A0A087XP58_POEFO Loading...

Pumilio homolog 1

AlphaFold DB , UniProt , Accession A0A087XP58, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 650 aa.

Structure Viewer

Loading PAE data...

(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	32.6	Very low	31.5	Very low	233 Å²	233	149 Å²	149	100%	1.148	80%	0.802	S	S	*	*				0	111.7	0	-61.3	178.1	-178.2	0	0	105.9
2	L	32.2	Very low	31.7	Very low	178 Å²	178	146.5 Å²	146.5	93%	0.932	80%	0.8	S	S	*	*				56	112.9	76.4	-66.1	170	0	0	0	111
3	G	29.2	Very low	31.7	Very low	66 Å²	66	146.4 Å²	146.4	68%	0.68	81%	0.806	S	S	*	*			cis	178	168.6	-6.4	0	0	0	0	0	112.4
4	L	32.9	Very low	31.9	Very low	148 Å²	148	147.9 Å²	147.9	78%	0.775	81%	0.811	S	S	*	*			trans	32.9	135.1	146.4	-61.7	155	0	0	0	119
5	F	30.9	Very low	32.1	Very low	185 Å²	185	143.7 Å²	143.7	81%	0.811	80%	0.804	S	S	*	*			cis	-147.9	147.8	47.3	-82.5	-102.4	0	0	0	113.9
6	S	30.2	Very low	32.4	Very low	77 Å²	77	142.8 Å²	142.8	54%	0.538	81%	0.806	S	S	.	*				3.7	153.2	120.9	12.6	0	0	0	0	119.2
7	H	29.6	Very low	32.7	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.745	80%	0.799	S	S	*	*			cis	-169.3	167.6	19.6	-126.2	11.9	0	0	0	113.3
8	F	29.1	Very low	33.3	Very low	189 Å²	189	135.1 Å²	135.1	83%	0.829	78%	0.784	S	S	*	*			trans	75	136.9	155.4	-85.4	-70.9	0	0	0	124.5
9	S	37.7	Very low	34	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	78%	0.781	S	S	*	*			trans	-89.8	153.7	171.6	177.5	0	0	0	0	111.4
10	G	29.2	Very low	34.8	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	77%	0.771	S	S	*	*			trans	-129.2	133.2	-177.5	0	0	0	0	0	113.8
11	Y	33.2	Very low	36.4	Very low	221 Å²	221	135.3 Å²	135.3	87%	0.867	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.1	164.2	179.1	-84.4	-100.3	0	0	0	113.1
12	P	33.3	Very low	36.8	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-65.4	146.7	-179.9	27.1	-36.3	0	0	0	113.7
13	V	32	Very low	37.8	Very low	145 Å²	145	131.6 Å²	131.6	88%	0.879	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-78	119.3	-180	177.9	0	0	0	0	110.8
14	L	34.2	Very low	38.6	Very low	167 Å²	167	130.9 Å²	130.9	87%	0.874	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-75.2	132.2	165.6	-88.8	156.9	0	0	0	110.3
15	A	35.1	Very low	39.2	Very low	85 Å²	85	126 Å²	126	70%	0.702	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-72	149.1	171.8	0	0	0	0	0	111.2
16	P	36.3	Very low	39.8	Very low	130 Å²	130	121.5 Å²	121.5	84%	0.844	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.1	179.4	28.4	-34.1	0	0	0	111.5
17	A	37.5	Very low	40.9	Very low	82 Å²	82	122.7 Å²	122.7	68%	0.678	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-72.4	127.4	174.7	0	0	0	0	0	110.9	Y19	A17-Y19 HydrophobicContact CB-CE2 4.44Å
18	A	43.6	Very low	41.8	Very low	65 Å²	65	120.4 Å²	120.4	54%	0.537	70%	0.696	S	S	.	*	P	Polyproline II helix	trans	-84.1	132	169.7	0	0	0	0	0	110.3	L26	A18-L26 HydrophobicContact CB-CD1 3.73Å
19	Y	46.4	Very low	42.1	Very low	186 Å²	186	118.2 Å²	118.2	73%	0.729	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-100.3	140	174	-80	-94.2	0	0	0	110.8	A17 V27	A17-Y19 HydrophobicContact CB-CE2 4.44Å; Y19-V27 PolarHBondContact O-N 2.96Å
20	Y	51.6	Low	42	Very low	148 Å²	148	119.4 Å²	119.4	58%	0.58	70%	0.696	S	S	*	*	B	Isolated β-bridge	trans	-110	145	172.4	-69.3	-92.2	0	0	0	109.4	G24 A25 L26	Y20-G24 WeakPolarHBondContact CD1-O 3.43Å; Y20-A25 WeakPolarHBondContact CA-O 3.41Å; Y20-L26 HydrophobicContact CD1-CB 4.19Å; Y20-L26 HydrophobicContact CD1-CD1 4.45Å; Y20-L26 HydrophobicContact CE1-CB 3.84Å; Y20-L26 HydrophobicContact CE1-CD1 3.75Å; Y20-L26 HydrophobicContact CE1-CG 4.42Å; Y20-L26 HydrophobicContact CE2-CD1 3.9Å; Y20-L26 VanDerWaalsContact CZ-CD1 3.44Å; Y20-L26 WeakPolarHBondContact OH-CD1 3.36Å
21	D	67.4	Low	42	Very low	75 Å²	75	118.9 Å²	118.9	40%	0.401	69%	0.691	S	S	.	*			trans	-80.4	178.4	171.1	71	21.1	0	0	0	112.5	T23 G24 A25	D21-T23 PolarHBondContact O-N 2.87Å; D21-T23 VanDerWaalsContact OD1-CA 3.31Å; D21-T23 WeakPolarHBondContact OD1-CA 3.15Å; D21-T23 WeakPolarHBondContact OD1-CB 3.44Å; D21-T23 PolarHBondContact OD1-N 3.19Å; D21-T23 PolarHBondContact OD1-OG1 3.49Å; D21-T23 PolarHBondContact OD2-OG1 3.46Å; D21-G24 PolarHBondContact O-N 3.07Å; D21-G24 PolarHBondContact OD1-N 3.16Å; D21-A25 PolarHBondContact N-O 2.86Å; D21-A25 PolarHBondContact OD1-N 3.32Å
22	Q	40.3	Very low	41.8	Very low	210 Å²	210	112.9 Å²	112.9	98%	0.981	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-5.9	179.5	-69.1	-177.6	-7.9	0	0	114.2
23	T	53.6	Low	41.7	Very low	123 Å²	123	118.8 Å²	118.8	76%	0.755	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-1.3	173.9	67	0	0	0	0	113.3	D21	D21-T23 PolarHBondContact O-N 2.87Å; D21-T23 VanDerWaalsContact OD1-CA 3.31Å; D21-T23 WeakPolarHBondContact OD1-CA 3.15Å; D21-T23 WeakPolarHBondContact OD1-CB 3.44Å; D21-T23 PolarHBondContact OD1-N 3.19Å; D21-T23 PolarHBondContact OD1-OG1 3.49Å; D21-T23 PolarHBondContact OD2-OG1 3.46Å
24	G	47	Very low	41.6	Very low	51 Å²	51	118.1 Å²	118.1	53%	0.526	70%	0.695	S	S	.	*			trans	83.2	17.8	177.3	0	0	0	0	0	114.6	Y20 D21	Y20-G24 WeakPolarHBondContact CD1-O 3.43Å; D21-G24 PolarHBondContact O-N 3.07Å; D21-G24 PolarHBondContact OD1-N 3.16Å
25	A	45.4	Very low	41.5	Very low	46 Å²	46	113.1 Å²	113.1	38%	0.38	68%	0.684	S	S	.	*			trans	-86.3	139	173.8	0	0	0	0	0	111.9	Y20 D21	Y20-A25 WeakPolarHBondContact CA-O 3.41Å; D21-A25 PolarHBondContact N-O 2.86Å; D21-A25 PolarHBondContact OD1-N 3.32Å
26	L	44.2	Very low	41.5	Very low	91 Å²	91	115.6 Å²	115.6	48%	0.476	69%	0.693	S	S	.	*	B	Isolated β-bridge	trans	-87.9	113.8	-179.9	-172.2	113.7	0	0	0	110.3	A18 Y20 V28	A18-L26 HydrophobicContact CB-CD1 3.73Å; Y20-L26 HydrophobicContact CD1-CB 4.19Å; Y20-L26 HydrophobicContact CD1-CD1 4.45Å; Y20-L26 HydrophobicContact CE1-CB 3.84Å; Y20-L26 HydrophobicContact CE1-CD1 3.75Å; Y20-L26 HydrophobicContact CE1-CG 4.42Å; Y20-L26 HydrophobicContact CE2-CD1 3.9Å; Y20-L26 VanDerWaalsContact CZ-CD1 3.44Å; Y20-L26 WeakPolarHBondContact OH-CD1 3.36Å; L26-V28 HydrophobicContact CD2-CG2 3.81Å
27	V	53	Low	41.3	Very low	102 Å²	102	115.9 Å²	115.9	62%	0.618	69%	0.692	S	S	*	*			trans	-101.3	112.6	-176.3	-175.8	0	0	0	0	110.7	Y19	Y19-V27 PolarHBondContact O-N 2.96Å
28	V	46.8	Very low	41	Very low	113 Å²	113	123.6 Å²	123.6	69%	0.685	70%	0.704	S	S	*	*			trans	-103.9	118	174.8	-178.7	0	0	0	0	109.5	L26 T30	L26-V28 HydrophobicContact CD2-CG2 3.81Å; V28-T30 PolarHBondContact O-N 2.87Å
29	N	37.1	Very low	40.4	Very low	142 Å²	142	128.8 Å²	128.8	76%	0.759	72%	0.721	S	S	*	*			trans	-82.9	106.2	-174.7	-174	15.2	0	0	0	112.3	G31	N29-G31 PolarHBondContact O-N 3.13Å
30	T	34.6	Very low	39.5	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	73%	0.73	S	S	*	*			trans	-81.8	99.7	163.1	52.2	0	0	0	0	109.1	V28	V28-T30 PolarHBondContact O-N 2.87Å
31	G	30.1	Very low	38.6	Very low	61 Å²	61	126.3 Å²	126.3	63%	0.629	74%	0.74	S	S	*	*			trans	-78.5	153.4	-158.7	0	0	0	0	0	117.4	N29	N29-G31 PolarHBondContact O-N 3.13Å
32	A	27.9	Very low	36.9	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	76%	0.759	S	S	*	*			trans	-163.8	151	145.8	0	0	0	0	0	111.2
33	R	30.7	Very low	36.3	Very low	243 Å²	243	123.6 Å²	123.6	92%	0.917	75%	0.753	S	S	*	*			trans	82.1	102.7	166	-61.4	-177.7	166.5	176.5	-4.5	120.6
34	S	30.2	Very low	35.1	Very low	131 Å²	131	123.5 Å²	123.5	92%	0.916	76%	0.758	S	S	*	*				55.2	109.2	118.4	-175.5	0	0	0	0	121.4
35	G	33.3	Very low	34.2	Very low	62 Å²	62	127.2 Å²	127.2	64%	0.639	77%	0.77	S	S	*	*			trans	158.8	134.2	155.2	0	0	0	0	0	113.2
36	P	33.7	Very low	33.4	Very low	136 Å²	136	132.3 Å²	132.3	88%	0.883	79%	0.789	S	S	*	*			trans	-84.8	129.9	-179.9	32.7	-32.1	0	0	0	111.8
37	V	32.7	Very low	32.8	Very low	136 Å²	136	135.2 Å²	135.2	82%	0.824	80%	0.804	S	S	*	*			trans	-121	126.9	169.7	-174.5	0	0	0	0	109.5
38	R	31.6	Very low	31.5	Very low	245 Å²	245	135.9 Å²	135.9	93%	0.925	81%	0.813	S	S	*	*			trans	-86.3	112.5	-170.9	-165	-177.5	-165.8	-176.1	4.8	109.7
39	L	30.9	Very low	31	Very low	173 Å²	173	136.3 Å²	136.3	91%	0.906	82%	0.818	S	S	*	*			trans	-85	130.2	175	-73.6	171.3	0	0	0	111.1
40	M	27.4	Very low	30.6	Very low	188 Å²	188	135.5 Å²	135.5	93%	0.926	82%	0.824	S	S	*	*			trans	-107.4	121.4	175.6	-168.3	172.6	179.6	0	0	107.6
41	A	33.4	Very low	30.3	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-87.1	134.9	-173.4	0	0	0	0	0	112.1
42	P	31.9	Very low	30.3	Very low	124 Å²	124	135.6 Å²	135.6	81%	0.805	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-77.5	150.1	167.4	32.7	-32.9	0	0	0	111
43	A	27.3	Very low	30.4	Very low	104 Å²	104	140 Å²	140	86%	0.86	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-73	144.8	-173	0	0	0	0	0	113.6
44	S	27.8	Very low	30.3	Very low	122 Å²	122	132.7 Å²	132.7	85%	0.853	83%	0.828	S	S	*	*			trans	-116.2	126.2	167.1	47.3	0	0	0	0	110.4
45	V	27.2	Very low	30.2	Very low	129 Å²	129	133 Å²	133	78%	0.782	82%	0.824	S	S	*	*			trans	-99.4	133.1	172.8	175.4	0	0	0	0	108
46	I	30.2	Very low	29.9	Very low	152 Å²	152	134.1 Å²	134.1	78%	0.779	83%	0.827	S	S	*	*			trans	178.3	114.3	134.7	-91.7	156.2	0	0	0	111
47	I	30.3	Very low	29.6	Very low	153 Å²	153	132.4 Å²	132.4	79%	0.785	82%	0.824	S	S	*	*			trans	29.8	117.2	137.7	-45.3	177.6	0	0	0	118.9
48	S	27.4	Very low	29.4	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	82%	0.822	S	S	*	*			trans	-91.6	152.6	171.4	-39.2	0	0	0	0	113.4
49	P	35	Very low	29.2	Very low	121 Å²	121	123.4 Å²	123.4	79%	0.786	82%	0.817	S	S	*	*			trans	-111.8	159.2	154.4	36.1	-28	0	0	0	113.2
50	S	28.3	Very low	29.1	Very low	126 Å²	126	119.2 Å²	119.2	88%	0.881	81%	0.807	S	S	*	*			trans	79.9	95	162.1	-167.2	0	0	0	0	120.4
51	A	29.2	Very low	29.2	Very low	100 Å²	100	115.6 Å²	115.6	83%	0.826	80%	0.8	S	S	*	*				-144	150.1	128.1	0	0	0	0	0	106.6
52	A	30	Very low	29.1	Very low	97 Å²	97	116.2 Å²	116.2	80%	0.802	81%	0.805	S	S	*	*			cis	-142.2	-179	13	0	0	0	0	0	112.5
53	Q	29.3	Very low	28.8	Very low	189 Å²	189	114.1 Å²	114.1	88%	0.883	81%	0.806	S	S	*	*			trans	-81	157.2	-171.8	-56.8	141.5	-61.7	0	0	113.7
54	A	28.5	Very low	28.8	Very low	89 Å²	89	112.8 Å²	112.8	74%	0.736	80%	0.803	S	S	*	*				146.9	160.6	105.1	0	0	0	0	0	115.6
55	V	28.1	Very low	28.8	Very low	137 Å²	137	111.9 Å²	111.9	83%	0.83	80%	0.802	S	S	*	*			trans	91.2	102.3	159.8	-166.9	0	0	0	0	119.2
56	A	28.2	Very low	29	Very low	86 Å²	86	113.8 Å²	113.8	71%	0.711	81%	0.808	S	S	*	*			trans	55.6	109.4	137.5	0	0	0	0	0	122.9
57	A	27.8	Very low	28.9	Very low	99 Å²	99	110 Å²	110	82%	0.818	81%	0.807	S	S	*	*				50.9	138	111.8	0	0	0	0	0	123.2
58	A	27.7	Very low	28.8	Very low	95 Å²	95	106 Å²	106	79%	0.785	80%	0.803	S	S	*	*			trans	83.7	100.8	147	0	0	0	0	0	120.5
59	A	27.2	Very low	28.9	Very low	98 Å²	98	109.6 Å²	109.6	81%	0.81	81%	0.812	S	S	*	*				69.9	144.9	120.2	0	0	0	0	0	122.8
60	A	29.5	Very low	28.6	Very low	84 Å²	84	107.4 Å²	107.4	69%	0.694	81%	0.811	S	S	*	*			trans	70.5	95.6	148.4	0	0	0	0	0	120.1
61	S	29.4	Very low	28.6	Very low	113 Å²	113	105.6 Å²	105.6	79%	0.79	81%	0.813	S	S	*	*				29.3	137.5	117.4	61.1	0	0	0	0	121.9
62	A	30.3	Very low	28.6	Very low	106 Å²	106	104.4 Å²	104.4	88%	0.876	81%	0.81	S	S	*	*			trans	69	146	168.9	0	0	0	0	0	115.2
63	G	25.9	Very low	28.6	Very low	81 Å²	81	104 Å²	104	84%	0.835	81%	0.807	S	S	*	*			cis	128.3	116.2	3.9	0	0	0	0	0	110.9
64	G	26.5	Very low	28.8	Very low	76 Å²	76	103 Å²	103	78%	0.784	81%	0.807	S	S	*	*			trans	121.2	134.2	165.1	0	0	0	0	0	117.1
65	A	29.6	Very low	28.9	Very low	102 Å²	102	101.9 Å²	101.9	84%	0.843	81%	0.805	S	S	*	*			trans	57.7	126.7	157.8	0	0	0	0	0	119.4
66	N	29.9	Very low	29.9	Very low	169 Å²	169	100.8 Å²	100.8	90%	0.904	80%	0.801	S	S	*	*			cis	95.9	133.2	33.5	-168.9	42.7	0	0	0	114.3
67	G	29.2	Very low	30.2	Very low	73 Å²	73	105 Å²	105	75%	0.753	80%	0.804	S	S	*	*			trans	101.1	138.1	179.2	0	0	0	0	0	114.2
68	G	27.7	Very low	30.3	Very low	68 Å²	68	109.8 Å²	109.8	70%	0.701	80%	0.8	S	S	*	*			cis	165.5	172	-5.3	0	0	0	0	0	112.3
69	L	30.4	Very low	30.3	Very low	192 Å²	192	109.6 Å²	109.6	100%	1.005	80%	0.798	S	S	*	*			trans	73.8	137.4	171.6	-53.6	159.3	0	0	0	116.7
70	G	27.4	Very low	30.4	Very low	75 Å²	75	112.1 Å²	112.1	77%	0.773	80%	0.796	S	S	*	*			cis	175.9	169.1	-7	0	0	0	0	0	114.2
71	G	28.6	Very low	30.2	Very low	88 Å²	88	113.8 Å²	113.8	91%	0.907	80%	0.797	S	S	*	*			trans	81.1	139.6	169.6	0	0	0	0	0	116.8
72	G	29.6	Very low	30.1	Very low	75 Å²	75	113.4 Å²	113.4	77%	0.773	79%	0.794	S	S	*	*			cis	179	160.9	-6.6	0	0	0	0	0	113.3
73	A	30.4	Very low	30	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	80%	0.795	S	S	*	*			trans	50.3	100.3	160.6	0	0	0	0	0	121.2
74	N	33.8	Very low	30.2	Very low	167 Å²	167	122.2 Å²	122.2	89%	0.893	80%	0.796	S	S	*	*				175.5	137	98.9	-92.2	-27	0	0	0	112.4
75	G	29.9	Very low	31	Very low	67 Å²	67	123.6 Å²	123.6	69%	0.691	79%	0.791	S	S	*	*			trans	-91.8	-157.9	168.6	0	0	0	0	0	111.9
76	P	49.5	Very low	31	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	79%	0.787	S	S	*	*			cis	-128.9	152.1	26.4	12.7	13	0	0	0	117.7
77	F	33.3	Very low	31.1	Very low	176 Å²	176	124.9 Å²	124.9	77%	0.772	77%	0.774	S	S	*	*			trans	62.2	135.5	140.2	-69.1	-51.7	0	0	0	121.8
78	R	30.8	Very low	31.3	Very low	199 Å²	199	129.9 Å²	129.9	75%	0.751	78%	0.778	S	S	*	*			cis	-157.2	145.9	-9.4	-161.2	168.7	-174.2	154.3	-2.4	110.8
79	A	28.5	Very low	31.4	Very low	90 Å²	90	130.5 Å²	130.5	74%	0.744	78%	0.784	S	S	*	*			trans	-97.4	-146.6	169	0	0	0	0	0	110.9
80	M	28.5	Very low	31.2	Very low	152 Å²	152	124.8 Å²	124.8	75%	0.749	77%	0.772	S	S	*	*			trans	87.3	110	169	-67.7	-173.3	162.7	0	0	116
81	T	25.1	Very low	32.3	Very low	118 Å²	118	128 Å²	128	72%	0.724	78%	0.779	S	S	*	*				76.3	128.9	61.8	65.4	0	0	0	0	114.4
82	S	27.2	Very low	32.4	Very low	105 Å²	105	127.4 Å²	127.4	73%	0.734	77%	0.773	S	S	*	*				179.4	143.2	117.1	40.4	0	0	0	0	114.1
83	Q	28.8	Very low	32.6	Very low	189 Å²	189	127.8 Å²	127.8	88%	0.883	78%	0.777	S	S	*	*			trans	55.2	117.9	137.5	-66.9	173.3	-12.8	0	0	122.5
84	Q	30	Very low	32.7	Very low	183 Å²	183	128.8 Å²	128.8	86%	0.855	79%	0.785	S	S	*	*			trans	-48.3	160.2	141.7	-108.4	-179.9	-1.3	0	0	112.5
85	P	43.6	Very low	32.8	Very low	105 Å²	105	129.7 Å²	129.7	68%	0.682	79%	0.789	S	S	*	*				-152.9	175.2	61.3	42.8	-23	0	0	0	118.9
86	Q	29.4	Very low	32.8	Very low	164 Å²	164	130.3 Å²	130.3	77%	0.766	80%	0.795	S	S	*	*			trans	68.2	148.6	162.8	-72.8	174.8	-41.4	0	0	117
87	Q	31.9	Very low	31.9	Very low	134 Å²	134	128.4 Å²	128.4	63%	0.626	80%	0.796	S	S	*	*			cis	-153.7	150.9	9.6	-133.8	169.2	44.4	0	0	112.5
88	Q	32	Very low	31.8	Very low	178 Å²	178	125.4 Å²	125.4	83%	0.832	80%	0.797	S	S	*	*			trans	52	135.2	148.4	-75.9	164.1	10	0	0	123.1
89	G	30.3	Very low	31.7	Very low	81 Å²	81	121.3 Å²	121.3	84%	0.835	80%	0.799	S	S	*	*			trans	131.9	60.2	141	0	0	0	0	0	119.9
90	G	27.6	Very low	31.6	Very low	72 Å²	72	125.7 Å²	125.7	74%	0.742	80%	0.801	S	S	*	*			trans	-99.4	-171.7	147.2	0	0	0	0	0	110.1
91	P	48.8	Very low	31.8	Very low	142 Å²	142	128.3 Å²	128.3	92%	0.922	80%	0.804	S	S	*	*			cis	-118	-160.3	-2.5	42.5	-26.4	0	0	0	109.8
92	G	31.1	Very low	31.9	Very low	76 Å²	76	125.7 Å²	125.7	78%	0.784	80%	0.801	S	S	*	*			cis	165.3	161.6	19.7	0	0	0	0	0	107.8
93	G	34	Very low	32	Very low	84 Å²	84	125.8 Å²	125.8	87%	0.866	80%	0.802	S	S	*	*			trans	-102.7	162.8	-174.3	0	0	0	0	0	115
94	A	32.3	Very low	32	Very low	110 Å²	110	122.8 Å²	122.8	91%	0.909	80%	0.797	S	S	*	*			trans	-164.2	164.6	154.8	0	0	0	0	0	111.1
95	L	36.9	Very low	32.1	Very low	186 Å²	186	118.5 Å²	118.5	97%	0.974	79%	0.787	S	S	*	*			trans	-80.7	152	-172.2	-64.2	152.6	0	0	0	113.8
96	G	30.4	Very low	31.6	Very low	79 Å²	79	121 Å²	121	81%	0.814	79%	0.794	S	S	*	*			trans	154.5	116.6	153.7	0	0	0	0	0	118.3
97	G	29	Very low	31.9	Very low	73 Å²	73	117.5 Å²	117.5	75%	0.753	79%	0.787	S	S	*	*			trans	82	114.4	133.4	0	0	0	0	0	122
98	S	30.9	Very low	31.8	Very low	114 Å²	114	116.1 Å²	116.1	80%	0.797	79%	0.793	S	S	*	*			trans	59.6	115.7	142	54.6	0	0	0	0	122.6
99	S	29.2	Very low	31.8	Very low	113 Å²	113	112.3 Å²	112.3	79%	0.79	79%	0.786	S	S	*	*				34.5	126.1	127.7	-52.7	0	0	0	0	121.4
100	F	27.6	Very low	32.3	Very low	181 Å²	181	113.3 Å²	113.3	79%	0.794	78%	0.78	S	S	*	*				162.5	127.4	85.6	-155.1	-107.6	0	0	0	113.2
101	Y	32.3	Very low	32.8	Very low	207 Å²	207	117.6 Å²	117.6	81%	0.812	78%	0.78	S	S	*	*			trans	42.2	139.8	156.8	-82.5	-97.7	0	0	0	125.7
102	G	27.3	Very low	32.1	Very low	64 Å²	64	115.5 Å²	115.5	66%	0.66	77%	0.769	S	S	*	*			trans	172.9	83.3	157.3	0	0	0	0	0	111.9
103	S	29.1	Very low	32.3	Very low	107 Å²	107	117.4 Å²	117.4	75%	0.748	77%	0.77	S	S	*	*				71.7	120.7	107.2	66.8	0	0	0	0	114.9
104	T	27.4	Very low	32.4	Very low	125 Å²	125	118.7 Å²	118.7	77%	0.767	77%	0.766	S	S	*	*				-149.2	129.2	71.9	31.8	0	0	0	0	111.5
105	S	33.1	Very low	32.7	Very low	93 Å²	93	121.4 Å²	121.4	65%	0.65	76%	0.764	S	S	*	*				70.8	130.9	73.6	86.2	0	0	0	0	112.7
106	L	33.5	Very low	32.5	Very low	159 Å²	159	122.3 Å²	122.3	83%	0.832	76%	0.761	S	S	*	*			cis	-153.5	169.4	23.7	-87.9	118.8	0	0	0	108.7
107	S	34.9	Very low	32.6	Very low	90 Å²	90	123.4 Å²	123.4	63%	0.629	76%	0.756	S	S	*	*			cis	-170.3	-169.5	-9.5	56.7	0	0	0	0	110.1
108	S	30.3	Very low	32.9	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	76%	0.762	S	S	*	*			trans	80.8	147.3	153.8	-57	0	0	0	0	118.6
109	S	32.3	Very low	32.9	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	76%	0.759	S	S	*	*			cis	-167.7	139.3	-18.8	51.3	0	0	0	0	113
110	S	40.4	Very low	33.1	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	76%	0.762	S	S	*	*			trans	51	140.8	136.4	-56.5	0	0	0	0	121.8
111	Q	37.8	Very low	33.3	Very low	162 Å²	162	123.5 Å²	123.5	76%	0.757	77%	0.765	S	S	*	*			cis	-172.3	153.3	5.1	-122.3	176.5	64.6	0	0	113
112	S	35.3	Very low	33.3	Very low	99 Å²	99	122.4 Å²	122.4	69%	0.692	77%	0.767	S	S	*	*			trans	54.1	164.8	140.2	81.6	0	0	0	0	121.3
113	S	34.4	Very low	34.4	Very low	115 Å²	115	124.8 Å²	124.8	80%	0.804	77%	0.771	S	S	*	*			cis	-159.8	179.6	-6.7	33.1	0	0	0	0	110.9
114	S	36.5	Very low	34.5	Very low	112 Å²	112	122.9 Å²	122.9	78%	0.783	77%	0.768	S	S	*	*			trans	-120.1	165.9	-173.5	38.6	0	0	0	0	114.4
115	L	37.2	Very low	35.5	Very low	166 Å²	166	123.1 Å²	123.1	87%	0.869	77%	0.772	S	S	*	*			trans	167	128.5	146	-95.4	164.7	0	0	0	115
116	F	34.4	Very low	35.5	Very low	206 Å²	206	122.1 Å²	122.1	90%	0.904	78%	0.776	S	S	*	*				-176.9	163.8	121.6	-115.2	-83	0	0	0	113.7
117	S	32.8	Very low	35.5	Very low	102 Å²	102	120.2 Å²	120.2	71%	0.713	78%	0.776	S	S	*	*			trans	-70.9	171.9	-175.2	-147.7	0	0	0	0	113.8
118	Q	33.5	Very low	35.4	Very low	185 Å²	185	120 Å²	120	86%	0.864	78%	0.78	S	S	*	*			cis	-168.5	138.9	31.5	-171.1	174.3	9.8	0	0	114.7
119	G	30.7	Very low	35.5	Very low	72 Å²	72	119.9 Å²	119.9	74%	0.742	78%	0.779	S	S	*	*			trans	73.5	147.6	153.7	0	0	0	0	0	120.1
120	S	34	Very low	35.5	Very low	121 Å²	121	123.7 Å²	123.7	85%	0.846	79%	0.791	S	S	*	*			cis	-170.6	149.7	-14	44.5	0	0	0	0	111.7
121	A	31.2	Very low	34.9	Very low	104 Å²	104	122.3 Å²	122.3	86%	0.86	79%	0.793	S	S	*	*			trans	79.8	119.5	164.2	0	0	0	0	0	121.5
122	Q	34.2	Very low	34.6	Very low	185 Å²	185	124.5 Å²	124.5	86%	0.864	80%	0.8	S	S	*	*			trans	-75.7	-175.1	158.2	-83.6	177.2	-86.5	0	0	112.1
123	P	49.4	Very low	34.4	Very low	113 Å²	113	124.4 Å²	124.4	73%	0.734	80%	0.8	S	S	*	*			cis	-117.8	177.3	-19.4	17.4	7.4	0	0	0	110.8
124	G	30.6	Very low	34.3	Very low	67 Å²	67	127.8 Å²	127.8	69%	0.691	80%	0.803	S	S	*	*			cis	81	151.1	43.3	0	0	0	0	0	112.1
125	P	50.2	Low	35.1	Very low	131 Å²	131	127.9 Å²	127.9	85%	0.851	80%	0.801	S	S	*	*			cis	-142.5	167.4	-11.9	41.8	-24.4	0	0	0	116.8
126	G	31.7	Very low	34.8	Very low	72 Å²	72	125 Å²	125	74%	0.742	80%	0.801	S	S	*	*			trans	74.1	165.7	148.3	0	0	0	0	0	119.1
127	S	33	Very low	34.7	Very low	119 Å²	119	120.3 Å²	120.3	83%	0.832	79%	0.794	S	S	*	*			cis	-169.6	158.8	-14.8	-104.2	0	0	0	0	109.7
128	A	33.6	Very low	34.6	Very low	85 Å²	85	121 Å²	121	70%	0.702	80%	0.798	S	S	*	*			trans	57	104.1	159.9	0	0	0	0	0	117.6
129	S	32.2	Very low	34.5	Very low	103 Å²	103	116.6 Å²	116.6	72%	0.72	79%	0.788	S	S	*	*				83.9	159.6	67.7	76	0	0	0	0	114.7
130	L	32.1	Very low	34.5	Very low	177 Å²	177	121.7 Å²	121.7	93%	0.927	80%	0.797	S	S	*	*			trans	74.8	140	-170.7	-43.5	174.2	0	0	0	113.5
131	G	28.5	Very low	34.3	Very low	73 Å²	73	119.9 Å²	119.9	75%	0.753	80%	0.798	S	S	*	*			cis	149.6	139.8	-5.2	0	0	0	0	0	112.1
132	F	30.6	Very low	34.3	Very low	207 Å²	207	119.8 Å²	119.8	91%	0.908	80%	0.797	S	S	*	*			trans	87.8	132.2	161.9	-127.4	-112	0	0	0	121.6
133	S	30.8	Very low	34.1	Very low	98 Å²	98	116.3 Å²	116.3	69%	0.685	79%	0.793	S	S	*	*			trans	49.6	119.3	149.1	63.9	0	0	0	0	123.5
134	Q	33.9	Very low	33.1	Very low	186 Å²	186	119.4 Å²	119.4	87%	0.869	80%	0.803	S	S	*	*			trans	-80.3	177.2	141	-101.6	-158.2	-0.3	0	0	111.2
135	P	52.2	Low	33.1	Very low	113 Å²	113	119.2 Å²	119.2	73%	0.734	80%	0.801	S	S	*	*			cis	-128.2	162.2	-3.1	30	-10.5	0	0	0	115.2
136	A	30.9	Very low	32.3	Very low	106 Å²	106	117.8 Å²	117.8	88%	0.876	80%	0.8	S	S	*	*			trans	-142.6	151.1	156.7	0	0	0	0	0	110.4
137	S	33.2	Very low	32.4	Very low	108 Å²	108	120.6 Å²	120.6	76%	0.755	80%	0.803	S	S	*	*			trans	-90.5	162.5	-169.7	48.2	0	0	0	0	114
138	S	30.7	Very low	32.4	Very low	115 Å²	115	123.2 Å²	123.2	80%	0.804	81%	0.807	S	S	*	*			trans	66.2	153.9	165.4	74.4	0	0	0	0	117
139	S	31	Very low	32.2	Very low	94 Å²	94	123 Å²	123	66%	0.657	81%	0.814	S	S	*	*			cis	-169.4	161.4	-27.1	56	0	0	0	0	108.4
140	L	31.2	Very low	32.1	Very low	178 Å²	178	121.1 Å²	121.1	93%	0.932	81%	0.81	S	S	*	*			trans	67.4	132.7	163.2	-59.4	165.3	0	0	0	118.3
141	G	29.3	Very low	32	Very low	84 Å²	84	123.4 Å²	123.4	87%	0.866	81%	0.813	S	S	*	*			trans	164.2	85.8	172.8	0	0	0	0	0	112
142	A	30.9	Very low	32.1	Very low	101 Å²	101	123.3 Å²	123.3	84%	0.835	81%	0.812	S	S	*	*			trans	-106.3	139.2	-171.8	0	0	0	0	0	113.6
143	S	29	Very low	32.4	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	81%	0.812	S	S	*	*			trans	167.4	147.8	160.2	52.2	0	0	0	0	109.1
144	L	30.2	Very low	32.3	Very low	177 Å²	177	120.9 Å²	120.9	93%	0.927	82%	0.821	S	S	*	*			cis	-167.6	154.6	-14.1	-122.4	154.5	0	0	0	107.9
145	G	30.6	Very low	32.3	Very low	64 Å²	64	119.1 Å²	119.1	66%	0.66	82%	0.822	S	S	*	*			trans	102.9	98.9	172.3	0	0	0	0	0	114.2
146	A	32.8	Very low	31.3	Very low	101 Å²	101	118.3 Å²	118.3	84%	0.835	83%	0.826	S	S	*	*				68.5	124.7	87	0	0	0	0	0	112.5
147	T	33.1	Very low	31.4	Very low	131 Å²	131	120.1 Å²	120.1	80%	0.804	82%	0.82	S	S	*	*			cis	-146.7	165.9	46.9	49.8	0	0	0	0	115
148	L	34.1	Very low	31.4	Very low	173 Å²	173	119.3 Å²	119.3	91%	0.906	82%	0.815	S	S	*	*			trans	-1.1	134.8	160.2	-85.4	59	0	0	0	117.4
149	G	29.4	Very low	31.3	Very low	82 Å²	82	119.9 Å²	119.9	85%	0.845	82%	0.819	S	S	*	*			cis	120.1	138.2	28.4	0	0	0	0	0	109.1
150	G	30.5	Very low	31.2	Very low	62 Å²	62	119.4 Å²	119.4	64%	0.639	83%	0.829	S	S	*	*			cis	-177.2	-176.1	-3.9	0	0	0	0	0	111.6
151	F	29.5	Very low	30.9	Very low	225 Å²	225	114.8 Å²	114.8	99%	0.987	82%	0.824	S	S	*	*			trans	57.8	134.9	168.6	-65.9	-89	0	0	0	119
152	G	29.2	Very low	31.2	Very low	72 Å²	72	117.3 Å²	117.3	74%	0.742	83%	0.828	S	S	*	*			cis	164.7	114.7	-4.2	0	0	0	0	0	111.5
153	T	37.1	Very low	31.1	Very low	149 Å²	149	116.4 Å²	116.4	91%	0.914	83%	0.829	S	S	*	*			trans	-84.8	148.8	167.2	38.3	0	0	0	0	110.4
154	A	29.8	Very low	31.2	Very low	104 Å²	104	116.3 Å²	116.3	86%	0.86	83%	0.828	S	S	*	*			trans	-140.8	124.9	165.7	0	0	0	0	0	110.3
155	V	32.9	Very low	31.3	Very low	149 Å²	149	118.5 Å²	118.5	90%	0.903	82%	0.824	S	S	*	*			trans	-126.7	128.8	171.7	173.5	0	0	0	0	107.4
156	A	31.3	Very low	31.2	Very low	97 Å²	97	126 Å²	126	80%	0.802	83%	0.832	S	S	*	*			trans	-178.7	158.9	161.1	0	0	0	0	0	109.1
157	N	32.7	Very low	31	Very low	143 Å²	143	127.7 Å²	127.7	77%	0.765	83%	0.827	S	S	*	*			cis	-162.6	156.4	-36.4	-171.2	21.4	0	0	0	107.4
158	S	34.3	Very low	30.7	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	83%	0.832	S	S	*	*			trans	20	123.5	155.8	64.4	0	0	0	0	122.2
159	S	28.5	Very low	30.6	Very low	128 Å²	128	127.2 Å²	127.2	90%	0.895	83%	0.83	S	S	*	*				-174.3	144	123.7	54.3	0	0	0	0	111.1
160	G	27.9	Very low	30.7	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	83%	0.834	S	S	*	*			trans	-102.3	-173.2	-173.3	0	0	0	0	0	115.5
161	G	26.8	Very low	30.5	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	84%	0.837	S	S	*	*			trans	165	124.7	172.7	0	0	0	0	0	113
162	S	34.2	Very low	30.4	Very low	137 Å²	137	127.9 Å²	127.9	96%	0.958	83%	0.832	S	S	*	*			trans	-74.3	145.8	177.4	-55.9	0	0	0	0	112.7
163	G	28.8	Very low	30.4	Very low	82 Å²	82	128.6 Å²	128.6	85%	0.845	83%	0.825	S	S	*	*			trans	-156.8	112	170.8	0	0	0	0	0	111.5
164	S	32.5	Very low	30.1	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	82%	0.82	S	S	*	*			trans	-105.3	168.2	178.4	-174.9	0	0	0	0	110.9
165	R	31.1	Very low	30	Very low	224 Å²	224	130.1 Å²	130.1	85%	0.845	81%	0.807	S	S	*	*			trans	85	144.7	177.9	-49.7	166.1	-177.7	-168.4	-0.9	113.1
166	R	29	Very low	29.8	Very low	221 Å²	221	132.3 Å²	132.3	83%	0.834	80%	0.801	S	S	*	*			cis	-155.7	159	14.2	-145.2	169.5	-171.7	168.2	-1.3	112.5
167	D	27.5	Very low	29.6	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	81%	0.806	S	S	*	*			trans	-67.6	163.8	177.5	-46.7	-95.5	0	0	0	114.9
168	S	27.4	Very low	29.3	Very low	130 Å²	130	142.2 Å²	142.2	91%	0.909	81%	0.812	S	S	*	*			trans	-155.4	120.8	135.2	-79.4	0	0	0	0	111.6
169	L	32	Very low	28.9	Very low	165 Å²	165	144 Å²	144	86%	0.864	82%	0.819	S	S	*	*			trans	-106.3	130.6	171.3	-78.3	163.3	0	0	0	109.7
170	T	32.8	Very low	29.4	Very low	151 Å²	151	143.7 Å²	143.7	93%	0.926	82%	0.815	S	S	*	*			trans	-157.6	140.5	151.8	50	0	0	0	0	108.1
171	G	25	Very low	29.3	Very low	68 Å²	68	145.4 Å²	145.4	70%	0.701	81%	0.813	S	S	*	*			cis	150.5	113.1	-10.5	0	0	0	0	0	112.3
172	N	27.7	Very low	29.3	Very low	164 Å²	164	147.5 Å²	147.5	88%	0.877	82%	0.815	S	S	*	*			trans	64.8	157.7	160.5	-80	13.6	0	0	0	119.5
173	S	28.8	Very low	29	Very low	86 Å²	86	149.1 Å²	149.1	60%	0.601	81%	0.812	S	S	*	*			cis	-173.8	143	-13.3	46.7	0	0	0	0	112.4
174	E	31.5	Very low	29	Very low	172 Å²	172	151.8 Å²	151.8	80%	0.804	81%	0.812	S	S	*	*			trans	61.5	164.8	145.4	-63.8	-171.9	159.7	0	0	119.5
175	L	28.2	Very low	29	Very low	114 Å²	114	152.8 Å²	152.8	60%	0.597	82%	0.816	S	S	*	*			cis	-159.7	162.2	5.9	-150.2	53	0	0	0	113
176	Y	27.9	Very low	28.8	Very low	195 Å²	195	149.8 Å²	149.8	77%	0.765	82%	0.815	S	S	*	*			trans	57.7	128.5	158.5	-73.5	-56	0	0	0	124.5
177	K	26.9	Very low	28.7	Very low	211 Å²	211	142.6 Å²	142.6	92%	0.917	81%	0.81	S	S	*	*				-169.3	168.1	106.5	-105	172.1	-175.6	175.7	0	114.7
178	R	25.9	Very low	28.7	Very low	236 Å²	236	144.8 Å²	144.8	89%	0.891	82%	0.816	S	S	*	*			trans	-94.6	172	-169.4	-69.7	179.7	174.9	176.8	-2.3	114.6
179	T	26.8	Very low	28.6	Very low	128 Å²	128	142.5 Å²	142.5	79%	0.785	81%	0.813	S	S	*	*			trans	-51	174.8	167.8	49.4	0	0	0	0	115.2
180	P	38.5	Very low	28.4	Very low	123 Å²	123	137.5 Å²	137.5	80%	0.799	80%	0.801	S	S	*	*			cis	-144.4	-165.8	22.8	44.6	-22.8	0	0	0	118.5
181	S	27	Very low	28	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	79%	0.793	S	S	*	*			trans	-63.3	160.6	-172.2	-34.3	0	0	0	0	118.2
182	S	25.7	Very low	28.3	Very low	124 Å²	124	144.7 Å²	144.7	87%	0.867	80%	0.796	S	S	*	*			trans	-144.1	148.3	153	61.7	0	0	0	0	111.9
183	L	27.4	Very low	28.2	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	80%	0.796	S	S	*	*			trans	-94.5	156.1	-173.3	-69	137.8	0	0	0	112.1
184	T	30.6	Very low	28.1	Very low	138 Å²	138	143.1 Å²	143.1	85%	0.847	79%	0.793	S	S	*	*			trans	-132	150.4	161.4	50.7	0	0	0	0	111.3
185	P	30.7	Very low	27.9	Very low	132 Å²	132	141.2 Å²	141.2	86%	0.857	79%	0.794	S	S	*	*			trans	-98	176.3	-154.4	38.7	-38.2	0	0	0	116.4
186	I	28.7	Very low	28	Very low	161 Å²	161	142.9 Å²	142.9	83%	0.826	80%	0.803	S	S	*	*			trans	-88.3	146.2	-176.2	-69.6	165.9	0	0	0	112.6
187	G	26.1	Very low	28	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	80%	0.8	S	S	*	*			trans	176.3	155.4	145.3	0	0	0	0	0	112.7
188	H	26.9	Very low	28.2	Very low	182 Å²	182	136.6 Å²	136.6	84%	0.843	80%	0.799	S	S	*	*			cis	-178	126.6	-33.4	-139.9	49.1	0	0	0	105.6
189	G	26.2	Very low	28.3	Very low	82 Å²	82	130.6 Å²	130.6	85%	0.845	79%	0.794	S	S	*	*			trans	71.3	147.9	173.1	0	0	0	0	0	116.9
190	G	26.5	Very low	28.6	Very low	59 Å²	59	130.6 Å²	130.6	61%	0.608	80%	0.796	S	S	*	*			cis	175	129.8	-8.8	0	0	0	0	0	111.3
191	F	26.1	Very low	28.2	Very low	174 Å²	174	130.6 Å²	130.6	76%	0.763	80%	0.798	S	S	*	*				47.5	143.6	123.7	-56.5	-68.7	0	0	0	121.4
192	Y	29.6	Very low	28.9	Very low	196 Å²	196	130.9 Å²	130.9	77%	0.769	80%	0.798	S	S	*	*			cis	-150.9	153.2	11.1	-56.5	-91.6	0	0	0	111.8
193	N	26.6	Very low	28.9	Very low	165 Å²	165	128.2 Å²	128.2	88%	0.882	79%	0.789	S	S	*	*			trans	40.2	139.9	134.8	-144.3	31.6	0	0	0	121.9
194	G	26.6	Very low	29.4	Very low	52 Å²	52	126.6 Å²	126.6	54%	0.536	79%	0.789	S	S	.	*			cis	171.3	-168.4	-4.1	0	0	0	0	0	115.3
195	T	28.1	Very low	29.4	Very low	132 Å²	132	126.7 Å²	126.7	81%	0.81	79%	0.789	S	S	*	*			trans	83.5	149.9	169.9	75.6	0	0	0	0	118.1
196	L	29.8	Very low	29.2	Very low	150 Å²	150	123.9 Å²	123.9	79%	0.785	78%	0.784	S	S	*	*			cis	-153.2	158.7	-6.7	-127.8	165.6	0	0	0	110.9	F198	L196-F198 HydrophobicContact CD2-CE2 4.48Å
197	G	27.1	Very low	29.4	Very low	69 Å²	69	124.3 Å²	124.3	71%	0.711	79%	0.785	S	S	*	*			trans	-171.6	140.2	171.8	0	0	0	0	0	113.9
198	F	31	Very low	29.9	Very low	204 Å²	204	125.8 Å²	125.8	90%	0.895	78%	0.782	S	S	*	*			trans	-101	152.8	-172.2	-88.3	-95.3	0	0	0	114.2	L196	L196-F198 HydrophobicContact CD2-CE2 4.48Å
199	S	28.6	Very low	30.1	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	79%	0.785	S	S	*	*			trans	-107	167.1	177.1	-53.3	0	0	0	0	113.1
200	P	32.5	Very low	30.4	Very low	128 Å²	128	127 Å²	127	83%	0.831	78%	0.78	S	S	*	*			trans	-99.3	173.2	151.5	34.4	-27.1	0	0	0	113.7
201	S	29.8	Very low	30.4	Very low	122 Å²	122	132.1 Å²	132.1	85%	0.853	79%	0.793	S	S	*	*			trans	-75.5	172.4	-155.8	-84.8	0	0	0	0	119.7
202	P	42	Very low	30.8	Very low	126 Å²	126	133.1 Å²	133.1	82%	0.818	80%	0.801	S	S	*	*			trans	-112.8	166.7	-151.7	41.9	-35.5	0	0	0	118.1
203	G	26.1	Very low	30.7	Very low	67 Å²	67	127 Å²	127	69%	0.691	80%	0.798	S	S	*	*			trans	-133.8	165	163.6	0	0	0	0	0	111.3
204	P	37.4	Very low	31.3	Very low	138 Å²	138	125.1 Å²	125.1	90%	0.896	79%	0.794	S	S	*	*			trans	-80.9	160.7	-144.4	29	-36.3	0	0	0	118.7
205	V	30.5	Very low	31.3	Very low	140 Å²	140	127.7 Å²	127.7	85%	0.848	80%	0.804	S	S	*	*			trans	-75.6	149.7	-165.7	175.7	0	0	0	0	114.8
206	G	27	Very low	31.3	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	80%	0.802	S	S	*	*			trans	-160.9	22.7	-179.3	0	0	0	0	0	121
207	M	33.1	Very low	31.1	Very low	170 Å²	170	127.8 Å²	127.8	84%	0.837	80%	0.804	S	S	*	*			trans	55.9	160.8	159.8	-71.7	-61.7	-81.3	0	0	120.7
208	P	37	Very low	31.2	Very low	102 Å²	102	132.1 Å²	132.1	66%	0.662	81%	0.81	S	S	*	*			trans	-107.5	159	-149.3	40.1	-35.6	0	0	0	116.1
209	L	29.9	Very low	31.4	Very low	173 Å²	173	128.9 Å²	128.9	91%	0.906	81%	0.807	S	S	*	*			trans	-131.4	152.8	159.3	-109.7	90.9	0	0	0	111.3
210	P	32.3	Very low	31.7	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	81%	0.807	S	S	*	*			trans	-97.6	161.8	-167.9	38.3	-36.5	0	0	0	115.3
211	N	27.7	Very low	31.9	Very low	167 Å²	167	128.3 Å²	128.3	89%	0.893	80%	0.801	S	S	*	*			trans	54	115	155.2	-119.3	24.1	0	0	0	119.8
212	Q	33.3	Very low	32.1	Very low	195 Å²	195	128.6 Å²	128.6	91%	0.911	80%	0.8	S	S	*	*			trans	-91.7	148.8	166	-67.8	-175.3	5.5	0	0	112.1
213	G	28.1	Very low	31.5	Very low	69 Å²	69	128.2 Å²	128.2	71%	0.711	80%	0.8	S	S	*	*			trans	-125.4	149.6	157.8	0	0	0	0	0	109.6
214	P	38.7	Very low	31.7	Very low	124 Å²	124	133 Å²	133	81%	0.805	81%	0.809	S	S	*	*			trans	-99.9	148.4	-157.8	36.8	-34.8	0	0	0	115
215	S	28	Very low	31.1	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	80%	0.8	S	S	*	*			trans	-179	109.9	142	-84.1	0	0	0	0	115.2
216	H	27.4	Very low	31	Very low	166 Å²	166	131.1 Å²	131.1	77%	0.769	79%	0.794	S	S	*	*			trans	46.7	115.4	137.7	-54.7	-72.5	0	0	0	124.4
217	S	25.9	Very low	30.9	Very low	119 Å²	119	135.9 Å²	135.9	83%	0.832	80%	0.797	S	S	*	*				-173.5	102.7	126.6	50.7	0	0	0	0	108.3
218	L	28.7	Very low	30.6	Very low	160 Å²	160	132 Å²	132	84%	0.838	79%	0.786	S	S	*	*				64	75.2	71.5	-69.8	-179.7	0	0	0	116.5
219	T	34.8	Very low	30.2	Very low	136 Å²	136	132.2 Å²	132.2	83%	0.834	79%	0.79	S	S	*	*			trans	-145.9	140.9	133.1	40	0	0	0	0	108.6
220	P	35.3	Very low	30.1	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-84.5	156.3	-168.5	34.1	-36.6	0	0	0	113.9
221	P	37.1	Very low	29.9	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.7	153.1	160.4	32.8	-33.7	0	0	0	110.5	S223	P221-S223 PolarHBondContact O-N 3.31Å
222	P	33.2	Very low	29.9	Very low	128 Å²	128	129.3 Å²	129.3	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.4	130.1	178.5	27.4	-34	0	0	0	111
223	S	29.6	Very low	29.9	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.8	131.6	175.5	-53.1	0	0	0	0	110.9	P221 S225	P221-S223 PolarHBondContact O-N 3.31Å; S223-S225 PolarHBondContact O-N 3.35Å
224	L	29.8	Very low	29.8	Very low	168 Å²	168	133.3 Å²	133.3	88%	0.88	80%	0.798	S	S	*	*			trans	-70.5	111.8	171.1	-69.8	164.3	0	0	0	109.6	N226	L224-N226 PolarHBondContact O-N 3.03Å
225	S	25.9	Very low	29.4	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	80%	0.802	S	S	*	*			trans	-76.3	86.1	176.2	44.1	0	0	0	0	111.3	S223 H227	S223-S225 PolarHBondContact O-N 3.35Å; S225-H227 PolarHBondContact O-N 2.93Å; S225-H227 VanDerWaalsContact O-N 3.09Å
226	N	27.4	Very low	29.4	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	81%	0.805	S	S	*	*			trans	-77.2	91.7	177.6	-140.3	65.1	0	0	0	110.7	L224 S228	L224-N226 PolarHBondContact O-N 3.03Å; N226-S228 VanDerWaalsContact C-N 3.28Å; N226-S228 PolarHBondContact ND2-OG 2.99Å; N226-S228 VanDerWaalsContact ND2-OG 3.16Å; N226-S228 PolarHBondContact O-N 3.45Å
227	H	25.9	Very low	29.5	Very low	173 Å²	173	129.9 Å²	129.9	80%	0.801	81%	0.806	S	S	*	*			trans	-75.3	77.7	171.9	-86.8	-79.1	0	0	0	111.5	S225 S229	S225-H227 PolarHBondContact O-N 2.93Å; S225-H227 VanDerWaalsContact O-N 3.09Å; H227-S229 PolarHBondContact O-N 2.62Å
228	S	27.1	Very low	29.8	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	81%	0.806	S	S	*	*			trans	-86	91.1	168.3	-61.8	0	0	0	0	110.2	N226 S230	N226-S228 VanDerWaalsContact C-N 3.28Å; N226-S228 PolarHBondContact ND2-OG 2.99Å; N226-S228 VanDerWaalsContact ND2-OG 3.16Å; N226-S228 PolarHBondContact O-N 3.45Å; S228-S230 PolarHBondContact O-N 3.29Å
229	S	28.2	Very low	29.9	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	80%	0.801	S	S	*	*			trans	-74.8	88.6	176	-62.1	0	0	0	0	111	H227 S231	H227-S229 PolarHBondContact O-N 2.62Å; S229-S231 PolarHBondContact O-N 2.72Å; S229-S231 VanDerWaalsContact O-N 3.07Å
230	S	27.2	Very low	29.8	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	81%	0.806	S	S	*	*			trans	-74.3	95.3	177.2	54.4	0	0	0	0	111.2	S228 N232	S228-S230 PolarHBondContact O-N 3.29Å; S230-N232 PolarHBondContact O-N 3.15Å
231	S	29.3	Very low	29.5	Very low	114 Å²	114	129 Å²	129	80%	0.797	80%	0.799	S	S	*	*			trans	-89.2	97.4	168.9	-59.1	0	0	0	0	109.5	S229	S229-S231 PolarHBondContact O-N 2.72Å; S229-S231 VanDerWaalsContact O-N 3.07Å
232	N	27.5	Very low	29.2	Very low	165 Å²	165	130.1 Å²	130.1	88%	0.882	81%	0.81	S	S	*	*			trans	-120.1	117.1	166	-106.3	4.9	0	0	0	109.7	S230	S230-N232 PolarHBondContact O-N 3.15Å
233	L	32.4	Very low	29.1	Very low	179 Å²	179	127.4 Å²	127.4	94%	0.937	81%	0.805	S	S	*	*			trans	-61.9	141.6	169.9	-69.1	150.1	0	0	0	109.5
234	N	27.3	Very low	29.3	Very low	168 Å²	168	133.3 Å²	133.3	90%	0.898	81%	0.809	S	S	*	*			trans	-134.8	117.2	160.7	-152.1	14.3	0	0	0	109.1
235	L	29.2	Very low	29.4	Very low	169 Å²	169	134.4 Å²	134.4	89%	0.885	81%	0.807	S	S	*	*			trans	-100.9	141.4	173.9	-165.9	66.9	0	0	0	107.5
236	G	28.2	Very low	29.7	Very low	78 Å²	78	137.4 Å²	137.4	80%	0.804	81%	0.814	S	S	*	*			trans	-74	168.5	-158.9	0	0	0	0	0	117.2
237	G	28.6	Very low	29.8	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	82%	0.818	S	S	*	*			trans	178.8	53.4	-179.5	0	0	0	0	0	118.6
238	L	32.7	Very low	30.1	Very low	159 Å²	159	133.2 Å²	133.2	83%	0.832	82%	0.821	S	S	*	*			trans	45.2	115.2	147.8	-60	178.1	0	0	0	123.6
239	T	30.9	Very low	30.4	Very low	120 Å²	120	133.6 Å²	133.6	74%	0.736	83%	0.829	S	S	*	*				48.3	102.4	127.4	65.6	0	0	0	0	123.4
240	N	32.4	Very low	30.9	Very low	175 Å²	175	134.8 Å²	134.8	94%	0.936	83%	0.834	S	S	*	*				168.1	151.8	124	-111	-4.9	0	0	0	107.6
241	G	29.7	Very low	31	Very low	61 Å²	61	133 Å²	133	63%	0.629	83%	0.834	S	S	*	*			cis	150	93.5	5.6	0	0	0	0	0	109.9
242	S	31.2	Very low	31.1	Very low	131 Å²	131	132.6 Å²	132.6	92%	0.916	84%	0.838	S	S	*	*			trans	59.6	119.8	161.5	-60	0	0	0	0	121.5
243	G	30.8	Very low	31.3	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	83%	0.832	S	S	*	*				114.3	114.9	109.5	0	0	0	0	0	121.3
244	R	32.8	Very low	31.3	Very low	242 Å²	242	128.8 Å²	128.8	91%	0.913	83%	0.827	S	S	*	*			trans	81	138.2	142.1	-63.3	-174.3	174.4	-168.1	-1.4	121.8
245	F	32	Very low	31.6	Very low	190 Å²	190	129 Å²	129	83%	0.833	82%	0.82	S	S	*	*			trans	-39.2	148.4	169.8	-45.2	-96.9	0	0	0	117.9
246	I	32	Very low	31.7	Very low	166 Å²	166	132.3 Å²	132.3	85%	0.851	82%	0.823	S	S	*	*				173	141.9	108.2	-86.6	158.2	0	0	0	109.9
247	S	29.9	Very low	31.9	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	83%	0.825	S	S	*	*			trans	-86.4	140.1	170.9	-50.6	0	0	0	0	111.7
248	A	33.3	Very low	31.9	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	83%	0.826	S	S	*	*			trans	-168.5	151.5	145.4	0	0	0	0	0	114
249	A	32.3	Very low	31.8	Very low	96 Å²	96	138.7 Å²	138.7	79%	0.793	83%	0.827	S	S	*	*			trans	-65.8	179.3	-178.8	0	0	0	0	0	115.4
250	P	38.7	Very low	31.8	Very low	131 Å²	131	137.5 Å²	137.5	85%	0.851	83%	0.83	S	S	*	*			trans	-107.2	165.8	-154.1	40.7	-35.9	0	0	0	116.1
251	G	29.4	Very low	31.8	Very low	79 Å²	79	134.1 Å²	134.1	81%	0.814	82%	0.82	S	S	*	*			trans	127.3	110.3	151.3	0	0	0	0	0	116
252	A	32	Very low	32	Very low	105 Å²	105	137.1 Å²	137.1	87%	0.868	83%	0.831	S	S	*	*			trans	-162.8	145.6	152.9	0	0	0	0	0	110.3
253	E	30.7	Very low	32	Very low	164 Å²	164	134.8 Å²	134.8	77%	0.766	83%	0.827	S	S	*	*			trans	-71.5	150.8	178.5	-62	176.6	86.7	0	0	112.9	K255	E253-K255 IonicContact OE1-NZ 3.6Å
254	A	33.5	Very low	32.3	Very low	101 Å²	101	137.1 Å²	137.1	84%	0.835	83%	0.833	S	S	*	*			trans	-140.8	102.9	156.4	0	0	0	0	0	110.5
255	K	32.9	Very low	32.3	Very low	171 Å²	171	131.2 Å²	131.2	74%	0.743	83%	0.829	S	S	*	*			trans	-74.3	130.6	166.9	-73.1	163.2	178.5	138.1	0	109	E253	E253-K255 IonicContact OE1-NZ 3.6Å
256	Y	31.8	Very low	32.9	Very low	239 Å²	239	129.9 Å²	129.9	94%	0.937	83%	0.829	S	S	*	*			trans	-131.8	142.9	153.2	-118.3	-92.8	0	0	0	110.3
257	R	32.3	Very low	33	Very low	229 Å²	229	132.4 Å²	132.4	86%	0.864	83%	0.834	S	S	*	*			trans	-114.8	170.2	-173.8	-95.6	-175.6	169.1	-175.1	-2.7	110.9
258	S	29.1	Very low	33.2	Very low	115 Å²	115	132 Å²	132	80%	0.804	83%	0.831	S	S	*	*			trans	90.4	111.9	169.1	-51.6	0	0	0	0	113.7
259	A	30.3	Very low	34	Very low	104 Å²	104	132 Å²	132	86%	0.86	82%	0.822	S	S	*	*				75.7	139	58.5	0	0	0	0	0	112.1
260	A	31.5	Very low	34.1	Very low	96 Å²	96	132 Å²	132	79%	0.793	82%	0.817	S	S	*	*			cis	-131.6	-177.6	6.9	0	0	0	0	0	109.7
261	S	32	Very low	34.4	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	81%	0.812	S	S	*	*			cis	-161.2	130.9	44.1	50.5	0	0	0	0	110.8
262	S	32.9	Very low	34.8	Very low	125 Å²	125	136.2 Å²	136.2	87%	0.874	82%	0.816	S	S	*	*				84	112.2	95.5	-56.8	0	0	0	0	115.6
263	G	32.1	Very low	35.2	Very low	81 Å²	81	138.5 Å²	138.5	84%	0.835	81%	0.812	S	S	*	*			trans	164.5	88.4	172	0	0	0	0	0	113.6
264	S	37.6	Very low	35.7	Very low	122 Å²	122	139.9 Å²	139.9	85%	0.853	82%	0.816	S	S	*	*			trans	-68	160.2	167.4	44.9	0	0	0	0	110.7
265	S	32.6	Very low	36	Very low	118 Å²	118	141.2 Å²	141.2	83%	0.825	82%	0.816	S	S	*	*			cis	-159.7	173	42.3	54.5	0	0	0	0	115.1
266	L	44.6	Very low	36	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	82%	0.821	S	S	*	*			trans	-71.9	144.1	-177.7	-58.6	150.4	0	0	0	113.8
267	F	34.7	Very low	36.6	Very low	219 Å²	219	133.3 Å²	133.3	96%	0.961	82%	0.818	S	S	*	*				-174.9	150.4	125.8	-105.4	-75.5	0	0	0	110.5
268	S	32.9	Very low	37.1	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	82%	0.819	S	S	*	*			trans	-98	-176.3	-175.4	-140.1	0	0	0	0	110.8
269	P	49.8	Very low	37.6	Very low	103 Å²	103	136.1 Å²	136.1	67%	0.669	82%	0.823	S	S	*	*			cis	-141.4	-168.2	-2.4	41.6	-21.2	0	0	0	116.2
270	S	35.5	Very low	38.1	Very low	96 Å²	96	142.6 Å²	142.6	67%	0.671	83%	0.825	S	S	*	*			trans	80.5	103.3	146.7	-63.1	0	0	0	0	121.7
271	S	44.6	Very low	38.8	Very low	107 Å²	107	147 Å²	147	75%	0.748	82%	0.822	S	S	*	*				25.3	105.7	128.3	55.2	0	0	0	0	119.3
272	Q	37.3	Very low	39.1	Very low	192 Å²	192	143.9 Å²	143.9	90%	0.897	81%	0.807	S	S	*	*			trans	-115.3	106	147.8	-73.3	-169.5	-23.6	0	0	109.9
273	L	41.4	Very low	39.8	Very low	153 Å²	153	146.3 Å²	146.3	80%	0.801	81%	0.806	S	S	*	*			trans	-64.3	144.8	156.3	-74.8	144.1	0	0	0	108
274	F	40.8	Very low	40.8	Very low	194 Å²	194	147.2 Å²	147.2	85%	0.851	80%	0.8	S	S	*	*			trans	100.1	100.4	-177.9	-53.1	-56.4	0	0	0	115.8
275	P	38.9	Very low	41.7	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	78%	0.782	S	S	*	*			trans	-72.3	128.5	161.8	30.4	-31.4	0	0	0	109.9	S277	P275-S277 PolarHBondContact O-N 3.11Å
276	S	32.5	Very low	43	Very low	121 Å²	121	143.9 Å²	143.9	85%	0.846	77%	0.766	S	S	*	*			trans	-68.3	127.7	173.1	-77.5	0	0	0	0	111.3	R278	S276-R278 VanDerWaalsContact C-N 3.35Å; S276-R278 PolarHBondContact O-N 3.3Å
277	S	44.3	Very low	44.1	Very low	124 Å²	124	139.4 Å²	139.4	87%	0.867	74%	0.741	S	S	*	*	S	Bend	trans	-77.5	73.5	-176.9	38.8	0	0	0	0	113.3	P275	P275-S277 PolarHBondContact O-N 3.11Å
278	R	42.8	Very low	45.5	Very low	235 Å²	235	135.7 Å²	135.7	89%	0.887	74%	0.739	S	S	*	*			trans	-141.9	95.4	157.3	-71.9	-165.1	-176.3	-173.8	2.4	111.3	S276 R280	S276-R278 VanDerWaalsContact C-N 3.35Å; S276-R278 PolarHBondContact O-N 3.3Å; R278-R280 PolarHBondContact O-N 3.27Å; R278-R280 VanDerWaalsContact O-N 3.16Å
279	L	40.3	Very low	47.3	Very low	168 Å²	168	133.3 Å²	133.3	88%	0.88	72%	0.723	S	S	*	*			trans	-67.2	107.7	165.2	-81.2	162.3	0	0	0	109.4
280	R	40.6	Very low	48.9	Very low	239 Å²	239	131.2 Å²	131.2	90%	0.902	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-77.8	118.3	154.3	-85.8	-176.3	168.8	179.9	-3	107	R278 G282	R278-R280 PolarHBondContact O-N 3.27Å; R278-R280 VanDerWaalsContact O-N 3.16Å; R280-G282 PolarHBondContact O-N 3.29Å
281	Y	46	Very low	51.6	Low	188 Å²	188	130.5 Å²	130.5	74%	0.737	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-59.6	117.9	172.4	-82.2	-90	0	0	0	110.2
282	G	38.5	Very low	53.9	Low	39 Å²	39	125.8 Å²	125.8	40%	0.402	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-98	147.3	169.3	0	0	0	0	0	110.3	R280 S284	R280-G282 PolarHBondContact O-N 3.29Å; G282-S284 PolarHBondContact O-N 3.26Å
283	M	48.7	Very low	56.6	Low	175 Å²	175	123.5 Å²	123.5	86%	0.862	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	19.4	179.8	-108.5	-71.5	145.1	0	0	114.5
284	S	51.4	Low	59.1	Low	100 Å²	100	118 Å²	118	70%	0.699	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-7.1	-171.2	43.9	0	0	0	0	114.9	G282	G282-S284 PolarHBondContact O-N 3.26Å
285	D	56.6	Low	61.7	Low	90 Å²	90	108.9 Å²	108.9	48%	0.481	58%	0.584	S	S	.	*	S	Bend	trans	-99.6	-2.3	-177.9	-69.8	-54.5	0	0	0	114.7	R293	D285-R293 PolarHBondContact O-N 2.97Å; D285-R293 VanDerWaalsContact O-N 3.13Å
286	V	61.1	Low	64.3	Low	81 Å²	81	105 Å²	105	49%	0.491	56%	0.555	S	S	.	*	B	Isolated β-bridge	trans	-88.6	117.7	174.8	-175.4	0	0	0	0	109.1
287	M	68.3	Low	67.2	Low	67 Å²	67	100.3 Å²	100.3	33%	0.33	52%	0.52	S	S	.	.			trans	-74.2	161.6	176.9	-71.9	-68.3	160.8	0	0	111.3	S289 G290 R291 R293	M287-S289 PolarHBondContact O-N 3.39Å; M287-G290 PolarHBondContact O-N 2.96Å; M287-R291 WeakPolarHBondContact CB-O 3.48Å; M287-R291 PolarHBondContact N-O 3.12Å; M287-R293 HydrophobicContact CE-CB 3.79Å; M287-R293 HydrophobicContact CE-CG 3.77Å
288	P	63.7	Low	69.7	Low	141 Å²	141	96.1 Å²	96.1	92%	0.916	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.4	174.4	-25.5	35	0	0	0	114.5	G290	P288-G290 PolarHBondContact O-N 2.86Å
289	S	70.3	Confident	72.1	Confident	58 Å²	58	89 Å²	89	41%	0.406	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-3.6	173.1	61.1	0	0	0	0	114.4	M287 R291 E296	M287-S289 PolarHBondContact O-N 3.39Å; S289-R291 PolarHBondContact O-N 2.98Å; S289-E296 PolarHBondContact OG-OE2 2.77Å
290	G	84.1	Confident	74.6	Confident	59 Å²	59	85.6 Å²	85.6	61%	0.608	44%	0.442	S	S	*	.	S	Bend	trans	76.6	-5.1	-173	0	0	0	0	0	114.5	M287 P288	M287-G290 PolarHBondContact O-N 2.96Å; P288-G290 PolarHBondContact O-N 2.86Å
291	R	90.9	Very high	77	Confident	81 Å²	81	80 Å²	80	31%	0.306	43%	0.43	S	S	.	.	S	Bend	trans	-87.3	154.1	175.3	-62.8	-175.3	-177.8	75	15.8	111.2	M287 S289 L295 E296 E317 D321	M287-R291 WeakPolarHBondContact CB-O 3.48Å; M287-R291 PolarHBondContact N-O 3.12Å; S289-R291 PolarHBondContact O-N 2.98Å; R291-L295 HydrophobicContact CB-CD2 4.29Å; R291-L295 HydrophobicContact CG-CD2 4.01Å; R291-E296 IonicContact NH1-OE2 3.97Å; R291-E317 WeakPolarHBondContact CA-OE1 3.4Å; R291-D321 IonicContact NE-OD2 3.29Å; R291-D321 PolarHBondContact NE-OD2 3.31Å
292	S	94.3	Very high	79.1	Confident	9 Å²	9	79.5 Å²	79.5	6%	0.063	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-64.1	152	163.9	70	0	0	0	0	110.7	L294 L295 E296 H314 E317	S292-L294 PolarHBondContact O-N 3.28Å; S292-L295 PolarHBondContact O-N 2.91Å; S292-L295 PolarHBondContact OG-N 3.19Å; S292-E296 PolarHBondContact O-N 3.48Å; S292-E296 VanDerWaalsContact O-N 3.11Å; S292-H314 VanDerWaalsContact CB-CE1 3.48Å; S292-H314 WeakPolarHBondContact CB-CE1 3.47Å; S292-H314 PolarHBondContact OG-ND1 2.97Å; S292-E317 WeakPolarHBondContact CB-OE2 3.36Å; S292-E317 PolarHBondContact N-OE1 3.29Å; S292-E317 VanDerWaalsContact OG-CD 3.27Å; S292-E317 PolarHBondContact OG-OE1 3.49Å; S292-E317 PolarHBondContact OG-OE2 3.4Å
293	R	92.9	Very high	81.5	Confident	144 Å²	144	82.6 Å²	82.6	54%	0.543	43%	0.427	S	S	.	.	H	α-helix	trans	-53.5	-38.6	171.4	-177.4	171.4	-176	170.8	3.2	113	D285 M287 E296 D297	D285-R293 PolarHBondContact O-N 2.97Å; D285-R293 VanDerWaalsContact O-N 3.13Å; M287-R293 HydrophobicContact CE-CB 3.79Å; M287-R293 HydrophobicContact CE-CG 3.77Å; R293-E296 PolarHBondContact O-N 2.94Å; R293-D297 WeakPolarHBondContact CG-OD2 3.48Å; R293-D297 IonicContact NE-OD2 3.53Å; R293-D297 WeakPolarHBondContact O-CB 3.37Å; R293-D297 PolarHBondContact O-N 2.77Å
294	L	94.9	Very high	83.3	Confident	36 Å²	36	78.8 Å²	78.8	19%	0.188	42%	0.416	C	S	.	.	H	α-helix	trans	-63.2	-45.8	-179.1	179.5	60	0	0	0	112.1	S292 F298 Y303 I311 H314 F318	S292-L294 PolarHBondContact O-N 3.28Å; L294-F298 WeakPolarHBondContact O-CB 3.44Å; L294-F298 PolarHBondContact O-N 3.08Å; L294-Y303 HydrophobicContact CD1-CD2 4.24Å; L294-Y303 HydrophobicContact CD1-CE2 3.94Å; L294-I311 HydrophobicContact CD2-CG2 4.12Å; L294-H314 HydrophobicContact CD2-CB 4.33Å; L294-F318 HydrophobicContact CD2-CE2 4.4Å; L294-F318 HydrophobicContact CG-CE2 4.17Å; L294-F318 HydrophobicContact CG-CZ 4.14Å
295	L	94.6	Very high	85.2	Confident	3 Å²	3	80.3 Å²	80.3	2%	0.016	42%	0.416	C	S	.	.	H	α-helix	trans	-66.8	-40.6	177.3	178.8	60	0	0	0	111.7	R291 S292 F298 R299 E317 F318 D321	R291-L295 HydrophobicContact CB-CD2 4.29Å; R291-L295 HydrophobicContact CG-CD2 4.01Å; S292-L295 PolarHBondContact O-N 2.91Å; S292-L295 PolarHBondContact OG-N 3.19Å; L295-F298 HydrophobicContact CD1-CD1 4.3Å; L295-F298 PolarHBondContact O-N 3.27Å; L295-R299 HydrophobicContact CD1-CG 4.3Å; L295-R299 WeakPolarHBondContact O-CB 3.31Å; L295-R299 VanDerWaalsContact O-CG 3.26Å; L295-R299 WeakPolarHBondContact O-CG 3.49Å; L295-R299 PolarHBondContact O-N 3.17Å; L295-E317 HydrophobicContact CD2-CG 3.89Å; L295-E317 WeakPolarHBondContact CD2-OE1 3.49Å; L295-F318 HydrophobicContact CB-CD2 4.21Å; L295-F318 HydrophobicContact CB-CE2 3.67Å; L295-F318 HydrophobicContact CB-CZ 4.13Å; L295-F318 HydrophobicContact CD1-CD1 4.06Å; L295-F318 HydrophobicContact CD1-CD2 3.94Å; L295-F318 HydrophobicContact CD1-CE1 3.97Å; L295-F318 HydrophobicContact CD1-CE2 3.87Å; L295-F318 HydrophobicContact CD1-CG 4.03Å; L295-F318 HydrophobicContact CD1-CZ 3.88Å; L295-F318 HydrophobicContact CG-CE2 4.33Å; L295-D321 HydrophobicContact CD1-CB 3.99Å; L295-D321 HydrophobicContact CD2-CB 3.76Å; L295-D321 HydrophobicContact CG-CB 4.47Å
296	E	94	Very high	87	Confident	47 Å²	47	76.7 Å²	76.7	22%	0.22	40%	0.396	C	S	.	.	H	α-helix	trans	-66.7	-45	178.2	-165.1	61.7	-119.2	0	0	111.7	S289 R291 S292 R293 F298 R299 N300	S289-E296 PolarHBondContact OG-OE2 2.77Å; R291-E296 IonicContact NH1-OE2 3.97Å; S292-E296 PolarHBondContact O-N 3.48Å; S292-E296 VanDerWaalsContact O-N 3.11Å; R293-E296 PolarHBondContact O-N 2.94Å; E296-F298 VanDerWaalsContact C-N 3.33Å; E296-F298 PolarHBondContact O-N 3.28Å; E296-R299 PolarHBondContact O-N 3.21Å; E296-N300 WeakPolarHBondContact O-CB 3.44Å; E296-N300 PolarHBondContact O-N 3.09Å; E296-N300 PolarHBondContact O-ND2 3.17Å; E296-N300 PolarHBondContact OE1-ND2 2.82Å
297	D	93.6	Very high	88.7	Confident	23 Å²	23	75.6 Å²	75.6	12%	0.123	39%	0.386	C	S	.	.	H	α-helix	trans	-67.2	-32	176.2	-80.4	-34.5	0	0	0	112.1	R293 N300 N301 R302 Y303	R293-D297 WeakPolarHBondContact CG-OD2 3.48Å; R293-D297 IonicContact NE-OD2 3.53Å; R293-D297 WeakPolarHBondContact O-CB 3.37Å; R293-D297 PolarHBondContact O-N 2.77Å; D297-N300 CarbonylContact O-C 3.59Å; D297-N301 PolarHBondContact O-N 3.3Å; D297-R302 HydrophobicContact CB-CB 4.22Å; D297-R302 HydrophobicContact CB-CG 4.36Å; D297-R302 WeakPolarHBondContact O-CB 3.15Å; D297-R302 PolarHBondContact O-N 3.29Å; D297-R302 WeakPolarHBondContact OD1-CD 3.49Å; D297-R302 IonicContact OD1-NE 3.72Å; D297-R302 PolarHBondContact OD1-NE 3.16Å; D297-Y303 HydrophobicContact CB-CD2 4.09Å; D297-Y303 HydrophobicContact CB-CE2 3.6Å
298	F	95.6	Very high	90	Very high	36 Å²	36	72.5 Å²	72.5	16%	0.158	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-49.3	169.3	169.3	-107.4	0	0	0	112.2	L294 L295 E296 N300 N301 L306 F318 H323 F327	L294-F298 WeakPolarHBondContact O-CB 3.44Å; L294-F298 PolarHBondContact O-N 3.08Å; L295-F298 HydrophobicContact CD1-CD1 4.3Å; L295-F298 PolarHBondContact O-N 3.27Å; E296-F298 VanDerWaalsContact C-N 3.33Å; E296-F298 PolarHBondContact O-N 3.28Å; F298-N300 PolarHBondContact O-N 3.39Å; F298-N301 WeakPolarHBondContact O-CA 3.2Å; F298-N301 PolarHBondContact O-N 3.3Å; F298-L306 HydrophobicContact CB-CD2 4.19Å; F298-L306 HydrophobicContact CD2-CD2 3.5Å; F298-L306 VanDerWaalsContact CD2-CD2 3.5Å; F298-L306 HydrophobicContact CE2-CD2 4.17Å; F298-L306 HydrophobicContact CG-CD2 3.96Å; F298-F318 HydrophobicContact CB-CE1 4.17Å; F298-F318 HydrophobicContact CB-CZ 4.08Å; F298-F318 HydrophobicContact CD1-CD1 4.41Å; F298-F318 AromaticContact CD1-CE1 3.64Å; F298-F318 HydrophobicContact CD1-CE1 3.64Å; F298-F318 HydrophobicContact CD1-CZ 4.3Å; F298-F318 HydrophobicContact CE1-CE1 4.24Å; F298-F318 AromaticContact CG-CE1 3.87Å; F298-F318 HydrophobicContact CG-CE1 3.87Å; F298-F318 HydrophobicContact CG-CZ 4.3Å; F298-H323 HydrophobicContact CE1-CB 4.04Å; F298-F327 HydrophobicContact CE1-CB 4.14Å; F298-F327 HydrophobicContact CE2-CB 4.45Å; F298-F327 AromaticContact CE2-CD2 3.83Å; F298-F327 HydrophobicContact CE2-CD2 3.83Å; F298-F327 HydrophobicContact CE2-CE2 4.33Å; F298-F327 HydrophobicContact CE2-CG 4.22Å; F298-F327 HydrophobicContact CZ-CB 3.66Å; F298-F327 AromaticContact CZ-CD2 3.87Å; F298-F327 HydrophobicContact CZ-CD2 3.87Å; F298-F327 AromaticContact CZ-CG 3.9Å; F298-F327 HydrophobicContact CZ-CG 3.9Å
299	R	93.7	Very high	91.5	Very high	85 Å²	85	73.6 Å²	73.6	32%	0.321	36%	0.357	S	S	.	.	H	α-helix	trans	-58.8	-35.3	177.2	-74.2	168.3	58.9	93.6	16.2	112.2	L295 E296 N301 D321 H323	L295-R299 HydrophobicContact CD1-CG 4.3Å; L295-R299 WeakPolarHBondContact O-CB 3.31Å; L295-R299 VanDerWaalsContact O-CG 3.26Å; L295-R299 WeakPolarHBondContact O-CG 3.49Å; L295-R299 PolarHBondContact O-N 3.17Å; E296-R299 PolarHBondContact O-N 3.21Å; R299-N301 PolarHBondContact O-N 2.92Å; R299-D321 IonicContact CZ-OD2 2.63Å; R299-D321 IonicContact NE-OD2 2.96Å; R299-D321 IonicContact NH1-OD1 2.8Å; R299-D321 PolarHBondContact NH1-OD1 3.2Å; R299-D321 IonicContact NH1-OD2 3.89Å; R299-D321 PolarHBondContact NH1-OD2 3.46Å; R299-H323 HydrophobicContact CG-CB 4.39Å
300	N	93.3	Very high	92.7	Very high	97 Å²	97	74.4 Å²	74.4	52%	0.519	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	17	175.1	-67.8	-67.1	0	0	0	113.8	E296 D297 F298 R302	E296-N300 WeakPolarHBondContact O-CB 3.44Å; E296-N300 PolarHBondContact O-N 3.09Å; E296-N300 PolarHBondContact O-ND2 3.17Å; E296-N300 PolarHBondContact OE1-ND2 2.82Å; D297-N300 CarbonylContact O-C 3.59Å; F298-N300 PolarHBondContact O-N 3.39Å; N300-R302 PolarHBondContact O-N 2.97Å; N300-R302 VanDerWaalsContact O-N 3.16Å
301	N	91.3	Very high	93.3	Very high	121 Å²	121	71.6 Å²	71.6	65%	0.647	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	26.9	175	-161.5	41.6	0	0	0	114.9	D297 F298 R299 Y303	D297-N301 PolarHBondContact O-N 3.3Å; F298-N301 WeakPolarHBondContact O-CA 3.2Å; F298-N301 PolarHBondContact O-N 3.3Å; R299-N301 PolarHBondContact O-N 2.92Å; N301-Y303 VanDerWaalsContact C-N 3.28Å; N301-Y303 PolarHBondContact O-N 3.33Å
302	R	90.1	Very high	93.5	Very high	177 Å²	177	70 Å²	70	67%	0.668	33%	0.332	S	S	*	.	S	Bend	trans	-75.6	-17	175.9	-58.8	-159.1	-168.4	-106.3	-2.6	113.4	D297 N300 P304	D297-R302 HydrophobicContact CB-CB 4.22Å; D297-R302 HydrophobicContact CB-CG 4.36Å; D297-R302 WeakPolarHBondContact O-CB 3.15Å; D297-R302 PolarHBondContact O-N 3.29Å; D297-R302 WeakPolarHBondContact OD1-CD 3.49Å; D297-R302 IonicContact OD1-NE 3.72Å; D297-R302 PolarHBondContact OD1-NE 3.16Å; N300-R302 PolarHBondContact O-N 2.97Å; N300-R302 VanDerWaalsContact O-N 3.16Å; R302-P304 WeakPolarHBondContact O-CD 3.31Å
303	Y	88.8	Confident	93.5	Very high	104 Å²	104	71.6 Å²	71.6	41%	0.408	35%	0.349	S	S	.	.			trans	-121.6	70.8	-179.7	-61.7	-62	0	0	0	112.2	L294 D297 N301 N305 L306	L294-Y303 HydrophobicContact CD1-CD2 4.24Å; L294-Y303 HydrophobicContact CD1-CE2 3.94Å; D297-Y303 HydrophobicContact CB-CD2 4.09Å; D297-Y303 HydrophobicContact CB-CE2 3.6Å; N301-Y303 VanDerWaalsContact C-N 3.28Å; N301-Y303 PolarHBondContact O-N 3.33Å; Y303-N305 PolarHBondContact O-N 2.97Å; Y303-L306 HydrophobicContact CG-CD1 4.43Å; Y303-L306 PolarHBondContact O-N 3.43Å
304	P	85.9	Confident	93.7	Very high	95 Å²	95	67 Å²	67	62%	0.617	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.2	-175.2	26.6	-35.8	0	0	0	114.1	R302	R302-P304 WeakPolarHBondContact O-CD 3.31Å
305	N	92.2	Very high	93.8	Very high	133 Å²	133	65.2 Å²	65.2	71%	0.711	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	20.5	-176.3	-70	-44	0	0	0	113.8	Y303 Q307	Y303-N305 PolarHBondContact O-N 2.97Å; N305-Q307 PolarHBondContact O-NE2 3.14Å
306	L	94.5	Very high	93.9	Very high	13 Å²	13	67 Å²	67	7%	0.068	33%	0.333	C	S	.	.			trans	-55.6	142.7	-178.4	-163	67.5	0	0	0	112.1	F298 Y303 D310 I311 F318 F327 K331	F298-L306 HydrophobicContact CB-CD2 4.19Å; F298-L306 HydrophobicContact CD2-CD2 3.5Å; F298-L306 VanDerWaalsContact CD2-CD2 3.5Å; F298-L306 HydrophobicContact CE2-CD2 4.17Å; F298-L306 HydrophobicContact CG-CD2 3.96Å; Y303-L306 HydrophobicContact CG-CD1 4.43Å; Y303-L306 PolarHBondContact O-N 3.43Å; L306-D310 HydrophobicContact CD1-CB 3.57Å; L306-D310 HydrophobicContact CG-CB 4.36Å; L306-I311 HydrophobicContact CD1-CG2 4.24Å; L306-I311 HydrophobicContact CD2-CG2 3.6Å; L306-I311 HydrophobicContact CG-CG2 4.01Å; L306-F318 HydrophobicContact CD2-CE1 4.14Å; L306-F318 HydrophobicContact CD2-CZ 4.42Å; L306-F327 HydrophobicContact CB-CE2 3.9Å; L306-F327 HydrophobicContact CB-CZ 3.86Å; L306-F327 HydrophobicContact CD2-CE1 4.33Å; L306-F327 HydrophobicContact CD2-CE2 4.37Å; L306-F327 HydrophobicContact CD2-CZ 4.02Å; L306-F327 HydrophobicContact CG-CE1 4.48Å; L306-F327 HydrophobicContact CG-CE2 4.33Å; L306-F327 HydrophobicContact CG-CZ 3.84Å; L306-F327 VanDerWaalsContact O-CE2 3.32Å; L306-F327 WeakPolarHBondContact O-CE2 3.27Å; L306-F327 WeakPolarHBondContact O-CZ 3.45Å; L306-K331 WeakPolarHBondContact O-CE 3.42Å; L306-K331 PolarHBondContact O-NZ 3.04Å
307	Q	95.8	Very high	94.1	Very high	58 Å²	58	67 Å²	67	27%	0.271	33%	0.333	S	S	.	.			trans	-121.6	166.4	177.6	-50.2	-58.8	-30.5	0	0	111.3	N305 R309 D310 K331	N305-Q307 PolarHBondContact O-NE2 3.14Å; Q307-R309 VanDerWaalsContact C-N 3.3Å; Q307-R309 HydrophobicContact CB-CG 4.22Å; Q307-R309 PolarHBondContact O-N 2.84Å; Q307-D310 WeakPolarHBondContact CA-OD2 3.41Å; Q307-D310 VanDerWaalsContact CB-OD2 3.31Å; Q307-D310 WeakPolarHBondContact CB-OD2 3.5Å; Q307-D310 PolarHBondContact N-OD2 3.37Å; Q307-D310 WeakPolarHBondContact O-CB 3.24Å; Q307-D310 PolarHBondContact O-N 2.71Å; Q307-K331 VanDerWaalsContact CD-NZ 3.31Å
308	L	95.4	Very high	94.3	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.01	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-61.4	-36.2	-178.3	-70.2	173.7	0	0	0	113.1	D310 I311 F327 I328 K331 L332 A335 E339 V343	L308-D310 PolarHBondContact O-N 2.84Å; L308-I311 HydrophobicContact CD2-CD1 4.41Å; L308-I311 VanDerWaalsContact O-CG1 3.24Å; L308-I311 WeakPolarHBondContact O-CG1 3.43Å; L308-I311 PolarHBondContact O-N 2.92Å; L308-F327 HydrophobicContact CD2-CE1 4.34Å; L308-I328 HydrophobicContact CD2-CG1 4.3Å; L308-I328 HydrophobicContact CD2-CG2 4.49Å; L308-K331 HydrophobicContact CD1-CB 3.79Å; L308-K331 HydrophobicContact CD2-CB 3.73Å; L308-K331 HydrophobicContact CD2-CG 4.32Å; L308-K331 HydrophobicContact CG-CB 3.63Å; L308-K331 HydrophobicContact CG-CG 4.28Å; L308-L332 HydrophobicContact CD1-CD2 4.27Å; L308-A335 HydrophobicContact CD1-CB 3.75Å; L308-E339 HydrophobicContact CD1-CB 4.26Å; L308-V343 HydrophobicContact CB-CG2 4.06Å; L308-V343 HydrophobicContact CD1-CG2 4Å; L308-V343 HydrophobicContact CD2-CG2 3.92Å; L308-V343 HydrophobicContact CG-CG2 4.2Å
309	R	95.5	Very high	94.4	Very high	165 Å²	165	64.1 Å²	64.1	62%	0.623	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-66	-23.2	175.5	66.1	-176.8	172.1	-152.3	-6.9	114	Q307 I311 L342	Q307-R309 VanDerWaalsContact C-N 3.3Å; Q307-R309 HydrophobicContact CB-CG 4.22Å; Q307-R309 PolarHBondContact O-N 2.84Å; R309-I311 VanDerWaalsContact C-N 3.31Å; R309-L342 HydrophobicContact CB-CD1 4.36Å
310	D	95.9	Very high	94.6	Very high	75 Å²	75	63.2 Å²	63.2	40%	0.401	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-82.6	-14.3	-176.6	-49.8	-33.5	0	0	0	111.7	L306 Q307 L308	L306-D310 HydrophobicContact CD1-CB 3.57Å; L306-D310 HydrophobicContact CG-CB 4.36Å; Q307-D310 WeakPolarHBondContact CA-OD2 3.41Å; Q307-D310 VanDerWaalsContact CB-OD2 3.31Å; Q307-D310 WeakPolarHBondContact CB-OD2 3.5Å; Q307-D310 PolarHBondContact N-OD2 3.37Å; Q307-D310 WeakPolarHBondContact O-CB 3.24Å; Q307-D310 PolarHBondContact O-N 2.71Å; L308-D310 PolarHBondContact O-N 2.84Å
311	I	96.3	Very high	94.8	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-108.5	18.4	176.4	59.6	159.9	0	0	0	112.7	L294 L306 L308 R309 H314 I315 F318 F327 I328	L294-I311 HydrophobicContact CD2-CG2 4.12Å; L306-I311 HydrophobicContact CD1-CG2 4.24Å; L306-I311 HydrophobicContact CD2-CG2 3.6Å; L306-I311 HydrophobicContact CG-CG2 4.01Å; L308-I311 HydrophobicContact CD2-CD1 4.41Å; L308-I311 VanDerWaalsContact O-CG1 3.24Å; L308-I311 WeakPolarHBondContact O-CG1 3.43Å; L308-I311 PolarHBondContact O-N 2.92Å; R309-I311 VanDerWaalsContact C-N 3.31Å; I311-H314 CarbonylContact O-C 3.02Å; I311-H314 WeakPolarHBondContact O-CA 3.26Å; I311-H314 WeakPolarHBondContact O-CB 3.46Å; I311-H314 PolarHBondContact O-N 3.43Å; I311-I315 HydrophobicContact CB-CD1 4.46Å; I311-I315 HydrophobicContact CD1-CD1 3.58Å; I311-I315 HydrophobicContact CG1-CD1 3.6Å; I311-I315 PolarHBondContact O-N 3.32Å; I311-F318 HydrophobicContact CB-CE2 4.42Å; I311-F318 HydrophobicContact CB-CZ 4.42Å; I311-F318 HydrophobicContact CD1-CB 4.32Å; I311-F318 HydrophobicContact CD1-CD1 3.92Å; I311-F318 HydrophobicContact CD1-CE1 4.46Å; I311-F318 HydrophobicContact CD1-CG 4.1Å; I311-F318 HydrophobicContact CG2-CD1 4.2Å; I311-F318 HydrophobicContact CG2-CE1 3.68Å; I311-F318 HydrophobicContact CG2-CE2 4.02Å; I311-F318 HydrophobicContact CG2-CZ 3.58Å; I311-F327 HydrophobicContact CD1-CD1 4.04Å; I311-F327 HydrophobicContact CD1-CE1 3.7Å; I311-F327 HydrophobicContact CG1-CE1 4.28Å; I311-I328 HydrophobicContact CD1-CD1 4.17Å; I311-I328 HydrophobicContact CD1-CG1 3.88Å
312	A	95.2	Very high	95.1	Very high	47 Å²	47	58.8 Å²	58.8	39%	0.388	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	135.8	173.5	0	0	0	0	0	110.9	H314 L342 E346	A312-H314 PolarHBondContact O-N 3.44Å; A312-L342 HydrophobicContact CB-CD1 4.44Å; A312-L342 HydrophobicContact CB-CD2 4.06Å; A312-E346 WeakPolarHBondContact CA-OE1 3.33Å
313	G	94.6	Very high	95.4	Very high	42 Å²	42	54.8 Å²	54.8	43%	0.433	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	-12.6	-170	0	0	0	0	0	114.5	E346	G313-E346 VanDerWaalsContact CA-OE2 3.24Å; G313-E346 WeakPolarHBondContact CA-OE2 3.35Å; G313-E346 PolarHBondContact N-OE1 3.28Å; G313-E346 PolarHBondContact N-OE2 3.36Å
314	H	96.6	Very high	95.9	Very high	47 Å²	47	49.9 Å²	49.9	22%	0.218	26%	0.261	C	S	.	.			trans	-115.7	7.3	178.8	-68	-88.9	0	0	0	112.9	S292 L294 I311 A312 M316 E317 F318	S292-H314 VanDerWaalsContact CB-CE1 3.48Å; S292-H314 WeakPolarHBondContact CB-CE1 3.47Å; S292-H314 PolarHBondContact OG-ND1 2.97Å; L294-H314 HydrophobicContact CD2-CB 4.33Å; I311-H314 CarbonylContact O-C 3.02Å; I311-H314 WeakPolarHBondContact O-CA 3.26Å; I311-H314 WeakPolarHBondContact O-CB 3.46Å; I311-H314 PolarHBondContact O-N 3.43Å; A312-H314 PolarHBondContact O-N 3.44Å; H314-M316 VanDerWaalsContact C-N 3.32Å; H314-M316 PolarHBondContact O-N 2.93Å; H314-E317 IonicContact CE1-OE2 3.64Å; H314-E317 IonicContact CG-OE2 3.21Å; H314-E317 IonicContact ND1-OE2 2.68Å; H314-E317 PolarHBondContact ND1-OE2 3.1Å; H314-E317 PolarHBondContact O-N 2.94Å; H314-F318 HydrophobicContact CB-CD2 3.9Å; H314-F318 HydrophobicContact CB-CE2 4.05Å; H314-F318 WeakPolarHBondContact O-CD2 3.32Å; H314-F318 PolarHBondContact O-N 2.89Å
315	I	97.5	Very high	96.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.3	-42.2	-175	-61.3	-60.7	0	0	0	112	I311 S319 I328 L342 V343 E346 I347	I311-I315 HydrophobicContact CB-CD1 4.46Å; I311-I315 HydrophobicContact CD1-CD1 3.58Å; I311-I315 HydrophobicContact CG1-CD1 3.6Å; I311-I315 PolarHBondContact O-N 3.32Å; I315-S319 VanDerWaalsContact O-CB 3.29Å; I315-S319 WeakPolarHBondContact O-CB 3.31Å; I315-S319 PolarHBondContact O-N 3.05Å; I315-S319 PolarHBondContact O-OG 3.3Å; I315-I328 HydrophobicContact CG2-CD1 4.32Å; I315-L342 HydrophobicContact CG1-CD2 4.47Å; I315-V343 HydrophobicContact CD1-CG2 3.96Å; I315-V343 HydrophobicContact CG2-CB 4.46Å; I315-V343 HydrophobicContact CG2-CG1 3.69Å; I315-E346 HydrophobicContact CB-CB 3.92Å; I315-E346 HydrophobicContact CB-CG 4.46Å; I315-E346 VanDerWaalsContact CB-OE2 3.31Å; I315-E346 WeakPolarHBondContact CB-OE2 3.31Å; I315-E346 HydrophobicContact CG1-CB 4.19Å; I315-E346 HydrophobicContact CG1-CG 4.26Å; I315-E346 WeakPolarHBondContact CG1-OE1 3.34Å; I315-E346 WeakPolarHBondContact CG1-OE2 3.46Å; I315-E346 HydrophobicContact CG2-CB 4.37Å; I315-E346 PolarHBondContact N-OE2 2.81Å; I315-I347 HydrophobicContact CG2-CG2 3.49Å; I315-I347 VanDerWaalsContact CG2-CG2 3.49Å
316	M	96.7	Very high	96.7	Very high	39 Å²	39	45.8 Å²	45.8	19%	0.192	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-45.8	177.4	-80.1	-62.9	-58.8	0	0	112.1	H314 S319 Q320 I347 A350 L354	H314-M316 VanDerWaalsContact C-N 3.32Å; H314-M316 PolarHBondContact O-N 2.93Å; M316-S319 PolarHBondContact O-N 3.16Å; M316-Q320 PolarHBondContact O-N 3.43Å; M316-I347 HydrophobicContact SD-CB 4.23Å; M316-I347 HydrophobicContact SD-CG2 4.03Å; M316-A350 HydrophobicContact CE-CB 3.5Å; M316-A350 HydrophobicContact SD-CB 3.91Å; M316-L354 HydrophobicContact CE-CD1 4.39Å; M316-L354 HydrophobicContact CE-CD2 3.73Å; M316-L354 HydrophobicContact CE-CG 3.92Å; M316-L354 HydrophobicContact SD-CD1 3.8Å; M316-L354 HydrophobicContact SD-CD2 4.17Å; M316-L354 HydrophobicContact SD-CG 4Å
317	E	97	Very high	96.9	Very high	47 Å²	47	46.3 Å²	46.3	22%	0.22	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-48.3	179.1	-169	-160.5	172.2	0	0	111.2	R291 S292 L295 H314 S319 Q320 D321	R291-E317 WeakPolarHBondContact CA-OE1 3.4Å; S292-E317 WeakPolarHBondContact CB-OE2 3.36Å; S292-E317 PolarHBondContact N-OE1 3.29Å; S292-E317 VanDerWaalsContact OG-CD 3.27Å; S292-E317 PolarHBondContact OG-OE1 3.49Å; S292-E317 PolarHBondContact OG-OE2 3.4Å; L295-E317 HydrophobicContact CD2-CG 3.89Å; L295-E317 WeakPolarHBondContact CD2-OE1 3.49Å; H314-E317 IonicContact CE1-OE2 3.64Å; H314-E317 IonicContact CG-OE2 3.21Å; H314-E317 IonicContact ND1-OE2 2.68Å; H314-E317 PolarHBondContact ND1-OE2 3.1Å; H314-E317 PolarHBondContact O-N 2.94Å; E317-S319 VanDerWaalsContact C-N 3.29Å; E317-S319 PolarHBondContact O-N 3.42Å; E317-Q320 PolarHBondContact O-N 3.49Å; E317-D321 PolarHBondContact O-N 3.25Å
318	F	98.1	Very high	97	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-39.7	175.8	-88	-116.8	0	0	0	111.1	L294 L295 F298 L306 I311 H314 Q320 D321 G324 S325 F327 I328	L294-F318 HydrophobicContact CD2-CE2 4.4Å; L294-F318 HydrophobicContact CG-CE2 4.17Å; L294-F318 HydrophobicContact CG-CZ 4.14Å; L295-F318 HydrophobicContact CB-CD2 4.21Å; L295-F318 HydrophobicContact CB-CE2 3.67Å; L295-F318 HydrophobicContact CB-CZ 4.13Å; L295-F318 HydrophobicContact CD1-CD1 4.06Å; L295-F318 HydrophobicContact CD1-CD2 3.94Å; L295-F318 HydrophobicContact CD1-CE1 3.97Å; L295-F318 HydrophobicContact CD1-CE2 3.87Å; L295-F318 HydrophobicContact CD1-CG 4.03Å; L295-F318 HydrophobicContact CD1-CZ 3.88Å; L295-F318 HydrophobicContact CG-CE2 4.33Å; F298-F318 HydrophobicContact CB-CE1 4.17Å; F298-F318 HydrophobicContact CB-CZ 4.08Å; F298-F318 HydrophobicContact CD1-CD1 4.41Å; F298-F318 AromaticContact CD1-CE1 3.64Å; F298-F318 HydrophobicContact CD1-CE1 3.64Å; F298-F318 HydrophobicContact CD1-CZ 4.3Å; F298-F318 HydrophobicContact CE1-CE1 4.24Å; F298-F318 AromaticContact CG-CE1 3.87Å; F298-F318 HydrophobicContact CG-CE1 3.87Å; F298-F318 HydrophobicContact CG-CZ 4.3Å; L306-F318 HydrophobicContact CD2-CE1 4.14Å; L306-F318 HydrophobicContact CD2-CZ 4.42Å; I311-F318 HydrophobicContact CB-CE2 4.42Å; I311-F318 HydrophobicContact CB-CZ 4.42Å; I311-F318 HydrophobicContact CD1-CB 4.32Å; I311-F318 HydrophobicContact CD1-CD1 3.92Å; I311-F318 HydrophobicContact CD1-CE1 4.46Å; I311-F318 HydrophobicContact CD1-CG 4.1Å; I311-F318 HydrophobicContact CG2-CD1 4.2Å; I311-F318 HydrophobicContact CG2-CE1 3.68Å; I311-F318 HydrophobicContact CG2-CE2 4.02Å; I311-F318 HydrophobicContact CG2-CZ 3.58Å; H314-F318 HydrophobicContact CB-CD2 3.9Å; H314-F318 HydrophobicContact CB-CE2 4.05Å; H314-F318 WeakPolarHBondContact O-CD2 3.32Å; H314-F318 PolarHBondContact O-N 2.89Å; F318-Q320 PolarHBondContact O-N 3.21Å; F318-D321 PolarHBondContact O-N 3.37Å; F318-D321 VanDerWaalsContact O-N 3.08Å; F318-G324 CarbonylContact O-C 3.59Å; F318-G324 VanDerWaalsContact O-CA 3.26Å; F318-G324 WeakPolarHBondContact O-CA 3.38Å; F318-S325 PolarHBondContact O-N 3.37Å; F318-F327 HydrophobicContact CD1-CD1 4.45Å; F318-I328 HydrophobicContact CB-CD1 3.66Å; F318-I328 HydrophobicContact CB-CG1 4.48Å
319	S	98.3	Very high	97.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-27.6	178.5	-61.1	0	0	0	0	113.3	I315 M316 E317 S325 I328 F359 G360	I315-S319 VanDerWaalsContact O-CB 3.29Å; I315-S319 WeakPolarHBondContact O-CB 3.31Å; I315-S319 PolarHBondContact O-N 3.05Å; I315-S319 PolarHBondContact O-OG 3.3Å; M316-S319 PolarHBondContact O-N 3.16Å; E317-S319 VanDerWaalsContact C-N 3.29Å; E317-S319 PolarHBondContact O-N 3.42Å; S319-S325 WeakPolarHBondContact O-CB 3.3Å; S319-I328 WeakPolarHBondContact OG-CD1 3.17Å; S319-F359 CarbonylContact O-C 3.42Å; S319-F359 VanDerWaalsContact O-C 3.32Å; S319-G360 WeakPolarHBondContact O-CA 3.38Å; S319-G360 PolarHBondContact O-N 3.49Å
320	Q	97.6	Very high	97.2	Very high	66 Å²	66	40.7 Å²	40.7	31%	0.308	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.5	176.8	-66.9	177.8	-33.9	0	0	113.2	M316 E317 F318 Q353 L354 F359	M316-Q320 PolarHBondContact O-N 3.43Å; E317-Q320 PolarHBondContact O-N 3.49Å; F318-Q320 PolarHBondContact O-N 3.21Å; Q320-Q353 VanDerWaalsContact NE2-NE2 3.1Å; Q320-L354 HydrophobicContact CG-CD2 3.68Å; Q320-F359 WeakPolarHBondContact O-CD2 3.38Å
321	D	97.6	Very high	97.3	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.043	20%	0.201	C	C	.	.	S	Bend	trans	-104.4	142.8	172.4	-173.5	-85.9	0	0	0	111.3	R291 L295 R299 E317 F318 H323 G324 S325	R291-D321 IonicContact NE-OD2 3.29Å; R291-D321 PolarHBondContact NE-OD2 3.31Å; L295-D321 HydrophobicContact CD1-CB 3.99Å; L295-D321 HydrophobicContact CD2-CB 3.76Å; L295-D321 HydrophobicContact CG-CB 4.47Å; R299-D321 IonicContact CZ-OD2 2.63Å; R299-D321 IonicContact NE-OD2 2.96Å; R299-D321 IonicContact NH1-OD1 2.8Å; R299-D321 PolarHBondContact NH1-OD1 3.2Å; R299-D321 IonicContact NH1-OD2 3.89Å; R299-D321 PolarHBondContact NH1-OD2 3.46Å; E317-D321 PolarHBondContact O-N 3.25Å; F318-D321 PolarHBondContact O-N 3.37Å; F318-D321 VanDerWaalsContact O-N 3.08Å; D321-H323 VanDerWaalsContact C-N 3.35Å; D321-H323 PolarHBondContact O-N 3.03Å; D321-H323 IonicContact OD1-CD2 3.45Å; D321-H323 PolarHBondContact OD1-N 3.2Å; D321-G324 PolarHBondContact O-N 3.38Å; D321-G324 PolarHBondContact OD1-N 2.93Å; D321-G324 VanDerWaalsContact OD1-N 3.14Å; D321-S325 WeakPolarHBondContact O-CB 3.5Å; D321-S325 PolarHBondContact O-N 2.77Å
322	Q	97.6	Very high	97.3	Very high	117 Å²	117	39.9 Å²	39.9	55%	0.547	20%	0.201	S	C	.	.	H	α-helix	trans	-58.3	-43.2	-179.9	-172.8	178.6	9.8	0	0	113.2	R326 F359	Q322-R326 WeakPolarHBondContact O-CB 3.41Å; Q322-F359 HydrophobicContact CB-CD1 4.14Å; Q322-F359 HydrophobicContact CB-CD2 4.36Å; Q322-F359 HydrophobicContact CB-CE1 3.76Å; Q322-F359 HydrophobicContact CB-CE2 4Å; Q322-F359 HydrophobicContact CB-CG 4.44Å; Q322-F359 HydrophobicContact CB-CZ 3.68Å; Q322-F359 HydrophobicContact CG-CD1 4.24Å; Q322-F359 HydrophobicContact CG-CE1 3.73Å; Q322-F359 HydrophobicContact CG-CZ 4.06Å
323	H	96.9	Very high	97.3	Very high	93 Å²	93	41.2 Å²	41.2	43%	0.431	20%	0.2	S	C	.	.	H	α-helix	trans	-83.4	-39.6	179.9	-58.6	-84.2	0	0	0	110.7	F298 R299 D321 R326 F327	F298-H323 HydrophobicContact CE1-CB 4.04Å; R299-H323 HydrophobicContact CG-CB 4.39Å; D321-H323 VanDerWaalsContact C-N 3.35Å; D321-H323 PolarHBondContact O-N 3.03Å; D321-H323 IonicContact OD1-CD2 3.45Å; D321-H323 PolarHBondContact OD1-N 3.2Å; H323-R326 PolarHBondContact O-N 3.46Å; H323-F327 WeakPolarHBondContact O-CB 3.48Å; H323-F327 PolarHBondContact O-N 3.14Å
324	G	97.9	Very high	97.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-45.9	177.2	0	0	0	0	0	112.8	F318 D321 R326 F327 I328	F318-G324 CarbonylContact O-C 3.59Å; F318-G324 VanDerWaalsContact O-CA 3.26Å; F318-G324 WeakPolarHBondContact O-CA 3.38Å; D321-G324 PolarHBondContact O-N 3.38Å; D321-G324 PolarHBondContact OD1-N 2.93Å; D321-G324 VanDerWaalsContact OD1-N 3.14Å; G324-R326 PolarHBondContact O-N 2.84Å; G324-F327 WeakPolarHBondContact O-CB 3.28Å; G324-F327 PolarHBondContact O-N 3.22Å; G324-I328 WeakPolarHBondContact O-CG1 3.42Å; G324-I328 PolarHBondContact O-N 3.01Å
325	S	98.3	Very high	97.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-44	177.9	176.5	0	0	0	0	110.6	F318 S319 D321 F327 I328 Q329 F359	F318-S325 PolarHBondContact O-N 3.37Å; S319-S325 WeakPolarHBondContact O-CB 3.3Å; D321-S325 WeakPolarHBondContact O-CB 3.5Å; D321-S325 PolarHBondContact O-N 2.77Å; S325-F327 VanDerWaalsContact C-N 3.29Å; S325-F327 PolarHBondContact O-N 3.36Å; S325-I328 PolarHBondContact O-N 3.29Å; S325-Q329 WeakPolarHBondContact O-CB 3.23Å; S325-Q329 WeakPolarHBondContact O-CG 3.43Å; S325-Q329 PolarHBondContact O-N 3.36Å; S325-Q329 PolarHBondContact O-NE2 3.19Å; S325-Q329 PolarHBondContact OG-NE2 3.12Å; S325-F359 PolarHBondContact OG-O 3Å
326	R	98.1	Very high	97.2	Very high	142 Å²	142	51.1 Å²	51.1	54%	0.536	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-38	177	-175.1	56.3	173	-171.4	0.2	112.1	Q322 H323 G324 L330	Q322-R326 WeakPolarHBondContact O-CB 3.41Å; H323-R326 PolarHBondContact O-N 3.46Å; G324-R326 PolarHBondContact O-N 2.84Å; R326-L330 HydrophobicContact CG-CD1 4.17Å; R326-L330 VanDerWaalsContact O-CG 3.29Å; R326-L330 WeakPolarHBondContact O-CG 3.36Å; R326-L330 PolarHBondContact O-N 2.85Å; R326-L330 VanDerWaalsContact O-N 3.15Å
327	F	98	Very high	97.2	Very high	23 Å²	23	53.8 Å²	53.8	10%	0.101	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-49.8	173.2	169.3	-93.7	0	0	0	111.9	F298 L306 L308 I311 F318 H323 G324 S325 Q329 L330 K331	F298-F327 HydrophobicContact CE1-CB 4.14Å; F298-F327 HydrophobicContact CE2-CB 4.45Å; F298-F327 AromaticContact CE2-CD2 3.83Å; F298-F327 HydrophobicContact CE2-CD2 3.83Å; F298-F327 HydrophobicContact CE2-CE2 4.33Å; F298-F327 HydrophobicContact CE2-CG 4.22Å; F298-F327 HydrophobicContact CZ-CB 3.66Å; F298-F327 AromaticContact CZ-CD2 3.87Å; F298-F327 HydrophobicContact CZ-CD2 3.87Å; F298-F327 AromaticContact CZ-CG 3.9Å; F298-F327 HydrophobicContact CZ-CG 3.9Å; L306-F327 HydrophobicContact CB-CE2 3.9Å; L306-F327 HydrophobicContact CB-CZ 3.86Å; L306-F327 HydrophobicContact CD2-CE1 4.33Å; L306-F327 HydrophobicContact CD2-CE2 4.37Å; L306-F327 HydrophobicContact CD2-CZ 4.02Å; L306-F327 HydrophobicContact CG-CE1 4.48Å; L306-F327 HydrophobicContact CG-CE2 4.33Å; L306-F327 HydrophobicContact CG-CZ 3.84Å; L306-F327 VanDerWaalsContact O-CE2 3.32Å; L306-F327 WeakPolarHBondContact O-CE2 3.27Å; L306-F327 WeakPolarHBondContact O-CZ 3.45Å; L308-F327 HydrophobicContact CD2-CE1 4.34Å; I311-F327 HydrophobicContact CD1-CD1 4.04Å; I311-F327 HydrophobicContact CD1-CE1 3.7Å; I311-F327 HydrophobicContact CG1-CE1 4.28Å; F318-F327 HydrophobicContact CD1-CD1 4.45Å; H323-F327 WeakPolarHBondContact O-CB 3.48Å; H323-F327 PolarHBondContact O-N 3.14Å; G324-F327 WeakPolarHBondContact O-CB 3.28Å; G324-F327 PolarHBondContact O-N 3.22Å; S325-F327 VanDerWaalsContact C-N 3.29Å; S325-F327 PolarHBondContact O-N 3.36Å; F327-Q329 PolarHBondContact O-N 3.48Å; F327-L330 PolarHBondContact O-N 3.35Å; F327-K331 HydrophobicContact CD2-CG 4.34Å; F327-K331 HydrophobicContact CE1-CG 4.25Å; F327-K331 HydrophobicContact CE2-CD 4.38Å; F327-K331 HydrophobicContact CE2-CG 4.04Å; F327-K331 HydrophobicContact CZ-CD 4.44Å; F327-K331 HydrophobicContact CZ-CG 3.99Å; F327-K331 VanDerWaalsContact O-CG 3.31Å; F327-K331 WeakPolarHBondContact O-CG 3.41Å; F327-K331 PolarHBondContact O-N 3.43Å
328	I	98.2	Very high	97.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-48.1	178.1	-68.4	169.6	0	0	0	110.5	L308 I311 I315 F318 S319 G324 S325 L330 K331 L332 V343 V363	L308-I328 HydrophobicContact CD2-CG1 4.3Å; L308-I328 HydrophobicContact CD2-CG2 4.49Å; I311-I328 HydrophobicContact CD1-CD1 4.17Å; I311-I328 HydrophobicContact CD1-CG1 3.88Å; I315-I328 HydrophobicContact CG2-CD1 4.32Å; F318-I328 HydrophobicContact CB-CD1 3.66Å; F318-I328 HydrophobicContact CB-CG1 4.48Å; S319-I328 WeakPolarHBondContact OG-CD1 3.17Å; G324-I328 WeakPolarHBondContact O-CG1 3.42Å; G324-I328 PolarHBondContact O-N 3.01Å; S325-I328 PolarHBondContact O-N 3.29Å; I328-L330 PolarHBondContact O-N 3.5Å; I328-K331 PolarHBondContact O-N 3.46Å; I328-L332 HydrophobicContact CG2-CD1 3.67Å; I328-L332 HydrophobicContact CG2-CG 4.02Å; I328-L332 WeakPolarHBondContact O-CB 3.46Å; I328-L332 WeakPolarHBondContact O-CG 3.17Å; I328-L332 PolarHBondContact O-N 2.73Å; I328-V343 HydrophobicContact CG2-CG1 4.22Å; I328-V363 HydrophobicContact CB-CG2 4.29Å; I328-V363 HydrophobicContact CG2-CG1 3.78Å; I328-V363 HydrophobicContact CG2-CG2 4.02Å
329	Q	98.3	Very high	97	Very high	19 Å²	19	57.3 Å²	57.3	9%	0.089	29%	0.285	C	S	.	.	H	α-helix	trans	-53.5	-52.5	177.7	-69.7	162.9	45.3	0	0	112.1	S325 F327 K331 L332 Y362 K366	S325-Q329 WeakPolarHBondContact O-CB 3.23Å; S325-Q329 WeakPolarHBondContact O-CG 3.43Å; S325-Q329 PolarHBondContact O-N 3.36Å; S325-Q329 PolarHBondContact O-NE2 3.19Å; S325-Q329 PolarHBondContact OG-NE2 3.12Å; F327-Q329 PolarHBondContact O-N 3.48Å; Q329-K331 VanDerWaalsContact C-N 3.29Å; Q329-K331 PolarHBondContact O-N 3.3Å; Q329-L332 PolarHBondContact O-N 3.04Å; Q329-Y362 VanDerWaalsContact NE2-CB 3.28Å; Q329-K366 HydrophobicContact CB-CG 4.23Å; Q329-K366 HydrophobicContact CG-CG 4.1Å
330	L	97.1	Very high	97	Very high	88 Å²	88	59.5 Å²	59.5	46%	0.461	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-31.6	-178.1	-71.2	169.9	0	0	0	112.8	R326 F327 I328	R326-L330 HydrophobicContact CG-CD1 4.17Å; R326-L330 VanDerWaalsContact O-CG 3.29Å; R326-L330 WeakPolarHBondContact O-CG 3.36Å; R326-L330 PolarHBondContact O-N 2.85Å; R326-L330 VanDerWaalsContact O-N 3.15Å; F327-L330 PolarHBondContact O-N 3.35Å; I328-L330 PolarHBondContact O-N 3.5Å
331	K	96.8	Very high	97	Very high	55 Å²	55	61 Å²	61	24%	0.239	30%	0.3	C	S	.	.	H	α-helix	trans	-76.9	-41.8	177.2	-69.4	-74.5	-173.2	170.1	0	112.1	L306 Q307 L308 F327 I328 Q329 E333 R334 A335	L306-K331 WeakPolarHBondContact O-CE 3.42Å; L306-K331 PolarHBondContact O-NZ 3.04Å; Q307-K331 VanDerWaalsContact CD-NZ 3.31Å; L308-K331 HydrophobicContact CD1-CB 3.79Å; L308-K331 HydrophobicContact CD2-CB 3.73Å; L308-K331 HydrophobicContact CD2-CG 4.32Å; L308-K331 HydrophobicContact CG-CB 3.63Å; L308-K331 HydrophobicContact CG-CG 4.28Å; F327-K331 HydrophobicContact CD2-CG 4.34Å; F327-K331 HydrophobicContact CE1-CG 4.25Å; F327-K331 HydrophobicContact CE2-CD 4.38Å; F327-K331 HydrophobicContact CE2-CG 4.04Å; F327-K331 HydrophobicContact CZ-CD 4.44Å; F327-K331 HydrophobicContact CZ-CG 3.99Å; F327-K331 VanDerWaalsContact O-CG 3.31Å; F327-K331 WeakPolarHBondContact O-CG 3.41Å; F327-K331 PolarHBondContact O-N 3.43Å; I328-K331 PolarHBondContact O-N 3.46Å; Q329-K331 VanDerWaalsContact C-N 3.29Å; Q329-K331 PolarHBondContact O-N 3.3Å; K331-E333 PolarHBondContact O-N 2.8Å; K331-R334 PolarHBondContact O-N 3.27Å; K331-A335 WeakPolarHBondContact O-CB 3.26Å; K331-A335 PolarHBondContact O-N 2.69Å
332	L	96.9	Very high	97	Very high	3 Å²	3	63 Å²	63	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-57.4	-32.9	-177.7	-78	174.2	0	0	0	113.4	L308 I328 Q329 R334 R340 V343 V363 K366 F367	L308-L332 HydrophobicContact CD1-CD2 4.27Å; I328-L332 HydrophobicContact CG2-CD1 3.67Å; I328-L332 HydrophobicContact CG2-CG 4.02Å; I328-L332 WeakPolarHBondContact O-CB 3.46Å; I328-L332 WeakPolarHBondContact O-CG 3.17Å; I328-L332 PolarHBondContact O-N 2.73Å; Q329-L332 PolarHBondContact O-N 3.04Å; L332-R334 VanDerWaalsContact C-N 3.27Å; L332-R334 PolarHBondContact O-N 2.71Å; L332-R340 HydrophobicContact CD2-CB 4.48Å; L332-R340 HydrophobicContact CD2-CG 3.96Å; L332-R340 PolarHBondContact O-NE 3.24Å; L332-R340 PolarHBondContact O-NH2 2.89Å; L332-V343 HydrophobicContact CD2-CB 4.42Å; L332-V343 HydrophobicContact CD2-CG1 4.31Å; L332-V363 HydrophobicContact CD1-CG1 4.3Å; L332-K366 HydrophobicContact CD1-CB 3.98Å; L332-F367 HydrophobicContact CD1-CD2 4.15Å; L332-F367 HydrophobicContact CD1-CE2 3.72Å; L332-F367 HydrophobicContact CD1-CZ 4.22Å; L332-F367 HydrophobicContact CD2-CE1 4.33Å; L332-F367 HydrophobicContact CD2-CE2 4.11Å; L332-F367 HydrophobicContact CD2-CZ 3.74Å
333	E	94.8	Very high	97	Very high	76 Å²	76	57.4 Å²	57.4	36%	0.355	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-37.2	176.8	-65.2	-177.1	173.7	0	0	112.5	K331 R340 K366 F370	K331-E333 PolarHBondContact O-N 2.8Å; E333-R340 PolarHBondContact O-NH2 3.49Å; E333-K366 HydrophobicContact CG-CD 4.42Å; E333-K366 WeakPolarHBondContact OE1-CE 3.5Å; E333-K366 IonicContact OE1-NZ 2.71Å; E333-K366 PolarHBondContact OE1-NZ 3.42Å; E333-F370 HydrophobicContact CB-CE2 4.49Å; E333-F370 HydrophobicContact CG-CD2 4.19Å; E333-F370 HydrophobicContact CG-CE2 3.62Å; E333-F370 HydrophobicContact CG-CZ 3.97Å
334	R	94.4	Very high	97	Very high	230 Å²	230	53.4 Å²	53.4	87%	0.868	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-3.6	-176.4	-57.4	-176.2	-173.3	-176.6	1.4	114.1	K331 L332	K331-R334 PolarHBondContact O-N 3.27Å; L332-R334 VanDerWaalsContact C-N 3.27Å; L332-R334 PolarHBondContact O-N 2.71Å
335	A	95.2	Very high	97	Very high	9 Å²	9	57 Å²	57	7%	0.074	29%	0.29	C	S	.	.			trans	-63	145.4	-179.4	0	0	0	0	0	112.3	L308 K331 E339 R340	L308-A335 HydrophobicContact CD1-CB 3.75Å; K331-A335 WeakPolarHBondContact O-CB 3.26Å; K331-A335 PolarHBondContact O-N 2.69Å; A335-E339 HydrophobicContact CB-CB 4.04Å; A335-R340 HydrophobicContact CB-CG 3.85Å; A335-R340 PolarHBondContact O-NH2 3.33Å
336	S	96.9	Very high	96.9	Very high	58 Å²	58	59.4 Å²	59.4	41%	0.406	30%	0.302	S	S	.	.			trans	-66	158.9	167.3	64	0	0	0	0	111.5	A338 E339 R340	S336-A338 PolarHBondContact O-N 2.83Å; S336-E339 WeakPolarHBondContact CB-OE2 3.46Å; S336-E339 PolarHBondContact N-OE2 3.37Å; S336-E339 PolarHBondContact O-N 3.44Å; S336-E339 VanDerWaalsContact O-N 3.11Å; S336-E339 WeakPolarHBondContact OG-CG 3.29Å; S336-E339 PolarHBondContact OG-N 2.93Å; S336-E339 PolarHBondContact OG-OE2 2.9Å; S336-R340 PolarHBondContact O-N 3.37Å
337	S	96.4	Very high	96.9	Very high	95 Å²	95	52.7 Å²	52.7	66%	0.664	28%	0.276	S	S	*	.	H	α-helix	trans	-56.7	-32.9	176.7	-50.8	0	0	0	0	112.8	Q341	S337-Q341 WeakPolarHBondContact O-CB 3.43Å; S337-Q341 PolarHBondContact O-N 3.06Å
338	A	96.4	Very high	96.9	Very high	74 Å²	74	53.9 Å²	53.9	61%	0.612	28%	0.283	S	S	*	.	H	α-helix	trans	-68.6	-43.3	176.4	0	0	0	0	0	112.4	S336 Q341 L342	S336-A338 PolarHBondContact O-N 2.83Å; A338-Q341 PolarHBondContact O-N 3.39Å; A338-L342 PolarHBondContact O-N 2.77Å
339	E	96.1	Very high	96.7	Very high	47 Å²	47	61.1 Å²	61.1	22%	0.22	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-40.3	175.3	-71.4	164.8	119.4	0	0	111.8	L308 A335 S336 Q341 L342 V343	L308-E339 HydrophobicContact CD1-CB 4.26Å; A335-E339 HydrophobicContact CB-CB 4.04Å; S336-E339 WeakPolarHBondContact CB-OE2 3.46Å; S336-E339 PolarHBondContact N-OE2 3.37Å; S336-E339 PolarHBondContact O-N 3.44Å; S336-E339 VanDerWaalsContact O-N 3.11Å; S336-E339 WeakPolarHBondContact OG-CG 3.29Å; S336-E339 PolarHBondContact OG-N 2.93Å; S336-E339 PolarHBondContact OG-OE2 2.9Å; E339-Q341 VanDerWaalsContact C-N 3.32Å; E339-Q341 PolarHBondContact O-N 3.35Å; E339-L342 PolarHBondContact O-N 3.4Å; E339-V343 WeakPolarHBondContact O-CG2 3.49Å; E339-V343 PolarHBondContact O-N 2.78Å; E339-V343 VanDerWaalsContact O-N 3.17Å
340	R	97.2	Very high	96.5	Very high	45 Å²	45	61.7 Å²	61.7	17%	0.17	33%	0.325	C	S	.	.	H	α-helix	trans	-59.9	-43.2	172.4	-67.1	-171	-173.7	123.6	5.8	111.2	L332 E333 A335 S336 V343 F344 F367	L332-R340 HydrophobicContact CD2-CB 4.48Å; L332-R340 HydrophobicContact CD2-CG 3.96Å; L332-R340 PolarHBondContact O-NE 3.24Å; L332-R340 PolarHBondContact O-NH2 2.89Å; E333-R340 PolarHBondContact O-NH2 3.49Å; A335-R340 HydrophobicContact CB-CG 3.85Å; A335-R340 PolarHBondContact O-NH2 3.33Å; S336-R340 PolarHBondContact O-N 3.37Å; R340-V343 PolarHBondContact O-N 2.95Å; R340-F344 VanDerWaalsContact O-CB 3.24Å; R340-F344 WeakPolarHBondContact O-CB 3.44Å; R340-F344 PolarHBondContact O-N 3.42Å; R340-F367 HydrophobicContact CB-CE1 4.25Å; R340-F367 WeakPolarHBondContact O-CE1 3.45Å; R340-F367 WeakPolarHBondContact O-CZ 3.3Å
341	Q	97.9	Very high	96.5	Very high	97 Å²	97	57.5 Å²	57.5	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-65.9	-36.4	179.2	-173.6	60.3	20.2	0	0	113	S337 A338 E339 F344 S345	S337-Q341 WeakPolarHBondContact O-CB 3.43Å; S337-Q341 PolarHBondContact O-N 3.06Å; A338-Q341 PolarHBondContact O-N 3.39Å; E339-Q341 VanDerWaalsContact C-N 3.32Å; E339-Q341 PolarHBondContact O-N 3.35Å; Q341-F344 PolarHBondContact O-N 3.15Å; Q341-S345 WeakPolarHBondContact O-CB 3.44Å; Q341-S345 PolarHBondContact O-N 3.31Å; Q341-S345 PolarHBondContact O-OG 2.98Å
342	L	96.9	Very high	96.6	Very high	51 Å²	51	58.2 Å²	58.2	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-57.8	172.5	-175.7	164.5	0	0	0	110.1	R309 A312 I315 A338 E339 F344 S345 E346	R309-L342 HydrophobicContact CB-CD1 4.36Å; A312-L342 HydrophobicContact CB-CD1 4.44Å; A312-L342 HydrophobicContact CB-CD2 4.06Å; I315-L342 HydrophobicContact CG1-CD2 4.47Å; A338-L342 PolarHBondContact O-N 2.77Å; E339-L342 PolarHBondContact O-N 3.4Å; L342-F344 VanDerWaalsContact C-N 3.27Å; L342-F344 PolarHBondContact O-N 3.2Å; L342-S345 PolarHBondContact O-N 3.48Å; L342-S345 PolarHBondContact O-OG 3.17Å; L342-E346 PolarHBondContact O-N 3.11Å
343	V	97.7	Very high	96.6	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-56.8	-42.7	178.4	177.3	0	0	0	0	111.1	L308 I315 I328 L332 E339 R340 S345 E346 I347 F367	L308-V343 HydrophobicContact CB-CG2 4.06Å; L308-V343 HydrophobicContact CD1-CG2 4Å; L308-V343 HydrophobicContact CD2-CG2 3.92Å; L308-V343 HydrophobicContact CG-CG2 4.2Å; I315-V343 HydrophobicContact CD1-CG2 3.96Å; I315-V343 HydrophobicContact CG2-CB 4.46Å; I315-V343 HydrophobicContact CG2-CG1 3.69Å; I328-V343 HydrophobicContact CG2-CG1 4.22Å; L332-V343 HydrophobicContact CD2-CB 4.42Å; L332-V343 HydrophobicContact CD2-CG1 4.31Å; E339-V343 WeakPolarHBondContact O-CG2 3.49Å; E339-V343 PolarHBondContact O-N 2.78Å; E339-V343 VanDerWaalsContact O-N 3.17Å; R340-V343 PolarHBondContact O-N 2.95Å; V343-S345 PolarHBondContact O-N 2.76Å; V343-E346 PolarHBondContact O-N 3.34Å; V343-I347 PolarHBondContact O-N 3.42Å; V343-F367 HydrophobicContact CB-CE2 4.47Å; V343-F367 HydrophobicContact CB-CZ 3.96Å; V343-F367 HydrophobicContact CG1-CE2 3.74Å; V343-F367 HydrophobicContact CG1-CZ 3.74Å
344	F	98.3	Very high	96.8	Very high	8 Å²	8	59.4 Å²	59.4	4%	0.035	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-43.1	180	-168.2	-105.1	0	0	0	112.8	R340 Q341 L342 E346 I347 L348 F367 Q375 A378 L379	R340-F344 VanDerWaalsContact O-CB 3.24Å; R340-F344 WeakPolarHBondContact O-CB 3.44Å; R340-F344 PolarHBondContact O-N 3.42Å; Q341-F344 PolarHBondContact O-N 3.15Å; L342-F344 VanDerWaalsContact C-N 3.27Å; L342-F344 PolarHBondContact O-N 3.2Å; F344-E346 VanDerWaalsContact C-N 3.28Å; F344-E346 PolarHBondContact O-N 3.24Å; F344-I347 WeakPolarHBondContact O-CG1 3.4Å; F344-I347 PolarHBondContact O-N 3.08Å; F344-L348 HydrophobicContact CE1-CB 4.33Å; F344-L348 HydrophobicContact CE1-CD1 4.07Å; F344-L348 HydrophobicContact CE1-CD2 3.88Å; F344-L348 HydrophobicContact CE1-CG 4.32Å; F344-L348 HydrophobicContact CZ-CD1 3.82Å; F344-L348 HydrophobicContact CZ-CD2 4.47Å; F344-L348 WeakPolarHBondContact O-CB 3.45Å; F344-L348 PolarHBondContact O-N 3.46Å; F344-F367 HydrophobicContact CB-CD1 4.48Å; F344-F367 HydrophobicContact CB-CE1 3.73Å; F344-F367 HydrophobicContact CB-CZ 3.93Å; F344-F367 AromaticContact CD2-CD1 3.55Å; F344-F367 HydrophobicContact CD2-CD1 3.55Å; F344-F367 HydrophobicContact CD2-CD2 4.48Å; F344-F367 AromaticContact CD2-CE1 3.65Å; F344-F367 HydrophobicContact CD2-CE1 3.65Å; F344-F367 AromaticContact CD2-CG 3.99Å; F344-F367 HydrophobicContact CD2-CG 3.99Å; F344-F367 HydrophobicContact CD2-CZ 4.17Å; F344-F367 HydrophobicContact CE2-CD1 4.23Å; F344-F367 HydrophobicContact CE2-CG 4.46Å; F344-F367 HydrophobicContact CG-CD1 4.43Å; F344-F367 HydrophobicContact CG-CE1 4.14Å; F344-Q375 HydrophobicContact CD1-CG 3.83Å; F344-Q375 HydrophobicContact CD2-CB 4.01Å; F344-Q375 HydrophobicContact CD2-CG 3.94Å; F344-Q375 HydrophobicContact CE1-CB 4.17Å; F344-Q375 HydrophobicContact CE1-CG 3.88Å; F344-Q375 HydrophobicContact CE2-CB 3.64Å; F344-Q375 HydrophobicContact CE2-CG 3.98Å; F344-Q375 HydrophobicContact CG-CB 4.42Å; F344-Q375 HydrophobicContact CG-CG 3.85Å; F344-Q375 HydrophobicContact CZ-CB 3.74Å; F344-Q375 HydrophobicContact CZ-CG 3.96Å; F344-Q375 VanDerWaalsContact CZ-O 3.27Å; F344-Q375 WeakPolarHBondContact CZ-O 3.24Å; F344-A378 HydrophobicContact CE1-CB 4.21Å; F344-A378 HydrophobicContact CZ-CB 3.98Å; F344-L379 HydrophobicContact CE2-CD1 3.88Å; F344-L379 HydrophobicContact CE2-CD2 4.2Å; F344-L379 HydrophobicContact CE2-CG 3.71Å; F344-L379 HydrophobicContact CZ-CG 4.09Å
345	S	97.1	Very high	97	Very high	75 Å²	75	48.4 Å²	48.4	52%	0.524	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-33	-177	69.8	0	0	0	0	113.1	Q341 L342 V343	Q341-S345 WeakPolarHBondContact O-CB 3.44Å; Q341-S345 PolarHBondContact O-N 3.31Å; Q341-S345 PolarHBondContact O-OG 2.98Å; L342-S345 PolarHBondContact O-N 3.48Å; L342-S345 PolarHBondContact O-OG 3.17Å; V343-S345 PolarHBondContact O-N 2.76Å
346	E	96.9	Very high	97.2	Very high	53 Å²	53	50 Å²	50	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-77.1	-35.9	177.1	-68.6	-173.8	-138.9	0	0	112.8	A312 G313 I315 L342 V343 F344	A312-E346 WeakPolarHBondContact CA-OE1 3.33Å; G313-E346 VanDerWaalsContact CA-OE2 3.24Å; G313-E346 WeakPolarHBondContact CA-OE2 3.35Å; G313-E346 PolarHBondContact N-OE1 3.28Å; G313-E346 PolarHBondContact N-OE2 3.36Å; I315-E346 HydrophobicContact CB-CB 3.92Å; I315-E346 HydrophobicContact CB-CG 4.46Å; I315-E346 VanDerWaalsContact CB-OE2 3.31Å; I315-E346 WeakPolarHBondContact CB-OE2 3.31Å; I315-E346 HydrophobicContact CG1-CB 4.19Å; I315-E346 HydrophobicContact CG1-CG 4.26Å; I315-E346 WeakPolarHBondContact CG1-OE1 3.34Å; I315-E346 WeakPolarHBondContact CG1-OE2 3.46Å; I315-E346 HydrophobicContact CG2-CB 4.37Å; I315-E346 PolarHBondContact N-OE2 2.81Å; L342-E346 PolarHBondContact O-N 3.11Å; V343-E346 PolarHBondContact O-N 3.34Å; F344-E346 VanDerWaalsContact C-N 3.28Å; F344-E346 PolarHBondContact O-N 3.24Å
347	I	97.2	Very high	97.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-86.5	-26.1	-176.2	68.5	178.7	0	0	0	114.3	I315 M316 V343 F344 Q349 A350 A351 L354 V363 I364 F367	I315-I347 HydrophobicContact CG2-CG2 3.49Å; I315-I347 VanDerWaalsContact CG2-CG2 3.49Å; M316-I347 HydrophobicContact SD-CB 4.23Å; M316-I347 HydrophobicContact SD-CG2 4.03Å; V343-I347 PolarHBondContact O-N 3.42Å; F344-I347 WeakPolarHBondContact O-CG1 3.4Å; F344-I347 PolarHBondContact O-N 3.08Å; I347-Q349 VanDerWaalsContact C-N 3.32Å; I347-Q349 PolarHBondContact O-N 2.99Å; I347-A350 CarbonylContact O-C 3.06Å; I347-A350 PolarHBondContact O-N 3.5Å; I347-A351 VanDerWaalsContact O-CA 3.28Å; I347-A351 WeakPolarHBondContact O-CA 3.44Å; I347-A351 PolarHBondContact O-N 2.98Å; I347-L354 HydrophobicContact CB-CD1 3.83Å; I347-L354 HydrophobicContact CG2-CD1 3.72Å; I347-V363 HydrophobicContact CD1-CG1 4.15Å; I347-I364 HydrophobicContact CD1-CD1 4.05Å; I347-F367 HydrophobicContact CD1-CD2 3.56Å; I347-F367 HydrophobicContact CD1-CE2 3.4Å; I347-F367 VanDerWaalsContact CD1-CE2 3.4Å; I347-F367 HydrophobicContact CD1-CZ 4.29Å
348	L	97.4	Very high	97.3	Very high	48 Å²	48	46.9 Å²	46.9	25%	0.251	25%	0.251	S	S	.	.	S	Bend	trans	-57.2	-41.7	-168.3	178.7	62.9	0	0	0	113.4	F344 A350 A351 A378 L379 R382	F344-L348 HydrophobicContact CE1-CB 4.33Å; F344-L348 HydrophobicContact CE1-CD1 4.07Å; F344-L348 HydrophobicContact CE1-CD2 3.88Å; F344-L348 HydrophobicContact CE1-CG 4.32Å; F344-L348 HydrophobicContact CZ-CD1 3.82Å; F344-L348 HydrophobicContact CZ-CD2 4.47Å; F344-L348 WeakPolarHBondContact O-CB 3.45Å; F344-L348 PolarHBondContact O-N 3.46Å; L348-A350 PolarHBondContact O-N 3Å; L348-A351 WeakPolarHBondContact O-CB 3.38Å; L348-A351 PolarHBondContact O-N 3.32Å; L348-A378 HydrophobicContact CD1-CB 4.2Å; L348-L379 HydrophobicContact CD1-CD2 4.37Å; L348-R382 HydrophobicContact CD1-CG 3.78Å; L348-R382 PolarHBondContact O-NE 3.13Å
349	Q	94.4	Very high	97.4	Very high	152 Å²	152	46.2 Å²	46.2	71%	0.71	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-43.1	-177.4	-172.8	60.1	23.1	0	0	111.6	I347 R382	I347-Q349 VanDerWaalsContact C-N 3.32Å; I347-Q349 PolarHBondContact O-N 2.99Å; Q349-R382 PolarHBondContact O-NH2 2.94Å; Q349-R382 VanDerWaalsContact O-NH2 3.12Å
350	A	94.1	Very high	97.6	Very high	31 Å²	31	44 Å²	44	26%	0.256	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	15.8	-179.4	0	0	0	0	0	113.3	M316 I347 L348 Y352 Q353 L354	M316-A350 HydrophobicContact CE-CB 3.5Å; M316-A350 HydrophobicContact SD-CB 3.91Å; I347-A350 CarbonylContact O-C 3.06Å; I347-A350 PolarHBondContact O-N 3.5Å; L348-A350 PolarHBondContact O-N 3Å; A350-Y352 VanDerWaalsContact C-N 3.26Å; A350-Y352 PolarHBondContact O-N 2.97Å; A350-Y352 VanDerWaalsContact O-N 3.14Å; A350-Q353 VanDerWaalsContact O-CB 3.31Å; A350-Q353 WeakPolarHBondContact O-CB 3.45Å; A350-Q353 PolarHBondContact O-N 3.47Å; A350-L354 PolarHBondContact O-N 2.81Å
351	A	97.8	Very high	97.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-54.5	-41.8	-170.8	0	0	0	0	0	112.6	I347 L348 Q353 L354 M355 I364 L379 R382	I347-A351 VanDerWaalsContact O-CA 3.28Å; I347-A351 WeakPolarHBondContact O-CA 3.44Å; I347-A351 PolarHBondContact O-N 2.98Å; L348-A351 WeakPolarHBondContact O-CB 3.38Å; L348-A351 PolarHBondContact O-N 3.32Å; A351-Q353 VanDerWaalsContact C-N 3.28Å; A351-Q353 PolarHBondContact O-N 3.45Å; A351-L354 WeakPolarHBondContact O-CB 3.34Å; A351-L354 PolarHBondContact O-N 3.19Å; A351-M355 HydrophobicContact CB-CE 4.09Å; A351-M355 VanDerWaalsContact O-CG 3.3Å; A351-M355 WeakPolarHBondContact O-CG 3.18Å; A351-M355 PolarHBondContact O-N 3.33Å; A351-I364 HydrophobicContact CB-CD1 4.07Å; A351-L379 HydrophobicContact CB-CD2 3.81Å; A351-R382 HydrophobicContact CB-CB 4.47Å; A351-R382 HydrophobicContact CB-CG 4.44Å
352	Y	97.9	Very high	97.7	Very high	70 Å²	70	42.5 Å²	42.5	28%	0.275	22%	0.215	S	C	.	.	H	α-helix	trans	-55.3	-39.4	176.4	-174.5	-92.3	0	0	0	113.2	A350 L354 M355 V356 H386 S389 L390	A350-Y352 VanDerWaalsContact C-N 3.26Å; A350-Y352 PolarHBondContact O-N 2.97Å; A350-Y352 VanDerWaalsContact O-N 3.14Å; Y352-L354 VanDerWaalsContact C-N 3.32Å; Y352-L354 PolarHBondContact O-N 2.82Å; Y352-M355 WeakPolarHBondContact O-CB 3.37Å; Y352-M355 PolarHBondContact O-N 2.89Å; Y352-V356 HydrophobicContact CE1-CG1 4.44Å; Y352-V356 PolarHBondContact O-N 3.07Å; Y352-H386 HydrophobicContact CD2-CB 4.33Å; Y352-H386 AromaticContact CD2-CD2 3.97Å; Y352-H386 HydrophobicContact CE2-CB 3.76Å; Y352-H386 AromaticContact CE2-CG 3.97Å; Y352-S389 PolarHBondContact OH-OG 3.38Å; Y352-L390 HydrophobicContact CD2-CD1 4.26Å; Y352-L390 HydrophobicContact CD2-CD2 4.19Å; Y352-L390 HydrophobicContact CD2-CG 4.44Å; Y352-L390 HydrophobicContact CE2-CD1 4.04Å; Y352-L390 HydrophobicContact CE2-CD2 3.67Å; Y352-L390 HydrophobicContact CE2-CG 3.8Å
353	Q	98.1	Very high	97.7	Very high	104 Å²	104	40 Å²	40	49%	0.486	20%	0.202	S	C	.	.	H	α-helix	trans	-63.9	-39.4	177.2	-171.2	-175.7	-2.8	0	0	111.1	Q320 A350 A351 V356 D357	Q320-Q353 VanDerWaalsContact NE2-NE2 3.1Å; A350-Q353 VanDerWaalsContact O-CB 3.31Å; A350-Q353 WeakPolarHBondContact O-CB 3.45Å; A350-Q353 PolarHBondContact O-N 3.47Å; A351-Q353 VanDerWaalsContact C-N 3.28Å; A351-Q353 PolarHBondContact O-N 3.45Å; Q353-V356 WeakPolarHBondContact O-CG2 3.46Å; Q353-D357 WeakPolarHBondContact O-CB 3.37Å; Q353-D357 PolarHBondContact O-N 3.13Å
354	L	98.6	Very high	97.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.4	-34.5	174.4	-61.5	-173.7	0	0	0	112.1	M316 Q320 I347 A350 A351 Y352 V356 D357 G360 N361 I364	M316-L354 HydrophobicContact CE-CD1 4.39Å; M316-L354 HydrophobicContact CE-CD2 3.73Å; M316-L354 HydrophobicContact CE-CG 3.92Å; M316-L354 HydrophobicContact SD-CD1 3.8Å; M316-L354 HydrophobicContact SD-CD2 4.17Å; M316-L354 HydrophobicContact SD-CG 4Å; Q320-L354 HydrophobicContact CG-CD2 3.68Å; I347-L354 HydrophobicContact CB-CD1 3.83Å; I347-L354 HydrophobicContact CG2-CD1 3.72Å; A350-L354 PolarHBondContact O-N 2.81Å; A351-L354 WeakPolarHBondContact O-CB 3.34Å; A351-L354 PolarHBondContact O-N 3.19Å; Y352-L354 VanDerWaalsContact C-N 3.32Å; Y352-L354 PolarHBondContact O-N 2.82Å; L354-V356 PolarHBondContact O-N 3.3Å; L354-D357 PolarHBondContact O-N 3.45Å; L354-D357 VanDerWaalsContact O-N 3.12Å; L354-G360 CarbonylContact O-C 3.56Å; L354-N361 VanDerWaalsContact O-CA 3.23Å; L354-N361 WeakPolarHBondContact O-CA 3.31Å; L354-N361 PolarHBondContact O-N 3.26Å; L354-I364 HydrophobicContact CB-CD1 4.05Å; L354-I364 HydrophobicContact CB-CG1 3.78Å; L354-I364 HydrophobicContact CD1-CD1 4.22Å
355	M	98.6	Very high	97.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-33	179.3	-66.1	174.1	-176	0	0	113.2	A351 Y352 I364 L379 I383 L390 Y395 G396 V399	A351-M355 HydrophobicContact CB-CE 4.09Å; A351-M355 VanDerWaalsContact O-CG 3.3Å; A351-M355 WeakPolarHBondContact O-CG 3.18Å; A351-M355 PolarHBondContact O-N 3.33Å; Y352-M355 WeakPolarHBondContact O-CB 3.37Å; Y352-M355 PolarHBondContact O-N 2.89Å; M355-I364 HydrophobicContact CE-CG2 3.94Å; M355-I364 HydrophobicContact CG-CB 4.44Å; M355-I364 HydrophobicContact CG-CG1 4.1Å; M355-I364 HydrophobicContact CG-CG2 4.02Å; M355-L379 HydrophobicContact CE-CD2 4.18Å; M355-I383 HydrophobicContact CE-CD1 3.98Å; M355-I383 HydrophobicContact CE-CG1 3.58Å; M355-I383 HydrophobicContact SD-CD1 4.3Å; M355-I383 HydrophobicContact SD-CG1 3.65Å; M355-L390 HydrophobicContact CB-CD2 3.92Å; M355-L390 HydrophobicContact SD-CD1 3.93Å; M355-Y395 CarbonylContact O-C 3.51Å; M355-G396 WeakPolarHBondContact O-CA 3.22Å; M355-G396 PolarHBondContact O-N 3.12Å; M355-V399 HydrophobicContact CB-CG2 4.1Å; M355-V399 HydrophobicContact CE-CG1 4.47Å; M355-V399 HydrophobicContact CG-CB 4.44Å; M355-V399 HydrophobicContact CG-CG1 3.95Å; M355-V399 HydrophobicContact CG-CG2 4.19Å; M355-V399 HydrophobicContact SD-CG1 4.26Å
356	V	98.5	Very high	97.9	Very high	42 Å²	42	39 Å²	39	26%	0.255	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	1.3	178.5	-58.7	0	0	0	0	113.8	Y352 Q353 L354 L390 Q393 Y395	Y352-V356 HydrophobicContact CE1-CG1 4.44Å; Y352-V356 PolarHBondContact O-N 3.07Å; Q353-V356 WeakPolarHBondContact O-CG2 3.46Å; L354-V356 PolarHBondContact O-N 3.3Å; V356-L390 HydrophobicContact CG1-CD2 3.63Å; V356-Q393 HydrophobicContact CB-CG 4.43Å; V356-Q393 HydrophobicContact CG1-CG 4.11Å; V356-Q393 PolarHBondContact O-NE2 3.22Å; V356-Y395 VanDerWaalsContact O-CD2 3.31Å; V356-Y395 WeakPolarHBondContact O-CD2 3.36Å
357	D	98.6	Very high	98	Very high	35 Å²	35	36.6 Å²	36.6	19%	0.187	18%	0.177	C	C	.	.	S	Bend	trans	-86.4	145.5	178.7	-176.2	-97	0	0	0	112.1	Q353 L354 F359 G360 N361	Q353-D357 WeakPolarHBondContact O-CB 3.37Å; Q353-D357 PolarHBondContact O-N 3.13Å; L354-D357 PolarHBondContact O-N 3.45Å; L354-D357 VanDerWaalsContact O-N 3.12Å; D357-F359 VanDerWaalsContact C-N 3.28Å; D357-F359 PolarHBondContact O-N 3.34Å; D357-F359 WeakPolarHBondContact OD1-CA 3.37Å; D357-F359 PolarHBondContact OD1-N 2.98Å; D357-G360 PolarHBondContact OD1-N 3.22Å; D357-N361 WeakPolarHBondContact O-CB 3.31Å; D357-N361 PolarHBondContact O-N 3.05Å; D357-N361 PolarHBondContact O-ND2 3.45Å
358	V	98.3	Very high	98	Very high	53 Å²	53	36.6 Å²	36.6	32%	0.321	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.9	-177.8	57.8	0	0	0	0	113.9	N361 Y362 Y395	V358-N361 PolarHBondContact O-ND2 3.05Å; V358-N361 VanDerWaalsContact O-ND2 3.1Å; V358-Y362 WeakPolarHBondContact O-CE2 3.34Å; V358-Y395 HydrophobicContact CB-CE1 4.06Å; V358-Y395 HydrophobicContact CB-CE2 3.88Å; V358-Y395 WeakPolarHBondContact CB-OH 3.29Å; V358-Y395 HydrophobicContact CG2-CE1 3.9Å; V358-Y395 HydrophobicContact CG2-CE2 4.49Å; V358-Y395 VanDerWaalsContact CG2-OH 3.27Å; V358-Y395 WeakPolarHBondContact CG2-OH 3.32Å
359	F	98.6	Very high	98	Very high	59 Å²	59	37.3 Å²	37.3	26%	0.259	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-34.1	178.4	-52.6	-55.3	0	0	0	112.5	S319 Q320 Q322 S325 D357 N361 Y362	S319-F359 CarbonylContact O-C 3.42Å; S319-F359 VanDerWaalsContact O-C 3.32Å; Q320-F359 WeakPolarHBondContact O-CD2 3.38Å; Q322-F359 HydrophobicContact CB-CD1 4.14Å; Q322-F359 HydrophobicContact CB-CD2 4.36Å; Q322-F359 HydrophobicContact CB-CE1 3.76Å; Q322-F359 HydrophobicContact CB-CE2 4Å; Q322-F359 HydrophobicContact CB-CG 4.44Å; Q322-F359 HydrophobicContact CB-CZ 3.68Å; Q322-F359 HydrophobicContact CG-CD1 4.24Å; Q322-F359 HydrophobicContact CG-CE1 3.73Å; Q322-F359 HydrophobicContact CG-CZ 4.06Å; S325-F359 PolarHBondContact OG-O 3Å; D357-F359 VanDerWaalsContact C-N 3.28Å; D357-F359 PolarHBondContact O-N 3.34Å; D357-F359 WeakPolarHBondContact OD1-CA 3.37Å; D357-F359 PolarHBondContact OD1-N 2.98Å; F359-N361 VanDerWaalsContact C-N 3.3Å; F359-N361 PolarHBondContact O-N 3.43Å; F359-Y362 PolarHBondContact O-N 3.39Å
360	G	98.4	Very high	98.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-30.6	-177.7	0	0	0	0	0	113.8	S319 L354 D357 Y362 V363 I364	S319-G360 WeakPolarHBondContact O-CA 3.38Å; S319-G360 PolarHBondContact O-N 3.49Å; L354-G360 CarbonylContact O-C 3.56Å; D357-G360 PolarHBondContact OD1-N 3.22Å; G360-Y362 PolarHBondContact O-N 3.28Å; G360-Y362 VanDerWaalsContact O-N 3.17Å; G360-V363 WeakPolarHBondContact O-CB 3.49Å; G360-V363 PolarHBondContact O-N 2.93Å; G360-I364 PolarHBondContact O-N 3.37Å
361	N	98.7	Very high	98.3	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-33.7	-177.1	74.3	88.1	0	0	0	111.7	L354 D357 V358 F359 V363 I364 Q365 V399	L354-N361 VanDerWaalsContact O-CA 3.23Å; L354-N361 WeakPolarHBondContact O-CA 3.31Å; L354-N361 PolarHBondContact O-N 3.26Å; D357-N361 WeakPolarHBondContact O-CB 3.31Å; D357-N361 PolarHBondContact O-N 3.05Å; D357-N361 PolarHBondContact O-ND2 3.45Å; V358-N361 PolarHBondContact O-ND2 3.05Å; V358-N361 VanDerWaalsContact O-ND2 3.1Å; F359-N361 VanDerWaalsContact C-N 3.3Å; F359-N361 PolarHBondContact O-N 3.43Å; N361-V363 VanDerWaalsContact C-N 3.34Å; N361-V363 PolarHBondContact O-N 3.22Å; N361-I364 PolarHBondContact O-N 3.31Å; N361-Q365 VanDerWaalsContact O-CG 3.29Å; N361-Q365 WeakPolarHBondContact O-CG 3.48Å; N361-Q365 PolarHBondContact O-N 2.95Å; N361-Q365 PolarHBondContact OD1-NE2 3.21Å; N361-V399 HydrophobicContact CB-CG2 4.06Å
362	Y	98.8	Very high	98.3	Very high	110 Å²	110	34.9 Å²	34.9	43%	0.431	17%	0.17	S	C	.	.	H	α-helix	trans	-68.4	-31.1	177.8	-62.4	-73.5	0	0	0	112.9	Q329 V358 F359 G360 K366	Q329-Y362 VanDerWaalsContact NE2-CB 3.28Å; V358-Y362 WeakPolarHBondContact O-CE2 3.34Å; F359-Y362 PolarHBondContact O-N 3.39Å; G360-Y362 PolarHBondContact O-N 3.28Å; G360-Y362 VanDerWaalsContact O-N 3.17Å; Y362-K366 WeakPolarHBondContact O-CG 3.44Å; Y362-K366 PolarHBondContact O-N 3.19Å
363	V	98.5	Very high	98.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.1	-45.1	174.8	-179.9	0	0	0	0	109.8	I328 L332 I347 G360 N361 Q365 K366 F367	I328-V363 HydrophobicContact CB-CG2 4.29Å; I328-V363 HydrophobicContact CG2-CG1 3.78Å; I328-V363 HydrophobicContact CG2-CG2 4.02Å; L332-V363 HydrophobicContact CD1-CG1 4.3Å; I347-V363 HydrophobicContact CD1-CG1 4.15Å; G360-V363 WeakPolarHBondContact O-CB 3.49Å; G360-V363 PolarHBondContact O-N 2.93Å; N361-V363 VanDerWaalsContact C-N 3.34Å; N361-V363 PolarHBondContact O-N 3.22Å; V363-Q365 PolarHBondContact O-N 3.35Å; V363-K366 PolarHBondContact O-N 2.82Å; V363-F367 HydrophobicContact CG1-CD2 4.36Å; V363-F367 HydrophobicContact CG1-CE2 4.21Å; V363-F367 WeakPolarHBondContact O-CD2 3.43Å; V363-F367 PolarHBondContact O-N 3.1Å
364	I	98.8	Very high	98.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-43.8	175.1	-56.1	-65.4	0	0	0	111.1	I347 A351 L354 M355 G360 N361 K366 F367 F368 L379 V399	I347-I364 HydrophobicContact CD1-CD1 4.05Å; A351-I364 HydrophobicContact CB-CD1 4.07Å; L354-I364 HydrophobicContact CB-CD1 4.05Å; L354-I364 HydrophobicContact CB-CG1 3.78Å; L354-I364 HydrophobicContact CD1-CD1 4.22Å; M355-I364 HydrophobicContact CE-CG2 3.94Å; M355-I364 HydrophobicContact CG-CB 4.44Å; M355-I364 HydrophobicContact CG-CG1 4.1Å; M355-I364 HydrophobicContact CG-CG2 4.02Å; G360-I364 PolarHBondContact O-N 3.37Å; N361-I364 PolarHBondContact O-N 3.31Å; I364-K366 VanDerWaalsContact C-N 3.3Å; I364-K366 PolarHBondContact O-N 3.48Å; I364-F367 PolarHBondContact O-N 3.17Å; I364-F367 VanDerWaalsContact O-N 3.09Å; I364-F368 HydrophobicContact CG2-CD2 4.22Å; I364-F368 HydrophobicContact CG2-CE2 3.86Å; I364-F368 PolarHBondContact O-N 3.45Å; I364-F368 VanDerWaalsContact O-N 3.16Å; I364-L379 HydrophobicContact CD1-CD2 4.13Å; I364-L379 HydrophobicContact CG2-CD1 4.22Å; I364-L379 HydrophobicContact CG2-CD2 4.34Å; I364-V399 HydrophobicContact CB-CG2 4.48Å; I364-V399 HydrophobicContact CG2-CG1 3.66Å; I364-V399 HydrophobicContact CG2-CG2 4.46Å
365	Q	98.7	Very high	98.3	Very high	27 Å²	27	36.3 Å²	36.3	13%	0.126	19%	0.185	C	C	.	.	H	α-helix	trans	-58.4	-39.1	174.9	-72.3	-179.9	66.7	0	0	112.4	N361 V363 F367 F368 E369 V399 K402	N361-Q365 VanDerWaalsContact O-CG 3.29Å; N361-Q365 WeakPolarHBondContact O-CG 3.48Å; N361-Q365 PolarHBondContact O-N 2.95Å; N361-Q365 PolarHBondContact OD1-NE2 3.21Å; V363-Q365 PolarHBondContact O-N 3.35Å; Q365-F367 VanDerWaalsContact C-N 3.3Å; Q365-F367 PolarHBondContact O-N 2.94Å; Q365-F368 PolarHBondContact O-N 3.48Å; Q365-F368 VanDerWaalsContact O-N 3.17Å; Q365-E369 PolarHBondContact O-N 2.98Å; Q365-V399 HydrophobicContact CG-CG2 4.31Å; Q365-K402 HydrophobicContact CB-CB 4.43Å; Q365-K402 HydrophobicContact CB-CG 4.06Å; Q365-K402 HydrophobicContact CG-CB 4.1Å; Q365-K402 HydrophobicContact CG-CG 3.75Å
366	K	98.5	Very high	98.3	Very high	34 Å²	34	37.5 Å²	37.5	15%	0.148	19%	0.19	C	C	.	.	H	α-helix	trans	-67.1	-26.6	176.2	-74.5	-73.1	167.1	-168.6	0	113.4	Q329 L332 E333 Y362 V363 I364 E369 F370	Q329-K366 HydrophobicContact CB-CG 4.23Å; Q329-K366 HydrophobicContact CG-CG 4.1Å; L332-K366 HydrophobicContact CD1-CB 3.98Å; E333-K366 HydrophobicContact CG-CD 4.42Å; E333-K366 WeakPolarHBondContact OE1-CE 3.5Å; E333-K366 IonicContact OE1-NZ 2.71Å; E333-K366 PolarHBondContact OE1-NZ 3.42Å; Y362-K366 WeakPolarHBondContact O-CG 3.44Å; Y362-K366 PolarHBondContact O-N 3.19Å; V363-K366 PolarHBondContact O-N 2.82Å; I364-K366 VanDerWaalsContact C-N 3.3Å; I364-K366 PolarHBondContact O-N 3.48Å; K366-E369 WeakPolarHBondContact CD-OE2 3.46Å; K366-E369 WeakPolarHBondContact CE-OE2 3.2Å; K366-E369 IonicContact NZ-OE2 3.73Å; K366-E369 PolarHBondContact NZ-OE2 3.35Å; K366-E369 PolarHBondContact O-N 2.97Å; K366-F370 HydrophobicContact CD-CD2 3.85Å; K366-F370 HydrophobicContact CD-CE2 3.62Å; K366-F370 PolarHBondContact O-N 2.85Å
367	F	98.6	Very high	98.3	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-74.8	-32.2	170	-84.1	-76.5	0	0	0	113.3	L332 R340 V343 F344 I347 V363 I364 Q365 G371 L379	L332-F367 HydrophobicContact CD1-CD2 4.15Å; L332-F367 HydrophobicContact CD1-CE2 3.72Å; L332-F367 HydrophobicContact CD1-CZ 4.22Å; L332-F367 HydrophobicContact CD2-CE1 4.33Å; L332-F367 HydrophobicContact CD2-CE2 4.11Å; L332-F367 HydrophobicContact CD2-CZ 3.74Å; R340-F367 HydrophobicContact CB-CE1 4.25Å; R340-F367 WeakPolarHBondContact O-CE1 3.45Å; R340-F367 WeakPolarHBondContact O-CZ 3.3Å; V343-F367 HydrophobicContact CB-CE2 4.47Å; V343-F367 HydrophobicContact CB-CZ 3.96Å; V343-F367 HydrophobicContact CG1-CE2 3.74Å; V343-F367 HydrophobicContact CG1-CZ 3.74Å; F344-F367 HydrophobicContact CB-CD1 4.48Å; F344-F367 HydrophobicContact CB-CE1 3.73Å; F344-F367 HydrophobicContact CB-CZ 3.93Å; F344-F367 AromaticContact CD2-CD1 3.55Å; F344-F367 HydrophobicContact CD2-CD1 3.55Å; F344-F367 HydrophobicContact CD2-CD2 4.48Å; F344-F367 AromaticContact CD2-CE1 3.65Å; F344-F367 HydrophobicContact CD2-CE1 3.65Å; F344-F367 AromaticContact CD2-CG 3.99Å; F344-F367 HydrophobicContact CD2-CG 3.99Å; F344-F367 HydrophobicContact CD2-CZ 4.17Å; F344-F367 HydrophobicContact CE2-CD1 4.23Å; F344-F367 HydrophobicContact CE2-CG 4.46Å; F344-F367 HydrophobicContact CG-CD1 4.43Å; F344-F367 HydrophobicContact CG-CE1 4.14Å; I347-F367 HydrophobicContact CD1-CD2 3.56Å; I347-F367 HydrophobicContact CD1-CE2 3.4Å; I347-F367 VanDerWaalsContact CD1-CE2 3.4Å; I347-F367 HydrophobicContact CD1-CZ 4.29Å; V363-F367 HydrophobicContact CG1-CD2 4.36Å; V363-F367 HydrophobicContact CG1-CE2 4.21Å; V363-F367 WeakPolarHBondContact O-CD2 3.43Å; V363-F367 PolarHBondContact O-N 3.1Å; I364-F367 PolarHBondContact O-N 3.17Å; I364-F367 VanDerWaalsContact O-N 3.09Å; Q365-F367 VanDerWaalsContact C-N 3.3Å; Q365-F367 PolarHBondContact O-N 2.94Å; F367-G371 WeakPolarHBondContact O-CA 3.27Å; F367-G371 PolarHBondContact O-N 3.42Å; F367-L379 HydrophobicContact CB-CD1 3.6Å
368	F	98.4	Very high	98.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-38.8	167.4	-74.6	-60.1	0	0	0	111.9	I364 Q365 K376 L379 I383 V399 K402 A403 F406 I407	I364-F368 HydrophobicContact CG2-CD2 4.22Å; I364-F368 HydrophobicContact CG2-CE2 3.86Å; I364-F368 PolarHBondContact O-N 3.45Å; I364-F368 VanDerWaalsContact O-N 3.16Å; Q365-F368 PolarHBondContact O-N 3.48Å; Q365-F368 VanDerWaalsContact O-N 3.17Å; F368-K376 HydrophobicContact CD1-CB 4.09Å; F368-K376 HydrophobicContact CD1-CG 4.27Å; F368-K376 HydrophobicContact CE1-CB 4.29Å; F368-K376 WeakPolarHBondContact CE1-O 3.48Å; F368-K376 WeakPolarHBondContact O-CD 3.45Å; F368-K376 WeakPolarHBondContact O-CE 3.41Å; F368-K376 PolarHBondContact O-NZ 2.89Å; F368-L379 HydrophobicContact CE1-CB 3.93Å; F368-L379 HydrophobicContact CE1-CD1 4.46Å; F368-L379 HydrophobicContact CE2-CB 4.26Å; F368-L379 HydrophobicContact CE2-CD1 4.28Å; F368-L379 HydrophobicContact CZ-CB 3.53Å; F368-L379 HydrophobicContact CZ-CD1 4.2Å; F368-I383 HydrophobicContact CE2-CD1 4.04Å; F368-I383 HydrophobicContact CZ-CD1 3.72Å; F368-V399 HydrophobicContact CD2-CG1 4.23Å; F368-V399 HydrophobicContact CE2-CG1 3.67Å; F368-K402 HydrophobicContact CB-CB 4.22Å; F368-K402 HydrophobicContact CD2-CB 4.49Å; F368-A403 HydrophobicContact CD1-CB 4.22Å; F368-A403 HydrophobicContact CD2-CB 4.37Å; F368-A403 HydrophobicContact CE1-CB 3.86Å; F368-A403 HydrophobicContact CE2-CB 4Å; F368-A403 HydrophobicContact CG-CB 4.47Å; F368-A403 HydrophobicContact CZ-CB 3.73Å; F368-F406 HydrophobicContact CB-CB 4.33Å; F368-F406 WeakPolarHBondContact O-CB 3.43Å; F368-I407 HydrophobicContact CD1-CD1 4.36Å; F368-I407 HydrophobicContact CD1-CG1 4.24Å; F368-I407 HydrophobicContact CE1-CD1 3.88Å; F368-I407 HydrophobicContact CE1-CG1 4.22Å
369	E	98	Very high	98.2	Very high	64 Å²	64	35.1 Å²	35.1	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-69.8	-53	179.1	-164.9	173.3	-161	0	0	112.7	Q365 K366 F406	Q365-E369 PolarHBondContact O-N 2.98Å; K366-E369 WeakPolarHBondContact CD-OE2 3.46Å; K366-E369 WeakPolarHBondContact CE-OE2 3.2Å; K366-E369 IonicContact NZ-OE2 3.73Å; K366-E369 PolarHBondContact NZ-OE2 3.35Å; K366-E369 PolarHBondContact O-N 2.97Å; E369-F406 HydrophobicContact CB-CE1 4.48Å; E369-F406 HydrophobicContact CB-CZ 4.42Å; E369-F406 HydrophobicContact CG-CE1 4.01Å; E369-F406 HydrophobicContact CG-CE2 4.49Å; E369-F406 HydrophobicContact CG-CZ 3.89Å
370	F	97.3	Very high	98.2	Very high	69 Å²	69	32.3 Å²	32.3	30%	0.303	17%	0.166	S	C	.	.	H	α-helix	trans	-117.2	-1.2	-169.2	-56.4	-73.2	0	0	0	116.1	E333 K366	E333-F370 HydrophobicContact CB-CE2 4.49Å; E333-F370 HydrophobicContact CG-CD2 4.19Å; E333-F370 HydrophobicContact CG-CE2 3.62Å; E333-F370 HydrophobicContact CG-CZ 3.97Å; K366-F370 HydrophobicContact CD-CD2 3.85Å; K366-F370 HydrophobicContact CD-CE2 3.62Å; K366-F370 PolarHBondContact O-N 2.85Å
371	G	97.6	Very high	98.1	Very high	10 Å²	10	37 Å²	37	10%	0.103	19%	0.188	C	C	.	.	S	Bend	trans	-71.7	160	177	0	0	0	0	0	112.9	F367 K376	F367-G371 WeakPolarHBondContact O-CA 3.27Å; F367-G371 PolarHBondContact O-N 3.42Å; G371-K376 WeakPolarHBondContact O-CE 3.48Å
372	S	97.8	Very high	98	Very high	52 Å²	52	40.8 Å²	40.8	36%	0.364	20%	0.202	S	C	.	.			trans	-64.8	160.1	169.6	69	0	0	0	0	110.9	D374 Q375 K376	S372-D374 PolarHBondContact O-N 3.27Å; S372-Q375 WeakPolarHBondContact O-CB 3.43Å; S372-Q375 PolarHBondContact O-N 3.17Å; S372-Q375 WeakPolarHBondContact OG-CG 3.27Å; S372-Q375 PolarHBondContact OG-N 3.38Å; S372-K376 WeakPolarHBondContact O-CG 3.29Å; S372-K376 PolarHBondContact O-N 3.15Å
373	L	97.4	Very high	97.9	Very high	74 Å²	74	35.6 Å²	35.6	39%	0.387	18%	0.182	S	C	.	.	H	α-helix	trans	-53.3	-44.1	177.3	-179	59.9	0	0	0	111.5	Q375 K376 L377 P408	L373-Q375 VanDerWaalsContact C-N 3.31Å; L373-Q375 PolarHBondContact O-N 2.99Å; L373-K376 PolarHBondContact O-N 3.4Å; L373-K376 VanDerWaalsContact O-N 3.12Å; L373-L377 HydrophobicContact CD1-CD1 4.18Å; L373-L377 HydrophobicContact CD1-CD2 4.49Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.93Å; L373-L377 HydrophobicContact CG-CG 4.26Å; L373-L377 WeakPolarHBondContact O-CG 3.24Å; L373-L377 PolarHBondContact O-N 3.23Å; L373-P408 HydrophobicContact CD1-CG 4.32Å
374	D	97.9	Very high	97.7	Very high	121 Å²	121	41.7 Å²	41.7	65%	0.647	21%	0.205	S	C	*	.	H	α-helix	trans	-59.6	-38.8	177.3	-48.1	-44.6	0	0	0	112.7	S372 A378	S372-D374 PolarHBondContact O-N 3.27Å; D374-A378 WeakPolarHBondContact O-CB 3.48Å; D374-A378 PolarHBondContact O-N 3.45Å
375	Q	98.3	Very high	97.6	Very high	9 Å²	9	44.4 Å²	44.4	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-66.8	-40.4	175.9	-71.2	171.4	-14.3	0	0	111.5	F344 S372 L373 L379	F344-Q375 HydrophobicContact CD1-CG 3.83Å; F344-Q375 HydrophobicContact CD2-CB 4.01Å; F344-Q375 HydrophobicContact CD2-CG 3.94Å; F344-Q375 HydrophobicContact CE1-CB 4.17Å; F344-Q375 HydrophobicContact CE1-CG 3.88Å; F344-Q375 HydrophobicContact CE2-CB 3.64Å; F344-Q375 HydrophobicContact CE2-CG 3.98Å; F344-Q375 HydrophobicContact CG-CB 4.42Å; F344-Q375 HydrophobicContact CG-CG 3.85Å; F344-Q375 HydrophobicContact CZ-CB 3.74Å; F344-Q375 HydrophobicContact CZ-CG 3.96Å; F344-Q375 VanDerWaalsContact CZ-O 3.27Å; F344-Q375 WeakPolarHBondContact CZ-O 3.24Å; S372-Q375 WeakPolarHBondContact O-CB 3.43Å; S372-Q375 PolarHBondContact O-N 3.17Å; S372-Q375 WeakPolarHBondContact OG-CG 3.27Å; S372-Q375 PolarHBondContact OG-N 3.38Å; L373-Q375 VanDerWaalsContact C-N 3.31Å; L373-Q375 PolarHBondContact O-N 2.99Å; Q375-L379 WeakPolarHBondContact O-CG 3.36Å; Q375-L379 PolarHBondContact O-N 2.9Å
376	K	98.4	Very high	97.6	Very high	26 Å²	26	47.1 Å²	47.1	11%	0.113	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-45	176	-56.1	-172.8	-162	-158	0	111.5	F368 G371 S372 L373 L379 A380 F406 I407	F368-K376 HydrophobicContact CD1-CB 4.09Å; F368-K376 HydrophobicContact CD1-CG 4.27Å; F368-K376 HydrophobicContact CE1-CB 4.29Å; F368-K376 WeakPolarHBondContact CE1-O 3.48Å; F368-K376 WeakPolarHBondContact O-CD 3.45Å; F368-K376 WeakPolarHBondContact O-CE 3.41Å; F368-K376 PolarHBondContact O-NZ 2.89Å; G371-K376 WeakPolarHBondContact O-CE 3.48Å; S372-K376 WeakPolarHBondContact O-CG 3.29Å; S372-K376 PolarHBondContact O-N 3.15Å; L373-K376 PolarHBondContact O-N 3.4Å; L373-K376 VanDerWaalsContact O-N 3.12Å; K376-L379 PolarHBondContact O-N 3.21Å; K376-A380 PolarHBondContact O-N 3.04Å; K376-F406 WeakPolarHBondContact CD-O 3.35Å; K376-F406 PolarHBondContact NZ-O 3.16Å; K376-I407 HydrophobicContact CB-CG1 4.1Å
377	L	97.8	Very high	97.6	Very high	48 Å²	48	45.6 Å²	45.6	25%	0.251	24%	0.239	S	C	.	.	H	α-helix	trans	-65.8	-41.4	178.2	-66.6	178.1	0	0	0	111.6	L373 L379 A380 E381 I407 Q411 V413	L373-L377 HydrophobicContact CD1-CD1 4.18Å; L373-L377 HydrophobicContact CD1-CD2 4.49Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.93Å; L373-L377 HydrophobicContact CG-CG 4.26Å; L373-L377 WeakPolarHBondContact O-CG 3.24Å; L373-L377 PolarHBondContact O-N 3.23Å; L377-L379 VanDerWaalsContact C-N 3.35Å; L377-L379 PolarHBondContact O-N 3.42Å; L377-A380 WeakPolarHBondContact O-CB 3.36Å; L377-A380 PolarHBondContact O-N 3.35Å; L377-A380 VanDerWaalsContact O-N 3.17Å; L377-E381 PolarHBondContact O-N 3.28Å; L377-I407 HydrophobicContact CD2-CG2 4.21Å; L377-Q411 HydrophobicContact CD2-CB 4.3Å; L377-Q411 HydrophobicContact CD2-CG 4.2Å; L377-V413 HydrophobicContact CD2-CG1 3.73Å
378	A	98.1	Very high	97.6	Very high	32 Å²	32	47.3 Å²	47.3	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-38.7	174.7	0	0	0	0	0	112.2	F344 L348 D374 E381 R382	F344-A378 HydrophobicContact CE1-CB 4.21Å; F344-A378 HydrophobicContact CZ-CB 3.98Å; L348-A378 HydrophobicContact CD1-CB 4.2Å; D374-A378 WeakPolarHBondContact O-CB 3.48Å; D374-A378 PolarHBondContact O-N 3.45Å; A378-E381 PolarHBondContact O-N 3.13Å; A378-R382 WeakPolarHBondContact O-CG 3.31Å; A378-R382 PolarHBondContact O-N 3.04Å
379	L	98.4	Very high	97.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-37.7	171.8	-75.2	171	0	0	0	112.7	F344 L348 A351 M355 I364 F367 F368 Q375 K376 L377 E381 R382 I383	F344-L379 HydrophobicContact CE2-CD1 3.88Å; F344-L379 HydrophobicContact CE2-CD2 4.2Å; F344-L379 HydrophobicContact CE2-CG 3.71Å; F344-L379 HydrophobicContact CZ-CG 4.09Å; L348-L379 HydrophobicContact CD1-CD2 4.37Å; A351-L379 HydrophobicContact CB-CD2 3.81Å; M355-L379 HydrophobicContact CE-CD2 4.18Å; I364-L379 HydrophobicContact CD1-CD2 4.13Å; I364-L379 HydrophobicContact CG2-CD1 4.22Å; I364-L379 HydrophobicContact CG2-CD2 4.34Å; F367-L379 HydrophobicContact CB-CD1 3.6Å; F368-L379 HydrophobicContact CE1-CB 3.93Å; F368-L379 HydrophobicContact CE1-CD1 4.46Å; F368-L379 HydrophobicContact CE2-CB 4.26Å; F368-L379 HydrophobicContact CE2-CD1 4.28Å; F368-L379 HydrophobicContact CZ-CB 3.53Å; F368-L379 HydrophobicContact CZ-CD1 4.2Å; Q375-L379 WeakPolarHBondContact O-CG 3.36Å; Q375-L379 PolarHBondContact O-N 2.9Å; K376-L379 PolarHBondContact O-N 3.21Å; L377-L379 VanDerWaalsContact C-N 3.35Å; L377-L379 PolarHBondContact O-N 3.42Å; L379-E381 VanDerWaalsContact C-N 3.31Å; L379-E381 PolarHBondContact O-N 3.1Å; L379-R382 WeakPolarHBondContact O-CA 3.5Å; L379-R382 WeakPolarHBondContact O-CB 3.29Å; L379-R382 PolarHBondContact O-N 3.03Å; L379-R382 VanDerWaalsContact O-N 3.07Å; L379-I383 WeakPolarHBondContact O-CG1 3.11Å; L379-I383 PolarHBondContact O-N 3.03Å; L379-I383 VanDerWaalsContact O-N 3.12Å
380	A	97.4	Very high	97.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-38.4	175.5	0	0	0	0	0	111.8	K376 L377 R382 I383 R384 I407 V413 M417	K376-A380 PolarHBondContact O-N 3.04Å; L377-A380 WeakPolarHBondContact O-CB 3.36Å; L377-A380 PolarHBondContact O-N 3.35Å; L377-A380 VanDerWaalsContact O-N 3.17Å; A380-R382 PolarHBondContact O-N 2.78Å; A380-I383 WeakPolarHBondContact O-CA 3.2Å; A380-I383 WeakPolarHBondContact O-CB 3.41Å; A380-I383 PolarHBondContact O-N 2.82Å; A380-R384 PolarHBondContact O-N 3.24Å; A380-I407 HydrophobicContact CB-CD1 3.82Å; A380-V413 HydrophobicContact CB-CB 4.49Å; A380-V413 HydrophobicContact CB-CG1 4.06Å; A380-V413 HydrophobicContact CB-CG2 3.61Å; A380-M417 HydrophobicContact CB-SD 4.09Å
381	E	96.1	Very high	97.7	Very high	97 Å²	97	44 Å²	44	45%	0.453	24%	0.241	S	C	.	.	H	α-helix	trans	-69.5	-19.6	173.9	-157.5	62.9	-163.4	0	0	113	L377 A378 L379 R384	L377-E381 PolarHBondContact O-N 3.28Å; A378-E381 PolarHBondContact O-N 3.13Å; L379-E381 VanDerWaalsContact C-N 3.31Å; L379-E381 PolarHBondContact O-N 3.1Å; E381-R384 WeakPolarHBondContact OE1-CD 3.32Å; E381-R384 IonicContact OE1-CZ 3.77Å; E381-R384 IonicContact OE1-NE 3.93Å; E381-R384 IonicContact OE1-NH1 3.27Å; E381-R384 PolarHBondContact OE1-NH1 3.03Å; E381-R384 IonicContact OE2-NH1 3.96Å
382	R	97.1	Very high	97.7	Very high	82 Å²	82	45.4 Å²	45.4	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-81.2	-17.8	167.5	-55.3	-56.4	-71.1	116.6	-0.2	113.6	L348 Q349 A351 A378 L379 A380	L348-R382 HydrophobicContact CD1-CG 3.78Å; L348-R382 PolarHBondContact O-NE 3.13Å; Q349-R382 PolarHBondContact O-NH2 2.94Å; Q349-R382 VanDerWaalsContact O-NH2 3.12Å; A351-R382 HydrophobicContact CB-CB 4.47Å; A351-R382 HydrophobicContact CB-CG 4.44Å; A378-R382 WeakPolarHBondContact O-CG 3.31Å; A378-R382 PolarHBondContact O-N 3.04Å; L379-R382 WeakPolarHBondContact O-CA 3.5Å; L379-R382 WeakPolarHBondContact O-CB 3.29Å; L379-R382 PolarHBondContact O-N 3.03Å; L379-R382 VanDerWaalsContact O-N 3.07Å; A380-R382 PolarHBondContact O-N 2.78Å
383	I	97.3	Very high	97.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-85.7	-30.1	175.2	-72.3	167.8	0	0	0	111.3	M355 F368 L379 A380 G385 H386 V387 L390 V399 I400 A403 M417	M355-I383 HydrophobicContact CE-CD1 3.98Å; M355-I383 HydrophobicContact CE-CG1 3.58Å; M355-I383 HydrophobicContact SD-CD1 4.3Å; M355-I383 HydrophobicContact SD-CG1 3.65Å; F368-I383 HydrophobicContact CE2-CD1 4.04Å; F368-I383 HydrophobicContact CZ-CD1 3.72Å; L379-I383 WeakPolarHBondContact O-CG1 3.11Å; L379-I383 PolarHBondContact O-N 3.03Å; L379-I383 VanDerWaalsContact O-N 3.12Å; A380-I383 WeakPolarHBondContact O-CA 3.2Å; A380-I383 WeakPolarHBondContact O-CB 3.41Å; A380-I383 PolarHBondContact O-N 2.82Å; I383-G385 PolarHBondContact O-N 3.35Å; I383-H386 CarbonylContact O-C 3.59Å; I383-H386 WeakPolarHBondContact O-CA 3.29Å; I383-H386 WeakPolarHBondContact O-CB 3.37Å; I383-H386 PolarHBondContact O-N 3.24Å; I383-V387 HydrophobicContact CG2-CG2 3.61Å; I383-V387 PolarHBondContact O-N 3.12Å; I383-L390 HydrophobicContact CB-CD1 4.41Å; I383-L390 HydrophobicContact CG1-CD1 4.05Å; I383-L390 HydrophobicContact CG2-CD1 4.15Å; I383-V399 HydrophobicContact CD1-CG1 4.21Å; I383-I400 HydrophobicContact CD1-CD1 4.28Å; I383-I400 HydrophobicContact CG1-CD1 4.46Å; I383-I400 HydrophobicContact CG2-CD1 3.44Å; I383-I400 VanDerWaalsContact CG2-CD1 3.44Å; I383-A403 HydrophobicContact CD1-CB 4.29Å; I383-M417 HydrophobicContact CD1-CE 4.47Å; I383-M417 HydrophobicContact CG2-CE 3.79Å; I383-M417 HydrophobicContact CG2-CG 4.44Å; I383-M417 HydrophobicContact CG2-SD 4.23Å
384	R	94.8	Very high	97.8	Very high	128 Å²	128	46.8 Å²	46.8	48%	0.483	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	133.7	-179.3	-167.3	-178.4	-171.5	173.4	9.3	112.7	A380 E381 H386 E420	A380-R384 PolarHBondContact O-N 3.24Å; E381-R384 WeakPolarHBondContact OE1-CD 3.32Å; E381-R384 IonicContact OE1-CZ 3.77Å; E381-R384 IonicContact OE1-NE 3.93Å; E381-R384 IonicContact OE1-NH1 3.27Å; E381-R384 PolarHBondContact OE1-NH1 3.03Å; E381-R384 IonicContact OE2-NH1 3.96Å; R384-H386 PolarHBondContact O-N 3.34Å; R384-E420 WeakPolarHBondContact CA-OE1 3.41Å
385	G	96.4	Very high	97.8	Very high	58 Å²	58	44 Å²	44	60%	0.598	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.7	1.2	-173.2	0	0	0	0	0	114.2	I383 E420	I383-G385 PolarHBondContact O-N 3.35Å; G385-E420 WeakPolarHBondContact CA-OE2 3.44Å; G385-E420 PolarHBondContact N-OE1 3.26Å; G385-E420 PolarHBondContact N-OE2 3.16Å; G385-E420 VanDerWaalsContact N-OE2 3.11Å
386	H	97.9	Very high	97.8	Very high	84 Å²	84	43.5 Å²	43.5	39%	0.389	22%	0.224	S	C	.	.			trans	-131.8	6.4	-176.8	-54.8	-41.1	0	0	0	113.6	Y352 I383 R384 L388 S389 L390 E420	Y352-H386 HydrophobicContact CD2-CB 4.33Å; Y352-H386 AromaticContact CD2-CD2 3.97Å; Y352-H386 HydrophobicContact CE2-CB 3.76Å; Y352-H386 AromaticContact CE2-CG 3.97Å; I383-H386 CarbonylContact O-C 3.59Å; I383-H386 WeakPolarHBondContact O-CA 3.29Å; I383-H386 WeakPolarHBondContact O-CB 3.37Å; I383-H386 PolarHBondContact O-N 3.24Å; R384-H386 PolarHBondContact O-N 3.34Å; H386-L388 PolarHBondContact O-N 3.31Å; H386-S389 WeakPolarHBondContact O-CB 3.35Å; H386-S389 PolarHBondContact O-N 3.39Å; H386-S389 VanDerWaalsContact O-N 3.1Å; H386-L390 HydrophobicContact CB-CD1 4.39Å; H386-L390 PolarHBondContact O-N 3.26Å; H386-E420 PolarHBondContact N-OE2 3.09Å; H386-E420 VanDerWaalsContact N-OE2 3.17Å
387	V	98.3	Very high	97.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-59	-46	-173.9	177.5	0	0	0	0	111.5	I383 S389 L390 A391 I400 M417 E420 L421	I383-V387 HydrophobicContact CG2-CG2 3.61Å; I383-V387 PolarHBondContact O-N 3.12Å; V387-S389 VanDerWaalsContact C-N 3.32Å; V387-S389 PolarHBondContact O-N 2.85Å; V387-L390 PolarHBondContact O-N 3.42Å; V387-A391 WeakPolarHBondContact O-CB 3.34Å; V387-A391 PolarHBondContact O-N 3.27Å; V387-I400 HydrophobicContact CG1-CD1 4.34Å; V387-I400 HydrophobicContact CG1-CG2 4.44Å; V387-M417 WeakPolarHBondContact CG1-O 3.35Å; V387-M417 HydrophobicContact CG2-CB 4.02Å; V387-M417 HydrophobicContact CG2-CG 3.97Å; V387-E420 HydrophobicContact CB-CB 3.85Å; V387-E420 HydrophobicContact CB-CG 4.48Å; V387-E420 WeakPolarHBondContact CB-OE2 3.45Å; V387-E420 HydrophobicContact CG2-CB 4.17Å; V387-E420 HydrophobicContact CG2-CG 4.34Å; V387-E420 VanDerWaalsContact CG2-OE2 3.31Å; V387-E420 WeakPolarHBondContact CG2-OE2 3.48Å; V387-E420 PolarHBondContact N-OE2 3.38Å; V387-L421 HydrophobicContact CG1-CD2 3.97Å; V387-L421 HydrophobicContact CG1-CG 4.23Å
388	L	98.4	Very high	97.9	Very high	37 Å²	37	45.4 Å²	45.4	19%	0.194	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-40.9	177.8	179.2	66.5	0	0	0	112.4	H386 L392 L421 H424 C428	H386-L388 PolarHBondContact O-N 3.31Å; L388-L392 HydrophobicContact CD1-CD1 4.02Å; L388-L392 HydrophobicContact CD1-CG 4.4Å; L388-L392 HydrophobicContact CG-CD1 4.26Å; L388-L392 WeakPolarHBondContact O-CG 3.48Å; L388-L392 PolarHBondContact O-N 2.87Å; L388-L421 HydrophobicContact CB-CD2 4.48Å; L388-L421 HydrophobicContact CD1-CD2 4.27Å; L388-H424 HydrophobicContact CD1-CB 3.79Å; L388-H424 HydrophobicContact CD2-CB 4.27Å; L388-H424 VanDerWaalsContact CD2-CD2 3.44Å; L388-H424 WeakPolarHBondContact CD2-CD2 3.35Å; L388-C428 VanDerWaalsContact CD1-SG 3.55Å
389	S	98.5	Very high	97.9	Very high	64 Å²	64	43.9 Å²	43.9	45%	0.448	22%	0.215	S	C	.	.	H	α-helix	trans	-64.6	-47.5	179.5	-174.2	0	0	0	0	110.7	Y352 H386 V387 Q393	Y352-S389 PolarHBondContact OH-OG 3.38Å; H386-S389 WeakPolarHBondContact O-CB 3.35Å; H386-S389 PolarHBondContact O-N 3.39Å; H386-S389 VanDerWaalsContact O-N 3.1Å; V387-S389 VanDerWaalsContact C-N 3.32Å; V387-S389 PolarHBondContact O-N 2.85Å; S389-Q393 PolarHBondContact O-N 3.28Å
390	L	98.8	Very high	97.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-39.4	178.1	-69.1	170	0	0	0	112.1	Y352 M355 V356 I383 H386 V387 L392 Q393 G396 C397 I400	Y352-L390 HydrophobicContact CD2-CD1 4.26Å; Y352-L390 HydrophobicContact CD2-CD2 4.19Å; Y352-L390 HydrophobicContact CD2-CG 4.44Å; Y352-L390 HydrophobicContact CE2-CD1 4.04Å; Y352-L390 HydrophobicContact CE2-CD2 3.67Å; Y352-L390 HydrophobicContact CE2-CG 3.8Å; M355-L390 HydrophobicContact CB-CD2 3.92Å; M355-L390 HydrophobicContact SD-CD1 3.93Å; V356-L390 HydrophobicContact CG1-CD2 3.63Å; I383-L390 HydrophobicContact CB-CD1 4.41Å; I383-L390 HydrophobicContact CG1-CD1 4.05Å; I383-L390 HydrophobicContact CG2-CD1 4.15Å; H386-L390 HydrophobicContact CB-CD1 4.39Å; H386-L390 PolarHBondContact O-N 3.26Å; V387-L390 PolarHBondContact O-N 3.42Å; L390-L392 VanDerWaalsContact C-N 3.29Å; L390-L392 PolarHBondContact O-N 3.3Å; L390-Q393 PolarHBondContact O-N 3.2Å; L390-G396 CarbonylContact O-C 3.37Å; L390-C397 PolarHBondContact O-N 3Å; L390-I400 HydrophobicContact CB-CD1 3.86Å; L390-I400 HydrophobicContact CB-CG1 3.72Å; L390-I400 HydrophobicContact CD1-CD1 3.95Å
391	A	98.7	Very high	98	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-33.9	-179.1	0	0	0	0	0	113.4	V387 C397 L421 N433 G434 V437	V387-A391 WeakPolarHBondContact O-CB 3.34Å; V387-A391 PolarHBondContact O-N 3.27Å; A391-C397 WeakPolarHBondContact O-CB 3.31Å; A391-L421 HydrophobicContact CB-CD2 4.35Å; A391-N433 CarbonylContact O-C 3.43Å; A391-N433 WeakPolarHBondContact O-CB 3.43Å; A391-G434 WeakPolarHBondContact O-CA 3.31Å; A391-G434 PolarHBondContact O-N 3.44Å; A391-V437 HydrophobicContact CB-CB 4.13Å; A391-V437 HydrophobicContact CB-CG1 4.07Å; A391-V437 HydrophobicContact CB-CG2 3.89Å
392	L	98.6	Very high	98.1	Very high	39 Å²	39	42.9 Å²	42.9	20%	0.204	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-8.9	176.6	-59.8	173.1	0	0	0	112.9	L388 L390 K427 D431 N433	L388-L392 HydrophobicContact CD1-CD1 4.02Å; L388-L392 HydrophobicContact CD1-CG 4.4Å; L388-L392 HydrophobicContact CG-CD1 4.26Å; L388-L392 WeakPolarHBondContact O-CG 3.48Å; L388-L392 PolarHBondContact O-N 2.87Å; L390-L392 VanDerWaalsContact C-N 3.29Å; L390-L392 PolarHBondContact O-N 3.3Å; L392-K427 HydrophobicContact CD1-CD 4.23Å; L392-D431 HydrophobicContact CD2-CB 3.54Å; L392-N433 PolarHBondContact O-ND2 2.81Å
393	Q	98.5	Very high	98.1	Very high	56 Å²	56	39 Å²	39	26%	0.262	20%	0.195	S	C	.	.	S	Bend	trans	-93.8	139.3	-177.7	-153.2	-83.3	-7.3	0	0	111.4	V356 S389 L390 Y395 G396 C397	V356-Q393 HydrophobicContact CB-CG 4.43Å; V356-Q393 HydrophobicContact CG1-CG 4.11Å; V356-Q393 PolarHBondContact O-NE2 3.22Å; S389-Q393 PolarHBondContact O-N 3.28Å; L390-Q393 PolarHBondContact O-N 3.2Å; Q393-Y395 VanDerWaalsContact C-N 3.31Å; Q393-Y395 PolarHBondContact O-N 2.87Å; Q393-G396 PolarHBondContact O-N 3Å; Q393-C397 VanDerWaalsContact O-CB 3.27Å; Q393-C397 WeakPolarHBondContact O-CB 3.41Å; Q393-C397 PolarHBondContact O-N 3.37Å; Q393-C397 PolarHBondContact O-SG 2.94Å
394	M	97.8	Very high	98.2	Very high	100 Å²	100	39.3 Å²	39.3	49%	0.493	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.3	-168.6	-174.6	169.7	60.6	0	0	115.5	N433	M394-N433 PolarHBondContact N-ND2 3.13Å
395	Y	98.6	Very high	98.3	Very high	61 Å²	61	37.3 Å²	37.3	24%	0.239	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-40	176.7	-50.3	-63.6	0	0	0	111.1	M355 V356 V358 Q393 C397 R398 V399	M355-Y395 CarbonylContact O-C 3.51Å; V356-Y395 VanDerWaalsContact O-CD2 3.31Å; V356-Y395 WeakPolarHBondContact O-CD2 3.36Å; V358-Y395 HydrophobicContact CB-CE1 4.06Å; V358-Y395 HydrophobicContact CB-CE2 3.88Å; V358-Y395 WeakPolarHBondContact CB-OH 3.29Å; V358-Y395 HydrophobicContact CG2-CE1 3.9Å; V358-Y395 HydrophobicContact CG2-CE2 4.49Å; V358-Y395 VanDerWaalsContact CG2-OH 3.27Å; V358-Y395 WeakPolarHBondContact CG2-OH 3.32Å; Q393-Y395 VanDerWaalsContact C-N 3.31Å; Q393-Y395 PolarHBondContact O-N 2.87Å; Y395-C397 VanDerWaalsContact C-N 3.25Å; Y395-C397 PolarHBondContact O-N 3.24Å; Y395-R398 VanDerWaalsContact O-CB 3.3Å; Y395-R398 WeakPolarHBondContact O-CB 3.22Å; Y395-R398 PolarHBondContact O-N 2.88Å; Y395-V399 PolarHBondContact O-N 3.25Å
396	G	98.6	Very high	98.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.7	-37	177.1	0	0	0	0	0	112.8	M355 L390 Q393 R398 V399 I400	M355-G396 WeakPolarHBondContact O-CA 3.22Å; M355-G396 PolarHBondContact O-N 3.12Å; L390-G396 CarbonylContact O-C 3.37Å; Q393-G396 PolarHBondContact O-N 3Å; G396-R398 PolarHBondContact O-N 2.87Å; G396-V399 WeakPolarHBondContact O-CB 3.46Å; G396-V399 PolarHBondContact O-N 3.05Å; G396-I400 WeakPolarHBondContact O-CG1 3.4Å; G396-I400 PolarHBondContact O-N 3.02Å
397	C	98.7	Very high	98.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-30.7	178.3	76.8	0	0	0	0	112	L390 A391 Q393 Y395 Q401 N433 V437	L390-C397 PolarHBondContact O-N 3Å; A391-C397 WeakPolarHBondContact O-CB 3.31Å; Q393-C397 VanDerWaalsContact O-CB 3.27Å; Q393-C397 WeakPolarHBondContact O-CB 3.41Å; Q393-C397 PolarHBondContact O-N 3.37Å; Q393-C397 PolarHBondContact O-SG 2.94Å; Y395-C397 VanDerWaalsContact C-N 3.25Å; Y395-C397 PolarHBondContact O-N 3.24Å; C397-Q401 VanDerWaalsContact C-NE2 3.32Å; C397-Q401 WeakPolarHBondContact O-CB 3.35Å; C397-Q401 VanDerWaalsContact O-CG 3.28Å; C397-Q401 WeakPolarHBondContact O-CG 3.45Å; C397-Q401 PolarHBondContact O-N 3.17Å; C397-Q401 PolarHBondContact O-NE2 3.49Å; C397-N433 HydrophobicContact CB-CB 3.89Å; C397-V437 HydrophobicContact CB-CG2 3.97Å
398	R	98.7	Very high	98.1	Very high	114 Å²	114	36 Å²	36	43%	0.43	18%	0.175	S	C	.	.	H	α-helix	trans	-72	-37.4	175.9	-54.9	-59.5	-177.3	175.1	-0.8	111.3	Y395 G396 Q401 K402	Y395-R398 VanDerWaalsContact O-CB 3.3Å; Y395-R398 WeakPolarHBondContact O-CB 3.22Å; Y395-R398 PolarHBondContact O-N 2.88Å; G396-R398 PolarHBondContact O-N 2.87Å; R398-Q401 PolarHBondContact O-N 3.03Å; R398-K402 PolarHBondContact O-N 2.87Å
399	V	98.7	Very high	97.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-47.7	173.5	-177.9	0	0	0	0	110.9	M355 N361 I364 Q365 F368 I383 Y395 G396 Q401 K402 A403	M355-V399 HydrophobicContact CB-CG2 4.1Å; M355-V399 HydrophobicContact CE-CG1 4.47Å; M355-V399 HydrophobicContact CG-CB 4.44Å; M355-V399 HydrophobicContact CG-CG1 3.95Å; M355-V399 HydrophobicContact CG-CG2 4.19Å; M355-V399 HydrophobicContact SD-CG1 4.26Å; N361-V399 HydrophobicContact CB-CG2 4.06Å; I364-V399 HydrophobicContact CB-CG2 4.48Å; I364-V399 HydrophobicContact CG2-CG1 3.66Å; I364-V399 HydrophobicContact CG2-CG2 4.46Å; Q365-V399 HydrophobicContact CG-CG2 4.31Å; F368-V399 HydrophobicContact CD2-CG1 4.23Å; F368-V399 HydrophobicContact CE2-CG1 3.67Å; I383-V399 HydrophobicContact CD1-CG1 4.21Å; Y395-V399 PolarHBondContact O-N 3.25Å; G396-V399 WeakPolarHBondContact O-CB 3.46Å; G396-V399 PolarHBondContact O-N 3.05Å; V399-Q401 VanDerWaalsContact C-N 3.32Å; V399-Q401 PolarHBondContact O-N 3.41Å; V399-K402 PolarHBondContact O-N 3.04Å; V399-K402 VanDerWaalsContact O-N 3.12Å; V399-A403 PolarHBondContact O-N 2.93Å
400	I	98.6	Very high	97.3	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-44.1	176.8	-59.3	-60.9	0	0	0	110.7	I383 V387 L390 G396 K402 A403 L404 M417 V437	I383-I400 HydrophobicContact CD1-CD1 4.28Å; I383-I400 HydrophobicContact CG1-CD1 4.46Å; I383-I400 HydrophobicContact CG2-CD1 3.44Å; I383-I400 VanDerWaalsContact CG2-CD1 3.44Å; V387-I400 HydrophobicContact CG1-CD1 4.34Å; V387-I400 HydrophobicContact CG1-CG2 4.44Å; L390-I400 HydrophobicContact CB-CD1 3.86Å; L390-I400 HydrophobicContact CB-CG1 3.72Å; L390-I400 HydrophobicContact CD1-CD1 3.95Å; G396-I400 WeakPolarHBondContact O-CG1 3.4Å; G396-I400 PolarHBondContact O-N 3.02Å; I400-K402 VanDerWaalsContact C-N 3.31Å; I400-K402 PolarHBondContact O-N 2.81Å; I400-A403 PolarHBondContact O-N 3.01Å; I400-L404 HydrophobicContact CG2-CD1 3.99Å; I400-L404 HydrophobicContact CG2-CG 4.43Å; I400-L404 WeakPolarHBondContact O-CG 3.49Å; I400-L404 PolarHBondContact O-N 3.12Å; I400-M417 HydrophobicContact CD1-CE 4.19Å; I400-M417 HydrophobicContact CG2-CE 4.48Å; I400-V437 HydrophobicContact CB-CG2 4.15Å; I400-V437 HydrophobicContact CG2-CG1 3.6Å; I400-V437 HydrophobicContact CG2-CG2 4.13Å
401	Q	98.7	Very high	97	Very high	26 Å²	26	42.5 Å²	42.5	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-57.6	-41.5	174.9	-78.8	162.7	76	0	0	112.5	C397 R398 V399 E405 V437 K440	C397-Q401 VanDerWaalsContact C-NE2 3.32Å; C397-Q401 WeakPolarHBondContact O-CB 3.35Å; C397-Q401 VanDerWaalsContact O-CG 3.28Å; C397-Q401 WeakPolarHBondContact O-CG 3.45Å; C397-Q401 PolarHBondContact O-N 3.17Å; C397-Q401 PolarHBondContact O-NE2 3.49Å; R398-Q401 PolarHBondContact O-N 3.03Å; V399-Q401 VanDerWaalsContact C-N 3.32Å; V399-Q401 PolarHBondContact O-N 3.41Å; Q401-E405 WeakPolarHBondContact O-CB 3.28Å; Q401-E405 PolarHBondContact O-N 3.02Å; Q401-E405 VanDerWaalsContact O-N 3.1Å; Q401-V437 HydrophobicContact CG-CG2 4.39Å; Q401-K440 HydrophobicContact CB-CG 4.23Å; Q401-K440 HydrophobicContact CG-CB 3.96Å; Q401-K440 HydrophobicContact CG-CG 4.17Å
402	K	98.4	Very high	96.6	Very high	48 Å²	48	48 Å²	48	21%	0.209	23%	0.226	C	C	.	.	H	α-helix	trans	-73.3	-31.9	177.3	-75.4	-71.8	169.5	-160.5	0	113.8	Q365 F368 R398 V399 I400 E405 F406	Q365-K402 HydrophobicContact CB-CB 4.43Å; Q365-K402 HydrophobicContact CB-CG 4.06Å; Q365-K402 HydrophobicContact CG-CB 4.1Å; Q365-K402 HydrophobicContact CG-CG 3.75Å; F368-K402 HydrophobicContact CB-CB 4.22Å; F368-K402 HydrophobicContact CD2-CB 4.49Å; R398-K402 PolarHBondContact O-N 2.87Å; V399-K402 PolarHBondContact O-N 3.04Å; V399-K402 VanDerWaalsContact O-N 3.12Å; I400-K402 VanDerWaalsContact C-N 3.31Å; I400-K402 PolarHBondContact O-N 2.81Å; K402-E405 WeakPolarHBondContact CD-OE2 3.44Å; K402-E405 WeakPolarHBondContact CE-OE2 3.35Å; K402-E405 IonicContact NZ-OE1 3.7Å; K402-E405 IonicContact NZ-OE2 3.88Å; K402-E405 PolarHBondContact NZ-OE2 3.17Å; K402-E405 PolarHBondContact O-N 2.97Å; K402-F406 HydrophobicContact CD-CD2 3.88Å; K402-F406 HydrophobicContact CD-CE2 3.61Å; K402-F406 WeakPolarHBondContact O-CB 3.19Å; K402-F406 WeakPolarHBondContact O-CD2 3.5Å; K402-F406 PolarHBondContact O-N 3.41Å; K402-F406 VanDerWaalsContact O-N 3.13Å
403	A	98.3	Very high	96.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-48	172	0	0	0	0	0	110.9	F368 I383 V399 I400 E405 F406 I407 M417	F368-A403 HydrophobicContact CD1-CB 4.22Å; F368-A403 HydrophobicContact CD2-CB 4.37Å; F368-A403 HydrophobicContact CE1-CB 3.86Å; F368-A403 HydrophobicContact CE2-CB 4Å; F368-A403 HydrophobicContact CG-CB 4.47Å; F368-A403 HydrophobicContact CZ-CB 3.73Å; I383-A403 HydrophobicContact CD1-CB 4.29Å; V399-A403 PolarHBondContact O-N 2.93Å; I400-A403 PolarHBondContact O-N 3.01Å; A403-E405 VanDerWaalsContact C-N 3.3Å; A403-E405 PolarHBondContact O-N 3.36Å; A403-F406 PolarHBondContact O-N 3.01Å; A403-I407 HydrophobicContact CB-CD1 4.06Å; A403-I407 WeakPolarHBondContact O-CB 3.44Å; A403-I407 WeakPolarHBondContact O-CG1 3.47Å; A403-I407 PolarHBondContact O-N 3.35Å; A403-M417 HydrophobicContact CB-CE 3.84Å
404	L	97.6	Very high	96.1	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-32.1	176.4	-68	167.1	0	0	0	113.4	I400 I414 V418 V437 K440 C444 V445	I400-L404 HydrophobicContact CG2-CD1 3.99Å; I400-L404 HydrophobicContact CG2-CG 4.43Å; I400-L404 WeakPolarHBondContact O-CG 3.49Å; I400-L404 PolarHBondContact O-N 3.12Å; L404-I414 HydrophobicContact CD2-CD1 4.29Å; L404-I414 HydrophobicContact CD2-CG2 4.45Å; L404-V418 HydrophobicContact CD2-CG2 3.73Å; L404-V437 HydrophobicContact CD1-CG1 4.34Å; L404-K440 HydrophobicContact CB-CG 3.84Å; L404-K440 HydrophobicContact CD1-CB 4.14Å; L404-K440 HydrophobicContact CD1-CG 3.98Å; L404-C444 WeakPolarHBondContact O-CB 3.48Å; L404-V445 HydrophobicContact CD2-CG2 3.95Å
405	E	97.7	Very high	95.8	Very high	86 Å²	86	41.4 Å²	41.4	40%	0.402	20%	0.199	S	C	.	.	H	α-helix	trans	-80.7	-29.7	-178.7	-174.4	-179.5	-169.3	0	0	113.5	Q401 K402 A403	Q401-E405 WeakPolarHBondContact O-CB 3.28Å; Q401-E405 PolarHBondContact O-N 3.02Å; Q401-E405 VanDerWaalsContact O-N 3.1Å; K402-E405 WeakPolarHBondContact CD-OE2 3.44Å; K402-E405 WeakPolarHBondContact CE-OE2 3.35Å; K402-E405 IonicContact NZ-OE1 3.7Å; K402-E405 IonicContact NZ-OE2 3.88Å; K402-E405 PolarHBondContact NZ-OE2 3.17Å; K402-E405 PolarHBondContact O-N 2.97Å; A403-E405 VanDerWaalsContact C-N 3.3Å; A403-E405 PolarHBondContact O-N 3.36Å
406	F	97.6	Very high	95.6	Very high	57 Å²	57	40.2 Å²	40.2	25%	0.25	20%	0.196	C	C	.	.	H	α-helix	trans	-122.1	-5.1	-168.1	-74.5	-83.8	0	0	0	116.6	F368 E369 K376 K402 A403	F368-F406 HydrophobicContact CB-CB 4.33Å; F368-F406 WeakPolarHBondContact O-CB 3.43Å; E369-F406 HydrophobicContact CB-CE1 4.48Å; E369-F406 HydrophobicContact CB-CZ 4.42Å; E369-F406 HydrophobicContact CG-CE1 4.01Å; E369-F406 HydrophobicContact CG-CE2 4.49Å; E369-F406 HydrophobicContact CG-CZ 3.89Å; K376-F406 WeakPolarHBondContact CD-O 3.35Å; K376-F406 PolarHBondContact NZ-O 3.16Å; K402-F406 HydrophobicContact CD-CD2 3.88Å; K402-F406 HydrophobicContact CD-CE2 3.61Å; K402-F406 WeakPolarHBondContact O-CB 3.19Å; K402-F406 WeakPolarHBondContact O-CD2 3.5Å; K402-F406 PolarHBondContact O-N 3.41Å; K402-F406 VanDerWaalsContact O-N 3.13Å; A403-F406 PolarHBondContact O-N 3.01Å
407	I	96.9	Very high	95.4	Very high	6 Å²	6	40.4 Å²	40.4	3%	0.031	20%	0.197	C	C	.	.	S	Bend	trans	-89.2	130.2	164.3	-59.1	166.2	0	0	0	107.3	F368 K376 L377 A380 A403 Q411 V413 I414	F368-I407 HydrophobicContact CD1-CD1 4.36Å; F368-I407 HydrophobicContact CD1-CG1 4.24Å; F368-I407 HydrophobicContact CE1-CD1 3.88Å; F368-I407 HydrophobicContact CE1-CG1 4.22Å; K376-I407 HydrophobicContact CB-CG1 4.1Å; L377-I407 HydrophobicContact CD2-CG2 4.21Å; A380-I407 HydrophobicContact CB-CD1 3.82Å; A403-I407 HydrophobicContact CB-CD1 4.06Å; A403-I407 WeakPolarHBondContact O-CB 3.44Å; A403-I407 WeakPolarHBondContact O-CG1 3.47Å; A403-I407 PolarHBondContact O-N 3.35Å; I407-Q411 HydrophobicContact CG2-CB 3.8Å; I407-Q411 HydrophobicContact CG2-CG 3.91Å; I407-V413 HydrophobicContact CD1-CG1 4.44Å; I407-V413 HydrophobicContact CG2-CG1 4.07Å; I407-I414 HydrophobicContact CB-CD1 3.69Å; I407-I414 HydrophobicContact CB-CG1 3.92Å; I407-I414 HydrophobicContact CD1-CD1 3.97Å; I407-I414 HydrophobicContact CG1-CD1 4.4Å; I407-I414 HydrophobicContact CG2-CD1 3.98Å; I407-I414 HydrophobicContact CG2-CG1 3.7Å
408	P	94.2	Very high	95.2	Very high	52 Å²	52	40.5 Å²	40.5	34%	0.338	20%	0.198	S	C	.	.			trans	-58.9	144	-179.7	-22.7	32.5	0	0	0	113.1	L373 E410 Q411	L373-P408 HydrophobicContact CD1-CG 4.32Å; P408-E410 WeakPolarHBondContact CB-OE2 3.37Å; P408-E410 PolarHBondContact O-N 2.91Å; P408-E410 VanDerWaalsContact O-N 3.12Å; P408-Q411 HydrophobicContact CB-CG 4.24Å; P408-Q411 HydrophobicContact CG-CG 4.44Å; P408-Q411 WeakPolarHBondContact O-CB 3.33Å; P408-Q411 WeakPolarHBondContact O-CG 3.5Å; P408-Q411 PolarHBondContact O-N 2.89Å
409	S	89.6	Confident	95.1	Very high	33 Å²	33	42.1 Å²	42.1	23%	0.231	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.3	-172.7	82.9	0	0	0	0	114	Q411 Q446	S409-Q411 VanDerWaalsContact C-N 3.27Å; S409-Q411 PolarHBondContact O-N 3.09Å; S409-Q446 PolarHBondContact OG-NE2 2.86Å
410	E	89.7	Confident	95	Very high	145 Å²	145	44.5 Å²	44.5	68%	0.678	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-12.9	179.8	-50.3	68.2	-141	0	0	111.9	P408 Q412	P408-E410 WeakPolarHBondContact CB-OE2 3.37Å; P408-E410 PolarHBondContact O-N 2.91Å; P408-E410 VanDerWaalsContact O-N 3.12Å; E410-Q412 PolarHBondContact O-N 2.96Å
411	Q	93.3	Very high	95	Very high	60 Å²	60	44.5 Å²	44.5	28%	0.28	22%	0.215	S	C	.	.	S	Bend	trans	-78	119.6	178	-61.2	-62.9	-28.6	0	0	110.3	L377 I407 P408 S409 V413 I414	L377-Q411 HydrophobicContact CD2-CB 4.3Å; L377-Q411 HydrophobicContact CD2-CG 4.2Å; I407-Q411 HydrophobicContact CG2-CB 3.8Å; I407-Q411 HydrophobicContact CG2-CG 3.91Å; P408-Q411 HydrophobicContact CB-CG 4.24Å; P408-Q411 HydrophobicContact CG-CG 4.44Å; P408-Q411 WeakPolarHBondContact O-CB 3.33Å; P408-Q411 WeakPolarHBondContact O-CG 3.5Å; P408-Q411 PolarHBondContact O-N 2.89Å; S409-Q411 VanDerWaalsContact C-N 3.27Å; S409-Q411 PolarHBondContact O-N 3.09Å; Q411-V413 HydrophobicContact CB-CG1 4.19Å; Q411-V413 PolarHBondContact O-N 3.48Å; Q411-I414 PolarHBondContact O-N 2.89Å
412	Q	90.6	Very high	94.9	Very high	115 Å²	115	47.3 Å²	47.3	54%	0.537	23%	0.231	S	C	.	.	H	α-helix	trans	-50.8	-32.7	-179.6	-177.8	58.4	43.1	0	0	113.2	E410 I414 S415 D416	E410-Q412 PolarHBondContact O-N 2.96Å; Q412-I414 PolarHBondContact O-N 3.47Å; Q412-S415 PolarHBondContact O-N 3.29Å; Q412-D416 PolarHBondContact NE2-OD1 3.34Å; Q412-D416 PolarHBondContact O-N 2.95Å
413	V	92.6	Very high	94.8	Very high	21 Å²	21	48.4 Å²	48.4	13%	0.127	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-30.3	179.1	77	0	0	0	0	113.3	L377 A380 I407 Q411 D416 M417	L377-V413 HydrophobicContact CD2-CG1 3.73Å; A380-V413 HydrophobicContact CB-CB 4.49Å; A380-V413 HydrophobicContact CB-CG1 4.06Å; A380-V413 HydrophobicContact CB-CG2 3.61Å; I407-V413 HydrophobicContact CD1-CG1 4.44Å; I407-V413 HydrophobicContact CG2-CG1 4.07Å; Q411-V413 HydrophobicContact CB-CG1 4.19Å; Q411-V413 PolarHBondContact O-N 3.48Å; V413-D416 PolarHBondContact O-N 3.33Å; V413-M417 HydrophobicContact CG2-CG 4.44Å; V413-M417 HydrophobicContact CG2-SD 4.49Å; V413-M417 VanDerWaalsContact O-CB 3.29Å; V413-M417 WeakPolarHBondContact O-CB 3.36Å; V413-M417 VanDerWaalsContact O-CG 3.22Å; V413-M417 WeakPolarHBondContact O-CG 3.35Å; V413-M417 PolarHBondContact O-N 3.11Å
414	I	93.6	Very high	94.8	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-46.4	174.6	-72.9	-56.5	0	0	0	110.9	L404 I407 Q411 Q412 D416 M417 V418 V445	L404-I414 HydrophobicContact CD2-CD1 4.29Å; L404-I414 HydrophobicContact CD2-CG2 4.45Å; I407-I414 HydrophobicContact CB-CD1 3.69Å; I407-I414 HydrophobicContact CB-CG1 3.92Å; I407-I414 HydrophobicContact CD1-CD1 3.97Å; I407-I414 HydrophobicContact CG1-CD1 4.4Å; I407-I414 HydrophobicContact CG2-CD1 3.98Å; I407-I414 HydrophobicContact CG2-CG1 3.7Å; Q411-I414 PolarHBondContact O-N 2.89Å; Q412-I414 PolarHBondContact O-N 3.47Å; I414-D416 VanDerWaalsContact C-N 3.31Å; I414-D416 PolarHBondContact O-N 2.95Å; I414-M417 PolarHBondContact O-N 3.18Å; I414-V418 WeakPolarHBondContact O-CG2 3.4Å; I414-V418 PolarHBondContact O-N 2.66Å; I414-V445 HydrophobicContact CG2-CB 4.31Å; I414-V445 HydrophobicContact CG2-CG1 3.96Å; I414-V445 HydrophobicContact CG2-CG2 3.46Å; I414-V445 VanDerWaalsContact CG2-CG2 3.46Å
415	S	91.6	Very high	94.9	Very high	35 Å²	35	52.1 Å²	52.1	25%	0.245	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-37	177.9	-66.6	0	0	0	0	111.8	Q412 R419	Q412-S415 PolarHBondContact O-N 3.29Å; S415-R419 VanDerWaalsContact O-CB 3.25Å; S415-R419 WeakPolarHBondContact O-CB 3.27Å; S415-R419 PolarHBondContact O-N 3.4Å; S415-R419 VanDerWaalsContact O-N 3.12Å
416	D	92.9	Very high	94.9	Very high	36 Å²	36	50.6 Å²	50.6	19%	0.193	27%	0.267	C	S	.	.	H	α-helix	trans	-70.5	-41.9	176.6	-69.6	-12.3	0	0	0	111.9	Q412 V413 I414 R419 E420	Q412-D416 PolarHBondContact NE2-OD1 3.34Å; Q412-D416 PolarHBondContact O-N 2.95Å; V413-D416 PolarHBondContact O-N 3.33Å; I414-D416 VanDerWaalsContact C-N 3.31Å; I414-D416 PolarHBondContact O-N 2.95Å; D416-R419 PolarHBondContact O-N 3.38Å; D416-R419 IonicContact OD1-CZ 2.99Å; D416-R419 IonicContact OD1-NH2 2.96Å; D416-R419 PolarHBondContact OD1-NH2 3.06Å; D416-E420 PolarHBondContact O-N 2.86Å
417	M	94.8	Very high	94.9	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-46.2	174.5	-80.1	177.8	55.7	0	0	112.2	A380 I383 V387 I400 A403 V413 I414 R419 E420	A380-M417 HydrophobicContact CB-SD 4.09Å; I383-M417 HydrophobicContact CD1-CE 4.47Å; I383-M417 HydrophobicContact CG2-CE 3.79Å; I383-M417 HydrophobicContact CG2-CG 4.44Å; I383-M417 HydrophobicContact CG2-SD 4.23Å; V387-M417 WeakPolarHBondContact CG1-O 3.35Å; V387-M417 HydrophobicContact CG2-CB 4.02Å; V387-M417 HydrophobicContact CG2-CG 3.97Å; I400-M417 HydrophobicContact CD1-CE 4.19Å; I400-M417 HydrophobicContact CG2-CE 4.48Å; A403-M417 HydrophobicContact CB-CE 3.84Å; V413-M417 HydrophobicContact CG2-CG 4.44Å; V413-M417 HydrophobicContact CG2-SD 4.49Å; V413-M417 VanDerWaalsContact O-CB 3.29Å; V413-M417 WeakPolarHBondContact O-CB 3.36Å; V413-M417 VanDerWaalsContact O-CG 3.22Å; V413-M417 WeakPolarHBondContact O-CG 3.35Å; V413-M417 PolarHBondContact O-N 3.11Å; I414-M417 PolarHBondContact O-N 3.18Å; M417-R419 VanDerWaalsContact C-N 3.28Å; M417-R419 PolarHBondContact O-N 2.88Å; M417-E420 PolarHBondContact O-N 3.31Å
418	V	95.2	Very high	95	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-36.6	178.4	172.8	0	0	0	0	111.2	L404 I414 E420 L421 C441 V445 L450 F452	L404-V418 HydrophobicContact CD2-CG2 3.73Å; I414-V418 WeakPolarHBondContact O-CG2 3.4Å; I414-V418 PolarHBondContact O-N 2.66Å; V418-E420 VanDerWaalsContact C-N 3.28Å; V418-E420 PolarHBondContact O-N 3.19Å; V418-L421 VanDerWaalsContact O-CB 3.31Å; V418-L421 WeakPolarHBondContact O-CB 3.33Å; V418-L421 PolarHBondContact O-N 3.41Å; V418-C441 HydrophobicContact CG1-CB 4.34Å; V418-C441 HydrophobicContact CG2-CB 4.2Å; V418-V445 HydrophobicContact CG2-CG1 4.42Å; V418-V445 HydrophobicContact CG2-CG2 3.92Å; V418-L450 HydrophobicContact CG1-CD2 4.03Å; V418-F452 HydrophobicContact CG1-CE1 3.85Å; V418-F452 HydrophobicContact CG1-CZ 3.76Å; V418-F452 WeakPolarHBondContact O-CZ 3.39Å
419	R	95.9	Very high	95.2	Very high	149 Å²	149	51 Å²	51	56%	0.562	26%	0.264	S	S	*	.	H	α-helix	trans	-70.5	-17.8	-179.6	-172.4	156.9	51.1	133.6	-0.8	114.2	S415 D416 M417 L421 D422	S415-R419 VanDerWaalsContact O-CB 3.25Å; S415-R419 WeakPolarHBondContact O-CB 3.27Å; S415-R419 PolarHBondContact O-N 3.4Å; S415-R419 VanDerWaalsContact O-N 3.12Å; D416-R419 PolarHBondContact O-N 3.38Å; D416-R419 IonicContact OD1-CZ 2.99Å; D416-R419 IonicContact OD1-NH2 2.96Å; D416-R419 PolarHBondContact OD1-NH2 3.06Å; M417-R419 VanDerWaalsContact C-N 3.28Å; M417-R419 PolarHBondContact O-N 2.88Å; R419-L421 PolarHBondContact O-N 2.74Å; R419-D422 VanDerWaalsContact O-CB 3.29Å; R419-D422 WeakPolarHBondContact O-CB 3.38Å; R419-D422 PolarHBondContact O-N 3.33Å; R419-D422 VanDerWaalsContact O-N 3.13Å
420	E	97.3	Very high	95.6	Very high	49 Å²	49	53.7 Å²	53.7	23%	0.229	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.1	166.5	-73.9	-177	-142.4	0	0	113.8	R384 G385 H386 V387 D416 M417 V418	R384-E420 WeakPolarHBondContact CA-OE1 3.41Å; G385-E420 WeakPolarHBondContact CA-OE2 3.44Å; G385-E420 PolarHBondContact N-OE1 3.26Å; G385-E420 PolarHBondContact N-OE2 3.16Å; G385-E420 VanDerWaalsContact N-OE2 3.11Å; H386-E420 PolarHBondContact N-OE2 3.09Å; H386-E420 VanDerWaalsContact N-OE2 3.17Å; V387-E420 HydrophobicContact CB-CB 3.85Å; V387-E420 HydrophobicContact CB-CG 4.48Å; V387-E420 WeakPolarHBondContact CB-OE2 3.45Å; V387-E420 HydrophobicContact CG2-CB 4.17Å; V387-E420 HydrophobicContact CG2-CG 4.34Å; V387-E420 VanDerWaalsContact CG2-OE2 3.31Å; V387-E420 WeakPolarHBondContact CG2-OE2 3.48Å; V387-E420 PolarHBondContact N-OE2 3.38Å; D416-E420 PolarHBondContact O-N 2.86Å; M417-E420 PolarHBondContact O-N 3.31Å; V418-E420 VanDerWaalsContact C-N 3.28Å; V418-E420 PolarHBondContact O-N 3.19Å
421	L	97.7	Very high	96.1	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.1	173.4	-56	179.5	0	0	0	113.2	V387 L388 A391 V418 R419 H424 V425 V437 F452	V387-L421 HydrophobicContact CG1-CD2 3.97Å; V387-L421 HydrophobicContact CG1-CG 4.23Å; L388-L421 HydrophobicContact CB-CD2 4.48Å; L388-L421 HydrophobicContact CD1-CD2 4.27Å; A391-L421 HydrophobicContact CB-CD2 4.35Å; V418-L421 VanDerWaalsContact O-CB 3.31Å; V418-L421 WeakPolarHBondContact O-CB 3.33Å; V418-L421 PolarHBondContact O-N 3.41Å; R419-L421 PolarHBondContact O-N 2.74Å; L421-H424 CarbonylContact O-C 3.55Å; L421-H424 WeakPolarHBondContact O-CA 3.27Å; L421-H424 PolarHBondContact O-N 2.76Å; L421-V425 PolarHBondContact O-N 3.11Å; L421-V425 VanDerWaalsContact O-N 3.13Å; L421-V437 HydrophobicContact CD1-CG1 4Å; L421-F452 HydrophobicContact CB-CE2 4.39Å
422	D	97.3	Very high	96.3	Very high	85 Å²	85	51.5 Å²	51.5	46%	0.455	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	145.5	176.7	-161.7	0.7	0	0	0	111	R419 H424 F452	R419-D422 VanDerWaalsContact O-CB 3.29Å; R419-D422 WeakPolarHBondContact O-CB 3.38Å; R419-D422 PolarHBondContact O-N 3.33Å; R419-D422 VanDerWaalsContact O-N 3.13Å; D422-H424 PolarHBondContact O-CD2 2.99Å; D422-H424 PolarHBondContact O-N 2.87Å; D422-F452 HydrophobicContact CB-CD2 3.7Å; D422-F452 HydrophobicContact CB-CE2 3.95Å; D422-F452 HydrophobicContact CB-CG 4.23Å; D422-F452 WeakPolarHBondContact OD1-CD2 3.09Å
423	G	97.2	Very high	96.7	Very high	70 Å²	70	47 Å²	47	72%	0.722	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	-5.7	-167	0	0	0	0	0	115.4
424	H	98.2	Very high	97	Very high	82 Å²	82	46 Å²	46	38%	0.38	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-0.2	-175.1	-61.4	-45.7	0	0	0	114.8	L388 L421 D422 L426 K427 C428	L388-H424 HydrophobicContact CD1-CB 3.79Å; L388-H424 HydrophobicContact CD2-CB 4.27Å; L388-H424 VanDerWaalsContact CD2-CD2 3.44Å; L388-H424 WeakPolarHBondContact CD2-CD2 3.35Å; L421-H424 CarbonylContact O-C 3.55Å; L421-H424 WeakPolarHBondContact O-CA 3.27Å; L421-H424 PolarHBondContact O-N 2.76Å; D422-H424 PolarHBondContact O-CD2 2.99Å; D422-H424 PolarHBondContact O-N 2.87Å; H424-L426 PolarHBondContact O-N 3.1Å; H424-K427 WeakPolarHBondContact O-CB 3.48Å; H424-K427 PolarHBondContact O-N 3.35Å; H424-C428 PolarHBondContact O-N 3.16Å; H424-C428 VanDerWaalsContact O-N 3.1Å
425	V	98.3	Very high	97.2	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-45.7	-56.1	-178.8	179.1	0	0	0	0	113	L421 K427 C428 V429 F452 I453 A456 F457	L421-V425 PolarHBondContact O-N 3.11Å; L421-V425 VanDerWaalsContact O-N 3.13Å; V425-K427 VanDerWaalsContact C-N 3.26Å; V425-K427 PolarHBondContact O-N 3.41Å; V425-C428 PolarHBondContact O-N 2.97Å; V425-C428 VanDerWaalsContact O-N 3.08Å; V425-V429 HydrophobicContact CG1-CG2 4.11Å; V425-V429 VanDerWaalsContact O-CG2 3.31Å; V425-V429 WeakPolarHBondContact O-CG2 3.47Å; V425-V429 PolarHBondContact O-N 3.46Å; V425-F452 HydrophobicContact CG2-CD2 3.61Å; V425-F452 HydrophobicContact CG2-CE2 3.48Å; V425-F452 VanDerWaalsContact CG2-CE2 3.48Å; V425-I453 HydrophobicContact CG1-CB 4.41Å; V425-I453 HydrophobicContact CG1-CG2 3.88Å; V425-I453 HydrophobicContact CG2-CG1 4.21Å; V425-A456 HydrophobicContact CB-CB 3.75Å; V425-A456 HydrophobicContact CG1-CB 3.91Å; V425-A456 HydrophobicContact CG2-CB 4.14Å; V425-F457 HydrophobicContact CG1-CD2 4.31Å; V425-F457 HydrophobicContact CG1-CE2 3.86Å
426	L	98.3	Very high	97.6	Very high	54 Å²	54	46.7 Å²	46.7	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-30.2	-176.8	-68.9	179.2	0	0	0	113.5	H424 K430 A456 Q460 L464	H424-L426 PolarHBondContact O-N 3.1Å; L426-K430 WeakPolarHBondContact O-CG 3.47Å; L426-K430 PolarHBondContact O-N 3.49Å; L426-A456 WeakPolarHBondContact CD2-O 3.25Å; L426-Q460 HydrophobicContact CD1-CG 4.15Å; L426-Q460 HydrophobicContact CD2-CG 4.43Å; L426-L464 HydrophobicContact CD2-CD1 3.8Å; L426-L464 HydrophobicContact CD2-CD2 4.35Å
427	K	98.5	Very high	97.8	Very high	122 Å²	122	45 Å²	45	53%	0.53	23%	0.226	S	C	.	.	H	α-helix	trans	-68	-47	173.6	-176.9	-174.3	179.4	-172.9	0	110.1	L392 H424 V425 K430 D431	L392-K427 HydrophobicContact CD1-CD 4.23Å; H424-K427 WeakPolarHBondContact O-CB 3.48Å; H424-K427 PolarHBondContact O-N 3.35Å; V425-K427 VanDerWaalsContact C-N 3.26Å; V425-K427 PolarHBondContact O-N 3.41Å; K427-K430 PolarHBondContact O-N 2.89Å; K427-D431 WeakPolarHBondContact O-CB 3.49Å; K427-D431 PolarHBondContact O-N 2.89Å; K427-D431 VanDerWaalsContact O-N 3.15Å
428	C	98.7	Very high	98	Very high	1 Å²	1	45 Å²	45	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-44.7	178	-64	0	0	0	0	112	L388 H424 V425 K430 D431 G434 N435 V438	L388-C428 VanDerWaalsContact CD1-SG 3.55Å; H424-C428 PolarHBondContact O-N 3.16Å; H424-C428 VanDerWaalsContact O-N 3.1Å; V425-C428 PolarHBondContact O-N 2.97Å; V425-C428 VanDerWaalsContact O-N 3.08Å; C428-K430 VanDerWaalsContact C-N 3.27Å; C428-K430 PolarHBondContact O-N 3.05Å; C428-D431 PolarHBondContact O-N 3.2Å; C428-D431 VanDerWaalsContact O-N 3.13Å; C428-G434 CarbonylContact O-C 3.59Å; C428-G434 WeakPolarHBondContact O-CA 3.44Å; C428-N435 PolarHBondContact O-N 2.99Å; C428-V438 HydrophobicContact CB-CG2 3.63Å
429	V	98.7	Very high	98.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-34.2	179.2	171.6	0	0	0	0	112.7	V425 V438 F457 L464 Y469 V473	V425-V429 HydrophobicContact CG1-CG2 4.11Å; V425-V429 VanDerWaalsContact O-CG2 3.31Å; V425-V429 WeakPolarHBondContact O-CG2 3.47Å; V425-V429 PolarHBondContact O-N 3.46Å; V429-V438 HydrophobicContact CG2-CB 4.33Å; V429-V438 HydrophobicContact CG2-CG1 3.99Å; V429-V438 HydrophobicContact CG2-CG2 4.16Å; V429-F457 HydrophobicContact CG1-CZ 4.15Å; V429-F457 HydrophobicContact CG2-CE2 3.81Å; V429-F457 HydrophobicContact CG2-CZ 3.79Å; V429-L464 HydrophobicContact CG1-CD2 3.76Å; V429-Y469 WeakPolarHBondContact O-CB 3.27Å; V429-V473 HydrophobicContact CG1-CB 4.39Å; V429-V473 HydrophobicContact CG1-CG2 4Å; V429-V473 HydrophobicContact CG2-CG1 4.26Å; V429-V473 HydrophobicContact CG2-CG2 4.23Å
430	K	98.4	Very high	98.3	Very high	90 Å²	90	40.1 Å²	40.1	39%	0.391	21%	0.209	S	C	.	.	H	α-helix	trans	-88.1	-8.2	178.9	-66.7	177.4	-178	176.1	0	113.5	L426 K427 C428 L464	L426-K430 WeakPolarHBondContact O-CG 3.47Å; L426-K430 PolarHBondContact O-N 3.49Å; K427-K430 PolarHBondContact O-N 2.89Å; C428-K430 VanDerWaalsContact C-N 3.27Å; C428-K430 PolarHBondContact O-N 3.05Å; K430-L464 HydrophobicContact CG-CD2 4.4Å
431	D	98.7	Very high	98.3	Very high	42 Å²	42	37.9 Å²	37.9	23%	0.225	20%	0.198	C	C	.	.	S	Bend	trans	-86.6	145.1	177.6	-179.5	-103.9	0	0	0	113	L392 K427 C428 N433 G434 N435	L392-D431 HydrophobicContact CD2-CB 3.54Å; K427-D431 WeakPolarHBondContact O-CB 3.49Å; K427-D431 PolarHBondContact O-N 2.89Å; K427-D431 VanDerWaalsContact O-N 3.15Å; C428-D431 PolarHBondContact O-N 3.2Å; C428-D431 VanDerWaalsContact O-N 3.13Å; D431-N433 VanDerWaalsContact C-N 3.25Å; D431-N433 PolarHBondContact O-N 3.44Å; D431-N433 WeakPolarHBondContact OD1-CA 3.41Å; D431-N433 VanDerWaalsContact OD1-CB 3.31Å; D431-N433 WeakPolarHBondContact OD1-CB 3.41Å; D431-N433 PolarHBondContact OD1-N 3.31Å; D431-G434 PolarHBondContact OD1-N 3.2Å; D431-N435 WeakPolarHBondContact O-CB 3.35Å; D431-N435 PolarHBondContact O-N 2.81Å; D431-N435 PolarHBondContact O-ND2 3.09Å
432	Q	98.1	Very high	98.3	Very high	117 Å²	117	37.9 Å²	37.9	55%	0.547	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.9	-178.7	64.6	178.2	-5.4	0	0	114.2	N435 H436 Y469	Q432-N435 VanDerWaalsContact C-ND2 3.29Å; Q432-N435 PolarHBondContact O-ND2 3.33Å; Q432-H436 PolarHBondContact O-CD2 2.83Å; Q432-Y469 HydrophobicContact CB-CE2 4.07Å
433	N	98.5	Very high	98.3	Very high	19 Å²	19	37 Å²	37	10%	0.102	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-47.3	177.7	-59.4	-48.6	0	0	0	110.6	A391 L392 M394 C397 D431 N435 H436	A391-N433 CarbonylContact O-C 3.43Å; A391-N433 WeakPolarHBondContact O-CB 3.43Å; L392-N433 PolarHBondContact O-ND2 2.81Å; M394-N433 PolarHBondContact N-ND2 3.13Å; C397-N433 HydrophobicContact CB-CB 3.89Å; D431-N433 VanDerWaalsContact C-N 3.25Å; D431-N433 PolarHBondContact O-N 3.44Å; D431-N433 WeakPolarHBondContact OD1-CA 3.41Å; D431-N433 VanDerWaalsContact OD1-CB 3.31Å; D431-N433 WeakPolarHBondContact OD1-CB 3.41Å; D431-N433 PolarHBondContact OD1-N 3.31Å; N433-N435 VanDerWaalsContact C-N 3.28Å; N433-N435 PolarHBondContact O-N 3.46Å; N433-H436 WeakPolarHBondContact O-CB 3.3Å; N433-H436 PolarHBondContact O-N 3.03Å; N433-H436 VanDerWaalsContact O-N 3.13Å
434	G	98.7	Very high	98.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.4	-33.7	-174.9	0	0	0	0	0	113.7	A391 C428 D431 H436 V437 V438	A391-G434 WeakPolarHBondContact O-CA 3.31Å; A391-G434 PolarHBondContact O-N 3.44Å; C428-G434 CarbonylContact O-C 3.59Å; C428-G434 WeakPolarHBondContact O-CA 3.44Å; D431-G434 PolarHBondContact OD1-N 3.2Å; G434-H436 PolarHBondContact O-N 3.38Å; G434-V437 WeakPolarHBondContact O-CB 3.34Å; G434-V437 PolarHBondContact O-N 3Å; G434-V438 PolarHBondContact O-N 2.97Å
435	N	98.8	Very high	98.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-32.9	179.6	77.3	92.9	0	0	0	112.1	C428 D431 Q432 N433 Q439 Y469	C428-N435 PolarHBondContact O-N 2.99Å; D431-N435 WeakPolarHBondContact O-CB 3.35Å; D431-N435 PolarHBondContact O-N 2.81Å; D431-N435 PolarHBondContact O-ND2 3.09Å; Q432-N435 VanDerWaalsContact C-ND2 3.29Å; Q432-N435 PolarHBondContact O-ND2 3.33Å; N433-N435 VanDerWaalsContact C-N 3.28Å; N433-N435 PolarHBondContact O-N 3.46Å; N435-Q439 VanDerWaalsContact C-NE2 3.34Å; N435-Q439 WeakPolarHBondContact O-CG 3.35Å; N435-Q439 PolarHBondContact O-N 3.48Å; N435-Q439 PolarHBondContact O-NE2 2.78Å; N435-Q439 PolarHBondContact OD1-NE2 2.84Å; N435-Y469 HydrophobicContact CB-CG 4.33Å
436	H	98.7	Very high	97.8	Very high	52 Å²	52	37 Å²	37	24%	0.241	18%	0.178	C	C	.	.	H	α-helix	trans	-72.9	-32.8	177.6	-67	-67.3	0	0	0	112.2	Q432 N433 G434 K440	Q432-H436 PolarHBondContact O-CD2 2.83Å; N433-H436 WeakPolarHBondContact O-CB 3.3Å; N433-H436 PolarHBondContact O-N 3.03Å; N433-H436 VanDerWaalsContact O-N 3.13Å; G434-H436 PolarHBondContact O-N 3.38Å; H436-K440 WeakPolarHBondContact O-CB 3.38Å; H436-K440 PolarHBondContact O-N 3.41Å
437	V	98.7	Very high	97.5	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-67.7	-47.3	172.3	174.9	0	0	0	0	110.3	A391 C397 I400 Q401 L404 L421 G434 Q439 K440 C441	A391-V437 HydrophobicContact CB-CB 4.13Å; A391-V437 HydrophobicContact CB-CG1 4.07Å; A391-V437 HydrophobicContact CB-CG2 3.89Å; C397-V437 HydrophobicContact CB-CG2 3.97Å; I400-V437 HydrophobicContact CB-CG2 4.15Å; I400-V437 HydrophobicContact CG2-CG1 3.6Å; I400-V437 HydrophobicContact CG2-CG2 4.13Å; Q401-V437 HydrophobicContact CG-CG2 4.39Å; L404-V437 HydrophobicContact CD1-CG1 4.34Å; L421-V437 HydrophobicContact CD1-CG1 4Å; G434-V437 WeakPolarHBondContact O-CB 3.34Å; G434-V437 PolarHBondContact O-N 3Å; V437-Q439 PolarHBondContact O-N 3.09Å; V437-K440 CarbonylContact O-C 3.57Å; V437-K440 PolarHBondContact O-N 3.02Å; V437-C441 PolarHBondContact O-N 3.48Å; V437-C441 PolarHBondContact O-SG 2.93Å
438	V	98.7	Very high	97.2	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-42.7	179.1	-177.5	0	0	0	0	111.6	C428 V429 G434 K440 C441 I442 I453 V473	C428-V438 HydrophobicContact CB-CG2 3.63Å; V429-V438 HydrophobicContact CG2-CB 4.33Å; V429-V438 HydrophobicContact CG2-CG1 3.99Å; V429-V438 HydrophobicContact CG2-CG2 4.16Å; G434-V438 PolarHBondContact O-N 2.97Å; V438-K440 VanDerWaalsContact C-N 3.33Å; V438-K440 PolarHBondContact O-N 3.19Å; V438-C441 WeakPolarHBondContact O-CB 3.47Å; V438-C441 PolarHBondContact O-N 3.08Å; V438-I442 HydrophobicContact CG1-CD1 4.09Å; V438-I442 WeakPolarHBondContact O-CD1 3.14Å; V438-I442 WeakPolarHBondContact O-CG1 3.36Å; V438-I442 PolarHBondContact O-N 2.9Å; V438-I442 VanDerWaalsContact O-N 3.16Å; V438-I453 HydrophobicContact CG1-CD1 4.44Å; V438-I453 HydrophobicContact CG1-CG2 4.22Å; V438-V473 HydrophobicContact CG1-CG1 3.66Å
439	Q	98.7	Very high	96.9	Very high	14 Å²	14	38 Å²	38	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-56.2	-46.8	171.4	-76.5	164.9	90	0	0	111.5	N435 V437 C441 I442 E443 V473 R476	N435-Q439 VanDerWaalsContact C-NE2 3.34Å; N435-Q439 WeakPolarHBondContact O-CG 3.35Å; N435-Q439 PolarHBondContact O-N 3.48Å; N435-Q439 PolarHBondContact O-NE2 2.78Å; N435-Q439 PolarHBondContact OD1-NE2 2.84Å; V437-Q439 PolarHBondContact O-N 3.09Å; Q439-C441 PolarHBondContact O-N 3.16Å; Q439-I442 PolarHBondContact O-N 3.03Å; Q439-I442 VanDerWaalsContact O-N 3.11Å; Q439-E443 WeakPolarHBondContact O-CG 3.21Å; Q439-E443 PolarHBondContact O-N 3.42Å; Q439-V473 HydrophobicContact CG-CG2 4.08Å; Q439-R476 HydrophobicContact CB-CG 3.92Å; Q439-R476 HydrophobicContact CG-CG 3.71Å
440	K	98.4	Very high	96.7	Very high	36 Å²	36	38 Å²	38	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-67.4	-32.6	-179.7	-171.1	56.9	61.3	-173.1	0	113.3	Q401 L404 H436 V437 V438 I442 E443 C444	Q401-K440 HydrophobicContact CB-CG 4.23Å; Q401-K440 HydrophobicContact CG-CB 3.96Å; Q401-K440 HydrophobicContact CG-CG 4.17Å; L404-K440 HydrophobicContact CB-CG 3.84Å; L404-K440 HydrophobicContact CD1-CB 4.14Å; L404-K440 HydrophobicContact CD1-CG 3.98Å; H436-K440 WeakPolarHBondContact O-CB 3.38Å; H436-K440 PolarHBondContact O-N 3.41Å; V437-K440 CarbonylContact O-C 3.57Å; V437-K440 PolarHBondContact O-N 3.02Å; V438-K440 VanDerWaalsContact C-N 3.33Å; V438-K440 PolarHBondContact O-N 3.19Å; K440-I442 VanDerWaalsContact C-N 3.31Å; K440-E443 WeakPolarHBondContact CE-OE2 3.35Å; K440-E443 IonicContact NZ-OE2 3.93Å; K440-E443 PolarHBondContact NZ-OE2 3.31Å; K440-E443 PolarHBondContact O-N 3.16Å; K440-C444 HydrophobicContact CD-CB 4.45Å; K440-C444 WeakPolarHBondContact CD-SG 3.33Å; K440-C444 WeakPolarHBondContact O-CB 3.39Å; K440-C444 PolarHBondContact O-N 3.45Å; K440-C444 VanDerWaalsContact O-N 3.08Å
441	C	97.9	Very high	96.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-44.9	169.7	-61.4	0	0	0	0	110.8	V418 V437 V438 Q439 V445 L450 I453	V418-C441 HydrophobicContact CG1-CB 4.34Å; V418-C441 HydrophobicContact CG2-CB 4.2Å; V437-C441 PolarHBondContact O-N 3.48Å; V437-C441 PolarHBondContact O-SG 2.93Å; V438-C441 WeakPolarHBondContact O-CB 3.47Å; V438-C441 PolarHBondContact O-N 3.08Å; Q439-C441 PolarHBondContact O-N 3.16Å; C441-V445 VanDerWaalsContact O-CB 3.27Å; C441-V445 WeakPolarHBondContact O-CB 3.32Å; C441-V445 PolarHBondContact O-N 3.29Å; C441-L450 HydrophobicContact CB-CD2 4.3Å; C441-I453 HydrophobicContact CB-CD1 4.45Å
442	I	97.9	Very high	96.4	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-36.7	-179.7	-62.7	155.9	0	0	0	112.3	V438 Q439 K440 L450 V473 R476 I477 H480	V438-I442 HydrophobicContact CG1-CD1 4.09Å; V438-I442 WeakPolarHBondContact O-CD1 3.14Å; V438-I442 WeakPolarHBondContact O-CG1 3.36Å; V438-I442 PolarHBondContact O-N 2.9Å; V438-I442 VanDerWaalsContact O-N 3.16Å; Q439-I442 PolarHBondContact O-N 3.03Å; Q439-I442 VanDerWaalsContact O-N 3.11Å; K440-I442 VanDerWaalsContact C-N 3.31Å; I442-L450 HydrophobicContact CB-CD1 4.37Å; I442-L450 HydrophobicContact CG1-CD1 4.26Å; I442-V473 HydrophobicContact CD1-CG1 3.59Å; I442-R476 HydrophobicContact CB-CB 4.12Å; I442-R476 HydrophobicContact CD1-CB 4.18Å; I442-R476 HydrophobicContact CG2-CB 3.78Å; I442-R476 VanDerWaalsContact CG2-O 3.26Å; I442-R476 WeakPolarHBondContact CG2-O 3.5Å; I442-I477 HydrophobicContact CD1-CD1 4.5Å; I442-I477 HydrophobicContact CD1-CG1 3.76Å; I442-H480 HydrophobicContact CG2-CB 3.82Å; I442-H480 WeakPolarHBondContact O-CB 3.42Å
443	E	97.2	Very high	96.4	Very high	66 Å²	66	32.4 Å²	32.4	31%	0.308	16%	0.164	S	C	.	.	H	α-helix	trans	-72.3	-32.7	178.6	-70.6	166.2	-151.7	0	0	113.9	Q439 K440 R476	Q439-E443 WeakPolarHBondContact O-CG 3.21Å; Q439-E443 PolarHBondContact O-N 3.42Å; K440-E443 WeakPolarHBondContact CE-OE2 3.35Å; K440-E443 IonicContact NZ-OE2 3.93Å; K440-E443 PolarHBondContact NZ-OE2 3.31Å; K440-E443 PolarHBondContact O-N 3.16Å; E443-R476 HydrophobicContact CG-CG 4.47Å; E443-R476 WeakPolarHBondContact OE1-CD 3.38Å
444	C	95.6	Very high	96.2	Very high	44 Å²	44	31.6 Å²	31.6	30%	0.297	16%	0.159	S	C	.	.	H	α-helix	trans	-117.5	-12.7	-166.2	-65.8	0	0	0	0	115.8	L404 K440	L404-C444 WeakPolarHBondContact O-CB 3.48Å; K440-C444 HydrophobicContact CD-CB 4.45Å; K440-C444 WeakPolarHBondContact CD-SG 3.33Å; K440-C444 WeakPolarHBondContact O-CB 3.39Å; K440-C444 PolarHBondContact O-N 3.45Å; K440-C444 VanDerWaalsContact O-N 3.08Å
445	V	94.6	Very high	96.1	Very high	8 Å²	8	35.3 Å²	35.3	5%	0.048	18%	0.177	C	C	.	.	S	Bend	trans	-113.4	143.8	-173.8	-175.1	0	0	0	0	111.1	L404 I414 V418 C441 A449 L450	L404-V445 HydrophobicContact CD2-CG2 3.95Å; I414-V445 HydrophobicContact CG2-CB 4.31Å; I414-V445 HydrophobicContact CG2-CG1 3.96Å; I414-V445 HydrophobicContact CG2-CG2 3.46Å; I414-V445 VanDerWaalsContact CG2-CG2 3.46Å; V418-V445 HydrophobicContact CG2-CG1 4.42Å; V418-V445 HydrophobicContact CG2-CG2 3.92Å; C441-V445 VanDerWaalsContact O-CB 3.27Å; C441-V445 WeakPolarHBondContact O-CB 3.32Å; C441-V445 PolarHBondContact O-N 3.29Å; V445-A449 HydrophobicContact CG1-CB 4.13Å; V445-L450 HydrophobicContact CB-CD2 4.18Å; V445-L450 HydrophobicContact CG1-CD2 4.32Å
446	Q	92.4	Very high	96	Very high	103 Å²	103	36.8 Å²	36.8	48%	0.481	19%	0.189	S	C	.	.			trans	-55.1	127.1	-176.3	-67.6	-66.7	-10.2	0	0	111.3	S409 H448 A449	S409-Q446 PolarHBondContact OG-NE2 2.86Å; Q446-H448 PolarHBondContact O-N 2.84Å; Q446-A449 WeakPolarHBondContact O-CB 3.35Å; Q446-A449 PolarHBondContact O-N 3.45Å
447	P	92.5	Very high	96	Very high	22 Å²	22	34.3 Å²	34.3	14%	0.143	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-53.1	-32.1	-171.6	-32.4	36.5	0	0	0	115.7	A449 L450 L482 Q485	P447-A449 VanDerWaalsContact C-N 3.25Å; P447-A449 PolarHBondContact O-N 3.07Å; P447-L450 WeakPolarHBondContact O-CB 3.02Å; P447-L450 PolarHBondContact O-N 3.07Å; P447-L482 HydrophobicContact CB-CD1 4.25Å; P447-L482 HydrophobicContact CB-CD2 4.47Å; P447-L482 HydrophobicContact CB-CG 3.82Å; P447-L482 HydrophobicContact CG-CG 4.41Å; P447-Q485 PolarHBondContact O-NE2 3.06Å
448	H	90.9	Very high	95.7	Very high	141 Å²	141	39 Å²	39	65%	0.653	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-56.9	-35.5	175.8	-60.3	94.3	0	0	0	113.2	Q446 L450	Q446-H448 PolarHBondContact O-N 2.84Å; H448-L450 VanDerWaalsContact C-N 3.25Å; H448-L450 PolarHBondContact O-N 3.05Å
449	A	92.4	Very high	95.6	Very high	35 Å²	35	41.5 Å²	41.5	29%	0.289	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-76.4	-12	177.9	0	0	0	0	0	113.2	V445 Q446 P447 F452	V445-A449 HydrophobicContact CG1-CB 4.13Å; Q446-A449 WeakPolarHBondContact O-CB 3.35Å; Q446-A449 PolarHBondContact O-N 3.45Å; P447-A449 VanDerWaalsContact C-N 3.25Å; P447-A449 PolarHBondContact O-N 3.07Å; A449-F452 WeakPolarHBondContact O-CD1 3.44Å; A449-F452 WeakPolarHBondContact O-CE1 3.33Å
450	L	95	Very high	95.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-94.8	2.3	-175.2	-53.9	-179.2	0	0	0	113.6	V418 C441 I442 V445 P447 H448 F452 I453 I454	V418-L450 HydrophobicContact CG1-CD2 4.03Å; C441-L450 HydrophobicContact CB-CD2 4.3Å; I442-L450 HydrophobicContact CB-CD1 4.37Å; I442-L450 HydrophobicContact CG1-CD1 4.26Å; V445-L450 HydrophobicContact CB-CD2 4.18Å; V445-L450 HydrophobicContact CG1-CD2 4.32Å; P447-L450 WeakPolarHBondContact O-CB 3.02Å; P447-L450 PolarHBondContact O-N 3.07Å; H448-L450 VanDerWaalsContact C-N 3.25Å; H448-L450 PolarHBondContact O-N 3.05Å; L450-F452 VanDerWaalsContact C-N 3.27Å; L450-F452 PolarHBondContact O-N 3.25Å; L450-F452 VanDerWaalsContact O-N 3.17Å; L450-I453 HydrophobicContact CB-CD1 4.39Å; L450-I453 HydrophobicContact CD2-CD1 3.92Å; L450-I453 WeakPolarHBondContact O-CA 3.32Å; L450-I453 VanDerWaalsContact O-CB 3.27Å; L450-I453 WeakPolarHBondContact O-CB 3.35Å; L450-I453 PolarHBondContact O-N 3.12Å; L450-I454 PolarHBondContact O-N 3.34Å
451	H	94.7	Very high	95.6	Very high	99 Å²	99	42.2 Å²	42.2	46%	0.458	23%	0.227	S	C	.	.	H	α-helix	trans	-55.9	-38.4	-172.2	-174.2	44.1	0	0	0	113.3	I453 I454 E455	H451-I453 PolarHBondContact O-N 3.44Å; H451-I454 WeakPolarHBondContact O-CB 3.18Å; H451-I454 PolarHBondContact O-N 3.38Å; H451-E455 IonicContact CE1-OE1 3.72Å; H451-E455 PolarHBondContact CE1-OE1 3.1Å; H451-E455 IonicContact ND1-OE1 3.75Å; H451-E455 IonicContact NE2-OE1 2.62Å; H451-E455 PolarHBondContact O-N 3.26Å
452	F	96.6	Very high	95.6	Very high	30 Å²	30	45 Å²	45	13%	0.132	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-28.2	175.8	76.6	-83.1	0	0	0	113.6	V418 L421 D422 V425 A449 L450 A456	V418-F452 HydrophobicContact CG1-CE1 3.85Å; V418-F452 HydrophobicContact CG1-CZ 3.76Å; V418-F452 WeakPolarHBondContact O-CZ 3.39Å; L421-F452 HydrophobicContact CB-CE2 4.39Å; D422-F452 HydrophobicContact CB-CD2 3.7Å; D422-F452 HydrophobicContact CB-CE2 3.95Å; D422-F452 HydrophobicContact CB-CG 4.23Å; D422-F452 WeakPolarHBondContact OD1-CD2 3.09Å; V425-F452 HydrophobicContact CG2-CD2 3.61Å; V425-F452 HydrophobicContact CG2-CE2 3.48Å; V425-F452 VanDerWaalsContact CG2-CE2 3.48Å; A449-F452 WeakPolarHBondContact O-CD1 3.44Å; A449-F452 WeakPolarHBondContact O-CE1 3.33Å; L450-F452 VanDerWaalsContact C-N 3.27Å; L450-F452 PolarHBondContact O-N 3.25Å; L450-F452 VanDerWaalsContact O-N 3.17Å; F452-A456 WeakPolarHBondContact O-CB 3.38Å; F452-A456 PolarHBondContact O-N 3.43Å; F452-A456 VanDerWaalsContact O-N 3.09Å
453	I	96.8	Very high	95.6	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-43	173	-55.1	-176.6	0	0	0	109.6	V425 V438 C441 L450 H451 A456 F457	V425-I453 HydrophobicContact CG1-CB 4.41Å; V425-I453 HydrophobicContact CG1-CG2 3.88Å; V425-I453 HydrophobicContact CG2-CG1 4.21Å; V438-I453 HydrophobicContact CG1-CD1 4.44Å; V438-I453 HydrophobicContact CG1-CG2 4.22Å; C441-I453 HydrophobicContact CB-CD1 4.45Å; L450-I453 HydrophobicContact CB-CD1 4.39Å; L450-I453 HydrophobicContact CD2-CD1 3.92Å; L450-I453 WeakPolarHBondContact O-CA 3.32Å; L450-I453 VanDerWaalsContact O-CB 3.27Å; L450-I453 WeakPolarHBondContact O-CB 3.35Å; L450-I453 PolarHBondContact O-N 3.12Å; H451-I453 PolarHBondContact O-N 3.44Å; I453-A456 PolarHBondContact O-N 3.13Å; I453-F457 HydrophobicContact CG2-CD2 4.41Å; I453-F457 HydrophobicContact CG2-CE2 4.06Å; I453-F457 WeakPolarHBondContact O-CD2 3.32Å; I453-F457 PolarHBondContact O-N 2.74Å
454	I	95.6	Very high	95.7	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-66.8	-43.3	179	-49.3	-59.1	0	0	0	110.8	L450 H451 A456 F457 I477 C481 Q485 I489	L450-I454 PolarHBondContact O-N 3.34Å; H451-I454 WeakPolarHBondContact O-CB 3.18Å; H451-I454 PolarHBondContact O-N 3.38Å; I454-A456 VanDerWaalsContact C-N 3.32Å; I454-A456 PolarHBondContact O-N 3.02Å; I454-F457 PolarHBondContact O-N 2.69Å; I454-F457 VanDerWaalsContact O-N 3.1Å; I454-I477 HydrophobicContact CD1-CD1 4.12Å; I454-I477 HydrophobicContact CD1-CG1 4.1Å; I454-I477 HydrophobicContact CD1-CG2 3.71Å; I454-C481 HydrophobicContact CD1-CB 4.5Å; I454-Q485 HydrophobicContact CD1-CB 4.33Å; I454-Q485 HydrophobicContact CG1-CB 4.05Å; I454-Q485 HydrophobicContact CG1-CG 4.24Å; I454-Q485 HydrophobicContact CG2-CB 4.38Å; I454-Q485 WeakPolarHBondContact CG2-O 3.44Å; I454-I489 HydrophobicContact CG2-CD1 4.45Å
455	E	96.3	Very high	95.9	Very high	78 Å²	78	41.7 Å²	41.7	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-41.8	175	-67.6	-54.4	118.6	0	0	112	H451 F457 K458	H451-E455 IonicContact CE1-OE1 3.72Å; H451-E455 PolarHBondContact CE1-OE1 3.1Å; H451-E455 IonicContact ND1-OE1 3.75Å; H451-E455 IonicContact NE2-OE1 2.62Å; H451-E455 PolarHBondContact O-N 3.26Å; E455-F457 PolarHBondContact O-N 3.02Å; E455-F457 VanDerWaalsContact O-N 3.16Å; E455-K458 PolarHBondContact O-N 2.73Å; E455-K458 WeakPolarHBondContact OE1-CE 3.5Å; E455-K458 IonicContact OE1-NZ 3.98Å; E455-K458 PolarHBondContact OE1-NZ 3.18Å; E455-K458 WeakPolarHBondContact OE2-CE 3.11Å; E455-K458 IonicContact OE2-NZ 3.9Å; E455-K458 PolarHBondContact OE2-NZ 3.21Å
456	A	97.4	Very high	96.1	Very high	30 Å²	30	43 Å²	43	25%	0.248	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.3	177.6	0	0	0	0	0	114.3	V425 L426 F452 I453 I454	V425-A456 HydrophobicContact CB-CB 3.75Å; V425-A456 HydrophobicContact CG1-CB 3.91Å; V425-A456 HydrophobicContact CG2-CB 4.14Å; L426-A456 WeakPolarHBondContact CD2-O 3.25Å; F452-A456 WeakPolarHBondContact O-CB 3.38Å; F452-A456 PolarHBondContact O-N 3.43Å; F452-A456 VanDerWaalsContact O-N 3.09Å; I453-A456 PolarHBondContact O-N 3.13Å; I454-A456 VanDerWaalsContact C-N 3.32Å; I454-A456 PolarHBondContact O-N 3.02Å
457	F	97.1	Very high	96.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-16.6	179	-87	-127	0	0	0	113.5	V425 V429 I453 I454 E455 G459 Q460 V461 L464 V473 I474 I477 I489	V425-F457 HydrophobicContact CG1-CD2 4.31Å; V425-F457 HydrophobicContact CG1-CE2 3.86Å; V429-F457 HydrophobicContact CG1-CZ 4.15Å; V429-F457 HydrophobicContact CG2-CE2 3.81Å; V429-F457 HydrophobicContact CG2-CZ 3.79Å; I453-F457 HydrophobicContact CG2-CD2 4.41Å; I453-F457 HydrophobicContact CG2-CE2 4.06Å; I453-F457 WeakPolarHBondContact O-CD2 3.32Å; I453-F457 PolarHBondContact O-N 2.74Å; I454-F457 PolarHBondContact O-N 2.69Å; I454-F457 VanDerWaalsContact O-N 3.1Å; E455-F457 PolarHBondContact O-N 3.02Å; E455-F457 VanDerWaalsContact O-N 3.16Å; F457-G459 PolarHBondContact O-N 2.65Å; F457-Q460 WeakPolarHBondContact O-CA 3.5Å; F457-Q460 WeakPolarHBondContact O-CB 3.34Å; F457-Q460 PolarHBondContact O-N 2.68Å; F457-V461 WeakPolarHBondContact O-CG2 3.42Å; F457-V461 PolarHBondContact O-N 3.02Å; F457-L464 HydrophobicContact CD1-CD1 3.53Å; F457-L464 HydrophobicContact CD2-CD1 4.02Å; F457-L464 HydrophobicContact CE1-CD1 3.53Å; F457-L464 HydrophobicContact CE2-CD1 4.05Å; F457-L464 HydrophobicContact CG-CD1 3.78Å; F457-L464 HydrophobicContact CZ-CD1 3.8Å; F457-V473 HydrophobicContact CE1-CB 4.4Å; F457-V473 HydrophobicContact CE1-CG1 4.16Å; F457-V473 HydrophobicContact CE2-CG1 4.42Å; F457-V473 HydrophobicContact CZ-CB 4.02Å; F457-V473 HydrophobicContact CZ-CG1 3.52Å; F457-I474 HydrophobicContact CD1-CD1 3.45Å; F457-I474 VanDerWaalsContact CD1-CD1 3.45Å; F457-I474 HydrophobicContact CD1-CG1 4.46Å; F457-I474 HydrophobicContact CE1-CD1 3.53Å; F457-I474 HydrophobicContact CE1-CG1 4.07Å; F457-I477 HydrophobicContact CD1-CD1 3.69Å; F457-I477 HydrophobicContact CE1-CD1 3.57Å; F457-I477 HydrophobicContact CE2-CD1 4.39Å; F457-I477 HydrophobicContact CG-CD1 4.19Å; F457-I477 HydrophobicContact CZ-CD1 3.95Å; F457-I489 HydrophobicContact CB-CD1 3.76Å
458	K	93.9	Very high	96.6	Very high	101 Å²	101	41.2 Å²	41.2	44%	0.439	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	130.5	180	-68	-178.9	178.4	171	0	111.4	E455 Q460	E455-K458 PolarHBondContact O-N 2.73Å; E455-K458 WeakPolarHBondContact OE1-CE 3.5Å; E455-K458 IonicContact OE1-NZ 3.98Å; E455-K458 PolarHBondContact OE1-NZ 3.18Å; E455-K458 WeakPolarHBondContact OE2-CE 3.11Å; E455-K458 IonicContact OE2-NZ 3.9Å; E455-K458 PolarHBondContact OE2-NZ 3.21Å; K458-Q460 PolarHBondContact O-N 2.72Å
459	G	96.3	Very high	97	Very high	53 Å²	53	38 Å²	38	55%	0.546	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	14.9	-175.1	0	0	0	0	0	113.9	F457 E492	F457-G459 PolarHBondContact O-N 2.65Å; G459-E492 VanDerWaalsContact C-OE1 3.27Å; G459-E492 WeakPolarHBondContact CA-OE1 3.41Å; G459-E492 WeakPolarHBondContact CA-OE2 3.41Å; G459-E492 PolarHBondContact N-OE2 3.33Å
460	Q	97.9	Very high	97.3	Very high	66 Å²	66	36.3 Å²	36.3	31%	0.308	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129	-2	177.9	-62.6	-66.1	-68.8	0	0	112.5	L426 F457 K458 F462 A463 L464 E492	L426-Q460 HydrophobicContact CD1-CG 4.15Å; L426-Q460 HydrophobicContact CD2-CG 4.43Å; F457-Q460 WeakPolarHBondContact O-CA 3.5Å; F457-Q460 WeakPolarHBondContact O-CB 3.34Å; F457-Q460 PolarHBondContact O-N 2.68Å; K458-Q460 PolarHBondContact O-N 2.72Å; Q460-F462 PolarHBondContact O-N 3.41Å; Q460-A463 PolarHBondContact O-N 3.08Å; Q460-A463 VanDerWaalsContact O-N 3.16Å; Q460-L464 HydrophobicContact CB-CD1 3.96Å; Q460-L464 HydrophobicContact CB-CG 4.24Å; Q460-L464 WeakPolarHBondContact O-CB 3.2Å; Q460-L464 VanDerWaalsContact O-CG 3.27Å; Q460-L464 WeakPolarHBondContact O-CG 3.45Å; Q460-L464 PolarHBondContact O-N 2.94Å; Q460-E492 PolarHBondContact N-OE1 2.74Å; Q460-E492 VanDerWaalsContact N-OE1 3.11Å
461	V	98.3	Very high	97.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-42.1	-171	176.8	0	0	0	0	111.4	F457 L464 S465 I474 I489 E492 L493	F457-V461 WeakPolarHBondContact O-CG2 3.42Å; F457-V461 PolarHBondContact O-N 3.02Å; V461-L464 PolarHBondContact O-N 3.42Å; V461-S465 WeakPolarHBondContact O-CB 3.35Å; V461-S465 PolarHBondContact O-N 2.99Å; V461-S465 PolarHBondContact O-OG 2.92Å; V461-I474 HydrophobicContact CG1-CD1 4.06Å; V461-I489 HydrophobicContact CG1-CG2 3.9Å; V461-I489 HydrophobicContact CG2-CD1 3.75Å; V461-I489 HydrophobicContact CG2-CG2 4.14Å; V461-E492 WeakPolarHBondContact CA-OE1 3.42Å; V461-E492 HydrophobicContact CB-CB 3.89Å; V461-E492 VanDerWaalsContact CB-CD 3.44Å; V461-E492 HydrophobicContact CB-CG 3.84Å; V461-E492 WeakPolarHBondContact CB-OE1 3.47Å; V461-E492 HydrophobicContact CG1-CB 4.33Å; V461-E492 HydrophobicContact CG2-CB 3.95Å; V461-E492 HydrophobicContact CG2-CG 4.19Å; V461-E492 WeakPolarHBondContact CG2-OE2 3.38Å; V461-E492 PolarHBondContact N-OE1 3.27Å; V461-L493 HydrophobicContact CG1-CD2 3.7Å; V461-L493 HydrophobicContact CG1-CG 3.66Å
462	F	98.5	Very high	97.7	Very high	59 Å²	59	37.4 Å²	37.4	26%	0.259	20%	0.198	S	C	.	.	H	α-helix	trans	-61.7	-49.4	174.5	177.6	-109.5	0	0	0	112.3	Q460 L464 S465 T466 H496 Q499 L500	Q460-F462 PolarHBondContact O-N 3.41Å; F462-L464 VanDerWaalsContact C-N 3.26Å; F462-L464 PolarHBondContact O-N 3.17Å; F462-S465 PolarHBondContact O-N 2.86Å; F462-T466 HydrophobicContact CD2-CG2 4.29Å; F462-T466 HydrophobicContact CE2-CG2 3.84Å; F462-T466 HydrophobicContact CZ-CG2 4.02Å; F462-T466 WeakPolarHBondContact O-CG2 3.26Å; F462-T466 PolarHBondContact O-N 3.39Å; F462-T466 VanDerWaalsContact O-N 3.09Å; F462-T466 PolarHBondContact O-OG1 3Å; F462-H496 HydrophobicContact CB-CB 4.4Å; F462-H496 HydrophobicContact CD2-CB 3.48Å; F462-H496 VanDerWaalsContact CD2-CB 3.48Å; F462-H496 AromaticContact CD2-CG 3.63Å; F462-H496 AromaticContact CD2-ND1 3.91Å; F462-H496 HydrophobicContact CE2-CB 4.1Å; F462-H496 HydrophobicContact CG-CB 4.2Å; F462-H496 AromaticContact CG-CG 3.85Å; F462-H496 AromaticContact CG-ND1 3.97Å; F462-Q499 HydrophobicContact CE2-CB 3.74Å; F462-Q499 HydrophobicContact CZ-CB 4.13Å; F462-L500 HydrophobicContact CD2-CD2 3.72Å; F462-L500 HydrophobicContact CD2-CG 3.95Å; F462-L500 HydrophobicContact CE2-CD2 3.91Å; F462-L500 HydrophobicContact CE2-CG 4.13Å
463	A	98.6	Very high	97.8	Very high	44 Å²	44	36 Å²	36	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-66	-27.9	-179	0	0	0	0	0	112.8	Q460 T466	Q460-A463 PolarHBondContact O-N 3.08Å; Q460-A463 VanDerWaalsContact O-N 3.16Å; A463-T466 PolarHBondContact O-OG1 2.93Å
464	L	98.7	Very high	97.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-84.7	-36.4	175.5	-66.4	175.3	0	0	0	112.2	L426 V429 K430 F457 Q460 V461 F462 T466 H467 G470 C471 I474	L426-L464 HydrophobicContact CD2-CD1 3.8Å; L426-L464 HydrophobicContact CD2-CD2 4.35Å; V429-L464 HydrophobicContact CG1-CD2 3.76Å; K430-L464 HydrophobicContact CG-CD2 4.4Å; F457-L464 HydrophobicContact CD1-CD1 3.53Å; F457-L464 HydrophobicContact CD2-CD1 4.02Å; F457-L464 HydrophobicContact CE1-CD1 3.53Å; F457-L464 HydrophobicContact CE2-CD1 4.05Å; F457-L464 HydrophobicContact CG-CD1 3.78Å; F457-L464 HydrophobicContact CZ-CD1 3.8Å; Q460-L464 HydrophobicContact CB-CD1 3.96Å; Q460-L464 HydrophobicContact CB-CG 4.24Å; Q460-L464 WeakPolarHBondContact O-CB 3.2Å; Q460-L464 VanDerWaalsContact O-CG 3.27Å; Q460-L464 WeakPolarHBondContact O-CG 3.45Å; Q460-L464 PolarHBondContact O-N 2.94Å; V461-L464 PolarHBondContact O-N 3.42Å; F462-L464 VanDerWaalsContact C-N 3.26Å; F462-L464 PolarHBondContact O-N 3.17Å; L464-T466 VanDerWaalsContact C-N 3.25Å; L464-T466 PolarHBondContact O-N 3.28Å; L464-H467 WeakPolarHBondContact O-CB 3.38Å; L464-H467 PolarHBondContact O-N 3.12Å; L464-G470 CarbonylContact O-C 3.57Å; L464-G470 WeakPolarHBondContact O-CA 3.46Å; L464-C471 PolarHBondContact O-N 3.16Å; L464-I474 HydrophobicContact CB-CD1 4.5Å; L464-I474 HydrophobicContact CB-CG1 4.4Å
465	S	98.8	Very high	98	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-28.4	177.2	-62.5	0	0	0	0	112.6	V461 F462 C471 L493 Y505 G506	V461-S465 WeakPolarHBondContact O-CB 3.35Å; V461-S465 PolarHBondContact O-N 2.99Å; V461-S465 PolarHBondContact O-OG 2.92Å; F462-S465 PolarHBondContact O-N 2.86Å; S465-C471 VanDerWaalsContact O-CB 3.3Å; S465-C471 WeakPolarHBondContact O-CB 3.48Å; S465-L493 WeakPolarHBondContact OG-CD2 3.4Å; S465-Y505 CarbonylContact O-C 3.16Å; S465-G506 WeakPolarHBondContact O-CA 3.38Å; S465-G506 PolarHBondContact O-N 3.42Å
466	T	98.7	Very high	98.1	Very high	36 Å²	36	35.9 Å²	35.9	22%	0.221	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.3	172.3	55	0	0	0	0	113.5	F462 A463 L464 L500 D503 Y505	F462-T466 HydrophobicContact CD2-CG2 4.29Å; F462-T466 HydrophobicContact CE2-CG2 3.84Å; F462-T466 HydrophobicContact CZ-CG2 4.02Å; F462-T466 WeakPolarHBondContact O-CG2 3.26Å; F462-T466 PolarHBondContact O-N 3.39Å; F462-T466 VanDerWaalsContact O-N 3.09Å; F462-T466 PolarHBondContact O-OG1 3Å; A463-T466 PolarHBondContact O-OG1 2.93Å; L464-T466 VanDerWaalsContact C-N 3.25Å; L464-T466 PolarHBondContact O-N 3.28Å; T466-L500 HydrophobicContact CG2-CD2 3.82Å; T466-D503 WeakPolarHBondContact CA-OD1 3.3Å; T466-D503 HydrophobicContact CG2-CB 3.93Å; T466-Y505 WeakPolarHBondContact O-CD2 3.4Å
467	H	98.8	Very high	98.1	Very high	44 Å²	44	34.5 Å²	34.5	20%	0.204	18%	0.178	C	C	.	.	S	Bend	trans	-97.4	135.9	178	-169.3	-102	0	0	0	111.5	L464 Y469 G470 C471	L464-H467 WeakPolarHBondContact O-CB 3.38Å; L464-H467 PolarHBondContact O-N 3.12Å; H467-Y469 AromaticContact CE1-CD2 3.67Å; H467-Y469 PolarHBondContact ND1-N 2.74Å; H467-Y469 PolarHBondContact O-N 3.3Å; H467-G470 PolarHBondContact ND1-N 3.21Å; H467-G470 PolarHBondContact O-N 3Å; H467-G470 VanDerWaalsContact O-N 3.09Å; H467-C471 PolarHBondContact O-N 3.38Å; H467-C471 VanDerWaalsContact O-N 3.08Å; H467-C471 PolarHBondContact O-SG 3.11Å; H467-C471 VanDerWaalsContact O-SG 3.41Å
468	P	98.3	Very high	98.2	Very high	43 Å²	43	36 Å²	36	28%	0.279	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.2	-177.8	17.6	-32.8	0	0	0	115.1	Y505	P468-Y505 HydrophobicContact CB-CD1 4.46Å; P468-Y505 HydrophobicContact CB-CE1 3.9Å; P468-Y505 HydrophobicContact CB-CE2 3.95Å; P468-Y505 HydrophobicContact CG-CE2 4.29Å
469	Y	98.6	Very high	98.4	Very high	74 Å²	74	34.9 Å²	34.9	29%	0.29	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-31.4	176.1	-48.7	-33.5	0	0	0	112.7	V429 Q432 N435 H467 C471 R472 V473	V429-Y469 WeakPolarHBondContact O-CB 3.27Å; Q432-Y469 HydrophobicContact CB-CE2 4.07Å; N435-Y469 HydrophobicContact CB-CG 4.33Å; H467-Y469 AromaticContact CE1-CD2 3.67Å; H467-Y469 PolarHBondContact ND1-N 2.74Å; H467-Y469 PolarHBondContact O-N 3.3Å; Y469-C471 PolarHBondContact O-N 2.96Å; Y469-R472 PolarHBondContact O-N 3.04Å; Y469-V473 PolarHBondContact O-N 2.94Å
470	G	98.6	Very high	98.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.6	-36.8	-174.7	0	0	0	0	0	111.9	L464 H467 R472 V473 I474	L464-G470 CarbonylContact O-C 3.57Å; L464-G470 WeakPolarHBondContact O-CA 3.46Å; H467-G470 PolarHBondContact ND1-N 3.21Å; H467-G470 PolarHBondContact O-N 3Å; H467-G470 VanDerWaalsContact O-N 3.09Å; G470-R472 PolarHBondContact O-N 3.12Å; G470-R472 VanDerWaalsContact O-N 3.16Å; G470-V473 PolarHBondContact O-N 3.26Å; G470-I474 WeakPolarHBondContact O-CG1 3.42Å; G470-I474 PolarHBondContact O-N 3.45Å
471	C	98.6	Very high	98.4	Very high	6 Å²	6	33.9 Å²	33.9	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-30.4	178	69.1	0	0	0	0	112.6	L464 S465 H467 Y469 Q475 V509	L464-C471 PolarHBondContact O-N 3.16Å; S465-C471 VanDerWaalsContact O-CB 3.3Å; S465-C471 WeakPolarHBondContact O-CB 3.48Å; H467-C471 PolarHBondContact O-N 3.38Å; H467-C471 VanDerWaalsContact O-N 3.08Å; H467-C471 PolarHBondContact O-SG 3.11Å; H467-C471 VanDerWaalsContact O-SG 3.41Å; Y469-C471 PolarHBondContact O-N 2.96Å; C471-Q475 WeakPolarHBondContact O-CG 3.35Å; C471-Q475 PolarHBondContact O-N 3.03Å; C471-Q475 PolarHBondContact O-NE2 3.49Å; C471-V509 HydrophobicContact CB-CG2 3.84Å
472	R	98.7	Very high	98.3	Very high	116 Å²	116	36.3 Å²	36.3	44%	0.438	18%	0.177	S	C	.	.	H	α-helix	trans	-75.4	-38.3	176.6	-59.5	-178.2	174.6	175.7	-3.5	111.9	Y469 G470 Q475 R476	Y469-R472 PolarHBondContact O-N 3.04Å; G470-R472 PolarHBondContact O-N 3.12Å; G470-R472 VanDerWaalsContact O-N 3.16Å; R472-Q475 PolarHBondContact O-N 2.9Å; R472-R476 PolarHBondContact O-N 3.19Å
473	V	98.7	Very high	98.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.9	-41	175.9	-170.1	0	0	0	0	110.5	V429 V438 Q439 I442 F457 Y469 G470 Q475 R476 I477	V429-V473 HydrophobicContact CG1-CB 4.39Å; V429-V473 HydrophobicContact CG1-CG2 4Å; V429-V473 HydrophobicContact CG2-CG1 4.26Å; V429-V473 HydrophobicContact CG2-CG2 4.23Å; V438-V473 HydrophobicContact CG1-CG1 3.66Å; Q439-V473 HydrophobicContact CG-CG2 4.08Å; I442-V473 HydrophobicContact CD1-CG1 3.59Å; F457-V473 HydrophobicContact CE1-CB 4.4Å; F457-V473 HydrophobicContact CE1-CG1 4.16Å; F457-V473 HydrophobicContact CE2-CG1 4.42Å; F457-V473 HydrophobicContact CZ-CB 4.02Å; F457-V473 HydrophobicContact CZ-CG1 3.52Å; Y469-V473 PolarHBondContact O-N 2.94Å; G470-V473 PolarHBondContact O-N 3.26Å; V473-Q475 VanDerWaalsContact C-N 3.34Å; V473-Q475 PolarHBondContact O-N 3.49Å; V473-R476 PolarHBondContact O-N 3.1Å; V473-I477 HydrophobicContact CG1-CD1 4.4Å; V473-I477 WeakPolarHBondContact O-CG1 3.35Å; V473-I477 PolarHBondContact O-N 3.19Å
474	I	98.6	Very high	98	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-55.5	-48.4	171.6	-65.1	-72.5	0	0	0	110.9	F457 V461 L464 G470 R476 I477 L478 I489 L493 V509	F457-I474 HydrophobicContact CD1-CD1 3.45Å; F457-I474 VanDerWaalsContact CD1-CD1 3.45Å; F457-I474 HydrophobicContact CD1-CG1 4.46Å; F457-I474 HydrophobicContact CE1-CD1 3.53Å; F457-I474 HydrophobicContact CE1-CG1 4.07Å; V461-I474 HydrophobicContact CG1-CD1 4.06Å; L464-I474 HydrophobicContact CB-CD1 4.5Å; L464-I474 HydrophobicContact CB-CG1 4.4Å; G470-I474 WeakPolarHBondContact O-CG1 3.42Å; G470-I474 PolarHBondContact O-N 3.45Å; I474-R476 PolarHBondContact O-N 3.09Å; I474-I477 WeakPolarHBondContact O-CB 3.4Å; I474-I477 PolarHBondContact O-N 3.25Å; I474-I477 VanDerWaalsContact O-N 3.16Å; I474-L478 HydrophobicContact CG2-CD1 4.07Å; I474-L478 HydrophobicContact CG2-CG 4.42Å; I474-L478 WeakPolarHBondContact O-CG 3.42Å; I474-L478 PolarHBondContact O-N 3.26Å; I474-I489 HydrophobicContact CD1-CG2 4.03Å; I474-I489 HydrophobicContact CG2-CG2 4.4Å; I474-L493 HydrophobicContact CG2-CD1 4.4Å; I474-V509 HydrophobicContact CG2-CG1 3.57Å; I474-V509 HydrophobicContact CG2-CG2 4.35Å
475	Q	98.7	Very high	97.9	Very high	33 Å²	33	42.8 Å²	42.8	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-45	177.2	-76.2	164.8	82.2	0	0	112.2	C471 R472 V473 I477 L478 E479 H512	C471-Q475 WeakPolarHBondContact O-CG 3.35Å; C471-Q475 PolarHBondContact O-N 3.03Å; C471-Q475 PolarHBondContact O-NE2 3.49Å; R472-Q475 PolarHBondContact O-N 2.9Å; V473-Q475 VanDerWaalsContact C-N 3.34Å; V473-Q475 PolarHBondContact O-N 3.49Å; Q475-I477 VanDerWaalsContact C-N 3.33Å; Q475-I477 PolarHBondContact O-N 3.23Å; Q475-L478 PolarHBondContact O-N 3.44Å; Q475-E479 VanDerWaalsContact O-CG 3.25Å; Q475-E479 WeakPolarHBondContact O-CG 3.4Å; Q475-E479 PolarHBondContact O-N 3.23Å; Q475-H512 HydrophobicContact CG-CB 3.99Å
476	R	98.6	Very high	97.8	Very high	49 Å²	49	43.6 Å²	43.6	19%	0.185	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-40.1	174.3	-68.8	-56.1	89	79.2	0.1	112.9	Q439 I442 E443 R472 V473 I474 E479 H480	Q439-R476 HydrophobicContact CB-CG 3.92Å; Q439-R476 HydrophobicContact CG-CG 3.71Å; I442-R476 HydrophobicContact CB-CB 4.12Å; I442-R476 HydrophobicContact CD1-CB 4.18Å; I442-R476 HydrophobicContact CG2-CB 3.78Å; I442-R476 VanDerWaalsContact CG2-O 3.26Å; I442-R476 WeakPolarHBondContact CG2-O 3.5Å; E443-R476 HydrophobicContact CG-CG 4.47Å; E443-R476 WeakPolarHBondContact OE1-CD 3.38Å; R472-R476 PolarHBondContact O-N 3.19Å; V473-R476 PolarHBondContact O-N 3.1Å; I474-R476 PolarHBondContact O-N 3.09Å; R476-E479 IonicContact CZ-OE1 2.76Å; R476-E479 IonicContact CZ-OE2 3.72Å; R476-E479 IonicContact NE-OE1 3.79Å; R476-E479 IonicContact NE-OE2 3.62Å; R476-E479 PolarHBondContact NE-OE2 3.17Å; R476-E479 IonicContact NH2-OE1 3.37Å; R476-E479 PolarHBondContact NH2-OE1 2.97Å; R476-E479 IonicContact NH2-OE2 3.88Å; R476-E479 PolarHBondContact NH2-OE2 2.83Å; R476-E479 PolarHBondContact O-N 3.37Å; R476-H480 PolarHBondContact O-CD2 3.45Å; R476-H480 PolarHBondContact O-N 3.08Å
477	I	98.3	Very high	97.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-48	175.4	-68.5	168.5	0	0	0	110.1	I442 I454 F457 V473 I474 Q475 E479 C481 T486 I489	I442-I477 HydrophobicContact CD1-CD1 4.5Å; I442-I477 HydrophobicContact CD1-CG1 3.76Å; I454-I477 HydrophobicContact CD1-CD1 4.12Å; I454-I477 HydrophobicContact CD1-CG1 4.1Å; I454-I477 HydrophobicContact CD1-CG2 3.71Å; F457-I477 HydrophobicContact CD1-CD1 3.69Å; F457-I477 HydrophobicContact CE1-CD1 3.57Å; F457-I477 HydrophobicContact CE2-CD1 4.39Å; F457-I477 HydrophobicContact CG-CD1 4.19Å; F457-I477 HydrophobicContact CZ-CD1 3.95Å; V473-I477 HydrophobicContact CG1-CD1 4.4Å; V473-I477 WeakPolarHBondContact O-CG1 3.35Å; V473-I477 PolarHBondContact O-N 3.19Å; I474-I477 WeakPolarHBondContact O-CB 3.4Å; I474-I477 PolarHBondContact O-N 3.25Å; I474-I477 VanDerWaalsContact O-N 3.16Å; Q475-I477 VanDerWaalsContact C-N 3.33Å; Q475-I477 PolarHBondContact O-N 3.23Å; I477-E479 PolarHBondContact O-N 3.04Å; I477-C481 HydrophobicContact CG2-CB 4.14Å; I477-C481 VanDerWaalsContact O-CB 3.23Å; I477-C481 WeakPolarHBondContact O-CB 3.08Å; I477-C481 PolarHBondContact O-N 2.94Å; I477-T486 HydrophobicContact CG2-CG2 4.29Å; I477-T486 VanDerWaalsContact O-CG2 3.24Å; I477-T486 WeakPolarHBondContact O-CG2 3.34Å; I477-I489 HydrophobicContact CG2-CG1 4.22Å
478	L	98.1	Very high	97.6	Very high	32 Å²	32	44.4 Å²	44.4	17%	0.168	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-26	179.4	-64	176.1	0	0	0	113.6	I474 Q475 T486 L490 L493 V509 V513	I474-L478 HydrophobicContact CG2-CD1 4.07Å; I474-L478 HydrophobicContact CG2-CG 4.42Å; I474-L478 WeakPolarHBondContact O-CG 3.42Å; I474-L478 PolarHBondContact O-N 3.26Å; Q475-L478 PolarHBondContact O-N 3.44Å; L478-T486 HydrophobicContact CD2-CG2 4.43Å; L478-L490 HydrophobicContact CD2-CD1 4.45Å; L478-L490 HydrophobicContact CD2-CD2 3.85Å; L478-L490 HydrophobicContact CD2-CG 3.87Å; L478-L493 HydrophobicContact CD1-CD1 4.14Å; L478-V509 HydrophobicContact CD1-CG1 4.4Å; L478-V513 HydrophobicContact CD1-CG2 3.86Å
479	E	97.5	Very high	97.6	Very high	77 Å²	77	42.4 Å²	42.4	36%	0.36	21%	0.207	S	C	.	.	H	α-helix	trans	-85.6	-37.1	-179.9	-72.3	165.1	-158.8	0	0	114.1	Q475 R476 I477 H512	Q475-E479 VanDerWaalsContact O-CG 3.25Å; Q475-E479 WeakPolarHBondContact O-CG 3.4Å; Q475-E479 PolarHBondContact O-N 3.23Å; R476-E479 IonicContact CZ-OE1 2.76Å; R476-E479 IonicContact CZ-OE2 3.72Å; R476-E479 IonicContact NE-OE1 3.79Å; R476-E479 IonicContact NE-OE2 3.62Å; R476-E479 PolarHBondContact NE-OE2 3.17Å; R476-E479 IonicContact NH2-OE1 3.37Å; R476-E479 PolarHBondContact NH2-OE1 2.97Å; R476-E479 IonicContact NH2-OE2 3.88Å; R476-E479 PolarHBondContact NH2-OE2 2.83Å; R476-E479 PolarHBondContact O-N 3.37Å; I477-E479 PolarHBondContact O-N 3.04Å; E479-H512 WeakPolarHBondContact CG-CE1 3.42Å; E479-H512 IonicContact OE1-CE1 2.69Å; E479-H512 PolarHBondContact OE1-CE1 2.84Å; E479-H512 IonicContact OE1-ND1 3.56Å; E479-H512 PolarHBondContact OE1-ND1 3.45Å; E479-H512 IonicContact OE1-NE2 2.74Å
480	H	97.1	Very high	97.6	Very high	83 Å²	83	39.5 Å²	39.5	38%	0.384	20%	0.196	S	C	.	.	H	α-helix	trans	-119.7	-19.6	-166.2	-65.2	-84.6	0	0	0	115.3	I442 R476	I442-H480 HydrophobicContact CG2-CB 3.82Å; I442-H480 WeakPolarHBondContact O-CB 3.42Å; R476-H480 PolarHBondContact O-CD2 3.45Å; R476-H480 PolarHBondContact O-N 3.08Å
481	C	96.8	Very high	97.5	Very high	15 Å²	15	44.9 Å²	44.9	10%	0.101	22%	0.222	C	C	.	.	S	Bend	trans	-83.8	160.4	-178.7	-64.4	0	0	0	0	112.3	I454 I477 Q485 T486	I454-C481 HydrophobicContact CD1-CB 4.5Å; I477-C481 HydrophobicContact CG2-CB 4.14Å; I477-C481 VanDerWaalsContact O-CB 3.23Å; I477-C481 WeakPolarHBondContact O-CB 3.08Å; I477-C481 PolarHBondContact O-N 2.94Å; C481-Q485 HydrophobicContact CB-CB 3.93Å; C481-T486 HydrophobicContact CB-CG2 3.96Å
482	L	96.8	Very high	97.5	Very high	51 Å²	51	46 Å²	46	27%	0.267	23%	0.226	S	C	.	.			trans	-66.6	155.9	-178.9	-61.7	173.3	0	0	0	111.4	P447 E484 Q485 T486	P447-L482 HydrophobicContact CB-CD1 4.25Å; P447-L482 HydrophobicContact CB-CD2 4.47Å; P447-L482 HydrophobicContact CB-CG 3.82Å; P447-L482 HydrophobicContact CG-CG 4.41Å; L482-E484 VanDerWaalsContact C-N 3.26Å; L482-E484 HydrophobicContact CB-CG 3.77Å; L482-E484 HydrophobicContact CD1-CG 4.45Å; L482-E484 PolarHBondContact O-N 3.11Å; L482-Q485 HydrophobicContact CB-CG 4.33Å; L482-Q485 WeakPolarHBondContact O-CA 3.36Å; L482-Q485 WeakPolarHBondContact O-CB 3.36Å; L482-Q485 PolarHBondContact O-N 3.24Å; L482-T486 PolarHBondContact O-N 2.9Å; L482-T486 PolarHBondContact O-OG1 2.96Å
483	P	95.4	Very high	97.5	Very high	95 Å²	95	40.6 Å²	40.6	62%	0.617	21%	0.206	S	C	*	.	H	α-helix	trans	-52.8	-41.3	176.4	-28.8	36.5	0	0	0	113.6	Q485 T486 L487	P483-Q485 PolarHBondContact O-N 2.77Å; P483-T486 WeakPolarHBondContact CA-OG1 3.35Å; P483-T486 PolarHBondContact O-N 2.73Å; P483-T486 PolarHBondContact O-OG1 2.68Å; P483-L487 WeakPolarHBondContact O-CB 3.43Å; P483-L487 WeakPolarHBondContact O-CD1 3.39Å; P483-L487 WeakPolarHBondContact O-CG 3.47Å; P483-L487 PolarHBondContact O-N 2.63Å
484	E	95.8	Very high	97.4	Very high	136 Å²	136	42.2 Å²	42.2	64%	0.636	21%	0.213	S	C	*	.	H	α-helix	trans	-61.5	-24.2	174.3	52.4	177.8	-148.2	0	0	114.4	L482 P488	L482-E484 VanDerWaalsContact C-N 3.26Å; L482-E484 HydrophobicContact CB-CG 3.77Å; L482-E484 HydrophobicContact CD1-CG 4.45Å; L482-E484 PolarHBondContact O-N 3.11Å; E484-P488 WeakPolarHBondContact O-CD 3.3Å
485	Q	96.4	Very high	97.4	Very high	9 Å²	9	49 Å²	49	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-90.9	-33	176.4	-67.1	176.7	-37.5	0	0	112.4	P447 I454 C481 L482 P483	P447-Q485 PolarHBondContact O-NE2 3.06Å; I454-Q485 HydrophobicContact CD1-CB 4.33Å; I454-Q485 HydrophobicContact CG1-CB 4.05Å; I454-Q485 HydrophobicContact CG1-CG 4.24Å; I454-Q485 HydrophobicContact CG2-CB 4.38Å; I454-Q485 WeakPolarHBondContact CG2-O 3.44Å; C481-Q485 HydrophobicContact CB-CB 3.93Å; L482-Q485 HydrophobicContact CB-CG 4.33Å; L482-Q485 WeakPolarHBondContact O-CA 3.36Å; L482-Q485 WeakPolarHBondContact O-CB 3.36Å; L482-Q485 PolarHBondContact O-N 3.24Å; P483-Q485 PolarHBondContact O-N 2.77Å
486	T	97.3	Very high	97.4	Very high	17 Å²	17	49.9 Å²	49.9	10%	0.104	25%	0.249	C	C	.	.	H	α-helix	trans	-83.1	-28	-179.9	56.6	0	0	0	0	112.9	I477 L478 C481 L482 P483 I489 L490	I477-T486 HydrophobicContact CG2-CG2 4.29Å; I477-T486 VanDerWaalsContact O-CG2 3.24Å; I477-T486 WeakPolarHBondContact O-CG2 3.34Å; L478-T486 HydrophobicContact CD2-CG2 4.43Å; C481-T486 HydrophobicContact CB-CG2 3.96Å; L482-T486 PolarHBondContact O-N 2.9Å; L482-T486 PolarHBondContact O-OG1 2.96Å; P483-T486 WeakPolarHBondContact CA-OG1 3.35Å; P483-T486 PolarHBondContact O-N 2.73Å; P483-T486 PolarHBondContact O-OG1 2.68Å; T486-I489 WeakPolarHBondContact O-CB 3.5Å; T486-I489 PolarHBondContact O-N 3.12Å; T486-I489 VanDerWaalsContact O-N 3.17Å; T486-L490 WeakPolarHBondContact O-CG 3.47Å; T486-L490 PolarHBondContact O-N 3.48Å
487	L	96.3	Very high	97.4	Very high	59 Å²	59	47.7 Å²	47.7	31%	0.309	24%	0.241	S	C	.	.	H	α-helix	trans	-49.7	-56.3	176.2	-85.6	167.5	0	0	0	114.6	P483 I489 L490 E491	P483-L487 WeakPolarHBondContact O-CB 3.43Å; P483-L487 WeakPolarHBondContact O-CD1 3.39Å; P483-L487 WeakPolarHBondContact O-CG 3.47Å; P483-L487 PolarHBondContact O-N 2.63Å; L487-I489 PolarHBondContact O-N 3.12Å; L487-L490 PolarHBondContact O-N 3.02Å; L487-L490 VanDerWaalsContact O-N 3.12Å; L487-E491 WeakPolarHBondContact O-CG 3.37Å; L487-E491 PolarHBondContact O-N 3.04Å
488	P	96.6	Very high	97.3	Very high	37 Å²	37	53.5 Å²	53.5	24%	0.24	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-30.1	-179.8	24.4	-34.9	0	0	0	112.8	E484 E492	E484-P488 WeakPolarHBondContact O-CD 3.3Å; P488-E492 PolarHBondContact O-N 2.86Å
489	I	97.9	Very high	97.3	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-43.6	175.1	-52.8	-61.1	0	0	0	110.4	I454 F457 V461 I474 I477 T486 L487 E492 L493	I454-I489 HydrophobicContact CG2-CD1 4.45Å; F457-I489 HydrophobicContact CB-CD1 3.76Å; V461-I489 HydrophobicContact CG1-CG2 3.9Å; V461-I489 HydrophobicContact CG2-CD1 3.75Å; V461-I489 HydrophobicContact CG2-CG2 4.14Å; I474-I489 HydrophobicContact CD1-CG2 4.03Å; I474-I489 HydrophobicContact CG2-CG2 4.4Å; I477-I489 HydrophobicContact CG2-CG1 4.22Å; T486-I489 WeakPolarHBondContact O-CB 3.5Å; T486-I489 PolarHBondContact O-N 3.12Å; T486-I489 VanDerWaalsContact O-N 3.17Å; L487-I489 PolarHBondContact O-N 3.12Å; I489-E492 PolarHBondContact O-N 3.4Å; I489-L493 HydrophobicContact CG2-CD1 4.34Å; I489-L493 WeakPolarHBondContact O-CB 3.46Å; I489-L493 VanDerWaalsContact O-CG 3.3Å; I489-L493 WeakPolarHBondContact O-CG 3.42Å; I489-L493 PolarHBondContact O-N 3.48Å
490	L	98.1	Very high	97.4	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-40.4	175.5	-72.4	164.7	0	0	0	111.9	L478 T486 L487 E492 L493 H494 V513	L478-L490 HydrophobicContact CD2-CD1 4.45Å; L478-L490 HydrophobicContact CD2-CD2 3.85Å; L478-L490 HydrophobicContact CD2-CG 3.87Å; T486-L490 WeakPolarHBondContact O-CG 3.47Å; T486-L490 PolarHBondContact O-N 3.48Å; L487-L490 PolarHBondContact O-N 3.02Å; L487-L490 VanDerWaalsContact O-N 3.12Å; L490-E492 PolarHBondContact O-N 3.42Å; L490-L493 HydrophobicContact CD2-CD1 4.33Å; L490-L493 PolarHBondContact O-N 2.92Å; L490-H494 PolarHBondContact O-CD2 3.19Å; L490-H494 PolarHBondContact O-N 3.3Å; L490-V513 HydrophobicContact CD2-CG1 4.21Å; L490-V513 HydrophobicContact CD2-CG2 3.92Å
491	E	97.5	Very high	97.5	Very high	113 Å²	113	49.3 Å²	49.3	53%	0.528	25%	0.248	S	C	.	.	H	α-helix	trans	-61.8	-39.6	177	-73.9	174.4	172.5	0	0	112.8	L487 Q495	L487-E491 WeakPolarHBondContact O-CG 3.37Å; L487-E491 PolarHBondContact O-N 3.04Å; E491-Q495 WeakPolarHBondContact O-CG 3.23Å; E491-Q495 PolarHBondContact O-NE2 2.89Å
492	E	98	Very high	97.6	Very high	29 Å²	29	52.1 Å²	52.1	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-75.5	-35.1	174.6	-161.9	179.9	138.8	0	0	112.2	G459 Q460 V461 P488 I489 L490 H494 Q495 H496	G459-E492 VanDerWaalsContact C-OE1 3.27Å; G459-E492 WeakPolarHBondContact CA-OE1 3.41Å; G459-E492 WeakPolarHBondContact CA-OE2 3.41Å; G459-E492 PolarHBondContact N-OE2 3.33Å; Q460-E492 PolarHBondContact N-OE1 2.74Å; Q460-E492 VanDerWaalsContact N-OE1 3.11Å; V461-E492 WeakPolarHBondContact CA-OE1 3.42Å; V461-E492 HydrophobicContact CB-CB 3.89Å; V461-E492 VanDerWaalsContact CB-CD 3.44Å; V461-E492 HydrophobicContact CB-CG 3.84Å; V461-E492 WeakPolarHBondContact CB-OE1 3.47Å; V461-E492 HydrophobicContact CG1-CB 4.33Å; V461-E492 HydrophobicContact CG2-CB 3.95Å; V461-E492 HydrophobicContact CG2-CG 4.19Å; V461-E492 WeakPolarHBondContact CG2-OE2 3.38Å; V461-E492 PolarHBondContact N-OE1 3.27Å; P488-E492 PolarHBondContact O-N 2.86Å; I489-E492 PolarHBondContact O-N 3.4Å; L490-E492 PolarHBondContact O-N 3.42Å; E492-H494 PolarHBondContact O-N 2.93Å; E492-Q495 PolarHBondContact O-N 2.95Å; E492-H496 PolarHBondContact O-CD2 2.96Å
493	L	98.3	Very high	97.7	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-46.4	171.4	-76.6	171.4	0	0	0	111.8	V461 S465 I474 L478 I489 L490 Q495 H496 T497 L500 V509 V513	V461-L493 HydrophobicContact CG1-CD2 3.7Å; V461-L493 HydrophobicContact CG1-CG 3.66Å; S465-L493 WeakPolarHBondContact OG-CD2 3.4Å; I474-L493 HydrophobicContact CG2-CD1 4.4Å; L478-L493 HydrophobicContact CD1-CD1 4.14Å; I489-L493 HydrophobicContact CG2-CD1 4.34Å; I489-L493 WeakPolarHBondContact O-CB 3.46Å; I489-L493 VanDerWaalsContact O-CG 3.3Å; I489-L493 WeakPolarHBondContact O-CG 3.42Å; I489-L493 PolarHBondContact O-N 3.48Å; L490-L493 HydrophobicContact CD2-CD1 4.33Å; L490-L493 PolarHBondContact O-N 2.92Å; L493-Q495 VanDerWaalsContact C-N 3.28Å; L493-Q495 PolarHBondContact O-N 3.12Å; L493-H496 CarbonylContact O-C 3.36Å; L493-H496 PolarHBondContact O-N 3.17Å; L493-T497 PolarHBondContact O-N 2.86Å; L493-L500 HydrophobicContact CD2-CD1 3.61Å; L493-V509 HydrophobicContact CD1-CG1 3.87Å; L493-V509 HydrophobicContact CD2-CG1 3.71Å; L493-V509 HydrophobicContact CG-CG1 4.49Å; L493-V513 HydrophobicContact CD1-CG2 4.49Å
494	H	98.4	Very high	97.8	Very high	33 Å²	33	51.3 Å²	51.3	15%	0.153	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-35.6	-177.2	-74.4	-52.9	0	0	0	112.4	L490 E492 H496 T497 D521	L490-H494 PolarHBondContact O-CD2 3.19Å; L490-H494 PolarHBondContact O-N 3.3Å; E492-H494 PolarHBondContact O-N 2.93Å; H494-H496 PolarHBondContact O-N 3.26Å; H494-T497 WeakPolarHBondContact CA-OG1 3.24Å; H494-T497 PolarHBondContact O-N 3.47Å; H494-T497 PolarHBondContact O-OG1 3.43Å; H494-D521 IonicContact CD2-OD1 2.72Å; H494-D521 PolarHBondContact CE1-O 3.2Å; H494-D521 IonicContact CE1-OD1 3.26Å; H494-D521 IonicContact NE2-OD1 2.73Å; H494-D521 PolarHBondContact NE2-OD1 2.89Å
495	Q	98.1	Very high	98	Very high	143 Å²	143	48.3 Å²	48.3	67%	0.668	23%	0.231	S	C	*	.	H	α-helix	trans	-61.9	-20.9	175.6	-70.8	167.6	57.8	0	0	113.8	E491 E492 L493	E491-Q495 WeakPolarHBondContact O-CG 3.23Å; E491-Q495 PolarHBondContact O-NE2 2.89Å; E492-Q495 PolarHBondContact O-N 2.95Å; L493-Q495 VanDerWaalsContact C-N 3.28Å; L493-Q495 PolarHBondContact O-N 3.12Å
496	H	98.3	Very high	98.1	Very high	52 Å²	52	47.9 Å²	47.9	24%	0.241	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	15.5	-175.5	-66.8	-74.7	0	0	0	113.6	F462 E492 L493 H494 E498 Q499 L500	F462-H496 HydrophobicContact CB-CB 4.4Å; F462-H496 HydrophobicContact CD2-CB 3.48Å; F462-H496 VanDerWaalsContact CD2-CB 3.48Å; F462-H496 AromaticContact CD2-CG 3.63Å; F462-H496 AromaticContact CD2-ND1 3.91Å; F462-H496 HydrophobicContact CE2-CB 4.1Å; F462-H496 HydrophobicContact CG-CB 4.2Å; F462-H496 AromaticContact CG-CG 3.85Å; F462-H496 AromaticContact CG-ND1 3.97Å; E492-H496 PolarHBondContact O-CD2 2.96Å; L493-H496 CarbonylContact O-C 3.36Å; L493-H496 PolarHBondContact O-N 3.17Å; H494-H496 PolarHBondContact O-N 3.26Å; H496-E498 PolarHBondContact O-N 3.28Å; H496-Q499 PolarHBondContact ND1-OE1 3.19Å; H496-Q499 PolarHBondContact O-N 2.84Å; H496-Q499 VanDerWaalsContact O-N 3.11Å; H496-L500 HydrophobicContact CB-CD1 3.96Å; H496-L500 HydrophobicContact CB-CG 4.14Å; H496-L500 WeakPolarHBondContact O-CG 3.31Å; H496-L500 PolarHBondContact O-N 3.04Å
497	T	98.4	Very high	98.1	Very high	3 Å²	3	47 Å²	47	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-51.1	-52	-173.3	-55.6	0	0	0	0	112.9	L493 H494 Q499 L500 V501 I525 E528	L493-T497 PolarHBondContact O-N 2.86Å; H494-T497 WeakPolarHBondContact CA-OG1 3.24Å; H494-T497 PolarHBondContact O-N 3.47Å; H494-T497 PolarHBondContact O-OG1 3.43Å; T497-Q499 PolarHBondContact O-N 2.93Å; T497-L500 PolarHBondContact O-N 3.31Å; T497-L500 VanDerWaalsContact O-N 3.12Å; T497-V501 HydrophobicContact CG2-CG1 4.12Å; T497-V501 WeakPolarHBondContact O-CG1 3.39Å; T497-V501 WeakPolarHBondContact O-CG2 3.41Å; T497-V501 PolarHBondContact O-N 3.26Å; T497-I525 HydrophobicContact CG2-CG1 4.31Å; T497-I525 HydrophobicContact CG2-CG2 4.36Å; T497-E528 HydrophobicContact CG2-CB 3.93Å; T497-E528 HydrophobicContact CG2-CG 4Å
498	E	97	Very high	98.3	Very high	121 Å²	121	50.4 Å²	50.4	57%	0.565	23%	0.233	S	C	*	.	H	α-helix	trans	-55.8	-37.8	-178.5	-170.2	-169.3	178.6	0	0	113	H496 V501 Q502	H496-E498 PolarHBondContact O-N 3.28Å; E498-V501 WeakPolarHBondContact O-CG2 3.32Å; E498-Q502 PolarHBondContact O-NE2 3.24Å
499	Q	98.5	Very high	98.4	Very high	103 Å²	103	48.6 Å²	48.6	48%	0.481	22%	0.222	S	C	.	.	H	α-helix	trans	-75.7	-44.8	178.3	-58.3	178.8	-62.4	0	0	110.6	F462 H496 T497 V501 Q502 D503	F462-Q499 HydrophobicContact CE2-CB 3.74Å; F462-Q499 HydrophobicContact CZ-CB 4.13Å; H496-Q499 PolarHBondContact ND1-OE1 3.19Å; H496-Q499 PolarHBondContact O-N 2.84Å; H496-Q499 VanDerWaalsContact O-N 3.11Å; T497-Q499 PolarHBondContact O-N 2.93Å; Q499-V501 PolarHBondContact O-N 3.26Å; Q499-Q502 PolarHBondContact O-N 3.5Å; Q499-D503 PolarHBondContact O-N 3.01Å; Q499-D503 VanDerWaalsContact O-N 3.09Å
500	L	98.8	Very high	98.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-36.4	-176.8	-70.7	171.8	0	0	0	112.9	F462 T466 L493 H496 T497 Q502 D503 G506 N507 I510	F462-L500 HydrophobicContact CD2-CD2 3.72Å; F462-L500 HydrophobicContact CD2-CG 3.95Å; F462-L500 HydrophobicContact CE2-CD2 3.91Å; F462-L500 HydrophobicContact CE2-CG 4.13Å; T466-L500 HydrophobicContact CG2-CD2 3.82Å; L493-L500 HydrophobicContact CD2-CD1 3.61Å; H496-L500 HydrophobicContact CB-CD1 3.96Å; H496-L500 HydrophobicContact CB-CG 4.14Å; H496-L500 WeakPolarHBondContact O-CG 3.31Å; H496-L500 PolarHBondContact O-N 3.04Å; T497-L500 PolarHBondContact O-N 3.31Å; T497-L500 VanDerWaalsContact O-N 3.12Å; L500-Q502 PolarHBondContact O-N 3.13Å; L500-D503 PolarHBondContact O-N 3.45Å; L500-G506 CarbonylContact O-C 3.32Å; L500-N507 WeakPolarHBondContact O-CA 3.25Å; L500-N507 PolarHBondContact O-N 3.44Å; L500-I510 HydrophobicContact CB-CD1 3.91Å; L500-I510 HydrophobicContact CB-CG1 3.74Å; L500-I510 HydrophobicContact CD1-CD1 4.05Å
501	V	98.7	Very high	98.4	Very high	2 Å²	2	49 Å²	49	1%	0.012	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.8	178.2	-62	0	0	0	0	113	T497 E498 Q499 I510 I529 L536 A542 V545	T497-V501 HydrophobicContact CG2-CG1 4.12Å; T497-V501 WeakPolarHBondContact O-CG1 3.39Å; T497-V501 WeakPolarHBondContact O-CG2 3.41Å; T497-V501 PolarHBondContact O-N 3.26Å; E498-V501 WeakPolarHBondContact O-CG2 3.32Å; Q499-V501 PolarHBondContact O-N 3.26Å; V501-I510 HydrophobicContact CG1-CB 4.05Å; V501-I510 HydrophobicContact CG1-CG1 3.89Å; V501-I510 HydrophobicContact CG1-CG2 3.71Å; V501-I529 HydrophobicContact CB-CD1 4.39Å; V501-I529 HydrophobicContact CG1-CD1 4.15Å; V501-I529 HydrophobicContact CG2-CD1 4.21Å; V501-L536 HydrophobicContact CG2-CD2 4.29Å; V501-A542 WeakPolarHBondContact O-CA 3.17Å; V501-A542 VanDerWaalsContact O-CB 3.24Å; V501-A542 WeakPolarHBondContact O-CB 3.46Å; V501-A542 PolarHBondContact O-N 3.18Å; V501-V545 HydrophobicContact CB-CB 4.35Å; V501-V545 HydrophobicContact CB-CG1 4.22Å; V501-V545 HydrophobicContact CB-CG2 4.02Å; V501-V545 HydrophobicContact CG1-CB 4.38Å; V501-V545 HydrophobicContact CG1-CG1 3.74Å; V501-V545 HydrophobicContact CG1-CG2 4.2Å
502	Q	98.6	Very high	98.5	Very high	74 Å²	74	44.1 Å²	44.1	35%	0.346	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-19.1	177.2	-65.7	175.9	92	0	0	113	E498 Q499 L500 L536 H539 F541 A542	E498-Q502 PolarHBondContact O-NE2 3.24Å; Q499-Q502 PolarHBondContact O-N 3.5Å; L500-Q502 PolarHBondContact O-N 3.13Å; Q502-L536 HydrophobicContact CG-CD2 3.98Å; Q502-H539 PolarHBondContact O-CE1 2.86Å; Q502-H539 VanDerWaalsContact O-CE1 3.24Å; Q502-F541 WeakPolarHBondContact O-CD2 3.38Å; Q502-A542 HydrophobicContact CG-CB 4.16Å
503	D	98.8	Very high	98.5	Very high	35 Å²	35	43 Å²	43	19%	0.187	20%	0.195	C	C	.	.	S	Bend	trans	-70.1	147.1	178.4	180	-108.8	0	0	0	113.3	T466 Q499 L500 Y505 G506 N507	T466-D503 WeakPolarHBondContact CA-OD1 3.3Å; T466-D503 HydrophobicContact CG2-CB 3.93Å; Q499-D503 PolarHBondContact O-N 3.01Å; Q499-D503 VanDerWaalsContact O-N 3.09Å; L500-D503 PolarHBondContact O-N 3.45Å; D503-Y505 VanDerWaalsContact C-N 3.25Å; D503-Y505 PolarHBondContact O-N 3.43Å; D503-Y505 WeakPolarHBondContact OD1-CA 3.24Å; D503-Y505 PolarHBondContact OD1-N 3.27Å; D503-G506 PolarHBondContact OD1-N 3.47Å; D503-N507 WeakPolarHBondContact O-CB 3.48Å; D503-N507 PolarHBondContact O-N 3.39Å; D503-N507 PolarHBondContact O-ND2 3.01Å
504	Q	98.6	Very high	98.6	Very high	93 Å²	93	42.9 Å²	42.9	44%	0.435	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.1	-178.2	73.5	-170.4	-55.7	0	0	114.4	N507 Y508 F541	Q504-N507 PolarHBondContact O-ND2 3.22Å; Q504-Y508 WeakPolarHBondContact O-CE2 3.46Å; Q504-F541 HydrophobicContact CB-CD1 4.4Å; Q504-F541 HydrophobicContact CB-CD2 4.24Å; Q504-F541 HydrophobicContact CB-CE1 3.86Å; Q504-F541 HydrophobicContact CB-CE2 3.68Å; Q504-F541 HydrophobicContact CB-CZ 3.46Å; Q504-F541 VanDerWaalsContact CB-CZ 3.46Å
505	Y	98.7	Very high	98.6	Very high	73 Å²	73	44.4 Å²	44.4	29%	0.286	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-41.3	175.9	-56.8	-61.4	0	0	0	111.8	S465 T466 P468 D503 N507 Y508	S465-Y505 CarbonylContact O-C 3.16Å; T466-Y505 WeakPolarHBondContact O-CD2 3.4Å; P468-Y505 HydrophobicContact CB-CD1 4.46Å; P468-Y505 HydrophobicContact CB-CE1 3.9Å; P468-Y505 HydrophobicContact CB-CE2 3.95Å; P468-Y505 HydrophobicContact CG-CE2 4.29Å; D503-Y505 VanDerWaalsContact C-N 3.25Å; D503-Y505 PolarHBondContact O-N 3.43Å; D503-Y505 WeakPolarHBondContact OD1-CA 3.24Å; D503-Y505 PolarHBondContact OD1-N 3.27Å; Y505-N507 PolarHBondContact O-N 3.15Å; Y505-Y508 WeakPolarHBondContact O-CB 3.34Å; Y505-Y508 PolarHBondContact O-N 2.93Å
506	G	98.8	Very high	98.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-32.9	-179.9	0	0	0	0	0	113.3	S465 L500 D503 Y508 V509 I510	S465-G506 WeakPolarHBondContact O-CA 3.38Å; S465-G506 PolarHBondContact O-N 3.42Å; L500-G506 CarbonylContact O-C 3.32Å; D503-G506 PolarHBondContact OD1-N 3.47Å; G506-Y508 PolarHBondContact O-N 3.41Å; G506-Y508 VanDerWaalsContact O-N 3.17Å; G506-V509 WeakPolarHBondContact O-CB 3.4Å; G506-V509 PolarHBondContact O-N 3.11Å; G506-I510 PolarHBondContact O-N 3.01Å; G506-I510 VanDerWaalsContact O-N 3.1Å
507	N	98.8	Very high	98.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-32.4	177.4	77.4	90.1	0	0	0	112	L500 D503 Q504 Y505 I510 Q511 F541 V545	L500-N507 WeakPolarHBondContact O-CA 3.25Å; L500-N507 PolarHBondContact O-N 3.44Å; D503-N507 WeakPolarHBondContact O-CB 3.48Å; D503-N507 PolarHBondContact O-N 3.39Å; D503-N507 PolarHBondContact O-ND2 3.01Å; Q504-N507 PolarHBondContact O-ND2 3.22Å; Y505-N507 PolarHBondContact O-N 3.15Å; N507-I510 PolarHBondContact O-N 3.24Å; N507-Q511 WeakPolarHBondContact O-CB 3.18Å; N507-Q511 WeakPolarHBondContact O-CG 3.19Å; N507-Q511 PolarHBondContact O-N 3.34Å; N507-Q511 PolarHBondContact O-NE2 3.42Å; N507-Q511 PolarHBondContact OD1-NE2 3.44Å; N507-F541 HydrophobicContact CB-CB 4.23Å; N507-V545 HydrophobicContact CB-CG2 3.93Å
508	Y	98.9	Very high	98.3	Very high	129 Å²	129	46.8 Å²	46.8	51%	0.506	22%	0.216	S	C	.	.	H	α-helix	trans	-71	-33.7	176.4	-65.9	-72.7	0	0	0	112.3	Q504 Y505 G506 H512	Q504-Y508 WeakPolarHBondContact O-CE2 3.46Å; Y505-Y508 WeakPolarHBondContact O-CB 3.34Å; Y505-Y508 PolarHBondContact O-N 2.93Å; G506-Y508 PolarHBondContact O-N 3.41Å; G506-Y508 VanDerWaalsContact O-N 3.17Å; Y508-H512 WeakPolarHBondContact O-CB 3.39Å; Y508-H512 PolarHBondContact O-N 2.93Å
509	V	98.8	Very high	98.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-44.6	174.7	-177	0	0	0	0	110.4	C471 I474 L478 L493 G506 H512 V513	C471-V509 HydrophobicContact CB-CG2 3.84Å; I474-V509 HydrophobicContact CG2-CG1 3.57Å; I474-V509 HydrophobicContact CG2-CG2 4.35Å; L478-V509 HydrophobicContact CD1-CG1 4.4Å; L493-V509 HydrophobicContact CD1-CG1 3.87Å; L493-V509 HydrophobicContact CD2-CG1 3.71Å; L493-V509 HydrophobicContact CG-CG1 4.49Å; G506-V509 WeakPolarHBondContact O-CB 3.4Å; G506-V509 PolarHBondContact O-N 3.11Å; V509-H512 WeakPolarHBondContact O-CB 3.5Å; V509-H512 PolarHBondContact O-N 3.49Å; V509-V513 PolarHBondContact O-N 2.9Å; V509-V513 VanDerWaalsContact O-N 3.13Å
510	I	98.8	Very high	98.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-41.5	177.2	-54.6	-60.5	0	0	0	111.5	L500 V501 G506 N507 H512 V513 L514 I525 V545	L500-I510 HydrophobicContact CB-CD1 3.91Å; L500-I510 HydrophobicContact CB-CG1 3.74Å; L500-I510 HydrophobicContact CD1-CD1 4.05Å; V501-I510 HydrophobicContact CG1-CB 4.05Å; V501-I510 HydrophobicContact CG1-CG1 3.89Å; V501-I510 HydrophobicContact CG1-CG2 3.71Å; G506-I510 PolarHBondContact O-N 3.01Å; G506-I510 VanDerWaalsContact O-N 3.1Å; N507-I510 PolarHBondContact O-N 3.24Å; I510-H512 VanDerWaalsContact C-N 3.28Å; I510-H512 PolarHBondContact O-N 3.38Å; I510-V513 PolarHBondContact O-N 3.45Å; I510-L514 HydrophobicContact CG2-CD1 4.27Å; I510-L514 WeakPolarHBondContact O-CG 3.21Å; I510-L514 PolarHBondContact O-N 2.9Å; I510-I525 HydrophobicContact CG2-CB 4.49Å; I510-I525 HydrophobicContact CG2-CD1 3.92Å; I510-I525 HydrophobicContact CG2-CG1 4.11Å; I510-I525 HydrophobicContact CG2-CG2 3.54Å; I510-V545 HydrophobicContact CG2-CG1 3.92Å
511	Q	98.8	Very high	98.3	Very high	20 Å²	20	44.4 Å²	44.4	9%	0.093	22%	0.218	C	C	.	.	H	α-helix	trans	-58.7	-39.9	172.6	-73.5	-178.6	78.8	0	0	111.9	N507 V513 L514 E515 V545 K548	N507-Q511 WeakPolarHBondContact O-CB 3.18Å; N507-Q511 WeakPolarHBondContact O-CG 3.19Å; N507-Q511 PolarHBondContact O-N 3.34Å; N507-Q511 PolarHBondContact O-NE2 3.42Å; N507-Q511 PolarHBondContact OD1-NE2 3.44Å; Q511-V513 PolarHBondContact O-N 2.95Å; Q511-L514 WeakPolarHBondContact O-CB 3.32Å; Q511-L514 PolarHBondContact O-N 3.41Å; Q511-E515 WeakPolarHBondContact O-CG 3.37Å; Q511-E515 PolarHBondContact O-N 3.17Å; Q511-V545 HydrophobicContact CG-CG2 4.14Å; Q511-K548 HydrophobicContact CB-CG 3.99Å; Q511-K548 HydrophobicContact CG-CB 4.38Å; Q511-K548 HydrophobicContact CG-CG 3.61Å; Q511-K548 VanDerWaalsContact OE1-CE 3.22Å
512	H	98.8	Very high	98.3	Very high	12 Å²	12	45.7 Å²	45.7	6%	0.056	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-44.1	177	-176.8	88.7	0	0	0	112.1	Q475 E479 Y508 V509 I510 L514 E515 H516	Q475-H512 HydrophobicContact CG-CB 3.99Å; E479-H512 WeakPolarHBondContact CG-CE1 3.42Å; E479-H512 IonicContact OE1-CE1 2.69Å; E479-H512 PolarHBondContact OE1-CE1 2.84Å; E479-H512 IonicContact OE1-ND1 3.56Å; E479-H512 PolarHBondContact OE1-ND1 3.45Å; E479-H512 IonicContact OE1-NE2 2.74Å; Y508-H512 WeakPolarHBondContact O-CB 3.39Å; Y508-H512 PolarHBondContact O-N 2.93Å; V509-H512 WeakPolarHBondContact O-CB 3.5Å; V509-H512 PolarHBondContact O-N 3.49Å; I510-H512 VanDerWaalsContact C-N 3.28Å; I510-H512 PolarHBondContact O-N 3.38Å; H512-L514 VanDerWaalsContact C-N 3.35Å; H512-E515 PolarHBondContact O-N 2.9Å; H512-H516 AromaticContact CE1-CE1 3.99Å; H512-H516 AromaticContact CE1-CG 3.89Å; H512-H516 AromaticContact CE1-ND1 3.23Å; H512-H516 PolarHBondContact CE1-ND1 2.84Å; H512-H516 AromaticContact CG-ND1 3.92Å; H512-H516 AromaticContact ND1-CE1 3.98Å; H512-H516 AromaticContact ND1-ND1 3.39Å; H512-H516 PolarHBondContact ND1-ND1 3.39Å; H512-H516 AromaticContact NE2-ND1 3.69Å; H512-H516 PolarHBondContact O-N 2.96Å; H512-H516 PolarHBondContact O-ND1 3.23Å
513	V	98.7	Very high	98.3	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.03	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-39.2	174.6	-179.7	0	0	0	0	111.3	L478 L490 L493 V509 I510 Q511 E515 G517 D521 K522 I525	L478-V513 HydrophobicContact CD1-CG2 3.86Å; L490-V513 HydrophobicContact CD2-CG1 4.21Å; L490-V513 HydrophobicContact CD2-CG2 3.92Å; L493-V513 HydrophobicContact CD1-CG2 4.49Å; V509-V513 PolarHBondContact O-N 2.9Å; V509-V513 VanDerWaalsContact O-N 3.13Å; I510-V513 PolarHBondContact O-N 3.45Å; Q511-V513 PolarHBondContact O-N 2.95Å; V513-E515 VanDerWaalsContact C-N 3.32Å; V513-E515 PolarHBondContact O-N 3.08Å; V513-G517 VanDerWaalsContact O-CA 3.26Å; V513-G517 WeakPolarHBondContact O-CA 3.23Å; V513-G517 PolarHBondContact O-N 2.81Å; V513-D521 HydrophobicContact CG1-CB 3.82Å; V513-K522 WeakPolarHBondContact O-CE 3.32Å; V513-I525 HydrophobicContact CB-CD1 3.81Å; V513-I525 HydrophobicContact CG1-CD1 3.52Å
514	L	98.7	Very high	98.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-34.7	174.9	-72.3	168.2	0	0	0	112.8	I510 Q511 H512 K522 I525 V526 V545 K548 C549 H552	I510-L514 HydrophobicContact CG2-CD1 4.27Å; I510-L514 WeakPolarHBondContact O-CG 3.21Å; I510-L514 PolarHBondContact O-N 2.9Å; Q511-L514 WeakPolarHBondContact O-CB 3.32Å; Q511-L514 PolarHBondContact O-N 3.41Å; H512-L514 VanDerWaalsContact C-N 3.35Å; L514-K522 HydrophobicContact CD2-CB 4.3Å; L514-K522 VanDerWaalsContact O-CD 3.28Å; L514-K522 WeakPolarHBondContact O-CD 3.42Å; L514-K522 WeakPolarHBondContact O-CE 3.47Å; L514-K522 PolarHBondContact O-NZ 3.37Å; L514-I525 HydrophobicContact CD1-CG2 4.06Å; L514-I525 HydrophobicContact CD2-CB 4.15Å; L514-I525 HydrophobicContact CD2-CD1 4.35Å; L514-I525 HydrophobicContact CD2-CG2 3.86Å; L514-I525 HydrophobicContact CG-CD1 4.26Å; L514-I525 HydrophobicContact CG-CG2 4.09Å; L514-V526 HydrophobicContact CD2-CG2 4.4Å; L514-V545 HydrophobicContact CD1-CG1 3.73Å; L514-K548 HydrophobicContact CB-CB 4.05Å; L514-K548 HydrophobicContact CD1-CB 3.72Å; L514-C549 VanDerWaalsContact CD1-SG 3.52Å; L514-H552 WeakPolarHBondContact O-CB 3.36Å
515	E	98.4	Very high	98.3	Very high	66 Å²	66	42.6 Å²	42.6	31%	0.308	21%	0.211	S	C	.	.	H	α-helix	trans	-77.2	-56.8	176.9	-71.8	180	152.4	0	0	111.8	Q511 H512 V513 K522 K548	Q511-E515 WeakPolarHBondContact O-CG 3.37Å; Q511-E515 PolarHBondContact O-N 3.17Å; H512-E515 PolarHBondContact O-N 2.9Å; V513-E515 VanDerWaalsContact C-N 3.32Å; V513-E515 PolarHBondContact O-N 3.08Å; E515-K522 PolarHBondContact O-NZ 3.22Å; E515-K548 HydrophobicContact CG-CD 4.29Å; E515-K548 WeakPolarHBondContact OE1-CE 3.48Å; E515-K548 IonicContact OE1-NZ 2.65Å; E515-K548 PolarHBondContact OE1-NZ 3.03Å
516	H	97	Very high	98.3	Very high	127 Å²	127	39.5 Å²	39.5	59%	0.588	20%	0.199	S	C	*	.	H	α-helix	trans	-107.7	-16.6	-164.1	-50	99.9	0	0	0	114.8	H512	H512-H516 AromaticContact CE1-CE1 3.99Å; H512-H516 AromaticContact CE1-CG 3.89Å; H512-H516 AromaticContact CE1-ND1 3.23Å; H512-H516 PolarHBondContact CE1-ND1 2.84Å; H512-H516 AromaticContact CG-ND1 3.92Å; H512-H516 AromaticContact ND1-CE1 3.98Å; H512-H516 AromaticContact ND1-ND1 3.39Å; H512-H516 PolarHBondContact ND1-ND1 3.39Å; H512-H516 AromaticContact NE2-ND1 3.69Å; H512-H516 PolarHBondContact O-N 2.96Å; H512-H516 PolarHBondContact O-ND1 3.23Å
517	G	95.9	Very high	98.2	Very high	28 Å²	28	42.4 Å²	42.4	29%	0.289	22%	0.224	S	C	.	.	S	Bend	trans	-71.1	177.1	-175.9	0	0	0	0	0	115.1	V513 K522	V513-G517 VanDerWaalsContact O-CA 3.26Å; V513-G517 WeakPolarHBondContact O-CA 3.23Å; V513-G517 PolarHBondContact O-N 2.81Å; G517-K522 WeakPolarHBondContact O-CE 3.12Å
518	R	96.6	Very high	98.2	Very high	93 Å²	93	47.8 Å²	47.8	35%	0.351	25%	0.249	S	C	.	.			trans	-73.1	153.1	176.8	-58.3	173.1	-63.2	167.7	-5.6	111	E520 D521 K522	R518-E520 VanDerWaalsContact C-N 3.25Å; R518-E520 HydrophobicContact CB-CG 3.92Å; R518-E520 VanDerWaalsContact CD-OE1 3.31Å; R518-E520 WeakPolarHBondContact CD-OE1 3.44Å; R518-E520 IonicContact CZ-OE1 2.69Å; R518-E520 IonicContact NE-OE1 3.23Å; R518-E520 PolarHBondContact NE-OE1 3.09Å; R518-E520 VanDerWaalsContact NH1-CD 3.34Å; R518-E520 IonicContact NH1-OE1 2.75Å; R518-E520 PolarHBondContact NH1-OE1 3.21Å; R518-E520 IonicContact NH1-OE2 3.21Å; R518-E520 IonicContact NH2-OE1 2.78Å; R518-E520 PolarHBondContact O-N 3.37Å; R518-D521 IonicContact CZ-OD2 3.66Å; R518-D521 IonicContact NE-OD2 3.08Å; R518-D521 PolarHBondContact NE-OD2 3.07Å; R518-D521 IonicContact NH2-OD1 3.09Å; R518-D521 PolarHBondContact NH2-OD1 3.27Å; R518-D521 IonicContact NH2-OD2 2.68Å; R518-D521 PolarHBondContact NH2-OD2 2.99Å; R518-D521 PolarHBondContact O-N 3.29Å; R518-K522 WeakPolarHBondContact O-CG 3.4Å; R518-K522 PolarHBondContact O-N 2.91Å; R518-K522 VanDerWaalsContact O-N 3.14Å
519	A	97.8	Very high	98.1	Very high	73 Å²	73	41.7 Å²	41.7	60%	0.603	23%	0.225	S	C	*	.	H	α-helix	trans	-54.4	-40.6	179.7	0	0	0	0	0	113	D521 K522 S523	A519-D521 VanDerWaalsContact C-N 3.34Å; A519-D521 PolarHBondContact O-N 2.8Å; A519-K522 PolarHBondContact O-N 3.26Å; A519-S523 PolarHBondContact O-N 3.25Å; A519-S523 PolarHBondContact O-OG 3.18Å
520	E	97.7	Very high	98	Very high	99 Å²	99	48.8 Å²	48.8	46%	0.463	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-38.7	176.7	63.5	-168.2	131.1	0	0	113.7	R518 S523 K524	R518-E520 VanDerWaalsContact C-N 3.25Å; R518-E520 HydrophobicContact CB-CG 3.92Å; R518-E520 VanDerWaalsContact CD-OE1 3.31Å; R518-E520 WeakPolarHBondContact CD-OE1 3.44Å; R518-E520 IonicContact CZ-OE1 2.69Å; R518-E520 IonicContact NE-OE1 3.23Å; R518-E520 PolarHBondContact NE-OE1 3.09Å; R518-E520 VanDerWaalsContact NH1-CD 3.34Å; R518-E520 IonicContact NH1-OE1 2.75Å; R518-E520 PolarHBondContact NH1-OE1 3.21Å; R518-E520 IonicContact NH1-OE2 3.21Å; R518-E520 IonicContact NH2-OE1 2.78Å; R518-E520 PolarHBondContact O-N 3.37Å; E520-S523 PolarHBondContact O-N 3.24Å; E520-K524 WeakPolarHBondContact O-CG 3.4Å; E520-K524 PolarHBondContact O-N 3.17Å; E520-K524 VanDerWaalsContact O-N 3.13Å
521	D	98.3	Very high	97.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-74	-35.9	178.8	-62.3	-54.1	0	0	0	110.8	H494 V513 R518 A519 K524 I525	H494-D521 IonicContact CD2-OD1 2.72Å; H494-D521 PolarHBondContact CE1-O 3.2Å; H494-D521 IonicContact CE1-OD1 3.26Å; H494-D521 IonicContact NE2-OD1 2.73Å; H494-D521 PolarHBondContact NE2-OD1 2.89Å; V513-D521 HydrophobicContact CG1-CB 3.82Å; R518-D521 IonicContact CZ-OD2 3.66Å; R518-D521 IonicContact NE-OD2 3.08Å; R518-D521 PolarHBondContact NE-OD2 3.07Å; R518-D521 IonicContact NH2-OD1 3.09Å; R518-D521 PolarHBondContact NH2-OD1 3.27Å; R518-D521 IonicContact NH2-OD2 2.68Å; R518-D521 PolarHBondContact NH2-OD2 2.99Å; R518-D521 PolarHBondContact O-N 3.29Å; A519-D521 VanDerWaalsContact C-N 3.34Å; A519-D521 PolarHBondContact O-N 2.8Å; D521-K524 PolarHBondContact O-N 3.3Å; D521-K524 IonicContact OD1-NZ 2.72Å; D521-I525 WeakPolarHBondContact O-CD1 3.46Å; D521-I525 WeakPolarHBondContact O-CG1 3.49Å; D521-I525 PolarHBondContact O-N 3.43Å
522	K	98.5	Very high	97.7	Very high	29 Å²	29	54 Å²	54	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-63.9	-43.5	172.2	-56.5	-174.3	-167.5	-157.4	0	111.4	V513 L514 E515 G517 R518 A519 K524 I525 V526	V513-K522 WeakPolarHBondContact O-CE 3.32Å; L514-K522 HydrophobicContact CD2-CB 4.3Å; L514-K522 VanDerWaalsContact O-CD 3.28Å; L514-K522 WeakPolarHBondContact O-CD 3.42Å; L514-K522 WeakPolarHBondContact O-CE 3.47Å; L514-K522 PolarHBondContact O-NZ 3.37Å; E515-K522 PolarHBondContact O-NZ 3.22Å; G517-K522 WeakPolarHBondContact O-CE 3.12Å; R518-K522 WeakPolarHBondContact O-CG 3.4Å; R518-K522 PolarHBondContact O-N 2.91Å; R518-K522 VanDerWaalsContact O-N 3.14Å; A519-K522 PolarHBondContact O-N 3.26Å; K522-K524 PolarHBondContact O-N 3.44Å; K522-I525 PolarHBondContact O-N 3.42Å; K522-V526 WeakPolarHBondContact O-CB 3.17Å; K522-V526 VanDerWaalsContact O-CG2 3.25Å; K522-V526 WeakPolarHBondContact O-CG2 3.33Å; K522-V526 PolarHBondContact O-N 3.36Å
523	S	98.6	Very high	97.7	Very high	44 Å²	44	53.5 Å²	53.5	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-40.3	177.9	-69.4	0	0	0	0	112.7	A519 E520 V526 A527 E557	A519-S523 PolarHBondContact O-N 3.25Å; A519-S523 PolarHBondContact O-OG 3.18Å; E520-S523 PolarHBondContact O-N 3.24Å; S523-V526 PolarHBondContact O-N 3.4Å; S523-A527 WeakPolarHBondContact O-CB 3.46Å; S523-A527 PolarHBondContact O-N 3.32Å; S523-E557 VanDerWaalsContact CA-OE1 3.29Å; S523-E557 WeakPolarHBondContact CA-OE1 3.41Å; S523-E557 WeakPolarHBondContact CB-OE1 3.42Å; S523-E557 PolarHBondContact OG-OE1 3.4Å
524	K	98.4	Very high	97.6	Very high	93 Å²	93	53.4 Å²	53.4	40%	0.404	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-52.4	172.4	-71.7	169	-174.6	170.9	0	111.2	E520 D521 K522 V526 A527 E528	E520-K524 WeakPolarHBondContact O-CG 3.4Å; E520-K524 PolarHBondContact O-N 3.17Å; E520-K524 VanDerWaalsContact O-N 3.13Å; D521-K524 PolarHBondContact O-N 3.3Å; D521-K524 IonicContact OD1-NZ 2.72Å; K522-K524 PolarHBondContact O-N 3.44Å; K524-V526 VanDerWaalsContact C-N 3.31Å; K524-V526 PolarHBondContact O-N 2.99Å; K524-A527 WeakPolarHBondContact O-CB 3.32Å; K524-A527 PolarHBondContact O-N 3.37Å; K524-A527 VanDerWaalsContact O-N 3.11Å; K524-E528 PolarHBondContact O-N 3.38Å
525	I	98.7	Very high	97.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-44.3	178.2	-66.1	158.4	0	0	0	111.1	T497 I510 V513 L514 D521 K522 A527 E528 I529	T497-I525 HydrophobicContact CG2-CG1 4.31Å; T497-I525 HydrophobicContact CG2-CG2 4.36Å; I510-I525 HydrophobicContact CG2-CB 4.49Å; I510-I525 HydrophobicContact CG2-CD1 3.92Å; I510-I525 HydrophobicContact CG2-CG1 4.11Å; I510-I525 HydrophobicContact CG2-CG2 3.54Å; V513-I525 HydrophobicContact CB-CD1 3.81Å; V513-I525 HydrophobicContact CG1-CD1 3.52Å; L514-I525 HydrophobicContact CD1-CG2 4.06Å; L514-I525 HydrophobicContact CD2-CB 4.15Å; L514-I525 HydrophobicContact CD2-CD1 4.35Å; L514-I525 HydrophobicContact CD2-CG2 3.86Å; L514-I525 HydrophobicContact CG-CD1 4.26Å; L514-I525 HydrophobicContact CG-CG2 4.09Å; D521-I525 WeakPolarHBondContact O-CD1 3.46Å; D521-I525 WeakPolarHBondContact O-CG1 3.49Å; D521-I525 PolarHBondContact O-N 3.43Å; K522-I525 PolarHBondContact O-N 3.42Å; I525-A527 VanDerWaalsContact C-N 3.3Å; I525-A527 PolarHBondContact O-N 3.24Å; I525-E528 PolarHBondContact O-N 2.98Å; I525-I529 HydrophobicContact CG2-CG1 4.48Å; I525-I529 VanDerWaalsContact O-CG1 3.32Å; I525-I529 WeakPolarHBondContact O-CG1 3.41Å; I525-I529 PolarHBondContact O-N 3.08Å
526	V	98.6	Very high	97.6	Very high	7 Å²	7	52 Å²	52	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-32	179.8	173.2	0	0	0	0	112.4	L514 K522 S523 K524 I529 R530 C549 A553 E557 L561	L514-V526 HydrophobicContact CD2-CG2 4.4Å; K522-V526 WeakPolarHBondContact O-CB 3.17Å; K522-V526 VanDerWaalsContact O-CG2 3.25Å; K522-V526 WeakPolarHBondContact O-CG2 3.33Å; K522-V526 PolarHBondContact O-N 3.36Å; S523-V526 PolarHBondContact O-N 3.4Å; K524-V526 VanDerWaalsContact C-N 3.31Å; K524-V526 PolarHBondContact O-N 2.99Å; V526-I529 PolarHBondContact O-N 3.26Å; V526-R530 PolarHBondContact O-N 3.21Å; V526-R530 VanDerWaalsContact O-N 3.14Å; V526-C549 HydrophobicContact CG2-CB 4.12Å; V526-A553 HydrophobicContact CG2-CB 3.79Å; V526-E557 HydrophobicContact CG1-CB 3.97Å; V526-E557 HydrophobicContact CG1-CG 4.3Å; V526-L561 HydrophobicContact CG1-CD1 3.93Å; V526-L561 HydrophobicContact CG1-CD2 4.25Å; V526-L561 HydrophobicContact CG1-CG 4.22Å
527	A	98.1	Very high	97.6	Very high	62 Å²	62	45.9 Å²	45.9	51%	0.512	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-40.3	173.8	0	0	0	0	0	112.1	S523 K524 I525 R530	S523-A527 WeakPolarHBondContact O-CB 3.46Å; S523-A527 PolarHBondContact O-N 3.32Å; K524-A527 WeakPolarHBondContact O-CB 3.32Å; K524-A527 PolarHBondContact O-N 3.37Å; K524-A527 VanDerWaalsContact O-N 3.11Å; I525-A527 VanDerWaalsContact C-N 3.3Å; I525-A527 PolarHBondContact O-N 3.24Å; A527-R530 PolarHBondContact O-N 3.36Å
528	E	97.8	Very high	97.7	Very high	112 Å²	112	47.9 Å²	47.9	52%	0.523	27%	0.268	S	S	.	.	H	α-helix	trans	-69.8	-28.8	176.6	-60.3	-59.7	138.9	0	0	113.3	T497 K524 I525	T497-E528 HydrophobicContact CG2-CB 3.93Å; T497-E528 HydrophobicContact CG2-CG 4Å; K524-E528 PolarHBondContact O-N 3.38Å; I525-E528 PolarHBondContact O-N 2.98Å
529	I	97.6	Very high	97.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-77.8	-28.2	176.8	-62	-67.1	0	0	0	111.8	V501 I525 V526 N532 V533 L536 V545 V546 L561	V501-I529 HydrophobicContact CB-CD1 4.39Å; V501-I529 HydrophobicContact CG1-CD1 4.15Å; V501-I529 HydrophobicContact CG2-CD1 4.21Å; I525-I529 HydrophobicContact CG2-CG1 4.48Å; I525-I529 VanDerWaalsContact O-CG1 3.32Å; I525-I529 WeakPolarHBondContact O-CG1 3.41Å; I525-I529 PolarHBondContact O-N 3.08Å; V526-I529 PolarHBondContact O-N 3.26Å; I529-N532 CarbonylContact O-C 3.45Å; I529-N532 PolarHBondContact O-N 2.89Å; I529-V533 HydrophobicContact CG2-CG2 4.24Å; I529-V533 PolarHBondContact O-N 3.32Å; I529-L536 HydrophobicContact CB-CD1 4.47Å; I529-L536 HydrophobicContact CD1-CD1 3.6Å; I529-L536 HydrophobicContact CG2-CD1 4.23Å; I529-V545 HydrophobicContact CD1-CG1 4.16Å; I529-V546 HydrophobicContact CG2-CG2 4.11Å; I529-L561 HydrophobicContact CG2-CD2 4.31Å
530	R	96.8	Very high	97.9	Very high	149 Å²	149	48.1 Å²	48.1	56%	0.562	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	136.8	-176.2	-175.3	-176.1	176	-159.6	-2.9	111.2	V526 A527 N532 L561	V526-R530 PolarHBondContact O-N 3.21Å; V526-R530 VanDerWaalsContact O-N 3.14Å; A527-R530 PolarHBondContact O-N 3.36Å; R530-N532 VanDerWaalsContact C-N 3.28Å; R530-L561 HydrophobicContact CB-CD2 4.26Å
531	G	95.1	Very high	97.9	Very high	64 Å²	64	46 Å²	46	66%	0.66	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.5	-10.5	-175.7	0	0	0	0	0	113.9	E564	G531-E564 VanDerWaalsContact C-OE1 3.32Å; G531-E564 VanDerWaalsContact CA-OE1 3.31Å; G531-E564 WeakPolarHBondContact CA-OE1 3.47Å; G531-E564 VanDerWaalsContact N-CD 3.26Å; G531-E564 PolarHBondContact N-OE1 3.33Å; G531-E564 VanDerWaalsContact N-OE1 3.12Å; G531-E564 PolarHBondContact N-OE2 2.78Å
532	N	96.6	Very high	97.9	Very high	69 Å²	69	45.9 Å²	45.9	37%	0.369	25%	0.248	S	C	.	.			trans	-131.2	25.9	175.5	-164.6	9.6	0	0	0	112	I529 R530 L534 G535 L536 E564	I529-N532 CarbonylContact O-C 3.45Å; I529-N532 PolarHBondContact O-N 2.89Å; R530-N532 VanDerWaalsContact C-N 3.28Å; N532-L534 PolarHBondContact O-N 3.5Å; N532-G535 PolarHBondContact O-N 2.89Å; N532-L536 HydrophobicContact CB-CD1 4.13Å; N532-L536 HydrophobicContact CB-CG 4.33Å; N532-L536 WeakPolarHBondContact O-CB 3.41Å; N532-L536 VanDerWaalsContact O-CG 3.31Å; N532-L536 WeakPolarHBondContact O-CG 3.42Å; N532-L536 PolarHBondContact O-N 3.27Å; N532-L536 VanDerWaalsContact O-N 3.08Å; N532-E564 PolarHBondContact N-OE1 3.43Å
533	V	97.9	Very high	98	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-36.9	-176.8	177	0	0	0	0	111	I529 S537 V546 L561 E564 V565 M592	I529-V533 HydrophobicContact CG2-CG2 4.24Å; I529-V533 PolarHBondContact O-N 3.32Å; V533-S537 WeakPolarHBondContact O-CB 3.39Å; V533-S537 PolarHBondContact O-N 3.21Å; V533-S537 PolarHBondContact O-OG 2.6Å; V533-V546 HydrophobicContact CG1-CG1 3.97Å; V533-L561 HydrophobicContact CG2-CB 4.45Å; V533-L561 HydrophobicContact CG2-CD2 3.63Å; V533-E564 VanDerWaalsContact CB-OE1 3.29Å; V533-E564 WeakPolarHBondContact CB-OE1 3.25Å; V533-E564 VanDerWaalsContact CG2-OE1 3.23Å; V533-E564 WeakPolarHBondContact CG2-OE1 3.49Å; V533-E564 PolarHBondContact N-OE1 3.2Å; V533-V565 HydrophobicContact CB-CG2 4.1Å; V533-V565 HydrophobicContact CG1-CG2 3.46Å; V533-V565 VanDerWaalsContact CG1-CG2 3.46Å; V533-M592 HydrophobicContact CG1-CE 3.92Å
534	L	96.9	Very high	98	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-55.4	179	176.6	54.7	0	0	0	112.7	N532 L536 S537 Q538 L568 E570 A575 T578 M579	N532-L534 PolarHBondContact O-N 3.5Å; L534-L536 PolarHBondContact O-N 2.81Å; L534-S537 PolarHBondContact O-N 2.99Å; L534-Q538 PolarHBondContact O-N 3.08Å; L534-L568 HydrophobicContact CB-CD2 4.22Å; L534-L568 HydrophobicContact CD2-CD2 4.06Å; L534-E570 HydrophobicContact CD2-CB 4.43Å; L534-E570 HydrophobicContact CD2-CG 3.52Å; L534-E570 WeakPolarHBondContact CD2-OE1 3.43Å; L534-E570 WeakPolarHBondContact CD2-OE2 3.17Å; L534-A575 HydrophobicContact CD1-CB 4.35Å; L534-A575 HydrophobicContact CD2-CB 3.73Å; L534-A575 HydrophobicContact CG-CB 4.47Å; L534-T578 HydrophobicContact CD1-CG2 4.3Å; L534-M579 HydrophobicContact CD1-CG 3.35Å; L534-M579 HydrophobicContact CD1-SD 3.91Å
535	G	97.1	Very high	98	Very high	31 Å²	31	41.1 Å²	41.1	32%	0.32	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-44.4	-178.4	0	0	0	0	0	112.1	N532 S537 Q538 H539	N532-G535 PolarHBondContact O-N 2.89Å; G535-S537 VanDerWaalsContact C-N 3.33Å; G535-S537 PolarHBondContact O-N 3.45Å; G535-Q538 PolarHBondContact O-N 2.98Å; G535-H539 PolarHBondContact O-N 3.29Å
536	L	98.6	Very high	98	Very high	5 Å²	5	41 Å²	41	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-66.6	-33.3	177.3	-63.8	171.7	0	0	0	112.6	V501 Q502 I529 N532 L534 Q538 H539 A542 S543 V546	V501-L536 HydrophobicContact CG2-CD2 4.29Å; Q502-L536 HydrophobicContact CG-CD2 3.98Å; I529-L536 HydrophobicContact CB-CD1 4.47Å; I529-L536 HydrophobicContact CD1-CD1 3.6Å; I529-L536 HydrophobicContact CG2-CD1 4.23Å; N532-L536 HydrophobicContact CB-CD1 4.13Å; N532-L536 HydrophobicContact CB-CG 4.33Å; N532-L536 WeakPolarHBondContact O-CB 3.41Å; N532-L536 VanDerWaalsContact O-CG 3.31Å; N532-L536 WeakPolarHBondContact O-CG 3.42Å; N532-L536 PolarHBondContact O-N 3.27Å; N532-L536 VanDerWaalsContact O-N 3.08Å; L534-L536 PolarHBondContact O-N 2.81Å; L536-Q538 VanDerWaalsContact C-N 3.3Å; L536-Q538 PolarHBondContact O-N 3.42Å; L536-H539 WeakPolarHBondContact O-CB 3.37Å; L536-H539 PolarHBondContact O-N 2.93Å; L536-H539 VanDerWaalsContact O-N 3.15Å; L536-A542 HydrophobicContact CB-CB 4.07Å; L536-A542 HydrophobicContact CD2-CB 3.85Å; L536-A542 CarbonylContact O-C 3.04Å; L536-S543 PolarHBondContact O-N 3Å; L536-S543 VanDerWaalsContact O-N 3.11Å; L536-V546 HydrophobicContact CB-CG2 3.84Å
537	S	98.6	Very high	98	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-29.5	175	-64.2	0	0	0	0	113.3	V533 L534 G535 S543 M579 Y584 A585	V533-S537 WeakPolarHBondContact O-CB 3.39Å; V533-S537 PolarHBondContact O-N 3.21Å; V533-S537 PolarHBondContact O-OG 2.6Å; L534-S537 PolarHBondContact O-N 2.99Å; G535-S537 VanDerWaalsContact C-N 3.33Å; G535-S537 PolarHBondContact O-N 3.45Å; S537-S543 VanDerWaalsContact O-CB 3.32Å; S537-S543 WeakPolarHBondContact O-CB 3.47Å; S537-M579 WeakPolarHBondContact OG-CE 3.26Å; S537-Y584 CarbonylContact O-C 3.39Å; S537-A585 WeakPolarHBondContact O-CA 3.5Å; S537-A585 WeakPolarHBondContact O-CB 3.26Å; S537-A585 PolarHBondContact O-N 3.16Å; S537-A585 VanDerWaalsContact O-N 3.08Å
538	Q	98.3	Very high	98	Very high	70 Å²	70	42.1 Å²	42.1	33%	0.327	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.9	174.9	-66.2	178	-49.4	0	0	112.9	L534 G535 L536 D582 Y584 A585	L534-Q538 PolarHBondContact O-N 3.08Å; G535-Q538 PolarHBondContact O-N 2.98Å; L536-Q538 VanDerWaalsContact C-N 3.3Å; L536-Q538 PolarHBondContact O-N 3.42Å; Q538-D582 HydrophobicContact CG-CB 4.34Å; Q538-Y584 WeakPolarHBondContact O-CD2 3.43Å; Q538-A585 HydrophobicContact CG-CB 4.25Å
539	H	98.7	Very high	98.1	Very high	61 Å²	61	36.8 Å²	36.8	28%	0.282	19%	0.193	S	C	.	.	S	Bend	trans	-91.9	133.8	179.8	-166.9	-113.9	0	0	0	112	Q502 G535 L536 F541 A542 S543	Q502-H539 PolarHBondContact O-CE1 2.86Å; Q502-H539 VanDerWaalsContact O-CE1 3.24Å; G535-H539 PolarHBondContact O-N 3.29Å; L536-H539 WeakPolarHBondContact O-CB 3.37Å; L536-H539 PolarHBondContact O-N 2.93Å; L536-H539 VanDerWaalsContact O-N 3.15Å; H539-F541 AromaticContact CE1-CD2 3.84Å; H539-F541 PolarHBondContact O-N 2.92Å; H539-F541 VanDerWaalsContact O-N 3.12Å; H539-A542 HydrophobicContact CB-CB 4.02Å; H539-A542 PolarHBondContact O-N 3.11Å; H539-S543 VanDerWaalsContact O-CB 3.23Å; H539-S543 WeakPolarHBondContact O-CB 3.35Å; H539-S543 PolarHBondContact O-N 3.18Å; H539-S543 PolarHBondContact O-OG 3.41Å
540	K	98.4	Very high	98.1	Very high	109 Å²	109	36.8 Å²	36.8	47%	0.474	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-39.9	-175.2	-177.9	-177.6	-179.2	67.9	0	113.7	S543 N544 Y584	K540-S543 PolarHBondContact O-OG 3.43Å; K540-N544 PolarHBondContact O-ND2 3.36Å; K540-N544 VanDerWaalsContact O-ND2 3.12Å; K540-Y584 HydrophobicContact CB-CD2 4.35Å; K540-Y584 HydrophobicContact CB-CE1 4.1Å; K540-Y584 HydrophobicContact CB-CE2 3.79Å; K540-Y584 HydrophobicContact CG-CE1 3.88Å; K540-Y584 HydrophobicContact CG-CE2 4.4Å
541	F	98.7	Very high	98.2	Very high	54 Å²	54	32 Å²	32	24%	0.237	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-43.1	-176.9	-56.9	-60	0	0	0	112.2	Q502 Q504 N507 H539 S543 N544	Q502-F541 WeakPolarHBondContact O-CD2 3.38Å; Q504-F541 HydrophobicContact CB-CD1 4.4Å; Q504-F541 HydrophobicContact CB-CD2 4.24Å; Q504-F541 HydrophobicContact CB-CE1 3.86Å; Q504-F541 HydrophobicContact CB-CE2 3.68Å; Q504-F541 HydrophobicContact CB-CZ 3.46Å; Q504-F541 VanDerWaalsContact CB-CZ 3.46Å; N507-F541 HydrophobicContact CB-CB 4.23Å; H539-F541 AromaticContact CE1-CD2 3.84Å; H539-F541 PolarHBondContact O-N 2.92Å; H539-F541 VanDerWaalsContact O-N 3.12Å; F541-S543 VanDerWaalsContact C-N 3.33Å; F541-S543 PolarHBondContact O-N 3.16Å; F541-N544 PolarHBondContact O-N 2.62Å; F541-N544 PolarHBondContact O-ND2 3.02Å
542	A	98.8	Very high	98.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-73.2	-23.7	-174.8	0	0	0	0	0	113.2	V501 Q502 L536 H539 N544 V545 V546	V501-A542 WeakPolarHBondContact O-CA 3.17Å; V501-A542 VanDerWaalsContact O-CB 3.24Å; V501-A542 WeakPolarHBondContact O-CB 3.46Å; V501-A542 PolarHBondContact O-N 3.18Å; Q502-A542 HydrophobicContact CG-CB 4.16Å; L536-A542 HydrophobicContact CB-CB 4.07Å; L536-A542 HydrophobicContact CD2-CB 3.85Å; L536-A542 CarbonylContact O-C 3.04Å; H539-A542 HydrophobicContact CB-CB 4.02Å; H539-A542 PolarHBondContact O-N 3.11Å; A542-N544 PolarHBondContact O-N 3.44Å; A542-V545 CarbonylContact O-C 3.52Å; A542-V545 WeakPolarHBondContact O-CA 3.48Å; A542-V545 WeakPolarHBondContact O-CB 3.42Å; A542-V545 PolarHBondContact O-N 2.87Å; A542-V546 WeakPolarHBondContact O-CG2 3.44Å; A542-V546 PolarHBondContact O-N 3.1Å
543	S	98.8	Very high	98.4	Very high	5 Å²	5	29.1 Å²	29.1	4%	0.035	15%	0.148	C	C	.	.	H	α-helix	trans	-54.3	-39.4	172.8	57.1	0	0	0	0	112.6	L536 S537 H539 K540 F541 V545 V546 E547	L536-S543 PolarHBondContact O-N 3Å; L536-S543 VanDerWaalsContact O-N 3.11Å; S537-S543 VanDerWaalsContact O-CB 3.32Å; S537-S543 WeakPolarHBondContact O-CB 3.47Å; H539-S543 VanDerWaalsContact O-CB 3.23Å; H539-S543 WeakPolarHBondContact O-CB 3.35Å; H539-S543 PolarHBondContact O-N 3.18Å; H539-S543 PolarHBondContact O-OG 3.41Å; K540-S543 PolarHBondContact O-OG 3.43Å; F541-S543 VanDerWaalsContact C-N 3.33Å; F541-S543 PolarHBondContact O-N 3.16Å; S543-V545 VanDerWaalsContact C-N 3.35Å; S543-V545 PolarHBondContact O-N 3.3Å; S543-V546 PolarHBondContact O-N 2.98Å; S543-E547 PolarHBondContact O-N 3.2Å
544	N	98.8	Very high	98.4	Very high	60 Å²	60	31.9 Å²	31.9	32%	0.321	17%	0.167	S	C	.	.	H	α-helix	trans	-64.3	-38.9	174.5	-48.6	-85.9	0	0	0	111.7	K540 F541 A542 E547 K548	K540-N544 PolarHBondContact O-ND2 3.36Å; K540-N544 VanDerWaalsContact O-ND2 3.12Å; F541-N544 PolarHBondContact O-N 2.62Å; F541-N544 PolarHBondContact O-ND2 3.02Å; A542-N544 PolarHBondContact O-N 3.44Å; N544-E547 WeakPolarHBondContact O-CB 3.32Å; N544-E547 PolarHBondContact O-N 3.47Å; N544-K548 WeakPolarHBondContact O-CG 3.33Å; N544-K548 PolarHBondContact O-N 3.3Å
545	V	98.8	Very high	98.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65	-44.5	175	-173.9	0	0	0	0	110.4	V501 N507 I510 Q511 L514 I529 A542 S543 E547 K548 C549	V501-V545 HydrophobicContact CB-CB 4.35Å; V501-V545 HydrophobicContact CB-CG1 4.22Å; V501-V545 HydrophobicContact CB-CG2 4.02Å; V501-V545 HydrophobicContact CG1-CB 4.38Å; V501-V545 HydrophobicContact CG1-CG1 3.74Å; V501-V545 HydrophobicContact CG1-CG2 4.2Å; N507-V545 HydrophobicContact CB-CG2 3.93Å; I510-V545 HydrophobicContact CG2-CG1 3.92Å; Q511-V545 HydrophobicContact CG-CG2 4.14Å; L514-V545 HydrophobicContact CD1-CG1 3.73Å; I529-V545 HydrophobicContact CD1-CG1 4.16Å; A542-V545 CarbonylContact O-C 3.52Å; A542-V545 WeakPolarHBondContact O-CA 3.48Å; A542-V545 WeakPolarHBondContact O-CB 3.42Å; A542-V545 PolarHBondContact O-N 2.87Å; S543-V545 VanDerWaalsContact C-N 3.35Å; S543-V545 PolarHBondContact O-N 3.3Å; V545-E547 VanDerWaalsContact C-N 3.32Å; V545-E547 PolarHBondContact O-N 3.15Å; V545-K548 CarbonylContact O-C 3.12Å; V545-K548 PolarHBondContact O-N 2.95Å; V545-K548 VanDerWaalsContact O-N 3.08Å; V545-C549 PolarHBondContact O-N 3.07Å; V545-C549 PolarHBondContact O-SG 3.34Å; V545-C549 VanDerWaalsContact O-SG 3.36Å
546	V	98.8	Very high	98.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-41.9	175.5	-177	0	0	0	0	110.8	I529 V533 L536 A542 S543 K548 C549 V550 V588	I529-V546 HydrophobicContact CG2-CG2 4.11Å; V533-V546 HydrophobicContact CG1-CG1 3.97Å; L536-V546 HydrophobicContact CB-CG2 3.84Å; A542-V546 WeakPolarHBondContact O-CG2 3.44Å; A542-V546 PolarHBondContact O-N 3.1Å; S543-V546 PolarHBondContact O-N 2.98Å; V546-K548 VanDerWaalsContact C-N 3.35Å; V546-K548 PolarHBondContact O-N 3.17Å; V546-C549 WeakPolarHBondContact O-CB 3.4Å; V546-C549 PolarHBondContact O-N 3.28Å; V546-V550 PolarHBondContact O-N 3.32Å; V546-V588 HydrophobicContact CB-CG1 4.32Å; V546-V588 HydrophobicContact CB-CG2 4.33Å; V546-V588 HydrophobicContact CG1-CG1 3.58Å; V546-V588 HydrophobicContact CG1-CG2 4.45Å
547	E	98.8	Very high	98.4	Very high	37 Å²	37	42.9 Å²	42.9	17%	0.173	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-42.4	172.1	-77.6	-164.3	-114.9	0	0	112.6	S543 N544 V545 V550 T551 Y587 V588 K591	S543-E547 PolarHBondContact O-N 3.2Å; N544-E547 WeakPolarHBondContact O-CB 3.32Å; N544-E547 PolarHBondContact O-N 3.47Å; V545-E547 VanDerWaalsContact C-N 3.32Å; V545-E547 PolarHBondContact O-N 3.15Å; E547-V550 WeakPolarHBondContact O-CG2 3.28Å; E547-T551 WeakPolarHBondContact O-CB 3.46Å; E547-T551 PolarHBondContact O-N 3.26Å; E547-T551 VanDerWaalsContact O-N 3.11Å; E547-T551 PolarHBondContact O-OG1 3.4Å; E547-Y587 WeakPolarHBondContact OE1-CB 2.98Å; E547-V588 HydrophobicContact CG-CG2 4.12Å; E547-K591 HydrophobicContact CB-CG 4.21Å; E547-K591 HydrophobicContact CG-CB 3.9Å; E547-K591 HydrophobicContact CG-CG 4.14Å; E547-K591 WeakPolarHBondContact OE2-CE 3.49Å; E547-K591 IonicContact OE2-NZ 2.84Å
548	K	98.7	Very high	98.4	Very high	55 Å²	55	44.4 Å²	44.4	24%	0.239	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-39.5	174.7	-65.2	-54	178.2	170.5	0	112.1	Q511 L514 E515 N544 V545 V546 T551 H552	Q511-K548 HydrophobicContact CB-CG 3.99Å; Q511-K548 HydrophobicContact CG-CB 4.38Å; Q511-K548 HydrophobicContact CG-CG 3.61Å; Q511-K548 VanDerWaalsContact OE1-CE 3.22Å; L514-K548 HydrophobicContact CB-CB 4.05Å; L514-K548 HydrophobicContact CD1-CB 3.72Å; E515-K548 HydrophobicContact CG-CD 4.29Å; E515-K548 WeakPolarHBondContact OE1-CE 3.48Å; E515-K548 IonicContact OE1-NZ 2.65Å; E515-K548 PolarHBondContact OE1-NZ 3.03Å; N544-K548 WeakPolarHBondContact O-CG 3.33Å; N544-K548 PolarHBondContact O-N 3.3Å; V545-K548 CarbonylContact O-C 3.12Å; V545-K548 PolarHBondContact O-N 2.95Å; V545-K548 VanDerWaalsContact O-N 3.08Å; V546-K548 VanDerWaalsContact C-N 3.35Å; V546-K548 PolarHBondContact O-N 3.17Å; K548-T551 PolarHBondContact O-N 3.12Å; K548-T551 VanDerWaalsContact O-N 3.13Å; K548-H552 PolarHBondContact O-CD2 2.72Å; K548-H552 PolarHBondContact O-N 3.13Å
549	C	98.7	Very high	98.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.7	-54.2	174.7	-71.4	0	0	0	0	111.1	L514 V526 V545 V546 T551 H552 A553 L561	L514-C549 VanDerWaalsContact CD1-SG 3.52Å; V526-C549 HydrophobicContact CG2-CB 4.12Å; V545-C549 PolarHBondContact O-N 3.07Å; V545-C549 PolarHBondContact O-SG 3.34Å; V545-C549 VanDerWaalsContact O-SG 3.36Å; V546-C549 WeakPolarHBondContact O-CB 3.4Å; V546-C549 PolarHBondContact O-N 3.28Å; C549-T551 PolarHBondContact O-N 3.08Å; C549-T551 VanDerWaalsContact O-N 3.12Å; C549-H552 PolarHBondContact O-N 3.13Å; C549-A553 WeakPolarHBondContact O-CB 3.5Å; C549-A553 PolarHBondContact O-N 3.38Å; C549-L561 HydrophobicContact CB-CD1 3.79Å
550	V	98.2	Very high	98.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-14.8	178.9	-57.3	0	0	0	0	113.3	V546 E547 R558 L561 I562 K591 M592 V595	V546-V550 PolarHBondContact O-N 3.32Å; E547-V550 WeakPolarHBondContact O-CG2 3.28Å; V550-R558 HydrophobicContact CB-CG 4.47Å; V550-R558 VanDerWaalsContact O-CD 3.31Å; V550-R558 WeakPolarHBondContact O-CD 3.39Å; V550-R558 WeakPolarHBondContact O-CG 3.31Å; V550-R558 PolarHBondContact O-NH1 3.48Å; V550-L561 HydrophobicContact CG1-CB 4.13Å; V550-L561 HydrophobicContact CG1-CD1 4.04Å; V550-I562 HydrophobicContact CG1-CG1 4.45Å; V550-K591 HydrophobicContact CG2-CB 4.25Å; V550-K591 HydrophobicContact CG2-CG 3.6Å; V550-M592 HydrophobicContact CG1-CE 3.9Å; V550-M592 HydrophobicContact CG1-CG 4.25Å; V550-M592 HydrophobicContact CG2-CG 4.41Å; V550-V595 HydrophobicContact CB-CG2 4.03Å; V550-V595 HydrophobicContact CG2-CG2 4.08Å; V550-V595 WeakPolarHBondContact O-CG2 3.46Å
551	T	98.5	Very high	98.2	Very high	49 Å²	49	38.1 Å²	38.1	30%	0.301	20%	0.2	S	C	.	.	H	α-helix	trans	-87.6	-46.8	174.3	-55.4	0	0	0	0	112.5	E547 K548 C549 R558	E547-T551 WeakPolarHBondContact O-CB 3.46Å; E547-T551 PolarHBondContact O-N 3.26Å; E547-T551 VanDerWaalsContact O-N 3.11Å; E547-T551 PolarHBondContact O-OG1 3.4Å; K548-T551 PolarHBondContact O-N 3.12Å; K548-T551 VanDerWaalsContact O-N 3.13Å; C549-T551 PolarHBondContact O-N 3.08Å; C549-T551 VanDerWaalsContact O-N 3.12Å; T551-R558 VanDerWaalsContact C-NH1 3.29Å; T551-R558 PolarHBondContact O-NH1 2.9Å
552	H	98.2	Very high	98.2	Very high	66 Å²	66	35.6 Å²	35.6	31%	0.306	19%	0.189	S	C	.	.	H	α-helix	trans	-110.7	-7.7	-166.3	-59.4	-83.4	0	0	0	115.5	L514 K548 C549	L514-H552 WeakPolarHBondContact O-CB 3.36Å; K548-H552 PolarHBondContact O-CD2 2.72Å; K548-H552 PolarHBondContact O-N 3.13Å; C549-H552 PolarHBondContact O-N 3.13Å
553	A	97.1	Very high	98	Very high	6 Å²	6	38.5 Å²	38.5	5%	0.05	20%	0.204	C	C	.	.	S	Bend	trans	-64.5	168.8	170.4	0	0	0	0	0	112.1	V526 C549 E557 R558	V526-A553 HydrophobicContact CG2-CB 3.79Å; C549-A553 WeakPolarHBondContact O-CB 3.5Å; C549-A553 PolarHBondContact O-N 3.38Å; A553-E557 HydrophobicContact CB-CB 3.87Å; A553-R558 PolarHBondContact O-NH2 3.24Å
554	S	98.1	Very high	97.9	Very high	58 Å²	58	39.8 Å²	39.8	41%	0.406	21%	0.21	S	C	.	.			trans	-63.3	167.4	171.4	73	0	0	0	0	111.9	A556 E557 R558	S554-A556 VanDerWaalsContact C-N 3.31Å; S554-A556 PolarHBondContact O-N 2.78Å; S554-E557 WeakPolarHBondContact CA-OE2 3.26Å; S554-E557 WeakPolarHBondContact CB-OE2 3.39Å; S554-E557 PolarHBondContact N-OE2 3.47Å; S554-E557 WeakPolarHBondContact OG-CB 3.46Å; S554-E557 VanDerWaalsContact OG-CG 3.31Å; S554-E557 WeakPolarHBondContact OG-CG 3.32Å; S554-E557 PolarHBondContact OG-N 3.11Å; S554-E557 PolarHBondContact OG-OE2 3.13Å; S554-R558 VanDerWaalsContact O-CB 3.23Å; S554-R558 WeakPolarHBondContact O-CB 3.42Å; S554-R558 PolarHBondContact O-N 3.48Å; S554-R558 PolarHBondContact O-NH2 3.26Å
555	R	97.3	Very high	97.7	Very high	167 Å²	167	37 Å²	37	63%	0.63	20%	0.195	S	C	*	.	H	α-helix	trans	-59.6	-41	177.6	-65.6	178.4	65.9	178.9	-2.3	112.3	A559 E597	R555-A559 WeakPolarHBondContact O-CB 3.29Å; R555-A559 PolarHBondContact O-N 3.14Å; R555-A559 VanDerWaalsContact O-N 3.16Å; R555-E597 IonicContact CZ-OE1 2.7Å; R555-E597 VanDerWaalsContact CZ-OE1 3.23Å; R555-E597 IonicContact CZ-OE2 2.73Å; R555-E597 IonicContact NE-OE1 2.78Å; R555-E597 PolarHBondContact NE-OE1 2.88Å; R555-E597 IonicContact NH2-OE1 3.82Å; R555-E597 PolarHBondContact NH2-OE1 3.22Å; R555-E597 IonicContact NH2-OE2 2.96Å; R555-E597 PolarHBondContact NH2-OE2 2.84Å
556	A	97.8	Very high	97.4	Very high	68 Å²	68	37.1 Å²	37.1	56%	0.562	20%	0.196	S	C	*	.	H	α-helix	trans	-70.2	-46.5	179.9	0	0	0	0	0	112.2	S554 A559 L560	S554-A556 VanDerWaalsContact C-N 3.31Å; S554-A556 PolarHBondContact O-N 2.78Å; A556-A559 WeakPolarHBondContact O-CB 2.82Å; A556-A559 PolarHBondContact O-N 3.4Å; A556-L560 WeakPolarHBondContact O-CG 3.31Å; A556-L560 PolarHBondContact O-N 3.4Å
557	E	98.1	Very high	96.9	Very high	36 Å²	36	41.4 Å²	41.4	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-44.6	178.2	-72.3	160.8	147	0	0	112.4	S523 V526 A553 S554 A559 L560 L561	S523-E557 VanDerWaalsContact CA-OE1 3.29Å; S523-E557 WeakPolarHBondContact CA-OE1 3.41Å; S523-E557 WeakPolarHBondContact CB-OE1 3.42Å; S523-E557 PolarHBondContact OG-OE1 3.4Å; V526-E557 HydrophobicContact CG1-CB 3.97Å; V526-E557 HydrophobicContact CG1-CG 4.3Å; A553-E557 HydrophobicContact CB-CB 3.87Å; S554-E557 WeakPolarHBondContact CA-OE2 3.26Å; S554-E557 WeakPolarHBondContact CB-OE2 3.39Å; S554-E557 PolarHBondContact N-OE2 3.47Å; S554-E557 WeakPolarHBondContact OG-CB 3.46Å; S554-E557 VanDerWaalsContact OG-CG 3.31Å; S554-E557 WeakPolarHBondContact OG-CG 3.32Å; S554-E557 PolarHBondContact OG-N 3.11Å; S554-E557 PolarHBondContact OG-OE2 3.13Å; E557-A559 PolarHBondContact O-N 2.95Å; E557-L560 WeakPolarHBondContact O-CB 3.45Å; E557-L560 PolarHBondContact O-N 3.22Å; E557-L560 VanDerWaalsContact O-N 3.15Å; E557-L561 WeakPolarHBondContact O-CG 3.29Å; E557-L561 PolarHBondContact O-N 3.33Å; E557-L561 VanDerWaalsContact O-N 3.07Å
558	R	98.1	Very high	96.3	Very high	32 Å²	32	43.1 Å²	43.1	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-55.3	-42.2	172.8	-176.5	-170.1	-13.9	-79.8	-11.4	111.3	V550 T551 A553 S554 L561 I562 V595	V550-R558 HydrophobicContact CB-CG 4.47Å; V550-R558 VanDerWaalsContact O-CD 3.31Å; V550-R558 WeakPolarHBondContact O-CD 3.39Å; V550-R558 WeakPolarHBondContact O-CG 3.31Å; V550-R558 PolarHBondContact O-NH1 3.48Å; T551-R558 VanDerWaalsContact C-NH1 3.29Å; T551-R558 PolarHBondContact O-NH1 2.9Å; A553-R558 PolarHBondContact O-NH2 3.24Å; S554-R558 VanDerWaalsContact O-CB 3.23Å; S554-R558 WeakPolarHBondContact O-CB 3.42Å; S554-R558 PolarHBondContact O-N 3.48Å; S554-R558 PolarHBondContact O-NH2 3.26Å; R558-L561 PolarHBondContact O-N 2.8Å; R558-I562 HydrophobicContact CG-CD1 3.97Å; R558-I562 WeakPolarHBondContact O-CG1 3.41Å; R558-I562 PolarHBondContact O-N 3.14Å; R558-V595 WeakPolarHBondContact CD-O 3.48Å; R558-V595 HydrophobicContact CG-CG2 4.35Å
559	A	97.3	Very high	95.4	Very high	28 Å²	28	45.1 Å²	45.1	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-46.6	177.7	0	0	0	0	0	111.2	R555 A556 E557 L561 I562 D563 Q600	R555-A559 WeakPolarHBondContact O-CB 3.29Å; R555-A559 PolarHBondContact O-N 3.14Å; R555-A559 VanDerWaalsContact O-N 3.16Å; A556-A559 WeakPolarHBondContact O-CB 2.82Å; A556-A559 PolarHBondContact O-N 3.4Å; E557-A559 PolarHBondContact O-N 2.95Å; A559-L561 PolarHBondContact O-N 3.12Å; A559-I562 PolarHBondContact O-N 2.89Å; A559-D563 WeakPolarHBondContact O-CB 3.45Å; A559-D563 PolarHBondContact O-N 2.85Å; A559-Q600 VanDerWaalsContact CA-NE2 3.34Å; A559-Q600 PolarHBondContact O-NE2 3.05Å
560	L	97.4	Very high	94	Very high	79 Å²	79	49.8 Å²	49.8	41%	0.414	28%	0.275	S	S	.	.	H	α-helix	trans	-56.3	-45.6	177.2	-67.3	172.4	0	0	0	112.8	A556 E557 I562 D563 E564	A556-L560 WeakPolarHBondContact O-CG 3.31Å; A556-L560 PolarHBondContact O-N 3.4Å; E557-L560 WeakPolarHBondContact O-CB 3.45Å; E557-L560 PolarHBondContact O-N 3.22Å; E557-L560 VanDerWaalsContact O-N 3.15Å; L560-I562 VanDerWaalsContact C-N 3.33Å; L560-I562 PolarHBondContact O-N 2.8Å; L560-D563 PolarHBondContact O-N 2.9Å; L560-E564 WeakPolarHBondContact O-CB 3.23Å; L560-E564 PolarHBondContact O-N 3.38Å
561	L	97.9	Very high	92.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-34.3	179.6	-63.7	176.6	0	0	0	113.1	V526 I529 R530 V533 C549 V550 E557 R558 A559	V526-L561 HydrophobicContact CG1-CD1 3.93Å; V526-L561 HydrophobicContact CG1-CD2 4.25Å; V526-L561 HydrophobicContact CG1-CG 4.22Å; I529-L561 HydrophobicContact CG2-CD2 4.31Å; R530-L561 HydrophobicContact CB-CD2 4.26Å; V533-L561 HydrophobicContact CG2-CB 4.45Å; V533-L561 HydrophobicContact CG2-CD2 3.63Å; C549-L561 HydrophobicContact CB-CD1 3.79Å; V550-L561 HydrophobicContact CG1-CB 4.13Å; V550-L561 HydrophobicContact CG1-CD1 4.04Å; E557-L561 WeakPolarHBondContact O-CG 3.29Å; E557-L561 PolarHBondContact O-N 3.33Å; E557-L561 VanDerWaalsContact O-N 3.07Å; R558-L561 PolarHBondContact O-N 2.8Å; A559-L561 PolarHBondContact O-N 3.12Å
562	I	97.3	Very high	91.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-79.3	-38.4	179.1	-66.1	170.9	0	0	0	110.9	V550 R558 A559 L560 E564 V565 C566 M592 V595 A596 Q600 V604	V550-I562 HydrophobicContact CG1-CG1 4.45Å; R558-I562 HydrophobicContact CG-CD1 3.97Å; R558-I562 WeakPolarHBondContact O-CG1 3.41Å; R558-I562 PolarHBondContact O-N 3.14Å; A559-I562 PolarHBondContact O-N 2.89Å; L560-I562 VanDerWaalsContact C-N 3.33Å; L560-I562 PolarHBondContact O-N 2.8Å; I562-E564 VanDerWaalsContact C-N 3.33Å; I562-V565 PolarHBondContact O-N 3.13Å; I562-C566 PolarHBondContact O-N 2.75Å; I562-C566 VanDerWaalsContact O-N 3.08Å; I562-C566 PolarHBondContact O-SG 3.22Å; I562-M592 HydrophobicContact CD1-CB 4.29Å; I562-M592 HydrophobicContact CD1-CG 4.34Å; I562-M592 HydrophobicContact CG1-CB 4.15Å; I562-M592 HydrophobicContact CG1-CE 4.17Å; I562-M592 HydrophobicContact CG1-CG 3.82Å; I562-M592 HydrophobicContact CG1-SD 4.1Å; I562-V595 HydrophobicContact CD1-CG2 4.31Å; I562-A596 HydrophobicContact CD1-CB 4.07Å; I562-Q600 HydrophobicContact CB-CG 4.41Å; I562-Q600 VanDerWaalsContact CG2-CD 3.49Å; I562-Q600 HydrophobicContact CG2-CG 3.72Å; I562-V604 HydrophobicContact CG2-CG2 3.69Å
563	D	95.6	Very high	91.1	Very high	61 Å²	61	57 Å²	57	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-68.3	-33.1	177.4	-72.6	-21	0	0	0	111.9	A559 L560 C566 S567 Q600	A559-D563 WeakPolarHBondContact O-CB 3.45Å; A559-D563 PolarHBondContact O-N 2.85Å; L560-D563 PolarHBondContact O-N 2.9Å; D563-C566 PolarHBondContact O-N 2.98Å; D563-S567 WeakPolarHBondContact O-CB 3.12Å; D563-S567 PolarHBondContact O-N 3.26Å; D563-S567 PolarHBondContact O-OG 3.39Å; D563-Q600 PolarHBondContact OD1-NE2 2.95Å; D563-Q600 PolarHBondContact OD2-NE2 3.12Å
564	E	95.6	Very high	90.8	Very high	32 Å²	32	57.8 Å²	57.8	15%	0.15	34%	0.339	C	S	.	.	H	α-helix	trans	-53.6	-55.6	170.2	-175.9	178.5	138.2	0	0	110.8	G531 N532 V533 L560 I562 C566 S567 L568	G531-E564 VanDerWaalsContact C-OE1 3.32Å; G531-E564 VanDerWaalsContact CA-OE1 3.31Å; G531-E564 WeakPolarHBondContact CA-OE1 3.47Å; G531-E564 VanDerWaalsContact N-CD 3.26Å; G531-E564 PolarHBondContact N-OE1 3.33Å; G531-E564 VanDerWaalsContact N-OE1 3.12Å; G531-E564 PolarHBondContact N-OE2 2.78Å; N532-E564 PolarHBondContact N-OE1 3.43Å; V533-E564 VanDerWaalsContact CB-OE1 3.29Å; V533-E564 WeakPolarHBondContact CB-OE1 3.25Å; V533-E564 VanDerWaalsContact CG2-OE1 3.23Å; V533-E564 WeakPolarHBondContact CG2-OE1 3.49Å; V533-E564 PolarHBondContact N-OE1 3.2Å; L560-E564 WeakPolarHBondContact O-CB 3.23Å; L560-E564 PolarHBondContact O-N 3.38Å; I562-E564 VanDerWaalsContact C-N 3.33Å; E564-C566 VanDerWaalsContact C-N 3.3Å; E564-C566 PolarHBondContact O-N 3.24Å; E564-S567 PolarHBondContact O-N 3.28Å; E564-S567 VanDerWaalsContact O-N 3.17Å; E564-L568 WeakPolarHBondContact O-CB 3.28Å; E564-L568 PolarHBondContact O-N 3.34Å
565	V	94.7	Very high	90.7	Very high	1 Å²	1	55 Å²	55	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-31	179.4	172.5	0	0	0	0	113	V533 I562 L576 M579 M592	V533-V565 HydrophobicContact CB-CG2 4.1Å; V533-V565 HydrophobicContact CG1-CG2 3.46Å; V533-V565 VanDerWaalsContact CG1-CG2 3.46Å; I562-V565 PolarHBondContact O-N 3.13Å; V565-L576 HydrophobicContact CG1-CB 3.91Å; V565-L576 HydrophobicContact CG1-CD1 3.8Å; V565-L576 HydrophobicContact CG1-CG 4.46Å; V565-L576 PolarHBondContact O-N 3.36Å; V565-M579 HydrophobicContact CB-SD 4.2Å; V565-M579 HydrophobicContact CG1-CE 4.16Å; V565-M579 HydrophobicContact CG1-SD 3.42Å; V565-M579 WeakPolarHBondContact CG1-SD 3.38Å; V565-M579 HydrophobicContact CG2-CE 4.11Å; V565-M579 HydrophobicContact CG2-SD 3.64Å; V565-M592 HydrophobicContact CB-CE 4.48Å; V565-M592 HydrophobicContact CB-SD 4.42Å; V565-M592 HydrophobicContact CG2-CE 3.9Å; V565-M592 HydrophobicContact CG2-SD 4.37Å
566	C	92.2	Very high	90.6	Very high	4 Å²	4	47.2 Å²	47.2	3%	0.027	29%	0.29	C	S	.	.	H	α-helix	trans	-75.7	-25.6	177	-68.3	0	0	0	0	113.2	I562 D563 E564 I603 K607	I562-C566 PolarHBondContact O-N 2.75Å; I562-C566 VanDerWaalsContact O-N 3.08Å; I562-C566 PolarHBondContact O-SG 3.22Å; D563-C566 PolarHBondContact O-N 2.98Å; E564-C566 VanDerWaalsContact C-N 3.3Å; E564-C566 PolarHBondContact O-N 3.24Å; C566-I603 HydrophobicContact CB-CG2 4.48Å; C566-K607 VanDerWaalsContact O-CE 3.23Å; C566-K607 WeakPolarHBondContact O-CE 2.93Å; C566-K607 PolarHBondContact O-NZ 3.45Å
567	S	89.9	Confident	90.4	Very high	90 Å²	90	44.9 Å²	44.9	63%	0.629	27%	0.267	S	S	*	.	H	α-helix	trans	-102.2	-32.5	-173	-52.7	0	0	0	0	113	D563 E564	D563-S567 WeakPolarHBondContact O-CB 3.12Å; D563-S567 PolarHBondContact O-N 3.26Å; D563-S567 PolarHBondContact O-OG 3.39Å; E564-S567 PolarHBondContact O-N 3.28Å; E564-S567 VanDerWaalsContact O-N 3.17Å
568	L	85.2	Confident	90.3	Very high	72 Å²	72	44.6 Å²	44.6	38%	0.377	27%	0.268	S	S	.	.			trans	-69	139.2	-177.8	-171.3	70.9	0	0	0	112.1	L534 E564 A575	L534-L568 HydrophobicContact CB-CD2 4.22Å; L534-L568 HydrophobicContact CD2-CD2 4.06Å; E564-L568 WeakPolarHBondContact O-CB 3.28Å; E564-L568 PolarHBondContact O-N 3.34Å; L568-A575 HydrophobicContact CB-CB 3.85Å; L568-A575 HydrophobicContact CD2-CB 4.09Å; L568-A575 HydrophobicContact CG-CB 4.19Å; L568-A575 WeakPolarHBondContact O-CB 3.07Å; L568-A575 PolarHBondContact O-N 3.17Å
569	T	79.8	Confident	90.3	Very high	98 Å²	98	43 Å²	43	60%	0.601	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.6	174.1	52.4	0	0	0	0	110.2	H573	T569-H573 CarbonylContact C-O 3.56Å; T569-H573 WeakPolarHBondContact CA-O 3.34Å
570	E	70.5	Confident	90.3	Very high	98 Å²	98	41.7 Å²	41.7	46%	0.458	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.2	169.3	-82.3	-165.5	160.2	0	0	109.7	L534 H573	L534-E570 HydrophobicContact CD2-CB 4.43Å; L534-E570 HydrophobicContact CD2-CG 3.52Å; L534-E570 WeakPolarHBondContact CD2-OE1 3.43Å; L534-E570 WeakPolarHBondContact CD2-OE2 3.17Å; E570-H573 CarbonylContact C-O 3.47Å; E570-H573 PolarHBondContact N-O 2.98Å; E570-H573 PolarHBondContact O-N 3.08Å; E570-H573 VanDerWaalsContact O-N 3.16Å; E570-H573 VanDerWaalsContact O-O 3.12Å
571	G	72.6	Confident	90.2	Very high	69 Å²	69	40.5 Å²	40.5	71%	0.711	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	-126.8	-177.8	0	0	0	0	0	111.9	H573	G571-H573 PolarHBondContact O-N 2.85Å
572	P	77.3	Confident	90.2	Very high	120 Å²	120	41.9 Å²	41.9	78%	0.779	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	4	-176.7	34.8	-37.2	0	0	0	114
573	H	83.9	Confident	90.2	Very high	78 Å²	78	45.8 Å²	45.8	36%	0.361	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.9	-166.4	-71.5	-12.9	0	0	0	112.3	T569 E570 G571 Y577	T569-H573 CarbonylContact C-O 3.56Å; T569-H573 WeakPolarHBondContact CA-O 3.34Å; E570-H573 CarbonylContact C-O 3.47Å; E570-H573 PolarHBondContact N-O 2.98Å; E570-H573 PolarHBondContact O-N 3.08Å; E570-H573 VanDerWaalsContact O-N 3.16Å; E570-H573 VanDerWaalsContact O-O 3.12Å; G571-H573 PolarHBondContact O-N 2.85Å; H573-Y577 HydrophobicContact CB-CD1 3.93Å; H573-Y577 AromaticContact CD2-CD1 3.89Å; H573-Y577 AromaticContact CD2-CE1 3.65Å; H573-Y577 AromaticContact CE1-CE1 3.96Å; H573-Y577 AromaticContact CG-CD1 3.7Å; H573-Y577 AromaticContact CG-CE1 3.83Å; H573-Y577 AromaticContact NE2-CE1 3.71Å
574	S	91.2	Very high	90.3	Very high	22 Å²	22	45.6 Å²	45.6	15%	0.154	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	146.7	171.6	60	0	0	0	0	110.6	L576 Y577 T578	S574-L576 PolarHBondContact O-N 3Å; S574-Y577 PolarHBondContact O-N 3.42Å; S574-Y577 VanDerWaalsContact OG-CB 3.27Å; S574-Y577 WeakPolarHBondContact OG-CB 3.5Å; S574-Y577 PolarHBondContact OG-N 2.66Å; S574-T578 PolarHBondContact O-N 3.13Å; S574-T578 VanDerWaalsContact O-N 3.08Å
575	A	94.4	Very high	90.5	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-51.6	-46.3	174.5	0	0	0	0	0	111.2	L534 L568 Y577 T578 M579	L534-A575 HydrophobicContact CD1-CB 4.35Å; L534-A575 HydrophobicContact CD2-CB 3.73Å; L534-A575 HydrophobicContact CG-CB 4.47Å; L568-A575 HydrophobicContact CB-CB 3.85Å; L568-A575 HydrophobicContact CD2-CB 4.09Å; L568-A575 HydrophobicContact CG-CB 4.19Å; L568-A575 WeakPolarHBondContact O-CB 3.07Å; L568-A575 PolarHBondContact O-N 3.17Å; A575-Y577 VanDerWaalsContact C-N 3.34Å; A575-Y577 PolarHBondContact O-N 3.11Å; A575-T578 WeakPolarHBondContact O-CB 3.42Å; A575-T578 PolarHBondContact O-N 3.31Å; A575-M579 VanDerWaalsContact O-CG 3.32Å; A575-M579 WeakPolarHBondContact O-CG 3.34Å; A575-M579 PolarHBondContact O-N 2.69Å
576	L	95	Very high	90.6	Very high	3 Å²	3	44 Å²	44	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-41.5	175.1	-170.7	64.3	0	0	0	113.5	V565 S574 M579 M580 V589 V604 K607 I608	V565-L576 HydrophobicContact CG1-CB 3.91Å; V565-L576 HydrophobicContact CG1-CD1 3.8Å; V565-L576 HydrophobicContact CG1-CG 4.46Å; V565-L576 PolarHBondContact O-N 3.36Å; S574-L576 PolarHBondContact O-N 3Å; L576-M579 PolarHBondContact O-N 2.98Å; L576-M580 HydrophobicContact CG-CE 4.3Å; L576-M580 WeakPolarHBondContact O-CB 3.27Å; L576-M580 VanDerWaalsContact O-CG 3.26Å; L576-M580 WeakPolarHBondContact O-CG 3.33Å; L576-M580 PolarHBondContact O-N 3.03Å; L576-V589 HydrophobicContact CD1-CB 4.49Å; L576-V589 HydrophobicContact CD1-CG1 3.82Å; L576-V589 HydrophobicContact CD1-CG2 3.83Å; L576-V604 HydrophobicContact CD2-CG1 4.41Å; L576-K607 HydrophobicContact CD2-CB 3.6Å; L576-I608 HydrophobicContact CD2-CD1 4.48Å; L576-I608 HydrophobicContact CD2-CG1 3.76Å; L576-I608 HydrophobicContact CG-CG1 4.33Å
577	Y	94.6	Very high	90.9	Very high	19 Å²	19	49.6 Å²	49.6	8%	0.075	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-39.4	177.3	174.4	-107.4	0	0	0	112.3	H573 S574 A575 K581 H611 T614	H573-Y577 HydrophobicContact CB-CD1 3.93Å; H573-Y577 AromaticContact CD2-CD1 3.89Å; H573-Y577 AromaticContact CD2-CE1 3.65Å; H573-Y577 AromaticContact CE1-CE1 3.96Å; H573-Y577 AromaticContact CG-CD1 3.7Å; H573-Y577 AromaticContact CG-CE1 3.83Å; H573-Y577 AromaticContact NE2-CE1 3.71Å; S574-Y577 PolarHBondContact O-N 3.42Å; S574-Y577 VanDerWaalsContact OG-CB 3.27Å; S574-Y577 WeakPolarHBondContact OG-CB 3.5Å; S574-Y577 PolarHBondContact OG-N 2.66Å; A575-Y577 VanDerWaalsContact C-N 3.34Å; A575-Y577 PolarHBondContact O-N 3.11Å; Y577-K581 HydrophobicContact CD1-CD 4.39Å; Y577-K581 HydrophobicContact CD2-CD 4.4Å; Y577-K581 HydrophobicContact CE1-CD 3.91Å; Y577-K581 HydrophobicContact CE2-CD 3.89Å; Y577-H611 HydrophobicContact CD2-CB 3.93Å; Y577-H611 AromaticContact CD2-CD2 3.91Å; Y577-H611 AromaticContact CD2-CE1 3.76Å; Y577-H611 AromaticContact CD2-CG 3.47Å; Y577-H611 VanDerWaalsContact CD2-CG 3.47Å; Y577-H611 AromaticContact CD2-ND1 3.38Å; Y577-H611 WeakPolarHBondContact CD2-ND1 3.41Å; Y577-H611 HydrophobicContact CE2-CB 4.21Å; Y577-H611 AromaticContact CE2-CG 4Å; Y577-H611 AromaticContact CE2-ND1 3.66Å; Y577-T614 HydrophobicContact CE2-CG2 4.05Å; Y577-T614 WeakPolarHBondContact OH-CG2 3.3Å
578	T	95.4	Very high	91.4	Very high	29 Å²	29	45.3 Å²	45.3	18%	0.178	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-49.6	172.5	-61.9	0	0	0	0	110.7	L534 S574 A575 M580 K581 D582	L534-T578 HydrophobicContact CD1-CG2 4.3Å; S574-T578 PolarHBondContact O-N 3.13Å; S574-T578 VanDerWaalsContact O-N 3.08Å; A575-T578 WeakPolarHBondContact O-CB 3.42Å; A575-T578 PolarHBondContact O-N 3.31Å; T578-M580 PolarHBondContact O-N 3.44Å; T578-K581 PolarHBondContact O-N 3.33Å; T578-D582 PolarHBondContact O-N 2.82Å
579	M	97.5	Very high	92	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-42.1	-178.1	-69.5	173.4	60.6	0	0	113.3	L534 S537 V565 A575 L576 K581 D582 A585 N586 V588 V589	L534-M579 HydrophobicContact CD1-CG 3.35Å; L534-M579 HydrophobicContact CD1-SD 3.91Å; S537-M579 WeakPolarHBondContact OG-CE 3.26Å; V565-M579 HydrophobicContact CB-SD 4.2Å; V565-M579 HydrophobicContact CG1-CE 4.16Å; V565-M579 HydrophobicContact CG1-SD 3.42Å; V565-M579 WeakPolarHBondContact CG1-SD 3.38Å; V565-M579 HydrophobicContact CG2-CE 4.11Å; V565-M579 HydrophobicContact CG2-SD 3.64Å; A575-M579 VanDerWaalsContact O-CG 3.32Å; A575-M579 WeakPolarHBondContact O-CG 3.34Å; A575-M579 PolarHBondContact O-N 2.69Å; L576-M579 PolarHBondContact O-N 2.98Å; M579-K581 PolarHBondContact O-N 3.2Å; M579-K581 VanDerWaalsContact O-N 3.11Å; M579-D582 PolarHBondContact O-N 2.96Å; M579-A585 HydrophobicContact CB-CB 3.66Å; M579-A585 HydrophobicContact CE-CB 4.32Å; M579-A585 HydrophobicContact CG-CB 3.76Å; M579-A585 CarbonylContact O-C 3.48Å; M579-N586 PolarHBondContact O-N 3.29Å; M579-N586 VanDerWaalsContact O-N 3.1Å; M579-V588 HydrophobicContact CE-CB 4.06Å; M579-V588 HydrophobicContact CE-CG1 3.86Å; M579-V589 HydrophobicContact CB-CG2 3.62Å; M579-V589 HydrophobicContact CE-CG2 3.97Å
580	M	97.4	Very high	92.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-22.2	178.3	-76.6	-170.8	-67.2	0	0	114.1	L576 T578 V589 I608 H611 L615 G621 I624	L576-M580 HydrophobicContact CG-CE 4.3Å; L576-M580 WeakPolarHBondContact O-CB 3.27Å; L576-M580 VanDerWaalsContact O-CG 3.26Å; L576-M580 WeakPolarHBondContact O-CG 3.33Å; L576-M580 PolarHBondContact O-N 3.03Å; T578-M580 PolarHBondContact O-N 3.44Å; M580-V589 HydrophobicContact CG-CB 4.43Å; M580-V589 HydrophobicContact CG-CG1 3.91Å; M580-V589 HydrophobicContact CG-CG2 4.22Å; M580-I608 HydrophobicContact CE-CB 4.45Å; M580-I608 HydrophobicContact CE-CG1 4.09Å; M580-I608 HydrophobicContact CE-CG2 4.25Å; M580-I608 HydrophobicContact SD-CB 4.11Å; M580-I608 HydrophobicContact SD-CD1 3.9Å; M580-I608 HydrophobicContact SD-CG1 3.57Å; M580-I608 VanDerWaalsContact SD-CG1 3.57Å; M580-I608 HydrophobicContact SD-CG2 3.62Å; M580-H611 HydrophobicContact CE-CB 4.36Å; M580-L615 HydrophobicContact CB-CD2 3.75Å; M580-L615 HydrophobicContact CE-CD1 4.02Å; M580-L615 HydrophobicContact CE-CD2 4.36Å; M580-L615 HydrophobicContact SD-CD1 3.64Å; M580-L615 HydrophobicContact SD-CD2 4.31Å; M580-G621 VanDerWaalsContact O-CA 3.26Å; M580-G621 WeakPolarHBondContact O-CA 3.47Å; M580-G621 PolarHBondContact O-N 2.98Å; M580-I624 HydrophobicContact CB-CG1 3.98Å; M580-I624 HydrophobicContact CG-CD1 4.31Å; M580-I624 HydrophobicContact CG-CG1 3.91Å; M580-I624 HydrophobicContact CG-CG2 4.31Å; M580-I624 HydrophobicContact SD-CG1 4.45Å; M580-I624 HydrophobicContact SD-CG2 3.91Å
581	K	95.8	Very high	94.1	Very high	54 Å²	54	37.1 Å²	37.1	24%	0.235	20%	0.199	C	C	.	.	H	α-helix	trans	-96.2	-15.5	-179.2	-72.4	170.5	39.8	173.8	0	113.7	Y577 T578 M579 L615 Y618 Y620	Y577-K581 HydrophobicContact CD1-CD 4.39Å; Y577-K581 HydrophobicContact CD2-CD 4.4Å; Y577-K581 HydrophobicContact CE1-CD 3.91Å; Y577-K581 HydrophobicContact CE2-CD 3.89Å; T578-K581 PolarHBondContact O-N 3.33Å; M579-K581 PolarHBondContact O-N 3.2Å; M579-K581 VanDerWaalsContact O-N 3.11Å; K581-L615 HydrophobicContact CG-CD2 4.31Å; K581-Y618 HydrophobicContact CD-CD1 4.25Å; K581-Y618 HydrophobicContact CD-CD2 4.01Å; K581-Y618 HydrophobicContact CD-CE1 4.02Å; K581-Y618 HydrophobicContact CD-CE2 3.76Å; K581-Y618 HydrophobicContact CD-CG 4.24Å; K581-Y618 VanDerWaalsContact CE-CZ 3.41Å; K581-Y618 HydrophobicContact CG-CD1 4.16Å; K581-Y618 HydrophobicContact CG-CD2 3.92Å; K581-Y618 HydrophobicContact CG-CE1 4.44Å; K581-Y618 HydrophobicContact CG-CE2 4.21Å; K581-Y618 HydrophobicContact CG-CG 3.88Å; K581-Y618 PolarHBondContact NZ-OH 3.47Å; K581-Y620 WeakPolarHBondContact O-CD2 3.49Å
582	D	97.8	Very high	95.3	Very high	29 Å²	29	34 Å²	34	16%	0.155	17%	0.166	C	C	.	.	S	Bend	trans	-81.3	154.7	-175	175.8	-105.7	0	0	0	112.6	Q538 T578 M579 Y584 A585 N586 Y620	Q538-D582 HydrophobicContact CG-CB 4.34Å; T578-D582 PolarHBondContact O-N 2.82Å; M579-D582 PolarHBondContact O-N 2.96Å; D582-Y584 VanDerWaalsContact C-N 3.32Å; D582-Y584 PolarHBondContact O-N 3.26Å; D582-Y584 WeakPolarHBondContact OD1-CA 3.39Å; D582-Y584 PolarHBondContact OD1-N 3.15Å; D582-A585 HydrophobicContact CB-CB 3.98Å; D582-A585 PolarHBondContact OD1-N 2.75Å; D582-N586 WeakPolarHBondContact O-CB 3.35Å; D582-N586 PolarHBondContact O-ND2 2.91Å; D582-Y620 WeakPolarHBondContact O-CB 3.43Å
583	Q	97.9	Very high	96.2	Very high	83 Å²	83	28.3 Å²	28.3	39%	0.388	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.2	-177	73.5	-169.8	-65.3	0	0	114.2	N586 Y587 Y620	Q583-N586 VanDerWaalsContact C-ND2 3.34Å; Q583-N586 PolarHBondContact O-ND2 3.42Å; Q583-N586 VanDerWaalsContact O-ND2 3.07Å; Q583-Y587 WeakPolarHBondContact O-CE2 3.46Å; Q583-Y620 HydrophobicContact CB-CD1 4.27Å; Q583-Y620 HydrophobicContact CB-CD2 4.16Å; Q583-Y620 HydrophobicContact CB-CE1 3.75Å; Q583-Y620 HydrophobicContact CB-CE2 3.63Å; Q583-Y620 HydrophobicContact CB-CG 4.45Å
584	Y	98.5	Very high	96.8	Very high	56 Å²	56	28.1 Å²	28.1	22%	0.22	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-46.3	179.4	-54.3	-59.2	0	0	0	111.6	S537 Q538 K540 D582 N586 Y587	S537-Y584 CarbonylContact O-C 3.39Å; Q538-Y584 WeakPolarHBondContact O-CD2 3.43Å; K540-Y584 HydrophobicContact CB-CD2 4.35Å; K540-Y584 HydrophobicContact CB-CE1 4.1Å; K540-Y584 HydrophobicContact CB-CE2 3.79Å; K540-Y584 HydrophobicContact CG-CE1 3.88Å; K540-Y584 HydrophobicContact CG-CE2 4.4Å; D582-Y584 VanDerWaalsContact C-N 3.32Å; D582-Y584 PolarHBondContact O-N 3.26Å; D582-Y584 WeakPolarHBondContact OD1-CA 3.39Å; D582-Y584 PolarHBondContact OD1-N 3.15Å; Y584-N586 PolarHBondContact O-N 3.31Å; Y584-N586 VanDerWaalsContact O-N 3.09Å; Y584-Y587 WeakPolarHBondContact O-CB 3.35Å; Y584-Y587 WeakPolarHBondContact O-CD2 3.42Å; Y584-Y587 PolarHBondContact O-N 3.33Å
585	A	98.3	Very high	97	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.3	-19.3	-173.7	0	0	0	0	0	113.7	S537 Q538 M579 D582 Y587 V588 V589	S537-A585 WeakPolarHBondContact O-CA 3.5Å; S537-A585 WeakPolarHBondContact O-CB 3.26Å; S537-A585 PolarHBondContact O-N 3.16Å; S537-A585 VanDerWaalsContact O-N 3.08Å; Q538-A585 HydrophobicContact CG-CB 4.25Å; M579-A585 HydrophobicContact CB-CB 3.66Å; M579-A585 HydrophobicContact CE-CB 4.32Å; M579-A585 HydrophobicContact CG-CB 3.76Å; M579-A585 CarbonylContact O-C 3.48Å; D582-A585 HydrophobicContact CB-CB 3.98Å; D582-A585 PolarHBondContact OD1-N 2.75Å; A585-Y587 PolarHBondContact O-N 2.9Å; A585-V588 WeakPolarHBondContact O-CB 3.31Å; A585-V588 PolarHBondContact O-N 3.02Å; A585-V589 WeakPolarHBondContact O-CG2 3.33Å; A585-V589 PolarHBondContact O-N 3.47Å
586	N	98.1	Very high	97.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.7	-28.8	172.7	80.6	89.2	0	0	0	112.4	M579 D582 Q583 Y584 Q590 I624	M579-N586 PolarHBondContact O-N 3.29Å; M579-N586 VanDerWaalsContact O-N 3.1Å; D582-N586 WeakPolarHBondContact O-CB 3.35Å; D582-N586 PolarHBondContact O-ND2 2.91Å; Q583-N586 VanDerWaalsContact C-ND2 3.34Å; Q583-N586 PolarHBondContact O-ND2 3.42Å; Q583-N586 VanDerWaalsContact O-ND2 3.07Å; Y584-N586 PolarHBondContact O-N 3.31Å; Y584-N586 VanDerWaalsContact O-N 3.09Å; N586-Q590 VanDerWaalsContact O-CG 3.28Å; N586-Q590 WeakPolarHBondContact O-CG 3.5Å; N586-Q590 PolarHBondContact O-N 3Å; N586-Q590 VanDerWaalsContact O-N 3.15Å; N586-Q590 PolarHBondContact O-NE2 3.36Å; N586-Q590 PolarHBondContact OD1-NE2 3.15Å; N586-Q590 VanDerWaalsContact OD1-NE2 3.12Å; N586-I624 HydrophobicContact CB-CD1 3.96Å; N586-I624 WeakPolarHBondContact O-CD1 3.37Å
587	Y	98.5	Very high	97.1	Very high	122 Å²	122	32 Å²	32	48%	0.478	15%	0.149	S	C	.	.	H	α-helix	trans	-72.1	-42.3	174.3	-64.9	-78.5	0	0	0	111	E547 Q583 Y584 A585 V589 Q590 K591	E547-Y587 WeakPolarHBondContact OE1-CB 2.98Å; Q583-Y587 WeakPolarHBondContact O-CE2 3.46Å; Y584-Y587 WeakPolarHBondContact O-CB 3.35Å; Y584-Y587 WeakPolarHBondContact O-CD2 3.42Å; Y584-Y587 PolarHBondContact O-N 3.33Å; A585-Y587 PolarHBondContact O-N 2.9Å; Y587-V589 PolarHBondContact O-N 3.09Å; Y587-Q590 WeakPolarHBondContact O-CB 3.31Å; Y587-Q590 PolarHBondContact O-N 3.18Å; Y587-Q590 VanDerWaalsContact O-N 3.16Å; Y587-K591 PolarHBondContact O-N 3.07Å
588	V	98.6	Very high	97	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.1	-46.3	172.6	-175.9	0	0	0	0	111.2	V546 E547 M579 A585 Q590 K591 M592	V546-V588 HydrophobicContact CB-CG1 4.32Å; V546-V588 HydrophobicContact CB-CG2 4.33Å; V546-V588 HydrophobicContact CG1-CG1 3.58Å; V546-V588 HydrophobicContact CG1-CG2 4.45Å; E547-V588 HydrophobicContact CG-CG2 4.12Å; M579-V588 HydrophobicContact CE-CB 4.06Å; M579-V588 HydrophobicContact CE-CG1 3.86Å; A585-V588 WeakPolarHBondContact O-CB 3.31Å; A585-V588 PolarHBondContact O-N 3.02Å; V588-Q590 PolarHBondContact O-N 2.82Å; V588-K591 WeakPolarHBondContact O-CB 3.47Å; V588-K591 PolarHBondContact O-N 3.06Å; V588-K591 VanDerWaalsContact O-N 3.13Å; V588-M592 HydrophobicContact CG1-CE 3.98Å; V588-M592 HydrophobicContact CG1-CG 4.37Å; V588-M592 HydrophobicContact CG1-SD 4.32Å; V588-M592 WeakPolarHBondContact O-CG 3.31Å; V588-M592 PolarHBondContact O-N 2.69Å
589	V	98.1	Very high	96.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.8	176.8	177.6	0	0	0	0	111.8	L576 M579 M580 A585 Y587 K591 M592 I593 I608 I624	L576-V589 HydrophobicContact CD1-CB 4.49Å; L576-V589 HydrophobicContact CD1-CG1 3.82Å; L576-V589 HydrophobicContact CD1-CG2 3.83Å; M579-V589 HydrophobicContact CB-CG2 3.62Å; M579-V589 HydrophobicContact CE-CG2 3.97Å; M580-V589 HydrophobicContact CG-CB 4.43Å; M580-V589 HydrophobicContact CG-CG1 3.91Å; M580-V589 HydrophobicContact CG-CG2 4.22Å; A585-V589 WeakPolarHBondContact O-CG2 3.33Å; A585-V589 PolarHBondContact O-N 3.47Å; Y587-V589 PolarHBondContact O-N 3.09Å; V589-K591 VanDerWaalsContact C-N 3.3Å; V589-K591 PolarHBondContact O-N 3.45Å; V589-M592 PolarHBondContact O-N 2.59Å; V589-I593 HydrophobicContact CG1-CD1 4.1Å; V589-I593 WeakPolarHBondContact O-CG1 3.14Å; V589-I593 PolarHBondContact O-N 2.58Å; V589-I608 HydrophobicContact CG1-CD1 4.31Å; V589-I624 HydrophobicContact CB-CD1 4.12Å; V589-I624 HydrophobicContact CG1-CD1 4.15Å
590	Q	97.8	Very high	96.7	Very high	34 Å²	34	40 Å²	40	16%	0.159	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-37.7	174.9	-71.1	172.6	80.6	0	0	112	N586 Y587 V588 I593 D594 I624 K627	N586-Q590 VanDerWaalsContact O-CG 3.28Å; N586-Q590 WeakPolarHBondContact O-CG 3.5Å; N586-Q590 PolarHBondContact O-N 3Å; N586-Q590 VanDerWaalsContact O-N 3.15Å; N586-Q590 PolarHBondContact O-NE2 3.36Å; N586-Q590 PolarHBondContact OD1-NE2 3.15Å; N586-Q590 VanDerWaalsContact OD1-NE2 3.12Å; Y587-Q590 WeakPolarHBondContact O-CB 3.31Å; Y587-Q590 PolarHBondContact O-N 3.18Å; Y587-Q590 VanDerWaalsContact O-N 3.16Å; V588-Q590 PolarHBondContact O-N 2.82Å; Q590-I593 PolarHBondContact O-N 3.21Å; Q590-D594 PolarHBondContact O-N 3.03Å; Q590-I624 HydrophobicContact CG-CD1 3.82Å; Q590-K627 HydrophobicContact CB-CD 4.31Å; Q590-K627 HydrophobicContact CB-CG 4.26Å; Q590-K627 HydrophobicContact CG-CB 4.05Å; Q590-K627 HydrophobicContact CG-CD 4.3Å; Q590-K627 HydrophobicContact CG-CG 3.94Å
591	K	98.1	Very high	96.5	Very high	62 Å²	62	42 Å²	42	27%	0.27	21%	0.208	S	C	.	.	H	α-helix	trans	-66	-47.2	175.1	-170.3	63.1	60.3	179.5	0	111.6	E547 V550 Y587 V588 V589 I593 D594 V595	E547-K591 HydrophobicContact CB-CG 4.21Å; E547-K591 HydrophobicContact CG-CB 3.9Å; E547-K591 HydrophobicContact CG-CG 4.14Å; E547-K591 WeakPolarHBondContact OE2-CE 3.49Å; E547-K591 IonicContact OE2-NZ 2.84Å; V550-K591 HydrophobicContact CG2-CB 4.25Å; V550-K591 HydrophobicContact CG2-CG 3.6Å; Y587-K591 PolarHBondContact O-N 3.07Å; V588-K591 WeakPolarHBondContact O-CB 3.47Å; V588-K591 PolarHBondContact O-N 3.06Å; V588-K591 VanDerWaalsContact O-N 3.13Å; V589-K591 VanDerWaalsContact C-N 3.3Å; V589-K591 PolarHBondContact O-N 3.45Å; K591-I593 VanDerWaalsContact C-N 3.26Å; K591-I593 PolarHBondContact O-N 3.32Å; K591-D594 WeakPolarHBondContact O-CB 3.49Å; K591-D594 PolarHBondContact O-N 3.07Å; K591-V595 HydrophobicContact CD-CG1 4.08Å; K591-V595 HydrophobicContact CG-CG1 4.37Å; K591-V595 VanDerWaalsContact O-CG2 3.31Å; K591-V595 WeakPolarHBondContact O-CG2 3.05Å; K591-V595 PolarHBondContact O-N 2.84Å
592	M	97.8	Very high	96.3	Very high	4 Å²	4	47 Å²	47	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-55.4	-42.1	175.4	-70.5	-177.8	164.2	0	0	111.3	V533 V550 I562 V565 V588 V589 D594 V595 A596	V533-M592 HydrophobicContact CG1-CE 3.92Å; V550-M592 HydrophobicContact CG1-CE 3.9Å; V550-M592 HydrophobicContact CG1-CG 4.25Å; V550-M592 HydrophobicContact CG2-CG 4.41Å; I562-M592 HydrophobicContact CD1-CB 4.29Å; I562-M592 HydrophobicContact CD1-CG 4.34Å; I562-M592 HydrophobicContact CG1-CB 4.15Å; I562-M592 HydrophobicContact CG1-CE 4.17Å; I562-M592 HydrophobicContact CG1-CG 3.82Å; I562-M592 HydrophobicContact CG1-SD 4.1Å; V565-M592 HydrophobicContact CB-CE 4.48Å; V565-M592 HydrophobicContact CB-SD 4.42Å; V565-M592 HydrophobicContact CG2-CE 3.9Å; V565-M592 HydrophobicContact CG2-SD 4.37Å; V588-M592 HydrophobicContact CG1-CE 3.98Å; V588-M592 HydrophobicContact CG1-CG 4.37Å; V588-M592 HydrophobicContact CG1-SD 4.32Å; V588-M592 WeakPolarHBondContact O-CG 3.31Å; V588-M592 PolarHBondContact O-N 2.69Å; V589-M592 PolarHBondContact O-N 2.59Å; M592-D594 PolarHBondContact O-N 2.84Å; M592-V595 PolarHBondContact O-N 2.72Å; M592-A596 WeakPolarHBondContact O-CB 3.5Å; M592-A596 PolarHBondContact O-N 3.38Å
593	I	95.8	Very high	96.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-42.1	174.6	-71.2	162.8	0	0	0	112	V589 Q590 K591 R601 V604 M605 I608 L628	V589-I593 HydrophobicContact CG1-CD1 4.1Å; V589-I593 WeakPolarHBondContact O-CG1 3.14Å; V589-I593 PolarHBondContact O-N 2.58Å; Q590-I593 PolarHBondContact O-N 3.21Å; K591-I593 VanDerWaalsContact C-N 3.26Å; K591-I593 PolarHBondContact O-N 3.32Å; I593-R601 PolarHBondContact O-NE 3.17Å; I593-V604 HydrophobicContact CG1-CG1 4.01Å; I593-M605 HydrophobicContact CG1-CE 4.42Å; I593-M605 HydrophobicContact CG2-CE 3.62Å; I593-I608 HydrophobicContact CD1-CD1 3.9Å; I593-L628 HydrophobicContact CD1-CD2 3.99Å
594	D	95.3	Very high	95.9	Very high	73 Å²	73	45.5 Å²	45.5	39%	0.39	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-50.9	178	-71.5	-28.4	0	0	0	111.6	Q590 K591 M592 R601 K627	Q590-D594 PolarHBondContact O-N 3.03Å; K591-D594 WeakPolarHBondContact O-CB 3.49Å; K591-D594 PolarHBondContact O-N 3.07Å; M592-D594 PolarHBondContact O-N 2.84Å; D594-R601 PolarHBondContact O-NH2 2.93Å; D594-K627 WeakPolarHBondContact OD1-CE 3.28Å; D594-K627 IonicContact OD1-NZ 3.85Å; D594-K627 PolarHBondContact OD1-NZ 2.79Å; D594-K627 IonicContact OD2-NZ 2.94Å; D594-K627 PolarHBondContact OD2-NZ 3.33Å
595	V	96.4	Very high	95.6	Very high	37 Å²	37	43.8 Å²	43.8	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-88.9	-15.9	-168	-54	0	0	0	0	114.7	V550 R558 I562 K591 M592	V550-V595 HydrophobicContact CB-CG2 4.03Å; V550-V595 HydrophobicContact CG2-CG2 4.08Å; V550-V595 WeakPolarHBondContact O-CG2 3.46Å; R558-V595 WeakPolarHBondContact CD-O 3.48Å; R558-V595 HydrophobicContact CG-CG2 4.35Å; I562-V595 HydrophobicContact CD1-CG2 4.31Å; K591-V595 HydrophobicContact CD-CG1 4.08Å; K591-V595 HydrophobicContact CG-CG1 4.37Å; K591-V595 VanDerWaalsContact O-CG2 3.31Å; K591-V595 WeakPolarHBondContact O-CG2 3.05Å; K591-V595 PolarHBondContact O-N 2.84Å; M592-V595 PolarHBondContact O-N 2.72Å
596	A	96.2	Very high	95.3	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	25%	0.249	C	C	.	.	S	Bend	trans	-61.3	140.1	178.3	0	0	0	0	0	112.2	I562 M592 R601	I562-A596 HydrophobicContact CD1-CB 4.07Å; M592-A596 WeakPolarHBondContact O-CB 3.5Å; M592-A596 PolarHBondContact O-N 3.38Å; A596-R601 HydrophobicContact CB-CB 3.86Å; A596-R601 HydrophobicContact CB-CG 4.37Å; A596-R601 VanDerWaalsContact O-CZ 3.23Å; A596-R601 PolarHBondContact O-NH2 2.98Å
597	E	94.3	Very high	95	Very high	70 Å²	70	54.5 Å²	54.5	33%	0.327	27%	0.266	S	S	.	.			trans	-66.3	154.5	172.5	-62.5	-162.4	-167.6	0	0	111.4	R555 T599 Q600 R601	R555-E597 IonicContact CZ-OE1 2.7Å; R555-E597 VanDerWaalsContact CZ-OE1 3.23Å; R555-E597 IonicContact CZ-OE2 2.73Å; R555-E597 IonicContact NE-OE1 2.78Å; R555-E597 PolarHBondContact NE-OE1 2.88Å; R555-E597 IonicContact NH2-OE1 3.82Å; R555-E597 PolarHBondContact NH2-OE1 3.22Å; R555-E597 IonicContact NH2-OE2 2.96Å; R555-E597 PolarHBondContact NH2-OE2 2.84Å; E597-T599 VanDerWaalsContact C-N 3.25Å; E597-T599 PolarHBondContact O-N 2.98Å; E597-Q600 PolarHBondContact O-N 3.29Å; E597-R601 WeakPolarHBondContact O-CB 3.09Å; E597-R601 PolarHBondContact O-N 3.43Å
598	P	93.3	Very high	94.8	Very high	89 Å²	89	48.7 Å²	48.7	58%	0.578	24%	0.243	S	C	*	.	H	α-helix	trans	-52.9	-36.7	-171.8	-29.6	36.2	0	0	0	115.3	K602	P598-K602 WeakPolarHBondContact O-CG 3.23Å; P598-K602 PolarHBondContact O-N 3.47Å
599	T	92.6	Very high	94.4	Very high	110 Å²	110	55 Å²	55	68%	0.675	27%	0.267	S	S	*	.	H	α-helix	trans	-68.4	-50.5	176.5	-53.5	0	0	0	0	111.5	E597 R601 K602 I603	E597-T599 VanDerWaalsContact C-N 3.25Å; E597-T599 PolarHBondContact O-N 2.98Å; T599-R601 PolarHBondContact O-N 3.08Å; T599-K602 WeakPolarHBondContact O-CB 3.21Å; T599-K602 PolarHBondContact O-N 3.42Å; T599-I603 PolarHBondContact O-N 3.2Å
600	Q	93.7	Very high	94.2	Very high	16 Å²	16	59.7 Å²	59.7	8%	0.075	30%	0.297	C	S	.	.	H	α-helix	trans	-66.6	-38.9	179.6	-174	171.4	56	0	0	112	A559 I562 D563 E597 K602 I603 V604	A559-Q600 VanDerWaalsContact CA-NE2 3.34Å; A559-Q600 PolarHBondContact O-NE2 3.05Å; I562-Q600 HydrophobicContact CB-CG 4.41Å; I562-Q600 VanDerWaalsContact CG2-CD 3.49Å; I562-Q600 HydrophobicContact CG2-CG 3.72Å; D563-Q600 PolarHBondContact OD1-NE2 2.95Å; D563-Q600 PolarHBondContact OD2-NE2 3.12Å; E597-Q600 PolarHBondContact O-N 3.29Å; Q600-K602 VanDerWaalsContact C-N 3.27Å; Q600-K602 PolarHBondContact O-N 3.23Å; Q600-I603 WeakPolarHBondContact O-CA 3.44Å; Q600-I603 WeakPolarHBondContact O-CB 3.42Å; Q600-I603 PolarHBondContact O-N 3.38Å; Q600-V604 PolarHBondContact O-N 3.49Å
601	R	94	Very high	94	Very high	42 Å²	42	60.2 Å²	60.2	16%	0.158	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-38.9	174.6	-164.9	-172.8	-69.8	132.9	1.1	111.3	I593 D594 A596 E597 T599 I603 V604 M605 Y631	I593-R601 PolarHBondContact O-NE 3.17Å; D594-R601 PolarHBondContact O-NH2 2.93Å; A596-R601 HydrophobicContact CB-CB 3.86Å; A596-R601 HydrophobicContact CB-CG 4.37Å; A596-R601 VanDerWaalsContact O-CZ 3.23Å; A596-R601 PolarHBondContact O-NH2 2.98Å; E597-R601 WeakPolarHBondContact O-CB 3.09Å; E597-R601 PolarHBondContact O-N 3.43Å; T599-R601 PolarHBondContact O-N 3.08Å; R601-I603 VanDerWaalsContact C-N 3.3Å; R601-I603 PolarHBondContact O-N 2.76Å; R601-V604 PolarHBondContact O-N 2.82Å; R601-M605 HydrophobicContact CG-CE 4.02Å; R601-M605 HydrophobicContact CG-CG 4.39Å; R601-M605 WeakPolarHBondContact O-CB 3.43Å; R601-M605 WeakPolarHBondContact O-CG 3.35Å; R601-M605 PolarHBondContact O-N 2.89Å; R601-Y631 VanDerWaalsContact CD-CE2 3.41Å; R601-Y631 VanDerWaalsContact CD-CZ 3.41Å; R601-Y631 VanDerWaalsContact CD-OH 3.26Å; R601-Y631 WeakPolarHBondContact CD-OH 3.36Å; R601-Y631 PolarHBondContact NH1-OH 2.85Å
602	K	91.9	Very high	93.7	Very high	160 Å²	160	58.4 Å²	58.4	70%	0.696	29%	0.292	S	S	*	.	H	α-helix	trans	-60.2	-38	173.4	-74.1	171.3	-179.7	-179	0	112.3	P598 T599 Q600 H606	P598-K602 WeakPolarHBondContact O-CG 3.23Å; P598-K602 PolarHBondContact O-N 3.47Å; T599-K602 WeakPolarHBondContact O-CB 3.21Å; T599-K602 PolarHBondContact O-N 3.42Å; Q600-K602 VanDerWaalsContact C-N 3.27Å; Q600-K602 PolarHBondContact O-N 3.23Å; K602-H606 WeakPolarHBondContact O-CB 3.23Å; K602-H606 PolarHBondContact O-N 3.01Å
603	I	92.4	Very high	93.4	Very high	77 Å²	77	63.8 Å²	63.8	40%	0.395	32%	0.318	S	S	.	.	H	α-helix	trans	-65.3	-48.8	176.4	-57.9	171.8	0	0	0	110.3	C566 T599 Q600 R601 M605 H606 K607	C566-I603 HydrophobicContact CB-CG2 4.48Å; T599-I603 PolarHBondContact O-N 3.2Å; Q600-I603 WeakPolarHBondContact O-CA 3.44Å; Q600-I603 WeakPolarHBondContact O-CB 3.42Å; Q600-I603 PolarHBondContact O-N 3.38Å; R601-I603 VanDerWaalsContact C-N 3.3Å; R601-I603 PolarHBondContact O-N 2.76Å; I603-M605 PolarHBondContact O-N 3.25Å; I603-H606 PolarHBondContact O-N 3.34Å; I603-K607 WeakPolarHBondContact O-CG 3.31Å; I603-K607 PolarHBondContact O-N 3.13Å
604	V	93.6	Very high	93.2	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.012	33%	0.333	C	S	.	.	H	α-helix	trans	-54.7	-52.5	174.4	177.9	0	0	0	0	110.3	I562 L576 I593 Q600 R601 H606 K607 I608	I562-V604 HydrophobicContact CG2-CG2 3.69Å; L576-V604 HydrophobicContact CD2-CG1 4.41Å; I593-V604 HydrophobicContact CG1-CG1 4.01Å; Q600-V604 PolarHBondContact O-N 3.49Å; R601-V604 PolarHBondContact O-N 2.82Å; V604-H606 VanDerWaalsContact C-N 3.33Å; V604-H606 PolarHBondContact O-N 2.75Å; V604-K607 PolarHBondContact O-N 2.74Å; V604-K607 VanDerWaalsContact O-N 3.13Å; V604-I608 HydrophobicContact CG1-CD1 3.85Å; V604-I608 HydrophobicContact CG1-CG1 4.47Å; V604-I608 WeakPolarHBondContact O-CG1 3.31Å; V604-I608 PolarHBondContact O-N 2.91Å
605	M	91.9	Very high	93.1	Very high	20 Å²	20	62.9 Å²	62.9	10%	0.099	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-42	179.4	-66.3	-67.6	177.2	0	0	112.6	I593 R601 I603 K607 I608 R609 L628 Y631	I593-M605 HydrophobicContact CG1-CE 4.42Å; I593-M605 HydrophobicContact CG2-CE 3.62Å; R601-M605 HydrophobicContact CG-CE 4.02Å; R601-M605 HydrophobicContact CG-CG 4.39Å; R601-M605 WeakPolarHBondContact O-CB 3.43Å; R601-M605 WeakPolarHBondContact O-CG 3.35Å; R601-M605 PolarHBondContact O-N 2.89Å; I603-M605 PolarHBondContact O-N 3.25Å; M605-K607 VanDerWaalsContact C-N 3.35Å; M605-K607 PolarHBondContact O-N 3.46Å; M605-I608 PolarHBondContact O-N 2.79Å; M605-R609 PolarHBondContact O-N 3.17Å; M605-L628 HydrophobicContact CE-CD2 3.59Å; M605-L628 HydrophobicContact SD-CD2 3.3Å; M605-L628 WeakPolarHBondContact SD-CD2 3.45Å; M605-Y631 HydrophobicContact CE-CD1 4.01Å; M605-Y631 HydrophobicContact CE-CE1 4.28Å; M605-Y631 HydrophobicContact CE-CG 4.17Å
606	H	92	Very high	92.9	Very high	143 Å²	143	67.2 Å²	67.2	66%	0.662	33%	0.327	S	S	*	.	H	α-helix	trans	-62.9	-40.8	177.2	-177.7	87.1	0	0	0	111.8	K602 I603 V604 P610	K602-H606 WeakPolarHBondContact O-CB 3.23Å; K602-H606 PolarHBondContact O-N 3.01Å; I603-H606 PolarHBondContact O-N 3.34Å; V604-H606 VanDerWaalsContact C-N 3.33Å; V604-H606 PolarHBondContact O-N 2.75Å; H606-P610 VanDerWaalsContact O-CD 3.28Å; H606-P610 WeakPolarHBondContact O-CD 3.21Å
607	K	92.3	Very high	92.8	Very high	83 Å²	83	75.4 Å²	75.4	36%	0.361	36%	0.363	S	S	.	.	H	α-helix	trans	-68.5	-30	175.4	-69.1	-92.8	178.9	155.5	0	112.9	C566 L576 I603 V604 M605 H611	C566-K607 VanDerWaalsContact O-CE 3.23Å; C566-K607 WeakPolarHBondContact O-CE 2.93Å; C566-K607 PolarHBondContact O-NZ 3.45Å; L576-K607 HydrophobicContact CD2-CB 3.6Å; I603-K607 WeakPolarHBondContact O-CG 3.31Å; I603-K607 PolarHBondContact O-N 3.13Å; V604-K607 PolarHBondContact O-N 2.74Å; V604-K607 VanDerWaalsContact O-N 3.13Å; M605-K607 VanDerWaalsContact C-N 3.35Å; M605-K607 PolarHBondContact O-N 3.46Å; K607-H611 PolarHBondContact O-CD2 3.02Å; K607-H611 VanDerWaalsContact O-CD2 3.31Å
608	I	93.8	Very high	92.8	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-77.5	-36.3	177.1	-61.3	175.5	0	0	0	112.1	L576 M580 V589 I593 V604 M605 P610 H611 L615 I624 L628	L576-I608 HydrophobicContact CD2-CD1 4.48Å; L576-I608 HydrophobicContact CD2-CG1 3.76Å; L576-I608 HydrophobicContact CG-CG1 4.33Å; M580-I608 HydrophobicContact CE-CB 4.45Å; M580-I608 HydrophobicContact CE-CG1 4.09Å; M580-I608 HydrophobicContact CE-CG2 4.25Å; M580-I608 HydrophobicContact SD-CB 4.11Å; M580-I608 HydrophobicContact SD-CD1 3.9Å; M580-I608 HydrophobicContact SD-CG1 3.57Å; M580-I608 VanDerWaalsContact SD-CG1 3.57Å; M580-I608 HydrophobicContact SD-CG2 3.62Å; V589-I608 HydrophobicContact CG1-CD1 4.31Å; I593-I608 HydrophobicContact CD1-CD1 3.9Å; V604-I608 HydrophobicContact CG1-CD1 3.85Å; V604-I608 HydrophobicContact CG1-CG1 4.47Å; V604-I608 WeakPolarHBondContact O-CG1 3.31Å; V604-I608 PolarHBondContact O-N 2.91Å; M605-I608 PolarHBondContact O-N 2.79Å; I608-P610 VanDerWaalsContact C-CD 3.48Å; I608-H611 PolarHBondContact O-N 3.01Å; I608-L615 HydrophobicContact CG2-CD1 4.06Å; I608-I624 HydrophobicContact CD1-CG2 4.35Å; I608-I624 HydrophobicContact CG2-CG2 4.47Å; I608-L628 HydrophobicContact CG2-CD1 3.89Å
609	R	91.6	Very high	92.9	Very high	133 Å²	133	76.3 Å²	76.3	50%	0.502	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-50.6	-44.6	-170.1	-168.4	177.9	-173.8	168.7	4.3	115.2	M605 H611 I612 G640	M605-R609 PolarHBondContact O-N 3.17Å; R609-H611 PolarHBondContact O-N 3.32Å; R609-I612 HydrophobicContact CB-CD1 4.47Å; R609-I612 HydrophobicContact CG-CD1 4.11Å; R609-I612 WeakPolarHBondContact O-CG1 3.45Å; R609-I612 PolarHBondContact O-N 2.91Å; R609-G640 PolarHBondContact NH2-O 3.34Å
610	P	93.1	Very high	93	Very high	97 Å²	97	75.1 Å²	75.1	63%	0.63	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62	-23.1	178.3	-23.4	35	0	0	0	114	H606 I608	H606-P610 VanDerWaalsContact O-CD 3.28Å; H606-P610 WeakPolarHBondContact O-CD 3.21Å; I608-P610 VanDerWaalsContact C-CD 3.48Å
611	H	92.9	Very high	93.1	Very high	46 Å²	46	74.4 Å²	74.4	21%	0.213	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-94.4	-5.4	-174.4	-56	-62.3	0	0	0	113.7	Y577 M580 K607 I608 R609 Q613 T614 L615	Y577-H611 HydrophobicContact CD2-CB 3.93Å; Y577-H611 AromaticContact CD2-CD2 3.91Å; Y577-H611 AromaticContact CD2-CE1 3.76Å; Y577-H611 AromaticContact CD2-CG 3.47Å; Y577-H611 VanDerWaalsContact CD2-CG 3.47Å; Y577-H611 AromaticContact CD2-ND1 3.38Å; Y577-H611 WeakPolarHBondContact CD2-ND1 3.41Å; Y577-H611 HydrophobicContact CE2-CB 4.21Å; Y577-H611 AromaticContact CE2-CG 4Å; Y577-H611 AromaticContact CE2-ND1 3.66Å; M580-H611 HydrophobicContact CE-CB 4.36Å; K607-H611 PolarHBondContact O-CD2 3.02Å; K607-H611 VanDerWaalsContact O-CD2 3.31Å; I608-H611 PolarHBondContact O-N 3.01Å; R609-H611 PolarHBondContact O-N 3.32Å; H611-Q613 PolarHBondContact O-N 3.47Å; H611-T614 CarbonylContact O-C 3.51Å; H611-T614 WeakPolarHBondContact O-CA 3.34Å; H611-T614 WeakPolarHBondContact O-CB 3.43Å; H611-T614 PolarHBondContact O-N 2.94Å; H611-L615 HydrophobicContact CB-CD1 4.15Å; H611-L615 HydrophobicContact CB-CG 4.17Å; H611-L615 WeakPolarHBondContact O-CG 3.37Å; H611-L615 PolarHBondContact O-N 2.97Å
612	I	92	Very high	93	Very high	23 Å²	23	77.4 Å²	77.4	12%	0.118	36%	0.357	C	S	.	.	H	α-helix	trans	-50.4	-52.2	-173.1	-72.8	171.7	0	0	0	112.8	R609 T614 L615 R616 L625 I642	R609-I612 HydrophobicContact CB-CD1 4.47Å; R609-I612 HydrophobicContact CG-CD1 4.11Å; R609-I612 WeakPolarHBondContact O-CG1 3.45Å; R609-I612 PolarHBondContact O-N 2.91Å; I612-T614 PolarHBondContact O-N 3.4Å; I612-L615 PolarHBondContact O-N 3.47Å; I612-R616 PolarHBondContact O-N 3.27Å; I612-L625 HydrophobicContact CB-CD2 4.27Å; I612-L625 HydrophobicContact CG1-CD2 4.1Å; I612-L625 HydrophobicContact CG2-CD2 4.05Å; I612-I642 HydrophobicContact CG2-CG2 4.46Å
613	Q	91.7	Very high	93.2	Very high	118 Å²	118	73.5 Å²	73.5	55%	0.551	34%	0.341	S	S	*	.	H	α-helix	trans	-68.4	-25.4	-177.8	-174.4	61.5	4	0	0	112.8	H611	H611-Q613 PolarHBondContact O-N 3.47Å
614	T	91.1	Very high	93.3	Very high	53 Å²	53	69.8 Å²	69.8	33%	0.325	32%	0.322	S	S	.	.	H	α-helix	trans	-79.7	-40.8	176.6	-65.7	0	0	0	0	111.3	Y577 H611 I612 R616 K617 Y618	Y577-T614 HydrophobicContact CE2-CG2 4.05Å; Y577-T614 WeakPolarHBondContact OH-CG2 3.3Å; H611-T614 CarbonylContact O-C 3.51Å; H611-T614 WeakPolarHBondContact O-CA 3.34Å; H611-T614 WeakPolarHBondContact O-CB 3.43Å; H611-T614 PolarHBondContact O-N 2.94Å; I612-T614 PolarHBondContact O-N 3.4Å; T614-R616 VanDerWaalsContact C-N 3.25Å; T614-R616 PolarHBondContact O-N 3.06Å; T614-K617 WeakPolarHBondContact O-CB 3Å; T614-K617 PolarHBondContact O-N 2.94Å; T614-Y618 HydrophobicContact CG2-CD2 4.35Å; T614-Y618 HydrophobicContact CG2-CE2 3.71Å; T614-Y618 VanDerWaalsContact O-CD2 3.32Å; T614-Y618 WeakPolarHBondContact O-CD2 3.45Å
615	L	93.6	Very high	93.3	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-30.7	178.1	-71.2	169.5	0	0	0	113	M580 K581 I608 H611 I612 K617 Y618 G621 K622 L625	M580-L615 HydrophobicContact CB-CD2 3.75Å; M580-L615 HydrophobicContact CE-CD1 4.02Å; M580-L615 HydrophobicContact CE-CD2 4.36Å; M580-L615 HydrophobicContact SD-CD1 3.64Å; M580-L615 HydrophobicContact SD-CD2 4.31Å; K581-L615 HydrophobicContact CG-CD2 4.31Å; I608-L615 HydrophobicContact CG2-CD1 4.06Å; H611-L615 HydrophobicContact CB-CD1 4.15Å; H611-L615 HydrophobicContact CB-CG 4.17Å; H611-L615 WeakPolarHBondContact O-CG 3.37Å; H611-L615 PolarHBondContact O-N 2.97Å; I612-L615 PolarHBondContact O-N 3.47Å; L615-K617 PolarHBondContact O-N 3.17Å; L615-K617 VanDerWaalsContact O-N 3.13Å; L615-Y618 PolarHBondContact O-N 3.41Å; L615-Y618 VanDerWaalsContact O-N 3.08Å; L615-G621 CarbonylContact O-C 3.06Å; L615-K622 PolarHBondContact O-N 3.21Å; L615-L625 HydrophobicContact CB-CD1 4.08Å; L615-L625 HydrophobicContact CB-CD2 4.16Å; L615-L625 HydrophobicContact CB-CG 4.13Å; L615-L625 HydrophobicContact CD1-CD2 4.11Å
616	R	93.4	Very high	93.3	Very high	128 Å²	128	71.2 Å²	71.2	48%	0.483	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.4	172.5	-71.5	-178.4	169.9	165.8	-9.2	113.5	I612 T614 L625	I612-R616 PolarHBondContact O-N 3.27Å; T614-R616 VanDerWaalsContact C-N 3.25Å; T614-R616 PolarHBondContact O-N 3.06Å; R616-L625 HydrophobicContact CB-CD1 4.23Å; R616-L625 HydrophobicContact CG-CD1 3.3Å
617	K	93.8	Very high	93.3	Very high	174 Å²	174	66.7 Å²	66.7	76%	0.757	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-9.1	-178.8	-56	-176.7	-179.6	-177.9	0	113.7	T614 L615	T614-K617 WeakPolarHBondContact O-CB 3Å; T614-K617 PolarHBondContact O-N 2.94Å; L615-K617 PolarHBondContact O-N 3.17Å; L615-K617 VanDerWaalsContact O-N 3.13Å
618	Y	93.9	Very high	93.2	Very high	84 Å²	84	63.1 Å²	63.1	33%	0.329	30%	0.299	S	S	.	.	S	Bend	trans	-104.8	137.5	-177	-72.1	-79.6	0	0	0	112	K581 T614 L615 Y620 G621 K622	K581-Y618 HydrophobicContact CD-CD1 4.25Å; K581-Y618 HydrophobicContact CD-CD2 4.01Å; K581-Y618 HydrophobicContact CD-CE1 4.02Å; K581-Y618 HydrophobicContact CD-CE2 3.76Å; K581-Y618 HydrophobicContact CD-CG 4.24Å; K581-Y618 VanDerWaalsContact CE-CZ 3.41Å; K581-Y618 HydrophobicContact CG-CD1 4.16Å; K581-Y618 HydrophobicContact CG-CD2 3.92Å; K581-Y618 HydrophobicContact CG-CE1 4.44Å; K581-Y618 HydrophobicContact CG-CE2 4.21Å; K581-Y618 HydrophobicContact CG-CG 3.88Å; K581-Y618 PolarHBondContact NZ-OH 3.47Å; T614-Y618 HydrophobicContact CG2-CD2 4.35Å; T614-Y618 HydrophobicContact CG2-CE2 3.71Å; T614-Y618 VanDerWaalsContact O-CD2 3.32Å; T614-Y618 WeakPolarHBondContact O-CD2 3.45Å; L615-Y618 PolarHBondContact O-N 3.41Å; L615-Y618 VanDerWaalsContact O-N 3.08Å; Y618-Y620 VanDerWaalsContact C-N 3.27Å; Y618-Y620 PolarHBondContact O-N 2.76Å; Y618-G621 PolarHBondContact O-N 3.31Å; Y618-K622 PolarHBondContact O-N 3.38Å
619	T	94.9	Very high	92.9	Very high	94 Å²	94	68 Å²	68	58%	0.577	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-44	-178.6	-52	0	0	0	0	112.8	K622	T619-K622 WeakPolarHBondContact O-CD 3.35Å; T619-K622 WeakPolarHBondContact O-CE 3.47Å; T619-K622 WeakPolarHBondContact O-CG 3.28Å
620	Y	95.9	Very high	92.6	Very high	85 Å²	85	69 Å²	69	33%	0.333	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-32.7	-179.2	-52	-72.8	0	0	0	112.8	K581 D582 Q583 Y618 K622 H623	K581-Y620 WeakPolarHBondContact O-CD2 3.49Å; D582-Y620 WeakPolarHBondContact O-CB 3.43Å; Q583-Y620 HydrophobicContact CB-CD1 4.27Å; Q583-Y620 HydrophobicContact CB-CD2 4.16Å; Q583-Y620 HydrophobicContact CB-CE1 3.75Å; Q583-Y620 HydrophobicContact CB-CE2 3.63Å; Q583-Y620 HydrophobicContact CB-CG 4.45Å; Y618-Y620 VanDerWaalsContact C-N 3.27Å; Y618-Y620 PolarHBondContact O-N 2.76Å; Y620-K622 PolarHBondContact O-N 3.16Å; Y620-K622 VanDerWaalsContact O-N 3.17Å; Y620-H623 WeakPolarHBondContact O-CB 3.31Å; Y620-H623 PolarHBondContact O-N 3.01Å
621	G	94.2	Very high	92.1	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.8	-31.6	-180	0	0	0	0	0	114.4	M580 L615 Y618 H623 I624 L625	M580-G621 VanDerWaalsContact O-CA 3.26Å; M580-G621 WeakPolarHBondContact O-CA 3.47Å; M580-G621 PolarHBondContact O-N 2.98Å; L615-G621 CarbonylContact O-C 3.06Å; Y618-G621 PolarHBondContact O-N 3.31Å; G621-H623 PolarHBondContact O-N 3.03Å; G621-I624 WeakPolarHBondContact O-CB 3.36Å; G621-I624 PolarHBondContact O-N 3Å; G621-L625 PolarHBondContact O-N 3.05Å
622	K	93.8	Very high	91.4	Very high	105 Å²	105	66.5 Å²	66.5	46%	0.457	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-27.6	174	74.3	-167.8	-174.8	-172.9	0	113.7	L615 Y618 T619 Y620 L625 A626	L615-K622 PolarHBondContact O-N 3.21Å; Y618-K622 PolarHBondContact O-N 3.38Å; T619-K622 WeakPolarHBondContact O-CD 3.35Å; T619-K622 WeakPolarHBondContact O-CE 3.47Å; T619-K622 WeakPolarHBondContact O-CG 3.28Å; Y620-K622 PolarHBondContact O-N 3.16Å; Y620-K622 VanDerWaalsContact O-N 3.17Å; K622-L625 PolarHBondContact O-N 2.78Å; K622-A626 PolarHBondContact O-N 3.5Å; K622-A626 VanDerWaalsContact O-N 3.13Å
623	H	94.4	Very high	90.5	Very high	78 Å²	78	73.4 Å²	73.4	36%	0.361	34%	0.34	S	S	.	.	H	α-helix	trans	-72	-33.5	178.2	-61.8	-58.9	0	0	0	112	Y620 G621 L625 A626 K627	Y620-H623 WeakPolarHBondContact O-CB 3.31Å; Y620-H623 PolarHBondContact O-N 3.01Å; G621-H623 PolarHBondContact O-N 3.03Å; H623-L625 VanDerWaalsContact C-N 3.31Å; H623-L625 PolarHBondContact O-N 3.45Å; H623-A626 PolarHBondContact O-N 3.4Å; H623-K627 WeakPolarHBondContact O-CB 3.39Å; H623-K627 PolarHBondContact O-N 2.91Å
624	I	95.5	Very high	89.5	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-44.5	170.7	-51.1	-57.6	0	0	0	110.2	M580 N586 V589 Q590 I608 G621 K627 L628	M580-I624 HydrophobicContact CB-CG1 3.98Å; M580-I624 HydrophobicContact CG-CD1 4.31Å; M580-I624 HydrophobicContact CG-CG1 3.91Å; M580-I624 HydrophobicContact CG-CG2 4.31Å; M580-I624 HydrophobicContact SD-CG1 4.45Å; M580-I624 HydrophobicContact SD-CG2 3.91Å; N586-I624 HydrophobicContact CB-CD1 3.96Å; N586-I624 WeakPolarHBondContact O-CD1 3.37Å; V589-I624 HydrophobicContact CB-CD1 4.12Å; V589-I624 HydrophobicContact CG1-CD1 4.15Å; Q590-I624 HydrophobicContact CG-CD1 3.82Å; I608-I624 HydrophobicContact CD1-CG2 4.35Å; I608-I624 HydrophobicContact CG2-CG2 4.47Å; G621-I624 WeakPolarHBondContact O-CB 3.36Å; G621-I624 PolarHBondContact O-N 3Å; I624-K627 WeakPolarHBondContact O-CB 3.07Å; I624-K627 PolarHBondContact O-N 3.24Å; I624-K627 VanDerWaalsContact O-N 3.15Å; I624-L628 HydrophobicContact CG2-CG 4.46Å; I624-L628 WeakPolarHBondContact O-CG 3.41Å; I624-L628 PolarHBondContact O-N 2.93Å
625	L	92.4	Very high	88.3	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.068	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-45.8	179.7	-56.8	-178.6	0	0	0	112.1	I612 L615 R616 G621 K622 H623 K627 L628 E629	I612-L625 HydrophobicContact CB-CD2 4.27Å; I612-L625 HydrophobicContact CG1-CD2 4.1Å; I612-L625 HydrophobicContact CG2-CD2 4.05Å; L615-L625 HydrophobicContact CB-CD1 4.08Å; L615-L625 HydrophobicContact CB-CD2 4.16Å; L615-L625 HydrophobicContact CB-CG 4.13Å; L615-L625 HydrophobicContact CD1-CD2 4.11Å; R616-L625 HydrophobicContact CB-CD1 4.23Å; R616-L625 HydrophobicContact CG-CD1 3.3Å; G621-L625 PolarHBondContact O-N 3.05Å; K622-L625 PolarHBondContact O-N 2.78Å; H623-L625 VanDerWaalsContact C-N 3.31Å; H623-L625 PolarHBondContact O-N 3.45Å; L625-K627 PolarHBondContact O-N 3.01Å; L625-L628 WeakPolarHBondContact O-CB 3.5Å; L625-L628 PolarHBondContact O-N 2.89Å; L625-L628 VanDerWaalsContact O-N 3.09Å; L625-E629 WeakPolarHBondContact O-CG 3.34Å; L625-E629 PolarHBondContact O-N 3.33Å
626	A	92.6	Very high	86.6	Confident	38 Å²	38	81.1 Å²	81.1	31%	0.314	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-30.3	174.9	0	0	0	0	0	113	K622 H623 K630	K622-A626 PolarHBondContact O-N 3.5Å; K622-A626 VanDerWaalsContact O-N 3.13Å; H623-A626 PolarHBondContact O-N 3.4Å; A626-K630 VanDerWaalsContact O-CG 3.31Å; A626-K630 WeakPolarHBondContact O-CG 3.46Å; A626-K630 PolarHBondContact O-N 3.25Å
627	K	92.4	Very high	84.8	Confident	48 Å²	48	78.7 Å²	78.7	21%	0.209	39%	0.391	C	S	.	.	H	α-helix	trans	-69.5	-43.7	171.8	-176.1	75.3	174.3	-170.7	0	111.5	Q590 D594 H623 I624 L625 K630 Y631	Q590-K627 HydrophobicContact CB-CD 4.31Å; Q590-K627 HydrophobicContact CB-CG 4.26Å; Q590-K627 HydrophobicContact CG-CB 4.05Å; Q590-K627 HydrophobicContact CG-CD 4.3Å; Q590-K627 HydrophobicContact CG-CG 3.94Å; D594-K627 WeakPolarHBondContact OD1-CE 3.28Å; D594-K627 IonicContact OD1-NZ 3.85Å; D594-K627 PolarHBondContact OD1-NZ 2.79Å; D594-K627 IonicContact OD2-NZ 2.94Å; D594-K627 PolarHBondContact OD2-NZ 3.33Å; H623-K627 WeakPolarHBondContact O-CB 3.39Å; H623-K627 PolarHBondContact O-N 2.91Å; I624-K627 WeakPolarHBondContact O-CB 3.07Å; I624-K627 PolarHBondContact O-N 3.24Å; I624-K627 VanDerWaalsContact O-N 3.15Å; L625-K627 PolarHBondContact O-N 3.01Å; K627-K630 PolarHBondContact O-N 3.32Å; K627-Y631 PolarHBondContact O-N 2.82Å
628	L	89.3	Confident	82.5	Confident	9 Å²	9	77.2 Å²	77.2	5%	0.047	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-49.6	177.2	-69.1	-168.9	0	0	0	111.7	I593 M605 I608 I624 L625 K630 Y631 Y632	I593-L628 HydrophobicContact CD1-CD2 3.99Å; M605-L628 HydrophobicContact CE-CD2 3.59Å; M605-L628 HydrophobicContact SD-CD2 3.3Å; M605-L628 WeakPolarHBondContact SD-CD2 3.45Å; I608-L628 HydrophobicContact CG2-CD1 3.89Å; I624-L628 HydrophobicContact CG2-CG 4.46Å; I624-L628 WeakPolarHBondContact O-CG 3.41Å; I624-L628 PolarHBondContact O-N 2.93Å; L625-L628 WeakPolarHBondContact O-CB 3.5Å; L625-L628 PolarHBondContact O-N 2.89Å; L625-L628 VanDerWaalsContact O-N 3.09Å; L628-K630 VanDerWaalsContact C-N 3.31Å; L628-K630 PolarHBondContact O-N 3.49Å; L628-Y631 WeakPolarHBondContact O-CA 3.32Å; L628-Y631 WeakPolarHBondContact O-CB 3.33Å; L628-Y631 PolarHBondContact O-N 3.25Å; L628-Y632 HydrophobicContact CB-CD2 4.33Å; L628-Y632 HydrophobicContact CB-CE2 4.03Å; L628-Y632 WeakPolarHBondContact O-CD2 3.12Å; L628-Y632 PolarHBondContact O-N 3.28Å
629	E	88.2	Confident	80.3	Confident	103 Å²	103	74.6 Å²	74.6	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-53.1	-48.3	177.2	-72.3	166.9	-178.4	0	0	111.2	L625 Y631 Y632 M633	L625-E629 WeakPolarHBondContact O-CG 3.34Å; L625-E629 PolarHBondContact O-N 3.33Å; E629-Y631 VanDerWaalsContact C-N 3.34Å; E629-Y631 PolarHBondContact O-N 3.25Å; E629-Y632 PolarHBondContact O-N 3.35Å; E629-M633 VanDerWaalsContact O-CG 3.31Å; E629-M633 WeakPolarHBondContact O-CG 3.26Å; E629-M633 PolarHBondContact O-N 3.14Å
630	K	86.2	Confident	78.2	Confident	153 Å²	153	71.5 Å²	71.5	67%	0.665	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-38.7	174.4	-72.1	174.7	-178.1	-178.3	0	113.3	A626 K627 L628 K634	A626-K630 VanDerWaalsContact O-CG 3.31Å; A626-K630 WeakPolarHBondContact O-CG 3.46Å; A626-K630 PolarHBondContact O-N 3.25Å; K627-K630 PolarHBondContact O-N 3.32Å; L628-K630 VanDerWaalsContact C-N 3.31Å; L628-K630 PolarHBondContact O-N 3.49Å; K630-K634 VanDerWaalsContact O-CB 3.28Å; K630-K634 WeakPolarHBondContact O-CB 3.21Å; K630-K634 PolarHBondContact O-N 3.02Å
631	Y	80.9	Confident	75.7	Confident	49 Å²	49	72.9 Å²	72.9	19%	0.192	39%	0.389	C	S	.	.	H	α-helix	trans	-64.2	-43.3	176.4	-179.8	-84.2	0	0	0	111.5	R601 M605 K627 L628 E629 K634 N635	R601-Y631 VanDerWaalsContact CD-CE2 3.41Å; R601-Y631 VanDerWaalsContact CD-CZ 3.41Å; R601-Y631 VanDerWaalsContact CD-OH 3.26Å; R601-Y631 WeakPolarHBondContact CD-OH 3.36Å; R601-Y631 PolarHBondContact NH1-OH 2.85Å; M605-Y631 HydrophobicContact CE-CD1 4.01Å; M605-Y631 HydrophobicContact CE-CE1 4.28Å; M605-Y631 HydrophobicContact CE-CG 4.17Å; K627-Y631 PolarHBondContact O-N 2.82Å; L628-Y631 WeakPolarHBondContact O-CA 3.32Å; L628-Y631 WeakPolarHBondContact O-CB 3.33Å; L628-Y631 PolarHBondContact O-N 3.25Å; E629-Y631 VanDerWaalsContact C-N 3.34Å; E629-Y631 PolarHBondContact O-N 3.25Å; Y631-K634 PolarHBondContact O-N 2.94Å; Y631-N635 VanDerWaalsContact CD2-ND2 3.33Å; Y631-N635 WeakPolarHBondContact CD2-ND2 3.43Å; Y631-N635 HydrophobicContact CE1-CB 4.43Å; Y631-N635 WeakPolarHBondContact CE2-ND2 3.37Å; Y631-N635 VanDerWaalsContact CZ-ND2 3.32Å; Y631-N635 WeakPolarHBondContact O-CB 3.39Å; Y631-N635 PolarHBondContact O-N 2.78Å; Y631-N635 VanDerWaalsContact O-N 3.14Å; Y631-N635 PolarHBondContact O-ND2 3.5Å
632	Y	78.8	Confident	73.7	Confident	41 Å²	41	77 Å²	77	16%	0.161	41%	0.41	C	S	.	.	H	α-helix	trans	-70.3	-44.3	179.8	-67.3	-63.2	0	0	0	112	L628 E629 K634 N635 G636 V637 L639	L628-Y632 HydrophobicContact CB-CD2 4.33Å; L628-Y632 HydrophobicContact CB-CE2 4.03Å; L628-Y632 WeakPolarHBondContact O-CD2 3.12Å; L628-Y632 PolarHBondContact O-N 3.28Å; E629-Y632 PolarHBondContact O-N 3.35Å; Y632-K634 VanDerWaalsContact C-N 3.28Å; Y632-K634 PolarHBondContact O-N 2.7Å; Y632-N635 PolarHBondContact O-N 3.23Å; Y632-G636 PolarHBondContact O-N 3.37Å; Y632-V637 HydrophobicContact CD1-CB 4.08Å; Y632-V637 HydrophobicContact CD1-CG1 4.44Å; Y632-V637 WeakPolarHBondContact CD1-O 3.16Å; Y632-V637 HydrophobicContact CE1-CB 4.43Å; Y632-V637 HydrophobicContact CE1-CG1 4.35Å; Y632-L639 HydrophobicContact CD1-CG 4.2Å; Y632-L639 HydrophobicContact CD2-CD1 3.53Å; Y632-L639 HydrophobicContact CD2-CG 3.97Å; Y632-L639 HydrophobicContact CE1-CD1 4.36Å; Y632-L639 HydrophobicContact CE1-CD2 4.43Å; Y632-L639 HydrophobicContact CE1-CG 3.84Å; Y632-L639 HydrophobicContact CE2-CD1 3.2Å; Y632-L639 HydrophobicContact CE2-CD2 4.38Å; Y632-L639 HydrophobicContact CE2-CG 3.63Å; Y632-L639 HydrophobicContact CG-CD1 4.27Å; Y632-L639 HydrophobicContact CG-CG 4.25Å
633	M	73.4	Confident	71.2	Confident	169 Å²	169	77.1 Å²	77.1	83%	0.833	42%	0.424	S	S	*	.	H	α-helix	trans	-58.8	-37.3	174.3	-68.6	-178.7	83.1	0	0	112.8	E629	E629-M633 VanDerWaalsContact O-CG 3.31Å; E629-M633 WeakPolarHBondContact O-CG 3.26Å; E629-M633 PolarHBondContact O-N 3.14Å
634	K	71.8	Confident	68.7	Low	178 Å²	178	76.2 Å²	76.2	77%	0.774	44%	0.435	S	S	*	.	H	α-helix	trans	-76	-31.3	-179.9	-173.5	173.9	-179.9	-179.2	0	113.6	K630 Y631 Y632	K630-K634 VanDerWaalsContact O-CB 3.28Å; K630-K634 WeakPolarHBondContact O-CB 3.21Å; K630-K634 PolarHBondContact O-N 3.02Å; Y631-K634 PolarHBondContact O-N 2.94Å; Y632-K634 VanDerWaalsContact C-N 3.28Å; Y632-K634 PolarHBondContact O-N 2.7Å
635	N	65.3	Low	65.9	Low	80 Å²	80	82 Å²	82	43%	0.428	47%	0.472	S	S	.	.	H	α-helix	trans	-109.8	-0.2	-169.5	-62.2	-58.5	0	0	0	114.5	Y631 Y632 V637	Y631-N635 VanDerWaalsContact CD2-ND2 3.33Å; Y631-N635 WeakPolarHBondContact CD2-ND2 3.43Å; Y631-N635 HydrophobicContact CE1-CB 4.43Å; Y631-N635 WeakPolarHBondContact CE2-ND2 3.37Å; Y631-N635 VanDerWaalsContact CZ-ND2 3.32Å; Y631-N635 WeakPolarHBondContact O-CB 3.39Å; Y631-N635 PolarHBondContact O-N 2.78Å; Y631-N635 VanDerWaalsContact O-N 3.14Å; Y631-N635 PolarHBondContact O-ND2 3.5Å; Y632-N635 PolarHBondContact O-N 3.23Å; N635-V637 HydrophobicContact CB-CG2 4.17Å; N635-V637 PolarHBondContact O-N 3.43Å; N635-V637 VanDerWaalsContact O-N 3.09Å
636	G	57.6	Low	63.3	Low	74 Å²	74	87 Å²	87	76%	0.763	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	15.9	176.7	0	0	0	0	0	114.8	Y632 D638	Y632-G636 PolarHBondContact O-N 3.37Å; G636-D638 PolarHBondContact O-N 3.45Å
637	V	56.3	Low	61	Low	77 Å²	77	93.3 Å²	93.3	47%	0.467	53%	0.534	S	S	.	.			trans	-85.5	110.8	179.3	-176.2	0	0	0	0	107.8	Y632 N635 L639	Y632-V637 HydrophobicContact CD1-CB 4.08Å; Y632-V637 HydrophobicContact CD1-CG1 4.44Å; Y632-V637 WeakPolarHBondContact CD1-O 3.16Å; Y632-V637 HydrophobicContact CE1-CB 4.43Å; Y632-V637 HydrophobicContact CE1-CG1 4.35Å; N635-V637 HydrophobicContact CB-CG2 4.17Å; N635-V637 PolarHBondContact O-N 3.43Å; N635-V637 VanDerWaalsContact O-N 3.09Å; V637-L639 PolarHBondContact O-N 3.18Å
638	D	44.8	Very low	58.6	Low	144 Å²	144	94.5 Å²	94.5	77%	0.77	56%	0.56	S	S	*	*			trans	-69.6	122.7	-178.1	-168.8	16.5	0	0	0	111.4	G636 G640	G636-D638 PolarHBondContact O-N 3.45Å; D638-G640 VanDerWaalsContact C-N 3.34Å; D638-G640 PolarHBondContact O-N 3.34Å
639	L	47.2	Very low	56.2	Low	29 Å²	29	101.6 Å²	101.6	15%	0.152	60%	0.597	C	S	.	*			trans	-80.6	90.2	162.7	-97.3	-179.2	0	0	0	107.5	Y632 V637 I642	Y632-L639 HydrophobicContact CD1-CG 4.2Å; Y632-L639 HydrophobicContact CD2-CD1 3.53Å; Y632-L639 HydrophobicContact CD2-CG 3.97Å; Y632-L639 HydrophobicContact CE1-CD1 4.36Å; Y632-L639 HydrophobicContact CE1-CD2 4.43Å; Y632-L639 HydrophobicContact CE1-CG 3.84Å; Y632-L639 HydrophobicContact CE2-CD1 3.2Å; Y632-L639 HydrophobicContact CE2-CD2 4.38Å; Y632-L639 HydrophobicContact CE2-CG 3.63Å; Y632-L639 HydrophobicContact CG-CD1 4.27Å; Y632-L639 HydrophobicContact CG-CG 4.25Å; V637-L639 PolarHBondContact O-N 3.18Å; L639-I642 HydrophobicContact CB-CD1 3.84Å; L639-I642 HydrophobicContact CB-CG1 3.74Å; L639-I642 HydrophobicContact CD1-CD1 3.59Å; L639-I642 HydrophobicContact CD1-CG1 3.9Å; L639-I642 HydrophobicContact CG-CD1 4.4Å; L639-I642 HydrophobicContact CG-CG1 4.44Å
640	G	51.8	Low	53.6	Low	29 Å²	29	109.1 Å²	109.1	30%	0.299	64%	0.635	S	S	.	*	S	Bend	trans	-44.7	140.6	164.9	0	0	0	0	0	110.3	R609 D638	R609-G640 PolarHBondContact NH2-O 3.34Å; D638-G640 VanDerWaalsContact C-N 3.34Å; D638-G640 PolarHBondContact O-N 3.34Å
641	P	42.6	Very low	52	Low	113 Å²	113	107 Å²	107	73%	0.734	63%	0.633	S	S	*	*				-45	132.9	-129.8	-0.1	-20.7	0	0	0	116.7	C643	P641-C643 PolarHBondContact O-N 3.09Å
642	I	52	Low	50.5	Low	86 Å²	86	110 Å²	110	44%	0.441	66%	0.657	S	S	.	*	S	Bend	trans	-73.5	-4.9	176.6	-56.6	-180	0	0	0	112.1	I612 L639	I612-I642 HydrophobicContact CG2-CG2 4.46Å; L639-I642 HydrophobicContact CB-CD1 3.84Å; L639-I642 HydrophobicContact CB-CG1 3.74Å; L639-I642 HydrophobicContact CD1-CD1 3.59Å; L639-I642 HydrophobicContact CD1-CG1 3.9Å; L639-I642 HydrophobicContact CG-CD1 4.4Å; L639-I642 HydrophobicContact CG-CG1 4.44Å
643	C	41.3	Very low	48.9	Very low	109 Å²	109	113.8 Å²	113.8	74%	0.736	68%	0.684	S	S	*	*	S	Bend	trans	-92.3	123.2	165.7	-69.1	0	0	0	0	110	P641	P641-C643 PolarHBondContact O-N 3.09Å
644	G	41.7	Very low	47.5	Very low	58 Å²	58	110.6 Å²	110.6	60%	0.598	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-60.8	159	155.3	0	0	0	0	0	110.1
645	P	38	Very low	45.9	Very low	121 Å²	121	106.4 Å²	106.4	79%	0.786	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.3	135.7	179.7	25.1	-33.8	0	0	0	109.8
646	P	37.5	Very low	44.6	Very low	120 Å²	120	108.1 Å²	108.1	78%	0.779	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.8	169.4	26.8	-32.9	0	0	0	109.1	G648	P646-G648 PolarHBondContact O-N 3.39Å
647	N	44	Very low	43.7	Very low	170 Å²	170	110.6 Å²	110.6	91%	0.909	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-50.1	133.9	178.2	-74.6	-22.7	0	0	0	110.5
648	G	42.3	Very low	42.8	Very low	73 Å²	73	113.2 Å²	113.2	75%	0.753	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-73.7	172.9	-158.7	0	0	0	0	0	116.1	P646	P646-G648 PolarHBondContact O-N 3.39Å
649	I	38.1	Very low	42.6	Very low	158 Å²	158	110.6 Å²	110.6	81%	0.81	69%	0.69	S	S	*	*			trans	-133.4	115.7	161	-62.3	-179.7	0	0	0	106.4
650	M	34.5	Very low	42.2	Very low	261 Å²	261	118 Å²	118	100%	1.286	74%	0.739	S	S	*	*			trans	57.3	0	179.7	-58.4	-164.2	-164.4	0	0	116.8

Retrieved 650 of 650 residues in 202.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).