A0A3Q0KST6_SCHMA Loading...

RFX-type winged-helix domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KST6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,245 aa.

						>A0A3Q0KST6_SCHMA|A0A3Q0KST6
MQSASGPGTTIVHLSPKNHTILQQGGQHVLLSKIASDSTSSRPPTSGVETSLLQTAHSNNSQTIYPAHYIEAIAEQTVYTANGEGGGILEIKSGTPLRKLFASVTKSLSGQYQEYTPIIYAPVSGGQTYYQTANGQVLATAFGAANSATGHVGALHTAAAAHANLTATSGVGHAQLVTHQGATYLVQSSQLDDDGSSISHTAKASPVTVQWLVDNYETAEGVSLPRSTLYFHYLQHCNEHKLEPMNPASFGKLIRSVFYGLRTRRLGTRGNSKYHYYGIRIKPNSPLNHFIEDAGFSLRHYPNYHRQTMEAAAEWKNFTNSSLNRLKSLNTNGNGVNSGGIGVGNTSVGLNNLTSHIHSTSHISSSNASSNINSSSSSNSQLSSHYGTSTTVTTLRSSDKSMLNNNNYIGSGNVSSHSTSQNIDSVTTNSITSPLLSSSGVGNGQHHAHFLGEASSALPNLDEICRSSGLPVPSEVDLPENSLNKNRLKTIETSNISPINEDVITFCRLYALSAGYMLDAVVNLDFTSIETVWKAFWCTEEVRDSRLKQSLSQERLYSLVSDPAILQFIRLYDHTFYQSLAEVLIPNVLRPIPPTLTQAIRNFAKSLEGWMRQAIQGLDTDLINLKISAVCALAQTLRRYTSLNHLAQAARAVLKNANQINQMLADLNRVDFNNVQEQASWVCQCSDSTVSQLEHDFKRILQKHASLEEWAQWLDTVVTSILQPLEGNSLAYTRAAHQLVLKWSFYSSMVIRDLTLRSASSFGSFHLIRLLYDEYIFYLVEHKVAAHLGMTPVAVMGEMGRDITQQHCTQNRLHLDNRNVPGKSSKSIHNNNNNTTINSPQHDNSNYLPFVNDDNDNNNDVDHTNSIFHHHQQQHSIKDRVVVVVGNDDCNPDTNTDDVISREKNRREQQQLDNDNVIVDENVMNHHDDEEEVDDFDEEVDEYLDDEDEVDDSLGDENAMLKEAHASAQAYCRNSSVAATNTSTILIPQSLDSTDNLLSNTGMEKDTLVMEDEINHEKQSNIEEVIVNDPHDNNNDIVDEEELVVKNIEEGTSNNKNKLEKLTQKHSNLFNNDKISSSTPAELTIQQSNKDKMSISTTTTTTTGSCSPPSIVTMPNPVRKVVRVTTFCDAKQPPVVVESSFANSTPSTTTIATTPTTTIRSINIKQSSSGSSSTISTPTITINCNRPPIEIHPSSLHITTTTPSSMINSSSGNTTTILNKLTVTTTTTSSTIPTDIIYAKRPKLS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	31.1	Very low	238 Å²	238	129.5 Å²	129.5	100%	1.172	83%	0.827	S	S	*	*				0	93	0	-50.1	180	95.8	0	0	105.3
2	Q	25.3	Very low	31.5	Very low	185 Å²	185	128.2 Å²	128.2	86%	0.864	82%	0.816	S	S	*	*				76.9	70.5	67.7	-159.2	168.7	25.3	0	0	112.9
3	S	26.5	Very low	32	Very low	107 Å²	107	130.5 Å²	130.5	75%	0.748	81%	0.81	S	S	*	*			trans	39.2	115.8	134.8	59.8	0	0	0	0	120.2
4	A	25.7	Very low	32	Very low	98 Å²	98	131.4 Å²	131.4	81%	0.81	81%	0.805	S	S	*	*				156.2	114.8	92.5	0	0	0	0	0	114.4
5	S	34.1	Very low	32.4	Very low	128 Å²	128	128.3 Å²	128.3	90%	0.895	79%	0.791	S	S	*	*			trans	-178	148.7	144.6	52.8	0	0	0	0	111.6
6	G	32.5	Very low	32.6	Very low	70 Å²	70	128.3 Å²	128.3	72%	0.722	79%	0.793	S	S	*	*			trans	-64.9	161.1	-162.5	0	0	0	0	0	119.2
7	P	32.8	Very low	33	Very low	139 Å²	139	131.1 Å²	131.1	90%	0.903	79%	0.792	S	S	*	*			trans	-82.7	131.1	176.6	33.6	-32.8	0	0	0	111.4
8	G	31.6	Very low	33.2	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	79%	0.793	S	S	*	*			trans	169	42.3	179.3	0	0	0	0	0	118.8
9	T	30.6	Very low	33.6	Very low	109 Å²	109	133.7 Å²	133.7	67%	0.669	79%	0.79	S	S	*	*			trans	-173.2	130.6	155.7	-76.4	0	0	0	0	108.6	I11	T9-I11 HydrophobicContact CG2-CG1 4.18Å
10	T	35.1	Very low	33.8	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	79%	0.788	S	S	*	*			trans	-135	129.1	171.1	-49.1	0	0	0	0	109.1	V12	T10-V12 HydrophobicContact CG2-CG2 4.07Å
11	I	32.1	Very low	33.9	Very low	144 Å²	144	132.5 Å²	132.5	74%	0.738	78%	0.78	S	S	*	*			trans	-109.9	122.4	-177.7	-58.2	172.5	0	0	0	108.1	T9	T9-I11 HydrophobicContact CG2-CG1 4.18Å
12	V	36.5	Very low	34	Very low	114 Å²	114	127.1 Å²	127.1	69%	0.691	76%	0.755	S	S	*	*			trans	-135.1	110.1	-179.8	-172.7	0	0	0	0	112.3	T10	T10-V12 HydrophobicContact CG2-CG2 4.07Å
13	H	37.3	Very low	34.6	Very low	159 Å²	159	125.5 Å²	125.5	74%	0.736	75%	0.748	S	S	*	*			trans	68.3	149.1	163.1	-143.3	-92.3	0	0	0	120.1
14	L	32.2	Very low	35.1	Very low	142 Å²	142	128.7 Å²	128.7	74%	0.743	75%	0.751	S	S	*	*			trans	-111	148.3	-176	-72.5	153.6	0	0	0	110.8
15	S	37.6	Very low	35.7	Very low	86 Å²	86	128 Å²	128	60%	0.601	75%	0.753	S	S	*	*			trans	-111.1	150.8	164.2	177	0	0	0	0	108.9	K17	S15-K17 PolarHBondContact O-N 2.95Å
16	P	36.7	Very low	36.1	Very low	127 Å²	127	125 Å²	125	83%	0.825	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	18.3	-177.9	-23.9	35.3	0	0	0	117
17	K	38.6	Very low	36.4	Very low	177 Å²	177	128.6 Å²	128.6	77%	0.77	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	35.4	-173.7	-63.3	-175.6	179.4	176.5	0	113.5	S15 H19	S15-K17 PolarHBondContact O-N 2.95Å; K17-H19 PolarHBondContact O-N 3.44Å
18	N	37.6	Very low	36.7	Very low	151 Å²	151	129.3 Å²	129.3	81%	0.807	73%	0.731	S	S	*	*			trans	44.3	51.3	157	-66.6	0.5	0	0	0	117.8
19	H	39.5	Very low	37	Very low	161 Å²	161	130.2 Å²	130.2	75%	0.745	72%	0.722	S	S	*	*			trans	-125.2	133	168.6	-73.1	4.3	0	0	0	110.5	K17	K17-H19 PolarHBondContact O-N 3.44Å
20	T	37.6	Very low	37.2	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	73%	0.726	S	S	*	*			trans	-120.2	129.4	178.7	-53.8	0	0	0	0	108.6
21	I	36.7	Very low	37.1	Very low	119 Å²	119	132.9 Å²	132.9	61%	0.61	73%	0.725	S	S	*	*			trans	-115.7	129.1	176.4	-59	176.3	0	0	0	107.9
22	L	37	Very low	37.2	Very low	125 Å²	125	131.4 Å²	131.4	65%	0.654	73%	0.728	S	S	*	*			trans	-109.2	132.7	170.5	-69.9	170.9	0	0	0	108.3
23	Q	37.5	Very low	36.9	Very low	151 Å²	151	135 Å²	135	71%	0.706	73%	0.734	S	S	*	*			trans	-108.8	117.9	-179.1	-171.3	178	11.8	0	0	109.8
24	Q	37	Very low	36.6	Very low	174 Å²	174	135.5 Å²	135.5	81%	0.813	74%	0.741	S	S	*	*	B	Isolated β-bridge	trans	-138.3	131	175.2	-164.8	177.4	24.1	0	0	108.7	G26	Q24-G26 VanDerWaalsContact C-N 3.26Å; Q24-G26 PolarHBondContact O-N 2.99Å; Q24-G26 VanDerWaalsContact O-N 3.11Å
25	G	38.4	Very low	36.6	Very low	83 Å²	83	132.6 Å²	132.6	86%	0.856	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	62	20.8	171	0	0	0	0	0	117.1	Q27	G25-Q27 PolarHBondContact O-N 3.04Å
26	G	43.4	Very low	36.4	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.3	8.2	175.1	0	0	0	0	0	116.2	Q24	Q24-G26 VanDerWaalsContact C-N 3.26Å; Q24-G26 PolarHBondContact O-N 2.99Å; Q24-G26 VanDerWaalsContact O-N 3.11Å
27	Q	38.2	Very low	36.1	Very low	146 Å²	146	136.1 Å²	136.1	68%	0.682	75%	0.752	S	S	*	*	B	Isolated β-bridge	trans	-107.6	136.4	174.9	-66.9	-172.6	-8.2	0	0	111.9	G25	G25-Q27 PolarHBondContact O-N 3.04Å
28	H	40.1	Very low	35.8	Very low	154 Å²	154	132.8 Å²	132.8	71%	0.713	75%	0.75	S	S	*	*			trans	-90.7	106.4	172.1	-72.9	-89.4	0	0	0	110.2
29	V	37.3	Very low	35.5	Very low	95 Å²	95	132 Å²	132	58%	0.576	75%	0.751	S	S	*	*			trans	-103.2	113.1	174.3	-177	0	0	0	0	109.6	L31	V29-L31 HydrophobicContact CG1-CD1 3.79Å; V29-L31 PolarHBondContact O-N 3.48Å
30	L	34.7	Very low	35.1	Very low	144 Å²	144	129.6 Å²	129.6	75%	0.754	75%	0.752	S	S	*	*			trans	-87.8	96.3	177.7	-170.6	77.6	0	0	0	110.5
31	L	33.3	Very low	34.8	Very low	151 Å²	151	128.7 Å²	128.7	79%	0.791	75%	0.751	S	S	*	*			trans	-76.4	128.1	173.6	-114.6	68.9	0	0	0	111.4	V29 K33	V29-L31 HydrophobicContact CG1-CD1 3.79Å; V29-L31 PolarHBondContact O-N 3.48Å; L31-K33 PolarHBondContact O-N 2.82Å
32	S	34	Very low	34.6	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	77%	0.766	S	S	*	*			trans	-82.5	112.2	-175.6	55.6	0	0	0	0	113.3
33	K	30.5	Very low	34.6	Very low	191 Å²	191	132.6 Å²	132.6	83%	0.83	76%	0.76	S	S	*	*			trans	33.2	85.9	149.9	-165.8	179.8	-176.8	179.8	0	116.7	L31	L31-K33 PolarHBondContact O-N 2.82Å
34	I	30.2	Very low	34.5	Very low	169 Å²	169	129.8 Å²	129.8	87%	0.867	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-72.6	125	158.2	-60.8	174.3	0	0	0	108
35	A	31.7	Very low	34.4	Very low	81 Å²	81	127.6 Å²	127.6	67%	0.669	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-95.6	141.4	170.6	0	0	0	0	0	110.1
36	S	35.5	Very low	34.3	Very low	120 Å²	120	129.3 Å²	129.3	84%	0.839	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-89.9	134.1	176.6	52.5	0	0	0	0	111.7
37	D	28.4	Very low	33.9	Very low	167 Å²	167	129.5 Å²	129.5	89%	0.893	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-62.6	144.5	-176.3	-77.3	-64.7	0	0	0	115.7
38	S	34	Very low	33.6	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	76%	0.764	S	S	*	*			trans	-151.6	103.9	144.9	56.1	0	0	0	0	113.5
39	T	31	Very low	33.3	Very low	135 Å²	135	129.2 Å²	129.2	83%	0.828	76%	0.763	S	S	*	*			trans	63	117	149.7	56.1	0	0	0	0	122.1
40	S	31.4	Very low	33.1	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	77%	0.771	S	S	*	*			trans	109.7	101.4	135.4	-149.5	0	0	0	0	121.5
41	S	31.3	Very low	33	Very low	103 Å²	103	127.7 Å²	127.7	72%	0.72	76%	0.764	S	S	*	*			trans	70.8	104.3	133	62.7	0	0	0	0	124.2
42	R	32.8	Very low	32.8	Very low	243 Å²	243	127.1 Å²	127.1	92%	0.917	76%	0.761	S	S	*	*				94.6	109.1	126	-161.9	172.6	178.3	175	-2	121.6
43	P	35.7	Very low	32.5	Very low	83 Å²	83	128.7 Å²	128.7	54%	0.539	76%	0.76	S	S	.	*			trans	-102.2	-155.9	167.4	44	-36.8	0	0	0	111.7
44	P	35.3	Very low	32.3	Very low	93 Å²	93	126.8 Å²	126.8	60%	0.604	75%	0.754	S	S	*	*			cis	-142.8	-148.1	1.4	39.9	-14.5	0	0	0	116.1
45	T	35.8	Very low	32.1	Very low	128 Å²	128	124.6 Å²	124.6	79%	0.785	75%	0.749	S	S	*	*			trans	88.2	152.6	165.3	69.1	0	0	0	0	120.3
46	S	35.7	Very low	31.8	Very low	118 Å²	118	124.8 Å²	124.8	83%	0.825	75%	0.75	S	S	*	*			cis	-176.7	144.9	-30.5	58.1	0	0	0	0	114.4
47	G	34.6	Very low	31.4	Very low	69 Å²	69	128 Å²	128	71%	0.711	75%	0.751	S	S	*	*			trans	138.7	121	166.2	0	0	0	0	0	113.3
48	V	32.9	Very low	31.3	Very low	146 Å²	146	125.5 Å²	125.5	89%	0.885	75%	0.747	S	S	*	*				80.8	130.9	51.5	175.5	0	0	0	0	112.2
49	E	32.8	Very low	30.9	Very low	149 Å²	149	127.8 Å²	127.8	70%	0.696	75%	0.751	S	S	*	*			cis	-95.3	-162.1	3	-88.9	-143.9	62.5	0	0	113.7	S51	E49-S51 PolarHBondContact OE1-OG 3.09Å
50	T	33.6	Very low	30.7	Very low	120 Å²	120	128.8 Å²	128.8	74%	0.736	75%	0.751	S	S	*	*			cis	70.8	159.1	18	29.2	0	0	0	0	116.6
51	S	33	Very low	30.2	Very low	87 Å²	87	128 Å²	128	61%	0.608	75%	0.746	S	S	*	*			cis	-155.8	175.5	14.6	-88.9	0	0	0	0	109.8	E49	E49-S51 PolarHBondContact OE1-OG 3.09Å
52	L	29.4	Very low	29.9	Very low	139 Å²	139	132 Å²	132	73%	0.728	75%	0.753	S	S	*	*			cis	-173.7	144.8	-23.8	-94.6	169.8	0	0	0	111.2
53	L	26.2	Very low	29.5	Very low	145 Å²	145	125.7 Å²	125.7	76%	0.759	74%	0.742	S	S	*	*			trans	63.5	162.4	150.5	-63.9	177.3	0	0	0	121.2
54	Q	26.7	Very low	29.1	Very low	152 Å²	152	129.6 Å²	129.6	71%	0.71	76%	0.756	S	S	*	*			cis	-168.9	140.2	-19.3	169.3	174.6	-4.4	0	0	113.5
55	T	25.7	Very low	28.5	Very low	123 Å²	123	135.1 Å²	135.1	76%	0.755	77%	0.767	S	S	*	*			trans	27.7	139.3	152.3	-44.9	0	0	0	0	123.9
56	A	26.2	Very low	28.3	Very low	85 Å²	85	134.4 Å²	134.4	70%	0.702	76%	0.764	S	S	*	*			trans	139.2	97	131.2	0	0	0	0	0	117.9
57	H	27	Very low	27.9	Very low	186 Å²	186	131.9 Å²	131.9	86%	0.861	75%	0.751	S	S	*	*			trans	46.9	155.2	132.9	-72.2	7.1	0	0	0	125.5
58	S	26.5	Very low	27.6	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	75%	0.754	S	S	*	*			trans	93.2	106	155	73.3	0	0	0	0	120.5
59	N	25.7	Very low	27.2	Very low	155 Å²	155	139.1 Å²	139.1	83%	0.829	75%	0.749	S	S	*	*			trans	1.8	112.9	150.9	-49.6	-7.5	0	0	0	119.3
60	N	25.6	Very low	26.8	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	74%	0.744	S	S	*	*				-166.9	152.4	111.1	-113.5	-32.6	0	0	0	114.7
61	S	22.8	Very low	26.4	Very low	94 Å²	94	140 Å²	140	66%	0.657	75%	0.747	S	S	*	*			trans	14.6	143.4	149.4	-57	0	0	0	0	123.3
62	Q	23.7	Very low	26	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.864	75%	0.754	S	S	*	*			trans	71.3	151.9	160.8	-63	174.5	-10.4	0	0	117
63	T	24.4	Very low	25.7	Very low	111 Å²	111	141.1 Å²	141.1	68%	0.681	76%	0.758	S	S	*	*			cis	-167.1	144.4	-25.7	-84	0	0	0	0	106.3
64	I	27.7	Very low	25.7	Very low	165 Å²	165	138.4 Å²	138.4	85%	0.846	76%	0.756	S	S	*	*			trans	-167.2	127.8	143.2	-98.7	146	0	0	0	109.1
65	Y	23.6	Very low	25.6	Very low	209 Å²	209	140.1 Å²	140.1	82%	0.82	76%	0.764	S	S	*	*			trans	-140.6	150.8	172.9	-103.1	-74.4	0	0	0	107.9
66	P	31.4	Very low	25.6	Very low	114 Å²	114	142.3 Å²	142.3	74%	0.74	77%	0.766	S	S	*	*				-111.1	138.1	128.8	-4.6	24.3	0	0	0	108.6
67	A	27.4	Very low	25.6	Very low	65 Å²	65	144.6 Å²	144.6	54%	0.537	77%	0.772	S	S	.	*			cis	61.5	115.4	18.9	0	0	0	0	0	113.1
68	H	27.6	Very low	25.5	Very low	169 Å²	169	140.9 Å²	140.9	78%	0.782	76%	0.762	S	S	*	*			cis	-132.8	-161.5	10.6	-58	-106.7	0	0	0	109.9
69	Y	23.9	Very low	25.3	Very low	198 Å²	198	145.9 Å²	145.9	78%	0.776	77%	0.765	S	S	*	*			cis	-161.4	-163.3	7.8	-143.3	174.9	0	0	0	113.7
70	I	24.7	Very low	25.3	Very low	114 Å²	114	144.8 Å²	144.8	59%	0.585	76%	0.764	S	S	*	*			trans	-16.5	135.8	161.9	-71.6	162.6	0	0	0	116.8
71	E	24.5	Very low	25.2	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.813	76%	0.758	S	S	*	*			cis	104.2	101.8	28.2	-178.2	-178.6	-122.7	0	0	114.4
72	A	25.6	Very low	25.4	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	77%	0.77	S	S	*	*			trans	-167	119.8	160.3	0	0	0	0	0	106.7
73	I	23.3	Very low	25.5	Very low	158 Å²	158	140.1 Å²	140.1	81%	0.81	77%	0.768	S	S	*	*				70	94.6	71.1	-57.3	170.4	0	0	0	113.8
74	A	25.3	Very low	25.5	Very low	88 Å²	88	144.5 Å²	144.5	73%	0.727	78%	0.781	S	S	*	*			trans	58.1	164.3	138.9	0	0	0	0	0	123.4
75	E	24.5	Very low	25.5	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	78%	0.782	S	S	*	*			trans	81.4	170.8	161.5	-54.2	-148.3	149.6	0	0	120.1
76	Q	26.3	Very low	25.6	Very low	169 Å²	169	134.8 Å²	134.8	79%	0.79	79%	0.785	S	S	*	*			trans	-83.2	164.5	-156.9	-58.5	162.4	2.9	0	0	112
77	T	26.1	Very low	25.5	Very low	134 Å²	134	133.1 Å²	133.1	82%	0.822	79%	0.788	S	S	*	*			trans	-136.5	83.7	159.6	-48.4	0	0	0	0	110.4
78	V	24.5	Very low	25.4	Very low	108 Å²	108	137.7 Å²	137.7	66%	0.655	80%	0.802	S	S	*	*			trans	-70.6	139.9	159.1	174.3	0	0	0	0	108.1	T80	V78-T80 PolarHBondContact O-N 3.41Å; V78-T80 VanDerWaalsContact O-N 3.12Å
79	Y	23	Very low	25.4	Very low	220 Å²	220	138 Å²	138	86%	0.863	81%	0.808	S	S	*	*			trans	-72.6	100.6	174.6	-81.7	-85.5	0	0	0	111.7
80	T	24.7	Very low	25.4	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	80%	0.804	S	S	*	*			trans	-132.7	145.1	157.8	49.8	0	0	0	0	110.1	V78	V78-T80 PolarHBondContact O-N 3.41Å; V78-T80 VanDerWaalsContact O-N 3.12Å
81	A	24.9	Very low	25.7	Very low	87 Å²	87	138 Å²	138	72%	0.719	82%	0.817	S	S	*	*			trans	-96.6	147.1	-175.3	0	0	0	0	0	112.4
82	N	25.7	Very low	25.7	Very low	169 Å²	169	137.4 Å²	137.4	90%	0.904	81%	0.812	S	S	*	*			trans	45.7	111.6	152.4	-54.7	1.8	0	0	0	118.8
83	G	26.2	Very low	25.8	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	82%	0.819	S	S	*	*			trans	175.2	122.4	163.7	0	0	0	0	0	112.3
84	E	25.5	Very low	26	Very low	203 Å²	203	135.2 Å²	135.2	95%	0.949	82%	0.817	S	S	*	*			trans	-84.3	142.5	-169.1	-60.8	169	116.2	0	0	114.2
85	G	27.7	Very low	26.3	Very low	84 Å²	84	137.3 Å²	137.3	87%	0.866	82%	0.82	S	S	*	*			trans	83.3	145.4	163.5	0	0	0	0	0	116.6
86	G	24.8	Very low	26.6	Very low	87 Å²	87	133.6 Å²	133.6	90%	0.897	81%	0.813	S	S	*	*			cis	154.7	106.4	-6.6	0	0	0	0	0	112.8
87	G	28.6	Very low	26.9	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	81%	0.81	S	S	*	*			trans	166.8	128.9	174.6	0	0	0	0	0	113.2
88	I	24.9	Very low	27.2	Very low	161 Å²	161	137 Å²	137	83%	0.826	81%	0.813	S	S	*	*			trans	-120	140.9	-178.4	-64.2	172	0	0	0	109.3
89	L	27.8	Very low	27.7	Very low	175 Å²	175	140.4 Å²	140.4	92%	0.916	82%	0.819	S	S	*	*			trans	-133.1	139.8	161	-80.1	175.2	0	0	0	110.9
90	E	24.3	Very low	28.1	Very low	145 Å²	145	136.1 Å²	136.1	68%	0.678	81%	0.81	S	S	*	*			trans	-104	137	-169.1	-178	-158.4	145.7	0	0	110.9	K92	E90-K92 WeakPolarHBondContact OE1-CE 3.21Å; E90-K92 IonicContact OE1-NZ 3.47Å
91	I	30.3	Very low	28.3	Very low	169 Å²	169	137.8 Å²	137.8	87%	0.867	81%	0.807	S	S	*	*			trans	-130.8	133.9	170.9	-61.5	-178.7	0	0	0	110
92	K	26.4	Very low	28.7	Very low	161 Å²	161	136.8 Å²	136.8	70%	0.7	80%	0.798	S	S	*	*			trans	-90.1	165.9	-167.3	-68.7	175.3	179	173.7	0	113.8	E90	E90-K92 WeakPolarHBondContact OE1-CE 3.21Å; E90-K92 IonicContact OE1-NZ 3.47Å
93	S	26.2	Very low	28.9	Very low	128 Å²	128	133.3 Å²	133.3	90%	0.895	79%	0.787	S	S	*	*	S	Bend	trans	-53.6	132	-179.1	44.6	0	0	0	0	113.9
94	G	28.8	Very low	29.1	Very low	74 Å²	74	135 Å²	135	76%	0.763	78%	0.781	S	S	*	*			trans	168.7	-12.5	171.9	0	0	0	0	0	118.1
95	T	30.5	Very low	29.4	Very low	131 Å²	131	130.8 Å²	130.8	80%	0.804	77%	0.769	S	S	*	*			trans	-109.2	124	-170.8	39.6	0	0	0	0	113.9
96	P	32.1	Very low	29.4	Very low	110 Å²	110	136 Å²	136	71%	0.714	77%	0.768	S	S	*	*			trans	-72.9	140.6	172.3	29.3	-33.4	0	0	0	111.3	R98	P96-R98 PolarHBondContact O-N 2.85Å
97	L	31.6	Very low	29.5	Very low	140 Å²	140	136.6 Å²	136.6	73%	0.733	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-57.9	-8.1	-169.9	-73.1	164.4	0	0	0	116.6	K99 L100	L97-K99 PolarHBondContact O-N 3.31Å; L97-K99 VanDerWaalsContact O-N 3.1Å; L97-L100 PolarHBondContact O-N 3.03Å
98	R	32.5	Very low	29.4	Very low	234 Å²	234	139.1 Å²	139.1	88%	0.883	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-70.3	-3.1	-173.8	-141.8	179.1	-167.9	-148.1	0.2	115.2	P96	P96-R98 PolarHBondContact O-N 2.85Å
99	K	35.1	Very low	29.4	Very low	181 Å²	181	137.7 Å²	137.7	79%	0.787	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-105.4	-20.7	177.2	-77.9	-168	173.9	-174.5	0	115.7	L97	L97-K99 PolarHBondContact O-N 3.31Å; L97-K99 VanDerWaalsContact O-N 3.1Å
100	L	31.2	Very low	29.2	Very low	130 Å²	130	131.7 Å²	131.7	68%	0.681	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-47.1	177.2	-105.7	69.3	0	0	0	111.6	L97 A102 S103	L97-L100 PolarHBondContact O-N 3.03Å; L100-A102 PolarHBondContact O-N 3.11Å; L100-A102 VanDerWaalsContact O-N 3.16Å; L100-S103 PolarHBondContact O-N 3.21Å; L100-S103 VanDerWaalsContact O-N 3.16Å
101	F	29.7	Very low	29.2	Very low	167 Å²	167	134.7 Å²	134.7	73%	0.732	75%	0.752	S	S	*	*	H	α-helix	trans	-62.5	-22.4	179.4	-78.5	-86.5	0	0	0	114.2	S103	F101-S103 VanDerWaalsContact C-N 3.34Å
102	A	32.6	Very low	28.8	Very low	65 Å²	65	135.6 Å²	135.6	54%	0.537	75%	0.746	S	S	.	*	H	α-helix	trans	-82	-8	179.6	0	0	0	0	0	114.2	L100	L100-A102 PolarHBondContact O-N 3.11Å; L100-A102 VanDerWaalsContact O-N 3.16Å
103	S	29.5	Very low	28.7	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	75%	0.753	S	S	*	*	H	α-helix	trans	-102.1	-20.2	-177.3	-165.6	0	0	0	0	113.9	L100 F101	L100-S103 PolarHBondContact O-N 3.21Å; L100-S103 VanDerWaalsContact O-N 3.16Å; F101-S103 VanDerWaalsContact C-N 3.34Å
104	V	30.3	Very low	28.7	Very low	117 Å²	117	139.8 Å²	139.8	71%	0.709	75%	0.754	S	S	*	*	H	α-helix	trans	-88.3	-25.8	-177	179.6	0	0	0	0	111.6	K106	V104-K106 PolarHBondContact O-N 2.96Å; V104-K106 VanDerWaalsContact O-N 3.17Å
105	T	31.8	Very low	28.5	Very low	113 Å²	113	146.9 Å²	146.9	69%	0.693	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	15.1	-174.3	54.2	0	0	0	0	115.1
106	K	28.5	Very low	28.3	Very low	193 Å²	193	145.7 Å²	145.7	84%	0.839	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	15.3	-177.5	-85.9	-165.6	169.9	-168.2	0	115.1	V104	V104-K106 PolarHBondContact O-N 2.96Å; V104-K106 VanDerWaalsContact O-N 3.17Å
107	S	26.8	Very low	28	Very low	100 Å²	100	145.7 Å²	145.7	70%	0.699	75%	0.752	S	S	*	*	S	Bend	trans	-120.4	-6.8	-174.6	-166.2	0	0	0	0	116.3
108	L	26.8	Very low	27.7	Very low	131 Å²	131	147.1 Å²	147.1	69%	0.686	76%	0.758	S	S	*	*			trans	-120	84.8	-179	-87.3	79.6	0	0	0	110.9	G110	L108-G110 PolarHBondContact O-N 3.29Å
109	S	23.6	Very low	27.4	Very low	132 Å²	132	140.4 Å²	140.4	92%	0.923	74%	0.739	S	S	*	*			trans	-87.7	81.8	164.8	54.9	0	0	0	0	109.4
110	G	24.4	Very low	26.9	Very low	49 Å²	49	139.4 Å²	139.4	51%	0.505	73%	0.731	S	S	.	*	S	Bend	trans	-158	136.9	179.7	0	0	0	0	0	110.6	L108 Y112	L108-G110 PolarHBondContact O-N 3.29Å; G110-Y112 WeakPolarHBondContact O-CD2 3.29Å; G110-Y112 PolarHBondContact O-N 2.8Å
111	Q	23.4	Very low	26.6	Very low	207 Å²	207	137.3 Å²	137.3	97%	0.967	73%	0.733	S	S	*	*			trans	-33.6	115.5	-170.5	-63.6	176.6	-10.6	0	0	115.4
112	Y	23.4	Very low	26.4	Very low	188 Å²	188	132.1 Å²	132.1	74%	0.737	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-103.1	124.7	164.7	-86.4	-91.1	0	0	0	109.6	G110	G110-Y112 WeakPolarHBondContact O-CD2 3.29Å; G110-Y112 PolarHBondContact O-N 2.8Å
113	Q	24.4	Very low	26.1	Very low	183 Å²	183	134.8 Å²	134.8	86%	0.855	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-77.5	141.9	160.8	-72.5	178.9	-56.6	0	0	109.4
114	E	25.5	Very low	26	Very low	195 Å²	195	132.7 Å²	132.7	91%	0.911	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-84.4	132.1	-173.2	-165.7	164.1	-155.2	0	0	111.2
115	Y	25	Very low	25.7	Very low	223 Å²	223	130 Å²	130	88%	0.875	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-80.8	120.9	-171.6	-96.7	-110.9	0	0	0	112.3
116	T	26.9	Very low	25.4	Very low	106 Å²	106	127.9 Å²	127.9	65%	0.65	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-72.1	152.3	163.6	49.9	0	0	0	0	111.4
117	P	25.4	Very low	25.2	Very low	109 Å²	109	125.9 Å²	125.9	71%	0.708	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59.9	148.3	172.9	26.7	-35	0	0	0	111.5	I119	P117-I119 PolarHBondContact O-N 2.85Å; P117-I119 VanDerWaalsContact O-N 3.13Å
118	I	23.9	Very low	25.2	Very low	171 Å²	171	126.3 Å²	126.3	88%	0.877	70%	0.699	S	S	*	*			trans	-66	112.4	-171.9	-56.4	176.7	0	0	0	110.3
119	I	27.8	Very low	25.1	Very low	93 Å²	93	129 Å²	129	48%	0.477	70%	0.701	S	S	.	*			trans	-93.5	133.2	172.9	-61.5	149.2	0	0	0	107.9	P117 A121	P117-I119 PolarHBondContact O-N 2.85Å; P117-I119 VanDerWaalsContact O-N 3.13Å; I119-A121 PolarHBondContact O-N 2.9Å
120	Y	24.1	Very low	25.3	Very low	160 Å²	160	131.3 Å²	131.3	63%	0.627	69%	0.691	S	S	*	*			trans	-63.7	105.9	166	-85.3	-84.4	0	0	0	109.8	P122 M960	Y120-P122 VanDerWaalsContact O-CD 3.24Å; Y120-P122 WeakPolarHBondContact O-CD 2.83Å; Y120-M960 HydrophobicContact CE2-CE 4.45Å; Y120-M960 WeakPolarHBondContact OH-CE 3.41Å; Y120-M960 PolarHBondContact OH-SD 2.84Å
121	A	24.2	Very low	25.3	Very low	86 Å²	86	138.3 Å²	138.3	71%	0.711	71%	0.711	S	S	*	*			trans	-77.6	114.2	171.2	0	0	0	0	0	109.6	I119 V123	I119-A121 PolarHBondContact O-N 2.9Å; A121-V123 PolarHBondContact O-N 3.34Å
122	P	26.2	Very low	25.6	Very low	57 Å²	57	132.2 Å²	132.2	37%	0.37	69%	0.688	S	S	.	*			trans	-74.4	111	173.4	30.3	-32.8	0	0	0	109.3	Y120 S124	Y120-P122 VanDerWaalsContact O-CD 3.24Å; Y120-P122 WeakPolarHBondContact O-CD 2.83Å; P122-S124 PolarHBondContact O-N 2.69Å; P122-S124 PolarHBondContact O-OG 3.49Å
123	V	26	Very low	26	Very low	121 Å²	121	128.4 Å²	128.4	73%	0.733	70%	0.695	S	S	*	*			trans	-53.5	111.8	172.7	179.7	0	0	0	0	108.6	A121 G125 Y943	A121-V123 PolarHBondContact O-N 3.34Å; V123-G125 PolarHBondContact O-N 3.32Å; V123-Y943 HydrophobicContact CG1-CE1 4.34Å
124	S	26.9	Very low	26.3	Very low	53 Å²	53	126.2 Å²	126.2	37%	0.371	69%	0.69	S	S	.	*	S	Bend	trans	-95.9	81	-171.4	-66.8	0	0	0	0	109.7	P122 R601	P122-S124 PolarHBondContact O-N 2.69Å; P122-S124 PolarHBondContact O-OG 3.49Å; S124-R601 PolarHBondContact OG-NH1 3.37Å
125	G	25.1	Very low	26.5	Very low	60 Å²	60	120 Å²	120	62%	0.619	68%	0.678	S	S	*	*			trans	147.1	96.4	177.5	0	0	0	0	0	112.5	V123	V123-G125 PolarHBondContact O-N 3.32Å
126	G	26	Very low	26.7	Very low	69 Å²	69	117.3 Å²	117.3	71%	0.711	67%	0.673	S	S	*	*			trans	175.9	135.1	176.6	0	0	0	0	0	113.3	T128	G126-T128 PolarHBondContact O-N 3.45Å
127	Q	24	Very low	26.8	Very low	151 Å²	151	118.2 Å²	118.2	71%	0.706	68%	0.678	S	S	*	*			trans	-85.4	96.5	178.2	-78.8	-88	-6.7	0	0	110.4	Y129	Q127-Y129 HydrophobicContact CB-CD2 4.13Å; Q127-Y129 HydrophobicContact CB-CE2 3.9Å; Q127-Y129 WeakPolarHBondContact O-CD2 3.48Å; Q127-Y129 PolarHBondContact O-N 2.88Å
128	T	26.8	Very low	26.9	Very low	108 Å²	108	119.3 Å²	119.3	66%	0.663	68%	0.677	S	S	*	*			trans	-77.8	83.8	-178.6	37.3	0	0	0	0	113.1	G126 Y130	G126-T128 PolarHBondContact O-N 3.45Å; T128-Y130 PolarHBondContact O-N 3.42Å; T128-Y130 VanDerWaalsContact O-N 3.17Å
129	Y	24.1	Very low	27.1	Very low	187 Å²	187	115.4 Å²	115.4	73%	0.733	67%	0.671	S	S	*	*			trans	-71.8	99.3	172.3	-78.5	-86.6	0	0	0	112.4	Q127 Q131	Q127-Y129 HydrophobicContact CB-CD2 4.13Å; Q127-Y129 HydrophobicContact CB-CE2 3.9Å; Q127-Y129 WeakPolarHBondContact O-CD2 3.48Å; Q127-Y129 PolarHBondContact O-N 2.88Å; Y129-Q131 PolarHBondContact O-N 2.86Å
130	Y	28.4	Very low	27.1	Very low	181 Å²	181	116.1 Å²	116.1	71%	0.71	68%	0.679	S	S	*	*			trans	-87.3	104.3	169	-69.7	-73.4	0	0	0	111.8	T128 T132	T128-Y130 PolarHBondContact O-N 3.42Å; T128-Y130 VanDerWaalsContact O-N 3.17Å; Y130-T132 PolarHBondContact O-N 2.9Å
131	Q	24.3	Very low	27.3	Very low	196 Å²	196	112.8 Å²	112.8	92%	0.916	69%	0.685	S	S	*	*			trans	-73.4	104.1	175.4	-173.2	177.3	18.5	0	0	111.1	Y129	Y129-Q131 PolarHBondContact O-N 2.86Å
132	T	28.9	Very low	27.4	Very low	80 Å²	80	118.5 Å²	118.5	49%	0.491	69%	0.694	S	S	.	*			trans	-74.3	150.8	168.7	66.9	0	0	0	0	111.1	Y130 N134 G135	Y130-T132 PolarHBondContact O-N 2.9Å; T132-N134 PolarHBondContact O-N 3.1Å; T132-G135 PolarHBondContact O-N 3.32Å
133	A	31.8	Very low	27.5	Very low	107 Å²	107	119.1 Å²	119.1	88%	0.884	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-3.1	-175.7	0	0	0	0	0	115.5
134	N	30.3	Very low	27.6	Very low	138 Å²	138	118.1 Å²	118.1	74%	0.738	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	1.8	-169.2	-61.4	-4.2	0	0	0	114	T132 Q136	T132-N134 PolarHBondContact O-N 3.1Å; N134-Q136 VanDerWaalsContact C-N 3.32Å; N134-Q136 PolarHBondContact O-N 2.97Å
135	G	29.7	Very low	27.8	Very low	64 Å²	64	120.2 Å²	120.2	66%	0.66	74%	0.736	S	S	*	*			trans	66	21.2	166.6	0	0	0	0	0	117	T132	T132-G135 PolarHBondContact O-N 3.32Å
136	Q	29.4	Very low	28	Very low	167 Å²	167	125 Å²	125	78%	0.78	75%	0.747	S	S	*	*			trans	-112.9	106.9	176.5	-70.8	-77.4	-60.4	0	0	109.4	N134	N134-Q136 VanDerWaalsContact C-N 3.32Å; N134-Q136 PolarHBondContact O-N 2.97Å
137	V	30.3	Very low	28.2	Very low	125 Å²	125	127.7 Å²	127.7	76%	0.758	76%	0.756	S	S	*	*			trans	-93.1	108	179.4	180	0	0	0	0	109.7	A139	V137-A139 PolarHBondContact O-N 3.39Å
138	L	27	Very low	28.5	Very low	131 Å²	131	125 Å²	125	69%	0.686	76%	0.759	S	S	*	*			trans	-91.6	83.7	174.3	-172.6	71.5	0	0	0	110.2	T140	L138-T140 HydrophobicContact CD2-CG2 4.48Å; L138-T140 HydrophobicContact CG-CG2 4.3Å; L138-T140 PolarHBondContact O-N 2.89Å; L138-T140 VanDerWaalsContact O-N 3.16Å
139	A	28.4	Very low	28.7	Very low	90 Å²	90	126.9 Å²	126.9	74%	0.744	77%	0.77	S	S	*	*			trans	-77.9	92.6	175.7	0	0	0	0	0	111.2	V137 A141	V137-A139 PolarHBondContact O-N 3.39Å; A139-A141 PolarHBondContact O-N 3.42Å
140	T	28	Very low	28.9	Very low	107 Å²	107	121 Å²	121	66%	0.656	77%	0.767	S	S	*	*			trans	-82.3	93.4	170.5	51.4	0	0	0	0	110.4	L138	L138-T140 HydrophobicContact CD2-CG2 4.48Å; L138-T140 HydrophobicContact CG-CG2 4.3Å; L138-T140 PolarHBondContact O-N 2.89Å; L138-T140 VanDerWaalsContact O-N 3.16Å
141	A	27.1	Very low	29.1	Very low	91 Å²	91	121.3 Å²	121.3	75%	0.752	77%	0.774	S	S	*	*			trans	-69.7	132	176.6	0	0	0	0	0	112.1	A139	A139-A141 PolarHBondContact O-N 3.42Å
142	F	26.5	Very low	29.2	Very low	205 Å²	205	119 Å²	119	90%	0.899	77%	0.773	S	S	*	*			trans	-116.1	67.5	158.8	-80.6	-78.3	0	0	0	108.8
143	G	28.9	Very low	29.2	Very low	70 Å²	70	119 Å²	119	72%	0.722	79%	0.789	S	S	*	*			trans	-75.6	121.2	172.3	0	0	0	0	0	110.4	A145	G143-A145 PolarHBondContact O-N 3.46Å
144	A	28.5	Very low	29.1	Very low	100 Å²	100	118.6 Å²	118.6	83%	0.826	79%	0.786	S	S	*	*			trans	-81	100.2	173	0	0	0	0	0	109.9	N146	A144-N146 PolarHBondContact O-N 3.42Å
145	A	29.4	Very low	28.9	Very low	97 Å²	97	118.8 Å²	118.8	80%	0.802	79%	0.786	S	S	*	*			trans	-91.2	85.8	175.8	0	0	0	0	0	110.9	G143	G143-A145 PolarHBondContact O-N 3.46Å
146	N	30	Very low	29	Very low	161 Å²	161	123.2 Å²	123.2	86%	0.861	79%	0.789	S	S	*	*			trans	-109.7	70.2	172.2	-94.8	12.5	0	0	0	111	A144	A144-N146 PolarHBondContact O-N 3.42Å
147	S	29.7	Very low	28.9	Very low	126 Å²	126	121.1 Å²	121.1	88%	0.881	79%	0.788	S	S	*	*			trans	-119.6	95.2	162.9	-69.8	0	0	0	0	108.2
148	A	30.7	Very low	28.7	Very low	93 Å²	93	119.5 Å²	119.5	77%	0.769	79%	0.788	S	S	*	*			trans	-130.4	71.1	-175.3	0	0	0	0	0	111.2	G150	A148-G150 PolarHBondContact O-N 3.17Å; A148-G150 VanDerWaalsContact O-N 3.13Å
149	T	32.1	Very low	28.7	Very low	148 Å²	148	117.7 Å²	117.7	91%	0.908	79%	0.792	S	S	*	*			trans	-59.6	110.9	154.5	33.3	0	0	0	0	107.6
150	G	27	Very low	28.6	Very low	64 Å²	64	118.4 Å²	118.4	66%	0.66	80%	0.798	S	S	*	*			trans	-72.9	140.9	-163.1	0	0	0	0	0	114	A148	A148-G150 PolarHBondContact O-N 3.17Å; A148-G150 VanDerWaalsContact O-N 3.13Å
151	H	32.4	Very low	28.6	Very low	188 Å²	188	117.6 Å²	117.6	87%	0.87	80%	0.802	S	S	*	*			trans	-147.9	152.3	141.5	-111.3	65.5	0	0	0	111.7
152	V	27.4	Very low	28.7	Very low	146 Å²	146	122.7 Å²	122.7	89%	0.885	81%	0.81	S	S	*	*			trans	-54.4	134	-175.3	-77.7	0	0	0	0	115.2
153	G	28.9	Very low	29	Very low	81 Å²	81	118 Å²	118	84%	0.835	81%	0.809	S	S	*	*			trans	175.1	137.9	169	0	0	0	0	0	111.6
154	A	28.3	Very low	29	Very low	98 Å²	98	121.7 Å²	121.7	81%	0.81	81%	0.812	S	S	*	*			trans	-120.5	168.8	-174.4	0	0	0	0	0	113
155	L	27.4	Very low	29.1	Very low	142 Å²	142	124.7 Å²	124.7	74%	0.743	81%	0.813	S	S	*	*			trans	102.8	100.9	143.7	-142.3	73.6	0	0	0	119.5
156	H	31.2	Very low	29	Very low	157 Å²	157	125.5 Å²	125.5	73%	0.727	81%	0.808	S	S	*	*			trans	75.1	110.2	135.6	-68.3	-174.9	0	0	0	123.2
157	T	26.8	Very low	29	Very low	123 Å²	123	122.3 Å²	122.3	76%	0.755	81%	0.805	S	S	*	*				63.8	102.2	106.8	-46.3	0	0	0	0	121.4
158	A	27.8	Very low	29.1	Very low	92 Å²	92	122.2 Å²	122.2	76%	0.76	80%	0.799	S	S	*	*			trans	83.1	140.7	132.2	0	0	0	0	0	123.8
159	A	26.6	Very low	29.1	Very low	93 Å²	93	123.6 Å²	123.6	77%	0.769	80%	0.803	S	S	*	*			trans	66	97.6	139.8	0	0	0	0	0	121.8
160	A	25.5	Very low	29	Very low	104 Å²	104	120 Å²	120	86%	0.86	80%	0.795	S	S	*	*				63.7	155.3	121.9	0	0	0	0	0	122.8
161	A	28.4	Very low	29	Very low	90 Å²	90	124.6 Å²	124.6	74%	0.744	81%	0.81	S	S	*	*			trans	86.6	109.2	165	0	0	0	0	0	119.8
162	H	28.6	Very low	28.8	Very low	199 Å²	199	119.2 Å²	119.2	92%	0.921	81%	0.806	S	S	*	*			trans	13	122.5	144.9	-58.1	-86.2	0	0	0	120.9
163	A	33.3	Very low	28.7	Very low	106 Å²	106	121.4 Å²	121.4	88%	0.876	81%	0.806	S	S	*	*			trans	-147.9	149.1	132.5	0	0	0	0	0	110.6
164	N	28.6	Very low	28.7	Very low	148 Å²	148	120.9 Å²	120.9	79%	0.791	79%	0.794	S	S	*	*			trans	-122.4	131.9	177.9	178.7	26.1	0	0	0	108.6
165	L	30.4	Very low	28.6	Very low	162 Å²	162	124 Å²	124	85%	0.848	79%	0.791	S	S	*	*			trans	-152.7	155.7	177.2	-110.7	163.9	0	0	0	111.6
166	T	28.2	Very low	28.6	Very low	114 Å²	114	123.5 Å²	123.5	70%	0.699	79%	0.789	S	S	*	*			trans	-137.9	150.4	-151.5	31.6	0	0	0	0	115
167	A	30.6	Very low	28.5	Very low	95 Å²	95	120.5 Å²	120.5	79%	0.785	78%	0.781	S	S	*	*			trans	71	157.7	164.5	0	0	0	0	0	115.6
168	T	29.9	Very low	28.6	Very low	124 Å²	124	118.5 Å²	118.5	76%	0.761	77%	0.769	S	S	*	*			cis	-143.8	159.9	21.3	45.1	0	0	0	0	114.7
169	S	31.9	Very low	28.6	Very low	121 Å²	121	119.8 Å²	119.8	85%	0.846	76%	0.759	S	S	*	*			trans	66	136.3	153.1	63.4	0	0	0	0	120.8
170	G	29.3	Very low	28.8	Very low	73 Å²	73	123.5 Å²	123.5	75%	0.753	76%	0.761	S	S	*	*			trans	149.1	51.8	159.1	0	0	0	0	0	120.7
171	V	27.2	Very low	29.2	Very low	160 Å²	160	122.6 Å²	122.6	97%	0.97	76%	0.761	S	S	*	*			trans	38.5	107	155.1	-170.5	0	0	0	0	119.2
172	G	28.2	Very low	29.3	Very low	76 Å²	76	119.8 Å²	119.8	78%	0.784	74%	0.738	S	S	*	*			trans	172.5	134.8	164.2	0	0	0	0	0	111.5
173	H	26.6	Very low	29.5	Very low	192 Å²	192	114.7 Å²	114.7	89%	0.889	72%	0.721	S	S	*	*			trans	-113.6	101.1	-172.8	-160.1	70.5	0	0	0	111.4
174	A	27.9	Very low	29.3	Very low	70 Å²	70	117.8 Å²	117.8	58%	0.579	71%	0.711	S	S	*	*			trans	-127.8	138.3	172.4	0	0	0	0	0	109.5
175	Q	26.8	Very low	29.3	Very low	162 Å²	162	117.5 Å²	117.5	76%	0.757	71%	0.709	S	S	*	*			trans	-102.7	117.1	-166.9	-176	178.9	-51.1	0	0	111.6	V177	Q175-V177 HydrophobicContact CG-CG2 4.35Å; Q175-V177 PolarHBondContact O-N 3.48Å
176	L	26.2	Very low	29.3	Very low	132 Å²	132	115.5 Å²	115.5	69%	0.691	70%	0.703	S	S	*	*			trans	-65.1	113.3	170.8	-82.6	160.3	0	0	0	110.3	T183	L176-T183 HydrophobicContact CD2-CG2 3.94Å
177	V	29.4	Very low	29.3	Very low	94 Å²	94	117.8 Å²	117.8	57%	0.57	71%	0.706	S	S	*	*			trans	-112	112.3	170.3	179.2	0	0	0	0	108.1	Q175	Q175-V177 HydrophobicContact CG-CG2 4.35Å; Q175-V177 PolarHBondContact O-N 3.48Å
178	T	28.7	Very low	29.1	Very low	81 Å²	81	118 Å²	118	50%	0.497	70%	0.702	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	119.2	179.6	-50.9	0	0	0	0	109.4
179	H	28.8	Very low	28.9	Very low	119 Å²	119	117.3 Å²	117.3	55%	0.551	70%	0.702	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-141.8	121.8	175.5	-169.4	-97	0	0	0	109.9
180	Q	31	Very low	28.7	Very low	172 Å²	172	119.6 Å²	119.6	80%	0.804	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.1	62.6	174.7	-62.8	-179	8.2	0	0	115.4	A182	Q180-A182 VanDerWaalsContact C-N 3.3Å; Q180-A182 PolarHBondContact O-N 2.72Å
181	G	33.3	Very low	28.6	Very low	85 Å²	85	122.7 Å²	122.7	88%	0.876	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.3	-16.4	160.5	0	0	0	0	0	116.8
182	A	29.5	Very low	28.5	Very low	30 Å²	30	122.1 Å²	122.1	25%	0.248	69%	0.689	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	140.4	172.5	0	0	0	0	0	111.6	Q180 Y184	Q180-A182 VanDerWaalsContact C-N 3.3Å; Q180-A182 PolarHBondContact O-N 2.72Å; A182-Y184 HydrophobicContact CB-CD2 4.26Å; A182-Y184 HydrophobicContact CB-CE1 4.4Å; A182-Y184 HydrophobicContact CB-CE2 3.44Å; A182-Y184 VanDerWaalsContact CB-CE2 3.44Å; A182-Y184 WeakPolarHBondContact CB-OH 3.28Å
183	T	32.9	Very low	28.5	Very low	93 Å²	93	126.4 Å²	126.4	57%	0.571	69%	0.694	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.1	112.9	172.1	-63.4	0	0	0	0	108.2	L176	L176-T183 HydrophobicContact CD2-CG2 3.94Å
184	Y	29.1	Very low	28.7	Very low	171 Å²	171	124.5 Å²	124.5	67%	0.671	69%	0.691	S	S	*	*			trans	-102	130.9	-179.8	-58.5	-79.7	0	0	0	110	A182	A182-Y184 HydrophobicContact CB-CD2 4.26Å; A182-Y184 HydrophobicContact CB-CE1 4.4Å; A182-Y184 HydrophobicContact CB-CE2 3.44Å; A182-Y184 VanDerWaalsContact CB-CE2 3.44Å; A182-Y184 WeakPolarHBondContact CB-OH 3.28Å
185	L	29.2	Very low	28.8	Very low	142 Å²	142	123.1 Å²	123.1	74%	0.743	68%	0.683	S	S	*	*			trans	-100.3	99.6	175.2	-157.4	171.7	0	0	0	108.1	Q187	L185-Q187 HydrophobicContact CD2-CB 3.85Å; L185-Q187 PolarHBondContact O-N 2.94Å
186	V	30.4	Very low	29.3	Very low	119 Å²	119	120.5 Å²	120.5	72%	0.721	68%	0.683	S	S	*	*			trans	-88.6	102.8	176.9	-177.9	0	0	0	0	108.8
187	Q	29.2	Very low	29.8	Very low	163 Å²	163	120 Å²	120	76%	0.762	69%	0.69	S	S	*	*			trans	-135.2	128.2	169.1	-175.6	162.8	-31.9	0	0	110.2	L185	L185-Q187 HydrophobicContact CD2-CB 3.85Å; L185-Q187 PolarHBondContact O-N 2.94Å
188	S	25	Very low	30.1	Very low	100 Å²	100	120.8 Å²	120.8	70%	0.699	69%	0.69	S	S	*	*			trans	-83.6	159.2	-176.7	-52.1	0	0	0	0	112.9
189	S	27.1	Very low	30.3	Very low	109 Å²	109	119.9 Å²	119.9	76%	0.762	69%	0.687	S	S	*	*			trans	89.4	112	156.5	-53.4	0	0	0	0	118.5
190	Q	26.2	Very low	31	Very low	168 Å²	168	121.3 Å²	121.3	79%	0.785	69%	0.694	S	S	*	*			trans	72.6	104.6	150.1	-73.1	-175.4	-111.8	0	0	120.5
191	L	28	Very low	31.8	Very low	139 Å²	139	116.6 Å²	116.6	73%	0.728	68%	0.677	S	S	*	*			trans	83.8	137.7	135	-59.4	172.8	0	0	0	118.5
192	D	25.9	Very low	32.3	Very low	148 Å²	148	116.3 Å²	116.3	79%	0.791	67%	0.666	S	S	*	*			trans	74.5	111.5	160.7	-47.8	-25.7	0	0	0	119.3
193	D	28.4	Very low	33.5	Very low	166 Å²	166	124.2 Å²	124.2	89%	0.888	70%	0.695	S	S	*	*			trans	64.1	90.8	145.6	-147.7	30	0	0	0	121.1
194	D	30.4	Very low	34.9	Very low	152 Å²	152	120.2 Å²	120.2	81%	0.813	67%	0.672	S	S	*	*				-172.8	126.6	125.3	-141.9	-33.9	0	0	0	111
195	G	28.6	Very low	37.1	Very low	40 Å²	40	113.9 Å²	113.9	41%	0.412	65%	0.652	S	S	.	*			trans	-115.9	-1.7	-159.9	0	0	0	0	0	118.5	S197 I198 S199	G195-S197 PolarHBondContact O-N 2.86Å; G195-I198 PolarHBondContact O-N 2.7Å; G195-S199 PolarHBondContact O-OG 2.77Å
196	S	37.8	Very low	39.7	Very low	108 Å²	108	112.2 Å²	112.2	76%	0.755	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-12.3	-156.2	56.8	0	0	0	0	118
197	S	37.1	Very low	42.4	Very low	121 Å²	121	109.7 Å²	109.7	85%	0.846	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-5.9	-179.5	62.8	0	0	0	0	114.8	G195	G195-S197 PolarHBondContact O-N 2.86Å
198	I	34.6	Very low	45.4	Very low	110 Å²	110	102 Å²	102	56%	0.564	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-9.5	-172.8	-141.5	163.1	0	0	0	113.1	G195 H200 T201 A202	G195-I198 PolarHBondContact O-N 2.7Å; I198-H200 PolarHBondContact O-N 2.95Å; I198-T201 HydrophobicContact CG1-CG2 4Å; I198-T201 WeakPolarHBondContact O-CG2 3.23Å; I198-T201 PolarHBondContact O-N 3.07Å; I198-A202 PolarHBondContact O-N 3.06Å
199	S	34.3	Very low	48.7	Very low	63 Å²	63	99.2 Å²	99.2	44%	0.441	58%	0.578	S	S	.	*	H	α-helix	trans	-62.9	-33	-166.2	-38.4	0	0	0	0	114.6	G195 A202 K203	G195-S199 PolarHBondContact O-OG 2.77Å; S199-A202 PolarHBondContact O-N 3.31Å; S199-K203 PolarHBondContact O-N 3.25Å
200	H	42.4	Very low	51.8	Low	148 Å²	148	99 Å²	99	69%	0.685	56%	0.564	S	S	*	*	H	α-helix	trans	-76.3	-30	-179.1	-68.1	-62.3	0	0	0	113.7	I198 A202	I198-H200 PolarHBondContact O-N 2.95Å; H200-A202 VanDerWaalsContact C-N 3.33Å
201	T	47.6	Very low	55	Low	74 Å²	74	92.3 Å²	92.3	45%	0.454	53%	0.532	S	S	.	.	H	α-helix	trans	-79.9	-18.5	170.8	-172	0	0	0	0	112.2	I198	I198-T201 HydrophobicContact CG1-CG2 4Å; I198-T201 WeakPolarHBondContact O-CG2 3.23Å; I198-T201 PolarHBondContact O-N 3.07Å
202	A	45.1	Very low	58.3	Low	79 Å²	79	85.7 Å²	85.7	65%	0.653	50%	0.497	S	S	*	.	H	α-helix	trans	-77.6	-22.2	177.8	0	0	0	0	0	113.9	I198 S199 H200	I198-A202 PolarHBondContact O-N 3.06Å; S199-A202 PolarHBondContact O-N 3.31Å; H200-A202 VanDerWaalsContact C-N 3.33Å
203	K	54.3	Low	61.5	Low	195 Å²	195	81.6 Å²	81.6	85%	0.848	48%	0.477	S	S	*	.	S	Bend	trans	-88.1	-11.8	173.3	-81.1	-160	171.8	-164	0	114.4	S199	S199-K203 PolarHBondContact O-N 3.25Å
204	A	62.7	Low	64.7	Low	10 Å²	10	77.5 Å²	77.5	8%	0.083	46%	0.456	C	S	.	.	S	Bend	trans	-81.6	129.9	-178.1	0	0	0	0	0	111.2	V209 L253	A204-V209 HydrophobicContact CB-CG2 4.24Å; A204-L253 HydrophobicContact CB-CD1 3.53Å; A204-L253 HydrophobicContact CB-CD2 3.94Å; A204-L253 HydrophobicContact CB-CG 4.36Å
205	S	74.5	Confident	67.8	Low	38 Å²	38	71 Å²	71	27%	0.266	42%	0.421	S	S	.	.			trans	-55.8	128.5	174.8	176.1	0	0	0	0	110.6	V207 T208 V209	S205-V207 PolarHBondContact O-N 3.3Å; S205-V207 VanDerWaalsContact O-N 3.12Å; S205-V207 PolarHBondContact OG-N 3.03Å; S205-T208 WeakPolarHBondContact O-CB 3.25Å; S205-T208 PolarHBondContact O-N 3.05Å; S205-V209 PolarHBondContact O-N 2.83Å
206	P	85	Confident	71	Confident	107 Å²	107	69.2 Å²	69.2	70%	0.695	40%	0.402	S	S	*	.	H	α-helix	trans	-56.1	-29	176.1	-27.3	35.6	0	0	0	113	V209 Q210	P206-V209 PolarHBondContact O-N 3.15Å; P206-Q210 WeakPolarHBondContact O-CB 3.4Å; P206-Q210 PolarHBondContact O-N 2.62Å
207	V	86.6	Confident	73.7	Confident	65 Å²	65	66.4 Å²	66.4	39%	0.394	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-45.8	175.2	-174.2	0	0	0	0	110.8	S205 Q210 W211 L242	S205-V207 PolarHBondContact O-N 3.3Å; S205-V207 VanDerWaalsContact O-N 3.12Å; S205-V207 PolarHBondContact OG-N 3.03Å; V207-Q210 PolarHBondContact O-N 3.11Å; V207-W211 WeakPolarHBondContact O-CB 3.48Å; V207-W211 PolarHBondContact O-N 3.24Å; V207-L242 HydrophobicContact CB-CD1 4.45Å
208	T	92	Very high	76.3	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-40.5	177.5	-53.4	0	0	0	0	112.2	S205 W211 L212 Y233 L253	S205-T208 WeakPolarHBondContact O-CB 3.25Å; S205-T208 PolarHBondContact O-N 3.05Å; T208-W211 PolarHBondContact O-N 3.35Å; T208-L212 WeakPolarHBondContact O-CB 3.47Å; T208-L212 WeakPolarHBondContact O-CG 3.19Å; T208-L212 PolarHBondContact O-N 3.47Å; T208-Y233 HydrophobicContact CG2-CD2 3.97Å; T208-Y233 HydrophobicContact CG2-CE2 3.46Å; T208-Y233 VanDerWaalsContact CG2-CE2 3.46Å; T208-L253 HydrophobicContact CG2-CD2 3.97Å
209	V	93.4	Very high	79	Confident	42 Å²	42	59.9 Å²	59.9	26%	0.255	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-45.3	177.2	176.4	0	0	0	0	110.5	A204 S205 P206 L212 V213 L253 V257	A204-V209 HydrophobicContact CB-CG2 4.24Å; S205-V209 PolarHBondContact O-N 2.83Å; P206-V209 PolarHBondContact O-N 3.15Å; V209-L212 PolarHBondContact O-N 3.43Å; V209-V213 WeakPolarHBondContact O-CG2 3.34Å; V209-V213 PolarHBondContact O-N 3.42Å; V209-L253 HydrophobicContact CG2-CD1 4.13Å; V209-V257 HydrophobicContact CG1-CG2 4.18Å
210	Q	92	Very high	81.6	Confident	104 Å²	104	66.1 Å²	66.1	49%	0.486	36%	0.36	S	S	.	.	H	α-helix	trans	-63.1	-45.4	176.6	-173.2	58.3	44	0	0	111.3	P206 V207 L212 V213 D214	P206-Q210 WeakPolarHBondContact O-CB 3.4Å; P206-Q210 PolarHBondContact O-N 2.62Å; V207-Q210 PolarHBondContact O-N 3.11Å; Q210-L212 PolarHBondContact O-N 2.75Å; Q210-V213 CarbonylContact O-C 3.49Å; Q210-V213 PolarHBondContact O-N 2.92Å; Q210-V213 VanDerWaalsContact O-N 3.16Å; Q210-D214 WeakPolarHBondContact CG-OD2 3.25Å; Q210-D214 PolarHBondContact NE2-OD1 3.34Å; Q210-D214 PolarHBondContact NE2-OD2 3.27Å; Q210-D214 WeakPolarHBondContact O-CB 3.21Å; Q210-D214 PolarHBondContact O-N 3.34Å
211	W	95	Very high	83.7	Confident	27 Å²	27	61.8 Å²	61.8	10%	0.102	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-41.4	175.8	170.9	89.8	0	0	0	113.1	V207 T208 D214 N215 Y216 H232 Y233 H236 L287	V207-W211 WeakPolarHBondContact O-CB 3.48Å; V207-W211 PolarHBondContact O-N 3.24Å; T208-W211 PolarHBondContact O-N 3.35Å; W211-D214 PolarHBondContact O-N 3.42Å; W211-N215 VanDerWaalsContact CD1-ND2 3.26Å; W211-N215 PolarHBondContact NE1-ND2 3.03Å; W211-N215 WeakPolarHBondContact O-CB 3.37Å; W211-N215 PolarHBondContact O-N 3.27Å; W211-N215 VanDerWaalsContact O-N 3.11Å; W211-N215 PolarHBondContact O-ND2 2.88Å; W211-Y216 AromaticContact CH2-CE2 3.87Å; W211-Y216 HydrophobicContact CH2-CE2 3.87Å; W211-Y216 HydrophobicContact CZ2-CE2 4.25Å; W211-Y216 HydrophobicContact CZ3-CE2 4.19Å; W211-H232 HydrophobicContact CH2-CB 4.02Å; W211-H232 HydrophobicContact CZ2-CB 3.86Å; W211-H232 VanDerWaalsContact CZ2-O 3.28Å; W211-H232 WeakPolarHBondContact CZ2-O 3.46Å; W211-Y233 HydrophobicContact CZ3-CD2 4.13Å; W211-H236 AromaticContact CD1-CE1 3.75Å; W211-H236 AromaticContact CD1-CG 3.62Å; W211-H236 AromaticContact CD1-ND1 3.3Å; W211-H236 VanDerWaalsContact CD1-ND1 3.3Å; W211-H236 HydrophobicContact CD2-CB 4Å; W211-H236 AromaticContact CD2-CD2 3.77Å; W211-H236 AromaticContact CD2-CG 3.68Å; W211-H236 AromaticContact CE2-CG 3.81Å; W211-H236 HydrophobicContact CG-CB 4.33Å; W211-H236 AromaticContact CG-CD2 3.74Å; W211-H236 AromaticContact CG-CE1 3.64Å; W211-H236 AromaticContact CG-CG 3.62Å; W211-H236 AromaticContact CG-ND1 3.55Å; W211-H236 AromaticContact CG-NE2 3.75Å; W211-H236 HydrophobicContact CZ2-CB 3.95Å; W211-H236 AromaticContact NE1-CG 3.72Å; W211-H236 AromaticContact NE1-ND1 3.77Å; W211-L287 HydrophobicContact CZ2-CD1 3.99Å
212	L	96.2	Very high	85.8	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60	-49.3	173.5	-83.3	172.5	0	0	0	110.9	T208 V209 Q210 D214 Y216 L229 F250 L253 V257 F258	T208-L212 WeakPolarHBondContact O-CB 3.47Å; T208-L212 WeakPolarHBondContact O-CG 3.19Å; T208-L212 PolarHBondContact O-N 3.47Å; V209-L212 PolarHBondContact O-N 3.43Å; Q210-L212 PolarHBondContact O-N 2.75Å; L212-D214 PolarHBondContact O-N 3.05Å; L212-Y216 HydrophobicContact CD2-CD2 4.15Å; L212-Y216 HydrophobicContact CD2-CE2 4.31Å; L212-Y216 WeakPolarHBondContact O-CD2 3.22Å; L212-Y216 PolarHBondContact O-N 3.4Å; L212-L229 HydrophobicContact CD2-CD2 4.47Å; L212-F250 HydrophobicContact CD1-CE2 4.49Å; L212-F250 HydrophobicContact CD2-CE2 4.44Å; L212-F250 HydrophobicContact CD2-CZ 4.28Å; L212-L253 HydrophobicContact CD1-CD2 4.3Å; L212-L253 HydrophobicContact CD1-CG 4.21Å; L212-V257 HydrophobicContact CB-CG1 4.35Å; L212-V257 HydrophobicContact CD1-CG2 4.13Å; L212-F258 HydrophobicContact CB-CE2 4.23Å; L212-F258 WeakPolarHBondContact O-CZ 3.13Å
213	V	94.3	Very high	87.9	Confident	62 Å²	62	59.8 Å²	59.8	38%	0.376	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-35.9	179.9	172.2	0	0	0	0	111.9	V209 Q210 V257 K282	V209-V213 WeakPolarHBondContact O-CG2 3.34Å; V209-V213 PolarHBondContact O-N 3.42Å; Q210-V213 CarbonylContact O-C 3.49Å; Q210-V213 PolarHBondContact O-N 2.92Å; Q210-V213 VanDerWaalsContact O-N 3.16Å; V213-V257 HydrophobicContact CG2-CG1 3.74Å; V213-K282 WeakPolarHBondContact O-CE 3.33Å; V213-K282 PolarHBondContact O-NZ 3.19Å
214	D	94.8	Very high	89.7	Confident	80 Å²	80	51.3 Å²	51.3	43%	0.428	30%	0.301	S	S	.	.	H	α-helix	trans	-75.6	-29.8	-178.1	-76.3	-28.4	0	0	0	113.5	Q210 W211 L212 K282	Q210-D214 WeakPolarHBondContact CG-OD2 3.25Å; Q210-D214 PolarHBondContact NE2-OD1 3.34Å; Q210-D214 PolarHBondContact NE2-OD2 3.27Å; Q210-D214 WeakPolarHBondContact O-CB 3.21Å; Q210-D214 PolarHBondContact O-N 3.34Å; W211-D214 PolarHBondContact O-N 3.42Å; L212-D214 PolarHBondContact O-N 3.05Å; D214-K282 WeakPolarHBondContact O-CD 3.18Å; D214-K282 PolarHBondContact O-NZ 2.95Å
215	N	94.8	Very high	91.1	Very high	16 Å²	16	52.4 Å²	52.4	9%	0.086	31%	0.307	C	S	.	.	H	α-helix	trans	-100.4	-24.2	-176	-71.5	-76.4	0	0	0	115.3	W211 K282 S285 L287	W211-N215 VanDerWaalsContact CD1-ND2 3.26Å; W211-N215 PolarHBondContact NE1-ND2 3.03Å; W211-N215 WeakPolarHBondContact O-CB 3.37Å; W211-N215 PolarHBondContact O-N 3.27Å; W211-N215 VanDerWaalsContact O-N 3.11Å; W211-N215 PolarHBondContact O-ND2 2.88Å; N215-K282 PolarHBondContact O-N 2.83Å; N215-S285 PolarHBondContact OD1-OG 3.44Å; N215-L287 HydrophobicContact CB-CD1 3.77Å
216	Y	96.1	Very high	92	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158.5	-176.2	-57.1	-88.9	0	0	0	112.4	W211 L212 L224 L229 H232 I279 R280 I281 K282 L287	W211-Y216 AromaticContact CH2-CE2 3.87Å; W211-Y216 HydrophobicContact CH2-CE2 3.87Å; W211-Y216 HydrophobicContact CZ2-CE2 4.25Å; W211-Y216 HydrophobicContact CZ3-CE2 4.19Å; L212-Y216 HydrophobicContact CD2-CD2 4.15Å; L212-Y216 HydrophobicContact CD2-CE2 4.31Å; L212-Y216 WeakPolarHBondContact O-CD2 3.22Å; L212-Y216 PolarHBondContact O-N 3.4Å; Y216-L224 HydrophobicContact CD1-CD2 3.97Å; Y216-L224 HydrophobicContact CE1-CD2 3.69Å; Y216-L229 HydrophobicContact CD1-CD1 3.83Å; Y216-L229 HydrophobicContact CE1-CB 4.49Å; Y216-L229 HydrophobicContact CE1-CD1 3.62Å; Y216-L229 HydrophobicContact CE1-CG 3.86Å; Y216-L229 HydrophobicContact CE2-CD1 4.36Å; Y216-L229 HydrophobicContact CE2-CG 4.26Å; Y216-L229 HydrophobicContact CG-CD1 4.3Å; Y216-H232 WeakPolarHBondContact OH-CB 3.33Å; Y216-H232 PolarHBondContact OH-ND1 3.37Å; Y216-I279 HydrophobicContact CG-CD1 4.41Å; Y216-R280 WeakPolarHBondContact CA-O 3.49Å; Y216-I281 HydrophobicContact CD1-CG1 4.02Å; Y216-I281 HydrophobicContact CE1-CD1 3.86Å; Y216-I281 HydrophobicContact CE1-CG1 3.68Å; Y216-K282 WeakPolarHBondContact O-CE 3.31Å; Y216-L287 HydrophobicContact CE2-CD1 4.18Å
217	E	94.4	Very high	92.2	Very high	50 Å²	50	49.9 Å²	49.9	23%	0.234	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	149.3	177.3	60.8	179.7	155.1	0	0	112.5	A219 I279 R280 K282 P283	E217-A219 PolarHBondContact O-N 3.44Å; E217-I279 WeakPolarHBondContact O-CA 3.49Å; E217-R280 VanDerWaalsContact CD-CZ 3.48Å; E217-R280 VanDerWaalsContact CD-NE 3.27Å; E217-R280 HydrophobicContact CG-CG 3.65Å; E217-R280 PolarHBondContact N-O 3.07Å; E217-R280 PolarHBondContact O-N 3.23Å; E217-R280 IonicContact OE1-CZ 2.68Å; E217-R280 IonicContact OE1-NE 3.14Å; E217-R280 PolarHBondContact OE1-NE 3.01Å; E217-R280 IonicContact OE1-NH2 2.71Å; E217-R280 PolarHBondContact OE1-NH2 3.03Å; E217-R280 IonicContact OE2-CZ 2.88Å; E217-R280 IonicContact OE2-NE 2.79Å; E217-R280 IonicContact OE2-NH2 3.18Å; E217-R280 PolarHBondContact OE2-NH2 3.27Å; E217-K282 HydrophobicContact CB-CD 4.46Å; E217-K282 HydrophobicContact CB-CG 3.78Å; E217-K282 HydrophobicContact CG-CG 3.64Å; E217-P283 WeakPolarHBondContact OE1-CD 3.48Å
218	T	93.3	Very high	92.5	Very high	88 Å²	88	48.5 Å²	48.5	54%	0.54	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	129.1	176.5	-43.3	0	0	0	0	110.5	G278	T218-G278 CarbonylContact C-O 3.59Å; T218-G278 WeakPolarHBondContact CA-O 3.39Å; T218-G278 WeakPolarHBondContact CG2-O 3.29Å
219	A	91.1	Very high	92.6	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	123.3	-174.8	0	0	0	0	0	111.7	E217 V222 G278 R280	E217-A219 PolarHBondContact O-N 3.44Å; A219-V222 HydrophobicContact CB-CG2 3.42Å; A219-V222 VanDerWaalsContact CB-CG2 3.42Å; A219-V222 VanDerWaalsContact O-CG2 3.27Å; A219-V222 WeakPolarHBondContact O-CG2 3.4Å; A219-G278 PolarHBondContact N-O 2.95Å; A219-G278 CarbonylContact O-C 3.1Å; A219-G278 WeakPolarHBondContact O-CA 3.47Å; A219-R280 HydrophobicContact CB-CB 4.3Å; A219-R280 HydrophobicContact CB-CG 3.74Å; A219-R280 VanDerWaalsContact CB-NH1 3.34Å
220	E	87.6	Confident	92.7	Very high	193 Å²	193	48.8 Å²	48.8	90%	0.902	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	153.7	174.9	-63.1	-165.2	158.3	0	0	112.1	V222	E220-V222 PolarHBondContact O-N 3.15Å; E220-V222 VanDerWaalsContact O-N 3.17Å
221	G	87.4	Confident	92.7	Very high	57 Å²	57	48 Å²	48	59%	0.588	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	79.5	-16.5	175	0	0	0	0	0	116
222	V	90.2	Very high	92.7	Very high	57 Å²	57	46.8 Å²	46.8	35%	0.345	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	155.9	-174.6	-66	0	0	0	0	113.8	A219 E220 Y277 G278 R280	A219-V222 HydrophobicContact CB-CG2 3.42Å; A219-V222 VanDerWaalsContact CB-CG2 3.42Å; A219-V222 VanDerWaalsContact O-CG2 3.27Å; A219-V222 WeakPolarHBondContact O-CG2 3.4Å; E220-V222 PolarHBondContact O-N 3.15Å; E220-V222 VanDerWaalsContact O-N 3.17Å; V222-Y277 WeakPolarHBondContact O-CD2 3.21Å; V222-G278 PolarHBondContact O-N 2.87Å; V222-G278 VanDerWaalsContact O-N 3.13Å; V222-R280 HydrophobicContact CG2-CB 4.17Å
223	S	90.1	Very high	92.6	Very high	54 Å²	54	46.9 Å²	46.9	38%	0.378	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	137.1	178	54.4	0	0	0	0	111.6	Y276	S223-Y276 CarbonylContact C-O 3.49Å; S223-Y276 VanDerWaalsContact CA-O 3.31Å; S223-Y276 WeakPolarHBondContact CA-O 3.27Å
224	L	92.4	Very high	92.6	Very high	17 Å²	17	47.2 Å²	47.2	9%	0.089	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.5	178.4	-176.5	71.1	0	0	0	109.5	Y216 R226 T228 L229 H275 Y276 I279 I281	Y216-L224 HydrophobicContact CD1-CD2 3.97Å; Y216-L224 HydrophobicContact CE1-CD2 3.69Å; L224-R226 PolarHBondContact O-N 3.15Å; L224-T228 HydrophobicContact CD1-CG2 4.49Å; L224-L229 HydrophobicContact CD2-CB 3.99Å; L224-L229 HydrophobicContact CD2-CD1 3.66Å; L224-L229 HydrophobicContact CD2-CG 4.32Å; L224-H275 CarbonylContact O-C 3.58Å; L224-H275 VanDerWaalsContact O-CA 3.23Å; L224-H275 WeakPolarHBondContact O-CA 3.31Å; L224-H275 WeakPolarHBondContact O-CB 3.23Å; L224-Y276 PolarHBondContact N-O 3.4Å; L224-Y276 PolarHBondContact O-N 2.88Å; L224-I279 HydrophobicContact CB-CG2 4.28Å; L224-I281 HydrophobicContact CD1-CD1 4.42Å; L224-I281 HydrophobicContact CD1-CG1 4.09Å; L224-I281 HydrophobicContact CD2-CG1 4.31Å
225	P	92.7	Very high	92.4	Very high	33 Å²	33	45.6 Å²	45.6	21%	0.214	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	136.5	179.7	-19.6	30.6	0	0	0	111.8	S227 T228 L229	P225-S227 PolarHBondContact O-N 2.93Å; P225-T228 PolarHBondContact O-N 2.9Å; P225-L229 PolarHBondContact O-N 3.43Å
226	R	93.4	Very high	92.2	Very high	35 Å²	35	45 Å²	45	13%	0.132	25%	0.252	C	S	.	.	H	α-helix	trans	-55.1	-40.2	176	-72.5	-167	-173.4	155.6	-2.2	110.4	L224 Y230 T263 Y274 Y276 E947 D948	L224-R226 PolarHBondContact O-N 3.15Å; R226-Y230 WeakPolarHBondContact O-CB 3.46Å; R226-Y230 PolarHBondContact O-N 3.23Å; R226-T263 PolarHBondContact NH2-OG1 3.39Å; R226-Y274 VanDerWaalsContact CD-CB 3.49Å; R226-Y274 PolarHBondContact N-O 3.45Å; R226-Y274 VanDerWaalsContact NH1-CD1 3.35Å; R226-Y276 HydrophobicContact CB-CE2 4.18Å; R226-Y276 HydrophobicContact CG-CD1 4.33Å; R226-Y276 HydrophobicContact CG-CD2 4.08Å; R226-Y276 HydrophobicContact CG-CE1 4.08Å; R226-Y276 HydrophobicContact CG-CE2 3.83Å; R226-Y276 HydrophobicContact CG-CG 4.33Å; R226-E947 PolarHBondContact NH1-O 3.48Å; R226-E947 VanDerWaalsContact NH1-O 3.12Å; R226-E947 PolarHBondContact NH2-O 3.06Å; R226-E947 VanDerWaalsContact NH2-O 3.09Å; R226-D948 IonicContact NH2-OD2 3.57Å
227	S	88.5	Confident	92.1	Very high	57 Å²	57	45 Å²	45	40%	0.399	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-39.8	-179.8	56.7	0	0	0	0	114.1	P225 Y230 F231	P225-S227 PolarHBondContact O-N 2.93Å; S227-Y230 PolarHBondContact O-N 3.49Å; S227-F231 VanDerWaalsContact O-CB 3.31Å; S227-F231 WeakPolarHBondContact O-CB 3.36Å; S227-F231 PolarHBondContact O-N 3.28Å
228	T	92	Very high	91.8	Very high	36 Å²	36	49.2 Å²	49.2	22%	0.221	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-44.9	179.8	-59.2	0	0	0	0	110.9	L224 P225 F231 H232	L224-T228 HydrophobicContact CD1-CG2 4.49Å; P225-T228 PolarHBondContact O-N 2.9Å; T228-F231 PolarHBondContact O-N 2.55Å; T228-H232 VanDerWaalsContact O-CG 3.31Å; T228-H232 PolarHBondContact O-N 3.07Å; T228-H232 VanDerWaalsContact O-N 3.12Å; T228-H232 PolarHBondContact O-ND1 3.02Å
229	L	94.2	Very high	91.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.7	-38.6	178.8	-169.7	152.3	0	0	0	111.4	L212 Y216 L224 P225 H232 Y233 F250 I254 Y276 I279	L212-L229 HydrophobicContact CD2-CD2 4.47Å; Y216-L229 HydrophobicContact CD1-CD1 3.83Å; Y216-L229 HydrophobicContact CE1-CB 4.49Å; Y216-L229 HydrophobicContact CE1-CD1 3.62Å; Y216-L229 HydrophobicContact CE1-CG 3.86Å; Y216-L229 HydrophobicContact CE2-CD1 4.36Å; Y216-L229 HydrophobicContact CE2-CG 4.26Å; Y216-L229 HydrophobicContact CG-CD1 4.3Å; L224-L229 HydrophobicContact CD2-CB 3.99Å; L224-L229 HydrophobicContact CD2-CD1 3.66Å; L224-L229 HydrophobicContact CD2-CG 4.32Å; P225-L229 PolarHBondContact O-N 3.43Å; L229-H232 PolarHBondContact O-N 3.35Å; L229-Y233 PolarHBondContact O-N 3.02Å; L229-Y233 VanDerWaalsContact O-N 3.13Å; L229-F250 HydrophobicContact CD2-CE1 3.35Å; L229-F250 HydrophobicContact CD2-CZ 3.36Å; L229-I254 HydrophobicContact CD1-CD1 3.51Å; L229-I254 HydrophobicContact CD2-CD1 3.75Å; L229-I254 HydrophobicContact CG-CD1 4.32Å; L229-Y276 HydrophobicContact CD1-CD2 4.4Å; L229-Y276 HydrophobicContact CD2-CE2 4.49Å; L229-I279 HydrophobicContact CD1-CD1 4.26Å
230	Y	95.3	Very high	91.4	Very high	50 Å²	50	55.2 Å²	55.2	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-68.5	-36	174.8	-172.3	-106.8	0	0	0	113	R226 S227 Y233 L234 P247 F250	R226-Y230 WeakPolarHBondContact O-CB 3.46Å; R226-Y230 PolarHBondContact O-N 3.23Å; S227-Y230 PolarHBondContact O-N 3.49Å; Y230-Y233 AromaticContact CD2-CD1 3.9Å; Y230-Y233 HydrophobicContact CD2-CD1 3.9Å; Y230-Y233 AromaticContact CE2-CD1 3.66Å; Y230-Y233 HydrophobicContact CE2-CD1 3.66Å; Y230-Y233 HydrophobicContact CE2-CE1 4.12Å; Y230-Y233 WeakPolarHBondContact O-CB 3.29Å; Y230-Y233 PolarHBondContact O-N 2.96Å; Y230-Y233 VanDerWaalsContact O-N 3.15Å; Y230-L234 HydrophobicContact CD1-CD1 4.14Å; Y230-L234 HydrophobicContact CD1-CG 4.27Å; Y230-L234 HydrophobicContact CE1-CD1 3.68Å; Y230-L234 HydrophobicContact CE1-CD2 4.01Å; Y230-L234 HydrophobicContact CE1-CG 3.77Å; Y230-L234 PolarHBondContact O-N 2.82Å; Y230-P247 HydrophobicContact CD1-CG 4.4Å; Y230-P247 HydrophobicContact CD2-CB 4.35Å; Y230-P247 HydrophobicContact CE1-CG 3.81Å; Y230-P247 HydrophobicContact CE2-CB 4.12Å; Y230-P247 HydrophobicContact CE2-CG 3.98Å; Y230-P247 WeakPolarHBondContact OH-CD 3.47Å; Y230-F250 AromaticContact CD2-CD1 3.69Å; Y230-F250 HydrophobicContact CD2-CD1 3.69Å; Y230-F250 HydrophobicContact CD2-CE1 4.06Å; Y230-F250 HydrophobicContact CD2-CG 4.24Å; Y230-F250 HydrophobicContact CE2-CB 4.5Å; Y230-F250 HydrophobicContact CE2-CD1 4.34Å; Y230-F250 HydrophobicContact CE2-CG 4.48Å
231	F	92.9	Very high	91.3	Very high	87 Å²	87	55.7 Å²	55.7	38%	0.382	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-46.3	173.3	173.1	-101.4	0	0	0	111.9	S227 T228 Y233 L234 Q235 F290	S227-F231 VanDerWaalsContact O-CB 3.31Å; S227-F231 WeakPolarHBondContact O-CB 3.36Å; S227-F231 PolarHBondContact O-N 3.28Å; T228-F231 PolarHBondContact O-N 2.55Å; F231-Y233 PolarHBondContact O-N 2.92Å; F231-L234 PolarHBondContact O-N 3.5Å; F231-Q235 PolarHBondContact O-N 3.31Å; F231-Q235 VanDerWaalsContact O-N 3.09Å; F231-F290 HydrophobicContact CE1-CD1 4.35Å
232	H	94.2	Very high	91.3	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-31.5	174.4	-59.3	157.5	0	0	0	112.7	W211 Y216 T228 L229 Q235 H236 L287 F290	W211-H232 HydrophobicContact CH2-CB 4.02Å; W211-H232 HydrophobicContact CZ2-CB 3.86Å; W211-H232 VanDerWaalsContact CZ2-O 3.28Å; W211-H232 WeakPolarHBondContact CZ2-O 3.46Å; Y216-H232 WeakPolarHBondContact OH-CB 3.33Å; Y216-H232 PolarHBondContact OH-ND1 3.37Å; T228-H232 VanDerWaalsContact O-CG 3.31Å; T228-H232 PolarHBondContact O-N 3.07Å; T228-H232 VanDerWaalsContact O-N 3.12Å; T228-H232 PolarHBondContact O-ND1 3.02Å; L229-H232 PolarHBondContact O-N 3.35Å; H232-Q235 PolarHBondContact O-N 3.07Å; H232-H236 PolarHBondContact O-N 3.18Å; H232-L287 HydrophobicContact CB-CD1 3.96Å; H232-L287 HydrophobicContact CB-CD2 4.29Å; H232-F290 WeakPolarHBondContact NE2-CB 3.47Å
233	Y	95.6	Very high	91	Very high	2 Å²	2	61 Å²	61	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-69.8	-42	175.6	171.4	-113.3	0	0	0	112.4	T208 W211 L229 Y230 F231 Q235 H236 C237 M245 F250	T208-Y233 HydrophobicContact CG2-CD2 3.97Å; T208-Y233 HydrophobicContact CG2-CE2 3.46Å; T208-Y233 VanDerWaalsContact CG2-CE2 3.46Å; W211-Y233 HydrophobicContact CZ3-CD2 4.13Å; L229-Y233 PolarHBondContact O-N 3.02Å; L229-Y233 VanDerWaalsContact O-N 3.13Å; Y230-Y233 AromaticContact CD2-CD1 3.9Å; Y230-Y233 HydrophobicContact CD2-CD1 3.9Å; Y230-Y233 AromaticContact CE2-CD1 3.66Å; Y230-Y233 HydrophobicContact CE2-CD1 3.66Å; Y230-Y233 HydrophobicContact CE2-CE1 4.12Å; Y230-Y233 WeakPolarHBondContact O-CB 3.29Å; Y230-Y233 PolarHBondContact O-N 2.96Å; Y230-Y233 VanDerWaalsContact O-N 3.15Å; F231-Y233 PolarHBondContact O-N 2.92Å; Y233-Q235 VanDerWaalsContact C-N 3.3Å; Y233-Q235 PolarHBondContact O-N 3.15Å; Y233-H236 WeakPolarHBondContact O-CB 3.48Å; Y233-H236 PolarHBondContact O-N 3.25Å; Y233-C237 WeakPolarHBondContact CE2-SG 3.33Å; Y233-C237 PolarHBondContact O-N 2.97Å; Y233-C237 PolarHBondContact OH-SG 3.35Å; Y233-C237 VanDerWaalsContact OH-SG 3.37Å; Y233-M245 HydrophobicContact CE1-CB 4.19Å; Y233-M245 WeakPolarHBondContact CE1-O 3.48Å; Y233-M245 WeakPolarHBondContact OH-CB 3.24Å; Y233-M245 WeakPolarHBondContact OH-CG 3.5Å; Y233-M245 PolarHBondContact OH-N 3.2Å; Y233-F250 HydrophobicContact CD1-CD1 4.4Å; Y233-F250 AromaticContact CD1-CD2 3.57Å; Y233-F250 HydrophobicContact CD1-CD2 3.57Å; Y233-F250 HydrophobicContact CD1-CE1 4.47Å; Y233-F250 AromaticContact CD1-CE2 3.68Å; Y233-F250 HydrophobicContact CD1-CE2 3.68Å; Y233-F250 AromaticContact CD1-CG 3.95Å; Y233-F250 HydrophobicContact CD1-CG 3.95Å; Y233-F250 HydrophobicContact CD1-CZ 4.13Å; Y233-F250 AromaticContact CD2-CD2 3.93Å; Y233-F250 HydrophobicContact CD2-CD2 3.93Å; Y233-F250 AromaticContact CD2-CE2 3.47Å; Y233-F250 HydrophobicContact CD2-CE2 3.47Å; Y233-F250 VanDerWaalsContact CD2-CE2 3.47Å; Y233-F250 HydrophobicContact CD2-CZ 4.21Å; Y233-F250 HydrophobicContact CE1-CB 4.42Å; Y233-F250 AromaticContact CE1-CD2 3.69Å; Y233-F250 HydrophobicContact CE1-CD2 3.69Å; Y233-F250 HydrophobicContact CE1-CE2 4.18Å; Y233-F250 HydrophobicContact CE1-CG 4.14Å; Y233-F250 HydrophobicContact CE2-CD2 4.07Å; Y233-F250 HydrophobicContact CE2-CE2 4.02Å; Y233-F250 AromaticContact CG-CD2 3.69Å; Y233-F250 HydrophobicContact CG-CD2 3.69Å; Y233-F250 HydrophobicContact CG-CE1 4.4Å; Y233-F250 AromaticContact CG-CE2 3.29Å; Y233-F250 HydrophobicContact CG-CE2 3.29Å; Y233-F250 HydrophobicContact CG-CG 4.4Å; Y233-F250 AromaticContact CG-CZ 3.69Å; Y233-F250 HydrophobicContact CG-CZ 3.69Å; Y233-F250 AromaticContact CZ-CD2 3.95Å
234	L	92.8	Very high	90.9	Very high	69 Å²	69	61.5 Å²	61.5	36%	0.361	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-41.6	172	-71.5	177.4	0	0	0	112	Y230 F231 C237 N238 P244	Y230-L234 HydrophobicContact CD1-CD1 4.14Å; Y230-L234 HydrophobicContact CD1-CG 4.27Å; Y230-L234 HydrophobicContact CE1-CD1 3.68Å; Y230-L234 HydrophobicContact CE1-CD2 4.01Å; Y230-L234 HydrophobicContact CE1-CG 3.77Å; Y230-L234 PolarHBondContact O-N 2.82Å; F231-L234 PolarHBondContact O-N 3.5Å; L234-C237 PolarHBondContact O-N 3.31Å; L234-N238 PolarHBondContact O-N 3.14Å; L234-P244 HydrophobicContact CD2-CB 3.74Å; L234-P244 HydrophobicContact CD2-CG 4.38Å
235	Q	91	Very high	90.6	Very high	47 Å²	47	63 Å²	63	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-61.3	-47	174.5	179.8	178.4	-12	0	0	111.5	F231 H232 Y233 C237 N238 E239	F231-Q235 PolarHBondContact O-N 3.31Å; F231-Q235 VanDerWaalsContact O-N 3.09Å; H232-Q235 PolarHBondContact O-N 3.07Å; Y233-Q235 VanDerWaalsContact C-N 3.3Å; Y233-Q235 PolarHBondContact O-N 3.15Å; Q235-C237 VanDerWaalsContact C-N 3.32Å; Q235-C237 PolarHBondContact O-N 3.12Å; Q235-N238 PolarHBondContact O-N 2.94Å; Q235-E239 HydrophobicContact CG-CG 4.37Å; Q235-E239 VanDerWaalsContact CG-OE1 3.31Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.44Å; Q235-E239 PolarHBondContact NE2-OE1 2.86Å; Q235-E239 WeakPolarHBondContact O-CG 3.43Å; Q235-E239 PolarHBondContact O-N 3.47Å
236	H	91.8	Very high	90.3	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-58.4	-41.8	176.3	174.9	58.6	0	0	0	112.6	W211 H232 Y233 E239 H240	W211-H236 AromaticContact CD1-CE1 3.75Å; W211-H236 AromaticContact CD1-CG 3.62Å; W211-H236 AromaticContact CD1-ND1 3.3Å; W211-H236 VanDerWaalsContact CD1-ND1 3.3Å; W211-H236 HydrophobicContact CD2-CB 4Å; W211-H236 AromaticContact CD2-CD2 3.77Å; W211-H236 AromaticContact CD2-CG 3.68Å; W211-H236 AromaticContact CE2-CG 3.81Å; W211-H236 HydrophobicContact CG-CB 4.33Å; W211-H236 AromaticContact CG-CD2 3.74Å; W211-H236 AromaticContact CG-CE1 3.64Å; W211-H236 AromaticContact CG-CG 3.62Å; W211-H236 AromaticContact CG-ND1 3.55Å; W211-H236 AromaticContact CG-NE2 3.75Å; W211-H236 HydrophobicContact CZ2-CB 3.95Å; W211-H236 AromaticContact NE1-CG 3.72Å; W211-H236 AromaticContact NE1-ND1 3.77Å; H232-H236 PolarHBondContact O-N 3.18Å; Y233-H236 WeakPolarHBondContact O-CB 3.48Å; Y233-H236 PolarHBondContact O-N 3.25Å; H236-E239 PolarHBondContact O-N 2.86Å; H236-H240 AromaticContact CE1-CD2 3.29Å; H236-H240 PolarHBondContact CE1-CD2 2.89Å; H236-H240 AromaticContact CE1-CG 3.88Å; H236-H240 AromaticContact CE1-NE2 3.53Å; H236-H240 AromaticContact ND1-CD2 3.19Å; H236-H240 PolarHBondContact ND1-CD2 2.91Å; H236-H240 AromaticContact ND1-NE2 3.56Å; H236-H240 WeakPolarHBondContact O-CB 3.46Å; H236-H240 PolarHBondContact O-CD2 3.03Å; H236-H240 PolarHBondContact O-N 2.98Å
237	C	92.7	Very high	90	Very high	4 Å²	4	64.2 Å²	64.2	3%	0.027	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-46.7	174.6	-76.5	0	0	0	0	112.2	Y233 L234 Q235 H240 K241 L242 P244	Y233-C237 WeakPolarHBondContact CE2-SG 3.33Å; Y233-C237 PolarHBondContact O-N 2.97Å; Y233-C237 PolarHBondContact OH-SG 3.35Å; Y233-C237 VanDerWaalsContact OH-SG 3.37Å; L234-C237 PolarHBondContact O-N 3.31Å; Q235-C237 VanDerWaalsContact C-N 3.32Å; Q235-C237 PolarHBondContact O-N 3.12Å; C237-H240 PolarHBondContact O-N 3.22Å; C237-K241 WeakPolarHBondContact O-CA 3.44Å; C237-K241 PolarHBondContact O-N 3Å; C237-L242 HydrophobicContact CB-CB 4.4Å; C237-L242 WeakPolarHBondContact CB-O 3.27Å; C237-L242 PolarHBondContact O-N 2.81Å; C237-P244 HydrophobicContact CB-CB 4.17Å
238	N	89.3	Confident	89.9	Confident	137 Å²	137	61.9 Å²	61.9	73%	0.733	31%	0.307	S	S	*	.	H	α-helix	trans	-63.1	-41.3	177.4	-177.1	72.9	0	0	0	112.6	L234 Q235	L234-N238 PolarHBondContact O-N 3.14Å; Q235-N238 PolarHBondContact O-N 2.94Å
239	E	89.8	Confident	89.7	Confident	118 Å²	118	61.3 Å²	61.3	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-66.5	-35.5	177.9	-74.2	172.4	-178.4	0	0	113	Q235 H236	Q235-E239 HydrophobicContact CG-CG 4.37Å; Q235-E239 VanDerWaalsContact CG-OE1 3.31Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.44Å; Q235-E239 PolarHBondContact NE2-OE1 2.86Å; Q235-E239 WeakPolarHBondContact O-CG 3.43Å; Q235-E239 PolarHBondContact O-N 3.47Å; H236-E239 PolarHBondContact O-N 2.86Å
240	H	85.5	Confident	89.7	Confident	103 Å²	103	61.4 Å²	61.4	48%	0.477	31%	0.305	S	S	.	.	H	α-helix	trans	-99.7	4.8	-178.5	-73.5	-95.2	0	0	0	114.7	H236 C237 L242	H236-H240 AromaticContact CE1-CD2 3.29Å; H236-H240 PolarHBondContact CE1-CD2 2.89Å; H236-H240 AromaticContact CE1-CG 3.88Å; H236-H240 AromaticContact CE1-NE2 3.53Å; H236-H240 AromaticContact ND1-CD2 3.19Å; H236-H240 PolarHBondContact ND1-CD2 2.91Å; H236-H240 AromaticContact ND1-NE2 3.56Å; H236-H240 WeakPolarHBondContact O-CB 3.46Å; H236-H240 PolarHBondContact O-CD2 3.03Å; H236-H240 PolarHBondContact O-N 2.98Å; C237-H240 PolarHBondContact O-N 3.22Å; H240-L242 HydrophobicContact CB-CD1 4.03Å; H240-L242 HydrophobicContact CB-CG 3.86Å; H240-L242 PolarHBondContact O-N 2.93Å
241	K	86.2	Confident	89.6	Confident	202 Å²	202	59.2 Å²	59.2	88%	0.878	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	37.3	-172.2	-56.7	-174.4	177.8	-173.6	0	113.4	C237	C237-K241 WeakPolarHBondContact O-CA 3.44Å; C237-K241 PolarHBondContact O-N 3Å
242	L	86.5	Confident	89.5	Confident	47 Å²	47	59.1 Å²	59.1	25%	0.246	30%	0.297	C	S	.	.			trans	-90.3	142.5	173.7	-58.4	174.3	0	0	0	109.5	V207 C237 H240	V207-L242 HydrophobicContact CB-CD1 4.45Å; C237-L242 HydrophobicContact CB-CB 4.4Å; C237-L242 WeakPolarHBondContact CB-O 3.27Å; C237-L242 PolarHBondContact O-N 2.81Å; H240-L242 HydrophobicContact CB-CD1 4.03Å; H240-L242 HydrophobicContact CB-CG 3.86Å; H240-L242 PolarHBondContact O-N 2.93Å
243	E	84.5	Confident	89.4	Confident	179 Å²	179	59.3 Å²	59.3	84%	0.836	30%	0.298	S	S	*	.			trans	-64.2	129.9	166.9	-168	-179.7	-179.8	0	0	109.8	M245	E243-M245 PolarHBondContact O-N 2.79Å
244	P	86.8	Confident	89.4	Confident	64 Å²	64	59.2 Å²	59.2	42%	0.416	30%	0.297	S	S	.	.			trans	-75.1	113.7	-179.6	29.2	-32.8	0	0	0	110.8	L234 C237 N246	L234-P244 HydrophobicContact CD2-CB 3.74Å; L234-P244 HydrophobicContact CD2-CG 4.38Å; C237-P244 HydrophobicContact CB-CB 4.17Å; P244-N246 PolarHBondContact O-N 2.94Å
245	M	87.7	Confident	89.4	Confident	49 Å²	49	61 Å²	61	24%	0.241	30%	0.299	C	S	.	.			trans	-52.9	133	165.1	-65.7	179.2	70.1	0	0	109.1	Y233 E243 F250 L253	Y233-M245 HydrophobicContact CE1-CB 4.19Å; Y233-M245 WeakPolarHBondContact CE1-O 3.48Å; Y233-M245 WeakPolarHBondContact OH-CB 3.24Å; Y233-M245 WeakPolarHBondContact OH-CG 3.5Å; Y233-M245 PolarHBondContact OH-N 3.2Å; E243-M245 PolarHBondContact O-N 2.79Å; M245-F250 HydrophobicContact CB-CB 4.39Å; M245-L253 HydrophobicContact SD-CD2 3.95Å
246	N	85.8	Confident	89.4	Confident	29 Å²	29	61.2 Å²	61.2	16%	0.155	31%	0.307	C	S	.	.			trans	-56	151.4	178.4	68.4	35.5	0	0	0	111.6	P244 A248 S249 F250 E942 L944	P244-N246 PolarHBondContact O-N 2.94Å; N246-A248 PolarHBondContact O-N 3.1Å; N246-S249 PolarHBondContact O-N 3.3Å; N246-S249 WeakPolarHBondContact OD1-CB 3.35Å; N246-S249 PolarHBondContact OD1-N 2.98Å; N246-S249 PolarHBondContact OD1-OG 2.97Å; N246-F250 VanDerWaalsContact O-CB 3.28Å; N246-F250 WeakPolarHBondContact O-CB 2.97Å; N246-F250 PolarHBondContact O-N 2.83Å; N246-E942 PolarHBondContact ND2-OE1 2.61Å; N246-E942 PolarHBondContact ND2-OE2 3.14Å; N246-L944 HydrophobicContact CB-CD1 3.39Å; N246-L944 HydrophobicContact CB-CD2 4.31Å; N246-L944 HydrophobicContact CB-CG 4.19Å; N246-L944 VanDerWaalsContact CG-CD2 3.49Å; N246-L944 WeakPolarHBondContact OD1-CD1 3.28Å; N246-L944 WeakPolarHBondContact OD1-CD2 3.38Å
247	P	87.1	Confident	89.4	Confident	64 Å²	64	62.9 Å²	62.9	42%	0.416	32%	0.317	S	S	.	.	H	α-helix	trans	-46.5	-28.7	-172.5	-28.4	24.8	0	0	0	118.5	Y230 G251 L944	Y230-P247 HydrophobicContact CD1-CG 4.4Å; Y230-P247 HydrophobicContact CD2-CB 4.35Å; Y230-P247 HydrophobicContact CE1-CG 3.81Å; Y230-P247 HydrophobicContact CE2-CB 4.12Å; Y230-P247 HydrophobicContact CE2-CG 3.98Å; Y230-P247 WeakPolarHBondContact OH-CD 3.47Å; P247-G251 PolarHBondContact O-N 3.39Å; P247-L944 HydrophobicContact CB-CD1 3.82Å; P247-L944 HydrophobicContact CG-CD1 3.82Å
248	A	86.8	Confident	89.5	Confident	8 Å²	8	63.4 Å²	63.4	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-111.5	-18.9	-175.5	0	0	0	0	0	116.2	N246 G251 K252 L944 D945	N246-A248 PolarHBondContact O-N 3.1Å; A248-G251 CarbonylContact O-C 3.35Å; A248-G251 WeakPolarHBondContact O-CA 3.48Å; A248-G251 PolarHBondContact O-N 3.09Å; A248-K252 VanDerWaalsContact O-CD 3.29Å; A248-K252 WeakPolarHBondContact O-CD 3.2Å; A248-K252 VanDerWaalsContact O-CG 3.24Å; A248-K252 WeakPolarHBondContact O-CG 3.25Å; A248-K252 PolarHBondContact O-N 3.29Å; A248-L944 HydrophobicContact CB-CB 3.87Å; A248-L944 HydrophobicContact CB-CD1 4.27Å; A248-L944 HydrophobicContact CB-CD2 3.53Å; A248-L944 HydrophobicContact CB-CG 4.08Å; A248-L944 VanDerWaalsContact N-CD1 3.34Å; A248-D945 HydrophobicContact CB-CB 3.4Å; A248-D945 VanDerWaalsContact CB-OD2 3.24Å; A248-D945 WeakPolarHBondContact CB-OD2 3.48Å
249	S	88.2	Confident	89.5	Confident	25 Å²	25	66.3 Å²	66.3	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-66.1	-35.5	154.9	-71	0	0	0	0	109.9	N246 K252 L253 E942	N246-S249 PolarHBondContact O-N 3.3Å; N246-S249 WeakPolarHBondContact OD1-CB 3.35Å; N246-S249 PolarHBondContact OD1-N 2.98Å; N246-S249 PolarHBondContact OD1-OG 2.97Å; S249-K252 PolarHBondContact O-N 3.17Å; S249-L253 PolarHBondContact O-N 3.47Å; S249-E942 PolarHBondContact OG-OE1 3.22Å
250	F	94	Very high	89.3	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.009	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-40.6	163.3	-178.9	-101.9	0	0	0	112.9	L212 L229 Y230 Y233 M245 N246 K252 L253 I254	L212-F250 HydrophobicContact CD1-CE2 4.49Å; L212-F250 HydrophobicContact CD2-CE2 4.44Å; L212-F250 HydrophobicContact CD2-CZ 4.28Å; L229-F250 HydrophobicContact CD2-CE1 3.35Å; L229-F250 HydrophobicContact CD2-CZ 3.36Å; Y230-F250 AromaticContact CD2-CD1 3.69Å; Y230-F250 HydrophobicContact CD2-CD1 3.69Å; Y230-F250 HydrophobicContact CD2-CE1 4.06Å; Y230-F250 HydrophobicContact CD2-CG 4.24Å; Y230-F250 HydrophobicContact CE2-CB 4.5Å; Y230-F250 HydrophobicContact CE2-CD1 4.34Å; Y230-F250 HydrophobicContact CE2-CG 4.48Å; Y233-F250 HydrophobicContact CD1-CD1 4.4Å; Y233-F250 AromaticContact CD1-CD2 3.57Å; Y233-F250 HydrophobicContact CD1-CD2 3.57Å; Y233-F250 HydrophobicContact CD1-CE1 4.47Å; Y233-F250 AromaticContact CD1-CE2 3.68Å; Y233-F250 HydrophobicContact CD1-CE2 3.68Å; Y233-F250 AromaticContact CD1-CG 3.95Å; Y233-F250 HydrophobicContact CD1-CG 3.95Å; Y233-F250 HydrophobicContact CD1-CZ 4.13Å; Y233-F250 AromaticContact CD2-CD2 3.93Å; Y233-F250 HydrophobicContact CD2-CD2 3.93Å; Y233-F250 AromaticContact CD2-CE2 3.47Å; Y233-F250 HydrophobicContact CD2-CE2 3.47Å; Y233-F250 VanDerWaalsContact CD2-CE2 3.47Å; Y233-F250 HydrophobicContact CD2-CZ 4.21Å; Y233-F250 HydrophobicContact CE1-CB 4.42Å; Y233-F250 AromaticContact CE1-CD2 3.69Å; Y233-F250 HydrophobicContact CE1-CD2 3.69Å; Y233-F250 HydrophobicContact CE1-CE2 4.18Å; Y233-F250 HydrophobicContact CE1-CG 4.14Å; Y233-F250 HydrophobicContact CE2-CD2 4.07Å; Y233-F250 HydrophobicContact CE2-CE2 4.02Å; Y233-F250 AromaticContact CG-CD2 3.69Å; Y233-F250 HydrophobicContact CG-CD2 3.69Å; Y233-F250 HydrophobicContact CG-CE1 4.4Å; Y233-F250 AromaticContact CG-CE2 3.29Å; Y233-F250 HydrophobicContact CG-CE2 3.29Å; Y233-F250 HydrophobicContact CG-CG 4.4Å; Y233-F250 AromaticContact CG-CZ 3.69Å; Y233-F250 HydrophobicContact CG-CZ 3.69Å; Y233-F250 AromaticContact CZ-CD2 3.95Å; M245-F250 HydrophobicContact CB-CB 4.39Å; N246-F250 VanDerWaalsContact O-CB 3.28Å; N246-F250 WeakPolarHBondContact O-CB 2.97Å; N246-F250 PolarHBondContact O-N 2.83Å; F250-K252 PolarHBondContact O-N 3.36Å; F250-L253 HydrophobicContact CD2-CD2 4.46Å; F250-L253 WeakPolarHBondContact O-CB 3.5Å; F250-L253 PolarHBondContact O-N 3.41Å; F250-I254 PolarHBondContact O-N 2.85Å
251	G	92.5	Very high	89.6	Confident	3 Å²	3	60 Å²	60	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-18.7	173	0	0	0	0	0	115.2	P247 A248 R255	P247-G251 PolarHBondContact O-N 3.39Å; A248-G251 CarbonylContact O-C 3.35Å; A248-G251 WeakPolarHBondContact O-CA 3.48Å; A248-G251 PolarHBondContact O-N 3.09Å; G251-R255 WeakPolarHBondContact O-CD 3.39Å; G251-R255 WeakPolarHBondContact O-CG 3.42Å; G251-R255 PolarHBondContact O-NE 3.25Å
252	K	89.7	Confident	89.8	Confident	86 Å²	86	58.7 Å²	58.7	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-84.5	-46	169.1	-69.7	151	-162.2	151	0	109.8	A248 S249 F250 I254 R255 S256 D945	A248-K252 VanDerWaalsContact O-CD 3.29Å; A248-K252 WeakPolarHBondContact O-CD 3.2Å; A248-K252 VanDerWaalsContact O-CG 3.24Å; A248-K252 WeakPolarHBondContact O-CG 3.25Å; A248-K252 PolarHBondContact O-N 3.29Å; S249-K252 PolarHBondContact O-N 3.17Å; F250-K252 PolarHBondContact O-N 3.36Å; K252-I254 PolarHBondContact O-N 2.85Å; K252-R255 PolarHBondContact O-N 3.4Å; K252-R255 VanDerWaalsContact O-N 3.17Å; K252-S256 PolarHBondContact O-N 3.4Å; K252-D945 WeakPolarHBondContact CE-OD2 3.43Å; K252-D945 IonicContact NZ-OD1 2.7Å; K252-D945 IonicContact NZ-OD2 3.68Å; K252-D945 PolarHBondContact NZ-OD2 3.22Å
253	L	93.9	Very high	90.1	Very high	5 Å²	5	58 Å²	58	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-55.4	-48.6	176.6	178.6	59.2	0	0	0	113.5	A204 T208 V209 L212 M245 S249 F250 R255 S256 V257	A204-L253 HydrophobicContact CB-CD1 3.53Å; A204-L253 HydrophobicContact CB-CD2 3.94Å; A204-L253 HydrophobicContact CB-CG 4.36Å; T208-L253 HydrophobicContact CG2-CD2 3.97Å; V209-L253 HydrophobicContact CG2-CD1 4.13Å; L212-L253 HydrophobicContact CD1-CD2 4.3Å; L212-L253 HydrophobicContact CD1-CG 4.21Å; M245-L253 HydrophobicContact SD-CD2 3.95Å; S249-L253 PolarHBondContact O-N 3.47Å; F250-L253 HydrophobicContact CD2-CD2 4.46Å; F250-L253 WeakPolarHBondContact O-CB 3.5Å; F250-L253 PolarHBondContact O-N 3.41Å; L253-R255 PolarHBondContact O-N 3.35Å; L253-S256 PolarHBondContact O-N 3.47Å; L253-S256 VanDerWaalsContact O-N 3.14Å; L253-S256 PolarHBondContact O-OG 3.17Å; L253-V257 HydrophobicContact CD1-CG2 4.2Å; L253-V257 WeakPolarHBondContact O-CG2 3.09Å; L253-V257 PolarHBondContact O-N 3.12Å
254	I	94.2	Very high	90.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-32.4	-179.7	-167.1	-176.9	0	0	0	112.3	L229 F250 K252 V257 F258 L261 Y276 I279	L229-I254 HydrophobicContact CD1-CD1 3.51Å; L229-I254 HydrophobicContact CD2-CD1 3.75Å; L229-I254 HydrophobicContact CG-CD1 4.32Å; F250-I254 PolarHBondContact O-N 2.85Å; K252-I254 PolarHBondContact O-N 2.85Å; I254-V257 PolarHBondContact O-N 2.7Å; I254-F258 HydrophobicContact CG1-CD2 3.97Å; I254-F258 PolarHBondContact O-N 2.97Å; I254-L261 HydrophobicContact CD1-CD2 3.83Å; I254-L261 HydrophobicContact CG1-CD2 3.94Å; I254-L261 HydrophobicContact CG2-CD2 4.46Å; I254-Y276 HydrophobicContact CD1-CD2 3.83Å; I254-Y276 HydrophobicContact CD1-CE2 3.76Å; I254-Y276 HydrophobicContact CD1-CG 4.34Å; I254-Y276 HydrophobicContact CG2-CE1 4.12Å; I254-Y276 HydrophobicContact CG2-CE2 4.37Å; I254-I279 HydrophobicContact CD1-CD1 4.2Å
255	R	92.4	Very high	90.6	Very high	106 Å²	106	55.5 Å²	55.5	40%	0.4	27%	0.271	S	S	.	.	H	α-helix	trans	-76.6	-24.3	179.3	-61.4	179.9	-146.1	-134.2	12.6	112.7	G251 K252 L253	G251-R255 WeakPolarHBondContact O-CD 3.39Å; G251-R255 WeakPolarHBondContact O-CG 3.42Å; G251-R255 PolarHBondContact O-NE 3.25Å; K252-R255 PolarHBondContact O-N 3.4Å; K252-R255 VanDerWaalsContact O-N 3.17Å; L253-R255 PolarHBondContact O-N 3.35Å
256	S	90.9	Very high	90.6	Very high	53 Å²	53	56.2 Å²	56.2	37%	0.371	28%	0.275	S	S	.	.	H	α-helix	trans	-80.4	-31.2	169.9	55.6	0	0	0	0	113	K252 L253	K252-S256 PolarHBondContact O-N 3.4Å; L253-S256 PolarHBondContact O-N 3.47Å; L253-S256 VanDerWaalsContact O-N 3.14Å; L253-S256 PolarHBondContact O-OG 3.17Å
257	V	93.6	Very high	90.6	Very high	37 Å²	37	57.9 Å²	57.9	22%	0.224	30%	0.299	C	S	.	.	H	α-helix	trans	-75.1	-45.8	175.3	178	0	0	0	0	111.5	V209 L212 V213 L253 I254	V209-V257 HydrophobicContact CG1-CG2 4.18Å; L212-V257 HydrophobicContact CB-CG1 4.35Å; L212-V257 HydrophobicContact CD1-CG2 4.13Å; V213-V257 HydrophobicContact CG2-CG1 3.74Å; L253-V257 HydrophobicContact CD1-CG2 4.2Å; L253-V257 WeakPolarHBondContact O-CG2 3.09Å; L253-V257 PolarHBondContact O-N 3.12Å; I254-V257 PolarHBondContact O-N 2.7Å
258	F	94	Very high	90.4	Very high	14 Å²	14	59.6 Å²	59.6	6%	0.061	31%	0.309	C	S	.	.	S	Bend	trans	-112.7	91	-177.8	-62.9	-78.3	0	0	0	111.6	L212 I254 L261 I279	L212-F258 HydrophobicContact CB-CE2 4.23Å; L212-F258 WeakPolarHBondContact O-CZ 3.13Å; I254-F258 HydrophobicContact CG1-CD2 3.97Å; I254-F258 PolarHBondContact O-N 2.97Å; F258-L261 HydrophobicContact CB-CD1 3.53Å; F258-L261 HydrophobicContact CB-CD2 4.45Å; F258-I279 HydrophobicContact CB-CD1 4.46Å; F258-I279 HydrophobicContact CD1-CD1 4.27Å; F258-I279 HydrophobicContact CD2-CD1 3.6Å; F258-I279 HydrophobicContact CE1-CD1 4.45Å; F258-I279 HydrophobicContact CE2-CD1 3.8Å; F258-I279 HydrophobicContact CG-CD1 3.86Å; F258-I279 HydrophobicContact CZ-CD1 4.24Å
259	Y	88.6	Confident	89.9	Confident	198 Å²	198	67.8 Å²	67.8	78%	0.776	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	137.5	176.8	-94.4	-101.9	0	0	0	112.7
260	G	86.6	Confident	89.3	Confident	63 Å²	63	69.6 Å²	69.6	65%	0.649	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	3.7	174.7	0	0	0	0	0	115.9
261	L	91	Very high	88.7	Confident	26 Å²	26	74.9 Å²	74.9	14%	0.136	39%	0.389	C	S	.	.			trans	-51.8	141.9	169.7	-113.7	63.5	0	0	0	111.8	I254 F258 Y276 I279	I254-L261 HydrophobicContact CD1-CD2 3.83Å; I254-L261 HydrophobicContact CG1-CD2 3.94Å; I254-L261 HydrophobicContact CG2-CD2 4.46Å; F258-L261 HydrophobicContact CB-CD1 3.53Å; F258-L261 HydrophobicContact CB-CD2 4.45Å; L261-Y276 HydrophobicContact CD2-CD1 3.88Å; L261-Y276 HydrophobicContact CD2-CG 4.06Å; L261-I279 HydrophobicContact CD1-CB 3.95Å; L261-I279 HydrophobicContact CD1-CD1 4.43Å; L261-I279 HydrophobicContact CD1-CG2 4.41Å
262	R	91.4	Very high	88.3	Confident	174 Å²	174	75.9 Å²	75.9	66%	0.657	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.3	176.1	-50.2	-173.7	-170.5	-168	2.4	110.7	Y277	R262-Y277 HydrophobicContact CB-CD1 4.4Å; R262-Y277 PolarHBondContact N-O 3.16Å; R262-Y277 PolarHBondContact O-N 2.97Å
263	T	91.5	Very high	88.2	Confident	33 Å²	33	77 Å²	77	20%	0.202	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	145.7	164.8	-55.6	0	0	0	0	110.4	R226 Y274 D948	R226-T263 PolarHBondContact NH2-OG1 3.39Å; T263-Y274 HydrophobicContact CG2-CD1 3.95Å; T263-D948 WeakPolarHBondContact CB-OD2 3.09Å; T263-D948 HydrophobicContact CG2-CB 3.8Å; T263-D948 VanDerWaalsContact CG2-OD2 3.32Å; T263-D948 WeakPolarHBondContact CG2-OD2 3.31Å; T263-D948 PolarHBondContact OG1-OD2 3.4Å
264	R	90.8	Very high	88.2	Confident	121 Å²	121	78.2 Å²	78.2	46%	0.457	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.3	155.2	-75	-169.6	167.1	-169.1	-5.3	111.7	L266 H275 Y277	R264-L266 HydrophobicContact CB-CD2 4.26Å; R264-L266 HydrophobicContact CB-CG 4.17Å; R264-H275 PolarHBondContact N-O 3.27Å; R264-H275 PolarHBondContact O-N 3.14Å; R264-Y277 HydrophobicContact CG-CG 4.33Å
265	R	91.6	Very high	88.2	Confident	70 Å²	70	79.5 Å²	79.5	26%	0.264	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.1	166.4	-170.2	-180	-167.4	-143.3	-3.5	107.7	S272 E949 V950 D951	R265-S272 PolarHBondContact NE-OG 2.91Å; R265-S272 PolarHBondContact NH2-OG 3.14Å; R265-E949 IonicContact CZ-OE1 3.72Å; R265-E949 IonicContact CZ-OE2 3.13Å; R265-E949 IonicContact NE-OE1 2.84Å; R265-E949 PolarHBondContact NE-OE1 3.38Å; R265-E949 IonicContact NE-OE2 3.73Å; R265-E949 PolarHBondContact NE-OE2 3.31Å; R265-E949 VanDerWaalsContact NH2-CD 3.26Å; R265-E949 IonicContact NH2-OE1 2.8Å; R265-E949 PolarHBondContact NH2-OE1 2.88Å; R265-E949 IonicContact NH2-OE2 4Å; R265-E949 PolarHBondContact NH2-OE2 3.49Å; R265-V950 PolarHBondContact NH1-O 3.02Å; R265-D951 IonicContact CZ-OD1 2.75Å; R265-D951 IonicContact CZ-OD2 3.95Å; R265-D951 IonicContact NH1-OD1 2.6Å; R265-D951 PolarHBondContact NH1-OD1 3.03Å; R265-D951 IonicContact NH1-OD2 2.84Å; R265-D951 IonicContact NH2-OD1 3.88Å; R265-D951 PolarHBondContact NH2-OD1 3.49Å; R265-D951 IonicContact NH2-OD2 2.73Å; R265-D951 PolarHBondContact NH2-OD2 3.11Å
266	L	87.1	Confident	88.3	Confident	64 Å²	64	75 Å²	75	34%	0.335	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.7	-178.1	-58.9	178.5	0	0	0	111	R264 S272 K273 H275	R264-L266 HydrophobicContact CB-CD2 4.26Å; R264-L266 HydrophobicContact CB-CG 4.17Å; L266-S272 WeakPolarHBondContact O-CA 3.38Å; L266-K273 PolarHBondContact N-O 3.08Å; L266-K273 PolarHBondContact O-N 2.91Å; L266-H275 HydrophobicContact CD1-CB 4.2Å
267	G	86.9	Confident	88.5	Confident	64 Å²	64	74.7 Å²	74.7	66%	0.66	39%	0.385	S	S	*	.	S	Bend	trans	146.7	-177	179	0	0	0	0	0	111.8
268	T	82	Confident	88.5	Confident	100 Å²	100	73.5 Å²	73.5	61%	0.613	38%	0.38	S	S	*	.	S	Bend	trans	-84.9	165.4	166.2	51.1	0	0	0	0	110.4	G270 N271 S272	T268-G270 PolarHBondContact O-N 3.34Å; T268-N271 CarbonylContact O-C 3.57Å; T268-N271 WeakPolarHBondContact O-CA 3.42Å; T268-N271 PolarHBondContact O-N 2.98Å; T268-S272 PolarHBondContact O-N 3.39Å; T268-S272 VanDerWaalsContact O-N 3.11Å
269	R	76.3	Confident	88.5	Confident	180 Å²	180	72.9 Å²	72.9	68%	0.679	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	130.8	176.3	-174.3	174.2	177.2	146.7	-2.9	110.4	N271 D952	R269-N271 PolarHBondContact O-N 2.88Å; R269-D952 IonicContact CZ-OD2 3.37Å; R269-D952 IonicContact NE-OD2 2.88Å; R269-D952 IonicContact NH1-OD2 3.19Å; R269-D952 PolarHBondContact NH1-OD2 3.45Å; R269-D952 IonicContact NH2-OD2 3.74Å
270	G	76.1	Confident	88.7	Confident	63 Å²	63	68.4 Å²	68.4	65%	0.649	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	3.2	-174.1	0	0	0	0	0	115.7	T268	T268-G270 PolarHBondContact O-N 3.34Å
271	N	81.2	Confident	89.1	Confident	112 Å²	112	65.9 Å²	65.9	60%	0.599	33%	0.331	S	S	*	.			trans	-134.4	17.5	175.3	-65.3	-94.9	0	0	0	111.6	T268 R269	T268-N271 CarbonylContact O-C 3.57Å; T268-N271 WeakPolarHBondContact O-CA 3.42Å; T268-N271 PolarHBondContact O-N 2.98Å; R269-N271 PolarHBondContact O-N 2.88Å
272	S	84.3	Confident	89.2	Confident	25 Å²	25	66.8 Å²	66.8	18%	0.175	33%	0.334	C	S	.	.			trans	-65.3	143.6	174.6	46.6	0	0	0	0	111	R265 L266 T268 E949	R265-S272 PolarHBondContact NE-OG 2.91Å; R265-S272 PolarHBondContact NH2-OG 3.14Å; L266-S272 WeakPolarHBondContact O-CA 3.38Å; T268-S272 PolarHBondContact O-N 3.39Å; T268-S272 VanDerWaalsContact O-N 3.11Å; S272-E949 WeakPolarHBondContact CB-OE1 3.28Å; S272-E949 PolarHBondContact OG-OE1 3.13Å
273	K	87.5	Confident	89.1	Confident	108 Å²	108	63.5 Å²	63.5	47%	0.47	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146	171.8	-63.8	-170.2	178.5	-173	0	111	L266 H275	L266-K273 PolarHBondContact N-O 3.08Å; L266-K273 PolarHBondContact O-N 2.91Å; K273-H275 PolarHBondContact O-CE1 3.18Å; K273-H275 PolarHBondContact O-ND1 3.29Å
274	Y	94.2	Very high	88.9	Confident	31 Å²	31	68.2 Å²	68.2	12%	0.122	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136.8	174.9	-61.5	-78.3	0	0	0	112.6	R226 T263 D946 E947 D948 E949	R226-Y274 VanDerWaalsContact CD-CB 3.49Å; R226-Y274 PolarHBondContact N-O 3.45Å; R226-Y274 VanDerWaalsContact NH1-CD1 3.35Å; T263-Y274 HydrophobicContact CG2-CD1 3.95Å; Y274-D946 VanDerWaalsContact CE2-OD1 3.23Å; Y274-D946 WeakPolarHBondContact CE2-OD1 3.24Å; Y274-D946 PolarHBondContact OH-OD1 3.24Å; Y274-D946 VanDerWaalsContact OH-OD1 3.06Å; Y274-E947 WeakPolarHBondContact CE1-O 3.32Å; Y274-E947 PolarHBondContact OH-O 3.38Å; Y274-D948 HydrophobicContact CD1-CB 4.49Å; Y274-D948 HydrophobicContact CE1-CB 3.88Å; Y274-E949 HydrophobicContact CE1-CG 3.76Å; Y274-E949 HydrophobicContact CE2-CG 3.81Å; Y274-E949 VanDerWaalsContact OH-CG 3.24Å; Y274-E949 WeakPolarHBondContact OH-CG 3.41Å; Y274-E949 PolarHBondContact OH-N 3.12Å; Y274-E949 VanDerWaalsContact OH-N 3.13Å
275	H	94.1	Very high	88.9	Confident	28 Å²	28	62.9 Å²	62.9	13%	0.13	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.1	174.7	-64.9	65.5	0	0	0	110.2	L224 R264 L266 K273	L224-H275 CarbonylContact O-C 3.58Å; L224-H275 VanDerWaalsContact O-CA 3.23Å; L224-H275 WeakPolarHBondContact O-CA 3.31Å; L224-H275 WeakPolarHBondContact O-CB 3.23Å; R264-H275 PolarHBondContact N-O 3.27Å; R264-H275 PolarHBondContact O-N 3.14Å; L266-H275 HydrophobicContact CD1-CB 4.2Å; K273-H275 PolarHBondContact O-CE1 3.18Å; K273-H275 PolarHBondContact O-ND1 3.29Å
276	Y	95.8	Very high	88.6	Confident	10 Å²	10	63.8 Å²	63.8	4%	0.039	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.2	160	-64.9	-58	0	0	0	108.6	S223 L224 R226 L229 I254 L261	S223-Y276 CarbonylContact C-O 3.49Å; S223-Y276 VanDerWaalsContact CA-O 3.31Å; S223-Y276 WeakPolarHBondContact CA-O 3.27Å; L224-Y276 PolarHBondContact N-O 3.4Å; L224-Y276 PolarHBondContact O-N 2.88Å; R226-Y276 HydrophobicContact CB-CE2 4.18Å; R226-Y276 HydrophobicContact CG-CD1 4.33Å; R226-Y276 HydrophobicContact CG-CD2 4.08Å; R226-Y276 HydrophobicContact CG-CE1 4.08Å; R226-Y276 HydrophobicContact CG-CE2 3.83Å; R226-Y276 HydrophobicContact CG-CG 4.33Å; L229-Y276 HydrophobicContact CD1-CD2 4.4Å; L229-Y276 HydrophobicContact CD2-CE2 4.49Å; I254-Y276 HydrophobicContact CD1-CD2 3.83Å; I254-Y276 HydrophobicContact CD1-CE2 3.76Å; I254-Y276 HydrophobicContact CD1-CG 4.34Å; I254-Y276 HydrophobicContact CG2-CE1 4.12Å; I254-Y276 HydrophobicContact CG2-CE2 4.37Å; L261-Y276 HydrophobicContact CD2-CD1 3.88Å; L261-Y276 HydrophobicContact CD2-CG 4.06Å
277	Y	94.6	Very high	88.5	Confident	48 Å²	48	61.3 Å²	61.3	19%	0.188	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133.5	177.9	179	-92.5	0	0	0	109.5	V222 R262 R264	V222-Y277 WeakPolarHBondContact O-CD2 3.21Å; R262-Y277 HydrophobicContact CB-CD1 4.4Å; R262-Y277 PolarHBondContact N-O 3.16Å; R262-Y277 PolarHBondContact O-N 2.97Å; R264-Y277 HydrophobicContact CG-CG 4.33Å
278	G	93.2	Very high	88	Confident	12 Å²	12	60.7 Å²	60.7	12%	0.124	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	104.1	8.8	-171.5	0	0	0	0	0	115	T218 A219 V222	T218-G278 CarbonylContact C-O 3.59Å; T218-G278 WeakPolarHBondContact CA-O 3.39Å; T218-G278 WeakPolarHBondContact CG2-O 3.29Å; A219-G278 PolarHBondContact N-O 2.95Å; A219-G278 CarbonylContact O-C 3.1Å; A219-G278 WeakPolarHBondContact O-CA 3.47Å; V222-G278 PolarHBondContact O-N 2.87Å; V222-G278 VanDerWaalsContact O-N 3.13Å
279	I	94.4	Very high	87.1	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.8	-176.4	-164.2	173.2	0	0	0	111.4	Y216 E217 L224 L229 I254 F258 L261	Y216-I279 HydrophobicContact CG-CD1 4.41Å; E217-I279 WeakPolarHBondContact O-CA 3.49Å; L224-I279 HydrophobicContact CB-CG2 4.28Å; L229-I279 HydrophobicContact CD1-CD1 4.26Å; I254-I279 HydrophobicContact CD1-CD1 4.2Å; F258-I279 HydrophobicContact CB-CD1 4.46Å; F258-I279 HydrophobicContact CD1-CD1 4.27Å; F258-I279 HydrophobicContact CD2-CD1 3.6Å; F258-I279 HydrophobicContact CE1-CD1 4.45Å; F258-I279 HydrophobicContact CE2-CD1 3.8Å; F258-I279 HydrophobicContact CG-CD1 3.86Å; F258-I279 HydrophobicContact CZ-CD1 4.24Å; L261-I279 HydrophobicContact CD1-CB 3.95Å; L261-I279 HydrophobicContact CD1-CD1 4.43Å; L261-I279 HydrophobicContact CD1-CG2 4.41Å
280	R	92.9	Very high	86.3	Confident	103 Å²	103	58.9 Å²	58.9	39%	0.389	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	165.6	169.3	64.2	-179.8	-176.2	-114.8	-6.7	111.7	Y216 E217 A219 V222	Y216-R280 WeakPolarHBondContact CA-O 3.49Å; E217-R280 VanDerWaalsContact CD-CZ 3.48Å; E217-R280 VanDerWaalsContact CD-NE 3.27Å; E217-R280 HydrophobicContact CG-CG 3.65Å; E217-R280 PolarHBondContact N-O 3.07Å; E217-R280 PolarHBondContact O-N 3.23Å; E217-R280 IonicContact OE1-CZ 2.68Å; E217-R280 IonicContact OE1-NE 3.14Å; E217-R280 PolarHBondContact OE1-NE 3.01Å; E217-R280 IonicContact OE1-NH2 2.71Å; E217-R280 PolarHBondContact OE1-NH2 3.03Å; E217-R280 IonicContact OE2-CZ 2.88Å; E217-R280 IonicContact OE2-NE 2.79Å; E217-R280 IonicContact OE2-NH2 3.18Å; E217-R280 PolarHBondContact OE2-NH2 3.27Å; A219-R280 HydrophobicContact CB-CB 4.3Å; A219-R280 HydrophobicContact CB-CG 3.74Å; A219-R280 VanDerWaalsContact CB-NH1 3.34Å; V222-R280 HydrophobicContact CG2-CB 4.17Å
281	I	94.5	Very high	85.3	Confident	11 Å²	11	59.3 Å²	59.3	6%	0.056	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.5	161.7	-49.5	-150.1	0	0	0	107.8	Y216 L224 L287 I291	Y216-I281 HydrophobicContact CD1-CG1 4.02Å; Y216-I281 HydrophobicContact CE1-CD1 3.86Å; Y216-I281 HydrophobicContact CE1-CG1 3.68Å; L224-I281 HydrophobicContact CD1-CD1 4.42Å; L224-I281 HydrophobicContact CD1-CG1 4.09Å; L224-I281 HydrophobicContact CD2-CG1 4.31Å; I281-L287 HydrophobicContact CD1-CB 4.19Å; I281-L287 HydrophobicContact CG2-CB 4.15Å; I281-I291 HydrophobicContact CB-CD1 4.26Å; I281-I291 HydrophobicContact CD1-CD1 3.93Å; I281-I291 HydrophobicContact CD1-CG1 4.1Å; I281-I291 HydrophobicContact CG1-CD1 4.14Å
282	K	94.1	Very high	83.3	Confident	45 Å²	45	62.4 Å²	62.4	20%	0.196	31%	0.312	C	S	.	.			trans	-67.5	140.5	177.8	-80	168.7	157.5	-177.1	0	110.9	V213 D214 N215 Y216 E217 N284 S285 N288	V213-K282 WeakPolarHBondContact O-CE 3.33Å; V213-K282 PolarHBondContact O-NZ 3.19Å; D214-K282 WeakPolarHBondContact O-CD 3.18Å; D214-K282 PolarHBondContact O-NZ 2.95Å; N215-K282 PolarHBondContact O-N 2.83Å; Y216-K282 WeakPolarHBondContact O-CE 3.31Å; E217-K282 HydrophobicContact CB-CD 4.46Å; E217-K282 HydrophobicContact CB-CG 3.78Å; E217-K282 HydrophobicContact CG-CG 3.64Å; K282-N284 WeakPolarHBondContact CB-OD1 3.49Å; K282-N284 PolarHBondContact O-N 2.9Å; K282-S285 WeakPolarHBondContact O-CB 3.31Å; K282-S285 PolarHBondContact O-N 3.4Å; K282-N288 PolarHBondContact O-ND2 3.37Å
283	P	87.2	Confident	80.9	Confident	104 Å²	104	65.7 Å²	65.7	68%	0.675	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.8	179.1	-27.8	34.8	0	0	0	115.8	E217	E217-P283 WeakPolarHBondContact OE1-CD 3.48Å
284	N	88.8	Confident	78.6	Confident	133 Å²	133	63.2 Å²	63.2	71%	0.711	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	3	177.5	69.6	-51.4	0	0	0	114	K282	K282-N284 WeakPolarHBondContact CB-OD1 3.49Å; K282-N284 PolarHBondContact O-N 2.9Å
285	S	89.8	Confident	75.6	Confident	8 Å²	8	64.5 Å²	64.5	6%	0.056	35%	0.35	C	S	.	.			trans	-74.1	140.3	175.5	171.9	0	0	0	0	110.9	N215 K282 L287 N288	N215-S285 PolarHBondContact OD1-OG 3.44Å; K282-S285 WeakPolarHBondContact O-CB 3.31Å; K282-S285 PolarHBondContact O-N 3.4Å; S285-L287 PolarHBondContact O-N 3.38Å; S285-L287 WeakPolarHBondContact OG-CB 3.37Å; S285-L287 WeakPolarHBondContact OG-CG 3.42Å; S285-L287 PolarHBondContact OG-N 3.12Å; S285-L287 VanDerWaalsContact OG-N 3.12Å; S285-N288 PolarHBondContact O-ND2 3.25Å
286	P	85.1	Confident	72.7	Confident	90 Å²	90	70 Å²	70	58%	0.584	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-61.9	-24.1	171.6	27	-35.3	0	0	0	112.7	N288 H289	P286-N288 PolarHBondContact O-N 3.31Å; P286-H289 PolarHBondContact O-N 2.58Å; P286-H289 PolarHBondContact O-ND1 2.88Å; P286-H289 VanDerWaalsContact O-ND1 3.14Å
287	L	85.7	Confident	69.7	Low	11 Å²	11	72 Å²	72	6%	0.058	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-65.1	-11.2	-175.4	-57.9	-180	0	0	0	114.3	W211 N215 Y216 H232 I281 S285 H289 F290	W211-L287 HydrophobicContact CZ2-CD1 3.99Å; N215-L287 HydrophobicContact CB-CD1 3.77Å; Y216-L287 HydrophobicContact CE2-CD1 4.18Å; H232-L287 HydrophobicContact CB-CD1 3.96Å; H232-L287 HydrophobicContact CB-CD2 4.29Å; I281-L287 HydrophobicContact CD1-CB 4.19Å; I281-L287 HydrophobicContact CG2-CB 4.15Å; S285-L287 PolarHBondContact O-N 3.38Å; S285-L287 WeakPolarHBondContact OG-CB 3.37Å; S285-L287 WeakPolarHBondContact OG-CG 3.42Å; S285-L287 PolarHBondContact OG-N 3.12Å; S285-L287 VanDerWaalsContact OG-N 3.12Å; L287-H289 PolarHBondContact O-N 2.86Å; L287-F290 HydrophobicContact CD2-CD2 4.43Å; L287-F290 PolarHBondContact O-N 3.26Å
288	N	77.5	Confident	66.9	Low	51 Å²	51	76.1 Å²	76.1	27%	0.273	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-60	-30.6	176.5	-71.9	-74	0	0	0	112.9	K282 S285 P286 F290 I291	K282-N288 PolarHBondContact O-ND2 3.37Å; S285-N288 PolarHBondContact O-ND2 3.25Å; P286-N288 PolarHBondContact O-N 3.31Å; N288-F290 PolarHBondContact O-N 3.17Å; N288-I291 HydrophobicContact CB-CD1 4.4Å; N288-I291 WeakPolarHBondContact O-CB 3.44Å; N288-I291 WeakPolarHBondContact O-CG1 3.32Å; N288-I291 PolarHBondContact O-N 3.3Å; N288-I291 VanDerWaalsContact O-N 3.13Å
289	H	62.8	Low	63.8	Low	153 Å²	153	85.1 Å²	85.1	71%	0.708	44%	0.444	S	S	*	.	H	α-helix	trans	-63.4	-28.1	178.1	-64.8	92.7	0	0	0	113.2	P286 L287 I291	P286-H289 PolarHBondContact O-N 2.58Å; P286-H289 PolarHBondContact O-ND1 2.88Å; P286-H289 VanDerWaalsContact O-ND1 3.14Å; L287-H289 PolarHBondContact O-N 2.86Å; H289-I291 VanDerWaalsContact C-N 3.28Å; H289-I291 PolarHBondContact O-N 3.25Å
290	F	59.4	Low	60.7	Low	89 Å²	89	90.5 Å²	90.5	39%	0.39	47%	0.469	S	S	.	.	H	α-helix	trans	-82.3	-3	178.6	-63.1	-81.6	0	0	0	113.5	F231 H232 L287 N288	F231-F290 HydrophobicContact CE1-CD1 4.35Å; H232-F290 WeakPolarHBondContact NE2-CB 3.47Å; L287-F290 HydrophobicContact CD2-CD2 4.43Å; L287-F290 PolarHBondContact O-N 3.26Å; N288-F290 PolarHBondContact O-N 3.17Å
291	I	55.1	Low	57.7	Low	72 Å²	72	91 Å²	91	37%	0.369	47%	0.471	S	S	.	.	H	α-helix	trans	-79.1	-35.6	177.1	-54.4	176.4	0	0	0	111.1	I281 N288 H289 A294	I281-I291 HydrophobicContact CB-CD1 4.26Å; I281-I291 HydrophobicContact CD1-CD1 3.93Å; I281-I291 HydrophobicContact CD1-CG1 4.1Å; I281-I291 HydrophobicContact CG1-CD1 4.14Å; N288-I291 HydrophobicContact CB-CD1 4.4Å; N288-I291 WeakPolarHBondContact O-CB 3.44Å; N288-I291 WeakPolarHBondContact O-CG1 3.32Å; N288-I291 PolarHBondContact O-N 3.3Å; N288-I291 VanDerWaalsContact O-N 3.13Å; H289-I291 VanDerWaalsContact C-N 3.28Å; H289-I291 PolarHBondContact O-N 3.25Å; I291-A294 WeakPolarHBondContact O-CB 3.43Å; I291-A294 PolarHBondContact O-N 3.49Å
292	E	38.7	Very low	54.6	Low	178 Å²	178	94.9 Å²	94.9	83%	0.832	50%	0.497	S	S	*	.	H	α-helix	trans	-77.2	-27.1	-171.5	-58.5	-164.2	144.2	0	0	112.9	A294	E292-A294 PolarHBondContact O-N 3.34Å
293	D	34.3	Very low	51.6	Low	93 Å²	93	96.2 Å²	96.2	50%	0.497	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-74.2	16.4	171.1	-90.4	-37.6	0	0	0	114.6	G295 F296 S297	D293-G295 PolarHBondContact O-N 3.07Å; D293-G295 VanDerWaalsContact O-N 3.08Å; D293-F296 PolarHBondContact O-N 3.32Å; D293-S297 PolarHBondContact O-N 3.08Å; D293-S297 VanDerWaalsContact O-N 3.14Å
294	A	37.6	Very low	49	Very low	56 Å²	56	99.7 Å²	99.7	46%	0.463	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-54.6	-24.3	168.3	0	0	0	0	0	113.1	I291 E292	I291-A294 WeakPolarHBondContact O-CB 3.43Å; I291-A294 PolarHBondContact O-N 3.49Å; E292-A294 PolarHBondContact O-N 3.34Å
295	G	31.7	Very low	46.4	Very low	58 Å²	58	99.9 Å²	99.9	60%	0.598	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-66.3	-40.4	170.6	0	0	0	0	0	114	D293 L298	D293-G295 PolarHBondContact O-N 3.07Å; D293-G295 VanDerWaalsContact O-N 3.08Å; G295-L298 PolarHBondContact O-N 3.49Å
296	F	34	Very low	43.8	Very low	145 Å²	145	106.1 Å²	106.1	64%	0.636	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-70.2	-36.9	175.3	-100.1	-92.1	0	0	0	112	D293 L298 R299	D293-F296 PolarHBondContact O-N 3.32Å; F296-L298 PolarHBondContact O-N 3.22Å; F296-L298 VanDerWaalsContact O-N 3.11Å; F296-R299 PolarHBondContact O-N 3.45Å
297	S	33.3	Very low	41.2	Very low	52 Å²	52	107.3 Å²	107.3	36%	0.364	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-64	-11.9	177.3	-68.6	0	0	0	0	114.5	D293 Y301	D293-S297 PolarHBondContact O-N 3.08Å; D293-S297 VanDerWaalsContact O-N 3.14Å; S297-Y301 VanDerWaalsContact O-CD2 3.22Å; S297-Y301 WeakPolarHBondContact O-CD2 3.39Å
298	L	35.1	Very low	38.8	Very low	133 Å²	133	110.9 Å²	110.9	70%	0.696	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-87.3	-3.9	179.6	-88.2	163.8	0	0	0	115.3	G295 F296	G295-L298 PolarHBondContact O-N 3.49Å; F296-L298 PolarHBondContact O-N 3.22Å; F296-L298 VanDerWaalsContact O-N 3.11Å
299	R	28.2	Very low	36.7	Very low	202 Å²	202	114 Å²	114	76%	0.762	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.8	-23.1	177.9	-73.2	-170.4	174.1	-169.4	-1.1	116.7	F296	F296-R299 PolarHBondContact O-N 3.45Å
300	H	29.8	Very low	35.3	Very low	114 Å²	114	110.2 Å²	110.2	53%	0.528	54%	0.543	S	S	.	.	S	Bend	trans	-99.9	-7	-171.8	-71.7	97	0	0	0	115.9	N303	H300-N303 PolarHBondContact O-N 2.92Å; H300-N303 VanDerWaalsContact O-N 3.14Å
301	Y	29.2	Very low	34.1	Very low	113 Å²	113	108.1 Å²	108.1	44%	0.443	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.8	-177.8	-94.6	-100.6	0	0	0	118.4	S297 N303	S297-Y301 VanDerWaalsContact O-CD2 3.22Å; S297-Y301 WeakPolarHBondContact O-CD2 3.39Å; Y301-N303 PolarHBondContact O-N 2.93Å
302	P	29.8	Very low	33.2	Very low	93 Å²	93	106.9 Å²	106.9	60%	0.604	54%	0.543	S	S	*	.	H	α-helix	trans	-68.5	-14.6	173.5	29	-35.9	0	0	0	112.7	R306	P302-R306 WeakPolarHBondContact O-CB 3.42Å
303	N	31.3	Very low	33.1	Very low	73 Å²	73	100.5 Å²	100.5	39%	0.39	52%	0.521	S	S	.	.	H	α-helix	trans	-93.8	-19.4	-172.3	-71.2	-10.7	0	0	0	114.7	H300 Y301 Q307	H300-N303 PolarHBondContact O-N 2.92Å; H300-N303 VanDerWaalsContact O-N 3.14Å; Y301-N303 PolarHBondContact O-N 2.93Å; N303-Q307 WeakPolarHBondContact O-CB 3.48Å; N303-Q307 WeakPolarHBondContact O-CG 3.34Å; N303-Q307 PolarHBondContact O-N 3.02Å
304	Y	31.9	Very low	33.1	Very low	176 Å²	176	102 Å²	102	69%	0.69	53%	0.525	S	S	*	.	H	α-helix	trans	-77	-51	-176.4	-139.2	-96.8	0	0	0	112.2	R306 Q307 T308	Y304-R306 PolarHBondContact O-N 2.93Å; Y304-Q307 PolarHBondContact O-N 2.76Å; Y304-T308 PolarHBondContact O-N 3.1Å; Y304-T308 PolarHBondContact O-OG1 3.32Å; Y304-T308 VanDerWaalsContact O-OG1 3.06Å
305	H	34.3	Very low	32.9	Very low	138 Å²	138	108.9 Å²	108.9	64%	0.639	54%	0.539	S	S	*	.	H	α-helix	trans	-61.6	-35.5	171.8	-174.4	70.3	0	0	0	111.4	T308 M309	H305-T308 PolarHBondContact O-N 3.33Å; H305-M309 WeakPolarHBondContact O-CB 3.42Å; H305-M309 WeakPolarHBondContact O-CG 3.46Å; H305-M309 PolarHBondContact O-N 3.49Å
306	R	34.4	Very low	33.1	Very low	138 Å²	138	113.3 Å²	113.3	52%	0.521	54%	0.541	S	S	.	.	H	α-helix	trans	-64.1	-40.7	171.1	-174.2	-169	166.2	128.7	9.2	111.9	P302 Y304 M309 E310	P302-R306 WeakPolarHBondContact O-CB 3.42Å; Y304-R306 PolarHBondContact O-N 2.93Å; R306-M309 CarbonylContact O-C 3.34Å; R306-M309 PolarHBondContact O-N 3.34Å; R306-E310 WeakPolarHBondContact CD-OE2 3.23Å; R306-E310 HydrophobicContact CG-CG 4.15Å; R306-E310 WeakPolarHBondContact CG-OE2 3.19Å; R306-E310 IonicContact CZ-OE1 3.87Å; R306-E310 VanDerWaalsContact CZ-OE1 3.23Å; R306-E310 IonicContact CZ-OE2 2.65Å; R306-E310 IonicContact NE-OE1 2.82Å; R306-E310 PolarHBondContact NE-OE1 3.35Å; R306-E310 IonicContact NE-OE2 2.7Å; R306-E310 PolarHBondContact NE-OE2 3.13Å; R306-E310 IonicContact NH2-OE1 3.41Å; R306-E310 PolarHBondContact NH2-OE1 3.42Å; R306-E310 IonicContact NH2-OE2 2.61Å; R306-E310 VanDerWaalsContact O-CB 3.25Å; R306-E310 WeakPolarHBondContact O-CB 3.46Å; R306-E310 WeakPolarHBondContact O-CG 3.29Å; R306-E310 PolarHBondContact O-N 2.84Å
307	Q	31.5	Very low	33.2	Very low	115 Å²	115	111.1 Å²	111.1	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-71.3	-31.9	176.9	-83.2	175.6	-31.6	0	0	112.6	N303 Y304 A311	N303-Q307 WeakPolarHBondContact O-CB 3.48Å; N303-Q307 WeakPolarHBondContact O-CG 3.34Å; N303-Q307 PolarHBondContact O-N 3.02Å; Y304-Q307 PolarHBondContact O-N 2.76Å; Q307-A311 WeakPolarHBondContact O-CB 3.5Å; Q307-A311 PolarHBondContact O-N 3.27Å
308	T	35.2	Very low	33.3	Very low	87 Å²	87	115.7 Å²	115.7	53%	0.534	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-39.6	169.7	-36.1	0	0	0	0	111	Y304 H305 A312	Y304-T308 PolarHBondContact O-N 3.1Å; Y304-T308 PolarHBondContact O-OG1 3.32Å; Y304-T308 VanDerWaalsContact O-OG1 3.06Å; H305-T308 PolarHBondContact O-N 3.33Å; T308-A312 WeakPolarHBondContact O-CB 3.41Å; T308-A312 PolarHBondContact O-N 3.02Å
309	M	33	Very low	33.4	Very low	115 Å²	115	113.1 Å²	113.1	57%	0.567	54%	0.54	S	S	*	.	H	α-helix	trans	-71.2	-37.3	175.4	-77.2	-73.7	161	0	0	113.3	H305 R306 A313	H305-M309 WeakPolarHBondContact O-CB 3.42Å; H305-M309 WeakPolarHBondContact O-CG 3.46Å; H305-M309 PolarHBondContact O-N 3.49Å; R306-M309 CarbonylContact O-C 3.34Å; R306-M309 PolarHBondContact O-N 3.34Å; M309-A313 WeakPolarHBondContact O-CB 3.45Å; M309-A313 PolarHBondContact O-N 2.8Å
310	E	33.9	Very low	33.8	Very low	75 Å²	75	107.9 Å²	107.9	35%	0.35	53%	0.527	S	S	.	.	H	α-helix	trans	-73.3	-38.9	175.3	-77.2	179.5	143.3	0	0	110.3	R306 A313 E314	R306-E310 WeakPolarHBondContact CD-OE2 3.23Å; R306-E310 HydrophobicContact CG-CG 4.15Å; R306-E310 WeakPolarHBondContact CG-OE2 3.19Å; R306-E310 IonicContact CZ-OE1 3.87Å; R306-E310 VanDerWaalsContact CZ-OE1 3.23Å; R306-E310 IonicContact CZ-OE2 2.65Å; R306-E310 IonicContact NE-OE1 2.82Å; R306-E310 PolarHBondContact NE-OE1 3.35Å; R306-E310 IonicContact NE-OE2 2.7Å; R306-E310 PolarHBondContact NE-OE2 3.13Å; R306-E310 IonicContact NH2-OE1 3.41Å; R306-E310 PolarHBondContact NH2-OE1 3.42Å; R306-E310 IonicContact NH2-OE2 2.61Å; R306-E310 VanDerWaalsContact O-CB 3.25Å; R306-E310 WeakPolarHBondContact O-CB 3.46Å; R306-E310 WeakPolarHBondContact O-CG 3.29Å; R306-E310 PolarHBondContact O-N 2.84Å; E310-A313 CarbonylContact O-C 3.6Å; E310-A313 PolarHBondContact O-N 3.47Å; E310-E314 WeakPolarHBondContact O-CA 3.34Å; E310-E314 WeakPolarHBondContact O-CB 3.37Å; E310-E314 WeakPolarHBondContact O-CG 3.4Å; E310-E314 PolarHBondContact O-N 3.02Å
311	A	34.1	Very low	34	Very low	45 Å²	45	105.2 Å²	105.2	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-38.4	170.8	0	0	0	0	0	112.3	Q307 E314 W315	Q307-A311 WeakPolarHBondContact O-CB 3.5Å; Q307-A311 PolarHBondContact O-N 3.27Å; A311-E314 PolarHBondContact O-N 2.82Å; A311-W315 WeakPolarHBondContact O-CB 3.2Å; A311-W315 PolarHBondContact O-N 2.96Å
312	A	35.3	Very low	34.2	Very low	46 Å²	46	102.1 Å²	102.1	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-69.9	-36.3	174.5	0	0	0	0	0	112.4	T308 K316	T308-A312 WeakPolarHBondContact O-CB 3.41Å; T308-A312 PolarHBondContact O-N 3.02Å; A312-K316 WeakPolarHBondContact O-CB 3.18Å; A312-K316 WeakPolarHBondContact O-CG 3.31Å; A312-K316 PolarHBondContact O-N 2.94Å
313	A	37.4	Very low	34.5	Very low	44 Å²	44	102.9 Å²	102.9	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-71.5	-36.3	172.3	0	0	0	0	0	111.7	M309 E310 K316 N317	M309-A313 WeakPolarHBondContact O-CB 3.45Å; M309-A313 PolarHBondContact O-N 2.8Å; E310-A313 CarbonylContact O-C 3.6Å; E310-A313 PolarHBondContact O-N 3.47Å; A313-K316 CarbonylContact O-C 3.53Å; A313-K316 PolarHBondContact O-N 3.48Å; A313-N317 WeakPolarHBondContact O-CB 3.47Å; A313-N317 PolarHBondContact O-N 3.41Å; A313-N317 PolarHBondContact O-ND2 3.15Å
314	E	33.6	Very low	34.7	Very low	124 Å²	124	104.8 Å²	104.8	58%	0.579	53%	0.525	S	S	*	.	H	α-helix	trans	-68.1	-39.3	173.4	-80.1	177.5	-178.4	0	0	110.8	E310 A311 N317 F318	E310-E314 WeakPolarHBondContact O-CA 3.34Å; E310-E314 WeakPolarHBondContact O-CB 3.37Å; E310-E314 WeakPolarHBondContact O-CG 3.4Å; E310-E314 PolarHBondContact O-N 3.02Å; A311-E314 PolarHBondContact O-N 2.82Å; E314-N317 CarbonylContact O-C 3.39Å; E314-N317 PolarHBondContact O-N 3.45Å; E314-F318 WeakPolarHBondContact O-CA 3.13Å; E314-F318 VanDerWaalsContact O-CB 3.27Å; E314-F318 WeakPolarHBondContact O-CB 3.44Å; E314-F318 PolarHBondContact O-N 3.11Å
315	W	33.4	Very low	34.7	Very low	200 Å²	200	105 Å²	105	76%	0.758	52%	0.524	S	S	*	.	H	α-helix	trans	-63.6	-47.1	170.2	-94.3	65.2	0	0	0	111.8	A311 N317 F318 T319	A311-W315 WeakPolarHBondContact O-CB 3.2Å; A311-W315 PolarHBondContact O-N 2.96Å; W315-N317 PolarHBondContact O-N 2.87Å; W315-F318 PolarHBondContact O-N 3.46Å; W315-F318 VanDerWaalsContact O-N 3.12Å; W315-T319 WeakPolarHBondContact O-CG2 3.34Å; W315-T319 PolarHBondContact O-N 2.89Å; W315-T319 PolarHBondContact O-OG1 2.57Å; W315-T319 VanDerWaalsContact O-OG1 3.13Å
316	K	36.7	Very low	34.5	Very low	151 Å²	151	105 Å²	105	66%	0.657	53%	0.528	S	S	*	.	H	α-helix	trans	-63.8	-27.5	174.4	-74.1	177.6	178.2	-179.5	0	112.6	A312 A313 T319 N320	A312-K316 WeakPolarHBondContact O-CB 3.18Å; A312-K316 WeakPolarHBondContact O-CG 3.31Å; A312-K316 PolarHBondContact O-N 2.94Å; A313-K316 CarbonylContact O-C 3.53Å; A313-K316 PolarHBondContact O-N 3.48Å; K316-T319 PolarHBondContact O-OG1 3.33Å; K316-N320 WeakPolarHBondContact O-CB 3.33Å; K316-N320 PolarHBondContact O-N 3Å; K316-N320 PolarHBondContact O-ND2 2.81Å
317	N	36.8	Very low	34.6	Very low	100 Å²	100	106.5 Å²	106.5	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-84.8	-26.2	172.2	-75.2	-39	0	0	0	112.9	A313 E314 W315 S321	A313-N317 WeakPolarHBondContact O-CB 3.47Å; A313-N317 PolarHBondContact O-N 3.41Å; A313-N317 PolarHBondContact O-ND2 3.15Å; E314-N317 CarbonylContact O-C 3.39Å; E314-N317 PolarHBondContact O-N 3.45Å; W315-N317 PolarHBondContact O-N 2.87Å; N317-S321 WeakPolarHBondContact O-CA 3.28Å; N317-S321 WeakPolarHBondContact O-CB 3.27Å; N317-S321 PolarHBondContact O-N 2.99Å; N317-S321 PolarHBondContact O-OG 2.87Å
318	F	34	Very low	34.6	Very low	148 Å²	148	105.3 Å²	105.3	65%	0.649	54%	0.543	S	S	*	.	H	α-helix	trans	-74.7	-41.5	175	-114.5	-91.9	0	0	0	110.6	E314 W315 S322	E314-F318 WeakPolarHBondContact O-CA 3.13Å; E314-F318 VanDerWaalsContact O-CB 3.27Å; E314-F318 WeakPolarHBondContact O-CB 3.44Å; E314-F318 PolarHBondContact O-N 3.11Å; W315-F318 PolarHBondContact O-N 3.46Å; W315-F318 VanDerWaalsContact O-N 3.12Å; F318-S322 WeakPolarHBondContact O-CB 3.34Å; F318-S322 PolarHBondContact O-N 3.44Å; F318-S322 PolarHBondContact O-OG 3.16Å
319	T	38.7	Very low	34.3	Very low	78 Å²	78	107.7 Å²	107.7	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-50.5	173.7	53.2	0	0	0	0	110.4	W315 K316 S321 S322 L323	W315-T319 WeakPolarHBondContact O-CG2 3.34Å; W315-T319 PolarHBondContact O-N 2.89Å; W315-T319 PolarHBondContact O-OG1 2.57Å; W315-T319 VanDerWaalsContact O-OG1 3.13Å; K316-T319 PolarHBondContact O-OG1 3.33Å; T319-S321 PolarHBondContact O-N 3.39Å; T319-S322 PolarHBondContact O-N 2.68Å; T319-L323 PolarHBondContact O-N 2.96Å
320	N	34.9	Very low	34.2	Very low	92 Å²	92	109.6 Å²	109.6	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-37	177.2	-78.5	-69.7	0	0	0	113.7	K316 N324	K316-N320 WeakPolarHBondContact O-CB 3.33Å; K316-N320 PolarHBondContact O-N 3Å; K316-N320 PolarHBondContact O-ND2 2.81Å; N320-N324 WeakPolarHBondContact O-CB 3.47Å; N320-N324 PolarHBondContact O-N 2.77Å; N320-N324 VanDerWaalsContact O-N 3.12Å; N320-N324 PolarHBondContact O-ND2 3.16Å
321	S	35	Very low	34.1	Very low	58 Å²	58	112.3 Å²	112.3	41%	0.406	59%	0.586	S	S	.	*	H	α-helix	trans	-72.2	-31.6	174.5	-64.7	0	0	0	0	112.3	N317 T319 R325	N317-S321 WeakPolarHBondContact O-CA 3.28Å; N317-S321 WeakPolarHBondContact O-CB 3.27Å; N317-S321 PolarHBondContact O-N 2.99Å; N317-S321 PolarHBondContact O-OG 2.87Å; T319-S321 PolarHBondContact O-N 3.39Å; S321-R325 WeakPolarHBondContact O-CB 3.46Å; S321-R325 PolarHBondContact O-N 2.99Å
322	S	33.3	Very low	33.9	Very low	48 Å²	48	118.4 Å²	118.4	34%	0.336	61%	0.612	S	S	.	*	H	α-helix	trans	-72.7	-43.2	175.7	-60.5	0	0	0	0	110.8	F318 T319 N324 R325 L326	F318-S322 WeakPolarHBondContact O-CB 3.34Å; F318-S322 PolarHBondContact O-N 3.44Å; F318-S322 PolarHBondContact O-OG 3.16Å; T319-S322 PolarHBondContact O-N 2.68Å; S322-N324 VanDerWaalsContact C-N 3.29Å; S322-N324 PolarHBondContact O-N 3.27Å; S322-R325 PolarHBondContact O-N 3.15Å; S322-L326 WeakPolarHBondContact O-CB 3.12Å; S322-L326 WeakPolarHBondContact O-CD1 3.38Å; S322-L326 PolarHBondContact O-N 3Å
323	L	36.1	Very low	33.8	Very low	109 Å²	109	119.6 Å²	119.6	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-60.8	-38.8	175.5	-126.1	69.8	0	0	0	112.2	T319 K327	T319-L323 PolarHBondContact O-N 2.96Å; L323-K327 WeakPolarHBondContact O-CG 3.23Å; L323-K327 PolarHBondContact O-N 2.92Å
324	N	34.4	Very low	33.5	Very low	113 Å²	113	125.8 Å²	125.8	60%	0.604	66%	0.656	S	S	*	*	H	α-helix	trans	-76.9	-30.2	175.8	-72.5	-46	0	0	0	113.2	N320 S322	N320-N324 WeakPolarHBondContact O-CB 3.47Å; N320-N324 PolarHBondContact O-N 2.77Å; N320-N324 VanDerWaalsContact O-N 3.12Å; N320-N324 PolarHBondContact O-ND2 3.16Å; S322-N324 VanDerWaalsContact C-N 3.29Å; S322-N324 PolarHBondContact O-N 3.27Å
325	R	33.5	Very low	33.4	Very low	181 Å²	181	123.8 Å²	123.8	68%	0.683	67%	0.669	S	S	*	*	H	α-helix	trans	-79.2	-30.6	176.8	-160.5	176.2	-57.9	-125.6	3.6	112.8	S321 S322 S328 L329	S321-R325 WeakPolarHBondContact O-CB 3.46Å; S321-R325 PolarHBondContact O-N 2.99Å; S322-R325 PolarHBondContact O-N 3.15Å; R325-S328 PolarHBondContact O-N 3.11Å; R325-L329 WeakPolarHBondContact O-CD1 3.37Å
326	L	30.6	Very low	33.2	Very low	138 Å²	138	120.2 Å²	120.2	72%	0.723	67%	0.669	S	S	*	*	H	α-helix	trans	-73.8	-26.6	171.8	-89	84.4	0	0	0	113.1	S322 S328	S322-L326 WeakPolarHBondContact O-CB 3.12Å; S322-L326 WeakPolarHBondContact O-CD1 3.38Å; S322-L326 PolarHBondContact O-N 3Å; L326-S328 VanDerWaalsContact C-N 3.25Å; L326-S328 PolarHBondContact O-N 3.4Å
327	K	35.4	Very low	32.9	Very low	170 Å²	170	119.9 Å²	119.9	74%	0.739	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-3.9	174.3	-73.2	179.1	179.9	-179.3	0	114.3	L323	L323-K327 WeakPolarHBondContact O-CG 3.23Å; L323-K327 PolarHBondContact O-N 2.92Å
328	S	31.2	Very low	32.6	Very low	89 Å²	89	120.6 Å²	120.6	62%	0.622	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	2.7	-179.1	-167.5	0	0	0	0	114.7	R325 L326	R325-S328 PolarHBondContact O-N 3.11Å; L326-S328 VanDerWaalsContact C-N 3.25Å; L326-S328 PolarHBondContact O-N 3.4Å
329	L	29.7	Very low	32.5	Very low	138 Å²	138	117.6 Å²	117.6	72%	0.723	70%	0.698	S	S	*	*			trans	-122.8	64	-179.2	-75.2	94.3	0	0	0	112.6	R325	R325-L329 WeakPolarHBondContact O-CD1 3.37Å
330	N	30.4	Very low	32	Very low	155 Å²	155	117.2 Å²	117.2	83%	0.829	71%	0.709	S	S	*	*			trans	-144.1	47.2	166.7	-161	12.1	0	0	0	114
331	T	31.8	Very low	31.7	Very low	132 Å²	132	121.2 Å²	121.2	81%	0.81	73%	0.729	S	S	*	*			trans	-140.5	52.9	174.5	57.6	0	0	0	0	112.2
332	N	30.5	Very low	31.4	Very low	173 Å²	173	121.6 Å²	121.6	93%	0.925	74%	0.742	S	S	*	*			trans	-101.1	101	175.9	-88.8	-10.3	0	0	0	111.7
333	G	32.8	Very low	31.2	Very low	71 Å²	71	126.3 Å²	126.3	73%	0.732	77%	0.768	S	S	*	*			trans	-95.2	128.6	170.8	0	0	0	0	0	112.8
334	N	30.6	Very low	30.9	Very low	173 Å²	173	124.4 Å²	124.4	93%	0.925	78%	0.775	S	S	*	*			trans	41.8	100.2	155.3	-61.9	-19	0	0	0	119.1
335	G	31.3	Very low	30.6	Very low	82 Å²	82	126.1 Å²	126.1	85%	0.845	78%	0.784	S	S	*	*			trans	-147.6	87.6	168.9	0	0	0	0	0	112.6
336	V	30.1	Very low	30.5	Very low	126 Å²	126	124.1 Å²	124.1	76%	0.764	79%	0.792	S	S	*	*			trans	-69.1	154.2	-166.6	-131.8	0	0	0	0	115.5
337	N	30.9	Very low	30.4	Very low	144 Å²	144	122.5 Å²	122.5	77%	0.77	79%	0.792	S	S	*	*			trans	81.9	146.3	161	-50.4	-36.3	0	0	0	118.4
338	S	30.2	Very low	30.3	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	80%	0.799	S	S	*	*			cis	-174.7	133.2	-21.3	52.9	0	0	0	0	113.3
339	G	30.4	Very low	30.1	Very low	85 Å²	85	119.9 Å²	119.9	88%	0.876	80%	0.798	S	S	*	*			trans	101.7	147.3	145.9	0	0	0	0	0	120.4
340	G	29.4	Very low	30.2	Very low	70 Å²	70	120.9 Å²	120.9	72%	0.722	80%	0.803	S	S	*	*			trans	92.9	109.3	168.7	0	0	0	0	0	115.5
341	I	28	Very low	30.4	Very low	177 Å²	177	119.3 Å²	119.3	91%	0.908	80%	0.795	S	S	*	*			cis	126.3	130	10.2	-76.5	167.1	0	0	0	109
342	G	29.8	Very low	30.3	Very low	65 Å²	65	119.9 Å²	119.9	67%	0.67	79%	0.793	S	S	*	*			trans	104.6	105.2	171.9	0	0	0	0	0	114.1
343	V	28.9	Very low	30.5	Very low	148 Å²	148	118.5 Å²	118.5	90%	0.897	78%	0.784	S	S	*	*			cis	94.5	119	19.1	-174.3	0	0	0	0	115.6
344	G	30.1	Very low	30.3	Very low	68 Å²	68	119.8 Å²	119.8	70%	0.701	78%	0.778	S	S	*	*			trans	127.1	102.3	172.3	0	0	0	0	0	111.7
345	N	27.4	Very low	30.6	Very low	150 Å²	150	116 Å²	116	80%	0.802	77%	0.766	S	S	*	*			cis	81.8	114.6	45.6	-67.5	12.7	0	0	0	115.2
346	T	31.5	Very low	30.7	Very low	138 Å²	138	119.2 Å²	119.2	85%	0.847	76%	0.758	S	S	*	*			trans	148.2	158.3	140.2	43.8	0	0	0	0	110.8
347	S	28.9	Very low	30.9	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	75%	0.753	S	S	*	*				166.5	96.2	-61.2	56.8	0	0	0	0	110.7
348	V	32.1	Very low	31	Very low	148 Å²	148	120.1 Å²	120.1	90%	0.897	75%	0.752	S	S	*	*			trans	-156.3	149.2	167.8	-173.9	0	0	0	0	107
349	G	28.3	Very low	31	Very low	57 Å²	57	118.7 Å²	118.7	59%	0.588	74%	0.742	S	S	*	*			cis	143	144.8	-10.7	0	0	0	0	0	113.7
350	L	31.3	Very low	31	Very low	158 Å²	158	120.1 Å²	120.1	83%	0.827	73%	0.734	S	S	*	*			trans	74.2	139.1	177.6	-45.9	179.7	0	0	0	115.2
351	N	33.3	Very low	31.2	Very low	123 Å²	123	120.9 Å²	120.9	66%	0.658	73%	0.728	S	S	*	*			cis	-162.6	132.3	-6.1	-105.3	-17	0	0	0	112.6
352	N	31.3	Very low	31.5	Very low	143 Å²	143	120 Å²	120	77%	0.765	72%	0.72	S	S	*	*			trans	57.2	153.8	154.5	-68.4	-17.2	0	0	0	120.2
353	L	33.3	Very low	31.6	Very low	144 Å²	144	123.9 Å²	123.9	75%	0.754	72%	0.723	S	S	*	*			cis	-142	125.7	14.6	-163.9	68.7	0	0	0	112.8
354	T	30.3	Very low	31.8	Very low	98 Å²	98	121.9 Å²	121.9	60%	0.601	72%	0.716	S	S	*	*			trans	18.7	140.5	144.2	-3.9	0	0	0	0	120
355	S	36.3	Very low	31.9	Very low	95 Å²	95	123.8 Å²	123.8	66%	0.664	72%	0.719	S	S	*	*			cis	-162.2	137	32.7	62.2	0	0	0	0	117.7
356	H	34	Very low	32.2	Very low	149 Å²	149	122 Å²	122	69%	0.69	72%	0.718	S	S	*	*			trans	65.6	146.9	130.3	-63.5	-14.9	0	0	0	121.6
357	I	34.2	Very low	32.2	Very low	126 Å²	126	123 Å²	123	65%	0.646	72%	0.719	S	S	*	*			cis	-154.4	133.5	-5.8	-119.2	159.8	0	0	0	111.2
358	H	31.6	Very low	32.4	Very low	162 Å²	162	122.9 Å²	122.9	75%	0.75	72%	0.723	S	S	*	*			trans	28.3	151.5	140.7	-62	75	0	0	0	123.6
359	S	30.2	Very low	32.3	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	72%	0.72	S	S	*	*			cis	-177.8	159.3	-17.9	-97.8	0	0	0	0	112.6
360	T	31.5	Very low	32.7	Very low	115 Å²	115	124.5 Å²	124.5	71%	0.706	73%	0.732	S	S	*	*			trans	32.1	105	142.6	65.8	0	0	0	0	118.9
361	S	33.3	Very low	32.6	Very low	86 Å²	86	124.1 Å²	124.1	60%	0.601	73%	0.731	S	S	*	*				76.9	139.4	79.1	76.1	0	0	0	0	116.4
362	H	34.2	Very low	32.6	Very low	159 Å²	159	125.9 Å²	125.9	74%	0.736	74%	0.739	S	S	*	*				176.1	118.1	120.7	-87.8	-57.7	0	0	0	113.5
363	I	31.8	Very low	32.5	Very low	146 Å²	146	126.7 Å²	126.7	75%	0.749	74%	0.743	S	S	*	*			trans	33.2	112.4	131.1	-44.3	168.9	0	0	0	118.3
364	S	32.9	Very low	32.5	Very low	107 Å²	107	125.6 Å²	125.6	75%	0.748	75%	0.748	S	S	*	*				177.2	135.1	117.4	-78.3	0	0	0	0	114.7
365	S	31.3	Very low	32.5	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	76%	0.758	S	S	*	*			trans	-22.1	145.6	160.9	57.2	0	0	0	0	117.8
366	S	35.7	Very low	32.4	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	77%	0.768	S	S	*	*				175.1	167.2	70.3	44.8	0	0	0	0	113.2
367	N	30.3	Very low	32.3	Very low	160 Å²	160	125.7 Å²	125.7	86%	0.856	77%	0.769	S	S	*	*			trans	-57.4	145.3	-178.5	-45.2	-29.6	0	0	0	115
368	A	34.3	Very low	32.3	Very low	100 Å²	100	125.5 Å²	125.5	83%	0.826	78%	0.779	S	S	*	*				-173.8	145	113	0	0	0	0	0	113.3
369	S	30	Very low	32.2	Very low	118 Å²	118	125.2 Å²	125.2	83%	0.825	78%	0.783	S	S	*	*			trans	-71.4	148	176.1	-35.5	0	0	0	0	113.4
370	S	36.2	Very low	32.4	Very low	122 Å²	122	126.4 Å²	126.4	85%	0.853	79%	0.791	S	S	*	*				-178	157.2	124.2	37.2	0	0	0	0	113.3
371	N	28.4	Very low	32.4	Very low	150 Å²	150	129.4 Å²	129.4	80%	0.802	80%	0.797	S	S	*	*			trans	-70.5	162.9	174.9	-55.3	-48.2	0	0	0	111.9
372	I	34.6	Very low	32.3	Very low	160 Å²	160	132.1 Å²	132.1	82%	0.821	80%	0.804	S	S	*	*				-172.6	140.3	113.8	-96.1	154	0	0	0	111
373	N	28.8	Very low	32	Very low	159 Å²	159	129 Å²	129	85%	0.85	80%	0.801	S	S	*	*			trans	-77.9	146.2	173.4	-60.4	-45	0	0	0	111.2
374	S	32.4	Very low	32	Very low	122 Å²	122	126.3 Å²	126.3	85%	0.853	80%	0.795	S	S	*	*			trans	-156.4	128.1	153.5	-79.4	0	0	0	0	111.4
375	S	30.8	Very low	31.9	Very low	117 Å²	117	128.3 Å²	128.3	82%	0.818	79%	0.792	S	S	*	*			trans	-99.5	153.1	176	51.5	0	0	0	0	111.7
376	S	33.4	Very low	31.9	Very low	124 Å²	124	133.2 Å²	133.2	87%	0.867	80%	0.795	S	S	*	*			trans	-155.6	155.1	154.5	52.3	0	0	0	0	110.6
377	S	31.6	Very low	31.6	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	79%	0.791	S	S	*	*			trans	-139.2	150.3	-162	-45.1	0	0	0	0	112.5
378	S	35.2	Very low	31.6	Very low	121 Å²	121	130.4 Å²	130.4	85%	0.846	79%	0.793	S	S	*	*			trans	-155.7	115.2	164	-69.9	0	0	0	0	108.5
379	N	29.6	Very low	31.3	Very low	156 Å²	156	130.9 Å²	130.9	83%	0.834	79%	0.79	S	S	*	*				85.2	86.2	51.3	-79.7	-11.8	0	0	0	116.1
380	S	34.4	Very low	31.2	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	79%	0.791	S	S	*	*			trans	-177.1	125.1	138.3	38.2	0	0	0	0	108.1
381	Q	31	Very low	30.9	Very low	179 Å²	179	131.5 Å²	131.5	84%	0.836	78%	0.784	S	S	*	*				62.6	130.2	77.1	-67.2	-172.4	-10.3	0	0	113
382	L	31.2	Very low	30.9	Very low	142 Å²	142	131 Å²	131	74%	0.743	79%	0.786	S	S	*	*			cis	-155.1	165.6	16	-151.1	72.8	0	0	0	112.6
383	S	28.4	Very low	30.6	Very low	95 Å²	95	128.2 Å²	128.2	66%	0.664	78%	0.777	S	S	*	*			trans	9.1	149.2	151.9	58.8	0	0	0	0	122.5
384	S	30.7	Very low	30.5	Very low	89 Å²	89	126 Å²	126	62%	0.622	77%	0.769	S	S	*	*			cis	177	150.1	-4.6	49.9	0	0	0	0	112.9
385	H	31	Very low	30.4	Very low	149 Å²	149	128.4 Å²	128.4	69%	0.69	77%	0.772	S	S	*	*			trans	66.4	154.7	155.8	-59.7	-19.4	0	0	0	118.1
386	Y	31.8	Very low	30.2	Very low	211 Å²	211	133.5 Å²	133.5	83%	0.827	77%	0.773	S	S	*	*			cis	-128.3	-176.9	0	-93.2	-64.5	0	0	0	111.4
387	G	29.6	Very low	29.9	Very low	68 Å²	68	132.2 Å²	132.2	70%	0.701	76%	0.764	S	S	*	*			trans	-68.9	-176.1	-177.5	0	0	0	0	0	116.1
388	T	29.3	Very low	29.9	Very low	145 Å²	145	132.4 Å²	132.4	89%	0.89	77%	0.765	S	S	*	*				-151.7	162.1	51	-59.2	0	0	0	0	113
389	S	28.5	Very low	29.7	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	75%	0.751	S	S	*	*			trans	-68	153.8	-172.5	-46.4	0	0	0	0	116.6
390	T	28.9	Very low	30	Very low	138 Å²	138	129.1 Å²	129.1	85%	0.847	73%	0.733	S	S	*	*			trans	-93.5	130.4	160.2	-52.6	0	0	0	0	109.8
391	T	28.4	Very low	29.8	Very low	116 Å²	116	126.6 Å²	126.6	71%	0.712	72%	0.716	S	S	*	*			trans	-104.2	118.7	169.5	41.3	0	0	0	0	110.9
392	V	29	Very low	29.7	Very low	139 Å²	139	125 Å²	125	84%	0.842	71%	0.71	S	S	*	*			trans	-75.2	126.3	161.1	179.3	0	0	0	0	106.9
393	T	28.2	Very low	29.8	Very low	102 Å²	102	125.6 Å²	125.6	63%	0.626	71%	0.713	S	S	*	*			trans	-116.3	124.4	-172.7	-48.8	0	0	0	0	110.8	L395	T393-L395 PolarHBondContact O-N 3.17Å
394	T	27.8	Very low	30	Very low	112 Å²	112	126.6 Å²	126.6	69%	0.687	71%	0.711	S	S	*	*			trans	-60.4	113.2	172.6	-32.6	0	0	0	0	109.9	R396	T394-R396 PolarHBondContact O-N 3.06Å
395	L	29.4	Very low	30.2	Very low	173 Å²	173	128 Å²	128	91%	0.906	71%	0.712	S	S	*	*			trans	-85.9	105.4	-179.6	-79.1	175.6	0	0	0	111.6	T393	T393-L395 PolarHBondContact O-N 3.17Å
396	R	25.9	Very low	30.3	Very low	223 Å²	223	126 Å²	126	84%	0.842	71%	0.706	S	S	*	*			trans	-127.1	119.9	170.4	-176.6	-179.9	-175.4	179.5	3.1	109.6	T394	T394-R396 PolarHBondContact O-N 3.06Å
397	S	29	Very low	30.4	Very low	97 Å²	97	122 Å²	122	68%	0.678	70%	0.699	S	S	*	*			trans	57.5	119.2	158.6	-57.8	0	0	0	0	119.9
398	S	30.7	Very low	30.5	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	70%	0.701	S	S	*	*			trans	81.2	149.2	138.8	-53.1	0	0	0	0	120.4
399	D	32.1	Very low	30.7	Very low	104 Å²	104	127.5 Å²	127.5	56%	0.556	69%	0.692	S	S	*	*			trans	60.3	126.8	157.7	-71.6	39.1	0	0	0	122.1	H1197	D399-H1197 IonicContact OD2-CE1 3.92Å; D399-H1197 IonicContact OD2-ND1 3.97Å
400	K	34.7	Very low	30.8	Very low	104 Å²	104	125.2 Å²	125.2	45%	0.452	69%	0.686	S	S	.	*			cis	-169.1	-172.8	-44.9	-80.5	111.8	109.1	176	0	104.4	L1196 H1197	K400-L1196 WeakPolarHBondContact CE-O 3.36Å; K400-H1197 VanDerWaalsContact CB-CA 3.45Å; K400-H1197 HydrophobicContact CB-CB 3.24Å; K400-H1197 HydrophobicContact CG-CB 4.21Å; K400-H1197 PolarHBondContact O-CD2 2.75Å
401	S	29.8	Very low	30.9	Very low	57 Å²	57	125.1 Å²	125.1	40%	0.399	69%	0.691	S	S	.	*			trans	51	130.2	143.6	75.4	0	0	0	0	126.5	H1197	S401-H1197 VanDerWaalsContact CA-CB 3.48Å; S401-H1197 WeakPolarHBondContact OG-CB 3.46Å; S401-H1197 PolarHBondContact OG-N 2.6Å
402	M	30.6	Very low	31.1	Very low	146 Å²	146	123.4 Å²	123.4	72%	0.719	70%	0.696	S	S	*	*				98.9	137.3	122.9	-78.7	-58.9	163.7	0	0	122.7
403	L	33.3	Very low	31.1	Very low	154 Å²	154	124.7 Å²	124.7	81%	0.806	70%	0.699	S	S	*	*			trans	68.8	138.6	168.1	-62.5	165.9	0	0	0	117.5
404	N	32	Very low	31.3	Very low	116 Å²	116	126.9 Å²	126.9	62%	0.62	71%	0.711	S	S	*	*			cis	-166.2	157.3	-21	-163.1	12.8	0	0	0	110.9
405	N	33.5	Very low	31.4	Very low	119 Å²	119	126.3 Å²	126.3	64%	0.636	71%	0.712	S	S	*	*			trans	62.6	152.7	160.9	-72.5	-17	0	0	0	117.7
406	N	34.7	Very low	31.4	Very low	107 Å²	107	122.9 Å²	122.9	57%	0.572	70%	0.702	S	S	*	*			cis	-162	144.3	-8.8	-117	-24.9	0	0	0	110
407	N	34	Very low	31.7	Very low	125 Å²	125	120.3 Å²	120.3	67%	0.668	70%	0.7	S	S	*	*			trans	56.7	149.3	146.7	-58.7	-22.6	0	0	0	119.9
408	Y	30.8	Very low	31.7	Very low	191 Å²	191	120.6 Å²	120.6	75%	0.749	70%	0.702	S	S	*	*			cis	-157	169	-2.6	-135.2	-140.8	0	0	0	109.8
409	I	33.2	Very low	31.8	Very low	138 Å²	138	121.3 Å²	121.3	71%	0.708	70%	0.701	S	S	*	*			trans	-1.5	135.8	154.4	-52.2	176.3	0	0	0	117.2
410	G	31.8	Very low	31.6	Very low	62 Å²	62	121.2 Å²	121.2	64%	0.639	71%	0.709	S	S	*	*			cis	136.8	150.9	1.5	0	0	0	0	0	113.8
411	S	31.2	Very low	31.6	Very low	136 Å²	136	124.3 Å²	124.3	95%	0.951	73%	0.725	S	S	*	*			trans	64.1	128.9	168.7	-58.9	0	0	0	0	119.7
412	G	32.6	Very low	31.6	Very low	79 Å²	79	128.1 Å²	128.1	81%	0.814	74%	0.741	S	S	*	*			trans	153.4	89.9	159.9	0	0	0	0	0	116.5
413	N	27.9	Very low	31.8	Very low	167 Å²	167	129 Å²	129	89%	0.893	75%	0.747	S	S	*	*			trans	-72	146	161.2	-77.8	-4.2	0	0	0	110.4
414	V	33.1	Very low	31.6	Very low	147 Å²	147	129.1 Å²	129.1	89%	0.891	75%	0.748	S	S	*	*				-173.1	154.9	125.5	142.5	0	0	0	0	109.7
415	S	28.6	Very low	31.4	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	75%	0.754	S	S	*	*			trans	-89	160.6	-167.5	53	0	0	0	0	116.2
416	S	30.9	Very low	31.3	Very low	101 Å²	101	130 Å²	130	71%	0.706	77%	0.766	S	S	*	*				117.4	139.5	127.8	79.9	0	0	0	0	120.4
417	H	32	Very low	30.9	Very low	170 Å²	170	130.6 Å²	130.6	79%	0.787	77%	0.774	S	S	*	*			trans	57.2	102	152.7	-65.1	-58.6	0	0	0	123.5
418	S	29.3	Very low	30.8	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	78%	0.784	S	S	*	*				105.1	148.5	106	78.8	0	0	0	0	122
419	T	31.7	Very low	30.6	Very low	121 Å²	121	129.4 Å²	129.4	74%	0.742	79%	0.786	S	S	*	*			trans	86.1	88	150.9	-43.7	0	0	0	0	120
420	S	28.7	Very low	30.4	Very low	103 Å²	103	128 Å²	128	72%	0.72	79%	0.789	S	S	*	*				39.2	129.2	126.3	-46.2	0	0	0	0	122.5
421	Q	34.7	Very low	30.2	Very low	169 Å²	169	130.8 Å²	130.8	79%	0.79	79%	0.787	S	S	*	*				-174.5	141.1	104.4	-99.6	175.7	30.5	0	0	114.6
422	N	29.1	Very low	30.2	Very low	136 Å²	136	130.5 Å²	130.5	73%	0.727	78%	0.78	S	S	*	*			trans	35	128.6	149.1	-51.7	-15.4	0	0	0	122.2
423	I	33.9	Very low	30	Very low	166 Å²	166	132 Å²	132	85%	0.851	78%	0.778	S	S	*	*				-171.1	155.9	105.1	-93.5	158.9	0	0	0	109.8
424	D	30.4	Very low	30.2	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	77%	0.769	S	S	*	*			trans	-84.8	176.9	-155.2	-57.5	-84.8	0	0	0	118
425	S	27.2	Very low	29.8	Very low	105 Å²	105	130.2 Å²	130.2	73%	0.734	77%	0.768	S	S	*	*			trans	-98.1	156	-165.2	55.2	0	0	0	0	115.9
426	V	31	Very low	29.9	Very low	148 Å²	148	132.5 Å²	132.5	90%	0.897	77%	0.772	S	S	*	*			trans	-140.7	135.8	148.2	-177.9	0	0	0	0	108.6
427	T	27.2	Very low	29.6	Very low	120 Å²	120	132.7 Å²	132.7	74%	0.736	77%	0.773	S	S	*	*			trans	-97.5	144.5	-175.2	32.5	0	0	0	0	114
428	T	31.7	Very low	29.5	Very low	144 Å²	144	129.7 Å²	129.7	88%	0.883	77%	0.771	S	S	*	*			trans	-140.3	145.7	156.2	43.7	0	0	0	0	109.6
429	N	27.5	Very low	29.5	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	78%	0.776	S	S	*	*			trans	-107	142.9	-171.3	-58.7	-29.5	0	0	0	111.6
430	S	27.6	Very low	29.4	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	77%	0.77	S	S	*	*				178.4	116.5	116	40.1	0	0	0	0	113.7
431	I	28.9	Very low	29.5	Very low	120 Å²	120	129.4 Å²	129.4	62%	0.615	78%	0.777	S	S	*	*			trans	52.6	71.6	147.7	-39.6	-178	0	0	0	116.7	D544	I431-D544 WeakPolarHBondContact CD1-OD1 3.03Å
432	T	30.4	Very low	29.4	Very low	131 Å²	131	123.7 Å²	123.7	80%	0.804	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-83.1	128.1	146.7	49.7	0	0	0	0	109.4
433	S	29.3	Very low	30	Very low	109 Å²	109	123.2 Å²	123.2	76%	0.762	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-56.6	145.4	160.9	-60.5	0	0	0	0	109.7	L435	S433-L435 PolarHBondContact O-N 3.07Å
434	P	30.2	Very low	30.3	Very low	108 Å²	108	118.1 Å²	118.1	70%	0.701	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.5	126.4	-166.4	25.4	-34.3	0	0	0	112.1	L436	P434-L436 PolarHBondContact O-N 3.38Å
435	L	26	Very low	31.1	Very low	169 Å²	169	119.3 Å²	119.3	89%	0.885	75%	0.751	S	S	*	*			trans	-69.4	80.4	162.8	-176.5	72.4	0	0	0	108.5	S433 S437	S433-L435 PolarHBondContact O-N 3.07Å; L435-S437 PolarHBondContact O-N 2.96Å
436	L	29.3	Very low	32.3	Very low	149 Å²	149	121.2 Å²	121.2	78%	0.78	75%	0.748	S	S	*	*			trans	-64.1	105.4	168.1	-90	154.8	0	0	0	108.1	P434 S438	P434-L436 PolarHBondContact O-N 3.38Å; L436-S438 PolarHBondContact O-N 3.26Å
437	S	25.9	Very low	33.9	Very low	104 Å²	104	115.7 Å²	115.7	73%	0.727	71%	0.712	S	S	*	*			trans	-69.4	80.2	174.7	56	0	0	0	0	109.8	L435 S439	L435-S437 PolarHBondContact O-N 2.96Å; S437-S439 PolarHBondContact O-N 3.37Å
438	S	30.2	Very low	35.7	Very low	107 Å²	107	113 Å²	113	75%	0.748	70%	0.702	S	S	*	*			trans	-67.6	94.2	175.3	-176.6	0	0	0	0	110	L436 G440	L436-S438 PolarHBondContact O-N 3.26Å; S438-G440 PolarHBondContact O-N 3.03Å; S438-G440 PolarHBondContact OG-N 3.38Å
439	S	27.9	Very low	37.8	Very low	116 Å²	116	113.5 Å²	113.5	81%	0.811	69%	0.694	S	S	*	*			trans	-73.7	34.1	165	-62.2	0	0	0	0	111.9	S437 V441	S437-S439 PolarHBondContact O-N 3.37Å; S439-V441 VanDerWaalsContact C-N 3.31Å; S439-V441 PolarHBondContact O-N 3.22Å
440	G	31.1	Very low	40.1	Very low	60 Å²	60	109.7 Å²	109.7	62%	0.619	67%	0.671	S	S	*	*			trans	-88.9	54	177.9	0	0	0	0	0	112.6	S438 G442	S438-G440 PolarHBondContact O-N 3.03Å; S438-G440 PolarHBondContact OG-N 3.38Å; G440-G442 PolarHBondContact O-N 2.63Å
441	V	29.4	Very low	42.8	Very low	145 Å²	145	105.8 Å²	105.8	88%	0.879	64%	0.641	S	S	*	*			trans	-73.6	114.3	-175.3	-177.5	0	0	0	0	110.5	S439	S439-V441 VanDerWaalsContact C-N 3.31Å; S439-V441 PolarHBondContact O-N 3.22Å
442	G	32.6	Very low	45.2	Very low	50 Å²	50	101 Å²	101	52%	0.515	62%	0.621	S	S	.	*	S	Bend	trans	173.2	-96.8	178.9	0	0	0	0	0	114.6	G440	G440-G442 PolarHBondContact O-N 2.63Å
443	N	41.9	Very low	47.6	Very low	125 Å²	125	102.2 Å²	102.2	67%	0.668	62%	0.618	S	S	*	*	S	Bend	trans	-89.1	-21.8	-155.5	-70.2	-10.2	0	0	0	116.8	Q445 H446	N443-Q445 VanDerWaalsContact C-N 3.31Å; N443-Q445 PolarHBondContact O-N 3.16Å; N443-H446 PolarHBondContact O-N 3.1Å; N443-H446 VanDerWaalsContact O-N 3.1Å
444	G	40.4	Very low	50.1	Low	59 Å²	59	98.3 Å²	98.3	61%	0.608	59%	0.592	S	S	*	*	H	α-helix	trans	-55.5	-40.2	-169.2	0	0	0	0	0	114.8	H446 H447	G444-H446 VanDerWaalsContact C-N 3.27Å; G444-H446 PolarHBondContact O-N 3Å; G444-H447 PolarHBondContact O-N 3.33Å
445	Q	46.5	Very low	52.2	Low	180 Å²	180	97.1 Å²	97.1	84%	0.841	59%	0.586	S	S	*	*	H	α-helix	trans	-65.4	-24.6	-178.1	-69.3	-175.8	-16	0	0	114	N443	N443-Q445 VanDerWaalsContact C-N 3.31Å; N443-Q445 PolarHBondContact O-N 3.16Å
446	H	53.5	Low	54.5	Low	145 Å²	145	93.6 Å²	93.6	67%	0.671	58%	0.576	S	S	*	*	H	α-helix	trans	-76.9	-23.7	-179.8	-84.9	-71.5	0	0	0	113.7	N443 G444 F450	N443-H446 PolarHBondContact O-N 3.1Å; N443-H446 VanDerWaalsContact O-N 3.1Å; G444-H446 VanDerWaalsContact C-N 3.27Å; G444-H446 PolarHBondContact O-N 3Å; H446-F450 WeakPolarHBondContact O-CD2 3.41Å
447	H	65.3	Low	57.2	Low	33 Å²	33	86.7 Å²	86.7	15%	0.153	54%	0.54	C	S	.	.	H	α-helix	trans	-83.8	-34.1	-178.7	-65.1	-69.2	0	0	0	113.1	G444 H449 F450 L524	G444-H447 PolarHBondContact O-N 3.33Å; H447-H449 PolarHBondContact O-N 3.26Å; H447-H449 VanDerWaalsContact O-N 3.08Å; H447-F450 PolarHBondContact O-N 2.92Å; H447-L524 HydrophobicContact CB-CD1 3.56Å
448	A	64.5	Low	60.2	Low	63 Å²	63	85.3 Å²	85.3	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-54	-32.3	-179.3	0	0	0	0	0	113.4	F450 L451	A448-F450 PolarHBondContact O-N 3.13Å; A448-L451 PolarHBondContact O-N 3.16Å
449	H	76.2	Confident	63	Low	155 Å²	155	80.8 Å²	80.8	72%	0.718	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-3.7	-179.5	-148.7	-35.9	0	0	0	114.6	H447 R590	H447-H449 PolarHBondContact O-N 3.26Å; H447-H449 VanDerWaalsContact O-N 3.08Å; H449-R590 PolarHBondContact O-NH2 2.82Å; H449-R590 VanDerWaalsContact O-NH2 3.16Å
450	F	75.8	Confident	66	Low	68 Å²	68	79.5 Å²	79.5	30%	0.298	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-16.3	174.7	-68.3	-90.7	0	0	0	113.9	H446 H447 A448 P593 L596	H446-F450 WeakPolarHBondContact O-CD2 3.41Å; H447-F450 PolarHBondContact O-N 2.92Å; A448-F450 PolarHBondContact O-N 3.13Å; F450-P593 HydrophobicContact CD1-CG 4.01Å; F450-P593 HydrophobicContact CD2-CG 3.79Å; F450-P593 HydrophobicContact CE1-CG 3.83Å; F450-P593 HydrophobicContact CE2-CG 3.61Å; F450-P593 HydrophobicContact CG-CG 3.99Å; F450-P593 HydrophobicContact CZ-CG 3.62Å; F450-L596 HydrophobicContact CB-CD2 4.03Å
451	L	82.9	Confident	68.9	Low	25 Å²	25	78.2 Å²	78.2	13%	0.131	46%	0.455	C	S	.	.	S	Bend	trans	-75.4	159.7	179.4	-58.7	-178.5	0	0	0	111.8	A448 V583 L584 L596	A448-L451 PolarHBondContact O-N 3.16Å; L451-V583 CarbonylContact C-O 3.58Å; L451-V583 WeakPolarHBondContact CA-O 3.28Å; L451-L584 HydrophobicContact CD2-CD2 4.18Å; L451-L596 HydrophobicContact CD2-CD2 4.33Å
452	G	79.9	Confident	71.8	Confident	20 Å²	20	73.9 Å²	73.9	21%	0.206	43%	0.427	C	S	.	.			trans	-79.3	176.6	172.5	0	0	0	0	0	113.1	A454 V583	G452-A454 PolarHBondContact O-N 2.93Å; G452-A454 VanDerWaalsContact O-N 3.14Å; G452-V583 PolarHBondContact N-O 3.23Å
453	E	81	Confident	74.5	Confident	156 Å²	156	75.3 Å²	75.3	73%	0.729	42%	0.42	S	S	*	.			trans	-77.4	101.9	-178.1	-165.3	-175.4	158.8	0	0	111.8	S455	E453-S455 VanDerWaalsContact CD-OG 3.25Å; E453-S455 WeakPolarHBondContact CG-OG 3.42Å; E453-S455 PolarHBondContact O-N 3.33Å; E453-S455 WeakPolarHBondContact OE1-CB 3.04Å; E453-S455 PolarHBondContact OE1-OG 2.95Å
454	A	81.1	Confident	76.8	Confident	27 Å²	27	69.7 Å²	69.7	22%	0.223	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-69.5	-12.2	179.1	0	0	0	0	0	114.7	G452 S456 A457 L518 V522 V583	G452-A454 PolarHBondContact O-N 2.93Å; G452-A454 VanDerWaalsContact O-N 3.14Å; A454-S456 PolarHBondContact O-N 3.03Å; A454-A457 WeakPolarHBondContact O-CB 3.18Å; A454-A457 PolarHBondContact O-N 3.21Å; A454-A457 VanDerWaalsContact O-N 3.17Å; A454-L518 HydrophobicContact CB-CD1 4.22Å; A454-V522 HydrophobicContact CB-CG2 3.52Å; A454-V583 HydrophobicContact CB-CG1 4.45Å; A454-V583 HydrophobicContact CB-CG2 4.26Å
455	S	74.5	Confident	79.3	Confident	83 Å²	83	66.9 Å²	66.9	58%	0.58	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-54.4	-32.8	-174.7	75.1	0	0	0	0	113.8	E453	E453-S455 VanDerWaalsContact CD-OG 3.25Å; E453-S455 WeakPolarHBondContact CG-OG 3.42Å; E453-S455 PolarHBondContact O-N 3.33Å; E453-S455 WeakPolarHBondContact OE1-CB 3.04Å; E453-S455 PolarHBondContact OE1-OG 2.95Å
456	S	75.4	Confident	81.4	Confident	96 Å²	96	65.2 Å²	65.2	67%	0.671	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-116.9	12.4	-172.1	-57.4	0	0	0	0	112.3	A454 L458	A454-S456 PolarHBondContact O-N 3.03Å; S456-L458 VanDerWaalsContact C-N 3.32Å; S456-L458 PolarHBondContact O-N 2.95Å
457	A	84.2	Confident	83	Confident	3 Å²	3	59.6 Å²	59.6	3%	0.025	32%	0.324	C	S	.	.			trans	-82.8	-3.8	-174.6	0	0	0	0	0	114.4	A454 L518 S579 V583	A454-A457 WeakPolarHBondContact O-CB 3.18Å; A454-A457 PolarHBondContact O-N 3.21Å; A454-A457 VanDerWaalsContact O-N 3.17Å; A457-L518 HydrophobicContact CB-CD1 3.79Å; A457-L518 HydrophobicContact CB-CD2 3.91Å; A457-S579 VanDerWaalsContact O-CB 3.29Å; A457-S579 WeakPolarHBondContact O-CB 3.43Å; A457-V583 HydrophobicContact CB-CG2 3.76Å
458	L	90	Very high	84.1	Confident	75 Å²	75	58.5 Å²	58.5	39%	0.393	32%	0.321	S	S	.	.	S	Bend	trans	-91	125	168.7	-65.7	179	0	0	0	110.2	S456 A514 L518 F576	S456-L458 VanDerWaalsContact C-N 3.32Å; S456-L458 PolarHBondContact O-N 2.95Å; L458-A514 HydrophobicContact CD2-CB 3.9Å; L458-L518 HydrophobicContact CD2-CB 4.29Å; L458-L518 HydrophobicContact CD2-CD2 3.97Å; L458-L518 HydrophobicContact CG-CD2 3.81Å; L458-F576 HydrophobicContact CD2-CD2 4.24Å; L458-F576 HydrophobicContact CD2-CE2 3.87Å
459	P	89.6	Confident	85.2	Confident	12 Å²	12	59 Å²	59	8%	0.078	33%	0.331	C	S	.	.			trans	-58.1	146.1	177.7	-24.7	31.6	0	0	0	113.6	L461 I464 Y572 T575 F576	P459-L461 PolarHBondContact O-N 3.33Å; P459-I464 HydrophobicContact CB-CD1 3.48Å; P459-I464 VanDerWaalsContact CB-CD1 3.48Å; P459-I464 HydrophobicContact CG-CD1 4.37Å; P459-Y572 HydrophobicContact CB-CD2 4.27Å; P459-Y572 HydrophobicContact CB-CE1 4.46Å; P459-Y572 HydrophobicContact CB-CE2 3.94Å; P459-Y572 HydrophobicContact CG-CD1 4.17Å; P459-Y572 HydrophobicContact CG-CE1 3.87Å; P459-Y572 HydrophobicContact CG-CE2 4.24Å; P459-Y572 HydrophobicContact CG-CG 4.49Å; P459-T575 HydrophobicContact CB-CG2 3.88Å; P459-T575 HydrophobicContact CG-CG2 3.82Å; P459-F576 HydrophobicContact CG-CB 3.78Å
460	N	89.8	Confident	85.8	Confident	89 Å²	89	52.3 Å²	52.3	48%	0.476	30%	0.301	S	S	.	.			trans	-67.1	105.7	176	-172.3	-69.9	0	0	0	110.3	D462 E463 I464	N460-D462 VanDerWaalsContact C-N 3.31Å; N460-D462 PolarHBondContact O-N 2.98Å; N460-D462 VanDerWaalsContact OD1-CB 3.28Å; N460-D462 WeakPolarHBondContact OD1-CB 3.48Å; N460-D462 PolarHBondContact OD1-N 2.98Å; N460-E463 HydrophobicContact CB-CB 3.89Å; N460-E463 PolarHBondContact O-N 3.41Å; N460-E463 WeakPolarHBondContact OD1-CB 3.44Å; N460-E463 PolarHBondContact OD1-N 2.7Å; N460-I464 PolarHBondContact O-N 3.1Å
461	L	91.5	Very high	86.1	Confident	33 Å²	33	51 Å²	51	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-41.6	-173.7	-173.7	60.5	0	0	0	112.4	P459 I464 C465 P473 C507 R508 A511 F568 Y572	P459-L461 PolarHBondContact O-N 3.33Å; L461-I464 PolarHBondContact O-N 3.29Å; L461-C465 WeakPolarHBondContact O-CB 3.33Å; L461-C465 PolarHBondContact O-N 3.02Å; L461-C465 PolarHBondContact O-SG 2.85Å; L461-P473 HydrophobicContact CD2-CB 4.48Å; L461-P473 HydrophobicContact CD2-CG 4.05Å; L461-P473 HydrophobicContact CG-CG 4.28Å; L461-C507 HydrophobicContact CD1-CB 4.16Å; L461-R508 HydrophobicContact CD2-CG 4.32Å; L461-A511 HydrophobicContact CD1-CB 4.2Å; L461-A511 HydrophobicContact CD2-CB 4.16Å; L461-F568 HydrophobicContact CD1-CE2 3.72Å; L461-F568 HydrophobicContact CD1-CZ 3.7Å; L461-Y572 HydrophobicContact CD1-CD2 4.4Å; L461-Y572 HydrophobicContact CD1-CE2 4.01Å
462	D	90.2	Very high	86.1	Confident	54 Å²	54	52 Å²	52	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-46.7	176	-101.3	38.8	0	0	0	112.7	N460 R466 V472	N460-D462 VanDerWaalsContact C-N 3.31Å; N460-D462 PolarHBondContact O-N 2.98Å; N460-D462 VanDerWaalsContact OD1-CB 3.28Å; N460-D462 WeakPolarHBondContact OD1-CB 3.48Å; N460-D462 PolarHBondContact OD1-N 2.98Å; D462-R466 WeakPolarHBondContact O-CB 3.48Å; D462-R466 VanDerWaalsContact O-CG 3.22Å; D462-R466 WeakPolarHBondContact O-CG 3.3Å; D462-R466 PolarHBondContact O-N 3.06Å; D462-R466 VanDerWaalsContact O-N 3.11Å; D462-R466 IonicContact OD2-CZ 3.54Å; D462-R466 IonicContact OD2-NH1 3.74Å; D462-R466 IonicContact OD2-NH2 2.69Å; D462-R466 PolarHBondContact OD2-NH2 3.32Å; D462-V472 HydrophobicContact CB-CG1 4.3Å; D462-V472 VanDerWaalsContact OD1-CG1 3.23Å; D462-V472 WeakPolarHBondContact OD1-CG1 3.2Å; D462-V472 WeakPolarHBondContact OD2-CG1 3.38Å
463	E	89.5	Confident	86	Confident	80 Å²	80	51.6 Å²	51.6	37%	0.374	30%	0.3	S	S	.	.	H	α-helix	trans	-65.9	-41.9	180	-162.5	164.5	-170.7	0	0	110.5	N460 S467 R1241	N460-E463 HydrophobicContact CB-CB 3.89Å; N460-E463 PolarHBondContact O-N 3.41Å; N460-E463 WeakPolarHBondContact OD1-CB 3.44Å; N460-E463 PolarHBondContact OD1-N 2.7Å; E463-S467 VanDerWaalsContact O-CB 3.31Å; E463-S467 WeakPolarHBondContact O-CB 3.49Å; E463-S467 PolarHBondContact O-N 3.15Å; E463-S467 PolarHBondContact O-OG 3.41Å; E463-R1241 IonicContact OE1-CZ 2.63Å; E463-R1241 IonicContact OE1-NE 3.62Å; E463-R1241 IonicContact OE1-NH2 3.19Å; E463-R1241 PolarHBondContact OE1-NH2 3.36Å; E463-R1241 IonicContact OE2-CZ 3.41Å; E463-R1241 IonicContact OE2-NH2 3.65Å; E463-R1241 PolarHBondContact OE2-NH2 3.47Å
464	I	91.3	Very high	85	Confident	8 Å²	8	47.7 Å²	47.7	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-72.7	-42.7	177.9	-64.5	-168.7	0	0	0	112.3	P459 N460 L461 R466 S467 S468 F568 L571 Y572	P459-I464 HydrophobicContact CB-CD1 3.48Å; P459-I464 VanDerWaalsContact CB-CD1 3.48Å; P459-I464 HydrophobicContact CG-CD1 4.37Å; N460-I464 PolarHBondContact O-N 3.1Å; L461-I464 PolarHBondContact O-N 3.29Å; I464-R466 PolarHBondContact O-N 3.38Å; I464-S467 WeakPolarHBondContact O-CB 3.41Å; I464-S467 PolarHBondContact O-N 3.49Å; I464-S467 VanDerWaalsContact O-N 3.1Å; I464-S468 PolarHBondContact O-N 3.45Å; I464-S468 PolarHBondContact O-OG 2.8Å; I464-S468 VanDerWaalsContact O-OG 3.09Å; I464-F568 HydrophobicContact CG2-CD2 3.66Å; I464-F568 HydrophobicContact CG2-CE2 3.84Å; I464-F568 HydrophobicContact CG2-CG 4.5Å; I464-L571 HydrophobicContact CB-CD2 4.42Å; I464-L571 HydrophobicContact CD1-CG 4.14Å; I464-L571 HydrophobicContact CG1-CD2 4.22Å; I464-L571 HydrophobicContact CG1-CG 4.13Å; I464-L571 HydrophobicContact CG2-CB 4.17Å; I464-L571 HydrophobicContact CG2-CD2 4.05Å; I464-L571 HydrophobicContact CG2-CG 4.04Å; I464-Y572 HydrophobicContact CD1-CD2 3.97Å; I464-Y572 HydrophobicContact CD1-CG 4.36Å; I464-Y572 HydrophobicContact CG2-CD2 4.28Å
465	C	91.9	Very high	83.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.2	-46.5	175	-72.7	0	0	0	0	111.5	L461 S467 S468 G469 L470	L461-C465 WeakPolarHBondContact O-CB 3.33Å; L461-C465 PolarHBondContact O-N 3.02Å; L461-C465 PolarHBondContact O-SG 2.85Å; C465-S467 VanDerWaalsContact C-N 3.31Å; C465-S467 PolarHBondContact O-N 3.4Å; C465-S468 PolarHBondContact O-N 2.87Å; C465-G469 PolarHBondContact O-N 3.27Å; C465-L470 HydrophobicContact CB-CB 4.32Å; C465-L470 PolarHBondContact O-N 3.13Å
466	R	91	Very high	81.7	Confident	145 Å²	145	55.3 Å²	55.3	55%	0.547	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-44.8	173.2	-70.7	170.3	-168	126.8	14.7	111.7	D462 I464 S468 G469 V472	D462-R466 WeakPolarHBondContact O-CB 3.48Å; D462-R466 VanDerWaalsContact O-CG 3.22Å; D462-R466 WeakPolarHBondContact O-CG 3.3Å; D462-R466 PolarHBondContact O-N 3.06Å; D462-R466 VanDerWaalsContact O-N 3.11Å; D462-R466 IonicContact OD2-CZ 3.54Å; D462-R466 IonicContact OD2-NH1 3.74Å; D462-R466 IonicContact OD2-NH2 2.69Å; D462-R466 PolarHBondContact OD2-NH2 3.32Å; I464-R466 PolarHBondContact O-N 3.38Å; R466-S468 VanDerWaalsContact C-N 3.25Å; R466-S468 PolarHBondContact O-N 3.02Å; R466-G469 PolarHBondContact O-N 3.01Å; R466-G469 VanDerWaalsContact O-N 3.15Å; R466-V472 HydrophobicContact CG-CG2 3.56Å
467	S	88.2	Confident	79.8	Confident	27 Å²	27	58 Å²	58	19%	0.189	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-27.8	-178.9	-60.3	0	0	0	0	113.5	E463 I464 C465 Y1238	E463-S467 VanDerWaalsContact O-CB 3.31Å; E463-S467 WeakPolarHBondContact O-CB 3.49Å; E463-S467 PolarHBondContact O-N 3.15Å; E463-S467 PolarHBondContact O-OG 3.41Å; I464-S467 WeakPolarHBondContact O-CB 3.41Å; I464-S467 PolarHBondContact O-N 3.49Å; I464-S467 VanDerWaalsContact O-N 3.1Å; C465-S467 VanDerWaalsContact C-N 3.31Å; C465-S467 PolarHBondContact O-N 3.4Å; S467-Y1238 VanDerWaalsContact C-OH 3.32Å; S467-Y1238 WeakPolarHBondContact CA-OH 3.17Å; S467-Y1238 WeakPolarHBondContact CB-OH 2.9Å; S467-Y1238 PolarHBondContact O-OH 3.27Å; S467-Y1238 VanDerWaalsContact OG-CE1 3.25Å; S467-Y1238 WeakPolarHBondContact OG-CE1 3.39Å
468	S	88.6	Confident	77.5	Confident	10 Å²	10	64.1 Å²	64.1	7%	0.07	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.3	177.4	-53	0	0	0	0	113.6	I464 C465 R466 L470 F568	I464-S468 PolarHBondContact O-N 3.45Å; I464-S468 PolarHBondContact O-OG 2.8Å; I464-S468 VanDerWaalsContact O-OG 3.09Å; C465-S468 PolarHBondContact O-N 2.87Å; R466-S468 VanDerWaalsContact C-N 3.25Å; R466-S468 PolarHBondContact O-N 3.02Å; S468-L470 VanDerWaalsContact C-N 3.25Å; S468-L470 PolarHBondContact O-N 3.01Å; S468-F568 WeakPolarHBondContact OG-CA 3.48Å; S468-F568 PolarHBondContact OG-N 2.95Å
469	G	86.3	Confident	74.8	Confident	72 Å²	72	65 Å²	65	74%	0.742	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	14.3	-176	0	0	0	0	0	114.5	C465 R466	C465-G469 PolarHBondContact O-N 3.27Å; R466-G469 PolarHBondContact O-N 3.01Å; R466-G469 VanDerWaalsContact O-N 3.15Å
470	L	89	Confident	72	Confident	15 Å²	15	71.8 Å²	71.8	8%	0.079	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-89.7	153.8	-176.2	-62.5	-178.1	0	0	0	112.3	C465 S468 V472 V503 A564 I565 F568	C465-L470 HydrophobicContact CB-CB 4.32Å; C465-L470 PolarHBondContact O-N 3.13Å; S468-L470 VanDerWaalsContact C-N 3.25Å; S468-L470 PolarHBondContact O-N 3.01Å; L470-V472 PolarHBondContact O-N 3.11Å; L470-V503 HydrophobicContact CB-CG1 4.37Å; L470-V503 HydrophobicContact CD1-CG1 4.34Å; L470-V503 HydrophobicContact CD2-CG1 4.1Å; L470-A564 HydrophobicContact CD2-CB 3.64Å; L470-I565 HydrophobicContact CD1-CD1 3.79Å; L470-I565 HydrophobicContact CD2-CD1 4.03Å; L470-F568 HydrophobicContact CD1-CB 3.54Å; L470-F568 HydrophobicContact CD1-CD2 3.9Å; L470-F568 HydrophobicContact CD1-CG 3.81Å
471	P	83.1	Confident	69.1	Low	41 Å²	41	75.3 Å²	75.3	27%	0.266	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-59.3	135.6	172.2	26	-35.7	0	0	0	111.6	N500 V503 I504	P471-N500 HydrophobicContact CG-CB 4.25Å; P471-V503 HydrophobicContact CG-CB 4.38Å; P471-V503 HydrophobicContact CG-CG1 3.84Å; P471-I504 HydrophobicContact CB-CD1 4.19Å; P471-I504 HydrophobicContact CB-CG1 4.23Å; P471-I504 HydrophobicContact CG-CD1 4.43Å; P471-I504 HydrophobicContact CG-CG1 4.08Å
472	V	82.7	Confident	66.3	Low	45 Å²	45	78 Å²	78	27%	0.273	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-76.7	130.3	-178.3	-179.6	0	0	0	0	110.7	D462 R466 L470 S474	D462-V472 HydrophobicContact CB-CG1 4.3Å; D462-V472 VanDerWaalsContact OD1-CG1 3.23Å; D462-V472 WeakPolarHBondContact OD1-CG1 3.2Å; D462-V472 WeakPolarHBondContact OD2-CG1 3.38Å; R466-V472 HydrophobicContact CG-CG2 3.56Å; L470-V472 PolarHBondContact O-N 3.11Å; V472-S474 PolarHBondContact O-N 3.22Å
473	P	77.1	Confident	63.5	Low	13 Å²	13	83.5 Å²	83.5	8%	0.084	47%	0.466	C	S	.	.			trans	-68.7	57.6	178.2	-25	38.1	0	0	0	116.5	L461 I504 C507 R508	L461-P473 HydrophobicContact CD2-CB 4.48Å; L461-P473 HydrophobicContact CD2-CG 4.05Å; L461-P473 HydrophobicContact CG-CG 4.28Å; P473-I504 HydrophobicContact CB-CG2 3.96Å; P473-I504 HydrophobicContact CG-CG2 4.28Å; P473-C507 HydrophobicContact CG-CB 4.44Å; P473-R508 HydrophobicContact CB-CG 4.09Å; P473-R508 PolarHBondContact O-NH2 3.22Å
474	S	59.8	Low	60.7	Low	73 Å²	73	86.6 Å²	86.6	51%	0.51	49%	0.485	S	S	.	.			trans	-43.3	144.5	-179.3	58.7	0	0	0	0	114.5	V472 V476 R508	V472-S474 PolarHBondContact O-N 3.22Å; S474-V476 PolarHBondContact O-N 3.33Å; S474-R508 PolarHBondContact O-NH2 3.26Å
475	E	45.4	Very low	57.9	Low	173 Å²	173	95.5 Å²	95.5	81%	0.808	52%	0.524	S	S	*	.	S	Bend	trans	-56	99.1	177.1	-70.7	-176.1	135.3	0	0	111.6
476	V	41	Very low	55.1	Low	97 Å²	97	103.3 Å²	103.3	59%	0.588	57%	0.566	S	S	*	*			trans	-141.6	111.8	171.2	-178.1	0	0	0	0	104.7	S474 L478	S474-V476 PolarHBondContact O-N 3.33Å; V476-L478 PolarHBondContact O-N 3.37Å
477	D	35.2	Very low	52.2	Low	152 Å²	152	108 Å²	108	81%	0.813	58%	0.583	S	S	*	*			trans	-58.3	125.6	-178.7	-62.3	-60.5	0	0	0	110.3	P479	D477-P479 VanDerWaalsContact O-CD 3.29Å; D477-P479 WeakPolarHBondContact O-CD 3.3Å
478	L	36.6	Very low	49.4	Very low	133 Å²	133	114 Å²	114	70%	0.696	61%	0.613	S	S	*	*			trans	-71.3	115.3	162.6	-86.3	161.9	0	0	0	107	V476 E480	V476-L478 PolarHBondContact O-N 3.37Å; L478-E480 PolarHBondContact O-N 3.39Å
479	P	33.7	Very low	46.7	Very low	93 Å²	93	123 Å²	123	60%	0.604	65%	0.65	S	S	*	*			trans	-72.6	100.3	-173.9	28.7	-34.2	0	0	0	110.4	D477 N481	D477-P479 VanDerWaalsContact O-CD 3.29Å; D477-P479 WeakPolarHBondContact O-CD 3.3Å; P479-N481 PolarHBondContact O-N 3.28Å
480	E	30.4	Very low	44	Very low	154 Å²	154	126 Å²	126	72%	0.72	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	128.5	165.4	-67.4	-165.7	137.5	0	0	109.1	L478	L478-E480 PolarHBondContact O-N 3.39Å
481	N	29.3	Very low	41.5	Very low	164 Å²	164	131.6 Å²	131.6	88%	0.877	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.1	61.3	179.4	-52.4	-64.6	0	0	0	117.6	P479	P479-N481 PolarHBondContact O-N 3.28Å
482	S	32.8	Very low	38.9	Very low	88 Å²	88	139.1 Å²	139.1	62%	0.615	72%	0.715	S	S	*	*			trans	-122.3	53.7	157.7	82.1	0	0	0	0	114.3	N484	S482-N484 PolarHBondContact O-N 2.93Å
483	L	30.8	Very low	36.7	Very low	171 Å²	171	143 Å²	143	90%	0.895	74%	0.739	S	S	*	*			trans	-74.6	62.4	173.3	-147.2	172	0	0	0	111.1
484	N	31.3	Very low	34.8	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	77%	0.77	S	S	*	*			trans	-145.1	86	-179.3	-116.2	-39.9	0	0	0	111.3	S482 N486	S482-N484 PolarHBondContact O-N 2.93Å; N484-N486 PolarHBondContact O-N 3.01Å
485	K	32.3	Very low	33.6	Very low	194 Å²	194	151.9 Å²	151.9	84%	0.843	79%	0.788	S	S	*	*	S	Bend	trans	-57.7	136.4	165.5	-67.2	174.9	179.3	174.3	0	108.3
486	N	31.7	Very low	33.9	Very low	165 Å²	165	148.4 Å²	148.4	88%	0.882	77%	0.774	S	S	*	*	S	Bend	trans	104.7	28.4	178.9	-52.2	-31.3	0	0	0	118.6	N484	N484-N486 PolarHBondContact O-N 3.01Å
487	R	30.2	Very low	34.7	Very low	242 Å²	242	146.9 Å²	146.9	91%	0.913	77%	0.767	S	S	*	*			trans	-147.3	43.6	163.3	-131.4	177.7	-155.7	-136.7	4.6	118.5
488	L	30.8	Very low	36	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	76%	0.759	S	S	*	*			trans	-130	81.1	165.5	-149.2	71.3	0	0	0	112.4
489	K	30.9	Very low	37.6	Very low	197 Å²	197	143 Å²	143	86%	0.857	75%	0.752	S	S	*	*			trans	-118.9	145.8	150.3	-79.2	-172.7	173.4	-175.8	0	106.7
490	T	29.8	Very low	39.8	Very low	137 Å²	137	141.5 Å²	141.5	84%	0.84	74%	0.738	S	S	*	*			trans	71.5	60	175.1	-38.1	0	0	0	0	115.6
491	I	36	Very low	42.3	Very low	132 Å²	132	138.5 Å²	138.5	68%	0.677	73%	0.725	S	S	*	*			trans	-131.2	126.3	134	-57	-177.8	0	0	0	106	T493	I491-T493 HydrophobicContact CG2-CG2 4.23Å; I491-T493 PolarHBondContact O-N 3.21Å
492	E	29.3	Very low	45	Very low	199 Å²	199	131.7 Å²	131.7	93%	0.93	69%	0.688	S	S	*	*			trans	-93.3	86.6	177.8	-67.2	-179	143.1	0	0	109.6
493	T	35.3	Very low	47.7	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	66%	0.661	S	S	*	*			trans	-87.5	134.2	166.2	44	0	0	0	0	110.1	I491 N495	I491-T493 HydrophobicContact CG2-CG2 4.23Å; I491-T493 PolarHBondContact O-N 3.21Å; T493-N495 PolarHBondContact O-N 3.46Å
494	S	37.9	Very low	50.5	Low	105 Å²	105	120.5 Å²	120.5	73%	0.734	62%	0.622	S	S	*	*			trans	-79.8	115.4	-164.6	53	0	0	0	0	114.1	I496	S494-I496 PolarHBondContact O-N 3.16Å; S494-I496 VanDerWaalsContact O-N 3.09Å
495	N	35.8	Very low	53.2	Low	167 Å²	167	115.1 Å²	115.1	89%	0.893	60%	0.595	S	S	*	*			trans	41.5	50.7	151.8	-67.4	-7.4	0	0	0	117.6	T493	T493-N495 PolarHBondContact O-N 3.46Å
496	I	50.8	Low	56	Low	101 Å²	101	105.9 Å²	105.9	52%	0.518	55%	0.554	S	S	.	*			trans	-87.2	123.1	159	-60.3	-179.4	0	0	0	107.8	S494 N500 E501	S494-I496 PolarHBondContact O-N 3.16Å; S494-I496 VanDerWaalsContact O-N 3.09Å; I496-N500 HydrophobicContact CG2-CB 3.78Å; I496-E501 HydrophobicContact CG2-CG 4.12Å
497	S	57.9	Low	58.8	Low	64 Å²	64	98 Å²	98	45%	0.448	51%	0.512	S	S	.	.			trans	-63	139.9	175	-61.7	0	0	0	0	110.1	I499 N500	S497-I499 PolarHBondContact O-N 2.94Å; S497-I499 VanDerWaalsContact O-N 3.1Å; S497-N500 WeakPolarHBondContact O-CB 3.38Å; S497-N500 PolarHBondContact O-N 3.03Å
498	P	63	Low	61.7	Low	97 Å²	97	89.9 Å²	89.9	63%	0.63	48%	0.482	S	S	*	.	H	α-helix	trans	-59.9	-27.8	-178.2	23	-33.5	0	0	0	113.4	N500 E501 D502	P498-N500 VanDerWaalsContact C-N 3.28Å; P498-N500 PolarHBondContact O-N 2.97Å; P498-E501 PolarHBondContact O-N 3.45Å; P498-D502 PolarHBondContact O-N 3.04Å; P498-D502 VanDerWaalsContact O-N 3.17Å
499	I	70.3	Confident	64.5	Low	108 Å²	108	83.7 Å²	83.7	55%	0.554	45%	0.449	S	S	*	.	H	α-helix	trans	-61.1	-36.1	173	-60.7	169.2	0	0	0	111.3	S497 E501 D502 V503	S497-I499 PolarHBondContact O-N 2.94Å; S497-I499 VanDerWaalsContact O-N 3.1Å; I499-E501 PolarHBondContact O-N 3.18Å; I499-D502 PolarHBondContact O-N 2.89Å; I499-V503 HydrophobicContact CG2-CG2 4.33Å; I499-V503 WeakPolarHBondContact O-CB 3.45Å; I499-V503 VanDerWaalsContact O-CG2 3.25Å; I499-V503 WeakPolarHBondContact O-CG2 3.15Å; I499-V503 PolarHBondContact O-N 2.64Å
500	N	79.6	Confident	67.4	Low	60 Å²	60	74.4 Å²	74.4	32%	0.321	41%	0.409	S	S	.	.	H	α-helix	trans	-68.9	-35.6	-179.6	-62.7	13.2	0	0	0	111.5	P471 I496 S497 P498 V503 I504	P471-N500 HydrophobicContact CG-CB 4.25Å; I496-N500 HydrophobicContact CG2-CB 3.78Å; S497-N500 WeakPolarHBondContact O-CB 3.38Å; S497-N500 PolarHBondContact O-N 3.03Å; P498-N500 VanDerWaalsContact C-N 3.28Å; P498-N500 PolarHBondContact O-N 2.97Å; N500-V503 PolarHBondContact O-N 3.17Å; N500-I504 WeakPolarHBondContact O-CB 3.48Å; N500-I504 VanDerWaalsContact O-CG1 3.25Å; N500-I504 WeakPolarHBondContact O-CG1 3.49Å; N500-I504 PolarHBondContact O-N 3.24Å
501	E	82.8	Confident	70.4	Confident	92 Å²	92	68.8 Å²	68.8	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-42.4	173.7	-66.1	-64.6	164.7	0	0	111.1	I496 P498 I499 V503 I504 T505	I496-E501 HydrophobicContact CG2-CG 4.12Å; P498-E501 PolarHBondContact O-N 3.45Å; I499-E501 PolarHBondContact O-N 3.18Å; E501-V503 VanDerWaalsContact C-N 3.35Å; E501-V503 PolarHBondContact O-N 2.96Å; E501-I504 PolarHBondContact O-N 3Å; E501-T505 WeakPolarHBondContact O-CB 3.43Å; E501-T505 PolarHBondContact O-N 2.9Å; E501-T505 PolarHBondContact O-OG1 3.46Å
502	D	85.9	Confident	73	Confident	21 Å²	21	65.5 Å²	65.5	11%	0.112	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-43	174	-75.2	-35.5	0	0	0	111.4	P498 I499 T505 F506 L551 R555 L559	P498-D502 PolarHBondContact O-N 3.04Å; P498-D502 VanDerWaalsContact O-N 3.17Å; I499-D502 PolarHBondContact O-N 2.89Å; D502-T505 PolarHBondContact O-N 3.13Å; D502-F506 WeakPolarHBondContact O-CB 3.45Å; D502-F506 PolarHBondContact O-N 2.82Å; D502-L551 HydrophobicContact CB-CD2 3.83Å; D502-L551 WeakPolarHBondContact OD1-CD2 3.23Å; D502-R555 IonicContact OD1-CZ 3.01Å; D502-R555 IonicContact OD1-NH1 2.7Å; D502-R555 PolarHBondContact OD1-NH1 2.75Å; D502-R555 IonicContact OD2-CZ 3.34Å; D502-R555 IonicContact OD2-NE 2.72Å; D502-R555 IonicContact OD2-NH1 2.94Å; D502-R555 PolarHBondContact OD2-NH1 2.82Å; D502-L559 HydrophobicContact CB-CD1 4.26Å; D502-L559 HydrophobicContact CB-CD2 4.37Å
503	V	89.2	Confident	75.9	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.036	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-48.8	175.3	167	0	0	0	0	112.3	L470 P471 I499 N500 E501 T505 F506 C507 L559 I565	L470-V503 HydrophobicContact CB-CG1 4.37Å; L470-V503 HydrophobicContact CD1-CG1 4.34Å; L470-V503 HydrophobicContact CD2-CG1 4.1Å; P471-V503 HydrophobicContact CG-CB 4.38Å; P471-V503 HydrophobicContact CG-CG1 3.84Å; I499-V503 HydrophobicContact CG2-CG2 4.33Å; I499-V503 WeakPolarHBondContact O-CB 3.45Å; I499-V503 VanDerWaalsContact O-CG2 3.25Å; I499-V503 WeakPolarHBondContact O-CG2 3.15Å; I499-V503 PolarHBondContact O-N 2.64Å; N500-V503 PolarHBondContact O-N 3.17Å; E501-V503 VanDerWaalsContact C-N 3.35Å; E501-V503 PolarHBondContact O-N 2.96Å; V503-T505 VanDerWaalsContact C-N 3.28Å; V503-T505 PolarHBondContact O-N 3.13Å; V503-F506 PolarHBondContact O-N 3.05Å; V503-C507 PolarHBondContact O-N 3.01Å; V503-C507 PolarHBondContact O-SG 2.67Å; V503-L559 HydrophobicContact CG2-CD2 3.62Å; V503-I565 HydrophobicContact CG1-CD1 3.98Å; V503-I565 HydrophobicContact CG2-CD1 4.12Å
504	I	89.4	Confident	78.7	Confident	18 Å²	18	50.4 Å²	50.4	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-42	177.7	-74.5	165.9	0	0	0	110.2	P471 P473 N500 E501 C507 R508	P471-I504 HydrophobicContact CB-CD1 4.19Å; P471-I504 HydrophobicContact CB-CG1 4.23Å; P471-I504 HydrophobicContact CG-CD1 4.43Å; P471-I504 HydrophobicContact CG-CG1 4.08Å; P473-I504 HydrophobicContact CB-CG2 3.96Å; P473-I504 HydrophobicContact CG-CG2 4.28Å; N500-I504 WeakPolarHBondContact O-CB 3.48Å; N500-I504 VanDerWaalsContact O-CG1 3.25Å; N500-I504 WeakPolarHBondContact O-CG1 3.49Å; N500-I504 PolarHBondContact O-N 3.24Å; E501-I504 PolarHBondContact O-N 3Å; I504-C507 PolarHBondContact O-N 2.81Å; I504-R508 WeakPolarHBondContact O-CB 3.42Å; I504-R508 WeakPolarHBondContact O-CG 3.17Å; I504-R508 PolarHBondContact O-N 3.36Å
505	T	87.6	Confident	81.3	Confident	31 Å²	31	46.4 Å²	46.4	19%	0.19	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-45.2	177.4	-61.4	0	0	0	0	111.2	E501 D502 V503 R508 L509 L551	E501-T505 WeakPolarHBondContact O-CB 3.43Å; E501-T505 PolarHBondContact O-N 2.9Å; E501-T505 PolarHBondContact O-OG1 3.46Å; D502-T505 PolarHBondContact O-N 3.13Å; V503-T505 VanDerWaalsContact C-N 3.28Å; V503-T505 PolarHBondContact O-N 3.13Å; T505-R508 PolarHBondContact O-N 2.78Å; T505-L509 HydrophobicContact CG2-CD1 3.69Å; T505-L509 WeakPolarHBondContact O-CB 3.48Å; T505-L509 WeakPolarHBondContact O-CD1 3.36Å; T505-L509 VanDerWaalsContact O-CG 3.27Å; T505-L509 WeakPolarHBondContact O-CG 3.35Å; T505-L509 PolarHBondContact O-N 3.4Å; T505-L551 HydrophobicContact CG2-CD1 3.9Å; T505-L551 HydrophobicContact CG2-CG 3.93Å
506	F	91.3	Very high	84.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.5	-50.5	173.6	173.6	-95	0	0	0	111.5	D502 V503 R508 L509 Y510 F536 L551 L556 L559 V560 I565 F568 I569	D502-F506 WeakPolarHBondContact O-CB 3.45Å; D502-F506 PolarHBondContact O-N 2.82Å; V503-F506 PolarHBondContact O-N 3.05Å; F506-R508 VanDerWaalsContact C-N 3.35Å; F506-R508 PolarHBondContact O-N 2.85Å; F506-L509 PolarHBondContact O-N 3.46Å; F506-Y510 HydrophobicContact CE1-CD2 4.09Å; F506-Y510 HydrophobicContact CE2-CD2 4.23Å; F506-Y510 AromaticContact CZ-CD2 3.61Å; F506-Y510 HydrophobicContact CZ-CD2 3.61Å; F506-Y510 HydrophobicContact CZ-CE2 4.17Å; F506-Y510 HydrophobicContact CZ-CG 4.45Å; F506-Y510 WeakPolarHBondContact O-CB 3.36Å; F506-Y510 PolarHBondContact O-N 3.08Å; F506-F536 HydrophobicContact CD2-CZ 4.28Å; F506-F536 HydrophobicContact CE2-CE1 4.15Å; F506-F536 AromaticContact CE2-CZ 3.81Å; F506-F536 HydrophobicContact CE2-CZ 3.81Å; F506-F536 HydrophobicContact CZ-CZ 4.48Å; F506-L551 HydrophobicContact CB-CD1 3.91Å; F506-L556 HydrophobicContact CD2-CD1 3.68Å; F506-L556 HydrophobicContact CE2-CD1 3.63Å; F506-L559 HydrophobicContact CB-CD1 3.87Å; F506-L559 HydrophobicContact CG-CD1 4.38Å; F506-V560 HydrophobicContact CE2-CG2 4.02Å; F506-V560 HydrophobicContact CZ-CG2 4.18Å; F506-I565 HydrophobicContact CD1-CD1 4.24Å; F506-I565 HydrophobicContact CD1-CG2 4.18Å; F506-I565 HydrophobicContact CE1-CG2 3.68Å; F506-I565 HydrophobicContact CZ-CG2 4.13Å; F506-F568 HydrophobicContact CE1-CD1 4.03Å; F506-F568 HydrophobicContact CE1-CE1 4.08Å; F506-I569 HydrophobicContact CE1-CD1 4.4Å; F506-I569 HydrophobicContact CE1-CG1 4.26Å; F506-I569 HydrophobicContact CZ-CD1 3.94Å; F506-I569 HydrophobicContact CZ-CG1 4.11Å
507	C	92.1	Very high	86.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-42.8	-179.1	-65.2	0	0	0	0	112.2	L461 P473 V503 I504 A511 F568	L461-C507 HydrophobicContact CD1-CB 4.16Å; P473-C507 HydrophobicContact CG-CB 4.44Å; V503-C507 PolarHBondContact O-N 3.01Å; V503-C507 PolarHBondContact O-SG 2.67Å; I504-C507 PolarHBondContact O-N 2.81Å; C507-A511 PolarHBondContact O-N 2.74Å; C507-A511 VanDerWaalsContact O-N 3.15Å; C507-F568 HydrophobicContact CB-CE1 4.45Å; C507-F568 HydrophobicContact CB-CE2 4.12Å; C507-F568 HydrophobicContact CB-CZ 3.87Å
508	R	89.4	Confident	87.9	Confident	71 Å²	71	37 Å²	37	27%	0.268	19%	0.194	S	C	.	.	H	α-helix	trans	-62.5	-43.4	175.3	-76.2	177.9	171.6	177.3	1.7	112.3	L461 P473 S474 I504 T505 F506 L512	L461-R508 HydrophobicContact CD2-CG 4.32Å; P473-R508 HydrophobicContact CB-CG 4.09Å; P473-R508 PolarHBondContact O-NH2 3.22Å; S474-R508 PolarHBondContact O-NH2 3.26Å; I504-R508 WeakPolarHBondContact O-CB 3.42Å; I504-R508 WeakPolarHBondContact O-CG 3.17Å; I504-R508 PolarHBondContact O-N 3.36Å; T505-R508 PolarHBondContact O-N 2.78Å; F506-R508 VanDerWaalsContact C-N 3.35Å; F506-R508 PolarHBondContact O-N 2.85Å; R508-L512 PolarHBondContact O-N 3.01Å
509	L	89.5	Confident	89.3	Confident	25 Å²	25	37 Å²	37	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-75.8	-30.1	-178.6	-67.7	165.8	0	0	0	112.6	T505 F506 L512 S513 F536 L547 S550	T505-L509 HydrophobicContact CG2-CD1 3.69Å; T505-L509 WeakPolarHBondContact O-CB 3.48Å; T505-L509 WeakPolarHBondContact O-CD1 3.36Å; T505-L509 VanDerWaalsContact O-CG 3.27Å; T505-L509 WeakPolarHBondContact O-CG 3.35Å; T505-L509 PolarHBondContact O-N 3.4Å; F506-L509 PolarHBondContact O-N 3.46Å; L509-L512 HydrophobicContact CD2-CD2 4.15Å; L509-L512 PolarHBondContact O-N 3.42Å; L509-S513 PolarHBondContact O-N 3.22Å; L509-F536 HydrophobicContact CB-CE2 4.15Å; L509-L547 HydrophobicContact CB-CD1 4.23Å; L509-L547 HydrophobicContact CD1-CD1 3.47Å; L509-L547 VanDerWaalsContact CD1-CD1 3.47Å; L509-L547 HydrophobicContact CG-CD1 4.46Å; L509-S550 VanDerWaalsContact CD1-OG 3.24Å; L509-S550 WeakPolarHBondContact CD1-OG 3.44Å
510	Y	92.6	Very high	90.4	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-49.9	171.4	-160.3	-87.8	0	0	0	110.6	F506 L512 S513 A514 F536 W537 F568 I569 Y572 D573 K626	F506-Y510 HydrophobicContact CE1-CD2 4.09Å; F506-Y510 HydrophobicContact CE2-CD2 4.23Å; F506-Y510 AromaticContact CZ-CD2 3.61Å; F506-Y510 HydrophobicContact CZ-CD2 3.61Å; F506-Y510 HydrophobicContact CZ-CE2 4.17Å; F506-Y510 HydrophobicContact CZ-CG 4.45Å; F506-Y510 WeakPolarHBondContact O-CB 3.36Å; F506-Y510 PolarHBondContact O-N 3.08Å; Y510-L512 VanDerWaalsContact C-N 3.33Å; Y510-L512 PolarHBondContact O-N 2.92Å; Y510-S513 WeakPolarHBondContact O-CB 3.49Å; Y510-S513 PolarHBondContact O-N 3.02Å; Y510-S513 VanDerWaalsContact O-N 3.16Å; Y510-S513 PolarHBondContact O-OG 2.65Å; Y510-A514 PolarHBondContact O-N 3.48Å; Y510-A514 VanDerWaalsContact O-N 3.12Å; Y510-F536 AromaticContact CD2-CE1 3.85Å; Y510-F536 HydrophobicContact CD2-CE1 3.85Å; Y510-F536 AromaticContact CD2-CZ 3.69Å; Y510-F536 HydrophobicContact CD2-CZ 3.69Å; Y510-F536 HydrophobicContact CE2-CE1 4.23Å; Y510-F536 HydrophobicContact CG-CZ 4.43Å; Y510-W537 HydrophobicContact CE2-CH2 4.39Å; Y510-W537 HydrophobicContact CE2-CZ2 4.13Å; Y510-F568 AromaticContact CD1-CE1 3.89Å; Y510-F568 HydrophobicContact CD1-CE1 3.89Å; Y510-F568 HydrophobicContact CD1-CZ 4.45Å; Y510-F568 AromaticContact CG-CE1 3.91Å; Y510-F568 HydrophobicContact CG-CE1 3.91Å; Y510-I569 HydrophobicContact CE2-CG1 4Å; Y510-Y572 AromaticContact CD1-CD1 3.77Å; Y510-Y572 HydrophobicContact CD1-CD1 3.77Å; Y510-Y572 HydrophobicContact CD1-CD2 4.48Å; Y510-Y572 HydrophobicContact CD1-CE1 4.25Å; Y510-Y572 AromaticContact CD1-CG 3.91Å; Y510-Y572 HydrophobicContact CD1-CG 3.91Å; Y510-Y572 AromaticContact CE1-CD1 3.63Å; Y510-Y572 HydrophobicContact CE1-CD1 3.63Å; Y510-Y572 HydrophobicContact CE1-CE1 4.42Å; Y510-Y572 AromaticContact CE1-CG 3.91Å; Y510-Y572 HydrophobicContact CE1-CG 3.91Å; Y510-D573 PolarHBondContact OH-OD1 3.44Å; Y510-K626 VanDerWaalsContact OH-CE 3.23Å; Y510-K626 WeakPolarHBondContact OH-CE 3.22Å; Y510-K626 PolarHBondContact OH-NZ 3.19Å
511	A	92.5	Very high	91	Very high	18 Å²	18	29.4 Å²	29.4	15%	0.149	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-37.7	174.1	0	0	0	0	0	113	L461 C507 S513 A514 G515 Y572	L461-A511 HydrophobicContact CD1-CB 4.2Å; L461-A511 HydrophobicContact CD2-CB 4.16Å; C507-A511 PolarHBondContact O-N 2.74Å; C507-A511 VanDerWaalsContact O-N 3.15Å; A511-S513 VanDerWaalsContact C-N 3.34Å; A511-S513 PolarHBondContact O-N 2.84Å; A511-A514 WeakPolarHBondContact O-CB 3.49Å; A511-A514 PolarHBondContact O-N 2.89Å; A511-G515 PolarHBondContact O-N 3.31Å; A511-Y572 WeakPolarHBondContact CA-OH 3.41Å; A511-Y572 HydrophobicContact CB-CE2 4.2Å; A511-Y572 WeakPolarHBondContact CB-OH 3.39Å
512	L	90.3	Very high	91.4	Very high	63 Å²	63	27.5 Å²	27.5	33%	0.33	15%	0.145	S	C	.	.	H	α-helix	trans	-63.1	-39.2	174.1	-177.5	62.6	0	0	0	112	R508 L509 Y510 A514 G515 Y516	R508-L512 PolarHBondContact O-N 3.01Å; L509-L512 HydrophobicContact CD2-CD2 4.15Å; L509-L512 PolarHBondContact O-N 3.42Å; Y510-L512 VanDerWaalsContact C-N 3.33Å; Y510-L512 PolarHBondContact O-N 2.92Å; L512-A514 VanDerWaalsContact C-N 3.32Å; L512-A514 PolarHBondContact O-N 3.41Å; L512-G515 WeakPolarHBondContact O-CA 3.29Å; L512-G515 PolarHBondContact O-N 3.28Å; L512-G515 VanDerWaalsContact O-N 3.15Å; L512-Y516 HydrophobicContact CD1-CE2 4Å; L512-Y516 HydrophobicContact CD2-CE2 4.14Å; L512-Y516 HydrophobicContact CG-CD2 4.35Å; L512-Y516 HydrophobicContact CG-CE2 3.67Å; L512-Y516 WeakPolarHBondContact O-CD2 3.38Å; L512-Y516 PolarHBondContact O-N 3.32Å; L512-Y516 VanDerWaalsContact O-N 3.14Å
513	S	91.9	Very high	91.6	Very high	9 Å²	9	31.5 Å²	31.5	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-37.7	174.4	82	0	0	0	0	112.2	L509 Y510 A511 G515 Y516 M517 V532	L509-S513 PolarHBondContact O-N 3.22Å; Y510-S513 WeakPolarHBondContact O-CB 3.49Å; Y510-S513 PolarHBondContact O-N 3.02Å; Y510-S513 VanDerWaalsContact O-N 3.16Å; Y510-S513 PolarHBondContact O-OG 2.65Å; A511-S513 VanDerWaalsContact C-N 3.34Å; A511-S513 PolarHBondContact O-N 2.84Å; S513-G515 VanDerWaalsContact C-N 3.33Å; S513-Y516 PolarHBondContact O-N 3.48Å; S513-M517 WeakPolarHBondContact O-CG 3.29Å; S513-M517 PolarHBondContact O-N 3Å; S513-V532 WeakPolarHBondContact O-CG1 3.29Å
514	A	94	Very high	91.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-34.3	172.4	0	0	0	0	0	112.7	L458 Y510 A511 L512 M517 L518 Y572 F576	L458-A514 HydrophobicContact CD2-CB 3.9Å; Y510-A514 PolarHBondContact O-N 3.48Å; Y510-A514 VanDerWaalsContact O-N 3.12Å; A511-A514 WeakPolarHBondContact O-CB 3.49Å; A511-A514 PolarHBondContact O-N 2.89Å; L512-A514 VanDerWaalsContact C-N 3.32Å; L512-A514 PolarHBondContact O-N 3.41Å; A514-M517 HydrophobicContact CB-CE 4.18Å; A514-M517 PolarHBondContact O-N 3.48Å; A514-L518 WeakPolarHBondContact O-CB 3.29Å; A514-L518 PolarHBondContact O-N 3.48Å; A514-Y572 HydrophobicContact CB-CE1 3.7Å; A514-F576 HydrophobicContact CB-CD1 4.13Å; A514-F576 HydrophobicContact CB-CD2 4.09Å; A514-F576 HydrophobicContact CB-CE1 3.99Å; A514-F576 HydrophobicContact CB-CE2 3.94Å; A514-F576 HydrophobicContact CB-CG 4.19Å; A514-F576 HydrophobicContact CB-CZ 3.89Å; A514-F576 VanDerWaalsContact O-CZ 3.31Å; A514-F576 WeakPolarHBondContact O-CZ 3.34Å
515	G	92.7	Very high	91.9	Very high	21 Å²	21	35.4 Å²	35.4	22%	0.216	19%	0.187	C	C	.	.	H	α-helix	trans	-56.5	-49.4	169.6	0	0	0	0	0	112.8	A511 L512 S513 L518 D519	A511-G515 PolarHBondContact O-N 3.31Å; L512-G515 WeakPolarHBondContact O-CA 3.29Å; L512-G515 PolarHBondContact O-N 3.28Å; L512-G515 VanDerWaalsContact O-N 3.15Å; S513-G515 VanDerWaalsContact C-N 3.33Å; G515-L518 PolarHBondContact O-N 2.9Å; G515-D519 PolarHBondContact O-N 3.49Å
516	Y	92.8	Very high	92.2	Very high	114 Å²	114	34.7 Å²	34.7	45%	0.447	18%	0.182	S	C	.	.	H	α-helix	trans	-67	-36.5	176.8	-61.2	-51	0	0	0	113	L512 S513 A520	L512-Y516 HydrophobicContact CD1-CE2 4Å; L512-Y516 HydrophobicContact CD2-CE2 4.14Å; L512-Y516 HydrophobicContact CG-CD2 4.35Å; L512-Y516 HydrophobicContact CG-CE2 3.67Å; L512-Y516 WeakPolarHBondContact O-CD2 3.38Å; L512-Y516 PolarHBondContact O-N 3.32Å; L512-Y516 VanDerWaalsContact O-N 3.14Å; S513-Y516 PolarHBondContact O-N 3.48Å; Y516-A520 WeakPolarHBondContact O-CB 3.35Å; Y516-A520 PolarHBondContact O-N 3.38Å
517	M	94.3	Very high	92.3	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.02	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-40.2	172.7	-73.4	-172.7	-89.4	0	0	112.5	S513 A514 V521 I529 V532 W533 F576	S513-M517 WeakPolarHBondContact O-CG 3.29Å; S513-M517 PolarHBondContact O-N 3Å; A514-M517 HydrophobicContact CB-CE 4.18Å; A514-M517 PolarHBondContact O-N 3.48Å; M517-V521 WeakPolarHBondContact O-CG2 3.4Å; M517-V521 PolarHBondContact O-N 3.11Å; M517-I529 HydrophobicContact CG-CG2 4.23Å; M517-I529 HydrophobicContact SD-CG2 4.34Å; M517-V532 HydrophobicContact CG-CB 4.34Å; M517-V532 HydrophobicContact CG-CG1 3.83Å; M517-W533 HydrophobicContact SD-CZ2 4.18Å; M517-W533 PolarHBondContact SD-NE1 3.23Å; M517-F576 HydrophobicContact CB-CE1 3.92Å; M517-F576 HydrophobicContact CB-CZ 3.73Å; M517-F576 HydrophobicContact CE-CD1 4.37Å; M517-F576 HydrophobicContact CE-CE1 3.76Å; M517-F576 HydrophobicContact SD-CE1 3.87Å
518	L	94.4	Very high	92.3	Very high	15 Å²	15	41.1 Å²	41.1	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-67.5	-43.7	179.4	179.8	61.6	0	0	0	111.6	A454 A457 L458 A514 G515 V521 V522 F576 L580	A454-L518 HydrophobicContact CB-CD1 4.22Å; A457-L518 HydrophobicContact CB-CD1 3.79Å; A457-L518 HydrophobicContact CB-CD2 3.91Å; L458-L518 HydrophobicContact CD2-CB 4.29Å; L458-L518 HydrophobicContact CD2-CD2 3.97Å; L458-L518 HydrophobicContact CG-CD2 3.81Å; A514-L518 WeakPolarHBondContact O-CB 3.29Å; A514-L518 PolarHBondContact O-N 3.48Å; G515-L518 PolarHBondContact O-N 2.9Å; L518-V521 PolarHBondContact O-N 2.89Å; L518-V522 HydrophobicContact CD1-CG2 4.23Å; L518-V522 HydrophobicContact CG-CG2 4.47Å; L518-V522 WeakPolarHBondContact O-CG2 3.46Å; L518-V522 PolarHBondContact O-N 2.86Å; L518-F576 HydrophobicContact CB-CE2 4.19Å; L518-F576 HydrophobicContact CB-CZ 4.4Å; L518-L580 HydrophobicContact CD1-CD2 3.79Å
519	D	92	Very high	92.5	Very high	99 Å²	99	37.9 Å²	37.9	53%	0.529	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-44.4	175.4	-174.9	54.5	0	0	0	111.4	G515 V521 V522 N523	G515-D519 PolarHBondContact O-N 3.49Å; D519-V521 VanDerWaalsContact C-N 3.35Å; D519-V521 PolarHBondContact O-N 2.8Å; D519-V522 PolarHBondContact O-N 2.61Å; D519-N523 VanDerWaalsContact CG-ND2 3.31Å; D519-N523 WeakPolarHBondContact O-CB 3.29Å; D519-N523 PolarHBondContact O-N 3.04Å; D519-N523 PolarHBondContact O-ND2 3.42Å; D519-N523 PolarHBondContact OD1-ND2 2.94Å
520	A	93.4	Very high	92.7	Very high	7 Å²	7	38.5 Å²	38.5	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-57.4	-44.1	173.2	0	0	0	0	0	112.5	Y516 L524 D525 I529	Y516-A520 WeakPolarHBondContact O-CB 3.35Å; Y516-A520 PolarHBondContact O-N 3.38Å; A520-L524 PolarHBondContact O-N 3.46Å; A520-L524 VanDerWaalsContact O-N 3.11Å; A520-D525 WeakPolarHBondContact CB-O 3.17Å; A520-D525 CarbonylContact O-C 3.6Å; A520-D525 PolarHBondContact O-N 3.23Å; A520-I529 HydrophobicContact CB-CG1 3.97Å
521	V	93.6	Very high	92.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-42.6	175.9	168	0	0	0	0	112.6	M517 L518 D519 L524 F526 I529 L580 L584 F603	M517-V521 WeakPolarHBondContact O-CG2 3.4Å; M517-V521 PolarHBondContact O-N 3.11Å; L518-V521 PolarHBondContact O-N 2.89Å; D519-V521 VanDerWaalsContact C-N 3.35Å; D519-V521 PolarHBondContact O-N 2.8Å; V521-L524 PolarHBondContact O-N 3.19Å; V521-L524 VanDerWaalsContact O-N 3.15Å; V521-F526 HydrophobicContact CG1-CE1 4.39Å; V521-F526 HydrophobicContact CG2-CD1 4.42Å; V521-F526 HydrophobicContact CG2-CE1 4.35Å; V521-I529 HydrophobicContact CG2-CD1 3.64Å; V521-L580 HydrophobicContact CB-CD2 4.28Å; V521-L580 HydrophobicContact CG1-CD2 4.25Å; V521-L580 HydrophobicContact CG2-CD1 4.37Å; V521-L580 HydrophobicContact CG2-CD2 4.12Å; V521-L584 HydrophobicContact CG1-CD1 4.2Å; V521-L584 HydrophobicContact CG1-CD2 3.79Å; V521-L584 HydrophobicContact CG1-CG 3.87Å; V521-F603 HydrophobicContact CG2-CZ 4.41Å
522	V	90.9	Very high	92.5	Very high	52 Å²	52	42.9 Å²	42.9	32%	0.315	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-37.3	-180	169.3	0	0	0	0	111.6	A454 L518 D519 L524 V583	A454-V522 HydrophobicContact CB-CG2 3.52Å; L518-V522 HydrophobicContact CD1-CG2 4.23Å; L518-V522 HydrophobicContact CG-CG2 4.47Å; L518-V522 WeakPolarHBondContact O-CG2 3.46Å; L518-V522 PolarHBondContact O-N 2.86Å; D519-V522 PolarHBondContact O-N 2.61Å; V522-L524 PolarHBondContact O-N 2.91Å; V522-V583 HydrophobicContact CG2-CG1 4.33Å
523	N	90.3	Very high	92.6	Very high	105 Å²	105	40.1 Å²	40.1	56%	0.561	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.3	174.8	-64.4	-54	0	0	0	113.5	D519 D525	D519-N523 VanDerWaalsContact CG-ND2 3.31Å; D519-N523 WeakPolarHBondContact O-CB 3.29Å; D519-N523 PolarHBondContact O-N 3.04Å; D519-N523 PolarHBondContact O-ND2 3.42Å; D519-N523 PolarHBondContact OD1-ND2 2.94Å; N523-D525 PolarHBondContact O-N 2.92Å
524	L	91	Very high	92.4	Very high	44 Å²	44	41.5 Å²	41.5	23%	0.23	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	15.4	-175.9	-56	173.5	0	0	0	115.3	H447 A520 V521 V522 F526 L584 L596	H447-L524 HydrophobicContact CB-CD1 3.56Å; A520-L524 PolarHBondContact O-N 3.46Å; A520-L524 VanDerWaalsContact O-N 3.11Å; V521-L524 PolarHBondContact O-N 3.19Å; V521-L524 VanDerWaalsContact O-N 3.15Å; V522-L524 PolarHBondContact O-N 2.91Å; L524-F526 HydrophobicContact CB-CE2 4.16Å; L524-F526 HydrophobicContact CD2-CE2 3.85Å; L524-F526 HydrophobicContact CD2-CZ 3.62Å; L524-F526 WeakPolarHBondContact O-CD2 3.22Å; L524-F526 PolarHBondContact O-N 3.4Å; L524-L584 HydrophobicContact CD2-CD2 4.5Å; L524-L596 HydrophobicContact CD1-CD1 4.07Å; L524-L596 HydrophobicContact CD2-CD1 3.7Å
525	D	93.8	Very high	92	Very high	62 Å²	62	42.8 Å²	42.8	33%	0.332	24%	0.239	S	C	.	.			trans	-81.4	71	168.5	-179.9	5.7	0	0	0	109.8	A520 N523 T527 S528	A520-D525 WeakPolarHBondContact CB-O 3.17Å; A520-D525 CarbonylContact O-C 3.6Å; A520-D525 PolarHBondContact O-N 3.23Å; N523-D525 PolarHBondContact O-N 2.92Å; D525-T527 PolarHBondContact O-N 2.7Å; D525-T527 WeakPolarHBondContact OD1-CB 3.4Å; D525-T527 PolarHBondContact OD1-N 2.68Å; D525-T527 PolarHBondContact OD1-OG1 3.48Å; D525-S528 VanDerWaalsContact CG-OG 3.31Å; D525-S528 PolarHBondContact O-N 3.05Å; D525-S528 PolarHBondContact OD1-N 3.4Å; D525-S528 VanDerWaalsContact OD2-CB 3.23Å; D525-S528 WeakPolarHBondContact OD2-CB 3.35Å; D525-S528 PolarHBondContact OD2-OG 3.24Å
526	F	94.3	Very high	91.8	Very high	17 Å²	17	42.4 Å²	42.4	8%	0.075	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.2	177.9	-62.4	-68.8	0	0	0	112.7	V521 L524 I529 L584 A599 F603 W610	V521-F526 HydrophobicContact CG1-CE1 4.39Å; V521-F526 HydrophobicContact CG2-CD1 4.42Å; V521-F526 HydrophobicContact CG2-CE1 4.35Å; L524-F526 HydrophobicContact CB-CE2 4.16Å; L524-F526 HydrophobicContact CD2-CE2 3.85Å; L524-F526 HydrophobicContact CD2-CZ 3.62Å; L524-F526 WeakPolarHBondContact O-CD2 3.22Å; L524-F526 PolarHBondContact O-N 3.4Å; F526-I529 HydrophobicContact CD1-CD1 4.23Å; F526-I529 WeakPolarHBondContact O-CB 3.33Å; F526-I529 WeakPolarHBondContact O-CG1 3.47Å; F526-I529 PolarHBondContact O-N 2.87Å; F526-L584 HydrophobicContact CE1-CD1 4.1Å; F526-L584 HydrophobicContact CE1-CD2 3.95Å; F526-L584 HydrophobicContact CZ-CD2 3.82Å; F526-A599 HydrophobicContact CE2-CB 4Å; F526-F603 HydrophobicContact CB-CB 4.15Å; F526-F603 HydrophobicContact CB-CD2 3.84Å; F526-F603 HydrophobicContact CB-CG 4.14Å; F526-F603 HydrophobicContact CD1-CB 3.82Å; F526-F603 AromaticContact CD1-CD1 3.53Å; F526-F603 HydrophobicContact CD1-CD1 3.53Å; F526-F603 AromaticContact CD1-CD2 3.6Å; F526-F603 HydrophobicContact CD1-CD2 3.6Å; F526-F603 AromaticContact CD1-CE1 3.9Å; F526-F603 HydrophobicContact CD1-CE1 3.9Å; F526-F603 AromaticContact CD1-CE2 3.97Å; F526-F603 HydrophobicContact CD1-CE2 3.97Å; F526-F603 AromaticContact CD1-CG 3.36Å; F526-F603 HydrophobicContact CD1-CG 3.36Å; F526-F603 HydrophobicContact CD1-CZ 4.1Å; F526-F603 HydrophobicContact CD2-CB 4.24Å; F526-F603 HydrophobicContact CE1-CB 4.26Å; F526-F603 AromaticContact CE1-CD1 3.58Å; F526-F603 HydrophobicContact CE1-CD1 3.58Å; F526-F603 HydrophobicContact CE1-CD2 4.48Å; F526-F603 AromaticContact CE1-CE1 3.97Å; F526-F603 HydrophobicContact CE1-CE1 3.97Å; F526-F603 AromaticContact CE1-CG 3.87Å; F526-F603 HydrophobicContact CE1-CG 3.87Å; F526-F603 HydrophobicContact CG-CB 3.8Å; F526-F603 HydrophobicContact CG-CD1 4.38Å; F526-F603 AromaticContact CG-CD2 3.98Å; F526-F603 HydrophobicContact CG-CD2 3.98Å; F526-F603 AromaticContact CG-CG 3.81Å; F526-F603 HydrophobicContact CG-CG 3.81Å; F526-F603 HydrophobicContact CZ-CD1 4.47Å; F526-W610 HydrophobicContact CB-CH2 4.35Å; F526-W610 VanDerWaalsContact O-CH2 3.3Å; F526-W610 WeakPolarHBondContact O-CH2 3.32Å; F526-W610 WeakPolarHBondContact O-CZ3 3.34Å
527	T	92.2	Very high	91.5	Very high	92 Å²	92	37 Å²	37	56%	0.564	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-41.4	177.8	20.5	0	0	0	0	113.2	D525 I529 E530 W610	D525-T527 PolarHBondContact O-N 2.7Å; D525-T527 WeakPolarHBondContact OD1-CB 3.4Å; D525-T527 PolarHBondContact OD1-N 2.68Å; D525-T527 PolarHBondContact OD1-OG1 3.48Å; T527-I529 PolarHBondContact O-N 2.76Å; T527-E530 PolarHBondContact O-N 3.43Å; T527-E530 VanDerWaalsContact O-N 3.17Å; T527-W610 HydrophobicContact CG2-CZ2 4.33Å
528	S	92.3	Very high	90.4	Very high	43 Å²	43	37.2 Å²	37.2	30%	0.301	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-17.6	178.6	-82.4	0	0	0	0	114.5	D525 E530 T531 V532	D525-S528 VanDerWaalsContact CG-OG 3.31Å; D525-S528 PolarHBondContact O-N 3.05Å; D525-S528 PolarHBondContact OD1-N 3.4Å; D525-S528 VanDerWaalsContact OD2-CB 3.23Å; D525-S528 WeakPolarHBondContact OD2-CB 3.35Å; D525-S528 PolarHBondContact OD2-OG 3.24Å; S528-E530 VanDerWaalsContact C-N 3.29Å; S528-E530 PolarHBondContact O-N 2.88Å; S528-T531 WeakPolarHBondContact O-CB 3.16Å; S528-T531 PolarHBondContact O-N 2.87Å; S528-T531 VanDerWaalsContact O-N 3.16Å; S528-V532 WeakPolarHBondContact O-CG2 3.5Å; S528-V532 PolarHBondContact O-N 3.39Å
529	I	93.9	Very high	88.7	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-35.8	177	-60.2	167.6	0	0	0	111.2	M517 A520 V521 F526 T527 T531 V532 W533 F603	M517-I529 HydrophobicContact CG-CG2 4.23Å; M517-I529 HydrophobicContact SD-CG2 4.34Å; A520-I529 HydrophobicContact CB-CG1 3.97Å; V521-I529 HydrophobicContact CG2-CD1 3.64Å; F526-I529 HydrophobicContact CD1-CD1 4.23Å; F526-I529 WeakPolarHBondContact O-CB 3.33Å; F526-I529 WeakPolarHBondContact O-CG1 3.47Å; F526-I529 PolarHBondContact O-N 2.87Å; T527-I529 PolarHBondContact O-N 2.76Å; I529-T531 VanDerWaalsContact C-N 3.35Å; I529-V532 PolarHBondContact O-N 3.18Å; I529-W533 HydrophobicContact CG2-CD2 4.23Å; I529-W533 HydrophobicContact CG2-CE3 4.36Å; I529-W533 HydrophobicContact CG2-CH2 4.2Å; I529-W533 HydrophobicContact CG2-CZ2 4.01Å; I529-W533 HydrophobicContact CG2-CZ3 4.35Å; I529-W533 PolarHBondContact O-N 2.79Å; I529-F603 HydrophobicContact CD1-CD2 4.3Å; I529-F603 HydrophobicContact CD1-CE2 3.4Å; I529-F603 VanDerWaalsContact CD1-CE2 3.4Å; I529-F603 HydrophobicContact CD1-CZ 3.7Å
530	E	93	Very high	86.9	Confident	37 Å²	37	39.3 Å²	39.3	17%	0.173	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-45.2	173.8	-170	-172.7	164.8	0	0	111	T527 S528 W533 K534 W610	T527-E530 PolarHBondContact O-N 3.43Å; T527-E530 VanDerWaalsContact O-N 3.17Å; S528-E530 VanDerWaalsContact C-N 3.29Å; S528-E530 PolarHBondContact O-N 2.88Å; E530-W533 PolarHBondContact O-N 3.42Å; E530-K534 HydrophobicContact CG-CD 4.15Å; E530-K534 WeakPolarHBondContact O-CB 3.41Å; E530-K534 WeakPolarHBondContact O-CG 3.47Å; E530-K534 PolarHBondContact O-N 2.88Å; E530-K534 VanDerWaalsContact OE1-CE 3.22Å; E530-K534 WeakPolarHBondContact OE1-CE 3.34Å; E530-K534 IonicContact OE1-NZ 3.71Å; E530-K534 PolarHBondContact OE1-NZ 2.91Å; E530-W610 HydrophobicContact CB-CB 4.16Å; E530-W610 HydrophobicContact CB-CD2 4.1Å; E530-W610 HydrophobicContact CB-CG 3.83Å; E530-W610 HydrophobicContact CG-CB 3.98Å; E530-W610 HydrophobicContact CG-CG 3.84Å; E530-W610 PolarHBondContact OE2-NE1 3.42Å
531	T	90	Very high	84.8	Confident	89 Å²	89	47.8 Å²	47.8	55%	0.546	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-42.2	177.5	-48.2	0	0	0	0	111.7	S528 I529 K534 A535	S528-T531 WeakPolarHBondContact O-CB 3.16Å; S528-T531 PolarHBondContact O-N 2.87Å; S528-T531 VanDerWaalsContact O-N 3.16Å; I529-T531 VanDerWaalsContact C-N 3.35Å; T531-K534 PolarHBondContact O-N 3.4Å; T531-A535 WeakPolarHBondContact O-CB 3.44Å; T531-A535 PolarHBondContact O-N 3.46Å
532	V	91	Very high	82.8	Confident	25 Å²	25	50.4 Å²	50.4	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-43.3	177.1	173.8	0	0	0	0	111.3	S513 M517 S528 I529 F536	S513-V532 WeakPolarHBondContact O-CG1 3.29Å; M517-V532 HydrophobicContact CG-CB 4.34Å; M517-V532 HydrophobicContact CG-CG1 3.83Å; S528-V532 WeakPolarHBondContact O-CG2 3.5Å; S528-V532 PolarHBondContact O-N 3.39Å; I529-V532 PolarHBondContact O-N 3.18Å; V532-F536 WeakPolarHBondContact O-CB 3.22Å; V532-F536 PolarHBondContact O-N 2.57Å
533	W	92.5	Very high	80.6	Confident	5 Å²	5	59 Å²	59	2%	0.019	30%	0.302	C	S	.	.	H	α-helix	trans	-66.5	-46.6	175.9	-72.8	-22.9	0	0	0	112.9	M517 I529 E530 A535 F536 W537 L607 W610 M611 A614 V630	M517-W533 HydrophobicContact SD-CZ2 4.18Å; M517-W533 PolarHBondContact SD-NE1 3.23Å; I529-W533 HydrophobicContact CG2-CD2 4.23Å; I529-W533 HydrophobicContact CG2-CE3 4.36Å; I529-W533 HydrophobicContact CG2-CH2 4.2Å; I529-W533 HydrophobicContact CG2-CZ2 4.01Å; I529-W533 HydrophobicContact CG2-CZ3 4.35Å; I529-W533 PolarHBondContact O-N 2.79Å; E530-W533 PolarHBondContact O-N 3.42Å; W533-A535 VanDerWaalsContact C-N 3.3Å; W533-A535 PolarHBondContact O-N 3.28Å; W533-F536 PolarHBondContact O-N 3.37Å; W533-W537 PolarHBondContact O-N 2.99Å; W533-L607 HydrophobicContact CH2-CD2 3.56Å; W533-L607 HydrophobicContact CZ2-CD2 4.43Å; W533-L607 HydrophobicContact CZ3-CD2 4.27Å; W533-W610 HydrophobicContact CE3-CB 4.09Å; W533-W610 HydrophobicContact CZ3-CB 3.91Å; W533-M611 HydrophobicContact CD2-CE 3.59Å; W533-M611 HydrophobicContact CD2-SD 4.44Å; W533-M611 HydrophobicContact CE3-CB 4.07Å; W533-M611 HydrophobicContact CE3-CE 3.92Å; W533-M611 HydrophobicContact CE3-SD 4.49Å; W533-M611 HydrophobicContact CG-CE 4.2Å; W533-M611 HydrophobicContact CH2-CB 4.19Å; W533-M611 HydrophobicContact CH2-CE 3.75Å; W533-M611 HydrophobicContact CZ2-CE 3.43Å; W533-M611 VanDerWaalsContact CZ2-CE 3.43Å; W533-M611 HydrophobicContact CZ3-CB 3.68Å; W533-M611 HydrophobicContact CZ3-CE 3.99Å; W533-A614 HydrophobicContact CB-CB 3.47Å; W533-A614 VanDerWaalsContact CB-CB 3.47Å; W533-V630 HydrophobicContact CH2-CG1 4.29Å; W533-V630 HydrophobicContact CH2-CG2 4.01Å; W533-V630 HydrophobicContact CZ2-CG2 4.24Å
534	K	87.8	Confident	78.7	Confident	38 Å²	38	57.7 Å²	57.7	17%	0.165	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-39	176.9	-75.7	174.6	164.5	177	0	112.2	E530 T531 C538 T539 A614	E530-K534 HydrophobicContact CG-CD 4.15Å; E530-K534 WeakPolarHBondContact O-CB 3.41Å; E530-K534 WeakPolarHBondContact O-CG 3.47Å; E530-K534 PolarHBondContact O-N 2.88Å; E530-K534 VanDerWaalsContact OE1-CE 3.22Å; E530-K534 WeakPolarHBondContact OE1-CE 3.34Å; E530-K534 IonicContact OE1-NZ 3.71Å; E530-K534 PolarHBondContact OE1-NZ 2.91Å; T531-K534 PolarHBondContact O-N 3.4Å; K534-C538 PolarHBondContact O-N 3.03Å; K534-C538 VanDerWaalsContact O-N 3.12Å; K534-T539 PolarHBondContact O-N 3.18Å; K534-A614 HydrophobicContact CG-CB 4.03Å
535	A	84.7	Confident	77	Confident	26 Å²	26	56.1 Å²	56.1	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-70.9	-34.1	177.7	0	0	0	0	0	113.5	T531 W533 V542 S545	T531-A535 WeakPolarHBondContact O-CB 3.44Å; T531-A535 PolarHBondContact O-N 3.46Å; W533-A535 VanDerWaalsContact C-N 3.3Å; W533-A535 PolarHBondContact O-N 3.28Å; A535-V542 HydrophobicContact CB-CG1 4.29Å; A535-V542 HydrophobicContact CB-CG2 4.19Å; A535-S545 PolarHBondContact O-OG 2.94Å; A535-S545 VanDerWaalsContact O-OG 3.12Å
536	F	88.5	Confident	75.4	Confident	13 Å²	13	60.3 Å²	60.3	6%	0.057	30%	0.299	C	S	.	.	H	α-helix	trans	-75	-52.1	175.6	-175.9	-93.8	0	0	0	111.7	F506 L509 Y510 V532 W533 C538 L547	F506-F536 HydrophobicContact CD2-CZ 4.28Å; F506-F536 HydrophobicContact CE2-CE1 4.15Å; F506-F536 AromaticContact CE2-CZ 3.81Å; F506-F536 HydrophobicContact CE2-CZ 3.81Å; F506-F536 HydrophobicContact CZ-CZ 4.48Å; L509-F536 HydrophobicContact CB-CE2 4.15Å; Y510-F536 AromaticContact CD2-CE1 3.85Å; Y510-F536 HydrophobicContact CD2-CE1 3.85Å; Y510-F536 AromaticContact CD2-CZ 3.69Å; Y510-F536 HydrophobicContact CD2-CZ 3.69Å; Y510-F536 HydrophobicContact CE2-CE1 4.23Å; Y510-F536 HydrophobicContact CG-CZ 4.43Å; V532-F536 WeakPolarHBondContact O-CB 3.22Å; V532-F536 PolarHBondContact O-N 2.57Å; W533-F536 PolarHBondContact O-N 3.37Å; F536-C538 PolarHBondContact O-N 2.66Å; F536-C538 VanDerWaalsContact O-N 3.14Å; F536-C538 PolarHBondContact O-SG 2.68Å; F536-C538 VanDerWaalsContact O-SG 3.39Å; F536-L547 HydrophobicContact CD2-CD2 4.21Å; F536-L547 HydrophobicContact CE2-CD2 4.19Å; F536-L547 WeakPolarHBondContact O-CD2 3.32Å
537	W	87.3	Confident	73.9	Confident	2 Å²	2	60 Å²	60	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-75.6	-0.3	-179.3	-66.6	116.7	0	0	0	114.3	Y510 W533 T539 L556 V560 I569 A614 I615 L618 L622	Y510-W537 HydrophobicContact CE2-CH2 4.39Å; Y510-W537 HydrophobicContact CE2-CZ2 4.13Å; W533-W537 PolarHBondContact O-N 2.99Å; W537-T539 VanDerWaalsContact C-N 3.26Å; W537-T539 PolarHBondContact O-N 3.19Å; W537-L556 HydrophobicContact CE3-CD2 4.45Å; W537-L556 HydrophobicContact CZ3-CD1 4.4Å; W537-V560 HydrophobicContact CZ3-CG2 4.19Å; W537-I569 HydrophobicContact CH2-CD1 4.35Å; W537-A614 WeakPolarHBondContact CB-O 3.31Å; W537-I615 HydrophobicContact CD2-CG2 4.4Å; W537-I615 HydrophobicContact CG-CG2 4.09Å; W537-L618 HydrophobicContact CB-CD1 4.23Å; W537-L618 HydrophobicContact CD2-CD1 3.77Å; W537-L618 HydrophobicContact CE3-CD1 3.45Å; W537-L618 VanDerWaalsContact CE3-CD1 3.45Å; W537-L618 HydrophobicContact CG-CD1 4.11Å; W537-L618 HydrophobicContact CZ3-CD1 4.11Å; W537-L622 HydrophobicContact CH2-CD1 4.11Å; W537-L622 HydrophobicContact CH2-CD2 4.04Å; W537-L622 HydrophobicContact CZ3-CD2 4Å
538	C	70.6	Confident	72.4	Confident	8 Å²	8	59.3 Å²	59.3	5%	0.054	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	24.9	171.6	-64.8	0	0	0	0	115	K534 F536 E540 K548	K534-C538 PolarHBondContact O-N 3.03Å; K534-C538 VanDerWaalsContact O-N 3.12Å; F536-C538 PolarHBondContact O-N 2.66Å; F536-C538 VanDerWaalsContact O-N 3.14Å; F536-C538 PolarHBondContact O-SG 2.68Å; F536-C538 VanDerWaalsContact O-SG 3.39Å; C538-E540 PolarHBondContact O-N 2.86Å; C538-K548 VanDerWaalsContact SG-CE 3.53Å
539	T	58.4	Low	71.1	Confident	48 Å²	48	64.4 Å²	64.4	29%	0.294	31%	0.306	S	S	.	.			trans	-70.2	-11	179	51.9	0	0	0	0	114.3	K534 W537 A614	K534-T539 PolarHBondContact O-N 3.18Å; W537-T539 VanDerWaalsContact C-N 3.26Å; W537-T539 PolarHBondContact O-N 3.19Å; T539-A614 WeakPolarHBondContact CG2-O 3.25Å
540	E	54.9	Low	70	Confident	109 Å²	109	67 Å²	67	51%	0.509	32%	0.324	S	S	.	.	S	Bend	trans	-128.3	163.1	173.5	-86.8	-177.9	106.8	0	0	112.7	C538 V542 K548	C538-E540 PolarHBondContact O-N 2.86Å; E540-V542 HydrophobicContact CB-CG2 4.28Å; E540-V542 PolarHBondContact O-N 3.25Å; E540-K548 PolarHBondContact O-NZ 3.45Å
541	E	49.1	Very low	69.2	Low	186 Å²	186	65.4 Å²	65.4	87%	0.869	32%	0.317	S	S	*	.			trans	-75.3	50.4	171.4	-65.1	-160.9	153.4	0	0	112.4	R543	E541-R543 PolarHBondContact O-N 3.42Å
542	V	51.9	Low	68.6	Low	54 Å²	54	63.4 Å²	63.4	33%	0.327	31%	0.307	S	S	.	.			trans	-60.2	110	165.5	-177.2	0	0	0	0	107.6	A535 E540 D544	A535-V542 HydrophobicContact CB-CG1 4.29Å; A535-V542 HydrophobicContact CB-CG2 4.19Å; E540-V542 HydrophobicContact CB-CG2 4.28Å; E540-V542 PolarHBondContact O-N 3.25Å; V542-D544 PolarHBondContact O-N 3.06Å
543	R	45.7	Very low	67.9	Low	234 Å²	234	66 Å²	66	88%	0.883	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.1	-168	-73.9	175.2	-81.8	-172.3	-4.4	113.6	E541	E541-R543 PolarHBondContact O-N 3.42Å
544	D	49	Very low	67.2	Low	77 Å²	77	73.5 Å²	73.5	41%	0.412	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	34	-172.9	-65.2	-75.7	0	0	0	113.5	I431 V542 R546	I431-D544 WeakPolarHBondContact CD1-OD1 3.03Å; V542-D544 PolarHBondContact O-N 3.06Å; D544-R546 PolarHBondContact O-N 2.95Å
545	S	55.3	Low	66.9	Low	10 Å²	10	77.6 Å²	77.6	7%	0.07	37%	0.367	C	S	.	.			trans	-59.4	100.9	165.9	-68.1	0	0	0	0	109.9	A535 L547 K548	A535-S545 PolarHBondContact O-OG 2.94Å; A535-S545 VanDerWaalsContact O-OG 3.12Å; S545-L547 PolarHBondContact O-N 2.93Å; S545-K548 PolarHBondContact O-N 3.35Å
546	R	61.1	Low	66.9	Low	151 Å²	151	76.4 Å²	76.4	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-47.6	-33.8	170.6	-74.7	-177.2	171	-159.5	-7.4	111.9	D544 Q549 S550	D544-R546 PolarHBondContact O-N 2.95Å; R546-Q549 PolarHBondContact O-N 3.32Å; R546-S550 PolarHBondContact O-N 3.46Å; R546-S550 PolarHBondContact O-OG 3.15Å
547	L	61.7	Low	66.6	Low	9 Å²	9	79.7 Å²	79.7	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-56.3	-52	172	-174	66.2	0	0	0	112.5	L509 F536 S545 Q549 S550 L551 L556	L509-L547 HydrophobicContact CB-CD1 4.23Å; L509-L547 HydrophobicContact CD1-CD1 3.47Å; L509-L547 VanDerWaalsContact CD1-CD1 3.47Å; L509-L547 HydrophobicContact CG-CD1 4.46Å; F536-L547 HydrophobicContact CD2-CD2 4.21Å; F536-L547 HydrophobicContact CE2-CD2 4.19Å; F536-L547 WeakPolarHBondContact O-CD2 3.32Å; S545-L547 PolarHBondContact O-N 2.93Å; L547-Q549 PolarHBondContact O-N 3.49Å; L547-Q549 VanDerWaalsContact O-N 3.07Å; L547-S550 PolarHBondContact O-N 2.93Å; L547-S550 PolarHBondContact O-OG 3.14Å; L547-S550 VanDerWaalsContact O-OG 3.06Å; L547-L551 HydrophobicContact CD1-CB 3.97Å; L547-L551 HydrophobicContact CD1-CD1 3.79Å; L547-L551 HydrophobicContact CD1-CG 4.44Å; L547-L551 CarbonylContact O-C 3.58Å; L547-L551 PolarHBondContact O-N 2.87Å; L547-L556 HydrophobicContact CD2-CD1 4.33Å; L547-L556 HydrophobicContact CD2-CD2 3.95Å
548	K	61.2	Low	66.5	Low	79 Å²	79	84.2 Å²	84.2	34%	0.343	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-21.9	179.1	-66.8	179.5	-175.4	170.3	0	113.6	C538 E540 S545 L551	C538-K548 VanDerWaalsContact SG-CE 3.53Å; E540-K548 PolarHBondContact O-NZ 3.45Å; S545-K548 PolarHBondContact O-N 3.35Å; K548-L551 WeakPolarHBondContact CA-O 3.32Å
549	Q	65.1	Low	67.3	Low	150 Å²	150	84.5 Å²	84.5	70%	0.701	40%	0.402	S	S	*	.	H	α-helix	trans	-84	-20.6	176.2	-58.5	-178.5	5.6	0	0	113.3	R546 L547	R546-Q549 PolarHBondContact O-N 3.32Å; L547-Q549 PolarHBondContact O-N 3.49Å; L547-Q549 VanDerWaalsContact O-N 3.07Å
550	S	72	Confident	68.7	Low	57 Å²	57	82.4 Å²	82.4	40%	0.399	39%	0.389	S	S	.	.	H	α-helix	trans	-112.9	-31.8	-174.1	48.6	0	0	0	0	113.6	L509 R546 L547	L509-S550 VanDerWaalsContact CD1-OG 3.24Å; L509-S550 WeakPolarHBondContact CD1-OG 3.44Å; R546-S550 PolarHBondContact O-N 3.46Å; R546-S550 PolarHBondContact O-OG 3.15Å; L547-S550 PolarHBondContact O-N 2.93Å; L547-S550 PolarHBondContact O-OG 3.14Å; L547-S550 VanDerWaalsContact O-OG 3.06Å
551	L	76	Confident	70.2	Confident	3 Å²	3	80.5 Å²	80.5	2%	0.016	39%	0.388	C	S	.	.	S	Bend	trans	-135.2	126.8	176.6	-80	166.6	0	0	0	109	D502 T505 F506 L547 K548 R555 L559	D502-L551 HydrophobicContact CB-CD2 3.83Å; D502-L551 WeakPolarHBondContact OD1-CD2 3.23Å; T505-L551 HydrophobicContact CG2-CD1 3.9Å; T505-L551 HydrophobicContact CG2-CG 3.93Å; F506-L551 HydrophobicContact CB-CD1 3.91Å; L547-L551 HydrophobicContact CD1-CB 3.97Å; L547-L551 HydrophobicContact CD1-CD1 3.79Å; L547-L551 HydrophobicContact CD1-CG 4.44Å; L547-L551 CarbonylContact O-C 3.58Å; L547-L551 PolarHBondContact O-N 2.87Å; K548-L551 WeakPolarHBondContact CA-O 3.32Å; L551-R555 HydrophobicContact CD2-CB 4.06Å; L551-L559 HydrophobicContact CD1-CD1 4.36Å; L551-L559 HydrophobicContact CD2-CD1 4.1Å
552	S	76.3	Confident	72.1	Confident	47 Å²	47	74.7 Å²	74.7	33%	0.329	36%	0.363	S	S	.	.			trans	-68.6	153.5	170.3	66.2	0	0	0	0	110.6	E554 R555 L556	S552-E554 PolarHBondContact O-N 2.93Å; S552-R555 WeakPolarHBondContact O-CA 3.29Å; S552-R555 WeakPolarHBondContact O-CB 3.38Å; S552-R555 PolarHBondContact O-N 2.86Å; S552-R555 WeakPolarHBondContact OG-CG 3.44Å; S552-R555 PolarHBondContact OG-N 3.02Å; S552-L556 PolarHBondContact O-N 2.71Å
553	Q	77	Confident	74	Confident	80 Å²	80	76.9 Å²	76.9	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-56.8	-36.5	176.9	-171.3	168.4	2	0	0	111.9	R555 L556 Y557	Q553-R555 PolarHBondContact O-N 3.34Å; Q553-L556 WeakPolarHBondContact O-CB 3.5Å; Q553-L556 PolarHBondContact O-N 3Å; Q553-Y557 HydrophobicContact CG-CD1 4.26Å; Q553-Y557 HydrophobicContact CG-CE1 3.64Å; Q553-Y557 HydrophobicContact CG-CE2 4.27Å; Q553-Y557 PolarHBondContact NE2-OH 3.14Å; Q553-Y557 WeakPolarHBondContact O-CD1 3.42Å; Q553-Y557 VanDerWaalsContact O-CG 3.28Å; Q553-Y557 PolarHBondContact O-N 2.95Å
554	E	77	Confident	76.2	Confident	162 Å²	162	67 Å²	67	76%	0.757	35%	0.347	S	S	*	.	H	α-helix	trans	-60.2	-42.5	172.2	-59.8	171.4	161.3	0	0	112.7	S552 S558	S552-E554 PolarHBondContact O-N 2.93Å; E554-S558 WeakPolarHBondContact O-CB 3.27Å; E554-S558 PolarHBondContact O-N 2.9Å
555	R	82.1	Confident	78.3	Confident	124 Å²	124	63.4 Å²	63.4	47%	0.468	33%	0.327	S	S	.	.	H	α-helix	trans	-69.3	-43.8	175.9	-75.6	-176.5	-179.1	-160.4	-1.5	111.7	D502 L551 S552 Q553 Y557 S558 L559	D502-R555 IonicContact OD1-CZ 3.01Å; D502-R555 IonicContact OD1-NH1 2.7Å; D502-R555 PolarHBondContact OD1-NH1 2.75Å; D502-R555 IonicContact OD2-CZ 3.34Å; D502-R555 IonicContact OD2-NE 2.72Å; D502-R555 IonicContact OD2-NH1 2.94Å; D502-R555 PolarHBondContact OD2-NH1 2.82Å; L551-R555 HydrophobicContact CD2-CB 4.06Å; S552-R555 WeakPolarHBondContact O-CA 3.29Å; S552-R555 WeakPolarHBondContact O-CB 3.38Å; S552-R555 PolarHBondContact O-N 2.86Å; S552-R555 WeakPolarHBondContact OG-CG 3.44Å; S552-R555 PolarHBondContact OG-N 3.02Å; Q553-R555 PolarHBondContact O-N 3.34Å; R555-Y557 VanDerWaalsContact C-N 3.26Å; R555-Y557 PolarHBondContact O-N 3.3Å; R555-S558 PolarHBondContact O-N 3.13Å; R555-L559 WeakPolarHBondContact O-CB 3.28Å; R555-L559 VanDerWaalsContact O-CG 3.29Å; R555-L559 WeakPolarHBondContact O-CG 3.26Å; R555-L559 PolarHBondContact O-N 3.09Å
556	L	84.3	Confident	80.1	Confident	1 Å²	1	64 Å²	64	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-52.9	-48	174	177.4	67.2	0	0	0	110.5	F506 W537 L547 S552 Q553 L559 V560	F506-L556 HydrophobicContact CD2-CD1 3.68Å; F506-L556 HydrophobicContact CE2-CD1 3.63Å; W537-L556 HydrophobicContact CE3-CD2 4.45Å; W537-L556 HydrophobicContact CZ3-CD1 4.4Å; L547-L556 HydrophobicContact CD2-CD1 4.33Å; L547-L556 HydrophobicContact CD2-CD2 3.95Å; S552-L556 PolarHBondContact O-N 2.71Å; Q553-L556 WeakPolarHBondContact O-CB 3.5Å; Q553-L556 PolarHBondContact O-N 3Å; L556-L559 PolarHBondContact O-N 3.06Å; L556-V560 HydrophobicContact CD1-CG2 4.38Å; L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 3.48Å; L556-V560 VanDerWaalsContact O-N 3.17Å
557	Y	83.2	Confident	81.7	Confident	83 Å²	83	60.5 Å²	60.5	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-68	-42.1	-179.2	-67.9	11.8	0	0	0	111.1	Q553 R555 L559 V560 S561 L618	Q553-Y557 HydrophobicContact CG-CD1 4.26Å; Q553-Y557 HydrophobicContact CG-CE1 3.64Å; Q553-Y557 HydrophobicContact CG-CE2 4.27Å; Q553-Y557 PolarHBondContact NE2-OH 3.14Å; Q553-Y557 WeakPolarHBondContact O-CD1 3.42Å; Q553-Y557 VanDerWaalsContact O-CG 3.28Å; Q553-Y557 PolarHBondContact O-N 2.95Å; R555-Y557 VanDerWaalsContact C-N 3.26Å; R555-Y557 PolarHBondContact O-N 3.3Å; Y557-L559 VanDerWaalsContact C-N 3.33Å; Y557-L559 PolarHBondContact O-N 2.88Å; Y557-V560 PolarHBondContact O-N 3.37Å; Y557-S561 PolarHBondContact O-N 3.31Å; Y557-L618 HydrophobicContact CD1-CD2 3.8Å; Y557-L618 HydrophobicContact CE1-CD2 3.25Å; Y557-L618 HydrophobicContact CE2-CD2 4.23Å; Y557-L618 VanDerWaalsContact CZ-CD2 3.47Å
558	S	85	Confident	83.3	Confident	96 Å²	96	60 Å²	60	67%	0.671	32%	0.318	S	S	*	.	H	α-helix	trans	-65.8	-29.2	176.5	-174	0	0	0	0	114.3	E554 R555	E554-S558 WeakPolarHBondContact O-CB 3.27Å; E554-S558 PolarHBondContact O-N 2.9Å; R555-S558 PolarHBondContact O-N 3.13Å
559	L	87.3	Confident	84.9	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.073	30%	0.301	C	S	.	.	H	α-helix	trans	-73	-39.6	174.5	-74.8	172.6	0	0	0	111.2	D502 V503 F506 L551 R555 L556 Y557 S561 D562 I565	D502-L559 HydrophobicContact CB-CD1 4.26Å; D502-L559 HydrophobicContact CB-CD2 4.37Å; V503-L559 HydrophobicContact CG2-CD2 3.62Å; F506-L559 HydrophobicContact CB-CD1 3.87Å; F506-L559 HydrophobicContact CG-CD1 4.38Å; L551-L559 HydrophobicContact CD1-CD1 4.36Å; L551-L559 HydrophobicContact CD2-CD1 4.1Å; R555-L559 WeakPolarHBondContact O-CB 3.28Å; R555-L559 VanDerWaalsContact O-CG 3.29Å; R555-L559 WeakPolarHBondContact O-CG 3.26Å; R555-L559 PolarHBondContact O-N 3.09Å; L556-L559 PolarHBondContact O-N 3.06Å; Y557-L559 VanDerWaalsContact C-N 3.33Å; Y557-L559 PolarHBondContact O-N 2.88Å; L559-S561 VanDerWaalsContact C-N 3.29Å; L559-S561 PolarHBondContact O-N 3.49Å; L559-D562 VanDerWaalsContact O-CB 3.23Å; L559-D562 WeakPolarHBondContact O-CB 3.44Å; L559-D562 PolarHBondContact O-N 3.01Å; L559-I565 VanDerWaalsContact O-CB 3.31Å; L559-I565 WeakPolarHBondContact O-CB 3.41Å; L559-I565 WeakPolarHBondContact O-CG1 3.09Å
560	V	87.9	Confident	86.3	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.03	29%	0.285	C	S	.	.	H	α-helix	trans	-78.3	-13.2	-169.6	177	0	0	0	0	113.1	F506 W537 L556 Y557 D562 I565 L566 I569 L622	F506-V560 HydrophobicContact CE2-CG2 4.02Å; F506-V560 HydrophobicContact CZ-CG2 4.18Å; W537-V560 HydrophobicContact CZ3-CG2 4.19Å; L556-V560 HydrophobicContact CD1-CG2 4.38Å; L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 3.48Å; L556-V560 VanDerWaalsContact O-N 3.17Å; Y557-V560 PolarHBondContact O-N 3.37Å; V560-D562 VanDerWaalsContact C-N 3.3Å; V560-I565 HydrophobicContact CG2-CG2 4.23Å; V560-L566 HydrophobicContact CG1-CD2 4.25Å; V560-L566 VanDerWaalsContact O-CD2 3.27Å; V560-L566 WeakPolarHBondContact O-CD2 3.48Å; V560-L566 VanDerWaalsContact O-CG 3.29Å; V560-L566 WeakPolarHBondContact O-CG 3.49Å; V560-I569 HydrophobicContact CG1-CD1 4.1Å; V560-I569 HydrophobicContact CG2-CD1 4.37Å; V560-L622 HydrophobicContact CG1-CB 3.95Å; V560-L622 HydrophobicContact CG1-CD1 3.64Å; V560-L622 HydrophobicContact CG1-CD2 3.6Å; V560-L622 HydrophobicContact CG1-CG 3.89Å
561	S	86.9	Confident	87.3	Confident	68 Å²	68	53.1 Å²	53.1	48%	0.476	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	1.6	164.7	-61.3	0	0	0	0	114.2	Y557 L559 P563 D619	Y557-S561 PolarHBondContact O-N 3.31Å; L559-S561 VanDerWaalsContact C-N 3.29Å; L559-S561 PolarHBondContact O-N 3.49Å; S561-P563 WeakPolarHBondContact O-CD 3.23Å; S561-D619 PolarHBondContact OG-OD2 3.03Å
562	D	89.1	Confident	88.3	Confident	64 Å²	64	53.1 Å²	53.1	34%	0.342	28%	0.277	S	S	.	.	S	Bend	trans	-79.9	123	170.8	-173.4	-26.2	0	0	0	110.4	L559 V560 A564 I565 L566	L559-D562 VanDerWaalsContact O-CB 3.23Å; L559-D562 WeakPolarHBondContact O-CB 3.44Å; L559-D562 PolarHBondContact O-N 3.01Å; V560-D562 VanDerWaalsContact C-N 3.3Å; D562-A564 PolarHBondContact O-N 3.47Å; D562-A564 VanDerWaalsContact O-N 3.13Å; D562-A564 WeakPolarHBondContact OD1-CB 3.47Å; D562-A564 PolarHBondContact OD1-N 3.33Å; D562-I565 HydrophobicContact CB-CB 4.14Å; D562-I565 HydrophobicContact CB-CG1 3.89Å; D562-I565 PolarHBondContact O-N 3.45Å; D562-L566 PolarHBondContact O-N 3.22Å
563	P	91.1	Very high	89.2	Confident	100 Å²	100	51 Å²	51	65%	0.649	26%	0.262	S	S	*	.	H	α-helix	trans	-53.4	-30.6	175.4	-27.8	36.3	0	0	0	115	S561 Q567	S561-P563 WeakPolarHBondContact O-CD 3.23Å; P563-Q567 WeakPolarHBondContact O-CB 3.47Å; P563-Q567 PolarHBondContact O-N 2.97Å
564	A	91.4	Very high	90.1	Very high	28 Å²	28	47.8 Å²	47.8	23%	0.231	25%	0.247	C	C	.	.	H	α-helix	trans	-71.4	-35.4	176.2	0	0	0	0	0	112	L470 D562 Q567 F568	L470-A564 HydrophobicContact CD2-CB 3.64Å; D562-A564 PolarHBondContact O-N 3.47Å; D562-A564 VanDerWaalsContact O-N 3.13Å; D562-A564 WeakPolarHBondContact OD1-CB 3.47Å; D562-A564 PolarHBondContact OD1-N 3.33Å; A564-Q567 PolarHBondContact O-N 3.18Å; A564-F568 PolarHBondContact O-N 2.96Å
565	I	93.5	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-72.4	-40.3	173.8	-62.7	-70	0	0	0	110.6	L470 V503 F506 L559 V560 D562 Q567 F568 I569	L470-I565 HydrophobicContact CD1-CD1 3.79Å; L470-I565 HydrophobicContact CD2-CD1 4.03Å; V503-I565 HydrophobicContact CG1-CD1 3.98Å; V503-I565 HydrophobicContact CG2-CD1 4.12Å; F506-I565 HydrophobicContact CD1-CD1 4.24Å; F506-I565 HydrophobicContact CD1-CG2 4.18Å; F506-I565 HydrophobicContact CE1-CG2 3.68Å; F506-I565 HydrophobicContact CZ-CG2 4.13Å; L559-I565 VanDerWaalsContact O-CB 3.31Å; L559-I565 WeakPolarHBondContact O-CB 3.41Å; L559-I565 WeakPolarHBondContact O-CG1 3.09Å; V560-I565 HydrophobicContact CG2-CG2 4.23Å; D562-I565 HydrophobicContact CB-CB 4.14Å; D562-I565 HydrophobicContact CB-CG1 3.89Å; D562-I565 PolarHBondContact O-N 3.45Å; I565-Q567 VanDerWaalsContact C-N 3.32Å; I565-Q567 PolarHBondContact O-N 3.38Å; I565-F568 WeakPolarHBondContact O-CB 3.04Å; I565-F568 PolarHBondContact O-N 3.04Å; I565-I569 HydrophobicContact CG2-CD1 4Å; I565-I569 HydrophobicContact CG2-CG1 4.49Å; I565-I569 VanDerWaalsContact O-CG1 3.28Å; I565-I569 WeakPolarHBondContact O-CG1 3.44Å; I565-I569 PolarHBondContact O-N 2.95Å
566	L	93.9	Very high	91.6	Very high	23 Å²	23	36 Å²	36	12%	0.12	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-41.2	171.6	-68.6	173	0	0	0	111.5	V560 D562 F568 I569 R570 D621 L622 L625	V560-L566 HydrophobicContact CG1-CD2 4.25Å; V560-L566 VanDerWaalsContact O-CD2 3.27Å; V560-L566 WeakPolarHBondContact O-CD2 3.48Å; V560-L566 VanDerWaalsContact O-CG 3.29Å; V560-L566 WeakPolarHBondContact O-CG 3.49Å; D562-L566 PolarHBondContact O-N 3.22Å; L566-F568 VanDerWaalsContact C-N 3.35Å; L566-F568 PolarHBondContact O-N 2.88Å; L566-I569 PolarHBondContact O-N 3.11Å; L566-R570 WeakPolarHBondContact O-CB 3.16Å; L566-R570 PolarHBondContact O-N 3.22Å; L566-D621 HydrophobicContact CD1-CB 4.33Å; L566-L622 HydrophobicContact CD2-CB 4.08Å; L566-L622 HydrophobicContact CD2-CD1 4.2Å; L566-L625 HydrophobicContact CB-CD1 4.02Å; L566-L625 HydrophobicContact CD2-CD1 4.18Å; L566-L625 WeakPolarHBondContact O-CD1 3.48Å
567	Q	93.3	Very high	92.1	Very high	77 Å²	77	36 Å²	36	36%	0.36	20%	0.2	S	C	.	.	H	α-helix	trans	-67.2	-33.9	175.8	-174	59.4	15.9	0	0	112.8	P563 A564 I565 R570 L571	P563-Q567 WeakPolarHBondContact O-CB 3.47Å; P563-Q567 PolarHBondContact O-N 2.97Å; A564-Q567 PolarHBondContact O-N 3.18Å; I565-Q567 VanDerWaalsContact C-N 3.32Å; I565-Q567 PolarHBondContact O-N 3.38Å; Q567-R570 VanDerWaalsContact OE1-NE 3.16Å; Q567-L571 WeakPolarHBondContact O-CB 3.43Å; Q567-L571 PolarHBondContact O-N 3.33Å; Q567-L571 VanDerWaalsContact O-N 3.08Å
568	F	95.7	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-49.6	169.9	170.6	-88.8	0	0	0	112	L461 I464 S468 L470 F506 C507 Y510 A564 I565 L566 R570 L571 Y572	L461-F568 HydrophobicContact CD1-CE2 3.72Å; L461-F568 HydrophobicContact CD1-CZ 3.7Å; I464-F568 HydrophobicContact CG2-CD2 3.66Å; I464-F568 HydrophobicContact CG2-CE2 3.84Å; I464-F568 HydrophobicContact CG2-CG 4.5Å; S468-F568 WeakPolarHBondContact OG-CA 3.48Å; S468-F568 PolarHBondContact OG-N 2.95Å; L470-F568 HydrophobicContact CD1-CB 3.54Å; L470-F568 HydrophobicContact CD1-CD2 3.9Å; L470-F568 HydrophobicContact CD1-CG 3.81Å; F506-F568 HydrophobicContact CE1-CD1 4.03Å; F506-F568 HydrophobicContact CE1-CE1 4.08Å; C507-F568 HydrophobicContact CB-CE1 4.45Å; C507-F568 HydrophobicContact CB-CE2 4.12Å; C507-F568 HydrophobicContact CB-CZ 3.87Å; Y510-F568 AromaticContact CD1-CE1 3.89Å; Y510-F568 HydrophobicContact CD1-CE1 3.89Å; Y510-F568 HydrophobicContact CD1-CZ 4.45Å; Y510-F568 AromaticContact CG-CE1 3.91Å; Y510-F568 HydrophobicContact CG-CE1 3.91Å; A564-F568 PolarHBondContact O-N 2.96Å; I565-F568 WeakPolarHBondContact O-CB 3.04Å; I565-F568 PolarHBondContact O-N 3.04Å; L566-F568 VanDerWaalsContact C-N 3.35Å; L566-F568 PolarHBondContact O-N 2.88Å; F568-R570 VanDerWaalsContact C-N 3.31Å; F568-R570 PolarHBondContact O-N 3.39Å; F568-L571 PolarHBondContact O-N 3.14Å; F568-Y572 HydrophobicContact CE2-CD2 4.2Å; F568-Y572 AromaticContact CZ-CD2 3.87Å; F568-Y572 HydrophobicContact CZ-CD2 3.87Å; F568-Y572 HydrophobicContact CZ-CG 4.45Å; F568-Y572 VanDerWaalsContact O-CB 3.27Å; F568-Y572 WeakPolarHBondContact O-CB 3.4Å; F568-Y572 PolarHBondContact O-N 3.05Å
569	I	95.5	Very high	93.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-45.2	177.5	-68.4	168.5	0	0	0	110.3	F506 Y510 W537 V560 I565 L566 D573 L622 L625 K626	F506-I569 HydrophobicContact CE1-CD1 4.4Å; F506-I569 HydrophobicContact CE1-CG1 4.26Å; F506-I569 HydrophobicContact CZ-CD1 3.94Å; F506-I569 HydrophobicContact CZ-CG1 4.11Å; Y510-I569 HydrophobicContact CE2-CG1 4Å; W537-I569 HydrophobicContact CH2-CD1 4.35Å; V560-I569 HydrophobicContact CG1-CD1 4.1Å; V560-I569 HydrophobicContact CG2-CD1 4.37Å; I565-I569 HydrophobicContact CG2-CD1 4Å; I565-I569 HydrophobicContact CG2-CG1 4.49Å; I565-I569 VanDerWaalsContact O-CG1 3.28Å; I565-I569 WeakPolarHBondContact O-CG1 3.44Å; I565-I569 PolarHBondContact O-N 2.95Å; L566-I569 PolarHBondContact O-N 3.11Å; I569-D573 WeakPolarHBondContact O-CB 3.49Å; I569-D573 PolarHBondContact O-N 2.97Å; I569-L622 HydrophobicContact CD1-CD1 3.71Å; I569-L622 HydrophobicContact CG2-CD1 4.17Å; I569-L625 HydrophobicContact CB-CD2 4.38Å; I569-L625 HydrophobicContact CG2-CD2 3.64Å; I569-K626 HydrophobicContact CG2-CD 4.29Å
570	R	94.6	Very high	93.6	Very high	94 Å²	94	28.2 Å²	28.2	36%	0.355	16%	0.158	S	C	.	.	H	α-helix	trans	-57.2	-54.4	177	-175.3	-162.7	-64.6	-110.3	1.5	111.8	L566 Q567 F568 H574 L625 E798	L566-R570 WeakPolarHBondContact O-CB 3.16Å; L566-R570 PolarHBondContact O-N 3.22Å; Q567-R570 VanDerWaalsContact OE1-NE 3.16Å; F568-R570 VanDerWaalsContact C-N 3.31Å; F568-R570 PolarHBondContact O-N 3.39Å; R570-H574 VanDerWaalsContact O-CB 3.31Å; R570-H574 WeakPolarHBondContact O-CB 3.41Å; R570-H574 VanDerWaalsContact O-CG 3.28Å; R570-H574 PolarHBondContact O-N 3.41Å; R570-L625 HydrophobicContact CB-CD1 4.19Å; R570-L625 HydrophobicContact CB-CD2 4.18Å; R570-L625 HydrophobicContact CB-CG 4.33Å; R570-E798 WeakPolarHBondContact CD-OE1 3.41Å; R570-E798 IonicContact CZ-OE1 2.83Å; R570-E798 IonicContact NE-OE1 2.67Å; R570-E798 IonicContact NH1-OE1 3.23Å; R570-E798 PolarHBondContact NH1-OE1 3.42Å
571	L	93.2	Very high	93.9	Very high	47 Å²	47	28 Å²	28	25%	0.246	16%	0.156	C	C	.	.	H	α-helix	trans	-67.9	-41.9	-175.8	-177.4	56.4	0	0	0	111.2	I464 Q567 F568 H574 T575	I464-L571 HydrophobicContact CB-CD2 4.42Å; I464-L571 HydrophobicContact CD1-CG 4.14Å; I464-L571 HydrophobicContact CG1-CD2 4.22Å; I464-L571 HydrophobicContact CG1-CG 4.13Å; I464-L571 HydrophobicContact CG2-CB 4.17Å; I464-L571 HydrophobicContact CG2-CD2 4.05Å; I464-L571 HydrophobicContact CG2-CG 4.04Å; Q567-L571 WeakPolarHBondContact O-CB 3.43Å; Q567-L571 PolarHBondContact O-N 3.33Å; Q567-L571 VanDerWaalsContact O-N 3.08Å; F568-L571 PolarHBondContact O-N 3.14Å; L571-H574 PolarHBondContact O-N 2.88Å; L571-T575 PolarHBondContact O-N 2.84Å; L571-T575 PolarHBondContact O-OG1 3.09Å; L571-T575 VanDerWaalsContact O-OG1 3.07Å
572	Y	95.6	Very high	94.2	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-47.9	178.3	-157.7	-74.3	0	0	0	112	P459 L461 I464 Y510 A511 A514 F568 T575 F576	P459-Y572 HydrophobicContact CB-CD2 4.27Å; P459-Y572 HydrophobicContact CB-CE1 4.46Å; P459-Y572 HydrophobicContact CB-CE2 3.94Å; P459-Y572 HydrophobicContact CG-CD1 4.17Å; P459-Y572 HydrophobicContact CG-CE1 3.87Å; P459-Y572 HydrophobicContact CG-CE2 4.24Å; P459-Y572 HydrophobicContact CG-CG 4.49Å; L461-Y572 HydrophobicContact CD1-CD2 4.4Å; L461-Y572 HydrophobicContact CD1-CE2 4.01Å; I464-Y572 HydrophobicContact CD1-CD2 3.97Å; I464-Y572 HydrophobicContact CD1-CG 4.36Å; I464-Y572 HydrophobicContact CG2-CD2 4.28Å; Y510-Y572 AromaticContact CD1-CD1 3.77Å; Y510-Y572 HydrophobicContact CD1-CD1 3.77Å; Y510-Y572 HydrophobicContact CD1-CD2 4.48Å; Y510-Y572 HydrophobicContact CD1-CE1 4.25Å; Y510-Y572 AromaticContact CD1-CG 3.91Å; Y510-Y572 HydrophobicContact CD1-CG 3.91Å; Y510-Y572 AromaticContact CE1-CD1 3.63Å; Y510-Y572 HydrophobicContact CE1-CD1 3.63Å; Y510-Y572 HydrophobicContact CE1-CE1 4.42Å; Y510-Y572 AromaticContact CE1-CG 3.91Å; Y510-Y572 HydrophobicContact CE1-CG 3.91Å; A511-Y572 WeakPolarHBondContact CA-OH 3.41Å; A511-Y572 HydrophobicContact CB-CE2 4.2Å; A511-Y572 WeakPolarHBondContact CB-OH 3.39Å; A514-Y572 HydrophobicContact CB-CE1 3.7Å; F568-Y572 HydrophobicContact CE2-CD2 4.2Å; F568-Y572 AromaticContact CZ-CD2 3.87Å; F568-Y572 HydrophobicContact CZ-CD2 3.87Å; F568-Y572 HydrophobicContact CZ-CG 4.45Å; F568-Y572 VanDerWaalsContact O-CB 3.27Å; F568-Y572 WeakPolarHBondContact O-CB 3.4Å; F568-Y572 PolarHBondContact O-N 3.05Å; Y572-T575 PolarHBondContact O-N 3.47Å; Y572-F576 HydrophobicContact CD1-CB 4.22Å; Y572-F576 HydrophobicContact CE1-CB 4.2Å; Y572-F576 WeakPolarHBondContact O-CB 3.35Å; Y572-F576 PolarHBondContact O-N 3.4Å
573	D	96.3	Very high	94.4	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.7	-46.2	177	-86.8	19.1	0	0	0	111.8	Y510 I569 T575 F576 Y577 K626 A629	Y510-D573 PolarHBondContact OH-OD1 3.44Å; I569-D573 WeakPolarHBondContact O-CB 3.49Å; I569-D573 PolarHBondContact O-N 2.97Å; D573-T575 VanDerWaalsContact C-N 3.3Å; D573-T575 PolarHBondContact O-N 3.42Å; D573-F576 PolarHBondContact O-N 2.92Å; D573-Y577 HydrophobicContact CB-CD2 3.98Å; D573-Y577 HydrophobicContact CB-CE2 3.63Å; D573-Y577 WeakPolarHBondContact O-CB 3.27Å; D573-Y577 WeakPolarHBondContact O-CD2 3.41Å; D573-Y577 PolarHBondContact O-N 2.95Å; D573-Y577 WeakPolarHBondContact OD2-CE2 3.29Å; D573-Y577 PolarHBondContact OD2-OH 3.35Å; D573-K626 IonicContact OD1-NZ 2.7Å; D573-K626 PolarHBondContact OD1-NZ 2.87Å; D573-K626 WeakPolarHBondContact OD2-CD 3.23Å; D573-K626 WeakPolarHBondContact OD2-CE 3.31Å; D573-K626 IonicContact OD2-NZ 2.89Å; D573-K626 PolarHBondContact OD2-NZ 3.31Å; D573-A629 HydrophobicContact CB-CB 3.99Å
574	H	94.8	Very high	94.6	Very high	13 Å²	13	21.8 Å²	21.8	6%	0.06	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-31.4	-180	-75.9	169.8	0	0	0	113.6	R570 L571 Q578 T791 A794 E798	R570-H574 VanDerWaalsContact O-CB 3.31Å; R570-H574 WeakPolarHBondContact O-CB 3.41Å; R570-H574 VanDerWaalsContact O-CG 3.28Å; R570-H574 PolarHBondContact O-N 3.41Å; L571-H574 PolarHBondContact O-N 2.88Å; H574-Q578 WeakPolarHBondContact O-CB 3.4Å; H574-T791 WeakPolarHBondContact O-CG2 3.48Å; H574-T791 PolarHBondContact O-OG1 3.33Å; H574-A794 HydrophobicContact CB-CB 3.97Å; H574-A794 WeakPolarHBondContact ND1-CB 3.32Å; H574-E798 IonicContact CE1-OE1 3.87Å; H574-E798 PolarHBondContact CE1-OE1 2.9Å; H574-E798 IonicContact ND1-OE1 3.91Å
575	T	94	Very high	94.8	Very high	40 Å²	40	20.9 Å²	20.9	25%	0.245	10%	0.101	C	C	.	.	H	α-helix	trans	-77.6	-48.1	171.6	-52.4	0	0	0	0	111.5	P459 L571 Y572 D573 Y577 Q578 S579	P459-T575 HydrophobicContact CB-CG2 3.88Å; P459-T575 HydrophobicContact CG-CG2 3.82Å; L571-T575 PolarHBondContact O-N 2.84Å; L571-T575 PolarHBondContact O-OG1 3.09Å; L571-T575 VanDerWaalsContact O-OG1 3.07Å; Y572-T575 PolarHBondContact O-N 3.47Å; D573-T575 VanDerWaalsContact C-N 3.3Å; D573-T575 PolarHBondContact O-N 3.42Å; T575-Y577 PolarHBondContact O-N 3.34Å; T575-Q578 WeakPolarHBondContact O-CB 3.49Å; T575-Q578 PolarHBondContact O-N 3.38Å; T575-S579 PolarHBondContact O-N 3.3Å; T575-S579 VanDerWaalsContact O-N 3.1Å; T575-S579 PolarHBondContact O-OG 3Å
576	F	96.4	Very high	94.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.3	-44.9	-177.4	178.2	-122.9	0	0	0	112.5	L458 P459 A514 M517 L518 Y572 D573 Q578 S579 L580	L458-F576 HydrophobicContact CD2-CD2 4.24Å; L458-F576 HydrophobicContact CD2-CE2 3.87Å; P459-F576 HydrophobicContact CG-CB 3.78Å; A514-F576 HydrophobicContact CB-CD1 4.13Å; A514-F576 HydrophobicContact CB-CD2 4.09Å; A514-F576 HydrophobicContact CB-CE1 3.99Å; A514-F576 HydrophobicContact CB-CE2 3.94Å; A514-F576 HydrophobicContact CB-CG 4.19Å; A514-F576 HydrophobicContact CB-CZ 3.89Å; A514-F576 VanDerWaalsContact O-CZ 3.31Å; A514-F576 WeakPolarHBondContact O-CZ 3.34Å; M517-F576 HydrophobicContact CB-CE1 3.92Å; M517-F576 HydrophobicContact CB-CZ 3.73Å; M517-F576 HydrophobicContact CE-CD1 4.37Å; M517-F576 HydrophobicContact CE-CE1 3.76Å; M517-F576 HydrophobicContact SD-CE1 3.87Å; L518-F576 HydrophobicContact CB-CE2 4.19Å; L518-F576 HydrophobicContact CB-CZ 4.4Å; Y572-F576 HydrophobicContact CD1-CB 4.22Å; Y572-F576 HydrophobicContact CE1-CB 4.2Å; Y572-F576 WeakPolarHBondContact O-CB 3.35Å; Y572-F576 PolarHBondContact O-N 3.4Å; D573-F576 PolarHBondContact O-N 2.92Å; F576-Q578 VanDerWaalsContact C-N 3.33Å; F576-Q578 PolarHBondContact O-N 3.19Å; F576-S579 CarbonylContact O-C 3.55Å; F576-S579 WeakPolarHBondContact O-CB 3.31Å; F576-S579 PolarHBondContact O-N 3.24Å; F576-S579 VanDerWaalsContact O-N 3.15Å; F576-L580 HydrophobicContact CD1-CD1 4.3Å; F576-L580 HydrophobicContact CD2-CG 4.45Å; F576-L580 HydrophobicContact CE1-CD1 3.69Å; F576-L580 HydrophobicContact CE1-CD2 4.47Å; F576-L580 HydrophobicContact CE1-CG 4.11Å; F576-L580 HydrophobicContact CE2-CD1 4.46Å; F576-L580 HydrophobicContact CE2-CD2 3.82Å; F576-L580 HydrophobicContact CE2-CG 4.03Å; F576-L580 HydrophobicContact CZ-CD1 3.79Å; F576-L580 HydrophobicContact CZ-CD2 3.74Å; F576-L580 HydrophobicContact CZ-CG 3.85Å; F576-L580 PolarHBondContact O-N 3.11Å
577	Y	96.7	Very high	94.6	Very high	1 Å²	1	26.5 Å²	26.5	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-68.7	-30.9	179.3	-63.8	-20.4	0	0	0	112.6	D573 T575 L580 A581 K626 A629 V630 L633	D573-Y577 HydrophobicContact CB-CD2 3.98Å; D573-Y577 HydrophobicContact CB-CE2 3.63Å; D573-Y577 WeakPolarHBondContact O-CB 3.27Å; D573-Y577 WeakPolarHBondContact O-CD2 3.41Å; D573-Y577 PolarHBondContact O-N 2.95Å; D573-Y577 WeakPolarHBondContact OD2-CE2 3.29Å; D573-Y577 PolarHBondContact OD2-OH 3.35Å; T575-Y577 PolarHBondContact O-N 3.34Å; Y577-L580 HydrophobicContact CD1-CD1 4.19Å; Y577-L580 PolarHBondContact O-N 3.19Å; Y577-A581 PolarHBondContact O-N 3.35Å; Y577-K626 PolarHBondContact OH-NZ 3.5Å; Y577-A629 HydrophobicContact CD2-CB 3.96Å; Y577-A629 HydrophobicContact CE2-CB 3.77Å; Y577-V630 HydrophobicContact CE2-CG2 3.77Å; Y577-L633 HydrophobicContact CD1-CD2 3.79Å; Y577-L633 HydrophobicContact CD2-CB 4.33Å; Y577-L633 HydrophobicContact CD2-CD2 4.49Å; Y577-L633 HydrophobicContact CE1-CD2 4.43Å; Y577-L633 HydrophobicContact CG-CB 4.23Å; Y577-L633 HydrophobicContact CG-CD2 3.83Å; Y577-L633 WeakPolarHBondContact O-CD1 3.29Å
578	Q	95	Very high	94.7	Very high	8 Å²	8	23 Å²	23	4%	0.037	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-48.6	168.2	-178.8	65.1	35.8	0	0	110.5	H574 T575 F576 L580 A581 E582 T791 P792 V793	H574-Q578 WeakPolarHBondContact O-CB 3.4Å; T575-Q578 WeakPolarHBondContact O-CB 3.49Å; T575-Q578 PolarHBondContact O-N 3.38Å; F576-Q578 VanDerWaalsContact C-N 3.33Å; F576-Q578 PolarHBondContact O-N 3.19Å; Q578-L580 VanDerWaalsContact C-N 3.34Å; Q578-L580 PolarHBondContact O-N 2.85Å; Q578-A581 WeakPolarHBondContact O-CB 3.29Å; Q578-A581 PolarHBondContact O-N 3.37Å; Q578-A581 VanDerWaalsContact O-N 3.11Å; Q578-E582 WeakPolarHBondContact CG-OE1 3.49Å; Q578-E582 PolarHBondContact NE2-OE1 3.41Å; Q578-E582 PolarHBondContact O-N 3.43Å; Q578-T791 HydrophobicContact CB-CG2 3.86Å; Q578-T791 HydrophobicContact CG-CG2 4.04Å; Q578-P792 VanDerWaalsContact OE1-CD 3.28Å; Q578-V793 HydrophobicContact CB-CG2 4.43Å
579	S	94.4	Very high	94.8	Very high	18 Å²	18	23.6 Å²	23.6	13%	0.126	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-36.2	177.7	-59	0	0	0	0	113.1	A457 T575 F576 E582 V583	A457-S579 VanDerWaalsContact O-CB 3.29Å; A457-S579 WeakPolarHBondContact O-CB 3.43Å; T575-S579 PolarHBondContact O-N 3.3Å; T575-S579 VanDerWaalsContact O-N 3.1Å; T575-S579 PolarHBondContact O-OG 3Å; F576-S579 CarbonylContact O-C 3.55Å; F576-S579 WeakPolarHBondContact O-CB 3.31Å; F576-S579 PolarHBondContact O-N 3.24Å; F576-S579 VanDerWaalsContact O-N 3.15Å; S579-E582 PolarHBondContact O-N 2.85Å; S579-V583 WeakPolarHBondContact O-CG2 3.3Å; S579-V583 PolarHBondContact O-N 3.28Å
580	L	95.9	Very high	94.6	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-63.5	-39.3	171.8	-68.5	-171.7	0	0	0	112.4	L518 V521 F576 Y577 Q578 E582 V583 L584 L633	L518-L580 HydrophobicContact CD1-CD2 3.79Å; V521-L580 HydrophobicContact CB-CD2 4.28Å; V521-L580 HydrophobicContact CG1-CD2 4.25Å; V521-L580 HydrophobicContact CG2-CD1 4.37Å; V521-L580 HydrophobicContact CG2-CD2 4.12Å; F576-L580 HydrophobicContact CD1-CD1 4.3Å; F576-L580 HydrophobicContact CD2-CG 4.45Å; F576-L580 HydrophobicContact CE1-CD1 3.69Å; F576-L580 HydrophobicContact CE1-CD2 4.47Å; F576-L580 HydrophobicContact CE1-CG 4.11Å; F576-L580 HydrophobicContact CE2-CD1 4.46Å; F576-L580 HydrophobicContact CE2-CD2 3.82Å; F576-L580 HydrophobicContact CE2-CG 4.03Å; F576-L580 HydrophobicContact CZ-CD1 3.79Å; F576-L580 HydrophobicContact CZ-CD2 3.74Å; F576-L580 HydrophobicContact CZ-CG 3.85Å; F576-L580 PolarHBondContact O-N 3.11Å; Y577-L580 HydrophobicContact CD1-CD1 4.19Å; Y577-L580 PolarHBondContact O-N 3.19Å; Q578-L580 VanDerWaalsContact C-N 3.34Å; Q578-L580 PolarHBondContact O-N 2.85Å; L580-E582 VanDerWaalsContact C-N 3.34Å; L580-V583 PolarHBondContact O-N 3.02Å; L580-L584 WeakPolarHBondContact O-CB 3.38Å; L580-L584 WeakPolarHBondContact O-CG 3.11Å; L580-L584 PolarHBondContact O-N 2.92Å; L580-L633 HydrophobicContact CD1-CD2 4.42Å
581	A	95.2	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.6	-37.2	175.8	0	0	0	0	0	111.9	Y577 Q578 I585 L633 T636 L637	Y577-A581 PolarHBondContact O-N 3.35Å; Q578-A581 WeakPolarHBondContact O-CB 3.29Å; Q578-A581 PolarHBondContact O-N 3.37Å; Q578-A581 VanDerWaalsContact O-N 3.11Å; A581-I585 WeakPolarHBondContact O-CA 3.49Å; A581-I585 PolarHBondContact O-N 3.19Å; A581-L633 HydrophobicContact CB-CD1 4.25Å; A581-T636 HydrophobicContact CB-CG2 4.33Å; A581-L637 HydrophobicContact CB-CD2 4.26Å
582	E	93.3	Very high	94.5	Very high	96 Å²	96	26.4 Å²	26.4	45%	0.449	14%	0.139	S	C	.	.	H	α-helix	trans	-73.3	-33.4	175.8	-71	169.8	-166.1	0	0	113	Q578 S579 L580 I585 P586	Q578-E582 WeakPolarHBondContact CG-OE1 3.49Å; Q578-E582 PolarHBondContact NE2-OE1 3.41Å; Q578-E582 PolarHBondContact O-N 3.43Å; S579-E582 PolarHBondContact O-N 2.85Å; L580-E582 VanDerWaalsContact C-N 3.34Å; E582-I585 CarbonylContact O-C 3.56Å; E582-P586 WeakPolarHBondContact O-CA 3.47Å; E582-P586 WeakPolarHBondContact O-CB 3.27Å; E582-P586 WeakPolarHBondContact O-CD 3.48Å; E582-P586 VanDerWaalsContact O-N 3.12Å
583	V	93.9	Very high	94.4	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-68.8	-39.8	171.7	169.2	0	0	0	0	111.3	L451 G452 A454 A457 V522 S579 L580	L451-V583 CarbonylContact C-O 3.58Å; L451-V583 WeakPolarHBondContact CA-O 3.28Å; G452-V583 PolarHBondContact N-O 3.23Å; A454-V583 HydrophobicContact CB-CG1 4.45Å; A454-V583 HydrophobicContact CB-CG2 4.26Å; A457-V583 HydrophobicContact CB-CG2 3.76Å; V522-V583 HydrophobicContact CG2-CG1 4.33Å; S579-V583 WeakPolarHBondContact O-CG2 3.3Å; S579-V583 PolarHBondContact O-N 3.28Å; L580-V583 PolarHBondContact O-N 3.02Å
584	L	94.8	Very high	94.2	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-78.1	-33.8	179.1	-72.8	175.1	0	0	0	113.5	L451 V521 L524 F526 L580 I600 F603 L637	L451-L584 HydrophobicContact CD2-CD2 4.18Å; V521-L584 HydrophobicContact CG1-CD1 4.2Å; V521-L584 HydrophobicContact CG1-CD2 3.79Å; V521-L584 HydrophobicContact CG1-CG 3.87Å; L524-L584 HydrophobicContact CD2-CD2 4.5Å; F526-L584 HydrophobicContact CE1-CD1 4.1Å; F526-L584 HydrophobicContact CE1-CD2 3.95Å; F526-L584 HydrophobicContact CZ-CD2 3.82Å; L580-L584 WeakPolarHBondContact O-CB 3.38Å; L580-L584 WeakPolarHBondContact O-CG 3.11Å; L580-L584 PolarHBondContact O-N 2.92Å; L584-I600 HydrophobicContact CB-CD1 4.11Å; L584-I600 HydrophobicContact CB-CG1 4.43Å; L584-I600 HydrophobicContact CD1-CG1 4.47Å; L584-I600 HydrophobicContact CD2-CD1 4.3Å; L584-I600 HydrophobicContact CD2-CG1 4.1Å; L584-F603 HydrophobicContact CD1-CD1 3.91Å; L584-F603 HydrophobicContact CD1-CE1 3.74Å; L584-L637 HydrophobicContact CB-CD2 4.32Å; L584-L637 HydrophobicContact CD1-CD1 4.33Å; L584-L637 HydrophobicContact CD1-CD2 4Å
585	I	94.5	Very high	94.1	Very high	8 Å²	8	36.9 Å²	36.9	4%	0.041	21%	0.207	C	C	.	.			trans	-137.8	70.6	-175.9	-49.1	175	0	0	0	109.5	A581 E582 N587 V588 I592 I600 L637 T641	A581-I585 WeakPolarHBondContact O-CA 3.49Å; A581-I585 PolarHBondContact O-N 3.19Å; E582-I585 CarbonylContact O-C 3.56Å; I585-N587 PolarHBondContact O-N 2.97Å; I585-N587 VanDerWaalsContact O-N 3.13Å; I585-V588 HydrophobicContact CG2-CG1 4.12Å; I585-I592 HydrophobicContact CG1-CD1 4.4Å; I585-I592 HydrophobicContact CG2-CD1 4Å; I585-I600 HydrophobicContact CD1-CG2 4.37Å; I585-I600 HydrophobicContact CG1-CD1 4.32Å; I585-L637 HydrophobicContact CD1-CD2 4.23Å; I585-T641 HydrophobicContact CD1-CG2 3.75Å
586	P	91.6	Very high	94	Very high	61 Å²	61	35.1 Å²	35.1	40%	0.396	20%	0.196	S	C	.	.	S	Bend	trans	-67.3	-14.6	-175.5	26.1	-36.5	0	0	0	114.4	E582	E582-P586 WeakPolarHBondContact O-CA 3.47Å; E582-P586 WeakPolarHBondContact O-CB 3.27Å; E582-P586 WeakPolarHBondContact O-CD 3.48Å; E582-P586 VanDerWaalsContact O-N 3.12Å
587	N	93.1	Very high	93.9	Very high	81 Å²	81	36 Å²	36	43%	0.433	20%	0.201	S	C	.	.			trans	-154.2	110	172.9	-177.9	-37.1	0	0	0	109.5	I585 L589 R590	I585-N587 PolarHBondContact O-N 2.97Å; I585-N587 VanDerWaalsContact O-N 3.13Å; N587-L589 PolarHBondContact O-N 2.92Å; N587-L589 WeakPolarHBondContact OD1-CA 3.36Å; N587-L589 WeakPolarHBondContact OD1-CB 3.47Å; N587-L589 PolarHBondContact OD1-N 2.88Å; N587-R590 HydrophobicContact CB-CB 3.95Å; N587-R590 PolarHBondContact O-N 3.46Å; N587-R590 PolarHBondContact OD1-N 2.68Å
588	V	95.2	Very high	93.8	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.018	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.4	-178.3	-62.3	0	0	0	0	114.2	I585 Y640 L643 N644 Y775 Y778	I585-V588 HydrophobicContact CG2-CG1 4.12Å; V588-Y640 HydrophobicContact CG1-CD1 4.39Å; V588-Y640 HydrophobicContact CG1-CD2 3.94Å; V588-Y640 HydrophobicContact CG1-CG 3.83Å; V588-L643 HydrophobicContact CB-CD2 3.96Å; V588-L643 HydrophobicContact CB-CG 4.27Å; V588-L643 HydrophobicContact CG1-CD2 4.33Å; V588-L643 HydrophobicContact CG2-CD2 3.83Å; V588-L643 HydrophobicContact CG2-CG 4.37Å; V588-N644 VanDerWaalsContact O-CA 3.29Å; V588-N644 WeakPolarHBondContact O-CA 3.38Å; V588-N644 PolarHBondContact O-ND2 3.23Å; V588-Y775 HydrophobicContact CG2-CD2 4.48Å; V588-Y775 HydrophobicContact CG2-CE2 4.05Å; V588-Y778 HydrophobicContact CG1-CD2 4.25Å; V588-Y778 HydrophobicContact CG1-CE2 3.69Å; V588-Y778 HydrophobicContact CG2-CD1 4.44Å; V588-Y778 HydrophobicContact CG2-CD2 4.48Å; V588-Y778 HydrophobicContact CG2-CE1 4.05Å; V588-Y778 HydrophobicContact CG2-CE2 4.08Å
589	L	96.1	Very high	93.8	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.063	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-26.6	176	-52.4	177.6	0	0	0	112.8	N587 A647 Q648 R651 L707 A711 Y775	N587-L589 PolarHBondContact O-N 2.92Å; N587-L589 WeakPolarHBondContact OD1-CA 3.36Å; N587-L589 WeakPolarHBondContact OD1-CB 3.47Å; N587-L589 PolarHBondContact OD1-N 2.88Å; L589-A647 HydrophobicContact CD2-CB 4.03Å; L589-Q648 PolarHBondContact O-NE2 3.19Å; L589-Q648 VanDerWaalsContact O-NE2 3.14Å; L589-R651 VanDerWaalsContact O-CZ 3.24Å; L589-R651 PolarHBondContact O-NH1 2.77Å; L589-R651 PolarHBondContact O-NH2 3.32Å; L589-L707 HydrophobicContact CD2-CD2 4.3Å; L589-A711 HydrophobicContact CD1-CB 3.56Å; L589-Y775 HydrophobicContact CD1-CE2 4.38Å; L589-Y775 HydrophobicContact CD2-CD2 4.11Å; L589-Y775 HydrophobicContact CD2-CE2 3.95Å; L589-Y775 HydrophobicContact CG-CE2 4.28Å
590	R	92.8	Very high	93.9	Very high	105 Å²	105	40.6 Å²	40.6	40%	0.396	23%	0.226	S	C	.	.	S	Bend	trans	-66.8	135.8	-174.9	-178.1	175.1	173.4	-171.8	-9.7	110.6	H449 N587 I592 N644	H449-R590 PolarHBondContact O-NH2 2.82Å; H449-R590 VanDerWaalsContact O-NH2 3.16Å; N587-R590 HydrophobicContact CB-CB 3.95Å; N587-R590 PolarHBondContact O-N 3.46Å; N587-R590 PolarHBondContact OD1-N 2.68Å; R590-I592 PolarHBondContact O-N 3.26Å; R590-N644 PolarHBondContact O-ND2 2.86Å
591	P	92.6	Very high	93.9	Very high	69 Å²	69	42.9 Å²	42.9	45%	0.448	24%	0.235	S	C	.	.			trans	-60.4	127.6	179.4	-17.6	27.9	0	0	0	112
592	I	92.8	Very high	93.9	Very high	26 Å²	26	46.7 Å²	46.7	13%	0.133	26%	0.255	C	S	.	.			trans	-104.6	135.4	176.9	-53.6	173.7	0	0	0	108.8	I585 R590 L596 T597 N644	I585-I592 HydrophobicContact CG1-CD1 4.4Å; I585-I592 HydrophobicContact CG2-CD1 4Å; R590-I592 PolarHBondContact O-N 3.26Å; I592-L596 HydrophobicContact CG2-CB 4.14Å; I592-L596 HydrophobicContact CG2-CD2 4.06Å; I592-L596 HydrophobicContact CG2-CG 4.05Å; I592-T597 WeakPolarHBondContact CB-OG1 3.4Å; I592-T597 VanDerWaalsContact CG2-OG1 3.29Å; I592-T597 WeakPolarHBondContact CG2-OG1 3.31Å; I592-N644 HydrophobicContact CD1-CB 4.21Å
593	P	93.1	Very high	94.1	Very high	28 Å²	28	42.3 Å²	42.3	18%	0.182	24%	0.235	C	C	.	.			trans	-57.8	134.8	176.3	-25.1	34.7	0	0	0	111.7	F450 T595 L596 T597	F450-P593 HydrophobicContact CD1-CG 4.01Å; F450-P593 HydrophobicContact CD2-CG 3.79Å; F450-P593 HydrophobicContact CE1-CG 3.83Å; F450-P593 HydrophobicContact CE2-CG 3.61Å; F450-P593 HydrophobicContact CG-CG 3.99Å; F450-P593 HydrophobicContact CZ-CG 3.62Å; P593-T595 VanDerWaalsContact C-N 3.26Å; P593-T595 PolarHBondContact O-N 2.83Å; P593-T595 VanDerWaalsContact O-N 3.14Å; P593-L596 HydrophobicContact CB-CB 4.39Å; P593-L596 PolarHBondContact O-N 3.36Å; P593-T597 PolarHBondContact O-N 2.99Å; P593-T597 PolarHBondContact O-OG1 3.33Å
594	P	91.4	Very high	94.2	Very high	108 Å²	108	42.1 Å²	42.1	70%	0.701	23%	0.233	S	C	*	.	H	α-helix	trans	-52.6	-39.6	-176.6	-30.2	36.2	0	0	0	114.4	L596 T597 Q598	P594-L596 PolarHBondContact O-N 2.9Å; P594-T597 WeakPolarHBondContact O-CB 3.12Å; P594-T597 PolarHBondContact O-N 3.02Å; P594-Q598 PolarHBondContact O-N 3.2Å
595	T	92.4	Very high	94.3	Very high	102 Å²	102	49.1 Å²	49.1	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-59.8	-42.7	175.9	-40.9	0	0	0	0	112.5	P593 Q598 A599	P593-T595 VanDerWaalsContact C-N 3.26Å; P593-T595 PolarHBondContact O-N 2.83Å; P593-T595 VanDerWaalsContact O-N 3.14Å; T595-Q598 PolarHBondContact O-N 3.27Å; T595-A599 WeakPolarHBondContact O-CB 3.38Å; T595-A599 PolarHBondContact O-N 3.37Å
596	L	93.5	Very high	94.4	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-40.6	177.7	179.2	57.6	0	0	0	110.9	F450 L451 L524 I592 P593 P594 Q598 A599 I600	F450-L596 HydrophobicContact CB-CD2 4.03Å; L451-L596 HydrophobicContact CD2-CD2 4.33Å; L524-L596 HydrophobicContact CD1-CD1 4.07Å; L524-L596 HydrophobicContact CD2-CD1 3.7Å; I592-L596 HydrophobicContact CG2-CB 4.14Å; I592-L596 HydrophobicContact CG2-CD2 4.06Å; I592-L596 HydrophobicContact CG2-CG 4.05Å; P593-L596 HydrophobicContact CB-CB 4.39Å; P593-L596 PolarHBondContact O-N 3.36Å; P594-L596 PolarHBondContact O-N 2.9Å; L596-Q598 VanDerWaalsContact C-N 3.29Å; L596-Q598 PolarHBondContact O-N 3.27Å; L596-A599 PolarHBondContact O-N 3.37Å; L596-I600 HydrophobicContact CD1-CD1 4.02Å; L596-I600 HydrophobicContact CD1-CG1 4.22Å; L596-I600 HydrophobicContact CG-CD1 3.94Å; L596-I600 VanDerWaalsContact O-CG1 3.29Å; L596-I600 WeakPolarHBondContact O-CG1 3.29Å; L596-I600 PolarHBondContact O-N 3.23Å
597	T	94.1	Very high	94.6	Very high	18 Å²	18	48 Å²	48	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-42	172.6	-58	0	0	0	0	111.6	I592 P593 P594 R601 T641	I592-T597 WeakPolarHBondContact CB-OG1 3.4Å; I592-T597 VanDerWaalsContact CG2-OG1 3.29Å; I592-T597 WeakPolarHBondContact CG2-OG1 3.31Å; P593-T597 PolarHBondContact O-N 2.99Å; P593-T597 PolarHBondContact O-OG1 3.33Å; P594-T597 WeakPolarHBondContact O-CB 3.12Å; P594-T597 PolarHBondContact O-N 3.02Å; T597-R601 WeakPolarHBondContact O-CB 3.28Å; T597-R601 VanDerWaalsContact O-CG 3.27Å; T597-R601 WeakPolarHBondContact O-CG 3.39Å; T597-R601 PolarHBondContact O-N 3.48Å; T597-T641 HydrophobicContact CG2-CG2 4.17Å
598	Q	94.4	Very high	94.7	Very high	93 Å²	93	47 Å²	47	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-71.3	-40.4	177.5	-168.1	60.2	30.9	0	0	112.2	P594 T595 L596 I600 R601 N602	P594-Q598 PolarHBondContact O-N 3.2Å; T595-Q598 PolarHBondContact O-N 3.27Å; L596-Q598 VanDerWaalsContact C-N 3.29Å; L596-Q598 PolarHBondContact O-N 3.27Å; Q598-I600 VanDerWaalsContact C-N 3.35Å; Q598-I600 PolarHBondContact O-N 2.93Å; Q598-R601 PolarHBondContact O-N 3.05Å; Q598-N602 PolarHBondContact NE2-OD1 3.46Å; Q598-N602 WeakPolarHBondContact O-CB 3.42Å; Q598-N602 PolarHBondContact O-N 2.87Å; Q598-N602 PolarHBondContact O-OD1 3.13Å
599	A	95.3	Very high	94.7	Very high	31 Å²	31	48.6 Å²	48.6	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-44.6	174.4	0	0	0	0	0	111.8	F526 T595 L596 R601 N602 F603	F526-A599 HydrophobicContact CE2-CB 4Å; T595-A599 WeakPolarHBondContact O-CB 3.38Å; T595-A599 PolarHBondContact O-N 3.37Å; L596-A599 PolarHBondContact O-N 3.37Å; A599-R601 PolarHBondContact O-N 3.39Å; A599-N602 PolarHBondContact O-N 2.91Å; A599-F603 WeakPolarHBondContact O-CB 3.37Å; A599-F603 PolarHBondContact O-N 2.83Å
600	I	96.1	Very high	94.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-38.7	175	-67.1	165.4	0	0	0	111.6	L584 I585 L596 Q598 A604 L637 T641	L584-I600 HydrophobicContact CB-CD1 4.11Å; L584-I600 HydrophobicContact CB-CG1 4.43Å; L584-I600 HydrophobicContact CD1-CG1 4.47Å; L584-I600 HydrophobicContact CD2-CD1 4.3Å; L584-I600 HydrophobicContact CD2-CG1 4.1Å; I585-I600 HydrophobicContact CD1-CG2 4.37Å; I585-I600 HydrophobicContact CG1-CD1 4.32Å; L596-I600 HydrophobicContact CD1-CD1 4.02Å; L596-I600 HydrophobicContact CD1-CG1 4.22Å; L596-I600 HydrophobicContact CG-CD1 3.94Å; L596-I600 VanDerWaalsContact O-CG1 3.29Å; L596-I600 WeakPolarHBondContact O-CG1 3.29Å; L596-I600 PolarHBondContact O-N 3.23Å; Q598-I600 VanDerWaalsContact C-N 3.35Å; Q598-I600 PolarHBondContact O-N 2.93Å; I600-A604 VanDerWaalsContact O-CB 3.31Å; I600-A604 WeakPolarHBondContact O-CB 3.16Å; I600-A604 PolarHBondContact O-N 3.4Å; I600-L637 HydrophobicContact CG2-CB 4.14Å; I600-L637 HydrophobicContact CG2-CD2 4.07Å; I600-L637 HydrophobicContact CG2-CG 4.48Å; I600-T641 HydrophobicContact CB-CG2 4.34Å; I600-T641 HydrophobicContact CG2-CG2 3.81Å
601	R	95.6	Very high	94.7	Very high	51 Å²	51	44.4 Å²	44.4	19%	0.192	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-41.1	175.6	-76.2	172.9	174.7	-164.9	0.4	112.4	S124 T597 Q598 A599 A604 K605	S124-R601 PolarHBondContact OG-NH1 3.37Å; T597-R601 WeakPolarHBondContact O-CB 3.28Å; T597-R601 VanDerWaalsContact O-CG 3.27Å; T597-R601 WeakPolarHBondContact O-CG 3.39Å; T597-R601 PolarHBondContact O-N 3.48Å; Q598-R601 PolarHBondContact O-N 3.05Å; A599-R601 PolarHBondContact O-N 3.39Å; R601-A604 CarbonylContact O-C 3.57Å; R601-A604 PolarHBondContact O-N 2.95Å; R601-K605 PolarHBondContact O-N 3.39Å
602	N	95.6	Very high	94.7	Very high	79 Å²	79	47 Å²	47	42%	0.422	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-45	175.9	-72.4	5	0	0	0	110.8	Q598 A599 A604 K605 S606	Q598-N602 PolarHBondContact NE2-OD1 3.46Å; Q598-N602 WeakPolarHBondContact O-CB 3.42Å; Q598-N602 PolarHBondContact O-N 2.87Å; Q598-N602 PolarHBondContact O-OD1 3.13Å; A599-N602 PolarHBondContact O-N 2.91Å; N602-A604 VanDerWaalsContact C-N 3.32Å; N602-A604 PolarHBondContact O-N 3.45Å; N602-K605 WeakPolarHBondContact O-CA 3.41Å; N602-K605 VanDerWaalsContact O-CB 3.28Å; N602-K605 WeakPolarHBondContact O-CB 3.42Å; N602-K605 PolarHBondContact O-N 3.08Å; N602-S606 PolarHBondContact O-N 3.28Å; N602-S606 VanDerWaalsContact O-N 3.11Å; N602-S606 PolarHBondContact O-OG 3.39Å
603	F	96.8	Very high	94.6	Very high	5 Å²	5	49.8 Å²	49.8	2%	0.022	26%	0.264	C	S	.	.	H	α-helix	trans	-53.3	-48.4	170.7	173.1	-135.4	0	0	0	111.6	V521 F526 I529 L584 A599 K605 S606 L607 W610 L637	V521-F603 HydrophobicContact CG2-CZ 4.41Å; F526-F603 HydrophobicContact CB-CB 4.15Å; F526-F603 HydrophobicContact CB-CD2 3.84Å; F526-F603 HydrophobicContact CB-CG 4.14Å; F526-F603 HydrophobicContact CD1-CB 3.82Å; F526-F603 AromaticContact CD1-CD1 3.53Å; F526-F603 HydrophobicContact CD1-CD1 3.53Å; F526-F603 AromaticContact CD1-CD2 3.6Å; F526-F603 HydrophobicContact CD1-CD2 3.6Å; F526-F603 AromaticContact CD1-CE1 3.9Å; F526-F603 HydrophobicContact CD1-CE1 3.9Å; F526-F603 AromaticContact CD1-CE2 3.97Å; F526-F603 HydrophobicContact CD1-CE2 3.97Å; F526-F603 AromaticContact CD1-CG 3.36Å; F526-F603 HydrophobicContact CD1-CG 3.36Å; F526-F603 HydrophobicContact CD1-CZ 4.1Å; F526-F603 HydrophobicContact CD2-CB 4.24Å; F526-F603 HydrophobicContact CE1-CB 4.26Å; F526-F603 AromaticContact CE1-CD1 3.58Å; F526-F603 HydrophobicContact CE1-CD1 3.58Å; F526-F603 HydrophobicContact CE1-CD2 4.48Å; F526-F603 AromaticContact CE1-CE1 3.97Å; F526-F603 HydrophobicContact CE1-CE1 3.97Å; F526-F603 AromaticContact CE1-CG 3.87Å; F526-F603 HydrophobicContact CE1-CG 3.87Å; F526-F603 HydrophobicContact CG-CB 3.8Å; F526-F603 HydrophobicContact CG-CD1 4.38Å; F526-F603 AromaticContact CG-CD2 3.98Å; F526-F603 HydrophobicContact CG-CD2 3.98Å; F526-F603 AromaticContact CG-CG 3.81Å; F526-F603 HydrophobicContact CG-CG 3.81Å; F526-F603 HydrophobicContact CZ-CD1 4.47Å; I529-F603 HydrophobicContact CD1-CD2 4.3Å; I529-F603 HydrophobicContact CD1-CE2 3.4Å; I529-F603 VanDerWaalsContact CD1-CE2 3.4Å; I529-F603 HydrophobicContact CD1-CZ 3.7Å; L584-F603 HydrophobicContact CD1-CD1 3.91Å; L584-F603 HydrophobicContact CD1-CE1 3.74Å; A599-F603 WeakPolarHBondContact O-CB 3.37Å; A599-F603 PolarHBondContact O-N 2.83Å; F603-K605 PolarHBondContact O-N 3.24Å; F603-S606 PolarHBondContact O-N 3.11Å; F603-L607 HydrophobicContact CD2-CD1 4.43Å; F603-L607 HydrophobicContact CD2-CD2 4.26Å; F603-L607 HydrophobicContact CD2-CG 3.92Å; F603-L607 HydrophobicContact CE1-CD1 4.22Å; F603-L607 HydrophobicContact CE2-CD1 4.1Å; F603-L607 HydrophobicContact CE2-CD2 3.46Å; F603-L607 VanDerWaalsContact CE2-CD2 3.46Å; F603-L607 HydrophobicContact CE2-CG 3.61Å; F603-L607 HydrophobicContact CZ-CD1 3.99Å; F603-L607 HydrophobicContact CZ-CD2 3.75Å; F603-L607 HydrophobicContact CZ-CG 4Å; F603-L607 WeakPolarHBondContact O-CG 3.43Å; F603-L607 PolarHBondContact O-N 2.99Å; F603-W610 AromaticContact CD2-CZ3 3.84Å; F603-W610 HydrophobicContact CD2-CZ3 3.84Å; F603-W610 HydrophobicContact CE2-CZ3 4.19Å; F603-L637 HydrophobicContact CD1-CD1 3.78Å; F603-L637 HydrophobicContact CE1-CD1 3.78Å
604	A	97.2	Very high	94.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71	-5.9	176.1	0	0	0	0	0	115.3	I600 R601 N602 L637 R638	I600-A604 VanDerWaalsContact O-CB 3.31Å; I600-A604 WeakPolarHBondContact O-CB 3.16Å; I600-A604 PolarHBondContact O-N 3.4Å; R601-A604 CarbonylContact O-C 3.57Å; R601-A604 PolarHBondContact O-N 2.95Å; N602-A604 VanDerWaalsContact C-N 3.32Å; N602-A604 PolarHBondContact O-N 3.45Å; A604-L637 HydrophobicContact CB-CB 3.88Å; A604-L637 HydrophobicContact CB-CD1 4.21Å; A604-R638 HydrophobicContact CB-CG 4.12Å; A604-R638 PolarHBondContact O-NE 2.85Å; A604-R638 VanDerWaalsContact O-NE 3.17Å; A604-R638 PolarHBondContact O-NH2 3.07Å
605	K	96.5	Very high	94.3	Very high	148 Å²	148	43.4 Å²	43.4	64%	0.643	22%	0.223	S	C	*	.	H	α-helix	trans	-87.2	-43.2	169.1	-170.4	-176	177.3	-172.5	0	110	R601 N602 F603	R601-K605 PolarHBondContact O-N 3.39Å; N602-K605 WeakPolarHBondContact O-CA 3.41Å; N602-K605 VanDerWaalsContact O-CB 3.28Å; N602-K605 WeakPolarHBondContact O-CB 3.42Å; N602-K605 PolarHBondContact O-N 3.08Å; F603-K605 PolarHBondContact O-N 3.24Å
606	S	96.1	Very high	93.8	Very high	45 Å²	45	44.8 Å²	44.8	32%	0.315	22%	0.222	S	C	.	.	H	α-helix	trans	-85	-28.4	-173.1	-52.8	0	0	0	0	115.4	N602 F603 E608 G609 W610	N602-S606 PolarHBondContact O-N 3.28Å; N602-S606 VanDerWaalsContact O-N 3.11Å; N602-S606 PolarHBondContact O-OG 3.39Å; F603-S606 PolarHBondContact O-N 3.11Å; S606-E608 VanDerWaalsContact C-N 3.32Å; S606-E608 PolarHBondContact O-N 2.96Å; S606-E608 VanDerWaalsContact O-N 3.09Å; S606-G609 PolarHBondContact O-N 3.32Å; S606-W610 VanDerWaalsContact CB-CE2 3.48Å; S606-W610 PolarHBondContact O-N 3.46Å
607	L	96.1	Very high	93.2	Very high	2 Å²	2	48 Å²	48	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-40.2	-50.2	-175.2	-96	174.5	0	0	0	115.1	W533 F603 M611 V630 L633 A634 L637	W533-L607 HydrophobicContact CH2-CD2 3.56Å; W533-L607 HydrophobicContact CZ2-CD2 4.43Å; W533-L607 HydrophobicContact CZ3-CD2 4.27Å; F603-L607 HydrophobicContact CD2-CD1 4.43Å; F603-L607 HydrophobicContact CD2-CD2 4.26Å; F603-L607 HydrophobicContact CD2-CG 3.92Å; F603-L607 HydrophobicContact CE1-CD1 4.22Å; F603-L607 HydrophobicContact CE2-CD1 4.1Å; F603-L607 HydrophobicContact CE2-CD2 3.46Å; F603-L607 VanDerWaalsContact CE2-CD2 3.46Å; F603-L607 HydrophobicContact CE2-CG 3.61Å; F603-L607 HydrophobicContact CZ-CD1 3.99Å; F603-L607 HydrophobicContact CZ-CD2 3.75Å; F603-L607 HydrophobicContact CZ-CG 4Å; F603-L607 WeakPolarHBondContact O-CG 3.43Å; F603-L607 PolarHBondContact O-N 2.99Å; L607-M611 PolarHBondContact O-N 3.28Å; L607-V630 HydrophobicContact CB-CG1 3.88Å; L607-V630 HydrophobicContact CD2-CG1 4.25Å; L607-L633 HydrophobicContact CD1-CD2 3.9Å; L607-L633 HydrophobicContact CD1-CG 3.94Å; L607-L633 HydrophobicContact CD2-CD2 4.44Å; L607-A634 HydrophobicContact CB-CB 4.29Å; L607-A634 HydrophobicContact CD1-CB 4.01Å; L607-L637 HydrophobicContact CD1-CD1 4.23Å
608	E	95.2	Very high	92.8	Very high	60 Å²	60	48.1 Å²	48.1	28%	0.28	26%	0.256	S	S	.	.	H	α-helix	trans	-68.8	-41.7	-178.3	-173.4	-176.5	149.2	0	0	112.1	S606 W610 M611 R612 I627 C631	S606-E608 VanDerWaalsContact C-N 3.32Å; S606-E608 PolarHBondContact O-N 2.96Å; S606-E608 VanDerWaalsContact O-N 3.09Å; E608-W610 VanDerWaalsContact C-N 3.34Å; E608-W610 PolarHBondContact O-N 3.03Å; E608-M611 PolarHBondContact O-N 3.42Å; E608-R612 HydrophobicContact CG-CG 4.37Å; E608-R612 WeakPolarHBondContact O-CB 3.47Å; E608-R612 VanDerWaalsContact O-CG 3.3Å; E608-R612 WeakPolarHBondContact O-CG 3.48Å; E608-R612 PolarHBondContact O-N 3.01Å; E608-R612 IonicContact OE1-CZ 2.96Å; E608-R612 IonicContact OE1-NE 3.96Å; E608-R612 PolarHBondContact OE1-NE 3.04Å; E608-R612 IonicContact OE1-NH2 3.41Å; E608-R612 PolarHBondContact OE1-NH2 3.37Å; E608-I627 HydrophobicContact CG-CD1 4.48Å; E608-C631 PolarHBondContact OE2-SG 2.86Å
609	G	94.1	Very high	92.4	Very high	36 Å²	36	46.9 Å²	46.9	37%	0.371	25%	0.253	S	S	.	.	H	α-helix	trans	-64.5	-38.2	178.8	0	0	0	0	0	112.4	S606 Q613	S606-G609 PolarHBondContact O-N 3.32Å; G609-Q613 WeakPolarHBondContact O-CG 3.37Å; G609-Q613 PolarHBondContact O-N 3.33Å; G609-Q613 VanDerWaalsContact O-N 3.16Å; G609-Q613 PolarHBondContact O-NE2 3.23Å
610	W	94.9	Very high	92.1	Very high	29 Å²	29	49.7 Å²	49.7	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-47.8	173.6	-66.1	-27.6	0	0	0	112.3	F526 T527 E530 W533 F603 S606 E608 R612 Q613 A614	F526-W610 HydrophobicContact CB-CH2 4.35Å; F526-W610 VanDerWaalsContact O-CH2 3.3Å; F526-W610 WeakPolarHBondContact O-CH2 3.32Å; F526-W610 WeakPolarHBondContact O-CZ3 3.34Å; T527-W610 HydrophobicContact CG2-CZ2 4.33Å; E530-W610 HydrophobicContact CB-CB 4.16Å; E530-W610 HydrophobicContact CB-CD2 4.1Å; E530-W610 HydrophobicContact CB-CG 3.83Å; E530-W610 HydrophobicContact CG-CB 3.98Å; E530-W610 HydrophobicContact CG-CG 3.84Å; E530-W610 PolarHBondContact OE2-NE1 3.42Å; W533-W610 HydrophobicContact CE3-CB 4.09Å; W533-W610 HydrophobicContact CZ3-CB 3.91Å; F603-W610 AromaticContact CD2-CZ3 3.84Å; F603-W610 HydrophobicContact CD2-CZ3 3.84Å; F603-W610 HydrophobicContact CE2-CZ3 4.19Å; S606-W610 VanDerWaalsContact CB-CE2 3.48Å; S606-W610 PolarHBondContact O-N 3.46Å; E608-W610 VanDerWaalsContact C-N 3.34Å; E608-W610 PolarHBondContact O-N 3.03Å; W610-R612 PolarHBondContact O-N 3.46Å; W610-Q613 PolarHBondContact O-N 3Å; W610-A614 PolarHBondContact O-N 3.5Å
611	M	95.2	Very high	91.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-46.4	177.2	-179	56.6	73.2	0	0	110.9	W533 L607 E608 Q613 A614 I615 K626 I627 V630	W533-M611 HydrophobicContact CD2-CE 3.59Å; W533-M611 HydrophobicContact CD2-SD 4.44Å; W533-M611 HydrophobicContact CE3-CB 4.07Å; W533-M611 HydrophobicContact CE3-CE 3.92Å; W533-M611 HydrophobicContact CE3-SD 4.49Å; W533-M611 HydrophobicContact CG-CE 4.2Å; W533-M611 HydrophobicContact CH2-CB 4.19Å; W533-M611 HydrophobicContact CH2-CE 3.75Å; W533-M611 HydrophobicContact CZ2-CE 3.43Å; W533-M611 VanDerWaalsContact CZ2-CE 3.43Å; W533-M611 HydrophobicContact CZ3-CB 3.68Å; W533-M611 HydrophobicContact CZ3-CE 3.99Å; L607-M611 PolarHBondContact O-N 3.28Å; E608-M611 PolarHBondContact O-N 3.42Å; M611-Q613 PolarHBondContact O-N 3.37Å; M611-A614 PolarHBondContact O-N 2.88Å; M611-A614 VanDerWaalsContact O-N 3.11Å; M611-I615 HydrophobicContact CG-CD1 3.98Å; M611-I615 VanDerWaalsContact O-CG1 3.29Å; M611-I615 WeakPolarHBondContact O-CG1 3.33Å; M611-I615 PolarHBondContact O-N 3.4Å; M611-I615 HydrophobicContact SD-CD1 4.08Å; M611-I615 HydrophobicContact SD-CG2 3.65Å; M611-K626 HydrophobicContact CE-CD 3.95Å; M611-K626 HydrophobicContact CG-CB 4.3Å; M611-K626 HydrophobicContact SD-CB 4.02Å; M611-K626 HydrophobicContact SD-CD 4.17Å; M611-K626 HydrophobicContact SD-CG 4.19Å; M611-I627 HydrophobicContact CB-CD1 4Å; M611-I627 HydrophobicContact CG-CD1 3.64Å; M611-V630 HydrophobicContact CB-CB 4.43Å; M611-V630 HydrophobicContact CB-CG1 4.15Å; M611-V630 HydrophobicContact CB-CG2 4.16Å; M611-V630 HydrophobicContact CE-CG2 3.58Å; M611-V630 HydrophobicContact CG-CB 4.45Å; M611-V630 HydrophobicContact CG-CG2 3.97Å
612	R	93.2	Very high	91.6	Very high	122 Å²	122	52.2 Å²	52.2	46%	0.46	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-29.5	176.7	-74.7	-175.2	-173.8	-78	2.5	113.6	E608 W610 Q616 I627	E608-R612 HydrophobicContact CG-CG 4.37Å; E608-R612 WeakPolarHBondContact O-CB 3.47Å; E608-R612 VanDerWaalsContact O-CG 3.3Å; E608-R612 WeakPolarHBondContact O-CG 3.48Å; E608-R612 PolarHBondContact O-N 3.01Å; E608-R612 IonicContact OE1-CZ 2.96Å; E608-R612 IonicContact OE1-NE 3.96Å; E608-R612 PolarHBondContact OE1-NE 3.04Å; E608-R612 IonicContact OE1-NH2 3.41Å; E608-R612 PolarHBondContact OE1-NH2 3.37Å; W610-R612 PolarHBondContact O-N 3.46Å; R612-Q616 WeakPolarHBondContact O-CG 3.38Å; R612-I627 HydrophobicContact CB-CD1 4.38Å; R612-I627 HydrophobicContact CG-CD1 3.41Å; R612-I627 VanDerWaalsContact CG-CD1 3.41Å; R612-I627 HydrophobicContact CG-CG1 4.26Å
613	Q	90	Very high	91.4	Very high	85 Å²	85	50.5 Å²	50.5	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-78	-40.2	174.1	-76.7	179.6	75.9	0	0	112.6	G609 W610 M611 I615	G609-Q613 WeakPolarHBondContact O-CG 3.37Å; G609-Q613 PolarHBondContact O-N 3.33Å; G609-Q613 VanDerWaalsContact O-N 3.16Å; G609-Q613 PolarHBondContact O-NE2 3.23Å; W610-Q613 PolarHBondContact O-N 3Å; M611-Q613 PolarHBondContact O-N 3.37Å; Q613-I615 VanDerWaalsContact C-N 3.3Å; Q613-I615 PolarHBondContact O-N 3Å
614	A	88.6	Confident	91.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-74.7	-12.7	-176.5	0	0	0	0	0	114.8	W533 K534 W537 T539 W610 M611	W533-A614 HydrophobicContact CB-CB 3.47Å; W533-A614 VanDerWaalsContact CB-CB 3.47Å; K534-A614 HydrophobicContact CG-CB 4.03Å; W537-A614 WeakPolarHBondContact CB-O 3.31Å; T539-A614 WeakPolarHBondContact CG2-O 3.25Å; W610-A614 PolarHBondContact O-N 3.5Å; M611-A614 PolarHBondContact O-N 2.88Å; M611-A614 VanDerWaalsContact O-N 3.11Å
615	I	89.5	Confident	91	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	16.3	-178.3	69.3	-170.9	0	0	0	114.1	W537 M611 Q613 G617 L618 I623 K626 I627	W537-I615 HydrophobicContact CD2-CG2 4.4Å; W537-I615 HydrophobicContact CG-CG2 4.09Å; M611-I615 HydrophobicContact CG-CD1 3.98Å; M611-I615 VanDerWaalsContact O-CG1 3.29Å; M611-I615 WeakPolarHBondContact O-CG1 3.33Å; M611-I615 PolarHBondContact O-N 3.4Å; M611-I615 HydrophobicContact SD-CD1 4.08Å; M611-I615 HydrophobicContact SD-CG2 3.65Å; Q613-I615 VanDerWaalsContact C-N 3.3Å; Q613-I615 PolarHBondContact O-N 3Å; I615-G617 PolarHBondContact O-N 3.17Å; I615-L618 HydrophobicContact CB-CD1 3.93Å; I615-L618 HydrophobicContact CB-CG 4.48Å; I615-L618 HydrophobicContact CG2-CD1 4.12Å; I615-L618 PolarHBondContact O-N 2.81Å; I615-I623 HydrophobicContact CB-CG1 4.43Å; I615-I623 HydrophobicContact CD1-CB 4.21Å; I615-I623 HydrophobicContact CD1-CG1 3.96Å; I615-I623 HydrophobicContact CD1-CG2 4.1Å; I615-I623 HydrophobicContact CG1-CG1 3.97Å; I615-K626 HydrophobicContact CD1-CB 3.99Å; I615-I627 HydrophobicContact CD1-CD1 4.12Å; I615-I627 HydrophobicContact CD1-CG1 4.08Å
616	Q	82.9	Confident	90.9	Very high	132 Å²	132	48.9 Å²	48.9	62%	0.617	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	127.5	-180	-63.2	-171.2	8	0	0	111.4	R612	R612-Q616 WeakPolarHBondContact O-CG 3.38Å
617	G	80.9	Confident	90.8	Very high	71 Å²	71	47.4 Å²	47.4	73%	0.732	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	6.9	-179.6	0	0	0	0	0	115.5	I615	I615-G617 PolarHBondContact O-N 3.17Å
618	L	84.6	Confident	90.7	Very high	19 Å²	19	48.3 Å²	48.3	10%	0.099	27%	0.267	C	S	.	.	S	Bend	trans	-85.9	175.3	169.6	-57.3	-175.8	0	0	0	112	W537 Y557 I615 L622 I623	W537-L618 HydrophobicContact CB-CD1 4.23Å; W537-L618 HydrophobicContact CD2-CD1 3.77Å; W537-L618 HydrophobicContact CE3-CD1 3.45Å; W537-L618 VanDerWaalsContact CE3-CD1 3.45Å; W537-L618 HydrophobicContact CG-CD1 4.11Å; W537-L618 HydrophobicContact CZ3-CD1 4.11Å; Y557-L618 HydrophobicContact CD1-CD2 3.8Å; Y557-L618 HydrophobicContact CE1-CD2 3.25Å; Y557-L618 HydrophobicContact CE2-CD2 4.23Å; Y557-L618 VanDerWaalsContact CZ-CD2 3.47Å; I615-L618 HydrophobicContact CB-CD1 3.93Å; I615-L618 HydrophobicContact CB-CG 4.48Å; I615-L618 HydrophobicContact CG2-CD1 4.12Å; I615-L618 PolarHBondContact O-N 2.81Å; L618-L622 HydrophobicContact CB-CD2 3.79Å; L618-L622 HydrophobicContact CD1-CD2 3.49Å; L618-L622 VanDerWaalsContact CD1-CD2 3.49Å; L618-L622 HydrophobicContact CG-CD2 4.25Å; L618-I623 HydrophobicContact CB-CG1 4.47Å; L618-I623 VanDerWaalsContact O-CD1 3.29Å; L618-I623 WeakPolarHBondContact O-CD1 3.4Å
619	D	86.1	Confident	90.7	Very high	68 Å²	68	45.4 Å²	45.4	36%	0.364	25%	0.254	S	S	.	.			trans	-62.3	144.1	-179	-163.2	-5.1	0	0	0	112.4	S561 D621 L622 I623	S561-D619 PolarHBondContact OG-OD2 3.03Å; D619-D621 VanDerWaalsContact C-N 3.34Å; D619-D621 PolarHBondContact O-N 2.71Å; D619-L622 HydrophobicContact CB-CB 4.46Å; D619-L622 WeakPolarHBondContact O-CB 3.32Å; D619-L622 PolarHBondContact O-N 3.3Å; D619-I623 VanDerWaalsContact O-CG1 3.29Å; D619-I623 WeakPolarHBondContact O-CG1 3.47Å; D619-I623 PolarHBondContact O-N 2.93Å
620	T	88.7	Confident	90.7	Very high	90 Å²	90	43.7 Å²	43.7	55%	0.552	24%	0.236	S	C	*	.	H	α-helix	trans	-66.2	-36	-173.9	-61.1	0	0	0	0	111.9	I623 N624	T620-I623 PolarHBondContact O-N 3.17Å; T620-N624 WeakPolarHBondContact O-CB 3.36Å; T620-N624 VanDerWaalsContact O-CG 3.26Å; T620-N624 PolarHBondContact O-N 3.12Å; T620-N624 PolarHBondContact O-ND2 2.9Å
621	D	89.7	Confident	90.8	Very high	102 Å²	102	43.8 Å²	43.8	55%	0.545	24%	0.241	S	C	.	.	H	α-helix	trans	-69.2	-38.8	177.9	-75.7	-11.8	0	0	0	111.8	L566 D619 L625	L566-D621 HydrophobicContact CD1-CB 4.33Å; D619-D621 VanDerWaalsContact C-N 3.34Å; D619-D621 PolarHBondContact O-N 2.71Å; D621-L625 WeakPolarHBondContact O-CB 3.45Å; D621-L625 PolarHBondContact O-N 2.79Å
622	L	91.7	Very high	90.8	Very high	2 Å²	2	44 Å²	44	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-47.8	169	175.5	72.7	0	0	0	111	W537 V560 L566 I569 L618 D619 N624 L625 K626	W537-L622 HydrophobicContact CH2-CD1 4.11Å; W537-L622 HydrophobicContact CH2-CD2 4.04Å; W537-L622 HydrophobicContact CZ3-CD2 4Å; V560-L622 HydrophobicContact CG1-CB 3.95Å; V560-L622 HydrophobicContact CG1-CD1 3.64Å; V560-L622 HydrophobicContact CG1-CD2 3.6Å; V560-L622 HydrophobicContact CG1-CG 3.89Å; L566-L622 HydrophobicContact CD2-CB 4.08Å; L566-L622 HydrophobicContact CD2-CD1 4.2Å; I569-L622 HydrophobicContact CD1-CD1 3.71Å; I569-L622 HydrophobicContact CG2-CD1 4.17Å; L618-L622 HydrophobicContact CB-CD2 3.79Å; L618-L622 HydrophobicContact CD1-CD2 3.49Å; L618-L622 VanDerWaalsContact CD1-CD2 3.49Å; L618-L622 HydrophobicContact CG-CD2 4.25Å; D619-L622 HydrophobicContact CB-CB 4.46Å; D619-L622 WeakPolarHBondContact O-CB 3.32Å; D619-L622 PolarHBondContact O-N 3.3Å; L622-N624 PolarHBondContact O-N 3.49Å; L622-L625 PolarHBondContact O-N 2.88Å; L622-K626 HydrophobicContact CD1-CG 4Å; L622-K626 HydrophobicContact CG-CG 4.32Å; L622-K626 WeakPolarHBondContact O-CB 3.46Å; L622-K626 PolarHBondContact O-N 3.16Å
623	I	92.4	Very high	90.9	Very high	42 Å²	42	38.3 Å²	38.3	22%	0.215	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-47.7	-177.2	-70.2	171.1	0	0	0	110.3	I615 L618 D619 T620 L625 K626 I627	I615-I623 HydrophobicContact CB-CG1 4.43Å; I615-I623 HydrophobicContact CD1-CB 4.21Å; I615-I623 HydrophobicContact CD1-CG1 3.96Å; I615-I623 HydrophobicContact CD1-CG2 4.1Å; I615-I623 HydrophobicContact CG1-CG1 3.97Å; L618-I623 HydrophobicContact CB-CG1 4.47Å; L618-I623 VanDerWaalsContact O-CD1 3.29Å; L618-I623 WeakPolarHBondContact O-CD1 3.4Å; D619-I623 VanDerWaalsContact O-CG1 3.29Å; D619-I623 WeakPolarHBondContact O-CG1 3.47Å; D619-I623 PolarHBondContact O-N 2.93Å; T620-I623 PolarHBondContact O-N 3.17Å; I623-L625 VanDerWaalsContact C-N 3.33Å; I623-L625 PolarHBondContact O-N 3.18Å; I623-K626 PolarHBondContact O-N 2.81Å; I623-I627 HydrophobicContact CG2-CG1 4.31Å; I623-I627 VanDerWaalsContact O-CB 3.31Å; I623-I627 WeakPolarHBondContact O-CB 3.36Å; I623-I627 VanDerWaalsContact O-CG1 3.23Å; I623-I627 WeakPolarHBondContact O-CG1 3.46Å; I623-I627 PolarHBondContact O-N 3.36Å
624	N	92.2	Very high	91.2	Very high	96 Å²	96	34.3 Å²	34.3	51%	0.513	20%	0.203	S	C	.	.	H	α-helix	trans	-60.1	-42.9	177	-71.8	-30.8	0	0	0	111.9	T620 L622 S628	T620-N624 WeakPolarHBondContact O-CB 3.36Å; T620-N624 VanDerWaalsContact O-CG 3.26Å; T620-N624 PolarHBondContact O-N 3.12Å; T620-N624 PolarHBondContact O-ND2 2.9Å; L622-N624 PolarHBondContact O-N 3.49Å; N624-S628 WeakPolarHBondContact O-CB 3.32Å; N624-S628 PolarHBondContact O-N 3.28Å
625	L	92.9	Very high	91.5	Very high	21 Å²	21	36 Å²	36	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-47.5	179	-173.1	166.7	0	0	0	112.1	L566 I569 R570 D621 L622 I623 S628 A629	L566-L625 HydrophobicContact CB-CD1 4.02Å; L566-L625 HydrophobicContact CD2-CD1 4.18Å; L566-L625 WeakPolarHBondContact O-CD1 3.48Å; I569-L625 HydrophobicContact CB-CD2 4.38Å; I569-L625 HydrophobicContact CG2-CD2 3.64Å; R570-L625 HydrophobicContact CB-CD1 4.19Å; R570-L625 HydrophobicContact CB-CD2 4.18Å; R570-L625 HydrophobicContact CB-CG 4.33Å; D621-L625 WeakPolarHBondContact O-CB 3.45Å; D621-L625 PolarHBondContact O-N 2.79Å; L622-L625 PolarHBondContact O-N 2.88Å; I623-L625 VanDerWaalsContact C-N 3.33Å; I623-L625 PolarHBondContact O-N 3.18Å; L625-S628 WeakPolarHBondContact O-CB 3.48Å; L625-S628 PolarHBondContact O-N 3.36Å; L625-A629 PolarHBondContact O-N 2.79Å; L625-A629 VanDerWaalsContact O-N 3.1Å
626	K	94.6	Very high	91.8	Very high	2 Å²	2	36 Å²	36	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-48.1	177.9	-89.2	-55.9	-153.9	170.8	0	112.6	Y510 I569 D573 Y577 M611 I615 L622 I623 S628 A629 V630	Y510-K626 VanDerWaalsContact OH-CE 3.23Å; Y510-K626 WeakPolarHBondContact OH-CE 3.22Å; Y510-K626 PolarHBondContact OH-NZ 3.19Å; I569-K626 HydrophobicContact CG2-CD 4.29Å; D573-K626 IonicContact OD1-NZ 2.7Å; D573-K626 PolarHBondContact OD1-NZ 2.87Å; D573-K626 WeakPolarHBondContact OD2-CD 3.23Å; D573-K626 WeakPolarHBondContact OD2-CE 3.31Å; D573-K626 IonicContact OD2-NZ 2.89Å; D573-K626 PolarHBondContact OD2-NZ 3.31Å; Y577-K626 PolarHBondContact OH-NZ 3.5Å; M611-K626 HydrophobicContact CE-CD 3.95Å; M611-K626 HydrophobicContact CG-CB 4.3Å; M611-K626 HydrophobicContact SD-CB 4.02Å; M611-K626 HydrophobicContact SD-CD 4.17Å; M611-K626 HydrophobicContact SD-CG 4.19Å; I615-K626 HydrophobicContact CD1-CB 3.99Å; L622-K626 HydrophobicContact CD1-CG 4Å; L622-K626 HydrophobicContact CG-CG 4.32Å; L622-K626 WeakPolarHBondContact O-CB 3.46Å; L622-K626 PolarHBondContact O-N 3.16Å; I623-K626 PolarHBondContact O-N 2.81Å; K626-S628 VanDerWaalsContact C-N 3.32Å; K626-S628 PolarHBondContact O-N 2.76Å; K626-A629 PolarHBondContact O-N 3.29Å; K626-V630 WeakPolarHBondContact O-CB 3.28Å; K626-V630 WeakPolarHBondContact O-CG2 3.38Å; K626-V630 PolarHBondContact O-N 2.82Å
627	I	93.9	Very high	92.4	Very high	15 Å²	15	29.7 Å²	29.7	8%	0.077	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-39.8	176.7	-64.1	-59.2	0	0	0	110.4	E608 M611 R612 I615 I623 A629 V630 C631	E608-I627 HydrophobicContact CG-CD1 4.48Å; M611-I627 HydrophobicContact CB-CD1 4Å; M611-I627 HydrophobicContact CG-CD1 3.64Å; R612-I627 HydrophobicContact CB-CD1 4.38Å; R612-I627 HydrophobicContact CG-CD1 3.41Å; R612-I627 VanDerWaalsContact CG-CD1 3.41Å; R612-I627 HydrophobicContact CG-CG1 4.26Å; I615-I627 HydrophobicContact CD1-CD1 4.12Å; I615-I627 HydrophobicContact CD1-CG1 4.08Å; I623-I627 HydrophobicContact CG2-CG1 4.31Å; I623-I627 VanDerWaalsContact O-CB 3.31Å; I623-I627 WeakPolarHBondContact O-CB 3.36Å; I623-I627 VanDerWaalsContact O-CG1 3.23Å; I623-I627 WeakPolarHBondContact O-CG1 3.46Å; I623-I627 PolarHBondContact O-N 3.36Å; I627-A629 PolarHBondContact O-N 2.94Å; I627-V630 PolarHBondContact O-N 3.24Å; I627-C631 VanDerWaalsContact O-CB 3.29Å; I627-C631 WeakPolarHBondContact O-CB 3.43Å; I627-C631 PolarHBondContact O-N 3.29Å; I627-C631 PolarHBondContact O-SG 3.36Å
628	S	93.1	Very high	93.1	Very high	20 Å²	20	31.1 Å²	31.1	14%	0.14	16%	0.164	C	C	.	.	H	α-helix	trans	-53.2	-50.7	174.2	176	0	0	0	0	112.8	N624 L625 K626 A632 R801	N624-S628 WeakPolarHBondContact O-CB 3.32Å; N624-S628 PolarHBondContact O-N 3.28Å; L625-S628 WeakPolarHBondContact O-CB 3.48Å; L625-S628 PolarHBondContact O-N 3.36Å; K626-S628 VanDerWaalsContact C-N 3.32Å; K626-S628 PolarHBondContact O-N 2.76Å; S628-A632 WeakPolarHBondContact O-CB 3.17Å; S628-A632 PolarHBondContact O-N 3.47Å; S628-R801 PolarHBondContact O-NH2 3.47Å; S628-R801 PolarHBondContact OG-NH2 3.22Å
629	A	94.7	Very high	93.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-70.6	-40	-178.7	0	0	0	0	0	112.7	D573 Y577 L625 K626 I627 A632 L633	D573-A629 HydrophobicContact CB-CB 3.99Å; Y577-A629 HydrophobicContact CD2-CB 3.96Å; Y577-A629 HydrophobicContact CE2-CB 3.77Å; L625-A629 PolarHBondContact O-N 2.79Å; L625-A629 VanDerWaalsContact O-N 3.1Å; K626-A629 PolarHBondContact O-N 3.29Å; I627-A629 PolarHBondContact O-N 2.94Å; A629-A632 WeakPolarHBondContact O-CB 3.47Å; A629-A632 PolarHBondContact O-N 3.34Å; A629-L633 PolarHBondContact O-N 3.05Å
630	V	96.1	Very high	94.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.4	-40.2	178.9	170.9	0	0	0	0	112.4	W533 Y577 L607 M611 K626 I627 A632 L633 A634	W533-V630 HydrophobicContact CH2-CG1 4.29Å; W533-V630 HydrophobicContact CH2-CG2 4.01Å; W533-V630 HydrophobicContact CZ2-CG2 4.24Å; Y577-V630 HydrophobicContact CE2-CG2 3.77Å; L607-V630 HydrophobicContact CB-CG1 3.88Å; L607-V630 HydrophobicContact CD2-CG1 4.25Å; M611-V630 HydrophobicContact CB-CB 4.43Å; M611-V630 HydrophobicContact CB-CG1 4.15Å; M611-V630 HydrophobicContact CB-CG2 4.16Å; M611-V630 HydrophobicContact CE-CG2 3.58Å; M611-V630 HydrophobicContact CG-CB 4.45Å; M611-V630 HydrophobicContact CG-CG2 3.97Å; K626-V630 WeakPolarHBondContact O-CB 3.28Å; K626-V630 WeakPolarHBondContact O-CG2 3.38Å; K626-V630 PolarHBondContact O-N 2.82Å; I627-V630 PolarHBondContact O-N 3.24Å; V630-A632 VanDerWaalsContact C-N 3.29Å; V630-A632 PolarHBondContact O-N 2.87Å; V630-L633 PolarHBondContact O-N 2.97Å; V630-A634 WeakPolarHBondContact O-CB 3.39Å; V630-A634 PolarHBondContact O-N 2.76Å
631	C	95.3	Very high	94.5	Very high	31 Å²	31	23.9 Å²	23.9	21%	0.209	12%	0.121	C	C	.	.	H	α-helix	trans	-64.3	-35.6	173.5	-65.1	0	0	0	0	111.3	E608 I627 A634 Q635	E608-C631 PolarHBondContact OE2-SG 2.86Å; I627-C631 VanDerWaalsContact O-CB 3.29Å; I627-C631 WeakPolarHBondContact O-CB 3.43Å; I627-C631 PolarHBondContact O-N 3.29Å; I627-C631 PolarHBondContact O-SG 3.36Å; C631-A634 PolarHBondContact O-N 2.96Å; C631-Q635 VanDerWaalsContact O-CB 3.27Å; C631-Q635 WeakPolarHBondContact O-CB 3.21Å; C631-Q635 PolarHBondContact O-N 3.29Å
632	A	94.9	Very high	94.7	Very high	5 Å²	5	20.1 Å²	20.1	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-65.2	-44.3	174.5	0	0	0	0	0	112.2	S628 A629 V630 Q635 T636 V793	S628-A632 WeakPolarHBondContact O-CB 3.17Å; S628-A632 PolarHBondContact O-N 3.47Å; A629-A632 WeakPolarHBondContact O-CB 3.47Å; A629-A632 PolarHBondContact O-N 3.34Å; V630-A632 VanDerWaalsContact C-N 3.29Å; V630-A632 PolarHBondContact O-N 2.87Å; A632-Q635 PolarHBondContact O-N 2.85Å; A632-T636 WeakPolarHBondContact O-CB 3.27Å; A632-T636 PolarHBondContact O-N 3.49Å; A632-T636 PolarHBondContact O-OG1 3.08Å; A632-V793 HydrophobicContact CB-CG1 4Å
633	L	96.7	Very high	95	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-57.8	-53.1	171.7	174.4	56.5	0	0	0	111.6	Y577 L580 A581 L607 A629 V630 Q635 T636 L637	Y577-L633 HydrophobicContact CD1-CD2 3.79Å; Y577-L633 HydrophobicContact CD2-CB 4.33Å; Y577-L633 HydrophobicContact CD2-CD2 4.49Å; Y577-L633 HydrophobicContact CE1-CD2 4.43Å; Y577-L633 HydrophobicContact CG-CB 4.23Å; Y577-L633 HydrophobicContact CG-CD2 3.83Å; Y577-L633 WeakPolarHBondContact O-CD1 3.29Å; L580-L633 HydrophobicContact CD1-CD2 4.42Å; A581-L633 HydrophobicContact CB-CD1 4.25Å; L607-L633 HydrophobicContact CD1-CD2 3.9Å; L607-L633 HydrophobicContact CD1-CG 3.94Å; L607-L633 HydrophobicContact CD2-CD2 4.44Å; A629-L633 PolarHBondContact O-N 3.05Å; V630-L633 PolarHBondContact O-N 2.97Å; L633-Q635 VanDerWaalsContact C-N 3.29Å; L633-Q635 PolarHBondContact O-N 3.31Å; L633-T636 WeakPolarHBondContact O-CB 3.37Å; L633-T636 PolarHBondContact O-N 3.3Å; L633-L637 HydrophobicContact CD1-CD1 3.99Å; L633-L637 HydrophobicContact CD1-CD2 4.49Å; L633-L637 HydrophobicContact CD1-CG 3.99Å; L633-L637 HydrophobicContact CG-CD1 4.15Å; L633-L637 WeakPolarHBondContact O-CG 3.26Å; L633-L637 PolarHBondContact O-N 3.49Å
634	A	96.8	Very high	95.1	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-58.6	-41.6	-178.1	0	0	0	0	0	111.7	L607 V630 C631 R638	L607-A634 HydrophobicContact CB-CB 4.29Å; L607-A634 HydrophobicContact CD1-CB 4.01Å; V630-A634 WeakPolarHBondContact O-CB 3.39Å; V630-A634 PolarHBondContact O-N 2.76Å; C631-A634 PolarHBondContact O-N 2.96Å; A634-R638 VanDerWaalsContact O-CG 3.29Å; A634-R638 WeakPolarHBondContact O-CG 3.44Å; A634-R638 PolarHBondContact O-N 3.06Å; A634-R638 VanDerWaalsContact O-N 3.13Å
635	Q	94.2	Very high	95.2	Very high	36 Å²	36	18.7 Å²	18.7	17%	0.168	9%	0.092	C	C	.	.	H	α-helix	trans	-68.5	-34.7	176	-177	57.9	11.4	0	0	113	C631 A632 L633 R639 M796	C631-Q635 VanDerWaalsContact O-CB 3.27Å; C631-Q635 WeakPolarHBondContact O-CB 3.21Å; C631-Q635 PolarHBondContact O-N 3.29Å; A632-Q635 PolarHBondContact O-N 2.85Å; L633-Q635 VanDerWaalsContact C-N 3.29Å; L633-Q635 PolarHBondContact O-N 3.31Å; Q635-R639 WeakPolarHBondContact O-CB 3.35Å; Q635-R639 WeakPolarHBondContact O-CG 3.45Å; Q635-R639 PolarHBondContact O-N 3.4Å; Q635-M796 HydrophobicContact CG-CE 4.11Å
636	T	95.1	Very high	95.4	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.9	-47.9	175.9	-58.2	0	0	0	0	110.8	A581 A632 L633 R638 R639 Y640 V793	A581-T636 HydrophobicContact CB-CG2 4.33Å; A632-T636 WeakPolarHBondContact O-CB 3.27Å; A632-T636 PolarHBondContact O-N 3.49Å; A632-T636 PolarHBondContact O-OG1 3.08Å; L633-T636 WeakPolarHBondContact O-CB 3.37Å; L633-T636 PolarHBondContact O-N 3.3Å; T636-R638 PolarHBondContact O-N 3.3Å; T636-R639 PolarHBondContact O-N 3.24Å; T636-Y640 HydrophobicContact CG2-CD1 4.17Å; T636-Y640 HydrophobicContact CG2-CD2 4.04Å; T636-Y640 HydrophobicContact CG2-CE1 3.67Å; T636-Y640 HydrophobicContact CG2-CE2 3.54Å; T636-Y640 HydrophobicContact CG2-CG 4.32Å; T636-Y640 WeakPolarHBondContact CG2-OH 3.19Å; T636-Y640 WeakPolarHBondContact O-CB 3.34Å; T636-Y640 WeakPolarHBondContact O-CD1 3.31Å; T636-Y640 PolarHBondContact O-N 3.47Å; T636-V793 HydrophobicContact CG2-CG2 4.12Å
637	L	96.8	Very high	95.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61	-41	176.2	-66.1	173.9	0	0	0	112.7	A581 L584 I585 I600 F603 A604 L607 L633 T641	A581-L637 HydrophobicContact CB-CD2 4.26Å; L584-L637 HydrophobicContact CB-CD2 4.32Å; L584-L637 HydrophobicContact CD1-CD1 4.33Å; L584-L637 HydrophobicContact CD1-CD2 4Å; I585-L637 HydrophobicContact CD1-CD2 4.23Å; I600-L637 HydrophobicContact CG2-CB 4.14Å; I600-L637 HydrophobicContact CG2-CD2 4.07Å; I600-L637 HydrophobicContact CG2-CG 4.48Å; F603-L637 HydrophobicContact CD1-CD1 3.78Å; F603-L637 HydrophobicContact CE1-CD1 3.78Å; A604-L637 HydrophobicContact CB-CB 3.88Å; A604-L637 HydrophobicContact CB-CD1 4.21Å; L607-L637 HydrophobicContact CD1-CD1 4.23Å; L633-L637 HydrophobicContact CD1-CD1 3.99Å; L633-L637 HydrophobicContact CD1-CD2 4.49Å; L633-L637 HydrophobicContact CD1-CG 3.99Å; L633-L637 HydrophobicContact CG-CD1 4.15Å; L633-L637 WeakPolarHBondContact O-CG 3.26Å; L633-L637 PolarHBondContact O-N 3.49Å; L637-T641 WeakPolarHBondContact O-CB 3.49Å; L637-T641 WeakPolarHBondContact O-CG2 3.4Å; L637-T641 PolarHBondContact O-N 3.06Å; L637-T641 PolarHBondContact O-OG1 3.15Å
638	R	94.9	Very high	95.6	Very high	101 Å²	101	20.7 Å²	20.7	38%	0.381	10%	0.101	S	C	.	.	H	α-helix	trans	-62.7	-46.8	174.3	-69.4	173.2	-147.1	145.3	-3.7	111.9	A604 A634 T636 T641 S642	A604-R638 HydrophobicContact CB-CG 4.12Å; A604-R638 PolarHBondContact O-NE 2.85Å; A604-R638 VanDerWaalsContact O-NE 3.17Å; A604-R638 PolarHBondContact O-NH2 3.07Å; A634-R638 VanDerWaalsContact O-CG 3.29Å; A634-R638 WeakPolarHBondContact O-CG 3.44Å; A634-R638 PolarHBondContact O-N 3.06Å; A634-R638 VanDerWaalsContact O-N 3.13Å; T636-R638 PolarHBondContact O-N 3.3Å; R638-T641 PolarHBondContact O-OG1 3.45Å; R638-S642 WeakPolarHBondContact O-CB 3.49Å; R638-S642 PolarHBondContact O-N 3.42Å
639	R	94.7	Very high	95.7	Very high	16 Å²	16	21.3 Å²	21.3	6%	0.06	11%	0.108	C	C	.	.	H	α-helix	trans	-63.5	-46.8	177.9	-78.8	176.8	58.5	-121.2	2.6	112	Q635 T636 T641 S642 L643 F777 E781 M796	Q635-R639 WeakPolarHBondContact O-CB 3.35Å; Q635-R639 WeakPolarHBondContact O-CG 3.45Å; Q635-R639 PolarHBondContact O-N 3.4Å; T636-R639 PolarHBondContact O-N 3.24Å; R639-T641 PolarHBondContact O-N 3.49Å; R639-S642 WeakPolarHBondContact O-CB 3.23Å; R639-S642 PolarHBondContact O-N 3.2Å; R639-S642 VanDerWaalsContact O-N 3.13Å; R639-L643 WeakPolarHBondContact O-CB 3.36Å; R639-L643 PolarHBondContact O-N 2.9Å; R639-F777 VanDerWaalsContact NH2-CE1 3.34Å; R639-E781 IonicContact CZ-OE2 3.81Å; R639-E781 IonicContact NH1-OE1 2.86Å; R639-E781 IonicContact NH1-OE2 3.88Å; R639-E781 PolarHBondContact NH1-OE2 3.05Å; R639-E781 IonicContact NH2-OE2 2.99Å; R639-E781 PolarHBondContact NH2-OE2 3.35Å; R639-M796 PolarHBondContact NH1-SD 3.4Å; R639-M796 VanDerWaalsContact NH1-SD 3.39Å
640	Y	96.3	Very high	95.7	Very high	7 Å²	7	21.3 Å²	21.3	3%	0.027	11%	0.108	C	C	.	.	H	α-helix	trans	-68.5	-35.4	-177.4	-69.2	12.4	0	0	0	111.8	V588 T636 N644 Y778 E781 H782	V588-Y640 HydrophobicContact CG1-CD1 4.39Å; V588-Y640 HydrophobicContact CG1-CD2 3.94Å; V588-Y640 HydrophobicContact CG1-CG 3.83Å; T636-Y640 HydrophobicContact CG2-CD1 4.17Å; T636-Y640 HydrophobicContact CG2-CD2 4.04Å; T636-Y640 HydrophobicContact CG2-CE1 3.67Å; T636-Y640 HydrophobicContact CG2-CE2 3.54Å; T636-Y640 HydrophobicContact CG2-CG 4.32Å; T636-Y640 WeakPolarHBondContact CG2-OH 3.19Å; T636-Y640 WeakPolarHBondContact O-CB 3.34Å; T636-Y640 WeakPolarHBondContact O-CD1 3.31Å; T636-Y640 PolarHBondContact O-N 3.47Å; Y640-N644 WeakPolarHBondContact O-CB 3.49Å; Y640-N644 PolarHBondContact O-N 3.38Å; Y640-Y778 HydrophobicContact CD1-CD2 4.22Å; Y640-Y778 AromaticContact CE1-CD2 3.75Å; Y640-Y778 HydrophobicContact CE1-CD2 3.75Å; Y640-Y778 HydrophobicContact CE1-CE2 4.07Å; Y640-Y778 HydrophobicContact CE2-CE2 4.26Å; Y640-Y778 AromaticContact CZ-CE2 3.95Å; Y640-E781 PolarHBondContact OH-OE1 3.02Å; Y640-H782 AromaticContact CZ-CE1 3.98Å; Y640-H782 PolarHBondContact OH-CE1 2.92Å; Y640-H782 VanDerWaalsContact OH-CE1 3.24Å
641	T	96.9	Very high	95.7	Very high	2 Å²	2	23 Å²	23	1%	0.012	11%	0.114	C	C	.	.	H	α-helix	trans	-73.1	-24.3	170.9	57.4	0	0	0	0	114	I585 T597 I600 L637 R638 R639 H645	I585-T641 HydrophobicContact CD1-CG2 3.75Å; T597-T641 HydrophobicContact CG2-CG2 4.17Å; I600-T641 HydrophobicContact CB-CG2 4.34Å; I600-T641 HydrophobicContact CG2-CG2 3.81Å; L637-T641 WeakPolarHBondContact O-CB 3.49Å; L637-T641 WeakPolarHBondContact O-CG2 3.4Å; L637-T641 PolarHBondContact O-N 3.06Å; L637-T641 PolarHBondContact O-OG1 3.15Å; R638-T641 PolarHBondContact O-OG1 3.45Å; R639-T641 PolarHBondContact O-N 3.49Å; T641-H645 PolarHBondContact O-N 2.92Å
642	S	95.1	Very high	95.6	Very high	23 Å²	23	24.8 Å²	24.8	16%	0.161	13%	0.131	C	C	.	.	H	α-helix	trans	-73.7	-49	171.1	-169.2	0	0	0	0	111.4	R638 R639 N644 H645 L646	R638-S642 WeakPolarHBondContact O-CB 3.49Å; R638-S642 PolarHBondContact O-N 3.42Å; R639-S642 WeakPolarHBondContact O-CB 3.23Å; R639-S642 PolarHBondContact O-N 3.2Å; R639-S642 VanDerWaalsContact O-N 3.13Å; S642-N644 VanDerWaalsContact C-N 3.27Å; S642-N644 PolarHBondContact O-N 3.26Å; S642-H645 WeakPolarHBondContact O-CB 3.22Å; S642-H645 PolarHBondContact O-N 3.43Å; S642-L646 PolarHBondContact O-N 3.05Å
643	L	96.6	Very high	95.5	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-56.9	-39.6	173.7	176.1	56.1	0	0	0	111.6	V588 R639 H645 L646 A647 L771 E774 Y775 Y778	V588-L643 HydrophobicContact CB-CD2 3.96Å; V588-L643 HydrophobicContact CB-CG 4.27Å; V588-L643 HydrophobicContact CG1-CD2 4.33Å; V588-L643 HydrophobicContact CG2-CD2 3.83Å; V588-L643 HydrophobicContact CG2-CG 4.37Å; R639-L643 WeakPolarHBondContact O-CB 3.36Å; R639-L643 PolarHBondContact O-N 2.9Å; L643-H645 VanDerWaalsContact C-N 3.35Å; L643-H645 PolarHBondContact O-N 3.37Å; L643-L646 PolarHBondContact O-N 3.4Å; L643-A647 WeakPolarHBondContact O-CB 3.3Å; L643-A647 PolarHBondContact O-N 3.06Å; L643-L771 HydrophobicContact CD1-CD1 3.79Å; L643-E774 HydrophobicContact CD1-CB 3.94Å; L643-Y775 HydrophobicContact CD1-CD2 4.25Å; L643-Y775 HydrophobicContact CD2-CD2 4.22Å; L643-Y778 HydrophobicContact CD2-CD2 4.14Å; L643-Y778 HydrophobicContact CD2-CG 4.01Å
644	N	96.1	Very high	95.3	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.027	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-39.1	174.4	-167.8	-101.7	0	0	0	113.2	V588 R590 I592 Y640 S642 A647 Q648	V588-N644 VanDerWaalsContact O-CA 3.29Å; V588-N644 WeakPolarHBondContact O-CA 3.38Å; V588-N644 PolarHBondContact O-ND2 3.23Å; R590-N644 PolarHBondContact O-ND2 2.86Å; I592-N644 HydrophobicContact CD1-CB 4.21Å; Y640-N644 WeakPolarHBondContact O-CB 3.49Å; Y640-N644 PolarHBondContact O-N 3.38Å; S642-N644 VanDerWaalsContact C-N 3.27Å; S642-N644 PolarHBondContact O-N 3.26Å; N644-A647 WeakPolarHBondContact O-CB 3.26Å; N644-A647 PolarHBondContact O-N 3.46Å; N644-Q648 PolarHBondContact ND2-NE2 2.88Å; N644-Q648 VanDerWaalsContact O-CG 3.28Å; N644-Q648 WeakPolarHBondContact O-CG 3.31Å; N644-Q648 PolarHBondContact O-N 3.14Å; N644-Q648 PolarHBondContact O-NE2 3.45Å
645	H	94.5	Very high	95.1	Very high	102 Å²	102	33.9 Å²	33.9	47%	0.472	17%	0.171	S	C	.	.	H	α-helix	trans	-67.2	-45	177	-174.7	-100.5	0	0	0	111.4	T641 S642 L643 A647 Q648 A649	T641-H645 PolarHBondContact O-N 2.92Å; S642-H645 WeakPolarHBondContact O-CB 3.22Å; S642-H645 PolarHBondContact O-N 3.43Å; L643-H645 VanDerWaalsContact C-N 3.35Å; L643-H645 PolarHBondContact O-N 3.37Å; H645-A647 VanDerWaalsContact C-N 3.3Å; H645-A647 PolarHBondContact O-N 3.01Å; H645-Q648 PolarHBondContact O-N 2.94Å; H645-A649 PolarHBondContact O-N 3.04Å
646	L	96.7	Very high	95	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-41.9	172	-69.4	172.2	0	0	0	111.7	S642 L643 Q648 A649 A650 L767 L770 L771 E774	S642-L646 PolarHBondContact O-N 3.05Å; L643-L646 PolarHBondContact O-N 3.4Å; L646-Q648 PolarHBondContact O-N 2.88Å; L646-A649 PolarHBondContact O-N 2.99Å; L646-A650 VanDerWaalsContact O-CB 3.28Å; L646-A650 WeakPolarHBondContact O-CB 3.35Å; L646-A650 PolarHBondContact O-N 3.16Å; L646-L767 HydrophobicContact CD2-CD1 4.11Å; L646-L770 HydrophobicContact CD2-CB 4.19Å; L646-L771 HydrophobicContact CB-CB 4.36Å; L646-L771 HydrophobicContact CB-CD1 4.05Å; L646-E774 HydrophobicContact CD1-CB 4.41Å; L646-E774 HydrophobicContact CD1-CG 4.04Å
647	A	96.9	Very high	95	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-41.1	176.3	0	0	0	0	0	112.5	L589 L643 N644 H645 R651 L707 L771	L589-A647 HydrophobicContact CD2-CB 4.03Å; L643-A647 WeakPolarHBondContact O-CB 3.3Å; L643-A647 PolarHBondContact O-N 3.06Å; N644-A647 WeakPolarHBondContact O-CB 3.26Å; N644-A647 PolarHBondContact O-N 3.46Å; H645-A647 VanDerWaalsContact C-N 3.3Å; H645-A647 PolarHBondContact O-N 3.01Å; A647-R651 PolarHBondContact O-N 3.26Å; A647-L707 HydrophobicContact CB-CD2 3.82Å; A647-L707 WeakPolarHBondContact O-CD2 3.44Å; A647-L771 HydrophobicContact CB-CD1 4.25Å
648	Q	94.6	Very high	94.9	Very high	52 Å²	52	42.4 Å²	42.4	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-68.5	-43.3	177.1	-58.3	-24	-57.3	0	0	112.1	L589 N644 H645 L646 R651 A652	L589-Q648 PolarHBondContact O-NE2 3.19Å; L589-Q648 VanDerWaalsContact O-NE2 3.14Å; N644-Q648 PolarHBondContact ND2-NE2 2.88Å; N644-Q648 VanDerWaalsContact O-CG 3.28Å; N644-Q648 WeakPolarHBondContact O-CG 3.31Å; N644-Q648 PolarHBondContact O-N 3.14Å; N644-Q648 PolarHBondContact O-NE2 3.45Å; H645-Q648 PolarHBondContact O-N 2.94Å; L646-Q648 PolarHBondContact O-N 2.88Å; Q648-R651 PolarHBondContact O-N 2.98Å; Q648-A652 PolarHBondContact O-N 3.28Å
649	A	95.2	Very high	94.8	Very high	34 Å²	34	40.7 Å²	40.7	28%	0.281	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-44.4	176.2	0	0	0	0	0	111.4	H645 L646 R651 A652 V653 L767	H645-A649 PolarHBondContact O-N 3.04Å; L646-A649 PolarHBondContact O-N 2.99Å; A649-R651 PolarHBondContact O-N 2.79Å; A649-A652 WeakPolarHBondContact O-CB 3.26Å; A649-A652 PolarHBondContact O-N 3.2Å; A649-A652 VanDerWaalsContact O-N 3.11Å; A649-V653 PolarHBondContact O-N 3.44Å; A649-L767 HydrophobicContact CB-CD1 4Å; A649-L767 HydrophobicContact CB-CD2 3.86Å; A649-L767 HydrophobicContact CB-CG 4.48Å
650	A	95.9	Very high	94.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-35.9	175.7	0	0	0	0	0	112.9	L646 A652 V653 L654 L771	L646-A650 VanDerWaalsContact O-CB 3.28Å; L646-A650 WeakPolarHBondContact O-CB 3.35Å; L646-A650 PolarHBondContact O-N 3.16Å; A650-A652 PolarHBondContact O-N 3.39Å; A650-V653 PolarHBondContact O-N 2.94Å; A650-L654 WeakPolarHBondContact O-CB 3.43Å; A650-L654 WeakPolarHBondContact O-CG 3.46Å; A650-L654 PolarHBondContact O-N 2.78Å; A650-L771 HydrophobicContact CB-CD2 3.49Å; A650-L771 VanDerWaalsContact CB-CD2 3.49Å
651	R	95	Very high	94.8	Very high	36 Å²	36	43.9 Å²	43.9	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-30.5	171.8	-84.5	-152.5	-166.7	87.1	4.1	112.9	L589 A647 Q648 A649 K655 L707 E708	L589-R651 VanDerWaalsContact O-CZ 3.24Å; L589-R651 PolarHBondContact O-NH1 2.77Å; L589-R651 PolarHBondContact O-NH2 3.32Å; A647-R651 PolarHBondContact O-N 3.26Å; Q648-R651 PolarHBondContact O-N 2.98Å; A649-R651 PolarHBondContact O-N 2.79Å; R651-K655 WeakPolarHBondContact O-CB 3.45Å; R651-K655 VanDerWaalsContact O-CG 3.22Å; R651-K655 WeakPolarHBondContact O-CG 3.26Å; R651-K655 PolarHBondContact O-N 2.66Å; R651-K655 VanDerWaalsContact O-N 3.08Å; R651-L707 HydrophobicContact CG-CB 3.86Å; R651-L707 HydrophobicContact CG-CD2 3.6Å; R651-L707 HydrophobicContact CG-CG 4.37Å; R651-E708 IonicContact CZ-OE1 3.67Å; R651-E708 VanDerWaalsContact CZ-OE1 3.22Å; R651-E708 IonicContact NE-OE1 3.62Å; R651-E708 PolarHBondContact NE-OE1 3.08Å; R651-E708 IonicContact NH2-OE1 2.87Å; R651-E708 PolarHBondContact NH2-OE1 3.12Å
652	A	93	Very high	94.7	Very high	67 Å²	67	47.3 Å²	47.3	55%	0.554	26%	0.255	S	S	*	.	H	α-helix	trans	-68.6	-41.6	176.4	0	0	0	0	0	111.7	Q648 A649 A650	Q648-A652 PolarHBondContact O-N 3.28Å; A649-A652 WeakPolarHBondContact O-CB 3.26Å; A649-A652 PolarHBondContact O-N 3.2Å; A649-A652 VanDerWaalsContact O-N 3.11Å; A650-A652 PolarHBondContact O-N 3.39Å
653	V	93.2	Very high	94.8	Very high	13 Å²	13	46.2 Å²	46.2	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-51.2	172.8	172.3	0	0	0	0	111.1	A649 A650 K655 N656 M663 L767 I768	A649-V653 PolarHBondContact O-N 3.44Å; A650-V653 PolarHBondContact O-N 2.94Å; V653-K655 PolarHBondContact O-N 3.12Å; V653-N656 WeakPolarHBondContact O-CB 3.36Å; V653-N656 PolarHBondContact O-N 2.79Å; V653-M663 HydrophobicContact CG1-SD 4Å; V653-L767 HydrophobicContact CG2-CD2 3.88Å; V653-I768 HydrophobicContact CG1-CD1 4.21Å
654	L	93.2	Very high	94.8	Very high	13 Å²	13	47 Å²	47	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-17.8	-175.8	-66.9	174.8	0	0	0	113.9	A650 I660 L707 I768	A650-L654 WeakPolarHBondContact O-CB 3.43Å; A650-L654 WeakPolarHBondContact O-CG 3.46Å; A650-L654 PolarHBondContact O-N 2.78Å; L654-I660 VanDerWaalsContact O-CD1 3.26Å; L654-I660 WeakPolarHBondContact O-CD1 3.48Å; L654-L707 HydrophobicContact CD1-CB 4.15Å; L654-L707 HydrophobicContact CD1-CD1 4.18Å; L654-I768 HydrophobicContact CD2-CD1 4.12Å
655	K	91.7	Very high	94.7	Very high	173 Å²	173	48.8 Å²	48.8	75%	0.752	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.9	169.5	-76.3	174.7	178.8	-176.6	0	113.5	R651 V653 A657	R651-K655 WeakPolarHBondContact O-CB 3.45Å; R651-K655 VanDerWaalsContact O-CG 3.22Å; R651-K655 WeakPolarHBondContact O-CG 3.26Å; R651-K655 PolarHBondContact O-N 2.66Å; R651-K655 VanDerWaalsContact O-N 3.08Å; V653-K655 PolarHBondContact O-N 3.12Å; K655-A657 PolarHBondContact O-N 2.71Å
656	N	93.5	Very high	94.8	Very high	42 Å²	42	44.1 Å²	44.1	23%	0.225	25%	0.245	C	C	.	.			trans	-95.7	96.1	-174.8	-169.1	-28.5	0	0	0	111.4	V653 N658 Q659 I660	V653-N656 WeakPolarHBondContact O-CB 3.36Å; V653-N656 PolarHBondContact O-N 2.79Å; N656-N658 PolarHBondContact O-N 2.8Å; N656-N658 VanDerWaalsContact O-N 3.14Å; N656-N658 WeakPolarHBondContact OD1-CB 3.46Å; N656-N658 PolarHBondContact OD1-N 2.66Å; N656-N658 VanDerWaalsContact OD1-N 3.12Å; N656-Q659 HydrophobicContact CB-CB 4.09Å; N656-Q659 HydrophobicContact CB-CG 4.04Å; N656-Q659 PolarHBondContact ND2-NE2 2.89Å; N656-Q659 PolarHBondContact O-N 3.13Å; N656-Q659 PolarHBondContact OD1-N 3.17Å; N656-I660 PolarHBondContact O-N 3.42Å
657	A	94.1	Very high	94.7	Very high	46 Å²	46	43 Å²	43	38%	0.38	24%	0.239	S	C	.	.	H	α-helix	trans	-56.5	-30	179.9	0	0	0	0	0	113.9	K655 N661	K655-A657 PolarHBondContact O-N 2.71Å; A657-N661 PolarHBondContact O-N 2.87Å; A657-N661 PolarHBondContact O-ND2 3.22Å
658	N	94.2	Very high	94.6	Very high	128 Å²	128	47.5 Å²	47.5	68%	0.684	26%	0.263	S	S	*	.	H	α-helix	trans	-71.2	-38.9	176.2	-67.4	-25.6	0	0	0	111.6	N656 Q662	N656-N658 PolarHBondContact O-N 2.8Å; N656-N658 VanDerWaalsContact O-N 3.14Å; N656-N658 WeakPolarHBondContact OD1-CB 3.46Å; N656-N658 PolarHBondContact OD1-N 2.66Å; N656-N658 VanDerWaalsContact OD1-N 3.12Å; N658-Q662 WeakPolarHBondContact O-CB 3.49Å; N658-Q662 PolarHBondContact O-N 2.75Å; N658-Q662 VanDerWaalsContact O-N 3.09Å
659	Q	93.2	Very high	94.6	Very high	65 Å²	65	52.2 Å²	52.2	30%	0.304	28%	0.279	S	S	.	.	H	α-helix	trans	-66.2	-43.6	173.4	-68.6	-176.4	18.4	0	0	111.2	N656 N661 Q662 M663 S764	N656-Q659 HydrophobicContact CB-CB 4.09Å; N656-Q659 HydrophobicContact CB-CG 4.04Å; N656-Q659 PolarHBondContact ND2-NE2 2.89Å; N656-Q659 PolarHBondContact O-N 3.13Å; N656-Q659 PolarHBondContact OD1-N 3.17Å; Q659-N661 PolarHBondContact O-N 3.27Å; Q659-Q662 PolarHBondContact O-N 3.23Å; Q659-M663 WeakPolarHBondContact O-CB 3.28Å; Q659-M663 VanDerWaalsContact O-CG 3.27Å; Q659-M663 WeakPolarHBondContact O-CG 3.38Å; Q659-M663 PolarHBondContact O-N 3.45Å; Q659-S764 PolarHBondContact OE1-OG 2.99Å
660	I	94.9	Very high	94.5	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-58.5	-45.4	176.7	-72.9	172.1	0	0	0	111.9	L654 N656 Q662 M663 L664 L701 H704	L654-I660 VanDerWaalsContact O-CD1 3.26Å; L654-I660 WeakPolarHBondContact O-CD1 3.48Å; N656-I660 PolarHBondContact O-N 3.42Å; I660-Q662 VanDerWaalsContact C-N 3.35Å; I660-Q662 PolarHBondContact O-N 3.44Å; I660-M663 WeakPolarHBondContact O-CB 3.24Å; I660-M663 PolarHBondContact O-N 3.24Å; I660-L664 HydrophobicContact CG2-CD1 4.16Å; I660-L664 WeakPolarHBondContact O-CG 3.39Å; I660-L664 PolarHBondContact O-N 2.93Å; I660-L701 HydrophobicContact CB-CD1 4.35Å; I660-L701 HydrophobicContact CG1-CD1 4.07Å; I660-L701 HydrophobicContact CG2-CD1 3.85Å; I660-L701 HydrophobicContact CG2-CG 4.11Å; I660-L701 VanDerWaalsContact CG2-O 3.26Å; I660-L701 WeakPolarHBondContact CG2-O 3.14Å; I660-H704 HydrophobicContact CD1-CB 4.37Å; I660-H704 WeakPolarHBondContact CD1-ND1 3.39Å; I660-H704 VanDerWaalsContact CG2-CE1 3.46Å; I660-H704 WeakPolarHBondContact CG2-CE1 3.44Å
661	N	95.4	Very high	94.3	Very high	88 Å²	88	54.2 Å²	54.2	47%	0.471	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-38.7	177.3	-81.2	-71.5	0	0	0	112.3	A657 Q659 L664 A665	A657-N661 PolarHBondContact O-N 2.87Å; A657-N661 PolarHBondContact O-ND2 3.22Å; Q659-N661 PolarHBondContact O-N 3.27Å; N661-L664 PolarHBondContact O-N 3.16Å; N661-A665 PolarHBondContact O-N 3.21Å
662	Q	96	Very high	94.1	Very high	74 Å²	74	53.9 Å²	53.9	35%	0.346	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-37	174.8	-172.3	55	65.3	0	0	112.4	N658 Q659 I660 A665 D666 S760	N658-Q662 WeakPolarHBondContact O-CB 3.49Å; N658-Q662 PolarHBondContact O-N 2.75Å; N658-Q662 VanDerWaalsContact O-N 3.09Å; Q659-Q662 PolarHBondContact O-N 3.23Å; I660-Q662 VanDerWaalsContact C-N 3.35Å; I660-Q662 PolarHBondContact O-N 3.44Å; Q662-A665 PolarHBondContact O-N 3.01Å; Q662-D666 PolarHBondContact NE2-OD1 3.41Å; Q662-D666 PolarHBondContact NE2-OD2 3.04Å; Q662-D666 VanDerWaalsContact NE2-OD2 3.17Å; Q662-D666 PolarHBondContact O-N 2.99Å; Q662-S760 WeakPolarHBondContact CG-OG 3.35Å; Q662-S760 PolarHBondContact NE2-OG 3.19Å
663	M	96.6	Very high	94	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-44.5	173.1	-75.7	171.7	67.8	0	0	111.6	V653 Q659 I660 A665 D666 L667 L701 F765 I768	V653-M663 HydrophobicContact CG1-SD 4Å; Q659-M663 WeakPolarHBondContact O-CB 3.28Å; Q659-M663 VanDerWaalsContact O-CG 3.27Å; Q659-M663 WeakPolarHBondContact O-CG 3.38Å; Q659-M663 PolarHBondContact O-N 3.45Å; I660-M663 WeakPolarHBondContact O-CB 3.24Å; I660-M663 PolarHBondContact O-N 3.24Å; M663-A665 VanDerWaalsContact C-N 3.34Å; M663-A665 PolarHBondContact O-N 3.32Å; M663-D666 PolarHBondContact O-N 3.11Å; M663-L667 WeakPolarHBondContact O-CB 3.42Å; M663-L667 PolarHBondContact O-N 2.97Å; M663-L701 HydrophobicContact CB-CD2 3.96Å; M663-L701 HydrophobicContact CE-CD1 4.04Å; M663-L701 HydrophobicContact CE-CD2 4.35Å; M663-L701 HydrophobicContact SD-CD1 4.5Å; M663-F765 HydrophobicContact CB-CE2 3.67Å; M663-F765 HydrophobicContact CB-CZ 3.61Å; M663-F765 HydrophobicContact CE-CD1 3.95Å; M663-F765 HydrophobicContact CE-CE1 3.7Å; M663-F765 HydrophobicContact CE-CE2 4.33Å; M663-F765 HydrophobicContact CE-CG 4.34Å; M663-F765 HydrophobicContact CE-CZ 3.88Å; M663-F765 HydrophobicContact CG-CD2 4.19Å; M663-F765 HydrophobicContact CG-CE2 3.74Å; M663-F765 HydrophobicContact CG-CZ 4.01Å; M663-F765 WeakPolarHBondContact O-CE2 3.42Å; M663-F765 WeakPolarHBondContact O-CZ 3.01Å; M663-I768 HydrophobicContact CE-CD1 3.51Å; M663-I768 HydrophobicContact SD-CD1 4.41Å
664	L	95.8	Very high	93.8	Very high	19 Å²	19	58.4 Å²	58.4	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-42	174.2	-74.6	164.5	0	0	0	112	I660 N661 N668 L701 Q702	I660-L664 HydrophobicContact CG2-CD1 4.16Å; I660-L664 WeakPolarHBondContact O-CG 3.39Å; I660-L664 PolarHBondContact O-N 2.93Å; N661-L664 PolarHBondContact O-N 3.16Å; L664-N668 WeakPolarHBondContact O-CB 3.5Å; L664-N668 VanDerWaalsContact O-CG 3.28Å; L664-N668 PolarHBondContact O-N 3.49Å; L664-N668 PolarHBondContact O-ND2 2.87Å; L664-L701 HydrophobicContact CD1-CG 4.38Å; L664-L701 HydrophobicContact CD2-CB 3.99Å; L664-L701 HydrophobicContact CD2-CD2 3.67Å; L664-L701 HydrophobicContact CD2-CG 3.81Å; L664-L701 HydrophobicContact CG-CB 4.47Å; L664-L701 HydrophobicContact CG-CD2 3.73Å; L664-L701 HydrophobicContact CG-CG 3.79Å; L664-Q702 HydrophobicContact CD1-CG 3.94Å; L664-Q702 HydrophobicContact CD2-CG 3.73Å
665	A	95.8	Very high	93.7	Very high	43 Å²	43	58 Å²	58	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-36.9	178.2	0	0	0	0	0	112.9	N661 Q662 M663 R669	N661-A665 PolarHBondContact O-N 3.21Å; Q662-A665 PolarHBondContact O-N 3.01Å; M663-A665 VanDerWaalsContact C-N 3.34Å; M663-A665 PolarHBondContact O-N 3.32Å; A665-R669 WeakPolarHBondContact O-CG 2.98Å
666	D	96.4	Very high	93.5	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-78.8	-38.5	176.9	-71.2	-30.4	0	0	0	112.4	Q662 M663 N668 R669 L754 A759 S760 S761	Q662-D666 PolarHBondContact NE2-OD1 3.41Å; Q662-D666 PolarHBondContact NE2-OD2 3.04Å; Q662-D666 VanDerWaalsContact NE2-OD2 3.17Å; Q662-D666 PolarHBondContact O-N 2.99Å; M663-D666 PolarHBondContact O-N 3.11Å; D666-N668 VanDerWaalsContact C-N 3.35Å; D666-N668 PolarHBondContact O-N 3.39Å; D666-R669 WeakPolarHBondContact O-CB 3.1Å; D666-R669 PolarHBondContact O-N 3.05Å; D666-R669 IonicContact OD1-CZ 2.64Å; D666-R669 IonicContact OD1-NH1 3.82Å; D666-R669 PolarHBondContact OD1-NH1 3.08Å; D666-L754 HydrophobicContact CB-CD2 4.33Å; D666-A759 HydrophobicContact CB-CB 4.02Å; D666-S760 PolarHBondContact OD2-N 2.73Å; D666-S760 VanDerWaalsContact OD2-N 3.13Å; D666-S760 PolarHBondContact OD2-OG 3.45Å; D666-S761 WeakPolarHBondContact CB-OG 3.33Å; D666-S761 PolarHBondContact OD2-N 2.95Å; D666-S761 VanDerWaalsContact OD2-N 3.11Å; D666-S761 PolarHBondContact OD2-OG 3.23Å
667	L	95	Very high	93.3	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-64.6	-36.8	176.6	-170.6	67.1	0	0	0	112.7	M663 R669 V670 F672 F697 K698 L701 V750 F765	M663-L667 WeakPolarHBondContact O-CB 3.42Å; M663-L667 PolarHBondContact O-N 2.97Å; L667-R669 PolarHBondContact O-N 3.32Å; L667-R669 VanDerWaalsContact O-N 3.14Å; L667-V670 WeakPolarHBondContact O-CB 3.1Å; L667-V670 PolarHBondContact O-N 2.96Å; L667-V670 VanDerWaalsContact O-N 3.09Å; L667-F672 HydrophobicContact CD1-CE2 4.09Å; L667-F672 HydrophobicContact CD1-CZ 3.82Å; L667-F672 HydrophobicContact CG-CE2 4.4Å; L667-F672 HydrophobicContact CG-CZ 4.5Å; L667-F697 HydrophobicContact CD2-CD1 3.62Å; L667-F697 HydrophobicContact CD2-CE1 3.75Å; L667-K698 HydrophobicContact CD2-CG 3.77Å; L667-L701 HydrophobicContact CD2-CD2 4.46Å; L667-V750 HydrophobicContact CD1-CG1 4.5Å; L667-F765 HydrophobicContact CB-CZ 3.87Å; L667-F765 HydrophobicContact CD1-CE1 4.17Å; L667-F765 HydrophobicContact CD1-CZ 4.18Å; L667-F765 HydrophobicContact CG-CZ 4.42Å
668	N	94.6	Very high	92.9	Very high	94 Å²	94	57.3 Å²	57.3	50%	0.503	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-1.9	174.7	-73.9	-34.3	0	0	0	113.6	L664 D666 K698	L664-N668 WeakPolarHBondContact O-CB 3.5Å; L664-N668 VanDerWaalsContact O-CG 3.28Å; L664-N668 PolarHBondContact O-N 3.49Å; L664-N668 PolarHBondContact O-ND2 2.87Å; D666-N668 VanDerWaalsContact C-N 3.35Å; D666-N668 PolarHBondContact O-N 3.39Å; N668-K698 WeakPolarHBondContact OD1-CE 3.18Å; N668-K698 PolarHBondContact OD1-NZ 3.24Å
669	R	94.6	Very high	92.6	Very high	152 Å²	152	51.2 Å²	51.2	57%	0.574	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-11.7	170.1	-62.5	165.2	171.8	166	-9.8	113.1	A665 D666 L667 R757	A665-R669 WeakPolarHBondContact O-CG 2.98Å; D666-R669 WeakPolarHBondContact O-CB 3.1Å; D666-R669 PolarHBondContact O-N 3.05Å; D666-R669 IonicContact OD1-CZ 2.64Å; D666-R669 IonicContact OD1-NH1 3.82Å; D666-R669 PolarHBondContact OD1-NH1 3.08Å; L667-R669 PolarHBondContact O-N 3.32Å; L667-R669 VanDerWaalsContact O-N 3.14Å; R669-R757 PolarHBondContact O-NE 3.48Å; R669-R757 PolarHBondContact O-NH1 2.83Å
670	V	93.3	Very high	92.3	Very high	11 Å²	11	50.2 Å²	50.2	7%	0.067	26%	0.255	C	S	.	.	S	Bend	trans	-72.5	131.1	178.4	174	0	0	0	0	109.7	L667 F672 V675 V750 D753 L754	L667-V670 WeakPolarHBondContact O-CB 3.1Å; L667-V670 PolarHBondContact O-N 2.96Å; L667-V670 VanDerWaalsContact O-N 3.09Å; V670-F672 HydrophobicContact CB-CD2 4.14Å; V670-F672 HydrophobicContact CB-CE2 3.74Å; V670-F672 HydrophobicContact CB-CZ 4.38Å; V670-F672 HydrophobicContact CG1-CD2 3.89Å; V670-F672 HydrophobicContact CG1-CE1 4.5Å; V670-F672 HydrophobicContact CG1-CE2 3.67Å; V670-F672 HydrophobicContact CG1-CG 4.4Å; V670-F672 HydrophobicContact CG1-CZ 4Å; V670-F672 PolarHBondContact O-N 3.04Å; V670-V675 HydrophobicContact CG1-CG2 4.43Å; V670-V750 HydrophobicContact CG1-CG1 4.43Å; V670-D753 WeakPolarHBondContact CA-OD1 3.49Å; V670-D753 HydrophobicContact CG1-CB 4.39Å; V670-D753 WeakPolarHBondContact CG1-OD1 3.41Å; V670-L754 HydrophobicContact CG2-CD2 3.63Å; V670-L754 HydrophobicContact CG2-CG 3.91Å
671	D	91.3	Very high	91.7	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	29%	0.294	S	S	.	.			trans	-88.3	87.9	176.2	-174.9	1.6	0	0	0	110.5	N673 N674 V675	D671-N673 PolarHBondContact O-N 2.63Å; D671-N673 WeakPolarHBondContact OD1-CB 3.45Å; D671-N673 PolarHBondContact OD1-N 2.94Å; D671-N673 PolarHBondContact OD1-ND2 3Å; D671-N674 HydrophobicContact CB-CB 4.15Å; D671-N674 PolarHBondContact O-N 3.45Å; D671-N674 PolarHBondContact OD1-N 2.71Å; D671-N674 WeakPolarHBondContact OD2-CB 3.5Å; D671-V675 PolarHBondContact O-N 3.34Å; D671-V675 VanDerWaalsContact O-N 3.08Å
672	F	91	Very high	91.1	Very high	28 Å²	28	58.6 Å²	58.6	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-28.6	179.4	-79	-86.8	0	0	0	113.2	L667 V670 V675 Q676 E694 V750	L667-F672 HydrophobicContact CD1-CE2 4.09Å; L667-F672 HydrophobicContact CD1-CZ 3.82Å; L667-F672 HydrophobicContact CG-CE2 4.4Å; L667-F672 HydrophobicContact CG-CZ 4.5Å; V670-F672 HydrophobicContact CB-CD2 4.14Å; V670-F672 HydrophobicContact CB-CE2 3.74Å; V670-F672 HydrophobicContact CB-CZ 4.38Å; V670-F672 HydrophobicContact CG1-CD2 3.89Å; V670-F672 HydrophobicContact CG1-CE1 4.5Å; V670-F672 HydrophobicContact CG1-CE2 3.67Å; V670-F672 HydrophobicContact CG1-CG 4.4Å; V670-F672 HydrophobicContact CG1-CZ 4Å; V670-F672 PolarHBondContact O-N 3.04Å; F672-V675 PolarHBondContact O-N 2.72Å; F672-Q676 WeakPolarHBondContact O-CB 3.03Å; F672-Q676 PolarHBondContact O-N 3.06Å; F672-E694 VanDerWaalsContact CB-OE2 3.32Å; F672-E694 WeakPolarHBondContact CB-OE2 3.38Å; F672-E694 HydrophobicContact CD1-CB 4.47Å; F672-E694 HydrophobicContact CD1-CG 3.89Å; F672-E694 HydrophobicContact CD2-CG 3.94Å; F672-E694 HydrophobicContact CE1-CG 3.91Å; F672-E694 HydrophobicContact CE2-CG 3.96Å; F672-E694 HydrophobicContact CG-CG 3.92Å; F672-E694 WeakPolarHBondContact CG-OE2 3.41Å; F672-E694 HydrophobicContact CZ-CG 3.95Å; F672-V750 HydrophobicContact CE1-CG2 3.84Å; F672-V750 HydrophobicContact CZ-CG1 4.35Å; F672-V750 HydrophobicContact CZ-CG2 4.4Å
673	N	89.9	Confident	90.6	Very high	124 Å²	124	55.1 Å²	55.1	66%	0.663	27%	0.27	S	S	*	.	H	α-helix	trans	-64.4	-46.3	176.1	-47.1	-84.4	0	0	0	110.8	D671 Q676 E677	D671-N673 PolarHBondContact O-N 2.63Å; D671-N673 WeakPolarHBondContact OD1-CB 3.45Å; D671-N673 PolarHBondContact OD1-N 2.94Å; D671-N673 PolarHBondContact OD1-ND2 3Å; N673-Q676 PolarHBondContact O-N 3.37Å; N673-E677 WeakPolarHBondContact O-CB 3.31Å; N673-E677 PolarHBondContact O-N 3.27Å
674	N	89.2	Confident	90	Very high	51 Å²	51	62.5 Å²	62.5	27%	0.273	30%	0.304	S	S	.	.	H	α-helix	trans	-67.9	-34.4	176.9	167.4	62.5	0	0	0	112.5	D671 Q678	D671-N674 HydrophobicContact CB-CB 4.15Å; D671-N674 PolarHBondContact O-N 3.45Å; D671-N674 PolarHBondContact OD1-N 2.71Å; D671-N674 WeakPolarHBondContact OD2-CB 3.5Å; N674-Q678 PolarHBondContact ND2-NE2 2.67Å; N674-Q678 VanDerWaalsContact O-CG 3.29Å; N674-Q678 WeakPolarHBondContact O-CG 3.28Å; N674-Q678 PolarHBondContact O-N 2.81Å; N674-Q678 PolarHBondContact O-NE2 2.93Å; N674-Q678 PolarHBondContact OD1-NE2 3.05Å
675	V	90.5	Very high	89.4	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.03	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-46.4	171.2	171.3	0	0	0	0	110.7	V670 D671 F672 Q678 A679 Y746 M749 V750	V670-V675 HydrophobicContact CG1-CG2 4.43Å; D671-V675 PolarHBondContact O-N 3.34Å; D671-V675 VanDerWaalsContact O-N 3.08Å; F672-V675 PolarHBondContact O-N 2.72Å; V675-Q678 PolarHBondContact O-N 3.47Å; V675-A679 VanDerWaalsContact O-CB 3.23Å; V675-A679 WeakPolarHBondContact O-CB 3.16Å; V675-A679 PolarHBondContact O-N 3.09Å; V675-Y746 HydrophobicContact CG1-CD1 4.16Å; V675-Y746 HydrophobicContact CG1-CE1 4.28Å; V675-M749 HydrophobicContact CG1-CB 3.87Å; V675-V750 HydrophobicContact CG1-CG2 4.26Å
676	Q	88.7	Confident	88.9	Confident	23 Å²	23	64.3 Å²	64.3	11%	0.107	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-40.7	-177.9	-176.7	171.9	-25.1	0	0	112.8	F672 N673 Q678 A679 S680 D687 V690	F672-Q676 WeakPolarHBondContact O-CB 3.03Å; F672-Q676 PolarHBondContact O-N 3.06Å; N673-Q676 PolarHBondContact O-N 3.37Å; Q676-Q678 VanDerWaalsContact C-N 3.33Å; Q676-Q678 PolarHBondContact O-N 3.19Å; Q676-A679 PolarHBondContact O-N 3.42Å; Q676-S680 VanDerWaalsContact O-CB 3.29Å; Q676-S680 WeakPolarHBondContact O-CB 3.44Å; Q676-S680 PolarHBondContact O-N 3.02Å; Q676-D687 VanDerWaalsContact NE2-CA 3.32Å; Q676-D687 VanDerWaalsContact NE2-CG 3.29Å; Q676-D687 PolarHBondContact NE2-OD1 3.48Å; Q676-V690 HydrophobicContact CG-CG1 4.3Å
677	E	87.8	Confident	88.4	Confident	133 Å²	133	69 Å²	69	62%	0.621	34%	0.34	S	S	*	.	H	α-helix	trans	-55.2	-49.7	173.5	-173.4	-168.7	157.4	0	0	110.4	N673 S680	N673-E677 WeakPolarHBondContact O-CB 3.31Å; N673-E677 PolarHBondContact O-N 3.27Å; E677-S680 PolarHBondContact O-OG 3.21Å
678	Q	86	Confident	88.2	Confident	91 Å²	91	73 Å²	73	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-68.7	-38	179.4	-65.8	176	44.5	0	0	112.8	N674 V675 Q676 M749	N674-Q678 PolarHBondContact ND2-NE2 2.67Å; N674-Q678 VanDerWaalsContact O-CG 3.29Å; N674-Q678 WeakPolarHBondContact O-CG 3.28Å; N674-Q678 PolarHBondContact O-N 2.81Å; N674-Q678 PolarHBondContact O-NE2 2.93Å; N674-Q678 PolarHBondContact OD1-NE2 3.05Å; V675-Q678 PolarHBondContact O-N 3.47Å; Q676-Q678 VanDerWaalsContact C-N 3.33Å; Q676-Q678 PolarHBondContact O-N 3.19Å; Q678-M749 HydrophobicContact CB-CE 3.49Å; Q678-M749 VanDerWaalsContact CB-CE 3.49Å; Q678-M749 HydrophobicContact CB-SD 4.49Å; Q678-M749 HydrophobicContact CG-CE 4.29Å; Q678-M749 VanDerWaalsContact OE1-CE 3.25Å
679	A	89	Confident	87.9	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-81	-23.5	-176.9	0	0	0	0	0	114.2	V675 Q676 W681 V682 C683 F745 Y746 M749	V675-A679 VanDerWaalsContact O-CB 3.23Å; V675-A679 WeakPolarHBondContact O-CB 3.16Å; V675-A679 PolarHBondContact O-N 3.09Å; Q676-A679 PolarHBondContact O-N 3.42Å; A679-W681 VanDerWaalsContact C-N 3.3Å; A679-W681 PolarHBondContact O-N 3.04Å; A679-V682 PolarHBondContact O-N 3.28Å; A679-C683 PolarHBondContact O-N 3.1Å; A679-F745 HydrophobicContact CB-CD1 4.46Å; A679-F745 HydrophobicContact CB-CE1 4.02Å; A679-Y746 HydrophobicContact CB-CD1 3.92Å; A679-Y746 HydrophobicContact CB-CD2 4.14Å; A679-Y746 HydrophobicContact CB-CE1 3.48Å; A679-Y746 VanDerWaalsContact CB-CE1 3.48Å; A679-Y746 HydrophobicContact CB-CE2 3.74Å; A679-Y746 HydrophobicContact CB-CG 4.22Å; A679-M749 HydrophobicContact CB-SD 3.93Å
680	S	87	Confident	87.6	Confident	43 Å²	43	64.8 Å²	64.8	30%	0.301	34%	0.339	S	S	.	.	H	α-helix	trans	-50.8	-47.5	-179.5	64.5	0	0	0	0	112.6	Q676 E677 V682 Q684	Q676-S680 VanDerWaalsContact O-CB 3.29Å; Q676-S680 WeakPolarHBondContact O-CB 3.44Å; Q676-S680 PolarHBondContact O-N 3.02Å; E677-S680 PolarHBondContact O-OG 3.21Å; S680-V682 VanDerWaalsContact C-N 3.28Å; S680-V682 PolarHBondContact O-N 2.79Å; S680-Q684 WeakPolarHBondContact O-CA 3.26Å; S680-Q684 PolarHBondContact O-N 3.16Å
681	W	80.8	Confident	87.5	Confident	217 Å²	217	67.1 Å²	67.1	82%	0.822	36%	0.355	S	S	*	.	H	α-helix	trans	-60.6	-29.6	179.3	-69.5	93.5	0	0	0	114.6	A679	A679-W681 VanDerWaalsContact C-N 3.3Å; A679-W681 PolarHBondContact O-N 3.04Å
682	V	84.8	Confident	87.6	Confident	50 Å²	50	68.8 Å²	68.8	30%	0.303	36%	0.361	S	S	.	.	H	α-helix	trans	-97.2	-46.4	-175.9	-178.6	0	0	0	0	110.9	A679 S680 F745	A679-V682 PolarHBondContact O-N 3.28Å; S680-V682 VanDerWaalsContact C-N 3.28Å; S680-V682 PolarHBondContact O-N 2.79Å; V682-F745 HydrophobicContact CB-CD1 4.48Å; V682-F745 HydrophobicContact CB-CE1 3.96Å; V682-F745 HydrophobicContact CB-CZ 3.98Å; V682-F745 HydrophobicContact CG1-CD1 4.32Å; V682-F745 HydrophobicContact CG1-CD2 4.22Å; V682-F745 HydrophobicContact CG1-CE1 4.15Å; V682-F745 HydrophobicContact CG1-CE2 4.05Å; V682-F745 HydrophobicContact CG1-CG 4.35Å; V682-F745 HydrophobicContact CG1-CZ 4.01Å; V682-F745 HydrophobicContact CG2-CE1 4.22Å; V682-F745 HydrophobicContact CG2-CE2 4.39Å; V682-F745 HydrophobicContact CG2-CZ 3.8Å
683	C	85.3	Confident	87.7	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.007	37%	0.366	C	S	.	.	H	α-helix	trans	-94.1	-25.3	-170.5	-66.1	0	0	0	0	113.9	A679 C685 K742 F745 Y746	A679-C683 PolarHBondContact O-N 3.1Å; C683-C685 PolarHBondContact O-N 2.99Å; C683-C685 VanDerWaalsContact O-N 3.11Å; C683-K742 HydrophobicContact CB-CB 4.35Å; C683-K742 HydrophobicContact CB-CD 4.41Å; C683-K742 HydrophobicContact CB-CG 4.06Å; C683-K742 VanDerWaalsContact O-CD 3.31Å; C683-K742 WeakPolarHBondContact O-CD 3.06Å; C683-K742 WeakPolarHBondContact O-CE 3.47Å; C683-K742 PolarHBondContact O-NZ 2.83Å; C683-F745 WeakPolarHBondContact SG-CD1 3.29Å; C683-Y746 HydrophobicContact CB-CD2 3.81Å; C683-Y746 HydrophobicContact CB-CE2 3.6Å
684	Q	83.1	Confident	87.9	Confident	155 Å²	155	65.9 Å²	65.9	72%	0.724	35%	0.345	S	S	*	.			trans	50.2	37.1	179.9	-55.3	176.9	1.4	0	0	113.1	S680	S680-Q684 WeakPolarHBondContact O-CA 3.26Å; S680-Q684 PolarHBondContact O-N 3.16Å
685	C	82.4	Confident	88.1	Confident	43 Å²	43	68.9 Å²	68.9	29%	0.291	36%	0.357	S	S	.	.			trans	-79.6	151.5	172.1	-59.1	0	0	0	0	109.6	C683 V690 Y746	C683-C685 PolarHBondContact O-N 2.99Å; C683-C685 VanDerWaalsContact O-N 3.11Å; C685-V690 HydrophobicContact CB-CG2 3.92Å; C685-Y746 HydrophobicContact CB-CE2 4.29Å
686	S	85.8	Confident	88.4	Confident	57 Å²	57	69.6 Å²	69.6	40%	0.399	36%	0.361	S	S	.	.			trans	-71	142.8	171.4	80	0	0	0	0	110.5	S688 T689 V690	S686-S688 PolarHBondContact O-N 3.37Å; S686-S688 PolarHBondContact OG-OG 2.96Å; S686-T689 WeakPolarHBondContact O-CB 3.44Å; S686-T689 PolarHBondContact O-N 3.13Å; S686-T689 WeakPolarHBondContact OG-CB 3.34Å; S686-T689 PolarHBondContact OG-N 3.29Å; S686-T689 PolarHBondContact OG-OG1 2.85Å; S686-V690 PolarHBondContact O-N 3.3Å
687	D	86.7	Confident	88.6	Confident	101 Å²	101	70 Å²	70	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-56.4	-41.7	179.4	-61.1	-40.5	0	0	0	111.8	Q676 T689 V690 S691	Q676-D687 VanDerWaalsContact NE2-CA 3.32Å; Q676-D687 VanDerWaalsContact NE2-CG 3.29Å; Q676-D687 PolarHBondContact NE2-OD1 3.48Å; D687-T689 VanDerWaalsContact C-N 3.3Å; D687-T689 PolarHBondContact O-N 3.3Å; D687-V690 PolarHBondContact O-N 3.22Å; D687-V690 VanDerWaalsContact O-N 3.16Å; D687-S691 PolarHBondContact O-N 3.04Å; D687-S691 PolarHBondContact O-OG 3.3Å
688	S	89.6	Confident	89	Confident	88 Å²	88	65.4 Å²	65.4	62%	0.615	34%	0.34	S	S	*	.	H	α-helix	trans	-57.4	-36.7	174.6	51.5	0	0	0	0	113.9	S686 Q692	S686-S688 PolarHBondContact O-N 3.37Å; S686-S688 PolarHBondContact OG-OG 2.96Å; S688-Q692 VanDerWaalsContact O-CB 3.26Å; S688-Q692 WeakPolarHBondContact O-CB 3.41Å; S688-Q692 PolarHBondContact O-N 3.39Å
689	T	88.8	Confident	89.4	Confident	59 Å²	59	66.7 Å²	66.7	36%	0.362	34%	0.341	S	S	.	.	H	α-helix	trans	-70.1	-42.5	177.2	-55.9	0	0	0	0	110.2	S686 D687 Q692 L693	S686-T689 WeakPolarHBondContact O-CB 3.44Å; S686-T689 PolarHBondContact O-N 3.13Å; S686-T689 WeakPolarHBondContact OG-CB 3.34Å; S686-T689 PolarHBondContact OG-N 3.29Å; S686-T689 PolarHBondContact OG-OG1 2.85Å; D687-T689 VanDerWaalsContact C-N 3.3Å; D687-T689 PolarHBondContact O-N 3.3Å; T689-Q692 PolarHBondContact O-N 3.31Å; T689-L693 HydrophobicContact CG2-CD1 4.14Å; T689-L693 VanDerWaalsContact O-CG 3.28Å; T689-L693 WeakPolarHBondContact O-CG 3.49Å; T689-L693 PolarHBondContact O-N 3.12Å
690	V	89.6	Confident	89.7	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-65.4	-47.4	-179.7	-178.6	0	0	0	0	110.5	Q676 C685 S686 D687 Q692 L693 E694 Y746	Q676-V690 HydrophobicContact CG-CG1 4.3Å; C685-V690 HydrophobicContact CB-CG2 3.92Å; S686-V690 PolarHBondContact O-N 3.3Å; D687-V690 PolarHBondContact O-N 3.22Å; D687-V690 VanDerWaalsContact O-N 3.16Å; V690-Q692 VanDerWaalsContact C-N 3.35Å; V690-Q692 PolarHBondContact O-N 3.38Å; V690-L693 PolarHBondContact O-N 3.37Å; V690-E694 PolarHBondContact O-N 3.01Å; V690-Y746 HydrophobicContact CG1-CE1 3.96Å; V690-Y746 HydrophobicContact CG2-CE1 4.32Å; V690-Y746 HydrophobicContact CG2-CE2 4.21Å
691	S	91.2	Very high	90	Very high	59 Å²	59	65.3 Å²	65.3	41%	0.413	33%	0.33	S	S	.	.	H	α-helix	trans	-64.8	-34.9	177.1	-55.1	0	0	0	0	113.1	D687 H695	D687-S691 PolarHBondContact O-N 3.04Å; D687-S691 PolarHBondContact O-OG 3.3Å; S691-H695 WeakPolarHBondContact O-CB 3.32Å; S691-H695 PolarHBondContact O-N 2.81Å
692	Q	93.1	Very high	90.6	Very high	100 Å²	100	60.5 Å²	60.5	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-44.4	174.3	-178.3	60.1	38.9	0	0	111.5	S688 T689 V690 E694 H695 D696	S688-Q692 VanDerWaalsContact O-CB 3.26Å; S688-Q692 WeakPolarHBondContact O-CB 3.41Å; S688-Q692 PolarHBondContact O-N 3.39Å; T689-Q692 PolarHBondContact O-N 3.31Å; V690-Q692 VanDerWaalsContact C-N 3.35Å; V690-Q692 PolarHBondContact O-N 3.38Å; Q692-E694 PolarHBondContact O-N 3.02Å; Q692-H695 PolarHBondContact O-N 3.36Å; Q692-D696 PolarHBondContact NE2-OD1 2.68Å; Q692-D696 PolarHBondContact NE2-OD2 3.44Å; Q692-D696 WeakPolarHBondContact O-CB 3.27Å; Q692-D696 PolarHBondContact O-N 3.37Å
693	L	93.2	Very high	91	Very high	45 Å²	45	64.5 Å²	64.5	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-39.1	176.8	-69.8	171.4	0	0	0	112.2	T689 V690 F697 W713 V717	T689-L693 HydrophobicContact CG2-CD1 4.14Å; T689-L693 VanDerWaalsContact O-CG 3.28Å; T689-L693 WeakPolarHBondContact O-CG 3.49Å; T689-L693 PolarHBondContact O-N 3.12Å; V690-L693 PolarHBondContact O-N 3.37Å; L693-F697 VanDerWaalsContact O-CB 3.31Å; L693-F697 WeakPolarHBondContact O-CB 3.45Å; L693-F697 PolarHBondContact O-N 2.81Å; L693-W713 HydrophobicContact CD2-CZ2 3.91Å; L693-V717 HydrophobicContact CD2-CB 4.26Å; L693-V717 HydrophobicContact CD2-CG1 3.71Å; L693-V717 HydrophobicContact CD2-CG2 3.46Å; L693-V717 VanDerWaalsContact CD2-CG2 3.46Å
694	E	92.8	Very high	91.4	Very high	46 Å²	46	68.4 Å²	68.4	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-48	173	-171	-156.5	142.6	0	0	111.6	F672 V690 Q692 F697 K698	F672-E694 VanDerWaalsContact CB-OE2 3.32Å; F672-E694 WeakPolarHBondContact CB-OE2 3.38Å; F672-E694 HydrophobicContact CD1-CB 4.47Å; F672-E694 HydrophobicContact CD1-CG 3.89Å; F672-E694 HydrophobicContact CD2-CG 3.94Å; F672-E694 HydrophobicContact CE1-CG 3.91Å; F672-E694 HydrophobicContact CE2-CG 3.96Å; F672-E694 HydrophobicContact CG-CG 3.92Å; F672-E694 WeakPolarHBondContact CG-OE2 3.41Å; F672-E694 HydrophobicContact CZ-CG 3.95Å; V690-E694 PolarHBondContact O-N 3.01Å; Q692-E694 PolarHBondContact O-N 3.02Å; E694-F697 PolarHBondContact O-N 2.93Å; E694-K698 HydrophobicContact CG-CD 4.33Å; E694-K698 WeakPolarHBondContact O-CB 3.48Å; E694-K698 WeakPolarHBondContact O-CG 3.47Å; E694-K698 PolarHBondContact O-N 3.25Å; E694-K698 WeakPolarHBondContact OE1-CE 3.45Å; E694-K698 IonicContact OE1-NZ 3.51Å; E694-K698 PolarHBondContact OE1-NZ 3.25Å
695	H	94.1	Very high	91.9	Very high	114 Å²	114	61.1 Å²	61.1	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-46.7	179.1	-179	84.9	0	0	0	111.5	S691 Q692 K698 R699	S691-H695 WeakPolarHBondContact O-CB 3.32Å; S691-H695 PolarHBondContact O-N 2.81Å; Q692-H695 PolarHBondContact O-N 3.36Å; H695-K698 PolarHBondContact O-N 2.9Å; H695-R699 VanDerWaalsContact O-CB 3.23Å; H695-R699 WeakPolarHBondContact O-CB 3.47Å; H695-R699 PolarHBondContact O-N 2.8Å
696	D	95.5	Very high	92.5	Very high	20 Å²	20	61.3 Å²	61.3	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-65.8	-43.2	178.8	-77.5	-31.1	0	0	0	112.5	Q692 K698 R699 I700 W713	Q692-D696 PolarHBondContact NE2-OD1 2.68Å; Q692-D696 PolarHBondContact NE2-OD2 3.44Å; Q692-D696 WeakPolarHBondContact O-CB 3.27Å; Q692-D696 PolarHBondContact O-N 3.37Å; D696-K698 VanDerWaalsContact C-N 3.31Å; D696-K698 PolarHBondContact O-N 3.42Å; D696-R699 WeakPolarHBondContact O-CB 3.15Å; D696-R699 PolarHBondContact O-N 3.45Å; D696-R699 IonicContact OD1-CZ 4Å; D696-R699 IonicContact OD1-NE 2.75Å; D696-R699 PolarHBondContact OD1-NE 2.86Å; D696-R699 IonicContact OD1-NH2 2.68Å; D696-R699 PolarHBondContact OD1-NH2 3.08Å; D696-I700 HydrophobicContact CB-CD1 4.41Å; D696-I700 WeakPolarHBondContact O-CB 3.19Å; D696-I700 WeakPolarHBondContact O-CD1 3.27Å; D696-I700 WeakPolarHBondContact O-CG1 3.4Å; D696-I700 PolarHBondContact O-N 2.99Å; D696-W713 HydrophobicContact CB-CZ2 4.12Å
697	F	94.5	Very high	92.9	Very high	33 Å²	33	58.9 Å²	58.9	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-58	-45.4	175.1	-172	-74.1	0	0	0	111.1	L667 L693 E694 L701 W710 W713 F765 Y772	L667-F697 HydrophobicContact CD2-CD1 3.62Å; L667-F697 HydrophobicContact CD2-CE1 3.75Å; L693-F697 VanDerWaalsContact O-CB 3.31Å; L693-F697 WeakPolarHBondContact O-CB 3.45Å; L693-F697 PolarHBondContact O-N 2.81Å; E694-F697 PolarHBondContact O-N 2.93Å; F697-L701 HydrophobicContact CE1-CD2 4.12Å; F697-L701 VanDerWaalsContact O-CB 3.31Å; F697-L701 WeakPolarHBondContact O-CB 3.41Å; F697-L701 PolarHBondContact O-N 3.27Å; F697-W710 HydrophobicContact CD1-CH2 4.21Å; F697-W710 HydrophobicContact CD2-CH2 4.13Å; F697-W710 AromaticContact CD2-CZ3 3.75Å; F697-W710 HydrophobicContact CD2-CZ3 3.75Å; F697-W710 HydrophobicContact CE1-CH2 4.14Å; F697-W710 HydrophobicContact CE2-CH2 4.09Å; F697-W710 AromaticContact CE2-CZ3 3.91Å; F697-W710 HydrophobicContact CE2-CZ3 3.91Å; F697-W710 HydrophobicContact CG-CH2 4.19Å; F697-W710 HydrophobicContact CG-CZ3 4.11Å; F697-W710 HydrophobicContact CZ-CH2 4.08Å; F697-W710 HydrophobicContact CZ-CZ3 4.37Å; F697-W710 WeakPolarHBondContact O-CH2 3.4Å; F697-W713 HydrophobicContact CB-CH2 4.19Å; F697-W713 HydrophobicContact CD2-CH2 4.07Å; F697-W713 HydrophobicContact CD2-CZ3 4.19Å; F697-F765 AromaticContact CE1-CE1 3.9Å; F697-F765 HydrophobicContact CE1-CE1 3.9Å; F697-F765 HydrophobicContact CZ-CD1 4.45Å; F697-F765 AromaticContact CZ-CE1 4Å; F697-F765 HydrophobicContact CZ-CE1 4Å; F697-Y772 AromaticContact CE2-CE2 3.97Å; F697-Y772 HydrophobicContact CE2-CE2 3.97Å
698	K	94.8	Very high	93.3	Very high	35 Å²	35	58 Å²	58	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-44.8	175.7	-76.6	175	174.9	178.4	0	111.8	L667 N668 E694 H695 D696 L701 Q702	L667-K698 HydrophobicContact CD2-CG 3.77Å; N668-K698 WeakPolarHBondContact OD1-CE 3.18Å; N668-K698 PolarHBondContact OD1-NZ 3.24Å; E694-K698 HydrophobicContact CG-CD 4.33Å; E694-K698 WeakPolarHBondContact O-CB 3.48Å; E694-K698 WeakPolarHBondContact O-CG 3.47Å; E694-K698 PolarHBondContact O-N 3.25Å; E694-K698 WeakPolarHBondContact OE1-CE 3.45Å; E694-K698 IonicContact OE1-NZ 3.51Å; E694-K698 PolarHBondContact OE1-NZ 3.25Å; H695-K698 PolarHBondContact O-N 2.9Å; D696-K698 VanDerWaalsContact C-N 3.31Å; D696-K698 PolarHBondContact O-N 3.42Å; K698-L701 PolarHBondContact O-N 3.35Å; K698-Q702 WeakPolarHBondContact O-CB 3.46Å; K698-Q702 VanDerWaalsContact O-CG 3.22Å; K698-Q702 WeakPolarHBondContact O-CG 3.41Å; K698-Q702 PolarHBondContact O-N 3.45Å
699	R	95.4	Very high	93.6	Very high	119 Å²	119	57.4 Å²	57.4	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-61.5	-43.6	178.9	179.1	177.2	66.7	80.9	-5.8	112.7	H695 D696 Q702 K703	H695-R699 VanDerWaalsContact O-CB 3.23Å; H695-R699 WeakPolarHBondContact O-CB 3.47Å; H695-R699 PolarHBondContact O-N 2.8Å; D696-R699 WeakPolarHBondContact O-CB 3.15Å; D696-R699 PolarHBondContact O-N 3.45Å; D696-R699 IonicContact OD1-CZ 4Å; D696-R699 IonicContact OD1-NE 2.75Å; D696-R699 PolarHBondContact OD1-NE 2.86Å; D696-R699 IonicContact OD1-NH2 2.68Å; D696-R699 PolarHBondContact OD1-NH2 3.08Å; R699-Q702 PolarHBondContact O-N 3.37Å; R699-K703 PolarHBondContact O-N 3.08Å
700	I	94.4	Very high	94	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.062	26%	0.262	C	S	.	.	H	α-helix	trans	-72.4	-39.4	-178.8	-62.7	161.9	0	0	0	110.4	D696 K703 A705 W710 W713	D696-I700 HydrophobicContact CB-CD1 4.41Å; D696-I700 WeakPolarHBondContact O-CB 3.19Å; D696-I700 WeakPolarHBondContact O-CD1 3.27Å; D696-I700 WeakPolarHBondContact O-CG1 3.4Å; D696-I700 PolarHBondContact O-N 2.99Å; I700-K703 WeakPolarHBondContact O-CB 3.21Å; I700-K703 PolarHBondContact O-N 3.36Å; I700-A705 HydrophobicContact CG2-CB 3.42Å; I700-A705 VanDerWaalsContact CG2-CB 3.42Å; I700-A705 WeakPolarHBondContact O-CB 3.48Å; I700-A705 PolarHBondContact O-N 2.75Å; I700-W710 HydrophobicContact CB-CD2 4.45Å; I700-W710 HydrophobicContact CB-CE3 4.18Å; I700-W710 HydrophobicContact CB-CH2 3.97Å; I700-W710 HydrophobicContact CB-CZ2 4.21Å; I700-W710 HydrophobicContact CB-CZ3 3.94Å; I700-W710 HydrophobicContact CG2-CD2 3.43Å; I700-W710 VanDerWaalsContact CG2-CD2 3.43Å; I700-W710 VanDerWaalsContact CG2-CE2 3.48Å; I700-W710 HydrophobicContact CG2-CE3 3.56Å; I700-W710 HydrophobicContact CG2-CG 4.08Å; I700-W710 HydrophobicContact CG2-CH2 3.91Å; I700-W710 HydrophobicContact CG2-CZ2 3.75Å; I700-W710 HydrophobicContact CG2-CZ3 3.8Å; I700-W713 HydrophobicContact CD1-CB 3.6Å; I700-W713 HydrophobicContact CD1-CD2 3.5Å; I700-W713 VanDerWaalsContact CD1-CD2 3.5Å; I700-W713 HydrophobicContact CD1-CE3 4.11Å; I700-W713 HydrophobicContact CD1-CG 3.23Å
701	L	93.4	Very high	94.3	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-40.6	173.5	-170.4	63.2	0	0	0	112	I660 M663 L664 L667 F697 K698 K703 H704 W710	I660-L701 HydrophobicContact CB-CD1 4.35Å; I660-L701 HydrophobicContact CG1-CD1 4.07Å; I660-L701 HydrophobicContact CG2-CD1 3.85Å; I660-L701 HydrophobicContact CG2-CG 4.11Å; I660-L701 VanDerWaalsContact CG2-O 3.26Å; I660-L701 WeakPolarHBondContact CG2-O 3.14Å; M663-L701 HydrophobicContact CB-CD2 3.96Å; M663-L701 HydrophobicContact CE-CD1 4.04Å; M663-L701 HydrophobicContact CE-CD2 4.35Å; M663-L701 HydrophobicContact SD-CD1 4.5Å; L664-L701 HydrophobicContact CD1-CG 4.38Å; L664-L701 HydrophobicContact CD2-CB 3.99Å; L664-L701 HydrophobicContact CD2-CD2 3.67Å; L664-L701 HydrophobicContact CD2-CG 3.81Å; L664-L701 HydrophobicContact CG-CB 4.47Å; L664-L701 HydrophobicContact CG-CD2 3.73Å; L664-L701 HydrophobicContact CG-CG 3.79Å; L667-L701 HydrophobicContact CD2-CD2 4.46Å; F697-L701 HydrophobicContact CE1-CD2 4.12Å; F697-L701 VanDerWaalsContact O-CB 3.31Å; F697-L701 WeakPolarHBondContact O-CB 3.41Å; F697-L701 PolarHBondContact O-N 3.27Å; K698-L701 PolarHBondContact O-N 3.35Å; L701-K703 VanDerWaalsContact C-N 3.3Å; L701-K703 PolarHBondContact O-N 3.08Å; L701-H704 PolarHBondContact O-N 2.97Å; L701-W710 HydrophobicContact CB-CH2 3.91Å; L701-W710 HydrophobicContact CB-CZ2 3.85Å; L701-W710 HydrophobicContact CD1-CZ2 3.98Å
702	Q	93.9	Very high	94.6	Very high	116 Å²	116	57.4 Å²	57.4	54%	0.542	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-32	172.7	-77.6	171	-9.3	0	0	113.6	L664 K698 R699 H704	L664-Q702 HydrophobicContact CD1-CG 3.94Å; L664-Q702 HydrophobicContact CD2-CG 3.73Å; K698-Q702 WeakPolarHBondContact O-CB 3.46Å; K698-Q702 VanDerWaalsContact O-CG 3.22Å; K698-Q702 WeakPolarHBondContact O-CG 3.41Å; K698-Q702 PolarHBondContact O-N 3.45Å; R699-Q702 PolarHBondContact O-N 3.37Å; Q702-H704 PolarHBondContact O-N 3.02Å
703	K	93.6	Very high	94.7	Very high	135 Å²	135	53.6 Å²	53.6	59%	0.587	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.6	177.2	-161.5	-169.2	175.2	-170.5	0	113	R699 I700 L701 A705 E709	R699-K703 PolarHBondContact O-N 3.08Å; I700-K703 WeakPolarHBondContact O-CB 3.21Å; I700-K703 PolarHBondContact O-N 3.36Å; L701-K703 VanDerWaalsContact C-N 3.3Å; L701-K703 PolarHBondContact O-N 3.08Å; K703-A705 HydrophobicContact CB-CB 4.33Å; K703-A705 HydrophobicContact CD-CB 4.4Å; K703-A705 PolarHBondContact O-N 2.92Å; K703-E709 IonicContact NZ-OE1 2.83Å; K703-E709 PolarHBondContact NZ-OE1 3.35Å
704	H	92.9	Very high	94.9	Very high	82 Å²	82	51.5 Å²	51.5	38%	0.38	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	41.1	-162.1	-64.2	-93.9	0	0	0	111.9	I660 L701 Q702	I660-H704 HydrophobicContact CD1-CB 4.37Å; I660-H704 WeakPolarHBondContact CD1-ND1 3.39Å; I660-H704 VanDerWaalsContact CG2-CE1 3.46Å; I660-H704 WeakPolarHBondContact CG2-CE1 3.44Å; L701-H704 PolarHBondContact O-N 2.97Å; Q702-H704 PolarHBondContact O-N 3.02Å
705	A	94	Very high	95.1	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.017	24%	0.24	C	C	.	.			trans	-62.2	147.3	-173.3	0	0	0	0	0	113.3	I700 K703 E709 W710	I700-A705 HydrophobicContact CG2-CB 3.42Å; I700-A705 VanDerWaalsContact CG2-CB 3.42Å; I700-A705 WeakPolarHBondContact O-CB 3.48Å; I700-A705 PolarHBondContact O-N 2.75Å; K703-A705 HydrophobicContact CB-CB 4.33Å; K703-A705 HydrophobicContact CD-CB 4.4Å; K703-A705 PolarHBondContact O-N 2.92Å; A705-E709 VanDerWaalsContact CA-OE2 3.23Å; A705-E709 WeakPolarHBondContact CA-OE2 3.14Å; A705-E709 HydrophobicContact CB-CB 3.98Å; A705-E709 WeakPolarHBondContact CB-OE2 3.32Å; A705-W710 PolarHBondContact O-NE1 3.31Å
706	S	94.3	Very high	95.2	Very high	47 Å²	47	49.7 Å²	49.7	33%	0.329	24%	0.237	S	C	.	.			trans	-71.5	162	179.1	93.2	0	0	0	0	112	E708 E709 W710	S706-E708 WeakPolarHBondContact CB-OE2 3.29Å; S706-E708 PolarHBondContact O-N 2.82Å; S706-E708 PolarHBondContact OG-N 3.47Å; S706-E708 PolarHBondContact OG-OE2 3.13Å; S706-E709 PolarHBondContact N-OE2 3.28Å; S706-E709 WeakPolarHBondContact O-CB 3.26Å; S706-E709 PolarHBondContact O-N 2.96Å; S706-E709 PolarHBondContact OG-N 2.87Å; S706-W710 PolarHBondContact O-N 3.05Å
707	L	95.4	Very high	95.2	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-34	178.4	173.7	61.1	0	0	0	112	L589 A647 R651 L654 W710 A711 L771	L589-L707 HydrophobicContact CD2-CD2 4.3Å; A647-L707 HydrophobicContact CB-CD2 3.82Å; A647-L707 WeakPolarHBondContact O-CD2 3.44Å; R651-L707 HydrophobicContact CG-CB 3.86Å; R651-L707 HydrophobicContact CG-CD2 3.6Å; R651-L707 HydrophobicContact CG-CG 4.37Å; L654-L707 HydrophobicContact CD1-CB 4.15Å; L654-L707 HydrophobicContact CD1-CD1 4.18Å; L707-W710 PolarHBondContact O-N 3.28Å; L707-A711 WeakPolarHBondContact O-CB 3.4Å; L707-A711 PolarHBondContact O-N 2.83Å; L707-L771 HydrophobicContact CD1-CD2 3.63Å
708	E	95.8	Very high	95.3	Very high	83 Å²	83	47.7 Å²	47.7	39%	0.388	23%	0.228	S	C	.	.	H	α-helix	trans	-67.6	-37.6	178.2	-56	71	-154.2	0	0	111.1	R651 S706 A711 Q712	R651-E708 IonicContact CZ-OE1 3.67Å; R651-E708 VanDerWaalsContact CZ-OE1 3.22Å; R651-E708 IonicContact NE-OE1 3.62Å; R651-E708 PolarHBondContact NE-OE1 3.08Å; R651-E708 IonicContact NH2-OE1 2.87Å; R651-E708 PolarHBondContact NH2-OE1 3.12Å; S706-E708 WeakPolarHBondContact CB-OE2 3.29Å; S706-E708 PolarHBondContact O-N 2.82Å; S706-E708 PolarHBondContact OG-N 3.47Å; S706-E708 PolarHBondContact OG-OE2 3.13Å; E708-A711 PolarHBondContact O-N 2.97Å; E708-Q712 WeakPolarHBondContact O-CB 3.36Å; E708-Q712 PolarHBondContact O-N 3.39Å
709	E	95.8	Very high	95.4	Very high	76 Å²	76	47.8 Å²	47.8	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-70	-37.9	173.6	-62.4	-175.1	97.2	0	0	112.6	K703 A705 S706 Q712 W713	K703-E709 IonicContact NZ-OE1 2.83Å; K703-E709 PolarHBondContact NZ-OE1 3.35Å; A705-E709 VanDerWaalsContact CA-OE2 3.23Å; A705-E709 WeakPolarHBondContact CA-OE2 3.14Å; A705-E709 HydrophobicContact CB-CB 3.98Å; A705-E709 WeakPolarHBondContact CB-OE2 3.32Å; S706-E709 PolarHBondContact N-OE2 3.28Å; S706-E709 WeakPolarHBondContact O-CB 3.26Å; S706-E709 PolarHBondContact O-N 2.96Å; S706-E709 PolarHBondContact OG-N 2.87Å; E709-Q712 PolarHBondContact O-N 2.85Å; E709-W713 PolarHBondContact O-N 3.42Å
710	W	95.6	Very high	95.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-43.4	171.1	-76.3	104.7	0	0	0	111.6	F697 I700 L701 A705 S706 L707 W713 L714 Y772	F697-W710 HydrophobicContact CD1-CH2 4.21Å; F697-W710 HydrophobicContact CD2-CH2 4.13Å; F697-W710 AromaticContact CD2-CZ3 3.75Å; F697-W710 HydrophobicContact CD2-CZ3 3.75Å; F697-W710 HydrophobicContact CE1-CH2 4.14Å; F697-W710 HydrophobicContact CE2-CH2 4.09Å; F697-W710 AromaticContact CE2-CZ3 3.91Å; F697-W710 HydrophobicContact CE2-CZ3 3.91Å; F697-W710 HydrophobicContact CG-CH2 4.19Å; F697-W710 HydrophobicContact CG-CZ3 4.11Å; F697-W710 HydrophobicContact CZ-CH2 4.08Å; F697-W710 HydrophobicContact CZ-CZ3 4.37Å; F697-W710 WeakPolarHBondContact O-CH2 3.4Å; I700-W710 HydrophobicContact CB-CD2 4.45Å; I700-W710 HydrophobicContact CB-CE3 4.18Å; I700-W710 HydrophobicContact CB-CH2 3.97Å; I700-W710 HydrophobicContact CB-CZ2 4.21Å; I700-W710 HydrophobicContact CB-CZ3 3.94Å; I700-W710 HydrophobicContact CG2-CD2 3.43Å; I700-W710 VanDerWaalsContact CG2-CD2 3.43Å; I700-W710 VanDerWaalsContact CG2-CE2 3.48Å; I700-W710 HydrophobicContact CG2-CE3 3.56Å; I700-W710 HydrophobicContact CG2-CG 4.08Å; I700-W710 HydrophobicContact CG2-CH2 3.91Å; I700-W710 HydrophobicContact CG2-CZ2 3.75Å; I700-W710 HydrophobicContact CG2-CZ3 3.8Å; L701-W710 HydrophobicContact CB-CH2 3.91Å; L701-W710 HydrophobicContact CB-CZ2 3.85Å; L701-W710 HydrophobicContact CD1-CZ2 3.98Å; A705-W710 PolarHBondContact O-NE1 3.31Å; S706-W710 PolarHBondContact O-N 3.05Å; L707-W710 PolarHBondContact O-N 3.28Å; W710-W713 HydrophobicContact CE3-CE3 4Å; W710-W713 HydrophobicContact CE3-CZ3 4.24Å; W710-W713 HydrophobicContact CZ3-CE3 4.31Å; W710-W713 HydrophobicContact CZ3-CZ3 4.2Å; W710-W713 PolarHBondContact O-N 2.63Å; W710-L714 WeakPolarHBondContact O-CG 3.38Å; W710-L714 PolarHBondContact O-N 3.48Å; W710-Y772 HydrophobicContact CE3-CE2 4.19Å; W710-Y772 AromaticContact CE3-CZ 3.9Å; W710-Y772 HydrophobicContact CZ3-CE2 4.42Å
711	A	96.6	Very high	95.1	Very high	5 Å²	5	47.7 Å²	47.7	4%	0.041	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-43.1	175.6	0	0	0	0	0	112.3	L589 L707 E708 W713 L714 D715 Y775	L589-A711 HydrophobicContact CD1-CB 3.56Å; L707-A711 WeakPolarHBondContact O-CB 3.4Å; L707-A711 PolarHBondContact O-N 2.83Å; E708-A711 PolarHBondContact O-N 2.97Å; A711-W713 VanDerWaalsContact C-N 3.32Å; A711-W713 PolarHBondContact O-N 3.34Å; A711-L714 PolarHBondContact O-N 3.32Å; A711-D715 PolarHBondContact O-N 2.85Å; A711-Y775 HydrophobicContact CB-CD1 4.4Å; A711-Y775 HydrophobicContact CB-CE1 3.57Å
712	Q	96.7	Very high	95.1	Very high	126 Å²	126	47.6 Å²	47.6	59%	0.589	25%	0.245	S	C	*	.	H	α-helix	trans	-60.4	-39.1	175	-168.3	70.9	53.7	0	0	112.2	E708 E709 T716	E708-Q712 WeakPolarHBondContact O-CB 3.36Å; E708-Q712 PolarHBondContact O-N 3.39Å; E709-Q712 PolarHBondContact O-N 2.85Å; Q712-T716 WeakPolarHBondContact O-CB 3.46Å; Q712-T716 PolarHBondContact O-N 3.42Å; Q712-T716 PolarHBondContact O-OG1 3.14Å
713	W	96.9	Very high	95	Very high	20 Å²	20	47.6 Å²	47.6	8%	0.076	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-44.9	173.4	171.4	68.5	0	0	0	112.1	L693 D696 F697 I700 E709 W710 A711 D715 T716 V717 Y772	L693-W713 HydrophobicContact CD2-CZ2 3.91Å; D696-W713 HydrophobicContact CB-CZ2 4.12Å; F697-W713 HydrophobicContact CB-CH2 4.19Å; F697-W713 HydrophobicContact CD2-CH2 4.07Å; F697-W713 HydrophobicContact CD2-CZ3 4.19Å; I700-W713 HydrophobicContact CD1-CB 3.6Å; I700-W713 HydrophobicContact CD1-CD2 3.5Å; I700-W713 VanDerWaalsContact CD1-CD2 3.5Å; I700-W713 HydrophobicContact CD1-CE3 4.11Å; I700-W713 HydrophobicContact CD1-CG 3.23Å; E709-W713 PolarHBondContact O-N 3.42Å; W710-W713 HydrophobicContact CE3-CE3 4Å; W710-W713 HydrophobicContact CE3-CZ3 4.24Å; W710-W713 HydrophobicContact CZ3-CE3 4.31Å; W710-W713 HydrophobicContact CZ3-CZ3 4.2Å; W710-W713 PolarHBondContact O-N 2.63Å; A711-W713 VanDerWaalsContact C-N 3.32Å; A711-W713 PolarHBondContact O-N 3.34Å; W713-D715 VanDerWaalsContact C-N 3.32Å; W713-D715 PolarHBondContact O-N 3.49Å; W713-T716 CarbonylContact O-C 3.58Å; W713-T716 WeakPolarHBondContact O-CA 3.4Å; W713-T716 WeakPolarHBondContact O-CB 3.3Å; W713-T716 PolarHBondContact O-N 3.03Å; W713-T716 VanDerWaalsContact O-N 3.08Å; W713-V717 HydrophobicContact CD2-CG2 4.23Å; W713-V717 HydrophobicContact CG-CG2 4.47Å; W713-V717 HydrophobicContact CZ2-CG2 4.07Å; W713-V717 WeakPolarHBondContact O-CG2 3.34Å; W713-V717 PolarHBondContact O-N 3.3Å; W713-Y772 HydrophobicContact CZ3-CE2 4.37Å
714	L	97.2	Very high	94.9	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-41.4	176.5	-67.5	172.8	0	0	0	111.8	W710 A711 T716 V717 V718 W743 Y772 Y775 I776 L779	W710-L714 WeakPolarHBondContact O-CG 3.38Å; W710-L714 PolarHBondContact O-N 3.48Å; A711-L714 PolarHBondContact O-N 3.32Å; L714-T716 VanDerWaalsContact C-N 3.32Å; L714-T716 PolarHBondContact O-N 3.09Å; L714-V717 PolarHBondContact O-N 3.34Å; L714-V718 WeakPolarHBondContact O-CG2 3.32Å; L714-V718 PolarHBondContact O-N 3.07Å; L714-W743 HydrophobicContact CD2-CH2 4.16Å; L714-Y772 HydrophobicContact CD1-CD1 3.57Å; L714-Y772 HydrophobicContact CD1-CD2 4.12Å; L714-Y772 HydrophobicContact CD1-CE1 3.88Å; L714-Y772 HydrophobicContact CD1-CE2 4.39Å; L714-Y772 HydrophobicContact CD1-CG 3.73Å; L714-Y772 HydrophobicContact CD2-CD2 4.13Å; L714-Y772 HydrophobicContact CD2-CG 4.39Å; L714-Y775 HydrophobicContact CB-CD1 4.18Å; L714-Y775 HydrophobicContact CB-CE1 4.41Å; L714-Y775 HydrophobicContact CD1-CD1 3.8Å; L714-I776 HydrophobicContact CD2-CD1 4.06Å; L714-I776 HydrophobicContact CD2-CG1 4.23Å; L714-L779 HydrophobicContact CB-CD1 3.96Å
715	D	97	Very high	94.7	Very high	44 Å²	44	45 Å²	45	24%	0.235	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-39.4	173	-175	59.8	0	0	0	112.3	A711 W713 T719 L779 K783	A711-D715 PolarHBondContact O-N 2.85Å; W713-D715 VanDerWaalsContact C-N 3.32Å; W713-D715 PolarHBondContact O-N 3.49Å; D715-T719 VanDerWaalsContact O-CB 3.22Å; D715-T719 WeakPolarHBondContact O-CB 3.35Å; D715-T719 PolarHBondContact O-N 3.2Å; D715-T719 PolarHBondContact O-OG1 2.61Å; D715-L779 HydrophobicContact CB-CD1 4.24Å; D715-L779 HydrophobicContact CB-CD2 4.01Å; D715-L779 WeakPolarHBondContact OD1-CD2 3.23Å; D715-K783 WeakPolarHBondContact OD1-CE 3.2Å; D715-K783 IonicContact OD1-NZ 3.62Å; D715-K783 PolarHBondContact OD1-NZ 2.96Å; D715-K783 IonicContact OD2-NZ 3.54Å
716	T	96.7	Very high	94.3	Very high	78 Å²	78	50.4 Å²	50.4	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-41.7	174.7	-53.8	0	0	0	0	111.6	Q712 W713 L714 S720	Q712-T716 WeakPolarHBondContact O-CB 3.46Å; Q712-T716 PolarHBondContact O-N 3.42Å; Q712-T716 PolarHBondContact O-OG1 3.14Å; W713-T716 CarbonylContact O-C 3.58Å; W713-T716 WeakPolarHBondContact O-CA 3.4Å; W713-T716 WeakPolarHBondContact O-CB 3.3Å; W713-T716 PolarHBondContact O-N 3.03Å; W713-T716 VanDerWaalsContact O-N 3.08Å; L714-T716 VanDerWaalsContact C-N 3.32Å; L714-T716 PolarHBondContact O-N 3.09Å; T716-S720 WeakPolarHBondContact O-CB 3.34Å; T716-S720 PolarHBondContact O-N 2.79Å; T716-S720 PolarHBondContact O-OG 3.45Å; T716-S720 VanDerWaalsContact O-OG 3.11Å
717	V	95.3	Very high	93.8	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-50.8	176.8	170	0	0	0	0	110.8	L693 W713 L714 T719 S720 I721	L693-V717 HydrophobicContact CD2-CB 4.26Å; L693-V717 HydrophobicContact CD2-CG1 3.71Å; L693-V717 HydrophobicContact CD2-CG2 3.46Å; L693-V717 VanDerWaalsContact CD2-CG2 3.46Å; W713-V717 HydrophobicContact CD2-CG2 4.23Å; W713-V717 HydrophobicContact CG-CG2 4.47Å; W713-V717 HydrophobicContact CZ2-CG2 4.07Å; W713-V717 WeakPolarHBondContact O-CG2 3.34Å; W713-V717 PolarHBondContact O-N 3.3Å; L714-V717 PolarHBondContact O-N 3.34Å; V717-T719 VanDerWaalsContact C-N 3.31Å; V717-T719 PolarHBondContact O-N 3.43Å; V717-S720 PolarHBondContact O-N 3.06Å; V717-S720 PolarHBondContact O-OG 2.94Å; V717-I721 HydrophobicContact CG1-CD1 3.99Å; V717-I721 WeakPolarHBondContact O-CG1 3.18Å; V717-I721 PolarHBondContact O-N 3.36Å
718	V	96.2	Very high	93.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-40.3	178.7	179	0	0	0	0	110.7	L714 L722 L739 I776 L779 V780 K783	L714-V718 WeakPolarHBondContact O-CG2 3.32Å; L714-V718 PolarHBondContact O-N 3.07Å; V718-L722 HydrophobicContact CG1-CD1 3.84Å; V718-L722 HydrophobicContact CG1-CG 4.47Å; V718-L722 WeakPolarHBondContact O-CG 3.26Å; V718-L722 PolarHBondContact O-N 3.29Å; V718-L739 HydrophobicContact CB-CD2 4.23Å; V718-L739 HydrophobicContact CG1-CD2 3.91Å; V718-L739 HydrophobicContact CG2-CD2 4.12Å; V718-I776 HydrophobicContact CG2-CG1 4.21Å; V718-I776 HydrophobicContact CG2-CG2 4.07Å; V718-L779 HydrophobicContact CG1-CB 4.49Å; V718-L779 HydrophobicContact CG2-CB 4.33Å; V718-L779 HydrophobicContact CG2-CD1 4.12Å; V718-V780 HydrophobicContact CG1-CG2 3.94Å; V718-K783 HydrophobicContact CB-CD 4.47Å; V718-K783 HydrophobicContact CG1-CD 3.66Å
719	T	95.7	Very high	93.2	Very high	38 Å²	38	54.2 Å²	54.2	23%	0.233	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-50	176.8	-56.3	0	0	0	0	111.6	D715 V717 I721 L722 Q723 K783	D715-T719 VanDerWaalsContact O-CB 3.22Å; D715-T719 WeakPolarHBondContact O-CB 3.35Å; D715-T719 PolarHBondContact O-N 3.2Å; D715-T719 PolarHBondContact O-OG1 2.61Å; V717-T719 VanDerWaalsContact C-N 3.31Å; V717-T719 PolarHBondContact O-N 3.43Å; T719-I721 PolarHBondContact O-N 3.24Å; T719-I721 VanDerWaalsContact O-N 3.13Å; T719-L722 PolarHBondContact O-N 3.2Å; T719-L722 VanDerWaalsContact O-N 3.13Å; T719-Q723 HydrophobicContact CG2-CB 4.34Å; T719-Q723 WeakPolarHBondContact O-CB 3.44Å; T719-Q723 PolarHBondContact O-N 3.4Å; T719-K783 WeakPolarHBondContact OG1-CE 3.44Å; T719-K783 PolarHBondContact OG1-NZ 3.29Å
720	S	93	Very high	92.8	Very high	70 Å²	70	54.2 Å²	54.2	49%	0.49	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-25	-177	61.8	0	0	0	0	113.9	T716 V717 P724	T716-S720 WeakPolarHBondContact O-CB 3.34Å; T716-S720 PolarHBondContact O-N 2.79Å; T716-S720 PolarHBondContact O-OG 3.45Å; T716-S720 VanDerWaalsContact O-OG 3.11Å; V717-S720 PolarHBondContact O-N 3.06Å; V717-S720 PolarHBondContact O-OG 2.94Å; S720-P724 WeakPolarHBondContact O-CD 3.2Å
721	I	91.8	Very high	92.5	Very high	58 Å²	58	55.7 Å²	55.7	30%	0.297	33%	0.326	S	S	.	.	H	α-helix	trans	-85	-31.7	177.5	-65.1	170.4	0	0	0	112.5	V717 T719 L739	V717-I721 HydrophobicContact CG1-CD1 3.99Å; V717-I721 WeakPolarHBondContact O-CG1 3.18Å; V717-I721 PolarHBondContact O-N 3.36Å; T719-I721 PolarHBondContact O-N 3.24Å; T719-I721 VanDerWaalsContact O-N 3.13Å; I721-L739 HydrophobicContact CB-CD2 4.31Å; I721-L739 HydrophobicContact CD1-CD1 3.63Å; I721-L739 HydrophobicContact CD1-CD2 4.44Å; I721-L739 HydrophobicContact CG2-CD1 4.31Å; I721-L739 HydrophobicContact CG2-CD2 4.15Å
722	L	93.7	Very high	92.4	Very high	0 Å²	0	56 Å²	56	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-98	-30.4	-176.1	-60.9	-177.1	0	0	0	114.1	V718 T719 P724 L725 Y732 A735 A736 L739 K783	V718-L722 HydrophobicContact CG1-CD1 3.84Å; V718-L722 HydrophobicContact CG1-CG 4.47Å; V718-L722 WeakPolarHBondContact O-CG 3.26Å; V718-L722 PolarHBondContact O-N 3.29Å; T719-L722 PolarHBondContact O-N 3.2Å; T719-L722 VanDerWaalsContact O-N 3.13Å; L722-P724 VanDerWaalsContact C-CD 3.42Å; L722-P724 VanDerWaalsContact C-N 3.34Å; L722-L725 PolarHBondContact O-N 3.48Å; L722-Y732 HydrophobicContact CB-CD2 4.39Å; L722-Y732 HydrophobicContact CB-CE2 3.75Å; L722-Y732 HydrophobicContact CD1-CE1 4.36Å; L722-Y732 WeakPolarHBondContact O-CD2 3.49Å; L722-Y732 WeakPolarHBondContact O-CE2 3.26Å; L722-A735 HydrophobicContact CD2-CB 4Å; L722-A736 HydrophobicContact CD1-CB 3.92Å; L722-A736 HydrophobicContact CD2-CB 3.98Å; L722-L739 HydrophobicContact CG-CD2 4.43Å; L722-K783 HydrophobicContact CD1-CD 4.44Å
723	Q	91	Very high	92.1	Very high	116 Å²	116	50.5 Å²	50.5	54%	0.542	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-53.9	-39.4	179.2	-174.1	179.9	18.8	0	0	113.7	T719 L725 E726	T719-Q723 HydrophobicContact CG2-CB 4.34Å; T719-Q723 WeakPolarHBondContact O-CB 3.44Å; T719-Q723 PolarHBondContact O-N 3.4Å; Q723-L725 PolarHBondContact O-N 2.83Å; Q723-E726 WeakPolarHBondContact O-CB 3.5Å; Q723-E726 PolarHBondContact O-N 3.06Å; Q723-E726 VanDerWaalsContact O-N 3.17Å
724	P	90.6	Very high	91.8	Very high	102 Å²	102	56 Å²	56	66%	0.662	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-64.8	-7.1	176.1	-22.5	35.3	0	0	0	115.2	S720 L722	S720-P724 WeakPolarHBondContact O-CD 3.2Å; L722-P724 VanDerWaalsContact C-CD 3.42Å; L722-P724 VanDerWaalsContact C-N 3.34Å
725	L	89.7	Confident	91.5	Very high	61 Å²	61	57.1 Å²	57.1	32%	0.319	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-112.4	4.3	-179.3	-57.6	173.8	0	0	0	112.6	L722 Q723 G727 N728 Y732 A735	L722-L725 PolarHBondContact O-N 3.48Å; Q723-L725 PolarHBondContact O-N 2.83Å; L725-G727 PolarHBondContact O-N 3.03Å; L725-G727 VanDerWaalsContact O-N 3.16Å; L725-N728 PolarHBondContact O-N 3.3Å; L725-Y732 HydrophobicContact CB-CD2 4.2Å; L725-A735 HydrophobicContact CD1-CB 3.22Å
726	E	86.1	Confident	91.4	Very high	114 Å²	114	55 Å²	55	53%	0.533	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	115.4	176	-75.4	179.9	-155.6	0	0	111.3	Q723 Y732	Q723-E726 WeakPolarHBondContact O-CB 3.5Å; Q723-E726 PolarHBondContact O-N 3.06Å; Q723-E726 VanDerWaalsContact O-N 3.17Å; E726-Y732 HydrophobicContact CG-CD2 4.26Å; E726-Y732 HydrophobicContact CG-CE2 3.73Å
727	G	84	Confident	91.1	Very high	73 Å²	73	54.8 Å²	54.8	75%	0.753	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.7	-16.1	-178.7	0	0	0	0	0	113.2	L725	L725-G727 PolarHBondContact O-N 3.03Å; L725-G727 VanDerWaalsContact O-N 3.16Å
728	N	89.2	Confident	91	Very high	92 Å²	92	56.4 Å²	56.4	49%	0.492	32%	0.32	S	S	.	.			trans	-121.4	88.5	173.2	-177.5	-23	0	0	0	110	L725 L730 A731 Y732	L725-N728 PolarHBondContact O-N 3.3Å; N728-L730 PolarHBondContact O-N 3.4Å; N728-L730 PolarHBondContact OD1-N 2.83Å; N728-A731 HydrophobicContact CB-CB 4Å; N728-A731 VanDerWaalsContact CG-CB 3.5Å; N728-A731 PolarHBondContact O-N 3.05Å; N728-A731 PolarHBondContact OD1-N 2.74Å; N728-Y732 WeakPolarHBondContact O-CB 3.43Å; N728-Y732 PolarHBondContact O-N 3.17Å
729	S	87.6	Confident	90.8	Very high	51 Å²	51	57.2 Å²	57.2	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-59.9	-31.2	-172.5	-47.4	0	0	0	0	114	T733 H787	S729-T733 WeakPolarHBondContact O-CB 3.1Å; S729-T733 PolarHBondContact O-N 3.13Å; S729-T733 PolarHBondContact O-OG1 3.19Å; S729-T733 VanDerWaalsContact O-OG1 3.05Å; S729-H787 VanDerWaalsContact CA-NE2 3.32Å; S729-H787 WeakPolarHBondContact CA-NE2 3.38Å; S729-H787 PolarHBondContact OG-CD2 2.87Å; S729-H787 PolarHBondContact OG-NE2 3.11Å
730	L	88.1	Confident	90.7	Very high	77 Å²	77	56.9 Å²	56.9	40%	0.403	32%	0.322	S	S	.	.	H	α-helix	trans	-69.6	-40.9	174.5	-176.7	62.3	0	0	0	111.8	N728 R734	N728-L730 PolarHBondContact O-N 3.4Å; N728-L730 PolarHBondContact OD1-N 2.83Å; L730-R734 VanDerWaalsContact O-CB 3.28Å; L730-R734 WeakPolarHBondContact O-CB 3.46Å; L730-R734 VanDerWaalsContact O-CD 3.31Å; L730-R734 WeakPolarHBondContact O-CD 3.41Å; L730-R734 WeakPolarHBondContact O-CG 3.35Å; L730-R734 PolarHBondContact O-N 2.93Å
731	A	90.1	Very high	90.7	Very high	32 Å²	32	58.6 Å²	58.6	26%	0.264	33%	0.325	S	S	.	.	H	α-helix	trans	-70.3	-43	174.9	0	0	0	0	0	111.6	N728 R734 A735	N728-A731 HydrophobicContact CB-CB 4Å; N728-A731 VanDerWaalsContact CG-CB 3.5Å; N728-A731 PolarHBondContact O-N 3.05Å; N728-A731 PolarHBondContact OD1-N 2.74Å; A731-R734 PolarHBondContact O-N 3.22Å; A731-A735 VanDerWaalsContact O-CB 3.29Å; A731-A735 WeakPolarHBondContact O-CB 3.36Å; A731-A735 PolarHBondContact O-N 3.04Å
732	Y	93	Very high	90.8	Very high	11 Å²	11	58.6 Å²	58.6	4%	0.043	32%	0.323	C	S	.	.	H	α-helix	trans	-57	-56.1	178.5	-169	-86.2	0	0	0	111.6	L722 L725 E726 N728 R734 A735 A736 V784 H787	L722-Y732 HydrophobicContact CB-CD2 4.39Å; L722-Y732 HydrophobicContact CB-CE2 3.75Å; L722-Y732 HydrophobicContact CD1-CE1 4.36Å; L722-Y732 WeakPolarHBondContact O-CD2 3.49Å; L722-Y732 WeakPolarHBondContact O-CE2 3.26Å; L725-Y732 HydrophobicContact CB-CD2 4.2Å; E726-Y732 HydrophobicContact CG-CD2 4.26Å; E726-Y732 HydrophobicContact CG-CE2 3.73Å; N728-Y732 WeakPolarHBondContact O-CB 3.43Å; N728-Y732 PolarHBondContact O-N 3.17Å; Y732-R734 PolarHBondContact O-N 3.41Å; Y732-A735 PolarHBondContact O-N 3.22Å; Y732-A736 WeakPolarHBondContact O-CB 3.38Å; Y732-A736 PolarHBondContact O-N 2.97Å; Y732-V784 HydrophobicContact CE1-CG2 4.41Å; Y732-H787 HydrophobicContact CD1-CB 3.8Å; Y732-H787 AromaticContact CD1-CD2 3.75Å; Y732-H787 AromaticContact CD1-CG 3.56Å; Y732-H787 AromaticContact CD2-ND1 3.87Å; Y732-H787 HydrophobicContact CE1-CB 3.5Å; Y732-H787 AromaticContact CE1-CG 3.7Å; Y732-H787 AromaticContact CE2-ND1 3.92Å; Y732-H787 HydrophobicContact CG-CB 4.48Å; Y732-H787 AromaticContact CG-CD2 3.81Å; Y732-H787 AromaticContact CG-CG 3.79Å; Y732-H787 AromaticContact CG-ND1 3.98Å
733	T	90.9	Very high	90.7	Very high	12 Å²	12	60.4 Å²	60.4	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-37.8	-179.8	-56.3	0	0	0	0	112.1	S729 A736 H737 V784 M799	S729-T733 WeakPolarHBondContact O-CB 3.1Å; S729-T733 PolarHBondContact O-N 3.13Å; S729-T733 PolarHBondContact O-OG1 3.19Å; S729-T733 VanDerWaalsContact O-OG1 3.05Å; T733-A736 PolarHBondContact O-N 3.21Å; T733-H737 PolarHBondContact O-N 3.36Å; T733-V784 HydrophobicContact CG2-CG1 4.16Å; T733-M799 HydrophobicContact CG2-CE 4.05Å; T733-M799 HydrophobicContact CG2-SD 3.59Å; T733-M799 VanDerWaalsContact CG2-SD 3.59Å
734	R	90.6	Very high	90.9	Very high	136 Å²	136	56.2 Å²	56.2	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-43	173	-76.7	173.5	179.3	-174.2	0.7	111.9	L730 A731 Y732 Q738	L730-R734 VanDerWaalsContact O-CB 3.28Å; L730-R734 WeakPolarHBondContact O-CB 3.46Å; L730-R734 VanDerWaalsContact O-CD 3.31Å; L730-R734 WeakPolarHBondContact O-CD 3.41Å; L730-R734 WeakPolarHBondContact O-CG 3.35Å; L730-R734 PolarHBondContact O-N 2.93Å; A731-R734 PolarHBondContact O-N 3.22Å; Y732-R734 PolarHBondContact O-N 3.41Å; R734-Q738 WeakPolarHBondContact O-CB 3.36Å; R734-Q738 VanDerWaalsContact O-CG 3.27Å; R734-Q738 WeakPolarHBondContact O-CG 3.37Å; R734-Q738 PolarHBondContact O-N 3.19Å
735	A	92.4	Very high	91	Very high	24 Å²	24	53.9 Å²	53.9	20%	0.198	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-37.2	176.8	0	0	0	0	0	112	L722 L725 A731 Y732 Q738 L739	L722-A735 HydrophobicContact CD2-CB 4Å; L725-A735 HydrophobicContact CD1-CB 3.22Å; A731-A735 VanDerWaalsContact O-CB 3.29Å; A731-A735 WeakPolarHBondContact O-CB 3.36Å; A731-A735 PolarHBondContact O-N 3.04Å; Y732-A735 PolarHBondContact O-N 3.22Å; A735-Q738 CarbonylContact O-C 3.55Å; A735-Q738 PolarHBondContact O-N 3.17Å; A735-L739 WeakPolarHBondContact O-CB 3.09Å; A735-L739 PolarHBondContact O-N 3.46Å
736	A	93.6	Very high	91.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-44.4	175.8	0	0	0	0	0	112.1	L722 Y732 T733 L739 V740 V780 V784	L722-A736 HydrophobicContact CD1-CB 3.92Å; L722-A736 HydrophobicContact CD2-CB 3.98Å; Y732-A736 WeakPolarHBondContact O-CB 3.38Å; Y732-A736 PolarHBondContact O-N 2.97Å; T733-A736 PolarHBondContact O-N 3.21Å; A736-L739 WeakPolarHBondContact O-CB 3.36Å; A736-L739 PolarHBondContact O-N 3.3Å; A736-V740 PolarHBondContact O-N 2.91Å; A736-V780 HydrophobicContact CB-CG1 3.91Å; A736-V784 HydrophobicContact CB-CG2 3.63Å
737	H	91.1	Very high	91.5	Very high	73 Å²	73	47.9 Å²	47.9	34%	0.338	26%	0.264	S	S	.	.	H	α-helix	trans	-66.6	-38.2	173	-62.3	165.1	0	0	0	112.4	T733 L739 L741	T733-H737 PolarHBondContact O-N 3.36Å; H737-L739 VanDerWaalsContact C-N 3.33Å; H737-L741 WeakPolarHBondContact O-CG 3.49Å; H737-L741 PolarHBondContact O-N 2.68Å
738	Q	91.7	Very high	91.9	Very high	44 Å²	44	46.2 Å²	46.2	21%	0.206	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-32.7	173.9	-76.7	-67.3	-57.1	0	0	112.8	R734 A735 L741 K742 Y971	R734-Q738 WeakPolarHBondContact O-CB 3.36Å; R734-Q738 VanDerWaalsContact O-CG 3.27Å; R734-Q738 WeakPolarHBondContact O-CG 3.37Å; R734-Q738 PolarHBondContact O-N 3.19Å; A735-Q738 CarbonylContact O-C 3.55Å; A735-Q738 PolarHBondContact O-N 3.17Å; Q738-L741 PolarHBondContact O-N 2.8Å; Q738-K742 VanDerWaalsContact O-CB 3.26Å; Q738-K742 WeakPolarHBondContact O-CB 3.25Å; Q738-K742 WeakPolarHBondContact O-CG 3.24Å; Q738-K742 PolarHBondContact O-N 3.45Å; Q738-Y971 VanDerWaalsContact NE2-CZ 3.31Å; Q738-Y971 PolarHBondContact NE2-OH 3.27Å
739	L	93.5	Very high	92.1	Very high	18 Å²	18	42.3 Å²	42.3	9%	0.094	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-48.5	176.7	173.3	55.9	0	0	0	111	V718 I721 L722 A735 A736 H737 L741 K742 W743 V780	V718-L739 HydrophobicContact CB-CD2 4.23Å; V718-L739 HydrophobicContact CG1-CD2 3.91Å; V718-L739 HydrophobicContact CG2-CD2 4.12Å; I721-L739 HydrophobicContact CB-CD2 4.31Å; I721-L739 HydrophobicContact CD1-CD1 3.63Å; I721-L739 HydrophobicContact CD1-CD2 4.44Å; I721-L739 HydrophobicContact CG2-CD1 4.31Å; I721-L739 HydrophobicContact CG2-CD2 4.15Å; L722-L739 HydrophobicContact CG-CD2 4.43Å; A735-L739 WeakPolarHBondContact O-CB 3.09Å; A735-L739 PolarHBondContact O-N 3.46Å; A736-L739 WeakPolarHBondContact O-CB 3.36Å; A736-L739 PolarHBondContact O-N 3.3Å; H737-L739 VanDerWaalsContact C-N 3.33Å; L739-L741 PolarHBondContact O-N 2.96Å; L739-K742 PolarHBondContact O-N 2.92Å; L739-W743 WeakPolarHBondContact O-CB 3.16Å; L739-W743 PolarHBondContact O-N 3.06Å; L739-V780 HydrophobicContact CD2-CG2 4.4Å
740	V	93.7	Very high	92.4	Very high	31 Å²	31	41 Å²	41	19%	0.188	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-51.8	175.6	-176.8	0	0	0	0	110.3	A736 K742 W743 S744 I776 V780	A736-V740 PolarHBondContact O-N 2.91Å; V740-K742 PolarHBondContact O-N 3.23Å; V740-W743 PolarHBondContact O-N 2.99Å; V740-S744 PolarHBondContact O-N 3.39Å; V740-S744 PolarHBondContact O-OG 2.85Å; V740-S744 VanDerWaalsContact O-OG 3.04Å; V740-I776 HydrophobicContact CG2-CG2 4.43Å; V740-V780 HydrophobicContact CG2-CB 4.22Å; V740-V780 HydrophobicContact CG2-CG1 4.1Å; V740-V780 HydrophobicContact CG2-CG2 3.99Å
741	L	93	Very high	92.8	Very high	106 Å²	106	38.3 Å²	38.3	56%	0.555	20%	0.196	S	C	*	.	H	α-helix	trans	-59.4	-44.4	-179.7	-68.5	171.4	0	0	0	113.2	H737 Q738 L739 F745	H737-L741 WeakPolarHBondContact O-CG 3.49Å; H737-L741 PolarHBondContact O-N 2.68Å; Q738-L741 PolarHBondContact O-N 2.8Å; L739-L741 PolarHBondContact O-N 2.96Å; L741-F745 WeakPolarHBondContact O-CB 3.21Å; L741-F745 PolarHBondContact O-N 3.17Å
742	K	92.7	Very high	93	Very high	57 Å²	57	39.7 Å²	39.7	25%	0.248	19%	0.194	C	C	.	.	H	α-helix	trans	-69.2	-41.4	179.3	-71	175.2	-175.4	-159.9	0	111.7	C683 Q738 L739 V740 F745 Y746	C683-K742 HydrophobicContact CB-CB 4.35Å; C683-K742 HydrophobicContact CB-CD 4.41Å; C683-K742 HydrophobicContact CB-CG 4.06Å; C683-K742 VanDerWaalsContact O-CD 3.31Å; C683-K742 WeakPolarHBondContact O-CD 3.06Å; C683-K742 WeakPolarHBondContact O-CE 3.47Å; C683-K742 PolarHBondContact O-NZ 2.83Å; Q738-K742 VanDerWaalsContact O-CB 3.26Å; Q738-K742 WeakPolarHBondContact O-CB 3.25Å; Q738-K742 WeakPolarHBondContact O-CG 3.24Å; Q738-K742 PolarHBondContact O-N 3.45Å; L739-K742 PolarHBondContact O-N 2.92Å; V740-K742 PolarHBondContact O-N 3.23Å; K742-F745 PolarHBondContact O-N 3.28Å; K742-Y746 WeakPolarHBondContact O-CB 3.16Å; K742-Y746 PolarHBondContact O-N 3.29Å
743	W	93.4	Very high	93	Very high	38 Å²	38	40 Å²	40	14%	0.144	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-54.7	175	168.8	-95.4	0	0	0	111.3	L714 L739 V740 F745 Y746 S747 Y772 I776	L714-W743 HydrophobicContact CD2-CH2 4.16Å; L739-W743 WeakPolarHBondContact O-CB 3.16Å; L739-W743 PolarHBondContact O-N 3.06Å; V740-W743 PolarHBondContact O-N 2.99Å; W743-F745 VanDerWaalsContact C-N 3.29Å; W743-F745 PolarHBondContact O-N 3Å; W743-Y746 PolarHBondContact O-N 3.26Å; W743-S747 PolarHBondContact O-N 2.92Å; W743-S747 PolarHBondContact O-OG 3.22Å; W743-Y772 HydrophobicContact CH2-CD2 4.14Å; W743-Y772 AromaticContact CZ2-CD2 3.87Å; W743-Y772 HydrophobicContact CZ2-CD2 3.87Å; W743-Y772 HydrophobicContact CZ2-CG 4.28Å; W743-I776 HydrophobicContact CD2-CD1 3.29Å; W743-I776 HydrophobicContact CE3-CD1 3.66Å; W743-I776 HydrophobicContact CG-CD1 3.65Å; W743-I776 HydrophobicContact CH2-CD1 4.17Å; W743-I776 HydrophobicContact CZ2-CD1 3.86Å; W743-I776 HydrophobicContact CZ3-CD1 4.07Å
744	S	93.5	Very high	93.2	Very high	29 Å²	29	39.5 Å²	39.5	20%	0.203	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-34.5	-176.6	-52.3	0	0	0	0	111.4	V740 S748 R769 D773	V740-S744 PolarHBondContact O-N 3.39Å; V740-S744 PolarHBondContact O-OG 2.85Å; V740-S744 VanDerWaalsContact O-OG 3.04Å; S744-S748 WeakPolarHBondContact O-CB 3.39Å; S744-S748 PolarHBondContact O-N 2.91Å; S744-S748 PolarHBondContact O-OG 3.18Å; S744-R769 PolarHBondContact O-NH2 3.32Å; S744-D773 WeakPolarHBondContact CB-OD1 3.35Å; S744-D773 PolarHBondContact OG-OD1 2.87Å
745	F	93.5	Very high	93.4	Very high	52 Å²	52	35.4 Å²	35.4	23%	0.228	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-58.2	171.8	-176	-88.5	0	0	0	112	A679 V682 C683 L741 K742 W743 S747 S748 M749	A679-F745 HydrophobicContact CB-CD1 4.46Å; A679-F745 HydrophobicContact CB-CE1 4.02Å; V682-F745 HydrophobicContact CB-CD1 4.48Å; V682-F745 HydrophobicContact CB-CE1 3.96Å; V682-F745 HydrophobicContact CB-CZ 3.98Å; V682-F745 HydrophobicContact CG1-CD1 4.32Å; V682-F745 HydrophobicContact CG1-CD2 4.22Å; V682-F745 HydrophobicContact CG1-CE1 4.15Å; V682-F745 HydrophobicContact CG1-CE2 4.05Å; V682-F745 HydrophobicContact CG1-CG 4.35Å; V682-F745 HydrophobicContact CG1-CZ 4.01Å; V682-F745 HydrophobicContact CG2-CE1 4.22Å; V682-F745 HydrophobicContact CG2-CE2 4.39Å; V682-F745 HydrophobicContact CG2-CZ 3.8Å; C683-F745 WeakPolarHBondContact SG-CD1 3.29Å; L741-F745 WeakPolarHBondContact O-CB 3.21Å; L741-F745 PolarHBondContact O-N 3.17Å; K742-F745 PolarHBondContact O-N 3.28Å; W743-F745 VanDerWaalsContact C-N 3.29Å; W743-F745 PolarHBondContact O-N 3Å; F745-S747 PolarHBondContact O-N 3.37Å; F745-S748 PolarHBondContact O-N 3.3Å; F745-M749 HydrophobicContact CD1-SD 4.18Å; F745-M749 HydrophobicContact CE1-CG 4.2Å; F745-M749 HydrophobicContact CE1-SD 3.4Å; F745-M749 WeakPolarHBondContact CE1-SD 3.24Å; F745-M749 HydrophobicContact CZ-SD 3.82Å; F745-M749 WeakPolarHBondContact O-CG 3.08Å; F745-M749 PolarHBondContact O-N 2.94Å
746	Y	92.3	Very high	93.5	Very high	29 Å²	29	40.6 Å²	40.6	11%	0.114	21%	0.207	C	C	.	.	H	α-helix	trans	-57	-50.1	-175.6	-115.6	-72	0	0	0	112.1	V675 A679 C683 C685 V690 K742 W743 S748 M749 V750	V675-Y746 HydrophobicContact CG1-CD1 4.16Å; V675-Y746 HydrophobicContact CG1-CE1 4.28Å; A679-Y746 HydrophobicContact CB-CD1 3.92Å; A679-Y746 HydrophobicContact CB-CD2 4.14Å; A679-Y746 HydrophobicContact CB-CE1 3.48Å; A679-Y746 VanDerWaalsContact CB-CE1 3.48Å; A679-Y746 HydrophobicContact CB-CE2 3.74Å; A679-Y746 HydrophobicContact CB-CG 4.22Å; C683-Y746 HydrophobicContact CB-CD2 3.81Å; C683-Y746 HydrophobicContact CB-CE2 3.6Å; C685-Y746 HydrophobicContact CB-CE2 4.29Å; V690-Y746 HydrophobicContact CG1-CE1 3.96Å; V690-Y746 HydrophobicContact CG2-CE1 4.32Å; V690-Y746 HydrophobicContact CG2-CE2 4.21Å; K742-Y746 WeakPolarHBondContact O-CB 3.16Å; K742-Y746 PolarHBondContact O-N 3.29Å; W743-Y746 PolarHBondContact O-N 3.26Å; Y746-S748 VanDerWaalsContact C-N 3.32Å; Y746-S748 PolarHBondContact O-N 3.38Å; Y746-M749 WeakPolarHBondContact O-CB 3.28Å; Y746-M749 PolarHBondContact O-N 3.4Å; Y746-M749 VanDerWaalsContact O-N 3.07Å; Y746-V750 PolarHBondContact O-N 2.81Å
747	S	93.4	Very high	93.4	Very high	20 Å²	20	46 Å²	46	14%	0.14	23%	0.228	C	C	.	.	H	α-helix	trans	-74.3	-22.8	-175.9	54.9	0	0	0	0	112.7	W743 F745 M749 V750 I751 R769	W743-S747 PolarHBondContact O-N 2.92Å; W743-S747 PolarHBondContact O-OG 3.22Å; F745-S747 PolarHBondContact O-N 3.37Å; S747-M749 VanDerWaalsContact C-N 3.31Å; S747-V750 PolarHBondContact O-N 3.32Å; S747-I751 WeakPolarHBondContact O-CG1 3.44Å; S747-I751 PolarHBondContact O-N 2.82Å; S747-R769 WeakPolarHBondContact OG-CD 3.43Å; S747-R769 PolarHBondContact OG-NE 3.12Å; S747-R769 VanDerWaalsContact OG-NE 3.08Å; S747-R769 PolarHBondContact OG-NH1 2.99Å
748	S	93.4	Very high	93.6	Very high	38 Å²	38	47.6 Å²	47.6	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-70.6	-25.1	167.6	-58	0	0	0	0	112.9	S744 F745 Y746 R752 R769	S744-S748 WeakPolarHBondContact O-CB 3.39Å; S744-S748 PolarHBondContact O-N 2.91Å; S744-S748 PolarHBondContact O-OG 3.18Å; F745-S748 PolarHBondContact O-N 3.3Å; Y746-S748 VanDerWaalsContact C-N 3.32Å; Y746-S748 PolarHBondContact O-N 3.38Å; S748-R752 PolarHBondContact O-N 3.41Å; S748-R769 PolarHBondContact OG-NE 3.42Å; S748-R769 PolarHBondContact OG-NH2 3.44Å
749	M	92.8	Very high	93.7	Very high	10 Å²	10	46 Å²	46	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-70.8	-38.4	170	-60.1	-161.7	56.1	0	0	112.3	V675 Q678 A679 F745 Y746 S747 R752 D753	V675-M749 HydrophobicContact CG1-CB 3.87Å; Q678-M749 HydrophobicContact CB-CE 3.49Å; Q678-M749 VanDerWaalsContact CB-CE 3.49Å; Q678-M749 HydrophobicContact CB-SD 4.49Å; Q678-M749 HydrophobicContact CG-CE 4.29Å; Q678-M749 VanDerWaalsContact OE1-CE 3.25Å; A679-M749 HydrophobicContact CB-SD 3.93Å; F745-M749 HydrophobicContact CD1-SD 4.18Å; F745-M749 HydrophobicContact CE1-CG 4.2Å; F745-M749 HydrophobicContact CE1-SD 3.4Å; F745-M749 WeakPolarHBondContact CE1-SD 3.24Å; F745-M749 HydrophobicContact CZ-SD 3.82Å; F745-M749 WeakPolarHBondContact O-CG 3.08Å; F745-M749 PolarHBondContact O-N 2.94Å; Y746-M749 WeakPolarHBondContact O-CB 3.28Å; Y746-M749 PolarHBondContact O-N 3.4Å; Y746-M749 VanDerWaalsContact O-N 3.07Å; S747-M749 VanDerWaalsContact C-N 3.31Å; M749-R752 PolarHBondContact O-N 2.94Å; M749-D753 PolarHBondContact O-N 3.02Å; M749-D753 VanDerWaalsContact O-N 3.08Å
750	V	94.2	Very high	93.7	Very high	24 Å²	24	48.9 Å²	48.9	15%	0.145	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-45	173.2	177.6	0	0	0	0	110.8	L667 V670 F672 V675 Y746 S747 R752 D753 L754	L667-V750 HydrophobicContact CD1-CG1 4.5Å; V670-V750 HydrophobicContact CG1-CG1 4.43Å; F672-V750 HydrophobicContact CE1-CG2 3.84Å; F672-V750 HydrophobicContact CZ-CG1 4.35Å; F672-V750 HydrophobicContact CZ-CG2 4.4Å; V675-V750 HydrophobicContact CG1-CG2 4.26Å; Y746-V750 PolarHBondContact O-N 2.81Å; S747-V750 PolarHBondContact O-N 3.32Å; V750-R752 VanDerWaalsContact C-N 3.35Å; V750-R752 PolarHBondContact O-N 2.74Å; V750-D753 PolarHBondContact O-N 2.95Å; V750-L754 HydrophobicContact CG1-CD1 4.26Å; V750-L754 WeakPolarHBondContact O-CG 3.35Å; V750-L754 PolarHBondContact O-N 3.39Å
751	I	95.4	Very high	93.8	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.108	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-44.4	174.9	-68.5	-66.9	0	0	0	111.3	S747 D753 L754 T755 F762 F765 R769	S747-I751 WeakPolarHBondContact O-CG1 3.44Å; S747-I751 PolarHBondContact O-N 2.82Å; I751-D753 PolarHBondContact O-N 2.81Å; I751-L754 HydrophobicContact CD1-CD1 4.47Å; I751-L754 WeakPolarHBondContact O-CB 3.42Å; I751-L754 PolarHBondContact O-N 2.85Å; I751-T755 PolarHBondContact O-N 3.27Å; I751-T755 PolarHBondContact O-OG1 2.95Å; I751-F762 HydrophobicContact CG2-CE2 3.84Å; I751-F765 HydrophobicContact CD1-CB 3.91Å; I751-R769 HydrophobicContact CD1-CB 3.99Å; I751-R769 HydrophobicContact CD1-CG 4.35Å; I751-R769 HydrophobicContact CG1-CB 4.09Å; I751-R769 HydrophobicContact CG1-CG 3.88Å
752	R	94.1	Very high	94	Very high	61 Å²	61	45.9 Å²	45.9	23%	0.23	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-40.8	177.4	-167.7	-171.8	-53.1	115.8	9.7	113.1	S748 M749 V750 L754 T755 L756 E957 L961	S748-R752 PolarHBondContact O-N 3.41Å; M749-R752 PolarHBondContact O-N 2.94Å; V750-R752 VanDerWaalsContact C-N 3.35Å; V750-R752 PolarHBondContact O-N 2.74Å; R752-L754 VanDerWaalsContact C-N 3.34Å; R752-T755 WeakPolarHBondContact O-CB 3.32Å; R752-T755 PolarHBondContact O-N 3.49Å; R752-L756 HydrophobicContact CG-CD1 4.3Å; R752-L756 VanDerWaalsContact O-CG 3.31Å; R752-L756 WeakPolarHBondContact O-CG 3.37Å; R752-L756 PolarHBondContact O-N 3.37Å; R752-E957 IonicContact NE-OE1 3.91Å; R752-L961 VanDerWaalsContact NH2-CD1 3.35Å
753	D	94.3	Very high	94	Very high	18 Å²	18	44.5 Å²	44.5	10%	0.096	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-35.8	177.5	-169	-104.9	0	0	0	111.5	V670 M749 V750 I751 L756 R757	V670-D753 WeakPolarHBondContact CA-OD1 3.49Å; V670-D753 HydrophobicContact CG1-CB 4.39Å; V670-D753 WeakPolarHBondContact CG1-OD1 3.41Å; M749-D753 PolarHBondContact O-N 3.02Å; M749-D753 VanDerWaalsContact O-N 3.08Å; V750-D753 PolarHBondContact O-N 2.95Å; I751-D753 PolarHBondContact O-N 2.81Å; D753-L756 PolarHBondContact O-N 3.26Å; D753-R757 VanDerWaalsContact CG-NH2 3.28Å; D753-R757 VanDerWaalsContact O-CG 3.31Å; D753-R757 WeakPolarHBondContact O-CG 3.37Å; D753-R757 PolarHBondContact O-N 3.18Å; D753-R757 VanDerWaalsContact O-N 3.11Å; D753-R757 IonicContact OD1-CZ 3.14Å; D753-R757 IonicContact OD1-NE 2.62Å; D753-R757 PolarHBondContact OD1-NE 3.3Å; D753-R757 IonicContact OD1-NH2 3.59Å; D753-R757 PolarHBondContact OD1-NH2 3.24Å; D753-R757 IonicContact OD2-CZ 3.14Å; D753-R757 IonicContact OD2-NE 3.68Å; D753-R757 IonicContact OD2-NH2 2.68Å; D753-R757 PolarHBondContact OD2-NH2 3.24Å
754	L	95.6	Very high	94.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.6	-40.9	169.7	-69	166.5	0	0	0	112.4	D666 V670 V750 I751 R752 R757 S758 A759 F762 F765	D666-L754 HydrophobicContact CB-CD2 4.33Å; V670-L754 HydrophobicContact CG2-CD2 3.63Å; V670-L754 HydrophobicContact CG2-CG 3.91Å; V750-L754 HydrophobicContact CG1-CD1 4.26Å; V750-L754 WeakPolarHBondContact O-CG 3.35Å; V750-L754 PolarHBondContact O-N 3.39Å; I751-L754 HydrophobicContact CD1-CD1 4.47Å; I751-L754 WeakPolarHBondContact O-CB 3.42Å; I751-L754 PolarHBondContact O-N 2.85Å; R752-L754 VanDerWaalsContact C-N 3.34Å; L754-R757 PolarHBondContact O-N 3.08Å; L754-S758 PolarHBondContact O-N 3.35Å; L754-A759 HydrophobicContact CB-CB 3.98Å; L754-A759 HydrophobicContact CD2-CB 3.7Å; L754-A759 HydrophobicContact CG-CB 4.46Å; L754-A759 WeakPolarHBondContact O-CB 3.44Å; L754-A759 PolarHBondContact O-N 2.83Å; L754-F762 HydrophobicContact CB-CD2 4.48Å; L754-F765 HydrophobicContact CD1-CB 3.87Å; L754-F765 HydrophobicContact CD1-CD1 4.18Å; L754-F765 HydrophobicContact CD1-CD2 3.7Å; L754-F765 HydrophobicContact CD1-CE2 4.29Å; L754-F765 HydrophobicContact CD1-CG 3.65Å; L754-F765 HydrophobicContact CD2-CD2 4.4Å; L754-F765 HydrophobicContact CD2-CE2 4.45Å
755	T	94.5	Very high	94.3	Very high	50 Å²	50	42.6 Å²	42.6	31%	0.307	24%	0.237	S	C	.	.	H	α-helix	trans	-59.6	-48.8	173.1	-49.2	0	0	0	0	111.2	I751 R752 R757 S758 F762	I751-T755 PolarHBondContact O-N 3.27Å; I751-T755 PolarHBondContact O-OG1 2.95Å; R752-T755 WeakPolarHBondContact O-CB 3.32Å; R752-T755 PolarHBondContact O-N 3.49Å; T755-R757 PolarHBondContact O-N 3.38Å; T755-S758 PolarHBondContact O-N 3.33Å; T755-F762 WeakPolarHBondContact OG1-CE2 3.3Å
756	L	93.2	Very high	94.4	Very high	133 Å²	133	43.9 Å²	43.9	70%	0.696	24%	0.243	S	C	*	.	H	α-helix	trans	-65.6	-25	-178.3	-71.7	170.7	0	0	0	113.3	R752 D753	R752-L756 HydrophobicContact CG-CD1 4.3Å; R752-L756 VanDerWaalsContact O-CG 3.31Å; R752-L756 WeakPolarHBondContact O-CG 3.37Å; R752-L756 PolarHBondContact O-N 3.37Å; D753-L756 PolarHBondContact O-N 3.26Å
757	R	92.7	Very high	94.5	Very high	113 Å²	113	44.3 Å²	44.3	43%	0.426	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3.1	172.7	-67.2	175.4	-156.2	-85.9	-13.6	113.5	R669 D753 L754 T755 A759	R669-R757 PolarHBondContact O-NE 3.48Å; R669-R757 PolarHBondContact O-NH1 2.83Å; D753-R757 VanDerWaalsContact CG-NH2 3.28Å; D753-R757 VanDerWaalsContact O-CG 3.31Å; D753-R757 WeakPolarHBondContact O-CG 3.37Å; D753-R757 PolarHBondContact O-N 3.18Å; D753-R757 VanDerWaalsContact O-N 3.11Å; D753-R757 IonicContact OD1-CZ 3.14Å; D753-R757 IonicContact OD1-NE 2.62Å; D753-R757 PolarHBondContact OD1-NE 3.3Å; D753-R757 IonicContact OD1-NH2 3.59Å; D753-R757 PolarHBondContact OD1-NH2 3.24Å; D753-R757 IonicContact OD2-CZ 3.14Å; D753-R757 IonicContact OD2-NE 3.68Å; D753-R757 IonicContact OD2-NH2 2.68Å; D753-R757 PolarHBondContact OD2-NH2 3.24Å; L754-R757 PolarHBondContact O-N 3.08Å; T755-R757 PolarHBondContact O-N 3.38Å; R757-A759 PolarHBondContact O-N 3.47Å
758	S	93.9	Very high	94.6	Very high	107 Å²	107	43.6 Å²	43.6	75%	0.748	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	45.7	-169.7	-57.3	0	0	0	0	112.1	L754 T755 S760	L754-S758 PolarHBondContact O-N 3.35Å; T755-S758 PolarHBondContact O-N 3.33Å; S758-S760 PolarHBondContact O-N 3.37Å
759	A	94.2	Very high	94.7	Very high	10 Å²	10	42.9 Å²	42.9	8%	0.083	23%	0.234	C	C	.	.			trans	-55.6	125.1	-176	0	0	0	0	0	111.3	D666 L754 R757 S761 F762	D666-A759 HydrophobicContact CB-CB 4.02Å; L754-A759 HydrophobicContact CB-CB 3.98Å; L754-A759 HydrophobicContact CD2-CB 3.7Å; L754-A759 HydrophobicContact CG-CB 4.46Å; L754-A759 WeakPolarHBondContact O-CB 3.44Å; L754-A759 PolarHBondContact O-N 2.83Å; R757-A759 PolarHBondContact O-N 3.47Å; A759-S761 PolarHBondContact O-N 2.81Å; A759-S761 VanDerWaalsContact O-N 3.11Å; A759-F762 HydrophobicContact CB-CB 4.48Å; A759-F762 WeakPolarHBondContact O-CB 3.41Å; A759-F762 PolarHBondContact O-N 2.89Å
760	S	94.5	Very high	94.9	Very high	80 Å²	80	45 Å²	45	56%	0.559	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.4	-176	62.4	0	0	0	0	113.8	Q662 D666 S758	Q662-S760 WeakPolarHBondContact CG-OG 3.35Å; Q662-S760 PolarHBondContact NE2-OG 3.19Å; D666-S760 PolarHBondContact OD2-N 2.73Å; D666-S760 VanDerWaalsContact OD2-N 3.13Å; D666-S760 PolarHBondContact OD2-OG 3.45Å; S758-S760 PolarHBondContact O-N 3.37Å
761	S	95.8	Very high	95	Very high	4 Å²	4	44 Å²	44	3%	0.028	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	11.1	175.2	54.9	0	0	0	0	114.3	D666 A759 G763 S764 F765	D666-S761 WeakPolarHBondContact CB-OG 3.33Å; D666-S761 PolarHBondContact OD2-N 2.95Å; D666-S761 VanDerWaalsContact OD2-N 3.11Å; D666-S761 PolarHBondContact OD2-OG 3.23Å; A759-S761 PolarHBondContact O-N 2.81Å; A759-S761 VanDerWaalsContact O-N 3.11Å; S761-G763 VanDerWaalsContact C-N 3.31Å; S761-G763 PolarHBondContact O-N 2.76Å; S761-S764 WeakPolarHBondContact O-CB 3.29Å; S761-S764 PolarHBondContact O-N 2.88Å; S761-F765 PolarHBondContact O-N 2.79Å; S761-F765 VanDerWaalsContact O-N 3.1Å; S761-F765 WeakPolarHBondContact OG-CE2 3.29Å
762	F	96	Very high	95	Very high	70 Å²	70	43.2 Å²	43.2	31%	0.307	23%	0.234	S	C	.	.	H	α-helix	trans	-49.5	-46.3	-178	168.7	-96.9	0	0	0	113.4	I751 L754 T755 A759 S764 F765 H766	I751-F762 HydrophobicContact CG2-CE2 3.84Å; L754-F762 HydrophobicContact CB-CD2 4.48Å; T755-F762 WeakPolarHBondContact OG1-CE2 3.3Å; A759-F762 HydrophobicContact CB-CB 4.48Å; A759-F762 WeakPolarHBondContact O-CB 3.41Å; A759-F762 PolarHBondContact O-N 2.89Å; F762-S764 VanDerWaalsContact C-N 3.34Å; F762-S764 PolarHBondContact O-N 2.7Å; F762-F765 PolarHBondContact O-N 2.88Å; F762-H766 HydrophobicContact CE1-CB 4.47Å; F762-H766 HydrophobicContact CZ-CB 4.4Å; F762-H766 WeakPolarHBondContact O-CB 3.24Å; F762-H766 PolarHBondContact O-N 3.34Å
763	G	93.9	Very high	95.1	Very high	27 Å²	27	41.9 Å²	41.9	28%	0.278	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-39.3	179.3	0	0	0	0	0	113.3	S761 H766 L767	S761-G763 VanDerWaalsContact C-N 3.31Å; S761-G763 PolarHBondContact O-N 2.76Å; G763-H766 PolarHBondContact O-N 3.23Å; G763-L767 WeakPolarHBondContact O-CB 3.37Å; G763-L767 PolarHBondContact O-N 3.06Å
764	S	95.7	Very high	95.1	Very high	17 Å²	17	43.8 Å²	43.8	12%	0.119	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-42.1	175.1	-56.2	0	0	0	0	111.7	Q659 S761 F762 I768	Q659-S764 PolarHBondContact OE1-OG 2.99Å; S761-S764 WeakPolarHBondContact O-CB 3.29Å; S761-S764 PolarHBondContact O-N 2.88Å; F762-S764 VanDerWaalsContact C-N 3.34Å; F762-S764 PolarHBondContact O-N 2.7Å; S764-I768 WeakPolarHBondContact O-CG1 3.35Å; S764-I768 PolarHBondContact O-N 3.08Å; S764-I768 VanDerWaalsContact O-N 3.16Å
765	F	96.2	Very high	95.2	Very high	10 Å²	10	45.1 Å²	45.1	4%	0.044	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-41.1	174.3	-82.8	-66.8	0	0	0	113.1	M663 L667 F697 I751 L754 S761 F762 I768 R769	M663-F765 HydrophobicContact CB-CE2 3.67Å; M663-F765 HydrophobicContact CB-CZ 3.61Å; M663-F765 HydrophobicContact CE-CD1 3.95Å; M663-F765 HydrophobicContact CE-CE1 3.7Å; M663-F765 HydrophobicContact CE-CE2 4.33Å; M663-F765 HydrophobicContact CE-CG 4.34Å; M663-F765 HydrophobicContact CE-CZ 3.88Å; M663-F765 HydrophobicContact CG-CD2 4.19Å; M663-F765 HydrophobicContact CG-CE2 3.74Å; M663-F765 HydrophobicContact CG-CZ 4.01Å; M663-F765 WeakPolarHBondContact O-CE2 3.42Å; M663-F765 WeakPolarHBondContact O-CZ 3.01Å; L667-F765 HydrophobicContact CB-CZ 3.87Å; L667-F765 HydrophobicContact CD1-CE1 4.17Å; L667-F765 HydrophobicContact CD1-CZ 4.18Å; L667-F765 HydrophobicContact CG-CZ 4.42Å; F697-F765 AromaticContact CE1-CE1 3.9Å; F697-F765 HydrophobicContact CE1-CE1 3.9Å; F697-F765 HydrophobicContact CZ-CD1 4.45Å; F697-F765 AromaticContact CZ-CE1 4Å; F697-F765 HydrophobicContact CZ-CE1 4Å; I751-F765 HydrophobicContact CD1-CB 3.91Å; L754-F765 HydrophobicContact CD1-CB 3.87Å; L754-F765 HydrophobicContact CD1-CD1 4.18Å; L754-F765 HydrophobicContact CD1-CD2 3.7Å; L754-F765 HydrophobicContact CD1-CE2 4.29Å; L754-F765 HydrophobicContact CD1-CG 3.65Å; L754-F765 HydrophobicContact CD2-CD2 4.4Å; L754-F765 HydrophobicContact CD2-CE2 4.45Å; S761-F765 PolarHBondContact O-N 2.79Å; S761-F765 VanDerWaalsContact O-N 3.1Å; S761-F765 WeakPolarHBondContact OG-CE2 3.29Å; F762-F765 PolarHBondContact O-N 2.88Å; F765-I768 PolarHBondContact O-N 3.21Å; F765-R769 VanDerWaalsContact O-CB 3.32Å; F765-R769 WeakPolarHBondContact O-CB 3.49Å; F765-R769 PolarHBondContact O-N 3.45Å
766	H	95.7	Very high	95.3	Very high	79 Å²	79	42.8 Å²	42.8	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-65	-41.9	178.1	-175.9	72.2	0	0	0	111.7	F762 G763 I768 R769 L770	F762-H766 HydrophobicContact CE1-CB 4.47Å; F762-H766 HydrophobicContact CZ-CB 4.4Å; F762-H766 WeakPolarHBondContact O-CB 3.24Å; F762-H766 PolarHBondContact O-N 3.34Å; G763-H766 PolarHBondContact O-N 3.23Å; H766-I768 PolarHBondContact O-N 3.11Å; H766-R769 WeakPolarHBondContact O-CB 3.16Å; H766-R769 PolarHBondContact O-N 3.29Å; H766-L770 WeakPolarHBondContact O-CG 3.36Å; H766-L770 PolarHBondContact O-N 2.93Å
767	L	96.1	Very high	95.4	Very high	39 Å²	39	40 Å²	40	20%	0.204	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-41.7	174.8	-179.8	60.2	0	0	0	112.5	L646 A649 V653 G763 L770 L771	L646-L767 HydrophobicContact CD2-CD1 4.11Å; A649-L767 HydrophobicContact CB-CD1 4Å; A649-L767 HydrophobicContact CB-CD2 3.86Å; A649-L767 HydrophobicContact CB-CG 4.48Å; V653-L767 HydrophobicContact CG2-CD2 3.88Å; G763-L767 WeakPolarHBondContact O-CB 3.37Å; G763-L767 PolarHBondContact O-N 3.06Å; L767-L770 PolarHBondContact O-N 3.06Å; L767-L771 PolarHBondContact O-N 3.27Å
768	I	95.2	Very high	95.5	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-38.7	176	-76.9	166.2	0	0	0	111.5	V653 L654 M663 S764 F765 H766 L771 Y772	V653-I768 HydrophobicContact CG1-CD1 4.21Å; L654-I768 HydrophobicContact CD2-CD1 4.12Å; M663-I768 HydrophobicContact CE-CD1 3.51Å; M663-I768 HydrophobicContact SD-CD1 4.41Å; S764-I768 WeakPolarHBondContact O-CG1 3.35Å; S764-I768 PolarHBondContact O-N 3.08Å; S764-I768 VanDerWaalsContact O-N 3.16Å; F765-I768 PolarHBondContact O-N 3.21Å; H766-I768 PolarHBondContact O-N 3.11Å; I768-L771 PolarHBondContact O-N 3.06Å; I768-Y772 HydrophobicContact CG2-CD1 4.27Å; I768-Y772 HydrophobicContact CG2-CD2 3.94Å; I768-Y772 HydrophobicContact CG2-CE1 3.88Å; I768-Y772 HydrophobicContact CG2-CE2 3.53Å; I768-Y772 HydrophobicContact CG2-CG 4.28Å; I768-Y772 VanDerWaalsContact CG2-CZ 3.47Å; I768-Y772 WeakPolarHBondContact O-CB 3.35Å; I768-Y772 WeakPolarHBondContact O-CD1 3.43Å; I768-Y772 VanDerWaalsContact O-CG 3.26Å; I768-Y772 PolarHBondContact O-N 3Å
769	R	95	Very high	95.7	Very high	24 Å²	24	32.2 Å²	32.2	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-49.6	173	173.9	85.6	-172.6	79.3	33.3	111.3	S744 S747 S748 I751 F765 H766 Y772 D773	S744-R769 PolarHBondContact O-NH2 3.32Å; S747-R769 WeakPolarHBondContact OG-CD 3.43Å; S747-R769 PolarHBondContact OG-NE 3.12Å; S747-R769 VanDerWaalsContact OG-NE 3.08Å; S747-R769 PolarHBondContact OG-NH1 2.99Å; S748-R769 PolarHBondContact OG-NE 3.42Å; S748-R769 PolarHBondContact OG-NH2 3.44Å; I751-R769 HydrophobicContact CD1-CB 3.99Å; I751-R769 HydrophobicContact CD1-CG 4.35Å; I751-R769 HydrophobicContact CG1-CB 4.09Å; I751-R769 HydrophobicContact CG1-CG 3.88Å; F765-R769 VanDerWaalsContact O-CB 3.32Å; F765-R769 WeakPolarHBondContact O-CB 3.49Å; F765-R769 PolarHBondContact O-N 3.45Å; H766-R769 WeakPolarHBondContact O-CB 3.16Å; H766-R769 PolarHBondContact O-N 3.29Å; R769-Y772 PolarHBondContact O-N 2.89Å; R769-D773 IonicContact CZ-OD1 3.5Å; R769-D773 IonicContact CZ-OD2 3.39Å; R769-D773 IonicContact NH1-OD1 2.72Å; R769-D773 PolarHBondContact NH1-OD1 2.82Å; R769-D773 IonicContact NH1-OD2 3.38Å; R769-D773 PolarHBondContact NH1-OD2 2.83Å; R769-D773 IonicContact NH2-OD1 3.4Å; R769-D773 PolarHBondContact NH2-OD1 3.17Å; R769-D773 IonicContact NH2-OD2 2.69Å; R769-D773 PolarHBondContact NH2-OD2 3.27Å; R769-D773 PolarHBondContact O-N 3.43Å
770	L	96.1	Very high	95.7	Very high	54 Å²	54	31.9 Å²	31.9	28%	0.283	17%	0.165	S	C	.	.	H	α-helix	trans	-60.8	-45.7	177.8	-70	173	0	0	0	112	L646 H766 L767 Y772 E774	L646-L770 HydrophobicContact CD2-CB 4.19Å; H766-L770 WeakPolarHBondContact O-CG 3.36Å; H766-L770 PolarHBondContact O-N 2.93Å; L767-L770 PolarHBondContact O-N 3.06Å; L770-Y772 VanDerWaalsContact C-N 3.32Å; L770-Y772 PolarHBondContact O-N 2.87Å; L770-E774 PolarHBondContact O-N 3.11Å
771	L	96.8	Very high	95.7	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-58.4	-43.5	174.4	172.5	66.6	0	0	0	111.8	L643 L646 A647 A650 L707 L767 I768 Y775	L643-L771 HydrophobicContact CD1-CD1 3.79Å; L646-L771 HydrophobicContact CB-CB 4.36Å; L646-L771 HydrophobicContact CB-CD1 4.05Å; A647-L771 HydrophobicContact CB-CD1 4.25Å; A650-L771 HydrophobicContact CB-CD2 3.49Å; A650-L771 VanDerWaalsContact CB-CD2 3.49Å; L707-L771 HydrophobicContact CD1-CD2 3.63Å; L767-L771 PolarHBondContact O-N 3.27Å; I768-L771 PolarHBondContact O-N 3.06Å; L771-Y775 VanDerWaalsContact O-CB 3.25Å; L771-Y775 WeakPolarHBondContact O-CB 3.31Å; L771-Y775 PolarHBondContact O-N 2.98Å
772	Y	96	Very high	95.6	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-77	-27.1	-173.2	-68.8	4.6	0	0	0	113	F697 W710 W713 L714 W743 I768 R769 L770 I776	F697-Y772 AromaticContact CE2-CE2 3.97Å; F697-Y772 HydrophobicContact CE2-CE2 3.97Å; W710-Y772 HydrophobicContact CE3-CE2 4.19Å; W710-Y772 AromaticContact CE3-CZ 3.9Å; W710-Y772 HydrophobicContact CZ3-CE2 4.42Å; W713-Y772 HydrophobicContact CZ3-CE2 4.37Å; L714-Y772 HydrophobicContact CD1-CD1 3.57Å; L714-Y772 HydrophobicContact CD1-CD2 4.12Å; L714-Y772 HydrophobicContact CD1-CE1 3.88Å; L714-Y772 HydrophobicContact CD1-CE2 4.39Å; L714-Y772 HydrophobicContact CD1-CG 3.73Å; L714-Y772 HydrophobicContact CD2-CD2 4.13Å; L714-Y772 HydrophobicContact CD2-CG 4.39Å; W743-Y772 HydrophobicContact CH2-CD2 4.14Å; W743-Y772 AromaticContact CZ2-CD2 3.87Å; W743-Y772 HydrophobicContact CZ2-CD2 3.87Å; W743-Y772 HydrophobicContact CZ2-CG 4.28Å; I768-Y772 HydrophobicContact CG2-CD1 4.27Å; I768-Y772 HydrophobicContact CG2-CD2 3.94Å; I768-Y772 HydrophobicContact CG2-CE1 3.88Å; I768-Y772 HydrophobicContact CG2-CE2 3.53Å; I768-Y772 HydrophobicContact CG2-CG 4.28Å; I768-Y772 VanDerWaalsContact CG2-CZ 3.47Å; I768-Y772 WeakPolarHBondContact O-CB 3.35Å; I768-Y772 WeakPolarHBondContact O-CD1 3.43Å; I768-Y772 VanDerWaalsContact O-CG 3.26Å; I768-Y772 PolarHBondContact O-N 3Å; R769-Y772 PolarHBondContact O-N 2.89Å; L770-Y772 VanDerWaalsContact C-N 3.32Å; L770-Y772 PolarHBondContact O-N 2.87Å; Y772-I776 VanDerWaalsContact O-CB 3.26Å; Y772-I776 WeakPolarHBondContact O-CB 3.31Å; Y772-I776 VanDerWaalsContact O-CG1 3.3Å; Y772-I776 WeakPolarHBondContact O-CG1 3.13Å; Y772-I776 PolarHBondContact O-N 2.89Å
773	D	95.8	Very high	95.5	Very high	33 Å²	33	28.9 Å²	28.9	18%	0.176	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-57	166.5	-86.1	-25.7	0	0	0	110.9	S744 R769 Y775 I776 F777	S744-D773 WeakPolarHBondContact CB-OD1 3.35Å; S744-D773 PolarHBondContact OG-OD1 2.87Å; R769-D773 IonicContact CZ-OD1 3.5Å; R769-D773 IonicContact CZ-OD2 3.39Å; R769-D773 IonicContact NH1-OD1 2.72Å; R769-D773 PolarHBondContact NH1-OD1 2.82Å; R769-D773 IonicContact NH1-OD2 3.38Å; R769-D773 PolarHBondContact NH1-OD2 2.83Å; R769-D773 IonicContact NH2-OD1 3.4Å; R769-D773 PolarHBondContact NH2-OD1 3.17Å; R769-D773 IonicContact NH2-OD2 2.69Å; R769-D773 PolarHBondContact NH2-OD2 3.27Å; R769-D773 PolarHBondContact O-N 3.43Å; D773-Y775 VanDerWaalsContact C-N 3.31Å; D773-Y775 PolarHBondContact O-N 3.25Å; D773-I776 PolarHBondContact O-N 3.47Å; D773-F777 WeakPolarHBondContact O-CB 3.19Å; D773-F777 PolarHBondContact O-N 2.67Å
774	E	95.2	Very high	95.5	Very high	58 Å²	58	27.7 Å²	27.7	27%	0.271	13%	0.13	S	C	.	.	H	α-helix	trans	-63.6	-36.7	-178.1	-70.6	-61.7	138.9	0	0	112.1	L643 L646 L770 Y778	L643-E774 HydrophobicContact CD1-CB 3.94Å; L646-E774 HydrophobicContact CD1-CB 4.41Å; L646-E774 HydrophobicContact CD1-CG 4.04Å; L770-E774 PolarHBondContact O-N 3.11Å; E774-Y778 VanDerWaalsContact O-CB 3.31Å; E774-Y778 WeakPolarHBondContact O-CB 3.47Å; E774-Y778 PolarHBondContact O-N 3.37Å
775	Y	97.4	Very high	95.4	Very high	28 Å²	28	26.9 Å²	26.9	11%	0.11	12%	0.124	C	C	.	.	H	α-helix	trans	-73.7	-39.9	178.2	-163.4	-106.2	0	0	0	113.1	V588 L589 L643 A711 L714 L771 D773 F777 Y778 L779	V588-Y775 HydrophobicContact CG2-CD2 4.48Å; V588-Y775 HydrophobicContact CG2-CE2 4.05Å; L589-Y775 HydrophobicContact CD1-CE2 4.38Å; L589-Y775 HydrophobicContact CD2-CD2 4.11Å; L589-Y775 HydrophobicContact CD2-CE2 3.95Å; L589-Y775 HydrophobicContact CG-CE2 4.28Å; L643-Y775 HydrophobicContact CD1-CD2 4.25Å; L643-Y775 HydrophobicContact CD2-CD2 4.22Å; A711-Y775 HydrophobicContact CB-CD1 4.4Å; A711-Y775 HydrophobicContact CB-CE1 3.57Å; L714-Y775 HydrophobicContact CB-CD1 4.18Å; L714-Y775 HydrophobicContact CB-CE1 4.41Å; L714-Y775 HydrophobicContact CD1-CD1 3.8Å; L771-Y775 VanDerWaalsContact O-CB 3.25Å; L771-Y775 WeakPolarHBondContact O-CB 3.31Å; L771-Y775 PolarHBondContact O-N 2.98Å; D773-Y775 VanDerWaalsContact C-N 3.31Å; D773-Y775 PolarHBondContact O-N 3.25Å; Y775-F777 VanDerWaalsContact C-N 3.32Å; Y775-Y778 HydrophobicContact CD2-CD1 4.06Å; Y775-Y778 AromaticContact CE2-CD1 3.76Å; Y775-Y778 HydrophobicContact CE2-CD1 3.76Å; Y775-Y778 AromaticContact CE2-CE1 3.98Å; Y775-Y778 HydrophobicContact CE2-CE1 3.98Å; Y775-Y778 WeakPolarHBondContact O-CB 3.45Å; Y775-Y778 PolarHBondContact O-N 3.15Å; Y775-L779 HydrophobicContact CD1-CD1 3.73Å; Y775-L779 HydrophobicContact CD1-CG 4.09Å; Y775-L779 HydrophobicContact CE1-CD1 3.57Å; Y775-L779 HydrophobicContact CE1-CD2 4.03Å; Y775-L779 HydrophobicContact CE1-CG 3.82Å; Y775-L779 VanDerWaalsContact O-CG 3.27Å; Y775-L779 WeakPolarHBondContact O-CG 3.39Å; Y775-L779 PolarHBondContact O-N 2.86Å
776	I	96.7	Very high	95.2	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-65.8	-38.1	172.1	-73.7	176.4	0	0	0	110.6	L714 V718 V740 W743 Y772 D773 L779 V780	L714-I776 HydrophobicContact CD2-CD1 4.06Å; L714-I776 HydrophobicContact CD2-CG1 4.23Å; V718-I776 HydrophobicContact CG2-CG1 4.21Å; V718-I776 HydrophobicContact CG2-CG2 4.07Å; V740-I776 HydrophobicContact CG2-CG2 4.43Å; W743-I776 HydrophobicContact CD2-CD1 3.29Å; W743-I776 HydrophobicContact CE3-CD1 3.66Å; W743-I776 HydrophobicContact CG-CD1 3.65Å; W743-I776 HydrophobicContact CH2-CD1 4.17Å; W743-I776 HydrophobicContact CZ2-CD1 3.86Å; W743-I776 HydrophobicContact CZ3-CD1 4.07Å; Y772-I776 VanDerWaalsContact O-CB 3.26Å; Y772-I776 WeakPolarHBondContact O-CB 3.31Å; Y772-I776 VanDerWaalsContact O-CG1 3.3Å; Y772-I776 WeakPolarHBondContact O-CG1 3.13Å; Y772-I776 PolarHBondContact O-N 2.89Å; D773-I776 PolarHBondContact O-N 3.47Å; I776-L779 PolarHBondContact O-N 3.09Å; I776-V780 HydrophobicContact CG2-CG2 4.27Å; I776-V780 WeakPolarHBondContact O-CB 3.42Å; I776-V780 WeakPolarHBondContact O-CG2 3.16Å; I776-V780 PolarHBondContact O-N 3Å
777	F	94.6	Very high	95	Very high	75 Å²	75	28.6 Å²	28.6	33%	0.329	15%	0.147	S	C	.	.	H	α-helix	trans	-63.9	-43.4	176.1	-176.4	-147.9	0	0	0	111.4	R639 D773 Y775 V780 E781 M796	R639-F777 VanDerWaalsContact NH2-CE1 3.34Å; D773-F777 WeakPolarHBondContact O-CB 3.19Å; D773-F777 PolarHBondContact O-N 2.67Å; Y775-F777 VanDerWaalsContact C-N 3.32Å; F777-V780 PolarHBondContact O-N 3.06Å; F777-E781 VanDerWaalsContact O-CB 3.28Å; F777-E781 WeakPolarHBondContact O-CB 3.13Å; F777-E781 PolarHBondContact O-N 3.46Å; F777-M796 HydrophobicContact CZ-SD 4.32Å
778	Y	95.6	Very high	94.7	Very high	44 Å²	44	28.6 Å²	28.6	17%	0.173	15%	0.147	C	C	.	.	H	α-helix	trans	-56.6	-46.5	170.2	167.9	-90.8	0	0	0	112.6	V588 Y640 L643 E774 Y775 E781 H782	V588-Y778 HydrophobicContact CG1-CD2 4.25Å; V588-Y778 HydrophobicContact CG1-CE2 3.69Å; V588-Y778 HydrophobicContact CG2-CD1 4.44Å; V588-Y778 HydrophobicContact CG2-CD2 4.48Å; V588-Y778 HydrophobicContact CG2-CE1 4.05Å; V588-Y778 HydrophobicContact CG2-CE2 4.08Å; Y640-Y778 HydrophobicContact CD1-CD2 4.22Å; Y640-Y778 AromaticContact CE1-CD2 3.75Å; Y640-Y778 HydrophobicContact CE1-CD2 3.75Å; Y640-Y778 HydrophobicContact CE1-CE2 4.07Å; Y640-Y778 HydrophobicContact CE2-CE2 4.26Å; Y640-Y778 AromaticContact CZ-CE2 3.95Å; L643-Y778 HydrophobicContact CD2-CD2 4.14Å; L643-Y778 HydrophobicContact CD2-CG 4.01Å; E774-Y778 VanDerWaalsContact O-CB 3.31Å; E774-Y778 WeakPolarHBondContact O-CB 3.47Å; E774-Y778 PolarHBondContact O-N 3.37Å; Y775-Y778 HydrophobicContact CD2-CD1 4.06Å; Y775-Y778 AromaticContact CE2-CD1 3.76Å; Y775-Y778 HydrophobicContact CE2-CD1 3.76Å; Y775-Y778 AromaticContact CE2-CE1 3.98Å; Y775-Y778 HydrophobicContact CE2-CE1 3.98Å; Y775-Y778 WeakPolarHBondContact O-CB 3.45Å; Y775-Y778 PolarHBondContact O-N 3.15Å; Y778-E781 PolarHBondContact O-N 2.74Å; Y778-H782 AromaticContact CD2-CE1 3.48Å; Y778-H782 VanDerWaalsContact CD2-CE1 3.48Å; Y778-H782 WeakPolarHBondContact CD2-CE1 3.23Å; Y778-H782 AromaticContact CD2-ND1 3.84Å; Y778-H782 AromaticContact CE2-CE1 3.09Å; Y778-H782 WeakPolarHBondContact CE2-CE1 3.14Å; Y778-H782 AromaticContact CE2-ND1 3.75Å; Y778-H782 AromaticContact CE2-NE2 3.7Å; Y778-H782 AromaticContact CZ-CE1 3.54Å; Y778-H782 AromaticContact CZ-ND1 3.96Å; Y778-H782 AromaticContact CZ-NE2 3.84Å; Y778-H782 PolarHBondContact O-N 2.87Å; Y778-H782 VanDerWaalsContact O-N 3.11Å; Y778-H782 PolarHBondContact O-ND1 2.99Å
779	L	96.6	Very high	94.4	Very high	11 Å²	11	31.2 Å²	31.2	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-42.2	177.4	-71.6	171.5	0	0	0	112.5	L714 D715 V718 Y775 I776 H782 K783	L714-L779 HydrophobicContact CB-CD1 3.96Å; D715-L779 HydrophobicContact CB-CD1 4.24Å; D715-L779 HydrophobicContact CB-CD2 4.01Å; D715-L779 WeakPolarHBondContact OD1-CD2 3.23Å; V718-L779 HydrophobicContact CG1-CB 4.49Å; V718-L779 HydrophobicContact CG2-CB 4.33Å; V718-L779 HydrophobicContact CG2-CD1 4.12Å; Y775-L779 HydrophobicContact CD1-CD1 3.73Å; Y775-L779 HydrophobicContact CD1-CG 4.09Å; Y775-L779 HydrophobicContact CE1-CD1 3.57Å; Y775-L779 HydrophobicContact CE1-CD2 4.03Å; Y775-L779 HydrophobicContact CE1-CG 3.82Å; Y775-L779 VanDerWaalsContact O-CG 3.27Å; Y775-L779 WeakPolarHBondContact O-CG 3.39Å; Y775-L779 PolarHBondContact O-N 2.86Å; I776-L779 PolarHBondContact O-N 3.09Å; L779-H782 PolarHBondContact O-N 3.45Å; L779-K783 WeakPolarHBondContact O-CB 3.5Å; L779-K783 VanDerWaalsContact O-CG 3.32Å; L779-K783 WeakPolarHBondContact O-CG 3.35Å; L779-K783 PolarHBondContact O-N 3.12Å
780	V	94.9	Very high	94.2	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-45.7	177.2	155.4	0	0	0	0	111	V718 A736 L739 V740 I776 F777 H782 K783 V784	V718-V780 HydrophobicContact CG1-CG2 3.94Å; A736-V780 HydrophobicContact CB-CG1 3.91Å; L739-V780 HydrophobicContact CD2-CG2 4.4Å; V740-V780 HydrophobicContact CG2-CB 4.22Å; V740-V780 HydrophobicContact CG2-CG1 4.1Å; V740-V780 HydrophobicContact CG2-CG2 3.99Å; I776-V780 HydrophobicContact CG2-CG2 4.27Å; I776-V780 WeakPolarHBondContact O-CB 3.42Å; I776-V780 WeakPolarHBondContact O-CG2 3.16Å; I776-V780 PolarHBondContact O-N 3Å; F777-V780 PolarHBondContact O-N 3.06Å; V780-H782 PolarHBondContact O-N 3.18Å; V780-K783 PolarHBondContact O-N 2.95Å; V780-V784 HydrophobicContact CG1-CG2 4.38Å; V780-V784 WeakPolarHBondContact O-CB 3.2Å; V780-V784 VanDerWaalsContact O-CG2 3.32Å; V780-V784 WeakPolarHBondContact O-CG2 3.22Å; V780-V784 PolarHBondContact O-N 3.15Å
781	E	93.3	Very high	94.1	Very high	5 Å²	5	30.8 Å²	30.8	2%	0.023	18%	0.175	C	C	.	.	H	α-helix	trans	-55.1	-50.1	174.9	174.9	-170.1	139.2	0	0	111.6	R639 Y640 F777 Y778 K783 V784 A785 P792 M796	R639-E781 IonicContact CZ-OE2 3.81Å; R639-E781 IonicContact NH1-OE1 2.86Å; R639-E781 IonicContact NH1-OE2 3.88Å; R639-E781 PolarHBondContact NH1-OE2 3.05Å; R639-E781 IonicContact NH2-OE2 2.99Å; R639-E781 PolarHBondContact NH2-OE2 3.35Å; Y640-E781 PolarHBondContact OH-OE1 3.02Å; F777-E781 VanDerWaalsContact O-CB 3.28Å; F777-E781 WeakPolarHBondContact O-CB 3.13Å; F777-E781 PolarHBondContact O-N 3.46Å; Y778-E781 PolarHBondContact O-N 2.74Å; E781-K783 PolarHBondContact O-N 3.18Å; E781-V784 PolarHBondContact O-N 3.14Å; E781-A785 VanDerWaalsContact O-CB 3.23Å; E781-A785 WeakPolarHBondContact O-CB 3.45Å; E781-A785 PolarHBondContact O-N 3.45Å; E781-P792 HydrophobicContact CG-CB 4Å; E781-P792 WeakPolarHBondContact OE1-CB 3.41Å; E781-M796 HydrophobicContact CG-CG 4.39Å
782	H	94.2	Very high	93.9	Very high	49 Å²	49	31.3 Å²	31.3	23%	0.227	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-38.6	179.5	-74.3	68.1	0	0	0	112.8	Y640 Y778 L779 V780 A786	Y640-H782 AromaticContact CZ-CE1 3.98Å; Y640-H782 PolarHBondContact OH-CE1 2.92Å; Y640-H782 VanDerWaalsContact OH-CE1 3.24Å; Y778-H782 AromaticContact CD2-CE1 3.48Å; Y778-H782 VanDerWaalsContact CD2-CE1 3.48Å; Y778-H782 WeakPolarHBondContact CD2-CE1 3.23Å; Y778-H782 AromaticContact CD2-ND1 3.84Å; Y778-H782 AromaticContact CE2-CE1 3.09Å; Y778-H782 WeakPolarHBondContact CE2-CE1 3.14Å; Y778-H782 AromaticContact CE2-ND1 3.75Å; Y778-H782 AromaticContact CE2-NE2 3.7Å; Y778-H782 AromaticContact CZ-CE1 3.54Å; Y778-H782 AromaticContact CZ-ND1 3.96Å; Y778-H782 AromaticContact CZ-NE2 3.84Å; Y778-H782 PolarHBondContact O-N 2.87Å; Y778-H782 VanDerWaalsContact O-N 3.11Å; Y778-H782 PolarHBondContact O-ND1 2.99Å; L779-H782 PolarHBondContact O-N 3.45Å; V780-H782 PolarHBondContact O-N 3.18Å; H782-A786 VanDerWaalsContact O-CB 3.3Å; H782-A786 WeakPolarHBondContact O-CB 3.42Å; H782-A786 PolarHBondContact O-N 3.05Å
783	K	94.5	Very high	93.8	Very high	38 Å²	38	31 Å²	31	17%	0.165	18%	0.177	C	C	.	.	H	α-helix	trans	-72.1	-39	178.4	-73	177.8	-161.3	-67.1	0	112.4	D715 V718 T719 L722 L779 V780 E781 H787	D715-K783 WeakPolarHBondContact OD1-CE 3.2Å; D715-K783 IonicContact OD1-NZ 3.62Å; D715-K783 PolarHBondContact OD1-NZ 2.96Å; D715-K783 IonicContact OD2-NZ 3.54Å; V718-K783 HydrophobicContact CB-CD 4.47Å; V718-K783 HydrophobicContact CG1-CD 3.66Å; T719-K783 WeakPolarHBondContact OG1-CE 3.44Å; T719-K783 PolarHBondContact OG1-NZ 3.29Å; L722-K783 HydrophobicContact CD1-CD 4.44Å; L779-K783 WeakPolarHBondContact O-CB 3.5Å; L779-K783 VanDerWaalsContact O-CG 3.32Å; L779-K783 WeakPolarHBondContact O-CG 3.35Å; L779-K783 PolarHBondContact O-N 3.12Å; V780-K783 PolarHBondContact O-N 2.95Å; E781-K783 PolarHBondContact O-N 3.18Å; K783-H787 WeakPolarHBondContact O-CB 3.35Å; K783-H787 PolarHBondContact O-N 3.24Å
784	V	93.4	Very high	93.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-44.6	172.4	169.9	0	0	0	0	110.6	Y732 T733 A736 V780 E781 H787 L788 V795 M799	Y732-V784 HydrophobicContact CE1-CG2 4.41Å; T733-V784 HydrophobicContact CG2-CG1 4.16Å; A736-V784 HydrophobicContact CB-CG2 3.63Å; V780-V784 HydrophobicContact CG1-CG2 4.38Å; V780-V784 WeakPolarHBondContact O-CB 3.2Å; V780-V784 VanDerWaalsContact O-CG2 3.32Å; V780-V784 WeakPolarHBondContact O-CG2 3.22Å; V780-V784 PolarHBondContact O-N 3.15Å; E781-V784 PolarHBondContact O-N 3.14Å; V784-H787 PolarHBondContact O-N 2.89Å; V784-L788 HydrophobicContact CG1-CD1 3.62Å; V784-L788 HydrophobicContact CG1-CG 4.3Å; V784-L788 WeakPolarHBondContact O-CB 3.45Å; V784-L788 VanDerWaalsContact O-CG 3.29Å; V784-L788 WeakPolarHBondContact O-CG 3.48Å; V784-L788 PolarHBondContact O-N 3.5Å; V784-V795 HydrophobicContact CG1-CG1 4.22Å; V784-V795 HydrophobicContact CG1-CG2 4.48Å; V784-M799 HydrophobicContact CG1-SD 4.03Å
785	A	93.3	Very high	93.3	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-57.4	-52.7	175.6	0	0	0	0	0	111.8	E781 H787 L788 G789 M790 P792 V795	E781-A785 VanDerWaalsContact O-CB 3.23Å; E781-A785 WeakPolarHBondContact O-CB 3.45Å; E781-A785 PolarHBondContact O-N 3.45Å; A785-H787 VanDerWaalsContact C-N 3.29Å; A785-H787 PolarHBondContact O-N 3.41Å; A785-L788 PolarHBondContact O-N 3.09Å; A785-G789 PolarHBondContact O-N 3.37Å; A785-M790 CarbonylContact C-O 3.45Å; A785-M790 WeakPolarHBondContact CB-O 3.42Å; A785-M790 PolarHBondContact O-N 3.04Å; A785-P792 HydrophobicContact CB-CG 4.08Å; A785-V795 HydrophobicContact CB-CG2 3.74Å
786	A	92.9	Very high	92.5	Very high	83 Å²	83	28.3 Å²	28.3	69%	0.686	17%	0.166	S	C	*	.	H	α-helix	trans	-61.7	-33.5	177.1	0	0	0	0	0	113.3	H782	H782-A786 VanDerWaalsContact O-CB 3.3Å; H782-A786 WeakPolarHBondContact O-CB 3.42Å; H782-A786 PolarHBondContact O-N 3.05Å
787	H	91.4	Very high	91.6	Very high	42 Å²	42	28.2 Å²	28.2	19%	0.194	17%	0.166	C	C	.	.	H	α-helix	trans	-73.1	-32.9	177.2	-172.1	76.4	0	0	0	113.2	S729 Y732 K783 V784 A785	S729-H787 VanDerWaalsContact CA-NE2 3.32Å; S729-H787 WeakPolarHBondContact CA-NE2 3.38Å; S729-H787 PolarHBondContact OG-CD2 2.87Å; S729-H787 PolarHBondContact OG-NE2 3.11Å; Y732-H787 HydrophobicContact CD1-CB 3.8Å; Y732-H787 AromaticContact CD1-CD2 3.75Å; Y732-H787 AromaticContact CD1-CG 3.56Å; Y732-H787 AromaticContact CD2-ND1 3.87Å; Y732-H787 HydrophobicContact CE1-CB 3.5Å; Y732-H787 AromaticContact CE1-CG 3.7Å; Y732-H787 AromaticContact CE2-ND1 3.92Å; Y732-H787 HydrophobicContact CG-CB 4.48Å; Y732-H787 AromaticContact CG-CD2 3.81Å; Y732-H787 AromaticContact CG-CG 3.79Å; Y732-H787 AromaticContact CG-ND1 3.98Å; K783-H787 WeakPolarHBondContact O-CB 3.35Å; K783-H787 PolarHBondContact O-N 3.24Å; V784-H787 PolarHBondContact O-N 2.89Å; A785-H787 VanDerWaalsContact C-N 3.29Å; A785-H787 PolarHBondContact O-N 3.41Å
788	L	90	Very high	90.8	Very high	38 Å²	38	26.8 Å²	26.8	20%	0.199	16%	0.16	C	C	.	.	H	α-helix	trans	-90.6	-6.5	179.9	-63.1	174.9	0	0	0	113.8	V784 A785 M790 M799	V784-L788 HydrophobicContact CG1-CD1 3.62Å; V784-L788 HydrophobicContact CG1-CG 4.3Å; V784-L788 WeakPolarHBondContact O-CB 3.45Å; V784-L788 VanDerWaalsContact O-CG 3.29Å; V784-L788 WeakPolarHBondContact O-CG 3.48Å; V784-L788 PolarHBondContact O-N 3.5Å; A785-L788 PolarHBondContact O-N 3.09Å; L788-M790 VanDerWaalsContact C-N 3.32Å; L788-M790 HydrophobicContact CB-CB 4.45Å; L788-M790 HydrophobicContact CB-CG 3.92Å; L788-M790 HydrophobicContact CB-SD 3.89Å; L788-M790 HydrophobicContact CD1-SD 4.01Å; L788-M799 HydrophobicContact CD1-CE 3.61Å; L788-M799 HydrophobicContact CD1-SD 4.19Å
789	G	88.7	Confident	89.5	Confident	59 Å²	59	26.8 Å²	26.8	61%	0.608	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	24.8	-173.3	0	0	0	0	0	113.5	A785	A785-G789 PolarHBondContact O-N 3.37Å
790	M	90.7	Very high	87.5	Confident	43 Å²	43	29.5 Å²	29.5	21%	0.212	19%	0.192	C	C	.	.			trans	-109.3	167.8	-177.6	-62.1	177.3	73.1	0	0	110.8	A785 L788 A794 V795 E798	A785-M790 CarbonylContact C-O 3.45Å; A785-M790 WeakPolarHBondContact CB-O 3.42Å; A785-M790 PolarHBondContact O-N 3.04Å; L788-M790 VanDerWaalsContact C-N 3.32Å; L788-M790 HydrophobicContact CB-CB 4.45Å; L788-M790 HydrophobicContact CB-CG 3.92Å; L788-M790 HydrophobicContact CB-SD 3.89Å; L788-M790 HydrophobicContact CD1-SD 4.01Å; M790-A794 HydrophobicContact CB-CB 4.28Å; M790-A794 HydrophobicContact CE-CB 3.87Å; M790-V795 HydrophobicContact CB-CG2 4.08Å; M790-V795 HydrophobicContact SD-CG2 4.35Å; M790-E798 WeakPolarHBondContact CE-OE2 3.46Å
791	T	93.1	Very high	85.4	Confident	27 Å²	27	35.4 Å²	35.4	17%	0.166	21%	0.214	C	C	.	.			trans	-86.8	153.3	166	61	0	0	0	0	111.5	H574 Q578 V793 A794 V795	H574-T791 WeakPolarHBondContact O-CG2 3.48Å; H574-T791 PolarHBondContact O-OG1 3.33Å; Q578-T791 HydrophobicContact CB-CG2 3.86Å; Q578-T791 HydrophobicContact CG-CG2 4.04Å; T791-V793 VanDerWaalsContact C-N 3.26Å; T791-V793 PolarHBondContact O-N 3.25Å; T791-A794 WeakPolarHBondContact O-CA 3.47Å; T791-A794 WeakPolarHBondContact O-CB 3.45Å; T791-A794 PolarHBondContact O-N 2.94Å; T791-A794 WeakPolarHBondContact OG1-CB 3.49Å; T791-A794 PolarHBondContact OG1-N 3.19Å; T791-A794 VanDerWaalsContact OG1-N 3.15Å; T791-V795 PolarHBondContact O-N 3.2Å
792	P	93.2	Very high	82.9	Confident	12 Å²	12	38.6 Å²	38.6	8%	0.078	23%	0.232	C	C	.	.	H	α-helix	trans	-48.8	-44.9	169.1	-29.6	33.5	0	0	0	113.3	Q578 E781 A785 A794 V795 M796	Q578-P792 VanDerWaalsContact OE1-CD 3.28Å; E781-P792 HydrophobicContact CG-CB 4Å; E781-P792 WeakPolarHBondContact OE1-CB 3.41Å; A785-P792 HydrophobicContact CB-CG 4.08Å; P792-A794 VanDerWaalsContact C-N 3.35Å; P792-A794 PolarHBondContact O-N 3.39Å; P792-V795 PolarHBondContact O-N 3.07Å; P792-M796 PolarHBondContact O-N 3.29Å
793	V	93.4	Very high	80.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-41.1	172.6	168.8	0	0	0	0	112.5	Q578 A632 T636 T791 M796 G797	Q578-V793 HydrophobicContact CB-CG2 4.43Å; A632-V793 HydrophobicContact CB-CG1 4Å; T636-V793 HydrophobicContact CG2-CG2 4.12Å; T791-V793 VanDerWaalsContact C-N 3.26Å; T791-V793 PolarHBondContact O-N 3.25Å; V793-M796 PolarHBondContact O-N 3.03Å; V793-G797 PolarHBondContact O-N 3.19Å
794	A	92	Very high	77.4	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-40.6	175.9	0	0	0	0	0	112.8	H574 M790 T791 P792 M796 G797 E798	H574-A794 HydrophobicContact CB-CB 3.97Å; H574-A794 WeakPolarHBondContact ND1-CB 3.32Å; M790-A794 HydrophobicContact CB-CB 4.28Å; M790-A794 HydrophobicContact CE-CB 3.87Å; T791-A794 WeakPolarHBondContact O-CA 3.47Å; T791-A794 WeakPolarHBondContact O-CB 3.45Å; T791-A794 PolarHBondContact O-N 2.94Å; T791-A794 WeakPolarHBondContact OG1-CB 3.49Å; T791-A794 PolarHBondContact OG1-N 3.19Å; T791-A794 VanDerWaalsContact OG1-N 3.15Å; P792-A794 VanDerWaalsContact C-N 3.35Å; P792-A794 PolarHBondContact O-N 3.39Å; A794-M796 VanDerWaalsContact C-N 3.35Å; A794-G797 PolarHBondContact O-N 2.96Å; A794-E798 PolarHBondContact O-N 3.41Å
795	V	88.8	Confident	74.5	Confident	13 Å²	13	50.7 Å²	50.7	8%	0.079	30%	0.299	C	S	.	.	I	π-helix	trans	-62.6	-43.4	175.3	174.9	0	0	0	0	110.5	V784 A785 M790 T791 P792 G797 M799 G800	V784-V795 HydrophobicContact CG1-CG1 4.22Å; V784-V795 HydrophobicContact CG1-CG2 4.48Å; A785-V795 HydrophobicContact CB-CG2 3.74Å; M790-V795 HydrophobicContact CB-CG2 4.08Å; M790-V795 HydrophobicContact SD-CG2 4.35Å; T791-V795 PolarHBondContact O-N 3.2Å; P792-V795 PolarHBondContact O-N 3.07Å; V795-G797 VanDerWaalsContact C-N 3.32Å; V795-G797 PolarHBondContact O-N 3.41Å; V795-M799 HydrophobicContact CG1-CB 4.06Å; V795-M799 HydrophobicContact CG1-SD 4.36Å; V795-M799 WeakPolarHBondContact O-CA 3.39Å; V795-M799 VanDerWaalsContact O-CB 3.26Å; V795-M799 WeakPolarHBondContact O-CB 3.45Å; V795-M799 PolarHBondContact O-N 3.2Å; V795-G800 PolarHBondContact O-N 3.49Å
796	M	80.2	Confident	71.6	Confident	45 Å²	45	56.1 Å²	56.1	22%	0.222	32%	0.324	C	S	.	.	I	π-helix	trans	-63.5	-35.6	173.1	-75.3	-60.8	-56.5	0	0	113	Q635 R639 F777 E781 P792 V793 A794	Q635-M796 HydrophobicContact CG-CE 4.11Å; R639-M796 PolarHBondContact NH1-SD 3.4Å; R639-M796 VanDerWaalsContact NH1-SD 3.39Å; F777-M796 HydrophobicContact CZ-SD 4.32Å; E781-M796 HydrophobicContact CG-CG 4.39Å; P792-M796 PolarHBondContact O-N 3.29Å; V793-M796 PolarHBondContact O-N 3.03Å; A794-M796 VanDerWaalsContact C-N 3.35Å
797	G	78.9	Confident	68.9	Low	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	I	π-helix	trans	-70.1	-55	178	0	0	0	0	0	113.3	V793 A794 V795 R801	V793-G797 PolarHBondContact O-N 3.19Å; A794-G797 PolarHBondContact O-N 2.96Å; V795-G797 VanDerWaalsContact C-N 3.32Å; V795-G797 PolarHBondContact O-N 3.41Å; G797-R801 VanDerWaalsContact O-CZ 3.22Å; G797-R801 PolarHBondContact O-NE 3.39Å; G797-R801 PolarHBondContact O-NH2 3.06Å
798	E	78.6	Confident	65.9	Low	45 Å²	45	59.7 Å²	59.7	21%	0.21	34%	0.336	C	S	.	.	I	π-helix	trans	-95.3	-52.8	-167.7	-57.4	-177.5	155.1	0	0	111.7	R570 H574 M790 A794 G800 R801 D802	R570-E798 WeakPolarHBondContact CD-OE1 3.41Å; R570-E798 IonicContact CZ-OE1 2.83Å; R570-E798 IonicContact NE-OE1 2.67Å; R570-E798 IonicContact NH1-OE1 3.23Å; R570-E798 PolarHBondContact NH1-OE1 3.42Å; H574-E798 IonicContact CE1-OE1 3.87Å; H574-E798 PolarHBondContact CE1-OE1 2.9Å; H574-E798 IonicContact ND1-OE1 3.91Å; M790-E798 WeakPolarHBondContact CE-OE2 3.46Å; A794-E798 PolarHBondContact O-N 3.41Å; E798-G800 VanDerWaalsContact C-N 3.26Å; E798-G800 PolarHBondContact O-N 3.37Å; E798-R801 PolarHBondContact O-N 2.83Å; E798-D802 PolarHBondContact O-N 3.48Å
799	M	67.2	Low	63.2	Low	44 Å²	44	61.4 Å²	61.4	22%	0.217	35%	0.348	C	S	.	.	I	π-helix	trans	-70.2	-24.8	-172.6	-166.8	162.5	-90.7	0	0	112.8	T733 V784 L788 V795 R801 I803	T733-M799 HydrophobicContact CG2-CE 4.05Å; T733-M799 HydrophobicContact CG2-SD 3.59Å; T733-M799 VanDerWaalsContact CG2-SD 3.59Å; V784-M799 HydrophobicContact CG1-SD 4.03Å; L788-M799 HydrophobicContact CD1-CE 3.61Å; L788-M799 HydrophobicContact CD1-SD 4.19Å; V795-M799 HydrophobicContact CG1-CB 4.06Å; V795-M799 HydrophobicContact CG1-SD 4.36Å; V795-M799 WeakPolarHBondContact O-CA 3.39Å; V795-M799 VanDerWaalsContact O-CB 3.26Å; V795-M799 WeakPolarHBondContact O-CB 3.45Å; V795-M799 PolarHBondContact O-N 3.2Å; M799-R801 PolarHBondContact O-N 2.84Å; M799-I803 HydrophobicContact CE-CD1 4.21Å; M799-I803 HydrophobicContact CG-CD1 3.31Å; M799-I803 HydrophobicContact CG-CG1 3.99Å; M799-I803 HydrophobicContact SD-CD1 3.9Å
800	G	55.6	Low	60.6	Low	67 Å²	67	63.2 Å²	63.2	69%	0.691	34%	0.341	S	S	*	.	H	α-helix	trans	-68.9	-11.7	170.9	0	0	0	0	0	115.4	V795 E798	V795-G800 PolarHBondContact O-N 3.49Å; E798-G800 VanDerWaalsContact C-N 3.26Å; E798-G800 PolarHBondContact O-N 3.37Å
801	R	49.3	Very low	57.9	Low	127 Å²	127	66.4 Å²	66.4	48%	0.479	36%	0.359	S	S	.	.	H	α-helix	trans	-111.8	-49	-179.7	-84.6	175.1	-84.4	-160.9	-8.5	113.7	S628 G797 E798 M799	S628-R801 PolarHBondContact O-NH2 3.47Å; S628-R801 PolarHBondContact OG-NH2 3.22Å; G797-R801 VanDerWaalsContact O-CZ 3.22Å; G797-R801 PolarHBondContact O-NE 3.39Å; G797-R801 PolarHBondContact O-NH2 3.06Å; E798-R801 PolarHBondContact O-N 2.83Å; M799-R801 PolarHBondContact O-N 2.84Å
802	D	41.2	Very low	55	Low	73 Å²	73	75 Å²	75	39%	0.39	39%	0.388	S	S	.	.	H	α-helix	trans	-83.9	-18.7	-165.3	-76.9	-63.9	0	0	0	116.4	E798 T804 Q805 Q806	E798-D802 PolarHBondContact O-N 3.48Å; D802-T804 PolarHBondContact O-N 2.83Å; D802-T804 VanDerWaalsContact O-N 3.15Å; D802-Q805 PolarHBondContact O-N 2.87Å; D802-Q805 VanDerWaalsContact O-N 3.08Å; D802-Q806 PolarHBondContact O-N 3.1Å; D802-Q806 PolarHBondContact OD1-NE2 3.16Å
803	I	40.5	Very low	52.2	Low	72 Å²	72	81.2 Å²	81.2	37%	0.369	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.9	-173.5	-83.8	-173.8	0	0	0	113.8	M799	M799-I803 HydrophobicContact CE-CD1 4.21Å; M799-I803 HydrophobicContact CG-CD1 3.31Å; M799-I803 HydrophobicContact CG-CG1 3.99Å; M799-I803 HydrophobicContact SD-CD1 3.9Å
804	T	32.4	Very low	49.3	Very low	120 Å²	120	89.1 Å²	89.1	74%	0.736	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.6	177.9	55.1	0	0	0	0	113.9	D802	D802-T804 PolarHBondContact O-N 2.83Å; D802-T804 VanDerWaalsContact O-N 3.15Å
805	Q	32.9	Very low	46.6	Very low	149 Å²	149	96 Å²	96	70%	0.696	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	-47.7	-172.4	-58.5	-161.1	35.5	0	0	114.9	D802	D802-Q805 PolarHBondContact O-N 2.87Å; D802-Q805 VanDerWaalsContact O-N 3.08Å
806	Q	32.4	Very low	43.9	Very low	115 Å²	115	103 Å²	103	54%	0.537	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-44.5	-164.7	-57.9	-155.1	37.8	0	0	114.7	D802 C808 T809	D802-Q806 PolarHBondContact O-N 3.1Å; D802-Q806 PolarHBondContact OD1-NE2 3.16Å; Q806-C808 PolarHBondContact O-N 2.97Å; Q806-T809 PolarHBondContact O-N 3.16Å; Q806-T809 PolarHBondContact O-OG1 3.18Å
807	H	35.8	Very low	41.6	Very low	102 Å²	102	107.3 Å²	107.3	47%	0.472	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-8.7	-174.7	-98.3	-48.9	0	0	0	115.6
808	C	28.5	Very low	39.4	Very low	98 Å²	98	118.6 Å²	118.6	66%	0.662	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-17.1	175.8	-154.5	0	0	0	0	113.3	Q806	Q806-C808 PolarHBondContact O-N 2.97Å
809	T	33.8	Very low	37.3	Very low	75 Å²	75	123.3 Å²	123.3	46%	0.46	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.3	-42.2	-178	61.3	0	0	0	0	112.5	Q806 N811 R812 L813	Q806-T809 PolarHBondContact O-N 3.16Å; Q806-T809 PolarHBondContact O-OG1 3.18Å; T809-N811 VanDerWaalsContact C-N 3.34Å; T809-N811 PolarHBondContact O-N 3.38Å; T809-R812 PolarHBondContact O-N 2.97Å; T809-L813 PolarHBondContact O-N 3.05Å
810	Q	35.1	Very low	35.8	Very low	96 Å²	96	127.2 Å²	127.2	45%	0.449	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-59.7	-39.9	-179	-72.3	167.5	-43.3	0	0	112.8	R812	Q810-R812 VanDerWaalsContact C-N 3.26Å; Q810-R812 PolarHBondContact O-N 3.29Å
811	N	32.7	Very low	34.8	Very low	111 Å²	111	129.8 Å²	129.8	59%	0.594	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-73.8	-13.6	175.1	-77.5	-70.8	0	0	0	113.9	T809	T809-N811 VanDerWaalsContact C-N 3.34Å; T809-N811 PolarHBondContact O-N 3.38Å
812	R	32.5	Very low	34	Very low	207 Å²	207	127.5 Å²	127.5	78%	0.781	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-95.6	-11.5	-178.8	-155.9	173.3	-172.6	-170.7	2.3	113.7	T809 Q810	T809-R812 PolarHBondContact O-N 2.97Å; Q810-R812 VanDerWaalsContact C-N 3.26Å; Q810-R812 PolarHBondContact O-N 3.29Å
813	L	34.6	Very low	33.5	Very low	142 Å²	142	133.4 Å²	133.4	74%	0.743	69%	0.691	S	S	*	*	S	Bend	trans	-101.3	-1.7	-179.5	-66.5	173.3	0	0	0	114	T809	T809-L813 PolarHBondContact O-N 3.05Å
814	H	32.6	Very low	33.1	Very low	167 Å²	167	135.6 Å²	135.6	77%	0.773	71%	0.712	S	S	*	*	S	Bend	trans	-108	8.8	-174.2	-150.7	-70.5	0	0	0	115
815	L	34.2	Very low	33.3	Very low	149 Å²	149	134.1 Å²	134.1	78%	0.78	71%	0.707	S	S	*	*	S	Bend	trans	-108.9	-25.6	177	-104.4	71.1	0	0	0	115	N817	L815-N817 PolarHBondContact O-N 2.96Å
816	D	33.1	Very low	33.3	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	72%	0.715	S	S	*	*	S	Bend	trans	-90.2	9.1	-172.9	-84.4	-38.6	0	0	0	115.3
817	N	32.8	Very low	33.3	Very low	135 Å²	135	136.4 Å²	136.4	72%	0.722	73%	0.727	S	S	*	*			trans	-124.1	41.5	-173.7	-148	-3.7	0	0	0	114.8	L815 N819	L815-N817 PolarHBondContact O-N 2.96Å; N817-N819 PolarHBondContact O-N 3.25Å
818	R	32.7	Very low	33.3	Very low	236 Å²	236	137.8 Å²	137.8	89%	0.891	74%	0.737	S	S	*	*			trans	-80.3	90.8	165.3	-79.8	-171.2	173.6	-178.8	-0.3	110.3	V820	R818-V820 PolarHBondContact O-N 3.31Å
819	N	33.2	Very low	33.6	Very low	144 Å²	144	140.5 Å²	140.5	77%	0.77	74%	0.739	S	S	*	*			trans	-57.1	121.5	-175.9	-134.3	-32.2	0	0	0	112.9	N817	N817-N819 PolarHBondContact O-N 3.25Å
820	V	35.1	Very low	33.7	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	75%	0.747	S	S	*	*			trans	-96.1	120.9	173.2	178	0	0	0	0	108.7	R818 G822	R818-V820 PolarHBondContact O-N 3.31Å; V820-G822 PolarHBondContact O-N 2.96Å
821	P	36	Very low	33.8	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	76%	0.758	S	S	*	*			trans	-73.5	111.7	-171.7	27.9	-34.3	0	0	0	112.5
822	G	31.6	Very low	34	Very low	78 Å²	78	144.6 Å²	144.6	80%	0.804	76%	0.762	S	S	*	*			trans	-72.4	159.1	180	0	0	0	0	0	114.9	V820	V820-G822 PolarHBondContact O-N 2.96Å
823	K	32	Very low	34.3	Very low	198 Å²	198	140.2 Å²	140.2	86%	0.861	75%	0.754	S	S	*	*			trans	-129.5	122.2	176.8	-79.2	-177.2	176.1	175.4	0	113
824	S	32.2	Very low	34.4	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	75%	0.75	S	S	*	*			trans	71.8	154.2	157.2	101.3	0	0	0	0	115.9
825	S	35.3	Very low	34.5	Very low	90 Å²	90	136.7 Å²	136.7	63%	0.629	75%	0.746	S	S	*	*			cis	-155.2	129.4	10	-86.2	0	0	0	0	114
826	K	32.8	Very low	34.6	Very low	199 Å²	199	135 Å²	135	87%	0.865	74%	0.742	S	S	*	*			trans	63.3	164	136.1	-60.9	179.2	178.4	177.3	0	121.9
827	S	33.6	Very low	34.6	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	74%	0.737	S	S	*	*			trans	80.4	132.5	173.1	-99.3	0	0	0	0	117.9
828	I	34.1	Very low	34.7	Very low	132 Å²	132	134.7 Å²	134.7	68%	0.677	74%	0.738	S	S	*	*			cis	-160.4	145.9	-10.4	-131.9	179.5	0	0	0	111.2
829	H	35.7	Very low	34.6	Very low	154 Å²	154	128.5 Å²	128.5	71%	0.713	73%	0.731	S	S	*	*			trans	62.6	151.6	163.6	-75.6	53.5	0	0	0	118.6
830	N	35.2	Very low	34.8	Very low	115 Å²	115	127.2 Å²	127.2	62%	0.615	73%	0.731	S	S	*	*			cis	-150.3	153.2	-5.6	-143.2	0.3	0	0	0	112
831	N	37.5	Very low	34.7	Very low	127 Å²	127	129.2 Å²	129.2	68%	0.679	73%	0.732	S	S	*	*			trans	15	143.4	144.9	-64.1	0.6	0	0	0	120
832	N	37.3	Very low	34.7	Very low	127 Å²	127	130.9 Å²	130.9	68%	0.679	73%	0.729	S	S	*	*			cis	-176.4	169.9	15.9	-117.1	3.1	0	0	0	109.3
833	N	38.4	Very low	34.8	Very low	114 Å²	114	132.8 Å²	132.8	61%	0.61	72%	0.721	S	S	*	*			cis	-166.1	168.4	-15.4	-151.6	0.3	0	0	0	110.3
834	N	36.4	Very low	34.9	Very low	124 Å²	124	129 Å²	129	66%	0.663	71%	0.71	S	S	*	*			trans	62.2	146	153.5	-68.4	-7.9	0	0	0	120.2
835	T	36	Very low	35	Very low	112 Å²	112	127.9 Å²	127.9	69%	0.687	70%	0.702	S	S	*	*			cis	-173.7	160.8	-5.4	29.3	0	0	0	0	107.6
836	T	34.9	Very low	34.9	Very low	114 Å²	114	130.4 Å²	130.4	70%	0.699	71%	0.708	S	S	*	*			cis	-173.7	-178.2	-27.5	-59.8	0	0	0	0	105.8
837	I	34.7	Very low	34.7	Very low	146 Å²	146	130.4 Å²	130.4	75%	0.749	70%	0.704	S	S	*	*			trans	80	130	162.9	-61.2	176.3	0	0	0	116
838	N	34.5	Very low	34.6	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	70%	0.697	S	S	*	*			cis	-159.4	162.5	-12.6	-107.7	1.6	0	0	0	111.4
839	S	30.3	Very low	34.7	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	70%	0.701	S	S	*	*			trans	-101.1	172.4	170.5	-47	0	0	0	0	112.6
840	P	37.1	Very low	34.2	Very low	117 Å²	117	130.7 Å²	130.7	76%	0.76	70%	0.701	S	S	*	*				-135.1	154.2	89.3	16	6.9	0	0	0	113.1
841	Q	32.6	Very low	34.1	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	71%	0.712	S	S	*	*			cis	88.8	144.8	47.8	-81.9	-161.6	-83.5	0	0	116.9
842	H	35.5	Very low	33.7	Very low	157 Å²	157	131 Å²	131	73%	0.727	71%	0.708	S	S	*	*			trans	94.7	137.4	179.4	-72.8	-77.3	0	0	0	115.4
843	D	34.8	Very low	33.4	Very low	118 Å²	118	131.3 Å²	131.3	63%	0.631	71%	0.709	S	S	*	*			cis	168.1	166.5	-8.3	-115.6	21.1	0	0	0	105.3
844	N	33.1	Very low	33.4	Very low	119 Å²	119	132.6 Å²	132.6	64%	0.636	72%	0.716	S	S	*	*			cis	-163.9	170	-13.3	-142.8	-39.6	0	0	0	109.4
845	S	35.2	Very low	33.1	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	72%	0.719	S	S	*	*			trans	60.9	154.3	155.5	62	0	0	0	0	120.8
846	N	33.1	Very low	33.1	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	72%	0.723	S	S	*	*			cis	-155.9	136.3	-16.2	-97.8	-13.1	0	0	0	108
847	Y	28	Very low	32.9	Very low	200 Å²	200	134.9 Å²	134.9	78%	0.784	72%	0.72	S	S	*	*				63.3	108.8	86.9	-100.9	-122.1	0	0	0	115.2
848	L	32	Very low	32.8	Very low	122 Å²	122	134 Å²	134	64%	0.639	72%	0.717	S	S	*	*				76.9	171.7	86.6	-73.8	-159.8	0	0	0	113.2
849	P	36.9	Very low	32.7	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	71%	0.713	S	S	*	*			cis	-140.1	-171.2	9.2	42.6	-21.8	0	0	0	118.1
850	F	24.9	Very low	32.8	Very low	166 Å²	166	135.2 Å²	135.2	73%	0.728	72%	0.715	S	S	*	*			trans	-56.8	155	170.9	-72.1	-122.8	0	0	0	116.8
851	V	32.7	Very low	32.6	Very low	137 Å²	137	135 Å²	135	83%	0.83	71%	0.711	S	S	*	*			trans	-141.8	146	131	-176.6	0	0	0	0	106.1
852	N	28.6	Very low	32.6	Very low	111 Å²	111	134 Å²	134	59%	0.594	71%	0.711	S	S	*	*			cis	121.7	140.3	2	-107.1	87.9	0	0	0	114.6
853	D	31.9	Very low	32.4	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	71%	0.712	S	S	*	*			trans	64.9	152.8	165.7	-45	-33.5	0	0	0	117
854	D	38	Very low	32.4	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	73%	0.726	S	S	*	*			cis	-145	-177.4	10.2	-145.7	-31	0	0	0	112.9
855	N	30.2	Very low	32.2	Very low	135 Å²	135	136 Å²	136	72%	0.722	73%	0.728	S	S	*	*			trans	-75.2	157.8	-177.9	-59.2	-96.3	0	0	0	113.3
856	D	36.5	Very low	32.1	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	73%	0.732	S	S	*	*				-171.7	172.1	95	-134.1	-37.2	0	0	0	114.5
857	N	30.3	Very low	31.9	Very low	120 Å²	120	134.1 Å²	134.1	64%	0.642	72%	0.718	S	S	*	*			trans	-88.6	152.8	-169.8	-60.1	-97.3	0	0	0	113.1
858	N	32.5	Very low	32	Very low	126 Å²	126	132.8 Å²	132.8	67%	0.674	72%	0.716	S	S	*	*				159.8	121	107.9	-84.1	-68.2	0	0	0	114.4
859	N	31.4	Very low	31.9	Very low	128 Å²	128	133.2 Å²	133.2	68%	0.684	72%	0.715	S	S	*	*				64	159.9	128.4	-51.9	-15.3	0	0	0	124.1
860	D	33.4	Very low	31.6	Very low	146 Å²	146	134 Å²	134	78%	0.781	71%	0.708	S	S	*	*			trans	65.1	110.3	164.6	-54.2	-24.4	0	0	0	118.3
861	V	32	Very low	31.8	Very low	112 Å²	112	132.7 Å²	132.7	68%	0.679	70%	0.704	S	S	*	*			cis	99.9	100.9	35.2	173.5	0	0	0	0	112.4
862	D	33.4	Very low	31.6	Very low	148 Å²	148	132.2 Å²	132.2	79%	0.791	69%	0.693	S	S	*	*				-178.3	117.9	126.2	-95.6	-25.2	0	0	0	107.5
863	H	32	Very low	31.6	Very low	162 Å²	162	133.9 Å²	133.9	75%	0.75	70%	0.697	S	S	*	*				63.4	83.6	51	-79.8	30.2	0	0	0	115.4
864	T	34.2	Very low	31.4	Very low	150 Å²	150	134.9 Å²	134.9	92%	0.92	70%	0.697	S	S	*	*				-131.6	132.5	121.3	45.2	0	0	0	0	109.5
865	N	29.7	Very low	31.2	Very low	125 Å²	125	135.7 Å²	135.7	67%	0.668	70%	0.696	S	S	*	*			trans	-156.3	134.8	-174.4	-164.8	2.6	0	0	0	109.3	I867	N865-I867 HydrophobicContact CB-CD1 4.03Å; N865-I867 HydrophobicContact CB-CG1 4.36Å; N865-I867 WeakPolarHBondContact OD1-CG1 3.21Å
866	S	32	Very low	31	Very low	107 Å²	107	134.2 Å²	134.2	75%	0.748	70%	0.696	S	S	*	*			trans	-153.9	104.9	166.1	-153.5	0	0	0	0	106.5
867	I	28.9	Very low	30.6	Very low	88 Å²	88	133.8 Å²	133.8	45%	0.451	69%	0.693	S	S	.	*			cis	58.8	115.2	45.2	-35.8	168.1	0	0	0	108.1	N865	N865-I867 HydrophobicContact CB-CD1 4.03Å; N865-I867 HydrophobicContact CB-CG1 4.36Å; N865-I867 WeakPolarHBondContact OD1-CG1 3.21Å
868	F	30.2	Very low	30.6	Very low	172 Å²	172	136.9 Å²	136.9	75%	0.754	70%	0.7	S	S	*	*				-158	129.3	77.9	-101.4	-100.8	0	0	0	109.3
869	H	30.8	Very low	30.4	Very low	130 Å²	130	138.2 Å²	138.2	60%	0.602	71%	0.707	S	S	*	*				73.1	148.2	90.1	-93	-98.3	0	0	0	113.9
870	H	30.3	Very low	30.3	Very low	132 Å²	132	142.6 Å²	142.6	61%	0.611	71%	0.714	S	S	*	*			cis	-161.9	147.9	5.2	-153.6	-2.8	0	0	0	110.7
871	H	29.7	Very low	29.9	Very low	138 Å²	138	142.7 Å²	142.7	64%	0.639	72%	0.72	S	S	*	*			trans	61	166.8	144.8	-101.5	14.8	0	0	0	118.8
872	Q	28.6	Very low	29.6	Very low	127 Å²	127	141.1 Å²	141.1	59%	0.593	71%	0.711	S	S	*	*			cis	-146.4	114.7	-14.5	-160.3	156	2.1	0	0	107.1
873	Q	27	Very low	29.2	Very low	147 Å²	147	140.8 Å²	140.8	69%	0.687	71%	0.714	S	S	*	*				47.7	111.5	105.2	172.5	-160.4	62.2	0	0	116
874	Q	29	Very low	29.1	Very low	155 Å²	155	139 Å²	139	72%	0.724	71%	0.714	S	S	*	*				-176.5	149.3	128.2	-102.7	170.8	61	0	0	114.1
875	H	32.5	Very low	28.8	Very low	158 Å²	158	138.5 Å²	138.5	73%	0.731	71%	0.71	S	S	*	*			trans	33.4	118.3	163.7	-54	-61.7	0	0	0	120.2
876	S	26.9	Very low	28.7	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	71%	0.705	S	S	*	*				62.8	123.8	69	-160.7	0	0	0	0	112.1
877	I	28.3	Very low	28.6	Very low	136 Å²	136	136.6 Å²	136.6	70%	0.697	71%	0.705	S	S	*	*				-164.6	137.9	79.2	-91.5	173.8	0	0	0	112.6
878	K	30	Very low	28.6	Very low	184 Å²	184	138.9 Å²	138.9	80%	0.8	72%	0.718	S	S	*	*			trans	58	124.4	155.7	-71.9	167.6	-168.5	172.3	0	122.1
879	D	28.3	Very low	28.7	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	72%	0.719	S	S	*	*			trans	-55.3	148.5	144.3	-50.2	-90.9	0	0	0	112.6
880	R	28.2	Very low	28.5	Very low	220 Å²	220	136.9 Å²	136.9	83%	0.83	73%	0.727	S	S	*	*			trans	-157.6	87.9	153.2	-118	-172.1	170.1	-166.2	-4.4	112.1	V882	R880-V882 HydrophobicContact CB-CG2 3.9Å; R880-V882 HydrophobicContact CG-CG2 3.51Å; R880-V882 PolarHBondContact O-N 2.95Å
881	V	25.3	Very low	28.6	Very low	148 Å²	148	138 Å²	138	90%	0.897	74%	0.737	S	S	*	*			trans	-70.6	119.1	151.7	176.8	0	0	0	0	106.4
882	V	26.7	Very low	29.1	Very low	80 Å²	80	135.4 Å²	135.4	49%	0.485	73%	0.733	S	S	.	*			trans	-138.6	113.9	179.5	-179.6	0	0	0	0	109.2	R880 V884	R880-V882 HydrophobicContact CB-CG2 3.9Å; R880-V882 HydrophobicContact CG-CG2 3.51Å; R880-V882 PolarHBondContact O-N 2.95Å; V882-V884 HydrophobicContact CG1-CB 4.11Å; V882-V884 HydrophobicContact CG1-CG2 3.58Å
883	V	25	Very low	29	Very low	141 Å²	141	136.3 Å²	136.3	86%	0.855	74%	0.742	S	S	*	*			trans	-98.2	111.9	160.9	177	0	0	0	0	106.6
884	V	30	Very low	29.3	Very low	123 Å²	123	136 Å²	136	75%	0.745	75%	0.75	S	S	*	*			trans	-141	140.5	172.4	168.3	0	0	0	0	108.8	V882	V882-V884 HydrophobicContact CG1-CB 4.11Å; V882-V884 HydrophobicContact CG1-CG2 3.58Å
885	V	27.7	Very low	29.4	Very low	140 Å²	140	135.7 Å²	135.7	85%	0.848	75%	0.754	S	S	*	*			trans	-96.9	146.7	178.6	176.1	0	0	0	0	109.8
886	G	26.8	Very low	29.4	Very low	55 Å²	55	133.7 Å²	133.7	57%	0.567	75%	0.752	S	S	*	*			trans	132.3	118.4	150.8	0	0	0	0	0	118
887	N	29.4	Very low	29.7	Very low	138 Å²	138	135.5 Å²	135.5	74%	0.738	75%	0.754	S	S	*	*			trans	69	110	137	-65.2	72.9	0	0	0	121.7
888	D	30.2	Very low	29.8	Very low	135 Å²	135	133.5 Å²	133.5	72%	0.722	75%	0.745	S	S	*	*				79.5	146.5	121.8	-50.4	-25.6	0	0	0	123.4
889	D	31	Very low	29.8	Very low	148 Å²	148	131 Å²	131	79%	0.791	74%	0.744	S	S	*	*			trans	74.4	99.2	159.8	-72.2	-36.5	0	0	0	123.7
890	C	28.5	Very low	30.1	Very low	112 Å²	112	131.5 Å²	131.5	76%	0.757	75%	0.746	S	S	*	*				77.8	94.1	118.1	-69.9	0	0	0	0	123
891	N	31.4	Very low	30.2	Very low	156 Å²	156	126.1 Å²	126.1	83%	0.834	74%	0.742	S	S	*	*				75.4	177	124.7	-126.7	23.5	0	0	0	118.4
892	P	39.9	Very low	30.4	Very low	84 Å²	84	127.9 Å²	127.9	55%	0.545	73%	0.732	S	S	.	*				-132.5	-157.6	-111.6	43.8	-23.2	0	0	0	114.5
893	D	27.3	Very low	30.7	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	74%	0.742	S	S	*	*			trans	67.1	129.9	172.6	-51.1	-34.8	0	0	0	115
894	T	33.1	Very low	31.2	Very low	140 Å²	140	133.3 Å²	133.3	86%	0.859	74%	0.74	S	S	*	*			cis	-153.6	158.4	45.8	34.2	0	0	0	0	115
895	N	30.9	Very low	31.4	Very low	150 Å²	150	134.9 Å²	134.9	80%	0.802	74%	0.744	S	S	*	*			trans	-70.7	142.2	174.8	168.2	37.8	0	0	0	115
896	T	32.8	Very low	31.6	Very low	115 Å²	115	138 Å²	138	71%	0.706	74%	0.741	S	S	*	*			trans	-156.2	138	146.1	12.7	0	0	0	0	114.8
897	D	33.4	Very low	31.9	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	75%	0.754	S	S	*	*			trans	58	106.1	152.1	-49	-28.1	0	0	0	119.5
898	D	29.9	Very low	32.1	Very low	94 Å²	94	148.1 Å²	148.1	50%	0.503	76%	0.759	S	S	.	*			cis	81.1	79.4	42.1	-150.6	32.1	0	0	0	115.5	R902	D898-R902 IonicContact OD1-NH1 3.2Å; D898-R902 IonicContact OD1-NH2 2.66Å; D898-R902 IonicContact OD2-CZ 3.68Å; D898-R902 IonicContact OD2-NH1 2.99Å; D898-R902 PolarHBondContact OD2-NH1 3.03Å; D898-R902 VanDerWaalsContact OD2-NH1 3.13Å; D898-R902 IonicContact OD2-NH2 3.22Å; D898-R902 PolarHBondContact OD2-NH2 3.1Å
899	V	29.9	Very low	32.1	Very low	131 Å²	131	149.4 Å²	149.4	79%	0.794	76%	0.761	S	S	*	*			trans	-148.8	158.2	138.6	-168.2	0	0	0	0	108.5
900	I	34	Very low	32	Very low	166 Å²	166	150.8 Å²	150.8	85%	0.851	76%	0.763	S	S	*	*	S	Bend	trans	74.9	35.6	173.9	-29.8	179.5	0	0	0	116.2
901	S	30.5	Very low	32.1	Very low	107 Å²	107	154.6 Å²	154.6	75%	0.748	77%	0.769	S	S	*	*			trans	-125.8	20	170.9	-65.8	0	0	0	0	115.1
902	R	30.7	Very low	32	Very low	184 Å²	184	154.1 Å²	154.1	69%	0.694	77%	0.766	S	S	*	*	S	Bend	trans	-115.2	-7.3	-170.7	-73.3	-173.3	177.1	111.6	16.3	117.8	D898	D898-R902 IonicContact OD1-NH1 3.2Å; D898-R902 IonicContact OD1-NH2 2.66Å; D898-R902 IonicContact OD2-CZ 3.68Å; D898-R902 IonicContact OD2-NH1 2.99Å; D898-R902 PolarHBondContact OD2-NH1 3.03Å; D898-R902 VanDerWaalsContact OD2-NH1 3.13Å; D898-R902 IonicContact OD2-NH2 3.22Å; D898-R902 PolarHBondContact OD2-NH2 3.1Å
903	E	33.3	Very low	31.6	Very low	148 Å²	148	157.3 Å²	157.3	69%	0.692	78%	0.778	S	S	*	*	S	Bend	trans	-107.5	-0.8	-166.5	-160.1	50.3	-143.3	0	0	116.3
904	K	34	Very low	32	Very low	188 Å²	188	157 Å²	157	82%	0.817	78%	0.777	S	S	*	*	S	Bend	trans	-101.2	-38.3	179.6	-146.7	173.8	-177.3	-175.1	0	114.2	R906	K904-R906 PolarHBondContact O-N 2.93Å
905	N	34.1	Very low	32.1	Very low	156 Å²	156	156.5 Å²	156.5	83%	0.834	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	39.3	-176.8	-61.3	12.6	0	0	0	113.1
906	R	33.7	Very low	32.1	Very low	204 Å²	204	155.9 Å²	155.9	77%	0.77	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	13.4	-172.9	-144.6	-178.4	177.3	104.1	5.1	115.2	K904	K904-R906 PolarHBondContact O-N 2.93Å
907	R	32.4	Very low	32	Very low	227 Å²	227	156.2 Å²	156.2	86%	0.857	77%	0.767	S	S	*	*	S	Bend	trans	-124.6	3.8	178	-71	-173.2	177.7	167.5	2.1	115.4
908	E	33.6	Very low	31.7	Very low	179 Å²	179	156.1 Å²	156.1	84%	0.836	77%	0.765	S	S	*	*	S	Bend	trans	-106.9	6.7	-179.4	-66.3	173.9	143.8	0	0	113.3
909	Q	30	Very low	31.6	Very low	162 Å²	162	157 Å²	157	76%	0.757	77%	0.774	S	S	*	*	S	Bend	trans	-125.9	54	-172.6	-159.5	76.8	71.5	0	0	112.5
910	Q	28.4	Very low	31.5	Very low	178 Å²	178	157.3 Å²	157.3	83%	0.832	77%	0.771	S	S	*	*			trans	-158.8	46	178.6	-141	148.5	110.2	0	0	117.4
911	Q	30.6	Very low	31.2	Very low	191 Å²	191	156.6 Å²	156.6	89%	0.893	76%	0.764	S	S	*	*			trans	-155.6	73.5	156.6	-146.6	74.6	76.8	0	0	112.4
912	L	28.8	Very low	31.1	Very low	147 Å²	147	157.4 Å²	157.4	77%	0.77	76%	0.76	S	S	*	*			trans	-109.4	130	159	-78.8	167.6	0	0	0	107.3
913	D	33.1	Very low	31.1	Very low	150 Å²	150	155 Å²	155	80%	0.802	77%	0.765	S	S	*	*			trans	176.1	155.9	135.6	-93.3	-18.9	0	0	0	111.9
914	N	34.5	Very low	31	Very low	138 Å²	138	155.6 Å²	155.6	74%	0.738	77%	0.77	S	S	*	*			trans	80	104.3	162.4	-58.4	-23.6	0	0	0	120.6
915	D	36	Very low	30.8	Very low	130 Å²	130	153.6 Å²	153.6	70%	0.695	77%	0.768	S	S	*	*				103.8	79	126.7	-69.5	-41.8	0	0	0	122.3
916	N	29.8	Very low	30.8	Very low	137 Å²	137	154.1 Å²	154.1	73%	0.733	77%	0.765	S	S	*	*				73.7	150.1	102.4	-89.4	-51.7	0	0	0	122.7
917	V	30.9	Very low	30.8	Very low	123 Å²	123	151.7 Å²	151.7	75%	0.745	76%	0.763	S	S	*	*			trans	73.7	134.1	152.7	162.9	0	0	0	0	118
918	I	27.1	Very low	30.8	Very low	139 Å²	139	147.1 Å²	147.1	71%	0.713	76%	0.755	S	S	*	*			cis	-165.7	130.9	-26.8	-124.4	174.3	0	0	0	109.1
919	V	28.3	Very low	30.9	Very low	113 Å²	113	146.8 Å²	146.8	69%	0.685	76%	0.759	S	S	*	*			trans	82.7	141	131.8	164.4	0	0	0	0	124.4
920	D	27.4	Very low	31	Very low	136 Å²	136	148.5 Å²	148.5	73%	0.727	77%	0.767	S	S	*	*			trans	66.4	118.1	156.3	-67.2	-9.3	0	0	0	126.2
921	E	28.8	Very low	31.3	Very low	151 Å²	151	148.8 Å²	148.8	71%	0.706	77%	0.768	S	S	*	*				65.5	112.8	124.3	-64.3	-142.3	123.2	0	0	124.3
922	N	28.7	Very low	31.4	Very low	124 Å²	124	149.2 Å²	149.2	66%	0.663	77%	0.771	S	S	*	*				70	161.2	124.8	-55.5	-26	0	0	0	121.5
923	V	29.2	Very low	31.5	Very low	133 Å²	133	148.3 Å²	148.3	81%	0.806	77%	0.771	S	S	*	*			trans	73.3	122.6	164	-174.5	0	0	0	0	114.5
924	M	31	Very low	31.3	Very low	162 Å²	162	147.9 Å²	147.9	80%	0.798	77%	0.768	S	S	*	*			cis	-153.8	165.1	8.1	-152.5	49	151.3	0	0	113.7
925	N	31.4	Very low	31.2	Very low	145 Å²	145	149 Å²	149	78%	0.775	77%	0.774	S	S	*	*			trans	-78.1	149.9	165.6	-67.8	-7	0	0	0	112.7
926	H	33.9	Very low	30.9	Very low	167 Å²	167	151.4 Å²	151.4	77%	0.773	78%	0.779	S	S	*	*			trans	179.7	145.9	145.4	-93.6	-54.7	0	0	0	108.1
927	H	34.1	Very low	31	Very low	154 Å²	154	152.6 Å²	152.6	71%	0.713	79%	0.785	S	S	*	*			cis	-152.1	168.5	-17.2	-143.9	-8.8	0	0	0	108.1
928	D	31.5	Very low	31	Very low	131 Å²	131	154.8 Å²	154.8	70%	0.701	79%	0.788	S	S	*	*			trans	-92.3	142.7	-176.2	-33.3	-101.8	0	0	0	110.1
929	D	36.4	Very low	31.2	Very low	172 Å²	172	156.2 Å²	156.2	92%	0.92	79%	0.791	S	S	*	*			trans	-148.7	122.9	158.1	-89.2	-48.2	0	0	0	106.8
930	E	31.1	Very low	31.5	Very low	198 Å²	198	155 Å²	155	93%	0.925	78%	0.784	S	S	*	*			trans	-98.4	126.4	174.5	-68.1	-178.1	152.6	0	0	109.3
931	E	35.2	Very low	31.7	Very low	183 Å²	183	154.4 Å²	154.4	86%	0.855	78%	0.78	S	S	*	*			trans	-122.7	127.4	159.9	-77.6	-164.9	137.9	0	0	109.4	V933	E931-V933 PolarHBondContact O-N 2.79Å
932	E	31.5	Very low	32.1	Very low	201 Å²	201	152.3 Å²	152.3	94%	0.939	77%	0.771	S	S	*	*			trans	-68.7	124.3	165.8	-70.7	178.1	118.6	0	0	109.4
933	V	32.5	Very low	32.3	Very low	127 Å²	127	153.1 Å²	153.1	77%	0.77	77%	0.766	S	S	*	*			trans	-140.2	135.8	162.1	-90.3	0	0	0	0	108.7	E931 D935	E931-V933 PolarHBondContact O-N 2.79Å; V933-D935 PolarHBondContact O-N 3.04Å
934	D	28.2	Very low	32.7	Very low	141 Å²	141	149.3 Å²	149.3	75%	0.754	74%	0.74	S	S	*	*			trans	-67.6	120.5	-168.5	-52.1	-94.9	0	0	0	112.8	F936	D934-F936 HydrophobicContact CB-CD2 4Å; D934-F936 HydrophobicContact CB-CE2 3.97Å; D934-F936 PolarHBondContact O-N 2.84Å
935	D	31.4	Very low	32.8	Very low	162 Å²	162	145.1 Å²	145.1	87%	0.866	72%	0.721	S	S	*	*			trans	-68	91.3	167.8	-100.4	-26.1	0	0	0	109.8	V933 D937	V933-D935 PolarHBondContact O-N 3.04Å; D935-D937 PolarHBondContact O-N 3.2Å
936	F	31.5	Very low	33	Very low	180 Å²	180	144.7 Å²	144.7	79%	0.789	72%	0.719	S	S	*	*			trans	-78.1	104.4	162.2	-84.8	-99.5	0	0	0	108.9	D934 E938	D934-F936 HydrophobicContact CB-CD2 4Å; D934-F936 HydrophobicContact CB-CE2 3.97Å; D934-F936 PolarHBondContact O-N 2.84Å; F936-E938 PolarHBondContact O-N 2.69Å
937	D	30.8	Very low	32.9	Very low	162 Å²	162	141.9 Å²	141.9	87%	0.866	71%	0.706	S	S	*	*			trans	-62.7	73.9	170.8	-81.3	-50	0	0	0	111.8	D935 E939	D935-D937 PolarHBondContact O-N 3.2Å; D937-E939 PolarHBondContact O-N 3.13Å; D937-E939 VanDerWaalsContact O-N 3.09Å
938	E	31.4	Very low	32.8	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	69%	0.693	S	S	*	*			trans	-80.1	83.5	171.8	-158.4	173.1	-152.3	0	0	109.4	F936 V940	F936-E938 PolarHBondContact O-N 2.69Å; E938-V940 HydrophobicContact CB-CG2 4.47Å; E938-V940 HydrophobicContact CG-CG2 3.85Å; E938-V940 PolarHBondContact O-N 2.92Å
939	E	31.8	Very low	32.9	Very low	169 Å²	169	135.9 Å²	135.9	79%	0.79	68%	0.677	S	S	*	*			trans	-67.1	75.7	177.1	-168.5	-178.7	-159.1	0	0	111.2	D937 D941	D937-E939 PolarHBondContact O-N 3.13Å; D937-E939 VanDerWaalsContact O-N 3.09Å; E939-D941 PolarHBondContact O-N 3.38Å; E939-D941 VanDerWaalsContact O-N 3.16Å
940	V	33.1	Very low	32.8	Very low	87 Å²	87	134 Å²	134	53%	0.527	67%	0.671	S	S	.	*			trans	-77.6	98.2	178.4	-172.8	0	0	0	0	110.7	E938 E942	E938-V940 HydrophobicContact CB-CG2 4.47Å; E938-V940 HydrophobicContact CG-CG2 3.85Å; E938-V940 PolarHBondContact O-N 2.92Å; V940-E942 HydrophobicContact CG1-CB 3.9Å; V940-E942 HydrophobicContact CG1-CG 4Å; V940-E942 PolarHBondContact O-N 2.72Å
941	D	32.6	Very low	32.9	Very low	123 Å²	123	128.3 Å²	128.3	66%	0.658	65%	0.647	S	S	*	*			trans	-61.5	66.1	163.5	-95.2	-34.1	0	0	0	111.2	E939 Y943	E939-D941 PolarHBondContact O-N 3.38Å; E939-D941 VanDerWaalsContact O-N 3.16Å; D941-Y943 WeakPolarHBondContact O-CD2 3.42Å; D941-Y943 PolarHBondContact O-N 3.4Å
942	E	36	Very low	32.8	Very low	107 Å²	107	123.8 Å²	123.8	50%	0.5	63%	0.629	S	S	.	*			trans	-82.3	81.5	-178.6	-123.8	-170.1	125.1	0	0	113.6	N246 S249 V940	N246-E942 PolarHBondContact ND2-OE1 2.61Å; N246-E942 PolarHBondContact ND2-OE2 3.14Å; S249-E942 PolarHBondContact OG-OE1 3.22Å; V940-E942 HydrophobicContact CG1-CB 3.9Å; V940-E942 HydrophobicContact CG1-CG 4Å; V940-E942 PolarHBondContact O-N 2.72Å
943	Y	34.9	Very low	33	Very low	142 Å²	142	118 Å²	118	56%	0.557	61%	0.611	S	S	*	*			trans	-37.2	144.3	156	-85.8	-107.8	0	0	0	114.1	V123 D941	V123-Y943 HydrophobicContact CG1-CE1 4.34Å; D941-Y943 WeakPolarHBondContact O-CD2 3.42Å; D941-Y943 PolarHBondContact O-N 3.4Å
944	L	37.4	Very low	33.2	Very low	53 Å²	53	117.4 Å²	117.4	28%	0.277	60%	0.602	S	S	.	*			trans	-146.4	112.1	169.8	-63.3	174.9	0	0	0	117.6	N246 P247 A248 D946	N246-L944 HydrophobicContact CB-CD1 3.39Å; N246-L944 HydrophobicContact CB-CD2 4.31Å; N246-L944 HydrophobicContact CB-CG 4.19Å; N246-L944 VanDerWaalsContact CG-CD2 3.49Å; N246-L944 WeakPolarHBondContact OD1-CD1 3.28Å; N246-L944 WeakPolarHBondContact OD1-CD2 3.38Å; P247-L944 HydrophobicContact CB-CD1 3.82Å; P247-L944 HydrophobicContact CG-CD1 3.82Å; A248-L944 HydrophobicContact CB-CB 3.87Å; A248-L944 HydrophobicContact CB-CD1 4.27Å; A248-L944 HydrophobicContact CB-CD2 3.53Å; A248-L944 HydrophobicContact CB-CG 4.08Å; A248-L944 VanDerWaalsContact N-CD1 3.34Å; L944-D946 PolarHBondContact O-N 2.99Å
945	D	31.8	Very low	33.6	Very low	74 Å²	74	112.5 Å²	112.5	40%	0.396	59%	0.585	S	S	.	*			trans	29.7	68.4	136.2	-43.8	16.5	0	0	0	118.4	A248 K252 E947	A248-D945 HydrophobicContact CB-CB 3.4Å; A248-D945 VanDerWaalsContact CB-OD2 3.24Å; A248-D945 WeakPolarHBondContact CB-OD2 3.48Å; K252-D945 WeakPolarHBondContact CE-OD2 3.43Å; K252-D945 IonicContact NZ-OD1 2.7Å; K252-D945 IonicContact NZ-OD2 3.68Å; K252-D945 PolarHBondContact NZ-OD2 3.22Å; D945-E947 HydrophobicContact CB-CG 4.15Å; D945-E947 PolarHBondContact O-N 2.99Å
946	D	35.1	Very low	34.1	Very low	135 Å²	135	109.9 Å²	109.9	72%	0.722	57%	0.571	S	S	*	*			trans	-76.3	62.4	152.5	-118.6	-41.2	0	0	0	110.6	Y274 L944	Y274-D946 VanDerWaalsContact CE2-OD1 3.23Å; Y274-D946 WeakPolarHBondContact CE2-OD1 3.24Å; Y274-D946 PolarHBondContact OH-OD1 3.24Å; Y274-D946 VanDerWaalsContact OH-OD1 3.06Å; L944-D946 PolarHBondContact O-N 2.99Å
947	E	32.4	Very low	34.6	Very low	109 Å²	109	104.2 Å²	104.2	51%	0.509	55%	0.547	S	S	.	.			trans	-86.8	125.4	177.5	-71.4	-98.8	143.9	0	0	111.5	R226 Y274 D945	R226-E947 PolarHBondContact NH1-O 3.48Å; R226-E947 VanDerWaalsContact NH1-O 3.12Å; R226-E947 PolarHBondContact NH2-O 3.06Å; R226-E947 VanDerWaalsContact NH2-O 3.09Å; Y274-E947 WeakPolarHBondContact CE1-O 3.32Å; Y274-E947 PolarHBondContact OH-O 3.38Å; D945-E947 HydrophobicContact CB-CG 4.15Å; D945-E947 PolarHBondContact O-N 2.99Å
948	D	32.1	Very low	35.1	Very low	83 Å²	83	100.9 Å²	100.9	44%	0.444	53%	0.529	S	S	.	.			trans	100.7	11.6	169.4	-56.4	-53.3	0	0	0	120.3	R226 T263 Y274 V950	R226-D948 IonicContact NH2-OD2 3.57Å; T263-D948 WeakPolarHBondContact CB-OD2 3.09Å; T263-D948 HydrophobicContact CG2-CB 3.8Å; T263-D948 VanDerWaalsContact CG2-OD2 3.32Å; T263-D948 WeakPolarHBondContact CG2-OD2 3.31Å; T263-D948 PolarHBondContact OG1-OD2 3.4Å; Y274-D948 HydrophobicContact CD1-CB 4.49Å; Y274-D948 HydrophobicContact CE1-CB 3.88Å; D948-V950 PolarHBondContact O-N 2.95Å
949	E	34.2	Very low	35.7	Very low	75 Å²	75	95.2 Å²	95.2	35%	0.35	51%	0.511	S	S	.	.			trans	-86	78.9	167.4	-72.6	-118	135.7	0	0	112	R265 S272 Y274 D951	R265-E949 IonicContact CZ-OE1 3.72Å; R265-E949 IonicContact CZ-OE2 3.13Å; R265-E949 IonicContact NE-OE1 2.84Å; R265-E949 PolarHBondContact NE-OE1 3.38Å; R265-E949 IonicContact NE-OE2 3.73Å; R265-E949 PolarHBondContact NE-OE2 3.31Å; R265-E949 VanDerWaalsContact NH2-CD 3.26Å; R265-E949 IonicContact NH2-OE1 2.8Å; R265-E949 PolarHBondContact NH2-OE1 2.88Å; R265-E949 IonicContact NH2-OE2 4Å; R265-E949 PolarHBondContact NH2-OE2 3.49Å; S272-E949 WeakPolarHBondContact CB-OE1 3.28Å; S272-E949 PolarHBondContact OG-OE1 3.13Å; Y274-E949 HydrophobicContact CE1-CG 3.76Å; Y274-E949 HydrophobicContact CE2-CG 3.81Å; Y274-E949 VanDerWaalsContact OH-CG 3.24Å; Y274-E949 WeakPolarHBondContact OH-CG 3.41Å; Y274-E949 PolarHBondContact OH-N 3.12Å; Y274-E949 VanDerWaalsContact OH-N 3.13Å; E949-D951 PolarHBondContact O-N 3.16Å
950	V	34.1	Very low	36.1	Very low	132 Å²	132	92.1 Å²	92.1	80%	0.8	50%	0.498	S	S	*	.			trans	-63.4	100.2	157	-84	0	0	0	0	109.3	R265 D948	R265-V950 PolarHBondContact NH1-O 3.02Å; D948-V950 PolarHBondContact O-N 2.95Å
951	D	32.1	Very low	36.8	Very low	79 Å²	79	90.3 Å²	90.3	42%	0.422	49%	0.485	S	S	.	.			trans	-126.6	159.7	176.9	-143.9	12.7	0	0	0	114.3	R265 E949 S953	R265-D951 IonicContact CZ-OD1 2.75Å; R265-D951 IonicContact CZ-OD2 3.95Å; R265-D951 IonicContact NH1-OD1 2.6Å; R265-D951 PolarHBondContact NH1-OD1 3.03Å; R265-D951 IonicContact NH1-OD2 2.84Å; R265-D951 IonicContact NH2-OD1 3.88Å; R265-D951 PolarHBondContact NH2-OD1 3.49Å; R265-D951 IonicContact NH2-OD2 2.73Å; R265-D951 PolarHBondContact NH2-OD2 3.11Å; E949-D951 PolarHBondContact O-N 3.16Å; D951-S953 VanDerWaalsContact C-N 3.3Å; D951-S953 PolarHBondContact O-N 2.9Å
952	D	34.5	Very low	37.6	Very low	89 Å²	89	91.7 Å²	91.7	48%	0.476	49%	0.485	S	S	.	.			trans	-72.4	63.5	-163.1	-71.4	-51.4	0	0	0	115	R269 L954 G955	R269-D952 IonicContact CZ-OD2 3.37Å; R269-D952 IonicContact NE-OD2 2.88Å; R269-D952 IonicContact NH1-OD2 3.19Å; R269-D952 PolarHBondContact NH1-OD2 3.45Å; R269-D952 IonicContact NH2-OD2 3.74Å; D952-L954 PolarHBondContact O-N 3.41Å; D952-G955 PolarHBondContact O-N 2.77Å
953	S	35.5	Very low	38.2	Very low	79 Å²	79	93.1 Å²	93.1	55%	0.552	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-4.6	-178.6	-167.8	0	0	0	0	115.3	D951 G955 D956 E957	D951-S953 VanDerWaalsContact C-N 3.3Å; D951-S953 PolarHBondContact O-N 2.9Å; S953-G955 PolarHBondContact O-N 2.81Å; S953-G955 VanDerWaalsContact O-N 3.1Å; S953-D956 PolarHBondContact O-N 3.05Å; S953-E957 PolarHBondContact O-N 2.81Å; S953-E957 VanDerWaalsContact O-N 3.15Å
954	L	36.4	Very low	38.5	Very low	114 Å²	114	88.9 Å²	88.9	60%	0.597	49%	0.487	S	S	*	.	H	α-helix	trans	-57.9	-13.3	159.7	-82.6	166.4	0	0	0	113.6	D952 N958	D952-L954 PolarHBondContact O-N 3.41Å; L954-N958 WeakPolarHBondContact O-CB 3.5Å; L954-N958 PolarHBondContact O-ND2 2.82Å
955	G	36.4	Very low	39	Very low	38 Å²	38	91.1 Å²	91.1	39%	0.392	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-50.1	166.2	0	0	0	0	0	112.8	D952 S953 N958 A959	D952-G955 PolarHBondContact O-N 2.77Å; S953-G955 PolarHBondContact O-N 2.81Å; S953-G955 VanDerWaalsContact O-N 3.1Å; G955-N958 WeakPolarHBondContact O-CB 3.48Å; G955-N958 PolarHBondContact O-N 2.66Å; G955-A959 PolarHBondContact O-N 3.13Å
956	D	42.6	Very low	39.9	Very low	107 Å²	107	90.2 Å²	90.2	57%	0.572	50%	0.498	S	S	*	.	H	α-helix	trans	-79.1	-33.3	-174.6	-58.9	-45.9	0	0	0	112.4	S953 N958 A959 M960	S953-D956 PolarHBondContact O-N 3.05Å; D956-N958 PolarHBondContact O-N 2.62Å; D956-A959 PolarHBondContact O-N 3.42Å; D956-M960 WeakPolarHBondContact O-CB 3.41Å; D956-M960 WeakPolarHBondContact O-CG 3.31Å; D956-M960 PolarHBondContact O-N 2.8Å
957	E	41.1	Very low	40.3	Very low	62 Å²	62	87.1 Å²	87.1	29%	0.29	49%	0.487	S	S	.	.	H	α-helix	trans	-58.6	-37.9	167.8	-160.4	-162.2	154.7	0	0	110.3	R752 S953 L961	R752-E957 IonicContact NE-OE1 3.91Å; S953-E957 PolarHBondContact O-N 2.81Å; S953-E957 VanDerWaalsContact O-N 3.15Å; E957-L961 HydrophobicContact CG-CD1 3.97Å; E957-L961 HydrophobicContact CG-CG 4.44Å; E957-L961 WeakPolarHBondContact O-CB 3.39Å; E957-L961 WeakPolarHBondContact O-CG 3.49Å; E957-L961 PolarHBondContact O-N 3.37Å
958	N	41.5	Very low	40.8	Very low	92 Å²	92	83.1 Å²	83.1	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-71.3	-31	173.2	-95.4	-70.6	0	0	0	113.7	L954 G955 D956 K962	L954-N958 WeakPolarHBondContact O-CB 3.5Å; L954-N958 PolarHBondContact O-ND2 2.82Å; G955-N958 WeakPolarHBondContact O-CB 3.48Å; G955-N958 PolarHBondContact O-N 2.66Å; D956-N958 PolarHBondContact O-N 2.62Å; N958-K962 VanDerWaalsContact O-CB 3.28Å; N958-K962 WeakPolarHBondContact O-CB 3.42Å; N958-K962 WeakPolarHBondContact O-CG 3.22Å; N958-K962 PolarHBondContact O-N 3.11Å
959	A	44.2	Very low	41.5	Very low	50 Å²	50	82.9 Å²	82.9	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-68.9	-51.4	174.5	0	0	0	0	0	110.4	G955 D956 L961 K962 E963	G955-A959 PolarHBondContact O-N 3.13Å; D956-A959 PolarHBondContact O-N 3.42Å; A959-L961 PolarHBondContact O-N 3.33Å; A959-K962 WeakPolarHBondContact O-CB 3.23Å; A959-K962 PolarHBondContact O-N 2.98Å; A959-E963 PolarHBondContact O-N 3.32Å
960	M	39.7	Very low	42	Very low	104 Å²	104	81.6 Å²	81.6	51%	0.512	47%	0.471	S	S	.	.	H	α-helix	trans	-57.2	-45.5	173.7	-73.9	-168.8	74	0	0	112.5	Y120 D956 K962 E963 A964	Y120-M960 HydrophobicContact CE2-CE 4.45Å; Y120-M960 WeakPolarHBondContact OH-CE 3.41Å; Y120-M960 PolarHBondContact OH-SD 2.84Å; D956-M960 WeakPolarHBondContact O-CB 3.41Å; D956-M960 WeakPolarHBondContact O-CG 3.31Å; D956-M960 PolarHBondContact O-N 2.8Å; M960-K962 VanDerWaalsContact C-N 3.35Å; M960-E963 PolarHBondContact O-N 3.11Å; M960-A964 VanDerWaalsContact O-CB 3.26Å; M960-A964 WeakPolarHBondContact O-CB 3.15Å; M960-A964 PolarHBondContact O-N 2.88Å
961	L	49	Very low	42.3	Very low	50 Å²	50	80.5 Å²	80.5	26%	0.262	45%	0.454	S	S	.	.	H	α-helix	trans	-69.8	-31.8	178.6	-71	172.8	0	0	0	112.2	R752 E957 A959 H965	R752-L961 VanDerWaalsContact NH2-CD1 3.35Å; E957-L961 HydrophobicContact CG-CD1 3.97Å; E957-L961 HydrophobicContact CG-CG 4.44Å; E957-L961 WeakPolarHBondContact O-CB 3.39Å; E957-L961 WeakPolarHBondContact O-CG 3.49Å; E957-L961 PolarHBondContact O-N 3.37Å; A959-L961 PolarHBondContact O-N 3.33Å; L961-H965 WeakPolarHBondContact O-CB 3.31Å; L961-H965 PolarHBondContact O-N 2.96Å
962	K	48.6	Very low	42.6	Very low	151 Å²	151	79.8 Å²	79.8	66%	0.657	45%	0.454	S	S	*	.	H	α-helix	trans	-64.5	-43	168.4	-83.2	172.8	-179.8	175	0	111.8	N958 A959 M960 A966	N958-K962 VanDerWaalsContact O-CB 3.28Å; N958-K962 WeakPolarHBondContact O-CB 3.42Å; N958-K962 WeakPolarHBondContact O-CG 3.22Å; N958-K962 PolarHBondContact O-N 3.11Å; A959-K962 WeakPolarHBondContact O-CB 3.23Å; A959-K962 PolarHBondContact O-N 2.98Å; M960-K962 VanDerWaalsContact C-N 3.35Å; K962-A966 WeakPolarHBondContact O-CB 3.41Å; K962-A966 PolarHBondContact O-N 3.45Å
963	E	47.7	Very low	43	Very low	138 Å²	138	82.8 Å²	82.8	65%	0.645	46%	0.458	S	S	*	.	H	α-helix	trans	-75.4	-39.5	-176.6	-174	150.9	-150.9	0	0	112.6	A959 M960 A966 S967	A959-E963 PolarHBondContact O-N 3.32Å; M960-E963 PolarHBondContact O-N 3.11Å; E963-A966 PolarHBondContact O-N 2.87Å; E963-S967 VanDerWaalsContact O-CB 3.26Å; E963-S967 WeakPolarHBondContact O-CB 3.43Å; E963-S967 PolarHBondContact O-N 2.85Å; E963-S967 PolarHBondContact O-OG 2.82Å
964	A	42.5	Very low	43.2	Very low	53 Å²	53	84.8 Å²	84.8	44%	0.438	46%	0.463	S	S	.	.	H	α-helix	trans	-62.7	-42.4	169.9	0	0	0	0	0	111.3	M960 S967 A968	M960-A964 VanDerWaalsContact O-CB 3.26Å; M960-A964 WeakPolarHBondContact O-CB 3.15Å; M960-A964 PolarHBondContact O-N 2.88Å; A964-S967 PolarHBondContact O-N 2.92Å; A964-A968 VanDerWaalsContact O-CB 3.3Å; A964-A968 WeakPolarHBondContact O-CB 3.34Å; A964-A968 PolarHBondContact O-N 2.92Å
965	H	47.1	Very low	43.3	Very low	99 Å²	99	81.8 Å²	81.8	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-70	-36.6	175.7	-179.6	-128.2	0	0	0	112.4	L961 A968 Q969	L961-H965 WeakPolarHBondContact O-CB 3.31Å; L961-H965 PolarHBondContact O-N 2.96Å; H965-A968 PolarHBondContact O-N 3.49Å; H965-Q969 PolarHBondContact CE1-NE2 2.81Å; H965-Q969 PolarHBondContact NE2-NE2 2.98Å; H965-Q969 WeakPolarHBondContact O-CB 3.37Å; H965-Q969 WeakPolarHBondContact O-CG 3.43Å; H965-Q969 PolarHBondContact O-N 3.13Å
966	A	50.7	Low	43.2	Very low	56 Å²	56	82.9 Å²	82.9	46%	0.463	45%	0.453	S	S	.	.	H	α-helix	trans	-66.2	-41.3	173.4	0	0	0	0	0	111.5	K962 E963 Q969 A970	K962-A966 WeakPolarHBondContact O-CB 3.41Å; K962-A966 PolarHBondContact O-N 3.45Å; E963-A966 PolarHBondContact O-N 2.87Å; A966-Q969 PolarHBondContact O-N 2.88Å; A966-A970 WeakPolarHBondContact O-CB 3.37Å; A966-A970 PolarHBondContact O-N 3.22Å
967	S	44.8	Very low	42.9	Very low	69 Å²	69	81.9 Å²	81.9	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-44.8	174.3	-60.7	0	0	0	0	111.4	E963 A964 Q969 A970 Y971	E963-S967 VanDerWaalsContact O-CB 3.26Å; E963-S967 WeakPolarHBondContact O-CB 3.43Å; E963-S967 PolarHBondContact O-N 2.85Å; E963-S967 PolarHBondContact O-OG 2.82Å; A964-S967 PolarHBondContact O-N 2.92Å; S967-Q969 PolarHBondContact O-N 2.81Å; S967-A970 PolarHBondContact O-N 2.87Å; S967-Y971 WeakPolarHBondContact O-CB 3.37Å; S967-Y971 PolarHBondContact O-N 2.97Å
968	A	41.9	Very low	42.5	Very low	26 Å²	26	82.2 Å²	82.2	22%	0.215	47%	0.465	C	S	.	.	H	α-helix	trans	-61.7	-42.4	173.1	0	0	0	0	0	111.8	A964 H965 Y971 C972	A964-A968 VanDerWaalsContact O-CB 3.3Å; A964-A968 WeakPolarHBondContact O-CB 3.34Å; A964-A968 PolarHBondContact O-N 2.92Å; H965-A968 PolarHBondContact O-N 3.49Å; A968-Y971 PolarHBondContact O-N 2.99Å; A968-C972 WeakPolarHBondContact O-CB 3.34Å; A968-C972 PolarHBondContact O-N 2.86Å; A968-C972 PolarHBondContact O-SG 3.12Å
969	Q	46.4	Very low	42.1	Very low	78 Å²	78	81 Å²	81	36%	0.364	47%	0.467	S	S	.	.	H	α-helix	trans	-66	-36.4	174.6	-78.3	-166.4	15.1	0	0	113.1	H965 A966 S967 R973	H965-Q969 PolarHBondContact CE1-NE2 2.81Å; H965-Q969 PolarHBondContact NE2-NE2 2.98Å; H965-Q969 WeakPolarHBondContact O-CB 3.37Å; H965-Q969 WeakPolarHBondContact O-CG 3.43Å; H965-Q969 PolarHBondContact O-N 3.13Å; A966-Q969 PolarHBondContact O-N 2.88Å; S967-Q969 PolarHBondContact O-N 2.81Å; Q969-R973 VanDerWaalsContact O-CB 3.3Å; Q969-R973 WeakPolarHBondContact O-CB 3.34Å; Q969-R973 VanDerWaalsContact O-CG 3.24Å; Q969-R973 WeakPolarHBondContact O-CG 3.48Å; Q969-R973 PolarHBondContact O-N 3.24Å; Q969-R973 VanDerWaalsContact OE1-NH1 3.13Å
970	A	45	Very low	41.5	Very low	48 Å²	48	82.9 Å²	82.9	40%	0.397	47%	0.474	S	S	.	.	H	α-helix	trans	-67.2	-43.4	174.8	0	0	0	0	0	110.9	A966 S967 R973 N974	A966-A970 WeakPolarHBondContact O-CB 3.37Å; A966-A970 PolarHBondContact O-N 3.22Å; S967-A970 PolarHBondContact O-N 2.87Å; A970-R973 PolarHBondContact O-N 3.49Å; A970-N974 PolarHBondContact O-N 2.93Å
971	Y	39.7	Very low	41.1	Very low	109 Å²	109	84.2 Å²	84.2	43%	0.427	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-51.9	174.8	-166.3	-93.5	0	0	0	111.3	Q738 S967 A968 R973 N974 S975	Q738-Y971 VanDerWaalsContact NE2-CZ 3.31Å; Q738-Y971 PolarHBondContact NE2-OH 3.27Å; S967-Y971 WeakPolarHBondContact O-CB 3.37Å; S967-Y971 PolarHBondContact O-N 2.97Å; A968-Y971 PolarHBondContact O-N 2.99Å; Y971-R973 VanDerWaalsContact C-N 3.31Å; Y971-R973 PolarHBondContact O-N 3.18Å; Y971-N974 PolarHBondContact O-N 3.08Å; Y971-N974 VanDerWaalsContact O-N 3.08Å; Y971-S975 WeakPolarHBondContact CE1-OG 3.43Å; Y971-S975 WeakPolarHBondContact O-CB 3.49Å; Y971-S975 PolarHBondContact O-N 2.8Å; Y971-S975 PolarHBondContact O-OG 3.45Å
972	C	40	Very low	40.2	Very low	63 Å²	63	87.6 Å²	87.6	43%	0.426	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-33.2	178	-70.4	0	0	0	0	113.3	A968 S976	A968-C972 WeakPolarHBondContact O-CB 3.34Å; A968-C972 PolarHBondContact O-N 2.86Å; A968-C972 PolarHBondContact O-SG 3.12Å; C972-S976 VanDerWaalsContact O-CB 3.29Å; C972-S976 WeakPolarHBondContact O-CB 3.09Å; C972-S976 PolarHBondContact O-N 2.86Å; C972-S976 PolarHBondContact O-OG 2.65Å; C972-S976 VanDerWaalsContact O-OG 3.13Å
973	R	43.1	Very low	39.2	Very low	152 Å²	152	84.9 Å²	84.9	57%	0.574	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-44.6	170.6	-80.6	176.6	173.9	113.6	1.5	111.9	Q969 A970 Y971 S976 V977	Q969-R973 VanDerWaalsContact O-CB 3.3Å; Q969-R973 WeakPolarHBondContact O-CB 3.34Å; Q969-R973 VanDerWaalsContact O-CG 3.24Å; Q969-R973 WeakPolarHBondContact O-CG 3.48Å; Q969-R973 PolarHBondContact O-N 3.24Å; Q969-R973 VanDerWaalsContact OE1-NH1 3.13Å; A970-R973 PolarHBondContact O-N 3.49Å; Y971-R973 VanDerWaalsContact C-N 3.31Å; Y971-R973 PolarHBondContact O-N 3.18Å; R973-S976 PolarHBondContact O-N 2.75Å; R973-S976 PolarHBondContact O-OG 3.47Å; R973-S976 VanDerWaalsContact O-OG 3.12Å; R973-V977 WeakPolarHBondContact O-CB 3.37Å; R973-V977 VanDerWaalsContact O-CG2 3.26Å; R973-V977 WeakPolarHBondContact O-CG2 3.49Å; R973-V977 PolarHBondContact O-N 3.18Å
974	N	39.4	Very low	38.3	Very low	121 Å²	121	83.6 Å²	83.6	65%	0.647	51%	0.507	S	S	*	.	H	α-helix	trans	-68.6	-39.1	179.1	-71.2	-11	0	0	0	111.8	A970 Y971 A978	A970-N974 PolarHBondContact O-N 2.93Å; Y971-N974 PolarHBondContact O-N 3.08Å; Y971-N974 VanDerWaalsContact O-N 3.08Å; N974-A978 PolarHBondContact O-N 2.98Å; N974-A978 VanDerWaalsContact O-N 3.08Å
975	S	37.1	Very low	37.6	Very low	52 Å²	52	88.7 Å²	88.7	36%	0.364	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-38.2	174.4	-63.8	0	0	0	0	112.8	Y971 A978 A979	Y971-S975 WeakPolarHBondContact CE1-OG 3.43Å; Y971-S975 WeakPolarHBondContact O-CB 3.49Å; Y971-S975 PolarHBondContact O-N 2.8Å; Y971-S975 PolarHBondContact O-OG 3.45Å; S975-A978 PolarHBondContact O-N 3.23Å; S975-A979 PolarHBondContact O-N 3.16Å
976	S	34.8	Very low	36.6	Very low	60 Å²	60	91.1 Å²	91.1	42%	0.42	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-38.6	176	69.3	0	0	0	0	112	C972 R973 A978 A979 T980	C972-S976 VanDerWaalsContact O-CB 3.29Å; C972-S976 WeakPolarHBondContact O-CB 3.09Å; C972-S976 PolarHBondContact O-N 2.86Å; C972-S976 PolarHBondContact O-OG 2.65Å; C972-S976 VanDerWaalsContact O-OG 3.13Å; R973-S976 PolarHBondContact O-N 2.75Å; R973-S976 PolarHBondContact O-OG 3.47Å; R973-S976 VanDerWaalsContact O-OG 3.12Å; S976-A978 VanDerWaalsContact C-N 3.26Å; S976-A978 PolarHBondContact O-N 2.96Å; S976-A979 PolarHBondContact O-N 3.05Å; S976-A979 VanDerWaalsContact O-N 3.08Å; S976-T980 WeakPolarHBondContact O-CG2 3.19Å; S976-T980 PolarHBondContact O-N 3.35Å; S976-T980 PolarHBondContact O-OG1 3.12Å; S976-T980 VanDerWaalsContact O-OG1 3.08Å
977	V	36.4	Very low	35.6	Very low	86 Å²	86	95.2 Å²	95.2	52%	0.521	55%	0.554	S	S	.	*	H	α-helix	trans	-65	-28.3	173.4	170.5	0	0	0	0	112.6	R973 N981	R973-V977 WeakPolarHBondContact O-CB 3.37Å; R973-V977 VanDerWaalsContact O-CG2 3.26Å; R973-V977 WeakPolarHBondContact O-CG2 3.49Å; R973-V977 PolarHBondContact O-N 3.18Å; V977-N981 PolarHBondContact O-ND2 3.03Å
978	A	33.6	Very low	34.8	Very low	70 Å²	70	97.7 Å²	97.7	58%	0.579	57%	0.568	S	S	*	*	H	α-helix	trans	-71.9	-41.6	168.9	0	0	0	0	0	112	N974 S975 S976	N974-A978 PolarHBondContact O-N 2.98Å; N974-A978 VanDerWaalsContact O-N 3.08Å; S975-A978 PolarHBondContact O-N 3.23Å; S976-A978 VanDerWaalsContact C-N 3.26Å; S976-A978 PolarHBondContact O-N 2.96Å
979	A	31.6	Very low	34.1	Very low	66 Å²	66	105.9 Å²	105.9	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-72.2	-30.7	-179.7	0	0	0	0	0	114.2	S975 S976 N981 T982	S975-A979 PolarHBondContact O-N 3.16Å; S976-A979 PolarHBondContact O-N 3.05Å; S976-A979 VanDerWaalsContact O-N 3.08Å; A979-N981 VanDerWaalsContact C-N 3.28Å; A979-N981 PolarHBondContact O-N 3.21Å; A979-T982 PolarHBondContact O-OG1 3.38Å
980	T	32.4	Very low	33.4	Very low	90 Å²	90	107.1 Å²	107.1	55%	0.552	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-1.1	-177.5	53.7	0	0	0	0	114.7	S976 S983	S976-T980 WeakPolarHBondContact O-CG2 3.19Å; S976-T980 PolarHBondContact O-N 3.35Å; S976-T980 PolarHBondContact O-OG1 3.12Å; S976-T980 VanDerWaalsContact O-OG1 3.08Å; T980-S983 PolarHBondContact O-OG 3.35Å
981	N	31.1	Very low	32.6	Very low	131 Å²	131	112.1 Å²	112.1	70%	0.701	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	2.5	175.6	-76.3	-55.4	0	0	0	113.9	V977 A979	V977-N981 PolarHBondContact O-ND2 3.03Å; A979-N981 VanDerWaalsContact C-N 3.28Å; A979-N981 PolarHBondContact O-N 3.21Å
982	T	30.9	Very low	32.1	Very low	122 Å²	122	112.1 Å²	112.1	75%	0.748	65%	0.646	S	S	*	*	S	Bend	trans	-106.1	65	167.5	41.7	0	0	0	0	110.6	A979	A979-T982 PolarHBondContact O-OG1 3.38Å
983	S	27.8	Very low	31.6	Very low	94 Å²	94	113.3 Å²	113.3	66%	0.657	66%	0.655	S	S	*	*			trans	-85.1	128.4	-177	-69.6	0	0	0	0	113.1	T980	T980-S983 PolarHBondContact O-OG 3.35Å
984	T	27.5	Very low	30.9	Very low	110 Å²	110	111.2 Å²	111.2	68%	0.675	66%	0.659	S	S	*	*			trans	58.6	94.1	151	-46.5	0	0	0	0	117.9	L986	T984-L986 HydrophobicContact CG2-CB 4.26Å; T984-L986 HydrophobicContact CG2-CD1 4.23Å; T984-L986 HydrophobicContact CG2-CG 4.43Å
985	I	27.4	Very low	30.6	Very low	161 Å²	161	111.5 Å²	111.5	83%	0.826	66%	0.661	S	S	*	*			trans	-112	103.3	139	-64.2	-178.8	0	0	0	107.2	I987	I985-I987 HydrophobicContact CG2-CD1 4.41Å; I985-I987 HydrophobicContact CG2-CG1 4.2Å
986	L	26.3	Very low	30.1	Very low	149 Å²	149	115.3 Å²	115.3	78%	0.78	68%	0.677	S	S	*	*			trans	-98.2	120.5	172.2	-104.6	164.1	0	0	0	108.3	T984	T984-L986 HydrophobicContact CG2-CB 4.26Å; T984-L986 HydrophobicContact CG2-CD1 4.23Å; T984-L986 HydrophobicContact CG2-CG 4.43Å
987	I	29.7	Very low	29.7	Very low	143 Å²	143	119.7 Å²	119.7	73%	0.733	70%	0.695	S	S	*	*			trans	-118.5	119.9	165.8	-59.3	179	0	0	0	106.4	I985	I985-I987 HydrophobicContact CG2-CD1 4.41Å; I985-I987 HydrophobicContact CG2-CG1 4.2Å
988	P	29.8	Very low	29.4	Very low	121 Å²	121	122.5 Å²	122.5	79%	0.786	71%	0.706	S	S	*	*			trans	-78.1	157.3	-171.2	31.4	-35.8	0	0	0	113.1
989	Q	26.8	Very low	29.1	Very low	197 Å²	197	123.7 Å²	123.7	92%	0.921	71%	0.71	S	S	*	*			trans	-91.9	138.5	177.8	-68.7	-178.9	-27.7	0	0	113.3
990	S	30.2	Very low	28.8	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	72%	0.72	S	S	*	*			trans	-148.8	125.2	145.1	53.4	0	0	0	0	105.8
991	L	28.5	Very low	28.5	Very low	153 Å²	153	129.2 Å²	129.2	80%	0.801	73%	0.732	S	S	*	*				54.4	128	78.5	-65.7	166.3	0	0	0	110.8
992	D	29.3	Very low	28.4	Very low	110 Å²	110	126.3 Å²	126.3	59%	0.588	73%	0.733	S	S	*	*			cis	-161.7	163	30.1	-166.8	42.2	0	0	0	113.7
993	S	31	Very low	28.2	Very low	87 Å²	87	128.7 Å²	128.7	61%	0.608	74%	0.738	S	S	*	*			trans	55.3	162.4	155.3	-68.2	0	0	0	0	121
994	T	28.3	Very low	28.4	Very low	108 Å²	108	130.7 Å²	130.7	66%	0.663	74%	0.737	S	S	*	*			cis	-155.3	174.2	-44.2	43.4	0	0	0	0	107.8
995	D	32	Very low	28.5	Very low	127 Å²	127	132.8 Å²	132.8	68%	0.679	74%	0.737	S	S	*	*			trans	70.4	118.3	158.1	-59.5	-56.3	0	0	0	118
996	N	26.7	Very low	28.7	Very low	133 Å²	133	131.4 Å²	131.4	71%	0.711	73%	0.731	S	S	*	*				92.2	132.2	52.5	-84.5	-48.3	0	0	0	114.2
997	L	26.8	Very low	29	Very low	152 Å²	152	129.2 Å²	129.2	80%	0.796	72%	0.724	S	S	*	*			trans	77.2	151.8	149.2	-72.7	164.6	0	0	0	121
998	L	29.5	Very low	29	Very low	145 Å²	145	129.8 Å²	129.8	76%	0.759	73%	0.728	S	S	*	*			trans	64.7	106.2	170.6	-86.5	70.7	0	0	0	116.2
999	S	27.5	Very low	29.1	Very low	94 Å²	94	129.9 Å²	129.9	66%	0.657	73%	0.726	S	S	*	*				80.9	111.1	73.2	78.6	0	0	0	0	112.5
1000	N	24.6	Very low	29.4	Very low	142 Å²	142	128.3 Å²	128.3	76%	0.759	72%	0.72	S	S	*	*				103.2	145.4	72.4	-172.2	22.2	0	0	0	110.5
1001	T	27.3	Very low	29.3	Very low	131 Å²	131	131.8 Å²	131.8	80%	0.804	73%	0.725	S	S	*	*			trans	65.2	140.1	177.1	71.5	0	0	0	0	118
1002	G	27.6	Very low	29.6	Very low	70 Å²	70	131.2 Å²	131.2	72%	0.722	72%	0.723	S	S	*	*			trans	128.3	102	151.5	0	0	0	0	0	116.9
1003	M	26.9	Very low	29.8	Very low	172 Å²	172	133.8 Å²	133.8	85%	0.847	73%	0.731	S	S	*	*			trans	1.4	148.3	135.8	-52.5	-172	-52.2	0	0	117.8
1004	E	31.8	Very low	29.8	Very low	135 Å²	135	134.6 Å²	134.6	63%	0.631	73%	0.728	S	S	*	*			cis	-161.5	172.5	24.7	-140.3	172.7	148.7	0	0	111.2
1005	K	31.2	Very low	30	Very low	155 Å²	155	135.5 Å²	135.5	67%	0.674	73%	0.728	S	S	*	*			trans	19.1	146	140.7	-76.9	172.1	-161.6	154.6	0	120.6
1006	D	31.5	Very low	30	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	73%	0.728	S	S	*	*			cis	-167.9	174.3	23.7	-130.6	-32.8	0	0	0	114.2
1007	T	31.1	Very low	30.2	Very low	104 Å²	104	136.3 Å²	136.3	64%	0.638	72%	0.724	S	S	*	*			trans	79.5	100.8	150.9	-60.6	0	0	0	0	121.2
1008	L	30.5	Very low	30.2	Very low	155 Å²	155	137.8 Å²	137.8	81%	0.812	72%	0.724	S	S	*	*				56.8	147.7	126.6	-51	-176.2	0	0	0	120
1009	V	31	Very low	30.3	Very low	122 Å²	122	138 Å²	138	74%	0.739	72%	0.721	S	S	*	*			cis	-169.2	149.4	2.2	109.2	0	0	0	0	107.1
1010	M	34	Very low	30.2	Very low	165 Å²	165	137.8 Å²	137.8	81%	0.813	72%	0.719	S	S	*	*			cis	-125.9	154.1	11.4	-62.6	172.8	-78.9	0	0	111.8
1011	E	27.6	Very low	30.5	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.822	72%	0.718	S	S	*	*			trans	-101	149.5	157.2	-60.4	169.2	118.1	0	0	108.3
1012	D	34.7	Very low	30.4	Very low	141 Å²	141	137.4 Å²	137.4	75%	0.754	71%	0.711	S	S	*	*			trans	174.4	133.2	161.8	-92.3	-25.1	0	0	0	107.2
1013	E	34.2	Very low	30.5	Very low	164 Å²	164	142.6 Å²	142.6	77%	0.766	72%	0.716	S	S	*	*			cis	-123	141.9	-13	-76.4	-179.4	100.4	0	0	107.4
1014	I	31.4	Very low	30.5	Very low	105 Å²	105	141.6 Å²	141.6	54%	0.538	71%	0.71	S	S	.	*			cis	77.8	113.7	46.7	-58.5	163.7	0	0	0	112.6
1015	N	32.5	Very low	30.4	Very low	126 Å²	126	142 Å²	142	67%	0.674	72%	0.721	S	S	*	*			trans	163.8	128.1	135.2	-85.5	-59.5	0	0	0	108.8
1016	H	32.2	Very low	30.1	Very low	143 Å²	143	140.1 Å²	140.1	66%	0.662	72%	0.717	S	S	*	*				71.3	142.2	60.8	-74.6	-119.4	0	0	0	112.9
1017	E	30.5	Very low	30.2	Very low	135 Å²	135	140 Å²	140	63%	0.631	72%	0.721	S	S	*	*			cis	-150.9	170.1	-3.8	-142.7	172.8	113.5	0	0	113.4	Q1019	E1017-Q1019 PolarHBondContact OE1-NE2 3.11Å
1018	K	26.8	Very low	30.2	Very low	183 Å²	183	141.1 Å²	141.1	80%	0.796	72%	0.723	S	S	*	*			trans	-71.6	121.5	157.3	-60.1	161.1	174.7	170.2	0	110.3
1019	Q	31.4	Very low	30.2	Very low	148 Å²	148	140.9 Å²	140.9	69%	0.692	72%	0.723	S	S	*	*			trans	-150	139.8	140.4	-94.1	102	44.3	0	0	107.1	E1017	E1017-Q1019 PolarHBondContact OE1-NE2 3.11Å
1020	S	25.7	Very low	30.4	Very low	90 Å²	90	138.8 Å²	138.8	63%	0.629	71%	0.712	S	S	*	*			cis	64	73.9	22.1	89.5	0	0	0	0	114.8
1021	N	29.8	Very low	30.4	Very low	138 Å²	138	138.6 Å²	138.6	74%	0.738	71%	0.708	S	S	*	*			trans	-179.7	127.1	132.8	-82.6	-12.9	0	0	0	106.6
1022	I	26.4	Very low	30.9	Very low	128 Å²	128	135.9 Å²	135.9	66%	0.656	70%	0.7	S	S	*	*				77	128.4	65.4	-68.5	172.6	0	0	0	111.3
1023	E	30.2	Very low	30.9	Very low	178 Å²	178	135 Å²	135	83%	0.832	70%	0.695	S	S	*	*			trans	65.1	155.3	172.7	-70.1	147.7	-149.5	0	0	117.4
1024	E	25.9	Very low	31	Very low	152 Å²	152	133.4 Å²	133.4	71%	0.71	69%	0.691	S	S	*	*			cis	-167.9	108.5	-32.6	177.4	177.9	-135.9	0	0	108.6
1025	V	29.8	Very low	31.2	Very low	143 Å²	143	134.4 Å²	134.4	87%	0.867	70%	0.698	S	S	*	*			trans	-144.1	83.1	163.8	-169	0	0	0	0	111.5
1026	I	25.7	Very low	31.3	Very low	115 Å²	115	134.5 Å²	134.5	59%	0.59	70%	0.698	S	S	*	*			trans	2.2	118	135.7	-51.5	166.6	0	0	0	112.9
1027	V	33	Very low	31.5	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	70%	0.704	S	S	*	*				-136.9	121.4	74.7	-179.4	0	0	0	0	113.5
1028	N	31.1	Very low	31.9	Very low	127 Å²	127	134.2 Å²	134.2	68%	0.679	71%	0.709	S	S	*	*			trans	22.1	122.8	144	-51.4	-0.6	0	0	0	120
1029	D	29.5	Very low	32.4	Very low	150 Å²	150	131.9 Å²	131.9	80%	0.802	71%	0.705	S	S	*	*				89.2	159.1	72.2	-140.6	43.7	0	0	0	111.4
1030	P	37.1	Very low	32.7	Very low	78 Å²	78	132.7 Å²	132.7	51%	0.506	71%	0.709	S	S	.	*				-139.9	-173	-72.6	43.7	-30.3	0	0	0	114.9
1031	H	33.8	Very low	33.3	Very low	161 Å²	161	136.5 Å²	136.5	75%	0.745	72%	0.716	S	S	*	*			trans	65.2	160.8	156.4	-74.6	-72.5	0	0	0	116.5
1032	D	36.5	Very low	33.8	Very low	119 Å²	119	137.4 Å²	137.4	64%	0.636	72%	0.716	S	S	*	*			cis	-145.6	135.1	-0	-123.7	-8.4	0	0	0	108.4
1033	N	34.8	Very low	34.2	Very low	122 Å²	122	137.5 Å²	137.5	65%	0.652	72%	0.718	S	S	*	*				65.3	142.1	100.8	-91.1	-43.8	0	0	0	118.9
1034	N	36.7	Very low	34.4	Very low	130 Å²	130	133.8 Å²	133.8	70%	0.695	71%	0.707	S	S	*	*			trans	72.7	146.9	163.9	-51.5	-44.8	0	0	0	117.6
1035	N	36.4	Very low	34.7	Very low	126 Å²	126	132.1 Å²	132.1	67%	0.674	71%	0.707	S	S	*	*			cis	-166	178	-17.3	-108.3	-8	0	0	0	110.7
1036	D	34.7	Very low	35	Very low	128 Å²	128	133.7 Å²	133.7	68%	0.684	70%	0.702	S	S	*	*			trans	73.5	111.2	159.8	-55.7	-25.2	0	0	0	116.8
1037	I	36.3	Very low	35.3	Very low	151 Å²	151	134.3 Å²	134.3	77%	0.774	71%	0.706	S	S	*	*				70.4	117.8	78.1	-65.8	165.8	0	0	0	110
1038	V	37.6	Very low	35.4	Very low	121 Å²	121	134.2 Å²	134.2	73%	0.733	70%	0.7	S	S	*	*			cis	-129.7	-170	27.5	-120.2	0	0	0	0	111
1039	D	37.1	Very low	35.5	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	70%	0.704	S	S	*	*			cis	-156.7	-175.5	13.9	-129.8	-34.1	0	0	0	113.9
1040	E	39.5	Very low	35.5	Very low	166 Å²	166	138 Å²	138	78%	0.776	71%	0.709	S	S	*	*			trans	-62.8	163	174.8	-67.5	170.9	172.3	0	0	116.5
1041	E	38.4	Very low	35.2	Very low	169 Å²	169	137.5 Å²	137.5	79%	0.79	72%	0.717	S	S	*	*			cis	-154.8	134.5	-4.9	-116.8	-179.2	165.5	0	0	106.8
1042	E	38.7	Very low	35.1	Very low	157 Å²	157	136.4 Å²	136.4	73%	0.734	72%	0.722	S	S	*	*				41	153.6	89.3	-84.5	-159.4	125.6	0	0	117.9
1043	L	35.5	Very low	34.9	Very low	131 Å²	131	135.2 Å²	135.2	69%	0.686	72%	0.723	S	S	*	*			cis	-152.2	132.5	10.7	-134	141.2	0	0	0	106.4
1044	V	34.3	Very low	34.6	Very low	100 Å²	100	135.7 Å²	135.7	61%	0.606	73%	0.726	S	S	*	*			cis	88.5	95.5	48.4	172.6	0	0	0	0	115.3
1045	V	32.4	Very low	34.4	Very low	116 Å²	116	134.8 Å²	134.8	70%	0.703	72%	0.721	S	S	*	*			trans	45.7	150.8	138.3	-155.8	0	0	0	0	121.5
1046	K	35.6	Very low	34.3	Very low	177 Å²	177	136.6 Å²	136.6	77%	0.77	72%	0.723	S	S	*	*			trans	101.2	143.6	157.8	-58.3	173.6	-171.5	165.9	0	116.2
1047	N	31.6	Very low	34.1	Very low	127 Å²	127	137.9 Å²	137.9	68%	0.679	73%	0.73	S	S	*	*			cis	-171.1	177.1	-22.3	-110.8	5.8	0	0	0	109.4
1048	I	35.1	Very low	34	Very low	128 Å²	128	140.2 Å²	140.2	66%	0.656	73%	0.734	S	S	*	*			trans	78.8	109.4	148	-77.5	155.8	0	0	0	118.8
1049	E	33.3	Very low	33.6	Very low	162 Å²	162	140 Å²	140	76%	0.757	73%	0.728	S	S	*	*			trans	65.7	121.8	132	-63.5	158.9	-159.9	0	0	123.1
1050	E	30	Very low	33.3	Very low	196 Å²	196	140 Å²	140	92%	0.916	72%	0.724	S	S	*	*				38.4	138	128.2	-51.2	-165.5	158.1	0	0	122
1051	G	31.9	Very low	33	Very low	66 Å²	66	139.5 Å²	139.5	68%	0.68	72%	0.719	S	S	*	*			trans	152.3	64.3	151.4	0	0	0	0	0	120.7
1052	T	30.9	Very low	32.7	Very low	139 Å²	139	138.6 Å²	138.6	85%	0.853	72%	0.719	S	S	*	*			trans	61.3	138.2	143.4	-17.7	0	0	0	0	122.2
1053	S	31.7	Very low	32.5	Very low	93 Å²	93	136 Å²	136	65%	0.65	71%	0.714	S	S	*	*			trans	71.6	104.7	144.6	-109	0	0	0	0	121.9
1054	N	29.8	Very low	32.4	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	72%	0.717	S	S	*	*				66.3	131	112.7	-79.9	-58.7	0	0	0	123.2
1055	N	32.2	Very low	32.4	Very low	111 Å²	111	139.8 Å²	139.8	59%	0.594	72%	0.719	S	S	*	*			trans	83	114.8	137.7	-81	-59	0	0	0	122.4
1056	K	33.6	Very low	32.6	Very low	165 Å²	165	141.6 Å²	141.6	72%	0.717	72%	0.72	S	S	*	*			trans	76.2	112.3	130.3	-65.9	164.3	-177.9	148.3	0	120.6
1057	N	31.3	Very low	32.6	Very low	155 Å²	155	137.1 Å²	137.1	83%	0.829	71%	0.711	S	S	*	*				47.7	153	121.6	-60.1	-3	0	0	0	121.9
1058	K	33.6	Very low	32.6	Very low	199 Å²	199	138.2 Å²	138.2	87%	0.865	72%	0.716	S	S	*	*			trans	84.6	139	159.2	-148.1	171.6	179	-177.4	0	112.7
1059	L	30.1	Very low	32.5	Very low	117 Å²	117	138.7 Å²	138.7	61%	0.613	72%	0.72	S	S	*	*			cis	-179.3	138.9	-7.3	167.8	76.1	0	0	0	111
1060	E	30.1	Very low	32.5	Very low	135 Å²	135	139 Å²	139	63%	0.631	72%	0.719	S	S	*	*			trans	61.6	172.5	162.3	-71.7	169.1	-167.3	0	0	116.6
1061	K	33.3	Very low	32.6	Very low	155 Å²	155	134.8 Å²	134.8	67%	0.674	70%	0.703	S	S	*	*			cis	-161.6	166.2	10.8	-140.7	158.5	-169.7	143.1	0	111.6
1062	L	31.5	Very low	32.7	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	70%	0.702	S	S	*	*			trans	70.8	148.5	160.8	-54.2	157.6	0	0	0	115.8
1063	T	34	Very low	32.9	Very low	103 Å²	103	136.4 Å²	136.4	63%	0.632	69%	0.69	S	S	*	*			cis	-163	137.1	-3.9	9.6	0	0	0	0	113.1
1064	Q	33.9	Very low	33	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.752	69%	0.689	S	S	*	*			trans	61.8	156.9	144.6	-67.5	-179.5	32.9	0	0	119.3
1065	K	34.2	Very low	33.2	Very low	150 Å²	150	139.2 Å²	139.2	65%	0.652	69%	0.69	S	S	*	*			cis	-161.2	156.8	4.6	-135.9	172.1	174.2	-177.5	0	112.6
1066	H	37.1	Very low	33.1	Very low	154 Å²	154	139 Å²	139	71%	0.713	70%	0.697	S	S	*	*			trans	64.7	148.9	158.9	-66.6	-61.2	0	0	0	119.8
1067	S	35.6	Very low	33.1	Very low	82 Å²	82	135.9 Å²	135.9	57%	0.573	70%	0.696	S	S	*	*			cis	-171.4	132.7	-21.8	51.6	0	0	0	0	114.3
1068	N	31.5	Very low	33.3	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	69%	0.692	S	S	*	*			trans	64.3	159.9	149	-51.2	-13.4	0	0	0	117.7
1069	L	32.4	Very low	33.3	Very low	138 Å²	138	130.4 Å²	130.4	72%	0.723	69%	0.69	S	S	*	*			cis	-139.6	144.7	15.6	-88.2	87.3	0	0	0	113.2
1070	F	34	Very low	33.5	Very low	169 Å²	169	130.5 Å²	130.5	74%	0.741	70%	0.697	S	S	*	*			trans	63.2	145.9	137	-75.7	-126.6	0	0	0	121.1
1071	N	32.8	Very low	33.6	Very low	107 Å²	107	128.8 Å²	128.8	57%	0.572	71%	0.706	S	S	*	*			cis	-169.6	149.7	-19.7	-119.7	17.6	0	0	0	110.7
1072	N	33.1	Very low	33.5	Very low	127 Å²	127	130 Å²	130	68%	0.679	71%	0.714	S	S	*	*			trans	64.6	147.4	155.3	-58.1	-4.1	0	0	0	116.4
1073	D	35.3	Very low	33.3	Very low	112 Å²	112	130 Å²	130	60%	0.599	71%	0.714	S	S	*	*			cis	-167.6	164.9	6.2	-108.8	11.8	0	0	0	107.8
1074	K	33.6	Very low	33.1	Very low	145 Å²	145	130.8 Å²	130.8	63%	0.63	72%	0.719	S	S	*	*			cis	-169.7	163.2	-14.7	-119.6	-179.8	-168.4	77.2	0	109
1075	I	33.5	Very low	33	Very low	139 Å²	139	129.4 Å²	129.4	71%	0.713	72%	0.716	S	S	*	*			trans	61.1	100.8	146.4	-67.6	171.1	0	0	0	117.9
1076	S	31.6	Very low	32.9	Very low	108 Å²	108	130 Å²	130	76%	0.755	72%	0.721	S	S	*	*				94.4	152.3	93.9	-65.8	0	0	0	0	114.2
1077	S	32.6	Very low	32.7	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	72%	0.723	S	S	*	*			cis	-164.7	164.6	-0.2	38.1	0	0	0	0	112.5
1078	S	35	Very low	32.5	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	73%	0.733	S	S	*	*			trans	66.6	143.8	155.6	60.7	0	0	0	0	118.7
1079	T	33.5	Very low	32.6	Very low	132 Å²	132	131.6 Å²	131.6	81%	0.81	73%	0.732	S	S	*	*			cis	-152.8	147.1	9.3	-28.8	0	0	0	0	112.4
1080	P	34.7	Very low	32.5	Very low	119 Å²	119	133.4 Å²	133.4	77%	0.773	73%	0.734	S	S	*	*			trans	-125	-175.4	168.6	41.4	-29.3	0	0	0	115
1081	A	31.4	Very low	32.5	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	73%	0.725	S	S	*	*			trans	80.1	158	-178.3	0	0	0	0	0	115
1082	E	31.4	Very low	32.4	Very low	179 Å²	179	133.2 Å²	133.2	84%	0.836	73%	0.732	S	S	*	*			cis	-147.5	168.6	29.5	-168.8	168.2	140.3	0	0	116.3
1083	L	28.1	Very low	32.1	Very low	149 Å²	149	134.8 Å²	134.8	78%	0.78	74%	0.738	S	S	*	*			trans	-65.2	170.3	-170.7	-59.9	152.7	0	0	0	119
1084	T	31	Very low	31.9	Very low	120 Å²	120	134.3 Å²	134.3	74%	0.736	74%	0.743	S	S	*	*			trans	155.4	105.4	139.4	-70.4	0	0	0	0	110.2
1085	I	30.3	Very low	31.5	Very low	133 Å²	133	135 Å²	135	68%	0.682	75%	0.752	S	S	*	*				63.3	121.9	90.3	-59.8	161.5	0	0	0	112
1086	Q	32.6	Very low	31.3	Very low	163 Å²	163	134 Å²	134	76%	0.762	76%	0.757	S	S	*	*				-167.4	122.5	66.2	-135.5	145.8	36.4	0	0	109.5
1087	Q	32.2	Very low	30.9	Very low	161 Å²	161	134 Å²	134	75%	0.752	75%	0.753	S	S	*	*				78.5	131.8	93.7	-73.8	-176	-39.5	0	0	120.1
1088	S	32.1	Very low	30.8	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	76%	0.758	S	S	*	*			trans	79.1	163.6	165	85.4	0	0	0	0	116.5
1089	N	32.9	Very low	30.3	Very low	146 Å²	146	136.5 Å²	136.5	78%	0.781	76%	0.759	S	S	*	*			cis	-145.4	-172.8	5.6	-149	-9.5	0	0	0	114.3
1090	K	31	Very low	30.1	Very low	175 Å²	175	137.1 Å²	137.1	76%	0.761	76%	0.764	S	S	*	*			trans	-88.7	-177.4	177	-59.1	168.4	167.6	173.5	0	112.3
1091	D	33.1	Very low	29.6	Very low	103 Å²	103	137.9 Å²	137.9	55%	0.551	77%	0.766	S	S	*	*			cis	-162.6	151.6	13	-138.1	-2.9	0	0	0	110.2
1092	K	31.5	Very low	29.6	Very low	169 Å²	169	140.2 Å²	140.2	74%	0.735	77%	0.77	S	S	*	*			trans	57.1	171.9	146.5	-72.2	166.2	-170.9	145.3	0	120.4
1093	M	27.8	Very low	29.4	Very low	161 Å²	161	138.7 Å²	138.7	79%	0.793	77%	0.773	S	S	*	*			cis	-177.8	177.2	-31.4	-178	164.2	167.4	0	0	107.3
1094	S	30.1	Very low	29.6	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	77%	0.773	S	S	*	*			trans	65.4	102.5	158.4	47	0	0	0	0	120.4
1095	I	26.1	Very low	29.5	Very low	161 Å²	161	135.6 Å²	135.6	83%	0.826	78%	0.781	S	S	*	*				3.8	129.4	122.8	-59.1	161.9	0	0	0	116.2
1096	S	28.8	Very low	29.3	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	79%	0.791	S	S	*	*				-172.2	135.9	128.8	-79.7	0	0	0	0	112.5
1097	T	23.8	Very low	29.1	Very low	109 Å²	109	132.6 Å²	132.6	67%	0.669	79%	0.789	S	S	*	*			trans	-75.7	144.1	167.1	-44.9	0	0	0	0	110.4
1098	T	28.7	Very low	29.2	Very low	130 Å²	130	130.4 Å²	130.4	80%	0.798	79%	0.788	S	S	*	*			trans	-178.7	144.2	138.6	-73.7	0	0	0	0	109.7
1099	T	24.8	Very low	29.2	Very low	127 Å²	127	131 Å²	131	78%	0.779	79%	0.79	S	S	*	*			trans	-76.3	145.6	177.2	35.9	0	0	0	0	113.8
1100	T	29.5	Very low	29	Very low	146 Å²	146	129.2 Å²	129.2	90%	0.896	79%	0.789	S	S	*	*			trans	-163.9	147.1	138.2	2.2	0	0	0	0	111.7
1101	T	25.6	Very low	28.7	Very low	135 Å²	135	128.3 Å²	128.3	83%	0.828	79%	0.79	S	S	*	*			trans	-99.6	132.5	-176.8	48.7	0	0	0	0	112.6
1102	T	30.4	Very low	28.4	Very low	147 Å²	147	129 Å²	129	90%	0.902	80%	0.798	S	S	*	*			trans	-144.7	138.8	152.3	30.1	0	0	0	0	110.2
1103	T	28.2	Very low	28.3	Very low	147 Å²	147	126.6 Å²	126.6	90%	0.902	80%	0.798	S	S	*	*			trans	-83.6	128.9	-173.4	48.1	0	0	0	0	112.6
1104	G	32.2	Very low	28.2	Very low	76 Å²	76	126.2 Å²	126.2	78%	0.784	80%	0.796	S	S	*	*			trans	-129.9	110.1	167.7	0	0	0	0	0	110.3
1105	S	27.1	Very low	28.3	Very low	129 Å²	129	126.9 Å²	126.9	90%	0.902	80%	0.798	S	S	*	*			trans	-76.4	128	-179.4	45.8	0	0	0	0	111.5
1106	C	26.9	Very low	28.4	Very low	130 Å²	130	126 Å²	126	88%	0.878	80%	0.795	S	S	*	*			trans	-141.3	143.8	166.6	-151	0	0	0	0	109.9
1107	S	29.3	Very low	28.7	Very low	103 Å²	103	125.1 Å²	125.1	72%	0.72	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-69.6	154.3	-164.1	-54.6	0	0	0	0	114
1108	P	32.6	Very low	28.9	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-57.9	147.5	162.5	27.9	-35.1	0	0	0	110.1
1109	P	32.5	Very low	29	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64	139.3	-174.9	26.5	-34.7	0	0	0	111.5
1110	S	28.3	Very low	29	Very low	109 Å²	109	133.2 Å²	133.2	76%	0.762	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-53.2	139.9	178.2	-56.8	0	0	0	0	112	V1112	S1110-V1112 PolarHBondContact O-N 3.48Å
1111	I	26.3	Very low	28.9	Very low	156 Å²	156	133 Å²	133	80%	0.8	79%	0.794	S	S	*	*			trans	-59.3	106.6	167.1	-68.2	175.2	0	0	0	108.1	T1113	I1111-T1113 VanDerWaalsContact C-N 3.35Å; I1111-T1113 PolarHBondContact O-N 2.94Å; I1111-T1113 VanDerWaalsContact O-N 3.08Å
1112	V	26	Very low	28.9	Very low	116 Å²	116	132.1 Å²	132.1	70%	0.703	79%	0.788	S	S	*	*			trans	-75.8	94	166.3	179.3	0	0	0	0	106.7	S1110 M1114	S1110-V1112 PolarHBondContact O-N 3.48Å; V1112-M1114 HydrophobicContact CG1-CG 4.35Å; V1112-M1114 HydrophobicContact CG1-SD 4.31Å; V1112-M1114 PolarHBondContact O-N 3.14Å
1113	T	28.9	Very low	28.7	Very low	120 Å²	120	135.4 Å²	135.4	74%	0.736	78%	0.784	S	S	*	*			trans	-64.9	85.4	170.5	-54.2	0	0	0	0	108.9	I1111	I1111-T1113 VanDerWaalsContact C-N 3.35Å; I1111-T1113 PolarHBondContact O-N 2.94Å; I1111-T1113 VanDerWaalsContact O-N 3.08Å
1114	M	27.2	Very low	28.6	Very low	153 Å²	153	134.3 Å²	134.3	75%	0.754	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-56	127.1	175.4	-75.5	-75.2	-90.7	0	0	109.1	V1112 N1116	V1112-M1114 HydrophobicContact CG1-CG 4.35Å; V1112-M1114 HydrophobicContact CG1-SD 4.31Å; V1112-M1114 PolarHBondContact O-N 3.14Å; M1114-N1116 PolarHBondContact O-N 3.08Å
1115	P	30.8	Very low	28.5	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.2	177.9	-25.7	34.8	0	0	0	111.3	P1117	P1115-P1117 VanDerWaalsContact O-N 3.17Å
1116	N	29	Very low	28.7	Very low	144 Å²	144	134.8 Å²	134.8	77%	0.77	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-46.6	120	176.5	-171.3	6	0	0	0	110	M1114 V1118	M1114-N1116 PolarHBondContact O-N 3.08Å; N1116-V1118 WeakPolarHBondContact O-CG2 3.27Å; N1116-V1118 PolarHBondContact O-N 3.17Å
1117	P	35	Very low	28.6	Very low	98 Å²	98	137.4 Å²	137.4	64%	0.636	76%	0.756	S	S	*	*			trans	-71.3	94.4	-167.6	26.5	-35.1	0	0	0	111.5	P1115 R1119	P1115-P1117 VanDerWaalsContact O-N 3.17Å; P1117-R1119 PolarHBondContact O-N 3.04Å
1118	V	27	Very low	28.6	Very low	135 Å²	135	138.5 Å²	138.5	82%	0.818	76%	0.762	S	S	*	*			trans	-70.6	65.6	172.3	-169.8	0	0	0	0	110.1	N1116 K1120	N1116-V1118 WeakPolarHBondContact O-CG2 3.27Å; N1116-V1118 PolarHBondContact O-N 3.17Å; V1118-K1120 PolarHBondContact O-N 3.37Å
1119	R	31.5	Very low	28.3	Very low	213 Å²	213	138.2 Å²	138.2	80%	0.804	75%	0.754	S	S	*	*			trans	-75.9	110.7	171.6	-76.8	-171.7	173.6	-177.5	-0.4	108.4	P1117 V1121	P1117-R1119 PolarHBondContact O-N 3.04Å; R1119-V1121 PolarHBondContact O-N 3.44Å
1120	K	24.6	Very low	28	Very low	188 Å²	188	137.4 Å²	137.4	82%	0.817	76%	0.758	S	S	*	*			trans	-58.2	114.8	-178.3	-60.5	170	-177.4	174.6	0	110.1	V1118 V1122	V1118-K1120 PolarHBondContact O-N 3.37Å; K1120-V1122 PolarHBondContact O-N 2.74Å
1121	V	27.2	Very low	28	Very low	142 Å²	142	139.2 Å²	139.2	86%	0.861	75%	0.752	S	S	*	*			trans	-68.6	102.2	161.7	179.1	0	0	0	0	107	R1119 R1123	R1119-V1121 PolarHBondContact O-N 3.44Å; V1121-R1123 PolarHBondContact O-N 3.28Å
1122	V	25.6	Very low	28.3	Very low	115 Å²	115	140.4 Å²	140.4	70%	0.697	75%	0.754	S	S	*	*			trans	-66.7	117	174	175.3	0	0	0	0	107.7	K1120 V1124	K1120-V1122 PolarHBondContact O-N 2.74Å; V1122-V1124 PolarHBondContact O-N 3.13Å
1123	R	27	Very low	28.5	Very low	217 Å²	217	140.3 Å²	140.3	82%	0.819	76%	0.756	S	S	*	*			trans	-66.5	100.2	170.6	-125.5	-173	-175.2	103.3	-1.9	107.9	V1121 T1125	V1121-R1123 PolarHBondContact O-N 3.28Å; R1123-T1125 HydrophobicContact CB-CG2 4.41Å; R1123-T1125 PolarHBondContact O-N 2.84Å
1124	V	26.4	Very low	28.6	Very low	124 Å²	124	140.1 Å²	140.1	75%	0.752	76%	0.756	S	S	*	*			trans	-74.3	85.8	166.4	-179.4	0	0	0	0	106.9	V1122 T1126	V1122-V1124 PolarHBondContact O-N 3.13Å; V1124-T1126 PolarHBondContact O-N 2.88Å; V1124-T1126 VanDerWaalsContact O-N 3.16Å
1125	T	28.7	Very low	28.7	Very low	86 Å²	86	139 Å²	139	53%	0.528	76%	0.758	S	S	.	*			trans	-72.9	101.7	173	49.3	0	0	0	0	109	R1123 F1127	R1123-T1125 HydrophobicContact CB-CG2 4.41Å; R1123-T1125 PolarHBondContact O-N 2.84Å; T1125-F1127 PolarHBondContact O-N 2.73Å
1126	T	31	Very low	28.4	Very low	128 Å²	128	139.8 Å²	139.8	79%	0.785	76%	0.761	S	S	*	*			trans	-66.4	99.2	164.4	36.9	0	0	0	0	109.2	V1124 C1128	V1124-T1126 PolarHBondContact O-N 2.88Å; V1124-T1126 VanDerWaalsContact O-N 3.16Å; T1126-C1128 PolarHBondContact O-N 3.04Å
1127	F	26.3	Very low	28.4	Very low	186 Å²	186	139.2 Å²	139.2	82%	0.816	76%	0.762	S	S	*	*			trans	-69	109.1	174.8	-90.6	-100.6	0	0	0	110.6	T1125	T1125-F1127 PolarHBondContact O-N 2.73Å
1128	C	28.8	Very low	28	Very low	126 Å²	126	142.7 Å²	142.7	85%	0.851	77%	0.77	S	S	*	*			trans	-119.7	80	162.6	-79.1	0	0	0	0	110.4	T1126	T1126-C1128 PolarHBondContact O-N 3.04Å
1129	D	26.6	Very low	28	Very low	108 Å²	108	141.4 Å²	141.4	58%	0.578	77%	0.767	S	S	*	*			trans	43.9	90.3	157.9	-154.7	19	0	0	0	118.5	K1131	D1129-K1131 PolarHBondContact O-N 2.96Å; D1129-K1131 VanDerWaalsContact O-N 3.16Å; D1129-K1131 IonicContact OD1-NZ 3.05Å; D1129-K1131 PolarHBondContact OD1-NZ 2.85Å; D1129-K1131 IonicContact OD2-NZ 2.67Å; D1129-K1131 PolarHBondContact OD2-NZ 2.82Å
1130	A	26.2	Very low	27.8	Very low	107 Å²	107	136.1 Å²	136.1	88%	0.884	76%	0.762	S	S	*	*			trans	-76	97.3	166.1	0	0	0	0	0	110.9
1131	K	28	Very low	28	Very low	148 Å²	148	136.5 Å²	136.5	64%	0.643	76%	0.764	S	S	*	*			trans	-112.3	98.5	167.8	-75.7	-173.8	172.6	73.4	0	111.7	D1129	D1129-K1131 PolarHBondContact O-N 2.96Å; D1129-K1131 VanDerWaalsContact O-N 3.16Å; D1129-K1131 IonicContact OD1-NZ 3.05Å; D1129-K1131 PolarHBondContact OD1-NZ 2.85Å; D1129-K1131 IonicContact OD2-NZ 2.67Å; D1129-K1131 PolarHBondContact OD2-NZ 2.82Å
1132	Q	32.1	Very low	28.1	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.8	150	161.3	-69.6	175.1	-28	0	0	110.1
1133	P	31.1	Very low	28.4	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-66.5	135.1	168.5	29.4	-33.6	0	0	0	109.6	V1135	P1133-V1135 PolarHBondContact O-N 3.07Å
1134	P	30	Very low	28.5	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.4	170.5	28.3	-32.3	0	0	0	109	V1136	P1134-V1136 PolarHBondContact O-N 3.14Å
1135	V	28.8	Very low	28.9	Very low	131 Å²	131	128.9 Å²	128.9	79%	0.794	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-63.7	121.5	172.5	173.4	0	0	0	0	108.7	P1133 V1137	P1133-V1135 PolarHBondContact O-N 3.07Å; V1135-V1137 HydrophobicContact CG1-CG2 4.24Å; V1135-V1137 PolarHBondContact O-N 3.4Å
1136	V	25.5	Very low	29.3	Very low	130 Å²	130	130.2 Å²	130.2	79%	0.788	76%	0.759	S	S	*	*			trans	-84.1	105.8	175.8	179.2	0	0	0	0	109.1	P1134	P1134-V1136 PolarHBondContact O-N 3.14Å
1137	V	29.7	Very low	29.4	Very low	131 Å²	131	129.1 Å²	129.1	79%	0.794	76%	0.756	S	S	*	*			trans	-132.2	145.9	155.6	-176.8	0	0	0	0	107	V1135	V1135-V1137 HydrophobicContact CG1-CG2 4.24Å; V1135-V1137 PolarHBondContact O-N 3.4Å
1138	E	25.8	Very low	29.8	Very low	172 Å²	172	125.9 Å²	125.9	80%	0.804	75%	0.752	S	S	*	*			trans	-86.2	172.9	-157.8	-62.5	169.7	100	0	0	115.5
1139	S	27.7	Very low	30	Very low	108 Å²	108	125.3 Å²	125.3	76%	0.755	75%	0.745	S	S	*	*			trans	101.5	94.7	147.7	76.8	0	0	0	0	120.9
1140	S	26.8	Very low	30.3	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	75%	0.75	S	S	*	*				96.3	127.6	121.8	-55	0	0	0	0	123.4
1141	F	27.7	Very low	30.6	Very low	197 Å²	197	127.9 Å²	127.9	86%	0.864	75%	0.746	S	S	*	*			trans	70.6	69.5	144.2	-65.5	-59.4	0	0	0	124.6
1142	A	30.2	Very low	30.7	Very low	81 Å²	81	124.7 Å²	124.7	67%	0.669	75%	0.747	S	S	*	*				47.6	148.2	105.7	0	0	0	0	0	125.9
1143	N	30.8	Very low	30.8	Very low	149 Å²	149	122.1 Å²	122.1	80%	0.797	75%	0.745	S	S	*	*			trans	81.3	146.6	152.3	-70.7	-13.6	0	0	0	120.3
1144	S	30.5	Very low	30.8	Very low	73 Å²	73	122.9 Å²	122.9	51%	0.51	75%	0.747	S	S	.	*			cis	-162.1	168.9	-3	39.4	0	0	0	0	114.7
1145	T	33.9	Very low	31.1	Very low	134 Å²	134	122.4 Å²	122.4	82%	0.822	74%	0.744	S	S	*	*			trans	-91.7	-155.7	-179.3	53.1	0	0	0	0	112.5
1146	P	38	Very low	31.2	Very low	115 Å²	115	122 Å²	122	75%	0.747	74%	0.742	S	S	*	*			cis	-126.4	-159.6	-3.4	36.1	-10.8	0	0	0	113.1
1147	S	33	Very low	31.5	Very low	104 Å²	104	121.6 Å²	121.6	73%	0.727	74%	0.74	S	S	*	*			cis	-141	-143.1	18.3	-73.6	0	0	0	0	111
1148	T	34	Very low	31.5	Very low	118 Å²	118	120.7 Å²	120.7	72%	0.724	74%	0.735	S	S	*	*			cis	-163.4	129	17.4	-52.7	0	0	0	0	113.5
1149	T	32.6	Very low	31.6	Very low	114 Å²	114	119.5 Å²	119.5	70%	0.699	73%	0.732	S	S	*	*			trans	35.8	139.3	143.3	-27	0	0	0	0	121.3
1150	T	33.5	Very low	31.7	Very low	112 Å²	112	126 Å²	126	69%	0.687	74%	0.741	S	S	*	*				-175.8	120.4	64.8	-51.8	0	0	0	0	115.7
1151	I	33.1	Very low	31.7	Very low	157 Å²	157	126.7 Å²	126.7	81%	0.805	75%	0.745	S	S	*	*			trans	51.6	151.2	142.4	-56.6	173.9	0	0	0	120.2
1152	A	30.7	Very low	32	Very low	81 Å²	81	124.9 Å²	124.9	67%	0.669	74%	0.743	S	S	*	*			cis	179.2	-170.4	-29.3	0	0	0	0	0	106.6
1153	T	33.2	Very low	31.8	Very low	128 Å²	128	127.9 Å²	127.9	79%	0.785	75%	0.748	S	S	*	*			cis	-158.1	-171.4	2.9	-22.8	0	0	0	0	110
1154	T	30.9	Very low	31.8	Very low	128 Å²	128	128 Å²	128	79%	0.785	75%	0.746	S	S	*	*			trans	-138.7	-168	175.4	57.8	0	0	0	0	109.5
1155	P	36.7	Very low	31.6	Very low	106 Å²	106	133 Å²	133	69%	0.688	76%	0.759	S	S	*	*			cis	-145.4	172.9	5.8	44.9	-24.3	0	0	0	120
1156	T	30.8	Very low	31.4	Very low	124 Å²	124	135.4 Å²	135.4	76%	0.761	76%	0.761	S	S	*	*			trans	32.1	152.1	145.4	-30.9	0	0	0	0	125.6
1157	T	32	Very low	31.1	Very low	120 Å²	120	134.5 Å²	134.5	74%	0.736	76%	0.757	S	S	*	*			trans	110.2	124.5	134.4	9.5	0	0	0	0	123.6
1158	T	29.6	Very low	31.1	Very low	113 Å²	113	134.8 Å²	134.8	69%	0.693	76%	0.76	S	S	*	*			trans	87.6	103.2	134.9	-59.5	0	0	0	0	124.1
1159	I	26.9	Very low	30.9	Very low	146 Å²	146	134.7 Å²	134.7	75%	0.749	76%	0.763	S	S	*	*				45.7	121.9	128.8	-52.7	172.4	0	0	0	120.8
1160	R	31	Very low	30.9	Very low	246 Å²	246	132.8 Å²	132.8	93%	0.928	77%	0.767	S	S	*	*				-164.6	141.6	120.3	-107.8	171.5	-167.6	-165.1	3.1	113.5
1161	S	26.5	Very low	30.7	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	77%	0.771	S	S	*	*			trans	-96.8	143.9	-178.8	-41.5	0	0	0	0	112
1162	I	33.6	Very low	30.6	Very low	160 Å²	160	130.8 Å²	130.8	82%	0.821	77%	0.771	S	S	*	*			trans	-131.2	139.5	161.1	-62.2	-178.5	0	0	0	107.8	I1164	I1162-I1164 HydrophobicContact CG2-CD1 4.44Å; I1162-I1164 HydrophobicContact CG2-CG1 4.3Å
1163	N	26.3	Very low	30.5	Very low	144 Å²	144	131.2 Å²	131.2	77%	0.77	77%	0.77	S	S	*	*			trans	-136.4	121.4	-173.7	178.9	-2.2	0	0	0	108.5
1164	I	32	Very low	30.3	Very low	150 Å²	150	130.3 Å²	130.3	77%	0.769	76%	0.764	S	S	*	*			trans	-131.9	124	179.2	-62	-177.9	0	0	0	109	I1162	I1162-I1164 HydrophobicContact CG2-CD1 4.44Å; I1162-I1164 HydrophobicContact CG2-CG1 4.3Å
1165	K	25.2	Very low	30.1	Very low	178 Å²	178	131.6 Å²	131.6	77%	0.774	76%	0.764	S	S	*	*			trans	-86.8	149.9	173.6	-58.3	172.8	176.8	178.7	0	110.4
1166	Q	30.7	Very low	29.8	Very low	186 Å²	186	131.9 Å²	131.9	87%	0.869	77%	0.769	S	S	*	*			trans	163.5	151.5	138.9	-92.8	159.3	18.8	0	0	109.1
1167	S	30.7	Very low	29.4	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	77%	0.773	S	S	*	*			cis	-173.6	172.9	-23.9	46	0	0	0	0	109.3
1168	S	32.9	Very low	29.3	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	78%	0.776	S	S	*	*			trans	74.2	151.5	168.2	78	0	0	0	0	117.8
1169	S	30.7	Very low	29	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	78%	0.78	S	S	*	*				-174.9	140.8	-51.1	43.3	0	0	0	0	111.2
1170	G	31.7	Very low	29	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	78%	0.784	S	S	*	*			trans	91.6	149.8	168	0	0	0	0	0	114.3
1171	S	30.5	Very low	28.6	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	78%	0.775	S	S	*	*			cis	-166.7	139.3	-8.9	49.9	0	0	0	0	111.5
1172	S	29.7	Very low	28.6	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	78%	0.776	S	S	*	*			trans	59.9	150.2	150.3	-67.8	0	0	0	0	119.9
1173	S	29.6	Very low	28.3	Very low	91 Å²	91	129.4 Å²	129.4	64%	0.636	77%	0.773	S	S	*	*			cis	-169.7	161.1	-15	47.7	0	0	0	0	110.7
1174	T	29.3	Very low	28.5	Very low	109 Å²	109	127.2 Å²	127.2	67%	0.669	77%	0.767	S	S	*	*			trans	44.7	110.3	145.3	54.8	0	0	0	0	119.1
1175	I	26.4	Very low	28.4	Very low	155 Å²	155	128.1 Å²	128.1	80%	0.795	77%	0.774	S	S	*	*				59.1	105.9	93.7	-59.7	163.2	0	0	0	113.7
1176	S	28.9	Very low	29	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	76%	0.764	S	S	*	*				174	144.1	127	-75.2	0	0	0	0	110.8
1177	T	22.8	Very low	29.3	Very low	138 Å²	138	123.2 Å²	123.2	85%	0.847	76%	0.756	S	S	*	*			trans	-73.2	151.8	156.9	41.6	0	0	0	0	109.4
1178	P	29.9	Very low	29.3	Very low	124 Å²	124	124 Å²	124	81%	0.805	76%	0.759	S	S	*	*				-145.1	163.9	107.8	38.5	-24.9	0	0	0	115.1
1179	T	23	Very low	29.1	Very low	125 Å²	125	123.3 Å²	123.3	77%	0.767	75%	0.746	S	S	*	*			trans	-73.1	144.1	165.2	-48.5	0	0	0	0	111.2
1180	I	27.3	Very low	29	Very low	166 Å²	166	127.2 Å²	127.2	85%	0.851	75%	0.752	S	S	*	*			trans	-178.8	160.1	134.3	-94.4	156.4	0	0	0	110.9
1181	T	23.2	Very low	28.8	Very low	119 Å²	119	130 Å²	130	73%	0.73	75%	0.747	S	S	*	*			trans	-101.3	-176.1	-162.2	-43.5	0	0	0	0	113
1182	I	26	Very low	28.6	Very low	160 Å²	160	132.9 Å²	132.9	82%	0.821	75%	0.748	S	S	*	*			trans	93.2	134	164.2	-57.6	168.4	0	0	0	114.3
1183	N	27.8	Very low	28.8	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	75%	0.748	S	S	*	*			cis	-163.1	165.9	-18.7	-173.9	34.9	0	0	0	111.8
1184	C	29.3	Very low	28.7	Very low	97 Å²	97	133.9 Å²	133.9	66%	0.655	75%	0.752	S	S	*	*			trans	-7.5	143.5	169.9	-73.2	0	0	0	0	122.7
1185	N	31.3	Very low	28.6	Very low	170 Å²	170	134.1 Å²	134.1	91%	0.909	76%	0.759	S	S	*	*				-148.6	154.7	108.9	-109.7	-23.1	0	0	0	112.9
1186	R	37	Very low	28.8	Very low	151 Å²	151	133 Å²	133	57%	0.57	75%	0.754	S	S	*	*			trans	-157.4	165.9	-167.2	-148.4	-177.1	-177.6	-72.7	-2.8	110.7	P1188	R1186-P1188 VanDerWaalsContact NH1-CA 3.32Å; R1186-P1188 PolarHBondContact NH1-O 3.31Å
1187	P	36.7	Very low	28.7	Very low	109 Å²	109	129.4 Å²	129.4	71%	0.708	72%	0.724	S	S	*	*				-148.3	-162.1	110.1	38.4	-20.2	0	0	0	113.7
1188	P	31.2	Very low	29.1	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	72%	0.72	S	S	*	*				-89	157.4	-95.7	32.8	-18.1	0	0	0	112.6	R1186	R1186-P1188 VanDerWaalsContact NH1-CA 3.32Å; R1186-P1188 PolarHBondContact NH1-O 3.31Å
1189	I	28.4	Very low	28.9	Very low	98 Å²	98	128.5 Å²	128.5	50%	0.503	71%	0.709	S	S	.	*			cis	62.5	104.1	16.7	-80	171.2	0	0	0	115.7	I1191	I1189-I1191 HydrophobicContact CD1-CD1 4.17Å; I1189-I1191 HydrophobicContact CG1-CD1 4.27Å; I1189-I1191 HydrophobicContact CG2-CD1 4Å; I1189-I1191 HydrophobicContact CG2-CG1 4.06Å
1190	E	28.7	Very low	29.4	Very low	197 Å²	197	128.8 Å²	128.8	92%	0.921	71%	0.711	S	S	*	*			trans	-112.7	137.2	142.3	-65.5	-174.8	141.6	0	0	107.6
1191	I	28.2	Very low	29.6	Very low	133 Å²	133	127.1 Å²	127.1	68%	0.682	71%	0.709	S	S	*	*			trans	-142.1	147.9	179.1	-74.3	173.8	0	0	0	107.4	I1189	I1189-I1191 HydrophobicContact CD1-CD1 4.17Å; I1189-I1191 HydrophobicContact CG1-CD1 4.27Å; I1189-I1191 HydrophobicContact CG2-CD1 4Å; I1189-I1191 HydrophobicContact CG2-CG1 4.06Å
1192	H	26.9	Very low	29.9	Very low	170 Å²	170	126.9 Å²	126.9	79%	0.787	71%	0.707	S	S	*	*			trans	-42.1	136.6	173	-92.5	-93.4	0	0	0	114.6
1193	P	33.4	Very low	30.3	Very low	125 Å²	125	125.5 Å²	125.5	81%	0.812	71%	0.709	S	S	*	*			trans	-96.5	119.1	154.3	33.3	-26.3	0	0	0	111.1
1194	S	28.1	Very low	30.3	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	71%	0.709	S	S	*	*			trans	-110.9	133	162.1	-61.4	0	0	0	0	109.4
1195	S	27.1	Very low	30.5	Very low	115 Å²	115	124.1 Å²	124.1	80%	0.804	71%	0.712	S	S	*	*			trans	38.9	107.6	158.1	-57.7	0	0	0	0	120.5
1196	L	30	Very low	30.4	Very low	132 Å²	132	124.3 Å²	124.3	69%	0.691	71%	0.709	S	S	*	*			trans	-166.2	136.6	156.2	-111.7	167.1	0	0	0	112.7	K400	K400-L1196 WeakPolarHBondContact CE-O 3.36Å
1197	H	27.3	Very low	30.2	Very low	34 Å²	34	123.6 Å²	123.6	16%	0.157	72%	0.715	C	S	.	*			trans	-85.8	148.7	174.4	-144.2	-2.2	0	0	0	112	D399 K400 S401 T1199	D399-H1197 IonicContact OD2-CE1 3.92Å; D399-H1197 IonicContact OD2-ND1 3.97Å; K400-H1197 VanDerWaalsContact CB-CA 3.45Å; K400-H1197 HydrophobicContact CB-CB 3.24Å; K400-H1197 HydrophobicContact CG-CB 4.21Å; K400-H1197 PolarHBondContact O-CD2 2.75Å; S401-H1197 VanDerWaalsContact CA-CB 3.48Å; S401-H1197 WeakPolarHBondContact OG-CB 3.46Å; S401-H1197 PolarHBondContact OG-N 2.6Å; H1197-T1199 PolarHBondContact CD2-OG1 3.16Å; H1197-T1199 PolarHBondContact NE2-OG1 3.42Å
1198	I	30.5	Very low	29.8	Very low	149 Å²	149	125.3 Å²	125.3	76%	0.764	72%	0.718	S	S	*	*				-124.8	141.6	129.2	-59.4	-178.7	0	0	0	106.9
1199	T	26	Very low	29.7	Very low	94 Å²	94	124.7 Å²	124.7	58%	0.577	72%	0.717	S	S	*	*			trans	-107.8	139.5	-177.8	-39.2	0	0	0	0	109.1	H1197	H1197-T1199 PolarHBondContact CD2-OG1 3.16Å; H1197-T1199 PolarHBondContact NE2-OG1 3.42Å
1200	T	32.2	Very low	29.9	Very low	131 Å²	131	124.8 Å²	124.8	80%	0.804	73%	0.726	S	S	*	*			trans	-136.2	142.4	173.6	-27.5	0	0	0	0	111.2
1201	T	32	Very low	30	Very low	131 Å²	131	121.2 Å²	121.2	80%	0.804	72%	0.723	S	S	*	*			trans	-75.5	150.4	-163.6	47.7	0	0	0	0	115.4
1202	T	30	Very low	30.2	Very low	114 Å²	114	118.1 Å²	118.1	70%	0.699	72%	0.724	S	S	*	*			trans	-65	168.8	161.3	51.2	0	0	0	0	112.2
1203	P	33.8	Very low	30.4	Very low	131 Å²	131	117.3 Å²	117.3	85%	0.851	73%	0.725	S	S	*	*				-120.8	134.4	124.2	34.1	-31.7	0	0	0	112.1
1204	S	28.6	Very low	30.1	Very low	106 Å²	106	117.1 Å²	117.1	74%	0.741	72%	0.722	S	S	*	*			trans	-88.7	144	175.8	-48.7	0	0	0	0	111.5
1205	S	32.5	Very low	30.3	Very low	103 Å²	103	117.9 Å²	117.9	72%	0.72	72%	0.723	S	S	*	*			trans	177.5	133.7	130.7	57.6	0	0	0	0	113.5
1206	M	29.2	Very low	30.4	Very low	173 Å²	173	117.5 Å²	117.5	85%	0.852	72%	0.716	S	S	*	*			trans	59.8	145	134.5	-65	-179.4	-178.2	0	0	119.5
1207	I	32.5	Very low	30.4	Very low	137 Å²	137	119.2 Å²	119.2	70%	0.703	72%	0.724	S	S	*	*			cis	-151.5	121.4	0.9	-110.5	156.4	0	0	0	104.7
1208	N	28.8	Very low	30.5	Very low	144 Å²	144	123.4 Å²	123.4	77%	0.77	75%	0.746	S	S	*	*				55.6	111.3	91.3	-146.2	25.6	0	0	0	115.3
1209	S	30.1	Very low	30.6	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	75%	0.749	S	S	*	*			trans	148.2	140.3	133.8	-64	0	0	0	0	117.2
1210	S	31.9	Very low	30.8	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	76%	0.757	S	S	*	*			trans	57.8	97.8	139.2	64.7	0	0	0	0	122.6
1211	S	30.3	Very low	30.5	Very low	122 Å²	122	129.2 Å²	129.2	85%	0.853	76%	0.762	S	S	*	*				41.4	130.8	116.3	65.2	0	0	0	0	122.2
1212	G	32.2	Very low	30.2	Very low	68 Å²	68	128.3 Å²	128.3	70%	0.701	76%	0.756	S	S	*	*			trans	157.4	108.5	145.1	0	0	0	0	0	119.3
1213	N	31.1	Very low	30.2	Very low	153 Å²	153	129.5 Å²	129.5	82%	0.818	76%	0.763	S	S	*	*			trans	54	105.5	131.1	-65.4	1.3	0	0	0	123.3
1214	T	28.7	Very low	30	Very low	121 Å²	121	128.9 Å²	128.9	74%	0.742	76%	0.757	S	S	*	*				79.3	147.2	119.8	-35.8	0	0	0	0	121.4
1215	T	31	Very low	29.8	Very low	119 Å²	119	130 Å²	130	73%	0.73	76%	0.759	S	S	*	*			trans	87.1	99.7	160.1	-27.3	0	0	0	0	115.1
1216	T	28.8	Very low	29.7	Very low	107 Å²	107	131.9 Å²	131.9	66%	0.656	77%	0.766	S	S	*	*				77.2	103.2	64.6	-55.2	0	0	0	0	115.4
1217	I	31.5	Very low	29.6	Very low	168 Å²	168	130.2 Å²	130.2	86%	0.862	77%	0.766	S	S	*	*			trans	-162.2	110.5	145.3	-83.8	133.3	0	0	0	103.2
1218	L	28.2	Very low	29.4	Very low	121 Å²	121	130.7 Å²	130.7	63%	0.634	78%	0.776	S	S	*	*			cis	87.4	85.5	31.4	-140.3	-175.7	0	0	0	114.4	K1220	L1218-K1220 HydrophobicContact CD2-CG 4.44Å
1219	N	33.2	Very low	29.3	Very low	152 Å²	152	129.5 Å²	129.5	81%	0.813	78%	0.779	S	S	*	*			trans	-160.6	94.9	148.2	-96.7	-29.6	0	0	0	108.9
1220	K	29.9	Very low	29.3	Very low	172 Å²	172	129.9 Å²	129.9	75%	0.748	78%	0.781	S	S	*	*				62.3	94.9	91.3	-92.8	-170.1	170.5	-177.7	0	115.7	L1218	L1218-K1220 HydrophobicContact CD2-CG 4.44Å
1221	L	25.7	Very low	29.1	Very low	173 Å²	173	132.1 Å²	132.1	91%	0.906	79%	0.791	S	S	*	*				-137.2	154.9	118.7	-141.1	82.6	0	0	0	108.7
1222	T	26.4	Very low	29.2	Very low	112 Å²	112	132.8 Å²	132.8	69%	0.687	78%	0.784	S	S	*	*			trans	-147.8	126.8	-174.8	-53.1	0	0	0	0	110
1223	V	29.2	Very low	29.1	Very low	139 Å²	139	133.5 Å²	133.5	84%	0.842	78%	0.776	S	S	*	*			trans	-136.3	133.2	163.1	-177.3	0	0	0	0	107.9
1224	T	30.1	Very low	29.2	Very low	117 Å²	117	132.8 Å²	132.8	72%	0.718	78%	0.777	S	S	*	*			trans	-87.1	153	-172.4	-45.1	0	0	0	0	111.7
1225	T	25.3	Very low	29.4	Very low	130 Å²	130	134 Å²	134	80%	0.798	78%	0.779	S	S	*	*			trans	-68.1	137.4	171.7	38	0	0	0	0	113.1
1226	T	29.6	Very low	29.6	Very low	142 Å²	142	133.8 Å²	133.8	87%	0.871	77%	0.772	S	S	*	*			trans	-139.7	137.8	153.1	40.5	0	0	0	0	109.4
1227	T	26.3	Very low	29.7	Very low	138 Å²	138	135.9 Å²	135.9	85%	0.847	78%	0.778	S	S	*	*			trans	-85.3	132.6	-170.1	49.5	0	0	0	0	114
1228	T	29.4	Very low	29.8	Very low	147 Å²	147	133.9 Å²	133.9	90%	0.902	76%	0.76	S	S	*	*			trans	-151	147.5	147.8	23.4	0	0	0	0	110.1
1229	S	25.8	Very low	30	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	77%	0.768	S	S	*	*			trans	-89	126.2	-174.3	53.2	0	0	0	0	113.5
1230	S	29.8	Very low	29.8	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.771	S	S	*	*			trans	-158.6	144	154.2	55.7	0	0	0	0	111.2
1231	T	29.1	Very low	29.8	Very low	148 Å²	148	135.7 Å²	135.7	91%	0.908	77%	0.769	S	S	*	*			trans	-69.6	136.7	-177.1	-37	0	0	0	0	112.2
1232	I	31	Very low	30	Very low	136 Å²	136	132.1 Å²	132.1	70%	0.697	76%	0.756	S	S	*	*			trans	-127.6	135.2	173.6	-60	178.7	0	0	0	107.8
1233	P	31.7	Very low	30.3	Very low	82 Å²	82	136.7 Å²	136.7	53%	0.532	77%	0.766	S	S	.	*			trans	-70.2	143.7	177	-14.8	30	0	0	0	112.1	D1235	P1233-D1235 PolarHBondContact O-N 3.17Å
1234	T	32.7	Very low	30.2	Very low	139 Å²	139	137.7 Å²	137.7	85%	0.853	77%	0.766	S	S	*	*			trans	-85.2	92.5	175.9	-29.4	0	0	0	0	110.2
1235	D	32	Very low	30	Very low	145 Å²	145	141 Å²	141	78%	0.775	79%	0.794	S	S	*	*			trans	-63.5	136.7	170.8	-78.5	-46.2	0	0	0	110.8	P1233 I1237	P1233-D1235 PolarHBondContact O-N 3.17Å; D1235-I1237 PolarHBondContact O-N 3.23Å
1236	I	35.1	Very low	30.2	Very low	115 Å²	115	141.6 Å²	141.6	59%	0.59	79%	0.794	S	S	*	*			trans	-78.9	114.4	-169.7	-59.6	178	0	0	0	110.6	Y1238	I1236-Y1238 HydrophobicContact CG2-CD2 3.82Å
1237	I	30.6	Very low	30.3	Very low	151 Å²	151	141.5 Å²	141.5	77%	0.774	79%	0.79	S	S	*	*			trans	-109.3	96.7	168.5	-56.8	177.9	0	0	0	108.7	D1235	D1235-I1237 PolarHBondContact O-N 3.23Å
1238	Y	34.9	Very low	30.5	Very low	126 Å²	126	141.7 Å²	141.7	49%	0.494	79%	0.787	S	S	.	*			trans	-123.6	134.7	163.3	-81	-70.7	0	0	0	111.9	S467 I1236	S467-Y1238 VanDerWaalsContact C-OH 3.32Å; S467-Y1238 WeakPolarHBondContact CA-OH 3.17Å; S467-Y1238 WeakPolarHBondContact CB-OH 2.9Å; S467-Y1238 PolarHBondContact O-OH 3.27Å; S467-Y1238 VanDerWaalsContact OG-CE1 3.25Å; S467-Y1238 WeakPolarHBondContact OG-CE1 3.39Å; I1236-Y1238 HydrophobicContact CG2-CD2 3.82Å
1239	A	31.8	Very low	30.6	Very low	96 Å²	96	141.4 Å²	141.4	79%	0.793	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-76.9	137.3	-172.8	0	0	0	0	0	111.5	R1241	A1239-R1241 PolarHBondContact O-N 3.38Å
1240	K	30.2	Very low	30.9	Very low	201 Å²	201	142.8 Å²	142.8	87%	0.874	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-57.4	120.3	169.6	-72.9	-176.7	173.2	-175.3	0	110.1
1241	R	29.3	Very low	30.9	Very low	186 Å²	186	145.2 Å²	145.2	70%	0.702	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72	126	151.5	-73.3	-169.3	-178.2	-160.2	4.6	108.1	E463 A1239	E463-R1241 IonicContact OE1-CZ 2.63Å; E463-R1241 IonicContact OE1-NE 3.62Å; E463-R1241 IonicContact OE1-NH2 3.19Å; E463-R1241 PolarHBondContact OE1-NH2 3.36Å; E463-R1241 IonicContact OE2-CZ 3.41Å; E463-R1241 IonicContact OE2-NH2 3.65Å; E463-R1241 PolarHBondContact OE2-NH2 3.47Å; A1239-R1241 PolarHBondContact O-N 3.38Å
1242	P	30.4	Very low	31	Very low	99 Å²	99	145 Å²	145	64%	0.643	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.7	137.6	163.6	29.8	-32.1	0	0	0	109
1243	K	30.8	Very low	31.1	Very low	207 Å²	207	145.7 Å²	145.7	90%	0.9	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.4	132.4	160.2	-74.9	-171.4	173.9	-173	0	107.7
1244	L	27.2	Very low	31	Very low	161 Å²	161	151 Å²	151	84%	0.843	80%	0.795	S	S	*	*			trans	-137.9	50	-173.3	-137	167.9	0	0	0	111.4
1245	S	26.9	Very low	30.8	Very low	186 Å²	186	152.1 Å²	152.1	100%	1.301	79%	0.79	S	S	*	*			trans	-162.8	0	161.5	62.2	0	0	0	0	107.2

Retrieved 1,245 of 1,245 residues in 1475 ms (Link to these results)

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