBondContact O-CG 3.48Å; I761-L765 PolarHBondContact O-N 3.07Å; A762-L765 PolarHBondContact O-N 2.73Å; A763-L765 VanDerWaalsContact C-N 3.33Å; A763-L765 PolarHBondContact O-N 3.3Å; L765-S767 PolarHBondContact O-N 3.03Å; L765-T768 PolarHBondContact O-N 3.19Å; L765-T768 PolarHBondContact O-OG1 3.39Å; L765-L779 HydrophobicContact CB-CD1 4.19Å; L765-L779 HydrophobicContact CB-CD2 3.73Å; L765-L779 HydrophobicContact CD1-CD2 3.42Å; L765-L779 VanDerWaalsContact CD1-CD2 3.42Å; L765-L779 HydrophobicContact CD2-CD2 3.95Å; L765-L779 HydrophobicContact CG-CD2 3.84Å
766	G	76.5	Confident	72.5	Confident	66 Å²	66	71.2 Å²	71.2	68%	0.68	41%	0.414	S	S	*	.	H	α-helix	trans	-67.1	-22.2	161.9	0	0	0	0	0	113.4	A762 T768	A762-G766 PolarHBondContact O-N 2.86Å; G766-T768 PolarHBondContact O-N 3.02Å
767	S	63.5	Low	70.5	Confident	76 Å²	76	75.8 Å²	75.8	53%	0.531	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-5.5	171.6	-65.4	0	0	0	0	114.3	A763 L765	A763-S767 WeakPolarHBondContact O-CB 3.21Å; A763-S767 PolarHBondContact O-N 2.81Å; A763-S767 VanDerWaalsContact O-N 3.17Å; A763-S767 PolarHBondContact O-OG 3.42Å; L765-S767 PolarHBondContact O-N 3.03Å
768	T	55.9	Low	68.4	Low	47 Å²	47	76.2 Å²	76.2	29%	0.288	43%	0.431	S	S	.	.	S	Bend	trans	-98.7	95.3	175.9	58.2	0	0	0	0	110.3	L765 G766	L765-T768 PolarHBondContact O-N 3.19Å; L765-T768 PolarHBondContact O-OG1 3.39Å; G766-T768 PolarHBondContact O-N 3.02Å
769	N	46.5	Very low	66.4	Low	134 Å²	134	72.9 Å²	72.9	72%	0.717	42%	0.42	S	S	*	.			trans	-47.9	152.8	175.6	-59.3	3.1	0	0	0	112.2	N771	N769-N771 PolarHBondContact O-N 3.07Å
770	N	52.3	Low	64.4	Low	161 Å²	161	66.9 Å²	66.9	86%	0.861	40%	0.403	S	S	*	.	S	Bend	trans	-49.5	-4.6	-164.5	-56.5	-11.7	0	0	0	119	C772	N770-C772 PolarHBondContact O-N 3.3Å; N770-C772 VanDerWaalsContact O-N 3.14Å
771	N	47.6	Very low	62.4	Low	162 Å²	162	72.1 Å²	72.1	87%	0.866	42%	0.419	S	S	*	.	S	Bend	trans	-83.8	21.3	-171.9	-62.5	12.3	0	0	0	114	N769	N769-N771 PolarHBondContact O-N 3.07Å
772	C	48.9	Very low	60.5	Low	56 Å²	56	72.8 Å²	72.8	38%	0.378	42%	0.422	S	S	.	.			trans	-143.5	71.7	-178	-148.8	0	0	0	0	112.8	N770 E774 V775 A776	N770-C772 PolarHBondContact O-N 3.3Å; N770-C772 VanDerWaalsContact O-N 3.14Å; C772-E774 PolarHBondContact O-N 3.41Å; C772-E774 VanDerWaalsContact O-N 3.13Å; C772-V775 HydrophobicContact CB-CB 4.09Å; C772-V775 HydrophobicContact CB-CG2 4.22Å; C772-V775 PolarHBondContact O-N 3.4Å; C772-V775 VanDerWaalsContact SG-CG2 3.51Å; C772-A776 PolarHBondContact O-N 2.98Å
773	S	53	Low	58.3	Low	76 Å²	76	75.8 Å²	75.8	53%	0.531	42%	0.423	S	S	.	.	H	α-helix	trans	-60.3	-21.1	178.6	68.5	0	0	0	0	114	R777	S773-R777 PolarHBondContact O-N 3.12Å; S773-R777 PolarHBondContact O-NE 2.9Å; S773-R777 PolarHBondContact OG-NH2 2.93Å
774	E	51.8	Low	55.8	Low	107 Å²	107	81.7 Å²	81.7	50%	0.5	43%	0.434	S	S	.	.	H	α-helix	trans	-75.8	-38.2	173.7	-174.9	162.2	-98.8	0	0	112.5	C772 R777 A778	C772-E774 PolarHBondContact O-N 3.41Å; C772-E774 VanDerWaalsContact O-N 3.13Å; E774-R777 PolarHBondContact O-N 3.42Å; E774-A778 PolarHBondContact O-N 3.38Å
775	V	52.1	Low	53.6	Low	22 Å²	22	87.1 Å²	87.1	13%	0.133	46%	0.459	C	S	.	.	H	α-helix	trans	-65.3	-44.2	167.5	169.9	0	0	0	0	109.6	L609 C772 R777 A778 L779	L609-V775 HydrophobicContact CD2-CG1 3.8Å; L609-V775 HydrophobicContact CD2-CG2 4Å; C772-V775 HydrophobicContact CB-CB 4.09Å; C772-V775 HydrophobicContact CB-CG2 4.22Å; C772-V775 PolarHBondContact O-N 3.4Å; C772-V775 VanDerWaalsContact SG-CG2 3.51Å; V775-R777 VanDerWaalsContact C-N 3.35Å; V775-R777 PolarHBondContact O-N 3.02Å; V775-A778 CarbonylContact O-C 3.55Å; V775-A778 WeakPolarHBondContact O-CA 3.49Å; V775-A778 WeakPolarHBondContact O-CB 3.43Å; V775-A778 PolarHBondContact O-N 3.43Å; V775-L779 HydrophobicContact CG1-CD1 4.46Å; V775-L779 HydrophobicContact CG1-CG 4.26Å; V775-L779 WeakPolarHBondContact O-CG 3.33Å; V775-L779 PolarHBondContact O-N 2.87Å
776	A	48.7	Very low	51.4	Low	43 Å²	43	90.8 Å²	90.8	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-55.7	-46.2	175.4	0	0	0	0	0	112.4	C772 A778 L779 D780	C772-A776 PolarHBondContact O-N 2.98Å; A776-A778 VanDerWaalsContact C-N 3.3Å; A776-A778 PolarHBondContact O-N 2.7Å; A776-L779 WeakPolarHBondContact O-CA 3.49Å; A776-L779 WeakPolarHBondContact O-CB 3.31Å; A776-L779 PolarHBondContact O-N 2.68Å; A776-D780 PolarHBondContact O-N 3.02Å
777	R	53.6	Low	49	Very low	140 Å²	140	91.7 Å²	91.7	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-60.5	-35.8	172.6	-81.8	177.6	-86.6	124	-3.9	113.2	S773 E774 V775 R781	S773-R777 PolarHBondContact O-N 3.12Å; S773-R777 PolarHBondContact O-NE 2.9Å; S773-R777 PolarHBondContact OG-NH2 2.93Å; E774-R777 PolarHBondContact O-N 3.42Å; V775-R777 VanDerWaalsContact C-N 3.35Å; V775-R777 PolarHBondContact O-N 3.02Å; R777-R781 WeakPolarHBondContact O-CG 3.29Å; R777-R781 PolarHBondContact O-N 3.43Å
778	A	51.7	Low	47.4	Very low	10 Å²	10	93.1 Å²	93.1	8%	0.083	48%	0.479	C	S	.	.	H	α-helix	trans	-70.8	-29.7	172	0	0	0	0	0	113.2	E774 V775 A776 I782	E774-A778 PolarHBondContact O-N 3.38Å; V775-A778 CarbonylContact O-C 3.55Å; V775-A778 WeakPolarHBondContact O-CA 3.49Å; V775-A778 WeakPolarHBondContact O-CB 3.43Å; V775-A778 PolarHBondContact O-N 3.43Å; A776-A778 VanDerWaalsContact C-N 3.3Å; A776-A778 PolarHBondContact O-N 2.7Å; A778-I782 WeakPolarHBondContact O-CD1 3.36Å; A778-I782 VanDerWaalsContact O-CG1 3.26Å; A778-I782 WeakPolarHBondContact O-CG1 3.34Å; A778-I782 PolarHBondContact O-N 3.09Å
779	L	52.8	Low	46.4	Very low	38 Å²	38	98 Å²	98	20%	0.199	50%	0.499	C	S	.	.	H	α-helix	trans	-67.9	-42.2	173.3	-63.5	-179	0	0	0	111.7	L765 V775 A776 I782 K783	L765-L779 HydrophobicContact CB-CD1 4.19Å; L765-L779 HydrophobicContact CB-CD2 3.73Å; L765-L779 HydrophobicContact CD1-CD2 3.42Å; L765-L779 VanDerWaalsContact CD1-CD2 3.42Å; L765-L779 HydrophobicContact CD2-CD2 3.95Å; L765-L779 HydrophobicContact CG-CD2 3.84Å; V775-L779 HydrophobicContact CG1-CD1 4.46Å; V775-L779 HydrophobicContact CG1-CG 4.26Å; V775-L779 WeakPolarHBondContact O-CG 3.33Å; V775-L779 PolarHBondContact O-N 2.87Å; A776-L779 WeakPolarHBondContact O-CA 3.49Å; A776-L779 WeakPolarHBondContact O-CB 3.31Å; A776-L779 PolarHBondContact O-N 2.68Å; L779-I782 WeakPolarHBondContact O-CB 3.39Å; L779-I782 PolarHBondContact O-N 2.94Å; L779-K783 PolarHBondContact O-N 2.93Å
780	D	51.3	Low	45.5	Very low	63 Å²	63	96.3 Å²	96.3	34%	0.337	50%	0.498	S	S	.	.	H	α-helix	trans	-70.2	-35.9	178.8	-64.5	-36.2	0	0	0	111.3	A776 I782 K783 Y784	A776-D780 PolarHBondContact O-N 3.02Å; D780-I782 VanDerWaalsContact C-N 3.26Å; D780-I782 PolarHBondContact O-N 2.99Å; D780-K783 PolarHBondContact O-N 3.05Å; D780-K783 VanDerWaalsContact O-N 3.14Å; D780-K783 IonicContact OD1-NZ 2.77Å; D780-K783 PolarHBondContact OD1-NZ 2.9Å; D780-Y784 HydrophobicContact CB-CD2 4.15Å; D780-Y784 HydrophobicContact CB-CE2 4.18Å; D780-Y784 WeakPolarHBondContact O-CD2 3.36Å; D780-Y784 PolarHBondContact O-N 2.95Å
781	R	53.7	Low	44.6	Very low	142 Å²	142	95.6 Å²	95.6	54%	0.536	49%	0.492	S	S	.	.	H	α-helix	trans	-56.7	-38.4	168.1	-74.1	-175.6	-177.6	-172.2	1.3	113	E404 R777 H785	E404-R781 WeakPolarHBondContact OE1-CD 3.42Å; E404-R781 IonicContact OE1-CZ 3.32Å; E404-R781 IonicContact OE1-NE 2.64Å; E404-R781 IonicContact OE1-NH1 2.98Å; E404-R781 PolarHBondContact OE1-NH1 3.23Å; E404-R781 IonicContact OE2-NH1 3.21Å; E404-R781 PolarHBondContact OE2-NH1 3.31Å; R777-R781 WeakPolarHBondContact O-CG 3.29Å; R777-R781 PolarHBondContact O-N 3.43Å; R781-H785 PolarHBondContact O-N 3.07Å
782	I	54	Low	43.6	Very low	44 Å²	44	95.3 Å²	95.3	23%	0.226	49%	0.486	C	S	.	.	H	α-helix	trans	-68.7	-41.4	175.7	-66.8	161	0	0	0	111	F415 Y610 A778 L779 D780	F415-I782 HydrophobicContact CZ-CD1 4.42Å; Y610-I782 HydrophobicContact CE1-CD1 4Å; A778-I782 WeakPolarHBondContact O-CD1 3.36Å; A778-I782 VanDerWaalsContact O-CG1 3.26Å; A778-I782 WeakPolarHBondContact O-CG1 3.34Å; A778-I782 PolarHBondContact O-N 3.09Å; L779-I782 WeakPolarHBondContact O-CB 3.39Å; L779-I782 PolarHBondContact O-N 2.94Å; D780-I782 VanDerWaalsContact C-N 3.26Å; D780-I782 PolarHBondContact O-N 2.99Å
783	K	44.2	Very low	42.5	Very low	126 Å²	126	97.8 Å²	97.8	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-42.6	177.2	-71.3	175.8	-170.9	155.9	0	113.3	L779 D780	L779-K783 PolarHBondContact O-N 2.93Å; D780-K783 PolarHBondContact O-N 3.05Å; D780-K783 VanDerWaalsContact O-N 3.14Å; D780-K783 IonicContact OD1-NZ 2.77Å; D780-K783 PolarHBondContact OD1-NZ 2.9Å
784	Y	38.8	Very low	41.5	Very low	184 Å²	184	102.7 Å²	102.7	72%	0.722	52%	0.52	S	S	*	.	H	α-helix	trans	-90.1	-1.9	-168.2	-69.9	-65.3	0	0	0	114.9	D780 H786	D780-Y784 HydrophobicContact CB-CD2 4.15Å; D780-Y784 HydrophobicContact CB-CE2 4.18Å; D780-Y784 WeakPolarHBondContact O-CD2 3.36Å; D780-Y784 PolarHBondContact O-N 2.95Å; Y784-H786 PolarHBondContact O-N 3.49Å
785	H	43.3	Very low	40.4	Very low	118 Å²	118	105.9 Å²	105.9	55%	0.546	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.4	174.1	-112.6	-70.3	0	0	0	114.9	R781 S787	R781-H785 PolarHBondContact O-N 3.07Å; H785-S787 VanDerWaalsContact C-N 3.27Å; H785-S787 PolarHBondContact O-N 3.25Å
786	H	40.1	Very low	39.3	Very low	91 Å²	91	108.2 Å²	108.2	42%	0.421	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	8	175.7	-69	-62.2	0	0	0	115	Q422 E423 Y784 P788	Q422-H786 PolarHBondContact NE2-CE1 3.46Å; Q422-H786 PolarHBondContact NE2-ND1 2.97Å; E423-H786 IonicContact OE1-CE1 3.21Å; E423-H786 PolarHBondContact OE1-CE1 2.8Å; E423-H786 IonicContact OE1-ND1 2.97Å; E423-H786 PolarHBondContact OE1-ND1 3.08Å; Y784-H786 PolarHBondContact O-N 3.49Å; H786-P788 WeakPolarHBondContact O-CD 3.47Å
787	S	26.1	Very low	38.7	Very low	85 Å²	85	114.9 Å²	114.9	59%	0.594	59%	0.585	S	S	*	*	S	Bend	trans	-63.5	124.3	161.7	-176.9	0	0	0	0	108.6	H785 Q789	H785-S787 VanDerWaalsContact C-N 3.27Å; H785-S787 PolarHBondContact O-N 3.25Å; S787-Q789 PolarHBondContact O-N 2.83Å
788	P	29.7	Very low	37.7	Very low	107 Å²	107	113.7 Å²	113.7	70%	0.695	60%	0.595	S	S	*	*			trans	-66.2	103.5	173	27.8	-32.2	0	0	0	107.9	H786 S790	H786-P788 WeakPolarHBondContact O-CD 3.47Å; P788-S790 VanDerWaalsContact C-N 3.27Å; P788-S790 PolarHBondContact O-N 3Å
789	Q	35	Very low	37	Very low	149 Å²	149	119 Å²	119	70%	0.696	63%	0.629	S	S	*	*			trans	-59.3	100.1	161.2	-74.3	-170.1	-6.7	0	0	106.9	S787 I791	S787-Q789 PolarHBondContact O-N 2.83Å; Q789-I791 PolarHBondContact O-N 3.35Å
790	S	26.4	Very low	36.3	Very low	99 Å²	99	123.6 Å²	123.6	69%	0.692	66%	0.658	S	S	*	*			trans	-60	103.5	169.2	178.5	0	0	0	0	106.7	P788 Q792	P788-S790 VanDerWaalsContact C-N 3.27Å; P788-S790 PolarHBondContact O-N 3Å; S790-Q792 PolarHBondContact O-N 3.13Å
791	I	35	Very low	35.3	Very low	145 Å²	145	131.9 Å²	131.9	74%	0.744	69%	0.685	S	S	*	*			trans	-66.3	94.1	161.2	-59.3	176.9	0	0	0	104.2	Q789	Q789-I791 PolarHBondContact O-N 3.35Å
792	Q	25	Very low	34.3	Very low	157 Å²	157	130.8 Å²	130.8	73%	0.734	70%	0.698	S	S	*	*			trans	-55.3	135.6	169.1	-69.3	-174.2	-9.8	0	0	107.4	S790 L794	S790-Q792 PolarHBondContact O-N 3.13Å; Q792-L794 PolarHBondContact O-N 2.96Å
793	P	25.6	Very low	33.4	Very low	107 Å²	107	136.9 Å²	136.9	70%	0.695	73%	0.729	S	S	*	*			trans	-51.8	137.1	170.6	-24.3	34	0	0	0	109.3	E795	P793-E795 PolarHBondContact O-N 3.17Å
794	L	32.7	Very low	32.7	Very low	179 Å²	179	140.7 Å²	140.7	94%	0.937	75%	0.746	S	S	*	*			trans	-72.7	85.1	177.1	-155	82	0	0	0	108.1	Q792 G796	Q792-L794 PolarHBondContact O-N 2.96Å; L794-G796 PolarHBondContact O-N 3.35Å
795	E	29	Very low	32.6	Very low	174 Å²	174	143.6 Å²	143.6	81%	0.813	76%	0.756	S	S	*	*			trans	-67.5	74.7	-172.4	-75.1	-155.1	137	0	0	113.2	P793 K797	P793-E795 PolarHBondContact O-N 3.17Å; E795-K797 PolarHBondContact O-N 3.13Å; E795-K797 VanDerWaalsContact O-N 3.12Å
796	G	28.2	Very low	32.2	Very low	72 Å²	72	142.7 Å²	142.7	74%	0.742	76%	0.763	S	S	*	*			trans	-81.6	44.8	173.4	0	0	0	0	0	114	L794	L794-G796 PolarHBondContact O-N 3.35Å
797	K	37.5	Very low	32.1	Very low	183 Å²	183	146 Å²	146	80%	0.796	78%	0.783	S	S	*	*	S	Bend	trans	-168.9	135.5	168.1	-105.2	149.6	-172.9	-178.5	0	111.7	E795	E795-K797 PolarHBondContact O-N 3.13Å; E795-K797 VanDerWaalsContact O-N 3.12Å
798	P	32.7	Very low	32.6	Very low	114 Å²	114	147 Å²	147	74%	0.74	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.9	147.2	176.7	32.4	-34.9	0	0	0	112	V800	P798-V800 PolarHBondContact O-N 3.36Å
799	P	35.6	Very low	33.1	Very low	123 Å²	123	147 Å²	147	80%	0.799	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.2	122.7	176.9	28.2	-33.8	0	0	0	111.8
800	V	38.8	Very low	33.2	Very low	133 Å²	133	147.2 Å²	147.2	81%	0.806	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70	129.3	173.8	178.4	0	0	0	0	109.8	P798 C802	P798-V800 PolarHBondContact O-N 3.36Å; V800-C802 PolarHBondContact O-N 3.11Å
801	R	29.6	Very low	33.7	Very low	238 Å²	238	147.1 Å²	147.1	90%	0.898	79%	0.789	S	S	*	*			trans	-77.1	114.9	-178.9	-65.6	174.5	176.7	164.5	-2.3	111.6
802	C	32.9	Very low	34	Very low	119 Å²	119	147.3 Å²	147.3	80%	0.804	79%	0.791	S	S	*	*			trans	-115.8	86.9	166.6	-79.3	0	0	0	0	112.6	V800	V800-C802 PolarHBondContact O-N 3.11Å
803	L	35	Very low	34.5	Very low	171 Å²	171	146.1 Å²	146.1	90%	0.895	79%	0.789	S	S	*	*			trans	31.5	117.6	143.9	-64.5	167.2	0	0	0	120.5
804	K	30.8	Very low	35.1	Very low	206 Å²	206	147.5 Å²	147.5	90%	0.896	79%	0.789	S	S	*	*			trans	-81.5	136.6	153.8	-71.4	-178.7	174.8	-178.4	0	111.2
805	R	35.1	Very low	35.2	Very low	245 Å²	245	148.3 Å²	148.3	93%	0.925	78%	0.78	S	S	*	*			trans	-141.8	131.2	143.7	-81.3	-177.3	168.8	166	-5.2	107
806	S	35.9	Very low	35.6	Very low	99 Å²	99	147.2 Å²	147.2	69%	0.692	78%	0.775	S	S	*	*			cis	97.1	99.1	25.1	-175.8	0	0	0	0	114.6
807	L	37	Very low	36.1	Very low	161 Å²	161	151.7 Å²	151.7	84%	0.843	78%	0.776	S	S	*	*			trans	-147.8	120.2	141.8	-72.7	176.1	0	0	0	104.4
808	T	36.5	Very low	35.8	Very low	105 Å²	105	150 Å²	150	64%	0.644	78%	0.775	S	S	*	*				60.2	131.4	59.9	71.3	0	0	0	0	112.3
809	T	40.1	Very low	36.1	Very low	108 Å²	108	152.6 Å²	152.6	66%	0.663	78%	0.781	S	S	*	*			cis	-156.6	150.1	44.3	49.9	0	0	0	0	115.2
810	N	37.1	Very low	36	Very low	154 Å²	154	157.8 Å²	157.8	82%	0.824	78%	0.784	S	S	*	*			trans	56.9	153.6	133.8	-57.8	2.2	0	0	0	121.2
811	S	37.3	Very low	35.9	Very low	96 Å²	96	157.2 Å²	157.2	67%	0.671	78%	0.783	S	S	*	*			cis	-169.9	137.5	-17.8	179.1	0	0	0	0	107.2
812	L	40.9	Very low	36.2	Very low	150 Å²	150	155.9 Å²	155.9	79%	0.785	78%	0.784	S	S	*	*				175.1	134.8	99.4	-83.3	165.5	0	0	0	106.5
813	D	35.7	Very low	36.3	Very low	131 Å²	131	156.6 Å²	156.6	70%	0.701	78%	0.784	S	S	*	*				65.9	129.3	88.7	-140.9	18	0	0	0	112.5
814	I	38.6	Very low	36.2	Very low	137 Å²	137	157.6 Å²	157.6	70%	0.703	78%	0.782	S	S	*	*			cis	-149.8	130.9	43.9	-78.8	172.3	0	0	0	114.2
815	R	35.5	Very low	36.6	Very low	196 Å²	196	154.3 Å²	154.3	74%	0.74	77%	0.774	S	S	*	*			trans	44.1	130.5	144.7	-68.8	178.2	164.5	145.9	0.8	125.9
816	H	36.3	Very low	36.9	Very low	151 Å²	151	147.2 Å²	147.2	70%	0.699	76%	0.76	S	S	*	*			trans	68.6	147	135.9	-61.7	-39.2	0	0	0	119.8
817	Q	39	Very low	36.6	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	77%	0.766	S	S	*	*			cis	-148.3	176.7	5.5	-133	172.8	92.9	0	0	113.6
818	L	32.2	Very low	36.5	Very low	148 Å²	148	149.7 Å²	149.7	78%	0.775	77%	0.766	S	S	*	*			trans	-46.6	156.3	-178.8	-60.6	150.9	0	0	0	114.6
819	I	37.3	Very low	36.4	Very low	169 Å²	169	148.8 Å²	148.8	87%	0.867	78%	0.778	S	S	*	*				-154.1	168.1	61.5	-79.8	177.2	0	0	0	112.3
820	R	33.9	Very low	35.9	Very low	231 Å²	231	147 Å²	147	87%	0.872	78%	0.781	S	S	*	*			trans	-76.8	157.6	-168.9	-75.7	-176.3	175.1	-173.7	-1.1	117.1
821	P	36.9	Very low	35.7	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	78%	0.782	S	S	*	*			trans	-88.9	173.8	178	38.2	-38.6	0	0	0	114.3
822	K	35.5	Very low	35.4	Very low	211 Å²	211	147.3 Å²	147.3	92%	0.917	78%	0.783	S	S	*	*			trans	-143.4	144.9	160.4	-104.3	-179	-179.9	178.6	0	112.5
823	V	35.6	Very low	35	Very low	133 Å²	133	151.3 Å²	151.3	81%	0.806	79%	0.789	S	S	*	*			trans	-78.9	148.2	173.7	175.8	0	0	0	0	109.9
824	F	32.5	Very low	35	Very low	192 Å²	192	149.3 Å²	149.3	84%	0.842	79%	0.786	S	S	*	*			trans	-141	132.4	160.8	-135.6	-104.7	0	0	0	113.1	P826	F824-P826 HydrophobicContact CD1-CG 4.25Å; F824-P826 HydrophobicContact CE1-CG 3.99Å
825	N	39.3	Very low	34.9	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	79%	0.79	S	S	*	*			trans	-144.6	133.5	168.5	176.2	28.9	0	0	0	105.1
826	P	41.5	Very low	35	Very low	95 Å²	95	147.9 Å²	147.9	62%	0.617	79%	0.788	S	S	*	*			trans	-143.4	155.4	153.8	39.6	-25.8	0	0	0	116	F824	F824-P826 HydrophobicContact CD1-CG 4.25Å; F824-P826 HydrophobicContact CE1-CG 3.99Å
827	F	30.7	Very low	34.9	Very low	186 Å²	186	146.7 Å²	146.7	82%	0.816	79%	0.792	S	S	*	*			trans	-81.6	164.7	159.9	-101.9	-116.9	0	0	0	111.6
828	C	33.6	Very low	35.2	Very low	126 Å²	126	144.3 Å²	144.3	85%	0.851	79%	0.791	S	S	*	*			trans	51.9	127.4	149.5	-70.7	0	0	0	0	121.4
829	G	34.5	Very low	35.5	Very low	86 Å²	86	142 Å²	142	89%	0.887	79%	0.787	S	S	*	*			trans	-175.7	142.4	160.3	0	0	0	0	0	109.9
830	G	29.7	Very low	35.6	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	78%	0.779	S	S	*	*			trans	-122.5	-176.5	-177.1	0	0	0	0	0	113.8
831	N	32.6	Very low	35.8	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	77%	0.774	S	S	*	*			trans	69.8	99.5	171.5	-64.7	5.5	0	0	0	118.1
832	S	30.9	Very low	35.9	Very low	99 Å²	99	143 Å²	143	69%	0.692	77%	0.773	S	S	*	*				27.9	123	124.8	61	0	0	0	0	120.2
833	Y	33.9	Very low	36.2	Very low	234 Å²	234	138.5 Å²	138.5	92%	0.918	76%	0.763	S	S	*	*				-153.9	166.2	116.4	-111.7	-77	0	0	0	110
834	S	34.1	Very low	36.3	Very low	90 Å²	90	142 Å²	142	63%	0.629	76%	0.762	S	S	*	*			trans	-106.2	159.3	-172.6	55.4	0	0	0	0	113.1
835	Q	37.8	Very low	36.6	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	75%	0.754	S	S	*	*				174.2	161.8	113.4	-93.3	-174.9	21	0	0	113.9
836	N	37.2	Very low	36.7	Very low	133 Å²	133	138 Å²	138	71%	0.711	75%	0.753	S	S	*	*			trans	110.9	79.7	159.1	-58	-32	0	0	0	119.1
837	T	35.1	Very low	36.7	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	75%	0.753	S	S	*	*				35.8	151.4	111.6	57.8	0	0	0	0	120.9
838	P	44.1	Very low	37	Very low	114 Å²	114	135.3 Å²	135.3	74%	0.74	75%	0.749	S	S	*	*			cis	-147.2	-177.5	32.6	42.8	-22.9	0	0	0	119.3
839	S	38.4	Very low	37.3	Very low	100 Å²	100	133.6 Å²	133.6	70%	0.699	73%	0.734	S	S	*	*			trans	105.5	116.7	138.7	-76.3	0	0	0	0	123.1
840	I	39.6	Very low	37.5	Very low	135 Å²	135	135.8 Å²	135.8	69%	0.692	73%	0.726	S	S	*	*			trans	95.8	99.4	135.2	-66	167.3	0	0	0	120.4
841	R	38.3	Very low	37.8	Very low	206 Å²	206	139.2 Å²	139.2	78%	0.777	73%	0.727	S	S	*	*			trans	65.6	145.1	139.4	-63.4	179.4	-176.3	162.4	-0.1	118.7
842	R	38.8	Very low	38	Very low	202 Å²	202	139.2 Å²	139.2	76%	0.762	73%	0.726	S	S	*	*			cis	-165.8	149.6	3	-123.3	177.3	178.8	166.8	-2.7	110.6
843	V	41	Very low	38.2	Very low	116 Å²	116	139.3 Å²	139.3	70%	0.703	73%	0.727	S	S	*	*			trans	68.2	134.5	145	164.4	0	0	0	0	117.5
844	R	38.7	Very low	38.5	Very low	206 Å²	206	133.8 Å²	133.8	78%	0.777	72%	0.717	S	S	*	*			cis	-160.6	145.7	3.2	-129.8	-179.6	-174.8	130.9	-2.4	111.9
845	T	39.9	Very low	38.6	Very low	110 Å²	110	135.6 Å²	135.6	68%	0.675	72%	0.72	S	S	*	*			trans	40.6	145.6	139.7	54.5	0	0	0	0	121.9
846	N	39.9	Very low	38.5	Very low	137 Å²	137	133.9 Å²	133.9	73%	0.733	72%	0.716	S	S	*	*			cis	-164.8	157.9	19.6	-136.5	27.2	0	0	0	113.9
847	S	41	Very low	38.6	Very low	87 Å²	87	134.3 Å²	134.3	61%	0.608	72%	0.723	S	S	*	*			trans	41.2	145.6	144	60.7	0	0	0	0	122.5
848	N	38.6	Very low	38.8	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	72%	0.72	S	S	*	*			cis	-173.8	175.9	0.1	-110.4	51.1	0	0	0	106.8
849	T	40.3	Very low	38.5	Very low	89 Å²	89	135.1 Å²	135.1	55%	0.546	72%	0.721	S	S	.	*			cis	-165.3	-179.3	-37.7	32.7	0	0	0	0	108
850	D	38.1	Very low	38.3	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	72%	0.721	S	S	*	*			trans	77.5	155.1	153	-50.4	-51	0	0	0	121.3
851	L	36.6	Very low	38.2	Very low	143 Å²	143	135.9 Å²	135.9	75%	0.749	73%	0.725	S	S	*	*				-171.9	171.2	-57	-111.7	174	0	0	0	111.4
852	L	36.5	Very low	38	Very low	156 Å²	156	133.9 Å²	133.9	82%	0.817	73%	0.729	S	S	*	*			trans	76.7	156.5	165.1	-46.2	-175.9	0	0	0	119.6
853	S	35.1	Very low	37.8	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	73%	0.726	S	S	*	*			cis	-175.6	176.3	-37.4	-165.2	0	0	0	0	111.2
854	V	39.1	Very low	37.9	Very low	117 Å²	117	128.7 Å²	128.7	71%	0.709	73%	0.731	S	S	*	*			trans	90.8	91.3	157.6	-167.4	0	0	0	0	120.7
855	D	37.2	Very low	37.9	Very low	128 Å²	128	125 Å²	125	68%	0.684	73%	0.731	S	S	*	*				70.7	109.1	120.2	-58.4	-2.1	0	0	0	126.8
856	N	36	Very low	38	Very low	134 Å²	134	126.1 Å²	126.1	72%	0.717	74%	0.74	S	S	*	*				59.3	118.4	113.1	-56	-40.9	0	0	0	123.7
857	T	38.1	Very low	37.8	Very low	141 Å²	141	124.5 Å²	124.5	87%	0.865	74%	0.74	S	S	*	*				172.7	156.9	122.3	28.1	0	0	0	0	110
858	V	40	Very low	37.5	Very low	116 Å²	116	126 Å²	126	70%	0.703	75%	0.746	S	S	*	*			cis	-169.4	156.5	-38.5	126.3	0	0	0	0	107.7
859	N	37.6	Very low	37.4	Very low	143 Å²	143	125.5 Å²	125.5	77%	0.765	75%	0.748	S	S	*	*			trans	75.5	86.6	168.3	-67.9	-19.8	0	0	0	122.7
860	S	34.7	Very low	37.2	Very low	101 Å²	101	125.7 Å²	125.7	71%	0.706	75%	0.752	S	S	*	*				49.3	138.4	95.7	-55.6	0	0	0	0	125.6
861	I	36	Very low	37.2	Very low	150 Å²	150	125.6 Å²	125.6	77%	0.769	75%	0.752	S	S	*	*			trans	104.7	111.2	133.3	-77.7	160.2	0	0	0	122.9
862	L	35.3	Very low	37.3	Very low	163 Å²	163	125.8 Å²	125.8	85%	0.853	75%	0.749	S	S	*	*			trans	53.4	158.3	142.3	-82.9	75	0	0	0	126
863	A	35.2	Very low	37.4	Very low	87 Å²	87	124.8 Å²	124.8	72%	0.719	74%	0.743	S	S	*	*			trans	-94.2	-162.4	168.6	0	0	0	0	0	110.7
864	P	42	Very low	37.6	Very low	122 Å²	122	126.6 Å²	126.6	79%	0.792	74%	0.74	S	S	*	*			cis	-142.8	-156.3	18.7	45.2	-22.8	0	0	0	115.9
865	T	39.8	Very low	37.6	Very low	129 Å²	129	128.2 Å²	128.2	79%	0.791	74%	0.74	S	S	*	*			trans	-79.9	153.2	176.7	53.4	0	0	0	0	115.3
866	P	42.1	Very low	37.7	Very low	133 Å²	133	128.4 Å²	128.4	86%	0.864	75%	0.745	S	S	*	*			trans	-141.3	-162.5	135.1	39.9	-25.2	0	0	0	114
867	S	34.5	Very low	37.9	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	75%	0.746	S	S	*	*			trans	-139.3	158.1	-166.9	70.8	0	0	0	0	115.2
868	T	34.3	Very low	38	Very low	120 Å²	120	127.9 Å²	127.9	74%	0.736	74%	0.741	S	S	*	*			trans	58.9	116	153.4	-36.6	0	0	0	0	120.4
869	T	37	Very low	38	Very low	126 Å²	126	127.9 Å²	127.9	77%	0.773	75%	0.746	S	S	*	*				172.5	127.9	116.2	30	0	0	0	0	116.8
870	S	36.5	Very low	38.2	Very low	92 Å²	92	126.2 Å²	126.2	64%	0.643	74%	0.743	S	S	*	*			trans	67.9	145.9	139.4	78.4	0	0	0	0	124.4
871	N	37.1	Very low	38.2	Very low	132 Å²	132	130.2 Å²	130.2	71%	0.706	75%	0.751	S	S	*	*			trans	71.9	141.9	150.5	-61	-25.3	0	0	0	119
872	Q	38.4	Very low	38.3	Very low	147 Å²	147	131.8 Å²	131.8	69%	0.687	75%	0.752	S	S	*	*			cis	-165.5	161.2	-5.5	-121	174.8	20.3	0	0	111.5
873	I	38.4	Very low	38.2	Very low	134 Å²	134	132.3 Å²	132.3	69%	0.687	75%	0.75	S	S	*	*			trans	70.8	140.8	149.1	-71.8	167.2	0	0	0	116.8
874	H	39.3	Very low	38.4	Very low	141 Å²	141	136.4 Å²	136.4	65%	0.653	75%	0.754	S	S	*	*			cis	-153.2	152.5	3	-130.3	-19.6	0	0	0	111.4
875	Q	39.1	Very low	38.2	Very low	151 Å²	151	137.6 Å²	137.6	71%	0.706	75%	0.753	S	S	*	*			trans	51.5	146.1	145.2	-79.6	172.4	-5.7	0	0	120.2
876	V	40.2	Very low	37.8	Very low	131 Å²	131	134.9 Å²	134.9	79%	0.794	74%	0.739	S	S	*	*			cis	-148.4	171	17.3	-176.1	0	0	0	0	107.4
877	Q	39.8	Very low	37.6	Very low	156 Å²	156	138.9 Å²	138.9	73%	0.729	74%	0.738	S	S	*	*				-171.7	169.2	-56.3	-167.6	162.5	-40.8	0	0	108.5
878	S	41.6	Very low	37.8	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	74%	0.739	S	S	*	*			trans	78.2	148.7	170.9	81.7	0	0	0	0	118.8
879	S	38.9	Very low	37.9	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	74%	0.741	S	S	*	*			cis	-164.4	164	-29.3	-98.5	0	0	0	0	110.9
880	P	41.7	Very low	37.8	Very low	108 Å²	108	143.5 Å²	143.5	70%	0.701	75%	0.748	S	S	*	*			trans	-127.5	173.5	-155.8	43.3	-30.4	0	0	0	118.9
881	Q	34.4	Very low	37.9	Very low	185 Å²	185	144.9 Å²	144.9	86%	0.864	76%	0.758	S	S	*	*			trans	65.1	131.7	148.3	-82.3	178.9	-30	0	0	123.8
882	K	37.8	Very low	37.8	Very low	183 Å²	183	145 Å²	145	80%	0.796	76%	0.764	S	S	*	*			trans	-169.9	134.7	141	-97.3	174.6	179.2	-175.1	0	106.3
883	E	34.5	Very low	37.6	Very low	173 Å²	173	144.6 Å²	144.6	81%	0.808	78%	0.776	S	S	*	*			cis	84.8	151.5	47.6	-72.1	-159.6	143.3	0	0	115.7
884	H	39.3	Very low	37.4	Very low	173 Å²	173	143.2 Å²	143.2	80%	0.801	78%	0.778	S	S	*	*			trans	91.6	143.9	-170	-67.3	-93.7	0	0	0	117.5
885	L	36.9	Very low	37.3	Very low	147 Å²	147	149.6 Å²	149.6	77%	0.77	81%	0.808	S	S	*	*			cis	-167.2	164.2	-46.3	-116.1	166.5	0	0	0	109.4
886	S	32.4	Very low	37.2	Very low	72 Å²	72	149.6 Å²	149.6	50%	0.503	81%	0.813	S	S	.	*			trans	-65.6	154.4	-171.5	54.6	0	0	0	0	118.2
887	Y	37.7	Very low	37	Very low	217 Å²	217	150.5 Å²	150.5	85%	0.851	81%	0.814	S	S	*	*				-155.1	127	125.3	-81.8	-68.6	0	0	0	107.7
888	H	37.8	Very low	36.9	Very low	158 Å²	158	150.2 Å²	150.2	73%	0.731	82%	0.819	S	S	*	*				57.7	133.9	83.9	-71.7	-79.4	0	0	0	113.9
889	S	37.5	Very low	36.6	Very low	113 Å²	113	152.6 Å²	152.6	79%	0.79	82%	0.822	S	S	*	*			cis	-144.7	169.3	23.1	-69.5	0	0	0	0	114.8
890	L	33.5	Very low	36.5	Very low	175 Å²	175	154.9 Å²	154.9	92%	0.916	82%	0.823	S	S	*	*			trans	-89.4	148.4	164.7	-70.6	156.7	0	0	0	111.1
891	S	39.6	Very low	36.1	Very low	122 Å²	122	158.1 Å²	158.1	85%	0.853	83%	0.831	S	S	*	*			trans	-155.4	115.3	145.5	61.6	0	0	0	0	111.5
892	T	34.6	Very low	36.2	Very low	135 Å²	135	156.1 Å²	156.1	83%	0.828	83%	0.829	S	S	*	*			trans	-84.8	138.2	162.7	47.6	0	0	0	0	110
893	C	34.5	Very low	36.1	Very low	138 Å²	138	154.1 Å²	154.1	93%	0.932	83%	0.831	S	S	*	*			trans	-161.2	162.2	140.2	-117.5	0	0	0	0	110.3
894	S	33.2	Very low	36.2	Very low	105 Å²	105	152.5 Å²	152.5	73%	0.734	83%	0.833	S	S	*	*			trans	-109.5	142.3	-170.8	51.2	0	0	0	0	112.7
895	E	37.8	Very low	36	Very low	275 Å²	275	150.6 Å²	150.6	100%	1.285	84%	0.836	S	S	*	*				-129	0	123.9	-84.8	-173.3	149.5	0	0	107.9

Retrieved 895 of 895 residues in 398.1 ms (Link to these results)

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