A0A087X2V6_POEFO Loading...

Coiled-coil and C2 domain-containing protein 1B

AlphaFold DB , UniProt , Accession A0A087X2V6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 870 aa.

						>A0A087X2V6_POEFO|A0A087X2V6
MFGKKKKAPMPKGQGAAAAKQMGLFVDLNPEEMMMGAEENLDDPDLEAELAALTGNKAAARGKAKPKGKSPLPMEDIAKMADECMRDVDEDDDDDNIEDDEDLLAELQEVVGDEEVGDAATPSSTSSASADSSQVETVEPPAAQEVKVSTAAPGSLQHTLEERAEMYKTAIQNAKSAGETSKARRYDRGLKTLESMIAAVKKGKPVNESEIPPPVATGAPTATPRPAVPSRPAPPVPSRPERETETTTLPTASPDAVTPGSEEERSSAASVATLSDRPSPEETPAELSKPRPTESEATKAMLLERQKEYKLAALRAKKDGDMEQAKLYFRTSKNFDAVIEALEKGQAVDLSGLPSPPGKGAGGISAAVSKPSSEQNLQASHTVTAASGPAGPSAPKDVLEALEQRRVKYVEASNQAKASGDDRKARMHDRIAKQYQSAIRAHKAGKPVDFDELPVPPGFPPIPGQKVAGDEQGLVATLEAASKLASTDVADEDDDEKEEESKVGVLEKPKKPTLDVPSAGPERKRSPSASPDRKSPEENLSPAAAQLLELLDSRKKQFMKAALQAKQKNDMEQAKVFLRTAKGLDPMIEAARSGKTVDISTLPSPPGDEEDDFILVHHSDVQVSEKAGPVYTQLCSILKEQHEKCLTYSKQFTHLGNVSETTKFEKLAESCKKSLDVLKLAQSRGLPPPQHHFEEKSFRTVRIFPELSSTDMVVLIVKGMNLPAPSGVQPNDLDAYIKFDFPYPSAEQPQKHKTNVIKNTNSPEFNQSFTLSINRNHRGFRRLVASKGLKLELLHKGGFLRSDKPVGSALIKLDKLESQSEIREIVEVMDGRKHTGGRVEVKVRLREPLSGQDVQTSTERWLVIDSSKGL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	41.2	Very low	231 Å²	231	164.5 Å²	164.5	100%	1.138	85%	0.85	S	S	*	*				0	137.9	0	-58.5	169.2	-176	0	0	106.1
2	F	41.2	Very low	41.4	Very low	217 Å²	217	167.9 Å²	167.9	95%	0.952	85%	0.854	S	S	*	*			cis	-115.7	-172.4	11.1	-69.2	-103.7	0	0	0	111.8
3	G	39.3	Very low	41.5	Very low	63 Å²	63	160.7 Å²	160.7	65%	0.649	85%	0.847	S	S	*	*			trans	175.8	178.2	171.1	0	0	0	0	0	113.6
4	K	42.5	Very low	42.2	Very low	203 Å²	203	163.6 Å²	163.6	88%	0.883	85%	0.853	S	S	*	*			trans	73.9	144.3	-177.6	-62	164.7	-177.8	172.4	0	112.4
5	K	41.7	Very low	42.6	Very low	174 Å²	174	155.8 Å²	155.8	76%	0.757	83%	0.829	S	S	*	*			cis	-159.4	148.3	18.6	-116.8	147.4	-178.9	-177	0	112.5
6	K	41.7	Very low	43.1	Very low	196 Å²	196	151.5 Å²	151.5	85%	0.852	82%	0.822	S	S	*	*			trans	43.2	129.6	141.9	-64.9	-176.6	173.5	-167.7	0	122.9
7	K	34.2	Very low	43.5	Very low	218 Å²	218	147.2 Å²	147.2	95%	0.948	81%	0.811	S	S	*	*				-155	176.8	111.2	-123.1	-180	-178.9	-177.1	0	111.7
8	A	34.3	Very low	43.9	Very low	90 Å²	90	142.7 Å²	142.7	74%	0.744	80%	0.797	S	S	*	*			trans	-137	-164.2	-164.7	0	0	0	0	0	112
9	P	50.4	Low	44.5	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	78%	0.78	S	S	*	*				-128.1	-165.1	-118	37	-14.9	0	0	0	115.9
10	M	39.1	Very low	45	Very low	179 Å²	179	140.5 Å²	140.5	88%	0.882	78%	0.781	S	S	*	*			trans	84.6	157.6	171.7	-58.9	-158.4	-64.2	0	0	116.9
11	P	46.2	Very low	45.3	Very low	126 Å²	126	142.1 Å²	142.1	82%	0.818	78%	0.783	S	S	*	*			cis	-116.3	177.4	2.9	39.9	-27	0	0	0	115.8
12	K	44.6	Very low	45.9	Very low	206 Å²	206	138.4 Å²	138.4	90%	0.896	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-88.1	138.2	175.6	-66.5	177.9	177.4	178.7	0	111.3
13	G	42.1	Very low	46.5	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-82.7	157.5	167.6	0	0	0	0	0	112.8
14	Q	51.7	Low	47.2	Very low	201 Å²	201	135.5 Å²	135.5	94%	0.939	76%	0.76	S	S	*	*	S	Bend	trans	-77	138.9	-178.6	-66.6	140.7	-58.8	0	0	112
15	G	47.5	Very low	47	Very low	47 Å²	47	134.3 Å²	134.3	49%	0.485	76%	0.755	S	S	.	*			trans	-161.8	-45.6	172.1	0	0	0	0	0	112.7	A17 A18	G15-A17 PolarHBondContact O-N 3.03Å; G15-A17 VanDerWaalsContact O-N 3.11Å; G15-A18 PolarHBondContact O-N 3.38Å
16	A	50.4	Low	47.2	Very low	87 Å²	87	132 Å²	132	72%	0.719	76%	0.755	S	S	*	*	H	α-helix	trans	-59.2	-25	179.9	0	0	0	0	0	114.7	K20	A16-K20 PolarHBondContact O-N 2.96Å
17	A	49.7	Very low	47.1	Very low	78 Å²	78	129.4 Å²	129.4	65%	0.645	75%	0.75	S	S	*	*	H	α-helix	trans	-69.4	-38.5	178.3	0	0	0	0	0	113	G15	G15-A17 PolarHBondContact O-N 3.03Å; G15-A17 VanDerWaalsContact O-N 3.11Å
18	A	50.7	Low	47.2	Very low	66 Å²	66	126.2 Å²	126.2	55%	0.545	74%	0.743	S	S	.	*	H	α-helix	trans	-73.8	-38.9	-178.7	0	0	0	0	0	111.9	G15 K20 Q21	G15-A18 PolarHBondContact O-N 3.38Å; A18-K20 VanDerWaalsContact C-N 3.31Å; A18-K20 PolarHBondContact O-N 3.3Å; A18-Q21 PolarHBondContact O-N 3.25Å
19	A	55.2	Low	47.5	Very low	59 Å²	59	126.9 Å²	126.9	49%	0.488	73%	0.734	S	S	.	*	H	α-helix	trans	-62.1	-37.6	177.3	0	0	0	0	0	112.5	Q21 M22	A19-Q21 PolarHBondContact O-N 2.91Å; A19-M22 PolarHBondContact O-N 3.26Å; A19-M22 VanDerWaalsContact O-N 3.16Å
20	K	55.4	Low	47.3	Very low	183 Å²	183	127.3 Å²	127.3	80%	0.796	74%	0.737	S	S	*	*	H	α-helix	trans	-72.2	-14.6	-179.3	-149.5	168.1	-170.2	174	0	113.8	A16 A18	A16-K20 PolarHBondContact O-N 2.96Å; A18-K20 VanDerWaalsContact C-N 3.31Å; A18-K20 PolarHBondContact O-N 3.3Å
21	Q	51.8	Low	47.7	Very low	175 Å²	175	127.4 Å²	127.4	82%	0.818	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-10.9	173.2	-165.1	171.4	0.5	0	0	113.1	A18 A19	A18-Q21 PolarHBondContact O-N 3.25Å; A19-Q21 PolarHBondContact O-N 2.91Å
22	M	54.1	Low	47.5	Very low	153 Å²	153	128.9 Å²	128.9	75%	0.754	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	12.2	-175.7	-63.7	-74.2	-79.5	0	0	113.5	A19 L24	A19-M22 PolarHBondContact O-N 3.26Å; A19-M22 VanDerWaalsContact O-N 3.16Å; M22-L24 PolarHBondContact O-N 2.99Å
23	G	53.4	Low	47.6	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.9	8.6	169.6	0	0	0	0	0	117.3	F25	G23-F25 PolarHBondContact O-N 3.29Å
24	L	54.5	Low	47.6	Very low	150 Å²	150	132.2 Å²	132.2	79%	0.785	73%	0.734	S	S	*	*			trans	-91.7	27.8	-162.3	-146.9	76.9	0	0	0	115.8	M22	M22-L24 PolarHBondContact O-N 2.99Å
25	F	38.9	Very low	47.2	Very low	178 Å²	178	131.5 Å²	131.5	78%	0.781	73%	0.733	S	S	*	*			trans	-145.2	126.4	172.8	-92.8	-90.1	0	0	0	110.5	G23	G23-F25 PolarHBondContact O-N 3.29Å
26	V	45.3	Very low	46.7	Very low	126 Å²	126	133.4 Å²	133.4	76%	0.764	75%	0.753	S	S	*	*			trans	-107.4	111.1	164.1	177.6	0	0	0	0	106.5	L28	V26-L28 PolarHBondContact O-N 3.31Å
27	D	40.2	Very low	46.3	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	76%	0.756	S	S	*	*			trans	-77.5	118.7	174.3	-79	-46.2	0	0	0	109.3
28	L	35.2	Very low	45.7	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	77%	0.768	S	S	*	*			trans	-94.3	103.7	172.5	-80.8	161.1	0	0	0	109.1	V26	V26-L28 PolarHBondContact O-N 3.31Å
29	N	41.8	Very low	45.5	Very low	105 Å²	105	144.6 Å²	144.6	56%	0.561	78%	0.782	S	S	*	*			trans	-87.7	119.5	179.5	-167	37.7	0	0	0	110.3	E31	N29-E31 VanDerWaalsContact C-N 3.29Å; N29-E31 PolarHBondContact O-N 2.89Å
30	P	45	Very low	44.5	Very low	121 Å²	121	149.8 Å²	149.8	79%	0.786	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	0.1	-166.1	32.4	-37.5	0	0	0	115.4
31	E	47.1	Very low	44.2	Very low	180 Å²	180	148 Å²	148	84%	0.841	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	1.4	-170.8	-144.3	161.5	-157.5	0	0	113.4	N29	N29-E31 VanDerWaalsContact C-N 3.29Å; N29-E31 PolarHBondContact O-N 2.89Å
32	E	43.3	Very low	44	Very low	158 Å²	158	147.4 Å²	147.4	74%	0.738	80%	0.802	S	S	*	*	S	Bend	trans	-108	-9.4	-176.2	-159.6	160	-153.5	0	0	113.2	M34	E32-M34 VanDerWaalsContact C-N 3.31Å; E32-M34 PolarHBondContact O-N 3.1Å
33	M	45.5	Very low	43.5	Very low	172 Å²	172	144.8 Å²	144.8	85%	0.847	79%	0.791	S	S	*	*	S	Bend	trans	-84.8	12.7	178.5	-83.9	-173.8	164.1	0	0	114.9
34	M	43.3	Very low	43.4	Very low	178 Å²	178	146.1 Å²	146.1	88%	0.877	79%	0.787	S	S	*	*	S	Bend	trans	-123.5	36.8	-176.5	-158.2	177.7	163.5	0	0	114.1	E32	E32-M34 VanDerWaalsContact C-N 3.31Å; E32-M34 PolarHBondContact O-N 3.1Å
35	M	43	Very low	43.4	Very low	186 Å²	186	144.9 Å²	144.9	92%	0.916	78%	0.782	S	S	*	*			trans	-154.4	104.8	158.5	-109.4	178.4	-69.4	0	0	109
36	G	37.8	Very low	43.9	Very low	87 Å²	87	142 Å²	142	90%	0.897	77%	0.773	S	S	*	*			trans	-177.3	32.8	-173.2	0	0	0	0	0	114
37	A	41.1	Very low	44.3	Very low	95 Å²	95	143.4 Å²	143.4	79%	0.785	77%	0.772	S	S	*	*			trans	-140.4	68.1	-178.4	0	0	0	0	0	110.6
38	E	36.7	Very low	45.2	Very low	193 Å²	193	139.4 Å²	139.4	90%	0.902	76%	0.758	S	S	*	*	S	Bend	trans	-160.5	170.7	146.8	-115.3	163.1	-139.7	0	0	110.2
39	E	46.3	Very low	46.5	Very low	177 Å²	177	139 Å²	139	83%	0.827	75%	0.752	S	S	*	*			trans	-64.1	139.4	-153.1	-58.5	170.1	140.1	0	0	115.8
40	N	35.5	Very low	46.8	Very low	168 Å²	168	139.5 Å²	139.5	90%	0.898	75%	0.754	S	S	*	*			trans	-141.1	121.4	145.1	-113.2	-9.9	0	0	0	108.1
41	L	48.7	Very low	47.4	Very low	147 Å²	147	136.4 Å²	136.4	77%	0.77	74%	0.739	S	S	*	*			trans	-90.5	168.9	166.6	-67.8	162.8	0	0	0	108.4
42	D	47.1	Very low	48.2	Very low	162 Å²	162	131.7 Å²	131.7	87%	0.866	73%	0.731	S	S	*	*			trans	68.4	67.5	-179.9	-50.2	-24.2	0	0	0	115.3
43	D	44.8	Very low	48.4	Very low	98 Å²	98	131.7 Å²	131.7	52%	0.524	74%	0.735	S	S	.	*			trans	-90.8	116.5	165	-167.8	-31.5	0	0	0	110.5	D45 L46	D43-D45 VanDerWaalsContact C-N 3.31Å; D43-D45 PolarHBondContact O-N 2.79Å; D43-D45 PolarHBondContact OD1-N 2.89Å; D43-L46 HydrophobicContact CB-CD1 4.36Å; D43-L46 PolarHBondContact O-N 3Å
44	P	51	Low	48.5	Very low	97 Å²	97	128 Å²	128	63%	0.63	72%	0.722	S	S	*	*	H	α-helix	trans	-70.6	-17.8	-172.9	28.8	-36.3	0	0	0	114.8	L46 A48	P44-L46 VanDerWaalsContact C-N 3.31Å; P44-A48 PolarHBondContact O-N 2.88Å
45	D	53.8	Low	48.5	Very low	124 Å²	124	122.6 Å²	122.6	66%	0.663	71%	0.713	S	S	*	*	H	α-helix	trans	-72.1	-28.1	176.3	-83	-15.2	0	0	0	111.4	D43 A48 E49	D43-D45 VanDerWaalsContact C-N 3.31Å; D43-D45 PolarHBondContact O-N 2.79Å; D43-D45 PolarHBondContact OD1-N 2.89Å; D45-A48 WeakPolarHBondContact O-CB 3.12Å; D45-A48 PolarHBondContact O-N 2.62Å; D45-E49 PolarHBondContact O-N 3.23Å; D45-E49 VanDerWaalsContact O-N 3.09Å
46	L	50.4	Low	48.2	Very low	116 Å²	116	121 Å²	121	61%	0.607	71%	0.708	S	S	*	*	H	α-helix	trans	-70	-35.8	175.4	-75.1	171.8	0	0	0	113	D43 P44 A48 E49 L50	D43-L46 HydrophobicContact CB-CD1 4.36Å; D43-L46 PolarHBondContact O-N 3Å; P44-L46 VanDerWaalsContact C-N 3.31Å; L46-A48 VanDerWaalsContact C-N 3.29Å; L46-E49 PolarHBondContact O-N 3.16Å; L46-L50 WeakPolarHBondContact O-CB 3.43Å; L46-L50 PolarHBondContact O-N 2.97Å; L46-L50 VanDerWaalsContact O-N 3.08Å
47	E	52.8	Low	48.4	Very low	157 Å²	157	126 Å²	126	73%	0.734	71%	0.705	S	S	*	*	H	α-helix	trans	-65.2	-35.1	170.7	-78.8	-155.7	131.3	0	0	111.6	L50 A51	E47-L50 PolarHBondContact O-N 2.97Å; E47-A51 VanDerWaalsContact O-CB 3.28Å; E47-A51 WeakPolarHBondContact O-CB 3.23Å; E47-A51 PolarHBondContact O-N 3.43Å
48	A	58.2	Low	48	Very low	57 Å²	57	126.2 Å²	126.2	47%	0.471	71%	0.706	S	S	.	*	H	α-helix	trans	-66.7	-40.1	178.1	0	0	0	0	0	112.4	P44 D45 L46 A52	P44-A48 PolarHBondContact O-N 2.88Å; D45-A48 WeakPolarHBondContact O-CB 3.12Å; D45-A48 PolarHBondContact O-N 2.62Å; L46-A48 VanDerWaalsContact C-N 3.29Å; A48-A52 PolarHBondContact O-N 3.31Å
49	E	63.4	Low	47.8	Very low	141 Å²	141	121.6 Å²	121.6	66%	0.659	70%	0.701	S	S	*	*	H	α-helix	trans	-67.6	-40.6	173.4	-67.7	-164.1	155.1	0	0	112.1	D45 L46 A51 A52 L53	D45-E49 PolarHBondContact O-N 3.23Å; D45-E49 VanDerWaalsContact O-N 3.09Å; L46-E49 PolarHBondContact O-N 3.16Å; E49-A51 PolarHBondContact O-N 2.94Å; E49-A52 WeakPolarHBondContact O-CB 2.94Å; E49-A52 PolarHBondContact O-N 3.19Å; E49-L53 PolarHBondContact O-N 3.32Å
50	L	47.1	Very low	47.2	Very low	115 Å²	115	117.9 Å²	117.9	60%	0.602	70%	0.701	S	S	*	*	H	α-helix	trans	-67.5	-37.3	178.3	-150.5	162.1	0	0	0	111.6	L46 E47 L53 T54	L46-L50 WeakPolarHBondContact O-CB 3.43Å; L46-L50 PolarHBondContact O-N 2.97Å; L46-L50 VanDerWaalsContact O-N 3.08Å; E47-L50 PolarHBondContact O-N 2.97Å; L50-L53 PolarHBondContact O-N 3.42Å; L50-T54 HydrophobicContact CD2-CG2 3.96Å; L50-T54 WeakPolarHBondContact O-CG2 3.33Å; L50-T54 PolarHBondContact O-N 3.24Å; L50-T54 VanDerWaalsContact O-N 3.1Å; L50-T54 PolarHBondContact O-OG1 3.11Å
51	A	58.2	Low	47.1	Very low	57 Å²	57	121.7 Å²	121.7	47%	0.471	70%	0.703	S	S	.	*	H	α-helix	trans	-65.2	-35.7	171.3	0	0	0	0	0	112.7	E47 E49 T54 G55	E47-A51 VanDerWaalsContact O-CB 3.28Å; E47-A51 WeakPolarHBondContact O-CB 3.23Å; E47-A51 PolarHBondContact O-N 3.43Å; E49-A51 PolarHBondContact O-N 2.94Å; A51-T54 PolarHBondContact O-OG1 3.25Å; A51-G55 PolarHBondContact O-N 2.95Å
52	A	64	Low	46.2	Very low	81 Å²	81	118.5 Å²	118.5	67%	0.669	71%	0.706	S	S	*	*	H	α-helix	trans	-67.3	-37.8	173.6	0	0	0	0	0	112.1	A48 E49	A48-A52 PolarHBondContact O-N 3.31Å; E49-A52 WeakPolarHBondContact O-CB 2.94Å; E49-A52 PolarHBondContact O-N 3.19Å
53	L	47.3	Very low	45.7	Very low	158 Å²	158	121.2 Å²	121.2	83%	0.827	71%	0.709	S	S	*	*	H	α-helix	trans	-72.9	-24.9	179.4	-146.7	75.5	0	0	0	113.6	E49 L50	E49-L53 PolarHBondContact O-N 3.32Å; L50-L53 PolarHBondContact O-N 3.42Å
54	T	48.3	Very low	45.1	Very low	93 Å²	93	121.5 Å²	121.5	57%	0.571	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	0.3	-176.1	51	0	0	0	0	114.6	L50 A51 N56	L50-T54 HydrophobicContact CD2-CG2 3.96Å; L50-T54 WeakPolarHBondContact O-CG2 3.33Å; L50-T54 PolarHBondContact O-N 3.24Å; L50-T54 VanDerWaalsContact O-N 3.1Å; L50-T54 PolarHBondContact O-OG1 3.11Å; A51-T54 PolarHBondContact O-OG1 3.25Å; T54-N56 PolarHBondContact O-N 3.07Å
55	G	42.9	Very low	44.5	Very low	66 Å²	66	126.4 Å²	126.4	68%	0.68	74%	0.737	S	S	*	*			trans	69.1	4.8	163.6	0	0	0	0	0	117.4	A51	A51-G55 PolarHBondContact O-N 2.95Å
56	N	36.9	Very low	44.2	Very low	151 Å²	151	125.8 Å²	125.8	81%	0.807	74%	0.74	S	S	*	*			trans	-85.8	128.6	-172.3	-163.4	11.1	0	0	0	112.2	T54	T54-N56 PolarHBondContact O-N 3.07Å
57	K	42	Very low	43.4	Very low	194 Å²	194	130 Å²	130	84%	0.843	75%	0.753	S	S	*	*			trans	-144.2	119	-167.2	-172	169.4	-171.3	163.2	0	115.2
58	A	32.7	Very low	42.6	Very low	98 Å²	98	126.1 Å²	126.1	81%	0.81	76%	0.756	S	S	*	*			trans	-126.9	82.2	-178.1	0	0	0	0	0	115
59	A	32.8	Very low	41.6	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	78%	0.777	S	S	*	*			trans	59.2	147.7	143.7	0	0	0	0	0	124.5
60	A	33.1	Very low	40.5	Very low	100 Å²	100	131.8 Å²	131.8	83%	0.826	78%	0.781	S	S	*	*			trans	75.3	138.3	155.9	0	0	0	0	0	119.8
61	R	32.7	Very low	40.6	Very low	248 Å²	248	132.6 Å²	132.6	94%	0.936	79%	0.793	S	S	*	*			cis	-173.5	128.7	-10.3	179	-175.4	-166.4	-164.2	5.6	110.4
62	G	31.6	Very low	40.2	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	81%	0.81	S	S	*	*			trans	163.3	77	170.5	0	0	0	0	0	120.3
63	K	35.7	Very low	40.4	Very low	218 Å²	218	137 Å²	137	95%	0.948	80%	0.801	S	S	*	*			trans	-47.7	138.2	-178.8	-60.2	170.9	176.3	178.4	0	118.6
64	A	31.9	Very low	40.9	Very low	105 Å²	105	136.5 Å²	136.5	87%	0.868	80%	0.796	S	S	*	*			trans	-159.6	158.6	130.9	0	0	0	0	0	111.5
65	K	39.8	Very low	41.7	Very low	200 Å²	200	138.9 Å²	138.9	87%	0.87	80%	0.801	S	S	*	*			trans	-153.2	154.5	-178.5	-131	179	-174.2	177.4	0	109.2
66	P	47	Very low	42.5	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	79%	0.792	S	S	*	*				-154.4	158	81.8	39.2	-19.9	0	0	0	118.7
67	K	34.1	Very low	43.8	Very low	204 Å²	204	138.8 Å²	138.8	89%	0.887	78%	0.783	S	S	*	*			trans	45.3	124.8	147.3	-59.9	170.7	-178.8	-178.6	0	120.1
68	G	35.2	Very low	44.9	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	76%	0.764	S	S	*	*			cis	122.5	138.5	-6.2	0	0	0	0	0	115.3
69	K	36.6	Very low	46.7	Very low	209 Å²	209	133.5 Å²	133.5	91%	0.909	75%	0.752	S	S	*	*			trans	-156.9	152.6	163.2	-104	172.3	-177.1	-177.5	0	110.9
70	S	40.3	Very low	48.2	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	74%	0.744	S	S	*	*			trans	-14.2	132.6	-179.9	48.6	0	0	0	0	121.4
71	P	48.8	Very low	49.9	Very low	132 Å²	132	132.3 Å²	132.3	86%	0.857	72%	0.722	S	S	*	*			trans	-83	174.3	159.2	0.5	19.6	0	0	0	113.4
72	L	51.4	Low	51.6	Low	156 Å²	156	125.3 Å²	125.3	82%	0.817	70%	0.703	S	S	*	*			trans	-79.2	159.1	169.3	-68.9	168.4	0	0	0	111.8
73	P	66.9	Low	53.2	Low	75 Å²	75	127.1 Å²	127.1	49%	0.487	69%	0.69	S	S	.	*			trans	-65.6	148.1	174.7	29.1	-35.6	0	0	0	111.6	D76	P73-D76 WeakPolarHBondContact CG-OD2 3.17Å
74	M	57.8	Low	54.6	Low	148 Å²	148	122.2 Å²	122.2	73%	0.729	68%	0.682	S	S	*	*	S	Bend	trans	-107.4	-18.6	176.7	-62.1	-169.8	-50.9	0	0	112.5	D76 I77 A78	M74-D76 VanDerWaalsContact C-N 3.3Å; M74-D76 PolarHBondContact O-N 2.97Å; M74-I77 PolarHBondContact O-N 2.96Å; M74-A78 PolarHBondContact O-N 3.37Å
75	E	65.6	Low	56.2	Low	142 Å²	142	123.9 Å²	123.9	66%	0.664	67%	0.674	S	S	*	*	H	α-helix	trans	-51.1	-46.4	176.5	-79.7	75.3	-177	0	0	112.2	I77 A78 K79	E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.47Å; E75-A78 PolarHBondContact O-N 2.7Å; E75-K79 WeakPolarHBondContact O-CB 3.21Å; E75-K79 PolarHBondContact O-N 3.26Å
76	D	59.4	Low	57.3	Low	93 Å²	93	123.1 Å²	123.1	50%	0.497	67%	0.665	S	S	.	*	H	α-helix	trans	-64.2	-37.3	-176.8	-53	-41.3	0	0	0	112.5	P73 M74 K79 M80	P73-D76 WeakPolarHBondContact CG-OD2 3.17Å; M74-D76 VanDerWaalsContact C-N 3.3Å; M74-D76 PolarHBondContact O-N 2.97Å; D76-K79 PolarHBondContact O-N 3.16Å; D76-M80 WeakPolarHBondContact O-CG 3.19Å; D76-M80 PolarHBondContact O-N 2.93Å; D76-M80 VanDerWaalsContact O-N 3.15Å
77	I	63.6	Low	57.4	Low	123 Å²	123	125.3 Å²	125.3	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-73.3	-39.1	178.4	-59.4	173.2	0	0	0	110.4	M74 E75 K79 A81	M74-I77 PolarHBondContact O-N 2.96Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.47Å; I77-K79 VanDerWaalsContact C-N 3.32Å; I77-A81 WeakPolarHBondContact O-CB 3.17Å; I77-A81 PolarHBondContact O-N 3.37Å; I77-A81 VanDerWaalsContact O-N 3.12Å
78	A	65.6	Low	57.9	Low	53 Å²	53	121.7 Å²	121.7	44%	0.438	67%	0.666	S	S	.	*	H	α-helix	trans	-63.8	-39.2	173.6	0	0	0	0	0	111.4	M74 E75 A81 D82	M74-A78 PolarHBondContact O-N 3.37Å; E75-A78 PolarHBondContact O-N 2.7Å; A78-A81 PolarHBondContact O-N 3.46Å; A78-D82 PolarHBondContact O-N 3.16Å
79	K	71.3	Confident	57.9	Low	128 Å²	128	125.3 Å²	125.3	56%	0.557	67%	0.667	S	S	*	*	H	α-helix	trans	-63.4	-47.1	178.9	-145.8	-172.9	178.5	-121.2	0	112.2	E75 D76 I77 A81 D82 E83	E75-K79 WeakPolarHBondContact O-CB 3.21Å; E75-K79 PolarHBondContact O-N 3.26Å; D76-K79 PolarHBondContact O-N 3.16Å; I77-K79 VanDerWaalsContact C-N 3.32Å; K79-A81 VanDerWaalsContact C-N 3.28Å; K79-A81 PolarHBondContact O-N 3.47Å; K79-D82 PolarHBondContact O-N 3.15Å; K79-E83 IonicContact NZ-OE1 2.64Å; K79-E83 PolarHBondContact NZ-OE1 3.07Å; K79-E83 WeakPolarHBondContact O-CB 3.27Å; K79-E83 WeakPolarHBondContact O-CG 3.49Å; K79-E83 PolarHBondContact O-N 2.94Å
80	M	63.8	Low	58.4	Low	125 Å²	125	124 Å²	124	62%	0.616	66%	0.664	S	S	*	*	H	α-helix	trans	-62.1	-35	174.4	-67.1	176.4	-170	0	0	112.3	D76 C84	D76-M80 WeakPolarHBondContact O-CG 3.19Å; D76-M80 PolarHBondContact O-N 2.93Å; D76-M80 VanDerWaalsContact O-N 3.15Å; M80-C84 WeakPolarHBondContact O-CB 3.46Å; M80-C84 PolarHBondContact O-N 2.85Å; M80-C84 PolarHBondContact O-SG 3.17Å; M80-C84 VanDerWaalsContact O-SG 3.34Å
81	A	68.8	Low	58.5	Low	45 Å²	45	126.1 Å²	126.1	37%	0.372	67%	0.667	S	S	.	*	H	α-helix	trans	-69.3	-41	176.3	0	0	0	0	0	112.8	I77 A78 K79 E83 C84 M85	I77-A81 WeakPolarHBondContact O-CB 3.17Å; I77-A81 PolarHBondContact O-N 3.37Å; I77-A81 VanDerWaalsContact O-N 3.12Å; A78-A81 PolarHBondContact O-N 3.46Å; K79-A81 VanDerWaalsContact C-N 3.28Å; K79-A81 PolarHBondContact O-N 3.47Å; A81-E83 VanDerWaalsContact C-N 3.33Å; A81-C84 PolarHBondContact O-N 2.91Å; A81-M85 PolarHBondContact O-N 2.97Å; A81-M85 VanDerWaalsContact O-N 3.09Å
82	D	67.6	Low	58.1	Low	102 Å²	102	128 Å²	128	55%	0.545	67%	0.67	S	S	.	*	H	α-helix	trans	-70.3	-27.2	175.9	-83.6	-2	0	0	0	112.8	A78 K79	A78-D82 PolarHBondContact O-N 3.16Å; K79-D82 PolarHBondContact O-N 3.15Å
83	E	66.5	Low	57.9	Low	117 Å²	117	128.2 Å²	128.2	55%	0.547	67%	0.672	S	S	.	*	H	α-helix	trans	-77.2	-35.9	172	-74.1	164.2	-176.3	0	0	111.2	K79 A81	K79-E83 IonicContact NZ-OE1 2.64Å; K79-E83 PolarHBondContact NZ-OE1 3.07Å; K79-E83 WeakPolarHBondContact O-CB 3.27Å; K79-E83 WeakPolarHBondContact O-CG 3.49Å; K79-E83 PolarHBondContact O-N 2.94Å; A81-E83 VanDerWaalsContact C-N 3.33Å
84	C	64.8	Low	56.6	Low	115 Å²	115	132.4 Å²	132.4	78%	0.777	69%	0.69	S	S	*	*	H	α-helix	trans	-78	-13.4	175.7	-73.2	0	0	0	0	115.8	M80 A81	M80-C84 WeakPolarHBondContact O-CB 3.46Å; M80-C84 PolarHBondContact O-N 2.85Å; M80-C84 PolarHBondContact O-SG 3.17Å; M80-C84 VanDerWaalsContact O-SG 3.34Å; A81-C84 PolarHBondContact O-N 2.91Å
85	M	64.8	Low	56.2	Low	140 Å²	140	133.1 Å²	133.1	69%	0.69	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	18.4	175.9	-65.8	-168.3	-58	0	0	113	A81 D87	A81-M85 PolarHBondContact O-N 2.97Å; A81-M85 VanDerWaalsContact O-N 3.09Å; M85-D87 PolarHBondContact O-N 3.12Å
86	R	63	Low	55.5	Low	184 Å²	184	131.9 Å²	131.9	69%	0.694	70%	0.695	S	S	*	*			trans	-97	82.2	178.7	-150.3	-179.6	-152.1	88.2	-0.7	110.1	V88	R86-V88 PolarHBondContact O-N 3.13Å
87	D	50.3	Low	55.2	Low	156 Å²	156	134.5 Å²	134.5	83%	0.834	71%	0.707	S	S	*	*			trans	-56.6	129	168.6	-63.5	-47.3	0	0	0	109.2	M85	M85-D87 PolarHBondContact O-N 3.12Å
88	V	43.7	Very low	54.6	Low	128 Å²	128	137.5 Å²	137.5	78%	0.776	72%	0.719	S	S	*	*			trans	-120.5	118.5	173.6	177.5	0	0	0	0	106.9	R86	R86-V88 PolarHBondContact O-N 3.13Å
89	D	35.4	Very low	53.9	Low	154 Å²	154	141 Å²	141	82%	0.824	73%	0.73	S	S	*	*			trans	-67.8	171.3	179.3	-66.2	-65.7	0	0	0	112.4
90	E	46.5	Very low	53.3	Low	182 Å²	182	139.1 Å²	139.1	85%	0.85	73%	0.726	S	S	*	*	S	Bend	trans	-67.9	161	-173	-60.8	175.4	124	0	0	114.7
91	D	43	Very low	53.2	Low	150 Å²	150	141 Å²	141	80%	0.802	73%	0.733	S	S	*	*			trans	64.1	103	163.1	-60.8	-20.5	0	0	0	120.1
92	D	39.9	Very low	52.8	Low	171 Å²	171	145.2 Å²	145.2	91%	0.914	75%	0.75	S	S	*	*				-167.4	157.2	118.1	-107.6	-26.6	0	0	0	111.5
93	D	47	Very low	52.2	Low	162 Å²	162	145 Å²	145	87%	0.866	75%	0.748	S	S	*	*			trans	-80.2	144.7	174.8	-68.3	-62.3	0	0	0	112
94	D	40.5	Very low	51.8	Low	162 Å²	162	144.4 Å²	144.4	87%	0.866	75%	0.748	S	S	*	*			trans	-156.7	147.4	140.5	-141.6	-16	0	0	0	114.2
95	D	49.9	Very low	51.6	Low	163 Å²	163	141.8 Å²	141.8	87%	0.872	73%	0.734	S	S	*	*			trans	-100.7	91.4	-179.7	-88.8	-55.4	0	0	0	110.3
96	N	49.9	Very low	51.7	Low	117 Å²	117	141.7 Å²	141.7	63%	0.626	73%	0.732	S	S	*	*			trans	-149.9	86.3	168.3	-158.7	57.5	0	0	0	115.6
97	I	53.1	Low	51.1	Low	148 Å²	148	137.7 Å²	137.7	76%	0.759	72%	0.724	S	S	*	*			trans	-114.5	-3.5	172.3	-75.5	174.2	0	0	0	112.1	D99	I97-D99 PolarHBondContact O-N 3.22Å
98	E	50.8	Low	51.1	Low	185 Å²	185	137.7 Å²	137.7	86%	0.864	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-9.9	-171.8	-60.5	-161.8	144.4	0	0	115.2
99	D	51	Low	51.8	Low	128 Å²	128	139.8 Å²	139.8	68%	0.684	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	25.5	-177.4	-78.2	-40.1	0	0	0	114.1	I97 E101	I97-D99 PolarHBondContact O-N 3.22Å; D99-E101 PolarHBondContact O-N 3.37Å; D99-E101 VanDerWaalsContact O-N 3.07Å
100	D	59.6	Low	52.5	Low	88 Å²	88	138.1 Å²	138.1	47%	0.471	72%	0.715	S	S	.	*			trans	-76.9	93.8	-179.8	-160.3	-4.9	0	0	0	111.9	D102 L103 L104	D100-D102 VanDerWaalsContact C-N 3.33Å; D100-D102 PolarHBondContact O-N 2.9Å; D100-L103 HydrophobicContact CB-CB 4.12Å; D100-L103 WeakPolarHBondContact O-CB 3.43Å; D100-L103 PolarHBondContact O-N 3.49Å; D100-L104 PolarHBondContact O-N 3.31Å
101	E	61.3	Low	52.4	Low	164 Å²	164	134.7 Å²	134.7	77%	0.766	71%	0.707	S	S	*	*	H	α-helix	trans	-63.1	-32.6	-168.3	-165.3	171.4	-178.2	0	0	113.5	D99 L103 L104 A105	D99-E101 PolarHBondContact O-N 3.37Å; D99-E101 VanDerWaalsContact O-N 3.07Å; E101-L103 VanDerWaalsContact C-N 3.35Å; E101-L104 PolarHBondContact O-N 3.41Å; E101-A105 PolarHBondContact O-N 3.37Å; E101-A105 VanDerWaalsContact O-N 3.14Å
102	D	59.4	Low	52	Low	134 Å²	134	130.2 Å²	130.2	72%	0.717	70%	0.696	S	S	*	*	H	α-helix	trans	-68.3	-33.6	174.6	-79.5	-33.4	0	0	0	111.8	D100 A105 E106	D100-D102 VanDerWaalsContact C-N 3.33Å; D100-D102 PolarHBondContact O-N 2.9Å; D102-A105 WeakPolarHBondContact O-CB 3.35Å; D102-A105 PolarHBondContact O-N 2.96Å; D102-E106 PolarHBondContact O-N 3.39Å
103	L	56.8	Low	51.8	Low	98 Å²	98	130.1 Å²	130.1	51%	0.513	70%	0.696	S	S	.	*	H	α-helix	trans	-71.7	-32	177.4	-155.8	80.5	0	0	0	112	D100 E101 L107	D100-L103 HydrophobicContact CB-CB 4.12Å; D100-L103 WeakPolarHBondContact O-CB 3.43Å; D100-L103 PolarHBondContact O-N 3.49Å; E101-L103 VanDerWaalsContact C-N 3.35Å; L103-L107 PolarHBondContact O-N 2.93Å
104	L	56.5	Low	51.2	Low	104 Å²	104	131.8 Å²	131.8	55%	0.545	70%	0.698	S	S	.	*	H	α-helix	trans	-69.3	-34.4	171.9	-68.5	173.7	0	0	0	111.7	D100 E101 L107 Q108	D100-L104 PolarHBondContact O-N 3.31Å; E101-L104 PolarHBondContact O-N 3.41Å; L104-L107 PolarHBondContact O-N 3.14Å; L104-Q108 WeakPolarHBondContact O-CB 3.46Å; L104-Q108 PolarHBondContact O-N 3.47Å
105	A	62.1	Low	50.8	Low	59 Å²	59	133.3 Å²	133.3	49%	0.488	70%	0.7	S	S	.	*	H	α-helix	trans	-64	-45.5	175.1	0	0	0	0	0	112.3	E101 D102 L107 Q108 E109	E101-A105 PolarHBondContact O-N 3.37Å; E101-A105 VanDerWaalsContact O-N 3.14Å; D102-A105 WeakPolarHBondContact O-CB 3.35Å; D102-A105 PolarHBondContact O-N 2.96Å; A105-L107 PolarHBondContact O-N 3.14Å; A105-Q108 PolarHBondContact O-N 3.4Å; A105-E109 PolarHBondContact O-N 3.15Å
106	E	66.7	Low	49.9	Very low	138 Å²	138	132.4 Å²	132.4	65%	0.645	70%	0.7	S	S	*	*	H	α-helix	trans	-62.6	-40.1	174.6	-70.5	-159.5	151.3	0	0	112.3	D102 Q108 E109 V110	D102-E106 PolarHBondContact O-N 3.39Å; E106-Q108 VanDerWaalsContact C-N 3.3Å; E106-Q108 PolarHBondContact O-N 2.73Å; E106-E109 PolarHBondContact O-N 2.93Å; E106-V110 WeakPolarHBondContact O-CG2 3.36Å; E106-V110 PolarHBondContact O-N 3.07Å; E106-V110 VanDerWaalsContact O-N 3.13Å
107	L	50.3	Low	48.9	Very low	100 Å²	100	130 Å²	130	52%	0.524	70%	0.703	S	S	.	*	H	α-helix	trans	-65.1	-33.6	176.6	-100.4	167.1	0	0	0	112.8	L103 L104 A105 V110 V111	L103-L107 PolarHBondContact O-N 2.93Å; L104-L107 PolarHBondContact O-N 3.14Å; A105-L107 PolarHBondContact O-N 3.14Å; L107-V110 PolarHBondContact O-N 3.36Å; L107-V111 WeakPolarHBondContact O-CG2 3.41Å; L107-V111 PolarHBondContact O-N 3.18Å
108	Q	50.5	Low	47.6	Very low	156 Å²	156	130.8 Å²	130.8	73%	0.729	71%	0.709	S	S	*	*	H	α-helix	trans	-68.5	-32.8	175.8	-167.1	66.9	42	0	0	112.2	L104 A105 E106	L104-Q108 WeakPolarHBondContact O-CB 3.46Å; L104-Q108 PolarHBondContact O-N 3.47Å; A105-Q108 PolarHBondContact O-N 3.4Å; E106-Q108 VanDerWaalsContact C-N 3.3Å; E106-Q108 PolarHBondContact O-N 2.73Å
109	E	58.1	Low	46.5	Very low	173 Å²	173	125.6 Å²	125.6	81%	0.808	70%	0.697	S	S	*	*	H	α-helix	trans	-73.1	-34.8	173.7	-171.6	173.5	172.5	0	0	112.2	A105 E106	A105-E109 PolarHBondContact O-N 3.15Å; E106-E109 PolarHBondContact O-N 2.93Å
110	V	49.3	Very low	45.3	Very low	118 Å²	118	124 Å²	124	72%	0.715	70%	0.702	S	S	*	*	H	α-helix	trans	-75.4	-22	-179.9	174	0	0	0	0	113.1	E106 L107 G112	E106-V110 WeakPolarHBondContact O-CG2 3.36Å; E106-V110 PolarHBondContact O-N 3.07Å; E106-V110 VanDerWaalsContact O-N 3.13Å; L107-V110 PolarHBondContact O-N 3.36Å; V110-G112 VanDerWaalsContact C-N 3.3Å; V110-G112 PolarHBondContact O-N 2.95Å
111	V	44.8	Very low	44.1	Very low	111 Å²	111	126 Å²	126	67%	0.673	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	29.7	-177.9	-175.1	0	0	0	0	113.5	L107	L107-V111 WeakPolarHBondContact O-CG2 3.41Å; L107-V111 PolarHBondContact O-N 3.18Å
112	G	34.4	Very low	42.9	Very low	56 Å²	56	124 Å²	124	58%	0.577	72%	0.719	S	S	*	*			trans	81.4	169.7	143.2	0	0	0	0	0	118.4	V110	V110-G112 VanDerWaalsContact C-N 3.3Å; V110-G112 PolarHBondContact O-N 2.95Å
113	D	35.3	Very low	41.5	Very low	169 Å²	169	122.8 Å²	122.8	90%	0.904	72%	0.721	S	S	*	*			trans	-153.7	92.6	170	-130.7	-15.7	0	0	0	110.5
114	E	33.7	Very low	40.3	Very low	197 Å²	197	123.2 Å²	123.2	92%	0.921	73%	0.732	S	S	*	*			trans	-121.6	97.6	160	-83.2	-161.5	159.9	0	0	108.7
115	E	33.2	Very low	38.8	Very low	194 Å²	194	124.2 Å²	124.2	91%	0.907	74%	0.743	S	S	*	*				-160.6	-179.5	128.7	-123.7	-175.8	151.7	0	0	112.9
116	V	30.7	Very low	37.1	Very low	143 Å²	143	127.1 Å²	127.1	87%	0.867	76%	0.759	S	S	*	*			trans	-134.2	126.8	-162.6	173.5	0	0	0	0	113.2
117	G	28.8	Very low	35.1	Very low	67 Å²	67	125.8 Å²	125.8	69%	0.691	77%	0.765	S	S	*	*			trans	83.5	154.9	163.5	0	0	0	0	0	115.2
118	D	27	Very low	34	Very low	165 Å²	165	125.1 Å²	125.1	88%	0.882	77%	0.774	S	S	*	*			cis	-159.1	166.5	-8	-146.6	31.3	0	0	0	107
119	A	26.3	Very low	32.9	Very low	75 Å²	75	123.3 Å²	123.3	62%	0.62	78%	0.779	S	S	*	*			cis	-158.1	-175.4	17.7	0	0	0	0	0	112.6
120	A	26.1	Very low	31.6	Very low	94 Å²	94	119.8 Å²	119.8	78%	0.777	78%	0.779	S	S	*	*			trans	62.1	91.9	152.7	0	0	0	0	0	119.3
121	T	34	Very low	30.4	Very low	132 Å²	132	121.4 Å²	121.4	81%	0.81	78%	0.784	S	S	*	*			trans	-50.4	147.8	141.2	49.5	0	0	0	0	111.1
122	P	36.8	Very low	29.7	Very low	122 Å²	122	120.3 Å²	120.3	79%	0.792	78%	0.781	S	S	*	*				-148.8	164.1	59.2	42.2	-23.2	0	0	0	119.3
123	S	30.7	Very low	29.5	Very low	107 Å²	107	122.6 Å²	122.6	75%	0.748	79%	0.788	S	S	*	*			trans	-70	174.1	159	-32.2	0	0	0	0	110.6
124	S	30.6	Very low	29.2	Very low	107 Å²	107	123 Å²	123	75%	0.748	79%	0.785	S	S	*	*			cis	-145.7	-159	12.4	-74.8	0	0	0	0	107
125	T	26.1	Very low	28.9	Very low	126 Å²	126	119 Å²	119	77%	0.773	77%	0.773	S	S	*	*			cis	-170.5	157.5	31.1	45.7	0	0	0	0	110.8
126	S	25.5	Very low	28.7	Very low	120 Å²	120	117.7 Å²	117.7	84%	0.839	77%	0.767	S	S	*	*				-133.1	145.8	116.6	66.8	0	0	0	0	107.6
127	S	25.4	Very low	28.3	Very low	109 Å²	109	116.9 Å²	116.9	76%	0.762	76%	0.763	S	S	*	*	S	Bend	cis	-138.5	179.5	24.5	58.1	0	0	0	0	114.2
128	A	26.6	Very low	28.2	Very low	86 Å²	86	119.7 Å²	119.7	71%	0.711	77%	0.766	S	S	*	*			trans	84	86.5	166.1	0	0	0	0	0	120.4
129	S	28.3	Very low	28.1	Very low	119 Å²	119	120.4 Å²	120.4	83%	0.832	76%	0.764	S	S	*	*				92.7	118.7	123.6	-55.5	0	0	0	0	122.6
130	A	29.3	Very low	29.1	Very low	99 Å²	99	121.5 Å²	121.5	82%	0.818	77%	0.765	S	S	*	*			trans	83.3	100.7	138.1	0	0	0	0	0	122.4
131	D	25.3	Very low	30	Very low	151 Å²	151	122.6 Å²	122.6	81%	0.807	76%	0.764	S	S	*	*				96.8	129.9	123.3	-150.7	21.7	0	0	0	122.9
132	S	29.4	Very low	29.6	Very low	88 Å²	88	120.7 Å²	120.7	62%	0.615	76%	0.762	S	S	*	*			trans	40.8	110.1	152.2	-71.2	0	0	0	0	125.5
133	S	29.5	Very low	29.4	Very low	105 Å²	105	119.7 Å²	119.7	73%	0.734	76%	0.764	S	S	*	*				83.2	111.9	107.8	-56.2	0	0	0	0	124
134	Q	29.5	Very low	29.2	Very low	178 Å²	178	124.2 Å²	124.2	83%	0.832	77%	0.773	S	S	*	*				91.9	130	122.6	-104.6	-175.2	-3.7	0	0	125.3
135	V	26.9	Very low	29.2	Very low	111 Å²	111	127.7 Å²	127.7	67%	0.673	78%	0.778	S	S	*	*			trans	58.1	127	151.2	-71.6	0	0	0	0	126.4
136	E	29.2	Very low	29.7	Very low	168 Å²	168	127.7 Å²	127.7	79%	0.785	78%	0.777	S	S	*	*			trans	59.4	106.9	131.2	-63	-177.1	104.3	0	0	125.3
137	T	23.3	Very low	29.9	Very low	125 Å²	125	132.1 Å²	132.1	77%	0.767	78%	0.781	S	S	*	*				55.7	144.5	110.4	-30.8	0	0	0	0	123.5
138	V	25.8	Very low	30.5	Very low	126 Å²	126	132.9 Å²	132.9	76%	0.764	78%	0.781	S	S	*	*			trans	108.5	91.2	155.1	-170	0	0	0	0	118.6
139	E	25.2	Very low	31	Very low	181 Å²	181	134.7 Å²	134.7	85%	0.846	79%	0.788	S	S	*	*				56.3	-174	125.3	-120.1	-159.4	126.4	0	0	121.5
140	P	47.8	Very low	31.7	Very low	98 Å²	98	135.5 Å²	135.5	64%	0.636	79%	0.789	S	S	*	*			trans	-118.2	-162.4	-132.4	45.7	-26.8	0	0	0	112.6
141	P	45.2	Very low	32.8	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	76%	0.763	S	S	*	*			cis	-139.8	-166.8	2.4	44.4	-25.2	0	0	0	116.4
142	A	24.5	Very low	34.1	Very low	93 Å²	93	128.5 Å²	128.5	77%	0.769	75%	0.752	S	S	*	*			trans	85.4	114	153.8	0	0	0	0	0	120.7
143	A	32.4	Very low	35.1	Very low	100 Å²	100	129.9 Å²	129.9	83%	0.826	76%	0.759	S	S	*	*			trans	26.6	118.2	144.3	0	0	0	0	0	121.6
144	Q	27.6	Very low	36.5	Very low	203 Å²	203	128.3 Å²	128.3	95%	0.949	76%	0.759	S	S	*	*				-150.1	168.4	128.8	-116.7	172.9	26.9	0	0	111.7
145	E	30	Very low	38.9	Very low	180 Å²	180	121.6 Å²	121.6	84%	0.841	73%	0.732	S	S	*	*			trans	-101	146.8	-154.2	-72.3	-176.2	120.2	0	0	116.4
146	V	36.1	Very low	41.5	Very low	126 Å²	126	119 Å²	119	76%	0.764	71%	0.714	S	S	*	*			trans	56.6	113.3	146.7	177.9	0	0	0	0	119
147	K	31.3	Very low	44.1	Very low	212 Å²	212	113.3 Å²	113.3	92%	0.922	69%	0.687	S	S	*	*				-148.7	96.9	124.3	-137.8	174.3	-171.4	176	0	112.4
148	V	37.5	Very low	47.1	Very low	126 Å²	126	110.7 Å²	110.7	76%	0.764	67%	0.666	S	S	*	*			trans	-112.5	132.3	169.8	-178.8	0	0	0	0	108.1	T150	V148-T150 PolarHBondContact O-N 3.19Å; V148-T150 VanDerWaalsContact O-N 3.12Å
149	S	36.9	Very low	49.9	Very low	123 Å²	123	107.3 Å²	107.3	86%	0.86	65%	0.646	S	S	*	*			trans	-73.1	100.9	179.7	-59.1	0	0	0	0	111
150	T	42.6	Very low	52.9	Low	136 Å²	136	98.7 Å²	98.7	83%	0.834	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-67.9	129.2	171.7	24.8	0	0	0	0	111.2	V148	V148-T150 PolarHBondContact O-N 3.19Å; V148-T150 VanDerWaalsContact O-N 3.12Å
151	A	52.5	Low	54.9	Low	35 Å²	35	96.5 Å²	96.5	29%	0.289	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-66	148.2	166.5	0	0	0	0	0	109.9
152	A	53.3	Low	57.1	Low	68 Å²	68	95.5 Å²	95.5	56%	0.562	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-61.9	137.5	-177.2	0	0	0	0	0	111.5	G154 S155	A152-G154 PolarHBondContact O-N 3.07Å; A152-S155 VanDerWaalsContact O-CB 3.27Å; A152-S155 WeakPolarHBondContact O-CB 3.41Å; A152-S155 PolarHBondContact O-N 3.4Å; A152-S155 VanDerWaalsContact O-N 3.08Å; A152-S155 PolarHBondContact O-OG 3.31Å
153	P	49.8	Very low	60.2	Low	117 Å²	117	93 Å²	93	76%	0.76	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	135	176.1	26.4	-34.1	0	0	0	110.1
154	G	59.8	Low	63.1	Low	73 Å²	73	88.5 Å²	88.5	75%	0.753	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	2.3	-172	0	0	0	0	0	115.2	A152	A152-G154 PolarHBondContact O-N 3.07Å
155	S	78.7	Confident	66.2	Low	36 Å²	36	85.3 Å²	85.3	25%	0.252	49%	0.49	S	S	.	.			trans	-74.8	146	167.3	62.6	0	0	0	0	111.9	A152 Q157 H158 T159	A152-S155 VanDerWaalsContact O-CB 3.27Å; A152-S155 WeakPolarHBondContact O-CB 3.41Å; A152-S155 PolarHBondContact O-N 3.4Å; A152-S155 VanDerWaalsContact O-N 3.08Å; A152-S155 PolarHBondContact O-OG 3.31Å; S155-Q157 PolarHBondContact O-N 2.71Å; S155-H158 WeakPolarHBondContact O-CB 3.49Å; S155-H158 PolarHBondContact O-N 3.33Å; S155-T159 PolarHBondContact O-N 3.26Å; S155-T159 PolarHBondContact O-OG1 2.89Å
156	L	81.4	Confident	69.2	Low	56 Å²	56	78.8 Å²	78.8	29%	0.293	46%	0.461	S	S	.	.	H	α-helix	trans	-59	-29.8	178.5	-176.6	148	0	0	0	112.3	T159 L160 V200 E208	L156-T159 PolarHBondContact O-N 3.48Å; L156-L160 HydrophobicContact CD2-CD1 3.65Å; L156-L160 HydrophobicContact CD2-CG 4.27Å; L156-L160 WeakPolarHBondContact O-CG 3.35Å; L156-L160 PolarHBondContact O-N 3.13Å; L156-L160 VanDerWaalsContact O-N 3.14Å; L156-V200 HydrophobicContact CD2-CG2 3.6Å; L156-E208 HydrophobicContact CD1-CG 3.98Å
157	Q	84.3	Confident	71.9	Confident	49 Å²	49	73.5 Å²	73.5	23%	0.229	43%	0.427	C	S	.	.	H	α-helix	trans	-62	-49.4	172.7	-162.3	-166.3	-66	0	0	111.8	S155 T159 L160 E161 V200 K201	S155-Q157 PolarHBondContact O-N 2.71Å; Q157-T159 VanDerWaalsContact C-N 3.3Å; Q157-T159 PolarHBondContact O-N 2.97Å; Q157-L160 PolarHBondContact O-N 3.1Å; Q157-L160 VanDerWaalsContact O-N 3.11Å; Q157-E161 HydrophobicContact CG-CG 4.48Å; Q157-E161 WeakPolarHBondContact CG-OE2 3.46Å; Q157-E161 PolarHBondContact NE2-OE1 3.49Å; Q157-E161 PolarHBondContact NE2-OE2 3.3Å; Q157-E161 WeakPolarHBondContact O-CG 3.24Å; Q157-E161 PolarHBondContact O-N 3.16Å; Q157-V200 HydrophobicContact CB-CG1 3.93Å; Q157-V200 HydrophobicContact CG-CG1 4.13Å; Q157-K201 VanDerWaalsContact NE2-CE 3.27Å
158	H	85.9	Confident	74.9	Confident	71 Å²	71	68 Å²	68	33%	0.329	40%	0.403	S	S	.	.	H	α-helix	trans	-57.2	-43.6	177	-176.8	-59.3	0	0	0	111.3	S155 L160 E161 E162	S155-H158 WeakPolarHBondContact O-CB 3.49Å; S155-H158 PolarHBondContact O-N 3.33Å; H158-L160 VanDerWaalsContact C-N 3.27Å; H158-L160 PolarHBondContact O-N 3.28Å; H158-E161 PolarHBondContact O-N 3.26Å; H158-E162 IonicContact CE1-OE2 3.41Å; H158-E162 IonicContact ND1-OE2 2.72Å; H158-E162 PolarHBondContact ND1-OE2 3.41Å; H158-E162 VanDerWaalsContact O-CB 3.24Å; H158-E162 WeakPolarHBondContact O-CB 3.49Å; H158-E162 PolarHBondContact O-N 3.18Å
159	T	85.3	Confident	77.5	Confident	54 Å²	54	64.5 Å²	64.5	33%	0.331	38%	0.382	S	S	.	.	H	α-helix	trans	-66.9	-24.2	179.4	-54.3	0	0	0	0	113.8	S155 L156 Q157 R163	S155-T159 PolarHBondContact O-N 3.26Å; S155-T159 PolarHBondContact O-OG1 2.89Å; L156-T159 PolarHBondContact O-N 3.48Å; Q157-T159 VanDerWaalsContact C-N 3.3Å; Q157-T159 PolarHBondContact O-N 2.97Å; T159-R163 VanDerWaalsContact O-CB 3.24Å; T159-R163 WeakPolarHBondContact O-CB 3.32Å; T159-R163 PolarHBondContact O-NH1 2.95Å; T159-R163 VanDerWaalsContact O-NH1 3.13Å
160	L	88.2	Confident	80.1	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-82.1	-41	171	-69.3	170.1	0	0	0	111.8	L156 Q157 H158 R163 A164 L193 M196 I197 V200 I211	L156-L160 HydrophobicContact CD2-CD1 3.65Å; L156-L160 HydrophobicContact CD2-CG 4.27Å; L156-L160 WeakPolarHBondContact O-CG 3.35Å; L156-L160 PolarHBondContact O-N 3.13Å; L156-L160 VanDerWaalsContact O-N 3.14Å; Q157-L160 PolarHBondContact O-N 3.1Å; Q157-L160 VanDerWaalsContact O-N 3.11Å; H158-L160 VanDerWaalsContact C-N 3.27Å; H158-L160 PolarHBondContact O-N 3.28Å; L160-R163 PolarHBondContact O-N 2.79Å; L160-A164 PolarHBondContact O-N 3.45Å; L160-L193 HydrophobicContact CD2-CD2 3.74Å; L160-M196 HydrophobicContact CD1-CB 3.84Å; L160-M196 HydrophobicContact CD2-CB 4.09Å; L160-M196 HydrophobicContact CD2-CE 4.01Å; L160-M196 HydrophobicContact CD2-SD 4.12Å; L160-I197 HydrophobicContact CB-CD1 4.25Å; L160-I197 HydrophobicContact CB-CG1 3.61Å; L160-I197 HydrophobicContact CD1-CG1 4.4Å; L160-V200 HydrophobicContact CD1-CG2 3.91Å; L160-I211 HydrophobicContact CD2-CD1 4.04Å; L160-I211 HydrophobicContact CD2-CG1 4.06Å; L160-I211 HydrophobicContact CD2-CG2 4.09Å
161	E	90.7	Very high	82.5	Confident	51 Å²	51	52.9 Å²	52.9	24%	0.238	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-50	-178.9	-71.5	174.4	142.9	0	0	111.4	Q157 H158 R163 A164 E165 I197 K201	Q157-E161 HydrophobicContact CG-CG 4.48Å; Q157-E161 WeakPolarHBondContact CG-OE2 3.46Å; Q157-E161 PolarHBondContact NE2-OE1 3.49Å; Q157-E161 PolarHBondContact NE2-OE2 3.3Å; Q157-E161 WeakPolarHBondContact O-CG 3.24Å; Q157-E161 PolarHBondContact O-N 3.16Å; H158-E161 PolarHBondContact O-N 3.26Å; E161-R163 PolarHBondContact O-N 2.9Å; E161-A164 WeakPolarHBondContact O-CB 3.45Å; E161-A164 PolarHBondContact O-N 3.22Å; E161-E165 PolarHBondContact O-N 3.11Å; E161-E165 VanDerWaalsContact O-N 3.09Å; E161-I197 HydrophobicContact CG-CD1 3.81Å; E161-I197 HydrophobicContact CG-CG1 4Å; E161-I197 HydrophobicContact CG-CG2 4.14Å; E161-K201 WeakPolarHBondContact OE1-CE 3.42Å; E161-K201 IonicContact OE1-NZ 2.78Å; E161-K201 PolarHBondContact OE1-NZ 3.11Å
162	E	90.6	Very high	84.4	Confident	95 Å²	95	57.3 Å²	57.3	44%	0.444	32%	0.321	S	S	.	.	H	α-helix	trans	-54	-40.3	171.6	-177.9	-171	161.7	0	0	112.2	H158 E165 M166	H158-E162 IonicContact CE1-OE2 3.41Å; H158-E162 IonicContact ND1-OE2 2.72Å; H158-E162 PolarHBondContact ND1-OE2 3.41Å; H158-E162 VanDerWaalsContact O-CB 3.24Å; H158-E162 WeakPolarHBondContact O-CB 3.49Å; H158-E162 PolarHBondContact O-N 3.18Å; E162-E165 PolarHBondContact O-N 2.97Å; E162-M166 HydrophobicContact CG-CE 4.46Å; E162-M166 PolarHBondContact O-N 3.24Å; E162-M166 VanDerWaalsContact O-N 3.11Å
163	R	89.9	Confident	86.2	Confident	42 Å²	42	57.3 Å²	57.3	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-73.7	-33.1	178.7	-169.8	-173.1	-105.2	84.1	-10.5	112.3	T159 L160 E161 E165 M166 Y167 L193 P212	T159-R163 VanDerWaalsContact O-CB 3.24Å; T159-R163 WeakPolarHBondContact O-CB 3.32Å; T159-R163 PolarHBondContact O-NH1 2.95Å; T159-R163 VanDerWaalsContact O-NH1 3.13Å; L160-R163 PolarHBondContact O-N 2.79Å; E161-R163 PolarHBondContact O-N 2.9Å; R163-E165 VanDerWaalsContact C-N 3.31Å; R163-M166 HydrophobicContact CB-CE 4.22Å; R163-M166 HydrophobicContact CG-CE 4.38Å; R163-M166 PolarHBondContact O-N 3.39Å; R163-Y167 HydrophobicContact CG-CD2 4.29Å; R163-Y167 HydrophobicContact CG-CE2 4.36Å; R163-Y167 WeakPolarHBondContact O-CD2 3.21Å; R163-Y167 PolarHBondContact O-N 3Å; R163-L193 HydrophobicContact CB-CD1 4.37Å; R163-L193 HydrophobicContact CB-CD2 4.23Å; R163-L193 HydrophobicContact CG-CD1 3.85Å; R163-L193 HydrophobicContact CG-CD2 4.03Å; R163-P212 VanDerWaalsContact CD-O 3.23Å; R163-P212 WeakPolarHBondContact CD-O 3.47Å; R163-P212 PolarHBondContact NE-O 3.29Å
164	A	92.4	Very high	88.1	Confident	5 Å²	5	51.9 Å²	51.9	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-63.6	-38.6	172.1	0	0	0	0	0	111	L160 E161 Y167 K168 L190 L193 I197	L160-A164 PolarHBondContact O-N 3.45Å; E161-A164 WeakPolarHBondContact O-CB 3.45Å; E161-A164 PolarHBondContact O-N 3.22Å; A164-Y167 PolarHBondContact O-N 2.78Å; A164-K168 WeakPolarHBondContact O-CG 3.45Å; A164-K168 PolarHBondContact O-N 2.97Å; A164-L190 HydrophobicContact CB-CD1 4.38Å; A164-L190 WeakPolarHBondContact O-CD1 3.46Å; A164-L193 HydrophobicContact CB-CB 4.28Å; A164-I197 HydrophobicContact CB-CD1 4.02Å
165	E	92.9	Very high	89.6	Confident	135 Å²	135	53.9 Å²	53.9	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-65.8	-41.6	174.9	-67.2	179.7	177.7	0	0	112.8	E161 E162 R163 Y167 K168 T169	E161-E165 PolarHBondContact O-N 3.11Å; E161-E165 VanDerWaalsContact O-N 3.09Å; E162-E165 PolarHBondContact O-N 2.97Å; R163-E165 VanDerWaalsContact C-N 3.31Å; E165-Y167 VanDerWaalsContact C-N 3.27Å; E165-Y167 PolarHBondContact O-N 2.77Å; E165-K168 PolarHBondContact O-N 3.33Å; E165-T169 PolarHBondContact O-N 2.81Å; E165-T169 PolarHBondContact O-OG1 3.45Å
166	M	92.5	Very high	90	Very high	44 Å²	44	56.9 Å²	56.9	22%	0.217	29%	0.285	C	S	.	.	H	α-helix	trans	-58.1	-39.3	169.7	-74	-169.3	-82.1	0	0	112.1	E162 R163 T169 A170 P214 V215 T217	E162-M166 HydrophobicContact CG-CE 4.46Å; E162-M166 PolarHBondContact O-N 3.24Å; E162-M166 VanDerWaalsContact O-N 3.11Å; R163-M166 HydrophobicContact CB-CE 4.22Å; R163-M166 HydrophobicContact CG-CE 4.38Å; R163-M166 PolarHBondContact O-N 3.39Å; M166-T169 PolarHBondContact O-OG1 3.35Å; M166-T169 VanDerWaalsContact O-OG1 3.07Å; M166-A170 VanDerWaalsContact O-CB 3.22Å; M166-A170 WeakPolarHBondContact O-CB 3.49Å; M166-A170 PolarHBondContact O-N 2.87Å; M166-P214 HydrophobicContact CE-CB 4.29Å; M166-V215 HydrophobicContact CB-CG2 3.94Å; M166-V215 VanDerWaalsContact O-CG2 3.32Å; M166-V215 WeakPolarHBondContact O-CG2 3.22Å; M166-T217 HydrophobicContact CB-CG2 4.13Å; M166-T217 HydrophobicContact CG-CG2 4.22Å
167	Y	93.5	Very high	90.4	Very high	14 Å²	14	57.3 Å²	57.3	6%	0.055	30%	0.297	C	S	.	.	H	α-helix	trans	-69.3	-40.5	174.8	-91.9	-103.7	0	0	0	112.6	R163 A164 E165 T169 A170 I171 Y186 L193 P212 P213 V215	R163-Y167 HydrophobicContact CG-CD2 4.29Å; R163-Y167 HydrophobicContact CG-CE2 4.36Å; R163-Y167 WeakPolarHBondContact O-CD2 3.21Å; R163-Y167 PolarHBondContact O-N 3Å; A164-Y167 PolarHBondContact O-N 2.78Å; E165-Y167 VanDerWaalsContact C-N 3.27Å; E165-Y167 PolarHBondContact O-N 2.77Å; Y167-T169 PolarHBondContact O-N 2.83Å; Y167-A170 PolarHBondContact O-N 2.88Å; Y167-I171 WeakPolarHBondContact O-CB 3.47Å; Y167-I171 VanDerWaalsContact O-CD1 3.3Å; Y167-I171 WeakPolarHBondContact O-CD1 3.37Å; Y167-I171 WeakPolarHBondContact O-CG1 3.39Å; Y167-I171 PolarHBondContact O-N 3.33Å; Y167-Y186 HydrophobicContact CD1-CD1 4.27Å; Y167-Y186 WeakPolarHBondContact CD1-O 3.47Å; Y167-Y186 AromaticContact CE1-CD1 3.96Å; Y167-Y186 HydrophobicContact CE1-CD1 3.96Å; Y167-L193 HydrophobicContact CD2-CD1 3.58Å; Y167-L193 HydrophobicContact CE2-CD1 3.98Å; Y167-L193 HydrophobicContact CG-CD1 3.92Å; Y167-P212 HydrophobicContact CE2-CB 4.16Å; Y167-P212 VanDerWaalsContact OH-CB 3.25Å; Y167-P212 WeakPolarHBondContact OH-CB 3.27Å; Y167-P213 WeakPolarHBondContact CE2-O 3.27Å; Y167-P213 PolarHBondContact OH-O 2.98Å; Y167-P213 VanDerWaalsContact OH-O 3.14Å; Y167-V215 HydrophobicContact CD2-CG1 4.26Å; Y167-V215 HydrophobicContact CD2-CG2 3.71Å; Y167-V215 HydrophobicContact CE1-CG1 4.21Å; Y167-V215 HydrophobicContact CE2-CB 4.44Å; Y167-V215 HydrophobicContact CE2-CG1 3.67Å; Y167-V215 HydrophobicContact CE2-CG2 3.94Å; Y167-V215 HydrophobicContact CG-CG2 4.19Å
168	K	94.4	Very high	90.4	Very high	96 Å²	96	57.5 Å²	57.5	42%	0.417	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-44.2	176.7	-70.7	178.5	-172.2	-172	0	112	A164 E165 I171 Q172 L190 E194	A164-K168 WeakPolarHBondContact O-CG 3.45Å; A164-K168 PolarHBondContact O-N 2.97Å; E165-K168 PolarHBondContact O-N 3.33Å; K168-I171 WeakPolarHBondContact O-CB 3.34Å; K168-I171 PolarHBondContact O-N 2.9Å; K168-Q172 WeakPolarHBondContact O-CG 3.44Å; K168-Q172 PolarHBondContact O-N 2.97Å; K168-Q172 VanDerWaalsContact O-N 3.08Å; K168-L190 HydrophobicContact CD-CD1 4.28Å; K168-L190 HydrophobicContact CG-CD1 3.53Å; K168-L190 HydrophobicContact CG-CD2 4.26Å; K168-E194 WeakPolarHBondContact CE-OE1 3.37Å; K168-E194 IonicContact NZ-OE1 2.63Å; K168-E194 PolarHBondContact NZ-OE1 2.85Å
169	T	92.5	Very high	90.6	Very high	54 Å²	54	58 Å²	58	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-70.3	-38.8	176.3	47.8	0	0	0	0	112.3	E165 M166 Y167 I171 Q172 N173 T217	E165-T169 PolarHBondContact O-N 2.81Å; E165-T169 PolarHBondContact O-OG1 3.45Å; M166-T169 PolarHBondContact O-OG1 3.35Å; M166-T169 VanDerWaalsContact O-OG1 3.07Å; Y167-T169 PolarHBondContact O-N 2.83Å; T169-I171 VanDerWaalsContact C-N 3.33Å; T169-I171 PolarHBondContact O-N 3.05Å; T169-Q172 PolarHBondContact O-N 2.81Å; T169-N173 PolarHBondContact O-N 3.44Å; T169-T217 WeakPolarHBondContact OG1-CG2 3.39Å
170	A	91.7	Very high	90.6	Very high	5 Å²	5	59.9 Å²	59.9	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-64.5	-33.8	172.4	0	0	0	0	0	113.2	M166 Y167 A174 Y186 V215	M166-A170 VanDerWaalsContact O-CB 3.22Å; M166-A170 WeakPolarHBondContact O-CB 3.49Å; M166-A170 PolarHBondContact O-N 2.87Å; Y167-A170 PolarHBondContact O-N 2.88Å; A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.36Å; A170-A174 PolarHBondContact O-N 3.5Å; A170-Y186 HydrophobicContact CB-CD2 3.83Å; A170-Y186 HydrophobicContact CB-CE2 3.86Å; A170-Y186 HydrophobicContact CB-CG 4.27Å; A170-Y186 WeakPolarHBondContact O-CD2 3.45Å; A170-V215 HydrophobicContact CB-CB 4.17Å; A170-V215 HydrophobicContact CB-CG2 3.65Å
171	I	92.4	Very high	90.4	Very high	10 Å²	10	63.9 Å²	63.9	5%	0.051	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-46.6	171.7	-73	158.7	0	0	0	110.7	Y167 K168 T169 A174 K175 Y186 D187 L190	Y167-I171 WeakPolarHBondContact O-CB 3.47Å; Y167-I171 VanDerWaalsContact O-CD1 3.3Å; Y167-I171 WeakPolarHBondContact O-CD1 3.37Å; Y167-I171 WeakPolarHBondContact O-CG1 3.39Å; Y167-I171 PolarHBondContact O-N 3.33Å; K168-I171 WeakPolarHBondContact O-CB 3.34Å; K168-I171 PolarHBondContact O-N 2.9Å; T169-I171 VanDerWaalsContact C-N 3.33Å; T169-I171 PolarHBondContact O-N 3.05Å; I171-A174 PolarHBondContact O-N 2.65Å; I171-K175 HydrophobicContact CG2-CD 3.72Å; I171-K175 WeakPolarHBondContact O-CB 3.46Å; I171-K175 VanDerWaalsContact O-CG 3.28Å; I171-K175 WeakPolarHBondContact O-CG 3.29Å; I171-K175 PolarHBondContact O-N 2.97Å; I171-Y186 VanDerWaalsContact CG1-CB 3.43Å; I171-D187 WeakPolarHBondContact CD1-OD1 3.33Å; I171-D187 WeakPolarHBondContact CG2-OD1 3.48Å; I171-L190 HydrophobicContact CD1-CB 3.93Å; I171-L190 HydrophobicContact CD1-CD1 4.38Å; I171-L190 HydrophobicContact CD1-CD2 3.87Å; I171-L190 HydrophobicContact CD1-CG 4.28Å
172	Q	92.4	Very high	90.3	Very high	128 Å²	128	65 Å²	65	60%	0.598	36%	0.357	S	S	*	.	H	α-helix	trans	-61.4	-47.9	177.2	-73.5	173.6	-18.2	0	0	111.3	K168 T169 A174 K175 S176	K168-Q172 WeakPolarHBondContact O-CG 3.44Å; K168-Q172 PolarHBondContact O-N 2.97Å; K168-Q172 VanDerWaalsContact O-N 3.08Å; T169-Q172 PolarHBondContact O-N 2.81Å; Q172-A174 PolarHBondContact O-N 2.67Å; Q172-K175 PolarHBondContact O-N 2.96Å; Q172-K175 VanDerWaalsContact O-N 3.12Å; Q172-S176 PolarHBondContact O-N 3.04Å; Q172-S176 PolarHBondContact O-OG 2.95Å
173	N	90.1	Very high	90.3	Very high	68 Å²	68	60.6 Å²	60.6	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-38.6	178.1	-71.8	-0.6	0	0	0	112.6	T169 K175 S176 A177 G218	T169-N173 PolarHBondContact O-N 3.44Å; N173-K175 VanDerWaalsContact C-N 3.35Å; N173-S176 PolarHBondContact O-OG 3.15Å; N173-A177 WeakPolarHBondContact O-CB 3.39Å; N173-A177 PolarHBondContact O-N 2.89Å; N173-G218 PolarHBondContact ND2-O 3Å
174	A	90.3	Very high	90.4	Very high	2 Å²	2	66.8 Å²	66.8	2%	0.017	36%	0.361	C	S	.	.	H	α-helix	trans	-71.3	-28.4	174.8	0	0	0	0	0	112.9	A170 I171 Q172 E179 K182 A183 Y186	A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.36Å; A170-A174 PolarHBondContact O-N 3.5Å; I171-A174 PolarHBondContact O-N 2.65Å; Q172-A174 PolarHBondContact O-N 2.67Å; A174-E179 HydrophobicContact CB-CB 4.45Å; A174-E179 CarbonylContact O-C 3.36Å; A174-E179 WeakPolarHBondContact O-CA 3.16Å; A174-E179 PolarHBondContact O-N 3.41Å; A174-K182 HydrophobicContact CB-CB 4.28Å; A174-K182 HydrophobicContact CB-CD 4.31Å; A174-K182 HydrophobicContact CB-CG 4.38Å; A174-A183 HydrophobicContact CB-CB 3.87Å; A174-Y186 HydrophobicContact CB-CD2 4.13Å; A174-Y186 HydrophobicContact CB-CE2 4.17Å
175	K	90.9	Very high	90.3	Very high	115 Å²	115	74.9 Å²	74.9	50%	0.5	39%	0.39	S	S	.	.	H	α-helix	trans	-75	-41.9	174.3	-75.1	170.1	-178.9	162	0	111.2	I171 Q172 N173 G178 A183 D187	I171-K175 HydrophobicContact CG2-CD 3.72Å; I171-K175 WeakPolarHBondContact O-CB 3.46Å; I171-K175 VanDerWaalsContact O-CG 3.28Å; I171-K175 WeakPolarHBondContact O-CG 3.29Å; I171-K175 PolarHBondContact O-N 2.97Å; Q172-K175 PolarHBondContact O-N 2.96Å; Q172-K175 VanDerWaalsContact O-N 3.12Å; N173-K175 VanDerWaalsContact C-N 3.35Å; K175-G178 PolarHBondContact O-N 3.44Å; K175-A183 HydrophobicContact CD-CB 4.47Å; K175-A183 HydrophobicContact CG-CB 3.72Å; K175-D187 WeakPolarHBondContact CE-OD2 3.48Å; K175-D187 IonicContact NZ-OD1 3.57Å; K175-D187 PolarHBondContact NZ-OD1 3.2Å; K175-D187 IonicContact NZ-OD2 3Å; K175-D187 PolarHBondContact NZ-OD2 3.04Å
176	S	88.5	Confident	90.3	Very high	100 Å²	100	70.8 Å²	70.8	70%	0.699	37%	0.369	S	S	*	.	H	α-helix	trans	-71.5	-32.2	176.5	61.6	0	0	0	0	113.6	Q172 N173 G178	Q172-S176 PolarHBondContact O-N 3.04Å; Q172-S176 PolarHBondContact O-OG 2.95Å; N173-S176 PolarHBondContact O-OG 3.15Å; S176-G178 PolarHBondContact O-N 3.17Å
177	A	88.4	Confident	90.4	Very high	65 Å²	65	71 Å²	71	54%	0.537	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	0.2	172.2	0	0	0	0	0	114.3	N173 E179	N173-A177 WeakPolarHBondContact O-CB 3.39Å; N173-A177 PolarHBondContact O-N 2.89Å; A177-E179 HydrophobicContact CB-CG 4.18Å; A177-E179 PolarHBondContact O-N 3.41Å
178	G	84.1	Confident	90.4	Very high	52 Å²	52	78.2 Å²	78.2	54%	0.536	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	4.7	-177.8	0	0	0	0	0	115.2	K175 S176 T180	K175-G178 PolarHBondContact O-N 3.44Å; S176-G178 PolarHBondContact O-N 3.17Å; G178-T180 PolarHBondContact O-N 3.02Å
179	E	90.3	Very high	90.3	Very high	83 Å²	83	74 Å²	74	39%	0.388	38%	0.383	S	S	.	.			trans	-76.4	58.2	-179.1	-62.7	-179	107.1	0	0	112	A174 A177 S181 K182 A183	A174-E179 HydrophobicContact CB-CB 4.45Å; A174-E179 CarbonylContact O-C 3.36Å; A174-E179 WeakPolarHBondContact O-CA 3.16Å; A174-E179 PolarHBondContact O-N 3.41Å; A177-E179 HydrophobicContact CB-CG 4.18Å; A177-E179 PolarHBondContact O-N 3.41Å; E179-S181 VanDerWaalsContact C-N 3.26Å; E179-S181 PolarHBondContact O-N 3.28Å; E179-S181 VanDerWaalsContact O-N 3.09Å; E179-K182 HydrophobicContact CB-CB 3.84Å; E179-K182 HydrophobicContact CB-CD 4Å; E179-K182 HydrophobicContact CG-CD 4.35Å; E179-K182 WeakPolarHBondContact O-CA 3.49Å; E179-K182 VanDerWaalsContact O-CB 3.29Å; E179-K182 WeakPolarHBondContact O-CB 3.49Å; E179-K182 PolarHBondContact O-N 3Å; E179-K182 WeakPolarHBondContact OE1-CD 3.5Å; E179-K182 IonicContact OE1-NZ 2.93Å; E179-K182 PolarHBondContact OE1-NZ 2.95Å; E179-K182 WeakPolarHBondContact OE2-CD 3.47Å; E179-K182 WeakPolarHBondContact OE2-CE 3.42Å; E179-K182 IonicContact OE2-NZ 3.46Å; E179-K182 PolarHBondContact OE2-NZ 3.07Å; E179-A183 PolarHBondContact O-N 2.69Å
180	T	86.4	Confident	90.4	Very high	93 Å²	93	72.4 Å²	72.4	57%	0.571	37%	0.372	S	S	*	.	H	α-helix	trans	-50.5	-38.6	-174	57.3	0	0	0	0	114.3	G178 K182 R184	G178-T180 PolarHBondContact O-N 3.02Å; T180-K182 VanDerWaalsContact C-N 3.32Å; T180-K182 PolarHBondContact O-N 3.15Å; T180-R184 WeakPolarHBondContact O-CB 3.47Å; T180-R184 WeakPolarHBondContact O-CG 3.38Å; T180-R184 PolarHBondContact O-N 3.23Å
181	S	83.8	Confident	90.5	Very high	84 Å²	84	79.6 Å²	79.6	59%	0.587	40%	0.402	S	S	*	.	H	α-helix	trans	-68.5	-26.9	176.3	-71.3	0	0	0	0	114	E179 R185	E179-S181 VanDerWaalsContact C-N 3.26Å; E179-S181 PolarHBondContact O-N 3.28Å; E179-S181 VanDerWaalsContact O-N 3.09Å; S181-R185 WeakPolarHBondContact O-CG 3.49Å; S181-R185 PolarHBondContact O-N 2.7Å
182	K	87.9	Confident	90.4	Very high	74 Å²	74	82.2 Å²	82.2	32%	0.322	42%	0.419	S	S	.	.	H	α-helix	trans	-83.6	-42.2	177.4	-167.4	-172.9	-172.4	174.6	0	110.2	A174 E179 T180 R184 R185 Y186	A174-K182 HydrophobicContact CB-CB 4.28Å; A174-K182 HydrophobicContact CB-CD 4.31Å; A174-K182 HydrophobicContact CB-CG 4.38Å; E179-K182 HydrophobicContact CB-CB 3.84Å; E179-K182 HydrophobicContact CB-CD 4Å; E179-K182 HydrophobicContact CG-CD 4.35Å; E179-K182 WeakPolarHBondContact O-CA 3.49Å; E179-K182 VanDerWaalsContact O-CB 3.29Å; E179-K182 WeakPolarHBondContact O-CB 3.49Å; E179-K182 PolarHBondContact O-N 3Å; E179-K182 WeakPolarHBondContact OE1-CD 3.5Å; E179-K182 IonicContact OE1-NZ 2.93Å; E179-K182 PolarHBondContact OE1-NZ 2.95Å; E179-K182 WeakPolarHBondContact OE2-CD 3.47Å; E179-K182 WeakPolarHBondContact OE2-CE 3.42Å; E179-K182 IonicContact OE2-NZ 3.46Å; E179-K182 PolarHBondContact OE2-NZ 3.07Å; T180-K182 VanDerWaalsContact C-N 3.32Å; T180-K182 PolarHBondContact O-N 3.15Å; K182-R184 VanDerWaalsContact C-N 3.33Å; K182-R184 PolarHBondContact O-N 3.25Å; K182-R185 WeakPolarHBondContact O-CA 3.17Å; K182-R185 WeakPolarHBondContact O-CB 3.12Å; K182-R185 PolarHBondContact O-N 3.44Å; K182-Y186 HydrophobicContact CD-CE2 4.19Å; K182-Y186 WeakPolarHBondContact CE-OH 3.32Å; K182-Y186 HydrophobicContact CG-CD2 4.36Å; K182-Y186 HydrophobicContact CG-CE2 3.68Å; K182-Y186 WeakPolarHBondContact O-CD2 3.4Å; K182-Y186 PolarHBondContact O-N 3.49Å
183	A	90.3	Very high	90.4	Very high	3 Å²	3	76.1 Å²	76.1	3%	0.025	39%	0.39	C	S	.	.	H	α-helix	trans	-53	-48.9	168.5	0	0	0	0	0	111.7	A174 K175 E179 R185 Y186 D187	A174-A183 HydrophobicContact CB-CB 3.87Å; K175-A183 HydrophobicContact CD-CB 4.47Å; K175-A183 HydrophobicContact CG-CB 3.72Å; E179-A183 PolarHBondContact O-N 2.69Å; A183-R185 VanDerWaalsContact C-N 3.25Å; A183-R185 PolarHBondContact O-N 3.39Å; A183-Y186 PolarHBondContact O-N 3.21Å; A183-Y186 VanDerWaalsContact O-N 3.13Å; A183-D187 WeakPolarHBondContact O-CB 3.25Å; A183-D187 PolarHBondContact O-N 2.87Å
184	R	92.5	Very high	90.5	Very high	172 Å²	172	76.3 Å²	76.3	65%	0.649	39%	0.389	S	S	*	.	H	α-helix	trans	-63.7	-21.1	174.5	-73	175.1	178.4	-173.5	-0.4	114.8	T180 K182	T180-R184 WeakPolarHBondContact O-CB 3.47Å; T180-R184 WeakPolarHBondContact O-CG 3.38Å; T180-R184 PolarHBondContact O-N 3.23Å; K182-R184 VanDerWaalsContact C-N 3.33Å; K182-R184 PolarHBondContact O-N 3.25Å
185	R	89.6	Confident	90.6	Very high	175 Å²	175	80 Å²	80	66%	0.66	42%	0.415	S	S	*	.	H	α-helix	trans	-78.3	-43	171.4	-73.2	170.6	-174.2	-156.5	1.6	110.6	S181 K182 A183 R188 G189	S181-R185 WeakPolarHBondContact O-CG 3.49Å; S181-R185 PolarHBondContact O-N 2.7Å; K182-R185 WeakPolarHBondContact O-CA 3.17Å; K182-R185 WeakPolarHBondContact O-CB 3.12Å; K182-R185 PolarHBondContact O-N 3.44Å; A183-R185 VanDerWaalsContact C-N 3.25Å; A183-R185 PolarHBondContact O-N 3.39Å; R185-R188 PolarHBondContact O-N 3.28Å; R185-G189 PolarHBondContact O-N 3.07Å
186	Y	94.2	Very high	90.4	Very high	49 Å²	49	75.2 Å²	75.2	19%	0.192	39%	0.394	C	S	.	.	H	α-helix	trans	-70	-40.6	176.7	-58.1	-40.9	0	0	0	112.3	Y167 A170 I171 A174 K182 A183 R188 G189 L190 V215	Y167-Y186 HydrophobicContact CD1-CD1 4.27Å; Y167-Y186 WeakPolarHBondContact CD1-O 3.47Å; Y167-Y186 AromaticContact CE1-CD1 3.96Å; Y167-Y186 HydrophobicContact CE1-CD1 3.96Å; A170-Y186 HydrophobicContact CB-CD2 3.83Å; A170-Y186 HydrophobicContact CB-CE2 3.86Å; A170-Y186 HydrophobicContact CB-CG 4.27Å; A170-Y186 WeakPolarHBondContact O-CD2 3.45Å; I171-Y186 VanDerWaalsContact CG1-CB 3.43Å; A174-Y186 HydrophobicContact CB-CD2 4.13Å; A174-Y186 HydrophobicContact CB-CE2 4.17Å; K182-Y186 HydrophobicContact CD-CE2 4.19Å; K182-Y186 WeakPolarHBondContact CE-OH 3.32Å; K182-Y186 HydrophobicContact CG-CD2 4.36Å; K182-Y186 HydrophobicContact CG-CE2 3.68Å; K182-Y186 WeakPolarHBondContact O-CD2 3.4Å; K182-Y186 PolarHBondContact O-N 3.49Å; A183-Y186 PolarHBondContact O-N 3.21Å; A183-Y186 VanDerWaalsContact O-N 3.13Å; Y186-R188 PolarHBondContact O-N 2.96Å; Y186-R188 VanDerWaalsContact O-N 3.1Å; Y186-G189 PolarHBondContact O-N 3.19Å; Y186-L190 WeakPolarHBondContact O-CB 3.21Å; Y186-L190 PolarHBondContact O-N 3.36Å; Y186-V215 HydrophobicContact CD1-CG1 4.03Å; Y186-V215 HydrophobicContact CE1-CB 4.37Å; Y186-V215 HydrophobicContact CE1-CG1 3.62Å
187	D	93.6	Very high	90.5	Very high	48 Å²	48	71.4 Å²	71.4	26%	0.257	37%	0.366	S	S	.	.	H	α-helix	trans	-54.8	-30.3	174.1	-77.1	-41.1	0	0	0	111.9	I171 K175 A183 K191	I171-D187 WeakPolarHBondContact CD1-OD1 3.33Å; I171-D187 WeakPolarHBondContact CG2-OD1 3.48Å; K175-D187 WeakPolarHBondContact CE-OD2 3.48Å; K175-D187 IonicContact NZ-OD1 3.57Å; K175-D187 PolarHBondContact NZ-OD1 3.2Å; K175-D187 IonicContact NZ-OD2 3Å; K175-D187 PolarHBondContact NZ-OD2 3.04Å; A183-D187 WeakPolarHBondContact O-CB 3.25Å; A183-D187 PolarHBondContact O-N 2.87Å; D187-K191 PolarHBondContact O-N 3.29Å
188	R	93.8	Very high	90.5	Very high	166 Å²	166	70.5 Å²	70.5	63%	0.626	36%	0.359	S	S	*	.	H	α-helix	trans	-76.4	-47.3	173.2	-72.8	-169.9	-64.3	-117.6	4.1	113.2	R185 Y186 L190 K191 T192	R185-R188 PolarHBondContact O-N 3.28Å; Y186-R188 PolarHBondContact O-N 2.96Å; Y186-R188 VanDerWaalsContact O-N 3.1Å; R188-L190 PolarHBondContact O-N 2.94Å; R188-K191 PolarHBondContact O-N 2.98Å; R188-K191 VanDerWaalsContact O-N 3.16Å; R188-T192 PolarHBondContact O-N 3.37Å; R188-T192 VanDerWaalsContact O-N 3.15Å; R188-T192 PolarHBondContact O-OG1 3.06Å
189	G	92.8	Very high	90.6	Very high	9 Å²	9	69.1 Å²	69.1	9%	0.093	34%	0.342	C	S	.	.	H	α-helix	trans	-61.6	-33.1	176.9	0	0	0	0	0	112.6	R185 Y186 T192 L193	R185-G189 PolarHBondContact O-N 3.07Å; Y186-G189 PolarHBondContact O-N 3.19Å; G189-T192 PolarHBondContact O-N 3.37Å; G189-L193 WeakPolarHBondContact O-CG 3.42Å; G189-L193 PolarHBondContact O-N 2.88Å
190	L	93.9	Very high	90.4	Very high	19 Å²	19	66.9 Å²	66.9	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-52.2	171	-172.6	79.8	0	0	0	111.8	A164 K168 I171 Y186 R188 T192 L193 E194	A164-L190 HydrophobicContact CB-CD1 4.38Å; A164-L190 WeakPolarHBondContact O-CD1 3.46Å; K168-L190 HydrophobicContact CD-CD1 4.28Å; K168-L190 HydrophobicContact CG-CD1 3.53Å; K168-L190 HydrophobicContact CG-CD2 4.26Å; I171-L190 HydrophobicContact CD1-CB 3.93Å; I171-L190 HydrophobicContact CD1-CD1 4.38Å; I171-L190 HydrophobicContact CD1-CD2 3.87Å; I171-L190 HydrophobicContact CD1-CG 4.28Å; Y186-L190 WeakPolarHBondContact O-CB 3.21Å; Y186-L190 PolarHBondContact O-N 3.36Å; R188-L190 PolarHBondContact O-N 2.94Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 2.96Å; L190-L193 WeakPolarHBondContact O-CA 3.45Å; L190-L193 WeakPolarHBondContact O-CB 3.44Å; L190-L193 PolarHBondContact O-N 2.8Å; L190-E194 HydrophobicContact CG-CG 4.43Å; L190-E194 PolarHBondContact O-N 3.06Å
191	K	93.7	Very high	90.4	Very high	156 Å²	156	68.3 Å²	68.3	68%	0.678	33%	0.332	S	S	*	.	H	α-helix	trans	-60.9	-34.4	179.4	-72.7	-174.2	175.5	-163.6	0	112.4	D187 R188 S195	D187-K191 PolarHBondContact O-N 3.29Å; R188-K191 PolarHBondContact O-N 2.98Å; R188-K191 VanDerWaalsContact O-N 3.16Å; K191-S195 VanDerWaalsContact O-CB 3.29Å; K191-S195 WeakPolarHBondContact O-CB 3.36Å; K191-S195 PolarHBondContact O-N 2.88Å
192	T	91.9	Very high	90.5	Very high	65 Å²	65	72.1 Å²	72.1	40%	0.399	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-44.3	171.9	-46	0	0	0	0	111.6	R188 G189 L190 S195 M196 P212	R188-T192 PolarHBondContact O-N 3.37Å; R188-T192 VanDerWaalsContact O-N 3.15Å; R188-T192 PolarHBondContact O-OG1 3.06Å; G189-T192 PolarHBondContact O-N 3.37Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 2.96Å; T192-S195 PolarHBondContact O-N 3.32Å; T192-M196 HydrophobicContact CG2-CE 3.91Å; T192-M196 WeakPolarHBondContact O-CG 3.43Å; T192-M196 PolarHBondContact O-N 3.2Å; T192-P212 HydrophobicContact CG2-CG 4.48Å
193	L	91.8	Very high	89.9	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-45.6	176.7	-71.6	161.9	0	0	0	112.2	L160 R163 A164 Y167 G189 L190 S195 M196 I197 I211 P212	L160-L193 HydrophobicContact CD2-CD2 3.74Å; R163-L193 HydrophobicContact CB-CD1 4.37Å; R163-L193 HydrophobicContact CB-CD2 4.23Å; R163-L193 HydrophobicContact CG-CD1 3.85Å; R163-L193 HydrophobicContact CG-CD2 4.03Å; A164-L193 HydrophobicContact CB-CB 4.28Å; Y167-L193 HydrophobicContact CD2-CD1 3.58Å; Y167-L193 HydrophobicContact CE2-CD1 3.98Å; Y167-L193 HydrophobicContact CG-CD1 3.92Å; G189-L193 WeakPolarHBondContact O-CG 3.42Å; G189-L193 PolarHBondContact O-N 2.88Å; L190-L193 WeakPolarHBondContact O-CA 3.45Å; L190-L193 WeakPolarHBondContact O-CB 3.44Å; L190-L193 PolarHBondContact O-N 2.8Å; L193-S195 VanDerWaalsContact C-N 3.31Å; L193-S195 PolarHBondContact O-N 3.12Å; L193-M196 HydrophobicContact CD2-CE 3.94Å; L193-M196 HydrophobicContact CG-CE 4.42Å; L193-M196 PolarHBondContact O-N 3.17Å; L193-I197 WeakPolarHBondContact O-CD1 3.14Å; L193-I197 VanDerWaalsContact O-CG1 3.25Å; L193-I197 WeakPolarHBondContact O-CG1 3.29Å; L193-I197 PolarHBondContact O-N 3.38Å; L193-I211 HydrophobicContact CD2-CG2 4.25Å; L193-P212 HydrophobicContact CG-CG 4.23Å
194	E	91.8	Very high	89.3	Confident	73 Å²	73	78.4 Å²	78.4	34%	0.341	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-35.6	177.7	-68.9	177.3	150.5	0	0	111.7	K168 L190 I197 A198	K168-E194 WeakPolarHBondContact CE-OE1 3.37Å; K168-E194 IonicContact NZ-OE1 2.63Å; K168-E194 PolarHBondContact NZ-OE1 2.85Å; L190-E194 HydrophobicContact CG-CG 4.43Å; L190-E194 PolarHBondContact O-N 3.06Å; E194-I197 PolarHBondContact O-N 3.35Å; E194-A198 WeakPolarHBondContact O-CB 3.12Å; E194-A198 PolarHBondContact O-N 3.39Å
195	S	91.8	Very high	88.3	Confident	80 Å²	80	76.4 Å²	76.4	56%	0.559	40%	0.395	S	S	*	.	H	α-helix	trans	-64.1	-44.5	170.9	-170.5	0	0	0	0	112.6	K191 T192 L193 A198 A199	K191-S195 VanDerWaalsContact O-CB 3.29Å; K191-S195 WeakPolarHBondContact O-CB 3.36Å; K191-S195 PolarHBondContact O-N 2.88Å; T192-S195 PolarHBondContact O-N 3.32Å; L193-S195 VanDerWaalsContact C-N 3.31Å; L193-S195 PolarHBondContact O-N 3.12Å; S195-A198 PolarHBondContact O-N 3.14Å; S195-A199 PolarHBondContact O-N 3.24Å
196	M	86.9	Confident	87.8	Confident	13 Å²	13	69.5 Å²	69.5	6%	0.064	37%	0.372	C	S	.	.	H	α-helix	trans	-65.4	-40	175.7	-74.2	-173.6	-78.6	0	0	112.5	L160 T192 L193 A198 A199 V200 V206 I211	L160-M196 HydrophobicContact CD1-CB 3.84Å; L160-M196 HydrophobicContact CD2-CB 4.09Å; L160-M196 HydrophobicContact CD2-CE 4.01Å; L160-M196 HydrophobicContact CD2-SD 4.12Å; T192-M196 HydrophobicContact CG2-CE 3.91Å; T192-M196 WeakPolarHBondContact O-CG 3.43Å; T192-M196 PolarHBondContact O-N 3.2Å; L193-M196 HydrophobicContact CD2-CE 3.94Å; L193-M196 HydrophobicContact CG-CE 4.42Å; L193-M196 PolarHBondContact O-N 3.17Å; M196-A198 VanDerWaalsContact C-N 3.3Å; M196-A198 PolarHBondContact O-N 2.8Å; M196-A199 WeakPolarHBondContact O-CB 3.31Å; M196-A199 PolarHBondContact O-N 2.64Å; M196-A199 VanDerWaalsContact O-N 3.12Å; M196-V200 WeakPolarHBondContact O-CG2 3.35Å; M196-V200 PolarHBondContact O-N 2.76Å; M196-V206 HydrophobicContact CB-CG1 4.18Å; M196-V206 HydrophobicContact CB-CG2 4.39Å; M196-V206 HydrophobicContact CG-CG1 3.78Å; M196-V206 HydrophobicContact CG-CG2 4.44Å; M196-V206 HydrophobicContact SD-CG1 3.5Å; M196-V206 VanDerWaalsContact SD-CG1 3.5Å; M196-I211 HydrophobicContact CE-CB 4.43Å; M196-I211 HydrophobicContact CE-CG1 4.25Å; M196-I211 HydrophobicContact SD-CG1 3.92Å
197	I	90.2	Very high	86.9	Confident	20 Å²	20	71.4 Å²	71.4	10%	0.103	39%	0.385	C	S	.	.	H	α-helix	trans	-59.8	-42.6	174.1	-67	160.7	0	0	0	110.2	L160 E161 A164 L193 E194 A199 K201	L160-I197 HydrophobicContact CB-CD1 4.25Å; L160-I197 HydrophobicContact CB-CG1 3.61Å; L160-I197 HydrophobicContact CD1-CG1 4.4Å; E161-I197 HydrophobicContact CG-CD1 3.81Å; E161-I197 HydrophobicContact CG-CG1 4Å; E161-I197 HydrophobicContact CG-CG2 4.14Å; A164-I197 HydrophobicContact CB-CD1 4.02Å; L193-I197 WeakPolarHBondContact O-CD1 3.14Å; L193-I197 VanDerWaalsContact O-CG1 3.25Å; L193-I197 WeakPolarHBondContact O-CG1 3.29Å; L193-I197 PolarHBondContact O-N 3.38Å; E194-I197 PolarHBondContact O-N 3.35Å; I197-A199 VanDerWaalsContact C-N 3.35Å; I197-K201 HydrophobicContact CG2-CD 3.94Å; I197-K201 WeakPolarHBondContact O-CB 3.44Å; I197-K201 VanDerWaalsContact O-CG 3.32Å; I197-K201 WeakPolarHBondContact O-CG 3.41Å; I197-K201 PolarHBondContact O-N 3.47Å
198	A	89.2	Confident	85.8	Confident	46 Å²	46	75.9 Å²	75.9	38%	0.38	41%	0.405	S	S	.	.	H	α-helix	trans	-67.4	-31.8	175.2	0	0	0	0	0	113.2	E194 S195 M196 K202	E194-A198 WeakPolarHBondContact O-CB 3.12Å; E194-A198 PolarHBondContact O-N 3.39Å; S195-A198 PolarHBondContact O-N 3.14Å; M196-A198 VanDerWaalsContact C-N 3.3Å; M196-A198 PolarHBondContact O-N 2.8Å; A198-K202 WeakPolarHBondContact O-CB 3.35Å; A198-K202 VanDerWaalsContact O-CG 3.26Å; A198-K202 WeakPolarHBondContact O-CG 3.37Å; A198-K202 PolarHBondContact O-N 3.41Å
199	A	86.3	Confident	84.7	Confident	24 Å²	24	72.7 Å²	72.7	20%	0.198	41%	0.408	C	S	.	.	H	α-helix	trans	-69.8	-45.7	174.6	0	0	0	0	0	112.1	S195 M196 I197 K202 G203 K204 V206	S195-A199 PolarHBondContact O-N 3.24Å; M196-A199 WeakPolarHBondContact O-CB 3.31Å; M196-A199 PolarHBondContact O-N 2.64Å; M196-A199 VanDerWaalsContact O-N 3.12Å; I197-A199 VanDerWaalsContact C-N 3.35Å; A199-K202 CarbonylContact O-C 3.56Å; A199-K202 WeakPolarHBondContact O-CA 3.46Å; A199-K202 PolarHBondContact O-N 3.26Å; A199-K202 VanDerWaalsContact O-N 3.09Å; A199-G203 PolarHBondContact O-N 3.16Å; A199-K204 HydrophobicContact CB-CB 4.36Å; A199-K204 PolarHBondContact O-N 2.98Å; A199-V206 HydrophobicContact CB-CG2 3.89Å
200	V	86.9	Confident	83.9	Confident	36 Å²	36	78.4 Å²	78.4	22%	0.218	43%	0.432	C	S	.	.	H	α-helix	trans	-62.6	-44.6	176.3	173.8	0	0	0	0	111.1	L156 Q157 L160 M196 K202 G203 V206	L156-V200 HydrophobicContact CD2-CG2 3.6Å; Q157-V200 HydrophobicContact CB-CG1 3.93Å; Q157-V200 HydrophobicContact CG-CG1 4.13Å; L160-V200 HydrophobicContact CD1-CG2 3.91Å; M196-V200 WeakPolarHBondContact O-CG2 3.35Å; M196-V200 PolarHBondContact O-N 2.76Å; V200-K202 PolarHBondContact O-N 3.23Å; V200-G203 PolarHBondContact O-N 2.87Å; V200-V206 HydrophobicContact CG2-CB 4.26Å; V200-V206 HydrophobicContact CG2-CG2 3.71Å
201	K	84.6	Confident	83.2	Confident	122 Å²	122	79.1 Å²	79.1	53%	0.53	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-17.1	174.9	-71.7	175	-178	175.1	0	113.7	Q157 E161 I197	Q157-K201 VanDerWaalsContact NE2-CE 3.27Å; E161-K201 WeakPolarHBondContact OE1-CE 3.42Å; E161-K201 IonicContact OE1-NZ 2.78Å; E161-K201 PolarHBondContact OE1-NZ 3.11Å; I197-K201 HydrophobicContact CG2-CD 3.94Å; I197-K201 WeakPolarHBondContact O-CB 3.44Å; I197-K201 VanDerWaalsContact O-CG 3.32Å; I197-K201 WeakPolarHBondContact O-CG 3.41Å; I197-K201 PolarHBondContact O-N 3.47Å
202	K	86.4	Confident	82.7	Confident	165 Å²	165	72.5 Å²	72.5	72%	0.717	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	13.8	170.9	-69.6	176.6	-179.6	-176.5	0	113	A198 A199 V200 K204	A198-K202 WeakPolarHBondContact O-CB 3.35Å; A198-K202 VanDerWaalsContact O-CG 3.26Å; A198-K202 WeakPolarHBondContact O-CG 3.37Å; A198-K202 PolarHBondContact O-N 3.41Å; A199-K202 CarbonylContact O-C 3.56Å; A199-K202 WeakPolarHBondContact O-CA 3.46Å; A199-K202 PolarHBondContact O-N 3.26Å; A199-K202 VanDerWaalsContact O-N 3.09Å; V200-K202 PolarHBondContact O-N 3.23Å; K202-K204 VanDerWaalsContact C-N 3.26Å; K202-K204 PolarHBondContact O-N 3.07Å
203	G	75.4	Confident	82.2	Confident	70 Å²	70	73.8 Å²	73.8	72%	0.722	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	14.1	175.4	0	0	0	0	0	115.4	A199 V200	A199-G203 PolarHBondContact O-N 3.16Å; V200-G203 PolarHBondContact O-N 2.87Å
204	K	79.1	Confident	81.7	Confident	138 Å²	138	78 Å²	78	60%	0.6	45%	0.445	S	S	*	.			trans	-84.1	139.1	178.5	-63.7	-170.1	176.3	-170.9	0	110.6	A199 K202 V206	A199-K204 HydrophobicContact CB-CB 4.36Å; A199-K204 PolarHBondContact O-N 2.98Å; K202-K204 VanDerWaalsContact C-N 3.26Å; K202-K204 PolarHBondContact O-N 3.07Å; K204-V206 PolarHBondContact O-N 3.45Å
205	P	70.7	Confident	81.4	Confident	131 Å²	131	75.2 Å²	75.2	85%	0.851	43%	0.434	S	S	*	.			trans	-65.2	133.1	173	28.3	-33.8	0	0	0	109.9
206	V	78.9	Confident	80.5	Confident	30 Å²	30	76.3 Å²	76.3	18%	0.182	45%	0.447	C	S	.	.			trans	-109.6	136	174.4	169.3	0	0	0	0	108.5	M196 A199 V200 K204	M196-V206 HydrophobicContact CB-CG1 4.18Å; M196-V206 HydrophobicContact CB-CG2 4.39Å; M196-V206 HydrophobicContact CG-CG1 3.78Å; M196-V206 HydrophobicContact CG-CG2 4.44Å; M196-V206 HydrophobicContact SD-CG1 3.5Å; M196-V206 VanDerWaalsContact SD-CG1 3.5Å; A199-V206 HydrophobicContact CB-CG2 3.89Å; V200-V206 HydrophobicContact CG2-CB 4.26Å; V200-V206 HydrophobicContact CG2-CG2 3.71Å; K204-V206 PolarHBondContact O-N 3.45Å
207	N	74.4	Confident	79.6	Confident	88 Å²	88	78.6 Å²	78.6	47%	0.471	46%	0.462	S	S	.	.			trans	-84.1	120.8	-180	-175.4	7.8	0	0	0	110.5	S209 E210	N207-S209 VanDerWaalsContact CG-OG 3.31Å; N207-S209 PolarHBondContact ND2-OG 3.46Å; N207-S209 PolarHBondContact O-N 3.38Å; N207-S209 VanDerWaalsContact O-N 3.12Å; N207-S209 PolarHBondContact OD1-N 2.93Å; N207-S209 PolarHBondContact OD1-OG 2.89Å; N207-E210 HydrophobicContact CB-CG 4.39Å; N207-E210 PolarHBondContact O-N 3.42Å
208	E	72.1	Confident	77.9	Confident	143 Å²	143	80.5 Å²	80.5	67%	0.668	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-61.3	-23.9	-175.6	-64.5	-176.8	176	0	0	113.3	L156 E210 I211	L156-E208 HydrophobicContact CD1-CG 3.98Å; E208-E210 PolarHBondContact O-N 2.91Å; E208-I211 HydrophobicContact CB-CD1 4.42Å; E208-I211 PolarHBondContact O-N 2.91Å
209	S	70.1	Confident	75.4	Confident	99 Å²	99	82.2 Å²	82.2	69%	0.692	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-71.7	-13.1	176.4	66.9	0	0	0	0	114.6	N207	N207-S209 VanDerWaalsContact CG-OG 3.31Å; N207-S209 PolarHBondContact ND2-OG 3.46Å; N207-S209 PolarHBondContact O-N 3.38Å; N207-S209 VanDerWaalsContact O-N 3.12Å; N207-S209 PolarHBondContact OD1-N 2.93Å; N207-S209 PolarHBondContact OD1-OG 2.89Å
210	E	75.1	Confident	73.4	Confident	129 Å²	129	87.2 Å²	87.2	60%	0.603	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-93.4	-5.4	179	-65.3	179.6	-172.7	0	0	112.9	N207 E208 P212	N207-E210 HydrophobicContact CB-CG 4.39Å; N207-E210 PolarHBondContact O-N 3.42Å; E208-E210 PolarHBondContact O-N 2.91Å; E210-P212 WeakPolarHBondContact O-CD 3.46Å
211	I	81	Confident	70.8	Confident	33 Å²	33	92.3 Å²	92.3	17%	0.169	56%	0.562	C	S	.	*	S	Bend	trans	-73	121.2	-178.6	-56.7	178.3	0	0	0	110	L160 L193 M196 E208	L160-I211 HydrophobicContact CD2-CD1 4.04Å; L160-I211 HydrophobicContact CD2-CG1 4.06Å; L160-I211 HydrophobicContact CD2-CG2 4.09Å; L193-I211 HydrophobicContact CD2-CG2 4.25Å; M196-I211 HydrophobicContact CE-CB 4.43Å; M196-I211 HydrophobicContact CE-CG1 4.25Å; M196-I211 HydrophobicContact SD-CG1 3.92Å; E208-I211 HydrophobicContact CB-CD1 4.42Å; E208-I211 PolarHBondContact O-N 2.91Å
212	P	82.4	Confident	68.5	Low	17 Å²	17	90.2 Å²	90.2	11%	0.11	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-56	147.2	177.2	-27.4	35.2	0	0	0	113.3	R163 Y167 T192 L193 E210	R163-P212 VanDerWaalsContact CD-O 3.23Å; R163-P212 WeakPolarHBondContact CD-O 3.47Å; R163-P212 PolarHBondContact NE-O 3.29Å; Y167-P212 HydrophobicContact CE2-CB 4.16Å; Y167-P212 VanDerWaalsContact OH-CB 3.25Å; Y167-P212 WeakPolarHBondContact OH-CB 3.27Å; T192-P212 HydrophobicContact CG2-CG 4.48Å; L193-P212 HydrophobicContact CG-CG 4.23Å; E210-P212 WeakPolarHBondContact O-CD 3.46Å
213	P	80.6	Confident	66.1	Low	93 Å²	93	88.9 Å²	88.9	60%	0.604	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-63.5	149.3	-179.6	27.2	-35.3	0	0	0	111.7	Y167	Y167-P213 WeakPolarHBondContact CE2-O 3.27Å; Y167-P213 PolarHBondContact OH-O 2.98Å; Y167-P213 VanDerWaalsContact OH-O 3.14Å
214	P	82.5	Confident	64.4	Low	87 Å²	87	91.3 Å²	91.3	57%	0.565	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-62.8	145.6	176.6	29	-34.8	0	0	0	110.9	M166	M166-P214 HydrophobicContact CE-CB 4.29Å
215	V	85.3	Confident	62.5	Low	16 Å²	16	94.9 Å²	94.9	10%	0.097	59%	0.587	C	S	.	*			trans	-113	134.6	-175.5	-69.2	0	0	0	0	110.9	M166 Y167 A170 Y186 T217	M166-V215 HydrophobicContact CB-CG2 3.94Å; M166-V215 VanDerWaalsContact O-CG2 3.32Å; M166-V215 WeakPolarHBondContact O-CG2 3.22Å; Y167-V215 HydrophobicContact CD2-CG1 4.26Å; Y167-V215 HydrophobicContact CD2-CG2 3.71Å; Y167-V215 HydrophobicContact CE1-CG1 4.21Å; Y167-V215 HydrophobicContact CE2-CB 4.44Å; Y167-V215 HydrophobicContact CE2-CG1 3.67Å; Y167-V215 HydrophobicContact CE2-CG2 3.94Å; Y167-V215 HydrophobicContact CG-CG2 4.19Å; A170-V215 HydrophobicContact CB-CB 4.17Å; A170-V215 HydrophobicContact CB-CG2 3.65Å; Y186-V215 HydrophobicContact CD1-CG1 4.03Å; Y186-V215 HydrophobicContact CE1-CB 4.37Å; Y186-V215 HydrophobicContact CE1-CG1 3.62Å; V215-T217 PolarHBondContact O-N 3.22Å
216	A	72.4	Confident	60.8	Low	102 Å²	102	94.2 Å²	94.2	84%	0.843	58%	0.582	S	S	*	*			trans	-75.1	109	-176.6	0	0	0	0	0	111.6	G218	A216-G218 VanDerWaalsContact C-N 3.26Å; A216-G218 PolarHBondContact O-N 3.24Å
217	T	69.3	Low	58.6	Low	62 Å²	62	97.1 Å²	97.1	38%	0.38	61%	0.61	S	S	.	*			trans	-83.7	60.4	-178	47.7	0	0	0	0	111.9	M166 T169 V215 A219	M166-T217 HydrophobicContact CB-CG2 4.13Å; M166-T217 HydrophobicContact CG-CG2 4.22Å; T169-T217 WeakPolarHBondContact OG1-CG2 3.39Å; V215-T217 PolarHBondContact O-N 3.22Å; T217-A219 PolarHBondContact O-N 2.87Å
218	G	53.3	Low	57	Low	60 Å²	60	98.6 Å²	98.6	62%	0.619	62%	0.621	S	S	*	*			trans	-59	111.1	-176.2	0	0	0	0	0	113.3	N173 A216	N173-G218 PolarHBondContact ND2-O 3Å; A216-G218 VanDerWaalsContact C-N 3.26Å; A216-G218 PolarHBondContact O-N 3.24Å
219	A	36.2	Very low	55.3	Low	81 Å²	81	97.6 Å²	97.6	67%	0.669	63%	0.627	S	S	*	*			trans	-110.1	134.7	171.9	0	0	0	0	0	110.1	T217	T217-A219 PolarHBondContact O-N 2.87Å
220	P	45.9	Very low	54	Low	130 Å²	130	98.3 Å²	98.3	84%	0.844	63%	0.632	S	S	*	*			trans	-84.1	131.6	177	32.6	-32.2	0	0	0	111.1
221	T	31.9	Very low	51.9	Low	142 Å²	142	104 Å²	104	87%	0.871	65%	0.648	S	S	*	*			trans	-137.7	127.7	166.6	-52.7	0	0	0	0	108.8
222	A	36.3	Very low	49.7	Very low	79 Å²	79	107.8 Å²	107.8	65%	0.653	68%	0.675	S	S	*	*			trans	-109.7	155.2	-174.7	0	0	0	0	0	112.1
223	T	35	Very low	47.7	Very low	137 Å²	137	111.5 Å²	111.5	84%	0.84	71%	0.708	S	S	*	*			trans	80.9	149.5	170	77.5	0	0	0	0	117.7
224	P	40.5	Very low	45.8	Very low	121 Å²	121	112.8 Å²	112.8	79%	0.786	72%	0.716	S	S	*	*			cis	-121.1	173	-24.6	36.5	-22.4	0	0	0	113.2	P226	P224-P226 WeakPolarHBondContact O-CD 3.38Å
225	R	38.4	Very low	43.6	Very low	213 Å²	213	114.6 Å²	114.6	80%	0.804	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-85.4	128.4	-178.5	169.4	-176.5	-179.9	-131.7	5.6	113.1
226	P	34.4	Very low	41.3	Very low	116 Å²	116	119.9 Å²	119.9	75%	0.753	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-87.8	169.1	156.3	-9.9	29.3	0	0	0	113	P224	P224-P226 WeakPolarHBondContact O-CD 3.38Å
227	A	34.3	Very low	39.5	Very low	92 Å²	92	120.9 Å²	120.9	76%	0.76	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-86.4	167.5	-171.2	0	0	0	0	0	115.4
228	V	39.8	Very low	37.7	Very low	118 Å²	118	123.4 Å²	123.4	72%	0.715	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.2	149.9	179.7	-139.6	0	0	0	0	111.8
229	P	37.7	Very low	36.7	Very low	123 Å²	123	131.8 Å²	131.8	80%	0.799	79%	0.79	S	S	*	*			trans	-118.4	152.1	138.6	35.8	-30	0	0	0	111.8
230	S	42.3	Very low	36.7	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	80%	0.797	S	S	*	*			trans	-101.8	151.5	-170.5	51	0	0	0	0	114.3
231	R	30.8	Very low	35.9	Very low	247 Å²	247	136.6 Å²	136.6	93%	0.932	80%	0.799	S	S	*	*			trans	-151.3	163.5	160.1	-100.4	-153.9	130.3	-158.2	-2.3	110.7
232	P	35.2	Very low	35.9	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-103	168.7	-150.5	9.9	11.3	0	0	0	115.1
233	A	39.2	Very low	35.6	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-83.1	141.9	178.6	0	0	0	0	0	113.8
234	P	40.7	Very low	35.3	Very low	119 Å²	119	142.4 Å²	142.4	77%	0.773	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-86.1	167.2	160.5	35.3	-31.7	0	0	0	111.9
235	P	36.3	Very low	34.8	Very low	126 Å²	126	145 Å²	145	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-98.4	167.4	-153.2	37.5	-37.8	0	0	0	117.1
236	V	38.3	Very low	34.2	Very low	126 Å²	126	140.6 Å²	140.6	76%	0.764	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.6	137.9	170.9	-173.9	0	0	0	0	110.8
237	P	34.3	Very low	33.9	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	79%	0.791	S	S	*	*			trans	-92.4	113.8	162.8	12	6.2	0	0	0	110.9
238	S	31.6	Very low	33.5	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.6	147.2	177.1	-52.1	0	0	0	0	112.7
239	R	31.3	Very low	32.9	Very low	236 Å²	236	144.3 Å²	144.3	89%	0.891	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-94.2	136.8	163.7	-169.2	176	-175	173.1	1.1	108.5
240	P	37.1	Very low	33	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-74.4	143.9	-171	28.8	-35.7	0	0	0	113.4
241	E	28.6	Very low	32.2	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-89.5	156.8	166.9	-59	175	119.4	0	0	110.9
242	R	31.7	Very low	32	Very low	212 Å²	212	137.4 Å²	137.4	80%	0.8	79%	0.788	S	S	*	*			trans	177	140.5	146.5	-91.4	-147.4	172.4	146.2	10	108.7
243	E	31.3	Very low	31.6	Very low	134 Å²	134	137.5 Å²	137.5	63%	0.626	79%	0.792	S	S	*	*			cis	-167.6	121.9	-17	-127	159.9	-145.4	0	0	106.9
244	T	27.8	Very low	31.7	Very low	135 Å²	135	138.3 Å²	138.3	83%	0.828	79%	0.789	S	S	*	*			trans	61.3	158.8	157.1	60.8	0	0	0	0	119.2
245	E	29.6	Very low	31	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	79%	0.79	S	S	*	*			cis	-134.4	146	10.5	-73.2	-175.5	126.5	0	0	114.1
246	T	26.5	Very low	30.5	Very low	122 Å²	122	137.1 Å²	137.1	75%	0.748	78%	0.779	S	S	*	*			trans	18.7	132.3	149.2	61.7	0	0	0	0	123.7
247	T	27	Very low	30.2	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	78%	0.783	S	S	*	*				168.3	119.4	103.4	-71.5	0	0	0	0	115.5
248	T	26.7	Very low	29.9	Very low	134 Å²	134	137.8 Å²	137.8	82%	0.822	78%	0.781	S	S	*	*			trans	50.1	116.8	158.9	58.3	0	0	0	0	125.5
249	L	27.9	Very low	30.6	Very low	150 Å²	150	138.2 Å²	138.2	79%	0.785	78%	0.781	S	S	*	*			trans	-29.2	170.3	139.9	-71.1	163.6	0	0	0	118
250	P	38.7	Very low	30.2	Very low	120 Å²	120	130.2 Å²	130.2	78%	0.779	77%	0.772	S	S	*	*			cis	-124.1	152.8	22.6	14.3	12.2	0	0	0	116.2
251	T	24.9	Very low	29.8	Very low	118 Å²	118	129.7 Å²	129.7	72%	0.724	77%	0.771	S	S	*	*				78.6	102.4	66.9	-49.7	0	0	0	0	116
252	A	28.2	Very low	29.7	Very low	101 Å²	101	129.7 Å²	129.7	84%	0.835	77%	0.771	S	S	*	*			trans	-177.8	130.1	133.5	0	0	0	0	0	113.1
253	S	25.9	Very low	29.5	Very low	115 Å²	115	128 Å²	128	80%	0.804	77%	0.773	S	S	*	*			trans	-167.8	174.8	167.6	65	0	0	0	0	108.3
254	P	41.4	Very low	29.4	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	78%	0.782	S	S	*	*			cis	-97.5	-146	-10.3	34.3	-17.7	0	0	0	109.8
255	D	26.8	Very low	29.3	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	79%	0.785	S	S	*	*			cis	-162.5	177.6	6.4	-134.6	-19.4	0	0	0	107.3
256	A	25.8	Very low	29.2	Very low	71 Å²	71	131 Å²	131	59%	0.587	78%	0.778	S	S	*	*			cis	-161.3	-175.4	3.2	0	0	0	0	0	110.7
257	V	30.4	Very low	29.3	Very low	139 Å²	139	130.8 Å²	130.8	84%	0.842	78%	0.781	S	S	*	*			trans	71.1	93.1	157.6	-166.1	0	0	0	0	119.2
258	T	29.2	Very low	29.5	Very low	125 Å²	125	129.9 Å²	129.9	77%	0.767	79%	0.786	S	S	*	*			trans	-69.8	174.3	149.9	46.1	0	0	0	0	113.8
259	P	45.1	Very low	29.5	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	78%	0.783	S	S	*	*			cis	-142.1	174.3	-31.7	36.9	-19.1	0	0	0	115.6
260	G	24.8	Very low	29.5	Very low	68 Å²	68	126.1 Å²	126.1	70%	0.701	78%	0.783	S	S	*	*			trans	90.7	158.4	145.6	0	0	0	0	0	118.2
261	S	27.9	Very low	29.2	Very low	115 Å²	115	126.4 Å²	126.4	80%	0.804	78%	0.782	S	S	*	*			cis	-162.9	172.2	-9.1	-75.2	0	0	0	0	110.5
262	E	26.5	Very low	29.4	Very low	187 Å²	187	123.5 Å²	123.5	87%	0.874	77%	0.77	S	S	*	*			trans	79.9	173	162.8	-52.5	-169.4	135.6	0	0	118.3
263	E	27.7	Very low	29.4	Very low	177 Å²	177	123.3 Å²	123.3	83%	0.827	76%	0.759	S	S	*	*			trans	-73.7	175.2	-162.1	-59.3	162.4	121.7	0	0	112.7
264	E	29.7	Very low	29.6	Very low	177 Å²	177	125.1 Å²	125.1	83%	0.827	76%	0.759	S	S	*	*			cis	-163.7	170.4	17.6	-151.7	178.8	156.6	0	0	108.5
265	R	25.7	Very low	29	Very low	234 Å²	234	124.9 Å²	124.9	88%	0.883	76%	0.76	S	S	*	*			trans	-157.2	126.9	159.5	-119.2	-177.4	-171.7	-163.5	-1.1	118
266	S	27.6	Very low	28.9	Very low	95 Å²	95	125.1 Å²	125.1	66%	0.664	76%	0.761	S	S	*	*			trans	66.8	87.5	144.3	-61.2	0	0	0	0	121.8
267	S	28.2	Very low	29	Very low	117 Å²	117	131.8 Å²	131.8	82%	0.818	77%	0.771	S	S	*	*				35.5	145.8	92.8	-45.4	0	0	0	0	123.2
268	A	30.3	Very low	29.1	Very low	101 Å²	101	130.9 Å²	130.9	84%	0.835	77%	0.768	S	S	*	*			trans	81	162.7	147	0	0	0	0	0	117.9
269	A	27.7	Very low	28.8	Very low	92 Å²	92	129.9 Å²	129.9	76%	0.76	77%	0.766	S	S	*	*			cis	-150.1	164.1	12	0	0	0	0	0	116.9
270	S	27.6	Very low	28.5	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	76%	0.761	S	S	*	*			trans	-46.6	178.3	150	-20.7	0	0	0	0	114.5
271	V	31.2	Very low	28.6	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	77%	0.766	S	S	*	*			cis	-160.3	-176.5	-5.3	102.8	0	0	0	0	109.1	L474	V271-L474 WeakPolarHBondContact O-CD2 3.02Å
272	A	29.7	Very low	28.6	Very low	57 Å²	57	137.5 Å²	137.5	47%	0.471	77%	0.769	S	S	.	*			trans	-93.6	-173.6	-175.7	0	0	0	0	0	116.5	L474	A272-L474 VanDerWaalsContact C-CD2 3.48Å; A272-L474 VanDerWaalsContact O-CD1 3.28Å; A272-L474 WeakPolarHBondContact O-CD1 3.17Å
273	T	28	Very low	28.6	Very low	98 Å²	98	135 Å²	135	60%	0.601	77%	0.767	S	S	*	*				139.5	151.8	121.3	-30.6	0	0	0	0	117
274	L	31	Very low	29	Very low	153 Å²	153	132.8 Å²	132.8	80%	0.801	77%	0.768	S	S	*	*			trans	75.1	159.2	158.6	-52.6	-179.5	0	0	0	120.2
275	S	27.8	Very low	29	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	77%	0.765	S	S	*	*			cis	-178.8	150.8	-32.1	-87.3	0	0	0	0	112
276	D	26	Very low	29.2	Very low	154 Å²	154	125.9 Å²	125.9	82%	0.824	76%	0.761	S	S	*	*				-177.8	-177.4	125.7	-149.3	-5.5	0	0	0	114
277	R	26.2	Very low	29.3	Very low	211 Å²	211	128.8 Å²	128.8	80%	0.796	77%	0.769	S	S	*	*			trans	-96.9	176.9	-165.7	-78.6	169	70	-133.7	5.5	114.2
278	P	33.8	Very low	29.5	Very low	120 Å²	120	129 Å²	129	78%	0.779	77%	0.77	S	S	*	*			cis	-143.1	-177.2	25.5	43.4	-22.2	0	0	0	119.9
279	S	22.9	Very low	29.6	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	77%	0.771	S	S	*	*			trans	-64.9	171.2	171.9	-78.2	0	0	0	0	115.1
280	P	38.8	Very low	30	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	78%	0.776	S	S	*	*			cis	-141.1	-177.2	22.4	43.7	-25	0	0	0	119.4
281	E	25.6	Very low	30.4	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.804	78%	0.778	S	S	*	*			trans	91.6	143.8	148.2	-98.3	168.3	145.3	0	0	123.3
282	E	28.6	Very low	30.9	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	77%	0.773	S	S	*	*			trans	60.8	138.3	170.8	-53	-152.8	124.2	0	0	123.1
283	T	26.5	Very low	32.2	Very low	134 Å²	134	141.1 Å²	141.1	82%	0.822	78%	0.778	S	S	*	*			trans	-113.3	150.5	-176.3	50.5	0	0	0	0	110.3
284	P	36.7	Very low	33.8	Very low	131 Å²	131	144.7 Å²	144.7	85%	0.851	79%	0.787	S	S	*	*				-144.7	171.9	85.2	34.8	-15.9	0	0	0	117.2
285	A	29.3	Very low	35.6	Very low	93 Å²	93	140.1 Å²	140.1	77%	0.769	77%	0.768	S	S	*	*			trans	-47.5	153.3	-176.5	0	0	0	0	0	116.4
286	E	28.8	Very low	37.9	Very low	172 Å²	172	141 Å²	141	80%	0.804	76%	0.761	S	S	*	*				-159.9	165.8	77.5	-122.5	-170.6	146.9	0	0	117.7
287	L	31.6	Very low	40.4	Very low	157 Å²	157	136.9 Å²	136.9	82%	0.822	75%	0.748	S	S	*	*			trans	44.2	117.7	158.9	-113.1	63.9	0	0	0	121.6
288	S	31.2	Very low	43	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	72%	0.722	S	S	*	*			trans	-135.5	160.4	167.7	64.9	0	0	0	0	112.6
289	K	32.4	Very low	45.4	Very low	193 Å²	193	126.1 Å²	126.1	84%	0.839	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-67.6	150	-173.6	-60.4	171.4	-175.5	173.8	0	111.8	R291	K289-R291 PolarHBondContact O-N 3.28Å
290	P	35.9	Very low	48.4	Very low	135 Å²	135	123.9 Å²	123.9	88%	0.877	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-62.9	133.1	-180	26.3	-34.8	0	0	0	112.1
291	R	36	Very low	50.6	Low	222 Å²	222	123 Å²	123	84%	0.838	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-98.9	145.9	169.9	-175.7	-178.6	-71.9	-156.3	-2	108.2	K289	K289-R291 PolarHBondContact O-N 3.28Å
292	P	41.3	Very low	53.5	Low	101 Å²	101	114.9 Å²	114.9	66%	0.656	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-54.6	142.8	170.1	23.6	-35.1	0	0	0	110.6
293	T	56.8	Low	56.4	Low	91 Å²	91	108.8 Å²	108.8	56%	0.558	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-76.6	148.7	-174	66.9	0	0	0	0	111.5	S295 E296	T293-S295 PolarHBondContact O-N 2.76Å; T293-S295 VanDerWaalsContact O-N 3.15Å; T293-E296 WeakPolarHBondContact O-CB 3.42Å; T293-E296 PolarHBondContact O-N 2.92Å
294	E	62.9	Low	59.5	Low	173 Å²	173	108.8 Å²	108.8	81%	0.808	60%	0.599	S	S	*	*	H	α-helix	trans	-61.6	-26.5	-178.7	-60.2	-178.6	154.5	0	0	112.3	E296 A297 T298	E294-E296 VanDerWaalsContact C-N 3.35Å; E294-E296 PolarHBondContact O-N 2.89Å; E294-A297 PolarHBondContact O-N 3.48Å; E294-T298 PolarHBondContact O-N 3.38Å; E294-T298 PolarHBondContact O-OG1 3.09Å
295	S	67.4	Low	61.8	Low	57 Å²	57	104.4 Å²	104.4	40%	0.399	57%	0.566	S	S	.	*	H	α-helix	trans	-61.1	-37	172.3	-172.7	0	0	0	0	113.4	T293 T298 K299	T293-S295 PolarHBondContact O-N 2.76Å; T293-S295 VanDerWaalsContact O-N 3.15Å; S295-T298 WeakPolarHBondContact CA-OG1 3.35Å; S295-T298 PolarHBondContact O-OG1 3.45Å; S295-T298 VanDerWaalsContact O-OG1 3.08Å; S295-K299 VanDerWaalsContact O-CB 3.24Å; S295-K299 WeakPolarHBondContact O-CB 3.26Å; S295-K299 PolarHBondContact O-N 3.2Å
296	E	76.1	Confident	64.8	Low	127 Å²	127	100.7 Å²	100.7	59%	0.593	53%	0.533	S	S	*	.	H	α-helix	trans	-71.4	-36.7	178.9	-168.1	170.8	-158.2	0	0	111.3	T293 E294 A300	T293-E296 WeakPolarHBondContact O-CB 3.42Å; T293-E296 PolarHBondContact O-N 2.92Å; E294-E296 VanDerWaalsContact C-N 3.35Å; E294-E296 PolarHBondContact O-N 2.89Å; E296-A300 PolarHBondContact O-N 3.36Å
297	A	79.6	Confident	67.8	Low	67 Å²	67	98.5 Å²	98.5	55%	0.554	52%	0.52	S	S	*	.	H	α-helix	trans	-69.5	-42.4	175.6	0	0	0	0	0	112.7	E294 A300 M301	E294-A297 PolarHBondContact O-N 3.48Å; A297-A300 PolarHBondContact O-N 3.07Å; A297-M301 PolarHBondContact O-N 3.21Å; A297-M301 VanDerWaalsContact O-N 3.11Å
298	T	80.2	Confident	70.7	Confident	39 Å²	39	94.5 Å²	94.5	24%	0.239	50%	0.498	C	S	.	.	H	α-helix	trans	-67.6	-39.3	175.9	53.6	0	0	0	0	111.6	E294 S295 A300 M301 L302 L350	E294-T298 PolarHBondContact O-N 3.38Å; E294-T298 PolarHBondContact O-OG1 3.09Å; S295-T298 WeakPolarHBondContact CA-OG1 3.35Å; S295-T298 PolarHBondContact O-OG1 3.45Å; S295-T298 VanDerWaalsContact O-OG1 3.08Å; T298-A300 VanDerWaalsContact C-N 3.34Å; T298-A300 PolarHBondContact O-N 3.29Å; T298-M301 PolarHBondContact O-N 3.27Å; T298-L302 VanDerWaalsContact O-CG 3.31Å; T298-L302 WeakPolarHBondContact O-CG 3.49Å; T298-L302 PolarHBondContact O-N 2.93Å; T298-L350 HydrophobicContact CG2-CD1 4.16Å
299	K	84.4	Confident	73.6	Confident	66 Å²	66	89.1 Å²	89.1	29%	0.287	46%	0.459	S	S	.	.	H	α-helix	trans	-57.6	-44.4	172.2	-173.9	-179.7	-178.8	179.7	0	112.2	S295 L302 L303 L342 E343	S295-K299 VanDerWaalsContact O-CB 3.24Å; S295-K299 WeakPolarHBondContact O-CB 3.26Å; S295-K299 PolarHBondContact O-N 3.2Å; K299-L302 PolarHBondContact O-N 2.6Å; K299-L303 HydrophobicContact CG-CD1 4.12Å; K299-L303 WeakPolarHBondContact O-CG 3.17Å; K299-L303 PolarHBondContact O-N 3.32Å; K299-L342 HydrophobicContact CB-CD2 3.86Å; K299-E343 HydrophobicContact CD-CG 4.38Å; K299-E343 WeakPolarHBondContact CE-OE1 3.48Å; K299-E343 IonicContact NZ-OE1 3.14Å; K299-E343 PolarHBondContact NZ-OE1 3.42Å
300	A	86.6	Confident	76.5	Confident	57 Å²	57	83.3 Å²	83.3	47%	0.471	43%	0.434	S	S	.	.	H	α-helix	trans	-61.2	-45.5	176.5	0	0	0	0	0	112.2	E296 A297 T298 L302 L303 E304	E296-A300 PolarHBondContact O-N 3.36Å; A297-A300 PolarHBondContact O-N 3.07Å; T298-A300 VanDerWaalsContact C-N 3.34Å; T298-A300 PolarHBondContact O-N 3.29Å; A300-L302 PolarHBondContact O-N 3.36Å; A300-L303 PolarHBondContact O-N 3.46Å; A300-E304 PolarHBondContact O-N 3.23Å
301	M	85.4	Confident	79.3	Confident	89 Å²	89	81.1 Å²	81.1	44%	0.438	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-42.4	176.9	-171.3	-164.4	70.2	0	0	112.2	A297 T298 E304 R305 L353	A297-M301 PolarHBondContact O-N 3.21Å; A297-M301 VanDerWaalsContact O-N 3.11Å; T298-M301 PolarHBondContact O-N 3.27Å; M301-E304 PolarHBondContact O-N 2.65Å; M301-R305 WeakPolarHBondContact O-CB 2.98Å; M301-R305 PolarHBondContact O-N 3.03Å; M301-L353 HydrophobicContact CE-CD1 4.35Å
302	L	86.3	Confident	81.8	Confident	1 Å²	1	71 Å²	71	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-64	-41.6	177.6	-70.5	162.8	0	0	0	111.9	T298 K299 A300 R305 Q306 F335 V338 I339 L342 L353	T298-L302 VanDerWaalsContact O-CG 3.31Å; T298-L302 WeakPolarHBondContact O-CG 3.49Å; T298-L302 PolarHBondContact O-N 2.93Å; K299-L302 PolarHBondContact O-N 2.6Å; A300-L302 PolarHBondContact O-N 3.36Å; L302-R305 PolarHBondContact O-N 3.45Å; L302-Q306 WeakPolarHBondContact O-CB 3.4Å; L302-Q306 PolarHBondContact O-N 3.36Å; L302-F335 HydrophobicContact CD2-CD1 3.82Å; L302-F335 HydrophobicContact CD2-CE1 4.02Å; L302-V338 HydrophobicContact CD1-CG1 3.89Å; L302-V338 HydrophobicContact CD2-CG1 3.79Å; L302-V338 HydrophobicContact CG-CG1 4.49Å; L302-I339 HydrophobicContact CB-CD1 4.08Å; L302-I339 HydrophobicContact CB-CG1 3.69Å; L302-I339 HydrophobicContact CD1-CG1 4.35Å; L302-L342 HydrophobicContact CD1-CD2 3.77Å; L302-L353 HydrophobicContact CD2-CD1 3.81Å; L302-L353 HydrophobicContact CD2-CD2 4.17Å
303	L	89.9	Confident	84.2	Confident	59 Å²	59	66.6 Å²	66.6	31%	0.309	35%	0.35	S	S	.	.	H	α-helix	trans	-67.4	-37.8	177.2	-78	165.1	0	0	0	113.1	K299 A300 K307 I339	K299-L303 HydrophobicContact CG-CD1 4.12Å; K299-L303 WeakPolarHBondContact O-CG 3.17Å; K299-L303 PolarHBondContact O-N 3.32Å; A300-L303 PolarHBondContact O-N 3.46Å; L303-K307 WeakPolarHBondContact O-CD 3.43Å; L303-K307 VanDerWaalsContact O-CG 3.29Å; L303-K307 WeakPolarHBondContact O-CG 3.49Å; L303-K307 PolarHBondContact O-N 3.02Å; L303-I339 HydrophobicContact CD2-CD1 3.82Å; L303-I339 HydrophobicContact CG-CD1 3.99Å
304	E	89.9	Confident	85.8	Confident	133 Å²	133	67.2 Å²	67.2	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-64.9	-48.2	172.4	-178.9	165.6	-130.7	0	0	110.8	A300 M301 Q306 K307 E308	A300-E304 PolarHBondContact O-N 3.23Å; M301-E304 PolarHBondContact O-N 2.65Å; E304-Q306 VanDerWaalsContact C-N 3.32Å; E304-Q306 PolarHBondContact O-N 3.01Å; E304-K307 WeakPolarHBondContact O-CA 3.41Å; E304-K307 WeakPolarHBondContact O-CB 3.5Å; E304-K307 PolarHBondContact O-N 2.71Å; E304-E308 PolarHBondContact O-N 2.88Å
305	R	86.5	Confident	87.2	Confident	40 Å²	40	66 Å²	66	15%	0.151	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-37.7	179.2	-172.8	153.2	-145.1	55.3	21.8	113.4	M301 L302 K307 E308 Y309 F335 P354 S355 P356	M301-R305 WeakPolarHBondContact O-CB 2.98Å; M301-R305 PolarHBondContact O-N 3.03Å; L302-R305 PolarHBondContact O-N 3.45Å; R305-K307 VanDerWaalsContact C-N 3.35Å; R305-E308 IonicContact CZ-OE2 2.78Å; R305-E308 IonicContact NH1-OE2 2.66Å; R305-E308 PolarHBondContact NH1-OE2 2.94Å; R305-E308 IonicContact NH2-OE2 3.99Å; R305-E308 WeakPolarHBondContact O-CB 3.47Å; R305-E308 PolarHBondContact O-N 3.22Å; R305-Y309 HydrophobicContact CG-CE2 4.31Å; R305-Y309 WeakPolarHBondContact O-CD2 3.43Å; R305-Y309 PolarHBondContact O-N 3.34Å; R305-F335 HydrophobicContact CB-CE1 4.13Å; R305-F335 HydrophobicContact CB-CZ 4.48Å; R305-F335 HydrophobicContact CG-CD1 4.4Å; R305-F335 HydrophobicContact CG-CE1 3.58Å; R305-F335 HydrophobicContact CG-CE2 4.27Å; R305-F335 HydrophobicContact CG-CZ 3.51Å; R305-P354 PolarHBondContact NE-O 2.86Å; R305-P354 VanDerWaalsContact NE-O 3.08Å; R305-P354 PolarHBondContact NH2-O 3.43Å; R305-S355 VanDerWaalsContact NH2-C 3.26Å; R305-P356 VanDerWaalsContact NH2-CD 3.28Å
306	Q	91.3	Very high	88.3	Confident	15 Å²	15	63.8 Å²	63.8	7%	0.07	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-42.4	171.8	-172.9	-167.1	73.7	0	0	112	L302 E304 E308 Y309 K310 S332 F335 D336	L302-Q306 WeakPolarHBondContact O-CB 3.4Å; L302-Q306 PolarHBondContact O-N 3.36Å; E304-Q306 VanDerWaalsContact C-N 3.32Å; E304-Q306 PolarHBondContact O-N 3.01Å; Q306-E308 VanDerWaalsContact C-N 3.32Å; Q306-E308 PolarHBondContact O-N 2.91Å; Q306-Y309 PolarHBondContact O-N 3.39Å; Q306-K310 HydrophobicContact CG-CD 4.07Å; Q306-K310 HydrophobicContact CG-CG 4.47Å; Q306-K310 VanDerWaalsContact NE2-NZ 3.1Å; Q306-K310 PolarHBondContact O-N 3.37Å; Q306-S332 PolarHBondContact NE2-O 2.85Å; Q306-F335 HydrophobicContact CB-CB 3.9Å; Q306-F335 HydrophobicContact CB-CG 4.32Å; Q306-F335 HydrophobicContact CG-CB 4.03Å; Q306-D336 PolarHBondContact NE2-OD1 3.41Å; Q306-D336 PolarHBondContact NE2-OD2 3.2Å
307	K	92.9	Very high	89.1	Confident	126 Å²	126	65 Å²	65	55%	0.548	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-35.7	178.1	-67.3	161.5	-173.1	171.1	0	111.4	L303 E304 R305 Y309 K310 L311	L303-K307 WeakPolarHBondContact O-CD 3.43Å; L303-K307 VanDerWaalsContact O-CG 3.29Å; L303-K307 WeakPolarHBondContact O-CG 3.49Å; L303-K307 PolarHBondContact O-N 3.02Å; E304-K307 WeakPolarHBondContact O-CA 3.41Å; E304-K307 WeakPolarHBondContact O-CB 3.5Å; E304-K307 PolarHBondContact O-N 2.71Å; R305-K307 VanDerWaalsContact C-N 3.35Å; K307-Y309 VanDerWaalsContact C-N 3.34Å; K307-Y309 PolarHBondContact O-N 2.9Å; K307-K310 PolarHBondContact O-N 2.84Å; K307-L311 WeakPolarHBondContact O-CB 3.28Å; K307-L311 VanDerWaalsContact O-CG 3.29Å; K307-L311 WeakPolarHBondContact O-CG 3.38Å; K307-L311 PolarHBondContact O-N 3.48Å
308	E	91.9	Very high	89.6	Confident	73 Å²	73	70.7 Å²	70.7	34%	0.341	34%	0.338	S	S	.	.	H	α-helix	trans	-54.4	-49.6	170.7	-60.4	-170.8	132.1	0	0	111.3	E304 R305 Q306 L311 A312 P357	E304-E308 PolarHBondContact O-N 2.88Å; R305-E308 IonicContact CZ-OE2 2.78Å; R305-E308 IonicContact NH1-OE2 2.66Å; R305-E308 PolarHBondContact NH1-OE2 2.94Å; R305-E308 IonicContact NH2-OE2 3.99Å; R305-E308 WeakPolarHBondContact O-CB 3.47Å; R305-E308 PolarHBondContact O-N 3.22Å; Q306-E308 VanDerWaalsContact C-N 3.32Å; Q306-E308 PolarHBondContact O-N 2.91Å; E308-L311 PolarHBondContact O-N 3.17Å; E308-A312 WeakPolarHBondContact O-CB 3.4Å; E308-A312 PolarHBondContact O-N 3.37Å; E308-P357 HydrophobicContact CB-CG 4.12Å
309	Y	92.5	Very high	89.9	Confident	8 Å²	8	75.1 Å²	75.1	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-70.1	-39.7	-179.8	-77	-68.5	0	0	0	113.8	R305 Q306 K307 L311 A312 A313 Y328 T331 F335 P354 S355 P357	R305-Y309 HydrophobicContact CG-CE2 4.31Å; R305-Y309 WeakPolarHBondContact O-CD2 3.43Å; R305-Y309 PolarHBondContact O-N 3.34Å; Q306-Y309 PolarHBondContact O-N 3.39Å; K307-Y309 VanDerWaalsContact C-N 3.34Å; K307-Y309 PolarHBondContact O-N 2.9Å; Y309-L311 VanDerWaalsContact C-N 3.3Å; Y309-L311 PolarHBondContact O-N 2.78Å; Y309-A312 PolarHBondContact O-N 2.69Å; Y309-A313 WeakPolarHBondContact O-CB 3.29Å; Y309-A313 PolarHBondContact O-N 3.22Å; Y309-Y328 AromaticContact CD1-CD1 3.71Å; Y309-Y328 HydrophobicContact CD1-CD1 3.71Å; Y309-Y328 HydrophobicContact CD1-CE1 4.49Å; Y309-Y328 HydrophobicContact CD1-CG 4.41Å; Y309-Y328 AromaticContact CE1-CD1 3.9Å; Y309-Y328 HydrophobicContact CE1-CD1 3.9Å; Y309-Y328 HydrophobicContact CE1-CE1 4.32Å; Y309-T331 HydrophobicContact CD1-CG2 3.77Å; Y309-T331 HydrophobicContact CD2-CG2 3.97Å; Y309-T331 HydrophobicContact CE1-CG2 3.6Å; Y309-T331 HydrophobicContact CE2-CG2 3.79Å; Y309-T331 HydrophobicContact CG-CG2 3.96Å; Y309-F335 HydrophobicContact CD2-CD2 4.16Å; Y309-F335 AromaticContact CD2-CE2 3.52Å; Y309-F335 HydrophobicContact CD2-CE2 3.52Å; Y309-F335 HydrophobicContact CD2-CZ 4.26Å; Y309-F335 AromaticContact CE2-CE2 3.51Å; Y309-F335 HydrophobicContact CE2-CE2 3.51Å; Y309-F335 AromaticContact CE2-CZ 3.92Å; Y309-F335 HydrophobicContact CE2-CZ 3.92Å; Y309-P354 HydrophobicContact CE2-CG 4.08Å; Y309-P354 VanDerWaalsContact OH-C 3.29Å; Y309-P354 WeakPolarHBondContact OH-CB 3.45Å; Y309-P354 PolarHBondContact OH-O 3.23Å; Y309-S355 PolarHBondContact OH-O 2.85Å; Y309-P357 HydrophobicContact CD1-CB 4.07Å; Y309-P357 HydrophobicContact CD1-CG 3.88Å; Y309-P357 HydrophobicContact CE1-CB 3.94Å; Y309-P357 HydrophobicContact CE1-CG 3.94Å; Y309-P357 HydrophobicContact CG-CG 4.38Å
310	K	93.1	Very high	89.7	Confident	71 Å²	71	74.7 Å²	74.7	31%	0.309	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-40.1	174.3	-70.3	178.1	177.7	170	0	110.5	Q306 K307 L314 S332 D336	Q306-K310 HydrophobicContact CG-CD 4.07Å; Q306-K310 HydrophobicContact CG-CG 4.47Å; Q306-K310 VanDerWaalsContact NE2-NZ 3.1Å; Q306-K310 PolarHBondContact O-N 3.37Å; K307-K310 PolarHBondContact O-N 2.84Å; K310-L314 WeakPolarHBondContact O-CG 3.37Å; K310-L314 PolarHBondContact O-N 2.91Å; K310-L314 VanDerWaalsContact O-N 3.17Å; K310-S332 WeakPolarHBondContact CG-OG 3.46Å; K310-D336 IonicContact NZ-OD1 2.66Å; K310-D336 IonicContact NZ-OD2 2.76Å; K310-D336 PolarHBondContact NZ-OD2 2.88Å
311	L	93.3	Very high	89.9	Confident	88 Å²	88	75.6 Å²	75.6	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-71.2	-32.7	173.7	-70.2	169.5	0	0	0	113.6	K307 E308 Y309 R315	K307-L311 WeakPolarHBondContact O-CB 3.28Å; K307-L311 VanDerWaalsContact O-CG 3.29Å; K307-L311 WeakPolarHBondContact O-CG 3.38Å; K307-L311 PolarHBondContact O-N 3.48Å; E308-L311 PolarHBondContact O-N 3.17Å; Y309-L311 VanDerWaalsContact C-N 3.3Å; Y309-L311 PolarHBondContact O-N 2.78Å; L311-R315 WeakPolarHBondContact O-CG 3.32Å; L311-R315 PolarHBondContact O-N 2.94Å; L311-R315 VanDerWaalsContact O-N 3.09Å; L311-R315 PolarHBondContact O-NH1 3.24Å
312	A	89.9	Confident	90	Very high	10 Å²	10	77.1 Å²	77.1	8%	0.083	38%	0.379	C	S	.	.	H	α-helix	trans	-68	-42.1	174.3	0	0	0	0	0	111.9	E308 Y309 L314 R315 A316 Y328 P357	E308-A312 WeakPolarHBondContact O-CB 3.4Å; E308-A312 PolarHBondContact O-N 3.37Å; Y309-A312 PolarHBondContact O-N 2.69Å; A312-L314 VanDerWaalsContact C-N 3.34Å; A312-L314 PolarHBondContact O-N 2.89Å; A312-R315 PolarHBondContact O-N 3.44Å; A312-A316 PolarHBondContact O-N 2.9Å; A312-Y328 HydrophobicContact CB-CD1 4.37Å; A312-Y328 HydrophobicContact CB-CD2 3.82Å; A312-Y328 HydrophobicContact CB-CE2 4.2Å; A312-Y328 HydrophobicContact CB-CG 3.91Å; A312-P357 HydrophobicContact CB-CB 3.53Å; A312-P357 HydrophobicContact CB-CG 3.7Å
313	A	91.4	Very high	90.1	Very high	9 Å²	9	82.4 Å²	82.4	7%	0.074	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-42.4	174	0	0	0	0	0	112.1	Y309 A316 K317 F329	Y309-A313 WeakPolarHBondContact O-CB 3.29Å; Y309-A313 PolarHBondContact O-N 3.22Å; A313-A316 PolarHBondContact O-N 3.42Å; A313-K317 WeakPolarHBondContact O-CB 3.43Å; A313-K317 PolarHBondContact O-N 3.4Å; A313-F329 HydrophobicContact CB-CB 4.07Å
314	L	91.2	Very high	90	Very high	103 Å²	103	83 Å²	83	54%	0.539	41%	0.405	S	S	.	.	H	α-helix	trans	-68.2	-30	176.8	-72.1	172	0	0	0	113.6	K310 A312 K318	K310-L314 WeakPolarHBondContact O-CG 3.37Å; K310-L314 PolarHBondContact O-N 2.91Å; K310-L314 VanDerWaalsContact O-N 3.17Å; A312-L314 VanDerWaalsContact C-N 3.34Å; A312-L314 PolarHBondContact O-N 2.89Å; L314-K318 WeakPolarHBondContact O-CG 3.48Å; L314-K318 PolarHBondContact O-N 3.2Å
315	R	91.4	Very high	89.8	Confident	149 Å²	149	77.2 Å²	77.2	56%	0.562	38%	0.38	S	S	*	.	H	α-helix	trans	-70.4	-53.9	170.9	-72.2	-179.3	-168.8	101.2	-2.1	110.6	L311 A312 K317 K318 D319	L311-R315 WeakPolarHBondContact O-CG 3.32Å; L311-R315 PolarHBondContact O-N 2.94Å; L311-R315 VanDerWaalsContact O-N 3.09Å; L311-R315 PolarHBondContact O-NH1 3.24Å; A312-R315 PolarHBondContact O-N 3.44Å; R315-K317 PolarHBondContact O-N 3.43Å; R315-K317 VanDerWaalsContact O-N 3.16Å; R315-K318 CarbonylContact O-C 3.42Å; R315-K318 WeakPolarHBondContact O-CA 3.33Å; R315-K318 WeakPolarHBondContact O-CB 3.24Å; R315-K318 PolarHBondContact O-N 3.31Å; R315-D319 VanDerWaalsContact O-CG 3.23Å; R315-D319 PolarHBondContact O-N 2.69Å; R315-D319 VanDerWaalsContact O-OD2 3.1Å
316	A	91.4	Very high	90	Very high	9 Å²	9	79.7 Å²	79.7	7%	0.074	39%	0.392	C	S	.	.	H	α-helix	trans	-53.6	-39.4	177.1	0	0	0	0	0	113	A312 A313 K318 D319 G320 D321 Q324 A325 Y328	A312-A316 PolarHBondContact O-N 2.9Å; A313-A316 PolarHBondContact O-N 3.42Å; A316-K318 PolarHBondContact O-N 2.82Å; A316-D319 PolarHBondContact O-N 3.49Å; A316-G320 PolarHBondContact O-N 2.95Å; A316-D321 CarbonylContact O-C 3.46Å; A316-D321 PolarHBondContact O-N 2.92Å; A316-Q324 HydrophobicContact CB-CB 3.86Å; A316-A325 HydrophobicContact CB-CB 3.96Å; A316-Y328 HydrophobicContact CB-CD2 4.41Å
317	K	92.5	Very high	89.9	Confident	153 Å²	153	83.1 Å²	83.1	67%	0.665	41%	0.41	S	S	*	.	H	α-helix	trans	-63.4	-36.4	173.7	-171.4	178.6	178.6	-176.7	0	112.9	A313 R315 A325	A313-K317 WeakPolarHBondContact O-CB 3.43Å; A313-K317 PolarHBondContact O-N 3.4Å; R315-K317 PolarHBondContact O-N 3.43Å; R315-K317 VanDerWaalsContact O-N 3.16Å; K317-A325 HydrophobicContact CB-CB 4.05Å
318	K	89.1	Confident	89.8	Confident	187 Å²	187	79.9 Å²	79.9	81%	0.813	40%	0.395	S	S	*	.	H	α-helix	trans	-76.1	-32.3	175.9	-73.6	-177.2	176.1	-165.5	0	113	L314 R315 A316 G320	L314-K318 WeakPolarHBondContact O-CG 3.48Å; L314-K318 PolarHBondContact O-N 3.2Å; R315-K318 CarbonylContact O-C 3.42Å; R315-K318 WeakPolarHBondContact O-CA 3.33Å; R315-K318 WeakPolarHBondContact O-CB 3.24Å; R315-K318 PolarHBondContact O-N 3.31Å; A316-K318 PolarHBondContact O-N 2.82Å; K318-G320 PolarHBondContact O-N 3.26Å
319	D	87.1	Confident	89.7	Confident	131 Å²	131	81.3 Å²	81.3	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	1	177.7	-55.8	-36.5	0	0	0	112.4	R315 A316 D321	R315-D319 VanDerWaalsContact O-CG 3.23Å; R315-D319 PolarHBondContact O-N 2.69Å; R315-D319 VanDerWaalsContact O-OD2 3.1Å; A316-D319 PolarHBondContact O-N 3.49Å; D319-D321 VanDerWaalsContact C-N 3.34Å; D319-D321 PolarHBondContact O-N 2.89Å
320	G	80.8	Confident	89.6	Confident	58 Å²	58	88.9 Å²	88.9	60%	0.598	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-9.5	178	0	0	0	0	0	115.5	A316 K318 M322	A316-G320 PolarHBondContact O-N 2.95Å; K318-G320 PolarHBondContact O-N 3.26Å; G320-M322 PolarHBondContact O-N 3.11Å
321	D	90.4	Very high	89.4	Confident	75 Å²	75	86.6 Å²	86.6	40%	0.401	42%	0.421	S	S	.	.			trans	-81.2	82.1	179.5	-165.7	-26.7	0	0	0	111.5	A316 D319 E323 Q324 A325	A316-D321 CarbonylContact O-C 3.46Å; A316-D321 PolarHBondContact O-N 2.92Å; D319-D321 VanDerWaalsContact C-N 3.34Å; D319-D321 PolarHBondContact O-N 2.89Å; D321-E323 PolarHBondContact O-N 2.81Å; D321-E323 PolarHBondContact OD1-N 2.96Å; D321-Q324 HydrophobicContact CB-CB 4.19Å; D321-Q324 HydrophobicContact CB-CG 4.44Å; D321-Q324 VanDerWaalsContact CG-CG 3.41Å; D321-Q324 WeakPolarHBondContact OD1-CB 2.92Å; D321-Q324 PolarHBondContact OD1-N 2.83Å; D321-Q324 WeakPolarHBondContact OD2-CG 3.33Å; D321-A325 WeakPolarHBondContact O-CB 3.5Å; D321-A325 PolarHBondContact O-N 3.29Å
322	M	87.8	Confident	89.2	Confident	121 Å²	121	82.4 Å²	82.4	60%	0.596	40%	0.399	S	S	*	.	H	α-helix	trans	-62.3	-25.8	176.7	-93.8	-173	-83.5	0	0	114	G320 K326	G320-M322 PolarHBondContact O-N 3.11Å; M322-K326 WeakPolarHBondContact O-CB 3.19Å; M322-K326 WeakPolarHBondContact O-CD 3.4Å; M322-K326 WeakPolarHBondContact O-CG 3.43Å; M322-K326 PolarHBondContact O-N 2.95Å
323	E	88.4	Confident	89.2	Confident	113 Å²	113	87.9 Å²	87.9	53%	0.528	42%	0.421	S	S	.	.	H	α-helix	trans	-81.2	-40.6	-178.9	-66.4	-51.7	123.4	0	0	111.7	D321 A325 K326 L327	D321-E323 PolarHBondContact O-N 2.81Å; D321-E323 PolarHBondContact OD1-N 2.96Å; E323-A325 VanDerWaalsContact C-N 3.3Å; E323-A325 PolarHBondContact O-N 3.36Å; E323-K326 PolarHBondContact O-N 2.64Å; E323-K326 WeakPolarHBondContact OE1-CD 3.09Å; E323-K326 WeakPolarHBondContact OE1-CE 3.27Å; E323-K326 IonicContact OE1-NZ 3.22Å; E323-K326 PolarHBondContact OE1-NZ 2.67Å; E323-L327 WeakPolarHBondContact O-CB 3.43Å; E323-L327 PolarHBondContact O-N 2.71Å
324	Q	86.5	Confident	88.8	Confident	71 Å²	71	92.9 Å²	92.9	33%	0.332	45%	0.446	S	S	.	.	H	α-helix	trans	-63	-37.8	167.1	-69.9	-65.7	-36	0	0	111.4	A316 D321 L327 Y328	A316-Q324 HydrophobicContact CB-CB 3.86Å; D321-Q324 HydrophobicContact CB-CB 4.19Å; D321-Q324 HydrophobicContact CB-CG 4.44Å; D321-Q324 VanDerWaalsContact CG-CG 3.41Å; D321-Q324 WeakPolarHBondContact OD1-CB 2.92Å; D321-Q324 PolarHBondContact OD1-N 2.83Å; D321-Q324 WeakPolarHBondContact OD2-CG 3.33Å; Q324-L327 PolarHBondContact O-N 3.27Å; Q324-Y328 HydrophobicContact CB-CD2 4.36Å; Q324-Y328 HydrophobicContact CB-CE2 4.11Å; Q324-Y328 WeakPolarHBondContact O-CD2 3.25Å; Q324-Y328 PolarHBondContact O-N 3.47Å
325	A	86.9	Confident	88.6	Confident	12 Å²	12	88.1 Å²	88.1	10%	0.099	42%	0.421	C	S	.	.	H	α-helix	trans	-60.5	-48	175.1	0	0	0	0	0	111.9	A316 K317 D321 E323 L327 F329	A316-A325 HydrophobicContact CB-CB 3.96Å; K317-A325 HydrophobicContact CB-CB 4.05Å; D321-A325 WeakPolarHBondContact O-CB 3.5Å; D321-A325 PolarHBondContact O-N 3.29Å; E323-A325 VanDerWaalsContact C-N 3.3Å; E323-A325 PolarHBondContact O-N 3.36Å; A325-L327 PolarHBondContact O-N 3.04Å; A325-F329 VanDerWaalsContact O-CB 3.23Å; A325-F329 WeakPolarHBondContact O-CB 3.48Å; A325-F329 PolarHBondContact O-N 3.15Å
326	K	89.9	Confident	88.3	Confident	92 Å²	92	84.3 Å²	84.3	40%	0.4	41%	0.412	S	S	.	.	H	α-helix	trans	-61.1	-41.8	174.4	-72.1	162.3	-167.1	173.5	0	111.8	M322 E323 R330	M322-K326 WeakPolarHBondContact O-CB 3.19Å; M322-K326 WeakPolarHBondContact O-CD 3.4Å; M322-K326 WeakPolarHBondContact O-CG 3.43Å; M322-K326 PolarHBondContact O-N 2.95Å; E323-K326 PolarHBondContact O-N 2.64Å; E323-K326 WeakPolarHBondContact OE1-CD 3.09Å; E323-K326 WeakPolarHBondContact OE1-CE 3.27Å; E323-K326 IonicContact OE1-NZ 3.22Å; E323-K326 PolarHBondContact OE1-NZ 2.67Å; K326-R330 WeakPolarHBondContact O-CB 3.27Å; K326-R330 VanDerWaalsContact O-CG 3.27Å; K326-R330 WeakPolarHBondContact O-CG 3.45Å; K326-R330 PolarHBondContact O-N 3.03Å
327	L	89	Confident	87.9	Confident	87 Å²	87	86.8 Å²	86.8	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-63.1	-56.1	179.3	-177	61.7	0	0	0	111.2	E323 Q324 A325 F329 R330 T331	E323-L327 WeakPolarHBondContact O-CB 3.43Å; E323-L327 PolarHBondContact O-N 2.71Å; Q324-L327 PolarHBondContact O-N 3.27Å; A325-L327 PolarHBondContact O-N 3.04Å; L327-F329 VanDerWaalsContact C-N 3.29Å; L327-F329 PolarHBondContact O-N 3Å; L327-R330 PolarHBondContact O-N 3.43Å; L327-T331 PolarHBondContact O-N 3.05Å; L327-T331 PolarHBondContact O-OG1 3.31Å
328	Y	92	Very high	87.4	Confident	58 Å²	58	81 Å²	81	23%	0.227	41%	0.41	C	S	.	.	H	α-helix	trans	-62.4	-34.6	178.7	-66.6	-46	0	0	0	112.7	Y309 A312 A316 Q324 T331 S332 P357	Y309-Y328 AromaticContact CD1-CD1 3.71Å; Y309-Y328 HydrophobicContact CD1-CD1 3.71Å; Y309-Y328 HydrophobicContact CD1-CE1 4.49Å; Y309-Y328 HydrophobicContact CD1-CG 4.41Å; Y309-Y328 AromaticContact CE1-CD1 3.9Å; Y309-Y328 HydrophobicContact CE1-CD1 3.9Å; Y309-Y328 HydrophobicContact CE1-CE1 4.32Å; A312-Y328 HydrophobicContact CB-CD1 4.37Å; A312-Y328 HydrophobicContact CB-CD2 3.82Å; A312-Y328 HydrophobicContact CB-CE2 4.2Å; A312-Y328 HydrophobicContact CB-CG 3.91Å; A316-Y328 HydrophobicContact CB-CD2 4.41Å; Q324-Y328 HydrophobicContact CB-CD2 4.36Å; Q324-Y328 HydrophobicContact CB-CE2 4.11Å; Q324-Y328 WeakPolarHBondContact O-CD2 3.25Å; Q324-Y328 PolarHBondContact O-N 3.47Å; Y328-T331 PolarHBondContact O-N 2.99Å; Y328-S332 PolarHBondContact O-N 3.17Å; Y328-P357 HydrophobicContact CD1-CB 4.04Å; Y328-P357 HydrophobicContact CE1-CB 3.62Å
329	F	90	Very high	87.2	Confident	103 Å²	103	72.6 Å²	72.6	45%	0.452	37%	0.374	S	S	.	.	H	α-helix	trans	-66.5	-45.9	175.4	-174.4	-110.8	0	0	0	112.1	A313 A325 L327 T331 S332 K333	A313-F329 HydrophobicContact CB-CB 4.07Å; A325-F329 VanDerWaalsContact O-CB 3.23Å; A325-F329 WeakPolarHBondContact O-CB 3.48Å; A325-F329 PolarHBondContact O-N 3.15Å; L327-F329 VanDerWaalsContact C-N 3.29Å; L327-F329 PolarHBondContact O-N 3Å; F329-T331 VanDerWaalsContact C-N 3.34Å; F329-T331 PolarHBondContact O-N 3.34Å; F329-S332 WeakPolarHBondContact O-CB 3.48Å; F329-S332 PolarHBondContact O-N 3.24Å; F329-S332 VanDerWaalsContact O-N 3.1Å; F329-S332 PolarHBondContact O-OG 3.4Å; F329-K333 HydrophobicContact CE1-CD 4.42Å; F329-K333 PolarHBondContact O-N 2.74Å; F329-K333 VanDerWaalsContact O-N 3.08Å
330	R	89.8	Confident	87	Confident	166 Å²	166	71 Å²	71	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-57.7	-46.7	171.7	-74.6	170.5	177.6	165.8	0.3	111.1	K326 L327 S332 K333 N334	K326-R330 WeakPolarHBondContact O-CB 3.27Å; K326-R330 VanDerWaalsContact O-CG 3.27Å; K326-R330 WeakPolarHBondContact O-CG 3.45Å; K326-R330 PolarHBondContact O-N 3.03Å; L327-R330 PolarHBondContact O-N 3.43Å; R330-S332 VanDerWaalsContact C-N 3.25Å; R330-S332 PolarHBondContact O-N 2.82Å; R330-K333 PolarHBondContact O-N 2.69Å; R330-K333 VanDerWaalsContact O-N 3.12Å; R330-N334 PolarHBondContact O-N 2.76Å; R330-N334 PolarHBondContact O-OD1 3.42Å
331	T	87.7	Confident	87.1	Confident	24 Å²	24	69.2 Å²	69.2	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-39.2	174.7	-55.5	0	0	0	0	111.8	Y309 L327 Y328 F329 N334 F335 P354	Y309-T331 HydrophobicContact CD1-CG2 3.77Å; Y309-T331 HydrophobicContact CD2-CG2 3.97Å; Y309-T331 HydrophobicContact CE1-CG2 3.6Å; Y309-T331 HydrophobicContact CE2-CG2 3.79Å; Y309-T331 HydrophobicContact CG-CG2 3.96Å; L327-T331 PolarHBondContact O-N 3.05Å; L327-T331 PolarHBondContact O-OG1 3.31Å; Y328-T331 PolarHBondContact O-N 2.99Å; F329-T331 VanDerWaalsContact C-N 3.34Å; F329-T331 PolarHBondContact O-N 3.34Å; T331-N334 WeakPolarHBondContact O-CB 3.46Å; T331-N334 PolarHBondContact O-N 2.9Å; T331-F335 HydrophobicContact CG2-CE2 4.2Å; T331-F335 VanDerWaalsContact O-CD2 3.24Å; T331-F335 WeakPolarHBondContact O-CD2 3.23Å; T331-P354 HydrophobicContact CG2-CB 4.33Å; T331-P354 HydrophobicContact CG2-CG 3.59Å
332	S	89.8	Confident	86.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-34.6	176.8	82	0	0	0	0	114.1	Q306 K310 Y328 F329 R330 N334 F335	Q306-S332 PolarHBondContact NE2-O 2.85Å; K310-S332 WeakPolarHBondContact CG-OG 3.46Å; Y328-S332 PolarHBondContact O-N 3.17Å; F329-S332 WeakPolarHBondContact O-CB 3.48Å; F329-S332 PolarHBondContact O-N 3.24Å; F329-S332 VanDerWaalsContact O-N 3.1Å; F329-S332 PolarHBondContact O-OG 3.4Å; R330-S332 VanDerWaalsContact C-N 3.25Å; R330-S332 PolarHBondContact O-N 2.82Å; S332-N334 VanDerWaalsContact C-N 3.31Å; S332-N334 PolarHBondContact O-N 3.38Å; S332-F335 PolarHBondContact O-N 2.85Å
333	K	89.2	Confident	86.3	Confident	125 Å²	125	66.8 Å²	66.8	54%	0.543	33%	0.327	S	S	.	.	H	α-helix	trans	-67.7	-29.8	174.3	-77.2	-161	170.8	-166	0	112.7	F329 R330 F335 D336	F329-K333 HydrophobicContact CE1-CD 4.42Å; F329-K333 PolarHBondContact O-N 2.74Å; F329-K333 VanDerWaalsContact O-N 3.08Å; R330-K333 PolarHBondContact O-N 2.69Å; R330-K333 VanDerWaalsContact O-N 3.12Å; K333-F335 PolarHBondContact O-N 3.42Å; K333-D336 WeakPolarHBondContact CA-OD2 3.4Å; K333-D336 WeakPolarHBondContact O-CB 3.47Å; K333-D336 PolarHBondContact O-N 3.46Å; K333-D336 VanDerWaalsContact O-N 3.11Å
334	N	84.5	Confident	86	Confident	114 Å²	114	68 Å²	68	61%	0.61	33%	0.33	S	S	*	.	H	α-helix	trans	-64.8	-23.6	174.4	-65.4	2.3	0	0	0	112.5	R330 T331 S332 V338	R330-N334 PolarHBondContact O-N 2.76Å; R330-N334 PolarHBondContact O-OD1 3.42Å; T331-N334 WeakPolarHBondContact O-CB 3.46Å; T331-N334 PolarHBondContact O-N 2.9Å; S332-N334 VanDerWaalsContact C-N 3.31Å; S332-N334 PolarHBondContact O-N 3.38Å; N334-V338 WeakPolarHBondContact O-CG2 3.47Å
335	F	85.8	Confident	85.1	Confident	3 Å²	3	67.8 Å²	67.8	1%	0.013	35%	0.347	C	S	.	.	H	α-helix	trans	-76.4	-31.2	172.3	-72.8	-87	0	0	0	112.9	L302 R305 Q306 Y309 T331 S332 K333 A337 V338 I339 L353 P354	L302-F335 HydrophobicContact CD2-CD1 3.82Å; L302-F335 HydrophobicContact CD2-CE1 4.02Å; R305-F335 HydrophobicContact CB-CE1 4.13Å; R305-F335 HydrophobicContact CB-CZ 4.48Å; R305-F335 HydrophobicContact CG-CD1 4.4Å; R305-F335 HydrophobicContact CG-CE1 3.58Å; R305-F335 HydrophobicContact CG-CE2 4.27Å; R305-F335 HydrophobicContact CG-CZ 3.51Å; Q306-F335 HydrophobicContact CB-CB 3.9Å; Q306-F335 HydrophobicContact CB-CG 4.32Å; Q306-F335 HydrophobicContact CG-CB 4.03Å; Y309-F335 HydrophobicContact CD2-CD2 4.16Å; Y309-F335 AromaticContact CD2-CE2 3.52Å; Y309-F335 HydrophobicContact CD2-CE2 3.52Å; Y309-F335 HydrophobicContact CD2-CZ 4.26Å; Y309-F335 AromaticContact CE2-CE2 3.51Å; Y309-F335 HydrophobicContact CE2-CE2 3.51Å; Y309-F335 AromaticContact CE2-CZ 3.92Å; Y309-F335 HydrophobicContact CE2-CZ 3.92Å; T331-F335 HydrophobicContact CG2-CE2 4.2Å; T331-F335 VanDerWaalsContact O-CD2 3.24Å; T331-F335 WeakPolarHBondContact O-CD2 3.23Å; S332-F335 PolarHBondContact O-N 2.85Å; K333-F335 PolarHBondContact O-N 3.42Å; F335-A337 PolarHBondContact O-N 3.11Å; F335-V338 PolarHBondContact O-N 3.44Å; F335-I339 HydrophobicContact CB-CD1 4.38Å; F335-I339 WeakPolarHBondContact O-CB 3.28Å; F335-I339 WeakPolarHBondContact O-CD1 3.43Å; F335-I339 VanDerWaalsContact O-CG1 3.22Å; F335-I339 WeakPolarHBondContact O-CG1 3.41Å; F335-I339 PolarHBondContact O-N 2.83Å; F335-L353 HydrophobicContact CD1-CD2 4.47Å; F335-L353 HydrophobicContact CE1-CD2 3.82Å; F335-L353 HydrophobicContact CZ-CD2 4.35Å; F335-P354 HydrophobicContact CE2-CG 3.94Å; F335-P354 HydrophobicContact CZ-CG 3.92Å
336	D	85.4	Confident	84.3	Confident	69 Å²	69	73.2 Å²	73.2	37%	0.369	37%	0.371	S	S	.	.	H	α-helix	trans	-58.1	-50	178	-70.1	-68.3	0	0	0	110.2	Q306 K310 K333 V338 I339 E340	Q306-D336 PolarHBondContact NE2-OD1 3.41Å; Q306-D336 PolarHBondContact NE2-OD2 3.2Å; K310-D336 IonicContact NZ-OD1 2.66Å; K310-D336 IonicContact NZ-OD2 2.76Å; K310-D336 PolarHBondContact NZ-OD2 2.88Å; K333-D336 WeakPolarHBondContact CA-OD2 3.4Å; K333-D336 WeakPolarHBondContact O-CB 3.47Å; K333-D336 PolarHBondContact O-N 3.46Å; K333-D336 VanDerWaalsContact O-N 3.11Å; D336-V338 VanDerWaalsContact C-N 3.33Å; D336-V338 PolarHBondContact O-N 2.88Å; D336-I339 PolarHBondContact O-N 3.36Å; D336-E340 WeakPolarHBondContact O-CB 3.31Å; D336-E340 PolarHBondContact O-N 2.93Å
337	A	82.6	Confident	82.6	Confident	61 Å²	61	74.1 Å²	74.1	50%	0.504	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-33.7	178.5	0	0	0	0	0	113.9	F335 A341	F335-A337 PolarHBondContact O-N 3.11Å; A337-A341 WeakPolarHBondContact O-CB 3.31Å; A337-A341 PolarHBondContact O-N 3.06Å
338	V	82.3	Confident	81.5	Confident	31 Å²	31	72.2 Å²	72.2	19%	0.188	39%	0.387	C	S	.	.	H	α-helix	trans	-72.2	-38.9	176.6	165.5	0	0	0	0	111.5	L302 N334 F335 D336 L342 V348	L302-V338 HydrophobicContact CD1-CG1 3.89Å; L302-V338 HydrophobicContact CD2-CG1 3.79Å; L302-V338 HydrophobicContact CG-CG1 4.49Å; N334-V338 WeakPolarHBondContact O-CG2 3.47Å; F335-V338 PolarHBondContact O-N 3.44Å; D336-V338 VanDerWaalsContact C-N 3.33Å; D336-V338 PolarHBondContact O-N 2.88Å; V338-L342 WeakPolarHBondContact O-CB 3.3Å; V338-L342 PolarHBondContact O-N 3.14Å; V338-L342 VanDerWaalsContact O-N 3.12Å; V338-V348 HydrophobicContact CG1-CG1 4.14Å; V338-V348 HydrophobicContact CG2-CG1 4.49Å
339	I	84.7	Confident	80	Confident	11 Å²	11	75.2 Å²	75.2	6%	0.056	41%	0.407	C	S	.	.	H	α-helix	trans	-67.5	-43.4	175.5	-67.5	160.4	0	0	0	110	L302 L303 F335 D336 A341 L342 E343	L302-I339 HydrophobicContact CB-CD1 4.08Å; L302-I339 HydrophobicContact CB-CG1 3.69Å; L302-I339 HydrophobicContact CD1-CG1 4.35Å; L303-I339 HydrophobicContact CD2-CD1 3.82Å; L303-I339 HydrophobicContact CG-CD1 3.99Å; F335-I339 HydrophobicContact CB-CD1 4.38Å; F335-I339 WeakPolarHBondContact O-CB 3.28Å; F335-I339 WeakPolarHBondContact O-CD1 3.43Å; F335-I339 VanDerWaalsContact O-CG1 3.22Å; F335-I339 WeakPolarHBondContact O-CG1 3.41Å; F335-I339 PolarHBondContact O-N 2.83Å; D336-I339 PolarHBondContact O-N 3.36Å; I339-A341 PolarHBondContact O-N 2.87Å; I339-L342 PolarHBondContact O-N 3.24Å; I339-E343 HydrophobicContact CG2-CG 4.48Å; I339-E343 WeakPolarHBondContact O-CG 3.45Å; I339-E343 PolarHBondContact O-N 2.92Å
340	E	84.7	Confident	78.7	Confident	97 Å²	97	73.8 Å²	73.8	45%	0.453	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-40	177.9	-168.6	-172	168	0	0	112.4	D336 E343 K344	D336-E340 WeakPolarHBondContact O-CB 3.31Å; D336-E340 PolarHBondContact O-N 2.93Å; E340-E343 PolarHBondContact O-N 3.26Å; E340-K344 HydrophobicContact CG-CD 4.37Å; E340-K344 WeakPolarHBondContact O-CB 3.41Å; E340-K344 VanDerWaalsContact O-CG 3.3Å; E340-K344 WeakPolarHBondContact O-CG 3.44Å; E340-K344 PolarHBondContact O-N 3.14Å; E340-K344 WeakPolarHBondContact OE1-CE 3.29Å; E340-K344 IonicContact OE1-NZ 2.69Å; E340-K344 PolarHBondContact OE1-NZ 2.85Å
341	A	81.3	Confident	77.4	Confident	20 Å²	20	70.6 Å²	70.6	17%	0.165	41%	0.407	C	S	.	.	H	α-helix	trans	-65.2	-38.5	174.2	0	0	0	0	0	112.5	A337 I339 K344 G345 Q346 V348	A337-A341 WeakPolarHBondContact O-CB 3.31Å; A337-A341 PolarHBondContact O-N 3.06Å; I339-A341 PolarHBondContact O-N 2.87Å; A341-K344 CarbonylContact O-C 3.57Å; A341-K344 PolarHBondContact O-N 3.36Å; A341-G345 PolarHBondContact O-N 3.47Å; A341-Q346 WeakPolarHBondContact O-CB 3.47Å; A341-Q346 PolarHBondContact O-N 3.34Å; A341-V348 HydrophobicContact CB-CG2 3.83Å
342	L	81.6	Confident	76	Confident	27 Å²	27	72.8 Å²	72.8	14%	0.141	43%	0.434	C	S	.	.	H	α-helix	trans	-68.9	-38.7	175.5	-175.2	64.7	0	0	0	112	K299 L302 V338 I339 K344 G345	K299-L342 HydrophobicContact CB-CD2 3.86Å; L302-L342 HydrophobicContact CD1-CD2 3.77Å; V338-L342 WeakPolarHBondContact O-CB 3.3Å; V338-L342 PolarHBondContact O-N 3.14Å; V338-L342 VanDerWaalsContact O-N 3.12Å; I339-L342 PolarHBondContact O-N 3.24Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.45Å; L342-G345 PolarHBondContact O-N 2.97Å
343	E	81.1	Confident	75	Confident	119 Å²	119	75 Å²	75	56%	0.556	45%	0.446	S	S	*	.	H	α-helix	trans	-63.7	-33.7	171.9	-75.3	-176.8	156.7	0	0	112.5	K299 I339 E340 G345	K299-E343 HydrophobicContact CD-CG 4.38Å; K299-E343 WeakPolarHBondContact CE-OE1 3.48Å; K299-E343 IonicContact NZ-OE1 3.14Å; K299-E343 PolarHBondContact NZ-OE1 3.42Å; I339-E343 HydrophobicContact CG2-CG 4.48Å; I339-E343 WeakPolarHBondContact O-CG 3.45Å; I339-E343 PolarHBondContact O-N 2.92Å; E340-E343 PolarHBondContact O-N 3.26Å; E343-G345 PolarHBondContact O-N 3.48Å
344	K	81.2	Confident	74	Confident	137 Å²	137	71.4 Å²	71.4	60%	0.596	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	6.2	172.3	-68.9	170.8	-174.5	175.6	0	113.6	E340 A341 L342 Q346	E340-K344 HydrophobicContact CG-CD 4.37Å; E340-K344 WeakPolarHBondContact O-CB 3.41Å; E340-K344 VanDerWaalsContact O-CG 3.3Å; E340-K344 WeakPolarHBondContact O-CG 3.44Å; E340-K344 PolarHBondContact O-N 3.14Å; E340-K344 WeakPolarHBondContact OE1-CE 3.29Å; E340-K344 IonicContact OE1-NZ 2.69Å; E340-K344 PolarHBondContact OE1-NZ 2.85Å; A341-K344 CarbonylContact O-C 3.57Å; A341-K344 PolarHBondContact O-N 3.36Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.45Å; K344-Q346 VanDerWaalsContact C-N 3.34Å; K344-Q346 PolarHBondContact O-N 3Å
345	G	68.4	Low	73.3	Confident	67 Å²	67	70.6 Å²	70.6	69%	0.691	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	17.7	173.7	0	0	0	0	0	115.1	A341 L342 E343	A341-G345 PolarHBondContact O-N 3.47Å; L342-G345 PolarHBondContact O-N 2.97Å; E343-G345 PolarHBondContact O-N 3.48Å
346	Q	68.8	Low	72.6	Confident	127 Å²	127	72.7 Å²	72.7	59%	0.593	45%	0.452	S	S	*	.			trans	-81.5	142.3	176.1	-64.5	-176.8	-34.5	0	0	110.9	A341 K344 V348	A341-Q346 WeakPolarHBondContact O-CB 3.47Å; A341-Q346 PolarHBondContact O-N 3.34Å; K344-Q346 VanDerWaalsContact C-N 3.34Å; K344-Q346 PolarHBondContact O-N 3Å; Q346-V348 PolarHBondContact O-N 3.11Å; Q346-V348 VanDerWaalsContact O-N 3.17Å
347	A	55.1	Low	71.5	Confident	111 Å²	111	71 Å²	71	92%	0.917	45%	0.446	S	S	*	.			trans	-75.3	102.6	174.5	0	0	0	0	0	110
348	V	65.4	Low	70.5	Confident	47 Å²	47	71.8 Å²	71.8	29%	0.285	46%	0.459	S	S	.	.			trans	-93.8	129.7	-179.5	-169.9	0	0	0	0	110.8	V338 A341 Q346 L350	V338-V348 HydrophobicContact CG1-CG1 4.14Å; V338-V348 HydrophobicContact CG2-CG1 4.49Å; A341-V348 HydrophobicContact CB-CG2 3.83Å; Q346-V348 PolarHBondContact O-N 3.11Å; Q346-V348 VanDerWaalsContact O-N 3.17Å; V348-L350 PolarHBondContact O-N 3.37Å
349	D	59.8	Low	68.8	Low	121 Å²	121	78.6 Å²	78.6	65%	0.647	49%	0.486	S	S	*	.			trans	-71.7	119.4	171.6	-178.4	6.7	0	0	0	110.7	S351	D349-S351 VanDerWaalsContact C-N 3.34Å; D349-S351 WeakPolarHBondContact OD1-CB 3.5Å; D349-S351 PolarHBondContact OD1-N 3.46Å; D349-S351 PolarHBondContact OD1-OG 3.34Å; D349-S351 PolarHBondContact OD2-OG 2.99Å
350	L	64.7	Low	66.6	Low	72 Å²	72	81.8 Å²	81.8	38%	0.377	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-85.6	-4.1	-178.7	-55.1	177	0	0	0	113	T298 V348 G352 L353	T298-L350 HydrophobicContact CG2-CD1 4.16Å; V348-L350 PolarHBondContact O-N 3.37Å; L350-G352 VanDerWaalsContact C-N 3.26Å; L350-G352 PolarHBondContact O-N 3.06Å; L350-L353 HydrophobicContact CB-CD1 4.11Å; L350-L353 HydrophobicContact CD2-CD1 4.02Å; L350-L353 WeakPolarHBondContact O-CG 3.48Å; L350-L353 PolarHBondContact O-N 3.08Å
351	S	61	Low	64.3	Low	100 Å²	100	82.2 Å²	82.2	70%	0.699	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-65.4	-24.7	-175.4	73.4	0	0	0	0	114.2	D349	D349-S351 VanDerWaalsContact C-N 3.34Å; D349-S351 WeakPolarHBondContact OD1-CB 3.5Å; D349-S351 PolarHBondContact OD1-N 3.46Å; D349-S351 PolarHBondContact OD1-OG 3.34Å; D349-S351 PolarHBondContact OD2-OG 2.99Å
352	G	59.6	Low	61.9	Low	69 Å²	69	84.7 Å²	84.7	71%	0.711	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-87.3	5.2	-179.2	0	0	0	0	0	116.2	L350	L350-G352 VanDerWaalsContact C-N 3.26Å; L350-G352 PolarHBondContact O-N 3.06Å
353	L	67.9	Low	59.5	Low	47 Å²	47	86.8 Å²	86.8	25%	0.246	60%	0.598	C	S	.	*	P	Polyproline II helix	trans	-76.1	133	-171.6	-65.9	178.9	0	0	0	113.4	M301 L302 F335 L350	M301-L353 HydrophobicContact CE-CD1 4.35Å; L302-L353 HydrophobicContact CD2-CD1 3.81Å; L302-L353 HydrophobicContact CD2-CD2 4.17Å; F335-L353 HydrophobicContact CD1-CD2 4.47Å; F335-L353 HydrophobicContact CE1-CD2 3.82Å; F335-L353 HydrophobicContact CZ-CD2 4.35Å; L350-L353 HydrophobicContact CB-CD1 4.11Å; L350-L353 HydrophobicContact CD2-CD1 4.02Å; L350-L353 WeakPolarHBondContact O-CG 3.48Å; L350-L353 PolarHBondContact O-N 3.08Å
354	P	67.4	Low	56.9	Low	50 Å²	50	89.1 Å²	89.1	33%	0.325	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-76.4	149.3	-174.3	29.8	-35.7	0	0	0	114.3	R305 Y309 T331 F335	R305-P354 PolarHBondContact NE-O 2.86Å; R305-P354 VanDerWaalsContact NE-O 3.08Å; R305-P354 PolarHBondContact NH2-O 3.43Å; Y309-P354 HydrophobicContact CE2-CG 4.08Å; Y309-P354 VanDerWaalsContact OH-C 3.29Å; Y309-P354 WeakPolarHBondContact OH-CB 3.45Å; Y309-P354 PolarHBondContact OH-O 3.23Å; T331-P354 HydrophobicContact CG2-CB 4.33Å; T331-P354 HydrophobicContact CG2-CG 3.59Å; F335-P354 HydrophobicContact CE2-CG 3.94Å; F335-P354 HydrophobicContact CZ-CG 3.92Å
355	S	71.1	Confident	54.5	Low	96 Å²	96	88 Å²	88	67%	0.671	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-79.3	152.5	-174.6	-79	0	0	0	0	114	R305 Y309	R305-S355 VanDerWaalsContact NH2-C 3.26Å; Y309-S355 PolarHBondContact OH-O 2.85Å
356	P	71.3	Confident	52.5	Low	47 Å²	47	89.5 Å²	89.5	31%	0.305	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-60.4	136.3	-158.9	-20.4	28.8	0	0	0	113.4	R305 G358 K359	R305-P356 VanDerWaalsContact NH2-CD 3.28Å; P356-G358 PolarHBondContact O-N 3.12Å; P356-K359 PolarHBondContact O-N 3.49Å
357	P	61.7	Low	50.5	Low	35 Å²	35	88.3 Å²	88.3	23%	0.227	64%	0.64	C	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	112	179.7	26.4	-32.9	0	0	0	109.5	E308 Y309 A312 Y328	E308-P357 HydrophobicContact CB-CG 4.12Å; Y309-P357 HydrophobicContact CD1-CB 4.07Å; Y309-P357 HydrophobicContact CD1-CG 3.88Å; Y309-P357 HydrophobicContact CE1-CB 3.94Å; Y309-P357 HydrophobicContact CE1-CG 3.94Å; Y309-P357 HydrophobicContact CG-CG 4.38Å; A312-P357 HydrophobicContact CB-CB 3.53Å; A312-P357 HydrophobicContact CB-CG 3.7Å; Y328-P357 HydrophobicContact CD1-CB 4.04Å; Y328-P357 HydrophobicContact CE1-CB 3.62Å
358	G	60.7	Low	49.2	Very low	77 Å²	77	89.2 Å²	89.2	79%	0.794	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.1	-12.9	-170.4	0	0	0	0	0	114.9	P356	P356-G358 PolarHBondContact O-N 3.12Å
359	K	47.7	Very low	47.4	Very low	173 Å²	173	92.1 Å²	92.1	75%	0.752	66%	0.656	S	S	*	*	S	Bend	trans	-94.1	114.3	165	-125.5	165.6	-175.8	172.3	0	108.6	P356	P356-K359 PolarHBondContact O-N 3.49Å
360	G	38.9	Very low	45.7	Very low	78 Å²	78	96.3 Å²	96.3	80%	0.804	67%	0.668	S	S	*	*			trans	-58.6	133.5	-154.6	0	0	0	0	0	116.2	G362	G360-G362 VanDerWaalsContact C-N 3.29Å; G360-G362 PolarHBondContact O-N 3.05Å
361	A	35.4	Very low	44	Very low	106 Å²	106	98.4 Å²	98.4	88%	0.876	69%	0.686	S	S	*	*			trans	-76.8	73.4	173.7	0	0	0	0	0	112	G363	A361-G363 VanDerWaalsContact C-N 3.33Å; A361-G363 PolarHBondContact O-N 2.98Å; A361-G363 VanDerWaalsContact O-N 3.14Å
362	G	31.3	Very low	42.2	Very low	72 Å²	72	98.7 Å²	98.7	74%	0.742	69%	0.688	S	S	*	*			trans	-72	92	154.1	0	0	0	0	0	108.2	G360	G360-G362 VanDerWaalsContact C-N 3.29Å; G360-G362 PolarHBondContact O-N 3.05Å
363	G	30.8	Very low	40.7	Very low	71 Å²	71	100.5 Å²	100.5	73%	0.732	69%	0.69	S	S	*	*			trans	-65.6	141.1	-163.5	0	0	0	0	0	115	A361	A361-G363 VanDerWaalsContact C-N 3.33Å; A361-G363 PolarHBondContact O-N 2.98Å; A361-G363 VanDerWaalsContact O-N 3.14Å
364	I	27.9	Very low	38.7	Very low	168 Å²	168	106.1 Å²	106.1	86%	0.862	72%	0.715	S	S	*	*			trans	-108.6	97.9	163	-56.3	177.1	0	0	0	107.5
365	S	29.3	Very low	36.8	Very low	114 Å²	114	111.8 Å²	111.8	80%	0.797	74%	0.737	S	S	*	*			trans	-67.8	133.6	161.2	-68	0	0	0	0	108.9	A367	S365-A367 PolarHBondContact O-N 3.4Å
366	A	27.8	Very low	34.5	Very low	98 Å²	98	113.6 Å²	113.6	81%	0.81	74%	0.739	S	S	*	*			trans	-60.7	130	174.8	0	0	0	0	0	110.6
367	A	24.9	Very low	32.4	Very low	103 Å²	103	116.8 Å²	116.8	85%	0.851	75%	0.753	S	S	*	*			trans	-94.4	108.1	-179.6	0	0	0	0	0	111	S365	S365-A367 PolarHBondContact O-N 3.4Å
368	V	27.7	Very low	30.7	Very low	129 Å²	129	123.5 Å²	123.5	78%	0.782	78%	0.782	S	S	*	*			trans	-133.3	118.8	165.2	-177.7	0	0	0	0	109.4
369	S	27.7	Very low	28.9	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	78%	0.776	S	S	*	*			trans	48.9	110.9	166.5	62.2	0	0	0	0	120.2
370	K	25.2	Very low	27.9	Very low	209 Å²	209	119.7 Å²	119.7	91%	0.909	77%	0.769	S	S	*	*			trans	-128.9	141.2	133.6	-80.5	-170.3	177.8	-177.4	0	109
371	P	29.2	Very low	27.3	Very low	116 Å²	116	123.9 Å²	123.9	75%	0.753	77%	0.768	S	S	*	*			trans	-90	179.2	165.9	37.1	-34	0	0	0	112
372	S	23.3	Very low	26.6	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	76%	0.761	S	S	*	*			trans	81.9	85.8	161.4	-52.2	0	0	0	0	119.1
373	S	27.6	Very low	26.4	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	76%	0.762	S	S	*	*				98.2	140.8	121.2	-59.6	0	0	0	0	122.1
374	E	25.6	Very low	26	Very low	164 Å²	164	130.9 Å²	130.9	77%	0.766	77%	0.771	S	S	*	*			trans	81.8	89.2	148.6	-76.4	162.5	-157.3	0	0	122.5
375	Q	28.1	Very low	26.1	Very low	170 Å²	170	127.8 Å²	127.8	79%	0.794	77%	0.771	S	S	*	*				70.6	97.7	118.7	-66.9	-176.5	30.8	0	0	122
376	N	23.1	Very low	26.2	Very low	134 Å²	134	126.9 Å²	126.9	72%	0.717	77%	0.77	S	S	*	*				74.1	132.7	103.9	-148.8	24.9	0	0	0	122
377	L	26.6	Very low	26.4	Very low	114 Å²	114	127.9 Å²	127.9	60%	0.597	77%	0.771	S	S	*	*			trans	69.6	115.7	165.7	-50.8	-172.4	0	0	0	118.3
378	Q	25.2	Very low	26.9	Very low	176 Å²	176	125.8 Å²	125.8	82%	0.822	76%	0.76	S	S	*	*				81.5	146.4	99.7	-69.5	173.4	-16.5	0	0	114.1
379	A	24.8	Very low	27.4	Very low	83 Å²	83	126.5 Å²	126.5	69%	0.686	77%	0.767	S	S	*	*			cis	-144	140.2	8.2	0	0	0	0	0	108.3
380	S	25.4	Very low	27.7	Very low	86 Å²	86	126 Å²	126	60%	0.601	77%	0.769	S	S	*	*				105.4	147	62.6	74	0	0	0	0	112.3
381	H	26.8	Very low	28.7	Very low	166 Å²	166	118.7 Å²	118.7	77%	0.769	75%	0.754	S	S	*	*			trans	71.4	141.2	178.2	-41.8	-68	0	0	0	115.9
382	T	21.4	Very low	29.6	Very low	121 Å²	121	116.1 Å²	116.1	74%	0.742	74%	0.737	S	S	*	*			cis	-156.1	158.4	-9	4.1	0	0	0	0	111.6
383	V	25.3	Very low	31.1	Very low	126 Å²	126	115.2 Å²	115.2	76%	0.764	73%	0.73	S	S	*	*			trans	-7.6	129	166.9	-74.5	0	0	0	0	120.4
384	T	24.2	Very low	32.2	Very low	150 Å²	150	113.9 Å²	113.9	92%	0.92	73%	0.726	S	S	*	*				178.4	170.5	107.9	29.2	0	0	0	0	110.9
385	A	29.6	Very low	33.5	Very low	103 Å²	103	106.5 Å²	106.5	85%	0.851	69%	0.692	S	S	*	*			trans	-123.6	129.8	-174.7	0	0	0	0	0	113.3
386	A	30.3	Very low	34.9	Very low	95 Å²	95	108 Å²	108	79%	0.785	70%	0.696	S	S	*	*			trans	-179.5	158.5	169.8	0	0	0	0	0	107.9
387	S	32.8	Very low	37.3	Very low	118 Å²	118	105.2 Å²	105.2	83%	0.825	68%	0.681	S	S	*	*			cis	-163.7	163.4	-21.4	-92	0	0	0	0	108.1
388	G	35.3	Very low	39.7	Very low	60 Å²	60	100.9 Å²	100.9	62%	0.619	66%	0.659	S	S	*	*	S	Bend	trans	-73.7	171.2	175	0	0	0	0	0	114.3	A390	G388-A390 PolarHBondContact O-N 3.28Å
389	P	38.6	Very low	42.4	Very low	144 Å²	144	94.2 Å²	94.2	94%	0.935	63%	0.629	S	S	*	*	S	Bend	trans	-62.4	126.7	177.4	27.1	-34.2	0	0	0	110.5
390	A	34.5	Very low	45.1	Very low	96 Å²	96	93.7 Å²	93.7	79%	0.793	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-86.1	144.5	-160.4	0	0	0	0	0	113.8	G388	G388-A390 PolarHBondContact O-N 3.28Å
391	G	44.5	Very low	47.8	Very low	57 Å²	57	89.8 Å²	89.8	59%	0.588	59%	0.585	S	S	*	*	S	Bend	trans	-66.9	171.2	146.9	0	0	0	0	0	110.3	S393	G391-S393 PolarHBondContact O-N 3.29Å
392	P	47.9	Very low	50.5	Low	62 Å²	62	81.9 Å²	81.9	40%	0.403	55%	0.549	S	S	.	.	S	Bend	trans	-54.4	132	173.5	25.2	-33.6	0	0	0	109.5	A394 F459	P392-A394 PolarHBondContact O-N 2.99Å; P392-F459 HydrophobicContact CG-CD1 4.28Å; P392-F459 HydrophobicContact CG-CE1 3.9Å; P392-F459 HydrophobicContact CG-CZ 4.28Å
393	S	55.1	Low	53.7	Low	86 Å²	86	78.9 Å²	78.9	60%	0.601	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-54.7	133.5	179.6	49.4	0	0	0	0	109.8	G391 P395	G391-S393 PolarHBondContact O-N 3.29Å; S393-P395 WeakPolarHBondContact O-CD 3.48Å
394	A	51.8	Low	56.6	Low	80 Å²	80	74.7 Å²	74.7	66%	0.661	50%	0.499	S	S	*	.			trans	-47.8	113.6	-178.3	0	0	0	0	0	109.6	P392 K396	P392-A394 PolarHBondContact O-N 2.99Å; A394-K396 PolarHBondContact O-N 2.79Å
395	P	53.3	Low	59.6	Low	10 Å²	10	68.1 Å²	68.1	7%	0.065	46%	0.457	C	S	.	.			trans	-63.5	135.8	-168.1	22.4	-32.4	0	0	0	109.7	S393 D397 E400 A401 P463	S393-P395 WeakPolarHBondContact O-CD 3.48Å; P395-D397 VanDerWaalsContact C-N 3.33Å; P395-E400 WeakPolarHBondContact CA-OE2 3.47Å; P395-E400 HydrophobicContact CB-CB 3.86Å; P395-E400 HydrophobicContact CB-CG 3.92Å; P395-A401 HydrophobicContact CB-CB 3.95Å; P395-A401 HydrophobicContact CG-CB 3.57Å; P395-P463 VanDerWaalsContact O-CG 3.29Å; P395-P463 WeakPolarHBondContact O-CG 3.36Å
396	K	57.3	Low	62.6	Low	200 Å²	200	66.1 Å²	66.1	87%	0.87	43%	0.427	S	S	*	.	S	Bend	trans	-85.4	-12	-176.4	-66.8	176.3	-178.1	172.6	0	112.7	A394 E400	A394-K396 PolarHBondContact O-N 2.79Å; K396-E400 PolarHBondContact N-OE2 2.86Å
397	D	72.6	Confident	65.5	Low	76 Å²	76	64.6 Å²	64.6	41%	0.406	41%	0.408	S	S	.	.	S	Bend	trans	-140.1	152.3	-179.8	-179.8	27.4	0	0	0	110.8	P395 L399 E400 A401	P395-D397 VanDerWaalsContact C-N 3.33Å; D397-L399 PolarHBondContact O-N 3.14Å; D397-L399 WeakPolarHBondContact OD2-CB 3.21Å; D397-E400 WeakPolarHBondContact O-CB 3.37Å; D397-E400 PolarHBondContact O-N 3.19Å; D397-E400 VanDerWaalsContact O-N 3.13Å; D397-A401 PolarHBondContact O-N 3.13Å
398	V	77.7	Confident	68.3	Low	23 Å²	23	63.5 Å²	63.5	14%	0.139	39%	0.388	C	S	.	.	H	α-helix	trans	-57.5	-39.1	176.1	175.9	0	0	0	0	111.2	E400 A401 L402 H442 F450 I462 P463	V398-E400 VanDerWaalsContact C-N 3.35Å; V398-E400 PolarHBondContact O-N 3.49Å; V398-A401 PolarHBondContact O-N 3.02Å; V398-L402 HydrophobicContact CG1-CD1 4.47Å; V398-L402 WeakPolarHBondContact O-CG 3.42Å; V398-L402 PolarHBondContact O-N 3.32Å; V398-L402 VanDerWaalsContact O-N 3.1Å; V398-H442 VanDerWaalsContact CG1-NE2 3.34Å; V398-H442 WeakPolarHBondContact CG1-NE2 3.33Å; V398-F450 HydrophobicContact CG1-CE1 3.66Å; V398-F450 HydrophobicContact CG1-CZ 3.68Å; V398-I462 HydrophobicContact CB-CG2 4.12Å; V398-I462 HydrophobicContact CG1-CG2 3.81Å; V398-I462 HydrophobicContact CG2-CG2 3.86Å; V398-P463 WeakPolarHBondContact CG2-O 3.43Å
399	L	80.9	Confident	71.1	Confident	37 Å²	37	61.7 Å²	61.7	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-37.5	177.6	-65.7	176.3	0	0	0	112.4	D397 L402 E403 H442 K443	D397-L399 PolarHBondContact O-N 3.14Å; D397-L399 WeakPolarHBondContact OD2-CB 3.21Å; L399-L402 PolarHBondContact O-N 3.39Å; L399-E403 VanDerWaalsContact O-CB 3.25Å; L399-E403 WeakPolarHBondContact O-CB 3.42Å; L399-E403 PolarHBondContact O-N 3.17Å; L399-H442 HydrophobicContact CD2-CB 3.75Å; L399-H442 WeakPolarHBondContact CD2-ND1 3.37Å; L399-H442 WeakPolarHBondContact CG-ND1 3.48Å; L399-K443 HydrophobicContact CD1-CD 4.48Å; L399-K443 HydrophobicContact CD1-CG 3.77Å; L399-K443 HydrophobicContact CD2-CD 4.41Å; L399-K443 HydrophobicContact CD2-CG 3.69Å; L399-K443 HydrophobicContact CG-CG 4.4Å
400	E	82.5	Confident	73.7	Confident	72 Å²	72	57.2 Å²	57.2	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-44.9	177.3	-169.3	-174.3	-177.2	0	0	110.4	P395 K396 D397 V398 L402 E403 Q404	P395-E400 WeakPolarHBondContact CA-OE2 3.47Å; P395-E400 HydrophobicContact CB-CB 3.86Å; P395-E400 HydrophobicContact CB-CG 3.92Å; K396-E400 PolarHBondContact N-OE2 2.86Å; D397-E400 WeakPolarHBondContact O-CB 3.37Å; D397-E400 PolarHBondContact O-N 3.19Å; D397-E400 VanDerWaalsContact O-N 3.13Å; V398-E400 VanDerWaalsContact C-N 3.35Å; V398-E400 PolarHBondContact O-N 3.49Å; E400-L402 PolarHBondContact O-N 3.49Å; E400-E403 PolarHBondContact O-N 2.89Å; E400-Q404 HydrophobicContact CG-CG 4.46Å; E400-Q404 WeakPolarHBondContact O-CB 3.46Å; E400-Q404 VanDerWaalsContact O-CG 3.25Å; E400-Q404 WeakPolarHBondContact O-CG 3.48Å; E400-Q404 PolarHBondContact O-N 2.83Å; E400-Q404 PolarHBondContact OE1-NE2 3.39Å
401	A	81.8	Confident	76.5	Confident	3 Å²	3	57.1 Å²	57.1	3%	0.025	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-44.8	176.2	0	0	0	0	0	112.5	P395 D397 V398 R405 I462	P395-A401 HydrophobicContact CB-CB 3.95Å; P395-A401 HydrophobicContact CG-CB 3.57Å; D397-A401 PolarHBondContact O-N 3.13Å; V398-A401 PolarHBondContact O-N 3.02Å; A401-R405 WeakPolarHBondContact O-CB 3.09Å; A401-R405 WeakPolarHBondContact O-CD 3.43Å; A401-R405 VanDerWaalsContact O-CG 3.23Å; A401-R405 WeakPolarHBondContact O-CG 3.43Å; A401-R405 PolarHBondContact O-N 2.78Å; A401-I462 HydrophobicContact CB-CG1 4.08Å; A401-I462 HydrophobicContact CB-CG2 4.47Å
402	L	83.9	Confident	78.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-42.2	176.9	-69.5	177.6	0	0	0	112.6	V398 L399 E400 R405 R406 Y435 A438 I439 F450 L453 I462	V398-L402 HydrophobicContact CG1-CD1 4.47Å; V398-L402 WeakPolarHBondContact O-CG 3.42Å; V398-L402 PolarHBondContact O-N 3.32Å; V398-L402 VanDerWaalsContact O-N 3.1Å; L399-L402 PolarHBondContact O-N 3.39Å; E400-L402 PolarHBondContact O-N 3.49Å; L402-R405 PolarHBondContact O-N 3.16Å; L402-R406 WeakPolarHBondContact O-CB 3.35Å; L402-R406 PolarHBondContact O-N 2.65Å; L402-Y435 HydrophobicContact CD2-CD1 3.92Å; L402-Y435 HydrophobicContact CD2-CE1 3.85Å; L402-A438 HydrophobicContact CD1-CB 4.37Å; L402-I439 HydrophobicContact CB-CD1 4.08Å; L402-I439 HydrophobicContact CB-CG1 3.51Å; L402-I439 HydrophobicContact CD1-CG1 4.05Å; L402-I439 HydrophobicContact CG-CG1 4.43Å; L402-F450 HydrophobicContact CD1-CE1 4.19Å; L402-F450 HydrophobicContact CD2-CD1 4.32Å; L402-F450 HydrophobicContact CD2-CE1 4.37Å; L402-L453 HydrophobicContact CD2-CD1 3.7Å; L402-I462 HydrophobicContact CD2-CD1 4.05Å
403	E	87.5	Confident	80.9	Confident	58 Å²	58	52.6 Å²	52.6	27%	0.271	28%	0.278	S	S	.	.	H	α-helix	trans	-66.8	-42.8	-178.3	-160.5	79.8	-110	0	0	110.7	L399 E400 R406 V407 I439 K443	L399-E403 VanDerWaalsContact O-CB 3.25Å; L399-E403 WeakPolarHBondContact O-CB 3.42Å; L399-E403 PolarHBondContact O-N 3.17Å; E400-E403 PolarHBondContact O-N 2.89Å; E403-R406 WeakPolarHBondContact O-CB 3.42Å; E403-R406 PolarHBondContact O-N 3.16Å; E403-R406 IonicContact OE1-CZ 3.92Å; E403-R406 VanDerWaalsContact OE1-CZ 3.23Å; E403-R406 IonicContact OE1-NE 2.77Å; E403-R406 PolarHBondContact OE1-NE 2.89Å; E403-R406 IonicContact OE1-NH2 3.68Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å; E403-V407 WeakPolarHBondContact O-CG2 3.32Å; E403-V407 PolarHBondContact O-N 2.8Å; E403-I439 HydrophobicContact CB-CD1 4.36Å; E403-K443 IonicContact OE2-NZ 3.24Å; E403-K443 PolarHBondContact OE2-NZ 2.8Å
404	Q	86.4	Confident	82.8	Confident	39 Å²	39	52.4 Å²	52.4	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-49	172.6	-71.1	176.8	7.9	0	0	111.8	E400 R406 V407 K408 F459	E400-Q404 HydrophobicContact CG-CG 4.46Å; E400-Q404 WeakPolarHBondContact O-CB 3.46Å; E400-Q404 VanDerWaalsContact O-CG 3.25Å; E400-Q404 WeakPolarHBondContact O-CG 3.48Å; E400-Q404 PolarHBondContact O-N 2.83Å; E400-Q404 PolarHBondContact OE1-NE2 3.39Å; Q404-R406 PolarHBondContact O-N 2.85Å; Q404-V407 PolarHBondContact O-N 3.42Å; Q404-K408 PolarHBondContact O-N 2.77Å; Q404-K408 VanDerWaalsContact O-N 3.12Å; Q404-F459 HydrophobicContact CB-CE1 4.18Å
405	R	87.1	Confident	84.8	Confident	12 Å²	12	55.5 Å²	55.5	5%	0.045	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-37.8	178	-69.4	171.4	-179	-164.9	3.6	112.1	A401 L402 K408 Y409 Y435 F459 P460	A401-R405 WeakPolarHBondContact O-CB 3.09Å; A401-R405 WeakPolarHBondContact O-CD 3.43Å; A401-R405 VanDerWaalsContact O-CG 3.23Å; A401-R405 WeakPolarHBondContact O-CG 3.43Å; A401-R405 PolarHBondContact O-N 2.78Å; L402-R405 PolarHBondContact O-N 3.16Å; R405-K408 PolarHBondContact O-N 3.37Å; R405-Y409 WeakPolarHBondContact O-CD2 3.44Å; R405-Y409 PolarHBondContact O-N 2.95Å; R405-Y435 HydrophobicContact CB-CD1 4.02Å; R405-Y435 HydrophobicContact CB-CE1 3.49Å; R405-Y435 VanDerWaalsContact CB-CE1 3.49Å; R405-Y435 WeakPolarHBondContact CD-OH 3.34Å; R405-Y435 HydrophobicContact CG-CE1 4.29Å; R405-F459 HydrophobicContact CG-CD1 3.84Å; R405-F459 HydrophobicContact CG-CE1 4.39Å; R405-F459 HydrophobicContact CG-CG 4.28Å; R405-P460 PolarHBondContact NH2-O 3.08Å
406	R	91.9	Very high	86.7	Confident	61 Å²	61	55.2 Å²	55.2	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-49.8	173.2	-172.2	-173.9	63.1	76	-0.1	111.2	L402 E403 Q404 K408 Y409 V410 I439	L402-R406 WeakPolarHBondContact O-CB 3.35Å; L402-R406 PolarHBondContact O-N 2.65Å; E403-R406 WeakPolarHBondContact O-CB 3.42Å; E403-R406 PolarHBondContact O-N 3.16Å; E403-R406 IonicContact OE1-CZ 3.92Å; E403-R406 VanDerWaalsContact OE1-CZ 3.23Å; E403-R406 IonicContact OE1-NE 2.77Å; E403-R406 PolarHBondContact OE1-NE 2.89Å; E403-R406 IonicContact OE1-NH2 3.68Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å; Q404-R406 PolarHBondContact O-N 2.85Å; R406-K408 VanDerWaalsContact C-N 3.25Å; R406-K408 PolarHBondContact O-N 2.83Å; R406-Y409 PolarHBondContact O-N 2.94Å; R406-V410 WeakPolarHBondContact O-CG2 3.33Å; R406-V410 PolarHBondContact O-N 3.42Å; R406-V410 VanDerWaalsContact O-N 3.09Å; R406-I439 HydrophobicContact CB-CD1 4.04Å; R406-I439 HydrophobicContact CG-CD1 4.49Å
407	V	91.9	Very high	88.5	Confident	63 Å²	63	50.2 Å²	50.2	38%	0.382	25%	0.248	S	C	.	.	H	α-helix	trans	-57.2	-42.3	178.8	170.3	0	0	0	0	110.2	E403 Q404 Y409 V410 E411	E403-V407 WeakPolarHBondContact O-CG2 3.32Å; E403-V407 PolarHBondContact O-N 2.8Å; Q404-V407 PolarHBondContact O-N 3.42Å; V407-Y409 VanDerWaalsContact C-N 3.32Å; V407-Y409 PolarHBondContact O-N 3.46Å; V407-V410 WeakPolarHBondContact O-CB 3.44Å; V407-V410 PolarHBondContact O-N 2.63Å; V407-E411 HydrophobicContact CG1-CG 4.48Å; V407-E411 PolarHBondContact O-N 2.76Å
408	K	91.4	Very high	89.4	Confident	94 Å²	94	51 Å²	51	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-33.7	-179.7	-161.8	53.9	171.2	-178.7	0	114.2	Q404 R405 R406 E411 A412 P456 F459	Q404-K408 PolarHBondContact O-N 2.77Å; Q404-K408 VanDerWaalsContact O-N 3.12Å; R405-K408 PolarHBondContact O-N 3.37Å; R406-K408 VanDerWaalsContact C-N 3.25Å; R406-K408 PolarHBondContact O-N 2.83Å; K408-E411 WeakPolarHBondContact CD-OE2 3.25Å; K408-E411 WeakPolarHBondContact CE-OE2 3.37Å; K408-E411 IonicContact NZ-OE2 2.64Å; K408-E411 PolarHBondContact NZ-OE2 2.86Å; K408-A412 WeakPolarHBondContact O-CB 3.44Å; K408-A412 PolarHBondContact O-N 3.24Å; K408-P456 HydrophobicContact CB-CG 4.42Å; K408-P456 HydrophobicContact CG-CB 4.41Å; K408-F459 HydrophobicContact CB-CE2 4.3Å; K408-F459 HydrophobicContact CB-CZ 4.03Å; K408-F459 HydrophobicContact CG-CE2 3.97Å; K408-F459 HydrophobicContact CG-CZ 4.1Å
409	Y	93.8	Very high	90	Very high	22 Å²	22	53.9 Å²	53.9	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-77	-26.4	172.5	-75.2	-65.5	0	0	0	113.8	R405 R406 V407 S413 H428 I431 Y435 P454 P456	R405-Y409 WeakPolarHBondContact O-CD2 3.44Å; R405-Y409 PolarHBondContact O-N 2.95Å; R406-Y409 PolarHBondContact O-N 2.94Å; V407-Y409 VanDerWaalsContact C-N 3.32Å; V407-Y409 PolarHBondContact O-N 3.46Å; Y409-S413 VanDerWaalsContact O-CB 3.27Å; Y409-S413 WeakPolarHBondContact O-CB 3.31Å; Y409-S413 PolarHBondContact O-N 2.78Å; Y409-H428 AromaticContact CD1-ND1 3.69Å; Y409-H428 AromaticContact CE1-ND1 3.97Å; Y409-I431 HydrophobicContact CD1-CB 4.23Å; Y409-I431 HydrophobicContact CD1-CD1 4.42Å; Y409-I431 HydrophobicContact CD1-CG2 3.9Å; Y409-I431 HydrophobicContact CD2-CG2 3.52Å; Y409-I431 HydrophobicContact CE1-CD1 4.19Å; Y409-I431 HydrophobicContact CE1-CG2 3.98Å; Y409-I431 HydrophobicContact CE2-CG2 3.59Å; Y409-I431 HydrophobicContact CG-CB 4.2Å; Y409-I431 HydrophobicContact CG-CG2 3.68Å; Y409-Y435 HydrophobicContact CD2-CD2 4.04Å; Y409-Y435 AromaticContact CD2-CE2 3.9Å; Y409-Y435 HydrophobicContact CD2-CE2 3.9Å; Y409-Y435 HydrophobicContact CE2-CD2 4.31Å; Y409-Y435 AromaticContact CE2-CE2 3.71Å; Y409-Y435 HydrophobicContact CE2-CE2 3.71Å; Y409-P454 WeakPolarHBondContact CE2-O 3.08Å; Y409-P454 PolarHBondContact OH-O 2.78Å; Y409-P456 HydrophobicContact CD2-CG 4.3Å; Y409-P456 HydrophobicContact CE2-CG 3.61Å
410	V	94.3	Very high	90.3	Very high	51 Å²	51	55.2 Å²	55.2	31%	0.309	31%	0.309	S	S	.	.	H	α-helix	trans	-68.4	-43.2	169.5	176.2	0	0	0	0	110.7	R406 V407 S413 N414 A432	R406-V410 WeakPolarHBondContact O-CG2 3.33Å; R406-V410 PolarHBondContact O-N 3.42Å; R406-V410 VanDerWaalsContact O-N 3.09Å; V407-V410 WeakPolarHBondContact O-CB 3.44Å; V407-V410 PolarHBondContact O-N 2.63Å; V410-S413 WeakPolarHBondContact O-CB 3.45Å; V410-S413 PolarHBondContact O-N 2.98Å; V410-N414 PolarHBondContact O-N 2.82Å; V410-A432 HydrophobicContact CG2-CB 3.77Å
411	E	93.4	Very high	90.6	Very high	93 Å²	93	54.8 Å²	54.8	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-57.1	-51.8	171.4	-71.7	173.8	-159	0	0	111.3	V407 K408 S413 N414 Q415	V407-E411 HydrophobicContact CG1-CG 4.48Å; V407-E411 PolarHBondContact O-N 2.76Å; K408-E411 WeakPolarHBondContact CD-OE2 3.25Å; K408-E411 WeakPolarHBondContact CE-OE2 3.37Å; K408-E411 IonicContact NZ-OE2 2.64Å; K408-E411 PolarHBondContact NZ-OE2 2.86Å; E411-S413 VanDerWaalsContact C-N 3.29Å; E411-S413 PolarHBondContact O-N 3.38Å; E411-N414 PolarHBondContact O-N 2.78Å; E411-N414 VanDerWaalsContact O-N 3.14Å; E411-Q415 WeakPolarHBondContact O-CB 3.46Å; E411-Q415 PolarHBondContact O-N 2.86Å
412	A	92.1	Very high	91	Very high	23 Å²	23	59.3 Å²	59.3	19%	0.19	33%	0.333	C	S	.	.	H	α-helix	trans	-62.4	-34.1	179.4	0	0	0	0	0	112.9	K408 A416 H428	K408-A412 WeakPolarHBondContact O-CB 3.44Å; K408-A412 PolarHBondContact O-N 3.24Å; A412-A416 VanDerWaalsContact O-CB 3.28Å; A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 2.67Å; A412-H428 HydrophobicContact CB-CB 4.33Å
413	S	92.7	Very high	91.3	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.007	37%	0.372	C	S	.	.	H	α-helix	trans	-64.1	-46.8	172.1	177.3	0	0	0	0	111.5	Y409 V410 E411 A416 K417 A425	Y409-S413 VanDerWaalsContact O-CB 3.27Å; Y409-S413 WeakPolarHBondContact O-CB 3.31Å; Y409-S413 PolarHBondContact O-N 2.78Å; V410-S413 WeakPolarHBondContact O-CB 3.45Å; V410-S413 PolarHBondContact O-N 2.98Å; E411-S413 VanDerWaalsContact C-N 3.29Å; E411-S413 PolarHBondContact O-N 3.38Å; S413-A416 PolarHBondContact O-N 3.48Å; S413-K417 WeakPolarHBondContact O-CG 3.41Å; S413-K417 PolarHBondContact O-N 3.49Å; S413-K417 VanDerWaalsContact OG-CE 3.25Å; S413-K417 WeakPolarHBondContact OG-CE 3.32Å; S413-K417 PolarHBondContact OG-NZ 3.07Å; S413-A425 PolarHBondContact OG-O 3Å
414	N	93.6	Very high	91.6	Very high	82 Å²	82	71.5 Å²	71.5	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-71.5	-36.4	-179.5	-68.1	-13.7	0	0	0	112.5	V410 E411 K417 A418	V410-N414 PolarHBondContact O-N 2.82Å; E411-N414 PolarHBondContact O-N 2.78Å; E411-N414 VanDerWaalsContact O-N 3.14Å; N414-K417 PolarHBondContact O-N 2.85Å; N414-K417 PolarHBondContact OD1-NZ 3.37Å; N414-A418 WeakPolarHBondContact O-CB 3.3Å; N414-A418 PolarHBondContact O-N 3.02Å
415	Q	93.7	Very high	92	Very high	146 Å²	146	69.8 Å²	69.8	68%	0.682	37%	0.371	S	S	*	.	H	α-helix	trans	-62.8	-41.9	172.1	-169.9	179.2	27.7	0	0	111.4	E411 A418 S419	E411-Q415 WeakPolarHBondContact O-CB 3.46Å; E411-Q415 PolarHBondContact O-N 2.86Å; Q415-A418 PolarHBondContact O-N 3.21Å; Q415-S419 PolarHBondContact O-N 3.08Å; Q415-S419 PolarHBondContact O-OG 3.34Å
416	A	94.5	Very high	92.3	Very high	4 Å²	4	77 Å²	77	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-65.7	-36.7	176	0	0	0	0	0	112.8	A412 S413 S419 G420 D421 K424 A425	A412-A416 VanDerWaalsContact O-CB 3.28Å; A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 2.67Å; S413-A416 PolarHBondContact O-N 3.48Å; A416-S419 CarbonylContact O-C 3.57Å; A416-S419 PolarHBondContact O-N 2.99Å; A416-S419 PolarHBondContact O-OG 2.98Å; A416-G420 PolarHBondContact O-N 3.33Å; A416-D421 PolarHBondContact O-N 2.94Å; A416-K424 HydrophobicContact CB-CB 4.1Å; A416-K424 HydrophobicContact CB-CD 4.37Å; A416-K424 HydrophobicContact CB-CG 4.06Å; A416-A425 HydrophobicContact CB-CB 4Å
417	K	93.9	Very high	92.3	Very high	94 Å²	94	78.7 Å²	78.7	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-47.7	171.2	-65.2	164.6	-158	160.5	0	111	S413 N414 S419 G420 A425	S413-K417 WeakPolarHBondContact O-CG 3.41Å; S413-K417 PolarHBondContact O-N 3.49Å; S413-K417 VanDerWaalsContact OG-CE 3.25Å; S413-K417 WeakPolarHBondContact OG-CE 3.32Å; S413-K417 PolarHBondContact OG-NZ 3.07Å; N414-K417 PolarHBondContact O-N 2.85Å; N414-K417 PolarHBondContact OD1-NZ 3.37Å; K417-S419 PolarHBondContact O-N 3.26Å; K417-G420 PolarHBondContact O-N 3.15Å; K417-A425 HydrophobicContact CG-CB 3.57Å
418	A	91.9	Very high	92.5	Very high	93 Å²	93	76.9 Å²	76.9	77%	0.769	40%	0.397	S	S	*	.	H	α-helix	trans	-63.9	-24.7	178.4	0	0	0	0	0	113.2	N414 Q415	N414-A418 WeakPolarHBondContact O-CB 3.3Å; N414-A418 PolarHBondContact O-N 3.02Å; Q415-A418 PolarHBondContact O-N 3.21Å
419	S	89.9	Confident	92.6	Very high	84 Å²	84	74.9 Å²	74.9	59%	0.587	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	11.4	172.6	75.9	0	0	0	0	114.4	Q415 A416 K417 D421	Q415-S419 PolarHBondContact O-N 3.08Å; Q415-S419 PolarHBondContact O-OG 3.34Å; A416-S419 CarbonylContact O-C 3.57Å; A416-S419 PolarHBondContact O-N 2.99Å; A416-S419 PolarHBondContact O-OG 2.98Å; K417-S419 PolarHBondContact O-N 3.26Å; S419-D421 PolarHBondContact O-N 2.91Å
420	G	87.1	Confident	92.7	Very high	64 Å²	64	82.2 Å²	82.2	66%	0.66	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	5.4	179	0	0	0	0	0	116.2	A416 K417 D422	A416-G420 PolarHBondContact O-N 3.33Å; K417-G420 PolarHBondContact O-N 3.15Å; G420-D422 VanDerWaalsContact C-N 3.34Å; G420-D422 PolarHBondContact O-N 3.3Å; G420-D422 VanDerWaalsContact O-N 3.1Å
421	D	90.5	Very high	92.6	Very high	63 Å²	63	80.8 Å²	80.8	34%	0.337	41%	0.409	S	S	.	.			trans	-88.8	75	178.2	-171.2	-13	0	0	0	110.8	A416 S419 R423 K424 A425	A416-D421 PolarHBondContact O-N 2.94Å; S419-D421 PolarHBondContact O-N 2.91Å; D421-R423 PolarHBondContact O-N 3.11Å; D421-R423 VanDerWaalsContact O-N 3.12Å; D421-R423 PolarHBondContact OD1-N 2.93Å; D421-K424 HydrophobicContact CB-CB 4.07Å; D421-K424 PolarHBondContact O-N 2.6Å; D421-K424 WeakPolarHBondContact OD1-CB 3.24Å; D421-K424 PolarHBondContact OD1-N 3.3Å; D421-K424 WeakPolarHBondContact OD2-CB 3.43Å; D421-K424 WeakPolarHBondContact OD2-CD 3.49Å; D421-A425 WeakPolarHBondContact O-CB 3.37Å; D421-A425 PolarHBondContact O-N 3.27Å
422	D	88.4	Confident	92.6	Very high	99 Å²	99	76.7 Å²	76.7	53%	0.529	39%	0.391	S	S	.	.	H	α-helix	trans	-57	-22.4	175.9	-105	-25	0	0	0	114	G420 R426	G420-D422 VanDerWaalsContact C-N 3.34Å; G420-D422 PolarHBondContact O-N 3.3Å; G420-D422 VanDerWaalsContact O-N 3.1Å; D422-R426 WeakPolarHBondContact O-CB 3.12Å; D422-R426 VanDerWaalsContact O-CG 3.31Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 2.94Å; D422-R426 PolarHBondContact O-NE 3.12Å
423	R	92.2	Very high	92.7	Very high	215 Å²	215	81.1 Å²	81.1	81%	0.811	41%	0.406	S	S	*	.	H	α-helix	trans	-78.5	-47.9	179.1	-174	178.4	179.2	-175	-1.9	110	D421 R426 M427	D421-R423 PolarHBondContact O-N 3.11Å; D421-R423 VanDerWaalsContact O-N 3.12Å; D421-R423 PolarHBondContact OD1-N 2.93Å; R423-R426 PolarHBondContact O-N 3.06Å; R423-M427 PolarHBondContact O-N 3.14Å
424	K	92.8	Very high	92.6	Very high	99 Å²	99	84.7 Å²	84.7	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-69.2	-35.1	176	-174	176.6	-178.1	-178.6	0	112.2	A416 D421 M427 H428	A416-K424 HydrophobicContact CB-CB 4.1Å; A416-K424 HydrophobicContact CB-CD 4.37Å; A416-K424 HydrophobicContact CB-CG 4.06Å; D421-K424 HydrophobicContact CB-CB 4.07Å; D421-K424 PolarHBondContact O-N 2.6Å; D421-K424 WeakPolarHBondContact OD1-CB 3.24Å; D421-K424 PolarHBondContact OD1-N 3.3Å; D421-K424 WeakPolarHBondContact OD2-CB 3.43Å; D421-K424 WeakPolarHBondContact OD2-CD 3.49Å; K424-M427 HydrophobicContact CG-CE 4.31Å; K424-M427 WeakPolarHBondContact O-CB 3.34Å; K424-M427 PolarHBondContact O-N 3.44Å; K424-H428 WeakPolarHBondContact CE-NE2 3.39Å; K424-H428 WeakPolarHBondContact CG-NE2 3.31Å; K424-H428 PolarHBondContact O-CD2 3.05Å; K424-H428 VanDerWaalsContact O-CD2 3.3Å; K424-H428 PolarHBondContact O-N 3.35Å
425	A	93.9	Very high	92.5	Very high	2 Å²	2	80.8 Å²	80.8	2%	0.017	40%	0.402	C	S	.	.	H	α-helix	trans	-55.6	-54.6	169.2	0	0	0	0	0	111.5	S413 A416 K417 D421 M427 H428 D429	S413-A425 PolarHBondContact OG-O 3Å; A416-A425 HydrophobicContact CB-CB 4Å; K417-A425 HydrophobicContact CG-CB 3.57Å; D421-A425 WeakPolarHBondContact O-CB 3.37Å; D421-A425 PolarHBondContact O-N 3.27Å; A425-M427 PolarHBondContact O-N 3.38Å; A425-H428 PolarHBondContact O-N 2.57Å; A425-D429 WeakPolarHBondContact O-CB 3.17Å; A425-D429 PolarHBondContact O-N 3.46Å
426	R	93.8	Very high	92.4	Very high	165 Å²	165	78.4 Å²	78.4	62%	0.623	39%	0.391	S	S	*	.	H	α-helix	trans	-63.9	-26.9	178.2	-75.2	178.8	-81.3	-162.5	-4	113.3	D422 R423 R430	D422-R426 WeakPolarHBondContact O-CB 3.12Å; D422-R426 VanDerWaalsContact O-CG 3.31Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 2.94Å; D422-R426 PolarHBondContact O-NE 3.12Å; R423-R426 PolarHBondContact O-N 3.06Å; R426-R430 PolarHBondContact O-N 2.97Å
427	M	93.6	Very high	92.1	Very high	95 Å²	95	81.5 Å²	81.5	47%	0.468	41%	0.412	S	S	.	.	H	α-helix	trans	-70.8	-54.5	172.1	-175.3	-176.5	75.8	0	0	111.9	R423 K424 A425 D429 R430 I431	R423-M427 PolarHBondContact O-N 3.14Å; K424-M427 HydrophobicContact CG-CE 4.31Å; K424-M427 WeakPolarHBondContact O-CB 3.34Å; K424-M427 PolarHBondContact O-N 3.44Å; A425-M427 PolarHBondContact O-N 3.38Å; M427-D429 VanDerWaalsContact C-N 3.3Å; M427-D429 PolarHBondContact O-N 2.91Å; M427-R430 WeakPolarHBondContact O-CB 3.48Å; M427-R430 PolarHBondContact O-N 3.24Å; M427-R430 VanDerWaalsContact O-N 3.16Å; M427-I431 HydrophobicContact CG-CD1 4.29Å; M427-I431 WeakPolarHBondContact O-CG1 3.37Å; M427-I431 PolarHBondContact O-N 2.92Å; M427-I431 VanDerWaalsContact O-N 3.13Å
428	H	94.9	Very high	91.8	Very high	25 Å²	25	77.4 Å²	77.4	12%	0.116	40%	0.396	C	S	.	.	H	α-helix	trans	-65.4	-33.2	179.9	-66.8	-46.7	0	0	0	112.5	Y409 A412 K424 A425 R430 I431 A432	Y409-H428 AromaticContact CD1-ND1 3.69Å; Y409-H428 AromaticContact CE1-ND1 3.97Å; A412-H428 HydrophobicContact CB-CB 4.33Å; K424-H428 WeakPolarHBondContact CE-NE2 3.39Å; K424-H428 WeakPolarHBondContact CG-NE2 3.31Å; K424-H428 PolarHBondContact O-CD2 3.05Å; K424-H428 VanDerWaalsContact O-CD2 3.3Å; K424-H428 PolarHBondContact O-N 3.35Å; A425-H428 PolarHBondContact O-N 2.57Å; H428-R430 VanDerWaalsContact C-N 3.33Å; H428-R430 PolarHBondContact O-N 3.26Å; H428-I431 PolarHBondContact O-N 3.48Å; H428-A432 WeakPolarHBondContact O-CB 3.41Å; H428-A432 PolarHBondContact O-N 3.43Å
429	D	94.6	Very high	91.7	Very high	53 Å²	53	73.5 Å²	73.5	28%	0.283	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-36.5	173	-166	81.2	0	0	0	112.7	A425 M427 K433	A425-D429 WeakPolarHBondContact O-CB 3.17Å; A425-D429 PolarHBondContact O-N 3.46Å; M427-D429 VanDerWaalsContact C-N 3.3Å; M427-D429 PolarHBondContact O-N 2.91Å; D429-K433 WeakPolarHBondContact O-CD 3.27Å; D429-K433 WeakPolarHBondContact O-CG 3.33Å; D429-K433 PolarHBondContact O-N 3.08Å; D429-K433 WeakPolarHBondContact OD2-CE 3.29Å; D429-K433 IonicContact OD2-NZ 3.51Å; D429-K433 PolarHBondContact OD2-NZ 3.21Å
430	R	94.6	Very high	91.6	Very high	176 Å²	176	77.9 Å²	77.9	66%	0.664	37%	0.366	S	S	*	.	H	α-helix	trans	-66.8	-44.9	172.6	-172.5	-173	-61.1	170.6	-1	111.6	R426 M427 H428 K433 Q434	R426-R430 PolarHBondContact O-N 2.97Å; M427-R430 WeakPolarHBondContact O-CB 3.48Å; M427-R430 PolarHBondContact O-N 3.24Å; M427-R430 VanDerWaalsContact O-N 3.16Å; H428-R430 VanDerWaalsContact C-N 3.33Å; H428-R430 PolarHBondContact O-N 3.26Å; R430-K433 WeakPolarHBondContact O-CA 3.46Å; R430-K433 WeakPolarHBondContact O-CB 3.35Å; R430-K433 PolarHBondContact O-N 2.95Å; R430-K433 VanDerWaalsContact O-N 3.1Å; R430-Q434 PolarHBondContact O-N 3.36Å
431	I	92.6	Very high	91.6	Very high	21 Å²	21	76.2 Å²	76.2	11%	0.108	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-42.4	179.1	-60.8	165.7	0	0	0	110.4	Y409 M427 H428 K433 Q434 Y435 P454	Y409-I431 HydrophobicContact CD1-CB 4.23Å; Y409-I431 HydrophobicContact CD1-CD1 4.42Å; Y409-I431 HydrophobicContact CD1-CG2 3.9Å; Y409-I431 HydrophobicContact CD2-CG2 3.52Å; Y409-I431 HydrophobicContact CE1-CD1 4.19Å; Y409-I431 HydrophobicContact CE1-CG2 3.98Å; Y409-I431 HydrophobicContact CE2-CG2 3.59Å; Y409-I431 HydrophobicContact CG-CB 4.2Å; Y409-I431 HydrophobicContact CG-CG2 3.68Å; M427-I431 HydrophobicContact CG-CD1 4.29Å; M427-I431 WeakPolarHBondContact O-CG1 3.37Å; M427-I431 PolarHBondContact O-N 2.92Å; M427-I431 VanDerWaalsContact O-N 3.13Å; H428-I431 PolarHBondContact O-N 3.48Å; I431-K433 PolarHBondContact O-N 3.47Å; I431-Q434 WeakPolarHBondContact O-CB 3.34Å; I431-Q434 PolarHBondContact O-N 3.24Å; I431-Q434 VanDerWaalsContact O-N 3.12Å; I431-Y435 HydrophobicContact CG2-CD2 4.01Å; I431-Y435 HydrophobicContact CG2-CE2 4.08Å; I431-Y435 WeakPolarHBondContact O-CD2 3.22Å; I431-Y435 PolarHBondContact O-N 3.37Å; I431-P454 HydrophobicContact CG2-CB 4.33Å; I431-P454 HydrophobicContact CG2-CG 4.18Å
432	A	93.4	Very high	91.3	Very high	7 Å²	7	75.9 Å²	75.9	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-34.1	173.4	0	0	0	0	0	112.7	V410 H428 Q436	V410-A432 HydrophobicContact CG2-CB 3.77Å; H428-A432 WeakPolarHBondContact O-CB 3.41Å; H428-A432 PolarHBondContact O-N 3.43Å; A432-Q436 WeakPolarHBondContact O-CB 3.42Å; A432-Q436 PolarHBondContact O-N 2.84Å
433	K	93.5	Very high	91.2	Very high	116 Å²	116	76.9 Å²	76.9	50%	0.504	34%	0.342	S	S	.	.	H	α-helix	trans	-73.2	-36.7	174	-75	163.4	178.2	163.5	0	112.8	D429 R430 I431 Q436 S437	D429-K433 WeakPolarHBondContact O-CD 3.27Å; D429-K433 WeakPolarHBondContact O-CG 3.33Å; D429-K433 PolarHBondContact O-N 3.08Å; D429-K433 WeakPolarHBondContact OD2-CE 3.29Å; D429-K433 IonicContact OD2-NZ 3.51Å; D429-K433 PolarHBondContact OD2-NZ 3.21Å; R430-K433 WeakPolarHBondContact O-CA 3.46Å; R430-K433 WeakPolarHBondContact O-CB 3.35Å; R430-K433 PolarHBondContact O-N 2.95Å; R430-K433 VanDerWaalsContact O-N 3.1Å; I431-K433 PolarHBondContact O-N 3.47Å; K433-Q436 WeakPolarHBondContact O-CB 3.22Å; K433-Q436 PolarHBondContact O-N 3.49Å; K433-Q436 VanDerWaalsContact O-N 3.14Å; K433-S437 PolarHBondContact O-N 3.13Å; K433-S437 PolarHBondContact O-OG 3.05Å
434	Q	91.4	Very high	90.8	Very high	76 Å²	76	69.9 Å²	69.9	36%	0.355	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-46.7	171.8	-70	170	-82.4	0	0	111.1	R430 I431 Q436 S437 A438 L453	R430-Q434 PolarHBondContact O-N 3.36Å; I431-Q434 WeakPolarHBondContact O-CB 3.34Å; I431-Q434 PolarHBondContact O-N 3.24Å; I431-Q434 VanDerWaalsContact O-N 3.12Å; Q434-Q436 VanDerWaalsContact C-N 3.32Å; Q434-Q436 PolarHBondContact O-N 3.09Å; Q434-S437 WeakPolarHBondContact CA-OG 3.41Å; Q434-S437 PolarHBondContact O-N 3.23Å; Q434-S437 PolarHBondContact O-OG 2.85Å; Q434-A438 PolarHBondContact O-N 3.01Å; Q434-L453 HydrophobicContact CB-CD2 4.41Å
435	Y	91.3	Very high	90	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.2	-38.2	170.9	-88	-85.1	0	0	0	112.9	L402 R405 Y409 I431 S437 A438 I439 L453 P454	L402-Y435 HydrophobicContact CD2-CD1 3.92Å; L402-Y435 HydrophobicContact CD2-CE1 3.85Å; R405-Y435 HydrophobicContact CB-CD1 4.02Å; R405-Y435 HydrophobicContact CB-CE1 3.49Å; R405-Y435 VanDerWaalsContact CB-CE1 3.49Å; R405-Y435 WeakPolarHBondContact CD-OH 3.34Å; R405-Y435 HydrophobicContact CG-CE1 4.29Å; Y409-Y435 HydrophobicContact CD2-CD2 4.04Å; Y409-Y435 AromaticContact CD2-CE2 3.9Å; Y409-Y435 HydrophobicContact CD2-CE2 3.9Å; Y409-Y435 HydrophobicContact CE2-CD2 4.31Å; Y409-Y435 AromaticContact CE2-CE2 3.71Å; Y409-Y435 HydrophobicContact CE2-CE2 3.71Å; I431-Y435 HydrophobicContact CG2-CD2 4.01Å; I431-Y435 HydrophobicContact CG2-CE2 4.08Å; I431-Y435 WeakPolarHBondContact O-CD2 3.22Å; I431-Y435 PolarHBondContact O-N 3.37Å; Y435-S437 PolarHBondContact O-N 3.18Å; Y435-A438 PolarHBondContact O-N 3.46Å; Y435-I439 WeakPolarHBondContact O-CB 3.41Å; Y435-I439 WeakPolarHBondContact O-CD1 3.47Å; Y435-I439 VanDerWaalsContact O-CG1 3.25Å; Y435-I439 WeakPolarHBondContact O-CG1 3.39Å; Y435-I439 PolarHBondContact O-N 2.82Å; Y435-L453 HydrophobicContact CD1-CD1 4.48Å; Y435-L453 HydrophobicContact CD2-CD2 4.44Å; Y435-L453 HydrophobicContact CE1-CB 4.28Å; Y435-L453 HydrophobicContact CE1-CD1 4.21Å; Y435-L453 HydrophobicContact CE2-CB 4.25Å; Y435-L453 HydrophobicContact CE2-CD2 4.48Å; Y435-P454 VanDerWaalsContact CE2-O 3.25Å; Y435-P454 WeakPolarHBondContact CE2-O 3.42Å; Y435-P454 PolarHBondContact OH-O 3.15Å
436	Q	92.1	Very high	89.3	Confident	95 Å²	95	75.4 Å²	75.4	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-35.9	175.9	-163.7	-179.1	29.2	0	0	112.7	A432 K433 Q434 R440	A432-Q436 WeakPolarHBondContact O-CB 3.42Å; A432-Q436 PolarHBondContact O-N 2.84Å; K433-Q436 WeakPolarHBondContact O-CB 3.22Å; K433-Q436 PolarHBondContact O-N 3.49Å; K433-Q436 VanDerWaalsContact O-N 3.14Å; Q434-Q436 VanDerWaalsContact C-N 3.32Å; Q434-Q436 PolarHBondContact O-N 3.09Å; Q436-R440 WeakPolarHBondContact O-CB 3.48Å; Q436-R440 PolarHBondContact O-N 2.95Å; Q436-R440 VanDerWaalsContact O-N 3.14Å
437	S	88.7	Confident	88.1	Confident	69 Å²	69	73.7 Å²	73.7	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-69	-40.7	171.5	37.6	0	0	0	0	112.6	K433 Q434 Y435 R440 A441	K433-S437 PolarHBondContact O-N 3.13Å; K433-S437 PolarHBondContact O-OG 3.05Å; Q434-S437 WeakPolarHBondContact CA-OG 3.41Å; Q434-S437 PolarHBondContact O-N 3.23Å; Q434-S437 PolarHBondContact O-OG 2.85Å; Y435-S437 PolarHBondContact O-N 3.18Å; S437-R440 PolarHBondContact O-N 3.02Å; S437-A441 WeakPolarHBondContact O-CB 3.23Å; S437-A441 PolarHBondContact O-N 3.08Å
438	A	86.8	Confident	87.4	Confident	9 Å²	9	70.2 Å²	70.2	7%	0.074	37%	0.369	C	S	.	.	H	α-helix	trans	-60.1	-48.1	175.5	0	0	0	0	0	111.8	L402 Q434 Y435 R440 A441 H442 V448 L453	L402-A438 HydrophobicContact CD1-CB 4.37Å; Q434-A438 PolarHBondContact O-N 3.01Å; Y435-A438 PolarHBondContact O-N 3.46Å; A438-R440 VanDerWaalsContact C-N 3.28Å; A438-R440 PolarHBondContact O-N 2.94Å; A438-A441 PolarHBondContact O-N 2.85Å; A438-H442 WeakPolarHBondContact O-CB 3.35Å; A438-H442 PolarHBondContact O-N 2.92Å; A438-V448 HydrophobicContact CB-CG1 3.82Å; A438-L453 HydrophobicContact CB-CD1 3.74Å; A438-L453 HydrophobicContact CB-CD2 4.16Å
439	I	88.8	Confident	86.5	Confident	10 Å²	10	73.4 Å²	73.4	5%	0.051	39%	0.387	C	S	.	.	H	α-helix	trans	-58.1	-40.1	174.8	-68.6	164	0	0	0	111.3	L402 E403 R406 Y435 K443	L402-I439 HydrophobicContact CB-CD1 4.08Å; L402-I439 HydrophobicContact CB-CG1 3.51Å; L402-I439 HydrophobicContact CD1-CG1 4.05Å; L402-I439 HydrophobicContact CG-CG1 4.43Å; E403-I439 HydrophobicContact CB-CD1 4.36Å; R406-I439 HydrophobicContact CB-CD1 4.04Å; R406-I439 HydrophobicContact CG-CD1 4.49Å; Y435-I439 WeakPolarHBondContact O-CB 3.41Å; Y435-I439 WeakPolarHBondContact O-CD1 3.47Å; Y435-I439 VanDerWaalsContact O-CG1 3.25Å; Y435-I439 WeakPolarHBondContact O-CG1 3.39Å; Y435-I439 PolarHBondContact O-N 2.82Å; I439-K443 HydrophobicContact CG2-CD 3.75Å; I439-K443 HydrophobicContact CG2-CG 4.44Å; I439-K443 VanDerWaalsContact CG2-NZ 3.3Å; I439-K443 VanDerWaalsContact O-CB 3.28Å; I439-K443 WeakPolarHBondContact O-CB 3.38Å; I439-K443 VanDerWaalsContact O-CG 3.26Å; I439-K443 WeakPolarHBondContact O-CG 3.33Å; I439-K443 PolarHBondContact O-N 2.85Å
440	R	89.3	Confident	85.6	Confident	176 Å²	176	73 Å²	73	66%	0.664	38%	0.382	S	S	*	.	H	α-helix	trans	-68.7	-40.2	177.8	-172.2	-176.4	-63.7	171.6	0.5	112.2	Q436 S437 A438 A444	Q436-R440 WeakPolarHBondContact O-CB 3.48Å; Q436-R440 PolarHBondContact O-N 2.95Å; Q436-R440 VanDerWaalsContact O-N 3.14Å; S437-R440 PolarHBondContact O-N 3.02Å; A438-R440 VanDerWaalsContact C-N 3.28Å; A438-R440 PolarHBondContact O-N 2.94Å; R440-A444 VanDerWaalsContact O-CB 3.28Å; R440-A444 WeakPolarHBondContact O-CB 3.41Å; R440-A444 PolarHBondContact O-N 2.89Å; R440-A444 VanDerWaalsContact O-N 3.09Å
441	A	85.8	Confident	84.6	Confident	29 Å²	29	70.6 Å²	70.6	24%	0.24	38%	0.383	C	S	.	.	H	α-helix	trans	-66.9	-44.1	177.7	0	0	0	0	0	111.6	S437 A438 A444 G445 K446 V448	S437-A441 WeakPolarHBondContact O-CB 3.23Å; S437-A441 PolarHBondContact O-N 3.08Å; A438-A441 PolarHBondContact O-N 2.85Å; A441-A444 CarbonylContact O-C 3.59Å; A441-A444 WeakPolarHBondContact O-CA 3.5Å; A441-A444 PolarHBondContact O-N 2.82Å; A441-A444 VanDerWaalsContact O-N 3.07Å; A441-G445 PolarHBondContact O-N 2.93Å; A441-K446 HydrophobicContact CB-CB 4.41Å; A441-K446 PolarHBondContact O-N 3.26Å; A441-V448 HydrophobicContact CB-CG2 3.64Å
442	H	84.9	Confident	83.9	Confident	56 Å²	56	76.9 Å²	76.9	26%	0.259	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-45.3	175.3	-165.7	-80	0	0	0	112	V398 L399 A438 A444 G445 V448	V398-H442 VanDerWaalsContact CG1-NE2 3.34Å; V398-H442 WeakPolarHBondContact CG1-NE2 3.33Å; L399-H442 HydrophobicContact CD2-CB 3.75Å; L399-H442 WeakPolarHBondContact CD2-ND1 3.37Å; L399-H442 WeakPolarHBondContact CG-ND1 3.48Å; A438-H442 WeakPolarHBondContact O-CB 3.35Å; A438-H442 PolarHBondContact O-N 2.92Å; H442-A444 PolarHBondContact O-N 3.18Å; H442-A444 VanDerWaalsContact O-N 3.14Å; H442-G445 PolarHBondContact O-N 2.9Å; H442-V448 HydrophobicContact CB-CG2 4.01Å
443	K	86	Confident	83.4	Confident	120 Å²	120	77.2 Å²	77.2	52%	0.522	41%	0.412	S	S	.	.	H	α-helix	trans	-64	-13.9	173.1	-71.3	174.4	-177	165.2	0	113.1	L399 E403 I439	L399-K443 HydrophobicContact CD1-CD 4.48Å; L399-K443 HydrophobicContact CD1-CG 3.77Å; L399-K443 HydrophobicContact CD2-CD 4.41Å; L399-K443 HydrophobicContact CD2-CG 3.69Å; L399-K443 HydrophobicContact CG-CG 4.4Å; E403-K443 IonicContact OE2-NZ 3.24Å; E403-K443 PolarHBondContact OE2-NZ 2.8Å; I439-K443 HydrophobicContact CG2-CD 3.75Å; I439-K443 HydrophobicContact CG2-CG 4.44Å; I439-K443 VanDerWaalsContact CG2-NZ 3.3Å; I439-K443 VanDerWaalsContact O-CB 3.28Å; I439-K443 WeakPolarHBondContact O-CB 3.38Å; I439-K443 VanDerWaalsContact O-CG 3.26Å; I439-K443 WeakPolarHBondContact O-CG 3.33Å; I439-K443 PolarHBondContact O-N 2.85Å
444	A	84.9	Confident	83	Confident	69 Å²	69	74.1 Å²	74.1	57%	0.57	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	10.1	173.5	0	0	0	0	0	113.7	R440 A441 H442 K446	R440-A444 VanDerWaalsContact O-CB 3.28Å; R440-A444 WeakPolarHBondContact O-CB 3.41Å; R440-A444 PolarHBondContact O-N 2.89Å; R440-A444 VanDerWaalsContact O-N 3.09Å; A441-A444 CarbonylContact O-C 3.59Å; A441-A444 WeakPolarHBondContact O-CA 3.5Å; A441-A444 PolarHBondContact O-N 2.82Å; A441-A444 VanDerWaalsContact O-N 3.07Å; H442-A444 PolarHBondContact O-N 3.18Å; H442-A444 VanDerWaalsContact O-N 3.14Å; A444-K446 PolarHBondContact O-N 2.89Å
445	G	75.1	Confident	82.5	Confident	72 Å²	72	74.1 Å²	74.1	74%	0.742	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	15.2	178.1	0	0	0	0	0	115.1	A441 H442	A441-G445 PolarHBondContact O-N 2.93Å; H442-G445 PolarHBondContact O-N 2.9Å
446	K	79.1	Confident	81.9	Confident	144 Å²	144	74.6 Å²	74.6	63%	0.626	41%	0.412	S	S	*	.			trans	-84.8	146.4	174.4	-66	-164.2	174.5	-167.6	0	110.3	A441 A444 V448	A441-K446 HydrophobicContact CB-CB 4.41Å; A441-K446 PolarHBondContact O-N 3.26Å; A444-K446 PolarHBondContact O-N 2.89Å; K446-V448 PolarHBondContact O-N 2.85Å
447	P	68.3	Low	81	Confident	129 Å²	129	76.5 Å²	76.5	84%	0.838	43%	0.432	S	S	*	.			trans	-58.1	137.5	169.5	26.7	-34.2	0	0	0	109.5
448	V	79.4	Confident	80.1	Confident	23 Å²	23	77 Å²	77	14%	0.139	45%	0.449	C	S	.	.			trans	-117.5	128.4	177.2	176.1	0	0	0	0	106.6	A438 A441 H442 K446 F450	A438-V448 HydrophobicContact CB-CG1 3.82Å; A441-V448 HydrophobicContact CB-CG2 3.64Å; H442-V448 HydrophobicContact CB-CG2 4.01Å; K446-V448 PolarHBondContact O-N 2.85Å; V448-F450 HydrophobicContact CB-CE1 4.24Å; V448-F450 HydrophobicContact CB-CE2 4.38Å; V448-F450 HydrophobicContact CB-CZ 4.07Å; V448-F450 HydrophobicContact CG1-CD1 4.18Å; V448-F450 HydrophobicContact CG1-CE1 4.04Å; V448-F450 HydrophobicContact CG1-CZ 4.37Å; V448-F450 VanDerWaalsContact O-CD2 3.32Å; V448-F450 WeakPolarHBondContact O-CD2 3.5Å; V448-F450 WeakPolarHBondContact O-CE2 3.23Å; V448-F450 PolarHBondContact O-N 3.36Å
449	D	76.3	Confident	79.5	Confident	92 Å²	92	78.6 Å²	78.6	49%	0.492	45%	0.454	S	S	.	.			trans	-74	119.5	165.8	-162.5	-45.8	0	0	0	108	D451 E452	D449-D451 PolarHBondContact OD1-N 3.09Å; D449-E452 PolarHBondContact OD1-N 3.13Å
450	F	75.4	Confident	78.5	Confident	45 Å²	45	80.4 Å²	80.4	20%	0.197	47%	0.467	C	S	.	.	S	Bend	trans	-92.9	-13.5	-179.5	-63.4	-76.3	0	0	0	112.5	V398 L402 V448 L453 I462	V398-F450 HydrophobicContact CG1-CE1 3.66Å; V398-F450 HydrophobicContact CG1-CZ 3.68Å; L402-F450 HydrophobicContact CD1-CE1 4.19Å; L402-F450 HydrophobicContact CD2-CD1 4.32Å; L402-F450 HydrophobicContact CD2-CE1 4.37Å; V448-F450 HydrophobicContact CB-CE1 4.24Å; V448-F450 HydrophobicContact CB-CE2 4.38Å; V448-F450 HydrophobicContact CB-CZ 4.07Å; V448-F450 HydrophobicContact CG1-CD1 4.18Å; V448-F450 HydrophobicContact CG1-CE1 4.04Å; V448-F450 HydrophobicContact CG1-CZ 4.37Å; V448-F450 VanDerWaalsContact O-CD2 3.32Å; V448-F450 WeakPolarHBondContact O-CD2 3.5Å; V448-F450 WeakPolarHBondContact O-CE2 3.23Å; V448-F450 PolarHBondContact O-N 3.36Å; F450-L453 HydrophobicContact CD1-CD1 4.45Å; F450-L453 PolarHBondContact O-N 2.96Å; F450-I462 HydrophobicContact CD1-CD1 3.55Å; F450-I462 HydrophobicContact CE1-CD1 4.06Å; F450-I462 HydrophobicContact CG-CD1 4.26Å
451	D	73.2	Confident	77.4	Confident	125 Å²	125	77.4 Å²	77.4	67%	0.668	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-23.9	-171.6	-57.2	-17.5	0	0	0	110.5	D449 L453 Q465	D449-D451 PolarHBondContact OD1-N 3.09Å; D451-L453 PolarHBondContact O-N 2.86Å; D451-Q465 PolarHBondContact OD1-NE2 3Å
452	E	78.1	Confident	76.6	Confident	152 Å²	152	76.6 Å²	76.6	71%	0.71	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-6.4	166.7	-67.2	-161.6	155.4	0	0	114.6	D449 P454	D449-E452 PolarHBondContact OD1-N 3.13Å; E452-P454 WeakPolarHBondContact O-CD 3.21Å
453	L	83.6	Confident	74.9	Confident	15 Å²	15	76.8 Å²	76.8	8%	0.079	47%	0.468	C	S	.	.	S	Bend	trans	-95.3	111.7	-174.2	-67.9	175.5	0	0	0	112.1	L402 Q434 Y435 A438 F450 D451 V455	L402-L453 HydrophobicContact CD2-CD1 3.7Å; Q434-L453 HydrophobicContact CB-CD2 4.41Å; Y435-L453 HydrophobicContact CD1-CD1 4.48Å; Y435-L453 HydrophobicContact CD2-CD2 4.44Å; Y435-L453 HydrophobicContact CE1-CB 4.28Å; Y435-L453 HydrophobicContact CE1-CD1 4.21Å; Y435-L453 HydrophobicContact CE2-CB 4.25Å; Y435-L453 HydrophobicContact CE2-CD2 4.48Å; A438-L453 HydrophobicContact CB-CD1 3.74Å; A438-L453 HydrophobicContact CB-CD2 4.16Å; F450-L453 HydrophobicContact CD1-CD1 4.45Å; F450-L453 PolarHBondContact O-N 2.96Å; D451-L453 PolarHBondContact O-N 2.86Å; L453-V455 PolarHBondContact O-N 3.14Å
454	P	84.1	Confident	73.4	Confident	51 Å²	51	75 Å²	75	33%	0.331	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-58.8	127.4	-178.3	-24.4	34.6	0	0	0	111.7	Y409 I431 Y435 E452	Y409-P454 WeakPolarHBondContact CE2-O 3.08Å; Y409-P454 PolarHBondContact OH-O 2.78Å; I431-P454 HydrophobicContact CG2-CB 4.33Å; I431-P454 HydrophobicContact CG2-CG 4.18Å; Y435-P454 VanDerWaalsContact CE2-O 3.25Å; Y435-P454 WeakPolarHBondContact CE2-O 3.42Å; Y435-P454 PolarHBondContact OH-O 3.15Å; E452-P454 WeakPolarHBondContact O-CD 3.21Å
455	V	81.4	Confident	71.5	Confident	76 Å²	76	76.1 Å²	76.1	46%	0.461	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-93.7	128.5	-178	-171.2	0	0	0	0	110.1	L453 F459	L453-V455 PolarHBondContact O-N 3.14Å; V455-F459 HydrophobicContact CG1-CB 4.25Å
456	P	78.5	Confident	69.7	Low	10 Å²	10	82.2 Å²	82.2	7%	0.065	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-68.4	142	173	-10.3	23.1	0	0	0	111.1	K408 Y409 G458 F459	K408-P456 HydrophobicContact CB-CG 4.42Å; K408-P456 HydrophobicContact CG-CB 4.41Å; Y409-P456 HydrophobicContact CD2-CG 4.3Å; Y409-P456 HydrophobicContact CE2-CG 3.61Å; P456-G458 PolarHBondContact O-N 3.19Å; P456-F459 HydrophobicContact CB-CD2 3.73Å; P456-F459 HydrophobicContact CB-CE2 4.02Å; P456-F459 HydrophobicContact CG-CD2 4Å; P456-F459 HydrophobicContact CG-CE2 4.26Å; P456-F459 HydrophobicContact CG-CG 4.44Å; P456-F459 PolarHBondContact O-N 3.03Å
457	P	74.4	Confident	68	Low	134 Å²	134	82.2 Å²	82.2	87%	0.87	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	132	174.8	-27.4	35.4	0	0	0	112.5
458	G	69.1	Low	66.5	Low	81 Å²	81	80.8 Å²	80.8	84%	0.835	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	3.6	178.1	0	0	0	0	0	116.4	P456	P456-G458 PolarHBondContact O-N 3.19Å
459	F	74.4	Confident	64.4	Low	41 Å²	41	82 Å²	82	18%	0.18	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-92.1	134.3	173.5	-80.3	-104.3	0	0	0	111.9	P392 Q404 R405 K408 V455 P456	P392-F459 HydrophobicContact CG-CD1 4.28Å; P392-F459 HydrophobicContact CG-CE1 3.9Å; P392-F459 HydrophobicContact CG-CZ 4.28Å; Q404-F459 HydrophobicContact CB-CE1 4.18Å; R405-F459 HydrophobicContact CG-CD1 3.84Å; R405-F459 HydrophobicContact CG-CE1 4.39Å; R405-F459 HydrophobicContact CG-CG 4.28Å; K408-F459 HydrophobicContact CB-CE2 4.3Å; K408-F459 HydrophobicContact CB-CZ 4.03Å; K408-F459 HydrophobicContact CG-CE2 3.97Å; K408-F459 HydrophobicContact CG-CZ 4.1Å; V455-F459 HydrophobicContact CG1-CB 4.25Å; P456-F459 HydrophobicContact CB-CD2 3.73Å; P456-F459 HydrophobicContact CB-CE2 4.02Å; P456-F459 HydrophobicContact CG-CD2 4Å; P456-F459 HydrophobicContact CG-CE2 4.26Å; P456-F459 HydrophobicContact CG-CG 4.44Å; P456-F459 PolarHBondContact O-N 3.03Å
460	P	66.9	Low	63.2	Low	49 Å²	49	85.6 Å²	85.6	32%	0.318	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-68.6	158.9	178.6	29	-35.3	0	0	0	112.5	R405	R405-P460 PolarHBondContact NH2-O 3.08Å
461	P	67.2	Low	61.7	Low	113 Å²	113	91.7 Å²	91.7	73%	0.734	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-62.1	158.7	172.8	27.5	-35.1	0	0	0	112
462	I	68.5	Low	60.2	Low	12 Å²	12	94.4 Å²	94.4	6%	0.062	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-76.4	130.6	-175.6	-62.1	-177	0	0	0	109.7	V398 A401 L402 F450 G464	V398-I462 HydrophobicContact CB-CG2 4.12Å; V398-I462 HydrophobicContact CG1-CG2 3.81Å; V398-I462 HydrophobicContact CG2-CG2 3.86Å; A401-I462 HydrophobicContact CB-CG1 4.08Å; A401-I462 HydrophobicContact CB-CG2 4.47Å; L402-I462 HydrophobicContact CD2-CD1 4.05Å; F450-I462 HydrophobicContact CD1-CD1 3.55Å; F450-I462 HydrophobicContact CE1-CD1 4.06Å; F450-I462 HydrophobicContact CG-CD1 4.26Å; I462-G464 PolarHBondContact O-N 3.24Å
463	P	48.9	Very low	58.4	Low	59 Å²	59	90 Å²	90	38%	0.383	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59	131.6	176.5	-21.1	30.7	0	0	0	112.1	P395 V398	P395-P463 VanDerWaalsContact O-CG 3.29Å; P395-P463 WeakPolarHBondContact O-CG 3.36Å; V398-P463 WeakPolarHBondContact CG2-O 3.43Å
464	G	54.1	Low	56.5	Low	83 Å²	83	92.3 Å²	92.3	86%	0.856	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.6	-18.9	177.7	0	0	0	0	0	114.8	I462 K466	I462-G464 PolarHBondContact O-N 3.24Å; G464-K466 PolarHBondContact O-N 2.69Å
465	Q	45	Very low	54.9	Low	93 Å²	93	94.9 Å²	94.9	44%	0.435	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-78.2	121	173.5	-152.8	152.3	-15.6	0	0	109.3	D451	D451-Q465 PolarHBondContact OD1-NE2 3Å
466	K	37.2	Very low	53.4	Low	200 Å²	200	94.4 Å²	94.4	87%	0.87	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-70.5	135.5	177.5	-79	-174.4	176.5	-179.3	0	109.9	G464 A468	G464-K466 PolarHBondContact O-N 2.69Å; K466-A468 PolarHBondContact O-N 2.89Å
467	V	44.9	Very low	52.3	Low	144 Å²	144	98.5 Å²	98.5	87%	0.873	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-70.5	117.2	170.4	-180	0	0	0	0	109.4
468	A	35.5	Very low	51.2	Low	98 Å²	98	97.8 Å²	97.8	81%	0.81	61%	0.608	S	S	*	*			trans	-122.8	137.1	142.8	0	0	0	0	0	105.9	K466	K466-A468 PolarHBondContact O-N 2.89Å
469	G	36.9	Very low	50.4	Low	49 Å²	49	99 Å²	99	51%	0.505	59%	0.592	S	S	.	*			cis	147.6	55.5	5.2	0	0	0	0	0	110.3	E471	G469-E471 VanDerWaalsContact C-N 3.27Å; G469-E471 PolarHBondContact O-N 3.5Å
470	D	49	Very low	49.6	Very low	167 Å²	167	99.9 Å²	99.9	89%	0.893	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	64.4	-165.8	-57	-73.3	0	0	0	113.9
471	E	44.8	Very low	48.7	Very low	173 Å²	173	100.5 Å²	100.5	81%	0.808	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.2	-13.4	-179	-118.2	160.1	-142.4	0	0	116.9	G469	G469-E471 VanDerWaalsContact C-N 3.27Å; G469-E471 PolarHBondContact O-N 3.5Å
472	Q	41.8	Very low	48	Very low	182 Å²	182	98.9 Å²	98.9	85%	0.85	61%	0.607	S	S	*	*	S	Bend	trans	-106	-18.3	-170.5	-67.8	-172.1	-8.8	0	0	117
473	G	40.4	Very low	47.3	Very low	60 Å²	60	105.6 Å²	105.6	62%	0.619	64%	0.636	S	S	*	*	S	Bend	trans	-79.6	-15.4	-177.6	0	0	0	0	0	115.5	T477	G473-T477 PolarHBondContact O-OG1 3.32Å
474	L	44.1	Very low	47	Very low	63 Å²	63	110.2 Å²	110.2	33%	0.33	66%	0.656	S	S	.	*	H	α-helix	trans	-91.6	-43.6	-163.1	-107.2	161.3	0	0	0	114.3	V271 A272 T477 L478	V271-L474 WeakPolarHBondContact O-CD2 3.02Å; A272-L474 VanDerWaalsContact C-CD2 3.48Å; A272-L474 VanDerWaalsContact O-CD1 3.28Å; A272-L474 WeakPolarHBondContact O-CD1 3.17Å; L474-T477 PolarHBondContact O-N 3.34Å; L474-L478 PolarHBondContact O-N 2.97Å
475	V	49.2	Very low	46.5	Very low	105 Å²	105	110 Å²	110	64%	0.636	65%	0.647	S	S	*	*	H	α-helix	trans	-64.3	-46.8	-175.1	-177.9	0	0	0	0	111.5	T477 L478 E479	V475-T477 VanDerWaalsContact C-N 3.27Å; V475-T477 PolarHBondContact O-N 3.46Å; V475-L478 PolarHBondContact O-N 3.44Å; V475-E479 PolarHBondContact O-N 2.69Å; V475-E479 VanDerWaalsContact O-N 3.11Å
476	A	50.2	Low	46.1	Very low	67 Å²	67	110.4 Å²	110.4	55%	0.554	66%	0.66	S	S	*	*	H	α-helix	trans	-61.3	-34.2	-179.8	0	0	0	0	0	113	A480	A476-A480 PolarHBondContact O-N 2.88Å
477	T	56.6	Low	45.9	Very low	96 Å²	96	107.7 Å²	107.7	59%	0.589	66%	0.66	S	S	*	*	H	α-helix	trans	-74.5	-33.6	-179.4	-49.6	0	0	0	0	111.7	G473 L474 V475 A481	G473-T477 PolarHBondContact O-OG1 3.32Å; L474-T477 PolarHBondContact O-N 3.34Å; V475-T477 VanDerWaalsContact C-N 3.27Å; V475-T477 PolarHBondContact O-N 3.46Å; T477-A481 PolarHBondContact O-N 3.31Å
478	L	50.8	Low	45.3	Very low	119 Å²	119	108 Å²	108	62%	0.623	66%	0.657	S	S	*	*	H	α-helix	trans	-72.5	-38	174.6	-123	88.1	0	0	0	112.6	L474 V475 A480 A481 S482	L474-L478 PolarHBondContact O-N 2.97Å; V475-L478 PolarHBondContact O-N 3.44Å; L478-A480 VanDerWaalsContact C-N 3.34Å; L478-A481 PolarHBondContact O-N 3.37Å; L478-S482 PolarHBondContact O-N 3.35Å; L478-S482 VanDerWaalsContact O-N 3.16Å
479	E	51.1	Low	45.1	Very low	106 Å²	106	110.4 Å²	110.4	50%	0.495	66%	0.661	S	S	.	*	H	α-helix	trans	-69	-31.9	178.9	-156.2	-162.1	143.8	0	0	112.5	V475 S482 K483	V475-E479 PolarHBondContact O-N 2.69Å; V475-E479 VanDerWaalsContact O-N 3.11Å; E479-S482 PolarHBondContact O-OG 2.89Å; E479-K483 IonicContact OE1-NZ 3.95Å; E479-K483 PolarHBondContact OE1-NZ 3.35Å
480	A	58.5	Low	44.8	Very low	59 Å²	59	111.8 Å²	111.8	49%	0.488	67%	0.668	S	S	.	*	H	α-helix	trans	-66.9	-36.1	171.5	0	0	0	0	0	112.4	A476 L478	A476-A480 PolarHBondContact O-N 2.88Å; L478-A480 VanDerWaalsContact C-N 3.34Å
481	A	47.1	Very low	43.8	Very low	63 Å²	63	110.6 Å²	110.6	52%	0.521	66%	0.662	S	S	.	*	H	α-helix	trans	-73.5	-37.8	-178.9	0	0	0	0	0	113.2	T477 L478 K483 L484	T477-A481 PolarHBondContact O-N 3.31Å; L478-A481 PolarHBondContact O-N 3.37Å; A481-K483 VanDerWaalsContact C-N 3.34Å; A481-K483 PolarHBondContact O-N 3.34Å; A481-L484 PolarHBondContact O-N 3.42Å
482	S	53.2	Low	43	Very low	79 Å²	79	110.3 Å²	110.3	55%	0.552	66%	0.66	S	S	*	*	H	α-helix	trans	-69.6	-29.8	-179.6	63.5	0	0	0	0	113.3	L478 E479 L484	L478-S482 PolarHBondContact O-N 3.35Å; L478-S482 VanDerWaalsContact O-N 3.16Å; E479-S482 PolarHBondContact O-OG 2.89Å; S482-L484 VanDerWaalsContact C-N 3.26Å; S482-L484 PolarHBondContact O-N 3.03Å
483	K	53.2	Low	42.2	Very low	152 Å²	152	108.2 Å²	108.2	66%	0.661	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-9.3	177	-81.1	170.4	173.4	158	0	114.8	E479 A481	E479-K483 IonicContact OE1-NZ 3.95Å; E479-K483 PolarHBondContact OE1-NZ 3.35Å; A481-K483 VanDerWaalsContact C-N 3.34Å; A481-K483 PolarHBondContact O-N 3.34Å
484	L	44.3	Very low	41.6	Very low	156 Å²	156	112.3 Å²	112.3	82%	0.817	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	4.3	178.4	-69.9	171.8	0	0	0	113.9	A481 S482	A481-L484 PolarHBondContact O-N 3.42Å; S482-L484 VanDerWaalsContact C-N 3.26Å; S482-L484 PolarHBondContact O-N 3.03Å
485	A	43.1	Very low	40.8	Very low	80 Å²	80	115.2 Å²	115.2	66%	0.661	68%	0.678	S	S	*	*	S	Bend	trans	-114.1	17.8	-168.9	0	0	0	0	0	115.2
486	S	36.4	Very low	39.9	Very low	100 Å²	100	116.5 Å²	116.5	70%	0.699	68%	0.678	S	S	*	*	S	Bend	trans	-148.2	138.6	178.8	-74.2	0	0	0	0	113.6
487	T	32.2	Very low	39	Very low	143 Å²	143	119.8 Å²	119.8	88%	0.877	68%	0.679	S	S	*	*			trans	70.8	99.7	171.3	11.6	0	0	0	0	118
488	D	33.5	Very low	37.7	Very low	151 Å²	151	122.7 Å²	122.7	81%	0.807	69%	0.686	S	S	*	*			trans	-68.3	145.9	145.7	-65	-82	0	0	0	110.8
489	V	31.3	Very low	36.6	Very low	149 Å²	149	125.9 Å²	125.9	90%	0.903	70%	0.698	S	S	*	*				-172.6	164.4	113.4	-88.1	0	0	0	0	110.5
490	A	29.6	Very low	35.5	Very low	77 Å²	77	127.1 Å²	127.1	64%	0.636	70%	0.704	S	S	*	*			trans	-74	179.3	178.6	0	0	0	0	0	112.6
491	D	27.9	Very low	34.1	Very low	143 Å²	143	129.8 Å²	129.8	77%	0.765	72%	0.719	S	S	*	*			cis	-156	166.1	33.2	-90.4	-56.8	0	0	0	113.7
492	E	27.8	Very low	33.1	Very low	166 Å²	166	134.2 Å²	134.2	78%	0.776	73%	0.726	S	S	*	*			trans	32.8	149.9	146.5	-59.1	-173.9	141.6	0	0	125.8
493	D	26.4	Very low	31.9	Very low	138 Å²	138	136.7 Å²	136.7	74%	0.738	74%	0.738	S	S	*	*			trans	82.3	140.9	150.2	-69.3	-11.1	0	0	0	126
494	D	26.5	Very low	30.6	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	74%	0.741	S	S	*	*			trans	58.2	146.1	153.7	-77.6	6.1	0	0	0	123.5
495	D	27.3	Very low	29.8	Very low	125 Å²	125	131.1 Å²	131.1	67%	0.668	74%	0.737	S	S	*	*			cis	-167.7	164.6	-25.8	-162.2	5.2	0	0	0	109.8
496	E	30.5	Very low	29.1	Very low	132 Å²	132	134.3 Å²	134.3	62%	0.617	74%	0.742	S	S	*	*			trans	61.3	158.2	163.7	-55.2	-150.6	143.8	0	0	117.3
497	K	31.2	Very low	28.6	Very low	135 Å²	135	135.7 Å²	135.7	59%	0.587	74%	0.738	S	S	*	*			cis	-170.5	169.4	-9.4	-111.8	177.6	-171.5	142.2	0	107.2
498	E	30.6	Very low	28.6	Very low	158 Å²	158	136.7 Å²	136.7	74%	0.738	73%	0.73	S	S	*	*			cis	-152.5	-162.5	-14.6	-131.4	155.5	-152.4	0	0	104.1
499	E	27.7	Very low	29	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	72%	0.722	S	S	*	*			cis	-115.5	-116.1	9.2	-64.7	-178.3	93.2	0	0	112.2
500	E	27.4	Very low	28.8	Very low	131 Å²	131	136 Å²	136	61%	0.612	72%	0.718	S	S	*	*			trans	-158.2	140.1	-134.3	-177.9	167.2	-95.3	0	0	118.4	K502	E500-K502 VanDerWaalsContact CD-CE 3.42Å; E500-K502 HydrophobicContact CG-CD 4.03Å; E500-K502 HydrophobicContact CG-CG 4.19Å; E500-K502 WeakPolarHBondContact OE1-CE 3.45Å; E500-K502 IonicContact OE1-NZ 2.73Å; E500-K502 PolarHBondContact OE1-NZ 2.99Å; E500-K502 WeakPolarHBondContact OE2-CE 3.37Å; E500-K502 IonicContact OE2-NZ 2.7Å; E500-K502 PolarHBondContact OE2-NZ 3.11Å
501	S	28.5	Very low	28.7	Very low	116 Å²	116	142 Å²	142	81%	0.811	73%	0.729	S	S	*	*			trans	178.5	92.2	136.8	28	0	0	0	0	110.3
502	K	27.5	Very low	29.8	Very low	156 Å²	156	140.4 Å²	140.4	68%	0.678	73%	0.727	S	S	*	*				48.4	132	88.3	-74.4	175.1	178.2	156.4	0	114	E500	E500-K502 VanDerWaalsContact CD-CE 3.42Å; E500-K502 HydrophobicContact CG-CD 4.03Å; E500-K502 HydrophobicContact CG-CG 4.19Å; E500-K502 WeakPolarHBondContact OE1-CE 3.45Å; E500-K502 IonicContact OE1-NZ 2.73Å; E500-K502 PolarHBondContact OE1-NZ 2.99Å; E500-K502 WeakPolarHBondContact OE2-CE 3.37Å; E500-K502 IonicContact OE2-NZ 2.7Å; E500-K502 PolarHBondContact OE2-NZ 3.11Å
503	V	26.2	Very low	29.8	Very low	130 Å²	130	138.2 Å²	138.2	79%	0.788	73%	0.725	S	S	*	*			cis	-132.2	157.2	27.6	174.7	0	0	0	0	109.1	V505	V503-V505 HydrophobicContact CG1-CG2 3.74Å
504	G	26	Very low	30	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	73%	0.726	S	S	*	*			cis	115.5	167	18.7	0	0	0	0	0	110.6
505	V	28.2	Very low	30	Very low	120 Å²	120	137.8 Å²	137.8	73%	0.727	72%	0.722	S	S	*	*			cis	-157.3	171.3	1.8	-165	0	0	0	0	108.3	V503	V503-V505 HydrophobicContact CG1-CG2 3.74Å
506	L	27.8	Very low	29.9	Very low	148 Å²	148	138 Å²	138	78%	0.775	73%	0.727	S	S	*	*			trans	91.9	133.1	162.5	-54.5	175.4	0	0	0	119.4
507	E	26.6	Very low	30.7	Very low	129 Å²	129	137.1 Å²	137.1	60%	0.603	73%	0.733	S	S	*	*			cis	-163.6	137.9	-32.3	-127.3	-159.2	-178	0	0	113.4
508	K	32.3	Very low	30.4	Very low	164 Å²	164	136.1 Å²	136.1	71%	0.713	74%	0.743	S	S	*	*			trans	42.2	165	133.4	-75.2	-179.2	-161	153.3	0	123.5
509	P	41.1	Very low	30.2	Very low	100 Å²	100	133.2 Å²	133.2	65%	0.649	75%	0.746	S	S	*	*			cis	-150	-172.9	-41	44.6	-26.6	0	0	0	117
510	K	27.4	Very low	30.1	Very low	186 Å²	186	127.8 Å²	127.8	81%	0.809	74%	0.74	S	S	*	*			trans	90.8	101	146.9	-75.6	176.4	-177.9	179.9	0	123.9
511	K	28.7	Very low	31	Very low	203 Å²	203	127.5 Å²	127.5	88%	0.883	75%	0.75	S	S	*	*				70.4	157.3	107.6	-82.8	-159.9	170.9	-170.4	0	122.6
512	P	50.3	Low	31	Very low	109 Å²	109	128.6 Å²	128.6	71%	0.708	74%	0.742	S	S	*	*			trans	-140.4	-133.7	-130.8	44.4	-22	0	0	0	116.4
513	T	28	Very low	31.1	Very low	120 Å²	120	130.3 Å²	130.3	74%	0.736	74%	0.744	S	S	*	*			trans	99.3	130.5	157	29.4	0	0	0	0	124.6
514	L	30.3	Very low	31.2	Very low	145 Å²	145	132.1 Å²	132.1	76%	0.759	74%	0.741	S	S	*	*			trans	84.6	123.8	139.5	-67	162.8	0	0	0	125.9
515	D	26.1	Very low	31.4	Very low	130 Å²	130	139.1 Å²	139.1	70%	0.695	75%	0.745	S	S	*	*			trans	56.1	118.2	130.7	-67.2	-7.1	0	0	0	127.8
516	V	25.7	Very low	31.6	Very low	128 Å²	128	138.4 Å²	138.4	78%	0.776	75%	0.746	S	S	*	*				47	146.6	106.7	178.1	0	0	0	0	120.1
517	P	47.7	Very low	32.2	Very low	114 Å²	114	137.3 Å²	137.3	74%	0.74	75%	0.748	S	S	*	*			cis	-137.2	-173.2	-22.8	37.4	-16.9	0	0	0	116.9
518	S	24.3	Very low	32.2	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	76%	0.758	S	S	*	*				118.1	140.5	128.9	-150.7	0	0	0	0	122.8
519	A	25.8	Very low	31.9	Very low	97 Å²	97	132.9 Å²	132.9	80%	0.802	76%	0.756	S	S	*	*			trans	60.8	139.8	151.8	0	0	0	0	0	123.9
520	G	26.4	Very low	31.3	Very low	72 Å²	72	133.7 Å²	133.7	74%	0.742	77%	0.765	S	S	*	*			trans	-101.4	-148.8	162.3	0	0	0	0	0	112.1
521	P	47	Very low	31.7	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	76%	0.764	S	S	*	*			cis	-144.1	-149.5	17.2	36.4	-10.7	0	0	0	115.2
522	E	27.1	Very low	31.6	Very low	138 Å²	138	126.8 Å²	126.8	65%	0.645	75%	0.753	S	S	*	*			trans	87.2	82.4	157	-66.6	-90.9	97.7	0	0	122.3
523	R	29.7	Very low	31.2	Very low	193 Å²	193	133.6 Å²	133.6	73%	0.728	77%	0.765	S	S	*	*				58.2	119.3	114.6	-75.8	-172.5	175.9	143.3	-10.4	124.1
524	K	29.1	Very low	31.4	Very low	167 Å²	167	135.6 Å²	135.6	73%	0.726	76%	0.763	S	S	*	*				110.2	116	125.6	-76.6	166.6	179.4	171.2	0	121.3
525	R	28.9	Very low	31.6	Very low	218 Å²	218	133.1 Å²	133.1	82%	0.823	76%	0.758	S	S	*	*			trans	79.6	80	135.8	-65.9	-179	175.9	-171.7	-2.9	121.3
526	S	34.3	Very low	32.3	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	77%	0.765	S	S	*	*				29.4	138.8	109.2	69	0	0	0	0	119.8
527	P	39.6	Very low	32.9	Very low	126 Å²	126	135.5 Å²	135.5	82%	0.818	77%	0.768	S	S	*	*				-147.5	164.5	79	40.1	-24.4	0	0	0	118.9
528	S	25.5	Very low	32.8	Very low	116 Å²	116	138 Å²	138	81%	0.811	77%	0.769	S	S	*	*			trans	97.7	121.8	151.8	-147.5	0	0	0	0	120.8
529	A	26.1	Very low	34.1	Very low	83 Å²	83	141 Å²	141	69%	0.686	78%	0.777	S	S	*	*			trans	57.5	77.1	146.1	0	0	0	0	0	121.4
530	S	29.1	Very low	35.6	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	76%	0.756	S	S	*	*				165.1	107.2	109.7	-72.2	0	0	0	0	112.8
531	P	36.3	Very low	37.5	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	74%	0.742	S	S	*	*			trans	-92	156.3	165.2	36	-31.1	0	0	0	111.2
532	D	27.2	Very low	38.6	Very low	122 Å²	122	138.2 Å²	138.2	65%	0.652	73%	0.734	S	S	*	*			cis	-165.5	145.7	-20.5	-143	-21.2	0	0	0	106.7	K534	D532-K534 HydrophobicContact CB-CG 4.4Å; D532-K534 WeakPolarHBondContact OD2-CE 3.22Å; D532-K534 IonicContact OD2-NZ 3.97Å
533	R	41.1	Very low	40.7	Very low	252 Å²	252	134.8 Å²	134.8	95%	0.951	73%	0.73	S	S	*	*			trans	-98.2	91.8	169.5	-114.2	-172.9	173.6	-170.3	-2.4	108.6
534	K	31.5	Very low	42.7	Very low	161 Å²	161	126.4 Å²	126.4	70%	0.7	70%	0.702	S	S	*	*			trans	-100.6	105.2	168.8	-67.9	-172.5	-179.2	-177	0	106.9	D532	D532-K534 HydrophobicContact CB-CG 4.4Å; D532-K534 WeakPolarHBondContact OD2-CE 3.22Å; D532-K534 IonicContact OD2-NZ 3.97Å
535	S	34.5	Very low	45.1	Very low	93 Å²	93	120.7 Å²	120.7	65%	0.65	69%	0.686	S	S	*	*				91.3	129.3	88.1	64.3	0	0	0	0	109.7
536	P	42.4	Very low	47.5	Very low	130 Å²	130	116.7 Å²	116.7	84%	0.844	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-67.6	135	-178.6	29.4	-33.9	0	0	0	110
537	E	38	Very low	49.7	Very low	178 Å²	178	113.1 Å²	113.1	83%	0.832	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-76.8	152.2	178	-72.1	-175	138.8	0	0	111.9
538	E	45.7	Very low	51.8	Low	166 Å²	166	108.6 Å²	108.6	78%	0.776	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-68.5	157.1	-171.8	-64.8	144.5	140	0	0	112.6	L540	E538-L540 VanDerWaalsContact C-N 3.28Å; E538-L540 PolarHBondContact O-N 3.26Å
539	N	50.9	Low	54.7	Low	178 Å²	178	110.1 Å²	110.1	95%	0.952	61%	0.612	S	S	*	*			trans	-71	78.5	177.8	-70.3	-53.7	0	0	0	111.7
540	L	58.3	Low	57.5	Low	70 Å²	70	110.1 Å²	110.1	37%	0.366	60%	0.6	S	S	.	*			trans	-71.1	146	168.3	-68.2	173.5	0	0	0	110.8	E538 A544	E538-L540 VanDerWaalsContact C-N 3.28Å; E538-L540 PolarHBondContact O-N 3.26Å; L540-A544 HydrophobicContact CB-CB 4.5Å
541	S	66.4	Low	60.3	Low	65 Å²	65	104.6 Å²	104.6	46%	0.455	56%	0.561	S	S	.	*			trans	-65.5	151.1	174.7	76.1	0	0	0	0	110.9	A543 A544 A545	S541-A543 PolarHBondContact O-N 3.22Å; S541-A543 VanDerWaalsContact O-N 3.15Å; S541-A544 PolarHBondContact O-N 3.49Å; S541-A544 WeakPolarHBondContact OG-CB 3.42Å; S541-A544 PolarHBondContact OG-N 3.19Å; S541-A545 PolarHBondContact O-N 3.31Å
542	P	70.1	Confident	62.7	Low	101 Å²	101	100 Å²	100	66%	0.656	53%	0.53	S	S	*	.	H	α-helix	trans	-61	-27.9	-177.9	22.7	-33.4	0	0	0	113	Q546	P542-Q546 VanDerWaalsContact O-CG 3.31Å; P542-Q546 WeakPolarHBondContact O-CG 3.47Å; P542-Q546 PolarHBondContact O-N 3.34Å; P542-Q546 VanDerWaalsContact O-N 3.17Å
543	A	70.1	Confident	65.5	Low	67 Å²	67	96.6 Å²	96.6	55%	0.554	52%	0.516	S	S	*	.	H	α-helix	trans	-71.2	-41.7	172.9	0	0	0	0	0	112.5	S541 A545 Q546 L547	S541-A543 PolarHBondContact O-N 3.22Å; S541-A543 VanDerWaalsContact O-N 3.15Å; A543-A545 VanDerWaalsContact C-N 3.34Å; A543-Q546 PolarHBondContact O-N 2.72Å; A543-L547 WeakPolarHBondContact O-CB 3.46Å; A543-L547 PolarHBondContact O-N 3.25Å
544	A	72.4	Confident	67.7	Low	16 Å²	16	85.5 Å²	85.5	13%	0.132	47%	0.474	C	S	.	.	H	α-helix	trans	-65.2	-38.2	175.3	0	0	0	0	0	111.7	L540 S541 L547 L548	L540-A544 HydrophobicContact CB-CB 4.5Å; S541-A544 PolarHBondContact O-N 3.49Å; S541-A544 WeakPolarHBondContact OG-CB 3.42Å; S541-A544 PolarHBondContact OG-N 3.19Å; A544-L547 PolarHBondContact O-N 3.3Å; A544-L548 WeakPolarHBondContact O-CB 3.39Å; A544-L548 PolarHBondContact O-N 2.82Å
545	A	78.8	Confident	70.4	Confident	47 Å²	47	80 Å²	80	39%	0.388	45%	0.45	S	S	.	.	H	α-helix	trans	-63	-43.9	175.1	0	0	0	0	0	112.6	S541 A543 L548 E549	S541-A545 PolarHBondContact O-N 3.31Å; A543-A545 VanDerWaalsContact C-N 3.34Å; A545-L548 WeakPolarHBondContact O-CB 3.3Å; A545-L548 PolarHBondContact O-N 2.83Å; A545-E549 PolarHBondContact O-N 2.78Å
546	Q	79.1	Confident	73.1	Confident	135 Å²	135	82 Å²	82	63%	0.631	45%	0.447	S	S	*	.	H	α-helix	trans	-65.5	-41.7	176.1	-72.2	170.9	30.2	0	0	112.3	P542 A543 L548 E549 L550	P542-Q546 VanDerWaalsContact O-CG 3.31Å; P542-Q546 WeakPolarHBondContact O-CG 3.47Å; P542-Q546 PolarHBondContact O-N 3.34Å; P542-Q546 VanDerWaalsContact O-N 3.17Å; A543-Q546 PolarHBondContact O-N 2.72Å; Q546-L548 VanDerWaalsContact C-N 3.33Å; Q546-L548 PolarHBondContact O-N 3.08Å; Q546-E549 PolarHBondContact O-N 3.39Å; Q546-L550 WeakPolarHBondContact O-CB 3.17Å; Q546-L550 PolarHBondContact O-N 3.33Å
547	L	79.8	Confident	75.2	Confident	29 Å²	29	79.6 Å²	79.6	15%	0.152	42%	0.424	C	S	.	.	H	α-helix	trans	-62.4	-41.4	174.4	-179.5	58.7	0	0	0	111.2	A543 A544 L550 L551 V597 I599	A543-L547 WeakPolarHBondContact O-CB 3.46Å; A543-L547 PolarHBondContact O-N 3.25Å; A544-L547 PolarHBondContact O-N 3.3Å; L547-L550 PolarHBondContact O-N 3.37Å; L547-L551 HydrophobicContact CD1-CD1 4.36Å; L547-L551 HydrophobicContact CD1-CG 4.4Å; L547-L551 HydrophobicContact CG-CD1 4.17Å; L547-L551 WeakPolarHBondContact O-CG 3.25Å; L547-L551 PolarHBondContact O-N 3.28Å; L547-V597 HydrophobicContact CD2-CB 4.21Å; L547-I599 HydrophobicContact CD1-CD1 4.4Å; L547-I599 HydrophobicContact CD1-CG1 4.1Å
548	L	84.5	Confident	77.7	Confident	32 Å²	32	71.5 Å²	71.5	17%	0.168	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-47.9	175.6	-173.3	71.3	0	0	0	112.1	A544 A545 Q546 L550 L551 D552 I588 A591 R592	A544-L548 WeakPolarHBondContact O-CB 3.39Å; A544-L548 PolarHBondContact O-N 2.82Å; A545-L548 WeakPolarHBondContact O-CB 3.3Å; A545-L548 PolarHBondContact O-N 2.83Å; Q546-L548 VanDerWaalsContact C-N 3.33Å; Q546-L548 PolarHBondContact O-N 3.08Å; L548-L550 VanDerWaalsContact C-N 3.32Å; L548-L550 PolarHBondContact O-N 2.7Å; L548-L551 PolarHBondContact O-N 3.3Å; L548-D552 PolarHBondContact O-N 3.31Å; L548-I588 HydrophobicContact CD1-CG2 3.94Å; L548-A591 HydrophobicContact CD1-CB 4.25Å; L548-R592 HydrophobicContact CD1-CG 3.45Å; L548-R592 VanDerWaalsContact CD1-CG 3.45Å; L548-R592 HydrophobicContact CD2-CG 4.11Å; L548-R592 HydrophobicContact CG-CG 4.44Å
549	E	86.4	Confident	79.8	Confident	147 Å²	147	68.3 Å²	68.3	69%	0.687	37%	0.373	S	S	*	.	H	α-helix	trans	-60.9	-42	178.2	-177.8	169.7	-159	0	0	111.5	A545 Q546 S553	A545-E549 PolarHBondContact O-N 2.78Å; Q546-E549 PolarHBondContact O-N 3.39Å; E549-S553 WeakPolarHBondContact O-CB 3.41Å; E549-S553 PolarHBondContact O-N 3.32Å
550	L	85.3	Confident	81.6	Confident	84 Å²	84	66.3 Å²	66.3	44%	0.44	36%	0.356	S	S	.	.	H	α-helix	trans	-58.1	-49.1	173.7	-179.6	63	0	0	0	111.2	Q546 L547 L548 S553 R554 L602	Q546-L550 WeakPolarHBondContact O-CB 3.17Å; Q546-L550 PolarHBondContact O-N 3.33Å; L547-L550 PolarHBondContact O-N 3.37Å; L548-L550 VanDerWaalsContact C-N 3.32Å; L548-L550 PolarHBondContact O-N 2.7Å; L550-S553 WeakPolarHBondContact O-CB 3.4Å; L550-S553 PolarHBondContact O-N 2.73Å; L550-R554 VanDerWaalsContact O-CB 3.25Å; L550-R554 WeakPolarHBondContact O-CB 3.43Å; L550-R554 PolarHBondContact O-N 2.81Å; L550-L602 HydrophobicContact CD2-CD1 4.48Å
551	L	87	Confident	83	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65.4	-45.4	-179.4	-67.5	168.6	0	0	0	113	L547 L548 S553 R554 K555 M587 I588 A591 L602	L547-L551 HydrophobicContact CD1-CD1 4.36Å; L547-L551 HydrophobicContact CD1-CG 4.4Å; L547-L551 HydrophobicContact CG-CD1 4.17Å; L547-L551 WeakPolarHBondContact O-CG 3.25Å; L547-L551 PolarHBondContact O-N 3.28Å; L548-L551 PolarHBondContact O-N 3.3Å; L551-S553 VanDerWaalsContact C-N 3.3Å; L551-S553 PolarHBondContact O-N 3.23Å; L551-R554 WeakPolarHBondContact O-CB 3.43Å; L551-R554 PolarHBondContact O-N 2.91Å; L551-K555 WeakPolarHBondContact O-CB 3.39Å; L551-K555 PolarHBondContact O-N 3.36Å; L551-M587 HydrophobicContact CD1-CB 4.45Å; L551-M587 HydrophobicContact CD2-CB 4.17Å; L551-I588 HydrophobicContact CB-CD1 4.46Å; L551-I588 HydrophobicContact CB-CG1 3.6Å; L551-I588 HydrophobicContact CD1-CG1 4.49Å; L551-A591 HydrophobicContact CD1-CB 3.71Å; L551-L602 HydrophobicContact CD2-CD1 4.19Å; L551-L602 HydrophobicContact CD2-CD2 3.39Å; L551-L602 HydrophobicContact CD2-CG 4.41Å
552	D	86.9	Confident	84.1	Confident	28 Å²	28	60.7 Å²	60.7	15%	0.15	32%	0.323	C	S	.	.	H	α-helix	trans	-68	-31	176.8	-102	-52.1	0	0	0	111.4	L548 K556 R592	L548-D552 PolarHBondContact O-N 3.31Å; D552-K556 WeakPolarHBondContact O-CB 3.37Å; D552-K556 WeakPolarHBondContact O-CD 3.48Å; D552-K556 WeakPolarHBondContact O-CE 3.39Å; D552-K556 WeakPolarHBondContact O-CG 3.36Å; D552-K556 PolarHBondContact O-N 2.89Å; D552-K556 VanDerWaalsContact O-N 3.11Å; D552-R592 IonicContact OD1-NH2 2.63Å; D552-R592 IonicContact OD2-CZ 3.91Å; D552-R592 IonicContact OD2-NH2 2.62Å; D552-R592 PolarHBondContact OD2-NH2 2.88Å
553	S	87.4	Confident	85	Confident	50 Å²	50	61 Å²	61	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-49.2	170	-173	0	0	0	0	111.8	E549 L550 L551 K555 K556 Q557	E549-S553 WeakPolarHBondContact O-CB 3.41Å; E549-S553 PolarHBondContact O-N 3.32Å; L550-S553 WeakPolarHBondContact O-CB 3.4Å; L550-S553 PolarHBondContact O-N 2.73Å; L551-S553 VanDerWaalsContact C-N 3.3Å; L551-S553 PolarHBondContact O-N 3.23Å; S553-K555 VanDerWaalsContact C-N 3.29Å; S553-K555 PolarHBondContact O-N 2.78Å; S553-K556 PolarHBondContact O-N 2.92Å; S553-K556 VanDerWaalsContact O-N 3.1Å; S553-Q557 WeakPolarHBondContact O-CG 3.24Å; S553-Q557 PolarHBondContact O-N 3.13Å
554	R	85.5	Confident	85.9	Confident	18 Å²	18	62.4 Å²	62.4	7%	0.068	31%	0.314	C	S	.	.	H	α-helix	trans	-49.8	-48.7	175	-161	92.3	-141.1	69.1	40.8	111.3	L550 L551 Q557 F558 L584 P603 S604	L550-R554 VanDerWaalsContact O-CB 3.25Å; L550-R554 WeakPolarHBondContact O-CB 3.43Å; L550-R554 PolarHBondContact O-N 2.81Å; L551-R554 WeakPolarHBondContact O-CB 3.43Å; L551-R554 PolarHBondContact O-N 2.91Å; R554-Q557 PolarHBondContact O-N 3.45Å; R554-F558 HydrophobicContact CG-CE2 4.46Å; R554-F558 VanDerWaalsContact NH2-CZ 3.26Å; R554-F558 WeakPolarHBondContact O-CD2 3.47Å; R554-F558 PolarHBondContact O-N 3.44Å; R554-L584 HydrophobicContact CB-CD1 3.92Å; R554-L584 HydrophobicContact CG-CD1 3.66Å; R554-L584 HydrophobicContact CG-CD2 4.25Å; R554-P603 PolarHBondContact NE-O 2.93Å; R554-P603 PolarHBondContact NH2-O 2.85Å; R554-S604 PolarHBondContact NH2-O 2.9Å
555	K	88.8	Confident	86.7	Confident	45 Å²	45	61.9 Å²	61.9	20%	0.196	31%	0.309	C	S	.	.	H	α-helix	trans	-65.2	-44.8	177	174.9	176.6	165.8	-172.1	0	112.9	L551 S553 Q557 F558 M559 L584 D585 I588	L551-K555 WeakPolarHBondContact O-CB 3.39Å; L551-K555 PolarHBondContact O-N 3.36Å; S553-K555 VanDerWaalsContact C-N 3.29Å; S553-K555 PolarHBondContact O-N 2.78Å; K555-Q557 VanDerWaalsContact C-N 3.28Å; K555-Q557 PolarHBondContact O-N 2.95Å; K555-F558 PolarHBondContact O-N 3.48Å; K555-M559 HydrophobicContact CG-SD 4.26Å; K555-M559 WeakPolarHBondContact O-CG 3.42Å; K555-M559 PolarHBondContact O-N 2.83Å; K555-L584 HydrophobicContact CB-CB 4.43Å; K555-L584 HydrophobicContact CB-CD1 4.02Å; K555-D585 WeakPolarHBondContact CE-OD1 3.5Å; K555-D585 IonicContact NZ-OD1 2.78Å; K555-D585 PolarHBondContact NZ-OD1 2.73Å; K555-I588 HydrophobicContact CB-CD1 4.12Å; K555-I588 HydrophobicContact CD-CD1 3.42Å; K555-I588 VanDerWaalsContact CD-CD1 3.42Å; K555-I588 HydrophobicContact CG-CD1 4.44Å
556	K	90.5	Very high	87.3	Confident	135 Å²	135	65.6 Å²	65.6	59%	0.587	32%	0.317	S	S	*	.	H	α-helix	trans	-59.5	-38.3	176.1	-71.7	158.5	-163	162.8	0	111.8	D552 S553 M559 K560	D552-K556 WeakPolarHBondContact O-CB 3.37Å; D552-K556 WeakPolarHBondContact O-CD 3.48Å; D552-K556 WeakPolarHBondContact O-CE 3.39Å; D552-K556 WeakPolarHBondContact O-CG 3.36Å; D552-K556 PolarHBondContact O-N 2.89Å; D552-K556 VanDerWaalsContact O-N 3.11Å; S553-K556 PolarHBondContact O-N 2.92Å; S553-K556 VanDerWaalsContact O-N 3.1Å; K556-M559 PolarHBondContact O-N 2.86Å; K556-K560 WeakPolarHBondContact O-CB 3.36Å; K556-K560 PolarHBondContact O-N 2.81Å
557	Q	87.5	Confident	87.8	Confident	80 Å²	80	66.8 Å²	66.8	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-51.4	175.1	-67.8	176.9	7.3	0	0	112	S553 R554 K555 M559 K560 A561 P606	S553-Q557 WeakPolarHBondContact O-CG 3.24Å; S553-Q557 PolarHBondContact O-N 3.13Å; R554-Q557 PolarHBondContact O-N 3.45Å; K555-Q557 VanDerWaalsContact C-N 3.28Å; K555-Q557 PolarHBondContact O-N 2.95Å; Q557-M559 VanDerWaalsContact C-N 3.33Å; Q557-M559 PolarHBondContact O-N 2.9Å; Q557-K560 WeakPolarHBondContact O-CB 3.15Å; Q557-K560 PolarHBondContact O-N 2.84Å; Q557-K560 VanDerWaalsContact O-N 3.13Å; Q557-A561 PolarHBondContact O-N 2.91Å; Q557-P606 HydrophobicContact CB-CG 4.23Å
558	F	89.9	Confident	88.2	Confident	9 Å²	9	73.7 Å²	73.7	4%	0.039	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-37.5	176.7	-78.5	-63.9	0	0	0	113.2	R554 K555 K560 A561 A562 F577 T580 A581 L584 P603 S604 P606	R554-F558 HydrophobicContact CG-CE2 4.46Å; R554-F558 VanDerWaalsContact NH2-CZ 3.26Å; R554-F558 WeakPolarHBondContact O-CD2 3.47Å; R554-F558 PolarHBondContact O-N 3.44Å; K555-F558 PolarHBondContact O-N 3.48Å; F558-K560 VanDerWaalsContact C-N 3.35Å; F558-A561 PolarHBondContact O-N 2.82Å; F558-A562 WeakPolarHBondContact O-CB 3.38Å; F558-A562 PolarHBondContact O-N 2.92Å; F558-F577 HydrophobicContact CD1-CB 4.38Å; F558-F577 AromaticContact CD1-CD1 3.87Å; F558-F577 HydrophobicContact CD1-CD1 3.87Å; F558-F577 HydrophobicContact CE1-CD1 4.13Å; F558-T580 HydrophobicContact CD1-CG2 4.21Å; F558-T580 HydrophobicContact CD2-CG2 4.03Å; F558-T580 HydrophobicContact CE1-CG2 3.8Å; F558-T580 HydrophobicContact CE2-CG2 3.59Å; F558-T580 HydrophobicContact CG-CG2 4.32Å; F558-T580 HydrophobicContact CZ-CG2 3.47Å; F558-T580 VanDerWaalsContact CZ-CG2 3.47Å; F558-A581 HydrophobicContact CB-CB 3.74Å; F558-L584 HydrophobicContact CD2-CD1 3.93Å; F558-L584 HydrophobicContact CE2-CD1 4.28Å; F558-P603 HydrophobicContact CE2-CB 4.38Å; F558-P603 HydrophobicContact CE2-CG 3.94Å; F558-P603 HydrophobicContact CZ-CB 4.1Å; F558-P603 HydrophobicContact CZ-CG 4.15Å; F558-S604 VanDerWaalsContact CZ-O 3.29Å; F558-S604 WeakPolarHBondContact CZ-O 3.19Å; F558-P606 HydrophobicContact CD1-CB 3.81Å; F558-P606 HydrophobicContact CD1-CG 3.67Å; F558-P606 HydrophobicContact CE1-CB 3.8Å; F558-P606 HydrophobicContact CE1-CG 3.89Å; F558-P606 HydrophobicContact CG-CG 4.19Å
559	M	89.6	Confident	88.3	Confident	99 Å²	99	78.6 Å²	78.6	49%	0.488	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-38.1	173.8	-69.9	-175.1	71.6	0	0	112.3	K555 K556 Q557 L563 A581	K555-M559 HydrophobicContact CG-SD 4.26Å; K555-M559 WeakPolarHBondContact O-CG 3.42Å; K555-M559 PolarHBondContact O-N 2.83Å; K556-M559 PolarHBondContact O-N 2.86Å; Q557-M559 VanDerWaalsContact C-N 3.33Å; Q557-M559 PolarHBondContact O-N 2.9Å; M559-L563 WeakPolarHBondContact O-CG 3.33Å; M559-L563 PolarHBondContact O-N 3.35Å; M559-L563 VanDerWaalsContact O-N 3.13Å; M559-A581 HydrophobicContact CG-CB 3.8Å
560	K	89.9	Confident	88.4	Confident	135 Å²	135	74.1 Å²	74.1	59%	0.587	36%	0.358	S	S	*	.	H	α-helix	trans	-66.5	-44.8	174.5	-175.1	-176.9	175.1	-170.9	0	111.6	K556 Q557 F558 A562 L563 Q564	K556-K560 WeakPolarHBondContact O-CB 3.36Å; K556-K560 PolarHBondContact O-N 2.81Å; Q557-K560 WeakPolarHBondContact O-CB 3.15Å; Q557-K560 PolarHBondContact O-N 2.84Å; Q557-K560 VanDerWaalsContact O-N 3.13Å; F558-K560 VanDerWaalsContact C-N 3.35Å; K560-A562 PolarHBondContact O-N 3.04Å; K560-L563 PolarHBondContact O-N 3Å; K560-Q564 WeakPolarHBondContact O-CG 3.38Å; K560-Q564 PolarHBondContact O-N 3.11Å
561	A	87.3	Confident	88.5	Confident	11 Å²	11	74.3 Å²	74.3	9%	0.091	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-43.3	175.5	0	0	0	0	0	111.8	Q557 F558 L563 Q564 A565 F577 P606	Q557-A561 PolarHBondContact O-N 2.91Å; F558-A561 PolarHBondContact O-N 2.82Å; A561-L563 VanDerWaalsContact C-N 3.32Å; A561-L563 PolarHBondContact O-N 2.96Å; A561-Q564 PolarHBondContact O-N 3.47Å; A561-A565 WeakPolarHBondContact O-CB 3.47Å; A561-A565 PolarHBondContact O-N 3.39Å; A561-F577 HydrophobicContact CB-CB 4.44Å; A561-F577 HydrophobicContact CB-CD1 4.46Å; A561-F577 HydrophobicContact CB-CD2 3.87Å; A561-F577 HydrophobicContact CB-CE2 4.18Å; A561-F577 HydrophobicContact CB-CG 4.02Å; A561-P606 HydrophobicContact CB-CB 3.78Å; A561-P606 HydrophobicContact CB-CG 3.92Å
562	A	89.8	Confident	88.5	Confident	6 Å²	6	81 Å²	81	5%	0.05	39%	0.389	C	S	.	.	H	α-helix	trans	-60	-39	175	0	0	0	0	0	112.9	F558 K560 K566 A574 F577 L578	F558-A562 WeakPolarHBondContact O-CB 3.38Å; F558-A562 PolarHBondContact O-N 2.92Å; K560-A562 PolarHBondContact O-N 3.04Å; A562-K566 WeakPolarHBondContact O-CB 3.5Å; A562-K566 PolarHBondContact O-N 2.76Å; A562-K566 VanDerWaalsContact O-N 3.07Å; A562-A574 WeakPolarHBondContact O-CB 3.18Å; A562-F577 HydrophobicContact CB-CB 3.84Å; A562-L578 HydrophobicContact CB-CB 4.07Å
563	L	89.6	Confident	88.3	Confident	108 Å²	108	84.4 Å²	84.4	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-69	-38.5	175	-71.3	170.3	0	0	0	112.2	M559 K560 A561 K566 Q567	M559-L563 WeakPolarHBondContact O-CG 3.33Å; M559-L563 PolarHBondContact O-N 3.35Å; M559-L563 VanDerWaalsContact O-N 3.13Å; K560-L563 PolarHBondContact O-N 3Å; A561-L563 VanDerWaalsContact C-N 3.32Å; A561-L563 PolarHBondContact O-N 2.96Å; L563-K566 PolarHBondContact O-N 3.42Å; L563-Q567 VanDerWaalsContact O-CG 3.32Å; L563-Q567 WeakPolarHBondContact O-CG 3.42Å; L563-Q567 PolarHBondContact O-N 2.76Å
564	Q	88.4	Confident	88.3	Confident	97 Å²	97	82.6 Å²	82.6	45%	0.453	39%	0.392	S	S	.	.	H	α-helix	trans	-69.1	-43.4	176.7	-73.3	177.7	-40.4	0	0	112.3	K560 A561 K566 Q567 K568	K560-Q564 WeakPolarHBondContact O-CG 3.38Å; K560-Q564 PolarHBondContact O-N 3.11Å; A561-Q564 PolarHBondContact O-N 3.47Å; Q564-K566 VanDerWaalsContact C-N 3.33Å; Q564-K566 PolarHBondContact O-N 2.99Å; Q564-Q567 PolarHBondContact O-N 3.47Å; Q564-Q567 VanDerWaalsContact O-N 3.15Å; Q564-K568 WeakPolarHBondContact O-CG 3.33Å; Q564-K568 PolarHBondContact O-N 2.97Å
565	A	88.3	Confident	88.3	Confident	4 Å²	4	86.9 Å²	86.9	3%	0.033	41%	0.411	C	S	.	.	H	α-helix	trans	-58	-45.6	172.3	0	0	0	0	0	111.1	A561 Q567 K568 N569 D570 Q573 A574 F577	A561-A565 WeakPolarHBondContact O-CB 3.47Å; A561-A565 PolarHBondContact O-N 3.39Å; A565-Q567 VanDerWaalsContact C-N 3.33Å; A565-Q567 PolarHBondContact O-N 3.49Å; A565-K568 CarbonylContact O-C 3.51Å; A565-K568 WeakPolarHBondContact O-CA 3.17Å; A565-K568 WeakPolarHBondContact O-CB 3.27Å; A565-K568 PolarHBondContact O-N 3.19Å; A565-K568 VanDerWaalsContact O-N 3.12Å; A565-N569 PolarHBondContact O-N 3.45Å; A565-N569 VanDerWaalsContact O-N 3.16Å; A565-D570 CarbonylContact C-O 3.47Å; A565-D570 HydrophobicContact CB-CB 4.43Å; A565-D570 PolarHBondContact O-N 2.86Å; A565-Q573 HydrophobicContact CB-CB 3.93Å; A565-A574 HydrophobicContact CB-CB 3.92Å; A565-F577 HydrophobicContact CB-CD2 4.32Å; A565-F577 HydrophobicContact CB-CE2 4.43Å
566	K	91.1	Very high	88.3	Confident	126 Å²	126	88.1 Å²	88.1	55%	0.548	42%	0.423	S	S	.	.	H	α-helix	trans	-60.9	-37.4	174.4	-173.5	-179.1	179	-173.3	0	113	A562 L563 Q564 N569 M571 A574	A562-K566 WeakPolarHBondContact O-CB 3.5Å; A562-K566 PolarHBondContact O-N 2.76Å; A562-K566 VanDerWaalsContact O-N 3.07Å; L563-K566 PolarHBondContact O-N 3.42Å; Q564-K566 VanDerWaalsContact C-N 3.33Å; Q564-K566 PolarHBondContact O-N 2.99Å; K566-N569 PolarHBondContact O-N 2.95Å; K566-N569 VanDerWaalsContact O-N 3.16Å; K566-M571 HydrophobicContact CG-SD 4.07Å; K566-A574 HydrophobicContact CB-CB 4.08Å
567	Q	91.1	Very high	88.3	Confident	160 Å²	160	83.8 Å²	83.8	75%	0.748	40%	0.404	S	S	*	.	H	α-helix	trans	-69	-34.7	174.4	-76.3	171.6	-6	0	0	112.6	L563 Q564 A565 N569	L563-Q567 VanDerWaalsContact O-CG 3.32Å; L563-Q567 WeakPolarHBondContact O-CG 3.42Å; L563-Q567 PolarHBondContact O-N 2.76Å; Q564-Q567 PolarHBondContact O-N 3.47Å; Q564-Q567 VanDerWaalsContact O-N 3.15Å; A565-Q567 VanDerWaalsContact C-N 3.33Å; A565-Q567 PolarHBondContact O-N 3.49Å; Q567-N569 PolarHBondContact O-N 3.2Å
568	K	86.9	Confident	88.4	Confident	174 Å²	174	84.1 Å²	84.1	76%	0.757	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	2.1	169.7	-67.6	179	178	-176.9	0	113.4	Q564 A565 D570	Q564-K568 WeakPolarHBondContact O-CG 3.33Å; Q564-K568 PolarHBondContact O-N 2.97Å; A565-K568 CarbonylContact O-C 3.51Å; A565-K568 WeakPolarHBondContact O-CA 3.17Å; A565-K568 WeakPolarHBondContact O-CB 3.27Å; A565-K568 PolarHBondContact O-N 3.19Å; A565-K568 VanDerWaalsContact O-N 3.12Å; K568-D570 PolarHBondContact O-N 3.43Å
569	N	86.6	Confident	88.4	Confident	134 Å²	134	91.9 Å²	91.9	72%	0.717	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	10.2	-174.5	-137.2	7.6	0	0	0	114.9	A565 K566 Q567 M571	A565-N569 PolarHBondContact O-N 3.45Å; A565-N569 VanDerWaalsContact O-N 3.16Å; K566-N569 PolarHBondContact O-N 2.95Å; K566-N569 VanDerWaalsContact O-N 3.16Å; Q567-N569 PolarHBondContact O-N 3.2Å; N569-M571 PolarHBondContact O-N 3.44Å
570	D	88.8	Confident	88.2	Confident	53 Å²	53	88.9 Å²	88.9	28%	0.283	42%	0.424	S	S	.	.			trans	-77.5	91.3	170	-169.1	-34.5	0	0	0	109.5	A565 K568 E572 Q573 A574	A565-D570 CarbonylContact C-O 3.47Å; A565-D570 HydrophobicContact CB-CB 4.43Å; A565-D570 PolarHBondContact O-N 2.86Å; K568-D570 PolarHBondContact O-N 3.43Å; D570-E572 PolarHBondContact O-N 3.47Å; D570-E572 PolarHBondContact OD1-N 2.72Å; D570-Q573 HydrophobicContact CB-CB 4.4Å; D570-Q573 WeakPolarHBondContact OD1-CB 3.31Å; D570-Q573 PolarHBondContact OD1-N 3.08Å; D570-Q573 WeakPolarHBondContact OD2-CG 3.41Å; D570-A574 WeakPolarHBondContact O-CB 3.39Å; D570-A574 PolarHBondContact O-N 2.93Å
571	M	87.1	Confident	88.2	Confident	89 Å²	89	82.6 Å²	82.6	44%	0.438	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	4.9	179	-74.4	-65	-60.9	0	0	113.5	K566 N569 K575	K566-M571 HydrophobicContact CG-SD 4.07Å; N569-M571 PolarHBondContact O-N 3.44Å; M571-K575 WeakPolarHBondContact O-CD 3.41Å; M571-K575 WeakPolarHBondContact O-CE 3.45Å; M571-K575 VanDerWaalsContact O-CG 3.23Å; M571-K575 WeakPolarHBondContact O-CG 3.45Å; M571-K575 PolarHBondContact O-NZ 2.66Å
572	E	87.4	Confident	88.3	Confident	141 Å²	141	88.3 Å²	88.3	66%	0.659	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-51.8	179.2	-53.4	-138.2	129.5	0	0	110.6	D570 A574 K575 V576	D570-E572 PolarHBondContact O-N 3.47Å; D570-E572 PolarHBondContact OD1-N 2.72Å; E572-A574 PolarHBondContact O-N 3.1Å; E572-K575 WeakPolarHBondContact O-CB 3.3Å; E572-K575 PolarHBondContact O-N 3.44Å; E572-K575 IonicContact OE1-NZ 3.9Å; E572-V576 PolarHBondContact O-N 2.93Å
573	Q	83.4	Confident	88.1	Confident	99 Å²	99	90.1 Å²	90.1	46%	0.463	44%	0.439	S	S	.	.	H	α-helix	trans	-54.7	-41.6	166.8	-70.2	-175	4.1	0	0	111.4	A565 D570 K575 V576 F577	A565-Q573 HydrophobicContact CB-CB 3.93Å; D570-Q573 HydrophobicContact CB-CB 4.4Å; D570-Q573 WeakPolarHBondContact OD1-CB 3.31Å; D570-Q573 PolarHBondContact OD1-N 3.08Å; D570-Q573 WeakPolarHBondContact OD2-CG 3.41Å; Q573-K575 VanDerWaalsContact C-N 3.25Å; Q573-K575 PolarHBondContact O-N 3.25Å; Q573-V576 PolarHBondContact O-N 3.12Å; Q573-V576 VanDerWaalsContact O-N 3.1Å; Q573-F577 HydrophobicContact CB-CD2 4.29Å; Q573-F577 HydrophobicContact CB-CE2 3.95Å; Q573-F577 VanDerWaalsContact O-CD2 3.27Å; Q573-F577 WeakPolarHBondContact O-CD2 3.49Å; Q573-F577 PolarHBondContact O-N 3.48Å
574	A	86.2	Confident	88	Confident	12 Å²	12	85 Å²	85	10%	0.099	41%	0.413	C	S	.	.	H	α-helix	trans	-59.9	-32.7	176.1	0	0	0	0	0	113.4	A562 A565 K566 D570 E572 L578	A562-A574 WeakPolarHBondContact O-CB 3.18Å; A565-A574 HydrophobicContact CB-CB 3.92Å; K566-A574 HydrophobicContact CB-CB 4.08Å; D570-A574 WeakPolarHBondContact O-CB 3.39Å; D570-A574 PolarHBondContact O-N 2.93Å; E572-A574 PolarHBondContact O-N 3.1Å; A574-L578 WeakPolarHBondContact O-CB 3.36Å; A574-L578 PolarHBondContact O-N 3.43Å
575	K	87.2	Confident	88	Confident	107 Å²	107	83.3 Å²	83.3	47%	0.465	41%	0.406	S	S	.	.	H	α-helix	trans	-75.7	-38.1	174.3	-66.6	165	-167.3	139.6	0	111.4	M571 E572 Q573 R579	M571-K575 WeakPolarHBondContact O-CD 3.41Å; M571-K575 WeakPolarHBondContact O-CE 3.45Å; M571-K575 VanDerWaalsContact O-CG 3.23Å; M571-K575 WeakPolarHBondContact O-CG 3.45Å; M571-K575 PolarHBondContact O-NZ 2.66Å; E572-K575 WeakPolarHBondContact O-CB 3.3Å; E572-K575 PolarHBondContact O-N 3.44Å; E572-K575 IonicContact OE1-NZ 3.9Å; Q573-K575 VanDerWaalsContact C-N 3.25Å; Q573-K575 PolarHBondContact O-N 3.25Å; K575-R579 WeakPolarHBondContact O-CB 3.48Å; K575-R579 PolarHBondContact O-N 2.88Å
576	V	87.8	Confident	87.9	Confident	71 Å²	71	86.9 Å²	86.9	43%	0.43	43%	0.43	S	S	.	.	H	α-helix	trans	-63.9	-57.4	177.8	174.4	0	0	0	0	110.2	E572 Q573 L578 R579 T580	E572-V576 PolarHBondContact O-N 2.93Å; Q573-V576 PolarHBondContact O-N 3.12Å; Q573-V576 VanDerWaalsContact O-N 3.1Å; V576-L578 VanDerWaalsContact C-N 3.27Å; V576-L578 PolarHBondContact O-N 3.42Å; V576-R579 WeakPolarHBondContact O-CA 3.29Å; V576-R579 WeakPolarHBondContact O-CB 3.42Å; V576-R579 PolarHBondContact O-N 3.18Å; V576-T580 PolarHBondContact O-N 2.88Å; V576-T580 PolarHBondContact O-OG1 3.3Å; V576-T580 VanDerWaalsContact O-OG1 3.11Å
577	F	89.9	Confident	87.4	Confident	45 Å²	45	82.2 Å²	82.2	20%	0.197	41%	0.41	C	S	.	.	H	α-helix	trans	-58.6	-37.1	179.2	-62.9	-45.4	0	0	0	112.7	F558 A561 A562 A565 Q573 T580 A581 P606	F558-F577 HydrophobicContact CD1-CB 4.38Å; F558-F577 AromaticContact CD1-CD1 3.87Å; F558-F577 HydrophobicContact CD1-CD1 3.87Å; F558-F577 HydrophobicContact CE1-CD1 4.13Å; A561-F577 HydrophobicContact CB-CB 4.44Å; A561-F577 HydrophobicContact CB-CD1 4.46Å; A561-F577 HydrophobicContact CB-CD2 3.87Å; A561-F577 HydrophobicContact CB-CE2 4.18Å; A561-F577 HydrophobicContact CB-CG 4.02Å; A562-F577 HydrophobicContact CB-CB 3.84Å; A565-F577 HydrophobicContact CB-CD2 4.32Å; A565-F577 HydrophobicContact CB-CE2 4.43Å; Q573-F577 HydrophobicContact CB-CD2 4.29Å; Q573-F577 HydrophobicContact CB-CE2 3.95Å; Q573-F577 VanDerWaalsContact O-CD2 3.27Å; Q573-F577 WeakPolarHBondContact O-CD2 3.49Å; Q573-F577 PolarHBondContact O-N 3.48Å; F577-T580 PolarHBondContact O-N 3Å; F577-A581 WeakPolarHBondContact O-CB 3.33Å; F577-A581 PolarHBondContact O-N 2.95Å; F577-P606 HydrophobicContact CD1-CB 4.07Å; F577-P606 HydrophobicContact CE1-CB 3.8Å; F577-P606 HydrophobicContact CZ-CB 4.38Å
578	L	90.2	Very high	87.1	Confident	86 Å²	86	75 Å²	75	45%	0.45	38%	0.376	S	S	.	.	H	α-helix	trans	-72.6	-26.6	176.1	-170.7	141.6	0	0	0	113.3	A562 A574 V576 K582	A562-L578 HydrophobicContact CB-CB 4.07Å; A574-L578 WeakPolarHBondContact O-CB 3.36Å; A574-L578 PolarHBondContact O-N 3.43Å; V576-L578 VanDerWaalsContact C-N 3.27Å; V576-L578 PolarHBondContact O-N 3.42Å; L578-K582 HydrophobicContact CD2-CD 4.27Å; L578-K582 WeakPolarHBondContact O-CG 3.24Å; L578-K582 PolarHBondContact O-N 3.02Å
579	R	89.5	Confident	87.1	Confident	173 Å²	173	73.6 Å²	73.6	65%	0.653	37%	0.372	S	S	*	.	H	α-helix	trans	-70	-46.6	169.4	-171.6	-172.4	-64.3	137.1	-2.5	110.2	K575 V576 K582 G583	K575-R579 WeakPolarHBondContact O-CB 3.48Å; K575-R579 PolarHBondContact O-N 2.88Å; V576-R579 WeakPolarHBondContact O-CA 3.29Å; V576-R579 WeakPolarHBondContact O-CB 3.42Å; V576-R579 PolarHBondContact O-N 3.18Å; R579-K582 PolarHBondContact O-N 3.5Å; R579-K582 VanDerWaalsContact O-N 3.16Å; R579-G583 PolarHBondContact O-N 3.13Å
580	T	86.6	Confident	86.9	Confident	35 Å²	35	68.4 Å²	68.4	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-42.4	178.3	-46.1	0	0	0	0	111.9	F558 V576 F577 K582 G583 L584 P603	F558-T580 HydrophobicContact CD1-CG2 4.21Å; F558-T580 HydrophobicContact CD2-CG2 4.03Å; F558-T580 HydrophobicContact CE1-CG2 3.8Å; F558-T580 HydrophobicContact CE2-CG2 3.59Å; F558-T580 HydrophobicContact CG-CG2 4.32Å; F558-T580 HydrophobicContact CZ-CG2 3.47Å; F558-T580 VanDerWaalsContact CZ-CG2 3.47Å; V576-T580 PolarHBondContact O-N 2.88Å; V576-T580 PolarHBondContact O-OG1 3.3Å; V576-T580 VanDerWaalsContact O-OG1 3.11Å; F577-T580 PolarHBondContact O-N 3Å; T580-K582 PolarHBondContact O-N 3.39Å; T580-G583 PolarHBondContact O-N 3.35Å; T580-G583 VanDerWaalsContact O-N 3.07Å; T580-L584 PolarHBondContact O-N 3.18Å; T580-P603 HydrophobicContact CG2-CB 3.84Å; T580-P603 HydrophobicContact CG2-CG 3.45Å; T580-P603 VanDerWaalsContact CG2-CG 3.45Å
581	A	89.1	Confident	86.5	Confident	3 Å²	3	66 Å²	66	3%	0.025	34%	0.336	C	S	.	.	H	α-helix	trans	-56.1	-35.6	173.6	0	0	0	0	0	113.4	F558 M559 F577	F558-A581 HydrophobicContact CB-CB 3.74Å; M559-A581 HydrophobicContact CG-CB 3.8Å; F577-A581 WeakPolarHBondContact O-CB 3.33Å; F577-A581 PolarHBondContact O-N 2.95Å
582	K	89.3	Confident	86.2	Confident	132 Å²	132	67.6 Å²	67.6	57%	0.574	34%	0.337	S	S	*	.	H	α-helix	trans	-82.4	-24.4	176.9	-72	-177.7	173.8	-169.3	0	113.6	L578 R579 T580 L584 D585	L578-K582 HydrophobicContact CD2-CD 4.27Å; L578-K582 WeakPolarHBondContact O-CG 3.24Å; L578-K582 PolarHBondContact O-N 3.02Å; R579-K582 PolarHBondContact O-N 3.5Å; R579-K582 VanDerWaalsContact O-N 3.16Å; T580-K582 PolarHBondContact O-N 3.39Å; K582-L584 PolarHBondContact O-N 3.34Å; K582-D585 WeakPolarHBondContact CA-OD2 3.29Å; K582-D585 WeakPolarHBondContact O-CB 3.34Å; K582-D585 PolarHBondContact O-N 3.43Å
583	G	86.4	Confident	85.8	Confident	44 Å²	44	64.2 Å²	64.2	45%	0.454	33%	0.329	S	S	.	.	H	α-helix	trans	-62.3	-25.8	170.9	0	0	0	0	0	112.9	R579 T580 P586	R579-G583 PolarHBondContact O-N 3.13Å; T580-G583 PolarHBondContact O-N 3.35Å; T580-G583 VanDerWaalsContact O-N 3.07Å; G583-P586 WeakPolarHBondContact O-CD 3.41Å; G583-P586 WeakPolarHBondContact O-CG 3.4Å
584	L	87.4	Confident	85.1	Confident	1 Å²	1	62 Å²	62	1%	0.005	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-16.9	176.4	-63.3	169.2	0	0	0	113.7	R554 K555 F558 T580 K582 M587 I588 L602	R554-L584 HydrophobicContact CB-CD1 3.92Å; R554-L584 HydrophobicContact CG-CD1 3.66Å; R554-L584 HydrophobicContact CG-CD2 4.25Å; K555-L584 HydrophobicContact CB-CB 4.43Å; K555-L584 HydrophobicContact CB-CD1 4.02Å; F558-L584 HydrophobicContact CD2-CD1 3.93Å; F558-L584 HydrophobicContact CE2-CD1 4.28Å; T580-L584 PolarHBondContact O-N 3.18Å; K582-L584 PolarHBondContact O-N 3.34Å; L584-M587 HydrophobicContact CD2-SD 3.94Å; L584-M587 WeakPolarHBondContact O-CB 3.43Å; L584-M587 PolarHBondContact O-N 3.25Å; L584-M587 VanDerWaalsContact O-N 3.14Å; L584-I588 HydrophobicContact CB-CD1 4.43Å; L584-I588 WeakPolarHBondContact O-CG1 3.46Å; L584-I588 PolarHBondContact O-N 2.96Å; L584-L602 HydrophobicContact CD2-CD2 3.66Å
585	D	87.6	Confident	84.4	Confident	60 Å²	60	68 Å²	68	32%	0.321	36%	0.356	S	S	.	.	H	α-helix	trans	-56	-51.1	179.7	-73.8	-39.1	0	0	0	113.5	K555 K582 M587 I588 E589	K555-D585 WeakPolarHBondContact CE-OD1 3.5Å; K555-D585 IonicContact NZ-OD1 2.78Å; K555-D585 PolarHBondContact NZ-OD1 2.73Å; K582-D585 WeakPolarHBondContact CA-OD2 3.29Å; K582-D585 WeakPolarHBondContact O-CB 3.34Å; K582-D585 PolarHBondContact O-N 3.43Å; D585-M587 PolarHBondContact O-N 2.81Å; D585-I588 PolarHBondContact O-N 3.14Å; D585-E589 PolarHBondContact O-N 3.5Å
586	P	85.8	Confident	83.1	Confident	80 Å²	80	69.9 Å²	69.9	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-24.6	176.4	25.9	-36.1	0	0	0	113.6	G583 A590	G583-P586 WeakPolarHBondContact O-CD 3.41Å; G583-P586 WeakPolarHBondContact O-CG 3.4Å; P586-A590 VanDerWaalsContact O-CB 3.24Å; P586-A590 WeakPolarHBondContact O-CB 3.46Å; P586-A590 PolarHBondContact O-N 3.23Å
587	M	81.1	Confident	82.3	Confident	28 Å²	28	67.6 Å²	67.6	14%	0.138	36%	0.363	C	S	.	.	H	α-helix	trans	-73.6	-40.8	175.1	-61.7	177.1	84.8	0	0	111	L551 L584 D585 A590 A591 V597 T601 L602	L551-M587 HydrophobicContact CD1-CB 4.45Å; L551-M587 HydrophobicContact CD2-CB 4.17Å; L584-M587 HydrophobicContact CD2-SD 3.94Å; L584-M587 WeakPolarHBondContact O-CB 3.43Å; L584-M587 PolarHBondContact O-N 3.25Å; L584-M587 VanDerWaalsContact O-N 3.14Å; D585-M587 PolarHBondContact O-N 2.81Å; M587-A590 PolarHBondContact O-N 3.19Å; M587-A591 WeakPolarHBondContact O-CB 3.18Å; M587-A591 PolarHBondContact O-N 3.35Å; M587-V597 HydrophobicContact CB-CG1 4.09Å; M587-V597 HydrophobicContact CE-CG1 3.45Å; M587-V597 VanDerWaalsContact CE-CG1 3.45Å; M587-V597 HydrophobicContact CG-CG1 4.2Å; M587-T601 WeakPolarHBondContact CE-OG1 3.43Å; M587-L602 HydrophobicContact CE-CD2 3.43Å; M587-L602 VanDerWaalsContact CE-CD2 3.43Å; M587-L602 HydrophobicContact CE-CG 4.04Å; M587-L602 HydrophobicContact SD-CD2 3.93Å
588	I	85.2	Confident	81	Confident	7 Å²	7	69.9 Å²	69.9	4%	0.036	38%	0.378	C	S	.	.	H	α-helix	trans	-63.5	-44.3	172.9	-67	162.2	0	0	0	110.2	L548 L551 K555 L584 D585 A591 R592	L548-I588 HydrophobicContact CD1-CG2 3.94Å; L551-I588 HydrophobicContact CB-CD1 4.46Å; L551-I588 HydrophobicContact CB-CG1 3.6Å; L551-I588 HydrophobicContact CD1-CG1 4.49Å; K555-I588 HydrophobicContact CB-CD1 4.12Å; K555-I588 HydrophobicContact CD-CD1 3.42Å; K555-I588 VanDerWaalsContact CD-CD1 3.42Å; K555-I588 HydrophobicContact CG-CD1 4.44Å; L584-I588 HydrophobicContact CB-CD1 4.43Å; L584-I588 WeakPolarHBondContact O-CG1 3.46Å; L584-I588 PolarHBondContact O-N 2.96Å; D585-I588 PolarHBondContact O-N 3.14Å; I588-A591 PolarHBondContact O-N 2.96Å; I588-R592 WeakPolarHBondContact O-CG 3.44Å; I588-R592 PolarHBondContact O-N 3.4Å
589	E	86.4	Confident	79.7	Confident	145 Å²	145	71 Å²	71	68%	0.678	38%	0.383	S	S	*	.	H	α-helix	trans	-64.8	-41.7	177.5	-169.9	167.8	-158.5	0	0	112.1	D585 R592 S593	D585-E589 PolarHBondContact O-N 3.5Å; E589-R592 PolarHBondContact O-N 3.27Å; E589-S593 PolarHBondContact O-N 3.09Å
590	A	82.7	Confident	78.2	Confident	26 Å²	26	67.4 Å²	67.4	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-60.2	-45.8	172.7	0	0	0	0	0	112.5	P586 M587 S593 G594 K595 V597	P586-A590 VanDerWaalsContact O-CB 3.24Å; P586-A590 WeakPolarHBondContact O-CB 3.46Å; P586-A590 PolarHBondContact O-N 3.23Å; M587-A590 PolarHBondContact O-N 3.19Å; A590-S593 WeakPolarHBondContact CA-OG 3.42Å; A590-S593 CarbonylContact O-C 3.54Å; A590-S593 WeakPolarHBondContact O-CA 3.47Å; A590-S593 PolarHBondContact O-N 3.5Å; A590-S593 VanDerWaalsContact O-N 3.15Å; A590-S593 PolarHBondContact O-OG 2.92Å; A590-G594 PolarHBondContact O-N 2.89Å; A590-K595 HydrophobicContact CB-CB 4.5Å; A590-K595 WeakPolarHBondContact O-CB 3.47Å; A590-K595 PolarHBondContact O-N 2.66Å; A590-V597 HydrophobicContact CB-CG2 3.89Å
591	A	81	Confident	77.2	Confident	2 Å²	2	69.9 Å²	69.9	2%	0.017	40%	0.399	C	S	.	.	H	α-helix	trans	-64.2	-39.4	177.3	0	0	0	0	0	112.6	L548 L551 M587 I588 S593 G594 V597	L548-A591 HydrophobicContact CD1-CB 4.25Å; L551-A591 HydrophobicContact CD1-CB 3.71Å; M587-A591 WeakPolarHBondContact O-CB 3.18Å; M587-A591 PolarHBondContact O-N 3.35Å; I588-A591 PolarHBondContact O-N 2.96Å; A591-S593 VanDerWaalsContact C-N 3.3Å; A591-S593 PolarHBondContact O-N 2.81Å; A591-G594 PolarHBondContact O-N 2.61Å; A591-G594 VanDerWaalsContact O-N 3.07Å; A591-V597 HydrophobicContact CB-CG2 4.19Å
592	R	80.6	Confident	76.2	Confident	123 Å²	123	71.1 Å²	71.1	46%	0.464	41%	0.406	S	S	.	.	H	α-helix	trans	-63.8	-35.5	172	-69.7	-178.1	-170	175.4	6	112	L548 D552 I588 E589 G594	L548-R592 HydrophobicContact CD1-CG 3.45Å; L548-R592 VanDerWaalsContact CD1-CG 3.45Å; L548-R592 HydrophobicContact CD2-CG 4.11Å; L548-R592 HydrophobicContact CG-CG 4.44Å; D552-R592 IonicContact OD1-NH2 2.63Å; D552-R592 IonicContact OD2-CZ 3.91Å; D552-R592 IonicContact OD2-NH2 2.62Å; D552-R592 PolarHBondContact OD2-NH2 2.88Å; I588-R592 WeakPolarHBondContact O-CG 3.44Å; I588-R592 PolarHBondContact O-N 3.4Å; E589-R592 PolarHBondContact O-N 3.27Å; R592-G594 PolarHBondContact O-N 3.08Å; R592-G594 VanDerWaalsContact O-N 3.14Å
593	S	78.2	Confident	75.2	Confident	69 Å²	69	67.1 Å²	67.1	48%	0.483	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	9.9	172.2	78.3	0	0	0	0	114.8	E589 A590 A591 K595	E589-S593 PolarHBondContact O-N 3.09Å; A590-S593 WeakPolarHBondContact CA-OG 3.42Å; A590-S593 CarbonylContact O-C 3.54Å; A590-S593 WeakPolarHBondContact O-CA 3.47Å; A590-S593 PolarHBondContact O-N 3.5Å; A590-S593 VanDerWaalsContact O-N 3.15Å; A590-S593 PolarHBondContact O-OG 2.92Å; A591-S593 VanDerWaalsContact C-N 3.3Å; A591-S593 PolarHBondContact O-N 2.81Å; S593-K595 VanDerWaalsContact C-N 3.26Å; S593-K595 PolarHBondContact O-N 2.7Å; S593-K595 WeakPolarHBondContact OG-CG 3.28Å
594	G	69	Low	74.4	Confident	53 Å²	53	67.9 Å²	67.9	55%	0.546	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	10.5	178.6	0	0	0	0	0	115.2	A590 A591 R592	A590-G594 PolarHBondContact O-N 2.89Å; A591-G594 PolarHBondContact O-N 2.61Å; A591-G594 VanDerWaalsContact O-N 3.07Å; R592-G594 PolarHBondContact O-N 3.08Å; R592-G594 VanDerWaalsContact O-N 3.14Å
595	K	71.6	Confident	73.6	Confident	138 Å²	138	69.8 Å²	69.8	60%	0.6	40%	0.404	S	S	*	.			trans	-82.9	140.8	179.9	-64.6	177.4	-176.1	175	0	110.8	A590 S593 V597	A590-K595 HydrophobicContact CB-CB 4.5Å; A590-K595 WeakPolarHBondContact O-CB 3.47Å; A590-K595 PolarHBondContact O-N 2.66Å; S593-K595 VanDerWaalsContact C-N 3.26Å; S593-K595 PolarHBondContact O-N 2.7Å; S593-K595 WeakPolarHBondContact OG-CG 3.28Å; K595-V597 PolarHBondContact O-N 2.83Å
596	T	58.9	Low	72.3	Confident	146 Å²	146	68.6 Å²	68.6	90%	0.896	40%	0.399	S	S	*	.			trans	-65.5	121.3	170.4	41.9	0	0	0	0	109.8
597	V	70.8	Confident	71	Confident	24 Å²	24	67.5 Å²	67.5	15%	0.145	40%	0.402	C	S	.	.			trans	-104.4	131.8	176.6	-176.1	0	0	0	0	108.4	L547 M587 A590 A591 K595 I599	L547-V597 HydrophobicContact CD2-CB 4.21Å; M587-V597 HydrophobicContact CB-CG1 4.09Å; M587-V597 HydrophobicContact CE-CG1 3.45Å; M587-V597 VanDerWaalsContact CE-CG1 3.45Å; M587-V597 HydrophobicContact CG-CG1 4.2Å; A590-V597 HydrophobicContact CB-CG2 3.89Å; A591-V597 HydrophobicContact CB-CG2 4.19Å; K595-V597 PolarHBondContact O-N 2.83Å; V597-I599 PolarHBondContact O-N 3.18Å; V597-I599 VanDerWaalsContact O-N 3.15Å
598	D	63.4	Low	69.2	Low	93 Å²	93	71.1 Å²	71.1	50%	0.497	42%	0.422	S	S	.	.			trans	-70	109.4	-180	-173.2	-13.1	0	0	0	111.1	S600 T601	D598-S600 PolarHBondContact O-N 2.83Å; D598-S600 VanDerWaalsContact OD1-CB 3.29Å; D598-S600 WeakPolarHBondContact OD1-CB 3.43Å; D598-S600 PolarHBondContact OD1-N 2.8Å; D598-S600 PolarHBondContact OD1-OG 3.15Å; D598-S600 PolarHBondContact OD2-OG 3.32Å; D598-T601 HydrophobicContact CB-CG2 4.09Å; D598-T601 PolarHBondContact O-N 2.54Å; D598-T601 VanDerWaalsContact O-N 3.16Å; D598-T601 PolarHBondContact O-OG1 2.9Å
599	I	63.4	Low	67.4	Low	109 Å²	109	78.2 Å²	78.2	56%	0.559	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-62.8	-27.1	-178.2	-57.5	177.2	0	0	0	111.2	L547 V597 T601 L602	L547-I599 HydrophobicContact CD1-CD1 4.4Å; L547-I599 HydrophobicContact CD1-CG1 4.1Å; V597-I599 PolarHBondContact O-N 3.18Å; V597-I599 VanDerWaalsContact O-N 3.15Å; I599-T601 PolarHBondContact O-N 3.14Å; I599-L602 HydrophobicContact CG2-CD1 4.12Å; I599-L602 WeakPolarHBondContact O-CB 3.38Å; I599-L602 PolarHBondContact O-N 2.9Å
600	S	56.8	Low	65.5	Low	98 Å²	98	79.8 Å²	79.8	69%	0.685	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-68	-18.2	178.6	74	0	0	0	0	113.6	D598 L602	D598-S600 PolarHBondContact O-N 2.83Å; D598-S600 VanDerWaalsContact OD1-CB 3.29Å; D598-S600 WeakPolarHBondContact OD1-CB 3.43Å; D598-S600 PolarHBondContact OD1-N 2.8Å; D598-S600 PolarHBondContact OD1-OG 3.15Å; D598-S600 PolarHBondContact OD2-OG 3.32Å; S600-L602 VanDerWaalsContact C-N 3.3Å; S600-L602 PolarHBondContact O-N 2.99Å
601	T	66.6	Low	63.7	Low	86 Å²	86	85.4 Å²	85.4	53%	0.528	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-85.7	2	178.8	66.2	0	0	0	0	113.9	M587 D598 I599 P603	M587-T601 WeakPolarHBondContact CE-OG1 3.43Å; D598-T601 HydrophobicContact CB-CG2 4.09Å; D598-T601 PolarHBondContact O-N 2.54Å; D598-T601 VanDerWaalsContact O-N 3.16Å; D598-T601 PolarHBondContact O-OG1 2.9Å; I599-T601 PolarHBondContact O-N 3.14Å; T601-P603 WeakPolarHBondContact O-CD 3.16Å
602	L	68.9	Low	61.8	Low	30 Å²	30	92.3 Å²	92.3	16%	0.157	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-81.3	122.1	-176.3	-69.4	171.9	0	0	0	112.6	L550 L551 L584 M587 I599 S600	L550-L602 HydrophobicContact CD2-CD1 4.48Å; L551-L602 HydrophobicContact CD2-CD1 4.19Å; L551-L602 HydrophobicContact CD2-CD2 3.39Å; L551-L602 HydrophobicContact CD2-CG 4.41Å; L584-L602 HydrophobicContact CD2-CD2 3.66Å; M587-L602 HydrophobicContact CE-CD2 3.43Å; M587-L602 VanDerWaalsContact CE-CD2 3.43Å; M587-L602 HydrophobicContact CE-CG 4.04Å; M587-L602 HydrophobicContact SD-CD2 3.93Å; I599-L602 HydrophobicContact CG2-CD1 4.12Å; I599-L602 WeakPolarHBondContact O-CB 3.38Å; I599-L602 PolarHBondContact O-N 2.9Å; S600-L602 VanDerWaalsContact C-N 3.3Å; S600-L602 PolarHBondContact O-N 2.99Å
603	P	67.3	Low	59.7	Low	47 Å²	47	95.7 Å²	95.7	31%	0.305	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-67	137.1	178.1	25.5	-32.9	0	0	0	111.8	R554 F558 T580 T601	R554-P603 PolarHBondContact NE-O 2.93Å; R554-P603 PolarHBondContact NH2-O 2.85Å; F558-P603 HydrophobicContact CE2-CB 4.38Å; F558-P603 HydrophobicContact CE2-CG 3.94Å; F558-P603 HydrophobicContact CZ-CB 4.1Å; F558-P603 HydrophobicContact CZ-CG 4.15Å; T580-P603 HydrophobicContact CG2-CB 3.84Å; T580-P603 HydrophobicContact CG2-CG 3.45Å; T580-P603 VanDerWaalsContact CG2-CG 3.45Å; T601-P603 WeakPolarHBondContact O-CD 3.16Å
604	S	70.1	Confident	57.8	Low	61 Å²	61	99.3 Å²	99.3	43%	0.427	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-56.6	154.9	-173.7	-55.9	0	0	0	0	114.7	R554 F558	R554-S604 PolarHBondContact NH2-O 2.9Å; F558-S604 VanDerWaalsContact CZ-O 3.29Å; F558-S604 WeakPolarHBondContact CZ-O 3.19Å
605	P	70.2	Confident	56.3	Low	40 Å²	40	104.3 Å²	104.3	26%	0.26	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-52.7	131.9	179.6	-29.2	39.3	0	0	0	113.3	G607 D608	P605-G607 PolarHBondContact O-N 3.27Å; P605-D608 HydrophobicContact CB-CB 4.19Å; P605-D608 WeakPolarHBondContact CB-OD2 3.47Å; P605-D608 WeakPolarHBondContact CD-OD2 3.48Å; P605-D608 WeakPolarHBondContact CG-OD2 3.41Å; P605-D608 PolarHBondContact O-N 3.06Å
606	P	61.1	Low	54.7	Low	36 Å²	36	101.9 Å²	101.9	23%	0.234	57%	0.567	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.7	86.9	174.6	29.8	-34.4	0	0	0	109.1	Q557 F558 A561 F577	Q557-P606 HydrophobicContact CB-CG 4.23Å; F558-P606 HydrophobicContact CD1-CB 3.81Å; F558-P606 HydrophobicContact CD1-CG 3.67Å; F558-P606 HydrophobicContact CE1-CB 3.8Å; F558-P606 HydrophobicContact CE1-CG 3.89Å; F558-P606 HydrophobicContact CG-CG 4.19Å; A561-P606 HydrophobicContact CB-CB 3.78Å; A561-P606 HydrophobicContact CB-CG 3.92Å; F577-P606 HydrophobicContact CD1-CB 4.07Å; F577-P606 HydrophobicContact CE1-CB 3.8Å; F577-P606 HydrophobicContact CZ-CB 4.38Å
607	G	57.3	Low	53.6	Low	56 Å²	56	102.4 Å²	102.4	58%	0.577	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.4	-29.6	-169.1	0	0	0	0	0	113	P605	P605-G607 PolarHBondContact O-N 3.27Å
608	D	44.7	Very low	52	Low	105 Å²	105	108.3 Å²	108.3	56%	0.561	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-90.4	-6.8	-173.7	-64.9	7.2	0	0	0	113.2	P605 E610	P605-D608 HydrophobicContact CB-CB 4.19Å; P605-D608 WeakPolarHBondContact CB-OD2 3.47Å; P605-D608 WeakPolarHBondContact CD-OD2 3.48Å; P605-D608 WeakPolarHBondContact CG-OD2 3.41Å; P605-D608 PolarHBondContact O-N 3.06Å; D608-E610 VanDerWaalsContact C-N 3.31Å; D608-E610 PolarHBondContact O-N 3.02Å
609	E	47.4	Very low	50.6	Low	156 Å²	156	107.8 Å²	107.8	73%	0.729	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-86	8.4	-178.7	-64.8	-176.3	166.5	0	0	114
610	E	46.2	Very low	49.5	Very low	178 Å²	178	110.1 Å²	110.1	83%	0.832	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-107.3	-11.9	177.1	-75.6	-168.2	-143.1	0	0	115.4	D608	D608-E610 VanDerWaalsContact C-N 3.31Å; D608-E610 PolarHBondContact O-N 3.02Å
611	D	44.1	Very low	48.4	Very low	144 Å²	144	111.5 Å²	111.5	77%	0.77	61%	0.605	S	S	*	*	S	Bend	trans	-112.1	-16.1	-169.1	-84.7	-42.8	0	0	0	117
612	D	42.3	Very low	47	Very low	147 Å²	147	115.2 Å²	115.2	79%	0.786	62%	0.617	S	S	*	*	S	Bend	trans	-120	11.9	-167.3	-119	-17.6	0	0	0	116.7
613	F	35.4	Very low	45.9	Very low	194 Å²	194	119.9 Å²	119.9	85%	0.851	65%	0.646	S	S	*	*			trans	-141.7	87.1	172.5	-92.7	-80.5	0	0	0	113.9	L615	F613-L615 PolarHBondContact O-N 3.05Å
614	I	37.3	Very low	44.6	Very low	145 Å²	145	121.4 Å²	121.4	74%	0.744	66%	0.658	S	S	*	*			trans	-89.2	71.7	167.8	-44.5	-176.6	0	0	0	110.5	V616	I614-V616 HydrophobicContact CG2-CG2 3.59Å; I614-V616 PolarHBondContact O-N 3.27Å
615	L	38.5	Very low	43.7	Very low	158 Å²	158	127 Å²	127	83%	0.827	68%	0.678	S	S	*	*			trans	-77	85.1	169.1	-166.7	82.1	0	0	0	109.7	F613 H617	F613-L615 PolarHBondContact O-N 3.05Å; L615-H617 PolarHBondContact O-N 3.19Å
616	V	37.9	Very low	43.1	Very low	87 Å²	87	133 Å²	133	53%	0.527	70%	0.699	S	S	.	*			trans	-69.4	94.1	-179.1	-167.5	0	0	0	0	110.9	I614 H618	I614-V616 HydrophobicContact CG2-CG2 3.59Å; I614-V616 PolarHBondContact O-N 3.27Å; V616-H618 VanDerWaalsContact CG1-CE1 3.44Å; V616-H618 WeakPolarHBondContact CG1-CE1 3.43Å; V616-H618 WeakPolarHBondContact CG1-ND1 3.23Å; V616-H618 PolarHBondContact O-N 3.05Å
617	H	36.2	Very low	43.4	Very low	157 Å²	157	132.6 Å²	132.6	73%	0.727	70%	0.699	S	S	*	*			trans	-72.7	95.4	166.2	-170.8	-73.7	0	0	0	109.4	L615 S619	L615-H617 PolarHBondContact O-N 3.19Å; H617-S619 PolarHBondContact CE1-OG 2.93Å; H617-S619 PolarHBondContact ND1-OG 3.17Å; H617-S619 PolarHBondContact O-N 2.83Å
618	H	36.3	Very low	44.3	Very low	148 Å²	148	131.5 Å²	131.5	69%	0.685	69%	0.688	S	S	*	*			trans	-65	98.8	-178.6	-59.5	-63.8	0	0	0	111.6	V616	V616-H618 VanDerWaalsContact CG1-CE1 3.44Å; V616-H618 WeakPolarHBondContact CG1-CE1 3.43Å; V616-H618 WeakPolarHBondContact CG1-ND1 3.23Å; V616-H618 PolarHBondContact O-N 3.05Å
619	S	34.6	Very low	46.1	Very low	81 Å²	81	130.4 Å²	130.4	57%	0.566	69%	0.687	S	S	*	*			trans	-151.7	73	171.5	-61.9	0	0	0	0	110.7	H617	H617-S619 PolarHBondContact CE1-OG 2.93Å; H617-S619 PolarHBondContact ND1-OG 3.17Å; H617-S619 PolarHBondContact O-N 2.83Å
620	D	39.4	Very low	47.9	Very low	158 Å²	158	125 Å²	125	85%	0.845	67%	0.665	S	S	*	*			trans	53.8	149.8	158.2	-56.1	-31.4	0	0	0	121.9
621	V	35.5	Very low	49.9	Very low	127 Å²	127	117 Å²	117	77%	0.77	63%	0.626	S	S	*	*			trans	80.9	125.3	168.2	-174.6	0	0	0	0	117.1
622	Q	35.5	Very low	52.1	Low	165 Å²	165	114.4 Å²	114.4	77%	0.771	62%	0.616	S	S	*	*			trans	72	100.7	171.9	-73.1	170.6	65.6	0	0	118.1	S624	Q622-S624 VanDerWaalsContact C-N 3.32Å; Q622-S624 PolarHBondContact O-N 3.23Å
623	V	45.9	Very low	54.3	Low	127 Å²	127	113.3 Å²	113.3	77%	0.77	61%	0.606	S	S	*	*			trans	-68.8	87.2	160.9	-178.7	0	0	0	0	108.6
624	S	40.3	Very low	56.9	Low	80 Å²	80	104.3 Å²	104.3	56%	0.559	57%	0.567	S	S	*	*			trans	-102.2	102.9	-170.2	-171.5	0	0	0	0	112.5	Q622 K626	Q622-S624 VanDerWaalsContact C-N 3.32Å; Q622-S624 PolarHBondContact O-N 3.23Å; S624-K626 VanDerWaalsContact C-N 3.25Å; S624-K626 PolarHBondContact O-N 3.16Å
625	E	51.8	Low	59.4	Low	179 Å²	179	98.1 Å²	98.1	84%	0.836	54%	0.537	S	S	*	.	S	Bend	trans	43.2	-39.7	162.5	-63	-173.4	121.1	0	0	121.1	A627	E625-A627 VanDerWaalsContact C-N 3.27Å; E625-A627 PolarHBondContact O-N 3.13Å
626	K	56.9	Low	62	Low	164 Å²	164	94 Å²	94	71%	0.713	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.4	-176.6	-66.3	-167.8	175.4	-168.1	0	114.8	S624 G628 P629 V630	S624-K626 VanDerWaalsContact C-N 3.25Å; S624-K626 PolarHBondContact O-N 3.16Å; K626-G628 PolarHBondContact O-N 3.4Å; K626-P629 WeakPolarHBondContact O-CD 3.46Å; K626-P629 WeakPolarHBondContact O-CG 3.33Å; K626-V630 WeakPolarHBondContact O-CG2 3.26Å
627	A	66.8	Low	64.6	Low	28 Å²	28	91.8 Å²	91.8	23%	0.231	51%	0.506	C	S	.	.	H	α-helix	trans	-66.5	-36.1	178.6	0	0	0	0	0	113	E625 V630 Y631 P688	E625-A627 VanDerWaalsContact C-N 3.27Å; E625-A627 PolarHBondContact O-N 3.13Å; A627-V630 PolarHBondContact O-N 3.09Å; A627-Y631 VanDerWaalsContact O-CD2 3.27Å; A627-Y631 WeakPolarHBondContact O-CD2 3.4Å; A627-Y631 PolarHBondContact O-N 3.27Å; A627-P688 HydrophobicContact CB-CG 4.36Å
628	G	76.8	Confident	67.3	Low	34 Å²	34	84.4 Å²	84.4	35%	0.351	47%	0.471	S	S	.	.	H	α-helix	trans	-56.9	-55.1	-179.7	0	0	0	0	0	114.6	K626 V630 Y631 T632	K626-G628 PolarHBondContact O-N 3.4Å; G628-V630 VanDerWaalsContact C-N 3.34Å; G628-V630 PolarHBondContact O-N 3.44Å; G628-Y631 WeakPolarHBondContact O-CB 3.29Å; G628-Y631 PolarHBondContact O-N 3.12Å; G628-T632 PolarHBondContact O-N 2.99Å; G628-T632 PolarHBondContact O-OG1 3.28Å
629	P	83.6	Confident	70	Confident	82 Å²	82	83.1 Å²	83.1	53%	0.532	46%	0.464	S	S	.	.	H	α-helix	trans	-63.5	-35.8	177.8	22.1	-32.4	0	0	0	113.1	K626 T632 Q633	K626-P629 WeakPolarHBondContact O-CD 3.46Å; K626-P629 WeakPolarHBondContact O-CG 3.33Å; P629-T632 PolarHBondContact O-N 3.47Å; P629-Q633 WeakPolarHBondContact O-CB 3.31Å; P629-Q633 PolarHBondContact O-N 3.21Å
630	V	84.9	Confident	72.9	Confident	43 Å²	43	84 Å²	84	26%	0.261	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-46.4	174.2	174.5	0	0	0	0	110.7	K626 A627 G628 T632 Q633 L634 P688	K626-V630 WeakPolarHBondContact O-CG2 3.26Å; A627-V630 PolarHBondContact O-N 3.09Å; G628-V630 VanDerWaalsContact C-N 3.34Å; G628-V630 PolarHBondContact O-N 3.44Å; V630-T632 VanDerWaalsContact C-N 3.33Å; V630-T632 PolarHBondContact O-N 3.31Å; V630-Q633 PolarHBondContact O-N 3.17Å; V630-L634 HydrophobicContact CG1-CD1 3.77Å; V630-L634 HydrophobicContact CG1-CG 4.28Å; V630-L634 WeakPolarHBondContact O-CB 3.42Å; V630-L634 VanDerWaalsContact O-CG 3.27Å; V630-L634 WeakPolarHBondContact O-CG 3.32Å; V630-L634 PolarHBondContact O-N 2.9Å; V630-P688 HydrophobicContact CB-CG 4.35Å; V630-P688 HydrophobicContact CG1-CB 4.06Å; V630-P688 HydrophobicContact CG1-CG 3.94Å
631	Y	87.9	Confident	75.4	Confident	8 Å²	8	76.8 Å²	76.8	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-56.6	-45	172.7	-90	-64.8	0	0	0	112.4	A627 G628 C635 L678 A681 Q682 L686 P687 P688	A627-Y631 VanDerWaalsContact O-CD2 3.27Å; A627-Y631 WeakPolarHBondContact O-CD2 3.4Å; A627-Y631 PolarHBondContact O-N 3.27Å; G628-Y631 WeakPolarHBondContact O-CB 3.29Å; G628-Y631 PolarHBondContact O-N 3.12Å; Y631-C635 VanDerWaalsContact O-CB 3.28Å; Y631-C635 WeakPolarHBondContact O-CB 3.4Å; Y631-C635 PolarHBondContact O-N 3.27Å; Y631-L678 HydrophobicContact CD1-CD1 4.25Å; Y631-L678 HydrophobicContact CD1-CD2 3.93Å; Y631-L678 HydrophobicContact CD1-CG 3.73Å; Y631-L678 HydrophobicContact CE1-CD1 4.34Å; Y631-L678 HydrophobicContact CE1-CG 3.95Å; Y631-L678 WeakPolarHBondContact CE1-O 3.46Å; Y631-L678 WeakPolarHBondContact O-CD2 3.36Å; Y631-A681 HydrophobicContact CE1-CB 4.11Å; Y631-A681 VanDerWaalsContact OH-C 3.31Å; Y631-A681 VanDerWaalsContact OH-CB 3.22Å; Y631-A681 WeakPolarHBondContact OH-CB 3.46Å; Y631-Q682 HydrophobicContact CD1-CB 3.84Å; Y631-Q682 HydrophobicContact CD1-CG 4.25Å; Y631-Q682 HydrophobicContact CD2-CB 4.43Å; Y631-Q682 HydrophobicContact CD2-CG 4.24Å; Y631-Q682 HydrophobicContact CE1-CB 3.85Å; Y631-Q682 HydrophobicContact CE2-CB 4.43Å; Y631-Q682 HydrophobicContact CG-CB 4.15Å; Y631-Q682 HydrophobicContact CG-CG 4.05Å; Y631-L686 WeakPolarHBondContact CE2-O 3.41Å; Y631-L686 PolarHBondContact OH-O 3.32Å; Y631-P687 VanDerWaalsContact OH-C 3.29Å; Y631-P687 PolarHBondContact OH-O 2.98Å; Y631-P687 VanDerWaalsContact OH-O 3.07Å; Y631-P688 HydrophobicContact CD2-CG 4.03Å; Y631-P688 HydrophobicContact CE2-CB 4.45Å; Y631-P688 HydrophobicContact CE2-CG 3.82Å
632	T	89.4	Confident	78.2	Confident	90 Å²	90	72.9 Å²	72.9	55%	0.552	39%	0.394	S	S	*	.	H	α-helix	trans	-63	-43.5	177.9	-58.8	0	0	0	0	112.3	G628 P629 V630 C635 S636	G628-T632 PolarHBondContact O-N 2.99Å; G628-T632 PolarHBondContact O-OG1 3.28Å; P629-T632 PolarHBondContact O-N 3.47Å; V630-T632 VanDerWaalsContact C-N 3.33Å; V630-T632 PolarHBondContact O-N 3.31Å; T632-C635 WeakPolarHBondContact O-CB 3.38Å; T632-C635 PolarHBondContact O-N 3.31Å; T632-S636 WeakPolarHBondContact O-CB 3.38Å; T632-S636 PolarHBondContact O-N 2.98Å
633	Q	89.8	Confident	80.9	Confident	124 Å²	124	71.4 Å²	71.4	58%	0.579	39%	0.387	S	S	*	.	H	α-helix	trans	-65.4	-48	179.4	-175.6	176.3	-0.7	0	0	111.7	P629 V630 C635 S636 I637	P629-Q633 WeakPolarHBondContact O-CB 3.31Å; P629-Q633 PolarHBondContact O-N 3.21Å; V630-Q633 PolarHBondContact O-N 3.17Å; Q633-C635 VanDerWaalsContact C-N 3.33Å; Q633-C635 PolarHBondContact O-N 3.49Å; Q633-S636 WeakPolarHBondContact O-CB 3.34Å; Q633-S636 PolarHBondContact O-N 2.93Å; Q633-I637 HydrophobicContact CG-CD1 4.08Å; Q633-I637 WeakPolarHBondContact O-CG1 3.45Å; Q633-I637 PolarHBondContact O-N 3.21Å
634	L	90.2	Very high	83.1	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-40.1	175.8	-64.8	172.4	0	0	0	111.5	V630 S636 L638 L678 P688 L862	V630-L634 HydrophobicContact CG1-CD1 3.77Å; V630-L634 HydrophobicContact CG1-CG 4.28Å; V630-L634 WeakPolarHBondContact O-CB 3.42Å; V630-L634 VanDerWaalsContact O-CG 3.27Å; V630-L634 WeakPolarHBondContact O-CG 3.32Å; V630-L634 PolarHBondContact O-N 2.9Å; L634-S636 VanDerWaalsContact C-N 3.33Å; L634-S636 PolarHBondContact O-N 3.28Å; L634-L638 WeakPolarHBondContact O-CB 3.49Å; L634-L638 WeakPolarHBondContact O-CG 3.41Å; L634-L638 PolarHBondContact O-N 3.4Å; L634-L678 HydrophobicContact CB-CD1 3.83Å; L634-L678 HydrophobicContact CB-CD2 3.87Å; L634-L678 HydrophobicContact CD1-CD1 3.86Å; L634-P688 HydrophobicContact CD1-CB 4.38Å; L634-L862 HydrophobicContact CB-CD2 4.39Å; L634-L862 HydrophobicContact CD2-CD1 3.78Å; L634-L862 HydrophobicContact CD2-CD2 3.58Å; L634-L862 HydrophobicContact CD2-CG 4.33Å
635	C	90	Very high	85.5	Confident	15 Å²	15	64 Å²	64	10%	0.101	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-42.2	170.5	-107.2	0	0	0	0	112.3	Y631 T632 Q633 K639 L678	Y631-C635 VanDerWaalsContact O-CB 3.28Å; Y631-C635 WeakPolarHBondContact O-CB 3.4Å; Y631-C635 PolarHBondContact O-N 3.27Å; T632-C635 WeakPolarHBondContact O-CB 3.38Å; T632-C635 PolarHBondContact O-N 3.31Å; Q633-C635 VanDerWaalsContact C-N 3.33Å; Q633-C635 PolarHBondContact O-N 3.49Å; C635-K639 WeakPolarHBondContact O-CB 3.32Å; C635-K639 WeakPolarHBondContact O-CD 3.23Å; C635-K639 WeakPolarHBondContact O-CG 3.25Å; C635-K639 PolarHBondContact O-N 3.22Å; C635-L678 HydrophobicContact CB-CD2 4.13Å
636	S	93.3	Very high	87.4	Confident	71 Å²	71	58.6 Å²	58.6	50%	0.497	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-46.2	-178.5	-161.7	0	0	0	0	111.4	T632 Q633 L634 K639 E640	T632-S636 WeakPolarHBondContact O-CB 3.38Å; T632-S636 PolarHBondContact O-N 2.98Å; Q633-S636 WeakPolarHBondContact O-CB 3.34Å; Q633-S636 PolarHBondContact O-N 2.93Å; L634-S636 VanDerWaalsContact C-N 3.33Å; L634-S636 PolarHBondContact O-N 3.28Å; S636-K639 PolarHBondContact O-N 3.01Å; S636-E640 PolarHBondContact O-N 2.96Å
637	I	92.1	Very high	89	Confident	41 Å²	41	53.5 Å²	53.5	21%	0.21	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-45.7	179	-61.9	165	0	0	0	110.2	Q633 K639 E640 Q641 F693 L862	Q633-I637 HydrophobicContact CG-CD1 4.08Å; Q633-I637 WeakPolarHBondContact O-CG1 3.45Å; Q633-I637 PolarHBondContact O-N 3.21Å; I637-K639 VanDerWaalsContact C-N 3.31Å; I637-K639 PolarHBondContact O-N 2.97Å; I637-E640 PolarHBondContact O-N 3.34Å; I637-Q641 HydrophobicContact CG2-CG 4.34Å; I637-Q641 WeakPolarHBondContact O-CB 3.33Å; I637-Q641 VanDerWaalsContact O-CG 3.27Å; I637-Q641 WeakPolarHBondContact O-CG 3.46Å; I637-Q641 PolarHBondContact O-N 3.29Å; I637-Q641 PolarHBondContact O-OE1 2.89Å; I637-F693 HydrophobicContact CD1-CE1 4.43Å; I637-F693 HydrophobicContact CD1-CZ 4.31Å; I637-L862 HydrophobicContact CB-CD2 3.81Å; I637-L862 HydrophobicContact CD1-CD2 4.4Å; I637-L862 HydrophobicContact CG2-CB 3.71Å; I637-L862 HydrophobicContact CG2-CD2 3.71Å; I637-L862 HydrophobicContact CG2-CG 4.38Å
638	L	92.6	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-31.7	177.2	-78	165.1	0	0	0	113.6	L634 H642 C671 L675 L862 I864	L634-L638 WeakPolarHBondContact O-CB 3.49Å; L634-L638 WeakPolarHBondContact O-CG 3.41Å; L634-L638 PolarHBondContact O-N 3.4Å; L638-H642 VanDerWaalsContact O-CB 3.25Å; L638-H642 WeakPolarHBondContact O-CB 3.42Å; L638-H642 PolarHBondContact O-N 3.49Å; L638-C671 HydrophobicContact CD2-CB 4.44Å; L638-L675 HydrophobicContact CB-CB 4.25Å; L638-L675 HydrophobicContact CB-CG 4.14Å; L638-L862 HydrophobicContact CG-CD2 4.05Å; L638-I864 HydrophobicContact CD1-CD1 3.81Å; L638-I864 HydrophobicContact CD1-CG1 4.26Å
639	K	93.6	Very high	90.7	Very high	121 Å²	121	52.4 Å²	52.4	53%	0.526	27%	0.274	S	S	.	.	H	α-helix	trans	-66.2	-49.9	171.3	-76.5	169.4	-177.5	-178.7	0	111.3	C635 S636 I637 Q641 H642 E643 L675	C635-K639 WeakPolarHBondContact O-CB 3.32Å; C635-K639 WeakPolarHBondContact O-CD 3.23Å; C635-K639 WeakPolarHBondContact O-CG 3.25Å; C635-K639 PolarHBondContact O-N 3.22Å; S636-K639 PolarHBondContact O-N 3.01Å; I637-K639 VanDerWaalsContact C-N 3.31Å; I637-K639 PolarHBondContact O-N 2.97Å; K639-Q641 VanDerWaalsContact C-N 3.34Å; K639-Q641 PolarHBondContact O-N 3.25Å; K639-H642 PolarHBondContact O-N 2.97Å; K639-E643 WeakPolarHBondContact O-CB 3.5Å; K639-E643 PolarHBondContact O-N 3.22Å; K639-L675 HydrophobicContact CG-CD1 3.81Å
640	E	94	Very high	90.9	Very high	100 Å²	100	54.6 Å²	54.6	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-43.4	178.8	-168.8	-167.6	143.7	0	0	111.4	S636 I637 E643 K644	S636-E640 PolarHBondContact O-N 2.96Å; I637-E640 PolarHBondContact O-N 3.34Å; E640-E643 PolarHBondContact O-N 3.2Å; E640-K644 WeakPolarHBondContact O-CB 3.49Å; E640-K644 VanDerWaalsContact O-CG 3.31Å; E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 2.91Å; E640-K644 WeakPolarHBondContact OE1-CE 3.44Å; E640-K644 IonicContact OE1-NZ 3.62Å; E640-K644 PolarHBondContact OE1-NZ 3.32Å
641	Q	93.1	Very high	91	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.028	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-46.3	173.6	-73.3	173.1	-64.3	0	0	112.2	I637 K639 K644 C645 W861 L862	I637-Q641 HydrophobicContact CG2-CG 4.34Å; I637-Q641 WeakPolarHBondContact O-CB 3.33Å; I637-Q641 VanDerWaalsContact O-CG 3.27Å; I637-Q641 WeakPolarHBondContact O-CG 3.46Å; I637-Q641 PolarHBondContact O-N 3.29Å; I637-Q641 PolarHBondContact O-OE1 2.89Å; K639-Q641 VanDerWaalsContact C-N 3.34Å; K639-Q641 PolarHBondContact O-N 3.25Å; Q641-K644 PolarHBondContact O-N 3.19Å; Q641-C645 PolarHBondContact O-N 2.87Å; Q641-C645 PolarHBondContact O-SG 2.93Å; Q641-W861 HydrophobicContact CB-CH2 3.63Å; Q641-W861 HydrophobicContact CB-CZ2 3.67Å; Q641-W861 HydrophobicContact CB-CZ3 4.21Å; Q641-W861 HydrophobicContact CG-CD2 4.23Å; Q641-W861 HydrophobicContact CG-CE3 4.09Å; Q641-W861 HydrophobicContact CG-CH2 3.83Å; Q641-W861 HydrophobicContact CG-CZ2 3.94Å; Q641-W861 HydrophobicContact CG-CZ3 3.9Å; Q641-W861 VanDerWaalsContact NE2-CG 3.28Å; Q641-L862 PolarHBondContact NE2-O 2.72Å
642	H	93.1	Very high	91	Very high	46 Å²	46	54.2 Å²	54.2	21%	0.213	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-43.7	177.8	-179.3	73.9	0	0	0	111.8	L638 K639 C645 L646 A668 C671	L638-H642 VanDerWaalsContact O-CB 3.25Å; L638-H642 WeakPolarHBondContact O-CB 3.42Å; L638-H642 PolarHBondContact O-N 3.49Å; K639-H642 PolarHBondContact O-N 2.97Å; H642-C645 PolarHBondContact O-N 3.47Å; H642-L646 WeakPolarHBondContact O-CG 3.43Å; H642-L646 PolarHBondContact O-N 2.89Å; H642-A668 PolarHBondContact CE1-O 3.02Å; H642-A668 PolarHBondContact ND1-O 3.3Å; H642-C671 HydrophobicContact CB-CB 3.97Å
643	E	93.7	Very high	90.9	Very high	133 Å²	133	53.5 Å²	53.5	62%	0.621	27%	0.266	S	S	*	.	H	α-helix	trans	-64.4	-42.8	177	-172.9	173.2	-178.7	0	0	112	K639 E640 L646 T647	K639-E643 WeakPolarHBondContact O-CB 3.5Å; K639-E643 PolarHBondContact O-N 3.22Å; E640-E643 PolarHBondContact O-N 3.2Å; E643-L646 PolarHBondContact O-N 3.01Å; E643-T647 WeakPolarHBondContact O-CB 3.32Å; E643-T647 PolarHBondContact O-N 3.07Å; E643-T647 PolarHBondContact O-OG1 3.12Å
644	K	91.1	Very high	90.5	Very high	52 Å²	52	52.4 Å²	52.4	23%	0.226	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-48.2	170.9	-75.7	172.9	-176.8	171	0	111.8	E640 Q641 L646 T647 Y648 E859	E640-K644 WeakPolarHBondContact O-CB 3.49Å; E640-K644 VanDerWaalsContact O-CG 3.31Å; E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 2.91Å; E640-K644 WeakPolarHBondContact OE1-CE 3.44Å; E640-K644 IonicContact OE1-NZ 3.62Å; E640-K644 PolarHBondContact OE1-NZ 3.32Å; Q641-K644 PolarHBondContact O-N 3.19Å; K644-L646 PolarHBondContact O-N 3.02Å; K644-T647 WeakPolarHBondContact O-CB 3.38Å; K644-T647 PolarHBondContact O-N 2.9Å; K644-T647 VanDerWaalsContact O-N 3.11Å; K644-Y648 HydrophobicContact CB-CD2 4.48Å; K644-Y648 HydrophobicContact CB-CE2 4.01Å; K644-Y648 VanDerWaalsContact O-CD2 3.32Å; K644-Y648 WeakPolarHBondContact O-CD2 3.47Å; K644-Y648 PolarHBondContact O-N 3.3Å; K644-E859 WeakPolarHBondContact CD-OE2 3.09Å; K644-E859 WeakPolarHBondContact CE-OE2 3.44Å; K644-E859 IonicContact NZ-OE2 2.8Å; K644-E859 PolarHBondContact NZ-OE2 3.35Å
645	C	91.3	Very high	90.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-43.8	177.7	-69.2	0	0	0	0	112.8	Q641 H642 T647 Y648 S649 L667 A668 W861	Q641-C645 PolarHBondContact O-N 2.87Å; Q641-C645 PolarHBondContact O-SG 2.93Å; H642-C645 PolarHBondContact O-N 3.47Å; C645-T647 VanDerWaalsContact C-N 3.27Å; C645-T647 PolarHBondContact O-N 3.43Å; C645-Y648 PolarHBondContact O-N 2.66Å; C645-S649 WeakPolarHBondContact O-CB 3.3Å; C645-S649 PolarHBondContact O-N 3.42Å; C645-L667 VanDerWaalsContact SG-CD2 3.57Å; C645-L667 VanDerWaalsContact SG-CG 3.5Å; C645-A668 HydrophobicContact CB-CB 3.59Å; C645-W861 WeakPolarHBondContact SG-CH2 3.47Å; C645-W861 VanDerWaalsContact SG-CZ2 3.55Å
646	L	91.6	Very high	89.8	Confident	65 Å²	65	56.5 Å²	56.5	34%	0.34	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-35	174.1	-70.6	179.4	0	0	0	112.2	H642 E643 K644 K650 A668	H642-L646 WeakPolarHBondContact O-CG 3.43Å; H642-L646 PolarHBondContact O-N 2.89Å; E643-L646 PolarHBondContact O-N 3.01Å; K644-L646 PolarHBondContact O-N 3.02Å; L646-K650 WeakPolarHBondContact O-CB 3.28Å; L646-K650 WeakPolarHBondContact O-CD 3.26Å; L646-K650 VanDerWaalsContact O-CG 3.23Å; L646-K650 WeakPolarHBondContact O-CG 3.45Å; L646-K650 PolarHBondContact O-N 3.3Å; L646-K650 VanDerWaalsContact O-N 3.07Å; L646-A668 HydrophobicContact CD2-CB 3.98Å; L646-A668 HydrophobicContact CG-CB 4.23Å
647	T	90.1	Very high	89.4	Confident	58 Å²	58	55.8 Å²	55.8	36%	0.356	29%	0.286	S	S	.	.	H	α-helix	trans	-69.3	-45.6	177.8	-59.7	0	0	0	0	111.1	E643 K644 C645 K650 Q651	E643-T647 WeakPolarHBondContact O-CB 3.32Å; E643-T647 PolarHBondContact O-N 3.07Å; E643-T647 PolarHBondContact O-OG1 3.12Å; K644-T647 WeakPolarHBondContact O-CB 3.38Å; K644-T647 PolarHBondContact O-N 2.9Å; K644-T647 VanDerWaalsContact O-N 3.11Å; C645-T647 VanDerWaalsContact C-N 3.27Å; C645-T647 PolarHBondContact O-N 3.43Å; T647-K650 PolarHBondContact O-N 3.43Å; T647-Q651 WeakPolarHBondContact O-CG 3.45Å; T647-Q651 PolarHBondContact O-N 3.1Å
648	Y	89.5	Confident	89.2	Confident	30 Å²	30	58.6 Å²	58.6	12%	0.118	31%	0.305	C	S	.	.	H	α-helix	trans	-67.8	-38.7	177.1	-58.4	-27.8	0	0	0	112.2	K644 C645 Q651 F652 F664 T700 E859	K644-Y648 HydrophobicContact CB-CD2 4.48Å; K644-Y648 HydrophobicContact CB-CE2 4.01Å; K644-Y648 VanDerWaalsContact O-CD2 3.32Å; K644-Y648 WeakPolarHBondContact O-CD2 3.47Å; K644-Y648 PolarHBondContact O-N 3.3Å; C645-Y648 PolarHBondContact O-N 2.66Å; Y648-Q651 PolarHBondContact O-N 3.23Å; Y648-F652 VanDerWaalsContact O-CD2 3.23Å; Y648-F652 WeakPolarHBondContact O-CD2 3.29Å; Y648-F652 PolarHBondContact O-N 3.2Å; Y648-F664 AromaticContact CD2-CD1 3.91Å; Y648-F664 HydrophobicContact CD2-CD1 3.91Å; Y648-F664 AromaticContact CD2-CE1 3.53Å; Y648-F664 HydrophobicContact CD2-CE1 3.53Å; Y648-F664 HydrophobicContact CD2-CZ 4.14Å; Y648-F664 HydrophobicContact CE2-CE1 4.47Å; Y648-F664 HydrophobicContact CG-CD1 4.33Å; Y648-F664 HydrophobicContact CG-CE1 4.16Å; Y648-F664 HydrophobicContact CG-CZ 4.5Å; Y648-T700 HydrophobicContact CD1-CG2 3.6Å; Y648-T700 HydrophobicContact CD2-CG2 3.84Å; Y648-T700 HydrophobicContact CE1-CG2 3.76Å; Y648-T700 HydrophobicContact CE2-CG2 3.97Å; Y648-T700 HydrophobicContact CG-CG2 3.65Å; Y648-E859 PolarHBondContact OH-OE1 3.07Å
649	S	89.4	Confident	89	Confident	8 Å²	8	62.8 Å²	62.8	6%	0.056	34%	0.335	C	S	.	.	H	α-helix	trans	-55.8	-54.9	169.6	151.8	0	0	0	0	110.7	C645 Q651 F652 T653 E665	C645-S649 WeakPolarHBondContact O-CB 3.3Å; C645-S649 PolarHBondContact O-N 3.42Å; S649-Q651 VanDerWaalsContact C-N 3.28Å; S649-Q651 PolarHBondContact O-N 3.28Å; S649-F652 PolarHBondContact O-N 3.05Å; S649-F652 VanDerWaalsContact O-N 3.08Å; S649-T653 WeakPolarHBondContact O-CB 3.43Å; S649-T653 PolarHBondContact O-N 3.48Å; S649-T653 PolarHBondContact O-OG1 3.39Å; S649-E665 WeakPolarHBondContact OG-CG 3.35Å; S649-E665 PolarHBondContact OG-OE1 3.47Å
650	K	88.4	Confident	88.7	Confident	129 Å²	129	59.1 Å²	59.1	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-55.1	-42.6	178.2	-72.4	168	-177.3	178.6	0	112.3	L646 T647 T653 H654	L646-K650 WeakPolarHBondContact O-CB 3.28Å; L646-K650 WeakPolarHBondContact O-CD 3.26Å; L646-K650 VanDerWaalsContact O-CG 3.23Å; L646-K650 WeakPolarHBondContact O-CG 3.45Å; L646-K650 PolarHBondContact O-N 3.3Å; L646-K650 VanDerWaalsContact O-N 3.07Å; T647-K650 PolarHBondContact O-N 3.43Å; K650-T653 PolarHBondContact O-N 3.31Å; K650-H654 PolarHBondContact O-CD2 3.38Å; K650-H654 PolarHBondContact O-N 2.66Å
651	Q	86.9	Confident	88.5	Confident	34 Å²	34	54.9 Å²	54.9	16%	0.159	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-46.7	176.4	-73.9	173.7	-14.7	0	0	112.2	T647 Y648 S649 H654 L655 V701 I703	T647-Q651 WeakPolarHBondContact O-CG 3.45Å; T647-Q651 PolarHBondContact O-N 3.1Å; Y648-Q651 PolarHBondContact O-N 3.23Å; S649-Q651 VanDerWaalsContact C-N 3.28Å; S649-Q651 PolarHBondContact O-N 3.28Å; Q651-H654 PolarHBondContact O-N 2.9Å; Q651-L655 WeakPolarHBondContact O-CG 3.29Å; Q651-L655 PolarHBondContact O-N 2.78Å; Q651-V701 PolarHBondContact OE1-O 2.74Å; Q651-I703 HydrophobicContact CB-CD1 4.41Å; Q651-I703 HydrophobicContact CB-CG1 4.22Å; Q651-I703 HydrophobicContact CG-CD1 4.46Å; Q651-I703 HydrophobicContact CG-CG1 3.93Å
652	F	87.4	Confident	88.4	Confident	8 Å²	8	57 Å²	57	4%	0.035	31%	0.314	C	S	.	.	H	α-helix	trans	-70.7	-30.6	177.8	-78.1	-62.7	0	0	0	113.6	Y648 S649 L655 G656 N657 E660 T661 F664 R699 V701	Y648-F652 VanDerWaalsContact O-CD2 3.23Å; Y648-F652 WeakPolarHBondContact O-CD2 3.29Å; Y648-F652 PolarHBondContact O-N 3.2Å; S649-F652 PolarHBondContact O-N 3.05Å; S649-F652 VanDerWaalsContact O-N 3.08Å; F652-L655 HydrophobicContact CD1-CD1 4.5Å; F652-L655 CarbonylContact O-C 3.09Å; F652-L655 PolarHBondContact O-N 3.18Å; F652-L655 VanDerWaalsContact O-N 3.14Å; F652-G656 PolarHBondContact O-N 3.5Å; F652-N657 HydrophobicContact CB-CB 4.29Å; F652-N657 HydrophobicContact CD1-CB 3.84Å; F652-N657 HydrophobicContact CG-CB 4.48Å; F652-N657 PolarHBondContact O-N 3.42Å; F652-E660 HydrophobicContact CB-CB 4.2Å; F652-E660 HydrophobicContact CD1-CB 3.84Å; F652-E660 HydrophobicContact CD1-CG 4.48Å; F652-E660 HydrophobicContact CD2-CB 3.69Å; F652-E660 HydrophobicContact CE1-CB 4.09Å; F652-E660 HydrophobicContact CE1-CG 4.29Å; F652-E660 HydrophobicContact CE2-CB 3.97Å; F652-E660 HydrophobicContact CG-CB 3.62Å; F652-E660 HydrophobicContact CZ-CB 4.14Å; F652-E660 HydrophobicContact CZ-CG 4.29Å; F652-T661 VanDerWaalsContact C-OG1 3.25Å; F652-T661 WeakPolarHBondContact CB-OG1 3.47Å; F652-F664 AromaticContact CD2-CD2 3.78Å; F652-F664 HydrophobicContact CD2-CD2 3.78Å; F652-F664 AromaticContact CD2-CE2 3.86Å; F652-F664 HydrophobicContact CD2-CE2 3.86Å; F652-F664 AromaticContact CE2-CD2 3.95Å; F652-F664 HydrophobicContact CE2-CD2 3.95Å; F652-F664 AromaticContact CE2-CE2 3.51Å; F652-F664 HydrophobicContact CE2-CE2 3.51Å; F652-F664 HydrophobicContact CE2-CZ 4.47Å; F652-R699 WeakPolarHBondContact CZ-O 3.47Å; F652-V701 HydrophobicContact CE1-CG2 3.8Å; F652-V701 HydrophobicContact CZ-CG2 4.18Å
653	T	87.4	Confident	88.3	Confident	75 Å²	75	60 Å²	60	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-66.3	-43.2	174.9	-59.9	0	0	0	0	111.3	S649 K650 L655 G656 T661	S649-T653 WeakPolarHBondContact O-CB 3.43Å; S649-T653 PolarHBondContact O-N 3.48Å; S649-T653 PolarHBondContact O-OG1 3.39Å; K650-T653 PolarHBondContact O-N 3.31Å; T653-L655 PolarHBondContact O-N 2.78Å; T653-G656 PolarHBondContact O-N 3.1Å; T653-G656 VanDerWaalsContact O-N 3.08Å; T653-T661 WeakPolarHBondContact CA-OG1 2.79Å; T653-T661 PolarHBondContact N-OG1 2.96Å; T653-T661 WeakPolarHBondContact OG1-CG2 3.48Å; T653-T661 PolarHBondContact OG1-OG1 3.06Å
654	H	82	Confident	88.2	Confident	101 Å²	101	53.7 Å²	53.7	47%	0.468	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-21.6	172.5	-70.8	-50.3	0	0	0	113.7	K650 Q651 I703	K650-H654 PolarHBondContact O-CD2 3.38Å; K650-H654 PolarHBondContact O-N 2.66Å; Q651-H654 PolarHBondContact O-N 2.9Å; H654-I703 HydrophobicContact CB-CD1 3.56Å
655	L	82	Confident	88.3	Confident	48 Å²	48	54.8 Å²	54.8	25%	0.251	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	1.2	175.6	-67.4	166.6	0	0	0	113.5	Q651 F652 T653 N657 V701 I703	Q651-L655 WeakPolarHBondContact O-CG 3.29Å; Q651-L655 PolarHBondContact O-N 2.78Å; F652-L655 HydrophobicContact CD1-CD1 4.5Å; F652-L655 CarbonylContact O-C 3.09Å; F652-L655 PolarHBondContact O-N 3.18Å; F652-L655 VanDerWaalsContact O-N 3.14Å; T653-L655 PolarHBondContact O-N 2.78Å; L655-N657 VanDerWaalsContact C-N 3.26Å; L655-N657 PolarHBondContact O-N 2.94Å; L655-V701 HydrophobicContact CD1-CB 3.51Å; L655-V701 HydrophobicContact CD1-CG1 3.57Å; L655-V701 HydrophobicContact CD1-CG2 4.02Å; L655-I703 HydrophobicContact CD1-CG2 4.25Å; L655-I703 HydrophobicContact CD2-CG2 4.14Å; L655-I703 HydrophobicContact CG-CG2 4.38Å
656	G	82.9	Confident	88.3	Confident	59 Å²	59	61.5 Å²	61.5	61%	0.608	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	13.2	-178.3	0	0	0	0	0	115.5	F652 T653 V658	F652-G656 PolarHBondContact O-N 3.5Å; T653-G656 PolarHBondContact O-N 3.1Å; T653-G656 VanDerWaalsContact O-N 3.08Å; G656-V658 PolarHBondContact O-N 2.87Å; G656-V658 VanDerWaalsContact O-N 3.12Å
657	N	86.1	Confident	88.3	Confident	56 Å²	56	60 Å²	60	30%	0.299	32%	0.324	S	S	.	.			trans	-88.5	75.4	-177	-174	-0.6	0	0	0	111.9	F652 L655 S659 E660 T661	F652-N657 HydrophobicContact CB-CB 4.29Å; F652-N657 HydrophobicContact CD1-CB 3.84Å; F652-N657 HydrophobicContact CG-CB 4.48Å; F652-N657 PolarHBondContact O-N 3.42Å; L655-N657 VanDerWaalsContact C-N 3.26Å; L655-N657 PolarHBondContact O-N 2.94Å; N657-S659 PolarHBondContact O-N 2.88Å; N657-S659 VanDerWaalsContact O-N 3.11Å; N657-E660 VanDerWaalsContact ND2-CG 3.31Å; N657-E660 WeakPolarHBondContact ND2-CG 3.38Å; N657-E660 PolarHBondContact O-N 2.86Å; N657-E660 VanDerWaalsContact O-N 3.14Å; N657-E660 PolarHBondContact OD1-N 3.29Å; N657-T661 PolarHBondContact O-N 3.34Å; N657-T661 PolarHBondContact O-OG1 3.41Å
658	V	87.8	Confident	88.5	Confident	101 Å²	101	57.4 Å²	57.4	61%	0.612	31%	0.308	S	S	*	.	H	α-helix	trans	-51.2	-35.8	-178.7	-173.8	0	0	0	0	113	G656 T662	G656-V658 PolarHBondContact O-N 2.87Å; G656-V658 VanDerWaalsContact O-N 3.12Å; V658-T662 HydrophobicContact CG1-CG2 4.18Å; V658-T662 WeakPolarHBondContact O-CB 3.36Å; V658-T662 WeakPolarHBondContact O-CG2 3.41Å; V658-T662 PolarHBondContact O-N 2.87Å; V658-T662 PolarHBondContact O-OG1 3.25Å
659	S	88.1	Confident	88.6	Confident	89 Å²	89	60.7 Å²	60.7	62%	0.622	33%	0.325	S	S	*	.	H	α-helix	trans	-67.1	-42.4	-179	-58.6	0	0	0	0	113.2	N657 T662 K663	N657-S659 PolarHBondContact O-N 2.88Å; N657-S659 VanDerWaalsContact O-N 3.11Å; S659-T662 PolarHBondContact O-OG1 3.17Å; S659-K663 VanDerWaalsContact O-CB 3.32Å; S659-K663 WeakPolarHBondContact O-CB 3.43Å; S659-K663 PolarHBondContact O-N 3.12Å
660	E	87.6	Confident	88.7	Confident	44 Å²	44	63.2 Å²	63.2	21%	0.206	34%	0.343	C	S	.	.	H	α-helix	trans	-80	-36.7	175.3	-70.4	-68.2	134.6	0	0	111.4	F652 N657 T662 K663 F664	F652-E660 HydrophobicContact CB-CB 4.2Å; F652-E660 HydrophobicContact CD1-CB 3.84Å; F652-E660 HydrophobicContact CD1-CG 4.48Å; F652-E660 HydrophobicContact CD2-CB 3.69Å; F652-E660 HydrophobicContact CE1-CB 4.09Å; F652-E660 HydrophobicContact CE1-CG 4.29Å; F652-E660 HydrophobicContact CE2-CB 3.97Å; F652-E660 HydrophobicContact CG-CB 3.62Å; F652-E660 HydrophobicContact CZ-CB 4.14Å; F652-E660 HydrophobicContact CZ-CG 4.29Å; N657-E660 VanDerWaalsContact ND2-CG 3.31Å; N657-E660 WeakPolarHBondContact ND2-CG 3.38Å; N657-E660 PolarHBondContact O-N 2.86Å; N657-E660 VanDerWaalsContact O-N 3.14Å; N657-E660 PolarHBondContact OD1-N 3.29Å; E660-T662 PolarHBondContact O-N 2.96Å; E660-K663 WeakPolarHBondContact O-CB 3.24Å; E660-K663 PolarHBondContact O-N 3.44Å; E660-K663 WeakPolarHBondContact OE1-CD 3.38Å; E660-K663 IonicContact OE1-NZ 2.64Å; E660-K663 PolarHBondContact OE1-NZ 2.83Å; E660-K663 WeakPolarHBondContact OE2-CD 3.27Å; E660-K663 IonicContact OE2-NZ 3.14Å; E660-K663 PolarHBondContact OE2-NZ 3.27Å; E660-F664 HydrophobicContact CB-CD2 4.48Å; E660-F664 VanDerWaalsContact O-CD2 3.25Å; E660-F664 WeakPolarHBondContact O-CD2 3.29Å; E660-F664 PolarHBondContact O-N 3.11Å; E660-F664 WeakPolarHBondContact OE2-CE2 3.49Å
661	T	88.8	Confident	88.8	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-50.6	-58.7	171.5	-72.8	0	0	0	0	111.6	F652 T653 N657 K663 F664 E665	F652-T661 VanDerWaalsContact C-OG1 3.25Å; F652-T661 WeakPolarHBondContact CB-OG1 3.47Å; T653-T661 WeakPolarHBondContact CA-OG1 2.79Å; T653-T661 PolarHBondContact N-OG1 2.96Å; T653-T661 WeakPolarHBondContact OG1-CG2 3.48Å; T653-T661 PolarHBondContact OG1-OG1 3.06Å; N657-T661 PolarHBondContact O-N 3.34Å; N657-T661 PolarHBondContact O-OG1 3.41Å; T661-K663 PolarHBondContact O-N 3.23Å; T661-F664 PolarHBondContact O-N 3.04Å; T661-F664 VanDerWaalsContact O-N 3.14Å; T661-E665 HydrophobicContact CG2-CG 4.48Å; T661-E665 WeakPolarHBondContact CG2-OE1 3.48Å; T661-E665 WeakPolarHBondContact O-CG 3.47Å; T661-E665 PolarHBondContact O-N 3.1Å
662	T	90.5	Very high	89.1	Confident	51 Å²	51	61 Å²	61	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-67	-24.7	-176	55.4	0	0	0	0	113.2	V658 S659 E660 K666	V658-T662 HydrophobicContact CG1-CG2 4.18Å; V658-T662 WeakPolarHBondContact O-CB 3.36Å; V658-T662 WeakPolarHBondContact O-CG2 3.41Å; V658-T662 PolarHBondContact O-N 2.87Å; V658-T662 PolarHBondContact O-OG1 3.25Å; S659-T662 PolarHBondContact O-OG1 3.17Å; E660-T662 PolarHBondContact O-N 2.96Å; T662-K666 WeakPolarHBondContact O-CB 3.31Å; T662-K666 WeakPolarHBondContact O-CD 3.43Å; T662-K666 WeakPolarHBondContact O-CG 2.94Å; T662-K666 PolarHBondContact O-N 3.34Å
663	K	90.9	Very high	89.3	Confident	107 Å²	107	66.4 Å²	66.4	47%	0.465	36%	0.356	S	S	.	.	H	α-helix	trans	-72	-45	172.6	170.6	-171.9	170	-157.2	0	111.6	S659 E660 T661 L667	S659-K663 VanDerWaalsContact O-CB 3.32Å; S659-K663 WeakPolarHBondContact O-CB 3.43Å; S659-K663 PolarHBondContact O-N 3.12Å; E660-K663 WeakPolarHBondContact O-CB 3.24Å; E660-K663 PolarHBondContact O-N 3.44Å; E660-K663 WeakPolarHBondContact OE1-CD 3.38Å; E660-K663 IonicContact OE1-NZ 2.64Å; E660-K663 PolarHBondContact OE1-NZ 2.83Å; E660-K663 WeakPolarHBondContact OE2-CD 3.27Å; E660-K663 IonicContact OE2-NZ 3.14Å; E660-K663 PolarHBondContact OE2-NZ 3.27Å; T661-K663 PolarHBondContact O-N 3.23Å; K663-L667 WeakPolarHBondContact O-CB 3.4Å; K663-L667 PolarHBondContact O-N 3.33Å
664	F	91.9	Very high	89.4	Confident	1 Å²	1	63.6 Å²	63.6	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-70.9	-30.6	174.7	-79.2	-70.2	0	0	0	112.7	Y648 F652 E660 T661 L667 A668 F698 T700	Y648-F664 AromaticContact CD2-CD1 3.91Å; Y648-F664 HydrophobicContact CD2-CD1 3.91Å; Y648-F664 AromaticContact CD2-CE1 3.53Å; Y648-F664 HydrophobicContact CD2-CE1 3.53Å; Y648-F664 HydrophobicContact CD2-CZ 4.14Å; Y648-F664 HydrophobicContact CE2-CE1 4.47Å; Y648-F664 HydrophobicContact CG-CD1 4.33Å; Y648-F664 HydrophobicContact CG-CE1 4.16Å; Y648-F664 HydrophobicContact CG-CZ 4.5Å; F652-F664 AromaticContact CD2-CD2 3.78Å; F652-F664 HydrophobicContact CD2-CD2 3.78Å; F652-F664 AromaticContact CD2-CE2 3.86Å; F652-F664 HydrophobicContact CD2-CE2 3.86Å; F652-F664 AromaticContact CE2-CD2 3.95Å; F652-F664 HydrophobicContact CE2-CD2 3.95Å; F652-F664 AromaticContact CE2-CE2 3.51Å; F652-F664 HydrophobicContact CE2-CE2 3.51Å; F652-F664 HydrophobicContact CE2-CZ 4.47Å; E660-F664 HydrophobicContact CB-CD2 4.48Å; E660-F664 VanDerWaalsContact O-CD2 3.25Å; E660-F664 WeakPolarHBondContact O-CD2 3.29Å; E660-F664 PolarHBondContact O-N 3.11Å; E660-F664 WeakPolarHBondContact OE2-CE2 3.49Å; T661-F664 PolarHBondContact O-N 3.04Å; T661-F664 VanDerWaalsContact O-N 3.14Å; F664-L667 HydrophobicContact CD1-CD2 4.44Å; F664-L667 PolarHBondContact O-N 2.9Å; F664-A668 WeakPolarHBondContact O-CB 3.49Å; F664-A668 PolarHBondContact O-N 2.89Å; F664-F698 HydrophobicContact CE1-CB 4.5Å; F664-F698 AromaticContact CE1-CD1 3.5Å; F664-F698 HydrophobicContact CE1-CD1 3.5Å; F664-F698 VanDerWaalsContact CE1-CD1 3.5Å; F664-F698 HydrophobicContact CE1-CE1 4.02Å; F664-F698 HydrophobicContact CE1-CG 4.19Å; F664-F698 HydrophobicContact CZ-CB 4.25Å; F664-F698 AromaticContact CZ-CD1 3.77Å; F664-F698 HydrophobicContact CZ-CD1 3.77Å; F664-F698 HydrophobicContact CZ-CG 4.36Å; F664-T700 HydrophobicContact CZ-CG2 4.28Å
665	E	92.9	Very high	89.9	Confident	75 Å²	75	59.4 Å²	59.4	35%	0.35	32%	0.32	S	S	.	.	H	α-helix	trans	-65.3	-48.1	170.9	-74.1	164.7	174.6	0	0	111.9	S649 T661 L667 A668 E669	S649-E665 WeakPolarHBondContact OG-CG 3.35Å; S649-E665 PolarHBondContact OG-OE1 3.47Å; T661-E665 HydrophobicContact CG2-CG 4.48Å; T661-E665 WeakPolarHBondContact CG2-OE1 3.48Å; T661-E665 WeakPolarHBondContact O-CG 3.47Å; T661-E665 PolarHBondContact O-N 3.1Å; E665-L667 PolarHBondContact O-N 3.29Å; E665-A668 WeakPolarHBondContact O-CB 3.4Å; E665-A668 PolarHBondContact O-N 3.32Å; E665-A668 VanDerWaalsContact O-N 3.11Å; E665-E669 PolarHBondContact O-N 2.85Å
666	K	92.8	Very high	90.2	Very high	141 Å²	141	60.1 Å²	60.1	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-59.7	-34.3	173.5	-74.7	166.2	-174.8	169.8	0	112.3	T662 S670	T662-K666 WeakPolarHBondContact O-CB 3.31Å; T662-K666 WeakPolarHBondContact O-CD 3.43Å; T662-K666 WeakPolarHBondContact O-CG 2.94Å; T662-K666 PolarHBondContact O-N 3.34Å; K666-S670 WeakPolarHBondContact O-CB 3.47Å; K666-S670 PolarHBondContact O-N 3.17Å
667	L	90.9	Very high	90.5	Very high	34 Å²	34	60.7 Å²	60.7	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-72.6	-38.5	174.6	-167.2	62.1	0	0	0	112.1	C645 K663 F664 E665 S670 C671 F698 W861	C645-L667 VanDerWaalsContact SG-CD2 3.57Å; C645-L667 VanDerWaalsContact SG-CG 3.5Å; K663-L667 WeakPolarHBondContact O-CB 3.4Å; K663-L667 PolarHBondContact O-N 3.33Å; F664-L667 HydrophobicContact CD1-CD2 4.44Å; F664-L667 PolarHBondContact O-N 2.9Å; E665-L667 PolarHBondContact O-N 3.29Å; L667-S670 PolarHBondContact O-N 3.25Å; L667-C671 PolarHBondContact O-N 3.37Å; L667-C671 PolarHBondContact O-SG 2.95Å; L667-F698 HydrophobicContact CD2-CE1 3.54Å; L667-F698 HydrophobicContact CD2-CZ 3.9Å; L667-W861 HydrophobicContact CD1-CZ2 4.26Å; L667-W861 HydrophobicContact CD2-CH2 4.25Å; L667-W861 HydrophobicContact CD2-CZ2 3.77Å; L667-W861 HydrophobicContact CG-CZ2 3.85Å
668	A	93.3	Very high	90.6	Very high	3 Å²	3	58 Å²	58	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-45.3	172	0	0	0	0	0	111.3	H642 C645 L646 F664 E665 S670 C671 K672	H642-A668 PolarHBondContact CE1-O 3.02Å; H642-A668 PolarHBondContact ND1-O 3.3Å; C645-A668 HydrophobicContact CB-CB 3.59Å; L646-A668 HydrophobicContact CD2-CB 3.98Å; L646-A668 HydrophobicContact CG-CB 4.23Å; F664-A668 WeakPolarHBondContact O-CB 3.49Å; F664-A668 PolarHBondContact O-N 2.89Å; E665-A668 WeakPolarHBondContact O-CB 3.4Å; E665-A668 PolarHBondContact O-N 3.32Å; E665-A668 VanDerWaalsContact O-N 3.11Å; A668-S670 VanDerWaalsContact C-N 3.34Å; A668-S670 PolarHBondContact O-N 2.85Å; A668-C671 PolarHBondContact O-N 3.28Å; A668-K672 WeakPolarHBondContact O-CB 3.07Å; A668-K672 PolarHBondContact O-N 3.21Å
669	E	93.4	Very high	90.7	Very high	99 Å²	99	57.9 Å²	57.9	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-57.5	-44.7	172.1	-84.3	-171.1	-136.8	0	0	112	E665 K672 K673	E665-E669 PolarHBondContact O-N 2.85Å; E669-K672 PolarHBondContact O-N 3.24Å; E669-K673 WeakPolarHBondContact O-CB 3.49Å; E669-K673 WeakPolarHBondContact O-CD 3.41Å; E669-K673 VanDerWaalsContact O-CG 3.23Å; E669-K673 WeakPolarHBondContact O-CG 3.4Å; E669-K673 PolarHBondContact O-N 3.16Å; E669-K673 WeakPolarHBondContact OE2-CE 3.29Å; E669-K673 IonicContact OE2-NZ 3.12Å; E669-K673 PolarHBondContact OE2-NZ 2.92Å
670	S	90.7	Very high	90.7	Very high	62 Å²	62	57.3 Å²	57.3	43%	0.434	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-47.4	178.4	-166.9	0	0	0	0	110.9	K666 L667 A668 K672 K673 S674	K666-S670 WeakPolarHBondContact O-CB 3.47Å; K666-S670 PolarHBondContact O-N 3.17Å; L667-S670 PolarHBondContact O-N 3.25Å; A668-S670 VanDerWaalsContact C-N 3.34Å; A668-S670 PolarHBondContact O-N 2.85Å; S670-K672 VanDerWaalsContact C-N 3.31Å; S670-K672 PolarHBondContact O-N 3.37Å; S670-K673 PolarHBondContact O-N 2.95Å; S670-S674 PolarHBondContact O-N 3.14Å; S670-S674 PolarHBondContact O-OG 3.18Å
671	C	91.4	Very high	90.7	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-41.2	174.6	-60.6	0	0	0	0	111.8	L638 H642 L667 A668 S674 L675 W861	L638-C671 HydrophobicContact CD2-CB 4.44Å; H642-C671 HydrophobicContact CB-CB 3.97Å; L667-C671 PolarHBondContact O-N 3.37Å; L667-C671 PolarHBondContact O-SG 2.95Å; A668-C671 PolarHBondContact O-N 3.28Å; C671-S674 PolarHBondContact O-N 3.1Å; C671-L675 VanDerWaalsContact O-CB 3.27Å; C671-L675 WeakPolarHBondContact O-CB 3.48Å; C671-L675 PolarHBondContact O-N 2.92Å; C671-W861 VanDerWaalsContact SG-CZ2 3.59Å
672	K	91.9	Very high	90.6	Very high	114 Å²	114	59.3 Å²	59.3	50%	0.496	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-46.2	176	-176.9	177.8	176.7	-177.3	0	111.7	A668 E669 S670 S674 L675 D676	A668-K672 WeakPolarHBondContact O-CB 3.07Å; A668-K672 PolarHBondContact O-N 3.21Å; E669-K672 PolarHBondContact O-N 3.24Å; S670-K672 VanDerWaalsContact C-N 3.31Å; S670-K672 PolarHBondContact O-N 3.37Å; K672-S674 PolarHBondContact O-N 2.75Å; K672-L675 WeakPolarHBondContact O-CB 3.4Å; K672-L675 PolarHBondContact O-N 3.39Å; K672-D676 WeakPolarHBondContact O-CB 3.45Å; K672-D676 PolarHBondContact O-N 3.01Å
673	K	91.8	Very high	90.5	Very high	121 Å²	121	61.5 Å²	61.5	53%	0.526	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-44.6	176.1	-70	160.4	-167.8	169	0	111	E669 S670 D676 V677	E669-K673 WeakPolarHBondContact O-CB 3.49Å; E669-K673 WeakPolarHBondContact O-CD 3.41Å; E669-K673 VanDerWaalsContact O-CG 3.23Å; E669-K673 WeakPolarHBondContact O-CG 3.4Å; E669-K673 PolarHBondContact O-N 3.16Å; E669-K673 WeakPolarHBondContact OE2-CE 3.29Å; E669-K673 IonicContact OE2-NZ 3.12Å; E669-K673 PolarHBondContact OE2-NZ 2.92Å; S670-K673 PolarHBondContact O-N 2.95Å; K673-D676 PolarHBondContact O-N 2.8Å; K673-V677 WeakPolarHBondContact O-CB 3.48Å; K673-V677 WeakPolarHBondContact O-CG2 3.44Å; K673-V677 PolarHBondContact O-N 3.14Å
674	S	90.2	Very high	90.3	Very high	15 Å²	15	63.2 Å²	63.2	11%	0.105	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-44.1	172.9	-63	0	0	0	0	112.6	S670 C671 K672 D676 V677 L678 I864	S670-S674 PolarHBondContact O-N 3.14Å; S670-S674 PolarHBondContact O-OG 3.18Å; C671-S674 PolarHBondContact O-N 3.1Å; K672-S674 PolarHBondContact O-N 2.75Å; S674-D676 PolarHBondContact O-N 3.17Å; S674-V677 PolarHBondContact O-N 2.88Å; S674-L678 WeakPolarHBondContact O-CB 3.42Å; S674-L678 PolarHBondContact O-N 2.96Å; S674-I864 WeakPolarHBondContact O-CD1 3.48Å
675	L	91.3	Very high	89.7	Confident	13 Å²	13	65.8 Å²	65.8	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-41.5	178.3	-155.4	-173.8	0	0	0	111	L638 K639 C671 K672 L678 K679	L638-L675 HydrophobicContact CB-CB 4.25Å; L638-L675 HydrophobicContact CB-CG 4.14Å; K639-L675 HydrophobicContact CG-CD1 3.81Å; C671-L675 VanDerWaalsContact O-CB 3.27Å; C671-L675 WeakPolarHBondContact O-CB 3.48Å; C671-L675 PolarHBondContact O-N 2.92Å; K672-L675 WeakPolarHBondContact O-CB 3.4Å; K672-L675 PolarHBondContact O-N 3.39Å; L675-L678 PolarHBondContact O-N 3.34Å; L675-K679 HydrophobicContact CD2-CD 4.06Å; L675-K679 VanDerWaalsContact CD2-CE 3.44Å; L675-K679 HydrophobicContact CD2-CG 3.98Å; L675-K679 WeakPolarHBondContact O-CG 3.35Å; L675-K679 PolarHBondContact O-N 3.24Å
676	D	90.1	Very high	89.2	Confident	64 Å²	64	66.1 Å²	66.1	34%	0.342	34%	0.344	S	S	.	.	H	α-helix	trans	-73	-34.2	178.7	-67.2	-27.2	0	0	0	112.4	K672 K673 S674 K679 L680	K672-D676 WeakPolarHBondContact O-CB 3.45Å; K672-D676 PolarHBondContact O-N 3.01Å; K673-D676 PolarHBondContact O-N 2.8Å; S674-D676 PolarHBondContact O-N 3.17Å; D676-K679 IonicContact OD1-NZ 3.89Å; D676-K679 PolarHBondContact OD1-NZ 3.46Å; D676-L680 VanDerWaalsContact O-CB 3.29Å; D676-L680 WeakPolarHBondContact O-CB 3.47Å; D676-L680 PolarHBondContact O-N 2.94Å
677	V	89.3	Confident	88.6	Confident	70 Å²	70	64.1 Å²	64.1	42%	0.424	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-43.8	166.1	166	0	0	0	0	111.1	K673 S674 L680 A681	K673-V677 WeakPolarHBondContact O-CB 3.48Å; K673-V677 WeakPolarHBondContact O-CG2 3.44Å; K673-V677 PolarHBondContact O-N 3.14Å; S674-V677 PolarHBondContact O-N 2.88Å; V677-L680 PolarHBondContact O-N 3.48Å; V677-A681 PolarHBondContact O-N 3.19Å
678	L	88.4	Confident	88	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-44.3	180	-161.7	103.4	0	0	0	111.6	Y631 L634 C635 S674 L675 L680 A681 Q682 P689 I864	Y631-L678 HydrophobicContact CD1-CD1 4.25Å; Y631-L678 HydrophobicContact CD1-CD2 3.93Å; Y631-L678 HydrophobicContact CD1-CG 3.73Å; Y631-L678 HydrophobicContact CE1-CD1 4.34Å; Y631-L678 HydrophobicContact CE1-CG 3.95Å; Y631-L678 WeakPolarHBondContact CE1-O 3.46Å; Y631-L678 WeakPolarHBondContact O-CD2 3.36Å; L634-L678 HydrophobicContact CB-CD1 3.83Å; L634-L678 HydrophobicContact CB-CD2 3.87Å; L634-L678 HydrophobicContact CD1-CD1 3.86Å; C635-L678 HydrophobicContact CB-CD2 4.13Å; S674-L678 WeakPolarHBondContact O-CB 3.42Å; S674-L678 PolarHBondContact O-N 2.96Å; L675-L678 PolarHBondContact O-N 3.34Å; L678-L680 VanDerWaalsContact C-N 3.33Å; L678-L680 PolarHBondContact O-N 3.33Å; L678-A681 PolarHBondContact O-N 3.31Å; L678-Q682 WeakPolarHBondContact O-CB 3.23Å; L678-Q682 PolarHBondContact O-N 2.98Å; L678-P689 HydrophobicContact CD1-CG 4.27Å; L678-I864 HydrophobicContact CB-CD1 3.98Å; L678-I864 HydrophobicContact CD1-CD1 3.57Å; L678-I864 HydrophobicContact CG-CD1 4.39Å
679	K	88.8	Confident	87.5	Confident	99 Å²	99	65.4 Å²	65.4	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-58.3	-42.1	171.1	-73	171.2	-175.6	151.7	0	112.2	L675 D676 Q682 S683	L675-K679 HydrophobicContact CD2-CD 4.06Å; L675-K679 VanDerWaalsContact CD2-CE 3.44Å; L675-K679 HydrophobicContact CD2-CG 3.98Å; L675-K679 WeakPolarHBondContact O-CG 3.35Å; L675-K679 PolarHBondContact O-N 3.24Å; D676-K679 IonicContact OD1-NZ 3.89Å; D676-K679 PolarHBondContact OD1-NZ 3.46Å; K679-Q682 PolarHBondContact O-N 3.04Å; K679-S683 WeakPolarHBondContact O-CB 3.47Å; K679-S683 PolarHBondContact O-N 2.9Å; K679-S683 PolarHBondContact O-OG 3.35Å
680	L	88.8	Confident	87.1	Confident	77 Å²	77	67.1 Å²	67.1	40%	0.403	36%	0.364	S	S	.	.	H	α-helix	trans	-69.8	-35.6	-178.7	-177.8	61.1	0	0	0	112.1	D676 V677 L678 S683 R684	D676-L680 VanDerWaalsContact O-CB 3.29Å; D676-L680 WeakPolarHBondContact O-CB 3.47Å; D676-L680 PolarHBondContact O-N 2.94Å; V677-L680 PolarHBondContact O-N 3.48Å; L678-L680 VanDerWaalsContact C-N 3.33Å; L678-L680 PolarHBondContact O-N 3.33Å; L680-S683 PolarHBondContact O-OG 2.87Å; L680-R684 HydrophobicContact CD1-CG 4.46Å; L680-R684 WeakPolarHBondContact O-CB 3.46Å; L680-R684 WeakPolarHBondContact O-CD 3.25Å; L680-R684 WeakPolarHBondContact O-CG 3.5Å; L680-R684 PolarHBondContact O-N 3.36Å
681	A	87	Confident	86.9	Confident	11 Å²	11	67.6 Å²	67.6	9%	0.091	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-43.5	171.7	0	0	0	0	0	111	Y631 V677 L678 R684 G685 L686 P689	Y631-A681 HydrophobicContact CE1-CB 4.11Å; Y631-A681 VanDerWaalsContact OH-C 3.31Å; Y631-A681 VanDerWaalsContact OH-CB 3.22Å; Y631-A681 WeakPolarHBondContact OH-CB 3.46Å; V677-A681 PolarHBondContact O-N 3.19Å; L678-A681 PolarHBondContact O-N 3.31Å; A681-R684 PolarHBondContact O-N 3.14Å; A681-G685 PolarHBondContact O-N 3.16Å; A681-L686 HydrophobicContact CB-CB 4.3Å; A681-L686 PolarHBondContact O-N 3.49Å; A681-P689 HydrophobicContact CB-CG 4.16Å
682	Q	87.3	Confident	86.8	Confident	86 Å²	86	70.7 Å²	70.7	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-60.9	-47	176.1	-168.9	-179	19.3	0	0	112.5	Y631 L678 K679 R684 G685	Y631-Q682 HydrophobicContact CD1-CB 3.84Å; Y631-Q682 HydrophobicContact CD1-CG 4.25Å; Y631-Q682 HydrophobicContact CD2-CB 4.43Å; Y631-Q682 HydrophobicContact CD2-CG 4.24Å; Y631-Q682 HydrophobicContact CE1-CB 3.85Å; Y631-Q682 HydrophobicContact CE2-CB 4.43Å; Y631-Q682 HydrophobicContact CG-CB 4.15Å; Y631-Q682 HydrophobicContact CG-CG 4.05Å; L678-Q682 WeakPolarHBondContact O-CB 3.23Å; L678-Q682 PolarHBondContact O-N 2.98Å; K679-Q682 PolarHBondContact O-N 3.04Å; Q682-R684 VanDerWaalsContact C-N 3.27Å; Q682-R684 PolarHBondContact O-N 3.09Å; Q682-G685 PolarHBondContact O-N 2.97Å
683	S	87.1	Confident	86.8	Confident	96 Å²	96	70.2 Å²	70.2	67%	0.671	37%	0.371	S	S	*	.	H	α-helix	trans	-70.9	-21	-179.8	67	0	0	0	0	113.7	K679 L680	K679-S683 WeakPolarHBondContact O-CB 3.47Å; K679-S683 PolarHBondContact O-N 2.9Å; K679-S683 PolarHBondContact O-OG 3.35Å; L680-S683 PolarHBondContact O-OG 2.87Å
684	R	86.9	Confident	86.8	Confident	144 Å²	144	68.3 Å²	68.3	54%	0.543	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.5	170.4	-69.9	173.1	177.5	-171.7	-0.7	113.6	L680 A681 Q682 L686	L680-R684 HydrophobicContact CD1-CG 4.46Å; L680-R684 WeakPolarHBondContact O-CB 3.46Å; L680-R684 WeakPolarHBondContact O-CD 3.25Å; L680-R684 WeakPolarHBondContact O-CG 3.5Å; L680-R684 PolarHBondContact O-N 3.36Å; A681-R684 PolarHBondContact O-N 3.14Å; Q682-R684 VanDerWaalsContact C-N 3.27Å; Q682-R684 PolarHBondContact O-N 3.09Å; R684-L686 HydrophobicContact CB-CD1 3.93Å; R684-L686 HydrophobicContact CB-CG 3.86Å; R684-L686 PolarHBondContact O-N 2.84Å
685	G	80.2	Confident	86.8	Confident	55 Å²	55	73.9 Å²	73.9	57%	0.567	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	22.1	-176.3	0	0	0	0	0	114.3	A681 Q682	A681-G685 PolarHBondContact O-N 3.16Å; Q682-G685 PolarHBondContact O-N 2.97Å
686	L	82.6	Confident	86.8	Confident	82 Å²	82	75.9 Å²	75.9	43%	0.429	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-76	159.3	179.4	-67.9	173.6	0	0	0	111.2	Y631 A681 R684	Y631-L686 WeakPolarHBondContact CE2-O 3.41Å; Y631-L686 PolarHBondContact OH-O 3.32Å; A681-L686 HydrophobicContact CB-CB 4.3Å; A681-L686 PolarHBondContact O-N 3.49Å; R684-L686 HydrophobicContact CB-CD1 3.93Å; R684-L686 HydrophobicContact CB-CG 3.86Å; R684-L686 PolarHBondContact O-N 2.84Å
687	P	78.9	Confident	86.8	Confident	98 Å²	98	76.7 Å²	76.7	64%	0.636	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-61.1	151	168.5	27.7	-35.7	0	0	0	111.1	Y631	Y631-P687 VanDerWaalsContact OH-C 3.29Å; Y631-P687 PolarHBondContact OH-O 2.98Å; Y631-P687 VanDerWaalsContact OH-O 3.07Å
688	P	78.8	Confident	86.8	Confident	40 Å²	40	74.1 Å²	74.1	26%	0.26	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-52.2	136	175.6	-26.7	34.7	0	0	0	112	A627 V630 Y631 L634	A627-P688 HydrophobicContact CB-CG 4.36Å; V630-P688 HydrophobicContact CB-CG 4.35Å; V630-P688 HydrophobicContact CG1-CB 4.06Å; V630-P688 HydrophobicContact CG1-CG 3.94Å; Y631-P688 HydrophobicContact CD2-CG 4.03Å; Y631-P688 HydrophobicContact CE2-CB 4.45Å; Y631-P688 HydrophobicContact CE2-CG 3.82Å; L634-P688 HydrophobicContact CD1-CB 4.38Å
689	P	83	Confident	86.8	Confident	25 Å²	25	81.8 Å²	81.8	16%	0.162	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-52.8	146.3	172.2	-28.6	35.9	0	0	0	112.6	L678 A681 H691 I864	L678-P689 HydrophobicContact CD1-CG 4.27Å; A681-P689 HydrophobicContact CB-CG 4.16Å; P689-H691 PolarHBondContact O-ND1 3.39Å; P689-I864 HydrophobicContact CB-CG2 3.6Å; P689-I864 HydrophobicContact CG-CG2 4.42Å
690	Q	84.3	Confident	86.6	Confident	135 Å²	135	77.3 Å²	77.3	63%	0.631	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-59	142.9	168.1	-73.9	-174.2	-9.3	0	0	109.5	D865	Q690-D865 HydrophobicContact CB-CB 4.07Å; Q690-D865 PolarHBondContact O-N 3.08Å
691	H	87.6	Confident	86.5	Confident	72 Å²	72	73.9 Å²	73.9	33%	0.333	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.7	-174.9	60.8	-86	0	0	0	110.1	P689 L862 V863	P689-H691 PolarHBondContact O-ND1 3.39Å; H691-L862 HydrophobicContact CB-CD1 3.78Å; H691-V863 WeakPolarHBondContact CA-O 3.27Å; H691-V863 VanDerWaalsContact CB-O 3.26Å; H691-V863 WeakPolarHBondContact CB-O 3.16Å
692	H	88.9	Confident	86.5	Confident	68 Å²	68	77.2 Å²	77.2	32%	0.315	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	170.5	174.9	60.3	-89.6	0	0	0	110	E694 L862 V863 D865	H692-E694 WeakPolarHBondContact NE2-CG 3.16Å; H692-L862 WeakPolarHBondContact O-CA 3.47Å; H692-V863 PolarHBondContact N-O 3.06Å; H692-V863 PolarHBondContact O-N 3.14Å; H692-D865 IonicContact CE1-OD1 3.56Å; H692-D865 PolarHBondContact CE1-OD1 2.87Å; H692-D865 IonicContact CE1-OD2 2.6Å; H692-D865 IonicContact CG-OD2 3.61Å; H692-D865 VanDerWaalsContact ND1-CG 3.3Å; H692-D865 IonicContact ND1-OD1 3.84Å; H692-D865 PolarHBondContact ND1-OD1 2.73Å; H692-D865 VanDerWaalsContact ND1-OD1 3.14Å; H692-D865 IonicContact ND1-OD2 2.57Å; H692-D865 PolarHBondContact ND1-OD2 3.17Å
693	F	91.1	Very high	86.5	Confident	104 Å²	104	73.5 Å²	73.5	46%	0.456	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.7	175.9	-68.1	-91.8	0	0	0	109.8	I637 R860 W861 L862	I637-F693 HydrophobicContact CD1-CE1 4.43Å; I637-F693 HydrophobicContact CD1-CZ 4.31Å; F693-R860 HydrophobicContact CB-CB 4.4Å; F693-R860 HydrophobicContact CD1-CB 4.15Å; F693-W861 WeakPolarHBondContact CA-O 3.19Å; F693-L862 HydrophobicContact CD1-CB 4.01Å; F693-L862 HydrophobicContact CE1-CB 3.73Å; F693-L862 HydrophobicContact CE1-CD1 4.14Å; F693-L862 HydrophobicContact CE1-CG 4.45Å; F693-L862 HydrophobicContact CE2-CD1 4.3Å; F693-L862 HydrophobicContact CZ-CB 4.39Å; F693-L862 HydrophobicContact CZ-CD1 3.99Å
694	E	92.3	Very high	86.6	Confident	80 Å²	80	70 Å²	70	37%	0.374	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.1	170.9	-60.1	-175.1	119.2	0	0	109.5	H692 K696 W861 V863	H692-E694 WeakPolarHBondContact NE2-CG 3.16Å; E694-K696 HydrophobicContact CB-CG 4.42Å; E694-K696 PolarHBondContact O-N 3.09Å; E694-K696 WeakPolarHBondContact OE2-CE 3.5Å; E694-K696 IonicContact OE2-NZ 3.58Å; E694-K696 PolarHBondContact OE2-NZ 2.95Å; E694-W861 PolarHBondContact N-O 3.21Å; E694-W861 WeakPolarHBondContact O-CA 3.39Å; E694-W861 VanDerWaalsContact O-CB 3.24Å; E694-W861 WeakPolarHBondContact O-CB 3.27Å; E694-W861 PolarHBondContact O-N 2.88Å; E694-V863 HydrophobicContact CG-CG2 4.14Å; E694-V863 WeakPolarHBondContact OE2-CG2 3.44Å
695	E	91	Very high	86.5	Confident	132 Å²	132	65.8 Å²	65.8	62%	0.617	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	109.6	171.8	-65.1	-160.4	154.7	0	0	110.3	T858 R860	E695-T858 HydrophobicContact CB-CG2 4.4Å; E695-R860 HydrophobicContact CG-CG 4.29Å; E695-R860 IonicContact OE1-NE 3.86Å
696	K	90	Very high	86.8	Confident	55 Å²	55	68.9 Å²	68.9	24%	0.239	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123	179.8	-71.4	-176	-179	147.3	0	110.9	E694 F698 T858 E859 W861	E694-K696 HydrophobicContact CB-CG 4.42Å; E694-K696 PolarHBondContact O-N 3.09Å; E694-K696 WeakPolarHBondContact OE2-CE 3.5Å; E694-K696 IonicContact OE2-NZ 3.58Å; E694-K696 PolarHBondContact OE2-NZ 2.95Å; K696-F698 HydrophobicContact CB-CE1 4.2Å; K696-F698 HydrophobicContact CB-CE2 3.72Å; K696-F698 HydrophobicContact CB-CZ 3.55Å; K696-F698 HydrophobicContact CD-CZ 4.05Å; K696-F698 HydrophobicContact CG-CZ 4.41Å; K696-T858 WeakPolarHBondContact O-CA 3.41Å; K696-E859 PolarHBondContact N-O 3.38Å; K696-E859 PolarHBondContact O-N 3.11Å; K696-W861 HydrophobicContact CB-CB 4.17Å; K696-W861 HydrophobicContact CD-CB 3.78Å; K696-W861 HydrophobicContact CD-CD2 4.34Å; K696-W861 HydrophobicContact CD-CG 3.72Å; K696-W861 HydrophobicContact CG-CB 3.98Å; K696-W861 HydrophobicContact CG-CG 4.43Å
697	S	90.3	Very high	87.2	Confident	82 Å²	82	66 Å²	66	57%	0.573	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.6	172.5	-65.7	0	0	0	0	110.2	S857 T858	S697-S857 CarbonylContact C-O 3.44Å; S697-S857 VanDerWaalsContact CA-O 3.31Å; S697-S857 WeakPolarHBondContact CA-O 3.26Å; S697-T858 PolarHBondContact OG-OG1 3.34Å
698	F	89.1	Confident	87.8	Confident	15 Å²	15	63.2 Å²	63.2	7%	0.066	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.2	174.6	-58.6	-69.9	0	0	0	110.3	F664 L667 K696 T700 T856 S857 E859 W861	F664-F698 HydrophobicContact CE1-CB 4.5Å; F664-F698 AromaticContact CE1-CD1 3.5Å; F664-F698 HydrophobicContact CE1-CD1 3.5Å; F664-F698 VanDerWaalsContact CE1-CD1 3.5Å; F664-F698 HydrophobicContact CE1-CE1 4.02Å; F664-F698 HydrophobicContact CE1-CG 4.19Å; F664-F698 HydrophobicContact CZ-CB 4.25Å; F664-F698 AromaticContact CZ-CD1 3.77Å; F664-F698 HydrophobicContact CZ-CD1 3.77Å; F664-F698 HydrophobicContact CZ-CG 4.36Å; L667-F698 HydrophobicContact CD2-CE1 3.54Å; L667-F698 HydrophobicContact CD2-CZ 3.9Å; K696-F698 HydrophobicContact CB-CE1 4.2Å; K696-F698 HydrophobicContact CB-CE2 3.72Å; K696-F698 HydrophobicContact CB-CZ 3.55Å; K696-F698 HydrophobicContact CD-CZ 4.05Å; K696-F698 HydrophobicContact CG-CZ 4.41Å; F698-T700 HydrophobicContact CB-CG2 4.14Å; F698-T856 CarbonylContact O-C 3.56Å; F698-T856 VanDerWaalsContact O-CA 3.29Å; F698-T856 WeakPolarHBondContact O-CA 3.46Å; F698-S857 PolarHBondContact N-O 3.26Å; F698-S857 PolarHBondContact O-N 3.03Å; F698-E859 HydrophobicContact CE2-CB 4.43Å; F698-W861 HydrophobicContact CD2-CZ3 4.5Å; F698-W861 HydrophobicContact CE2-CD2 4.15Å; F698-W861 AromaticContact CE2-CE3 3.35Å; F698-W861 HydrophobicContact CE2-CE3 3.35Å; F698-W861 HydrophobicContact CE2-CH2 4.34Å; F698-W861 AromaticContact CE2-CZ3 3.47Å; F698-W861 HydrophobicContact CE2-CZ3 3.47Å; F698-W861 VanDerWaalsContact CE2-CZ3 3.47Å; F698-W861 AromaticContact CZ-CD2 3.81Å; F698-W861 HydrophobicContact CZ-CD2 3.81Å; F698-W861 AromaticContact CZ-CE3 3.45Å; F698-W861 HydrophobicContact CZ-CE3 3.45Å; F698-W861 VanDerWaalsContact CZ-CE3 3.45Å; F698-W861 HydrophobicContact CZ-CH2 4.08Å; F698-W861 HydrophobicContact CZ-CZ2 4.41Å; F698-W861 AromaticContact CZ-CZ3 3.6Å; F698-W861 HydrophobicContact CZ-CZ3 3.6Å
699	R	88	Confident	88.3	Confident	161 Å²	161	64 Å²	64	61%	0.608	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	112.1	166.1	-176	-179.7	178.2	132.5	1.7	107.4	F652 V854	F652-R699 WeakPolarHBondContact CZ-O 3.47Å; R699-V854 HydrophobicContact CG-CG1 3.58Å
700	T	86.3	Confident	88.7	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.037	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	169.6	-178.8	58.5	0	0	0	0	109.6	Y648 F664 F698 V854 Q855	Y648-T700 HydrophobicContact CD1-CG2 3.6Å; Y648-T700 HydrophobicContact CD2-CG2 3.84Å; Y648-T700 HydrophobicContact CE1-CG2 3.76Å; Y648-T700 HydrophobicContact CE2-CG2 3.97Å; Y648-T700 HydrophobicContact CG-CG2 3.65Å; F664-T700 HydrophobicContact CZ-CG2 4.28Å; F698-T700 HydrophobicContact CB-CG2 4.14Å; T700-V854 WeakPolarHBondContact O-CA 3.49Å; T700-Q855 PolarHBondContact N-O 2.99Å; T700-Q855 PolarHBondContact O-N 3.14Å; T700-Q855 VanDerWaalsContact O-O 3.1Å; T700-Q855 PolarHBondContact OG1-O 3.22Å
701	V	85.9	Confident	89.2	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.1	177.1	-177.4	0	0	0	0	108.9	Q651 F652 L655 I703 Q852 D853 V854	Q651-V701 PolarHBondContact OE1-O 2.74Å; F652-V701 HydrophobicContact CE1-CG2 3.8Å; F652-V701 HydrophobicContact CZ-CG2 4.18Å; L655-V701 HydrophobicContact CD1-CB 3.51Å; L655-V701 HydrophobicContact CD1-CG1 3.57Å; L655-V701 HydrophobicContact CD1-CG2 4.02Å; V701-I703 HydrophobicContact CG1-CG2 4.28Å; V701-I703 PolarHBondContact O-N 2.84Å; V701-Q852 HydrophobicContact CG1-CB 4.02Å; V701-Q852 HydrophobicContact CG2-CB 4.47Å; V701-D853 CarbonylContact C-O 3.53Å; V701-D853 WeakPolarHBondContact CA-O 3.39Å; V701-V854 HydrophobicContact CG2-CG2 4.31Å
702	R	87	Confident	89.5	Confident	82 Å²	82	58.9 Å²	58.9	31%	0.309	30%	0.295	S	S	.	.			trans	-76.4	108.2	-179.2	-176.1	-176.7	-63.3	-177	3.3	109.9	F704 S820 D853	R702-F704 HydrophobicContact CG-CE2 3.99Å; R702-F704 HydrophobicContact CG-CZ 4.22Å; R702-S820 WeakPolarHBondContact O-CB 3.39Å; R702-S820 PolarHBondContact O-OG 2.86Å; R702-D853 HydrophobicContact CB-CB 4.23Å; R702-D853 PolarHBondContact N-O 3.24Å
703	I	87.7	Confident	89.9	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.036	29%	0.286	C	S	.	.			trans	-124	154.2	169.2	62.2	164.5	0	0	0	110.5	Q651 H654 L655 V701 P705 R846 E847	Q651-I703 HydrophobicContact CB-CD1 4.41Å; Q651-I703 HydrophobicContact CB-CG1 4.22Å; Q651-I703 HydrophobicContact CG-CD1 4.46Å; Q651-I703 HydrophobicContact CG-CG1 3.93Å; H654-I703 HydrophobicContact CB-CD1 3.56Å; L655-I703 HydrophobicContact CD1-CG2 4.25Å; L655-I703 HydrophobicContact CD2-CG2 4.14Å; L655-I703 HydrophobicContact CG-CG2 4.38Å; V701-I703 HydrophobicContact CG1-CG2 4.28Å; V701-I703 PolarHBondContact O-N 2.84Å; I703-P705 WeakPolarHBondContact O-CD 3.41Å; I703-R846 CarbonylContact C-O 3.58Å; I703-R846 VanDerWaalsContact CA-O 3.3Å; I703-R846 WeakPolarHBondContact CA-O 3.28Å; I703-R846 WeakPolarHBondContact CB-O 3.39Å; I703-E847 HydrophobicContact CG2-CG 3.83Å
704	F	88.8	Confident	90.1	Very high	23 Å²	23	51.7 Å²	51.7	10%	0.101	26%	0.264	C	S	.	.			trans	-115.2	80.8	175.7	-66.2	-80.7	0	0	0	108.3	R702 E706 L707 E821 L845 R846	R702-F704 HydrophobicContact CG-CE2 3.99Å; R702-F704 HydrophobicContact CG-CZ 4.22Å; F704-E706 WeakPolarHBondContact CA-OE2 3.25Å; F704-E706 WeakPolarHBondContact CB-OE2 3.36Å; F704-E706 WeakPolarHBondContact CD1-OE1 3.48Å; F704-E706 PolarHBondContact O-N 2.91Å; F704-L707 HydrophobicContact CB-CD1 4Å; F704-L707 HydrophobicContact CB-CG 4.13Å; F704-L707 WeakPolarHBondContact O-CB 3.34Å; F704-L707 PolarHBondContact O-N 3.44Å; F704-E821 HydrophobicContact CE2-CB 3.68Å; F704-E821 HydrophobicContact CZ-CB 3.79Å; F704-L845 WeakPolarHBondContact CD2-O 3.39Å; F704-R846 PolarHBondContact N-O 3.18Å; F704-R846 WeakPolarHBondContact O-CA 3.17Å
705	P	85.1	Confident	90.3	Very high	55 Å²	55	50 Å²	50	36%	0.357	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.7	-173.1	30.4	-36.1	0	0	0	113.1	I703 L707	I703-P705 WeakPolarHBondContact O-CD 3.41Å; P705-L707 PolarHBondContact O-N 3.23Å
706	E	86.9	Confident	90.6	Very high	121 Å²	121	43.7 Å²	43.7	57%	0.565	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.1	170.5	78.7	-80.2	-165.3	0	0	113.5	F704	F704-E706 WeakPolarHBondContact CA-OE2 3.25Å; F704-E706 WeakPolarHBondContact CB-OE2 3.36Å; F704-E706 WeakPolarHBondContact CD1-OE1 3.48Å; F704-E706 PolarHBondContact O-N 2.91Å
707	L	90.6	Very high	90.9	Very high	21 Å²	21	41.8 Å²	41.8	11%	0.11	22%	0.221	C	C	.	.	S	Bend	trans	-101.6	142.1	177.3	-56.2	-176.2	0	0	0	111.3	F704 P705 V713 R844 R846	F704-L707 HydrophobicContact CB-CD1 4Å; F704-L707 HydrophobicContact CB-CG 4.13Å; F704-L707 WeakPolarHBondContact O-CB 3.34Å; F704-L707 PolarHBondContact O-N 3.44Å; P705-L707 PolarHBondContact O-N 3.23Å; L707-V713 HydrophobicContact CD1-CG2 4.31Å; L707-V713 HydrophobicContact CD2-CG2 3.56Å; L707-R844 HydrophobicContact CD1-CB 3.88Å; L707-R846 HydrophobicContact CB-CB 4.01Å; L707-R846 VanDerWaalsContact O-CD 3.31Å; L707-R846 WeakPolarHBondContact O-CD 3.25Å; L707-R846 VanDerWaalsContact O-CG 3.29Å; L707-R846 WeakPolarHBondContact O-CG 3.24Å; L707-R846 PolarHBondContact O-NH1 3.06Å
708	S	90.8	Very high	91.2	Very high	40 Å²	40	40.6 Å²	40.6	28%	0.28	21%	0.205	S	C	.	.			trans	-76.3	159.8	171.5	87.8	0	0	0	0	111.3	T710 D711	S708-T710 PolarHBondContact O-N 3.27Å; S708-T710 VanDerWaalsContact O-N 3.14Å; S708-T710 PolarHBondContact OG-N 3.34Å; S708-T710 VanDerWaalsContact OG-N 3.15Å; S708-T710 PolarHBondContact OG-OG1 3.12Å; S708-D711 VanDerWaalsContact CB-OD2 3.27Å; S708-D711 WeakPolarHBondContact CB-OD2 3.44Å; S708-D711 PolarHBondContact O-N 3.36Å; S708-D711 PolarHBondContact OG-N 3.42Å; S708-D711 PolarHBondContact OG-OD2 3.09Å
709	S	88.8	Confident	91.5	Very high	57 Å²	57	39.9 Å²	39.9	40%	0.399	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-5.5	173.7	-55	0	0	0	0	113.6	R775 R846	S709-R775 WeakPolarHBondContact O-CD 3.37Å; S709-R775 WeakPolarHBondContact O-CG 3.43Å; S709-R846 WeakPolarHBondContact OG-CD 3.24Å
710	T	92.4	Very high	91.8	Very high	78 Å²	78	35 Å²	35	48%	0.479	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	2.5	175.4	40.3	0	0	0	0	113.5	S708 S772 I773	S708-T710 PolarHBondContact O-N 3.27Å; S708-T710 VanDerWaalsContact O-N 3.14Å; S708-T710 PolarHBondContact OG-N 3.34Å; S708-T710 VanDerWaalsContact OG-N 3.15Å; S708-T710 PolarHBondContact OG-OG1 3.12Å; T710-S772 WeakPolarHBondContact O-CA 3.42Å; T710-I773 VanDerWaalsContact O-CG1 3.29Å; T710-I773 WeakPolarHBondContact O-CG1 3.42Å; T710-I773 PolarHBondContact O-N 2.97Å
711	D	94.1	Very high	92.1	Very high	46 Å²	46	39.2 Å²	39.2	25%	0.246	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.7	-176.8	-65.6	-45.3	0	0	0	113.5	S708 T770	S708-D711 VanDerWaalsContact CB-OD2 3.27Å; S708-D711 WeakPolarHBondContact CB-OD2 3.44Å; S708-D711 PolarHBondContact O-N 3.36Å; S708-D711 PolarHBondContact OG-N 3.42Å; S708-D711 PolarHBondContact OG-OD2 3.09Å; D711-T770 HydrophobicContact CB-CG2 3.74Å; D711-T770 WeakPolarHBondContact OD1-CG2 3.39Å
712	M	94.7	Very high	92.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.9	165.3	-173.9	177.8	76.6	0	0	108.7	V714 F741 L771 I773 F780 L816 V843 R844 L845	M712-V714 HydrophobicContact CE-CG2 4.27Å; M712-F741 HydrophobicContact CE-CD2 4.26Å; M712-F741 HydrophobicContact CE-CE1 4.35Å; M712-F741 HydrophobicContact CE-CE2 3.52Å; M712-F741 HydrophobicContact CE-CZ 3.57Å; M712-L771 HydrophobicContact CE-CD1 3.75Å; M712-L771 PolarHBondContact N-O 3.05Å; M712-L771 WeakPolarHBondContact O-CB 3.5Å; M712-L771 PolarHBondContact O-N 3.14Å; M712-I773 HydrophobicContact CB-CD1 4.11Å; M712-I773 HydrophobicContact CB-CG1 4.29Å; M712-I773 HydrophobicContact CB-CG2 3.83Å; M712-F780 HydrophobicContact SD-CE2 4.26Å; M712-F780 HydrophobicContact SD-CZ 4.34Å; M712-L816 HydrophobicContact SD-CD1 3.82Å; M712-V843 HydrophobicContact CE-CG1 4.21Å; M712-V843 HydrophobicContact CG-CG1 3.77Å; M712-V843 HydrophobicContact SD-CG1 3.76Å; M712-R844 CarbonylContact C-O 3.5Å; M712-R844 WeakPolarHBondContact CA-O 3.46Å; M712-R844 WeakPolarHBondContact CG-O 3.44Å; M712-L845 HydrophobicContact CB-CD2 3.68Å; M712-L845 HydrophobicContact CG-CD2 3.61Å; M712-L845 HydrophobicContact CG-CG 4.33Å; M712-L845 HydrophobicContact SD-CD2 4.16Å
713	V	96.3	Very high	92.4	Very high	20 Å²	20	37 Å²	37	12%	0.121	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.4	-178.9	175.9	0	0	0	0	110.2	L707 F769 T770 V843 R844	L707-V713 HydrophobicContact CD1-CG2 4.31Å; L707-V713 HydrophobicContact CD2-CG2 3.56Å; V713-F769 WeakPolarHBondContact CA-O 3.36Å; V713-T770 HydrophobicContact CG2-CG2 4.29Å; V713-V843 CarbonylContact O-C 3.58Å; V713-V843 WeakPolarHBondContact O-CA 3.41Å; V713-R844 PolarHBondContact N-O 3.34Å; V713-R844 PolarHBondContact O-N 3.06Å
714	V	96.6	Very high	92.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.9	169.9	178.2	0	0	0	0	108.3	M712 I716 F739 S768 F769 L771 L789 V841 V843	M712-V714 HydrophobicContact CE-CG2 4.27Å; V714-I716 HydrophobicContact CG1-CG1 4.28Å; V714-F739 HydrophobicContact CB-CZ 4.21Å; V714-F739 HydrophobicContact CG1-CE1 4.32Å; V714-F739 HydrophobicContact CG1-CZ 4.23Å; V714-S768 CarbonylContact O-C 3.52Å; V714-S768 WeakPolarHBondContact O-CA 3.33Å; V714-F769 PolarHBondContact N-O 3.28Å; V714-F769 PolarHBondContact O-N 3.25Å; V714-L771 HydrophobicContact CB-CD1 4.48Å; V714-L771 HydrophobicContact CG2-CD1 3.56Å; V714-L771 HydrophobicContact CG2-CG 4.45Å; V714-L789 HydrophobicContact CG1-CD2 3.95Å; V714-L789 HydrophobicContact CG2-CD2 3.81Å; V714-V841 HydrophobicContact CG1-CG1 4.02Å; V714-V843 HydrophobicContact CG2-CG1 4.11Å; V714-V843 HydrophobicContact CG2-CG2 4.28Å
715	L	97.1	Very high	92.1	Very high	45 Å²	45	38 Å²	38	24%	0.236	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	110.6	174.6	166.9	57.8	0	0	0	109.3	V717 K842	L715-V717 HydrophobicContact CG-CG2 4.22Å; L715-V717 PolarHBondContact O-N 3.46Å; L715-K842 HydrophobicContact CB-CB 4.23Å; L715-K842 HydrophobicContact CD2-CD 4.17Å; L715-K842 PolarHBondContact N-O 3.34Å; L715-K842 PolarHBondContact O-N 3.02Å
716	I	96.9	Very high	91.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.2	173.9	-60.3	-177.6	0	0	0	107.2	V714 I737 F739 T754 F765 N766 Q767 F769 L791 V841	V714-I716 HydrophobicContact CG1-CG1 4.28Å; I716-I737 HydrophobicContact CD1-CB 4.17Å; I716-I737 HydrophobicContact CD1-CG2 3.66Å; I716-I737 HydrophobicContact CG2-CD1 3.56Å; I716-F739 HydrophobicContact CD1-CD1 3.97Å; I716-F739 HydrophobicContact CD1-CE1 3.92Å; I716-T754 HydrophobicContact CB-CG2 4.34Å; I716-T754 HydrophobicContact CD1-CG2 3.84Å; I716-T754 HydrophobicContact CG2-CG2 4.22Å; I716-F765 HydrophobicContact CG2-CB 4.15Å; I716-F765 HydrophobicContact CG2-CD2 3.79Å; I716-F765 HydrophobicContact CG2-CG 4.23Å; I716-N766 WeakPolarHBondContact O-CA 3.46Å; I716-N766 PolarHBondContact O-N 2.88Å; I716-N766 VanDerWaalsContact O-N 3.08Å; I716-Q767 PolarHBondContact N-O 2.64Å; I716-Q767 PolarHBondContact O-N 2.96Å; I716-F769 HydrophobicContact CD1-CD2 4.43Å; I716-F769 HydrophobicContact CD1-CE2 3.91Å; I716-F769 HydrophobicContact CG1-CD2 4.5Å; I716-F769 HydrophobicContact CG1-CE2 4.19Å; I716-L791 HydrophobicContact CD1-CD1 4.44Å; I716-L791 HydrophobicContact CD1-CD2 4.33Å; I716-V841 HydrophobicContact CG1-CG1 4.5Å
717	V	96.6	Very high	91.5	Very high	14 Å²	14	39.1 Å²	39.1	9%	0.085	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-67.3	-175.2	-175	0	0	0	0	109.1	L715 F765 N766 E840 K842	L715-V717 HydrophobicContact CG-CG2 4.22Å; L715-V717 PolarHBondContact O-N 3.46Å; V717-F765 PolarHBondContact O-N 3.42Å; V717-N766 PolarHBondContact O-N 2.84Å; V717-E840 HydrophobicContact CB-CB 4.11Å; V717-E840 HydrophobicContact CB-CG 3.96Å; V717-E840 WeakPolarHBondContact CB-O 3.26Å; V717-E840 HydrophobicContact CG1-CG 4.41Å; V717-E840 HydrophobicContact CG2-CG 4.1Å; V717-E840 PolarHBondContact N-O 3.43Å; V717-K842 HydrophobicContact CG2-CD 4.2Å; V717-K842 HydrophobicContact CG2-CG 4.22Å
718	K	95.9	Very high	91.2	Very high	58 Å²	58	39.5 Å²	39.5	25%	0.252	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	154.1	-177	60.3	-172.9	168.3	-173.1	0	115.2	M720 P763 E764 V839 E840	K718-M720 HydrophobicContact CG-CG 4.41Å; K718-P763 CarbonylContact C-O 3.54Å; K718-P763 WeakPolarHBondContact CA-O 3.35Å; K718-P763 WeakPolarHBondContact CB-O 3.17Å; K718-E764 HydrophobicContact CB-CB 4.24Å; K718-E764 HydrophobicContact CB-CG 3.93Å; K718-E764 HydrophobicContact CD-CG 3.93Å; K718-E764 WeakPolarHBondContact CD-OE1 3.5Å; K718-E764 IonicContact NZ-OE1 2.72Å; K718-E764 PolarHBondContact NZ-OE1 3.22Å; K718-V839 CarbonylContact O-C 3.51Å; K718-V839 WeakPolarHBondContact O-CA 3.3Å; K718-E840 HydrophobicContact CG-CB 4.21Å; K718-E840 PolarHBondContact N-O 3.38Å; K718-E840 PolarHBondContact O-N 3.43Å
719	G	95.4	Very high	90.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	152.5	158.8	0	0	0	0	0	111.3	S762 P763 R838	G719-S762 CarbonylContact O-C 3.54Å; G719-S762 VanDerWaalsContact O-CA 3.27Å; G719-S762 WeakPolarHBondContact O-CA 3.05Å; G719-P763 PolarHBondContact N-O 3.18Å; G719-R838 CarbonylContact C-O 3.44Å; G719-R838 WeakPolarHBondContact CA-O 3.18Å
720	M	95.1	Very high	90.5	Very high	58 Å²	58	43.3 Å²	43.3	29%	0.286	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.3	177.8	-57.8	175.9	73	0	0	108.9	K718 L722 I825 G837 R838	K718-M720 HydrophobicContact CG-CG 4.41Å; M720-L722 PolarHBondContact O-N 2.65Å; M720-I825 HydrophobicContact SD-CG2 4.42Å; M720-G837 WeakPolarHBondContact O-CA 3.23Å; M720-R838 HydrophobicContact CB-CB 4.45Å; M720-R838 PolarHBondContact N-O 3.34Å; M720-R838 PolarHBondContact O-N 2.95Å
721	N	92.4	Very high	90.1	Very high	94 Å²	94	44.9 Å²	44.9	50%	0.503	27%	0.273	S	S	.	.	S	Bend	trans	49.6	39.7	176.9	-62.6	-23.5	0	0	0	114.2	N761 S762 G837	N721-N761 PolarHBondContact N-O 3.38Å; N721-S762 PolarHBondContact N-OG 3.47Å; N721-S762 VanDerWaalsContact N-OG 3.13Å; N721-G837 WeakPolarHBondContact O-CA 3.34Å
722	L	91.7	Very high	89.9	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-59.4	139.5	-179.4	-59.5	-173.3	0	0	0	111.2	M720 L733 A735 N761 P763 L793 V806 V828	M720-L722 PolarHBondContact O-N 2.65Å; L722-L733 HydrophobicContact CB-CD2 3.65Å; L722-L733 HydrophobicContact CD1-CD2 4.22Å; L722-A735 HydrophobicContact CD1-CB 4.17Å; L722-N761 WeakPolarHBondContact CB-O 3.26Å; L722-N761 WeakPolarHBondContact CG-O 3.28Å; L722-N761 PolarHBondContact N-O 3.13Å; L722-P763 HydrophobicContact CD1-CG 3.59Å; L722-L793 HydrophobicContact CD1-CD2 3.98Å; L722-L793 HydrophobicContact CD2-CD2 3.47Å; L722-L793 VanDerWaalsContact CD2-CD2 3.47Å; L722-L793 HydrophobicContact CG-CD2 4.34Å; L722-V806 HydrophobicContact CB-CG1 4.36Å; L722-V828 HydrophobicContact CD2-CG2 4.09Å
723	P	86.9	Confident	89.6	Confident	34 Å²	34	46.7 Å²	46.7	22%	0.221	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-69.2	146	-178.8	31.7	-38.6	0	0	0	111.1	V806 T835	P723-V806 HydrophobicContact CG-CG1 3.73Å; P723-V806 WeakPolarHBondContact CG-O 3.5Å; P723-T835 HydrophobicContact CG-CG2 4.14Å
724	A	85.3	Confident	89.5	Confident	37 Å²	37	47.2 Å²	47.2	31%	0.306	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-82.5	123.9	173.2	0	0	0	0	0	110.4	V728 P730	A724-V728 VanDerWaalsContact CB-O 3.3Å; A724-V728 WeakPolarHBondContact CB-O 3.42Å; A724-P730 HydrophobicContact CB-CB 4.48Å; A724-P730 HydrophobicContact CB-CG 4.02Å
725	P	85	Confident	89.4	Confident	16 Å²	16	47.4 Å²	47.4	10%	0.104	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-73.7	146	178.2	30.4	-33.7	0	0	0	110.8	G727 V728 L733 H795 K804 V806	P725-G727 PolarHBondContact O-N 3.46Å; P725-V728 HydrophobicContact CG-CB 4.44Å; P725-V728 HydrophobicContact CG-CG2 4.2Å; P725-V728 WeakPolarHBondContact O-CB 3.12Å; P725-V728 WeakPolarHBondContact O-CG2 3.33Å; P725-V728 PolarHBondContact O-N 3.01Å; P725-V728 VanDerWaalsContact O-N 3.08Å; P725-L733 VanDerWaalsContact CD-CD1 3.45Å; P725-L733 HydrophobicContact CG-CD1 4.2Å; P725-H795 HydrophobicContact CG-CB 3.68Å; P725-K804 HydrophobicContact CB-CB 4.04Å; P725-K804 HydrophobicContact CB-CD 3.97Å; P725-K804 HydrophobicContact CG-CB 4.2Å; P725-K804 HydrophobicContact CG-CD 4.1Å; P725-V806 HydrophobicContact CG-CG2 4.25Å
726	S	81.2	Confident	89.3	Confident	114 Å²	114	46.4 Å²	46.4	80%	0.797	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.6	118.2	-168.4	-52.6	0	0	0	0	114.9	K804	S726-K804 PolarHBondContact O-NZ 2.99Å
727	G	77.1	Confident	89.3	Confident	84 Å²	84	46.4 Å²	46.4	87%	0.866	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	22.6	-178.9	0	0	0	0	0	115.4	P725	P725-G727 PolarHBondContact O-N 3.46Å
728	V	84.1	Confident	89.3	Confident	29 Å²	29	49 Å²	49	18%	0.176	29%	0.29	C	S	.	.			trans	-129.2	148.7	170.7	-170.2	0	0	0	0	107.4	A724 P725 D732	A724-V728 VanDerWaalsContact CB-O 3.3Å; A724-V728 WeakPolarHBondContact CB-O 3.42Å; P725-V728 HydrophobicContact CG-CB 4.44Å; P725-V728 HydrophobicContact CG-CG2 4.2Å; P725-V728 WeakPolarHBondContact O-CB 3.12Å; P725-V728 WeakPolarHBondContact O-CG2 3.33Å; P725-V728 PolarHBondContact O-N 3.01Å; P725-V728 VanDerWaalsContact O-N 3.08Å; V728-D732 HydrophobicContact CG1-CB 3.93Å; V728-D732 WeakPolarHBondContact CG1-O 3.31Å
729	Q	82.8	Confident	89.2	Confident	128 Å²	128	46.3 Å²	46.3	60%	0.598	28%	0.278	S	S	*	.			trans	-87.1	154.9	171.3	-67	-66.6	-10.8	0	0	110.7	N731 D732 L733	Q729-N731 PolarHBondContact O-N 3.25Å; Q729-N731 VanDerWaalsContact O-N 3.14Å; Q729-D732 HydrophobicContact CB-CB 4.29Å; Q729-D732 PolarHBondContact O-N 3.31Å; Q729-L733 PolarHBondContact O-N 3.18Å
730	P	82.2	Confident	89.1	Confident	50 Å²	50	49.4 Å²	49.4	33%	0.325	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-54.5	-34.6	177	-26.3	34.6	0	0	0	113.6	A724 L733 T760 N761	A724-P730 HydrophobicContact CB-CB 4.48Å; A724-P730 HydrophobicContact CB-CG 4.02Å; P730-L733 WeakPolarHBondContact O-CB 3.21Å; P730-T760 CarbonylContact O-C 3.48Å; P730-N761 HydrophobicContact CB-CB 4.07Å; P730-N761 WeakPolarHBondContact O-CB 3.32Å; P730-N761 PolarHBondContact O-N 3.11Å
731	N	85.3	Confident	89	Confident	111 Å²	111	46.6 Å²	46.6	59%	0.594	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-87	-3.8	-179.9	-59.6	2.3	0	0	0	113.4	Q729 N759	Q729-N731 PolarHBondContact O-N 3.25Å; Q729-N731 VanDerWaalsContact O-N 3.14Å; N731-N759 CarbonylContact O-C 3.5Å; N731-N759 WeakPolarHBondContact O-CA 3.28Å; N731-N759 WeakPolarHBondContact O-CB 3.28Å; N731-N759 VanDerWaalsContact O-O 3.13Å
732	D	88.8	Confident	88.7	Confident	84 Å²	84	44.2 Å²	44.2	45%	0.449	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-104.2	14.5	172.5	-66.2	-40.7	0	0	0	111.6	V728 Q729 D734 N759	V728-D732 HydrophobicContact CG1-CB 3.93Å; V728-D732 WeakPolarHBondContact CG1-O 3.31Å; Q729-D732 HydrophobicContact CB-CB 4.29Å; Q729-D732 PolarHBondContact O-N 3.31Å; D732-D734 PolarHBondContact O-N 3.4Å; D732-N759 PolarHBondContact OD1-ND2 3.16Å
733	L	89.8	Confident	88.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.274	C	S	.	.			trans	-78.8	100.3	-178.3	-172.9	74.3	0	0	0	110.9	L722 P725 Q729 P730 A735 N759 T760 H795 V806	L722-L733 HydrophobicContact CB-CD2 3.65Å; L722-L733 HydrophobicContact CD1-CD2 4.22Å; P725-L733 VanDerWaalsContact CD-CD1 3.45Å; P725-L733 HydrophobicContact CG-CD1 4.2Å; Q729-L733 PolarHBondContact O-N 3.18Å; P730-L733 WeakPolarHBondContact O-CB 3.21Å; L733-A735 HydrophobicContact CD2-CB 4.13Å; L733-A735 HydrophobicContact CG-CB 4.12Å; L733-A735 PolarHBondContact O-N 3.12Å; L733-N759 PolarHBondContact O-N 3.45Å; L733-T760 PolarHBondContact O-N 2.97Å; L733-T760 VanDerWaalsContact O-N 3.13Å; L733-H795 HydrophobicContact CD1-CB 3.86Å; L733-V806 HydrophobicContact CD1-CG2 4.01Å
734	D	93.3	Very high	88.3	Confident	31 Å²	31	46.4 Å²	46.4	17%	0.166	28%	0.282	C	S	.	.			trans	-76.4	93.9	162.8	-80.5	18.1	0	0	0	109.3	D732 V756 I757 K758 N759 H795 K796	D732-D734 PolarHBondContact O-N 3.4Å; D734-V756 HydrophobicContact CB-CG1 4.08Å; D734-I757 CarbonylContact C-O 3.56Å; D734-I757 WeakPolarHBondContact CA-O 3.43Å; D734-K758 VanDerWaalsContact OD1-CA 3.24Å; D734-K758 WeakPolarHBondContact OD1-CA 3.44Å; D734-K758 VanDerWaalsContact OD1-CB 3.25Å; D734-K758 WeakPolarHBondContact OD1-CB 3.16Å; D734-K758 WeakPolarHBondContact OD2-CD 3.45Å; D734-K758 WeakPolarHBondContact OD2-CE 3.49Å; D734-K758 WeakPolarHBondContact OD2-CG 3.41Å; D734-N759 PolarHBondContact OD1-N 3.24Å; D734-N759 VanDerWaalsContact OD1-N 3.09Å; D734-H795 PolarHBondContact N-ND1 3.38Å; D734-H795 CarbonylContact O-C 3.55Å; D734-H795 WeakPolarHBondContact O-CA 3.48Å; D734-H795 PolarHBondContact O-ND1 3.41Å; D734-H795 VanDerWaalsContact O-ND1 3.13Å; D734-K796 HydrophobicContact CB-CB 4.12Å; D734-K796 PolarHBondContact O-N 2.8Å
735	A	94.3	Very high	88.1	Confident	3 Å²	3	47.5 Å²	47.5	3%	0.025	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.6	-172.3	0	0	0	0	0	113.5	L722 L733 V756 I757 P763 F765	L722-A735 HydrophobicContact CD1-CB 4.17Å; L733-A735 HydrophobicContact CD2-CB 4.13Å; L733-A735 HydrophobicContact CG-CB 4.12Å; L733-A735 PolarHBondContact O-N 3.12Å; A735-V756 WeakPolarHBondContact O-CA 3.34Å; A735-I757 PolarHBondContact N-O 2.99Å; A735-I757 PolarHBondContact O-N 3.24Å; A735-P763 HydrophobicContact CB-CB 4.22Å; A735-P763 HydrophobicContact CB-CG 3.8Å; A735-F765 HydrophobicContact CB-CZ 4.4Å
736	Y	95.9	Very high	87.9	Confident	25 Å²	25	50.6 Å²	50.6	10%	0.098	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	158.2	162.9	73.6	-77.8	0	0	0	111.1	V756 L794 K796 D803	Y736-V756 HydrophobicContact CD1-CG2 4.19Å; Y736-V756 HydrophobicContact CG-CG2 4.23Å; Y736-L794 HydrophobicContact CD1-CB 4.2Å; Y736-L794 WeakPolarHBondContact CD1-O 3.47Å; Y736-L794 HydrophobicContact CE1-CB 3.57Å; Y736-L794 HydrophobicContact CE2-CB 4.35Å; Y736-L794 HydrophobicContact CE2-CD1 4.24Å; Y736-L794 PolarHBondContact N-O 2.99Å; Y736-L794 PolarHBondContact O-N 3.4Å; Y736-K796 HydrophobicContact CD1-CB 4.25Å; Y736-K796 HydrophobicContact CD1-CD 4.37Å; Y736-K796 HydrophobicContact CE1-CB 4.3Å; Y736-K796 HydrophobicContact CE1-CD 4.01Å; Y736-D803 HydrophobicContact CE1-CB 4.35Å; Y736-D803 PolarHBondContact OH-OD2 3.23Å
737	I	96.3	Very high	88.1	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.9	172.3	-70.8	158	0	0	0	109	I716 K753 T754 F765 L791 E792 L793 V839	I716-I737 HydrophobicContact CD1-CB 4.17Å; I716-I737 HydrophobicContact CD1-CG2 3.66Å; I716-I737 HydrophobicContact CG2-CD1 3.56Å; I737-K753 CarbonylContact O-C 3.57Å; I737-K753 VanDerWaalsContact O-CA 3.26Å; I737-K753 WeakPolarHBondContact O-CA 3.46Å; I737-T754 HydrophobicContact CB-CG2 3.97Å; I737-T754 PolarHBondContact N-OG1 3.23Å; I737-T754 PolarHBondContact O-N 2.94Å; I737-T754 PolarHBondContact O-OG1 3.45Å; I737-F765 HydrophobicContact CD1-CD2 4.03Å; I737-F765 HydrophobicContact CD1-CE2 3.58Å; I737-F765 HydrophobicContact CD1-CZ 4.23Å; I737-F765 HydrophobicContact CG1-CE2 4.22Å; I737-F765 HydrophobicContact CG1-CZ 4.39Å; I737-L791 HydrophobicContact CG2-CB 3.95Å; I737-L791 HydrophobicContact CG2-CD1 4.23Å; I737-L791 HydrophobicContact CG2-CD2 4.2Å; I737-L791 HydrophobicContact CG2-CG 4.35Å; I737-E792 WeakPolarHBondContact CA-O 3.43Å; I737-L793 HydrophobicContact CD1-CD1 4.33Å; I737-L793 HydrophobicContact CD1-CG 4.28Å; I737-L793 HydrophobicContact CG1-CD1 3.88Å; I737-L793 HydrophobicContact CG1-CG 3.69Å; I737-V839 HydrophobicContact CD1-CG2 3.72Å
738	K	95.8	Very high	88.4	Confident	67 Å²	67	56.6 Å²	56.6	29%	0.291	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	156.4	160.5	73.8	-177.7	-171.2	-172.4	0	109.4	H752 K753 E792 L794	K738-H752 CarbonylContact C-O 3.55Å; K738-H752 VanDerWaalsContact CA-O 3.24Å; K738-H752 WeakPolarHBondContact CA-O 3.38Å; K738-K753 HydrophobicContact CB-CB 4.15Å; K738-E792 WeakPolarHBondContact CE-OE2 3.33Å; K738-E792 HydrophobicContact CG-CB 4.03Å; K738-E792 PolarHBondContact N-O 3.15Å; K738-E792 IonicContact NZ-OE2 2.86Å; K738-E792 PolarHBondContact NZ-OE2 3.16Å; K738-E792 PolarHBondContact O-N 3.29Å; K738-L794 HydrophobicContact CD-CD1 3.71Å; K738-L794 HydrophobicContact CG-CD1 3.74Å
739	F	95.6	Very high	88.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.009	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	147.6	169.6	66	-94.9	0	0	0	111.8	V714 I716 F741 K751 H752 F769 L771 L789 K790 L791	V714-F739 HydrophobicContact CB-CZ 4.21Å; V714-F739 HydrophobicContact CG1-CE1 4.32Å; V714-F739 HydrophobicContact CG1-CZ 4.23Å; I716-F739 HydrophobicContact CD1-CD1 3.97Å; I716-F739 HydrophobicContact CD1-CE1 3.92Å; F739-F741 HydrophobicContact CD2-CB 4.46Å; F739-F741 HydrophobicContact CE2-CB 4.49Å; F739-K751 WeakPolarHBondContact O-CA 3.25Å; F739-H752 HydrophobicContact CD1-CB 4.29Å; F739-H752 HydrophobicContact CD2-CB 4.48Å; F739-H752 HydrophobicContact CE1-CB 3.76Å; F739-H752 HydrophobicContact CE2-CB 3.98Å; F739-H752 HydrophobicContact CZ-CB 3.6Å; F739-H752 PolarHBondContact N-O 2.98Å; F739-H752 PolarHBondContact O-N 3.3Å; F739-F769 HydrophobicContact CE1-CB 4.47Å; F739-F769 AromaticContact CE1-CD2 3.71Å; F739-F769 HydrophobicContact CE1-CD2 3.71Å; F739-F769 HydrophobicContact CE1-CE2 4.14Å; F739-F769 HydrophobicContact CE1-CG 4.08Å; F739-F769 HydrophobicContact CZ-CB 3.94Å; F739-F769 HydrophobicContact CZ-CD2 4.05Å; F739-F769 HydrophobicContact CZ-CG 4.04Å; F739-L771 HydrophobicContact CE2-CD1 3.94Å; F739-L771 HydrophobicContact CE2-CD2 3.92Å; F739-L771 HydrophobicContact CZ-CD1 4.45Å; F739-L771 HydrophobicContact CZ-CD2 4.29Å; F739-L789 HydrophobicContact CB-CD1 4.37Å; F739-L789 HydrophobicContact CD2-CD1 3.73Å; F739-L789 HydrophobicContact CD2-CD2 4.43Å; F739-L789 HydrophobicContact CE2-CD1 4.36Å; F739-L789 HydrophobicContact CG-CD1 4.31Å; F739-K790 WeakPolarHBondContact CB-O 3.33Å; F739-L791 HydrophobicContact CB-CD2 3.59Å; F739-L791 HydrophobicContact CD1-CD2 3.74Å; F739-L791 HydrophobicContact CG-CD2 3.84Å
740	D	93.3	Very high	89.2	Confident	65 Å²	65	52.5 Å²	52.5	35%	0.348	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	109.3	176.6	-73.1	16.8	0	0	0	107.3	P742 P749 K751	D740-P742 WeakPolarHBondContact O-CD 3.27Å; D740-P749 HydrophobicContact CB-CB 4.36Å; D740-K751 HydrophobicContact CB-CG 4.45Å; D740-K751 WeakPolarHBondContact OD1-CD 3.5Å; D740-K751 WeakPolarHBondContact OD1-CG 3.45Å; D740-K751 IonicContact OD1-NZ 3.33Å; D740-K751 WeakPolarHBondContact OD2-CE 3.48Å; D740-K751 IonicContact OD2-NZ 2.82Å; D740-K751 PolarHBondContact OD2-NZ 3.01Å
741	F	92.6	Very high	89.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.4	178.5	179.1	-119.4	0	0	0	109.6	M712 F739 Y743 P749 Q750 L771 I773 F780 L783 L789	M712-F741 HydrophobicContact CE-CD2 4.26Å; M712-F741 HydrophobicContact CE-CE1 4.35Å; M712-F741 HydrophobicContact CE-CE2 3.52Å; M712-F741 HydrophobicContact CE-CZ 3.57Å; F739-F741 HydrophobicContact CD2-CB 4.46Å; F739-F741 HydrophobicContact CE2-CB 4.49Å; F741-Y743 HydrophobicContact CE1-CD1 4.08Å; F741-Y743 HydrophobicContact CE1-CG 4.21Å; F741-Y743 PolarHBondContact O-N 3.33Å; F741-P749 CarbonylContact O-C 3.16Å; F741-P749 WeakPolarHBondContact O-CA 3.39Å; F741-P749 WeakPolarHBondContact O-CB 3.48Å; F741-Q750 HydrophobicContact CB-CB 4.33Å; F741-Q750 HydrophobicContact CD1-CB 4.44Å; F741-Q750 PolarHBondContact N-O 3.23Å; F741-Q750 PolarHBondContact O-N 3.15Å; F741-L771 HydrophobicContact CB-CD1 4.18Å; F741-L771 HydrophobicContact CD1-CB 4.14Å; F741-L771 HydrophobicContact CD1-CD1 3.94Å; F741-L771 HydrophobicContact CD1-CG 4.46Å; F741-L771 HydrophobicContact CD2-CD1 4.2Å; F741-L771 HydrophobicContact CE1-CB 4.18Å; F741-L771 HydrophobicContact CE1-CD1 4.32Å; F741-L771 HydrophobicContact CG-CD1 3.87Å; F741-I773 HydrophobicContact CE1-CG2 3.87Å; F741-I773 HydrophobicContact CZ-CG2 3.91Å; F741-F780 HydrophobicContact CZ-CD2 4.14Å; F741-F780 AromaticContact CZ-CE2 3.99Å; F741-F780 HydrophobicContact CZ-CE2 3.99Å; F741-L783 HydrophobicContact CD2-CD2 3.94Å; F741-L783 HydrophobicContact CE2-CD2 3.44Å; F741-L783 VanDerWaalsContact CE2-CD2 3.44Å; F741-L783 HydrophobicContact CE2-CG 4.23Å; F741-L783 HydrophobicContact CZ-CD2 3.86Å; F741-L789 HydrophobicContact CB-CD1 4.34Å; F741-L789 HydrophobicContact CD2-CD1 4.1Å
742	P	86.3	Confident	90.3	Very high	44 Å²	44	53.7 Å²	53.7	29%	0.286	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	55.7	-166.5	35.7	-38	0	0	0	113	D740 L783	D740-P742 WeakPolarHBondContact O-CD 3.27Å; P742-L783 HydrophobicContact CG-CD1 3.61Å; P742-L783 HydrophobicContact CG-CD2 3.92Å; P742-L783 HydrophobicContact CG-CG 4.42Å
743	Y	86.8	Confident	90.6	Very high	24 Å²	24	56.9 Å²	56.9	9%	0.094	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	139.9	176.6	175.7	-82.3	0	0	0	108.6	F741 Q750 S772 N774 H777 F780	F741-Y743 HydrophobicContact CE1-CD1 4.08Å; F741-Y743 HydrophobicContact CE1-CG 4.21Å; F741-Y743 PolarHBondContact O-N 3.33Å; Y743-Q750 PolarHBondContact O-NE2 3.45Å; Y743-S772 VanDerWaalsContact CD1-O 3.23Å; Y743-S772 WeakPolarHBondContact CD1-O 3.44Å; Y743-S772 WeakPolarHBondContact CE1-O 3.49Å; Y743-N774 WeakPolarHBondContact OH-CB 3.38Å; Y743-N774 PolarHBondContact OH-N 2.87Å; Y743-H777 HydrophobicContact CE2-CB 4.17Å; Y743-H777 AromaticContact CE2-ND1 3.54Å; Y743-F780 HydrophobicContact CD2-CB 3.71Å; Y743-F780 HydrophobicContact CE2-CB 3.73Å
744	P	82.5	Confident	90.9	Very high	60 Å²	60	57.1 Å²	57.1	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-69.6	-32.1	10.3	26.2	-35.1	0	0	0	115.2
745	S	81.7	Confident	91	Very high	61 Å²	61	60.8 Å²	60.8	43%	0.427	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.4	-179.1	-72.3	0	0	0	0	111.3	E747 Q748	S745-E747 PolarHBondContact O-N 3.26Å; S745-Q748 CarbonylContact O-C 3.53Å; S745-Q748 PolarHBondContact O-N 3.37Å; S745-Q748 VanDerWaalsContact O-N 3.12Å
746	A	80.3	Confident	91.1	Very high	80 Å²	80	63.2 Å²	63.2	66%	0.661	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.7	176.6	0	0	0	0	0	113.3
747	E	84.8	Confident	91	Very high	184 Å²	184	64.6 Å²	64.6	86%	0.86	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-21.5	175.5	-66.7	164.2	-169.8	0	0	112.8	S745 P749	S745-E747 PolarHBondContact O-N 3.26Å; E747-P749 WeakPolarHBondContact O-CD 3.47Å
748	Q	84.9	Confident	90.8	Very high	141 Å²	141	71 Å²	71	66%	0.659	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	64.3	177	-64.5	-176.3	-0.9	0	0	110.6	S745	S745-Q748 CarbonylContact O-C 3.53Å; S745-Q748 PolarHBondContact O-N 3.37Å; S745-Q748 VanDerWaalsContact O-N 3.12Å
749	P	89.8	Confident	90.6	Very high	31 Å²	31	72.5 Å²	72.5	20%	0.201	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	142.4	176.4	32.8	-36.6	0	0	0	111.3	D740 F741 E747 K751	D740-P749 HydrophobicContact CB-CB 4.36Å; F741-P749 CarbonylContact O-C 3.16Å; F741-P749 WeakPolarHBondContact O-CA 3.39Å; F741-P749 WeakPolarHBondContact O-CB 3.48Å; E747-P749 WeakPolarHBondContact O-CD 3.47Å; P749-K751 HydrophobicContact CG-CG 4.39Å; P749-K751 PolarHBondContact O-N 3.33Å
750	Q	92.9	Very high	90.4	Very high	39 Å²	39	74 Å²	74	18%	0.182	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	116.6	171.3	-71.7	168.1	80	0	0	109.3	F741 Y743 L771 S772	F741-Q750 HydrophobicContact CB-CB 4.33Å; F741-Q750 HydrophobicContact CD1-CB 4.44Å; F741-Q750 PolarHBondContact N-O 3.23Å; F741-Q750 PolarHBondContact O-N 3.15Å; Y743-Q750 PolarHBondContact O-NE2 3.45Å; Q750-L771 HydrophobicContact CB-CD2 4.4Å; Q750-S772 PolarHBondContact NE2-O 3.32Å
751	K	94.3	Very high	90.3	Very high	136 Å²	136	73 Å²	73	59%	0.591	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.3	-173.5	-54.4	-161.5	-178.8	-140.6	0	111.7	F739 D740 P749	F739-K751 WeakPolarHBondContact O-CA 3.25Å; D740-K751 HydrophobicContact CB-CG 4.45Å; D740-K751 WeakPolarHBondContact OD1-CD 3.5Å; D740-K751 WeakPolarHBondContact OD1-CG 3.45Å; D740-K751 IonicContact OD1-NZ 3.33Å; D740-K751 WeakPolarHBondContact OD2-CE 3.48Å; D740-K751 IonicContact OD2-NZ 2.82Å; D740-K751 PolarHBondContact OD2-NZ 3.01Å; P749-K751 HydrophobicContact CG-CG 4.39Å; P749-K751 PolarHBondContact O-N 3.33Å
752	H	96	Very high	90.3	Very high	51 Å²	51	74.9 Å²	74.9	24%	0.236	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.3	-178	-62.9	-95.1	0	0	0	111.2	K738 F739 F769 L771	K738-H752 CarbonylContact C-O 3.55Å; K738-H752 VanDerWaalsContact CA-O 3.24Å; K738-H752 WeakPolarHBondContact CA-O 3.38Å; F739-H752 HydrophobicContact CD1-CB 4.29Å; F739-H752 HydrophobicContact CD2-CB 4.48Å; F739-H752 HydrophobicContact CE1-CB 3.76Å; F739-H752 HydrophobicContact CE2-CB 3.98Å; F739-H752 HydrophobicContact CZ-CB 3.6Å; F739-H752 PolarHBondContact N-O 2.98Å; F739-H752 PolarHBondContact O-N 3.3Å; H752-F769 HydrophobicContact CB-CD1 3.77Å; H752-F769 HydrophobicContact CB-CE1 4.15Å; H752-F769 HydrophobicContact CB-CG 4.13Å; H752-F769 AromaticContact ND1-CD1 3.73Å; H752-L771 WeakPolarHBondContact CD2-CD2 3.49Å; H752-L771 VanDerWaalsContact NE2-CD2 3.26Å; H752-L771 WeakPolarHBondContact NE2-CD2 3.36Å
753	K	95.3	Very high	90.7	Very high	150 Å²	150	72.8 Å²	72.8	65%	0.652	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	145.6	178.2	67.4	-176.6	-177.6	-178.2	0	110.4	I737 K738 F769	I737-K753 CarbonylContact O-C 3.57Å; I737-K753 VanDerWaalsContact O-CA 3.26Å; I737-K753 WeakPolarHBondContact O-CA 3.46Å; K738-K753 HydrophobicContact CB-CB 4.15Å; K753-F769 VanDerWaalsContact O-CE1 3.29Å; K753-F769 WeakPolarHBondContact O-CE1 3.49Å; K753-F769 WeakPolarHBondContact O-CZ 3.43Å
754	T	96.8	Very high	91.1	Very high	6 Å²	6	76.5 Å²	76.5	4%	0.037	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-77.5	166.2	172.1	67.5	0	0	0	0	111.6	I716 I737 F765 F769	I716-T754 HydrophobicContact CB-CG2 4.34Å; I716-T754 HydrophobicContact CD1-CG2 3.84Å; I716-T754 HydrophobicContact CG2-CG2 4.22Å; I737-T754 HydrophobicContact CB-CG2 3.97Å; I737-T754 PolarHBondContact N-OG1 3.23Å; I737-T754 PolarHBondContact O-N 2.94Å; I737-T754 PolarHBondContact O-OG1 3.45Å; T754-F765 HydrophobicContact CG2-CB 4.32Å; T754-F765 HydrophobicContact CG2-CD1 4.08Å; T754-F765 HydrophobicContact CG2-CG 4.16Å; T754-F765 WeakPolarHBondContact OG1-CD1 3.46Å; T754-F765 WeakPolarHBondContact OG1-CE1 3.38Å; T754-F769 HydrophobicContact CG2-CE2 4.11Å; T754-F769 HydrophobicContact CG2-CZ 4.01Å
755	N	95.4	Very high	91.7	Very high	108 Å²	108	74.5 Å²	74.5	58%	0.578	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-58	155.5	156.9	-65.2	-27.7	0	0	0	110.6
756	V	95.2	Very high	92.4	Very high	54 Å²	54	76.2 Å²	76.2	33%	0.327	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-89.1	117	175.9	-175.4	0	0	0	0	108.7	D734 A735 Y736 K796	D734-V756 HydrophobicContact CB-CG1 4.08Å; A735-V756 WeakPolarHBondContact O-CA 3.34Å; Y736-V756 HydrophobicContact CD1-CG2 4.19Å; Y736-V756 HydrophobicContact CG-CG2 4.23Å; V756-K796 HydrophobicContact CG1-CB 3.79Å; V756-K796 HydrophobicContact CG1-CG 4.37Å; V756-K796 HydrophobicContact CG2-CB 4.33Å; V756-K796 HydrophobicContact CG2-CD 4.06Å; V756-K796 HydrophobicContact CG2-CG 4.29Å
757	I	94.6	Very high	93.1	Very high	53 Å²	53	74.7 Å²	74.7	27%	0.272	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-96	130.9	173.4	-51.3	-60.2	0	0	0	107.7	D734 A735 T760 P763 F765	D734-I757 CarbonylContact C-O 3.56Å; D734-I757 WeakPolarHBondContact CA-O 3.43Å; A735-I757 PolarHBondContact N-O 2.99Å; A735-I757 PolarHBondContact O-N 3.24Å; I757-T760 HydrophobicContact CG2-CG2 3.72Å; I757-P763 HydrophobicContact CB-CB 3.67Å; I757-P763 HydrophobicContact CG1-CB 4.1Å; I757-P763 HydrophobicContact CG2-CB 3.86Å; I757-F765 HydrophobicContact CB-CE1 4.33Å; I757-F765 HydrophobicContact CD1-CD1 4.49Å; I757-F765 HydrophobicContact CG1-CD1 3.58Å; I757-F765 HydrophobicContact CG1-CE1 3.68Å; I757-F765 HydrophobicContact CG1-CG 4.49Å
758	K	92.8	Very high	93.7	Very high	135 Å²	135	69.6 Å²	69.6	59%	0.587	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-100.7	154.5	-167.1	-62.9	-162.7	173.2	-179.9	0	113.7	D734 T760	D734-K758 VanDerWaalsContact OD1-CA 3.24Å; D734-K758 WeakPolarHBondContact OD1-CA 3.44Å; D734-K758 VanDerWaalsContact OD1-CB 3.25Å; D734-K758 WeakPolarHBondContact OD1-CB 3.16Å; D734-K758 WeakPolarHBondContact OD2-CD 3.45Å; D734-K758 WeakPolarHBondContact OD2-CE 3.49Å; D734-K758 WeakPolarHBondContact OD2-CG 3.41Å; K758-T760 VanDerWaalsContact C-N 3.32Å; K758-T760 PolarHBondContact O-N 3.4Å
759	N	90.9	Very high	94.2	Very high	98 Å²	98	63.7 Å²	63.7	52%	0.524	33%	0.325	S	S	.	.	S	Bend	trans	48.4	44.8	170.2	-66.2	97.5	0	0	0	114.7	N731 D732 L733 D734	N731-N759 CarbonylContact O-C 3.5Å; N731-N759 WeakPolarHBondContact O-CA 3.28Å; N731-N759 WeakPolarHBondContact O-CB 3.28Å; N731-N759 VanDerWaalsContact O-O 3.13Å; D732-N759 PolarHBondContact OD1-ND2 3.16Å; L733-N759 PolarHBondContact O-N 3.45Å; D734-N759 PolarHBondContact OD1-N 3.24Å; D734-N759 VanDerWaalsContact OD1-N 3.09Å
760	T	92.4	Very high	94.5	Very high	34 Å²	34	66 Å²	66	21%	0.209	34%	0.339	C	S	.	.			trans	-152.3	137	178.7	-179	0	0	0	0	114	P730 L733 I757 K758 S762 P763	P730-T760 CarbonylContact O-C 3.48Å; L733-T760 PolarHBondContact O-N 2.97Å; L733-T760 VanDerWaalsContact O-N 3.13Å; I757-T760 HydrophobicContact CG2-CG2 3.72Å; K758-T760 VanDerWaalsContact C-N 3.32Å; K758-T760 PolarHBondContact O-N 3.4Å; T760-S762 PolarHBondContact O-N 3.4Å; T760-S762 PolarHBondContact OG1-N 3.26Å; T760-S762 PolarHBondContact OG1-O 3.23Å; T760-P763 HydrophobicContact CG2-CB 3.91Å
761	N	91	Very high	94.5	Very high	43 Å²	43	64.2 Å²	64.2	23%	0.23	33%	0.33	C	S	.	.	S	Bend	trans	-76.6	-12.3	170.3	78.6	-13.6	0	0	0	112.8	N721 L722 P730 P763	N721-N761 PolarHBondContact N-O 3.38Å; L722-N761 WeakPolarHBondContact CB-O 3.26Å; L722-N761 WeakPolarHBondContact CG-O 3.28Å; L722-N761 PolarHBondContact N-O 3.13Å; P730-N761 HydrophobicContact CB-CB 4.07Å; P730-N761 WeakPolarHBondContact O-CB 3.32Å; P730-N761 PolarHBondContact O-N 3.11Å; N761-P763 VanDerWaalsContact C-CD 3.48Å
762	S	92.6	Very high	94.5	Very high	41 Å²	41	60.9 Å²	60.9	29%	0.287	32%	0.324	S	S	.	.	S	Bend	trans	-132	69.7	-175.1	-57.9	0	0	0	0	109.6	G719 N721 T760 E764	G719-S762 CarbonylContact O-C 3.54Å; G719-S762 VanDerWaalsContact O-CA 3.27Å; G719-S762 WeakPolarHBondContact O-CA 3.05Å; N721-S762 PolarHBondContact N-OG 3.47Å; N721-S762 VanDerWaalsContact N-OG 3.13Å; T760-S762 PolarHBondContact O-N 3.4Å; T760-S762 PolarHBondContact OG1-N 3.26Å; T760-S762 PolarHBondContact OG1-O 3.23Å; S762-E764 PolarHBondContact O-N 3.4Å
763	P	93.6	Very high	94.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.314	C	S	.	.			trans	-72.7	124.2	-176.6	30	-37.4	0	0	0	111.6	K718 G719 L722 A735 I757 T760 N761 F765	K718-P763 CarbonylContact C-O 3.54Å; K718-P763 WeakPolarHBondContact CA-O 3.35Å; K718-P763 WeakPolarHBondContact CB-O 3.17Å; G719-P763 PolarHBondContact N-O 3.18Å; L722-P763 HydrophobicContact CD1-CG 3.59Å; A735-P763 HydrophobicContact CB-CB 4.22Å; A735-P763 HydrophobicContact CB-CG 3.8Å; I757-P763 HydrophobicContact CB-CB 3.67Å; I757-P763 HydrophobicContact CG1-CB 4.1Å; I757-P763 HydrophobicContact CG2-CB 3.86Å; T760-P763 HydrophobicContact CG2-CB 3.91Å; N761-P763 VanDerWaalsContact C-CD 3.48Å; P763-F765 HydrophobicContact CB-CE1 4.05Å; P763-F765 HydrophobicContact CB-CE2 3.93Å; P763-F765 HydrophobicContact CB-CZ 3.63Å; P763-F765 HydrophobicContact CG-CE1 4.38Å; P763-F765 HydrophobicContact CG-CE2 3.57Å; P763-F765 HydrophobicContact CG-CZ 3.48Å; P763-F765 VanDerWaalsContact CG-CZ 3.48Å
764	E	95.6	Very high	94.2	Very high	102 Å²	102	55 Å²	55	48%	0.477	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.4	167.6	-55.6	-153.8	145.9	0	0	109.6	K718 S762	K718-E764 HydrophobicContact CB-CB 4.24Å; K718-E764 HydrophobicContact CB-CG 3.93Å; K718-E764 HydrophobicContact CD-CG 3.93Å; K718-E764 WeakPolarHBondContact CD-OE1 3.5Å; K718-E764 IonicContact NZ-OE1 2.72Å; K718-E764 PolarHBondContact NZ-OE1 3.22Å; S762-E764 PolarHBondContact O-N 3.4Å
765	F	95	Very high	93.8	Very high	18 Å²	18	56.5 Å²	56.5	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-41.4	-176	-62.2	-72.4	0	0	0	111.8	I716 V717 A735 I737 T754 I757 P763 Q767	I716-F765 HydrophobicContact CG2-CB 4.15Å; I716-F765 HydrophobicContact CG2-CD2 3.79Å; I716-F765 HydrophobicContact CG2-CG 4.23Å; V717-F765 PolarHBondContact O-N 3.42Å; A735-F765 HydrophobicContact CB-CZ 4.4Å; I737-F765 HydrophobicContact CD1-CD2 4.03Å; I737-F765 HydrophobicContact CD1-CE2 3.58Å; I737-F765 HydrophobicContact CD1-CZ 4.23Å; I737-F765 HydrophobicContact CG1-CE2 4.22Å; I737-F765 HydrophobicContact CG1-CZ 4.39Å; T754-F765 HydrophobicContact CG2-CB 4.32Å; T754-F765 HydrophobicContact CG2-CD1 4.08Å; T754-F765 HydrophobicContact CG2-CG 4.16Å; T754-F765 WeakPolarHBondContact OG1-CD1 3.46Å; T754-F765 WeakPolarHBondContact OG1-CE1 3.38Å; I757-F765 HydrophobicContact CB-CE1 4.33Å; I757-F765 HydrophobicContact CD1-CD1 4.49Å; I757-F765 HydrophobicContact CG1-CD1 3.58Å; I757-F765 HydrophobicContact CG1-CE1 3.68Å; I757-F765 HydrophobicContact CG1-CG 4.49Å; P763-F765 HydrophobicContact CB-CE1 4.05Å; P763-F765 HydrophobicContact CB-CE2 3.93Å; P763-F765 HydrophobicContact CB-CZ 3.63Å; P763-F765 HydrophobicContact CG-CE1 4.38Å; P763-F765 HydrophobicContact CG-CE2 3.57Å; P763-F765 HydrophobicContact CG-CZ 3.48Å; P763-F765 VanDerWaalsContact CG-CZ 3.48Å; F765-Q767 PolarHBondContact O-N 3.23Å
766	N	95.9	Very high	93.4	Very high	97 Å²	97	57.4 Å²	57.4	52%	0.519	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.3	37.2	-179	-64.5	-46.5	0	0	0	114.2	I716 V717	I716-N766 WeakPolarHBondContact O-CA 3.46Å; I716-N766 PolarHBondContact O-N 2.88Å; I716-N766 VanDerWaalsContact O-N 3.08Å; V717-N766 PolarHBondContact O-N 2.84Å
767	Q	96.1	Very high	93.2	Very high	47 Å²	47	59 Å²	59	22%	0.22	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.5	-169.2	-167.4	168.9	3.9	0	0	111.5	I716 F765 F769	I716-Q767 PolarHBondContact N-O 2.64Å; I716-Q767 PolarHBondContact O-N 2.96Å; F765-Q767 PolarHBondContact O-N 3.23Å; Q767-F769 HydrophobicContact CB-CE2 4.17Å; Q767-F769 HydrophobicContact CB-CZ 4.17Å; Q767-F769 HydrophobicContact CG-CE1 4.12Å; Q767-F769 HydrophobicContact CG-CE2 4Å; Q767-F769 HydrophobicContact CG-CZ 3.6Å; Q767-F769 WeakPolarHBondContact O-CE2 3.46Å
768	S	95.8	Very high	92.9	Very high	77 Å²	77	66.9 Å²	66.9	54%	0.538	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	147.5	175.2	48	0	0	0	0	112.3	V714	V714-S768 CarbonylContact O-C 3.52Å; V714-S768 WeakPolarHBondContact O-CA 3.33Å
769	F	96.1	Very high	92.7	Very high	18 Å²	18	62.1 Å²	62.1	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	116.1	175.8	-56.3	-81.6	0	0	0	108.9	V713 V714 I716 F739 H752 K753 T754 Q767	V713-F769 WeakPolarHBondContact CA-O 3.36Å; V714-F769 PolarHBondContact N-O 3.28Å; V714-F769 PolarHBondContact O-N 3.25Å; I716-F769 HydrophobicContact CD1-CD2 4.43Å; I716-F769 HydrophobicContact CD1-CE2 3.91Å; I716-F769 HydrophobicContact CG1-CD2 4.5Å; I716-F769 HydrophobicContact CG1-CE2 4.19Å; F739-F769 HydrophobicContact CE1-CB 4.47Å; F739-F769 AromaticContact CE1-CD2 3.71Å; F739-F769 HydrophobicContact CE1-CD2 3.71Å; F739-F769 HydrophobicContact CE1-CE2 4.14Å; F739-F769 HydrophobicContact CE1-CG 4.08Å; F739-F769 HydrophobicContact CZ-CB 3.94Å; F739-F769 HydrophobicContact CZ-CD2 4.05Å; F739-F769 HydrophobicContact CZ-CG 4.04Å; H752-F769 HydrophobicContact CB-CD1 3.77Å; H752-F769 HydrophobicContact CB-CE1 4.15Å; H752-F769 HydrophobicContact CB-CG 4.13Å; H752-F769 AromaticContact ND1-CD1 3.73Å; K753-F769 VanDerWaalsContact O-CE1 3.29Å; K753-F769 WeakPolarHBondContact O-CE1 3.49Å; K753-F769 WeakPolarHBondContact O-CZ 3.43Å; T754-F769 HydrophobicContact CG2-CE2 4.11Å; T754-F769 HydrophobicContact CG2-CZ 4.01Å; Q767-F769 HydrophobicContact CB-CE2 4.17Å; Q767-F769 HydrophobicContact CB-CZ 4.17Å; Q767-F769 HydrophobicContact CG-CE1 4.12Å; Q767-F769 HydrophobicContact CG-CE2 4Å; Q767-F769 HydrophobicContact CG-CZ 3.6Å; Q767-F769 WeakPolarHBondContact O-CE2 3.46Å
770	T	95.7	Very high	92.7	Very high	80 Å²	80	57.5 Å²	57.5	49%	0.491	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.8	171.9	-47	0	0	0	0	109.2	D711 V713	D711-T770 HydrophobicContact CB-CG2 3.74Å; D711-T770 WeakPolarHBondContact OD1-CG2 3.39Å; V713-T770 HydrophobicContact CG2-CG2 4.29Å
771	L	94	Very high	92.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.4	179.2	-54.8	175.5	0	0	0	109	M712 V714 F739 F741 Q750 H752	M712-L771 HydrophobicContact CE-CD1 3.75Å; M712-L771 PolarHBondContact N-O 3.05Å; M712-L771 WeakPolarHBondContact O-CB 3.5Å; M712-L771 PolarHBondContact O-N 3.14Å; V714-L771 HydrophobicContact CB-CD1 4.48Å; V714-L771 HydrophobicContact CG2-CD1 3.56Å; V714-L771 HydrophobicContact CG2-CG 4.45Å; F739-L771 HydrophobicContact CE2-CD1 3.94Å; F739-L771 HydrophobicContact CE2-CD2 3.92Å; F739-L771 HydrophobicContact CZ-CD1 4.45Å; F739-L771 HydrophobicContact CZ-CD2 4.29Å; F741-L771 HydrophobicContact CB-CD1 4.18Å; F741-L771 HydrophobicContact CD1-CB 4.14Å; F741-L771 HydrophobicContact CD1-CD1 3.94Å; F741-L771 HydrophobicContact CD1-CG 4.46Å; F741-L771 HydrophobicContact CD2-CD1 4.2Å; F741-L771 HydrophobicContact CE1-CB 4.18Å; F741-L771 HydrophobicContact CE1-CD1 4.32Å; F741-L771 HydrophobicContact CG-CD1 3.87Å; Q750-L771 HydrophobicContact CB-CD2 4.4Å; H752-L771 WeakPolarHBondContact CD2-CD2 3.49Å; H752-L771 VanDerWaalsContact NE2-CD2 3.26Å; H752-L771 WeakPolarHBondContact NE2-CD2 3.36Å
772	S	93.2	Very high	92.4	Very high	67 Å²	67	66.8 Å²	66.8	47%	0.469	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.5	175.5	-174.9	0	0	0	0	110.3	T710 Y743 Q750	T710-S772 WeakPolarHBondContact O-CA 3.42Å; Y743-S772 VanDerWaalsContact CD1-O 3.23Å; Y743-S772 WeakPolarHBondContact CD1-O 3.44Å; Y743-S772 WeakPolarHBondContact CE1-O 3.49Å; Q750-S772 PolarHBondContact NE2-O 3.32Å
773	I	93.6	Very high	92.3	Very high	3 Å²	3	65 Å²	65	2%	0.015	32%	0.321	C	S	.	.			trans	-133.4	161.2	-178.3	59.4	154.7	0	0	0	111.3	T710 M712 F741 R775 F780 L845	T710-I773 VanDerWaalsContact O-CG1 3.29Å; T710-I773 WeakPolarHBondContact O-CG1 3.42Å; T710-I773 PolarHBondContact O-N 2.97Å; M712-I773 HydrophobicContact CB-CD1 4.11Å; M712-I773 HydrophobicContact CB-CG1 4.29Å; M712-I773 HydrophobicContact CB-CG2 3.83Å; F741-I773 HydrophobicContact CE1-CG2 3.87Å; F741-I773 HydrophobicContact CZ-CG2 3.91Å; I773-R775 HydrophobicContact CD1-CG 4.09Å; I773-F780 HydrophobicContact CB-CD2 4.29Å; I773-F780 HydrophobicContact CB-CE1 4.24Å; I773-F780 HydrophobicContact CB-CE2 4.05Å; I773-F780 HydrophobicContact CB-CZ 4.02Å; I773-F780 HydrophobicContact CD1-CE1 3.74Å; I773-F780 HydrophobicContact CD1-CE2 4.45Å; I773-F780 HydrophobicContact CD1-CZ 3.63Å; I773-F780 HydrophobicContact CG1-CZ 4.45Å; I773-F780 HydrophobicContact CG2-CD2 4Å; I773-F780 HydrophobicContact CG2-CE2 3.56Å; I773-F780 HydrophobicContact CG2-CZ 3.89Å; I773-L845 HydrophobicContact CD1-CD2 3.49Å; I773-L845 VanDerWaalsContact CD1-CD2 3.49Å
774	N	91.3	Very high	92.2	Very high	74 Å²	74	65.1 Å²	65.1	40%	0.396	32%	0.322	S	S	.	.			trans	-125.6	110.1	162.9	-175.6	-43.2	0	0	0	109	Y743 N776 H777 F780	Y743-N774 WeakPolarHBondContact OH-CB 3.38Å; Y743-N774 PolarHBondContact OH-N 2.87Å; N774-N776 PolarHBondContact O-N 3.39Å; N774-N776 WeakPolarHBondContact OD1-CA 3.47Å; N774-N776 PolarHBondContact OD1-N 3.46Å; N774-H777 HydrophobicContact CB-CB 4.01Å; N774-H777 PolarHBondContact O-N 2.82Å; N774-H777 PolarHBondContact OD1-N 2.99Å; N774-F780 VanDerWaalsContact O-CD1 3.31Å; N774-F780 WeakPolarHBondContact O-CD1 3.34Å
775	R	89.1	Confident	91.9	Very high	38 Å²	38	62.8 Å²	62.8	14%	0.143	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.7	-178	-64.7	164.9	67.8	77	-4.3	113.5	S709 I773 R781 E847 P848 L849	S709-R775 WeakPolarHBondContact O-CD 3.37Å; S709-R775 WeakPolarHBondContact O-CG 3.43Å; I773-R775 HydrophobicContact CD1-CG 4.09Å; R775-R781 PolarHBondContact O-NE 3.41Å; R775-R781 PolarHBondContact O-NH2 2.82Å; R775-E847 PolarHBondContact NH1-O 3.41Å; R775-E847 VanDerWaalsContact NH2-CB 3.31Å; R775-E847 PolarHBondContact NH2-O 3.36Å; R775-E847 IonicContact NH2-OE2 3.23Å; R775-P848 PolarHBondContact NH2-O 3.44Å; R775-L849 HydrophobicContact CB-CD2 4.25Å; R775-L849 HydrophobicContact CG-CD2 3.95Å
776	N	87.9	Confident	91.3	Very high	126 Å²	126	65.5 Å²	65.5	67%	0.674	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-11.2	-178.2	-65.6	-21.7	0	0	0	113.5	N774 R778 R781	N774-N776 PolarHBondContact O-N 3.39Å; N774-N776 WeakPolarHBondContact OD1-CA 3.47Å; N774-N776 PolarHBondContact OD1-N 3.46Å; N776-R778 PolarHBondContact O-N 3.18Å; N776-R781 PolarHBondContact OD1-NH2 3.09Å
777	H	90.3	Very high	90.7	Very high	88 Å²	88	66.5 Å²	66.5	41%	0.407	34%	0.341	S	S	.	.			trans	-72.5	123.5	178.2	-173	-126.4	0	0	0	111.6	Y743 N774 G779 F780 R781	Y743-H777 HydrophobicContact CE2-CB 4.17Å; Y743-H777 AromaticContact CE2-ND1 3.54Å; N774-H777 HydrophobicContact CB-CB 4.01Å; N774-H777 PolarHBondContact O-N 2.82Å; N774-H777 PolarHBondContact OD1-N 2.99Å; H777-G779 PolarHBondContact ND1-N 3.25Å; H777-G779 PolarHBondContact O-N 2.99Å; H777-G779 VanDerWaalsContact O-N 3.11Å; H777-F780 PolarHBondContact O-N 3.07Å; H777-R781 PolarHBondContact O-N 3.12Å
778	R	88.1	Confident	90.4	Very high	219 Å²	219	64.7 Å²	64.7	83%	0.826	34%	0.335	S	S	*	.	H	α-helix	trans	-54.2	-33.1	178.5	-173.2	-178.9	179.1	-141.1	0.4	113.1	N776 R782	N776-R778 PolarHBondContact O-N 3.18Å; R778-R782 WeakPolarHBondContact O-CB 3.38Å; R778-R782 PolarHBondContact O-N 3.34Å
779	G	87.4	Confident	90.3	Very high	35 Å²	35	61 Å²	61	36%	0.361	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-39.4	175.8	0	0	0	0	0	113.3	H777 L783	H777-G779 PolarHBondContact ND1-N 3.25Å; H777-G779 PolarHBondContact O-N 2.99Å; H777-G779 VanDerWaalsContact O-N 3.11Å; G779-L783 WeakPolarHBondContact O-CB 3.42Å; G779-L783 PolarHBondContact O-N 3.04Å
780	F	91	Very high	90.2	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-70.7	-48.8	177	174.1	-119.4	0	0	0	111.4	M712 F741 Y743 I773 N774 H777 R782 L783 V784 L849	M712-F780 HydrophobicContact SD-CE2 4.26Å; M712-F780 HydrophobicContact SD-CZ 4.34Å; F741-F780 HydrophobicContact CZ-CD2 4.14Å; F741-F780 AromaticContact CZ-CE2 3.99Å; F741-F780 HydrophobicContact CZ-CE2 3.99Å; Y743-F780 HydrophobicContact CD2-CB 3.71Å; Y743-F780 HydrophobicContact CE2-CB 3.73Å; I773-F780 HydrophobicContact CB-CD2 4.29Å; I773-F780 HydrophobicContact CB-CE1 4.24Å; I773-F780 HydrophobicContact CB-CE2 4.05Å; I773-F780 HydrophobicContact CB-CZ 4.02Å; I773-F780 HydrophobicContact CD1-CE1 3.74Å; I773-F780 HydrophobicContact CD1-CE2 4.45Å; I773-F780 HydrophobicContact CD1-CZ 3.63Å; I773-F780 HydrophobicContact CG1-CZ 4.45Å; I773-F780 HydrophobicContact CG2-CD2 4Å; I773-F780 HydrophobicContact CG2-CE2 3.56Å; I773-F780 HydrophobicContact CG2-CZ 3.89Å; N774-F780 VanDerWaalsContact O-CD1 3.31Å; N774-F780 WeakPolarHBondContact O-CD1 3.34Å; H777-F780 PolarHBondContact O-N 3.07Å; F780-R782 VanDerWaalsContact C-N 3.27Å; F780-R782 PolarHBondContact O-N 2.83Å; F780-L783 WeakPolarHBondContact O-CA 3.47Å; F780-L783 WeakPolarHBondContact O-CB 3.45Å; F780-L783 PolarHBondContact O-N 3.14Å; F780-V784 HydrophobicContact CD2-CG2 4.08Å; F780-V784 HydrophobicContact CE1-CG2 4.3Å; F780-V784 HydrophobicContact CE2-CG2 3.62Å; F780-V784 HydrophobicContact CZ-CG2 3.75Å; F780-V784 WeakPolarHBondContact O-CG2 3.37Å; F780-V784 PolarHBondContact O-N 2.78Å; F780-L849 HydrophobicContact CD1-CD1 4.3Å; F780-L849 HydrophobicContact CE1-CD1 3.55Å; F780-L849 HydrophobicContact CE1-CD2 3.73Å; F780-L849 HydrophobicContact CE1-CG 4.31Å; F780-L849 HydrophobicContact CZ-CD1 3.98Å; F780-L849 HydrophobicContact CZ-CD2 4.41Å
781	R	90	Very high	90.2	Very high	102 Å²	102	60.9 Å²	60.9	39%	0.385	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-38.8	176.4	-63.4	-165.9	-173.3	-169.4	3.6	112.3	R775 N776 H777 V784 A785	R775-R781 PolarHBondContact O-NE 3.41Å; R775-R781 PolarHBondContact O-NH2 2.82Å; N776-R781 PolarHBondContact OD1-NH2 3.09Å; H777-R781 PolarHBondContact O-N 3.12Å; R781-V784 PolarHBondContact O-N 3.21Å; R781-A785 WeakPolarHBondContact O-CB 3.29Å; R781-A785 PolarHBondContact O-N 3.4Å
782	R	88.6	Confident	90.3	Very high	170 Å²	170	63.8 Å²	63.8	64%	0.642	32%	0.315	S	S	*	.	H	α-helix	trans	-66	-36.8	173.4	-172.3	178	-177.7	-173.4	3.8	113.3	R778 F780 S786	R778-R782 WeakPolarHBondContact O-CB 3.38Å; R778-R782 PolarHBondContact O-N 3.34Å; F780-R782 VanDerWaalsContact C-N 3.27Å; F780-R782 PolarHBondContact O-N 2.83Å; R782-S786 PolarHBondContact O-N 2.86Å; R782-S786 PolarHBondContact O-OG 3.34Å
783	L	89.7	Confident	90.4	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-45.3	175.3	170.5	54.4	0	0	0	110.8	F741 P742 G779 F780 K787 G788	F741-L783 HydrophobicContact CD2-CD2 3.94Å; F741-L783 HydrophobicContact CE2-CD2 3.44Å; F741-L783 VanDerWaalsContact CE2-CD2 3.44Å; F741-L783 HydrophobicContact CE2-CG 4.23Å; F741-L783 HydrophobicContact CZ-CD2 3.86Å; P742-L783 HydrophobicContact CG-CD1 3.61Å; P742-L783 HydrophobicContact CG-CD2 3.92Å; P742-L783 HydrophobicContact CG-CG 4.42Å; G779-L783 WeakPolarHBondContact O-CB 3.42Å; G779-L783 PolarHBondContact O-N 3.04Å; F780-L783 WeakPolarHBondContact O-CA 3.47Å; F780-L783 WeakPolarHBondContact O-CB 3.45Å; F780-L783 PolarHBondContact O-N 3.14Å; L783-K787 HydrophobicContact CD1-CB 3.64Å; L783-K787 HydrophobicContact CD1-CD 4.12Å; L783-K787 PolarHBondContact O-N 3.37Å; L783-K787 VanDerWaalsContact O-N 3.11Å; L783-G788 WeakPolarHBondContact CD1-O 3.42Å; L783-G788 PolarHBondContact O-N 3.07Å
784	V	91.4	Very high	90.4	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-57	176.7	175.1	0	0	0	0	111.1	F780 R781 S786 L813 D814 L816 E817 L849	F780-V784 HydrophobicContact CD2-CG2 4.08Å; F780-V784 HydrophobicContact CE1-CG2 4.3Å; F780-V784 HydrophobicContact CE2-CG2 3.62Å; F780-V784 HydrophobicContact CZ-CG2 3.75Å; F780-V784 WeakPolarHBondContact O-CG2 3.37Å; F780-V784 PolarHBondContact O-N 2.78Å; R781-V784 PolarHBondContact O-N 3.21Å; V784-S786 PolarHBondContact O-N 2.97Å; V784-L813 HydrophobicContact CB-CB 4.36Å; V784-L813 HydrophobicContact CG1-CB 4.05Å; V784-L813 WeakPolarHBondContact CG1-O 3.38Å; V784-L813 CarbonylContact O-C 3.58Å; V784-D814 PolarHBondContact O-N 3.12Å; V784-L816 HydrophobicContact CG1-CB 4.13Å; V784-E817 HydrophobicContact CG1-CG 4.12Å; V784-L849 HydrophobicContact CB-CD1 4.27Å; V784-L849 HydrophobicContact CG1-CD1 4.03Å; V784-L849 HydrophobicContact CG2-CD1 3.87Å
785	A	89.1	Confident	90.5	Very high	53 Å²	53	58.9 Å²	58.9	44%	0.438	28%	0.283	S	S	.	.	H	α-helix	trans	-69.2	-31.8	-174.9	0	0	0	0	0	115.1	R781	R781-A785 WeakPolarHBondContact O-CB 3.29Å; R781-A785 PolarHBondContact O-N 3.4Å
786	S	83.1	Confident	90.7	Very high	75 Å²	75	60.8 Å²	60.8	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-133.2	0.6	-164.5	104	0	0	0	0	116.8	R782 V784	R782-S786 PolarHBondContact O-N 2.86Å; R782-S786 PolarHBondContact O-OG 3.34Å; V784-S786 PolarHBondContact O-N 2.97Å
787	K	82.8	Confident	90.7	Very high	119 Å²	119	55.4 Å²	55.4	52%	0.517	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-35.3	-178.6	-75.6	-175.4	174.1	-173.2	0	114	L783	L783-K787 HydrophobicContact CD1-CB 3.64Å; L783-K787 HydrophobicContact CD1-CD 4.12Å; L783-K787 PolarHBondContact O-N 3.37Å; L783-K787 VanDerWaalsContact O-N 3.11Å
788	G	90.1	Very high	90.4	Very high	9 Å²	9	53.5 Å²	53.5	9%	0.093	27%	0.271	C	S	.	.			trans	68.3	-166.1	-176	0	0	0	0	0	113.7	L783 I811	L783-G788 WeakPolarHBondContact CD1-O 3.42Å; L783-G788 PolarHBondContact O-N 3.07Å; G788-I811 CarbonylContact C-O 3.56Å; G788-I811 WeakPolarHBondContact CA-O 3.45Å
789	L	93.3	Very high	90.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.6	177.3	177.2	65.8	0	0	0	110.7	V714 F739 F741 L791 I811 L813	V714-L789 HydrophobicContact CG1-CD2 3.95Å; V714-L789 HydrophobicContact CG2-CD2 3.81Å; F739-L789 HydrophobicContact CB-CD1 4.37Å; F739-L789 HydrophobicContact CD2-CD1 3.73Å; F739-L789 HydrophobicContact CD2-CD2 4.43Å; F739-L789 HydrophobicContact CE2-CD1 4.36Å; F739-L789 HydrophobicContact CG-CD1 4.31Å; F741-L789 HydrophobicContact CB-CD1 4.34Å; F741-L789 HydrophobicContact CD2-CD1 4.1Å; L789-L791 HydrophobicContact CD2-CD2 4.17Å; L789-L791 HydrophobicContact CG-CD2 4.24Å; L789-I811 HydrophobicContact CB-CB 4.41Å; L789-I811 HydrophobicContact CB-CD1 4.13Å; L789-I811 HydrophobicContact CD2-CD1 3.87Å; L789-I811 HydrophobicContact CG-CD1 4.11Å; L789-I811 PolarHBondContact N-O 3.42Å; L789-I811 PolarHBondContact O-N 2.87Å; L789-L813 HydrophobicContact CB-CD1 4.18Å; L789-L813 HydrophobicContact CB-CG 4.45Å
790	K	94.6	Very high	90.3	Very high	95 Å²	95	58 Å²	58	41%	0.413	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.4	176.2	-170.5	-164.7	180	-166.6	0	110.5	F739 E792 A809 L810	F739-K790 WeakPolarHBondContact CB-O 3.33Å; K790-E792 HydrophobicContact CD-CG 4.35Å; K790-E792 WeakPolarHBondContact CE-OE1 3.48Å; K790-E792 IonicContact NZ-OE1 2.91Å; K790-E792 PolarHBondContact NZ-OE1 3.3Å; K790-A809 WeakPolarHBondContact CA-O 3.12Å; K790-L810 HydrophobicContact CB-CD1 4.04Å
791	L	95.6	Very high	90.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137.3	164.7	-54.2	-171.5	0	0	0	109.7	I716 I737 F739 L789 L793 S808 A809 I811 V839 V841	I716-L791 HydrophobicContact CD1-CD1 4.44Å; I716-L791 HydrophobicContact CD1-CD2 4.33Å; I737-L791 HydrophobicContact CG2-CB 3.95Å; I737-L791 HydrophobicContact CG2-CD1 4.23Å; I737-L791 HydrophobicContact CG2-CD2 4.2Å; I737-L791 HydrophobicContact CG2-CG 4.35Å; F739-L791 HydrophobicContact CB-CD2 3.59Å; F739-L791 HydrophobicContact CD1-CD2 3.74Å; F739-L791 HydrophobicContact CG-CD2 3.84Å; L789-L791 HydrophobicContact CD2-CD2 4.17Å; L789-L791 HydrophobicContact CG-CD2 4.24Å; L791-L793 HydrophobicContact CB-CD1 4.28Å; L791-S808 CarbonylContact O-C 3.38Å; L791-S808 WeakPolarHBondContact O-CA 3.46Å; L791-S808 VanDerWaalsContact O-CB 3.23Å; L791-S808 WeakPolarHBondContact O-CB 3.5Å; L791-A809 HydrophobicContact CB-CB 4.45Å; L791-A809 PolarHBondContact N-O 3.5Å; L791-A809 PolarHBondContact O-N 3.13Å; L791-I811 HydrophobicContact CD1-CD1 3.91Å; L791-I811 HydrophobicContact CD2-CD1 4.06Å; L791-I811 HydrophobicContact CG-CD1 3.76Å; L791-V839 HydrophobicContact CD1-CG1 4.24Å; L791-V839 HydrophobicContact CD1-CG2 4.3Å; L791-V841 HydrophobicContact CD1-CG2 3.59Å
792	E	95.4	Very high	90.2	Very high	61 Å²	61	67.5 Å²	67.5	29%	0.285	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.8	167.1	-66.5	-169.4	175.7	0	0	109	I737 K738 K790 L794	I737-E792 WeakPolarHBondContact CA-O 3.43Å; K738-E792 WeakPolarHBondContact CE-OE2 3.33Å; K738-E792 HydrophobicContact CG-CB 4.03Å; K738-E792 PolarHBondContact N-O 3.15Å; K738-E792 IonicContact NZ-OE2 2.86Å; K738-E792 PolarHBondContact NZ-OE2 3.16Å; K738-E792 PolarHBondContact O-N 3.29Å; K790-E792 HydrophobicContact CD-CG 4.35Å; K790-E792 WeakPolarHBondContact CE-OE1 3.48Å; K790-E792 IonicContact NZ-OE1 2.91Å; K790-E792 PolarHBondContact NZ-OE1 3.3Å; E792-L794 HydrophobicContact CB-CD1 4.07Å; E792-L794 WeakPolarHBondContact O-CD1 3.33Å
793	L	95.1	Very high	90.4	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.1	177.4	-78	67.9	0	0	0	108.1	L722 I737 L791 V806 G807 V828	L722-L793 HydrophobicContact CD1-CD2 3.98Å; L722-L793 HydrophobicContact CD2-CD2 3.47Å; L722-L793 VanDerWaalsContact CD2-CD2 3.47Å; L722-L793 HydrophobicContact CG-CD2 4.34Å; I737-L793 HydrophobicContact CD1-CD1 4.33Å; I737-L793 HydrophobicContact CD1-CG 4.28Å; I737-L793 HydrophobicContact CG1-CD1 3.88Å; I737-L793 HydrophobicContact CG1-CG 3.69Å; L791-L793 HydrophobicContact CB-CD1 4.28Å; L793-V806 HydrophobicContact CB-CB 3.99Å; L793-V806 HydrophobicContact CB-CG1 4.18Å; L793-V806 WeakPolarHBondContact O-CB 3.44Å; L793-V806 PolarHBondContact O-N 3.27Å; L793-G807 PolarHBondContact N-O 3.23Å; L793-G807 PolarHBondContact O-N 3.44Å; L793-V828 HydrophobicContact CD1-CG2 4.44Å; L793-V828 HydrophobicContact CD2-CB 4.41Å; L793-V828 HydrophobicContact CD2-CG1 3.97Å; L793-V828 HydrophobicContact CD2-CG2 3.51Å
794	L	94.4	Very high	90.6	Very high	17 Å²	17	65 Å²	65	9%	0.089	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.3	-179.6	-62	97.4	0	0	0	111.5	Y736 K738 E792 D803 K804	Y736-L794 HydrophobicContact CD1-CB 4.2Å; Y736-L794 WeakPolarHBondContact CD1-O 3.47Å; Y736-L794 HydrophobicContact CE1-CB 3.57Å; Y736-L794 HydrophobicContact CE2-CB 4.35Å; Y736-L794 HydrophobicContact CE2-CD1 4.24Å; Y736-L794 PolarHBondContact N-O 2.99Å; Y736-L794 PolarHBondContact O-N 3.4Å; K738-L794 HydrophobicContact CD-CD1 3.71Å; K738-L794 HydrophobicContact CG-CD1 3.74Å; E792-L794 HydrophobicContact CB-CD1 4.07Å; E792-L794 WeakPolarHBondContact O-CD1 3.33Å; L794-D803 HydrophobicContact CD2-CB 4.22Å; L794-K804 CarbonylContact C-O 3.53Å; L794-K804 VanDerWaalsContact CA-O 3.28Å; L794-K804 WeakPolarHBondContact CA-O 3.45Å
795	H	94.2	Very high	90.6	Very high	21 Å²	21	69.6 Å²	69.6	10%	0.097	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.5	166.8	168.1	56.6	0	0	0	109.1	P725 L733 D734 G797 D803 K804 V806	P725-H795 HydrophobicContact CG-CB 3.68Å; L733-H795 HydrophobicContact CD1-CB 3.86Å; D734-H795 PolarHBondContact N-ND1 3.38Å; D734-H795 CarbonylContact O-C 3.55Å; D734-H795 WeakPolarHBondContact O-CA 3.48Å; D734-H795 PolarHBondContact O-ND1 3.41Å; D734-H795 VanDerWaalsContact O-ND1 3.13Å; H795-G797 PolarHBondContact O-N 3.13Å; H795-D803 CarbonylContact O-C 3.56Å; H795-D803 VanDerWaalsContact O-CA 3.3Å; H795-D803 WeakPolarHBondContact O-CA 3.23Å; H795-K804 HydrophobicContact CB-CB 4.38Å; H795-K804 PolarHBondContact N-O 3.1Å; H795-K804 PolarHBondContact O-N 3.46Å; H795-V806 HydrophobicContact CB-CG2 3.88Å
796	K	93.2	Very high	90.8	Very high	78 Å²	78	67.6 Å²	67.6	34%	0.339	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.6	116.9	177.5	-167.4	78.4	-162.6	96.6	0	110.2	D734 Y736 V756 D803	D734-K796 HydrophobicContact CB-CB 4.12Å; D734-K796 PolarHBondContact O-N 2.8Å; Y736-K796 HydrophobicContact CD1-CB 4.25Å; Y736-K796 HydrophobicContact CD1-CD 4.37Å; Y736-K796 HydrophobicContact CE1-CB 4.3Å; Y736-K796 HydrophobicContact CE1-CD 4.01Å; V756-K796 HydrophobicContact CG1-CB 3.79Å; V756-K796 HydrophobicContact CG1-CG 4.37Å; V756-K796 HydrophobicContact CG2-CB 4.33Å; V756-K796 HydrophobicContact CG2-CD 4.06Å; V756-K796 HydrophobicContact CG2-CG 4.29Å; K796-D803 VanDerWaalsContact CA-OD1 3.29Å; K796-D803 WeakPolarHBondContact CA-OD1 3.25Å; K796-D803 WeakPolarHBondContact CD-OD1 3.38Å; K796-D803 IonicContact NZ-OD1 2.74Å; K796-D803 PolarHBondContact NZ-OD1 3.28Å; K796-D803 IonicContact NZ-OD2 2.65Å; K796-D803 PolarHBondContact NZ-OD2 2.91Å
797	G	88.2	Confident	91.3	Very high	13 Å²	13	64.4 Å²	64.4	13%	0.134	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-63	133.9	170.6	0	0	0	0	0	111.2	H795 D803	H795-G797 PolarHBondContact O-N 3.13Å; G797-D803 PolarHBondContact N-OD1 2.64Å
798	G	84.2	Confident	91.9	Very high	48 Å²	48	60.1 Å²	60.1	50%	0.495	32%	0.317	S	S	.	.			trans	-65.3	-175.2	169.2	0	0	0	0	0	112.9	L800 R801	G798-L800 PolarHBondContact O-N 2.93Å; G798-R801 WeakPolarHBondContact O-CB 3.35Å; G798-R801 PolarHBondContact O-N 3.37Å
799	F	83.6	Confident	92.1	Very high	191 Å²	191	59.7 Å²	59.7	84%	0.838	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	126	-176.3	-172.5	-109.5	0	0	0	112.7	R801	F799-R801 PolarHBondContact O-N 2.98Å
800	L	88.5	Confident	92.2	Very high	158 Å²	158	64.6 Å²	64.6	83%	0.827	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	20.6	-175.6	-56.1	173.6	0	0	0	116	G798	G798-L800 PolarHBondContact O-N 2.93Å
801	R	88	Confident	92.2	Very high	198 Å²	198	60.1 Å²	60.1	75%	0.747	32%	0.319	S	S	*	.			trans	-113.3	142.7	171.9	-62	-179.1	177.8	177.5	-1.4	110.7	G798 F799	G798-R801 WeakPolarHBondContact O-CB 3.35Å; G798-R801 PolarHBondContact O-N 3.37Å; F799-R801 PolarHBondContact O-N 2.98Å
802	S	91	Very high	92.1	Very high	103 Å²	103	66.3 Å²	66.3	72%	0.72	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-72.3	156.5	171.7	47.6	0	0	0	0	111.9
803	D	93.6	Very high	92	Very high	51 Å²	51	63.4 Å²	63.4	27%	0.273	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-71.9	130	174.9	-61.2	-34.6	0	0	0	109.8	Y736 L794 H795 K796 G797	Y736-D803 HydrophobicContact CE1-CB 4.35Å; Y736-D803 PolarHBondContact OH-OD2 3.23Å; L794-D803 HydrophobicContact CD2-CB 4.22Å; H795-D803 CarbonylContact O-C 3.56Å; H795-D803 VanDerWaalsContact O-CA 3.3Å; H795-D803 WeakPolarHBondContact O-CA 3.23Å; K796-D803 VanDerWaalsContact CA-OD1 3.29Å; K796-D803 WeakPolarHBondContact CA-OD1 3.25Å; K796-D803 WeakPolarHBondContact CD-OD1 3.38Å; K796-D803 IonicContact NZ-OD1 2.74Å; K796-D803 PolarHBondContact NZ-OD1 3.28Å; K796-D803 IonicContact NZ-OD2 2.65Å; K796-D803 PolarHBondContact NZ-OD2 2.91Å; G797-D803 PolarHBondContact N-OD1 2.64Å
804	K	92.6	Very high	91.9	Very high	72 Å²	72	66.4 Å²	66.4	31%	0.313	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.3	-178.3	-64.2	-177.4	-175.7	171.1	0	109.9	P725 S726 L794 H795	P725-K804 HydrophobicContact CB-CB 4.04Å; P725-K804 HydrophobicContact CB-CD 3.97Å; P725-K804 HydrophobicContact CG-CB 4.2Å; P725-K804 HydrophobicContact CG-CD 4.1Å; S726-K804 PolarHBondContact O-NZ 2.99Å; L794-K804 CarbonylContact C-O 3.53Å; L794-K804 VanDerWaalsContact CA-O 3.28Å; L794-K804 WeakPolarHBondContact CA-O 3.45Å; H795-K804 HydrophobicContact CB-CB 4.38Å; H795-K804 PolarHBondContact N-O 3.1Å; H795-K804 PolarHBondContact O-N 3.46Å
805	P	92.9	Very high	91.8	Very high	98 Å²	98	69.3 Å²	69.3	64%	0.636	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	138.2	167.6	28.8	-33.6	0	0	0	110.2
806	V	92.3	Very high	91.7	Very high	10 Å²	10	68.3 Å²	68.3	6%	0.061	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-33.9	172.3	169.1	0	0	0	0	109.5	L722 P723 P725 L733 L793 H795	L722-V806 HydrophobicContact CB-CG1 4.36Å; P723-V806 HydrophobicContact CG-CG1 3.73Å; P723-V806 WeakPolarHBondContact CG-O 3.5Å; P725-V806 HydrophobicContact CG-CG2 4.25Å; L733-V806 HydrophobicContact CD1-CG2 4.01Å; L793-V806 HydrophobicContact CB-CB 3.99Å; L793-V806 HydrophobicContact CB-CG1 4.18Å; L793-V806 WeakPolarHBondContact O-CB 3.44Å; L793-V806 PolarHBondContact O-N 3.27Å; H795-V806 HydrophobicContact CB-CG2 3.88Å
807	G	93.4	Very high	91.6	Very high	9 Å²	9	68.1 Å²	68.1	9%	0.093	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.2	-166.6	173.5	0	0	0	0	0	110.7	L793 M829	L793-G807 PolarHBondContact N-O 3.23Å; L793-G807 PolarHBondContact O-N 3.44Å; G807-M829 CarbonylContact C-O 3.5Å
808	S	95.4	Very high	91.7	Very high	28 Å²	28	70.6 Å²	70.6	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	144.8	173.2	57.5	0	0	0	0	111.7	L791 M829	L791-S808 CarbonylContact O-C 3.38Å; L791-S808 WeakPolarHBondContact O-CA 3.46Å; L791-S808 VanDerWaalsContact O-CB 3.23Å; L791-S808 WeakPolarHBondContact O-CB 3.5Å; S808-M829 PolarHBondContact N-O 3.09Å; S808-M829 PolarHBondContact O-N 3.4Å; S808-M829 PolarHBondContact OG-O 3.32Å
809	A	95.3	Very high	92.1	Very high	1 Å²	1	72 Å²	72	1%	0.008	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	140.7	177.8	0	0	0	0	0	109.1	K790 L791 V826 V839	K790-A809 WeakPolarHBondContact CA-O 3.12Å; L791-A809 HydrophobicContact CB-CB 4.45Å; L791-A809 PolarHBondContact N-O 3.5Å; L791-A809 PolarHBondContact O-N 3.13Å; A809-V826 HydrophobicContact CB-CB 4.22Å; A809-V826 HydrophobicContact CB-CG1 3.83Å; A809-V839 HydrophobicContact CB-CG1 3.55Å
810	L	94.5	Very high	92.5	Very high	102 Å²	102	62.9 Å²	62.9	53%	0.534	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	104	179.6	-174	67.2	0	0	0	109.9	K790 V826	K790-L810 HydrophobicContact CB-CD1 4.04Å; L810-V826 WeakPolarHBondContact O-CG1 3.29Å
811	I	94.8	Very high	92.7	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.8	178.2	-53	147.1	0	0	0	108.1	G788 L789 L791 L813 V826 V841	G788-I811 CarbonylContact C-O 3.56Å; G788-I811 WeakPolarHBondContact CA-O 3.45Å; L789-I811 HydrophobicContact CB-CB 4.41Å; L789-I811 HydrophobicContact CB-CD1 4.13Å; L789-I811 HydrophobicContact CD2-CD1 3.87Å; L789-I811 HydrophobicContact CG-CD1 4.11Å; L789-I811 PolarHBondContact N-O 3.42Å; L789-I811 PolarHBondContact O-N 2.87Å; L791-I811 HydrophobicContact CD1-CD1 3.91Å; L791-I811 HydrophobicContact CD2-CD1 4.06Å; L791-I811 HydrophobicContact CG-CD1 3.76Å; I811-L813 HydrophobicContact CG2-CD2 4.36Å; I811-V826 HydrophobicContact CB-CG2 4.32Å; I811-V826 HydrophobicContact CG1-CG2 3.86Å; I811-V841 HydrophobicContact CD1-CB 4.09Å; I811-V841 HydrophobicContact CD1-CG1 3.77Å; I811-V841 HydrophobicContact CD1-CG2 4.03Å; I811-V841 HydrophobicContact CG1-CB 4.43Å; I811-V841 HydrophobicContact CG1-CG2 4.3Å
812	K	93.9	Very high	93	Very high	130 Å²	130	47.5 Å²	47.5	57%	0.565	26%	0.258	S	S	*	.			trans	-80	136.3	170.1	-66.5	-174.2	178.8	-176.9	0	109.4	D814 I822 E824	K812-D814 WeakPolarHBondContact CB-OD1 3.47Å; K812-I822 WeakPolarHBondContact O-CD1 3.25Å; K812-E824 PolarHBondContact N-OE2 2.96Å
813	L	94.1	Very high	93.3	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.252	C	S	.	.			trans	-107.5	-4.9	179.7	-64.6	-179.6	0	0	0	112.5	V784 L789 I811 K815 L816 I822 V843	V784-L813 HydrophobicContact CB-CB 4.36Å; V784-L813 HydrophobicContact CG1-CB 4.05Å; V784-L813 WeakPolarHBondContact CG1-O 3.38Å; V784-L813 CarbonylContact O-C 3.58Å; L789-L813 HydrophobicContact CB-CD1 4.18Å; L789-L813 HydrophobicContact CB-CG 4.45Å; I811-L813 HydrophobicContact CG2-CD2 4.36Å; L813-K815 PolarHBondContact O-N 3.28Å; L813-K815 VanDerWaalsContact O-N 3.13Å; L813-L816 HydrophobicContact CB-CD1 4.37Å; L813-L816 HydrophobicContact CD2-CD1 4.05Å; L813-L816 VanDerWaalsContact O-CB 3.27Å; L813-L816 WeakPolarHBondContact O-CB 3.46Å; L813-L816 PolarHBondContact O-N 2.9Å; L813-I822 HydrophobicContact CD2-CD1 4.43Å; L813-V843 HydrophobicContact CD2-CB 4.34Å; L813-V843 HydrophobicContact CD2-CG1 4.15Å; L813-V843 HydrophobicContact CD2-CG2 4.05Å
814	D	92.6	Very high	93.3	Very high	64 Å²	64	49.7 Å²	49.7	34%	0.342	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-43.3	-43.7	177.5	52.7	-2.2	0	0	0	113.9	V784 K812 L816 E817	V784-D814 PolarHBondContact O-N 3.12Å; K812-D814 WeakPolarHBondContact CB-OD1 3.47Å; D814-L816 PolarHBondContact O-N 2.99Å; D814-L816 VanDerWaalsContact O-N 3.15Å; D814-E817 WeakPolarHBondContact O-CB 3.38Å; D814-E817 PolarHBondContact O-N 2.91Å
815	K	92.3	Very high	93.5	Very high	79 Å²	79	50.6 Å²	50.6	34%	0.343	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-59.1	-24.8	177.5	-62.9	158.4	-172	173.1	0	113.7	L813 E817 S818 Q819 I822 E824	L813-K815 PolarHBondContact O-N 3.28Å; L813-K815 VanDerWaalsContact O-N 3.13Å; K815-E817 PolarHBondContact O-N 3.19Å; K815-S818 PolarHBondContact O-N 3.42Å; K815-S818 VanDerWaalsContact O-N 3.14Å; K815-Q819 WeakPolarHBondContact O-CB 3.44Å; K815-Q819 PolarHBondContact O-N 3.22Å; K815-I822 HydrophobicContact CB-CD1 3.73Å; K815-I822 HydrophobicContact CB-CG1 3.78Å; K815-I822 HydrophobicContact CD-CD1 4.4Å; K815-I822 HydrophobicContact CD-CG1 4.43Å; K815-E824 IonicContact NZ-OE1 2.66Å; K815-E824 PolarHBondContact NZ-OE1 3.07Å
816	L	92.4	Very high	93.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-66.7	-11.4	174.5	-66.3	178.9	0	0	0	113.6	M712 V784 L813 D814 S818 Q819 I822 V843 L845 L849	M712-L816 HydrophobicContact SD-CD1 3.82Å; V784-L816 HydrophobicContact CG1-CB 4.13Å; L813-L816 HydrophobicContact CB-CD1 4.37Å; L813-L816 HydrophobicContact CD2-CD1 4.05Å; L813-L816 VanDerWaalsContact O-CB 3.27Å; L813-L816 WeakPolarHBondContact O-CB 3.46Å; L813-L816 PolarHBondContact O-N 2.9Å; D814-L816 PolarHBondContact O-N 2.99Å; D814-L816 VanDerWaalsContact O-N 3.15Å; L816-S818 VanDerWaalsContact C-N 3.29Å; L816-Q819 WeakPolarHBondContact CA-O 3.49Å; L816-I822 HydrophobicContact CD2-CD1 4.17Å; L816-I822 HydrophobicContact CD2-CG1 3.86Å; L816-I822 HydrophobicContact CG-CD1 3.75Å; L816-I822 HydrophobicContact CG-CG1 4.03Å; L816-V843 HydrophobicContact CD1-CG1 3.9Å; L816-L845 HydrophobicContact CB-CD1 3.86Å; L816-L845 HydrophobicContact CD1-CD1 4.07Å; L816-L845 HydrophobicContact CD1-CG 4.27Å; L816-L845 HydrophobicContact CD2-CD1 4.01Å; L816-L845 HydrophobicContact CD2-CG 4.13Å; L816-L845 HydrophobicContact CG-CD1 4.19Å; L816-L849 PolarHBondContact O-N 2.85Å
817	E	90.8	Very high	93.8	Very high	73 Å²	73	49.4 Å²	49.4	34%	0.341	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-67.9	-30.1	171.2	-64.1	-160.2	150.2	0	0	112.2	V784 D814 K815 S850	V784-E817 HydrophobicContact CG1-CG 4.12Å; D814-E817 WeakPolarHBondContact O-CB 3.38Å; D814-E817 PolarHBondContact O-N 2.91Å; K815-E817 PolarHBondContact O-N 3.19Å; E817-S850 CarbonylContact O-C 3.51Å; E817-S850 WeakPolarHBondContact O-CA 3.47Å; E817-S850 PolarHBondContact O-N 3.03Å; E817-S850 PolarHBondContact O-OG 3.03Å
818	S	90.4	Very high	93.9	Very high	66 Å²	66	49 Å²	49	46%	0.462	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-17.3	-179.7	58.4	0	0	0	0	115.3	K815 L816 P848 D853	K815-S818 PolarHBondContact O-N 3.42Å; K815-S818 VanDerWaalsContact O-N 3.14Å; L816-S818 VanDerWaalsContact C-N 3.29Å; S818-P848 VanDerWaalsContact C-CB 3.48Å; S818-D853 WeakPolarHBondContact O-CA 3.32Å
819	Q	91.6	Very high	93.8	Very high	77 Å²	77	49.8 Å²	49.8	36%	0.36	24%	0.239	S	C	.	.			trans	-116.7	148.2	-177.6	-60.5	179.9	-24.3	0	0	112.2	K815 L816 D853	K815-Q819 WeakPolarHBondContact O-CB 3.44Å; K815-Q819 PolarHBondContact O-N 3.22Å; L816-Q819 WeakPolarHBondContact CA-O 3.49Å; Q819-D853 WeakPolarHBondContact CA-OD2 3.38Å
820	S	91.8	Very high	93.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-86.1	-21.6	176.3	-60.2	0	0	0	0	112.9	R702 R844 L845 E847 P848 D853	R702-S820 WeakPolarHBondContact O-CB 3.39Å; R702-S820 PolarHBondContact O-OG 2.86Å; S820-R844 WeakPolarHBondContact O-CA 3.35Å; S820-L845 PolarHBondContact O-N 2.92Å; S820-E847 WeakPolarHBondContact OG-CA 3.47Å; S820-P848 VanDerWaalsContact OG-CD 3.31Å; S820-P848 WeakPolarHBondContact OG-CD 3.39Å; S820-D853 PolarHBondContact N-OD2 3.34Å
821	E	93.8	Very high	93.2	Very high	30 Å²	30	52.8 Å²	52.8	14%	0.14	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	124	175.5	176.3	172.3	-140	0	0	112.1	F704 V843 R844	F704-E821 HydrophobicContact CE2-CB 3.68Å; F704-E821 HydrophobicContact CZ-CB 3.79Å; E821-V843 WeakPolarHBondContact CA-O 3.49Å; E821-R844 HydrophobicContact CB-CG 4.13Å; E821-R844 HydrophobicContact CG-CG 3.95Å; E821-R844 IonicContact OE1-CZ 2.67Å; E821-R844 VanDerWaalsContact OE1-CZ 3.22Å; E821-R844 IonicContact OE1-NE 2.7Å; E821-R844 PolarHBondContact OE1-NE 3.01Å; E821-R844 IonicContact OE1-NH2 2.74Å; E821-R844 PolarHBondContact OE1-NH2 3.04Å; E821-R844 IonicContact OE2-NE 2.61Å; E821-R844 IonicContact OE2-NH2 2.71Å; E821-R844 PolarHBondContact OE2-NH2 3.18Å
822	I	94.4	Very high	92.9	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	133.9	159.1	-60.9	-176.4	0	0	0	108.7	K812 L813 K815 L816 E824 K842 V843	K812-I822 WeakPolarHBondContact O-CD1 3.25Å; L813-I822 HydrophobicContact CD2-CD1 4.43Å; K815-I822 HydrophobicContact CB-CD1 3.73Å; K815-I822 HydrophobicContact CB-CG1 3.78Å; K815-I822 HydrophobicContact CD-CD1 4.4Å; K815-I822 HydrophobicContact CD-CG1 4.43Å; L816-I822 HydrophobicContact CD2-CD1 4.17Å; L816-I822 HydrophobicContact CD2-CG1 3.86Å; L816-I822 HydrophobicContact CG-CD1 3.75Å; L816-I822 HydrophobicContact CG-CG1 4.03Å; I822-E824 HydrophobicContact CG2-CB 3.94Å; I822-K842 CarbonylContact O-C 3.5Å; I822-K842 WeakPolarHBondContact O-CA 3.41Å; I822-V843 HydrophobicContact CB-CB 4.46Å; I822-V843 PolarHBondContact N-O 3.38Å; I822-V843 PolarHBondContact O-N 3.17Å
823	R	95.8	Very high	92.7	Very high	162 Å²	162	65.3 Å²	65.3	61%	0.611	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.4	158.5	-178	-179.9	-168.5	-175.3	-1.1	107.8	E840 K842	R823-E840 IonicContact CZ-OE1 2.76Å; R823-E840 IonicContact NE-OE1 3.53Å; R823-E840 PolarHBondContact NE-OE1 2.87Å; R823-E840 IonicContact NH2-OE1 2.6Å; R823-E840 PolarHBondContact NH2-OE1 3.19Å; R823-K842 HydrophobicContact CB-CG 4.07Å; R823-K842 HydrophobicContact CG-CG 3.88Å
824	E	95.1	Very high	92.6	Very high	38 Å²	38	71.5 Å²	71.5	18%	0.178	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.4	-175.1	-165.2	162.1	-105	0	0	111.2	K812 K815 I822 V826 V841	K812-E824 PolarHBondContact N-OE2 2.96Å; K815-E824 IonicContact NZ-OE1 2.66Å; K815-E824 PolarHBondContact NZ-OE1 3.07Å; I822-E824 HydrophobicContact CG2-CB 3.94Å; E824-V826 HydrophobicContact CB-CG2 4.27Å; E824-V826 HydrophobicContact CG-CG2 3.84Å; E824-V841 PolarHBondContact N-O 3.39Å; E824-V841 PolarHBondContact O-N 3.24Å
825	I	96.2	Very high	92.4	Very high	92 Å²	92	70.2 Å²	70.2	47%	0.472	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	99.1	173.2	-58.1	177.4	0	0	0	106.5	M720 R838 V839 E840	M720-I825 HydrophobicContact SD-CG2 4.42Å; I825-R838 HydrophobicContact CG2-CB 3.87Å; I825-R838 HydrophobicContact CG2-CG 4.47Å; I825-V839 CarbonylContact C-O 3.59Å; I825-V839 WeakPolarHBondContact CA-O 3.14Å; I825-E840 HydrophobicContact CG1-CB 4.19Å; I825-E840 HydrophobicContact CG1-CG 4.11Å
826	V	95.6	Very high	92.2	Very high	16 Å²	16	68.6 Å²	68.6	10%	0.097	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	140.8	-172.8	-173.2	0	0	0	0	109.8	A809 L810 I811 E824 R838 V839	A809-V826 HydrophobicContact CB-CB 4.22Å; A809-V826 HydrophobicContact CB-CG1 3.83Å; L810-V826 WeakPolarHBondContact O-CG1 3.29Å; I811-V826 HydrophobicContact CB-CG2 4.32Å; I811-V826 HydrophobicContact CG1-CG2 3.86Å; E824-V826 HydrophobicContact CB-CG2 4.27Å; E824-V826 HydrophobicContact CG-CG2 3.84Å; V826-R838 CarbonylContact O-C 3.6Å; V826-R838 VanDerWaalsContact O-CA 3.29Å; V826-R838 WeakPolarHBondContact O-CA 3.28Å; V826-V839 HydrophobicContact CB-CG1 4.29Å; V826-V839 PolarHBondContact N-O 2.93Å; V826-V839 PolarHBondContact O-N 3.12Å
827	E	95.4	Very high	92.3	Very high	66 Å²	66	68.6 Å²	68.6	31%	0.308	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	144.2	174.3	-155	-174.4	159.7	0	0	112.2	H834 G836 G837 R838	E827-H834 WeakPolarHBondContact OE1-CB 3.32Å; E827-H834 IonicContact OE1-CG 2.71Å; E827-H834 IonicContact OE1-ND1 2.64Å; E827-H834 PolarHBondContact OE1-ND1 2.95Å; E827-H834 IonicContact OE2-CE1 3.47Å; E827-H834 IonicContact OE2-CG 2.65Å; E827-H834 IonicContact OE2-ND1 2.69Å; E827-H834 PolarHBondContact OE2-ND1 3.34Å; E827-G836 PolarHBondContact OE1-N 3.48Å; E827-G837 WeakPolarHBondContact CG-O 3.39Å; E827-R838 HydrophobicContact CG-CG 4.23Å
828	V	95.3	Very high	92.5	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.9	178.2	179	0	0	0	0	109	L722 L793 T835 G837	L722-V828 HydrophobicContact CD2-CG2 4.09Å; L793-V828 HydrophobicContact CD1-CG2 4.44Å; L793-V828 HydrophobicContact CD2-CB 4.41Å; L793-V828 HydrophobicContact CD2-CG1 3.97Å; L793-V828 HydrophobicContact CD2-CG2 3.51Å; V828-T835 WeakPolarHBondContact O-CB 3.36Å; V828-T835 WeakPolarHBondContact O-CG2 3.22Å; V828-T835 PolarHBondContact O-N 2.93Å; V828-T835 VanDerWaalsContact O-N 3.16Å; V828-T835 PolarHBondContact O-OG1 3.25Å; V828-G837 WeakPolarHBondContact CB-O 3.45Å; V828-G837 PolarHBondContact N-O 3.15Å
829	M	94	Very high	92.8	Very high	46 Å²	46	67.4 Å²	67.4	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.4	-175.5	-60.5	-65.1	-71.6	0	0	111.4	G807 S808 G831 K833 H834	G807-M829 CarbonylContact C-O 3.5Å; S808-M829 PolarHBondContact N-O 3.09Å; S808-M829 PolarHBondContact O-N 3.4Å; S808-M829 PolarHBondContact OG-O 3.32Å; M829-G831 PolarHBondContact O-N 2.85Å; M829-K833 CarbonylContact C-O 3.39Å; M829-K833 WeakPolarHBondContact CA-O 3.14Å; M829-H834 HydrophobicContact SD-CB 4.32Å
830	D	91.3	Very high	93.1	Very high	99 Å²	99	64.2 Å²	64.2	53%	0.529	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	89	165.6	-178.9	28.8	0	0	0	109.2	R832 K833 T835	D830-R832 PolarHBondContact O-N 3.43Å; D830-K833 PolarHBondContact N-O 3.03Å; D830-K833 PolarHBondContact O-N 3.4Å; D830-T835 HydrophobicContact CB-CG2 3.85Å
831	G	86.4	Confident	93.4	Very high	67 Å²	67	64.3 Å²	64.3	69%	0.691	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	-90	-175.1	0	0	0	0	0	112.8	M829	M829-G831 PolarHBondContact O-N 2.85Å
832	R	86.8	Confident	93.5	Very high	241 Å²	241	64.8 Å²	64.8	91%	0.909	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-1.5	175.6	-65.2	-173.9	-178	179.9	0.5	113.6	D830	D830-R832 PolarHBondContact O-N 3.43Å
833	K	91.3	Very high	93.6	Very high	153 Å²	153	64.7 Å²	64.7	67%	0.665	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	130.7	-177.1	-66.7	-179.4	178.3	179.1	0	110.8	M829 D830	M829-K833 CarbonylContact C-O 3.39Å; M829-K833 WeakPolarHBondContact CA-O 3.14Å; D830-K833 PolarHBondContact N-O 3.03Å; D830-K833 PolarHBondContact O-N 3.4Å
834	H	90.4	Very high	93.6	Very high	130 Å²	130	60.2 Å²	60.2	60%	0.602	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	133.4	165	-70.1	-97.9	0	0	0	109.2	E827 M829	E827-H834 WeakPolarHBondContact OE1-CB 3.32Å; E827-H834 IonicContact OE1-CG 2.71Å; E827-H834 IonicContact OE1-ND1 2.64Å; E827-H834 PolarHBondContact OE1-ND1 2.95Å; E827-H834 IonicContact OE2-CE1 3.47Å; E827-H834 IonicContact OE2-CG 2.65Å; E827-H834 IonicContact OE2-ND1 2.69Å; E827-H834 PolarHBondContact OE2-ND1 3.34Å; M829-H834 HydrophobicContact SD-CB 4.32Å
835	T	88.8	Confident	93.5	Very high	38 Å²	38	58.4 Å²	58.4	23%	0.233	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-8.8	178.6	71.1	0	0	0	0	113.4	P723 V828 D830 G837	P723-T835 HydrophobicContact CG-CG2 4.14Å; V828-T835 WeakPolarHBondContact O-CB 3.36Å; V828-T835 WeakPolarHBondContact O-CG2 3.22Å; V828-T835 PolarHBondContact O-N 2.93Å; V828-T835 VanDerWaalsContact O-N 3.16Å; V828-T835 PolarHBondContact O-OG1 3.25Å; D830-T835 HydrophobicContact CB-CG2 3.85Å; T835-G837 PolarHBondContact O-N 3Å; T835-G837 VanDerWaalsContact O-N 3.16Å; T835-G837 PolarHBondContact OG1-N 2.98Å
836	G	89.3	Confident	93.3	Very high	44 Å²	44	56.6 Å²	56.6	45%	0.454	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.7	-16.5	-172.8	0	0	0	0	0	114.7	E827	E827-G836 PolarHBondContact OE1-N 3.48Å
837	G	93.6	Very high	93.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	149.7	170.6	0	0	0	0	0	111.9	M720 N721 E827 V828 T835	M720-G837 WeakPolarHBondContact O-CA 3.23Å; N721-G837 WeakPolarHBondContact O-CA 3.34Å; E827-G837 WeakPolarHBondContact CG-O 3.39Å; V828-G837 WeakPolarHBondContact CB-O 3.45Å; V828-G837 PolarHBondContact N-O 3.15Å; T835-G837 PolarHBondContact O-N 3Å; T835-G837 VanDerWaalsContact O-N 3.16Å; T835-G837 PolarHBondContact OG1-N 2.98Å
838	R	96.4	Very high	92.9	Very high	115 Å²	115	55.1 Å²	55.1	43%	0.434	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	160.5	177.8	-63.6	-170.9	-70	-111.5	3.2	111.3	G719 M720 I825 V826 E827	G719-R838 CarbonylContact C-O 3.44Å; G719-R838 WeakPolarHBondContact CA-O 3.18Å; M720-R838 HydrophobicContact CB-CB 4.45Å; M720-R838 PolarHBondContact N-O 3.34Å; M720-R838 PolarHBondContact O-N 2.95Å; I825-R838 HydrophobicContact CG2-CB 3.87Å; I825-R838 HydrophobicContact CG2-CG 4.47Å; V826-R838 CarbonylContact O-C 3.6Å; V826-R838 VanDerWaalsContact O-CA 3.29Å; V826-R838 WeakPolarHBondContact O-CA 3.28Å; E827-R838 HydrophobicContact CG-CG 4.23Å
839	V	96.6	Very high	92.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.7	173.9	62.1	0	0	0	0	110.2	K718 I737 L791 A809 I825 V826 V841	K718-V839 CarbonylContact O-C 3.51Å; K718-V839 WeakPolarHBondContact O-CA 3.3Å; I737-V839 HydrophobicContact CD1-CG2 3.72Å; L791-V839 HydrophobicContact CD1-CG1 4.24Å; L791-V839 HydrophobicContact CD1-CG2 4.3Å; A809-V839 HydrophobicContact CB-CG1 3.55Å; I825-V839 CarbonylContact C-O 3.59Å; I825-V839 WeakPolarHBondContact CA-O 3.14Å; V826-V839 HydrophobicContact CB-CG1 4.29Å; V826-V839 PolarHBondContact N-O 2.93Å; V826-V839 PolarHBondContact O-N 3.12Å; V839-V841 HydrophobicContact CG1-CG2 4.13Å; V839-V841 HydrophobicContact CG2-CG2 3.87Å
840	E	97.3	Very high	92.2	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.7	172.2	-176.2	-177.2	174	0	0	109.8	V717 K718 R823 I825	V717-E840 HydrophobicContact CB-CB 4.11Å; V717-E840 HydrophobicContact CB-CG 3.96Å; V717-E840 WeakPolarHBondContact CB-O 3.26Å; V717-E840 HydrophobicContact CG1-CG 4.41Å; V717-E840 HydrophobicContact CG2-CG 4.1Å; V717-E840 PolarHBondContact N-O 3.43Å; K718-E840 HydrophobicContact CG-CB 4.21Å; K718-E840 PolarHBondContact N-O 3.38Å; K718-E840 PolarHBondContact O-N 3.43Å; R823-E840 IonicContact CZ-OE1 2.76Å; R823-E840 IonicContact NE-OE1 3.53Å; R823-E840 PolarHBondContact NE-OE1 2.87Å; R823-E840 IonicContact NH2-OE1 2.6Å; R823-E840 PolarHBondContact NH2-OE1 3.19Å; I825-E840 HydrophobicContact CG1-CB 4.19Å; I825-E840 HydrophobicContact CG1-CG 4.11Å
841	V	96.9	Very high	91.9	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.3	-177.6	-165.6	0	0	0	0	109.6	V714 I716 L791 I811 E824 V839 V843	V714-V841 HydrophobicContact CG1-CG1 4.02Å; I716-V841 HydrophobicContact CG1-CG1 4.5Å; L791-V841 HydrophobicContact CD1-CG2 3.59Å; I811-V841 HydrophobicContact CD1-CB 4.09Å; I811-V841 HydrophobicContact CD1-CG1 3.77Å; I811-V841 HydrophobicContact CD1-CG2 4.03Å; I811-V841 HydrophobicContact CG1-CB 4.43Å; I811-V841 HydrophobicContact CG1-CG2 4.3Å; E824-V841 PolarHBondContact N-O 3.39Å; E824-V841 PolarHBondContact O-N 3.24Å; V839-V841 HydrophobicContact CG1-CG2 4.13Å; V839-V841 HydrophobicContact CG2-CG2 3.87Å; V841-V843 HydrophobicContact CG1-CG2 4.45Å
842	K	96.8	Very high	91.8	Very high	40 Å²	40	57.5 Å²	57.5	17%	0.174	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141	168.6	-64.3	173	-176.2	178.3	0	109.6	L715 V717 I822 R823	L715-K842 HydrophobicContact CB-CB 4.23Å; L715-K842 HydrophobicContact CD2-CD 4.17Å; L715-K842 PolarHBondContact N-O 3.34Å; L715-K842 PolarHBondContact O-N 3.02Å; V717-K842 HydrophobicContact CG2-CD 4.2Å; V717-K842 HydrophobicContact CG2-CG 4.22Å; I822-K842 CarbonylContact O-C 3.5Å; I822-K842 WeakPolarHBondContact O-CA 3.41Å; R823-K842 HydrophobicContact CB-CG 4.07Å; R823-K842 HydrophobicContact CG-CG 3.88Å
843	V	95.9	Very high	91.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.7	173.1	-170.4	0	0	0	0	108.2	M712 V713 V714 L813 L816 E821 I822 V841	M712-V843 HydrophobicContact CE-CG1 4.21Å; M712-V843 HydrophobicContact CG-CG1 3.77Å; M712-V843 HydrophobicContact SD-CG1 3.76Å; V713-V843 CarbonylContact O-C 3.58Å; V713-V843 WeakPolarHBondContact O-CA 3.41Å; V714-V843 HydrophobicContact CG2-CG1 4.11Å; V714-V843 HydrophobicContact CG2-CG2 4.28Å; L813-V843 HydrophobicContact CD2-CB 4.34Å; L813-V843 HydrophobicContact CD2-CG1 4.15Å; L813-V843 HydrophobicContact CD2-CG2 4.05Å; L816-V843 HydrophobicContact CD1-CG1 3.9Å; E821-V843 WeakPolarHBondContact CA-O 3.49Å; I822-V843 HydrophobicContact CB-CB 4.46Å; I822-V843 PolarHBondContact N-O 3.38Å; I822-V843 PolarHBondContact O-N 3.17Å; V841-V843 HydrophobicContact CG1-CG2 4.45Å
844	R	95.6	Very high	91.6	Very high	68 Å²	68	41.9 Å²	41.9	26%	0.257	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.8	-175.7	-66.8	-177.6	176.3	-163.6	-10.8	112	L707 M712 V713 S820 E821	L707-R844 HydrophobicContact CD1-CB 3.88Å; M712-R844 CarbonylContact C-O 3.5Å; M712-R844 WeakPolarHBondContact CA-O 3.46Å; M712-R844 WeakPolarHBondContact CG-O 3.44Å; V713-R844 PolarHBondContact N-O 3.34Å; V713-R844 PolarHBondContact O-N 3.06Å; S820-R844 WeakPolarHBondContact O-CA 3.35Å; E821-R844 HydrophobicContact CB-CG 4.13Å; E821-R844 HydrophobicContact CG-CG 3.95Å; E821-R844 IonicContact OE1-CZ 2.67Å; E821-R844 VanDerWaalsContact OE1-CZ 3.22Å; E821-R844 IonicContact OE1-NE 2.7Å; E821-R844 PolarHBondContact OE1-NE 3.01Å; E821-R844 IonicContact OE1-NH2 2.74Å; E821-R844 PolarHBondContact OE1-NH2 3.04Å; E821-R844 IonicContact OE2-NE 2.61Å; E821-R844 IonicContact OE2-NH2 2.71Å; E821-R844 PolarHBondContact OE2-NH2 3.18Å
845	L	94.3	Very high	91.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	155.9	164.2	-65.7	172.1	0	0	0	108.1	F704 M712 I773 L816 S820 E847 L849	F704-L845 WeakPolarHBondContact CD2-O 3.39Å; M712-L845 HydrophobicContact CB-CD2 3.68Å; M712-L845 HydrophobicContact CG-CD2 3.61Å; M712-L845 HydrophobicContact CG-CG 4.33Å; M712-L845 HydrophobicContact SD-CD2 4.16Å; I773-L845 HydrophobicContact CD1-CD2 3.49Å; I773-L845 VanDerWaalsContact CD1-CD2 3.49Å; L816-L845 HydrophobicContact CB-CD1 3.86Å; L816-L845 HydrophobicContact CD1-CD1 4.07Å; L816-L845 HydrophobicContact CD1-CG 4.27Å; L816-L845 HydrophobicContact CD2-CD1 4.01Å; L816-L845 HydrophobicContact CD2-CG 4.13Å; L816-L845 HydrophobicContact CG-CD1 4.19Å; S820-L845 PolarHBondContact O-N 2.92Å; L845-E847 VanDerWaalsContact CB-O 3.26Å; L845-E847 WeakPolarHBondContact CB-O 3.21Å; L845-E847 PolarHBondContact O-N 3.2Å; L845-L849 HydrophobicContact CD1-CD1 4.4Å; L845-L849 HydrophobicContact CD1-CD2 3.6Å; L845-L849 HydrophobicContact CD1-CG 3.74Å
846	R	91.5	Very high	91.5	Very high	54 Å²	54	42 Å²	42	20%	0.204	24%	0.235	C	C	.	.	S	Bend	trans	-49.8	-42.9	169.1	-178.4	-169.7	171.3	91.5	-2.5	113.1	I703 F704 L707 S709	I703-R846 CarbonylContact C-O 3.58Å; I703-R846 VanDerWaalsContact CA-O 3.3Å; I703-R846 WeakPolarHBondContact CA-O 3.28Å; I703-R846 WeakPolarHBondContact CB-O 3.39Å; F704-R846 PolarHBondContact N-O 3.18Å; F704-R846 WeakPolarHBondContact O-CA 3.17Å; L707-R846 HydrophobicContact CB-CB 4.01Å; L707-R846 VanDerWaalsContact O-CD 3.31Å; L707-R846 WeakPolarHBondContact O-CD 3.25Å; L707-R846 VanDerWaalsContact O-CG 3.29Å; L707-R846 WeakPolarHBondContact O-CG 3.24Å; L707-R846 PolarHBondContact O-NH1 3.06Å; S709-R846 WeakPolarHBondContact OG-CD 3.24Å
847	E	91.1	Very high	91.5	Very high	44 Å²	44	40.9 Å²	40.9	21%	0.206	22%	0.221	C	C	.	.	S	Bend	trans	-152.3	156.8	-171.6	-76.5	151.2	-139.5	0	0	107.7	I703 R775 S820 L845	I703-E847 HydrophobicContact CG2-CG 3.83Å; R775-E847 PolarHBondContact NH1-O 3.41Å; R775-E847 VanDerWaalsContact NH2-CB 3.31Å; R775-E847 PolarHBondContact NH2-O 3.36Å; R775-E847 IonicContact NH2-OE2 3.23Å; S820-E847 WeakPolarHBondContact OG-CA 3.47Å; L845-E847 VanDerWaalsContact CB-O 3.26Å; L845-E847 WeakPolarHBondContact CB-O 3.21Å; L845-E847 PolarHBondContact O-N 3.2Å
848	P	91.9	Very high	91.3	Very high	8 Å²	8	44.9 Å²	44.9	5%	0.052	25%	0.245	C	C	.	.			trans	-66.7	163.3	176.7	33.9	-39.3	0	0	0	111.4	R775 S818 S820 S850 D853	R775-P848 PolarHBondContact NH2-O 3.44Å; S818-P848 VanDerWaalsContact C-CB 3.48Å; S820-P848 VanDerWaalsContact OG-CD 3.31Å; S820-P848 WeakPolarHBondContact OG-CD 3.39Å; P848-S850 VanDerWaalsContact C-N 3.32Å; P848-S850 PolarHBondContact O-N 2.92Å; P848-D853 HydrophobicContact CG-CB 4.33Å
849	L	88.5	Confident	91	Very high	15 Å²	15	41.1 Å²	41.1	8%	0.079	23%	0.233	C	C	.	.	S	Bend	trans	-78.9	-13.9	-179.2	-56.8	-176.9	0	0	0	114.4	R775 F780 V784 L816 L845	R775-L849 HydrophobicContact CB-CD2 4.25Å; R775-L849 HydrophobicContact CG-CD2 3.95Å; F780-L849 HydrophobicContact CD1-CD1 4.3Å; F780-L849 HydrophobicContact CE1-CD1 3.55Å; F780-L849 HydrophobicContact CE1-CD2 3.73Å; F780-L849 HydrophobicContact CE1-CG 4.31Å; F780-L849 HydrophobicContact CZ-CD1 3.98Å; F780-L849 HydrophobicContact CZ-CD2 4.41Å; V784-L849 HydrophobicContact CB-CD1 4.27Å; V784-L849 HydrophobicContact CG1-CD1 4.03Å; V784-L849 HydrophobicContact CG2-CD1 3.87Å; L816-L849 PolarHBondContact O-N 2.85Å; L845-L849 HydrophobicContact CD1-CD1 4.4Å; L845-L849 HydrophobicContact CD1-CD2 3.6Å; L845-L849 HydrophobicContact CD1-CG 3.74Å
850	S	86.1	Confident	90.7	Very high	65 Å²	65	50 Å²	50	46%	0.455	27%	0.266	S	S	.	.	S	Bend	trans	-150.5	148.1	172.9	66	0	0	0	0	111.5	E817 P848	E817-S850 CarbonylContact O-C 3.51Å; E817-S850 WeakPolarHBondContact O-CA 3.47Å; E817-S850 PolarHBondContact O-N 3.03Å; E817-S850 PolarHBondContact O-OG 3.03Å; P848-S850 VanDerWaalsContact C-N 3.32Å; P848-S850 PolarHBondContact O-N 2.92Å
851	G	83.9	Confident	90.4	Very high	73 Å²	73	49.8 Å²	49.8	75%	0.753	27%	0.265	S	S	*	.	S	Bend	trans	64	-140.1	-177.7	0	0	0	0	0	113.1
852	Q	84.8	Confident	90.2	Very high	108 Å²	108	49.9 Å²	49.9	51%	0.505	27%	0.265	S	S	.	.			trans	-143.2	139.4	-178.7	-70.1	177.1	-9.1	0	0	109	V701 V854	V701-Q852 HydrophobicContact CG1-CB 4.02Å; V701-Q852 HydrophobicContact CG2-CB 4.47Å; Q852-V854 HydrophobicContact CB-CG2 3.96Å; Q852-V854 PolarHBondContact O-N 3.11Å
853	D	86.4	Confident	89.9	Confident	16 Å²	16	49.6 Å²	49.6	9%	0.086	27%	0.267	C	S	.	.			trans	-79.1	74.6	176.2	-172.9	5.5	0	0	0	109.1	V701 R702 S818 Q819 S820 P848 Q855	V701-D853 CarbonylContact C-O 3.53Å; V701-D853 WeakPolarHBondContact CA-O 3.39Å; R702-D853 HydrophobicContact CB-CB 4.23Å; R702-D853 PolarHBondContact N-O 3.24Å; S818-D853 WeakPolarHBondContact O-CA 3.32Å; Q819-D853 WeakPolarHBondContact CA-OD2 3.38Å; S820-D853 PolarHBondContact N-OD2 3.34Å; P848-D853 HydrophobicContact CG-CB 4.33Å; D853-Q855 PolarHBondContact O-N 2.93Å
854	V	87.8	Confident	89.5	Confident	50 Å²	50	49.9 Å²	49.9	30%	0.303	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	115	-175.9	177.3	0	0	0	0	109.5	R699 T700 V701 Q852	R699-V854 HydrophobicContact CG-CG1 3.58Å; T700-V854 WeakPolarHBondContact O-CA 3.49Å; V701-V854 HydrophobicContact CG2-CG2 4.31Å; Q852-V854 HydrophobicContact CB-CG2 3.96Å; Q852-V854 PolarHBondContact O-N 3.11Å
855	Q	87.3	Confident	89	Confident	79 Å²	79	49.5 Å²	49.5	37%	0.369	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.3	170	-174	170.4	-14.6	0	0	109.6	T700 D853	T700-Q855 PolarHBondContact N-O 2.99Å; T700-Q855 PolarHBondContact O-N 3.14Å; T700-Q855 VanDerWaalsContact O-O 3.1Å; T700-Q855 PolarHBondContact OG1-O 3.22Å; D853-Q855 PolarHBondContact O-N 2.93Å
856	T	89.8	Confident	87.5	Confident	92 Å²	92	54.7 Å²	54.7	56%	0.564	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.9	166.6	-54.9	0	0	0	0	108.3	F698	F698-T856 CarbonylContact O-C 3.56Å; F698-T856 VanDerWaalsContact O-CA 3.29Å; F698-T856 WeakPolarHBondContact O-CA 3.46Å
857	S	88.7	Confident	85.5	Confident	20 Å²	20	56 Å²	56	14%	0.14	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133	166.4	58.3	0	0	0	0	109.6	S697 F698 E859	S697-S857 CarbonylContact C-O 3.44Å; S697-S857 VanDerWaalsContact CA-O 3.31Å; S697-S857 WeakPolarHBondContact CA-O 3.26Å; F698-S857 PolarHBondContact N-O 3.26Å; F698-S857 PolarHBondContact O-N 3.03Å; S857-E859 VanDerWaalsContact CB-OE1 3.3Å; S857-E859 WeakPolarHBondContact CB-OE1 3.42Å; S857-E859 PolarHBondContact OG-OE1 2.87Å
858	T	90.5	Very high	83.1	Confident	85 Å²	85	64.5 Å²	64.5	52%	0.521	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.1	166.6	-56.8	0	0	0	0	107.2	E695 K696 S697	E695-T858 HydrophobicContact CB-CG2 4.4Å; K696-T858 WeakPolarHBondContact O-CA 3.41Å; S697-T858 PolarHBondContact OG-OG1 3.34Å
859	E	88.9	Confident	80.5	Confident	36 Å²	36	67.2 Å²	67.2	17%	0.168	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.1	-172.6	-68.5	178.8	-123.1	0	0	110.6	K644 Y648 K696 F698 S857 W861	K644-E859 WeakPolarHBondContact CD-OE2 3.09Å; K644-E859 WeakPolarHBondContact CE-OE2 3.44Å; K644-E859 IonicContact NZ-OE2 2.8Å; K644-E859 PolarHBondContact NZ-OE2 3.35Å; Y648-E859 PolarHBondContact OH-OE1 3.07Å; K696-E859 PolarHBondContact N-O 3.38Å; K696-E859 PolarHBondContact O-N 3.11Å; F698-E859 HydrophobicContact CE2-CB 4.43Å; S857-E859 VanDerWaalsContact CB-OE1 3.3Å; S857-E859 WeakPolarHBondContact CB-OE1 3.42Å; S857-E859 PolarHBondContact OG-OE1 2.87Å; E859-W861 PolarHBondContact O-N 3.01Å; E859-W861 VanDerWaalsContact O-N 3.09Å
860	R	90.8	Very high	77.8	Confident	185 Å²	185	76 Å²	76	70%	0.698	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	99.9	173.9	-73.7	-176.4	175.4	-176.5	-2	109	F693 E695 L862	F693-R860 HydrophobicContact CB-CB 4.4Å; F693-R860 HydrophobicContact CD1-CB 4.15Å; E695-R860 HydrophobicContact CG-CG 4.29Å; E695-R860 IonicContact OE1-NE 3.86Å; R860-L862 PolarHBondContact O-N 3.09Å
861	W	91.6	Very high	77.4	Confident	7 Å²	7	76.6 Å²	76.6	3%	0.027	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	105.7	-174.1	-157.5	-89.9	0	0	0	110.6	Q641 C645 L667 C671 F693 E694 K696 F698 E859 V863	Q641-W861 HydrophobicContact CB-CH2 3.63Å; Q641-W861 HydrophobicContact CB-CZ2 3.67Å; Q641-W861 HydrophobicContact CB-CZ3 4.21Å; Q641-W861 HydrophobicContact CG-CD2 4.23Å; Q641-W861 HydrophobicContact CG-CE3 4.09Å; Q641-W861 HydrophobicContact CG-CH2 3.83Å; Q641-W861 HydrophobicContact CG-CZ2 3.94Å; Q641-W861 HydrophobicContact CG-CZ3 3.9Å; Q641-W861 VanDerWaalsContact NE2-CG 3.28Å; C645-W861 WeakPolarHBondContact SG-CH2 3.47Å; C645-W861 VanDerWaalsContact SG-CZ2 3.55Å; L667-W861 HydrophobicContact CD1-CZ2 4.26Å; L667-W861 HydrophobicContact CD2-CH2 4.25Å; L667-W861 HydrophobicContact CD2-CZ2 3.77Å; L667-W861 HydrophobicContact CG-CZ2 3.85Å; C671-W861 VanDerWaalsContact SG-CZ2 3.59Å; F693-W861 WeakPolarHBondContact CA-O 3.19Å; E694-W861 PolarHBondContact N-O 3.21Å; E694-W861 WeakPolarHBondContact O-CA 3.39Å; E694-W861 VanDerWaalsContact O-CB 3.24Å; E694-W861 WeakPolarHBondContact O-CB 3.27Å; E694-W861 PolarHBondContact O-N 2.88Å; K696-W861 HydrophobicContact CB-CB 4.17Å; K696-W861 HydrophobicContact CD-CB 3.78Å; K696-W861 HydrophobicContact CD-CD2 4.34Å; K696-W861 HydrophobicContact CD-CG 3.72Å; K696-W861 HydrophobicContact CG-CB 3.98Å; K696-W861 HydrophobicContact CG-CG 4.43Å; F698-W861 HydrophobicContact CD2-CZ3 4.5Å; F698-W861 HydrophobicContact CE2-CD2 4.15Å; F698-W861 AromaticContact CE2-CE3 3.35Å; F698-W861 HydrophobicContact CE2-CE3 3.35Å; F698-W861 HydrophobicContact CE2-CH2 4.34Å; F698-W861 AromaticContact CE2-CZ3 3.47Å; F698-W861 HydrophobicContact CE2-CZ3 3.47Å; F698-W861 VanDerWaalsContact CE2-CZ3 3.47Å; F698-W861 AromaticContact CZ-CD2 3.81Å; F698-W861 HydrophobicContact CZ-CD2 3.81Å; F698-W861 AromaticContact CZ-CE3 3.45Å; F698-W861 HydrophobicContact CZ-CE3 3.45Å; F698-W861 VanDerWaalsContact CZ-CE3 3.45Å; F698-W861 HydrophobicContact CZ-CH2 4.08Å; F698-W861 HydrophobicContact CZ-CZ2 4.41Å; F698-W861 AromaticContact CZ-CZ3 3.6Å; F698-W861 HydrophobicContact CZ-CZ3 3.6Å; E859-W861 PolarHBondContact O-N 3.01Å; E859-W861 VanDerWaalsContact O-N 3.09Å; W861-V863 PolarHBondContact O-N 2.87Å
862	L	92.1	Very high	77	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.01	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	130	168	177.1	62.9	0	0	0	110.1	L634 I637 L638 Q641 H691 H692 F693 R860	L634-L862 HydrophobicContact CB-CD2 4.39Å; L634-L862 HydrophobicContact CD2-CD1 3.78Å; L634-L862 HydrophobicContact CD2-CD2 3.58Å; L634-L862 HydrophobicContact CD2-CG 4.33Å; I637-L862 HydrophobicContact CB-CD2 3.81Å; I637-L862 HydrophobicContact CD1-CD2 4.4Å; I637-L862 HydrophobicContact CG2-CB 3.71Å; I637-L862 HydrophobicContact CG2-CD2 3.71Å; I637-L862 HydrophobicContact CG2-CG 4.38Å; L638-L862 HydrophobicContact CG-CD2 4.05Å; Q641-L862 PolarHBondContact NE2-O 2.72Å; H691-L862 HydrophobicContact CB-CD1 3.78Å; H692-L862 WeakPolarHBondContact O-CA 3.47Å; F693-L862 HydrophobicContact CD1-CB 4.01Å; F693-L862 HydrophobicContact CE1-CB 3.73Å; F693-L862 HydrophobicContact CE1-CD1 4.14Å; F693-L862 HydrophobicContact CE1-CG 4.45Å; F693-L862 HydrophobicContact CE2-CD1 4.3Å; F693-L862 HydrophobicContact CZ-CB 4.39Å; F693-L862 HydrophobicContact CZ-CD1 3.99Å; R860-L862 PolarHBondContact O-N 3.09Å
863	V	90.4	Very high	76.6	Confident	34 Å²	34	75 Å²	75	21%	0.206	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132	170.7	174.7	0	0	0	0	107.9	H691 H692 E694 W861	H691-V863 WeakPolarHBondContact CA-O 3.27Å; H691-V863 VanDerWaalsContact CB-O 3.26Å; H691-V863 WeakPolarHBondContact CB-O 3.16Å; H692-V863 PolarHBondContact N-O 3.06Å; H692-V863 PolarHBondContact O-N 3.14Å; E694-V863 HydrophobicContact CG-CG2 4.14Å; E694-V863 WeakPolarHBondContact OE2-CG2 3.44Å; W861-V863 PolarHBondContact O-N 2.87Å
864	I	88.5	Confident	76	Confident	7 Å²	7	78.5 Å²	78.5	4%	0.036	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.3	166.3	-67.1	-176.3	0	0	0	108.2	L638 S674 L678 P689 S866	L638-I864 HydrophobicContact CD1-CD1 3.81Å; L638-I864 HydrophobicContact CD1-CG1 4.26Å; S674-I864 WeakPolarHBondContact O-CD1 3.48Å; L678-I864 HydrophobicContact CB-CD1 3.98Å; L678-I864 HydrophobicContact CD1-CD1 3.57Å; L678-I864 HydrophobicContact CG-CD1 4.39Å; P689-I864 HydrophobicContact CB-CG2 3.6Å; P689-I864 HydrophobicContact CG-CG2 4.42Å; I864-S866 PolarHBondContact O-N 3.08Å
865	D	83.8	Confident	75.3	Confident	59 Å²	59	80.3 Å²	80.3	32%	0.316	44%	0.442	S	S	.	.			trans	-65.2	108.9	172	-74.8	-67.5	0	0	0	109.5	Q690 H692 S867	Q690-D865 HydrophobicContact CB-CB 4.07Å; Q690-D865 PolarHBondContact O-N 3.08Å; H692-D865 IonicContact CE1-OD1 3.56Å; H692-D865 PolarHBondContact CE1-OD1 2.87Å; H692-D865 IonicContact CE1-OD2 2.6Å; H692-D865 IonicContact CG-OD2 3.61Å; H692-D865 VanDerWaalsContact ND1-CG 3.3Å; H692-D865 IonicContact ND1-OD1 3.84Å; H692-D865 PolarHBondContact ND1-OD1 2.73Å; H692-D865 VanDerWaalsContact ND1-OD1 3.14Å; H692-D865 IonicContact ND1-OD2 2.57Å; H692-D865 PolarHBondContact ND1-OD2 3.17Å; D865-S867 PolarHBondContact O-N 3.45Å
866	S	64.3	Low	74.5	Confident	109 Å²	109	80.3 Å²	80.3	76%	0.762	45%	0.447	S	S	*	.			trans	-74.4	77.1	173.6	-61.8	0	0	0	0	109	I864 K868	I864-S866 PolarHBondContact O-N 3.08Å; S866-K868 PolarHBondContact O-N 3.12Å
867	S	48.4	Very low	73.4	Confident	82 Å²	82	79.5 Å²	79.5	57%	0.573	44%	0.439	S	S	*	.			trans	-51.2	119.7	177.5	55.3	0	0	0	0	110.1	D865 G869	D865-S867 PolarHBondContact O-N 3.45Å; S867-G869 VanDerWaalsContact C-N 3.27Å; S867-G869 PolarHBondContact O-N 2.63Å
868	K	40.9	Very low	72.2	Confident	223 Å²	223	84.1 Å²	84.1	97%	0.97	46%	0.461	S	S	*	.	S	Bend	trans	-67.8	83.7	177.4	-69.4	179.7	179	175.8	0	110.2	S866	S866-K868 PolarHBondContact O-N 3.12Å
869	G	38.2	Very low	70.7	Confident	65 Å²	65	84 Å²	84	67%	0.67	46%	0.457	S	S	*	.			trans	153	86.8	-176.9	0	0	0	0	0	111.6	S867	S867-G869 VanDerWaalsContact C-N 3.27Å; S867-G869 PolarHBondContact O-N 2.63Å
870	L	30.8	Very low	69.1	Low	199 Å²	199	88.4 Å²	88.4	100%	1.042	48%	0.483	S	S	*	.			trans	-145.2	0	164.7	-138.1	176.6	0	0	0	107.8

Retrieved 870 of 870 residues in 366.7 ms (Link to these results)

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