A0A087YH90_POEFO Loading...

Cullin-4B

AlphaFold DB , UniProt , Accession A0A087YH90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 868 aa.

						>A0A087YH90_POEFO|A0A087YH90
MFPTGLSSPNPPPPPTQEARPAATDVKSDSGNITSPKKRKINGSERDDTSDTISSSPPKTLNSSSSSSSCSPTPPLHIQKKLRFEDSVDFIGLDVKMAEEAAAAAAAASCSNNKSKAMFLAGGVGGHHANGLTKTAGSGTFSSSKPGAAKKLVIKNFREKPKLPENYTQETWQKLKEAVEAIQNSTSIKYNLEELYQAVENLCSHKISAKLYKQLRTVCEDHIKAQIDQFRDALDSVLFLKKIDKCWQDHCRQMIMIRSIFLFLDRTYVLQNSMLPSIWDMGLELFRFYIISDLKVQSKTIDGILLLIERERNGEAIDRSLLRSLLSMLSDLQIYQDSFEQRFLEETNRLYAAEGQRLMQEREVPEYLHHVNKRLEEEADRVITYLDQSTQKPLIATMEKQLLGEHLTAILQKGLTHLLDENRIQDLSLLYQLFSRVRGGVQVLLQQWIEYIKAFGSTIVINPEKDKTMVQELLDFKDKVDHIIDICFLKNEKFVNAMKEAFETFINKRPNKPAELIAKHVDSKLRAGNKEATDEELEKMLDKIMIIFRFIYGKDVFEAFYKKDLAKRLLVGKSASVDAEKSMLSKLKHECGAAFTSKLEGMFKDMELSKDIMVQFKQYMQCQNIPGNIELTVNILTMGYWPTYVPMEVHLPPEMVRLQEIFKTFYLGKHSGRKLQWQSTLGHCVLKAEFKEKGKKELQVSLFQTLVLLMFNEGEEFTLEEIKVATGIEDSELRRTLQSLACGKARVLTKIPKSKDVEDGDKFSCNDDFKHKLFRIKINQIQMKETVEEQASTTERVFQDRQYQIDAAIVRIMKMRKTLSHNLLMSEVYNQLKFPVKPADLKKRIESLIDRDYMERDKENSNQYNYVA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	35.8	Very low	238 Å²	238	141 Å²	141	100%	1.172	84%	0.838	S	S	*	*				0	98.1	0	-79.6	174.3	169.9	0	0	106.3
2	F	27.1	Very low	36.4	Very low	207 Å²	207	139.3 Å²	139.3	91%	0.908	83%	0.833	S	S	*	*			trans	-125.6	154.9	-163.4	-85.8	-81	0	0	0	111.5
3	P	46	Very low	36.8	Very low	100 Å²	100	137.8 Å²	137.8	65%	0.649	83%	0.829	S	S	*	*			trans	-103.3	165.8	-165.2	39.6	-31.5	0	0	0	114.5
4	T	37.8	Very low	37.2	Very low	142 Å²	142	136.8 Å²	136.8	87%	0.871	83%	0.827	S	S	*	*			trans	54.7	119.6	148	52.8	0	0	0	0	120.1
5	G	30.1	Very low	37.9	Very low	76 Å²	76	136 Å²	136	78%	0.784	83%	0.826	S	S	*	*			trans	-113.8	131.8	168.3	0	0	0	0	0	112.7
6	L	31.5	Very low	38.1	Very low	170 Å²	170	136.1 Å²	136.1	89%	0.89	83%	0.827	S	S	*	*			trans	-152.6	126.9	150.8	-88.6	178.4	0	0	0	110.7
7	S	31.9	Very low	37.8	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	83%	0.831	S	S	*	*			trans	74.5	118.5	142.7	-51.8	0	0	0	0	124.8
8	S	30	Very low	37.4	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	83%	0.833	S	S	*	*			trans	71.1	165.3	144.3	-72.1	0	0	0	0	120.5
9	P	42.6	Very low	37	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	83%	0.832	S	S	*	*			cis	-133.2	-178.9	-19	28.9	-5.4	0	0	0	114.7
10	N	34.9	Very low	36.7	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-53.4	150.9	175.1	-79.7	-24.6	0	0	0	116.1
11	P	42.8	Very low	37	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-93.2	161.2	167.3	34.9	-29.9	0	0	0	114.2
12	P	43.4	Very low	36.5	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-91.7	170.3	-167.7	37.8	-35.2	0	0	0	114.2
13	P	41.4	Very low	36.5	Very low	121 Å²	121	130.5 Å²	130.5	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-88.8	155.5	176.1	35.2	-32	0	0	0	113
14	P	42.8	Very low	35.7	Very low	123 Å²	123	132 Å²	132	80%	0.799	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.5	168.3	172	35.7	-29	0	0	0	113.4
15	P	47.4	Very low	35.2	Very low	125 Å²	125	131.9 Å²	131.9	81%	0.812	80%	0.804	S	S	*	*			trans	-104.5	164.7	-139	39.3	-35.3	0	0	0	116
16	T	40.5	Very low	35.2	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	80%	0.803	S	S	*	*			trans	-78.1	137.5	166	39.1	0	0	0	0	112.8
17	Q	32.7	Very low	35.1	Very low	193 Å²	193	135 Å²	135	90%	0.902	80%	0.799	S	S	*	*			trans	-159.1	158.2	145.5	-121.2	175.3	10.7	0	0	113
18	E	31.8	Very low	34.9	Very low	183 Å²	183	135.2 Å²	135.2	86%	0.855	80%	0.801	S	S	*	*			trans	-86.3	174.6	-151.7	-62.8	163.2	124.2	0	0	116.8
19	A	28.4	Very low	34.8	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	80%	0.797	S	S	*	*			trans	116.2	114.4	135.5	0	0	0	0	0	118.3
20	R	32.8	Very low	34.3	Very low	242 Å²	242	135.8 Å²	135.8	91%	0.913	80%	0.796	S	S	*	*			trans	-57	161.7	150.2	-102.6	178.9	175.7	179.2	-1.1	110.3
21	P	41.9	Very low	34	Very low	115 Å²	115	132 Å²	132	75%	0.747	80%	0.795	S	S	*	*			cis	-151.3	179.3	48.8	37.9	-14.7	0	0	0	117.7
22	A	27.9	Very low	33.3	Very low	99 Å²	99	134 Å²	134	82%	0.818	80%	0.8	S	S	*	*			trans	27.2	147.9	142.2	0	0	0	0	0	120.4
23	A	28.1	Very low	32.7	Very low	79 Å²	79	136.2 Å²	136.2	65%	0.653	80%	0.803	S	S	*	*			cis	179.9	-179	-1.7	0	0	0	0	0	105.8
24	T	28.7	Very low	32.1	Very low	132 Å²	132	136 Å²	136	81%	0.81	80%	0.799	S	S	*	*			trans	80.5	143.4	164.7	69.6	0	0	0	0	117.5
25	D	27.2	Very low	31.5	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	80%	0.796	S	S	*	*			cis	-175.9	178.5	-29.6	-139.6	-46.5	0	0	0	104.8
26	V	30.4	Very low	31	Very low	127 Å²	127	135.4 Å²	135.4	77%	0.77	80%	0.799	S	S	*	*			trans	106.2	86.8	174.5	-175.1	0	0	0	0	111.6
27	K	30.2	Very low	30.5	Very low	185 Å²	185	138 Å²	138	80%	0.804	80%	0.798	S	S	*	*				59.6	126.3	86.7	-75	-177.1	174.4	178.2	0	111.5
28	S	27.7	Very low	30.3	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	79%	0.792	S	S	*	*			cis	-173.5	160.5	39.1	40.8	0	0	0	0	105.9
29	D	27.6	Very low	30	Very low	141 Å²	141	138.9 Å²	138.9	75%	0.754	79%	0.79	S	S	*	*			cis	-169.8	154.8	26.9	-141.1	-34.2	0	0	0	110.2
30	S	31.1	Very low	29.9	Very low	111 Å²	111	143 Å²	143	78%	0.776	79%	0.79	S	S	*	*			trans	69.7	114.1	144.6	-64.3	0	0	0	0	122.9
31	G	30.1	Very low	29.7	Very low	81 Å²	81	139.7 Å²	139.7	84%	0.835	79%	0.789	S	S	*	*			trans	156.9	58.3	154.8	0	0	0	0	0	118.3
32	N	27.2	Very low	28.9	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	79%	0.792	S	S	*	*			trans	-56.1	144.5	163.7	-89.3	-23.8	0	0	0	110.2
33	I	30.4	Very low	28.8	Very low	166 Å²	166	140.2 Å²	140.2	85%	0.851	79%	0.788	S	S	*	*				-164	134.1	85.4	-80.9	155.1	0	0	0	109.8
34	T	28.3	Very low	28.8	Very low	116 Å²	116	141.7 Å²	141.7	71%	0.712	79%	0.794	S	S	*	*			trans	-83.7	147.2	174.3	47.1	0	0	0	0	113.6
35	S	30.7	Very low	28.7	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	79%	0.788	S	S	*	*			trans	0.2	152.2	148.7	65.5	0	0	0	0	119.6
36	P	37	Very low	28.8	Very low	132 Å²	132	145.7 Å²	145.7	86%	0.857	79%	0.79	S	S	*	*				-158.8	-177.4	84.5	39	-16.3	0	0	0	118.2
37	K	30.9	Very low	28.6	Very low	190 Å²	190	146 Å²	146	83%	0.826	79%	0.787	S	S	*	*			trans	-69.3	160.1	179.9	-73.4	168	170.4	165.6	0	116.3
38	K	28.4	Very low	28.5	Very low	180 Å²	180	143.9 Å²	143.9	78%	0.783	79%	0.785	S	S	*	*			trans	88.6	128.6	137.1	-92.6	178.5	-179.4	179	0	122.4
39	R	25.5	Very low	28.5	Very low	216 Å²	216	144.9 Å²	144.9	82%	0.815	79%	0.787	S	S	*	*			trans	91.8	115	132.6	-95.5	-173.5	173.5	168.7	-3.7	122.2
40	K	27	Very low	28.5	Very low	183 Å²	183	142.4 Å²	142.4	80%	0.796	78%	0.78	S	S	*	*				52	121	119.2	-127	-173.4	-174.5	-170.9	0	119.9
41	I	26.7	Very low	28.3	Very low	174 Å²	174	144.2 Å²	144.2	89%	0.892	78%	0.781	S	S	*	*			trans	-147.5	149.7	144.6	-62.4	-169.2	0	0	0	110.4
42	N	26.7	Very low	28.2	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	78%	0.775	S	S	*	*			trans	-88.3	165.1	-172.5	-98.1	-1.5	0	0	0	116.1
43	G	25	Very low	28.2	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	78%	0.777	S	S	*	*			trans	91.6	143.4	141.3	0	0	0	0	0	116.6
44	S	27.9	Very low	27.9	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	77%	0.77	S	S	*	*			cis	-176.7	171.2	6.2	42.7	0	0	0	0	109.8
45	E	27.4	Very low	27.7	Very low	148 Å²	148	143.3 Å²	143.3	69%	0.692	77%	0.774	S	S	*	*			trans	89.4	139.6	164.5	-51.4	-161.1	130.4	0	0	118.1
46	R	28.3	Very low	27.5	Very low	206 Å²	206	143.6 Å²	143.6	78%	0.777	78%	0.776	S	S	*	*			cis	-169.4	150.6	-10.2	-108.1	-177.7	-152.3	-175.2	11.7	109
47	D	27.6	Very low	28	Very low	134 Å²	134	142.8 Å²	142.8	72%	0.717	77%	0.771	S	S	*	*			trans	5.3	145.2	157.6	-62.9	-25.7	0	0	0	126.1
48	D	28.1	Very low	28.9	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	76%	0.762	S	S	*	*			trans	47.3	146.3	133.8	-57.4	-28.3	0	0	0	120.9
49	T	26.7	Very low	29.2	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	76%	0.764	S	S	*	*			cis	-165.1	169	39.8	25.7	0	0	0	0	111.2
50	S	28.3	Very low	29.2	Very low	88 Å²	88	134.4 Å²	134.4	62%	0.615	76%	0.761	S	S	*	*			trans	-45.8	151.3	165.5	49.6	0	0	0	0	117.9
51	D	26	Very low	29.3	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	76%	0.761	S	S	*	*				177.6	150.9	104.7	-101.8	-44.7	0	0	0	116.6
52	T	28.4	Very low	29.3	Very low	116 Å²	116	131 Å²	131	71%	0.712	75%	0.752	S	S	*	*			trans	-58.2	155.9	177.4	-15.6	0	0	0	0	115.8
53	I	26.1	Very low	29.5	Very low	170 Å²	170	128.5 Å²	128.5	87%	0.872	75%	0.747	S	S	*	*				175.6	141	124.3	-85.8	155.2	0	0	0	113.2
54	S	24.6	Very low	29.6	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	75%	0.745	S	S	*	*			trans	-70.5	155.6	-179.9	177.8	0	0	0	0	116
55	S	23.6	Very low	29.6	Very low	114 Å²	114	130 Å²	130	80%	0.797	75%	0.746	S	S	*	*				165.6	130.3	115.6	48.4	0	0	0	0	115.3
56	S	28.5	Very low	29.6	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	75%	0.745	S	S	*	*			trans	-75.1	-168.8	162.8	-40.6	0	0	0	0	111
57	P	46.5	Very low	29.5	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	75%	0.746	S	S	*	*			cis	-145.1	-144.2	10.1	43.5	-18.8	0	0	0	112.7
58	P	50.2	Low	29.5	Very low	99 Å²	99	122 Å²	122	64%	0.643	75%	0.749	S	S	*	*			cis	-143.3	170.6	-13	34.9	-12.2	0	0	0	120.5
59	K	33.2	Very low	29.4	Very low	189 Å²	189	120.2 Å²	120.2	82%	0.822	75%	0.747	S	S	*	*			trans	70.4	143.4	142	-75.8	168.1	-176.5	-176.4	0	120.7
60	T	26.7	Very low	29.2	Very low	123 Å²	123	120.1 Å²	120.1	76%	0.755	75%	0.75	S	S	*	*			cis	-157.8	131.9	43.9	35.7	0	0	0	0	111.8
61	L	28.8	Very low	29.2	Very low	151 Å²	151	121.2 Å²	121.2	79%	0.791	76%	0.758	S	S	*	*				91.8	120.9	83.8	-95.1	159	0	0	0	118.7
62	N	27.5	Very low	29.9	Very low	133 Å²	133	119.1 Å²	119.1	71%	0.711	75%	0.752	S	S	*	*			trans	129.1	99.6	142.8	-78.2	4.2	0	0	0	113.7
63	S	29.4	Very low	29.8	Very low	101 Å²	101	120 Å²	120	71%	0.706	76%	0.757	S	S	*	*				60.3	126.8	84.2	71.3	0	0	0	0	112.7
64	S	28.1	Very low	30.6	Very low	100 Å²	100	117.3 Å²	117.3	70%	0.699	75%	0.751	S	S	*	*			cis	-174.1	128.7	43.5	31.1	0	0	0	0	109.2
65	S	28.4	Very low	31.3	Very low	113 Å²	113	117.9 Å²	117.9	79%	0.79	75%	0.753	S	S	*	*				51.2	133.3	113	69.6	0	0	0	0	116.3
66	S	26	Very low	31.4	Very low	98 Å²	98	120.3 Å²	120.3	69%	0.685	76%	0.756	S	S	*	*				-175.4	129.7	53.1	49.1	0	0	0	0	109.1
67	S	26.7	Very low	31.2	Very low	113 Å²	113	122.9 Å²	122.9	79%	0.79	76%	0.755	S	S	*	*				65.2	142.6	106.6	79.1	0	0	0	0	115
68	S	27.1	Very low	30.2	Very low	111 Å²	111	125 Å²	125	78%	0.776	76%	0.759	S	S	*	*			cis	-165.1	164.8	20.2	36.2	0	0	0	0	111.5
69	S	27.2	Very low	29.1	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	77%	0.767	S	S	*	*			trans	-61.9	155.3	176.1	49.2	0	0	0	0	118.1
70	C	22.7	Very low	28.7	Very low	127 Å²	127	128.7 Å²	128.7	86%	0.858	77%	0.767	S	S	*	*				165.4	139.8	118.3	-91.5	0	0	0	0	113.4
71	S	26.6	Very low	28.7	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	77%	0.774	S	S	*	*			trans	-87	179.9	166.8	39.2	0	0	0	0	111.8
72	P	42	Very low	28.5	Very low	105 Å²	105	133.4 Å²	133.4	68%	0.682	78%	0.778	S	S	*	*			cis	-137.8	156.2	-5.3	36.2	-15.1	0	0	0	118.6
73	T	25.4	Very low	28.3	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	79%	0.785	S	S	*	*			trans	57.5	170.2	147.9	60.9	0	0	0	0	123.5
74	P	43.5	Very low	28	Very low	115 Å²	115	143.1 Å²	143.1	75%	0.747	80%	0.795	S	S	*	*				-110.7	-159.3	-94.9	38.7	-16.6	0	0	0	111.8
75	P	39.3	Very low	27.9	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	80%	0.801	S	S	*	*			cis	-138.3	171.6	3.9	38.5	-16.8	0	0	0	117.2
76	L	25.6	Very low	27.6	Very low	165 Å²	165	149 Å²	149	86%	0.864	81%	0.805	S	S	*	*				155.8	142.9	127.6	-88.9	159.1	0	0	0	114.8
77	H	24.6	Very low	27.6	Very low	166 Å²	166	149.9 Å²	149.9	77%	0.769	81%	0.811	S	S	*	*			trans	-48.5	147.5	176	-88.3	-72.2	0	0	0	116
78	I	26.2	Very low	27.6	Very low	160 Å²	160	150.4 Å²	150.4	82%	0.821	81%	0.808	S	S	*	*				-160.9	129.8	127.9	-93.1	144.8	0	0	0	109.6
79	Q	26.4	Very low	27.5	Very low	175 Å²	175	152.7 Å²	152.7	82%	0.818	81%	0.812	S	S	*	*			trans	-70.8	140.7	173.3	-68.1	170.2	-27.9	0	0	111.4
80	K	25.6	Very low	27.3	Very low	190 Å²	190	156.7 Å²	156.7	83%	0.826	82%	0.817	S	S	*	*			trans	-142.3	108	146.5	-78.3	-166.9	178.5	172.7	0	111.8
81	K	24.9	Very low	27.6	Very low	207 Å²	207	158.5 Å²	158.5	90%	0.9	82%	0.816	S	S	*	*			trans	-56.3	136.8	150.5	-92.7	172	166.6	173.1	0	108.9
82	L	25.3	Very low	27.5	Very low	165 Å²	165	155.9 Å²	155.9	86%	0.864	81%	0.807	S	S	*	*			trans	-132.5	119.2	155	-92.1	160.6	0	0	0	109.2
83	R	23.7	Very low	26.6	Very low	228 Å²	228	158.7 Å²	158.7	86%	0.86	82%	0.816	S	S	*	*			trans	-68.9	147.2	172	-82	173.2	168.3	158.2	-5.9	109.5
84	F	23.1	Very low	26.6	Very low	211 Å²	211	160 Å²	160	93%	0.925	82%	0.818	S	S	*	*			trans	-76.9	128.7	153.1	-94.2	-101.8	0	0	0	108.2
85	E	24.8	Very low	25.7	Very low	176 Å²	176	160.6 Å²	160.6	82%	0.822	82%	0.819	S	S	*	*			trans	-110.2	134.9	158	-81.6	-156.8	150.4	0	0	108.8
86	D	24.2	Very low	25.1	Very low	161 Å²	161	164.3 Å²	164.3	86%	0.861	82%	0.824	S	S	*	*			trans	-67.5	142.8	166.5	-72.1	-46.9	0	0	0	109.9
87	S	24.8	Very low	25	Very low	116 Å²	116	165.1 Å²	165.1	81%	0.811	83%	0.825	S	S	*	*			trans	-134.3	112.5	154.3	-146.2	0	0	0	0	109.2
88	V	26.3	Very low	25	Very low	123 Å²	123	161.2 Å²	161.2	75%	0.745	82%	0.822	S	S	*	*			trans	-78.3	130	164.2	-149	0	0	0	0	105.7
89	D	25.4	Very low	24.9	Very low	160 Å²	160	162.3 Å²	162.3	86%	0.856	82%	0.824	S	S	*	*			trans	-144.4	134.1	154.6	-98.8	-33.6	0	0	0	111.5
90	F	23.6	Very low	24.8	Very low	186 Å²	186	162.9 Å²	162.9	82%	0.816	83%	0.826	S	S	*	*			trans	-108.2	124	-166.6	-151.6	-90.6	0	0	0	106
91	I	27.8	Very low	24.7	Very low	164 Å²	164	158.7 Å²	158.7	84%	0.841	83%	0.827	S	S	*	*			trans	-125.1	110.3	163.9	-62.7	178.1	0	0	0	107.3
92	G	25.3	Very low	24.5	Very low	58 Å²	58	154 Å²	154	60%	0.598	83%	0.827	S	S	*	*			trans	-75	147.8	172.4	0	0	0	0	0	111.5
93	L	23.8	Very low	24.4	Very low	164 Å²	164	151.4 Å²	151.4	86%	0.859	83%	0.829	S	S	*	*			trans	-131.2	117.9	167	-107.4	147.7	0	0	0	108.2
94	D	25.5	Very low	24.4	Very low	160 Å²	160	145.4 Å²	145.4	86%	0.856	83%	0.828	S	S	*	*			trans	-75.9	142.1	179.4	-155.2	-8.9	0	0	0	110
95	V	23.8	Very low	24.4	Very low	127 Å²	127	140.3 Å²	140.3	77%	0.77	83%	0.825	S	S	*	*			trans	-133.5	114.9	179.4	173.7	0	0	0	0	108.9
96	K	25.8	Very low	24.2	Very low	189 Å²	189	137 Å²	137	82%	0.822	83%	0.827	S	S	*	*			trans	-161.3	117	146.8	-111.4	177.3	-175.3	-178.6	0	112.5
97	M	25.3	Very low	24.1	Very low	182 Å²	182	134.3 Å²	134.3	90%	0.897	83%	0.828	S	S	*	*			trans	50.7	139.5	140.1	-61	-165	171.3	0	0	119.2
98	A	24.4	Very low	24.2	Very low	84 Å²	84	133.9 Å²	133.9	69%	0.694	83%	0.831	S	S	*	*			cis	-162.1	152.1	16.4	0	0	0	0	0	110.3
99	E	23.3	Very low	23.9	Very low	183 Å²	183	133.1 Å²	133.1	86%	0.855	83%	0.831	S	S	*	*			trans	69.6	99.8	131.1	-156.6	171	-152.9	0	0	119.8
100	E	23.7	Very low	23.7	Very low	187 Å²	187	130.2 Å²	130.2	87%	0.874	82%	0.823	S	S	*	*				168.1	139.5	120.1	-96.6	-173.6	146.4	0	0	110.9
101	A	23.2	Very low	23.8	Very low	102 Å²	102	125.7 Å²	125.7	84%	0.843	81%	0.814	S	S	*	*			trans	66	96.4	156.1	0	0	0	0	0	120.1
102	A	22.3	Very low	23.6	Very low	109 Å²	109	124.8 Å²	124.8	90%	0.901	81%	0.811	S	S	*	*			trans	-155.3	109.3	136	0	0	0	0	0	110.7
103	A	22.5	Very low	23.6	Very low	109 Å²	109	129.5 Å²	129.5	90%	0.901	82%	0.822	S	S	*	*			trans	-126	100.7	167.2	0	0	0	0	0	108.5
104	A	24.1	Very low	23.8	Very low	103 Å²	103	132 Å²	132	85%	0.851	83%	0.826	S	S	*	*			trans	-156.4	96.1	167.7	0	0	0	0	0	110.3
105	A	21.9	Very low	23.9	Very low	104 Å²	104	129.7 Å²	129.7	86%	0.86	82%	0.823	S	S	*	*				148.6	125.6	128.4	0	0	0	0	0	113
106	A	21.9	Very low	24	Very low	105 Å²	105	132 Å²	132	87%	0.868	82%	0.823	S	S	*	*			trans	77.9	84.5	152.5	0	0	0	0	0	120
107	A	22	Very low	24	Very low	105 Å²	105	127.8 Å²	127.8	87%	0.868	82%	0.823	S	S	*	*				-175	128.4	123.5	0	0	0	0	0	110.3
108	A	25.6	Very low	24.1	Very low	107 Å²	107	125.4 Å²	125.4	88%	0.884	81%	0.812	S	S	*	*			trans	161.8	120.7	133	0	0	0	0	0	111.4
109	S	21.7	Very low	24	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	82%	0.815	S	S	*	*			trans	-87.8	162.3	167.2	68.4	0	0	0	0	111.4
110	C	20.5	Very low	24.2	Very low	99 Å²	99	127.9 Å²	127.9	67%	0.669	81%	0.81	S	S	*	*			trans	73.7	133.2	166.4	-59.4	0	0	0	0	115.2
111	S	25.1	Very low	24.2	Very low	91 Å²	91	123.5 Å²	123.5	64%	0.636	81%	0.806	S	S	*	*			cis	-165.1	162.5	9.5	-89.3	0	0	0	0	110.4
112	N	24.4	Very low	24.3	Very low	145 Å²	145	122.5 Å²	122.5	78%	0.775	81%	0.806	S	S	*	*			trans	60.4	104.7	147.5	-70.4	-4.7	0	0	0	120.9
113	N	25.5	Very low	24.4	Very low	157 Å²	157	120.7 Å²	120.7	84%	0.84	80%	0.798	S	S	*	*				-170.1	110.3	117.6	-97.5	-20	0	0	0	109.4
114	K	27.2	Very low	24.7	Very low	216 Å²	216	122.6 Å²	122.6	94%	0.939	80%	0.798	S	S	*	*			trans	-132.9	93.1	164.9	-95.6	-171.9	178.8	176.3	0	110.6
115	S	27.5	Very low	24.8	Very low	113 Å²	113	121 Å²	121	79%	0.79	79%	0.792	S	S	*	*			trans	-85.7	124.5	156.5	-52.4	0	0	0	0	109
116	K	26.8	Very low	25.1	Very low	175 Å²	175	119.7 Å²	119.7	76%	0.761	79%	0.788	S	S	*	*			trans	33.7	113.1	143.7	-85.2	170.3	172.3	166.1	0	119.1
117	A	25.5	Very low	25.5	Very low	101 Å²	101	123.1 Å²	123.1	84%	0.835	79%	0.786	S	S	*	*			trans	-81.2	141.5	146.6	0	0	0	0	0	111
118	M	26.1	Very low	26	Very low	132 Å²	132	127.7 Å²	127.7	65%	0.65	79%	0.789	S	S	*	*			trans	-143.8	114.2	156.4	-141	179.5	143.4	0	0	103.6	R266	M118-R266 PolarHBondContact SD-NH1 2.92Å; M118-R266 PolarHBondContact SD-NH2 3.31Å
119	F	24.1	Very low	26.2	Very low	175 Å²	175	127.4 Å²	127.4	77%	0.768	79%	0.786	S	S	*	*				34.5	124.6	85.1	-87.9	-95.4	0	0	0	112.2
120	L	26.7	Very low	26.7	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	80%	0.796	S	S	*	*			cis	-169.9	160.6	0.4	-120.9	-179.3	0	0	0	106.3
121	A	23.9	Very low	27	Very low	95 Å²	95	129.2 Å²	129.2	79%	0.785	80%	0.797	S	S	*	*			trans	52.4	126.1	152.4	0	0	0	0	0	118.7
122	G	24.5	Very low	27.3	Very low	82 Å²	82	133 Å²	133	85%	0.845	81%	0.809	S	S	*	*			cis	121.9	130.6	35.2	0	0	0	0	0	107.3
123	G	25.2	Very low	27.5	Very low	71 Å²	71	133 Å²	133	73%	0.732	82%	0.815	S	S	*	*			trans	142.9	97.7	161.6	0	0	0	0	0	118
124	V	29.4	Very low	27.9	Very low	148 Å²	148	135 Å²	135	90%	0.897	82%	0.816	S	S	*	*			trans	76.3	93.6	135.7	-158.5	0	0	0	0	118.6
125	G	25.7	Very low	28	Very low	71 Å²	71	130.7 Å²	130.7	73%	0.732	81%	0.808	S	S	*	*			trans	-106.5	106.7	146.2	0	0	0	0	0	109.6
126	G	28.8	Very low	28.1	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	81%	0.812	S	S	*	*			trans	-81	114.3	170.8	0	0	0	0	0	110.7
127	H	30.3	Very low	28.3	Very low	177 Å²	177	125.9 Å²	125.9	82%	0.819	82%	0.815	S	S	*	*			trans	-84.8	128.7	168.2	-80.3	83.9	0	0	0	110
128	H	31.1	Very low	28.7	Very low	201 Å²	201	127.6 Å²	127.6	93%	0.931	82%	0.821	S	S	*	*			trans	-144.9	114.3	145.7	-88.8	-71.4	0	0	0	108.3
129	A	30	Very low	29.1	Very low	100 Å²	100	124.6 Å²	124.6	83%	0.826	82%	0.824	S	S	*	*			trans	-111.8	125	163.8	0	0	0	0	0	107.4
130	N	31.8	Very low	29.7	Very low	177 Å²	177	122.4 Å²	122.4	95%	0.947	83%	0.825	S	S	*	*			trans	-112.2	119	162	-113.6	-0.6	0	0	0	106.5
131	G	27.5	Very low	30	Very low	67 Å²	67	124.7 Å²	124.7	69%	0.691	83%	0.83	S	S	*	*			trans	-96.2	131.9	169.7	0	0	0	0	0	110.2
132	L	31.6	Very low	30.6	Very low	170 Å²	170	125.7 Å²	125.7	89%	0.89	83%	0.831	S	S	*	*			trans	171.8	118.2	136.7	-121.2	74.8	0	0	0	108.5
133	T	29.5	Very low	31.5	Very low	146 Å²	146	127.5 Å²	127.5	90%	0.896	83%	0.831	S	S	*	*			trans	-149.5	137.3	136	44.1	0	0	0	0	110.9
134	K	31.9	Very low	32.3	Very low	198 Å²	198	129.7 Å²	129.7	86%	0.861	84%	0.835	S	S	*	*			trans	-68.6	148.3	173.6	-86.1	175.4	170.9	176.5	0	112.2
135	T	29.7	Very low	32.8	Very low	127 Å²	127	132.6 Å²	132.6	78%	0.779	84%	0.835	S	S	*	*			trans	-2.6	130.6	147.1	57.9	0	0	0	0	119.5
136	A	31.2	Very low	33.7	Very low	106 Å²	106	135.5 Å²	135.5	88%	0.876	84%	0.841	S	S	*	*				153.6	145	109.2	0	0	0	0	0	111.8
137	G	31	Very low	34.8	Very low	80 Å²	80	135.8 Å²	135.8	83%	0.825	84%	0.844	S	S	*	*			trans	120	100.6	152.9	0	0	0	0	0	116.3
138	S	34	Very low	36	Very low	137 Å²	137	132 Å²	132	96%	0.958	84%	0.843	S	S	*	*			trans	-55.4	141.2	164.8	-177.4	0	0	0	0	112.6
139	G	33.8	Very low	37.1	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	84%	0.836	S	S	*	*			trans	172.4	106.6	170.8	0	0	0	0	0	113.3
140	T	35.8	Very low	38.8	Very low	128 Å²	128	131.9 Å²	131.9	79%	0.785	84%	0.839	S	S	*	*			trans	-51.1	132.5	175.1	41.4	0	0	0	0	115.2
141	F	33	Very low	40.8	Very low	192 Å²	192	133.2 Å²	133.2	84%	0.842	84%	0.836	S	S	*	*				159.3	136.5	116.4	-98.5	-83	0	0	0	115.3
142	S	37.3	Very low	43.1	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	85%	0.846	S	S	*	*			trans	79.5	129.6	154.1	90.1	0	0	0	0	120.8
143	S	42.3	Very low	45.1	Very low	121 Å²	121	136.2 Å²	136.2	85%	0.846	84%	0.841	S	S	*	*			trans	-74.5	129.6	-174.8	55.1	0	0	0	0	114.2
144	S	41.9	Very low	47.3	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	83%	0.829	S	S	*	*			trans	-155.2	125.1	143.3	53.2	0	0	0	0	110.2
145	K	41.2	Very low	48.9	Very low	208 Å²	208	135 Å²	135	90%	0.904	83%	0.828	S	S	*	*			trans	-68.3	132.5	-174.7	-81.6	180	173.9	178.1	0	111.7
146	P	43.1	Very low	50.7	Low	133 Å²	133	135.9 Å²	135.9	86%	0.864	83%	0.828	S	S	*	*	S	Bend	trans	-82	129.3	170.9	30.9	-29.2	0	0	0	110.8
147	G	53.7	Low	52.2	Low	82 Å²	82	136.5 Å²	136.5	85%	0.845	81%	0.811	S	S	*	*			trans	159.6	-11	174.5	0	0	0	0	0	116.5	A149	G147-A149 PolarHBondContact O-N 2.84Å
148	A	54.7	Low	53.5	Low	96 Å²	96	143.5 Å²	143.5	79%	0.793	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81.1	118.3	176.7	0	0	0	0	0	111.2	K150	A148-K150 PolarHBondContact O-N 3.5Å
149	A	53.3	Low	54.9	Low	94 Å²	94	144.8 Å²	144.8	78%	0.777	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-53.5	131.6	171.3	0	0	0	0	0	110.9	G147 K151	G147-A149 PolarHBondContact O-N 2.84Å; A149-K151 PolarHBondContact O-N 2.76Å
150	K	66.3	Low	56.1	Low	206 Å²	206	149.3 Å²	149.3	90%	0.896	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-60.9	117.6	174.7	-85.8	-178.2	176.3	176.6	0	109.4	A148 L152	A148-K150 PolarHBondContact O-N 3.5Å; K150-L152 PolarHBondContact O-N 2.86Å
151	K	73.3	Confident	57.4	Low	204 Å²	204	148.9 Å²	148.9	89%	0.887	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.9	121	174.1	-68.2	-178	179.2	179.2	0	109.7	A149	A149-K151 PolarHBondContact O-N 2.76Å
152	L	77.3	Confident	58.8	Low	172 Å²	172	148.7 Å²	148.7	90%	0.901	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-85	136.2	169.7	-79.7	156.8	0	0	0	109.5	K150	K150-L152 PolarHBondContact O-N 2.86Å
153	V	72.9	Confident	59.9	Low	129 Å²	129	146.4 Å²	146.4	78%	0.782	78%	0.78	S	S	*	*			trans	-111.5	118.8	176.4	-179.8	0	0	0	0	108.3	K155	V153-K155 PolarHBondContact O-N 3.25Å
154	I	76.2	Confident	61.3	Low	125 Å²	125	144.9 Å²	144.9	64%	0.641	77%	0.767	S	S	*	*			trans	-71	114.9	176.7	-58.6	174.6	0	0	0	108.1	F157	I154-F157 HydrophobicContact CB-CB 4.35Å; I154-F157 HydrophobicContact CG2-CB 4.28Å; I154-F157 HydrophobicContact CG2-CD2 4.47Å
155	K	65.5	Low	62.4	Low	192 Å²	192	148.4 Å²	148.4	84%	0.835	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	136.8	175.7	-72.3	-174.5	176.1	-178.5	0	109.8	V153	V153-K155 PolarHBondContact O-N 3.25Å
156	N	65.9	Low	64.1	Low	146 Å²	146	143 Å²	143	78%	0.781	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	70	23.9	-179.2	-56.6	-33.4	0	0	0	117.2	R158	N156-R158 VanDerWaalsContact C-N 3.3Å; N156-R158 PolarHBondContact O-N 3.18Å
157	F	63.1	Low	65.7	Low	119 Å²	119	139.5 Å²	139.5	52%	0.522	72%	0.722	S	S	.	*			trans	-77.6	78.1	171.2	-160.5	-103.3	0	0	0	110.8	I154 K160	I154-F157 HydrophobicContact CB-CB 4.35Å; I154-F157 HydrophobicContact CG2-CB 4.28Å; I154-F157 HydrophobicContact CG2-CD2 4.47Å; F157-K160 HydrophobicContact CE1-CB 4.4Å; F157-K160 HydrophobicContact CE1-CG 3.66Å; F157-K160 HydrophobicContact CZ-CG 4.21Å
158	R	58.8	Low	66.9	Low	228 Å²	228	138.1 Å²	138.1	86%	0.86	70%	0.697	S	S	*	*			trans	-74.7	-22.6	-169.2	-75.6	-168.8	176.1	-173.8	-0.4	115	N156	N156-R158 VanDerWaalsContact C-N 3.3Å; N156-R158 PolarHBondContact O-N 3.18Å
159	E	63.1	Low	68.2	Low	164 Å²	164	140.4 Å²	140.4	77%	0.766	69%	0.691	S	S	*	*	S	Bend	trans	-158.7	144.8	170.3	-106.1	177.7	175.1	0	0	110.3
160	K	60.2	Low	69.7	Low	165 Å²	165	142.1 Å²	142.1	72%	0.717	68%	0.683	S	S	*	*			trans	-67.5	127.1	169.3	-80.5	-179.8	179.6	178.5	0	107.8	F157 K162	F157-K160 HydrophobicContact CE1-CB 4.4Å; F157-K160 HydrophobicContact CE1-CG 3.66Å; F157-K160 HydrophobicContact CZ-CG 4.21Å; K160-K162 PolarHBondContact O-N 2.97Å
161	P	61.5	Low	70.6	Confident	119 Å²	119	132.9 Å²	132.9	77%	0.773	64%	0.644	S	S	*	*			trans	-56.1	115.6	169.8	20.4	-28.5	0	0	0	108.5
162	K	62.5	Low	71.4	Confident	187 Å²	187	124.5 Å²	124.5	81%	0.813	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-88.6	132.2	173.8	-69	179.1	-177.9	172.5	0	107.2	K160	K160-K162 PolarHBondContact O-N 2.97Å
163	L	61.9	Low	71.9	Confident	68 Å²	68	120.2 Å²	120.2	36%	0.356	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-56.6	146.7	170.8	-72.1	166.9	0	0	0	109.7	E165 Y167	L163-E165 PolarHBondContact O-N 3.17Å; L163-Y167 HydrophobicContact CD1-CD1 4.21Å; L163-Y167 HydrophobicContact CD2-CD1 3.66Å; L163-Y167 HydrophobicContact CD2-CE1 3.88Å; L163-Y167 HydrophobicContact CD2-CG 4.12Å; L163-Y167 HydrophobicContact CG-CD1 4.4Å
164	P	70.8	Confident	72.8	Confident	89 Å²	89	116 Å²	116	58%	0.578	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-52.2	138.5	166	-21	30.2	0	0	0	110.1	N166 Y167	P164-N166 PolarHBondContact O-N 3.4Å; P164-N166 VanDerWaalsContact O-N 3.1Å; P164-Y167 VanDerWaalsContact O-CB 3.28Å; P164-Y167 WeakPolarHBondContact O-CB 3.43Å; P164-Y167 PolarHBondContact O-N 2.92Å
165	E	65.8	Low	73.5	Confident	190 Å²	190	110.1 Å²	110.1	89%	0.888	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.9	-177.4	-68.3	-174.9	165.1	0	0	112.3	L163	L163-E165 PolarHBondContact O-N 3.17Å
166	N	75.6	Confident	74.8	Confident	94 Å²	94	103.8 Å²	103.8	50%	0.503	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.6	-179.7	-65.3	-11.7	0	0	0	114.8	P164 T168 Q169 E170	P164-N166 PolarHBondContact O-N 3.4Å; P164-N166 VanDerWaalsContact O-N 3.1Å; N166-T168 VanDerWaalsContact C-N 3.29Å; N166-T168 PolarHBondContact O-N 3.39Å; N166-Q169 PolarHBondContact O-N 3.45Å; N166-Q169 VanDerWaalsContact O-N 3.11Å; N166-E170 HydrophobicContact CB-CG 4.4Å; N166-E170 PolarHBondContact O-N 3.31Å
167	Y	78.3	Confident	76	Confident	61 Å²	61	99.5 Å²	99.5	24%	0.239	47%	0.471	C	S	.	.	H	α-helix	trans	-58.2	-40.2	-172.1	179.7	-100.2	0	0	0	112.7	L163 P164 T171	L163-Y167 HydrophobicContact CD1-CD1 4.21Å; L163-Y167 HydrophobicContact CD2-CD1 3.66Å; L163-Y167 HydrophobicContact CD2-CE1 3.88Å; L163-Y167 HydrophobicContact CD2-CG 4.12Å; L163-Y167 HydrophobicContact CG-CD1 4.4Å; P164-Y167 VanDerWaalsContact O-CB 3.28Å; P164-Y167 WeakPolarHBondContact O-CB 3.43Å; P164-Y167 PolarHBondContact O-N 2.92Å; Y167-T171 WeakPolarHBondContact O-CB 3.33Å; Y167-T171 PolarHBondContact O-N 3.31Å; Y167-T171 PolarHBondContact O-OG1 2.72Å
168	T	78.3	Confident	77.4	Confident	53 Å²	53	94 Å²	94	33%	0.325	45%	0.447	S	S	.	.	H	α-helix	trans	-68.5	-36.4	-179.3	61.8	0	0	0	0	112.6	N166 W172 L202 I207	N166-T168 VanDerWaalsContact C-N 3.29Å; N166-T168 PolarHBondContact O-N 3.39Å; T168-W172 WeakPolarHBondContact O-CB 3.44Å; T168-W172 PolarHBondContact O-N 3.02Å; T168-W172 VanDerWaalsContact O-N 3.14Å; T168-L202 HydrophobicContact CG2-CD2 4.41Å; T168-I207 HydrophobicContact CG2-CD1 3.42Å; T168-I207 VanDerWaalsContact CG2-CD1 3.42Å
169	Q	82.1	Confident	79.1	Confident	144 Å²	144	83.1 Å²	83.1	67%	0.673	41%	0.406	S	S	*	.	H	α-helix	trans	-79.5	-41.4	-177.9	-168.8	168.3	-4	0	0	111.5	N166 W172 Q173	N166-Q169 PolarHBondContact O-N 3.45Å; N166-Q169 VanDerWaalsContact O-N 3.11Å; Q169-W172 PolarHBondContact O-N 3.01Å; Q169-Q173 WeakPolarHBondContact O-CB 3.16Å; Q169-Q173 PolarHBondContact O-N 2.84Å
170	E	84.1	Confident	80.5	Confident	129 Å²	129	78.4 Å²	78.4	60%	0.603	38%	0.384	S	S	*	.	H	α-helix	trans	-65.2	-43.2	174.7	-72.9	179.4	179.2	0	0	111.9	N166 W172 Q173 K174	N166-E170 HydrophobicContact CB-CG 4.4Å; N166-E170 PolarHBondContact O-N 3.31Å; E170-W172 PolarHBondContact O-N 3.17Å; E170-Q173 PolarHBondContact O-N 3.31Å; E170-K174 WeakPolarHBondContact O-CB 3.47Å; E170-K174 PolarHBondContact O-N 3.31Å
171	T	85.1	Confident	82	Confident	13 Å²	13	71.2 Å²	71.2	8%	0.08	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-38.3	178.2	-51.9	0	0	0	0	111.3	Y167 K174 L175 A198 L202	Y167-T171 WeakPolarHBondContact O-CB 3.33Å; Y167-T171 PolarHBondContact O-N 3.31Å; Y167-T171 PolarHBondContact O-OG1 2.72Å; T171-K174 WeakPolarHBondContact O-CB 3.25Å; T171-K174 PolarHBondContact O-N 2.79Å; T171-L175 WeakPolarHBondContact O-CG 3.44Å; T171-L175 PolarHBondContact O-N 3.23Å; T171-L175 VanDerWaalsContact O-N 3.1Å; T171-A198 HydrophobicContact CG2-CB 3.62Å; T171-L202 HydrophobicContact CG2-CD1 3.53Å; T171-L202 HydrophobicContact CG2-CD2 4.4Å; T171-L202 HydrophobicContact CG2-CG 3.88Å
172	W	89.9	Confident	83.5	Confident	28 Å²	28	66 Å²	66	11%	0.106	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-44.1	171.6	170.5	-110.7	0	0	0	112.1	T168 Q169 E170 K174 L175 K176 L211 Q214 V218	T168-W172 WeakPolarHBondContact O-CB 3.44Å; T168-W172 PolarHBondContact O-N 3.02Å; T168-W172 VanDerWaalsContact O-N 3.14Å; Q169-W172 PolarHBondContact O-N 3.01Å; E170-W172 PolarHBondContact O-N 3.17Å; W172-K174 VanDerWaalsContact C-N 3.29Å; W172-K174 PolarHBondContact O-N 2.8Å; W172-L175 HydrophobicContact CE3-CB 4.38Å; W172-L175 PolarHBondContact O-N 3.31Å; W172-L175 VanDerWaalsContact O-N 3.14Å; W172-K176 HydrophobicContact CZ2-CB 4.15Å; W172-K176 HydrophobicContact CZ2-CD 4.36Å; W172-K176 HydrophobicContact CZ2-CG 4.42Å; W172-K176 WeakPolarHBondContact O-CB 3.05Å; W172-K176 PolarHBondContact O-N 2.68Å; W172-L211 HydrophobicContact CE3-CD1 3.42Å; W172-L211 VanDerWaalsContact CE3-CD1 3.42Å; W172-L211 HydrophobicContact CZ3-CD1 3.61Å; W172-Q214 HydrophobicContact CD2-CB 4.28Å; W172-Q214 HydrophobicContact CE3-CB 4.3Å; W172-Q214 VanDerWaalsContact CH2-C 3.5Å; W172-Q214 HydrophobicContact CH2-CB 3.48Å; W172-Q214 VanDerWaalsContact CH2-CB 3.48Å; W172-Q214 HydrophobicContact CZ2-CB 3.45Å; W172-Q214 VanDerWaalsContact CZ2-CB 3.45Å; W172-Q214 HydrophobicContact CZ2-CG 4.34Å; W172-Q214 HydrophobicContact CZ3-CB 3.92Å; W172-V218 HydrophobicContact CH2-CG2 4.13Å; W172-V218 HydrophobicContact CZ2-CG2 3.84Å
173	Q	89.3	Confident	84.9	Confident	82 Å²	82	57.7 Å²	57.7	38%	0.383	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-41.3	178.8	-175.9	57.5	35.1	0	0	111.5	Q169 E170 L175 K176 E177	Q169-Q173 WeakPolarHBondContact O-CB 3.16Å; Q169-Q173 PolarHBondContact O-N 2.84Å; E170-Q173 PolarHBondContact O-N 3.31Å; Q173-L175 PolarHBondContact O-N 2.78Å; Q173-K176 PolarHBondContact O-N 2.94Å; Q173-E177 PolarHBondContact NE2-OE1 3.32Å; Q173-E177 WeakPolarHBondContact O-CG 3.41Å; Q173-E177 PolarHBondContact O-N 3.16Å
174	K	90.1	Very high	86.3	Confident	40 Å²	40	59.2 Å²	59.2	17%	0.174	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-45.5	173	-175.6	-178.4	-172.5	169.9	0	112.7	E170 T171 W172 A178 Y190 E194 L195	E170-K174 WeakPolarHBondContact O-CB 3.47Å; E170-K174 PolarHBondContact O-N 3.31Å; T171-K174 WeakPolarHBondContact O-CB 3.25Å; T171-K174 PolarHBondContact O-N 2.79Å; W172-K174 VanDerWaalsContact C-N 3.29Å; W172-K174 PolarHBondContact O-N 2.8Å; K174-A178 PolarHBondContact O-N 3.06Å; K174-A178 VanDerWaalsContact O-N 3.14Å; K174-Y190 HydrophobicContact CB-CE2 4.47Å; K174-Y190 HydrophobicContact CD-CD1 4.28Å; K174-Y190 HydrophobicContact CD-CE1 4.28Å; K174-Y190 HydrophobicContact CD-CG 4.38Å; K174-Y190 VanDerWaalsContact CE-CG 3.44Å; K174-Y190 HydrophobicContact CG-CD1 4.25Å; K174-Y190 HydrophobicContact CG-CD2 3.7Å; K174-Y190 HydrophobicContact CG-CE1 4.11Å; K174-Y190 HydrophobicContact CG-CE2 3.58Å; K174-Y190 HydrophobicContact CG-CG 4.03Å; K174-E194 IonicContact NZ-OE1 3.76Å; K174-E194 PolarHBondContact NZ-OE1 3.33Å; K174-E194 IonicContact NZ-OE2 3.96Å; K174-L195 HydrophobicContact CD-CD2 4.35Å; K174-L195 HydrophobicContact CG-CD2 3.98Å
175	L	92.3	Very high	87.2	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-39.4	177	-68.9	171.4	0	0	0	111.8	T171 W172 Q173 A178 V179 L195 V199 L202 L211 I260 F261	T171-L175 WeakPolarHBondContact O-CG 3.44Å; T171-L175 PolarHBondContact O-N 3.23Å; T171-L175 VanDerWaalsContact O-N 3.1Å; W172-L175 HydrophobicContact CE3-CB 4.38Å; W172-L175 PolarHBondContact O-N 3.31Å; W172-L175 VanDerWaalsContact O-N 3.14Å; Q173-L175 PolarHBondContact O-N 2.78Å; L175-A178 PolarHBondContact O-N 2.82Å; L175-V179 WeakPolarHBondContact O-CG2 3.45Å; L175-V179 PolarHBondContact O-N 3.38Å; L175-L195 HydrophobicContact CD2-CB 4.29Å; L175-L195 HydrophobicContact CD2-CD2 4.01Å; L175-V199 HydrophobicContact CD1-CG2 3.79Å; L175-V199 HydrophobicContact CD2-CG2 3.66Å; L175-V199 HydrophobicContact CG-CG2 4.41Å; L175-L202 HydrophobicContact CD1-CD1 3.75Å; L175-L211 HydrophobicContact CD1-CD1 4.23Å; L175-I260 HydrophobicContact CD2-CG2 4.24Å; L175-F261 HydrophobicContact CB-CZ 4.1Å; L175-F261 HydrophobicContact CD1-CE1 4.28Å; L175-F261 HydrophobicContact CD1-CZ 4.38Å; L175-F261 HydrophobicContact CD2-CZ 4.29Å; L175-F261 HydrophobicContact CG-CZ 4.5Å
176	K	92.5	Very high	88.4	Confident	60 Å²	60	54.3 Å²	54.3	26%	0.261	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-47.4	175.6	-176.4	174.1	-172.3	-79.3	0	111.3	W172 Q173 A178 V179 E180 V218	W172-K176 HydrophobicContact CZ2-CB 4.15Å; W172-K176 HydrophobicContact CZ2-CD 4.36Å; W172-K176 HydrophobicContact CZ2-CG 4.42Å; W172-K176 WeakPolarHBondContact O-CB 3.05Å; W172-K176 PolarHBondContact O-N 2.68Å; Q173-K176 PolarHBondContact O-N 2.94Å; K176-A178 VanDerWaalsContact C-N 3.28Å; K176-A178 PolarHBondContact O-N 3.08Å; K176-V179 PolarHBondContact O-N 2.99Å; K176-E180 WeakPolarHBondContact CE-OE1 3.46Å; K176-E180 IonicContact NZ-OE1 3Å; K176-E180 PolarHBondContact NZ-OE1 3.02Å; K176-E180 WeakPolarHBondContact O-CB 3.22Å; K176-E180 WeakPolarHBondContact O-CG 3.31Å; K176-E180 PolarHBondContact O-N 2.92Å; K176-V218 HydrophobicContact CD-CG2 4.44Å; K176-V218 HydrophobicContact CG-CG2 4.17Å
177	E	91.7	Very high	88.9	Confident	56 Å²	56	55.1 Å²	55.1	26%	0.262	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-38.3	175.1	-76.7	-176.8	-145.7	0	0	112.2	Q173 A181 K189	Q173-E177 PolarHBondContact NE2-OE1 3.32Å; Q173-E177 WeakPolarHBondContact O-CG 3.41Å; Q173-E177 PolarHBondContact O-N 3.16Å; E177-A181 WeakPolarHBondContact O-CB 3.38Å; E177-A181 PolarHBondContact O-N 2.94Å; E177-K189 IonicContact OE2-NZ 2.65Å; E177-K189 PolarHBondContact OE2-NZ 3.45Å
178	A	92.5	Very high	89.3	Confident	2 Å²	2	54.3 Å²	54.3	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-43.2	176.1	0	0	0	0	0	112.2	K174 L175 K176 A181 I182 I188 L195	K174-A178 PolarHBondContact O-N 3.06Å; K174-A178 VanDerWaalsContact O-N 3.14Å; L175-A178 PolarHBondContact O-N 2.82Å; K176-A178 VanDerWaalsContact C-N 3.28Å; K176-A178 PolarHBondContact O-N 3.08Å; A178-A181 PolarHBondContact O-N 3.07Å; A178-I182 WeakPolarHBondContact O-CD1 3.24Å; A178-I182 VanDerWaalsContact O-CG1 3.23Å; A178-I182 WeakPolarHBondContact O-CG1 3.26Å; A178-I182 PolarHBondContact O-N 3.4Å; A178-I188 HydrophobicContact CB-CG2 3.9Å; A178-L195 HydrophobicContact CB-CD1 3.66Å; A178-L195 HydrophobicContact CB-CD2 4.05Å
179	V	93.6	Very high	89.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-47	176.6	171.8	0	0	0	0	111.1	L175 K176 A181 I182 Q183 L215 V218 I257 F261	L175-V179 WeakPolarHBondContact O-CG2 3.45Å; L175-V179 PolarHBondContact O-N 3.38Å; K176-V179 PolarHBondContact O-N 2.99Å; V179-A181 VanDerWaalsContact C-N 3.28Å; V179-A181 PolarHBondContact O-N 3.44Å; V179-I182 PolarHBondContact O-N 3.41Å; V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 WeakPolarHBondContact O-CB 3.35Å; V179-Q183 WeakPolarHBondContact O-CG 3.5Å; V179-Q183 PolarHBondContact O-N 3.49Å; V179-L215 HydrophobicContact CG1-CD1 4.36Å; V179-L215 HydrophobicContact CG2-CD1 3.86Å; V179-V218 HydrophobicContact CB-CG1 4.39Å; V179-V218 HydrophobicContact CG1-CB 4.49Å; V179-V218 HydrophobicContact CG1-CG1 3.65Å; V179-I257 HydrophobicContact CG1-CD1 3.9Å; V179-I257 HydrophobicContact CG2-CG1 4.4Å; V179-F261 HydrophobicContact CG2-CE2 3.69Å; V179-F261 HydrophobicContact CG2-CZ 4.12Å
180	E	93.1	Very high	89.8	Confident	65 Å²	65	56.3 Å²	56.3	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-36.9	176.4	-73.1	173.6	176.8	0	0	111.5	K176 N184 V218	K176-E180 WeakPolarHBondContact CE-OE1 3.46Å; K176-E180 IonicContact NZ-OE1 3Å; K176-E180 PolarHBondContact NZ-OE1 3.02Å; K176-E180 WeakPolarHBondContact O-CB 3.22Å; K176-E180 WeakPolarHBondContact O-CG 3.31Å; K176-E180 PolarHBondContact O-N 2.92Å; E180-N184 WeakPolarHBondContact O-CB 3.5Å; E180-N184 PolarHBondContact O-N 3.16Å; E180-N184 PolarHBondContact O-ND2 2.65Å; E180-V218 HydrophobicContact CG-CG1 4.29Å
181	A	91.4	Very high	90.1	Very high	13 Å²	13	54.4 Å²	54.4	11%	0.107	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-45.5	176.1	0	0	0	0	0	111.9	E177 A178 V179 N184 S185 T186 I188	E177-A181 WeakPolarHBondContact O-CB 3.38Å; E177-A181 PolarHBondContact O-N 2.94Å; A178-A181 PolarHBondContact O-N 3.07Å; V179-A181 VanDerWaalsContact C-N 3.28Å; V179-A181 PolarHBondContact O-N 3.44Å; A181-N184 PolarHBondContact O-N 3.05Å; A181-S185 PolarHBondContact O-N 3.06Å; A181-T186 CarbonylContact C-O 3.47Å; A181-T186 WeakPolarHBondContact CA-OG1 3.49Å; A181-T186 WeakPolarHBondContact CB-OG1 3.47Å; A181-T186 PolarHBondContact O-N 3.14Å; A181-T186 PolarHBondContact O-OG1 3.36Å; A181-I188 HydrophobicContact CB-CG1 4.4Å
182	I	93.1	Very high	90.2	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-48.1	176.8	-67.9	165.1	0	0	0	110.9	A178 V179 N184 S185 I188 Q253 M256 I257 I260	A178-I182 WeakPolarHBondContact O-CD1 3.24Å; A178-I182 VanDerWaalsContact O-CG1 3.23Å; A178-I182 WeakPolarHBondContact O-CG1 3.26Å; A178-I182 PolarHBondContact O-N 3.4Å; V179-I182 PolarHBondContact O-N 3.41Å; I182-N184 VanDerWaalsContact C-N 3.34Å; I182-N184 PolarHBondContact O-N 3.43Å; I182-S185 PolarHBondContact O-N 3.47Å; I182-S185 VanDerWaalsContact O-N 3.08Å; I182-I188 HydrophobicContact CD1-CD1 3.8Å; I182-I188 HydrophobicContact CG1-CD1 3.6Å; I182-I188 HydrophobicContact CG1-CG1 3.99Å; I182-Q253 HydrophobicContact CG2-CB 3.81Å; I182-Q253 HydrophobicContact CG2-CG 3.91Å; I182-Q253 PolarHBondContact O-NE2 3.45Å; I182-M256 HydrophobicContact CD1-CB 4.45Å; I182-M256 HydrophobicContact CD1-CG 3.9Å; I182-M256 HydrophobicContact CD1-SD 3.92Å; I182-M256 HydrophobicContact CG1-CG 4.34Å; I182-M256 HydrophobicContact CG1-SD 3.71Å; I182-M256 HydrophobicContact CG2-CB 4.26Å; I182-M256 HydrophobicContact CG2-SD 4.11Å; I182-I257 HydrophobicContact CD1-CG1 3.97Å; I182-I257 HydrophobicContact CG2-CD1 4.19Å; I182-I257 HydrophobicContact CG2-CG1 4.19Å; I182-I260 HydrophobicContact CD1-CD1 3.52Å
183	Q	91.7	Very high	90.2	Very high	12 Å²	12	62 Å²	62	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-37.8	-178.3	-77.3	173.6	-18.4	0	0	112.8	V179 S185 H222 Q253 I257	V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 WeakPolarHBondContact O-CB 3.35Å; V179-Q183 WeakPolarHBondContact O-CG 3.5Å; V179-Q183 PolarHBondContact O-N 3.49Å; Q183-S185 PolarHBondContact O-N 3.44Å; Q183-H222 HydrophobicContact CG-CB 4.49Å; Q183-Q253 PolarHBondContact O-NE2 3.13Å; Q183-I257 HydrophobicContact CG-CD1 4.3Å
184	N	90.6	Very high	90.3	Very high	101 Å²	101	61.6 Å²	61.6	54%	0.54	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	6.5	175.9	-64.7	-42.7	0	0	0	113.4	E180 A181 I182 T186	E180-N184 WeakPolarHBondContact O-CB 3.5Å; E180-N184 PolarHBondContact O-N 3.16Å; E180-N184 PolarHBondContact O-ND2 2.65Å; A181-N184 PolarHBondContact O-N 3.05Å; I182-N184 VanDerWaalsContact C-N 3.34Å; I182-N184 PolarHBondContact O-N 3.43Å; N184-T186 HydrophobicContact CB-CG2 4.19Å; N184-T186 PolarHBondContact O-N 3.22Å
185	S	90.8	Very high	90.3	Very high	95 Å²	95	59.7 Å²	59.7	66%	0.664	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.9	-175.8	-54.5	0	0	0	0	113.5	A181 I182 Q183	A181-S185 PolarHBondContact O-N 3.06Å; I182-S185 PolarHBondContact O-N 3.47Å; I182-S185 VanDerWaalsContact O-N 3.08Å; Q183-S185 PolarHBondContact O-N 3.44Å
186	T	90.5	Very high	90.3	Very high	81 Å²	81	62.6 Å²	62.6	50%	0.497	33%	0.325	S	S	.	.			trans	-105.8	157.5	176.9	59.2	0	0	0	0	111.3	A181 N184 I188	A181-T186 CarbonylContact C-O 3.47Å; A181-T186 WeakPolarHBondContact CA-OG1 3.49Å; A181-T186 WeakPolarHBondContact CB-OG1 3.47Å; A181-T186 PolarHBondContact O-N 3.14Å; A181-T186 PolarHBondContact O-OG1 3.36Å; N184-T186 HydrophobicContact CB-CG2 4.19Å; N184-T186 PolarHBondContact O-N 3.22Å; T186-I188 PolarHBondContact O-N 3.03Å
187	S	85.4	Confident	90.2	Very high	110 Å²	110	63.9 Å²	63.9	77%	0.769	33%	0.332	S	S	*	.			trans	-69.3	130.7	-177.5	59.9	0	0	0	0	112.1
188	I	87.4	Confident	90	Very high	44 Å²	44	61.6 Å²	61.6	23%	0.226	32%	0.322	C	S	.	.			trans	-70.4	131.4	175.2	-49.2	171.9	0	0	0	109.2	A178 A181 I182 T186 Y190 L192 L195 M256	A178-I188 HydrophobicContact CB-CG2 3.9Å; A181-I188 HydrophobicContact CB-CG1 4.4Å; I182-I188 HydrophobicContact CD1-CD1 3.8Å; I182-I188 HydrophobicContact CG1-CD1 3.6Å; I182-I188 HydrophobicContact CG1-CG1 3.99Å; T186-I188 PolarHBondContact O-N 3.03Å; I188-Y190 VanDerWaalsContact C-N 3.32Å; I188-Y190 WeakPolarHBondContact CG2-O 3.2Å; I188-L192 HydrophobicContact CD1-CD2 4.12Å; I188-L195 HydrophobicContact CG2-CD1 3.85Å; I188-M256 HydrophobicContact CD1-SD 4.27Å
189	K	83.2	Confident	89.9	Confident	165 Å²	165	61.5 Å²	61.5	72%	0.717	32%	0.322	S	S	*	.	S	Bend	trans	-72.2	-24.6	179.2	-59.6	175.3	-168.3	159.6	0	113.6	E177	E177-K189 IonicContact OE2-NZ 2.65Å; E177-K189 PolarHBondContact OE2-NZ 3.45Å
190	Y	86.9	Confident	89.8	Confident	75 Å²	75	64.7 Å²	64.7	29%	0.294	34%	0.336	S	S	.	.	S	Bend	trans	-109.9	152.7	-172.3	-51.7	-73.5	0	0	0	111.1	K174 I188 L195	K174-Y190 HydrophobicContact CB-CE2 4.47Å; K174-Y190 HydrophobicContact CD-CD1 4.28Å; K174-Y190 HydrophobicContact CD-CE1 4.28Å; K174-Y190 HydrophobicContact CD-CG 4.38Å; K174-Y190 VanDerWaalsContact CE-CG 3.44Å; K174-Y190 HydrophobicContact CG-CD1 4.25Å; K174-Y190 HydrophobicContact CG-CD2 3.7Å; K174-Y190 HydrophobicContact CG-CE1 4.11Å; K174-Y190 HydrophobicContact CG-CE2 3.58Å; K174-Y190 HydrophobicContact CG-CG 4.03Å; I188-Y190 VanDerWaalsContact C-N 3.32Å; I188-Y190 WeakPolarHBondContact CG2-O 3.2Å; Y190-L195 HydrophobicContact CD2-CD2 4.32Å; Y190-L195 HydrophobicContact CG-CD2 4.37Å
191	N	90.1	Very high	89.5	Confident	88 Å²	88	64.9 Å²	64.9	47%	0.471	34%	0.339	S	S	.	.			trans	-77.6	149	178.4	74.2	75.9	0	0	0	111.4	E193 E194 L195	N191-E193 VanDerWaalsContact C-N 3.32Å; N191-E193 PolarHBondContact O-N 2.99Å; N191-E193 PolarHBondContact OD1-N 3.03Å; N191-E194 VanDerWaalsContact CG-CB 3.45Å; N191-E194 VanDerWaalsContact ND2-CB 3.3Å; N191-E194 WeakPolarHBondContact ND2-CB 3.42Å; N191-E194 PolarHBondContact ND2-OE2 3.13Å; N191-E194 PolarHBondContact O-N 3.29Å; N191-E194 WeakPolarHBondContact OD1-CB 3.29Å; N191-E194 PolarHBondContact OD1-N 2.99Å; N191-L195 WeakPolarHBondContact O-CG 3.43Å; N191-L195 PolarHBondContact O-N 2.96Å; N191-L195 VanDerWaalsContact O-N 3.11Å
192	L	88.6	Confident	89.1	Confident	92 Å²	92	64.5 Å²	64.5	48%	0.482	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-35.3	-173.6	-67.3	174.8	0	0	0	113.1	I188 L195 Y196 I260	I188-L192 HydrophobicContact CD1-CD2 4.12Å; L192-L195 PolarHBondContact O-N 3.47Å; L192-Y196 WeakPolarHBondContact O-CB 3.5Å; L192-Y196 PolarHBondContact O-N 3.08Å; L192-I260 HydrophobicContact CD2-CD1 3.88Å; L192-I260 HydrophobicContact CD2-CG1 3.78Å
193	E	89.3	Confident	88.7	Confident	109 Å²	109	64.5 Å²	64.5	51%	0.509	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-42.2	179	-177.8	59.7	-151.8	0	0	111.2	N191 L195 Y196 Q197	N191-E193 VanDerWaalsContact C-N 3.32Å; N191-E193 PolarHBondContact O-N 2.99Å; N191-E193 PolarHBondContact OD1-N 3.03Å; E193-L195 VanDerWaalsContact C-N 3.34Å; E193-L195 PolarHBondContact O-N 2.98Å; E193-Y196 PolarHBondContact O-N 3.2Å; E193-Q197 WeakPolarHBondContact O-CB 3.42Å; E193-Q197 VanDerWaalsContact O-CG 3.31Å; E193-Q197 WeakPolarHBondContact O-CG 3.41Å; E193-Q197 PolarHBondContact O-N 3.45Å; E193-Q197 PolarHBondContact OE1-NE2 3.36Å
194	E	90.5	Very high	88.1	Confident	74 Å²	74	67.6 Å²	67.6	35%	0.346	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-37.2	176.3	-178.5	-175.9	-170.4	0	0	111.7	K174 N191 A198	K174-E194 IonicContact NZ-OE1 3.76Å; K174-E194 PolarHBondContact NZ-OE1 3.33Å; K174-E194 IonicContact NZ-OE2 3.96Å; N191-E194 VanDerWaalsContact CG-CB 3.45Å; N191-E194 VanDerWaalsContact ND2-CB 3.3Å; N191-E194 WeakPolarHBondContact ND2-CB 3.42Å; N191-E194 PolarHBondContact ND2-OE2 3.13Å; N191-E194 PolarHBondContact O-N 3.29Å; N191-E194 WeakPolarHBondContact OD1-CB 3.29Å; N191-E194 PolarHBondContact OD1-N 2.99Å; E194-A198 VanDerWaalsContact O-CB 3.25Å; E194-A198 WeakPolarHBondContact O-CB 3.37Å; E194-A198 PolarHBondContact O-N 3.35Å
195	L	90.9	Very high	87.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-69.8	-38.8	173.6	-66.1	170.5	0	0	0	111.8	K174 L175 A178 I188 Y190 N191 L192 E193 A198 V199 I260	K174-L195 HydrophobicContact CD-CD2 4.35Å; K174-L195 HydrophobicContact CG-CD2 3.98Å; L175-L195 HydrophobicContact CD2-CB 4.29Å; L175-L195 HydrophobicContact CD2-CD2 4.01Å; A178-L195 HydrophobicContact CB-CD1 3.66Å; A178-L195 HydrophobicContact CB-CD2 4.05Å; I188-L195 HydrophobicContact CG2-CD1 3.85Å; Y190-L195 HydrophobicContact CD2-CD2 4.32Å; Y190-L195 HydrophobicContact CG-CD2 4.37Å; N191-L195 WeakPolarHBondContact O-CG 3.43Å; N191-L195 PolarHBondContact O-N 2.96Å; N191-L195 VanDerWaalsContact O-N 3.11Å; L192-L195 PolarHBondContact O-N 3.47Å; E193-L195 VanDerWaalsContact C-N 3.34Å; E193-L195 PolarHBondContact O-N 2.98Å; L195-A198 WeakPolarHBondContact O-CB 3.4Å; L195-A198 PolarHBondContact O-N 3.38Å; L195-V199 WeakPolarHBondContact O-CG2 3.49Å; L195-V199 PolarHBondContact O-N 3.01Å; L195-V199 VanDerWaalsContact O-N 3.09Å; L195-I260 HydrophobicContact CB-CG2 3.77Å; L195-I260 HydrophobicContact CD1-CD1 4.15Å
196	Y	92.4	Very high	87.1	Confident	61 Å²	61	72 Å²	72	24%	0.239	36%	0.363	C	S	.	.	H	α-helix	trans	-63.3	-48.7	174.8	173	-91.3	0	0	0	111.6	L192 E193 A198 V199 E200 L262 F263	L192-Y196 WeakPolarHBondContact O-CB 3.5Å; L192-Y196 PolarHBondContact O-N 3.08Å; E193-Y196 PolarHBondContact O-N 3.2Å; Y196-A198 VanDerWaalsContact C-N 3.27Å; Y196-A198 PolarHBondContact O-N 3.28Å; Y196-V199 WeakPolarHBondContact O-CB 3.46Å; Y196-V199 PolarHBondContact O-N 2.99Å; Y196-E200 PolarHBondContact O-N 2.99Å; Y196-L262 HydrophobicContact CD2-CB 4.3Å; Y196-L262 HydrophobicContact CE2-CB 3.96Å; Y196-L262 HydrophobicContact CE2-CD2 4.46Å; Y196-F263 HydrophobicContact CE2-CB 3.9Å
197	Q	89.8	Confident	86.7	Confident	87 Å²	87	70.4 Å²	70.4	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-35.3	176.5	-71.4	175	12.6	0	0	111.9	E193 V199 E200 N201	E193-Q197 WeakPolarHBondContact O-CB 3.42Å; E193-Q197 VanDerWaalsContact O-CG 3.31Å; E193-Q197 WeakPolarHBondContact O-CG 3.41Å; E193-Q197 PolarHBondContact O-N 3.45Å; E193-Q197 PolarHBondContact OE1-NE2 3.36Å; Q197-V199 VanDerWaalsContact C-N 3.34Å; Q197-E200 PolarHBondContact O-N 3.34Å; Q197-N201 WeakPolarHBondContact O-CB 3.32Å; Q197-N201 VanDerWaalsContact O-CG 3.24Å; Q197-N201 PolarHBondContact O-N 3.45Å; Q197-N201 PolarHBondContact O-ND2 3.05Å; Q197-N201 VanDerWaalsContact O-ND2 3.12Å
198	A	88.5	Confident	86.8	Confident	8 Å²	8	65.8 Å²	65.8	7%	0.066	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-42.2	172.5	0	0	0	0	0	112	T171 E194 L195 Y196 L202	T171-A198 HydrophobicContact CG2-CB 3.62Å; E194-A198 VanDerWaalsContact O-CB 3.25Å; E194-A198 WeakPolarHBondContact O-CB 3.37Å; E194-A198 PolarHBondContact O-N 3.35Å; L195-A198 WeakPolarHBondContact O-CB 3.4Å; L195-A198 PolarHBondContact O-N 3.38Å; Y196-A198 VanDerWaalsContact C-N 3.27Å; Y196-A198 PolarHBondContact O-N 3.28Å; A198-L202 WeakPolarHBondContact O-CB 3.48Å; A198-L202 VanDerWaalsContact O-CG 3.3Å; A198-L202 WeakPolarHBondContact O-CG 3.37Å; A198-L202 PolarHBondContact O-N 3.49Å; A198-L202 VanDerWaalsContact O-N 3.08Å
199	V	89.9	Confident	86.8	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-44.1	174.1	175.6	0	0	0	0	111.3	L175 L195 Y196 Q197 L202 C203 L211 I260 F261 L264	L175-V199 HydrophobicContact CD1-CG2 3.79Å; L175-V199 HydrophobicContact CD2-CG2 3.66Å; L175-V199 HydrophobicContact CG-CG2 4.41Å; L195-V199 WeakPolarHBondContact O-CG2 3.49Å; L195-V199 PolarHBondContact O-N 3.01Å; L195-V199 VanDerWaalsContact O-N 3.09Å; Y196-V199 WeakPolarHBondContact O-CB 3.46Å; Y196-V199 PolarHBondContact O-N 2.99Å; Q197-V199 VanDerWaalsContact C-N 3.34Å; V199-L202 PolarHBondContact O-N 3.41Å; V199-C203 WeakPolarHBondContact O-CB 3.23Å; V199-C203 PolarHBondContact O-N 2.59Å; V199-C203 PolarHBondContact O-SG 3.29Å; V199-L211 HydrophobicContact CG1-CD2 4.13Å; V199-I260 HydrophobicContact CG2-CG2 4.4Å; V199-F261 HydrophobicContact CG1-CD1 4.1Å; V199-F261 HydrophobicContact CG2-CD1 3.72Å; V199-F261 HydrophobicContact CG2-CE1 3.87Å; V199-F261 HydrophobicContact CG2-CG 4.2Å; V199-F261 HydrophobicContact CG2-CZ 4.44Å; V199-L264 HydrophobicContact CG1-CB 3.89Å
200	E	91.1	Very high	87	Confident	68 Å²	68	64.5 Å²	64.5	32%	0.318	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-47.1	178.3	176.4	170.3	-165.2	0	0	112.2	Y196 Q197 C203 S204 F263	Y196-E200 PolarHBondContact O-N 2.99Å; Q197-E200 PolarHBondContact O-N 3.34Å; E200-C203 PolarHBondContact O-N 3.21Å; E200-S204 WeakPolarHBondContact O-CB 3.31Å; E200-S204 PolarHBondContact O-N 3.34Å; E200-S204 PolarHBondContact O-OG 2.93Å; E200-F263 HydrophobicContact CB-CB 4.37Å; E200-F263 HydrophobicContact CB-CD1 4.2Å; E200-F263 HydrophobicContact CB-CD2 4.12Å; E200-F263 HydrophobicContact CB-CE2 4.46Å; E200-F263 HydrophobicContact CB-CG 3.97Å; E200-F263 HydrophobicContact CG-CD1 4.29Å; E200-F263 HydrophobicContact CG-CD2 3.86Å; E200-F263 HydrophobicContact CG-CE1 4.16Å; E200-F263 HydrophobicContact CG-CE2 3.72Å; E200-F263 HydrophobicContact CG-CG 4.14Å; E200-F263 HydrophobicContact CG-CZ 3.87Å
201	N	86.6	Confident	87.2	Confident	69 Å²	69	61 Å²	61	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-49.6	177.2	-72	-33.1	0	0	0	110.8	Q197 C203 S204 H205	Q197-N201 WeakPolarHBondContact O-CB 3.32Å; Q197-N201 VanDerWaalsContact O-CG 3.24Å; Q197-N201 PolarHBondContact O-N 3.45Å; Q197-N201 PolarHBondContact O-ND2 3.05Å; Q197-N201 VanDerWaalsContact O-ND2 3.12Å; N201-C203 VanDerWaalsContact C-N 3.28Å; N201-C203 PolarHBondContact O-N 2.61Å; N201-S204 WeakPolarHBondContact O-CB 3.15Å; N201-S204 PolarHBondContact O-N 2.9Å; N201-S204 VanDerWaalsContact O-N 3.13Å; N201-H205 PolarHBondContact O-CD2 2.83Å; N201-H205 PolarHBondContact O-N 2.9Å
202	L	83.9	Confident	87.3	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-38	177.3	-76.1	175.7	0	0	0	113	T168 T171 L175 A198 V199 H205 I207 L211	T168-L202 HydrophobicContact CG2-CD2 4.41Å; T171-L202 HydrophobicContact CG2-CD1 3.53Å; T171-L202 HydrophobicContact CG2-CD2 4.4Å; T171-L202 HydrophobicContact CG2-CG 3.88Å; L175-L202 HydrophobicContact CD1-CD1 3.75Å; A198-L202 WeakPolarHBondContact O-CB 3.48Å; A198-L202 VanDerWaalsContact O-CG 3.3Å; A198-L202 WeakPolarHBondContact O-CG 3.37Å; A198-L202 PolarHBondContact O-N 3.49Å; A198-L202 VanDerWaalsContact O-N 3.08Å; V199-L202 PolarHBondContact O-N 3.41Å; L202-H205 PolarHBondContact O-N 2.63Å; L202-I207 PolarHBondContact O-N 3Å; L202-L211 HydrophobicContact CB-CD2 4.4Å; L202-L211 HydrophobicContact CD1-CD1 4.42Å
203	C	84	Confident	87.5	Confident	11 Å²	11	60.4 Å²	60.4	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-68.1	-39.9	176.4	-70.4	0	0	0	0	112	V199 E200 N201 H205 K206 S208 F263	V199-C203 WeakPolarHBondContact O-CB 3.23Å; V199-C203 PolarHBondContact O-N 2.59Å; V199-C203 PolarHBondContact O-SG 3.29Å; E200-C203 PolarHBondContact O-N 3.21Å; N201-C203 VanDerWaalsContact C-N 3.28Å; N201-C203 PolarHBondContact O-N 2.61Å; C203-H205 PolarHBondContact O-N 3.13Å; C203-K206 PolarHBondContact O-N 2.8Å; C203-S208 WeakPolarHBondContact CA-OG 3.5Å; C203-S208 PolarHBondContact O-OG 3Å; C203-F263 HydrophobicContact CB-CD1 3.65Å; C203-F263 HydrophobicContact CB-CE1 3.65Å
204	S	80.7	Confident	87.6	Confident	77 Å²	77	57.6 Å²	57.6	54%	0.538	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-25.7	177.1	-62.8	0	0	0	0	112.9	E200 N201 K206	E200-S204 WeakPolarHBondContact O-CB 3.31Å; E200-S204 PolarHBondContact O-N 3.34Å; E200-S204 PolarHBondContact O-OG 2.93Å; N201-S204 WeakPolarHBondContact O-CB 3.15Å; N201-S204 PolarHBondContact O-N 2.9Å; N201-S204 VanDerWaalsContact O-N 3.13Å; S204-K206 VanDerWaalsContact C-N 3.27Å; S204-K206 PolarHBondContact O-N 3.26Å
205	H	78.3	Confident	87.8	Confident	90 Å²	90	54 Å²	54	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	13.6	174.2	-68.1	-70.3	0	0	0	114.7	N201 L202 C203 I207	N201-H205 PolarHBondContact O-CD2 2.83Å; N201-H205 PolarHBondContact O-N 2.9Å; L202-H205 PolarHBondContact O-N 2.63Å; C203-H205 PolarHBondContact O-N 3.13Å; H205-I207 VanDerWaalsContact C-N 3.29Å; H205-I207 HydrophobicContact CB-CD1 4.23Å; H205-I207 HydrophobicContact CB-CG1 4.32Å; H205-I207 PolarHBondContact O-N 3.48Å
206	K	80.8	Confident	88	Confident	199 Å²	199	57.7 Å²	57.7	87%	0.865	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	25.4	179.8	-56.8	-173.5	174.8	-173.7	0	114.9	C203 S204	C203-K206 PolarHBondContact O-N 2.8Å; S204-K206 VanDerWaalsContact C-N 3.27Å; S204-K206 PolarHBondContact O-N 3.26Å
207	I	82.8	Confident	88.1	Confident	47 Å²	47	57.8 Å²	57.8	24%	0.241	29%	0.287	C	S	.	.			trans	-93.9	2.5	179.2	-52.1	176.4	0	0	0	111.7	T168 L202 H205 A209 K210 L211	T168-I207 HydrophobicContact CG2-CD1 3.42Å; T168-I207 VanDerWaalsContact CG2-CD1 3.42Å; L202-I207 PolarHBondContact O-N 3Å; H205-I207 VanDerWaalsContact C-N 3.29Å; H205-I207 HydrophobicContact CB-CD1 4.23Å; H205-I207 HydrophobicContact CB-CG1 4.32Å; H205-I207 PolarHBondContact O-N 3.48Å; I207-A209 VanDerWaalsContact C-N 3.32Å; I207-A209 PolarHBondContact O-N 3.43Å; I207-A209 VanDerWaalsContact O-N 3.13Å; I207-K210 HydrophobicContact CG2-CB 4.11Å; I207-K210 HydrophobicContact CG2-CD 4.44Å; I207-K210 PolarHBondContact O-N 2.82Å; I207-K210 VanDerWaalsContact O-N 3.08Å; I207-L211 PolarHBondContact O-N 3.28Å
208	S	86.4	Confident	88.4	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-53.3	-38.8	-172.5	-43.6	0	0	0	0	115	C203 L211 Y212 Y268	C203-S208 WeakPolarHBondContact CA-OG 3.5Å; C203-S208 PolarHBondContact O-OG 3Å; S208-L211 PolarHBondContact O-N 3.09Å; S208-Y212 PolarHBondContact O-N 3.47Å; S208-Y268 VanDerWaalsContact CB-CG 3.47Å
209	A	87.7	Confident	88.7	Confident	50 Å²	50	53.9 Å²	53.9	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-43.8	178.8	0	0	0	0	0	112.8	I207 K213 Y268	I207-A209 VanDerWaalsContact C-N 3.32Å; I207-A209 PolarHBondContact O-N 3.43Å; I207-A209 VanDerWaalsContact O-N 3.13Å; A209-K213 PolarHBondContact O-N 3.23Å; A209-Y268 HydrophobicContact CB-CE1 4.26Å; A209-Y268 HydrophobicContact CB-CE2 4.28Å; A209-Y268 VanDerWaalsContact CB-OH 3.23Å; A209-Y268 WeakPolarHBondContact CB-OH 3.36Å
210	K	88.4	Confident	88.9	Confident	133 Å²	133	55.3 Å²	55.3	58%	0.578	28%	0.275	S	S	*	.	H	α-helix	trans	-67.6	-41.4	176.7	-173.9	-179.4	177.3	-177.1	0	110.2	I207 K213 Q214	I207-K210 HydrophobicContact CG2-CB 4.11Å; I207-K210 HydrophobicContact CG2-CD 4.44Å; I207-K210 PolarHBondContact O-N 2.82Å; I207-K210 VanDerWaalsContact O-N 3.08Å; K210-K213 PolarHBondContact O-N 3.35Å; K210-Q214 HydrophobicContact CG-CG 4.33Å; K210-Q214 WeakPolarHBondContact O-CB 3.42Å; K210-Q214 VanDerWaalsContact O-CG 3.27Å; K210-Q214 WeakPolarHBondContact O-CG 3.45Å; K210-Q214 PolarHBondContact O-N 3.06Å
211	L	90	Very high	89.1	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-45.8	-179.7	-172.8	62.4	0	0	0	112.3	W172 L175 V199 L202 I207 S208 Q214 L215 F261 L264	W172-L211 HydrophobicContact CE3-CD1 3.42Å; W172-L211 VanDerWaalsContact CE3-CD1 3.42Å; W172-L211 HydrophobicContact CZ3-CD1 3.61Å; L175-L211 HydrophobicContact CD1-CD1 4.23Å; V199-L211 HydrophobicContact CG1-CD2 4.13Å; L202-L211 HydrophobicContact CB-CD2 4.4Å; L202-L211 HydrophobicContact CD1-CD1 4.42Å; I207-L211 PolarHBondContact O-N 3.28Å; S208-L211 PolarHBondContact O-N 3.09Å; L211-Q214 PolarHBondContact O-N 3.24Å; L211-L215 WeakPolarHBondContact O-CB 3.25Å; L211-L215 PolarHBondContact O-N 2.78Å; L211-F261 HydrophobicContact CD1-CE1 4.22Å; L211-F261 HydrophobicContact CD2-CE1 4.4Å; L211-F261 HydrophobicContact CG-CE1 4.27Å; L211-L264 HydrophobicContact CD2-CD1 4.43Å; L211-L264 HydrophobicContact CD2-CD2 4.17Å; L211-L264 HydrophobicContact CG-CD2 4.13Å
212	Y	93.1	Very high	89.4	Confident	12 Å²	12	54.4 Å²	54.4	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-45.5	176.1	-177.5	-90	0	0	0	111.9	S208 Q214 L215 R216 L264 V269 L275 P276 I278 M281	S208-Y212 PolarHBondContact O-N 3.47Å; Y212-Q214 VanDerWaalsContact C-N 3.32Å; Y212-Q214 PolarHBondContact O-N 3.38Å; Y212-L215 PolarHBondContact O-N 3.44Å; Y212-R216 PolarHBondContact O-N 3.43Å; Y212-L264 HydrophobicContact CD2-CD2 4.49Å; Y212-V269 HydrophobicContact CD2-CG2 3.49Å; Y212-V269 VanDerWaalsContact CD2-CG2 3.49Å; Y212-V269 HydrophobicContact CE2-CG1 4.37Å; Y212-V269 HydrophobicContact CE2-CG2 3.63Å; Y212-V269 HydrophobicContact CG-CG2 4.46Å; Y212-L275 HydrophobicContact CE1-CD2 4.2Å; Y212-P276 WeakPolarHBondContact OH-CD 3.46Å; Y212-P276 WeakPolarHBondContact OH-CG 3.46Å; Y212-P276 PolarHBondContact OH-O 2.88Å; Y212-I278 HydrophobicContact CE2-CG1 4.49Å; Y212-M281 HydrophobicContact CE1-SD 4.47Å; Y212-M281 HydrophobicContact CE2-SD 4.35Å
213	K	92.1	Very high	89.8	Confident	154 Å²	154	54.4 Å²	54.4	67%	0.67	27%	0.272	S	S	*	.	H	α-helix	trans	-61.5	-40.9	177.5	-173.8	174.8	-178.8	176	0	112.1	A209 K210 T217	A209-K213 PolarHBondContact O-N 3.23Å; K210-K213 PolarHBondContact O-N 3.35Å; K213-T217 PolarHBondContact O-N 2.88Å; K213-T217 PolarHBondContact O-OG1 3.15Å
214	Q	92.5	Very high	90.2	Very high	50 Å²	50	57.6 Å²	57.6	23%	0.234	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-43	177.7	-72.8	-180	-53.5	0	0	111.8	W172 K210 L211 Y212 T217 V218	W172-Q214 HydrophobicContact CD2-CB 4.28Å; W172-Q214 HydrophobicContact CE3-CB 4.3Å; W172-Q214 VanDerWaalsContact CH2-C 3.5Å; W172-Q214 HydrophobicContact CH2-CB 3.48Å; W172-Q214 VanDerWaalsContact CH2-CB 3.48Å; W172-Q214 HydrophobicContact CZ2-CB 3.45Å; W172-Q214 VanDerWaalsContact CZ2-CB 3.45Å; W172-Q214 HydrophobicContact CZ2-CG 4.34Å; W172-Q214 HydrophobicContact CZ3-CB 3.92Å; K210-Q214 HydrophobicContact CG-CG 4.33Å; K210-Q214 WeakPolarHBondContact O-CB 3.42Å; K210-Q214 VanDerWaalsContact O-CG 3.27Å; K210-Q214 WeakPolarHBondContact O-CG 3.45Å; K210-Q214 PolarHBondContact O-N 3.06Å; L211-Q214 PolarHBondContact O-N 3.24Å; Y212-Q214 VanDerWaalsContact C-N 3.32Å; Y212-Q214 PolarHBondContact O-N 3.38Å; Q214-T217 PolarHBondContact O-N 3.22Å; Q214-V218 WeakPolarHBondContact O-CG2 3.34Å; Q214-V218 PolarHBondContact O-N 2.97Å; Q214-V218 VanDerWaalsContact O-N 3.09Å
215	L	94.3	Very high	90.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-46.2	173.9	179.4	62.5	0	0	0	111.6	V179 L211 Y212 T217 V218 C219 I257 F261 I278	V179-L215 HydrophobicContact CG1-CD1 4.36Å; V179-L215 HydrophobicContact CG2-CD1 3.86Å; L211-L215 WeakPolarHBondContact O-CB 3.25Å; L211-L215 PolarHBondContact O-N 2.78Å; Y212-L215 PolarHBondContact O-N 3.44Å; L215-T217 VanDerWaalsContact C-N 3.28Å; L215-T217 PolarHBondContact O-N 3.45Å; L215-V218 PolarHBondContact O-N 3.34Å; L215-C219 PolarHBondContact O-N 3.4Å; L215-C219 PolarHBondContact O-SG 3.03Å; L215-C219 VanDerWaalsContact O-SG 3.42Å; L215-I257 HydrophobicContact CD1-CG2 3.95Å; L215-I257 HydrophobicContact CD2-CG2 4.26Å; L215-F261 HydrophobicContact CD1-CD2 4.39Å; L215-F261 HydrophobicContact CD1-CE1 4.43Å; L215-F261 HydrophobicContact CD1-CE2 3.92Å; L215-F261 HydrophobicContact CD1-CZ 3.92Å; L215-F261 HydrophobicContact CD2-CB 4.35Å; L215-F261 HydrophobicContact CD2-CD1 3.91Å; L215-F261 HydrophobicContact CD2-CD2 4.11Å; L215-F261 HydrophobicContact CD2-CE1 4.15Å; L215-F261 HydrophobicContact CD2-CE2 4.36Å; L215-F261 HydrophobicContact CD2-CG 3.87Å; L215-F261 HydrophobicContact CD2-CZ 4.36Å; L215-I278 HydrophobicContact CD2-CD1 4.03Å; L215-I278 HydrophobicContact CD2-CG1 4.44Å; L215-I278 HydrophobicContact CD2-CG2 4.32Å
216	R	95	Very high	91.3	Very high	77 Å²	77	55 Å²	55	29%	0.291	27%	0.274	S	S	.	.	H	α-helix	trans	-55.8	-44.5	175.5	-172.6	173.8	-171.1	-90.7	10.4	111.6	Y212 C219 E220 M281 E284	Y212-R216 PolarHBondContact O-N 3.43Å; R216-C219 PolarHBondContact O-N 2.95Å; R216-E220 IonicContact NH1-OE2 3.89Å; R216-E220 PolarHBondContact NH1-OE2 2.91Å; R216-E220 WeakPolarHBondContact O-CB 3.49Å; R216-E220 PolarHBondContact O-N 3.46Å; R216-M281 HydrophobicContact CB-SD 3.5Å; R216-M281 VanDerWaalsContact CB-SD 3.5Å; R216-M281 HydrophobicContact CG-CG 4.01Å; R216-M281 HydrophobicContact CG-SD 3.63Å; R216-E284 IonicContact NH2-OE1 3.76Å; R216-E284 PolarHBondContact NH2-OE1 3.35Å
217	T	94.9	Very high	91.7	Very high	62 Å²	62	46.9 Å²	46.9	38%	0.38	24%	0.24	S	C	.	.	H	α-helix	trans	-62.4	-46	-179.4	-52.2	0	0	0	0	111.4	K213 Q214 L215 C219 E220 D221	K213-T217 PolarHBondContact O-N 2.88Å; K213-T217 PolarHBondContact O-OG1 3.15Å; Q214-T217 PolarHBondContact O-N 3.22Å; L215-T217 VanDerWaalsContact C-N 3.28Å; L215-T217 PolarHBondContact O-N 3.45Å; T217-C219 PolarHBondContact O-N 2.93Å; T217-E220 PolarHBondContact O-N 3.14Å; T217-D221 VanDerWaalsContact O-CG 3.31Å; T217-D221 PolarHBondContact O-N 3.11Å
218	V	95.3	Very high	91.8	Very high	13 Å²	13	49 Å²	49	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-42.9	178.5	177.6	0	0	0	0	111.3	W172 K176 V179 E180 Q214 L215 H222	W172-V218 HydrophobicContact CH2-CG2 4.13Å; W172-V218 HydrophobicContact CZ2-CG2 3.84Å; K176-V218 HydrophobicContact CD-CG2 4.44Å; K176-V218 HydrophobicContact CG-CG2 4.17Å; V179-V218 HydrophobicContact CB-CG1 4.39Å; V179-V218 HydrophobicContact CG1-CB 4.49Å; V179-V218 HydrophobicContact CG1-CG1 3.65Å; E180-V218 HydrophobicContact CG-CG1 4.29Å; Q214-V218 WeakPolarHBondContact O-CG2 3.34Å; Q214-V218 PolarHBondContact O-N 2.97Å; Q214-V218 VanDerWaalsContact O-N 3.09Å; L215-V218 PolarHBondContact O-N 3.34Å; V218-H222 PolarHBondContact O-N 2.99Å
219	C	94.8	Very high	91.7	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-42	174.3	-65.7	0	0	0	0	112.4	L215 R216 T217 H222 I223 M281 L285	L215-C219 PolarHBondContact O-N 3.4Å; L215-C219 PolarHBondContact O-SG 3.03Å; L215-C219 VanDerWaalsContact O-SG 3.42Å; R216-C219 PolarHBondContact O-N 2.95Å; T217-C219 PolarHBondContact O-N 2.93Å; C219-H222 PolarHBondContact O-N 3.21Å; C219-I223 VanDerWaalsContact O-CG1 3.27Å; C219-I223 WeakPolarHBondContact O-CG1 3.16Å; C219-I223 PolarHBondContact O-N 3.1Å; C219-M281 HydrophobicContact CB-CE 4.37Å; C219-L285 HydrophobicContact CB-CD1 3.75Å
220	E	94.9	Very high	91.7	Very high	30 Å²	30	49.2 Å²	49.2	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-45.2	179.8	179.7	170.5	174.2	0	0	112.1	R216 T217 H222 I223 K224 L285 Y289	R216-E220 IonicContact NH1-OE2 3.89Å; R216-E220 PolarHBondContact NH1-OE2 2.91Å; R216-E220 WeakPolarHBondContact O-CB 3.49Å; R216-E220 PolarHBondContact O-N 3.46Å; T217-E220 PolarHBondContact O-N 3.14Å; E220-H222 PolarHBondContact O-N 3.5Å; E220-I223 PolarHBondContact O-N 2.94Å; E220-K224 HydrophobicContact CG-CD 4.34Å; E220-K224 WeakPolarHBondContact O-CG 3.27Å; E220-K224 PolarHBondContact O-N 3.25Å; E220-K224 WeakPolarHBondContact OE1-CE 3.09Å; E220-K224 IonicContact OE1-NZ 2.79Å; E220-K224 PolarHBondContact OE1-NZ 3.39Å; E220-L285 HydrophobicContact CB-CD1 4.25Å; E220-L285 HydrophobicContact CB-CD2 3.8Å; E220-L285 HydrophobicContact CG-CD2 3.93Å; E220-Y289 HydrophobicContact CG-CE2 3.66Å; E220-Y289 PolarHBondContact OE1-OH 3.43Å
221	D	93.9	Very high	91.2	Very high	94 Å²	94	51 Å²	51	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-40.8	178.5	-69.1	-20.6	0	0	0	111.7	T217 A225	T217-D221 VanDerWaalsContact O-CG 3.31Å; T217-D221 PolarHBondContact O-N 3.11Å; D221-A225 PolarHBondContact O-N 3.01Å; D221-A225 VanDerWaalsContact O-N 3.16Å
222	H	93.7	Very high	90.5	Very high	24 Å²	24	55.9 Å²	55.9	11%	0.111	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-47.8	176	179.2	74.8	0	0	0	112.1	Q183 V218 C219 E220 K224 A225 Q226	Q183-H222 HydrophobicContact CG-CB 4.49Å; V218-H222 PolarHBondContact O-N 2.99Å; C219-H222 PolarHBondContact O-N 3.21Å; E220-H222 PolarHBondContact O-N 3.5Å; H222-K224 VanDerWaalsContact C-N 3.33Å; H222-K224 PolarHBondContact O-N 3.12Å; H222-A225 WeakPolarHBondContact O-CB 3.49Å; H222-A225 PolarHBondContact O-N 3.23Å; H222-A225 VanDerWaalsContact O-N 3.13Å; H222-Q226 PolarHBondContact CE1-NE2 2.88Å; H222-Q226 WeakPolarHBondContact O-CG 3.28Å; H222-Q226 PolarHBondContact O-N 3.44Å; H222-Q226 VanDerWaalsContact O-N 3.14Å
223	I	93.4	Very high	89.2	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-37.9	-179.3	-63.5	-66.8	0	0	0	111.3	C219 E220 A225 Q226 H250 F286 I290	C219-I223 VanDerWaalsContact O-CG1 3.27Å; C219-I223 WeakPolarHBondContact O-CG1 3.16Å; C219-I223 PolarHBondContact O-N 3.1Å; E220-I223 PolarHBondContact O-N 2.94Å; I223-A225 VanDerWaalsContact C-N 3.29Å; I223-A225 PolarHBondContact O-N 3.46Å; I223-Q226 WeakPolarHBondContact O-CB 3.29Å; I223-Q226 PolarHBondContact O-N 3.08Å; I223-Q226 VanDerWaalsContact O-N 3.07Å; I223-H250 WeakPolarHBondContact CD1-ND1 3.45Å; I223-F286 HydrophobicContact CD1-CD2 4.38Å; I223-I290 HydrophobicContact CG2-CD1 4.13Å; I223-I290 HydrophobicContact CG2-CG1 3.82Å
224	K	91.9	Very high	88.3	Confident	78 Å²	78	55.9 Å²	55.9	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-41.7	172.5	-76.9	172.5	-174.8	164.2	0	111.9	E220 H222 Q226 I227 Y289	E220-K224 HydrophobicContact CG-CD 4.34Å; E220-K224 WeakPolarHBondContact O-CG 3.27Å; E220-K224 PolarHBondContact O-N 3.25Å; E220-K224 WeakPolarHBondContact OE1-CE 3.09Å; E220-K224 IonicContact OE1-NZ 2.79Å; E220-K224 PolarHBondContact OE1-NZ 3.39Å; H222-K224 VanDerWaalsContact C-N 3.33Å; H222-K224 PolarHBondContact O-N 3.12Å; K224-Q226 PolarHBondContact O-N 3.19Å; K224-I227 WeakPolarHBondContact O-CG2 3.42Å; K224-I227 PolarHBondContact O-N 3.44Å; K224-Y289 HydrophobicContact CD-CE1 4.14Å; K224-Y289 WeakPolarHBondContact CE-OH 3.32Å; K224-Y289 HydrophobicContact CG-CD1 3.73Å; K224-Y289 HydrophobicContact CG-CD2 4.34Å; K224-Y289 HydrophobicContact CG-CE1 3.86Å; K224-Y289 HydrophobicContact CG-CE2 4.43Å; K224-Y289 HydrophobicContact CG-CG 4Å; K224-Y289 PolarHBondContact NZ-OH 3.01Å
225	A	91.7	Very high	88	Confident	60 Å²	60	58 Å²	58	50%	0.496	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-27	176.7	0	0	0	0	0	112.9	D221 H222 I223 I227	D221-A225 PolarHBondContact O-N 3.01Å; D221-A225 VanDerWaalsContact O-N 3.16Å; H222-A225 WeakPolarHBondContact O-CB 3.49Å; H222-A225 PolarHBondContact O-N 3.23Å; H222-A225 VanDerWaalsContact O-N 3.13Å; I223-A225 VanDerWaalsContact C-N 3.29Å; I223-A225 PolarHBondContact O-N 3.46Å; A225-I227 VanDerWaalsContact C-N 3.29Å; A225-I227 PolarHBondContact O-N 3.1Å
226	Q	90.6	Very high	87.7	Confident	54 Å²	54	59.9 Å²	59.9	25%	0.252	32%	0.321	S	S	.	.	H	α-helix	trans	-71.1	-17.9	177.7	-66	-54	-54.9	0	0	113.6	H222 I223 K224 D228 Q229 F230 I290	H222-Q226 PolarHBondContact CE1-NE2 2.88Å; H222-Q226 WeakPolarHBondContact O-CG 3.28Å; H222-Q226 PolarHBondContact O-N 3.44Å; H222-Q226 VanDerWaalsContact O-N 3.14Å; I223-Q226 WeakPolarHBondContact O-CB 3.29Å; I223-Q226 PolarHBondContact O-N 3.08Å; I223-Q226 VanDerWaalsContact O-N 3.07Å; K224-Q226 PolarHBondContact O-N 3.19Å; Q226-D228 VanDerWaalsContact C-N 3.3Å; Q226-D228 PolarHBondContact O-N 3.39Å; Q226-Q229 WeakPolarHBondContact O-CG 3.31Å; Q226-Q229 PolarHBondContact O-NE2 2.9Å; Q226-F230 WeakPolarHBondContact O-CE2 3.27Å; Q226-I290 HydrophobicContact CB-CD1 4.13Å
227	I	88	Confident	87.4	Confident	27 Å²	27	58.1 Å²	58.1	14%	0.138	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-66.7	-33.2	-178	-158.3	-177.1	0	0	0	112.5	K224 A225 Q229 F230 Y289 I290 D293	K224-I227 WeakPolarHBondContact O-CG2 3.42Å; K224-I227 PolarHBondContact O-N 3.44Å; A225-I227 VanDerWaalsContact C-N 3.29Å; A225-I227 PolarHBondContact O-N 3.1Å; I227-Q229 PolarHBondContact O-N 3.27Å; I227-F230 PolarHBondContact O-N 3.22Å; I227-Y289 VanDerWaalsContact CD1-O 3.26Å; I227-Y289 WeakPolarHBondContact CD1-O 3.44Å; I227-I290 HydrophobicContact CB-CD1 4.09Å; I227-I290 HydrophobicContact CG1-CD1 4.45Å; I227-D293 HydrophobicContact CD1-CB 4.1Å
228	D	85.4	Confident	87.2	Confident	93 Å²	93	60.1 Å²	60.1	50%	0.497	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-66.1	-25.5	-171.3	-69.9	-32	0	0	0	112	Q226 F230 R231	Q226-D228 VanDerWaalsContact C-N 3.3Å; Q226-D228 PolarHBondContact O-N 3.39Å; D228-F230 PolarHBondContact O-N 3.49Å; D228-R231 PolarHBondContact O-N 3.44Å; D228-R231 IonicContact OD1-CZ 3.78Å; D228-R231 IonicContact OD1-NE 2.84Å; D228-R231 PolarHBondContact OD1-NE 2.99Å; D228-R231 IonicContact OD1-NH2 3.87Å
229	Q	85	Confident	87.1	Confident	55 Å²	55	59.6 Å²	59.6	26%	0.257	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-66.7	-16	174.9	86.1	-169	-57.1	0	0	113.6	Q226 I227 K242	Q226-Q229 WeakPolarHBondContact O-CG 3.31Å; Q226-Q229 PolarHBondContact O-NE2 2.9Å; I227-Q229 PolarHBondContact O-N 3.27Å; Q229-K242 WeakPolarHBondContact O-CE 3.35Å; Q229-K242 PolarHBondContact O-NZ 2.95Å
230	F	87.1	Confident	87.1	Confident	11 Å²	11	59.5 Å²	59.5	5%	0.048	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-99.6	-2.1	-179.5	-58.2	-63	0	0	0	113.3	Q226 I227 D228 D232 F239 K242 I243 C246 I290 V296	Q226-F230 WeakPolarHBondContact O-CE2 3.27Å; I227-F230 PolarHBondContact O-N 3.22Å; D228-F230 PolarHBondContact O-N 3.49Å; F230-D232 VanDerWaalsContact C-N 3.32Å; F230-D232 PolarHBondContact O-N 3.24Å; F230-F239 HydrophobicContact CB-CE2 4.14Å; F230-F239 HydrophobicContact CD1-CE2 4.13Å; F230-K242 HydrophobicContact CD1-CD 4.39Å; F230-K242 HydrophobicContact CE1-CB 4.27Å; F230-K242 HydrophobicContact CE1-CD 4.26Å; F230-K242 HydrophobicContact CE1-CG 3.92Å; F230-I243 HydrophobicContact CD1-CD1 3.52Å; F230-I243 HydrophobicContact CD1-CG1 4.09Å; F230-I243 HydrophobicContact CD2-CD1 4.26Å; F230-I243 HydrophobicContact CE1-CD1 3.33Å; F230-I243 HydrophobicContact CE1-CG1 3.8Å; F230-I243 HydrophobicContact CE2-CD1 4.1Å; F230-I243 HydrophobicContact CG-CD1 3.99Å; F230-I243 HydrophobicContact CZ-CD1 3.65Å; F230-I243 HydrophobicContact CZ-CG1 4.45Å; F230-C246 HydrophobicContact CE2-CB 4.5Å; F230-C246 HydrophobicContact CZ-CB 3.66Å; F230-I290 HydrophobicContact CD2-CG2 4.23Å; F230-I290 HydrophobicContact CE2-CD1 4.32Å; F230-I290 HydrophobicContact CE2-CG2 3.89Å; F230-V296 HydrophobicContact CB-CG2 3.89Å
231	R	77.9	Confident	87	Confident	171 Å²	171	63 Å²	63	65%	0.645	34%	0.337	S	S	*	.	S	Bend	trans	-75.2	-18.9	179.9	-67.3	-176.2	-177.3	-83.8	-3.7	113.6	D228	D228-R231 PolarHBondContact O-N 3.44Å; D228-R231 IonicContact OD1-CZ 3.78Å; D228-R231 IonicContact OD1-NE 2.84Å; D228-R231 PolarHBondContact OD1-NE 2.99Å; D228-R231 IonicContact OD1-NH2 3.87Å
232	D	75.8	Confident	87	Confident	104 Å²	104	61.5 Å²	61.5	56%	0.556	33%	0.326	S	S	*	.	S	Bend	trans	-75.3	144.1	-179.7	-66	-31.9	0	0	0	113.1	F230 L234	F230-D232 VanDerWaalsContact C-N 3.32Å; F230-D232 PolarHBondContact O-N 3.24Å; D232-L234 VanDerWaalsContact C-N 3.29Å; D232-L234 PolarHBondContact O-N 2.97Å
233	A	64.7	Low	87	Confident	107 Å²	107	60.3 Å²	60.3	88%	0.884	32%	0.321	S	S	*	.			trans	-74.4	77.9	177.4	0	0	0	0	0	111.6
234	L	74.1	Confident	87.1	Confident	58 Å²	58	61 Å²	61	30%	0.304	32%	0.324	S	S	.	.			trans	-84.5	153.4	172.7	-65	168.9	0	0	0	112	D232 F239 K242 K299	D232-L234 VanDerWaalsContact C-N 3.29Å; D232-L234 PolarHBondContact O-N 2.97Å; L234-F239 HydrophobicContact CB-CB 4.21Å; L234-K242 HydrophobicContact CD1-CD 3.77Å; L234-K299 WeakPolarHBondContact O-CE 3.39Å; L234-K299 PolarHBondContact O-NZ 2.94Å
235	D	86.4	Confident	87.2	Confident	96 Å²	96	63.1 Å²	63.1	51%	0.513	33%	0.333	S	S	.	.			trans	-53.5	147.1	163.7	171.1	74.4	0	0	0	111	V237 L238 F239	D235-V237 VanDerWaalsContact C-N 3.33Å; D235-V237 PolarHBondContact O-N 3.27Å; D235-V237 WeakPolarHBondContact OD2-CB 3.4Å; D235-V237 PolarHBondContact OD2-N 3.22Å; D235-L238 HydrophobicContact CB-CB 4.39Å; D235-L238 HydrophobicContact CB-CD1 4.25Å; D235-L238 HydrophobicContact CB-CG 4.39Å; D235-L238 PolarHBondContact O-N 3.41Å; D235-L238 PolarHBondContact OD2-N 2.95Å; D235-F239 VanDerWaalsContact O-CB 3.25Å; D235-F239 WeakPolarHBondContact O-CB 3.35Å; D235-F239 PolarHBondContact O-N 2.88Å
236	S	87.2	Confident	87.4	Confident	39 Å²	39	60.9 Å²	60.9	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-57.5	-41.5	-175	-60.6	0	0	0	0	112.8	F239 L240	S236-F239 PolarHBondContact O-N 2.9Å; S236-L240 VanDerWaalsContact O-CG 3.29Å; S236-L240 WeakPolarHBondContact O-CG 3.45Å; S236-L240 PolarHBondContact O-N 3.37Å
237	V	89.4	Confident	87.6	Confident	39 Å²	39	58.9 Å²	58.9	24%	0.236	30%	0.304	C	S	.	.	H	α-helix	trans	-72.8	-41.2	-177.9	-177.6	0	0	0	0	111.2	D235 F239 L240 K241 L307	D235-V237 VanDerWaalsContact C-N 3.33Å; D235-V237 PolarHBondContact O-N 3.27Å; D235-V237 WeakPolarHBondContact OD2-CB 3.4Å; D235-V237 PolarHBondContact OD2-N 3.22Å; V237-F239 VanDerWaalsContact C-N 3.31Å; V237-L240 PolarHBondContact O-N 3.27Å; V237-K241 PolarHBondContact O-N 3.29Å; V237-L307 HydrophobicContact CG2-CD2 4.08Å
238	L	90.1	Very high	88	Confident	104 Å²	104	60.5 Å²	60.5	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-38.5	175.4	-68.9	177.7	0	0	0	111.6	D235 K241 K242	D235-L238 HydrophobicContact CB-CB 4.39Å; D235-L238 HydrophobicContact CB-CD1 4.25Å; D235-L238 HydrophobicContact CB-CG 4.39Å; D235-L238 PolarHBondContact O-N 3.41Å; D235-L238 PolarHBondContact OD2-N 2.95Å; L238-K241 PolarHBondContact O-N 2.8Å; L238-K242 WeakPolarHBondContact O-CB 3.42Å; L238-K242 PolarHBondContact O-N 3.1Å
239	F	93.6	Very high	88.4	Confident	2 Å²	2	58 Å²	58	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-47.8	174.4	179.5	-95.7	0	0	0	111.5	F230 L234 D235 S236 V237 K241 K242 I243 V296 K299 T300	F230-F239 HydrophobicContact CB-CE2 4.14Å; F230-F239 HydrophobicContact CD1-CE2 4.13Å; L234-F239 HydrophobicContact CB-CB 4.21Å; D235-F239 VanDerWaalsContact O-CB 3.25Å; D235-F239 WeakPolarHBondContact O-CB 3.35Å; D235-F239 PolarHBondContact O-N 2.88Å; S236-F239 PolarHBondContact O-N 2.9Å; V237-F239 VanDerWaalsContact C-N 3.31Å; F239-K241 PolarHBondContact O-N 3.49Å; F239-K242 WeakPolarHBondContact O-CB 3.44Å; F239-K242 PolarHBondContact O-N 3.14Å; F239-K242 VanDerWaalsContact O-N 3.13Å; F239-I243 HydrophobicContact CD1-CG1 4.29Å; F239-I243 HydrophobicContact CE1-CD1 4.38Å; F239-I243 HydrophobicContact CE1-CG1 3.84Å; F239-I243 HydrophobicContact CZ-CD1 4.07Å; F239-I243 HydrophobicContact CZ-CG1 3.96Å; F239-I243 WeakPolarHBondContact O-CG1 3.33Å; F239-I243 PolarHBondContact O-N 3.25Å; F239-V296 HydrophobicContact CZ-CG1 4.17Å; F239-K299 HydrophobicContact CD1-CB 4.24Å; F239-K299 HydrophobicContact CD1-CD 3.93Å; F239-K299 HydrophobicContact CD1-CG 3.72Å; F239-K299 HydrophobicContact CD2-CD 3.87Å; F239-K299 HydrophobicContact CE1-CB 3.77Å; F239-K299 HydrophobicContact CE1-CD 4.02Å; F239-K299 HydrophobicContact CE1-CG 3.77Å; F239-K299 HydrophobicContact CE2-CD 3.95Å; F239-K299 HydrophobicContact CG-CD 3.85Å; F239-K299 HydrophobicContact CG-CG 4.14Å; F239-K299 HydrophobicContact CZ-CB 4.09Å; F239-K299 HydrophobicContact CZ-CD 4.03Å; F239-K299 HydrophobicContact CZ-CG 4.22Å; F239-T300 WeakPolarHBondContact CE1-OG1 3.35Å
240	L	94.3	Very high	88.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-44.3	177.1	-70.6	-176.5	0	0	0	112.6	S236 V237 K242 I243 D244 T300 I304 L307 L321 L325	S236-L240 VanDerWaalsContact O-CG 3.29Å; S236-L240 WeakPolarHBondContact O-CG 3.45Å; S236-L240 PolarHBondContact O-N 3.37Å; V237-L240 PolarHBondContact O-N 3.27Å; L240-K242 VanDerWaalsContact C-N 3.26Å; L240-K242 PolarHBondContact O-N 3.38Å; L240-I243 PolarHBondContact O-N 3.01Å; L240-D244 WeakPolarHBondContact O-CB 3.5Å; L240-D244 PolarHBondContact O-N 3.26Å; L240-T300 HydrophobicContact CD2-CG2 4.04Å; L240-I304 HydrophobicContact CD2-CG1 4.26Å; L240-L307 HydrophobicContact CD1-CD1 3.6Å; L240-L307 HydrophobicContact CD1-CG 4.27Å; L240-L321 HydrophobicContact CB-CD2 4.2Å; L240-L325 HydrophobicContact CB-CD1 3.89Å; L240-L325 HydrophobicContact CD1-CD1 4.35Å; L240-L325 HydrophobicContact CD2-CD1 3.97Å; L240-L325 HydrophobicContact CG-CD1 4.27Å
241	K	94.1	Very high	89.2	Confident	102 Å²	102	56.1 Å²	56.1	44%	0.443	29%	0.291	S	S	.	.	H	α-helix	trans	-61.8	-34.5	175.3	-73.3	-177.3	176.1	-176.2	0	112.4	V237 L238 F239 K245 L321	V237-K241 PolarHBondContact O-N 3.29Å; L238-K241 PolarHBondContact O-N 2.8Å; F239-K241 PolarHBondContact O-N 3.49Å; K241-K245 WeakPolarHBondContact O-CB 3.4Å; K241-K245 PolarHBondContact O-N 3.14Å; K241-L321 HydrophobicContact CG-CD1 4.29Å; K241-L321 HydrophobicContact CG-CD2 3.72Å
242	K	93.2	Very high	90	Very high	63 Å²	63	55.4 Å²	55.4	27%	0.274	29%	0.288	S	S	.	.	H	α-helix	trans	-69.5	-42.9	177	-161.9	177.2	-173.1	178.2	0	111.6	Q229 F230 L234 L238 F239 L240 C246	Q229-K242 WeakPolarHBondContact O-CE 3.35Å; Q229-K242 PolarHBondContact O-NZ 2.95Å; F230-K242 HydrophobicContact CD1-CD 4.39Å; F230-K242 HydrophobicContact CE1-CB 4.27Å; F230-K242 HydrophobicContact CE1-CD 4.26Å; F230-K242 HydrophobicContact CE1-CG 3.92Å; L234-K242 HydrophobicContact CD1-CD 3.77Å; L238-K242 WeakPolarHBondContact O-CB 3.42Å; L238-K242 PolarHBondContact O-N 3.1Å; F239-K242 WeakPolarHBondContact O-CB 3.44Å; F239-K242 PolarHBondContact O-N 3.14Å; F239-K242 VanDerWaalsContact O-N 3.13Å; L240-K242 VanDerWaalsContact C-N 3.26Å; L240-K242 PolarHBondContact O-N 3.38Å; K242-C246 WeakPolarHBondContact O-CB 3.29Å; K242-C246 PolarHBondContact O-N 3.48Å
243	I	94.1	Very high	90.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-48.4	174.7	-68.1	-76.6	0	0	0	110.5	F230 F239 L240 K245 C246 W247 I290 I291 V296 L325 M328	F230-I243 HydrophobicContact CD1-CD1 3.52Å; F230-I243 HydrophobicContact CD1-CG1 4.09Å; F230-I243 HydrophobicContact CD2-CD1 4.26Å; F230-I243 HydrophobicContact CE1-CD1 3.33Å; F230-I243 HydrophobicContact CE1-CG1 3.8Å; F230-I243 HydrophobicContact CE2-CD1 4.1Å; F230-I243 HydrophobicContact CG-CD1 3.99Å; F230-I243 HydrophobicContact CZ-CD1 3.65Å; F230-I243 HydrophobicContact CZ-CG1 4.45Å; F239-I243 HydrophobicContact CD1-CG1 4.29Å; F239-I243 HydrophobicContact CE1-CD1 4.38Å; F239-I243 HydrophobicContact CE1-CG1 3.84Å; F239-I243 HydrophobicContact CZ-CD1 4.07Å; F239-I243 HydrophobicContact CZ-CG1 3.96Å; F239-I243 WeakPolarHBondContact O-CG1 3.33Å; F239-I243 PolarHBondContact O-N 3.25Å; L240-I243 PolarHBondContact O-N 3.01Å; I243-K245 PolarHBondContact O-N 3Å; I243-C246 PolarHBondContact O-N 2.78Å; I243-W247 WeakPolarHBondContact O-CB 3.45Å; I243-W247 PolarHBondContact O-N 3.02Å; I243-I290 HydrophobicContact CD1-CG2 4.46Å; I243-I291 HydrophobicContact CG2-CD1 4.28Å; I243-V296 HydrophobicContact CD1-CG1 3.65Å; I243-L325 HydrophobicContact CB-CD2 4.32Å; I243-L325 HydrophobicContact CG2-CD2 3.76Å; I243-M328 HydrophobicContact CG2-CE 3.93Å; I243-M328 HydrophobicContact CG2-SD 4.16Å
244	D	95.1	Very high	92.3	Very high	19 Å²	19	46.5 Å²	46.5	10%	0.102	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-45.6	178.8	178.9	51.9	0	0	0	111.9	L240 C246 W247 Q248 L321 S324 L325	L240-D244 WeakPolarHBondContact O-CB 3.5Å; L240-D244 PolarHBondContact O-N 3.26Å; D244-C246 PolarHBondContact O-N 3.42Å; D244-W247 WeakPolarHBondContact O-CB 3.43Å; D244-W247 PolarHBondContact O-N 2.82Å; D244-Q248 VanDerWaalsContact CG-NE2 3.29Å; D244-Q248 WeakPolarHBondContact O-CB 3.4Å; D244-Q248 VanDerWaalsContact O-CG 3.3Å; D244-Q248 WeakPolarHBondContact O-CG 3.48Å; D244-Q248 PolarHBondContact O-N 3.35Å; D244-Q248 PolarHBondContact OD1-NE2 2.96Å; D244-Q248 VanDerWaalsContact OD1-NE2 3.1Å; D244-Q248 PolarHBondContact OD2-NE2 2.87Å; D244-L321 HydrophobicContact CB-CD1 3.42Å; D244-L321 VanDerWaalsContact CB-CD1 3.42Å; D244-S324 WeakPolarHBondContact OD1-CB 3.28Å; D244-S324 PolarHBondContact OD1-OG 3.13Å; D244-L325 HydrophobicContact CB-CD2 3.93Å; D244-L325 HydrophobicContact CB-CG 4.18Å
245	K	94.4	Very high	93.3	Very high	121 Å²	121	47.7 Å²	47.7	53%	0.526	23%	0.231	S	C	.	.	H	α-helix	trans	-60.9	-46.8	175.4	179.2	164.8	174.1	45.9	0	112.1	K241 I243 W247 Q248 D249	K241-K245 WeakPolarHBondContact O-CB 3.4Å; K241-K245 PolarHBondContact O-N 3.14Å; I243-K245 PolarHBondContact O-N 3Å; K245-W247 VanDerWaalsContact C-N 3.27Å; K245-W247 PolarHBondContact O-N 3.47Å; K245-Q248 PolarHBondContact O-N 3.05Å; K245-D249 WeakPolarHBondContact CG-OD2 3.38Å; K245-D249 IonicContact NZ-OD1 2.69Å; K245-D249 IonicContact NZ-OD2 3.93Å; K245-D249 PolarHBondContact NZ-OD2 3.19Å; K245-D249 WeakPolarHBondContact O-CB 3.49Å; K245-D249 VanDerWaalsContact O-CG 3.26Å; K245-D249 PolarHBondContact O-N 2.93Å
246	C	94.4	Very high	93.6	Very high	14 Å²	14	47.1 Å²	47.1	10%	0.095	23%	0.226	C	C	.	.	H	α-helix	trans	-60.2	-39.2	177.7	-175.7	0	0	0	0	111.8	F230 K242 I243 D244 H250	F230-C246 HydrophobicContact CE2-CB 4.5Å; F230-C246 HydrophobicContact CZ-CB 3.66Å; K242-C246 WeakPolarHBondContact O-CB 3.29Å; K242-C246 PolarHBondContact O-N 3.48Å; I243-C246 PolarHBondContact O-N 2.78Å; D244-C246 PolarHBondContact O-N 3.42Å; C246-H250 VanDerWaalsContact O-CB 3.29Å; C246-H250 WeakPolarHBondContact O-CB 3.34Å; C246-H250 PolarHBondContact O-N 2.94Å
247	W	95.4	Very high	93.9	Very high	11 Å²	11	45.2 Å²	45.2	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-50.6	175.7	171.8	-116.7	0	0	0	112.3	I243 D244 K245 D249 H250 C251 L283 F286 M328 D331 L332	I243-W247 WeakPolarHBondContact O-CB 3.45Å; I243-W247 PolarHBondContact O-N 3.02Å; D244-W247 WeakPolarHBondContact O-CB 3.43Å; D244-W247 PolarHBondContact O-N 2.82Å; K245-W247 VanDerWaalsContact C-N 3.27Å; K245-W247 PolarHBondContact O-N 3.47Å; W247-D249 VanDerWaalsContact C-N 3.3Å; W247-D249 PolarHBondContact O-N 2.93Å; W247-H250 PolarHBondContact O-N 2.93Å; W247-C251 VanDerWaalsContact CZ2-SG 3.51Å; W247-C251 PolarHBondContact O-N 3.24Å; W247-C251 PolarHBondContact O-SG 2.93Å; W247-C251 VanDerWaalsContact O-SG 3.38Å; W247-L283 HydrophobicContact CH2-CD2 3.45Å; W247-L283 VanDerWaalsContact CH2-CD2 3.45Å; W247-L283 HydrophobicContact CZ2-CD2 4.35Å; W247-L283 HydrophobicContact CZ3-CD2 4.13Å; W247-F286 HydrophobicContact CB-CZ 4.09Å; W247-F286 AromaticContact CE3-CD1 3.69Å; W247-F286 HydrophobicContact CE3-CD1 3.69Å; W247-F286 HydrophobicContact CE3-CD2 4.16Å; W247-F286 AromaticContact CE3-CE1 3.63Å; W247-F286 HydrophobicContact CE3-CE1 3.63Å; W247-F286 HydrophobicContact CE3-CE2 4.11Å; W247-F286 AromaticContact CE3-CG 3.96Å; W247-F286 HydrophobicContact CE3-CG 3.96Å; W247-F286 AromaticContact CE3-CZ 3.86Å; W247-F286 HydrophobicContact CE3-CZ 3.86Å; W247-F286 HydrophobicContact CZ3-CB 4.3Å; W247-F286 AromaticContact CZ3-CD1 3.76Å; W247-F286 HydrophobicContact CZ3-CD1 3.76Å; W247-F286 HydrophobicContact CZ3-CD2 4.48Å; W247-F286 HydrophobicContact CZ3-CE1 4.17Å; W247-F286 AromaticContact CZ3-CG 3.93Å; W247-F286 HydrophobicContact CZ3-CG 3.93Å; W247-M328 HydrophobicContact CB-CG 4.42Å; W247-M328 HydrophobicContact CB-SD 3.71Å; W247-M328 HydrophobicContact CD2-CB 4.02Å; W247-M328 HydrophobicContact CD2-CG 3.47Å; W247-M328 VanDerWaalsContact CD2-CG 3.47Å; W247-M328 HydrophobicContact CD2-SD 3.88Å; W247-M328 HydrophobicContact CE3-CG 3.89Å; W247-M328 HydrophobicContact CE3-SD 4.21Å; W247-M328 HydrophobicContact CG-CB 4.02Å; W247-M328 HydrophobicContact CG-CG 3.71Å; W247-M328 HydrophobicContact CG-SD 3.66Å; W247-M328 HydrophobicContact CH2-CG 4.23Å; W247-M328 HydrophobicContact CZ2-CB 4.12Å; W247-M328 HydrophobicContact CZ2-CG 3.92Å; W247-M328 HydrophobicContact CZ3-CG 4.26Å; W247-D331 HydrophobicContact CH2-CB 4.45Å; W247-D331 HydrophobicContact CZ2-CB 4.12Å; W247-L332 HydrophobicContact CH2-CD2 3.79Å; W247-L332 HydrophobicContact CH2-CG 4.03Å; W247-L332 HydrophobicContact CZ3-CD1 4.35Å; W247-L332 HydrophobicContact CZ3-CD2 3.82Å; W247-L332 HydrophobicContact CZ3-CG 4.23Å
248	Q	95.6	Very high	94.2	Very high	62 Å²	62	46.7 Å²	46.7	29%	0.29	21%	0.214	S	C	.	.	H	α-helix	trans	-60.1	-42.3	179.3	-71.9	176.3	14.5	0	0	111.9	D244 K245 R252	D244-Q248 VanDerWaalsContact CG-NE2 3.29Å; D244-Q248 WeakPolarHBondContact O-CB 3.4Å; D244-Q248 VanDerWaalsContact O-CG 3.3Å; D244-Q248 WeakPolarHBondContact O-CG 3.48Å; D244-Q248 PolarHBondContact O-N 3.35Å; D244-Q248 PolarHBondContact OD1-NE2 2.96Å; D244-Q248 VanDerWaalsContact OD1-NE2 3.1Å; D244-Q248 PolarHBondContact OD2-NE2 2.87Å; K245-Q248 PolarHBondContact O-N 3.05Å; Q248-R252 VanDerWaalsContact O-CG 3.29Å; Q248-R252 WeakPolarHBondContact O-CG 3.48Å; Q248-R252 PolarHBondContact O-N 3.02Å
249	D	94.3	Very high	94.3	Very high	39 Å²	39	44.4 Å²	44.4	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-46	177.8	-69.3	-21	0	0	0	110	K245 W247 C251 R252 Q253	K245-D249 WeakPolarHBondContact CG-OD2 3.38Å; K245-D249 IonicContact NZ-OD1 2.69Å; K245-D249 IonicContact NZ-OD2 3.93Å; K245-D249 PolarHBondContact NZ-OD2 3.19Å; K245-D249 WeakPolarHBondContact O-CB 3.49Å; K245-D249 VanDerWaalsContact O-CG 3.26Å; K245-D249 PolarHBondContact O-N 2.93Å; W247-D249 VanDerWaalsContact C-N 3.3Å; W247-D249 PolarHBondContact O-N 2.93Å; D249-C251 PolarHBondContact O-N 2.91Å; D249-R252 PolarHBondContact O-N 3.5Å; D249-R252 IonicContact OD1-NH1 3.05Å; D249-Q253 WeakPolarHBondContact O-CB 3.42Å; D249-Q253 WeakPolarHBondContact O-CG 3.48Å; D249-Q253 PolarHBondContact O-N 3.34Å
250	H	94.7	Very high	94.3	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-56.7	-47.8	173.9	177.3	61.4	0	0	0	112.8	I223 C246 W247 R252 Q253 M254 G282 F286	I223-H250 WeakPolarHBondContact CD1-ND1 3.45Å; C246-H250 VanDerWaalsContact O-CB 3.29Å; C246-H250 WeakPolarHBondContact O-CB 3.34Å; C246-H250 PolarHBondContact O-N 2.94Å; W247-H250 PolarHBondContact O-N 2.93Å; H250-R252 PolarHBondContact O-N 3.49Å; H250-Q253 PolarHBondContact O-N 3.02Å; H250-M254 WeakPolarHBondContact CE1-CG 3.14Å; H250-M254 WeakPolarHBondContact O-CB 3.3Å; H250-M254 VanDerWaalsContact O-CG 3.31Å; H250-M254 WeakPolarHBondContact O-CG 3.49Å; H250-M254 PolarHBondContact O-N 3.49Å; H250-G282 PolarHBondContact NE2-O 2.94Å; H250-F286 HydrophobicContact CB-CD2 4.14Å; H250-F286 HydrophobicContact CB-CE2 4.23Å; H250-F286 AromaticContact CD2-CD2 3.56Å; H250-F286 AromaticContact CD2-CG 3.96Å; H250-F286 AromaticContact CG-CD2 3.85Å
251	C	94.9	Very high	94.3	Very high	19 Å²	19	44.4 Å²	44.4	13%	0.128	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-46.6	177.7	-73.5	0	0	0	0	112	W247 D249 Q253 M254 I255 W279	W247-C251 VanDerWaalsContact CZ2-SG 3.51Å; W247-C251 PolarHBondContact O-N 3.24Å; W247-C251 PolarHBondContact O-SG 2.93Å; W247-C251 VanDerWaalsContact O-SG 3.38Å; D249-C251 PolarHBondContact O-N 2.91Å; C251-Q253 VanDerWaalsContact C-N 3.35Å; C251-Q253 PolarHBondContact O-N 3.27Å; C251-M254 PolarHBondContact O-N 3.18Å; C251-I255 VanDerWaalsContact O-CG1 3.3Å; C251-I255 WeakPolarHBondContact O-CG1 3.23Å; C251-I255 PolarHBondContact O-N 3.45Å; C251-W279 HydrophobicContact CB-CH2 3.89Å; C251-W279 HydrophobicContact CB-CZ3 4.49Å; C251-W279 WeakPolarHBondContact O-CZ3 3.21Å
252	R	94.3	Very high	94.3	Very high	156 Å²	156	42.5 Å²	42.5	59%	0.589	20%	0.201	S	C	*	.	H	α-helix	trans	-61.9	-44.6	178.1	-72.7	171.8	-175.3	160.4	3.9	111.4	Q248 D249 H250 I255 M256	Q248-R252 VanDerWaalsContact O-CG 3.29Å; Q248-R252 WeakPolarHBondContact O-CG 3.48Å; Q248-R252 PolarHBondContact O-N 3.02Å; D249-R252 PolarHBondContact O-N 3.5Å; D249-R252 IonicContact OD1-NH1 3.05Å; H250-R252 PolarHBondContact O-N 3.49Å; R252-I255 PolarHBondContact O-N 2.93Å; R252-M256 PolarHBondContact O-N 2.94Å; R252-M256 VanDerWaalsContact O-N 3.12Å
253	Q	94.6	Very high	94.3	Very high	21 Å²	21	41.5 Å²	41.5	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-43	178.4	-69.3	169.5	1.8	0	0	111.7	I182 Q183 D249 H250 C251 M256 I257	I182-Q253 HydrophobicContact CG2-CB 3.81Å; I182-Q253 HydrophobicContact CG2-CG 3.91Å; I182-Q253 PolarHBondContact O-NE2 3.45Å; Q183-Q253 PolarHBondContact O-NE2 3.13Å; D249-Q253 WeakPolarHBondContact O-CB 3.42Å; D249-Q253 WeakPolarHBondContact O-CG 3.48Å; D249-Q253 PolarHBondContact O-N 3.34Å; H250-Q253 PolarHBondContact O-N 3.02Å; C251-Q253 VanDerWaalsContact C-N 3.35Å; C251-Q253 PolarHBondContact O-N 3.27Å; Q253-M256 WeakPolarHBondContact O-CB 3.43Å; Q253-M256 PolarHBondContact O-N 3.47Å; Q253-I257 WeakPolarHBondContact O-CG1 3.19Å; Q253-I257 PolarHBondContact O-N 3.35Å
254	M	95	Very high	94.2	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-66.6	-36.3	176.5	-71.5	-67.1	84.4	0	0	113.3	H250 C251 M256 I257 R258 W279	H250-M254 WeakPolarHBondContact CE1-CG 3.14Å; H250-M254 WeakPolarHBondContact O-CB 3.3Å; H250-M254 VanDerWaalsContact O-CG 3.31Å; H250-M254 WeakPolarHBondContact O-CG 3.49Å; H250-M254 PolarHBondContact O-N 3.49Å; C251-M254 PolarHBondContact O-N 3.18Å; M254-M256 VanDerWaalsContact C-N 3.3Å; M254-M256 PolarHBondContact O-N 2.92Å; M254-I257 HydrophobicContact CE-CB 4.03Å; M254-I257 HydrophobicContact CE-CD1 3.19Å; M254-I257 HydrophobicContact CE-CG1 4.14Å; M254-I257 HydrophobicContact CE-CG2 4.28Å; M254-I257 PolarHBondContact O-N 3.48Å; M254-R258 VanDerWaalsContact O-CB 3.29Å; M254-R258 WeakPolarHBondContact O-CB 3.35Å; M254-R258 PolarHBondContact O-N 3.48Å; M254-W279 HydrophobicContact CB-CE3 3.97Å; M254-W279 HydrophobicContact CB-CZ3 3.86Å
255	I	93.9	Very high	94.1	Very high	84 Å²	84	41.5 Å²	41.5	43%	0.431	20%	0.197	S	C	.	.	H	α-helix	trans	-61.2	-43.3	172.2	-69.9	164	0	0	0	110.2	C251 R252 R258 S259 W279	C251-I255 VanDerWaalsContact O-CG1 3.3Å; C251-I255 WeakPolarHBondContact O-CG1 3.23Å; C251-I255 PolarHBondContact O-N 3.45Å; R252-I255 PolarHBondContact O-N 2.93Å; I255-R258 PolarHBondContact O-N 2.9Å; I255-S259 PolarHBondContact O-N 3.3Å; I255-W279 HydrophobicContact CD1-CH2 4.34Å; I255-W279 HydrophobicContact CD1-CZ3 4.24Å; I255-W279 HydrophobicContact CG1-CE3 4.23Å; I255-W279 HydrophobicContact CG1-CH2 4.14Å; I255-W279 HydrophobicContact CG1-CZ3 3.56Å
256	M	92.8	Very high	94	Very high	83 Å²	83	41.6 Å²	41.6	41%	0.409	19%	0.194	S	C	.	.	H	α-helix	trans	-67	-44.4	179.3	-166.2	175.7	-65.2	0	0	111.8	I182 I188 R252 Q253 M254 R258 S259 I260	I182-M256 HydrophobicContact CD1-CB 4.45Å; I182-M256 HydrophobicContact CD1-CG 3.9Å; I182-M256 HydrophobicContact CD1-SD 3.92Å; I182-M256 HydrophobicContact CG1-CG 4.34Å; I182-M256 HydrophobicContact CG1-SD 3.71Å; I182-M256 HydrophobicContact CG2-CB 4.26Å; I182-M256 HydrophobicContact CG2-SD 4.11Å; I188-M256 HydrophobicContact CD1-SD 4.27Å; R252-M256 PolarHBondContact O-N 2.94Å; R252-M256 VanDerWaalsContact O-N 3.12Å; Q253-M256 WeakPolarHBondContact O-CB 3.43Å; Q253-M256 PolarHBondContact O-N 3.47Å; M254-M256 VanDerWaalsContact C-N 3.3Å; M254-M256 PolarHBondContact O-N 2.92Å; M256-R258 PolarHBondContact O-N 3.42Å; M256-S259 WeakPolarHBondContact O-CB 3.33Å; M256-S259 PolarHBondContact O-N 3.13Å; M256-S259 PolarHBondContact O-OG 3.46Å; M256-I260 PolarHBondContact O-N 2.69Å; M256-I260 VanDerWaalsContact O-N 3.14Å
257	I	94.4	Very high	93.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-44	175.3	-72.6	163.1	0	0	0	110.5	V179 I182 Q183 L215 Q253 M254 S259 I260 F261 I278	V179-I257 HydrophobicContact CG1-CD1 3.9Å; V179-I257 HydrophobicContact CG2-CG1 4.4Å; I182-I257 HydrophobicContact CD1-CG1 3.97Å; I182-I257 HydrophobicContact CG2-CD1 4.19Å; I182-I257 HydrophobicContact CG2-CG1 4.19Å; Q183-I257 HydrophobicContact CG-CD1 4.3Å; L215-I257 HydrophobicContact CD1-CG2 3.95Å; L215-I257 HydrophobicContact CD2-CG2 4.26Å; Q253-I257 WeakPolarHBondContact O-CG1 3.19Å; Q253-I257 PolarHBondContact O-N 3.35Å; M254-I257 HydrophobicContact CE-CB 4.03Å; M254-I257 HydrophobicContact CE-CD1 3.19Å; M254-I257 HydrophobicContact CE-CG1 4.14Å; M254-I257 HydrophobicContact CE-CG2 4.28Å; M254-I257 PolarHBondContact O-N 3.48Å; I257-S259 PolarHBondContact O-N 2.82Å; I257-I260 PolarHBondContact O-N 3.32Å; I257-F261 HydrophobicContact CG2-CD2 4Å; I257-F261 HydrophobicContact CG2-CE2 4.36Å; I257-F261 WeakPolarHBondContact O-CD2 3.42Å; I257-F261 PolarHBondContact O-N 3.05Å; I257-I278 HydrophobicContact CG2-CG2 4.26Å
258	R	94.5	Very high	93.4	Very high	69 Å²	69	45 Å²	45	26%	0.26	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-34.1	173.6	-171.5	-178.9	68.7	-175.7	-3.9	112.3	M254 I255 M256 F261 L262 D265 I278	M254-R258 VanDerWaalsContact O-CB 3.29Å; M254-R258 WeakPolarHBondContact O-CB 3.35Å; M254-R258 PolarHBondContact O-N 3.48Å; I255-R258 PolarHBondContact O-N 2.9Å; M256-R258 PolarHBondContact O-N 3.42Å; R258-F261 CarbonylContact O-C 3.57Å; R258-L262 VanDerWaalsContact O-CA 3.24Å; R258-L262 WeakPolarHBondContact O-CA 3.31Å; R258-L262 WeakPolarHBondContact O-CB 3.38Å; R258-L262 PolarHBondContact O-N 2.84Å; R258-D265 WeakPolarHBondContact CD-OD2 3.33Å; R258-D265 WeakPolarHBondContact CG-OD2 3.31Å; R258-I278 HydrophobicContact CB-CG2 4.38Å; R258-I278 HydrophobicContact CG-CB 4.49Å
259	S	93.4	Very high	93.2	Very high	56 Å²	56	42.3 Å²	42.3	39%	0.392	20%	0.198	S	C	.	.	H	α-helix	trans	-67.1	-40.2	177.6	77.5	0	0	0	0	112.5	I255 M256 I257 L262	I255-S259 PolarHBondContact O-N 3.3Å; M256-S259 WeakPolarHBondContact O-CB 3.33Å; M256-S259 PolarHBondContact O-N 3.13Å; M256-S259 PolarHBondContact O-OG 3.46Å; I257-S259 PolarHBondContact O-N 2.82Å; S259-L262 WeakPolarHBondContact O-CB 3.41Å
260	I	93.4	Very high	93	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-44.1	175.5	-66.8	167.7	0	0	0	110.6	L175 I182 L192 L195 V199 M256 I257 L262	L175-I260 HydrophobicContact CD2-CG2 4.24Å; I182-I260 HydrophobicContact CD1-CD1 3.52Å; L192-I260 HydrophobicContact CD2-CD1 3.88Å; L192-I260 HydrophobicContact CD2-CG1 3.78Å; L195-I260 HydrophobicContact CB-CG2 3.77Å; L195-I260 HydrophobicContact CD1-CD1 4.15Å; V199-I260 HydrophobicContact CG2-CG2 4.4Å; M256-I260 PolarHBondContact O-N 2.69Å; M256-I260 VanDerWaalsContact O-N 3.14Å; I257-I260 PolarHBondContact O-N 3.32Å; I260-L262 VanDerWaalsContact C-N 3.28Å; I260-L262 PolarHBondContact O-N 3Å
261	F	94.9	Very high	92.8	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	21.9	-177.7	-69.7	-96.4	0	0	0	113.2	L175 V179 V199 L211 L215 I257 R258 F263 L264 D265 I278	L175-F261 HydrophobicContact CB-CZ 4.1Å; L175-F261 HydrophobicContact CD1-CE1 4.28Å; L175-F261 HydrophobicContact CD1-CZ 4.38Å; L175-F261 HydrophobicContact CD2-CZ 4.29Å; L175-F261 HydrophobicContact CG-CZ 4.5Å; V179-F261 HydrophobicContact CG2-CE2 3.69Å; V179-F261 HydrophobicContact CG2-CZ 4.12Å; V199-F261 HydrophobicContact CG1-CD1 4.1Å; V199-F261 HydrophobicContact CG2-CD1 3.72Å; V199-F261 HydrophobicContact CG2-CE1 3.87Å; V199-F261 HydrophobicContact CG2-CG 4.2Å; V199-F261 HydrophobicContact CG2-CZ 4.44Å; L211-F261 HydrophobicContact CD1-CE1 4.22Å; L211-F261 HydrophobicContact CD2-CE1 4.4Å; L211-F261 HydrophobicContact CG-CE1 4.27Å; L215-F261 HydrophobicContact CD1-CD2 4.39Å; L215-F261 HydrophobicContact CD1-CE1 4.43Å; L215-F261 HydrophobicContact CD1-CE2 3.92Å; L215-F261 HydrophobicContact CD1-CZ 3.92Å; L215-F261 HydrophobicContact CD2-CB 4.35Å; L215-F261 HydrophobicContact CD2-CD1 3.91Å; L215-F261 HydrophobicContact CD2-CD2 4.11Å; L215-F261 HydrophobicContact CD2-CE1 4.15Å; L215-F261 HydrophobicContact CD2-CE2 4.36Å; L215-F261 HydrophobicContact CD2-CG 3.87Å; L215-F261 HydrophobicContact CD2-CZ 4.36Å; I257-F261 HydrophobicContact CG2-CD2 4Å; I257-F261 HydrophobicContact CG2-CE2 4.36Å; I257-F261 WeakPolarHBondContact O-CD2 3.42Å; I257-F261 PolarHBondContact O-N 3.05Å; R258-F261 CarbonylContact O-C 3.57Å; F261-F263 VanDerWaalsContact C-N 3.26Å; F261-F263 PolarHBondContact O-N 2.84Å; F261-L264 HydrophobicContact CB-CB 4.43Å; F261-L264 HydrophobicContact CD1-CD2 3.93Å; F261-L264 WeakPolarHBondContact O-CB 3.34Å; F261-L264 PolarHBondContact O-N 3.31Å; F261-D265 PolarHBondContact O-N 2.9Å; F261-I278 HydrophobicContact CB-CD1 3.42Å; F261-I278 VanDerWaalsContact CB-CD1 3.42Å; F261-I278 HydrophobicContact CG-CD1 4.43Å
262	L	93.6	Very high	92.5	Very high	62 Å²	62	56 Å²	56	33%	0.325	26%	0.264	S	S	.	.	H	α-helix	trans	-59.5	-37.7	-173.9	-179.5	69.8	0	0	0	112.1	Y196 R258 S259 I260 D265 R266	Y196-L262 HydrophobicContact CD2-CB 4.3Å; Y196-L262 HydrophobicContact CE2-CB 3.96Å; Y196-L262 HydrophobicContact CE2-CD2 4.46Å; R258-L262 VanDerWaalsContact O-CA 3.24Å; R258-L262 WeakPolarHBondContact O-CA 3.31Å; R258-L262 WeakPolarHBondContact O-CB 3.38Å; R258-L262 PolarHBondContact O-N 2.84Å; S259-L262 WeakPolarHBondContact O-CB 3.41Å; I260-L262 VanDerWaalsContact C-N 3.28Å; I260-L262 PolarHBondContact O-N 3Å; L262-D265 PolarHBondContact O-N 3.41Å; L262-R266 HydrophobicContact CD1-CG 4.11Å; L262-R266 WeakPolarHBondContact O-CG 3.44Å; L262-R266 PolarHBondContact O-N 3.33Å
263	F	92.9	Very high	92.1	Very high	42 Å²	42	54.3 Å²	54.3	18%	0.184	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-42.2	176.4	-167.4	-90.3	0	0	0	111.6	Y196 E200 C203 F261 T267	Y196-F263 HydrophobicContact CE2-CB 3.9Å; E200-F263 HydrophobicContact CB-CB 4.37Å; E200-F263 HydrophobicContact CB-CD1 4.2Å; E200-F263 HydrophobicContact CB-CD2 4.12Å; E200-F263 HydrophobicContact CB-CE2 4.46Å; E200-F263 HydrophobicContact CB-CG 3.97Å; E200-F263 HydrophobicContact CG-CD1 4.29Å; E200-F263 HydrophobicContact CG-CD2 3.86Å; E200-F263 HydrophobicContact CG-CE1 4.16Å; E200-F263 HydrophobicContact CG-CE2 3.72Å; E200-F263 HydrophobicContact CG-CG 4.14Å; E200-F263 HydrophobicContact CG-CZ 3.87Å; C203-F263 HydrophobicContact CB-CD1 3.65Å; C203-F263 HydrophobicContact CB-CE1 3.65Å; F261-F263 VanDerWaalsContact C-N 3.26Å; F261-F263 PolarHBondContact O-N 2.84Å; F263-T267 HydrophobicContact CD1-CG2 4.05Å; F263-T267 HydrophobicContact CD2-CG2 4.31Å; F263-T267 HydrophobicContact CE1-CG2 3.81Å; F263-T267 HydrophobicContact CE2-CG2 4.07Å; F263-T267 HydrophobicContact CG-CG2 4.31Å; F263-T267 HydrophobicContact CZ-CG2 3.82Å; F263-T267 WeakPolarHBondContact O-CB 3.18Å; F263-T267 WeakPolarHBondContact O-CG2 3.34Å; F263-T267 PolarHBondContact O-N 3.41Å; F263-T267 PolarHBondContact O-OG1 2.9Å
264	L	91.9	Very high	91.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-44.6	177	178.9	67.9	0	0	0	111.4	V199 L211 Y212 F261 Y268 V269	V199-L264 HydrophobicContact CG1-CB 3.89Å; L211-L264 HydrophobicContact CD2-CD1 4.43Å; L211-L264 HydrophobicContact CD2-CD2 4.17Å; L211-L264 HydrophobicContact CG-CD2 4.13Å; Y212-L264 HydrophobicContact CD2-CD2 4.49Å; F261-L264 HydrophobicContact CB-CB 4.43Å; F261-L264 HydrophobicContact CD1-CD2 3.93Å; F261-L264 WeakPolarHBondContact O-CB 3.34Å; F261-L264 PolarHBondContact O-N 3.31Å; L264-Y268 HydrophobicContact CD1-CD1 4.16Å; L264-Y268 HydrophobicContact CD1-CG 4.44Å; L264-Y268 PolarHBondContact O-N 3.05Å; L264-Y268 VanDerWaalsContact O-N 3.15Å; L264-V269 HydrophobicContact CG-CG2 4.49Å; L264-V269 PolarHBondContact O-N 3.37Å; L264-V269 VanDerWaalsContact O-N 3.13Å
265	D	92.1	Very high	91.6	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.102	33%	0.325	C	S	.	.	I	π-helix	trans	-65	-42.7	-178.7	-155.6	20.7	0	0	0	111.5	R258 F261 L262 L270 I278	R258-D265 WeakPolarHBondContact CD-OD2 3.33Å; R258-D265 WeakPolarHBondContact CG-OD2 3.31Å; F261-D265 PolarHBondContact O-N 2.9Å; L262-D265 PolarHBondContact O-N 3.41Å; D265-L270 WeakPolarHBondContact O-CB 3.45Å; D265-L270 PolarHBondContact O-N 2.93Å; D265-I278 HydrophobicContact CB-CD1 3.87Å; D265-I278 HydrophobicContact CB-CG1 4.15Å; D265-I278 PolarHBondContact OD1-N 3.42Å; D265-I278 VanDerWaalsContact OD1-N 3.17Å
266	R	92.5	Very high	91.5	Very high	123 Å²	123	61.8 Å²	61.8	46%	0.464	32%	0.316	S	S	.	.	I	π-helix	trans	-86.4	-15	-176.5	-62	-168.2	99.5	144.2	2	115.5	M118 L262 L270	M118-R266 PolarHBondContact SD-NH1 2.92Å; M118-R266 PolarHBondContact SD-NH2 3.31Å; L262-R266 HydrophobicContact CD1-CG 4.11Å; L262-R266 WeakPolarHBondContact O-CG 3.44Å; L262-R266 PolarHBondContact O-N 3.33Å; R266-L270 WeakPolarHBondContact O-CD2 3.37Å
267	T	89.9	Confident	91.6	Very high	40 Å²	40	59.2 Å²	59.2	25%	0.245	31%	0.307	C	S	.	.	I	π-helix	trans	-103.9	-68.7	178.6	60.6	0	0	0	0	111.2	F263 Q271	F263-T267 HydrophobicContact CD1-CG2 4.05Å; F263-T267 HydrophobicContact CD2-CG2 4.31Å; F263-T267 HydrophobicContact CE1-CG2 3.81Å; F263-T267 HydrophobicContact CE2-CG2 4.07Å; F263-T267 HydrophobicContact CG-CG2 4.31Å; F263-T267 HydrophobicContact CZ-CG2 3.82Å; F263-T267 WeakPolarHBondContact O-CB 3.18Å; F263-T267 WeakPolarHBondContact O-CG2 3.34Å; F263-T267 PolarHBondContact O-N 3.41Å; F263-T267 PolarHBondContact O-OG1 2.9Å; T267-Q271 WeakPolarHBondContact O-CB 3.35Å; T267-Q271 WeakPolarHBondContact O-CG 3.39Å; T267-Q271 PolarHBondContact O-N 3.37Å; T267-Q271 PolarHBondContact O-OE1 3.34Å
268	Y	89	Confident	91.6	Very high	57 Å²	57	59.2 Å²	59.2	22%	0.224	31%	0.307	C	S	.	.	I	π-helix	trans	-75.9	-52.1	-174.2	179.3	-108.9	0	0	0	111.8	S208 A209 L264 Q271 N272 L275	S208-Y268 VanDerWaalsContact CB-CG 3.47Å; A209-Y268 HydrophobicContact CB-CE1 4.26Å; A209-Y268 HydrophobicContact CB-CE2 4.28Å; A209-Y268 VanDerWaalsContact CB-OH 3.23Å; A209-Y268 WeakPolarHBondContact CB-OH 3.36Å; L264-Y268 HydrophobicContact CD1-CD1 4.16Å; L264-Y268 HydrophobicContact CD1-CG 4.44Å; L264-Y268 PolarHBondContact O-N 3.05Å; L264-Y268 VanDerWaalsContact O-N 3.15Å; Y268-Q271 PolarHBondContact O-N 3.01Å; Y268-N272 WeakPolarHBondContact CD2-ND2 3.37Å; Y268-N272 VanDerWaalsContact CE2-ND2 3.3Å; Y268-N272 WeakPolarHBondContact CE2-ND2 3.27Å; Y268-N272 PolarHBondContact O-N 2.92Å; Y268-N272 PolarHBondContact O-ND2 2.96Å; Y268-L275 HydrophobicContact CD1-CD1 4.29Å; Y268-L275 HydrophobicContact CE1-CD1 3.51Å
269	V	90.5	Very high	91.6	Very high	6 Å²	6	58.8 Å²	58.8	4%	0.036	31%	0.305	C	S	.	.	I	π-helix	trans	-67.3	-45.4	-174.9	-176.9	0	0	0	0	110.8	Y212 L264 Q271 N272 L275 P276	Y212-V269 HydrophobicContact CD2-CG2 3.49Å; Y212-V269 VanDerWaalsContact CD2-CG2 3.49Å; Y212-V269 HydrophobicContact CE2-CG1 4.37Å; Y212-V269 HydrophobicContact CE2-CG2 3.63Å; Y212-V269 HydrophobicContact CG-CG2 4.46Å; L264-V269 HydrophobicContact CG-CG2 4.49Å; L264-V269 PolarHBondContact O-N 3.37Å; L264-V269 VanDerWaalsContact O-N 3.13Å; V269-Q271 PolarHBondContact O-N 3.12Å; V269-N272 CarbonylContact O-C 3.56Å; V269-N272 PolarHBondContact O-N 2.73Å; V269-N272 VanDerWaalsContact O-O 3.12Å; V269-L275 HydrophobicContact CG1-CB 4.21Å; V269-P276 VanDerWaalsContact CG1-O 3.23Å; V269-P276 WeakPolarHBondContact CG1-O 3.44Å
270	L	90.3	Very high	91.6	Very high	131 Å²	131	59.7 Å²	59.7	69%	0.686	31%	0.306	S	S	*	.	H	α-helix	trans	-59.4	-31.1	177.4	-170.8	64.3	0	0	0	114.1	D265 R266 N272	D265-L270 WeakPolarHBondContact O-CB 3.45Å; D265-L270 PolarHBondContact O-N 2.93Å; R266-L270 WeakPolarHBondContact O-CD2 3.37Å; L270-N272 VanDerWaalsContact C-N 3.35Å
271	Q	89.3	Confident	91.7	Very high	160 Å²	160	59.6 Å²	59.6	75%	0.748	31%	0.305	S	S	*	.	H	α-helix	trans	-79.7	-16.1	176.9	-73.8	173.4	3.2	0	0	113.3	T267 Y268 V269	T267-Q271 WeakPolarHBondContact O-CB 3.35Å; T267-Q271 WeakPolarHBondContact O-CG 3.39Å; T267-Q271 PolarHBondContact O-N 3.37Å; T267-Q271 PolarHBondContact O-OE1 3.34Å; Y268-Q271 PolarHBondContact O-N 3.01Å; V269-Q271 PolarHBondContact O-N 3.12Å
272	N	88.8	Confident	91.7	Very high	61 Å²	61	59.6 Å²	59.6	33%	0.326	31%	0.305	S	S	.	.			trans	-111.3	95	-177.8	-71.7	-76.2	0	0	0	110.3	Y268 V269 L270 M274 L275	Y268-N272 WeakPolarHBondContact CD2-ND2 3.37Å; Y268-N272 VanDerWaalsContact CE2-ND2 3.3Å; Y268-N272 WeakPolarHBondContact CE2-ND2 3.27Å; Y268-N272 PolarHBondContact O-N 2.92Å; Y268-N272 PolarHBondContact O-ND2 2.96Å; V269-N272 CarbonylContact O-C 3.56Å; V269-N272 PolarHBondContact O-N 2.73Å; V269-N272 VanDerWaalsContact O-O 3.12Å; L270-N272 VanDerWaalsContact C-N 3.35Å; N272-M274 PolarHBondContact O-N 3.28Å; N272-L275 HydrophobicContact CB-CB 4.36Å; N272-L275 HydrophobicContact CB-CD1 3.97Å; N272-L275 HydrophobicContact CB-CG 4.13Å; N272-L275 PolarHBondContact O-N 2.99Å
273	S	85.8	Confident	91.7	Very high	121 Å²	121	57.8 Å²	57.8	85%	0.846	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.6	-179.3	56.3	0	0	0	0	115.1
274	M	89.6	Confident	91.8	Very high	172 Å²	172	59.8 Å²	59.8	85%	0.847	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.4	177.5	-63.4	-61.8	-65.1	0	0	113.6	N272	N272-M274 PolarHBondContact O-N 3.28Å
275	L	89.6	Confident	91.9	Very high	54 Å²	54	59.9 Å²	59.9	28%	0.283	31%	0.306	S	S	.	.	S	Bend	trans	-104.7	128.6	-179.5	-65.1	179.2	0	0	0	110.2	Y212 Y268 V269 N272	Y212-L275 HydrophobicContact CE1-CD2 4.2Å; Y268-L275 HydrophobicContact CD1-CD1 4.29Å; Y268-L275 HydrophobicContact CE1-CD1 3.51Å; V269-L275 HydrophobicContact CG1-CB 4.21Å; N272-L275 HydrophobicContact CB-CB 4.36Å; N272-L275 HydrophobicContact CB-CD1 3.97Å; N272-L275 HydrophobicContact CB-CG 4.13Å; N272-L275 PolarHBondContact O-N 2.99Å
276	P	91.9	Very high	92	Very high	39 Å²	39	59 Å²	59	25%	0.253	30%	0.301	S	S	.	.			trans	-67.5	149.9	174.2	24.4	-27.4	0	0	0	110.4	Y212 V269 D280 M281	Y212-P276 WeakPolarHBondContact OH-CD 3.46Å; Y212-P276 WeakPolarHBondContact OH-CG 3.46Å; Y212-P276 PolarHBondContact OH-O 2.88Å; V269-P276 VanDerWaalsContact CG1-O 3.23Å; V269-P276 WeakPolarHBondContact CG1-O 3.44Å; P276-D280 HydrophobicContact CB-CB 3.84Å; P276-M281 HydrophobicContact CG-CB 4.27Å
277	S	94.6	Very high	92.1	Very high	30 Å²	30	57.1 Å²	57.1	21%	0.21	29%	0.294	C	S	.	.			trans	-56.9	161	171.4	75.5	0	0	0	0	110.5	W279 D280 M281	S277-W279 PolarHBondContact O-N 2.96Å; S277-W279 VanDerWaalsContact O-N 3.14Å; S277-W279 PolarHBondContact OG-N 3.04Å; S277-D280 WeakPolarHBondContact CB-OD2 3.36Å; S277-D280 PolarHBondContact O-N 3.16Å; S277-D280 VanDerWaalsContact O-N 3.1Å; S277-D280 PolarHBondContact OG-N 3.17Å; S277-D280 VanDerWaalsContact OG-N 3.13Å; S277-D280 PolarHBondContact OG-OD2 3.23Å; S277-M281 WeakPolarHBondContact O-CB 3.33Å; S277-M281 PolarHBondContact O-N 2.77Å
278	I	94.8	Very high	92.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.1	-33.6	177.6	-62.4	179.1	0	0	0	111	Y212 L215 I257 R258 F261 D265 M281 G282	Y212-I278 HydrophobicContact CE2-CG1 4.49Å; L215-I278 HydrophobicContact CD2-CD1 4.03Å; L215-I278 HydrophobicContact CD2-CG1 4.44Å; L215-I278 HydrophobicContact CD2-CG2 4.32Å; I257-I278 HydrophobicContact CG2-CG2 4.26Å; R258-I278 HydrophobicContact CB-CG2 4.38Å; R258-I278 HydrophobicContact CG-CB 4.49Å; F261-I278 HydrophobicContact CB-CD1 3.42Å; F261-I278 VanDerWaalsContact CB-CD1 3.42Å; F261-I278 HydrophobicContact CG-CD1 4.43Å; D265-I278 HydrophobicContact CB-CD1 3.87Å; D265-I278 HydrophobicContact CB-CG1 4.15Å; D265-I278 PolarHBondContact OD1-N 3.42Å; D265-I278 VanDerWaalsContact OD1-N 3.17Å; I278-M281 HydrophobicContact CG2-CE 4.38Å; I278-G282 PolarHBondContact O-N 3.11Å; I278-G282 VanDerWaalsContact O-N 3.16Å
279	W	94.8	Very high	92.4	Very high	60 Å²	60	61.4 Å²	61.4	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-53.7	174.3	-177.4	-101.3	0	0	0	111.7	C251 M254 I255 S277 M281 G282 L283	C251-W279 HydrophobicContact CB-CH2 3.89Å; C251-W279 HydrophobicContact CB-CZ3 4.49Å; C251-W279 WeakPolarHBondContact O-CZ3 3.21Å; M254-W279 HydrophobicContact CB-CE3 3.97Å; M254-W279 HydrophobicContact CB-CZ3 3.86Å; I255-W279 HydrophobicContact CD1-CH2 4.34Å; I255-W279 HydrophobicContact CD1-CZ3 4.24Å; I255-W279 HydrophobicContact CG1-CE3 4.23Å; I255-W279 HydrophobicContact CG1-CH2 4.14Å; I255-W279 HydrophobicContact CG1-CZ3 3.56Å; S277-W279 PolarHBondContact O-N 2.96Å; S277-W279 VanDerWaalsContact O-N 3.14Å; S277-W279 PolarHBondContact OG-N 3.04Å; W279-M281 VanDerWaalsContact C-N 3.28Å; W279-M281 PolarHBondContact O-N 3.28Å; W279-G282 WeakPolarHBondContact O-CA 3.45Å; W279-G282 PolarHBondContact O-N 3.49Å; W279-L283 HydrophobicContact CZ2-CD2 4.27Å; W279-L283 WeakPolarHBondContact O-CG 3.3Å; W279-L283 PolarHBondContact O-N 3.27Å
280	D	93.4	Very high	92.4	Very high	75 Å²	75	61.1 Å²	61.1	40%	0.401	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-34.8	-177.5	-55.5	-41.2	0	0	0	111.8	P276 S277 G282 L283 E284	P276-D280 HydrophobicContact CB-CB 3.84Å; S277-D280 WeakPolarHBondContact CB-OD2 3.36Å; S277-D280 PolarHBondContact O-N 3.16Å; S277-D280 VanDerWaalsContact O-N 3.1Å; S277-D280 PolarHBondContact OG-N 3.17Å; S277-D280 VanDerWaalsContact OG-N 3.13Å; S277-D280 PolarHBondContact OG-OD2 3.23Å; D280-G282 VanDerWaalsContact C-N 3.34Å; D280-G282 PolarHBondContact O-N 3.1Å; D280-L283 PolarHBondContact O-N 2.68Å; D280-E284 WeakPolarHBondContact O-CB 3.38Å; D280-E284 PolarHBondContact O-N 2.86Å
281	M	95.2	Very high	92.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-43.7	170.4	-179.5	-161.1	72.8	0	0	111.2	Y212 R216 C219 P276 S277 I278 W279 L283 E284 L285	Y212-M281 HydrophobicContact CE1-SD 4.47Å; Y212-M281 HydrophobicContact CE2-SD 4.35Å; R216-M281 HydrophobicContact CB-SD 3.5Å; R216-M281 VanDerWaalsContact CB-SD 3.5Å; R216-M281 HydrophobicContact CG-CG 4.01Å; R216-M281 HydrophobicContact CG-SD 3.63Å; C219-M281 HydrophobicContact CB-CE 4.37Å; P276-M281 HydrophobicContact CG-CB 4.27Å; S277-M281 WeakPolarHBondContact O-CB 3.33Å; S277-M281 PolarHBondContact O-N 2.77Å; I278-M281 HydrophobicContact CG2-CE 4.38Å; W279-M281 VanDerWaalsContact C-N 3.28Å; W279-M281 PolarHBondContact O-N 3.28Å; M281-L283 VanDerWaalsContact C-N 3.35Å; M281-E284 PolarHBondContact O-N 3.39Å; M281-L285 HydrophobicContact CG-CD1 4.35Å; M281-L285 VanDerWaalsContact O-CG 3.27Å; M281-L285 WeakPolarHBondContact O-CG 3.32Å; M281-L285 PolarHBondContact O-N 3.32Å
282	G	94.7	Very high	92.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-39.6	175.3	0	0	0	0	0	112.8	H250 I278 W279 D280 F286	H250-G282 PolarHBondContact NE2-O 2.94Å; I278-G282 PolarHBondContact O-N 3.11Å; I278-G282 VanDerWaalsContact O-N 3.16Å; W279-G282 WeakPolarHBondContact O-CA 3.45Å; W279-G282 PolarHBondContact O-N 3.49Å; D280-G282 VanDerWaalsContact C-N 3.34Å; D280-G282 PolarHBondContact O-N 3.1Å; G282-F286 WeakPolarHBondContact O-CB 3.49Å; G282-F286 PolarHBondContact O-N 3.41Å; G282-F286 VanDerWaalsContact O-N 3.13Å
283	L	94.3	Very high	92.3	Very high	23 Å²	23	49.6 Å²	49.6	12%	0.12	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-45.8	174.6	-58.6	-179	0	0	0	111.5	W247 W279 D280 M281 L285 F286 R287 L332	W247-L283 HydrophobicContact CH2-CD2 3.45Å; W247-L283 VanDerWaalsContact CH2-CD2 3.45Å; W247-L283 HydrophobicContact CZ2-CD2 4.35Å; W247-L283 HydrophobicContact CZ3-CD2 4.13Å; W279-L283 HydrophobicContact CZ2-CD2 4.27Å; W279-L283 WeakPolarHBondContact O-CG 3.3Å; W279-L283 PolarHBondContact O-N 3.27Å; D280-L283 PolarHBondContact O-N 2.68Å; M281-L283 VanDerWaalsContact C-N 3.35Å; L283-L285 PolarHBondContact O-N 2.96Å; L283-F286 PolarHBondContact O-N 3.35Å; L283-R287 WeakPolarHBondContact O-CB 3.5Å; L283-R287 PolarHBondContact O-N 3.38Å; L283-L332 HydrophobicContact CB-CD2 4.18Å; L283-L332 HydrophobicContact CD2-CD2 4.41Å; L283-L332 WeakPolarHBondContact O-CD2 3.33Å
284	E	94.4	Very high	92.4	Very high	84 Å²	84	50 Å²	50	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-57.9	-47.1	177.8	-175.1	-165.7	135.7	0	0	111.3	R216 D280 M281 R287 F288	R216-E284 IonicContact NH2-OE1 3.76Å; R216-E284 PolarHBondContact NH2-OE1 3.35Å; D280-E284 WeakPolarHBondContact O-CB 3.38Å; D280-E284 PolarHBondContact O-N 2.86Å; M281-E284 PolarHBondContact O-N 3.39Å; E284-R287 PolarHBondContact O-N 2.97Å; E284-F288 VanDerWaalsContact O-CB 3.31Å; E284-F288 WeakPolarHBondContact O-CB 3.4Å; E284-F288 PolarHBondContact O-N 3.39Å
285	L	94.3	Very high	92.3	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-44.6	178.2	-70.1	174	0	0	0	111.8	C219 E220 M281 L283 F288 Y289	C219-L285 HydrophobicContact CB-CD1 3.75Å; E220-L285 HydrophobicContact CB-CD1 4.25Å; E220-L285 HydrophobicContact CB-CD2 3.8Å; E220-L285 HydrophobicContact CG-CD2 3.93Å; M281-L285 HydrophobicContact CG-CD1 4.35Å; M281-L285 VanDerWaalsContact O-CG 3.27Å; M281-L285 WeakPolarHBondContact O-CG 3.32Å; M281-L285 PolarHBondContact O-N 3.32Å; L283-L285 PolarHBondContact O-N 2.96Å; L285-F288 PolarHBondContact O-N 2.86Å; L285-Y289 HydrophobicContact CD2-CD2 4.23Å; L285-Y289 HydrophobicContact CD2-CE2 3.91Å; L285-Y289 WeakPolarHBondContact O-CB 3.28Å; L285-Y289 WeakPolarHBondContact O-CD2 3.47Å; L285-Y289 PolarHBondContact O-N 2.88Å
286	F	95.1	Very high	92.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-43.6	178.3	-166	-84.3	0	0	0	111.7	I223 W247 H250 G282 L283 F288 I290 I291 M328 L332	I223-F286 HydrophobicContact CD1-CD2 4.38Å; W247-F286 HydrophobicContact CB-CZ 4.09Å; W247-F286 AromaticContact CE3-CD1 3.69Å; W247-F286 HydrophobicContact CE3-CD1 3.69Å; W247-F286 HydrophobicContact CE3-CD2 4.16Å; W247-F286 AromaticContact CE3-CE1 3.63Å; W247-F286 HydrophobicContact CE3-CE1 3.63Å; W247-F286 HydrophobicContact CE3-CE2 4.11Å; W247-F286 AromaticContact CE3-CG 3.96Å; W247-F286 HydrophobicContact CE3-CG 3.96Å; W247-F286 AromaticContact CE3-CZ 3.86Å; W247-F286 HydrophobicContact CE3-CZ 3.86Å; W247-F286 HydrophobicContact CZ3-CB 4.3Å; W247-F286 AromaticContact CZ3-CD1 3.76Å; W247-F286 HydrophobicContact CZ3-CD1 3.76Å; W247-F286 HydrophobicContact CZ3-CD2 4.48Å; W247-F286 HydrophobicContact CZ3-CE1 4.17Å; W247-F286 AromaticContact CZ3-CG 3.93Å; W247-F286 HydrophobicContact CZ3-CG 3.93Å; H250-F286 HydrophobicContact CB-CD2 4.14Å; H250-F286 HydrophobicContact CB-CE2 4.23Å; H250-F286 AromaticContact CD2-CD2 3.56Å; H250-F286 AromaticContact CD2-CG 3.96Å; H250-F286 AromaticContact CG-CD2 3.85Å; G282-F286 WeakPolarHBondContact O-CB 3.49Å; G282-F286 PolarHBondContact O-N 3.41Å; G282-F286 VanDerWaalsContact O-N 3.13Å; L283-F286 PolarHBondContact O-N 3.35Å; F286-F288 PolarHBondContact O-N 2.88Å; F286-I290 HydrophobicContact CD1-CB 4.3Å; F286-I290 HydrophobicContact CD2-CG1 4.1Å; F286-I290 HydrophobicContact CE1-CB 4.19Å; F286-I290 HydrophobicContact CE1-CG2 4.13Å; F286-I290 HydrophobicContact CE2-CB 4.41Å; F286-I290 HydrophobicContact CE2-CG1 4.12Å; F286-I290 HydrophobicContact CE2-CG2 4.44Å; F286-I290 HydrophobicContact CG-CB 4.47Å; F286-I290 HydrophobicContact CG-CG1 4.41Å; F286-I290 HydrophobicContact CZ-CB 4.25Å; F286-I290 HydrophobicContact CZ-CG1 4.44Å; F286-I290 HydrophobicContact CZ-CG2 3.97Å; F286-I290 WeakPolarHBondContact O-CB 3.18Å; F286-I290 PolarHBondContact O-N 3.44Å; F286-I291 HydrophobicContact CD1-CG1 3.96Å; F286-I291 HydrophobicContact CE1-CD1 4.02Å; F286-I291 HydrophobicContact CE1-CG1 3.65Å; F286-I291 PolarHBondContact O-N 3.3Å; F286-M328 HydrophobicContact CE1-SD 3.88Å; F286-M328 HydrophobicContact CZ-SD 4.43Å; F286-L332 HydrophobicContact CB-CD2 4.49Å; F286-L332 HydrophobicContact CD1-CD1 3.81Å; F286-L332 HydrophobicContact CD1-CD2 4.32Å; F286-L332 HydrophobicContact CE1-CD1 4.22Å
287	R	94	Very high	92.4	Very high	83 Å²	83	48.1 Å²	48.1	31%	0.313	23%	0.231	S	C	.	.	I	π-helix	trans	-56	-52.2	173.8	-178.3	-176.2	171.6	148.6	-5.4	110.4	L283 E284 S292 L332 Q333 I334	L283-R287 WeakPolarHBondContact O-CB 3.5Å; L283-R287 PolarHBondContact O-N 3.38Å; E284-R287 PolarHBondContact O-N 2.97Å; R287-S292 VanDerWaalsContact O-CB 3.23Å; R287-S292 WeakPolarHBondContact O-CB 3.37Å; R287-S292 PolarHBondContact O-N 2.84Å; R287-S292 PolarHBondContact O-OG 3.38Å; R287-L332 HydrophobicContact CB-CD2 4.08Å; R287-L332 WeakPolarHBondContact CD-O 3.4Å; R287-L332 PolarHBondContact NH1-O 3.49Å; R287-Q333 PolarHBondContact NH1-O 2.82Å; R287-Q333 VanDerWaalsContact NH1-O 3.11Å; R287-I334 HydrophobicContact CG-CG2 4.35Å
288	F	92.8	Very high	92.3	Very high	134 Å²	134	48.4 Å²	48.4	59%	0.588	23%	0.233	S	C	*	.	I	π-helix	trans	-71.2	-42.7	-171	-173.2	-96.7	0	0	0	112.9	E284 L285 F286	E284-F288 VanDerWaalsContact O-CB 3.31Å; E284-F288 WeakPolarHBondContact O-CB 3.4Å; E284-F288 PolarHBondContact O-N 3.39Å; L285-F288 PolarHBondContact O-N 2.86Å; F286-F288 PolarHBondContact O-N 2.88Å
289	Y	91.7	Very high	92.1	Very high	54 Å²	54	51.1 Å²	51.1	21%	0.212	24%	0.244	C	C	.	.	I	π-helix	trans	-95.7	-27.7	-172.6	-71.2	-64.8	0	0	0	114.7	E220 K224 I227 L285	E220-Y289 HydrophobicContact CG-CE2 3.66Å; E220-Y289 PolarHBondContact OE1-OH 3.43Å; K224-Y289 HydrophobicContact CD-CE1 4.14Å; K224-Y289 WeakPolarHBondContact CE-OH 3.32Å; K224-Y289 HydrophobicContact CG-CD1 3.73Å; K224-Y289 HydrophobicContact CG-CD2 4.34Å; K224-Y289 HydrophobicContact CG-CE1 3.86Å; K224-Y289 HydrophobicContact CG-CE2 4.43Å; K224-Y289 HydrophobicContact CG-CG 4Å; K224-Y289 PolarHBondContact NZ-OH 3.01Å; I227-Y289 VanDerWaalsContact CD1-O 3.26Å; I227-Y289 WeakPolarHBondContact CD1-O 3.44Å; L285-Y289 HydrophobicContact CD2-CD2 4.23Å; L285-Y289 HydrophobicContact CD2-CE2 3.91Å; L285-Y289 WeakPolarHBondContact O-CB 3.28Å; L285-Y289 WeakPolarHBondContact O-CD2 3.47Å; L285-Y289 PolarHBondContact O-N 2.88Å
290	I	90.8	Very high	92.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-101.5	-63.4	-179.1	-54.7	-59.6	0	0	0	110.4	I223 Q226 I227 F230 I243 F286 D293 V296	I223-I290 HydrophobicContact CG2-CD1 4.13Å; I223-I290 HydrophobicContact CG2-CG1 3.82Å; Q226-I290 HydrophobicContact CB-CD1 4.13Å; I227-I290 HydrophobicContact CB-CD1 4.09Å; I227-I290 HydrophobicContact CG1-CD1 4.45Å; F230-I290 HydrophobicContact CD2-CG2 4.23Å; F230-I290 HydrophobicContact CE2-CD1 4.32Å; F230-I290 HydrophobicContact CE2-CG2 3.89Å; I243-I290 HydrophobicContact CD1-CG2 4.46Å; F286-I290 HydrophobicContact CD1-CB 4.3Å; F286-I290 HydrophobicContact CD2-CG1 4.1Å; F286-I290 HydrophobicContact CE1-CB 4.19Å; F286-I290 HydrophobicContact CE1-CG2 4.13Å; F286-I290 HydrophobicContact CE2-CB 4.41Å; F286-I290 HydrophobicContact CE2-CG1 4.12Å; F286-I290 HydrophobicContact CE2-CG2 4.44Å; F286-I290 HydrophobicContact CG-CB 4.47Å; F286-I290 HydrophobicContact CG-CG1 4.41Å; F286-I290 HydrophobicContact CZ-CB 4.25Å; F286-I290 HydrophobicContact CZ-CG1 4.44Å; F286-I290 HydrophobicContact CZ-CG2 3.97Å; F286-I290 WeakPolarHBondContact O-CB 3.18Å; F286-I290 PolarHBondContact O-N 3.44Å; I290-D293 PolarHBondContact O-N 3.22Å; I290-V296 HydrophobicContact CG2-CG1 4.38Å; I290-V296 WeakPolarHBondContact O-CB 3.41Å; I290-V296 WeakPolarHBondContact O-CG1 3.33Å
291	I	89.1	Confident	92.1	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.216	C	C	.	.	I	π-helix	trans	-81.4	-26.3	-169.2	-57.1	-64.7	0	0	0	113.3	I243 F286 D293 V296 Q297 M328 L329 L332 I334	I243-I291 HydrophobicContact CG2-CD1 4.28Å; F286-I291 HydrophobicContact CD1-CG1 3.96Å; F286-I291 HydrophobicContact CE1-CD1 4.02Å; F286-I291 HydrophobicContact CE1-CG1 3.65Å; F286-I291 PolarHBondContact O-N 3.3Å; I291-D293 PolarHBondContact O-N 2.87Å; I291-V296 HydrophobicContact CD1-CG1 4.36Å; I291-Q297 VanDerWaalsContact O-CB 3.25Å; I291-Q297 WeakPolarHBondContact O-CB 3.39Å; I291-M328 HydrophobicContact CD1-CE 3.74Å; I291-M328 HydrophobicContact CD1-SD 4.24Å; I291-M328 HydrophobicContact CG1-CE 4.35Å; I291-L329 HydrophobicContact CG2-CD2 4.33Å; I291-L332 HydrophobicContact CB-CD1 4.36Å; I291-L332 HydrophobicContact CG1-CD1 3.75Å; I291-I334 HydrophobicContact CB-CD1 4.1Å; I291-I334 HydrophobicContact CG2-CD1 3.17Å
292	S	87.4	Confident	92.1	Very high	57 Å²	57	48.3 Å²	48.3	40%	0.399	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.1	176.1	-55.4	0	0	0	0	113.1	R287 L294	R287-S292 VanDerWaalsContact O-CB 3.23Å; R287-S292 WeakPolarHBondContact O-CB 3.37Å; R287-S292 PolarHBondContact O-N 2.84Å; R287-S292 PolarHBondContact O-OG 3.38Å; S292-L294 PolarHBondContact O-N 3.46Å
293	D	90.1	Very high	92.1	Very high	50 Å²	50	48.4 Å²	48.4	27%	0.267	23%	0.234	S	C	.	.	S	Bend	trans	-65.1	122.8	165.9	178.1	-86.6	0	0	0	109.3	I227 I290 I291 K295 V296 Q297	I227-D293 HydrophobicContact CD1-CB 4.1Å; I290-D293 PolarHBondContact O-N 3.22Å; I291-D293 PolarHBondContact O-N 2.87Å; D293-K295 VanDerWaalsContact C-N 3.25Å; D293-K295 PolarHBondContact O-N 2.99Å; D293-K295 WeakPolarHBondContact OD1-CB 3.3Å; D293-K295 PolarHBondContact OD1-N 2.8Å; D293-V296 HydrophobicContact CB-CB 4.17Å; D293-V296 HydrophobicContact CB-CG2 4.1Å; D293-V296 PolarHBondContact O-N 2.73Å; D293-V296 VanDerWaalsContact O-N 3.16Å; D293-V296 PolarHBondContact OD1-N 3.08Å; D293-V296 VanDerWaalsContact OD1-N 3.08Å; D293-Q297 WeakPolarHBondContact O-CB 3.48Å; D293-Q297 PolarHBondContact O-N 3.28Å
294	L	87.3	Confident	92.1	Very high	131 Å²	131	47.3 Å²	47.3	69%	0.686	23%	0.229	S	C	*	.	H	α-helix	trans	-58.4	-35.6	-171.1	-174.9	65.7	0	0	0	113.2	S292 S298	S292-L294 PolarHBondContact O-N 3.46Å; L294-S298 WeakPolarHBondContact O-CB 3.46Å; L294-S298 PolarHBondContact O-N 2.66Å
295	K	89.1	Confident	92.2	Very high	173 Å²	173	44.3 Å²	44.3	75%	0.752	22%	0.216	S	C	*	.	H	α-helix	trans	-74.1	-43.5	-179.5	-67.9	-177	177.8	-178.6	0	110.7	D293 K299	D293-K295 VanDerWaalsContact C-N 3.25Å; D293-K295 PolarHBondContact O-N 2.99Å; D293-K295 WeakPolarHBondContact OD1-CB 3.3Å; D293-K295 PolarHBondContact OD1-N 2.8Å; K295-K299 WeakPolarHBondContact O-CB 3.31Å; K295-K299 PolarHBondContact O-N 3.1Å
296	V	91.3	Very high	92.2	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.036	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-45.8	176.1	176	0	0	0	0	110.2	F230 F239 I243 I290 I291 D293 T300	F230-V296 HydrophobicContact CB-CG2 3.89Å; F239-V296 HydrophobicContact CZ-CG1 4.17Å; I243-V296 HydrophobicContact CD1-CG1 3.65Å; I290-V296 HydrophobicContact CG2-CG1 4.38Å; I290-V296 WeakPolarHBondContact O-CB 3.41Å; I290-V296 WeakPolarHBondContact O-CG1 3.33Å; I291-V296 HydrophobicContact CD1-CG1 4.36Å; D293-V296 HydrophobicContact CB-CB 4.17Å; D293-V296 HydrophobicContact CB-CG2 4.1Å; D293-V296 PolarHBondContact O-N 2.73Å; D293-V296 VanDerWaalsContact O-N 3.16Å; D293-V296 PolarHBondContact OD1-N 3.08Å; D293-V296 VanDerWaalsContact OD1-N 3.08Å; V296-T300 VanDerWaalsContact O-CB 3.31Å; V296-T300 WeakPolarHBondContact O-CB 3.5Å; V296-T300 PolarHBondContact O-N 3.31Å; V296-T300 PolarHBondContact O-OG1 3.32Å
297	Q	91.6	Very high	92.2	Very high	46 Å²	46	47.2 Å²	47.2	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-59.3	178.3	-161	-176.3	50	0	0	111.2	I291 D293 K299 T300 I301 S338	I291-Q297 VanDerWaalsContact O-CB 3.25Å; I291-Q297 WeakPolarHBondContact O-CB 3.39Å; D293-Q297 WeakPolarHBondContact O-CB 3.48Å; D293-Q297 PolarHBondContact O-N 3.28Å; Q297-K299 VanDerWaalsContact C-N 3.32Å; Q297-K299 PolarHBondContact O-N 3.27Å; Q297-T300 PolarHBondContact O-N 2.99Å; Q297-T300 VanDerWaalsContact O-N 3.13Å; Q297-I301 WeakPolarHBondContact O-CG1 3.33Å; Q297-I301 PolarHBondContact O-N 3.13Å; Q297-S338 PolarHBondContact NE2-OG 3.42Å
298	S	91.6	Very high	92.3	Very high	36 Å²	36	43.4 Å²	43.4	25%	0.252	22%	0.216	S	C	.	.	H	α-helix	trans	-58	-47.2	-176.9	-165	0	0	0	0	110.6	L294 T300 I301 D302	L294-S298 WeakPolarHBondContact O-CB 3.46Å; L294-S298 PolarHBondContact O-N 2.66Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.06Å; S298-I301 PolarHBondContact O-N 3.04Å; S298-D302 VanDerWaalsContact O-CB 3.24Å; S298-D302 WeakPolarHBondContact O-CB 3.42Å; S298-D302 PolarHBondContact O-N 2.53Å; S298-D302 PolarHBondContact OG-OD2 3.12Å
299	K	91.9	Very high	92.4	Very high	56 Å²	56	41 Å²	41	24%	0.243	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-32.7	-178.7	-165.7	172.6	-179.1	176.5	0	113.1	L234 F239 K295 Q297 G303	L234-K299 WeakPolarHBondContact O-CE 3.39Å; L234-K299 PolarHBondContact O-NZ 2.94Å; F239-K299 HydrophobicContact CD1-CB 4.24Å; F239-K299 HydrophobicContact CD1-CD 3.93Å; F239-K299 HydrophobicContact CD1-CG 3.72Å; F239-K299 HydrophobicContact CD2-CD 3.87Å; F239-K299 HydrophobicContact CE1-CB 3.77Å; F239-K299 HydrophobicContact CE1-CD 4.02Å; F239-K299 HydrophobicContact CE1-CG 3.77Å; F239-K299 HydrophobicContact CE2-CD 3.95Å; F239-K299 HydrophobicContact CG-CD 3.85Å; F239-K299 HydrophobicContact CG-CG 4.14Å; F239-K299 HydrophobicContact CZ-CB 4.09Å; F239-K299 HydrophobicContact CZ-CD 4.03Å; F239-K299 HydrophobicContact CZ-CG 4.22Å; K295-K299 WeakPolarHBondContact O-CB 3.31Å; K295-K299 PolarHBondContact O-N 3.1Å; Q297-K299 VanDerWaalsContact C-N 3.32Å; Q297-K299 PolarHBondContact O-N 3.27Å; K299-G303 PolarHBondContact O-N 3.05Å
300	T	93.4	Very high	92.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-49.8	174	-55.9	0	0	0	0	110.6	F239 L240 V296 Q297 S298 G303 I304	F239-T300 WeakPolarHBondContact CE1-OG1 3.35Å; L240-T300 HydrophobicContact CD2-CG2 4.04Å; V296-T300 VanDerWaalsContact O-CB 3.31Å; V296-T300 WeakPolarHBondContact O-CB 3.5Å; V296-T300 PolarHBondContact O-N 3.31Å; V296-T300 PolarHBondContact O-OG1 3.32Å; Q297-T300 PolarHBondContact O-N 2.99Å; Q297-T300 VanDerWaalsContact O-N 3.13Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.06Å; T300-G303 PolarHBondContact O-N 2.6Å; T300-I304 HydrophobicContact CG2-CD1 3.99Å; T300-I304 VanDerWaalsContact O-CG1 3.28Å; T300-I304 WeakPolarHBondContact O-CG1 3.21Å; T300-I304 PolarHBondContact O-N 2.97Å
301	I	94.8	Very high	92.7	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-50.1	179.6	-61.4	-50.3	0	0	0	110.9	Q297 S298 G303 I304 L305 L329 F339	Q297-I301 WeakPolarHBondContact O-CG1 3.33Å; Q297-I301 PolarHBondContact O-N 3.13Å; S298-I301 PolarHBondContact O-N 3.04Å; I301-G303 VanDerWaalsContact C-N 3.27Å; I301-G303 PolarHBondContact O-N 2.6Å; I301-I304 PolarHBondContact O-N 3.31Å; I301-I304 VanDerWaalsContact O-N 3.15Å; I301-L305 HydrophobicContact CG2-CD1 3.89Å; I301-L305 HydrophobicContact CG2-CG 4.36Å; I301-L305 VanDerWaalsContact O-CG 3.31Å; I301-L305 WeakPolarHBondContact O-CG 3.32Å; I301-L305 PolarHBondContact O-N 2.8Å; I301-L329 HydrophobicContact CD1-CD1 3.64Å; I301-F339 HydrophobicContact CD1-CB 3.83Å; I301-F339 HydrophobicContact CD1-CD2 4.2Å; I301-F339 HydrophobicContact CD1-CG 4.48Å; I301-F339 HydrophobicContact CG2-CD2 4.34Å
302	D	94	Very high	92.9	Very high	71 Å²	71	44 Å²	44	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-37.5	-179.9	-60	-26.8	0	0	0	111.1	S298 L306 R342	S298-D302 VanDerWaalsContact O-CB 3.24Å; S298-D302 WeakPolarHBondContact O-CB 3.42Å; S298-D302 PolarHBondContact O-N 2.53Å; S298-D302 PolarHBondContact OG-OD2 3.12Å; D302-L306 VanDerWaalsContact O-CB 3.29Å; D302-L306 WeakPolarHBondContact O-CB 3.46Å; D302-L306 PolarHBondContact O-N 3.11Å; D302-R342 IonicContact OD1-NH1 3.55Å; D302-R342 PolarHBondContact OD1-NH1 3.26Å; D302-R342 IonicContact OD2-NH1 2.83Å
303	G	94.5	Very high	93.1	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-43.5	174.1	0	0	0	0	0	113.2	K299 T300 I301 L306 L307	K299-G303 PolarHBondContact O-N 3.05Å; T300-G303 PolarHBondContact O-N 2.6Å; I301-G303 VanDerWaalsContact C-N 3.27Å; I301-G303 PolarHBondContact O-N 2.6Å; G303-L306 PolarHBondContact O-N 2.85Å; G303-L307 WeakPolarHBondContact O-CG 3.47Å; G303-L307 PolarHBondContact O-N 3.46Å; G303-L307 VanDerWaalsContact O-N 3.1Å
304	I	96.3	Very high	93.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-47.1	176.6	-71.5	167.2	0	0	0	110	L240 T300 I301 L306 L307 I308 L322 L325 L326 L329 F339	L240-I304 HydrophobicContact CD2-CG1 4.26Å; T300-I304 HydrophobicContact CG2-CD1 3.99Å; T300-I304 VanDerWaalsContact O-CG1 3.28Å; T300-I304 WeakPolarHBondContact O-CG1 3.21Å; T300-I304 PolarHBondContact O-N 2.97Å; I301-I304 PolarHBondContact O-N 3.31Å; I301-I304 VanDerWaalsContact O-N 3.15Å; I304-L306 VanDerWaalsContact C-N 3.33Å; I304-L306 PolarHBondContact O-N 3.29Å; I304-L307 PolarHBondContact O-N 3.35Å; I304-I308 HydrophobicContact CG2-CD1 3.97Å; I304-I308 WeakPolarHBondContact O-CG1 3.25Å; I304-I308 PolarHBondContact O-N 3.37Å; I304-I308 VanDerWaalsContact O-N 3.08Å; I304-L322 HydrophobicContact CB-CD2 4.27Å; I304-L322 HydrophobicContact CG1-CD2 4.12Å; I304-L322 HydrophobicContact CG2-CD2 3.93Å; I304-L325 HydrophobicContact CD1-CB 4.13Å; I304-L325 HydrophobicContact CG1-CD1 4.42Å; I304-L326 HydrophobicContact CD1-CD2 4.19Å; I304-L326 HydrophobicContact CG2-CD2 4.01Å; I304-L326 HydrophobicContact CG2-CG 4.48Å; I304-L329 HydrophobicContact CD1-CD1 4.04Å; I304-F339 HydrophobicContact CB-CE2 4.33Å; I304-F339 HydrophobicContact CG2-CD2 4.17Å; I304-F339 HydrophobicContact CG2-CE2 3.43Å; I304-F339 VanDerWaalsContact CG2-CE2 3.43Å; I304-F339 HydrophobicContact CG2-CZ 3.98Å
305	L	95.9	Very high	93.4	Very high	22 Å²	22	45.9 Å²	45.9	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-41.9	178.4	-66.7	173.7	0	0	0	111.8	I301 L307 I308 E309 F339 R342 F343 E346	I301-L305 HydrophobicContact CG2-CD1 3.89Å; I301-L305 HydrophobicContact CG2-CG 4.36Å; I301-L305 VanDerWaalsContact O-CG 3.31Å; I301-L305 WeakPolarHBondContact O-CG 3.32Å; I301-L305 PolarHBondContact O-N 2.8Å; L305-L307 PolarHBondContact O-N 3.28Å; L305-I308 PolarHBondContact O-N 3.43Å; L305-E309 WeakPolarHBondContact O-CB 3.42Å; L305-E309 PolarHBondContact O-N 3.31Å; L305-F339 HydrophobicContact CD2-CD2 4.43Å; L305-F339 HydrophobicContact CD2-CE2 3.72Å; L305-F339 HydrophobicContact CD2-CZ 4.41Å; L305-F339 HydrophobicContact CG-CE2 4.27Å; L305-R342 HydrophobicContact CD1-CB 4.21Å; L305-F343 HydrophobicContact CD2-CB 3.84Å; L305-F343 HydrophobicContact CD2-CD2 3.89Å; L305-F343 HydrophobicContact CD2-CG 4.38Å; L305-E346 HydrophobicContact CD1-CG 4.34Å
306	L	94.3	Very high	93.5	Very high	54 Å²	54	42.7 Å²	42.7	28%	0.283	24%	0.244	S	C	.	.	H	α-helix	trans	-60.6	-41.7	175.9	178.5	65.8	0	0	0	112.4	D302 G303 I304 E309 R310	D302-L306 VanDerWaalsContact O-CB 3.29Å; D302-L306 WeakPolarHBondContact O-CB 3.46Å; D302-L306 PolarHBondContact O-N 3.11Å; G303-L306 PolarHBondContact O-N 2.85Å; I304-L306 VanDerWaalsContact C-N 3.33Å; I304-L306 PolarHBondContact O-N 3.29Å; L306-E309 PolarHBondContact O-N 3.11Å; L306-R310 WeakPolarHBondContact O-CG 3.29Å; L306-R310 PolarHBondContact O-N 3.48Å
307	L	95.3	Very high	93.6	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.052	25%	0.25	C	C	.	.	H	α-helix	trans	-64.6	-41.9	176.2	-72	-178	0	0	0	111.4	V237 L240 G303 I304 L305 R310 E311 I317 L322	V237-L307 HydrophobicContact CG2-CD2 4.08Å; L240-L307 HydrophobicContact CD1-CD1 3.6Å; L240-L307 HydrophobicContact CD1-CG 4.27Å; G303-L307 WeakPolarHBondContact O-CG 3.47Å; G303-L307 PolarHBondContact O-N 3.46Å; G303-L307 VanDerWaalsContact O-N 3.1Å; I304-L307 PolarHBondContact O-N 3.35Å; L305-L307 PolarHBondContact O-N 3.28Å; L307-R310 PolarHBondContact O-N 3.08Å; L307-E311 PolarHBondContact O-N 2.86Å; L307-I317 HydrophobicContact CB-CD1 4.37Å; L307-I317 HydrophobicContact CD2-CG2 4.24Å; L307-L322 HydrophobicContact CB-CD1 4.29Å; L307-L322 HydrophobicContact CB-CD2 4.17Å; L307-L322 HydrophobicContact CD1-CD2 3.83Å; L307-L322 HydrophobicContact CD1-CG 4.27Å
308	I	96	Very high	93.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-41.7	177.4	-63	167.5	0	0	0	110.9	I304 L305 E311 R312 L322 F339 F343 Y385 L386	I304-I308 HydrophobicContact CG2-CD1 3.97Å; I304-I308 WeakPolarHBondContact O-CG1 3.25Å; I304-I308 PolarHBondContact O-N 3.37Å; I304-I308 VanDerWaalsContact O-N 3.08Å; L305-I308 PolarHBondContact O-N 3.43Å; I308-E311 PolarHBondContact O-N 3.44Å; I308-R312 WeakPolarHBondContact O-CG 3.3Å; I308-R312 PolarHBondContact O-N 3.25Å; I308-L322 HydrophobicContact CG1-CD1 3.98Å; I308-F339 HydrophobicContact CD1-CE2 4.4Å; I308-F339 HydrophobicContact CD1-CZ 3.94Å; I308-F343 HydrophobicContact CD1-CD2 4.19Å; I308-F343 HydrophobicContact CD1-CE2 4.12Å; I308-F343 HydrophobicContact CG2-CE2 4.16Å; I308-Y385 HydrophobicContact CD1-CE2 4.17Å; I308-Y385 HydrophobicContact CG1-CE2 4.04Å; I308-L386 HydrophobicContact CD1-CD2 4.42Å
309	E	94.5	Very high	93.8	Very high	84 Å²	84	47.5 Å²	47.5	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-44.9	176.3	-174.5	177.6	-169.3	0	0	111.9	L305 L306 E311 R312 N313 L350	L305-E309 WeakPolarHBondContact O-CB 3.42Å; L305-E309 PolarHBondContact O-N 3.31Å; L306-E309 PolarHBondContact O-N 3.11Å; E309-E311 VanDerWaalsContact C-N 3.33Å; E309-E311 PolarHBondContact O-N 2.84Å; E309-R312 WeakPolarHBondContact O-CB 3.13Å; E309-R312 PolarHBondContact O-N 2.92Å; E309-N313 PolarHBondContact O-N 2.86Å; E309-N313 VanDerWaalsContact O-N 3.12Å; E309-N313 PolarHBondContact O-ND2 3.08Å; E309-L350 HydrophobicContact CG-CD1 4.33Å
310	R	93.4	Very high	94	Very high	90 Å²	90	48.8 Å²	48.8	34%	0.34	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-41.7	174.6	-75.2	-180	178.3	-175.3	0.7	112.3	L306 L307 R312 N313 G314 E315 I317	L306-R310 WeakPolarHBondContact O-CG 3.29Å; L306-R310 PolarHBondContact O-N 3.48Å; L307-R310 PolarHBondContact O-N 3.08Å; R310-R312 PolarHBondContact O-N 3.49Å; R310-N313 CarbonylContact O-C 3.59Å; R310-N313 PolarHBondContact O-N 2.69Å; R310-N313 VanDerWaalsContact O-N 3.11Å; R310-G314 PolarHBondContact O-N 2.96Å; R310-E315 HydrophobicContact CB-CB 4.08Å; R310-E315 HydrophobicContact CB-CG 4.39Å; R310-E315 WeakPolarHBondContact CD-OE2 3.44Å; R310-E315 WeakPolarHBondContact O-CB 3.13Å; R310-E315 PolarHBondContact O-N 3.46Å; R310-I317 HydrophobicContact CB-CG2 4.38Å
311	E	94.8	Very high	94.1	Very high	17 Å²	17	49 Å²	49	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-38.6	175.4	-171.5	179.3	-139	0	0	112.4	L307 I308 E309 N313 G314 I317 R319 R381 Y385	L307-E311 PolarHBondContact O-N 2.86Å; I308-E311 PolarHBondContact O-N 3.44Å; E309-E311 VanDerWaalsContact C-N 3.33Å; E309-E311 PolarHBondContact O-N 2.84Å; E311-N313 PolarHBondContact O-N 2.99Å; E311-G314 PolarHBondContact O-N 3.13Å; E311-I317 HydrophobicContact CB-CD1 3.76Å; E311-I317 HydrophobicContact CB-CG1 3.9Å; E311-I317 HydrophobicContact CB-CG2 4.28Å; E311-I317 HydrophobicContact CG-CD1 4.2Å; E311-I317 HydrophobicContact CG-CG1 4.09Å; E311-R319 IonicContact OE1-CZ 3.81Å; E311-R319 IonicContact OE1-NE 3.29Å; E311-R319 PolarHBondContact OE1-NE 3.26Å; E311-R319 IonicContact OE1-NH2 3.12Å; E311-R319 PolarHBondContact OE1-NH2 2.92Å; E311-R381 IonicContact OE2-NE 3.23Å; E311-R381 PolarHBondContact OE2-NE 3.2Å; E311-Y385 WeakPolarHBondContact OE2-CE1 3.44Å; E311-Y385 PolarHBondContact OE2-OH 3.48Å
312	R	93.8	Very high	94.2	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.045	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-27.1	173.4	-74.3	173.6	172.1	164.5	-0.3	112.5	I308 E309 R310 G314 T347 R374 E378	I308-R312 WeakPolarHBondContact O-CG 3.3Å; I308-R312 PolarHBondContact O-N 3.25Å; E309-R312 WeakPolarHBondContact O-CB 3.13Å; E309-R312 PolarHBondContact O-N 2.92Å; R310-R312 PolarHBondContact O-N 3.49Å; R312-G314 VanDerWaalsContact C-N 3.31Å; R312-T347 PolarHBondContact NH1-OG1 3.1Å; R312-T347 PolarHBondContact NH2-OG1 2.6Å; R312-R374 PolarHBondContact O-NH1 2.84Å; R312-R374 PolarHBondContact O-NH2 3.44Å; R312-R374 VanDerWaalsContact O-NH2 3.17Å; R312-E378 IonicContact CZ-OE1 3.78Å; R312-E378 IonicContact CZ-OE2 2.73Å; R312-E378 IonicContact NE-OE1 3.89Å; R312-E378 PolarHBondContact NE-OE1 3.33Å; R312-E378 IonicContact NE-OE2 2.78Å; R312-E378 IonicContact NH2-OE1 3.92Å; R312-E378 PolarHBondContact NH2-OE1 3.14Å; R312-E378 VanDerWaalsContact NH2-OE1 3.16Å; R312-E378 IonicContact NH2-OE2 2.66Å; R312-E378 PolarHBondContact NH2-OE2 3.04Å
313	N	91.2	Very high	94.3	Very high	107 Å²	107	52 Å²	52	57%	0.572	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-0.9	175.2	-63.8	-29.9	0	0	0	113.4	E309 R310 E311	E309-N313 PolarHBondContact O-N 2.86Å; E309-N313 VanDerWaalsContact O-N 3.12Å; E309-N313 PolarHBondContact O-ND2 3.08Å; R310-N313 CarbonylContact O-C 3.59Å; R310-N313 PolarHBondContact O-N 2.69Å; R310-N313 VanDerWaalsContact O-N 3.11Å; E311-N313 PolarHBondContact O-N 2.99Å
314	G	89.9	Confident	94.4	Very high	69 Å²	69	53.1 Å²	53.1	71%	0.711	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	8.6	176.4	0	0	0	0	0	114.8	R310 E311 R312	R310-G314 PolarHBondContact O-N 2.96Å; E311-G314 PolarHBondContact O-N 3.13Å; R312-G314 VanDerWaalsContact C-N 3.31Å
315	E	93.5	Very high	94.4	Very high	101 Å²	101	53.1 Å²	53.1	47%	0.472	29%	0.292	S	S	.	.			trans	-75.5	143.5	173.1	-62.4	179	-139.3	0	0	111.1	R310	R310-E315 HydrophobicContact CB-CB 4.08Å; R310-E315 HydrophobicContact CB-CG 4.39Å; R310-E315 WeakPolarHBondContact CD-OE2 3.44Å; R310-E315 WeakPolarHBondContact O-CB 3.13Å; R310-E315 PolarHBondContact O-N 3.46Å
316	A	90.9	Very high	94.4	Very high	107 Å²	107	52.3 Å²	52.3	88%	0.884	29%	0.287	S	S	*	.			trans	-76.7	126.2	174.1	0	0	0	0	0	110.5
317	I	93.9	Very high	94.5	Very high	31 Å²	31	52.5 Å²	52.5	16%	0.159	29%	0.293	C	S	.	.			trans	-120.3	161.3	177.8	63.9	158.4	0	0	0	111.8	L307 R310 E311 R319 L322	L307-I317 HydrophobicContact CB-CD1 4.37Å; L307-I317 HydrophobicContact CD2-CG2 4.24Å; R310-I317 HydrophobicContact CB-CG2 4.38Å; E311-I317 HydrophobicContact CB-CD1 3.76Å; E311-I317 HydrophobicContact CB-CG1 3.9Å; E311-I317 HydrophobicContact CB-CG2 4.28Å; E311-I317 HydrophobicContact CG-CD1 4.2Å; E311-I317 HydrophobicContact CG-CG1 4.09Å; I317-R319 HydrophobicContact CG1-CG 4.34Å; I317-R319 PolarHBondContact O-N 3Å; I317-R319 VanDerWaalsContact O-N 3.08Å; I317-L322 HydrophobicContact CD1-CD1 3.38Å; I317-L322 HydrophobicContact CD1-CG 4.33Å
318	D	93.7	Very high	94.5	Very high	66 Å²	66	52 Å²	52	35%	0.353	29%	0.291	S	S	.	.			trans	-78.3	90.9	172.9	-170.7	-15.9	0	0	0	110.6	S320 L321 L322	D318-S320 PolarHBondContact O-N 3.38Å; D318-S320 WeakPolarHBondContact OD1-CB 3.44Å; D318-S320 PolarHBondContact OD1-N 3Å; D318-S320 PolarHBondContact OD1-OG 3.12Å; D318-L321 HydrophobicContact CB-CB 3.98Å; D318-L321 PolarHBondContact O-N 2.8Å; D318-L321 PolarHBondContact OD1-N 3.32Å; D318-L321 VanDerWaalsContact OD1-N 3.13Å; D318-L322 PolarHBondContact O-N 2.9Å
319	R	94.3	Very high	94.4	Very high	92 Å²	92	52 Å²	52	35%	0.347	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-24.8	178.3	-62.1	-166.8	176.9	-168.7	-7.7	113.1	E311 I317 R323 D380 T384 Y385	E311-R319 IonicContact OE1-CZ 3.81Å; E311-R319 IonicContact OE1-NE 3.29Å; E311-R319 PolarHBondContact OE1-NE 3.26Å; E311-R319 IonicContact OE1-NH2 3.12Å; E311-R319 PolarHBondContact OE1-NH2 2.92Å; I317-R319 HydrophobicContact CG1-CG 4.34Å; I317-R319 PolarHBondContact O-N 3Å; I317-R319 VanDerWaalsContact O-N 3.08Å; R319-R323 WeakPolarHBondContact O-CB 3.2Å; R319-R323 PolarHBondContact O-N 2.8Å; R319-D380 IonicContact CZ-OD2 3.9Å; R319-D380 IonicContact NH1-OD2 2.8Å; R319-D380 PolarHBondContact NH1-OD2 2.97Å; R319-D380 IonicContact NH2-OD2 3.14Å; R319-T384 HydrophobicContact CB-CG2 4.18Å; R319-Y385 HydrophobicContact CB-CD1 4.37Å; R319-Y385 HydrophobicContact CG-CD1 4.42Å; R319-Y385 HydrophobicContact CG-CE1 4.41Å
320	S	95.3	Very high	94.4	Very high	83 Å²	83	50.3 Å²	50.3	58%	0.58	29%	0.288	S	S	*	.	H	α-helix	trans	-73.1	-39.2	179.4	74.8	0	0	0	0	111.6	D318 R323 S324	D318-S320 PolarHBondContact O-N 3.38Å; D318-S320 WeakPolarHBondContact OD1-CB 3.44Å; D318-S320 PolarHBondContact OD1-N 3Å; D318-S320 PolarHBondContact OD1-OG 3.12Å; S320-R323 PolarHBondContact O-N 3.16Å; S320-S324 WeakPolarHBondContact O-CB 3.23Å; S320-S324 PolarHBondContact O-N 3.48Å
321	L	95.6	Very high	94.4	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-47.6	172.9	177.9	62.3	0	0	0	111.3	L240 K241 D244 D318 S324 L325	L240-L321 HydrophobicContact CB-CD2 4.2Å; K241-L321 HydrophobicContact CG-CD1 4.29Å; K241-L321 HydrophobicContact CG-CD2 3.72Å; D244-L321 HydrophobicContact CB-CD1 3.42Å; D244-L321 VanDerWaalsContact CB-CD1 3.42Å; D318-L321 HydrophobicContact CB-CB 3.98Å; D318-L321 PolarHBondContact O-N 2.8Å; D318-L321 PolarHBondContact OD1-N 3.32Å; D318-L321 VanDerWaalsContact OD1-N 3.13Å; L321-S324 PolarHBondContact O-N 2.8Å; L321-L325 HydrophobicContact CD1-CD1 3.8Å; L321-L325 HydrophobicContact CD1-CG 4.19Å; L321-L325 HydrophobicContact CG-CD1 3.88Å; L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 WeakPolarHBondContact O-CG 3.29Å; L321-L325 PolarHBondContact O-N 3.28Å
322	L	96.4	Very high	94.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-45.7	176.9	-76.3	-170	0	0	0	112.3	I304 L307 I308 I317 D318 S324 L325 L326 Y385	I304-L322 HydrophobicContact CB-CD2 4.27Å; I304-L322 HydrophobicContact CG1-CD2 4.12Å; I304-L322 HydrophobicContact CG2-CD2 3.93Å; L307-L322 HydrophobicContact CB-CD1 4.29Å; L307-L322 HydrophobicContact CB-CD2 4.17Å; L307-L322 HydrophobicContact CD1-CD2 3.83Å; L307-L322 HydrophobicContact CD1-CG 4.27Å; I308-L322 HydrophobicContact CG1-CD1 3.98Å; I317-L322 HydrophobicContact CD1-CD1 3.38Å; I317-L322 HydrophobicContact CD1-CG 4.33Å; D318-L322 PolarHBondContact O-N 2.9Å; L322-S324 VanDerWaalsContact C-N 3.3Å; L322-S324 PolarHBondContact O-N 3.32Å; L322-L325 PolarHBondContact O-N 3.18Å; L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 WeakPolarHBondContact O-CG 3.27Å; L322-L326 PolarHBondContact O-N 3.3Å; L322-Y385 HydrophobicContact CB-CD1 4.36Å; L322-Y385 HydrophobicContact CB-CD2 4.34Å; L322-Y385 HydrophobicContact CB-CG 4.07Å; L322-Y385 HydrophobicContact CD1-CD1 4.3Å; L322-Y385 HydrophobicContact CD1-CD2 4.25Å; L322-Y385 HydrophobicContact CD1-CE1 4.05Å; L322-Y385 HydrophobicContact CD1-CE2 4Å; L322-Y385 HydrophobicContact CD1-CG 4.4Å
323	R	96.6	Very high	94.3	Very high	138 Å²	138	55.9 Å²	55.9	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-57.6	-45.1	177	-177.7	-176	-67.4	-167.6	-3.3	111.3	R319 S320 S327 T384	R319-R323 WeakPolarHBondContact O-CB 3.2Å; R319-R323 PolarHBondContact O-N 2.8Å; S320-R323 PolarHBondContact O-N 3.16Å; R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 2.95Å; R323-T384 PolarHBondContact NE-O 3Å; R323-T384 PolarHBondContact NH2-O 3.38Å
324	S	96.4	Very high	94.4	Very high	26 Å²	26	51.1 Å²	51.1	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-47	179.9	-173	0	0	0	0	111.9	D244 S320 L321 L322 S327 M328	D244-S324 WeakPolarHBondContact OD1-CB 3.28Å; D244-S324 PolarHBondContact OD1-OG 3.13Å; S320-S324 WeakPolarHBondContact O-CB 3.23Å; S320-S324 PolarHBondContact O-N 3.48Å; L321-S324 PolarHBondContact O-N 2.8Å; L322-S324 VanDerWaalsContact C-N 3.3Å; L322-S324 PolarHBondContact O-N 3.32Å; S324-S327 PolarHBondContact O-N 3.25Å; S324-M328 WeakPolarHBondContact O-CB 3.35Å; S324-M328 PolarHBondContact O-N 2.9Å
325	L	96.2	Very high	94.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-41.2	179.5	-72	168.4	0	0	0	112.9	L240 I243 D244 I304 L321 L322 M328 L329	L240-L325 HydrophobicContact CB-CD1 3.89Å; L240-L325 HydrophobicContact CD1-CD1 4.35Å; L240-L325 HydrophobicContact CD2-CD1 3.97Å; L240-L325 HydrophobicContact CG-CD1 4.27Å; I243-L325 HydrophobicContact CB-CD2 4.32Å; I243-L325 HydrophobicContact CG2-CD2 3.76Å; D244-L325 HydrophobicContact CB-CD2 3.93Å; D244-L325 HydrophobicContact CB-CG 4.18Å; I304-L325 HydrophobicContact CD1-CB 4.13Å; I304-L325 HydrophobicContact CG1-CD1 4.42Å; L321-L325 HydrophobicContact CD1-CD1 3.8Å; L321-L325 HydrophobicContact CD1-CG 4.19Å; L321-L325 HydrophobicContact CG-CD1 3.88Å; L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 WeakPolarHBondContact O-CG 3.29Å; L321-L325 PolarHBondContact O-N 3.28Å; L322-L325 PolarHBondContact O-N 3.18Å; L325-M328 HydrophobicContact CD2-CE 4.02Å; L325-M328 VanDerWaalsContact O-CB 3.32Å; L325-M328 WeakPolarHBondContact O-CB 3.4Å; L325-M328 PolarHBondContact O-N 3.49Å; L325-L329 WeakPolarHBondContact O-CG 3.23Å; L325-L329 PolarHBondContact O-N 3.17Å
326	L	96.3	Very high	94.5	Very high	4 Å²	4	49 Å²	49	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-36.2	177.1	-68.9	173.9	0	0	0	111.6	I304 L322 M328 L329 S330 Y335 F339 Y385 L386	I304-L326 HydrophobicContact CD1-CD2 4.19Å; I304-L326 HydrophobicContact CG2-CD2 4.01Å; I304-L326 HydrophobicContact CG2-CG 4.48Å; L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 WeakPolarHBondContact O-CG 3.27Å; L322-L326 PolarHBondContact O-N 3.3Å; L326-M328 VanDerWaalsContact C-N 3.32Å; L326-L329 HydrophobicContact CD2-CD1 4.15Å; L326-L329 PolarHBondContact O-N 2.9Å; L326-S330 PolarHBondContact O-N 3.38Å; L326-Y335 HydrophobicContact CB-CE2 4.39Å; L326-Y335 HydrophobicContact CD2-CD2 4.22Å; L326-Y335 HydrophobicContact CD2-CE2 3.93Å; L326-F339 HydrophobicContact CD2-CD1 3.83Å; L326-F339 HydrophobicContact CD2-CD2 4.23Å; L326-F339 HydrophobicContact CD2-CE1 3.66Å; L326-F339 HydrophobicContact CD2-CE2 4.1Å; L326-F339 HydrophobicContact CD2-CG 4.11Å; L326-F339 HydrophobicContact CD2-CZ 3.81Å; L326-Y385 HydrophobicContact CD1-CD2 3.7Å; L326-Y385 HydrophobicContact CD1-CG 4.49Å; L326-Y385 WeakPolarHBondContact CD1-O 3.32Å; L326-L386 HydrophobicContact CD1-CD2 3.97Å
327	S	95.6	Very high	94.4	Very high	59 Å²	59	49.8 Å²	49.8	41%	0.413	26%	0.256	S	S	.	.	H	α-helix	trans	-60.3	-43	169.1	-170.2	0	0	0	0	111	R323 S324 L329 S330 D331	R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 2.95Å; S324-S327 PolarHBondContact O-N 3.25Å; S327-L329 PolarHBondContact O-N 3.4Å; S327-S330 WeakPolarHBondContact O-CB 3.49Å; S327-S330 PolarHBondContact O-N 3.22Å; S327-D331 WeakPolarHBondContact O-CB 3.48Å; S327-D331 PolarHBondContact O-N 2.99Å
328	M	95.4	Very high	94.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-48.5	173.1	174.4	-167.7	74.4	0	0	111.3	I243 W247 F286 I291 S324 L325 L326 S330 D331 L332	I243-M328 HydrophobicContact CG2-CE 3.93Å; I243-M328 HydrophobicContact CG2-SD 4.16Å; W247-M328 HydrophobicContact CB-CG 4.42Å; W247-M328 HydrophobicContact CB-SD 3.71Å; W247-M328 HydrophobicContact CD2-CB 4.02Å; W247-M328 HydrophobicContact CD2-CG 3.47Å; W247-M328 VanDerWaalsContact CD2-CG 3.47Å; W247-M328 HydrophobicContact CD2-SD 3.88Å; W247-M328 HydrophobicContact CE3-CG 3.89Å; W247-M328 HydrophobicContact CE3-SD 4.21Å; W247-M328 HydrophobicContact CG-CB 4.02Å; W247-M328 HydrophobicContact CG-CG 3.71Å; W247-M328 HydrophobicContact CG-SD 3.66Å; W247-M328 HydrophobicContact CH2-CG 4.23Å; W247-M328 HydrophobicContact CZ2-CB 4.12Å; W247-M328 HydrophobicContact CZ2-CG 3.92Å; W247-M328 HydrophobicContact CZ3-CG 4.26Å; F286-M328 HydrophobicContact CE1-SD 3.88Å; F286-M328 HydrophobicContact CZ-SD 4.43Å; I291-M328 HydrophobicContact CD1-CE 3.74Å; I291-M328 HydrophobicContact CD1-SD 4.24Å; I291-M328 HydrophobicContact CG1-CE 4.35Å; S324-M328 WeakPolarHBondContact O-CB 3.35Å; S324-M328 PolarHBondContact O-N 2.9Å; L325-M328 HydrophobicContact CD2-CE 4.02Å; L325-M328 VanDerWaalsContact O-CB 3.32Å; L325-M328 WeakPolarHBondContact O-CB 3.4Å; L325-M328 PolarHBondContact O-N 3.49Å; L326-M328 VanDerWaalsContact C-N 3.32Å; M328-S330 PolarHBondContact O-N 3.13Å; M328-D331 PolarHBondContact O-N 2.94Å; M328-L332 HydrophobicContact CG-CD1 3.66Å; M328-L332 HydrophobicContact CG-CG 4.27Å; M328-L332 WeakPolarHBondContact O-CB 3.41Å; M328-L332 WeakPolarHBondContact O-CG 3.32Å; M328-L332 PolarHBondContact O-N 3.34Å; M328-L332 HydrophobicContact SD-CD1 4.38Å
329	L	94.8	Very high	94.3	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-32.9	178.4	-63.1	-176.7	0	0	0	112.4	I291 I301 I304 L325 L326 S327 Q333 I334 Y335 F339	I291-L329 HydrophobicContact CG2-CD2 4.33Å; I301-L329 HydrophobicContact CD1-CD1 3.64Å; I304-L329 HydrophobicContact CD1-CD1 4.04Å; L325-L329 WeakPolarHBondContact O-CG 3.23Å; L325-L329 PolarHBondContact O-N 3.17Å; L326-L329 HydrophobicContact CD2-CD1 4.15Å; L326-L329 PolarHBondContact O-N 2.9Å; S327-L329 PolarHBondContact O-N 3.4Å; L329-Q333 PolarHBondContact O-N 3.08Å; L329-I334 HydrophobicContact CB-CG1 4.13Å; L329-I334 HydrophobicContact CD2-CD1 3.45Å; L329-I334 VanDerWaalsContact CD2-CD1 3.45Å; L329-I334 HydrophobicContact CD2-CG1 3.88Å; L329-I334 VanDerWaalsContact O-CG1 3.31Å; L329-I334 WeakPolarHBondContact O-CG1 3.42Å; L329-I334 PolarHBondContact O-N 3.49Å; L329-Y335 HydrophobicContact CB-CD2 4.44Å; L329-Y335 PolarHBondContact O-N 2.58Å; L329-Y335 VanDerWaalsContact O-N 3.08Å; L329-F339 HydrophobicContact CD1-CB 4.02Å; L329-F339 HydrophobicContact CD1-CG 4.41Å
330	S	94.8	Very high	94.4	Very high	48 Å²	48	43.2 Å²	43.2	34%	0.336	23%	0.23	S	C	.	.	H	α-helix	trans	-70.9	-48.5	175.2	-167	0	0	0	0	111.5	L326 S327 M328 L332 Q333	L326-S330 PolarHBondContact O-N 3.38Å; S327-S330 WeakPolarHBondContact O-CB 3.49Å; S327-S330 PolarHBondContact O-N 3.22Å; M328-S330 PolarHBondContact O-N 3.13Å; S330-L332 PolarHBondContact O-N 2.99Å; S330-Q333 WeakPolarHBondContact O-CA 3.47Å; S330-Q333 PolarHBondContact O-N 3.2Å
331	D	93.1	Very high	94.3	Very high	80 Å²	80	44.8 Å²	44.8	43%	0.428	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-34.7	176.8	-69.1	-28.9	0	0	0	112	W247 S327 M328 Q333	W247-D331 HydrophobicContact CH2-CB 4.45Å; W247-D331 HydrophobicContact CZ2-CB 4.12Å; S327-D331 WeakPolarHBondContact O-CB 3.48Å; S327-D331 PolarHBondContact O-N 2.99Å; M328-D331 PolarHBondContact O-N 2.94Å; D331-Q333 VanDerWaalsContact C-N 3.3Å
332	L	93.4	Very high	94.3	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.3	175.8	-62.8	175.6	0	0	0	113.6	W247 L283 F286 R287 I291 M328 S330 I334	W247-L332 HydrophobicContact CH2-CD2 3.79Å; W247-L332 HydrophobicContact CH2-CG 4.03Å; W247-L332 HydrophobicContact CZ3-CD1 4.35Å; W247-L332 HydrophobicContact CZ3-CD2 3.82Å; W247-L332 HydrophobicContact CZ3-CG 4.23Å; L283-L332 HydrophobicContact CB-CD2 4.18Å; L283-L332 HydrophobicContact CD2-CD2 4.41Å; L283-L332 WeakPolarHBondContact O-CD2 3.33Å; F286-L332 HydrophobicContact CB-CD2 4.49Å; F286-L332 HydrophobicContact CD1-CD1 3.81Å; F286-L332 HydrophobicContact CD1-CD2 4.32Å; F286-L332 HydrophobicContact CE1-CD1 4.22Å; R287-L332 HydrophobicContact CB-CD2 4.08Å; R287-L332 WeakPolarHBondContact CD-O 3.4Å; R287-L332 PolarHBondContact NH1-O 3.49Å; I291-L332 HydrophobicContact CB-CD1 4.36Å; I291-L332 HydrophobicContact CG1-CD1 3.75Å; M328-L332 HydrophobicContact CG-CD1 3.66Å; M328-L332 HydrophobicContact CG-CG 4.27Å; M328-L332 WeakPolarHBondContact O-CB 3.41Å; M328-L332 WeakPolarHBondContact O-CG 3.32Å; M328-L332 PolarHBondContact O-N 3.34Å; M328-L332 HydrophobicContact SD-CD1 4.38Å; S330-L332 PolarHBondContact O-N 2.99Å; L332-I334 HydrophobicContact CB-CD1 4.09Å; L332-I334 HydrophobicContact CB-CG1 4Å; L332-I334 HydrophobicContact CD1-CD1 4.32Å; L332-I334 PolarHBondContact O-N 2.69Å
333	Q	92.7	Very high	94.3	Very high	152 Å²	152	49.8 Å²	49.8	71%	0.71	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	44.9	179.3	-54.1	175.5	-7.7	0	0	113.5	R287 L329 S330 D331	R287-Q333 PolarHBondContact NH1-O 2.82Å; R287-Q333 VanDerWaalsContact NH1-O 3.11Å; L329-Q333 PolarHBondContact O-N 3.08Å; S330-Q333 WeakPolarHBondContact O-CA 3.47Å; S330-Q333 PolarHBondContact O-N 3.2Å; D331-Q333 VanDerWaalsContact C-N 3.3Å
334	I	92.8	Very high	94.3	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	23%	0.23	C	C	.	.			trans	-127.9	-4.9	177.8	54.3	175.7	0	0	0	112.8	R287 I291 L329 L332 Q336 S338	R287-I334 HydrophobicContact CG-CG2 4.35Å; I291-I334 HydrophobicContact CB-CD1 4.1Å; I291-I334 HydrophobicContact CG2-CD1 3.17Å; L329-I334 HydrophobicContact CB-CG1 4.13Å; L329-I334 HydrophobicContact CD2-CD1 3.45Å; L329-I334 VanDerWaalsContact CD2-CD1 3.45Å; L329-I334 HydrophobicContact CD2-CG1 3.88Å; L329-I334 VanDerWaalsContact O-CG1 3.31Å; L329-I334 WeakPolarHBondContact O-CG1 3.42Å; L329-I334 PolarHBondContact O-N 3.49Å; L332-I334 HydrophobicContact CB-CD1 4.09Å; L332-I334 HydrophobicContact CB-CG1 4Å; L332-I334 HydrophobicContact CD1-CD1 4.32Å; L332-I334 PolarHBondContact O-N 2.69Å; I334-Q336 PolarHBondContact O-N 3.25Å; I334-S338 VanDerWaalsContact O-CB 3.31Å; I334-S338 WeakPolarHBondContact O-CB 3.4Å; I334-S338 PolarHBondContact O-N 2.96Å
335	Y	94.4	Very high	94.3	Very high	7 Å²	7	48.5 Å²	48.5	3%	0.027	25%	0.245	C	C	.	.	I	π-helix	trans	-54.5	-52.8	179.6	179	-82.9	0	0	0	112.2	L326 L329 F339 E340 D387 T390	L326-Y335 HydrophobicContact CB-CE2 4.39Å; L326-Y335 HydrophobicContact CD2-CD2 4.22Å; L326-Y335 HydrophobicContact CD2-CE2 3.93Å; L329-Y335 HydrophobicContact CB-CD2 4.44Å; L329-Y335 PolarHBondContact O-N 2.58Å; L329-Y335 VanDerWaalsContact O-N 3.08Å; Y335-F339 AromaticContact CD2-CD1 3.89Å; Y335-F339 HydrophobicContact CD2-CD1 3.89Å; Y335-F339 HydrophobicContact CE1-CD1 4.35Å; Y335-F339 AromaticContact CE2-CD1 3.49Å; Y335-F339 HydrophobicContact CE2-CD1 3.49Å; Y335-F339 VanDerWaalsContact CE2-CD1 3.49Å; Y335-F339 AromaticContact CE2-CE1 3.78Å; Y335-F339 HydrophobicContact CE2-CE1 3.78Å; Y335-F339 HydrophobicContact CG-CD1 4.47Å; Y335-F339 AromaticContact CZ-CD1 3.74Å; Y335-F339 AromaticContact CZ-CE1 3.92Å; Y335-F339 WeakPolarHBondContact O-CA 3.3Å; Y335-F339 WeakPolarHBondContact O-CB 3.42Å; Y335-F339 PolarHBondContact O-N 2.93Å; Y335-E340 HydrophobicContact CD1-CB 4.25Å; Y335-E340 HydrophobicContact CE1-CB 3.98Å; Y335-E340 HydrophobicContact CE1-CG 4.37Å; Y335-E340 PolarHBondContact O-N 3.39Å; Y335-D387 HydrophobicContact CD1-CB 4.13Å; Y335-D387 HydrophobicContact CE1-CB 3.54Å; Y335-D387 HydrophobicContact CE2-CB 3.95Å; Y335-D387 VanDerWaalsContact CZ-CB 3.44Å; Y335-D387 PolarHBondContact OH-N 3.31Å; Y335-D387 VanDerWaalsContact OH-N 3.12Å; Y335-T390 VanDerWaalsContact CE1-OG1 3.27Å; Y335-T390 WeakPolarHBondContact CE1-OG1 3.46Å; Y335-T390 PolarHBondContact OH-OG1 3.21Å
336	Q	91.2	Very high	94.2	Very high	120 Å²	120	51.7 Å²	51.7	56%	0.561	26%	0.259	S	S	*	.	I	π-helix	trans	-65.7	-47.2	-175.7	-64	-165.8	-16.6	0	0	111.9	I334 E340	I334-Q336 PolarHBondContact O-N 3.25Å; Q336-E340 WeakPolarHBondContact CG-OE2 3.26Å
337	D	89.1	Confident	94.2	Very high	123 Å²	123	51.5 Å²	51.5	66%	0.658	26%	0.258	S	S	*	.	I	π-helix	trans	-75.1	-39.5	-173.7	-61.4	-28.9	0	0	0	113.3
338	S	90.5	Very high	94.3	Very high	28 Å²	28	51.2 Å²	51.2	20%	0.196	25%	0.252	C	S	.	.	I	π-helix	trans	-102.8	-29.3	-169.8	-54.1	0	0	0	0	113.9	Q297 I334	Q297-S338 PolarHBondContact NE2-OG 3.42Å; I334-S338 VanDerWaalsContact O-CB 3.31Å; I334-S338 WeakPolarHBondContact O-CB 3.4Å; I334-S338 PolarHBondContact O-N 2.96Å
339	F	95.4	Very high	94.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.28	C	S	.	.	I	π-helix	trans	-106.7	-56.1	-177.2	173.6	-104.5	0	0	0	112.4	I301 I304 L305 I308 L326 L329 Y335 Q341 R342 F343 L386	I301-F339 HydrophobicContact CD1-CB 3.83Å; I301-F339 HydrophobicContact CD1-CD2 4.2Å; I301-F339 HydrophobicContact CD1-CG 4.48Å; I301-F339 HydrophobicContact CG2-CD2 4.34Å; I304-F339 HydrophobicContact CB-CE2 4.33Å; I304-F339 HydrophobicContact CG2-CD2 4.17Å; I304-F339 HydrophobicContact CG2-CE2 3.43Å; I304-F339 VanDerWaalsContact CG2-CE2 3.43Å; I304-F339 HydrophobicContact CG2-CZ 3.98Å; L305-F339 HydrophobicContact CD2-CD2 4.43Å; L305-F339 HydrophobicContact CD2-CE2 3.72Å; L305-F339 HydrophobicContact CD2-CZ 4.41Å; L305-F339 HydrophobicContact CG-CE2 4.27Å; I308-F339 HydrophobicContact CD1-CE2 4.4Å; I308-F339 HydrophobicContact CD1-CZ 3.94Å; L326-F339 HydrophobicContact CD2-CD1 3.83Å; L326-F339 HydrophobicContact CD2-CD2 4.23Å; L326-F339 HydrophobicContact CD2-CE1 3.66Å; L326-F339 HydrophobicContact CD2-CE2 4.1Å; L326-F339 HydrophobicContact CD2-CG 4.11Å; L326-F339 HydrophobicContact CD2-CZ 3.81Å; L329-F339 HydrophobicContact CD1-CB 4.02Å; L329-F339 HydrophobicContact CD1-CG 4.41Å; Y335-F339 AromaticContact CD2-CD1 3.89Å; Y335-F339 HydrophobicContact CD2-CD1 3.89Å; Y335-F339 HydrophobicContact CE1-CD1 4.35Å; Y335-F339 AromaticContact CE2-CD1 3.49Å; Y335-F339 HydrophobicContact CE2-CD1 3.49Å; Y335-F339 VanDerWaalsContact CE2-CD1 3.49Å; Y335-F339 AromaticContact CE2-CE1 3.78Å; Y335-F339 HydrophobicContact CE2-CE1 3.78Å; Y335-F339 HydrophobicContact CG-CD1 4.47Å; Y335-F339 AromaticContact CZ-CD1 3.74Å; Y335-F339 AromaticContact CZ-CE1 3.92Å; Y335-F339 WeakPolarHBondContact O-CA 3.3Å; Y335-F339 WeakPolarHBondContact O-CB 3.42Å; Y335-F339 PolarHBondContact O-N 2.93Å; F339-Q341 PolarHBondContact O-N 3.48Å; F339-R342 PolarHBondContact O-N 3.47Å; F339-F343 HydrophobicContact CD1-CB 4.41Å; F339-F343 HydrophobicContact CD2-CB 4.5Å; F339-F343 HydrophobicContact CE1-CB 3.98Å; F339-F343 HydrophobicContact CE1-CG 4.11Å; F339-F343 HydrophobicContact CE2-CB 4.06Å; F339-F343 HydrophobicContact CZ-CB 3.79Å; F339-F343 AromaticContact CZ-CD2 3.94Å; F339-F343 HydrophobicContact CZ-CD2 3.94Å; F339-F343 AromaticContact CZ-CG 3.88Å; F339-F343 HydrophobicContact CZ-CG 3.88Å; F339-F343 WeakPolarHBondContact O-CB 3.45Å; F339-F343 PolarHBondContact O-N 3.2Å; F339-L386 HydrophobicContact CE1-CD2 4.03Å; F339-L386 HydrophobicContact CZ-CD2 4.18Å
340	E	95.4	Very high	94.3	Very high	22 Å²	22	60.2 Å²	60.2	10%	0.103	29%	0.288	C	S	.	.	I	π-helix	trans	-59.4	-44.3	-167.3	-176.2	170.3	-141.4	0	0	112.4	Y335 Q336 F343 L344 T390	Y335-E340 HydrophobicContact CD1-CB 4.25Å; Y335-E340 HydrophobicContact CE1-CB 3.98Å; Y335-E340 HydrophobicContact CE1-CG 4.37Å; Y335-E340 PolarHBondContact O-N 3.39Å; Q336-E340 WeakPolarHBondContact CG-OE2 3.26Å; E340-F343 PolarHBondContact O-N 2.93Å; E340-L344 HydrophobicContact CG-CD1 4.02Å; E340-L344 HydrophobicContact CG-CG 4.42Å; E340-L344 WeakPolarHBondContact O-CB 3.36Å; E340-L344 VanDerWaalsContact O-CG 3.28Å; E340-L344 WeakPolarHBondContact O-CG 3.4Å; E340-L344 PolarHBondContact O-N 2.9Å; E340-T390 HydrophobicContact CG-CG2 4.37Å; E340-T390 WeakPolarHBondContact OE1-CA 3.44Å; E340-T390 VanDerWaalsContact OE1-CB 3.32Å; E340-T390 WeakPolarHBondContact OE1-CB 3.49Å; E340-T390 PolarHBondContact OE1-OG1 3.01Å
341	Q	93.9	Very high	94.4	Very high	117 Å²	117	57.9 Å²	57.9	55%	0.547	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-50.8	177.6	-173.7	-178.5	-16.8	0	0	111.9	F339 F343 L344 E345	F339-Q341 PolarHBondContact O-N 3.48Å; Q341-F343 VanDerWaalsContact C-N 3.32Å; Q341-F343 PolarHBondContact O-N 2.85Å; Q341-L344 PolarHBondContact O-N 2.96Å; Q341-E345 WeakPolarHBondContact CG-OE1 3.33Å; Q341-E345 PolarHBondContact NE2-OE1 3.12Å; Q341-E345 WeakPolarHBondContact O-CG 3.4Å; Q341-E345 PolarHBondContact O-N 3.34Å
342	R	95.3	Very high	94.5	Very high	108 Å²	108	55 Å²	55	41%	0.408	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-39.6	177	-91.6	-157.2	-179.9	171.2	6.5	112.3	D302 L305 F339 L344 E345 E346	D302-R342 IonicContact OD1-NH1 3.55Å; D302-R342 PolarHBondContact OD1-NH1 3.26Å; D302-R342 IonicContact OD2-NH1 2.83Å; L305-R342 HydrophobicContact CD1-CB 4.21Å; F339-R342 PolarHBondContact O-N 3.47Å; R342-L344 VanDerWaalsContact C-N 3.34Å; R342-L344 PolarHBondContact O-N 3.44Å; R342-E345 PolarHBondContact O-N 3.06Å; R342-E346 WeakPolarHBondContact O-CB 3.36Å; R342-E346 WeakPolarHBondContact O-CG 3.16Å; R342-E346 PolarHBondContact O-N 2.9Å
343	F	97.1	Very high	94.7	Very high	1 Å²	1	57.6 Å²	57.6	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-44.7	176.9	168.6	-106.8	0	0	0	111.6	L305 I308 F339 E340 Q341 T347 L386 T390 L394	L305-F343 HydrophobicContact CD2-CB 3.84Å; L305-F343 HydrophobicContact CD2-CD2 3.89Å; L305-F343 HydrophobicContact CD2-CG 4.38Å; I308-F343 HydrophobicContact CD1-CD2 4.19Å; I308-F343 HydrophobicContact CD1-CE2 4.12Å; I308-F343 HydrophobicContact CG2-CE2 4.16Å; F339-F343 HydrophobicContact CD1-CB 4.41Å; F339-F343 HydrophobicContact CD2-CB 4.5Å; F339-F343 HydrophobicContact CE1-CB 3.98Å; F339-F343 HydrophobicContact CE1-CG 4.11Å; F339-F343 HydrophobicContact CE2-CB 4.06Å; F339-F343 HydrophobicContact CZ-CB 3.79Å; F339-F343 AromaticContact CZ-CD2 3.94Å; F339-F343 HydrophobicContact CZ-CD2 3.94Å; F339-F343 AromaticContact CZ-CG 3.88Å; F339-F343 HydrophobicContact CZ-CG 3.88Å; F339-F343 WeakPolarHBondContact O-CB 3.45Å; F339-F343 PolarHBondContact O-N 3.2Å; E340-F343 PolarHBondContact O-N 2.93Å; Q341-F343 VanDerWaalsContact C-N 3.32Å; Q341-F343 PolarHBondContact O-N 2.85Å; F343-T347 WeakPolarHBondContact O-CB 3.29Å; F343-T347 PolarHBondContact O-N 2.77Å; F343-T347 PolarHBondContact O-OG1 3.38Å; F343-L386 HydrophobicContact CE1-CD1 4.2Å; F343-L386 HydrophobicContact CZ-CD1 3.91Å; F343-L386 HydrophobicContact CZ-CD2 4.4Å; F343-T390 HydrophobicContact CD1-CG2 3.89Å; F343-T390 HydrophobicContact CE1-CG2 3.68Å; F343-L394 HydrophobicContact CE1-CD1 3.92Å; F343-L394 HydrophobicContact CE1-CD2 4.17Å; F343-L394 HydrophobicContact CE1-CG 4.46Å; F343-L394 HydrophobicContact CZ-CD1 3.94Å; F343-L394 HydrophobicContact CZ-CD2 4.16Å
344	L	96.6	Very high	94.8	Very high	33 Å²	33	51 Å²	51	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-39	177.7	-67.7	173.3	0	0	0	111.9	E340 Q341 R342 T347 N348 P393 L394	E340-L344 HydrophobicContact CG-CD1 4.02Å; E340-L344 HydrophobicContact CG-CG 4.42Å; E340-L344 WeakPolarHBondContact O-CB 3.36Å; E340-L344 VanDerWaalsContact O-CG 3.28Å; E340-L344 WeakPolarHBondContact O-CG 3.4Å; E340-L344 PolarHBondContact O-N 2.9Å; Q341-L344 PolarHBondContact O-N 2.96Å; R342-L344 VanDerWaalsContact C-N 3.34Å; R342-L344 PolarHBondContact O-N 3.44Å; L344-T347 PolarHBondContact O-N 2.76Å; L344-N348 WeakPolarHBondContact O-CB 3.29Å; L344-N348 PolarHBondContact O-N 3.06Å; L344-P393 HydrophobicContact CD1-CB 3.67Å; L344-P393 HydrophobicContact CD2-CB 4.07Å; L344-L394 HydrophobicContact CD2-CB 4.3Å
345	E	95.7	Very high	94.9	Very high	105 Å²	105	50.7 Å²	50.7	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-48.4	175.3	-74.5	171.9	-171.7	0	0	111.8	Q341 R342 N348 R349	Q341-E345 WeakPolarHBondContact CG-OE1 3.33Å; Q341-E345 PolarHBondContact NE2-OE1 3.12Å; Q341-E345 WeakPolarHBondContact O-CG 3.4Å; Q341-E345 PolarHBondContact O-N 3.34Å; R342-E345 PolarHBondContact O-N 3.06Å; E345-N348 WeakPolarHBondContact O-CB 3.42Å; E345-N348 PolarHBondContact O-N 3.09Å; E345-R349 PolarHBondContact O-N 3.36Å
346	E	95.1	Very high	94.9	Very high	66 Å²	66	56.1 Å²	56.1	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-40.5	177	-77	-60.8	144	0	0	112.2	L305 R342 N348 R349 L350	L305-E346 HydrophobicContact CD1-CG 4.34Å; R342-E346 WeakPolarHBondContact O-CB 3.36Å; R342-E346 WeakPolarHBondContact O-CG 3.16Å; R342-E346 PolarHBondContact O-N 2.9Å; E346-N348 VanDerWaalsContact C-N 3.34Å; E346-N348 PolarHBondContact O-N 2.78Å; E346-R349 VanDerWaalsContact CD-NH2 3.33Å; E346-R349 PolarHBondContact O-N 3.14Å; E346-R349 IonicContact OE1-CZ 3.21Å; E346-R349 IonicContact OE1-NE 3.29Å; E346-R349 IonicContact OE1-NH1 2.9Å; E346-R349 IonicContact OE1-NH2 3.34Å; E346-R349 PolarHBondContact OE1-NH2 3.27Å; E346-R349 IonicContact OE2-CZ 3.92Å; E346-R349 IonicContact OE2-NE 2.61Å; E346-R349 PolarHBondContact OE2-NE 2.86Å; E346-R349 IonicContact OE2-NH2 3.12Å; E346-R349 PolarHBondContact OE2-NH2 2.89Å; E346-L350 WeakPolarHBondContact O-CB 3.35Å; E346-L350 PolarHBondContact O-N 3.38Å
347	T	96.2	Very high	95.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-39.8	175.8	-61.9	0	0	0	0	112	R312 F343 L344 L350 Y351 L394	R312-T347 PolarHBondContact NH1-OG1 3.1Å; R312-T347 PolarHBondContact NH2-OG1 2.6Å; F343-T347 WeakPolarHBondContact O-CB 3.29Å; F343-T347 PolarHBondContact O-N 2.77Å; F343-T347 PolarHBondContact O-OG1 3.38Å; L344-T347 PolarHBondContact O-N 2.76Å; T347-L350 PolarHBondContact O-N 3.48Å; T347-Y351 HydrophobicContact CG2-CD2 3.48Å; T347-Y351 VanDerWaalsContact CG2-CD2 3.48Å; T347-Y351 HydrophobicContact CG2-CE2 3.54Å; T347-Y351 WeakPolarHBondContact O-CD2 3.18Å; T347-Y351 PolarHBondContact O-N 3.38Å; T347-L394 HydrophobicContact CG2-CD1 3.68Å
348	N	96.3	Very high	95.4	Very high	54 Å²	54	50.7 Å²	50.7	29%	0.289	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-47.8	175.7	-171.3	-50.3	0	0	0	110.8	L344 E345 E346 L350 A352 T397 Q401	L344-N348 WeakPolarHBondContact O-CB 3.29Å; L344-N348 PolarHBondContact O-N 3.06Å; E345-N348 WeakPolarHBondContact O-CB 3.42Å; E345-N348 PolarHBondContact O-N 3.09Å; E346-N348 VanDerWaalsContact C-N 3.34Å; E346-N348 PolarHBondContact O-N 2.78Å; N348-L350 PolarHBondContact O-N 2.98Å; N348-A352 WeakPolarHBondContact O-CB 3.43Å; N348-A352 PolarHBondContact O-N 2.99Å; N348-T397 HydrophobicContact CB-CG2 3.72Å; N348-Q401 PolarHBondContact OD1-NE2 3.2Å
349	R	96.1	Very high	95.6	Very high	155 Å²	155	50.3 Å²	50.3	59%	0.585	24%	0.236	S	C	*	.	H	α-helix	trans	-60.5	-46.1	177.8	-173.4	179.1	71.8	172.8	5.9	112.2	E345 E346 A353	E345-R349 PolarHBondContact O-N 3.36Å; E346-R349 VanDerWaalsContact CD-NH2 3.33Å; E346-R349 PolarHBondContact O-N 3.14Å; E346-R349 IonicContact OE1-CZ 3.21Å; E346-R349 IonicContact OE1-NE 3.29Å; E346-R349 IonicContact OE1-NH1 2.9Å; E346-R349 IonicContact OE1-NH2 3.34Å; E346-R349 PolarHBondContact OE1-NH2 3.27Å; E346-R349 IonicContact OE2-CZ 3.92Å; E346-R349 IonicContact OE2-NE 2.61Å; E346-R349 PolarHBondContact OE2-NE 2.86Å; E346-R349 IonicContact OE2-NH2 3.12Å; E346-R349 PolarHBondContact OE2-NH2 2.89Å; R349-A353 PolarHBondContact O-N 3.36Å
350	L	95.5	Very high	95.5	Very high	35 Å²	35	58 Å²	58	18%	0.183	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-53	-180	-176.1	154.2	0	0	0	111.2	E309 E346 T347 N348 A352 A353 E354	E309-L350 HydrophobicContact CG-CD1 4.33Å; E346-L350 WeakPolarHBondContact O-CB 3.35Å; E346-L350 PolarHBondContact O-N 3.38Å; T347-L350 PolarHBondContact O-N 3.48Å; N348-L350 PolarHBondContact O-N 2.98Å; L350-A352 VanDerWaalsContact C-N 3.34Å; L350-A352 PolarHBondContact O-N 2.77Å; L350-A353 PolarHBondContact O-N 2.99Å; L350-E354 WeakPolarHBondContact CD2-OE2 3.14Å; L350-E354 WeakPolarHBondContact O-CB 3.46Å; L350-E354 PolarHBondContact O-N 3.2Å
351	Y	97	Very high	95.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-72.5	-25.7	-177.3	-73.5	-52.6	0	0	0	113.4	T347 E354 G355 R374 E378 M398 L402	T347-Y351 HydrophobicContact CG2-CD2 3.48Å; T347-Y351 VanDerWaalsContact CG2-CD2 3.48Å; T347-Y351 HydrophobicContact CG2-CE2 3.54Å; T347-Y351 WeakPolarHBondContact O-CD2 3.18Å; T347-Y351 PolarHBondContact O-N 3.38Å; Y351-E354 VanDerWaalsContact CD1-OE2 3.3Å; Y351-E354 WeakPolarHBondContact CD1-OE2 3.35Å; Y351-E354 WeakPolarHBondContact CE1-OE2 3.31Å; Y351-G355 PolarHBondContact O-N 3.02Å; Y351-R374 HydrophobicContact CE1-CB 4.41Å; Y351-R374 HydrophobicContact CE1-CG 4.16Å; Y351-E378 HydrophobicContact CE2-CG 4.48Å; Y351-E378 WeakPolarHBondContact OH-CG 3.24Å; Y351-E378 PolarHBondContact OH-OE1 3.11Å; Y351-M398 HydrophobicContact CD2-CG 3.82Å; Y351-M398 HydrophobicContact CE1-CE 4.32Å; Y351-M398 HydrophobicContact CE2-CE 3.87Å; Y351-M398 HydrophobicContact CE2-CG 3.71Å; Y351-M398 HydrophobicContact CE2-SD 4.16Å; Y351-L402 HydrophobicContact CD1-CD1 3.88Å; Y351-L402 HydrophobicContact CD1-CD2 4.04Å; Y351-L402 HydrophobicContact CD1-CG 4.19Å; Y351-L402 HydrophobicContact CE1-CD1 4.25Å; Y351-L402 HydrophobicContact CG-CD1 4.35Å; Y351-L402 HydrophobicContact CG-CD2 4.47Å; Y351-L402 HydrophobicContact CG-CG 4.38Å
352	A	95.8	Very high	95.5	Very high	20 Å²	20	61.8 Å²	61.8	17%	0.165	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-46.1	170	0	0	0	0	0	111.5	N348 L350 Q356 Q401	N348-A352 WeakPolarHBondContact O-CB 3.43Å; N348-A352 PolarHBondContact O-N 2.99Å; L350-A352 VanDerWaalsContact C-N 3.34Å; L350-A352 PolarHBondContact O-N 2.77Å; A352-Q356 WeakPolarHBondContact O-CG 3.42Å; A352-Q356 PolarHBondContact O-N 3.45Å; A352-Q401 HydrophobicContact CB-CG 4.44Å
353	A	95.8	Very high	95.5	Very high	58 Å²	58	61.8 Å²	61.8	48%	0.479	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-42.5	176.8	0	0	0	0	0	111.9	R349 L350 Q356 R357	R349-A353 PolarHBondContact O-N 3.36Å; L350-A353 PolarHBondContact O-N 2.99Å; A353-Q356 PolarHBondContact O-N 3Å; A353-R357 WeakPolarHBondContact O-CB 3.45Å; A353-R357 PolarHBondContact O-N 2.93Å
354	E	95.4	Very high	95.4	Very high	13 Å²	13	61.8 Å²	61.8	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-42.1	178.4	-171.4	170.5	-173	0	0	111.8	L350 Y351 R357 L358 H370 R374	L350-E354 WeakPolarHBondContact CD2-OE2 3.14Å; L350-E354 WeakPolarHBondContact O-CB 3.46Å; L350-E354 PolarHBondContact O-N 3.2Å; Y351-E354 VanDerWaalsContact CD1-OE2 3.3Å; Y351-E354 WeakPolarHBondContact CD1-OE2 3.35Å; Y351-E354 WeakPolarHBondContact CE1-OE2 3.31Å; E354-R357 PolarHBondContact O-N 3.45Å; E354-L358 HydrophobicContact CG-CD1 3.61Å; E354-L358 HydrophobicContact CG-CG 4.15Å; E354-L358 WeakPolarHBondContact O-CB 3.36Å; E354-L358 WeakPolarHBondContact O-CG 3.31Å; E354-L358 PolarHBondContact O-N 3.08Å; E354-H370 IonicContact OE1-CD2 3.7Å; E354-H370 IonicContact OE1-CE1 2.78Å; E354-H370 PolarHBondContact OE1-CE1 3.4Å; E354-H370 VanDerWaalsContact OE1-CE1 3.23Å; E354-H370 IonicContact OE1-NE2 2.74Å; E354-H370 PolarHBondContact OE1-NE2 2.96Å; E354-R374 IonicContact OE1-CZ 3.73Å; E354-R374 IonicContact OE1-NE 2.89Å; E354-R374 PolarHBondContact OE1-NE 2.99Å; E354-R374 VanDerWaalsContact OE1-NE 3.1Å; E354-R374 IonicContact OE1-NH2 2.93Å; E354-R374 PolarHBondContact OE1-NH2 3.02Å; E354-R374 IonicContact OE2-NE 2.85Å; E354-R374 IonicContact OE2-NH2 2.94Å
355	G	94.8	Very high	95.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-50.8	176.4	0	0	0	0	0	112.2	Y351 M359	Y351-G355 PolarHBondContact O-N 3.02Å; G355-M359 VanDerWaalsContact O-CB 3.29Å; G355-M359 WeakPolarHBondContact O-CB 3.46Å; G355-M359 PolarHBondContact O-N 2.74Å; G355-M359 VanDerWaalsContact O-N 3.11Å
356	Q	94.6	Very high	95.4	Very high	120 Å²	120	61.2 Å²	61.2	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-61.9	-47.8	178.5	-70.4	175.7	8	0	0	112.4	A352 A353	A352-Q356 WeakPolarHBondContact O-CG 3.42Å; A352-Q356 PolarHBondContact O-N 3.45Å; A353-Q356 PolarHBondContact O-N 3Å
357	R	96.3	Very high	95.5	Very high	128 Å²	128	58.1 Å²	58.1	48%	0.483	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-53.1	-178.6	-178.4	-171.3	63.7	160.1	-2.7	111.5	A353 E354 M359 Q360 E361	A353-R357 WeakPolarHBondContact O-CB 3.45Å; A353-R357 PolarHBondContact O-N 2.93Å; E354-R357 PolarHBondContact O-N 3.45Å; R357-M359 VanDerWaalsContact C-N 3.3Å; R357-M359 PolarHBondContact O-N 3.46Å; R357-Q360 PolarHBondContact O-N 3.38Å; R357-Q360 VanDerWaalsContact O-N 3.12Å; R357-E361 WeakPolarHBondContact CD-OE1 3.24Å; R357-E361 VanDerWaalsContact CG-CD 3.42Å; R357-E361 HydrophobicContact CG-CG 4.22Å; R357-E361 WeakPolarHBondContact CG-OE1 3.11Å; R357-E361 IonicContact NE-OE2 3.34Å; R357-E361 WeakPolarHBondContact O-CG 3.28Å; R357-E361 PolarHBondContact O-N 3.01Å
358	L	95.7	Very high	95.5	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-70.5	-26.5	-174.1	-67	-179.2	0	0	0	112.9	E354 Q360 R362 Y367 H370	E354-L358 HydrophobicContact CG-CD1 3.61Å; E354-L358 HydrophobicContact CG-CG 4.15Å; E354-L358 WeakPolarHBondContact O-CB 3.36Å; E354-L358 WeakPolarHBondContact O-CG 3.31Å; E354-L358 PolarHBondContact O-N 3.08Å; L358-Q360 PolarHBondContact O-N 2.92Å; L358-R362 HydrophobicContact CD2-CG 4.44Å; L358-R362 WeakPolarHBondContact O-CB 3.4Å; L358-R362 PolarHBondContact O-N 2.95Å; L358-Y367 HydrophobicContact CB-CD2 3.78Å; L358-Y367 HydrophobicContact CB-CE2 3.82Å; L358-H370 WeakPolarHBondContact CD1-CD2 3.31Å; L358-H370 VanDerWaalsContact CD1-NE2 3.26Å; L358-H370 WeakPolarHBondContact CD1-NE2 3.34Å
359	M	94.1	Very high	95.6	Very high	21 Å²	21	60.1 Å²	60.1	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-32	172.7	-165.4	59.4	50.1	0	0	112.4	G355 R357 Y367 H406 I410 K413	G355-M359 VanDerWaalsContact O-CB 3.29Å; G355-M359 WeakPolarHBondContact O-CB 3.46Å; G355-M359 PolarHBondContact O-N 2.74Å; G355-M359 VanDerWaalsContact O-N 3.11Å; R357-M359 VanDerWaalsContact C-N 3.3Å; R357-M359 PolarHBondContact O-N 3.46Å; M359-Y367 HydrophobicContact CE-CD1 3.62Å; M359-Y367 HydrophobicContact CE-CD2 3.95Å; M359-Y367 HydrophobicContact CE-CE1 3.25Å; M359-Y367 HydrophobicContact CE-CE2 3.6Å; M359-Y367 HydrophobicContact CE-CG 3.95Å; M359-H406 HydrophobicContact CE-CB 3.86Å; M359-I410 HydrophobicContact CE-CD1 3.95Å; M359-I410 HydrophobicContact CE-CG1 3.48Å; M359-I410 VanDerWaalsContact CE-CG1 3.48Å; M359-I410 HydrophobicContact SD-CG1 3.75Å; M359-K413 PolarHBondContact O-NZ 3.26Å
360	Q	93.3	Very high	95.6	Very high	161 Å²	161	53.9 Å²	53.9	75%	0.752	26%	0.258	S	S	*	.	H	α-helix	trans	-84.2	-44.1	177.9	-64	177.9	11.6	0	0	111.5	R357 L358	R357-Q360 PolarHBondContact O-N 3.38Å; R357-Q360 VanDerWaalsContact O-N 3.12Å; L358-Q360 PolarHBondContact O-N 2.92Å
361	E	94.6	Very high	95.6	Very high	124 Å²	124	52.3 Å²	52.3	58%	0.579	25%	0.25	S	C	*	.	H	α-helix	trans	-75.6	-30.1	-174	-70.4	176.7	-179.7	0	0	114.4	R357	R357-E361 WeakPolarHBondContact CD-OE1 3.24Å; R357-E361 VanDerWaalsContact CG-CD 3.42Å; R357-E361 HydrophobicContact CG-CG 4.22Å; R357-E361 WeakPolarHBondContact CG-OE1 3.11Å; R357-E361 IonicContact NE-OE2 3.34Å; R357-E361 WeakPolarHBondContact O-CG 3.28Å; R357-E361 PolarHBondContact O-N 3.01Å
362	R	94.3	Very high	95.7	Very high	94 Å²	94	54.4 Å²	54.4	36%	0.355	26%	0.261	S	S	.	.	S	Bend	trans	-119.5	159.6	-171	-61.3	-168.6	-176.6	175.2	2.7	113.6	L358 E366 K413	L358-R362 HydrophobicContact CD2-CG 4.44Å; L358-R362 WeakPolarHBondContact O-CB 3.4Å; L358-R362 PolarHBondContact O-N 2.95Å; R362-E366 HydrophobicContact CB-CB 4.38Å; R362-K413 PolarHBondContact O-NZ 2.86Å
363	E	94.8	Very high	95.7	Very high	108 Å²	108	59 Å²	59	51%	0.505	28%	0.277	S	S	.	.			trans	-75.7	156.2	169.9	-70.4	-58.6	149.9	0	0	111.6	E366 Y367	E363-E366 PolarHBondContact O-N 2.86Å; E363-Y367 WeakPolarHBondContact O-CB 3.3Å; E363-Y367 PolarHBondContact O-N 3.26Å
364	V	95.9	Very high	95.7	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-56.5	-45	-176.1	170.8	0	0	0	0	113.6	E366 Y367 L368 I410 K413 L418	V364-E366 VanDerWaalsContact C-N 3.35Å; V364-E366 PolarHBondContact O-N 2.84Å; V364-Y367 PolarHBondContact O-N 2.97Å; V364-L368 HydrophobicContact CG1-CD1 3.92Å; V364-L368 HydrophobicContact CG1-CG 4.21Å; V364-L368 VanDerWaalsContact O-CG 3.31Å; V364-L368 WeakPolarHBondContact O-CG 3.44Å; V364-L368 PolarHBondContact O-N 3.44Å; V364-I410 HydrophobicContact CG1-CG2 3.75Å; V364-I410 HydrophobicContact CG2-CG2 4.44Å; V364-K413 HydrophobicContact CG2-CB 4.22Å; V364-K413 HydrophobicContact CG2-CD 4.35Å; V364-K413 HydrophobicContact CG2-CG 4.39Å; V364-L418 HydrophobicContact CG1-CD1 4.21Å
365	P	96.1	Very high	95.7	Very high	15 Å²	15	57.3 Å²	57.3	10%	0.097	26%	0.259	C	S	.	.	H	α-helix	trans	-54.5	-48.8	175.8	-24	31.3	0	0	0	112.9	Y367 L368 H369 L418	P365-Y367 VanDerWaalsContact C-N 3.34Å; P365-Y367 PolarHBondContact O-N 3.34Å; P365-L368 PolarHBondContact O-N 2.99Å; P365-H369 PolarHBondContact O-N 2.85Å; P365-H369 VanDerWaalsContact O-N 3.11Å; P365-H369 PolarHBondContact O-ND1 2.74Å; P365-L418 HydrophobicContact CG-CD2 3.87Å
366	E	96.1	Very high	95.7	Very high	112 Å²	112	63 Å²	63	52%	0.523	29%	0.285	S	S	.	.	H	α-helix	trans	-68	-36.6	-177.9	-62.4	177	-179.8	0	0	111.7	R362 E363 V364 H370	R362-E366 HydrophobicContact CB-CB 4.38Å; E363-E366 PolarHBondContact O-N 2.86Å; V364-E366 VanDerWaalsContact C-N 3.35Å; V364-E366 PolarHBondContact O-N 2.84Å; E366-H370 WeakPolarHBondContact O-CB 3.38Å; E366-H370 PolarHBondContact O-N 3.25Å
367	Y	97.2	Very high	95.7	Very high	1 Å²	1	59.6 Å²	59.6	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-48.2	173.8	-177	-95.7	0	0	0	111.5	L358 M359 E363 V364 P365 H369 H370 V371 L402 I410	L358-Y367 HydrophobicContact CB-CD2 3.78Å; L358-Y367 HydrophobicContact CB-CE2 3.82Å; M359-Y367 HydrophobicContact CE-CD1 3.62Å; M359-Y367 HydrophobicContact CE-CD2 3.95Å; M359-Y367 HydrophobicContact CE-CE1 3.25Å; M359-Y367 HydrophobicContact CE-CE2 3.6Å; M359-Y367 HydrophobicContact CE-CG 3.95Å; E363-Y367 WeakPolarHBondContact O-CB 3.3Å; E363-Y367 PolarHBondContact O-N 3.26Å; V364-Y367 PolarHBondContact O-N 2.97Å; P365-Y367 VanDerWaalsContact C-N 3.34Å; P365-Y367 PolarHBondContact O-N 3.34Å; Y367-H369 VanDerWaalsContact C-N 3.35Å; Y367-H369 PolarHBondContact O-N 3.19Å; Y367-H370 WeakPolarHBondContact O-CB 3.34Å; Y367-H370 PolarHBondContact O-N 3.04Å; Y367-H370 VanDerWaalsContact O-N 3.12Å; Y367-V371 HydrophobicContact CD1-CG2 4Å; Y367-V371 HydrophobicContact CE1-CG2 3.55Å; Y367-V371 WeakPolarHBondContact O-CG2 3.45Å; Y367-V371 PolarHBondContact O-N 3.03Å; Y367-L402 WeakPolarHBondContact CE1-O 3.3Å; Y367-L402 PolarHBondContact OH-O 3.23Å; Y367-I410 HydrophobicContact CD1-CD1 4.35Å; Y367-I410 HydrophobicContact CE1-CD1 3.96Å; Y367-I410 HydrophobicContact CE1-CG1 4.46Å
368	L	96.8	Very high	95.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-40.5	-180	-65.9	173.6	0	0	0	112.2	V364 P365 H370 V371 N372 L429 L430 L433	V364-L368 HydrophobicContact CG1-CD1 3.92Å; V364-L368 HydrophobicContact CG1-CG 4.21Å; V364-L368 VanDerWaalsContact O-CG 3.31Å; V364-L368 WeakPolarHBondContact O-CG 3.44Å; V364-L368 PolarHBondContact O-N 3.44Å; P365-L368 PolarHBondContact O-N 2.99Å; L368-H370 VanDerWaalsContact C-N 3.31Å; L368-H370 PolarHBondContact O-N 2.79Å; L368-V371 PolarHBondContact O-N 3.37Å; L368-N372 PolarHBondContact O-N 2.98Å; L368-L429 HydrophobicContact CB-CD2 3.88Å; L368-L429 HydrophobicContact CB-CG 4.28Å; L368-L430 HydrophobicContact CD1-CB 3.73Å; L368-L430 HydrophobicContact CD1-CD1 4.05Å; L368-L430 HydrophobicContact CD1-CG 4.1Å; L368-L433 HydrophobicContact CB-CD1 4.04Å; L368-L433 HydrophobicContact CD2-CD1 3.82Å; L368-L433 HydrophobicContact CG-CD1 4.49Å
369	H	96.9	Very high	95.6	Very high	96 Å²	96	55 Å²	55	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-61.2	-41.5	173.2	-78.1	89.9	0	0	0	111.9	P365 Y367 N372 K373 D426	P365-H369 PolarHBondContact O-N 2.85Å; P365-H369 VanDerWaalsContact O-N 3.11Å; P365-H369 PolarHBondContact O-ND1 2.74Å; Y367-H369 VanDerWaalsContact C-N 3.35Å; Y367-H369 PolarHBondContact O-N 3.19Å; H369-N372 PolarHBondContact O-N 3.48Å; H369-K373 WeakPolarHBondContact O-CB 3.3Å; H369-K373 PolarHBondContact O-N 2.77Å; H369-D426 IonicContact CE1-OD1 3.08Å; H369-D426 PolarHBondContact CE1-OD1 2.99Å; H369-D426 IonicContact ND1-OD1 3.59Å
370	H	96.4	Very high	95.6	Very high	24 Å²	24	57.1 Å²	57.1	11%	0.111	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-43.8	175.7	-177.8	81.8	0	0	0	112	E354 L358 E366 Y367 L368 N372 K373 R374	E354-H370 IonicContact OE1-CD2 3.7Å; E354-H370 IonicContact OE1-CE1 2.78Å; E354-H370 PolarHBondContact OE1-CE1 3.4Å; E354-H370 VanDerWaalsContact OE1-CE1 3.23Å; E354-H370 IonicContact OE1-NE2 2.74Å; E354-H370 PolarHBondContact OE1-NE2 2.96Å; L358-H370 WeakPolarHBondContact CD1-CD2 3.31Å; L358-H370 VanDerWaalsContact CD1-NE2 3.26Å; L358-H370 WeakPolarHBondContact CD1-NE2 3.34Å; E366-H370 WeakPolarHBondContact O-CB 3.38Å; E366-H370 PolarHBondContact O-N 3.25Å; Y367-H370 WeakPolarHBondContact O-CB 3.34Å; Y367-H370 PolarHBondContact O-N 3.04Å; Y367-H370 VanDerWaalsContact O-N 3.12Å; L368-H370 VanDerWaalsContact C-N 3.31Å; L368-H370 PolarHBondContact O-N 2.79Å; H370-N372 PolarHBondContact O-N 3.28Å; H370-K373 PolarHBondContact O-N 3.33Å; H370-R374 WeakPolarHBondContact O-CG 3.36Å; H370-R374 PolarHBondContact O-N 3.08Å
371	V	96.9	Very high	95.7	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-45.5	175.9	176.1	0	0	0	0	111.2	Y367 L368 K373 R374 L375 L402 L403 L433	Y367-V371 HydrophobicContact CD1-CG2 4Å; Y367-V371 HydrophobicContact CE1-CG2 3.55Å; Y367-V371 WeakPolarHBondContact O-CG2 3.45Å; Y367-V371 PolarHBondContact O-N 3.03Å; L368-V371 PolarHBondContact O-N 3.37Å; V371-K373 PolarHBondContact O-N 2.56Å; V371-R374 PolarHBondContact O-N 3.21Å; V371-L375 HydrophobicContact CG1-CD1 4.22Å; V371-L375 WeakPolarHBondContact O-CG 3.47Å; V371-L375 PolarHBondContact O-N 3.39Å; V371-L402 HydrophobicContact CG1-CB 4.16Å; V371-L402 HydrophobicContact CG1-CD1 4.35Å; V371-L402 HydrophobicContact CG2-CB 3.98Å; V371-L402 HydrophobicContact CG2-CD1 4.44Å; V371-L403 HydrophobicContact CG1-CD1 4.15Å; V371-L403 HydrophobicContact CG1-CD2 3.97Å; V371-L403 HydrophobicContact CG1-CG 3.97Å; V371-L403 HydrophobicContact CG2-CD2 4.41Å; V371-L433 HydrophobicContact CG1-CD2 4.35Å
372	N	97.1	Very high	95.8	Very high	44 Å²	44	44.1 Å²	44.1	24%	0.235	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-44.7	177.5	-170.8	68.1	0	0	0	111.8	L368 H369 H370 R374 L375 E376 L429	L368-N372 PolarHBondContact O-N 2.98Å; H369-N372 PolarHBondContact O-N 3.48Å; H370-N372 PolarHBondContact O-N 3.28Å; N372-R374 VanDerWaalsContact C-N 3.33Å; N372-R374 PolarHBondContact O-N 3.13Å; N372-L375 PolarHBondContact O-N 3.04Å; N372-E376 PolarHBondContact ND2-OE1 2.83Å; N372-E376 WeakPolarHBondContact O-CG 3.34Å; N372-E376 PolarHBondContact O-N 2.67Å; N372-L429 HydrophobicContact CB-CD1 4.02Å
373	K	96.1	Very high	95.8	Very high	117 Å²	117	45.9 Å²	45.9	51%	0.509	23%	0.225	S	C	.	.	H	α-helix	trans	-56.8	-45.5	174.8	-177.2	-176.5	179.1	-165.4	0	111.6	H369 H370 V371 L375 E376 E377	H369-K373 WeakPolarHBondContact O-CB 3.3Å; H369-K373 PolarHBondContact O-N 2.77Å; H370-K373 PolarHBondContact O-N 3.33Å; V371-K373 PolarHBondContact O-N 2.56Å; K373-L375 PolarHBondContact O-N 3.03Å; K373-E376 PolarHBondContact O-N 3.02Å; K373-E377 WeakPolarHBondContact CE-OE1 3.42Å; K373-E377 IonicContact NZ-OE1 3.42Å; K373-E377 WeakPolarHBondContact O-CG 3.33Å; K373-E377 PolarHBondContact O-N 2.59Å
374	R	95.8	Very high	95.8	Very high	24 Å²	24	41.6 Å²	41.6	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-43.1	177.5	-72.6	-59.2	-165.6	-168.7	7.2	112.2	R312 Y351 E354 H370 V371 N372 E376 E377 E378 M398 L402	R312-R374 PolarHBondContact O-NH1 2.84Å; R312-R374 PolarHBondContact O-NH2 3.44Å; R312-R374 VanDerWaalsContact O-NH2 3.17Å; Y351-R374 HydrophobicContact CE1-CB 4.41Å; Y351-R374 HydrophobicContact CE1-CG 4.16Å; E354-R374 IonicContact OE1-CZ 3.73Å; E354-R374 IonicContact OE1-NE 2.89Å; E354-R374 PolarHBondContact OE1-NE 2.99Å; E354-R374 VanDerWaalsContact OE1-NE 3.1Å; E354-R374 IonicContact OE1-NH2 2.93Å; E354-R374 PolarHBondContact OE1-NH2 3.02Å; E354-R374 IonicContact OE2-NE 2.85Å; E354-R374 IonicContact OE2-NH2 2.94Å; H370-R374 WeakPolarHBondContact O-CG 3.36Å; H370-R374 PolarHBondContact O-N 3.08Å; V371-R374 PolarHBondContact O-N 3.21Å; N372-R374 VanDerWaalsContact C-N 3.33Å; N372-R374 PolarHBondContact O-N 3.13Å; R374-E376 VanDerWaalsContact C-N 3.31Å; R374-E376 PolarHBondContact O-N 3.39Å; R374-E377 IonicContact CZ-OE2 3.75Å; R374-E377 IonicContact NH1-OE2 3.52Å; R374-E377 PolarHBondContact NH1-OE2 3.15Å; R374-E377 PolarHBondContact O-N 3.34Å; R374-E378 WeakPolarHBondContact O-CG 3.42Å; R374-E378 PolarHBondContact O-N 3.02Å; R374-M398 HydrophobicContact CB-CE 3.76Å; R374-M398 WeakPolarHBondContact O-CE 3.44Å; R374-L402 HydrophobicContact CB-CD1 4.32Å
375	L	95.8	Very high	95.7	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-40.1	176.8	-71.7	169.8	0	0	0	111.9	V371 N372 K373 A379 I395 M398 E399 L433	V371-L375 HydrophobicContact CG1-CD1 4.22Å; V371-L375 WeakPolarHBondContact O-CG 3.47Å; V371-L375 PolarHBondContact O-N 3.39Å; N372-L375 PolarHBondContact O-N 3.04Å; K373-L375 PolarHBondContact O-N 3.03Å; L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 3.41Å; L375-I395 HydrophobicContact CD2-CD1 4.06Å; L375-I395 HydrophobicContact CD2-CG2 4.44Å; L375-M398 HydrophobicContact CD2-CB 4.13Å; L375-M398 HydrophobicContact CD2-CE 4.07Å; L375-M398 HydrophobicContact CD2-SD 4.09Å; L375-M398 HydrophobicContact CG-CE 4.44Å; L375-E399 HydrophobicContact CD2-CG 4.42Å; L375-L433 HydrophobicContact CD1-CD2 3.81Å
376	E	95.3	Very high	95.7	Very high	119 Å²	119	42 Å²	42	56%	0.556	21%	0.207	S	C	*	.	H	α-helix	trans	-66.2	-45.9	175.4	-71.3	172.2	-176.6	0	0	112	N372 K373 R374 E378 A379 D380	N372-E376 PolarHBondContact ND2-OE1 2.83Å; N372-E376 WeakPolarHBondContact O-CG 3.34Å; N372-E376 PolarHBondContact O-N 2.67Å; K373-E376 PolarHBondContact O-N 3.02Å; R374-E376 VanDerWaalsContact C-N 3.31Å; R374-E376 PolarHBondContact O-N 3.39Å; E376-E378 PolarHBondContact O-N 3.02Å; E376-A379 PolarHBondContact O-N 2.61Å; E376-D380 PolarHBondContact O-N 3.18Å
377	E	94.8	Very high	95.6	Very high	48 Å²	48	39.2 Å²	39.2	22%	0.224	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-44.7	176.7	-71.9	175.4	-175.8	0	0	111.9	K373 R374 D380 R381	K373-E377 WeakPolarHBondContact CE-OE1 3.42Å; K373-E377 IonicContact NZ-OE1 3.42Å; K373-E377 WeakPolarHBondContact O-CG 3.33Å; K373-E377 PolarHBondContact O-N 2.59Å; R374-E377 IonicContact CZ-OE2 3.75Å; R374-E377 IonicContact NH1-OE2 3.52Å; R374-E377 PolarHBondContact NH1-OE2 3.15Å; R374-E377 PolarHBondContact O-N 3.34Å; E377-D380 PolarHBondContact O-N 3.01Å; E377-R381 WeakPolarHBondContact O-CG 3.13Å; E377-R381 PolarHBondContact O-N 3.42Å; E377-R381 IonicContact OE2-NH1 2.68Å; E377-R381 IonicContact OE2-NH2 3.04Å; E377-R381 PolarHBondContact OE2-NH2 3.11Å
378	E	95.4	Very high	95.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-32.8	179.7	-66.6	-72.3	153	0	0	112.2	R312 Y351 R374 E376 R381 V382 L394 M398	R312-E378 IonicContact CZ-OE1 3.78Å; R312-E378 IonicContact CZ-OE2 2.73Å; R312-E378 IonicContact NE-OE1 3.89Å; R312-E378 PolarHBondContact NE-OE1 3.33Å; R312-E378 IonicContact NE-OE2 2.78Å; R312-E378 IonicContact NH2-OE1 3.92Å; R312-E378 PolarHBondContact NH2-OE1 3.14Å; R312-E378 VanDerWaalsContact NH2-OE1 3.16Å; R312-E378 IonicContact NH2-OE2 2.66Å; R312-E378 PolarHBondContact NH2-OE2 3.04Å; Y351-E378 HydrophobicContact CE2-CG 4.48Å; Y351-E378 WeakPolarHBondContact OH-CG 3.24Å; Y351-E378 PolarHBondContact OH-OE1 3.11Å; R374-E378 WeakPolarHBondContact O-CG 3.42Å; R374-E378 PolarHBondContact O-N 3.02Å; E376-E378 PolarHBondContact O-N 3.02Å; E378-R381 VanDerWaalsContact CD-NH1 3.27Å; E378-R381 PolarHBondContact O-N 2.95Å; E378-R381 IonicContact OE1-CZ 3.84Å; E378-R381 IonicContact OE1-NE 3.28Å; E378-R381 IonicContact OE1-NH1 3.1Å; E378-R381 PolarHBondContact OE1-NH1 3.12Å; E378-V382 WeakPolarHBondContact O-CG2 3.15Å; E378-V382 PolarHBondContact O-N 3.43Å; E378-L394 HydrophobicContact CB-CD2 4.2Å; E378-M398 HydrophobicContact CB-CE 4.12Å; E378-M398 HydrophobicContact CB-SD 3.61Å; E378-M398 HydrophobicContact CG-CE 3.56Å; E378-M398 HydrophobicContact CG-SD 3.45Å; E378-M398 WeakPolarHBondContact CG-SD 3.39Å
379	A	93.8	Very high	95.4	Very high	32 Å²	32	46.1 Å²	46.1	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-41.1	170.9	0	0	0	0	0	111.8	L375 E376 V382 I383	L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 3.41Å; E376-A379 PolarHBondContact O-N 2.61Å; A379-V382 PolarHBondContact O-N 3.34Å; A379-I383 WeakPolarHBondContact O-CG1 3.35Å; A379-I383 PolarHBondContact O-N 3.13Å
380	D	94.7	Very high	95.3	Very high	66 Å²	66	41.5 Å²	41.5	35%	0.353	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-39.8	173.4	-178.7	64.4	0	0	0	112	R319 E376 E377 V382 I383 T384	R319-D380 IonicContact CZ-OD2 3.9Å; R319-D380 IonicContact NH1-OD2 2.8Å; R319-D380 PolarHBondContact NH1-OD2 2.97Å; R319-D380 IonicContact NH2-OD2 3.14Å; E376-D380 PolarHBondContact O-N 3.18Å; E377-D380 PolarHBondContact O-N 3.01Å; D380-V382 VanDerWaalsContact C-N 3.33Å; D380-V382 PolarHBondContact O-N 2.96Å; D380-I383 PolarHBondContact O-N 3.28Å; D380-T384 VanDerWaalsContact O-CB 3.31Å; D380-T384 WeakPolarHBondContact O-CB 3.48Å; D380-T384 PolarHBondContact O-N 3.23Å; D380-T384 PolarHBondContact O-OG1 2.91Å
381	R	94.9	Very high	95.3	Very high	7 Å²	7	44 Å²	44	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-41.1	175.6	-72.2	177.6	-174.2	102.8	15	112.1	E311 E377 E378 T384 Y385 L386	E311-R381 IonicContact OE2-NE 3.23Å; E311-R381 PolarHBondContact OE2-NE 3.2Å; E377-R381 WeakPolarHBondContact O-CG 3.13Å; E377-R381 PolarHBondContact O-N 3.42Å; E377-R381 IonicContact OE2-NH1 2.68Å; E377-R381 IonicContact OE2-NH2 3.04Å; E377-R381 PolarHBondContact OE2-NH2 3.11Å; E378-R381 VanDerWaalsContact CD-NH1 3.27Å; E378-R381 PolarHBondContact O-N 2.95Å; E378-R381 IonicContact OE1-CZ 3.84Å; E378-R381 IonicContact OE1-NE 3.28Å; E378-R381 IonicContact OE1-NH1 3.1Å; E378-R381 PolarHBondContact OE1-NH1 3.12Å; R381-T384 PolarHBondContact O-N 2.95Å; R381-Y385 HydrophobicContact CB-CE2 4.38Å; R381-Y385 WeakPolarHBondContact CD-OH 3.38Å; R381-Y385 HydrophobicContact CG-CE1 4.3Å; R381-Y385 WeakPolarHBondContact CG-OH 3.37Å; R381-Y385 PolarHBondContact O-N 2.78Å; R381-L386 HydrophobicContact CB-CD1 4.26Å; R381-L386 PolarHBondContact O-N 2.97Å
382	V	95.9	Very high	95.2	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-47.5	174.4	170.9	0	0	0	0	111.3	E378 A379 D380 T384 L386 Q391 L394	E378-V382 WeakPolarHBondContact O-CG2 3.15Å; E378-V382 PolarHBondContact O-N 3.43Å; A379-V382 PolarHBondContact O-N 3.34Å; D380-V382 VanDerWaalsContact C-N 3.33Å; D380-V382 PolarHBondContact O-N 2.96Å; V382-T384 VanDerWaalsContact C-N 3.25Å; V382-T384 PolarHBondContact O-N 3.48Å; V382-L386 HydrophobicContact CG2-CD1 4.05Å; V382-L386 VanDerWaalsContact O-O 3.13Å; V382-Q391 HydrophobicContact CG1-CB 3.83Å; V382-Q391 HydrophobicContact CG1-CG 4.07Å; V382-Q391 HydrophobicContact CG2-CB 4.23Å; V382-Q391 HydrophobicContact CG2-CG 4.27Å; V382-L394 HydrophobicContact CG2-CD2 3.9Å
383	I	94.9	Very high	95.1	Very high	132 Å²	132	52.8 Å²	52.8	68%	0.677	27%	0.265	S	S	*	.	H	α-helix	trans	-66.7	-32.5	178.8	-63.5	165.8	0	0	0	111	A379 D380	A379-I383 WeakPolarHBondContact O-CG1 3.35Å; A379-I383 PolarHBondContact O-N 3.13Å; D380-I383 PolarHBondContact O-N 3.28Å
384	T	94.8	Very high	95.1	Very high	18 Å²	18	47.2 Å²	47.2	11%	0.11	24%	0.24	C	C	.	.	H	α-helix	trans	-83.7	-46.5	-171.1	-55.2	0	0	0	0	113.8	R319 R323 D380 R381 V382	R319-T384 HydrophobicContact CB-CG2 4.18Å; R323-T384 PolarHBondContact NE-O 3Å; R323-T384 PolarHBondContact NH2-O 3.38Å; D380-T384 VanDerWaalsContact O-CB 3.31Å; D380-T384 WeakPolarHBondContact O-CB 3.48Å; D380-T384 PolarHBondContact O-N 3.23Å; D380-T384 PolarHBondContact O-OG1 2.91Å; R381-T384 PolarHBondContact O-N 2.95Å; V382-T384 VanDerWaalsContact C-N 3.25Å; V382-T384 PolarHBondContact O-N 3.48Å
385	Y	95	Very high	95	Very high	11 Å²	11	47.2 Å²	47.2	4%	0.043	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.9	-13.3	-174.2	56.4	-110.4	0	0	0	116.5	I308 E311 R319 L322 L326 R381	I308-Y385 HydrophobicContact CD1-CE2 4.17Å; I308-Y385 HydrophobicContact CG1-CE2 4.04Å; E311-Y385 WeakPolarHBondContact OE2-CE1 3.44Å; E311-Y385 PolarHBondContact OE2-OH 3.48Å; R319-Y385 HydrophobicContact CB-CD1 4.37Å; R319-Y385 HydrophobicContact CG-CD1 4.42Å; R319-Y385 HydrophobicContact CG-CE1 4.41Å; L322-Y385 HydrophobicContact CB-CD1 4.36Å; L322-Y385 HydrophobicContact CB-CD2 4.34Å; L322-Y385 HydrophobicContact CB-CG 4.07Å; L322-Y385 HydrophobicContact CD1-CD1 4.3Å; L322-Y385 HydrophobicContact CD1-CD2 4.25Å; L322-Y385 HydrophobicContact CD1-CE1 4.05Å; L322-Y385 HydrophobicContact CD1-CE2 4Å; L322-Y385 HydrophobicContact CD1-CG 4.4Å; L326-Y385 HydrophobicContact CD1-CD2 3.7Å; L326-Y385 HydrophobicContact CD1-CG 4.49Å; L326-Y385 WeakPolarHBondContact CD1-O 3.32Å; R381-Y385 HydrophobicContact CB-CE2 4.38Å; R381-Y385 WeakPolarHBondContact CD-OH 3.38Å; R381-Y385 HydrophobicContact CG-CE1 4.3Å; R381-Y385 WeakPolarHBondContact CG-OH 3.37Å; R381-Y385 PolarHBondContact O-N 2.78Å
386	L	95.8	Very high	95	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	26%	0.26	C	S	.	.	S	Bend	trans	-83.5	162.4	176.2	-55.4	167.1	0	0	0	111.5	I308 L326 F339 F343 R381 V382 L394	I308-L386 HydrophobicContact CD1-CD2 4.42Å; L326-L386 HydrophobicContact CD1-CD2 3.97Å; F339-L386 HydrophobicContact CE1-CD2 4.03Å; F339-L386 HydrophobicContact CZ-CD2 4.18Å; F343-L386 HydrophobicContact CE1-CD1 4.2Å; F343-L386 HydrophobicContact CZ-CD1 3.91Å; F343-L386 HydrophobicContact CZ-CD2 4.4Å; R381-L386 HydrophobicContact CB-CD1 4.26Å; R381-L386 PolarHBondContact O-N 2.97Å; V382-L386 HydrophobicContact CG2-CD1 4.05Å; V382-L386 VanDerWaalsContact O-O 3.13Å; L386-L394 HydrophobicContact CD1-CD2 4Å
387	D	94.4	Very high	95	Very high	52 Å²	52	44.7 Å²	44.7	28%	0.278	24%	0.24	S	C	.	.			trans	-72.8	143.8	171.9	-168.3	-86.9	0	0	0	111.1	Y335 S389 T390	Y335-D387 HydrophobicContact CD1-CB 4.13Å; Y335-D387 HydrophobicContact CE1-CB 3.54Å; Y335-D387 HydrophobicContact CE2-CB 3.95Å; Y335-D387 VanDerWaalsContact CZ-CB 3.44Å; Y335-D387 PolarHBondContact OH-N 3.31Å; Y335-D387 VanDerWaalsContact OH-N 3.12Å; D387-S389 PolarHBondContact O-N 3.39Å; D387-S389 WeakPolarHBondContact OD1-CB 3.41Å; D387-S389 PolarHBondContact OD1-N 3.3Å; D387-S389 PolarHBondContact OD1-OG 2.93Å; D387-T390 WeakPolarHBondContact O-CB 3.48Å; D387-T390 PolarHBondContact O-N 3.32Å
388	Q	94.1	Very high	95	Very high	98 Å²	98	42.4 Å²	42.4	46%	0.458	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-61.2	-26.4	-179.4	-174.5	58	48.6	0	0	112.8	T390 Q391	Q388-T390 PolarHBondContact O-N 3.47Å; Q388-Q391 PolarHBondContact O-N 3.49Å
389	S	94.3	Very high	95	Very high	48 Å²	48	44 Å²	44	34%	0.336	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-63.1	-29.8	174.7	59.6	0	0	0	0	112.9	D387 Q391 P393	D387-S389 PolarHBondContact O-N 3.39Å; D387-S389 WeakPolarHBondContact OD1-CB 3.41Å; D387-S389 PolarHBondContact OD1-N 3.3Å; D387-S389 PolarHBondContact OD1-OG 2.93Å; S389-Q391 VanDerWaalsContact C-N 3.34Å; S389-Q391 PolarHBondContact O-N 2.9Å; S389-P393 VanDerWaalsContact O-CD 3.3Å; S389-P393 WeakPolarHBondContact O-CD 3.44Å
390	T	95.6	Very high	95	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-75.9	-18.7	-178.2	-54.5	0	0	0	0	113.6	Y335 E340 F343 D387 Q388 K392 P393 L394	Y335-T390 VanDerWaalsContact CE1-OG1 3.27Å; Y335-T390 WeakPolarHBondContact CE1-OG1 3.46Å; Y335-T390 PolarHBondContact OH-OG1 3.21Å; E340-T390 HydrophobicContact CG-CG2 4.37Å; E340-T390 WeakPolarHBondContact OE1-CA 3.44Å; E340-T390 VanDerWaalsContact OE1-CB 3.32Å; E340-T390 WeakPolarHBondContact OE1-CB 3.49Å; E340-T390 PolarHBondContact OE1-OG1 3.01Å; F343-T390 HydrophobicContact CD1-CG2 3.89Å; F343-T390 HydrophobicContact CE1-CG2 3.68Å; D387-T390 WeakPolarHBondContact O-CB 3.48Å; D387-T390 PolarHBondContact O-N 3.32Å; Q388-T390 PolarHBondContact O-N 3.47Å; T390-K392 VanDerWaalsContact C-N 3.34Å; T390-K392 PolarHBondContact O-N 3.12Å; T390-P393 WeakPolarHBondContact O-CD 3.45Å; T390-L394 HydrophobicContact CG2-CB 4.28Å; T390-L394 WeakPolarHBondContact O-CB 3.4Å; T390-L394 PolarHBondContact O-N 3.4Å
391	Q	95.3	Very high	95.1	Very high	75 Å²	75	45.4 Å²	45.4	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-54.5	-49.3	-176.1	-169.5	179.5	-6.8	0	0	112.4	V382 Q388 S389 I395	V382-Q391 HydrophobicContact CG1-CB 3.83Å; V382-Q391 HydrophobicContact CG1-CG 4.07Å; V382-Q391 HydrophobicContact CG2-CB 4.23Å; V382-Q391 HydrophobicContact CG2-CG 4.27Å; Q388-Q391 PolarHBondContact O-N 3.49Å; S389-Q391 VanDerWaalsContact C-N 3.34Å; S389-Q391 PolarHBondContact O-N 2.9Å; Q391-I395 HydrophobicContact CG-CG1 4.38Å; Q391-I395 WeakPolarHBondContact O-CB 3.44Å; Q391-I395 VanDerWaalsContact O-CG1 3.26Å; Q391-I395 WeakPolarHBondContact O-CG1 3.36Å; Q391-I395 PolarHBondContact O-N 2.93Å
392	K	95.1	Very high	95.1	Very high	180 Å²	180	45 Å²	45	78%	0.783	23%	0.233	S	C	*	.	H	α-helix	trans	-69.8	-48.5	-173.4	-178.4	-178.1	-178.3	-177.5	0	112.1	T390 L394 A396	T390-K392 VanDerWaalsContact C-N 3.34Å; T390-K392 PolarHBondContact O-N 3.12Å; K392-L394 VanDerWaalsContact C-N 3.35Å; K392-L394 PolarHBondContact O-N 3.25Å; K392-A396 VanDerWaalsContact O-CB 3.32Å; K392-A396 WeakPolarHBondContact O-CB 3.46Å; K392-A396 PolarHBondContact O-N 3.01Å; K392-A396 VanDerWaalsContact O-N 3.11Å
393	P	96.3	Very high	95.1	Very high	52 Å²	52	44.8 Å²	44.8	34%	0.338	23%	0.232	S	C	.	.	H	α-helix	trans	-60.4	-39	173.5	-25.2	34.3	0	0	0	114.2	L344 S389 T390 T397	L344-P393 HydrophobicContact CD1-CB 3.67Å; L344-P393 HydrophobicContact CD2-CB 4.07Å; S389-P393 VanDerWaalsContact O-CD 3.3Å; S389-P393 WeakPolarHBondContact O-CD 3.44Å; T390-P393 WeakPolarHBondContact O-CD 3.45Å; P393-T397 WeakPolarHBondContact O-CB 3.31Å; P393-T397 PolarHBondContact O-N 2.96Å; P393-T397 PolarHBondContact O-OG1 2.97Å
394	L	96	Very high	95	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-55.1	179.7	174.2	58.1	0	0	0	111.5	F343 L344 T347 E378 V382 L386 T390 K392 A396 T397 M398	F343-L394 HydrophobicContact CE1-CD1 3.92Å; F343-L394 HydrophobicContact CE1-CD2 4.17Å; F343-L394 HydrophobicContact CE1-CG 4.46Å; F343-L394 HydrophobicContact CZ-CD1 3.94Å; F343-L394 HydrophobicContact CZ-CD2 4.16Å; L344-L394 HydrophobicContact CD2-CB 4.3Å; T347-L394 HydrophobicContact CG2-CD1 3.68Å; E378-L394 HydrophobicContact CB-CD2 4.2Å; V382-L394 HydrophobicContact CG2-CD2 3.9Å; L386-L394 HydrophobicContact CD1-CD2 4Å; T390-L394 HydrophobicContact CG2-CB 4.28Å; T390-L394 WeakPolarHBondContact O-CB 3.4Å; T390-L394 PolarHBondContact O-N 3.4Å; K392-L394 VanDerWaalsContact C-N 3.35Å; K392-L394 PolarHBondContact O-N 3.25Å; L394-A396 VanDerWaalsContact C-N 3.3Å; L394-A396 PolarHBondContact O-N 3.48Å; L394-T397 WeakPolarHBondContact O-CB 3.46Å; L394-T397 PolarHBondContact O-N 3.45Å; L394-T397 VanDerWaalsContact O-N 3.08Å; L394-M398 HydrophobicContact CD1-CG 4.49Å; L394-M398 HydrophobicContact CD1-SD 4.5Å; L394-M398 WeakPolarHBondContact O-CG 3.47Å; L394-M398 PolarHBondContact O-N 3.44Å
395	I	94.1	Very high	95	Very high	24 Å²	24	44.3 Å²	44.3	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-41.7	-180	-65.1	-63.9	0	0	0	110.7	L375 Q391 T397 M398 E399	L375-I395 HydrophobicContact CD2-CD1 4.06Å; L375-I395 HydrophobicContact CD2-CG2 4.44Å; Q391-I395 HydrophobicContact CG-CG1 4.38Å; Q391-I395 WeakPolarHBondContact O-CB 3.44Å; Q391-I395 VanDerWaalsContact O-CG1 3.26Å; Q391-I395 WeakPolarHBondContact O-CG1 3.36Å; Q391-I395 PolarHBondContact O-N 2.93Å; I395-T397 VanDerWaalsContact C-N 3.28Å; I395-T397 PolarHBondContact O-N 3.33Å; I395-M398 HydrophobicContact CD1-SD 4.26Å; I395-M398 PolarHBondContact O-N 3.29Å; I395-E399 HydrophobicContact CG2-CG 4.09Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.38Å; I395-E399 WeakPolarHBondContact O-CB 3.35Å; I395-E399 WeakPolarHBondContact O-CG 3.33Å; I395-E399 PolarHBondContact O-N 3.01Å
396	A	95	Very high	95	Very high	53 Å²	53	45 Å²	45	44%	0.438	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-36.8	176.3	0	0	0	0	0	112.6	K392 L394 K400	K392-A396 VanDerWaalsContact O-CB 3.32Å; K392-A396 WeakPolarHBondContact O-CB 3.46Å; K392-A396 PolarHBondContact O-N 3.01Å; K392-A396 VanDerWaalsContact O-N 3.11Å; L394-A396 VanDerWaalsContact C-N 3.3Å; L394-A396 PolarHBondContact O-N 3.48Å; A396-K400 VanDerWaalsContact O-CB 3.3Å; A396-K400 WeakPolarHBondContact O-CB 3.37Å; A396-K400 PolarHBondContact O-N 3.34Å
397	T	95.6	Very high	94.9	Very high	23 Å²	23	45 Å²	45	14%	0.141	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-42.6	176.4	-59	0	0	0	0	111.1	N348 P393 L394 I395 K400 Q401	N348-T397 HydrophobicContact CB-CG2 3.72Å; P393-T397 WeakPolarHBondContact O-CB 3.31Å; P393-T397 PolarHBondContact O-N 2.96Å; P393-T397 PolarHBondContact O-OG1 2.97Å; L394-T397 WeakPolarHBondContact O-CB 3.46Å; L394-T397 PolarHBondContact O-N 3.45Å; L394-T397 VanDerWaalsContact O-N 3.08Å; I395-T397 VanDerWaalsContact C-N 3.28Å; I395-T397 PolarHBondContact O-N 3.33Å; T397-K400 PolarHBondContact O-N 3.37Å; T397-Q401 WeakPolarHBondContact O-CG 3.32Å; T397-Q401 PolarHBondContact O-N 3.44Å
398	M	95.1	Very high	94.8	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-47.7	176.8	-62.6	177.9	75.1	0	0	112.4	Y351 R374 L375 E378 L394 I395 K400 Q401 L402	Y351-M398 HydrophobicContact CD2-CG 3.82Å; Y351-M398 HydrophobicContact CE1-CE 4.32Å; Y351-M398 HydrophobicContact CE2-CE 3.87Å; Y351-M398 HydrophobicContact CE2-CG 3.71Å; Y351-M398 HydrophobicContact CE2-SD 4.16Å; R374-M398 HydrophobicContact CB-CE 3.76Å; R374-M398 WeakPolarHBondContact O-CE 3.44Å; L375-M398 HydrophobicContact CD2-CB 4.13Å; L375-M398 HydrophobicContact CD2-CE 4.07Å; L375-M398 HydrophobicContact CD2-SD 4.09Å; L375-M398 HydrophobicContact CG-CE 4.44Å; E378-M398 HydrophobicContact CB-CE 4.12Å; E378-M398 HydrophobicContact CB-SD 3.61Å; E378-M398 HydrophobicContact CG-CE 3.56Å; E378-M398 HydrophobicContact CG-SD 3.45Å; E378-M398 WeakPolarHBondContact CG-SD 3.39Å; L394-M398 HydrophobicContact CD1-CG 4.49Å; L394-M398 HydrophobicContact CD1-SD 4.5Å; L394-M398 WeakPolarHBondContact O-CG 3.47Å; L394-M398 PolarHBondContact O-N 3.44Å; I395-M398 HydrophobicContact CD1-SD 4.26Å; I395-M398 PolarHBondContact O-N 3.29Å; M398-K400 PolarHBondContact O-N 3.04Å; M398-Q401 PolarHBondContact O-N 3.33Å; M398-L402 HydrophobicContact CE-CD1 4.34Å; M398-L402 WeakPolarHBondContact O-CB 3.33Å; M398-L402 PolarHBondContact O-N 3.31Å
399	E	94.2	Very high	94.8	Very high	33 Å²	33	43.2 Å²	43.2	15%	0.154	24%	0.237	C	C	.	.	I	π-helix	trans	-60.5	-36.6	178	-72.5	175.2	169.2	0	0	110.7	L375 I395 L403 G404 R436 V437	L375-E399 HydrophobicContact CD2-CG 4.42Å; I395-E399 HydrophobicContact CG2-CG 4.09Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.38Å; I395-E399 WeakPolarHBondContact O-CB 3.35Å; I395-E399 WeakPolarHBondContact O-CG 3.33Å; I395-E399 PolarHBondContact O-N 3.01Å; E399-L403 WeakPolarHBondContact O-CB 3.42Å; E399-L403 PolarHBondContact O-N 3.38Å; E399-G404 PolarHBondContact O-N 3.19Å; E399-R436 HydrophobicContact CG-CB 4.37Å; E399-R436 WeakPolarHBondContact OE1-CB 3.39Å; E399-R436 WeakPolarHBondContact OE1-CD 3.19Å; E399-R436 IonicContact OE1-NH1 3.49Å; E399-R436 PolarHBondContact OE1-NH1 3.49Å; E399-R436 VanDerWaalsContact OE1-NH1 3.17Å; E399-V437 HydrophobicContact CB-CG2 4.44Å
400	K	94.3	Very high	94.9	Very high	106 Å²	106	41 Å²	41	46%	0.461	22%	0.222	S	C	.	.	I	π-helix	trans	-65.1	-54.8	172.5	-175.9	-175.1	175.4	-173.1	0	112	A396 T397 M398 G404 E405	A396-K400 VanDerWaalsContact O-CB 3.3Å; A396-K400 WeakPolarHBondContact O-CB 3.37Å; A396-K400 PolarHBondContact O-N 3.34Å; T397-K400 PolarHBondContact O-N 3.37Å; M398-K400 PolarHBondContact O-N 3.04Å; K400-G404 CarbonylContact O-C 3.5Å; K400-G404 VanDerWaalsContact O-CA 3.24Å; K400-G404 WeakPolarHBondContact O-CA 3.07Å; K400-G404 PolarHBondContact O-N 3.23Å; K400-E405 WeakPolarHBondContact CE-OE1 3.33Å; K400-E405 PolarHBondContact O-N 2.8Å
401	Q	95.6	Very high	94.9	Very high	21 Å²	21	41.1 Å²	41.1	10%	0.098	22%	0.222	C	C	.	.	I	π-helix	trans	-75.8	-39.1	-169.8	-66.2	-59.2	-14.2	0	0	113.6	N348 A352 T397 M398 H406	N348-Q401 PolarHBondContact OD1-NE2 3.2Å; A352-Q401 HydrophobicContact CB-CG 4.44Å; T397-Q401 WeakPolarHBondContact O-CG 3.32Å; T397-Q401 PolarHBondContact O-N 3.44Å; M398-Q401 PolarHBondContact O-N 3.33Å; Q401-H406 PolarHBondContact O-CD2 2.85Å; Q401-H406 PolarHBondContact O-NE2 2.86Å
402	L	95.6	Very high	94.7	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	I	π-helix	trans	-88.9	-21.8	-177.6	-62.7	177.9	0	0	0	113.4	Y351 Y367 V371 R374 M398	Y351-L402 HydrophobicContact CD1-CD1 3.88Å; Y351-L402 HydrophobicContact CD1-CD2 4.04Å; Y351-L402 HydrophobicContact CD1-CG 4.19Å; Y351-L402 HydrophobicContact CE1-CD1 4.25Å; Y351-L402 HydrophobicContact CG-CD1 4.35Å; Y351-L402 HydrophobicContact CG-CD2 4.47Å; Y351-L402 HydrophobicContact CG-CG 4.38Å; Y367-L402 WeakPolarHBondContact CE1-O 3.3Å; Y367-L402 PolarHBondContact OH-O 3.23Å; V371-L402 HydrophobicContact CG1-CB 4.16Å; V371-L402 HydrophobicContact CG1-CD1 4.35Å; V371-L402 HydrophobicContact CG2-CB 3.98Å; V371-L402 HydrophobicContact CG2-CD1 4.44Å; R374-L402 HydrophobicContact CB-CD1 4.32Å; M398-L402 HydrophobicContact CE-CD1 4.34Å; M398-L402 WeakPolarHBondContact O-CB 3.33Å; M398-L402 PolarHBondContact O-N 3.31Å
403	L	95.3	Very high	94.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	I	π-helix	trans	-122.4	-55.3	-179.2	-61.2	169.9	0	0	0	111.3	V371 E399 E405 H406 L407 I410 L433 V437	V371-L403 HydrophobicContact CG1-CD1 4.15Å; V371-L403 HydrophobicContact CG1-CD2 3.97Å; V371-L403 HydrophobicContact CG1-CG 3.97Å; V371-L403 HydrophobicContact CG2-CD2 4.41Å; E399-L403 WeakPolarHBondContact O-CB 3.42Å; E399-L403 PolarHBondContact O-N 3.38Å; L403-E405 PolarHBondContact O-N 2.93Å; L403-H406 CarbonylContact O-C 3.54Å; L403-H406 PolarHBondContact O-N 2.95Å; L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.22Å; L403-I410 HydrophobicContact CD2-CD1 4.43Å; L403-L433 HydrophobicContact CD1-CB 3.91Å; L403-L433 HydrophobicContact CD1-CD2 4.28Å; L403-L433 HydrophobicContact CD2-CB 4.26Å; L403-V437 HydrophobicContact CB-CG2 3.58Å; L403-V437 HydrophobicContact CD1-CG2 4.02Å; L403-V437 HydrophobicContact CG-CG2 4.48Å
404	G	93.9	Very high	94.2	Very high	25 Å²	25	37.6 Å²	37.6	26%	0.258	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-53.4	-51.3	-173.2	0	0	0	0	0	115	E399 K400 H406	E399-G404 PolarHBondContact O-N 3.19Å; K400-G404 CarbonylContact O-C 3.5Å; K400-G404 VanDerWaalsContact O-CA 3.24Å; K400-G404 WeakPolarHBondContact O-CA 3.07Å; K400-G404 PolarHBondContact O-N 3.23Å; G404-H406 PolarHBondContact O-N 2.76Å
405	E	94	Very high	94.1	Very high	114 Å²	114	37.8 Å²	37.8	53%	0.533	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-69.6	-11.6	179.7	-60	-60.1	153.8	0	0	113.1	K400 L403	K400-E405 WeakPolarHBondContact CE-OE1 3.33Å; K400-E405 PolarHBondContact O-N 2.8Å; L403-E405 PolarHBondContact O-N 2.93Å
406	H	94.6	Very high	94	Very high	26 Å²	26	40.4 Å²	40.4	12%	0.12	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-124.1	3.1	-170.6	-57.7	-42.3	0	0	0	114.6	M359 Q401 L403 G404 T408 A409 I410	M359-H406 HydrophobicContact CE-CB 3.86Å; Q401-H406 PolarHBondContact O-CD2 2.85Å; Q401-H406 PolarHBondContact O-NE2 2.86Å; L403-H406 CarbonylContact O-C 3.54Å; L403-H406 PolarHBondContact O-N 2.95Å; G404-H406 PolarHBondContact O-N 2.76Å; H406-T408 VanDerWaalsContact C-N 3.34Å; H406-T408 PolarHBondContact O-N 3.33Å; H406-A409 PolarHBondContact O-N 3.29Å; H406-A409 VanDerWaalsContact O-N 3.08Å; H406-I410 HydrophobicContact CB-CD1 4.07Å; H406-I410 HydrophobicContact CB-CG1 4.28Å; H406-I410 VanDerWaalsContact O-CG1 3.31Å; H406-I410 WeakPolarHBondContact O-CG1 3.27Å; H406-I410 PolarHBondContact O-N 3Å
407	L	93.9	Very high	94	Very high	15 Å²	15	42.1 Å²	42.1	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-48.8	-51.9	-175.5	-69.3	174.1	0	0	0	112.6	L403 L411 F434 V437	L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.22Å; L407-L411 WeakPolarHBondContact O-CG 3.36Å; L407-L411 PolarHBondContact O-N 3.43Å; L407-F434 HydrophobicContact CB-CE1 4.22Å; L407-F434 HydrophobicContact CD2-CD1 3.68Å; L407-F434 HydrophobicContact CD2-CD2 4.39Å; L407-F434 HydrophobicContact CD2-CE1 3.52Å; L407-F434 HydrophobicContact CD2-CE2 4.27Å; L407-F434 HydrophobicContact CD2-CG 4.11Å; L407-F434 HydrophobicContact CD2-CZ 3.85Å; L407-F434 HydrophobicContact CG-CE1 4.47Å; L407-V437 HydrophobicContact CD1-CG1 3.93Å; L407-V437 HydrophobicContact CD2-CB 4.41Å; L407-V437 HydrophobicContact CD2-CG1 4.46Å
408	T	93.4	Very high	94	Very high	70 Å²	70	41 Å²	41	43%	0.429	21%	0.214	S	C	.	.	H	α-helix	trans	-67.7	-40.6	-178	-53.9	0	0	0	0	112.1	H406 L411 Q412	H406-T408 VanDerWaalsContact C-N 3.34Å; H406-T408 PolarHBondContact O-N 3.33Å; T408-L411 PolarHBondContact O-N 2.99Å; T408-Q412 HydrophobicContact CG2-CG 4.24Å; T408-Q412 WeakPolarHBondContact O-CB 3.17Å; T408-Q412 VanDerWaalsContact O-CG 3.28Å; T408-Q412 WeakPolarHBondContact O-CG 3.47Å; T408-Q412 PolarHBondContact O-N 3.02Å
409	A	94.1	Very high	94	Very high	41 Å²	41	41 Å²	41	34%	0.339	21%	0.214	S	C	.	.	H	α-helix	trans	-65.5	-41.7	-179.6	0	0	0	0	0	111.8	H406 L411 Q412 K413	H406-A409 PolarHBondContact O-N 3.29Å; H406-A409 VanDerWaalsContact O-N 3.08Å; A409-L411 PolarHBondContact O-N 3.11Å; A409-Q412 PolarHBondContact O-N 3.44Å; A409-K413 WeakPolarHBondContact O-CB 3.44Å; A409-K413 PolarHBondContact O-N 3.39Å
410	I	95.5	Very high	93.9	Very high	1 Å²	1	43 Å²	43	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-57.6	-49.1	175.7	-69.2	165.4	0	0	0	110.3	M359 V364 Y367 L403 H406 G414 F434	M359-I410 HydrophobicContact CE-CD1 3.95Å; M359-I410 HydrophobicContact CE-CG1 3.48Å; M359-I410 VanDerWaalsContact CE-CG1 3.48Å; M359-I410 HydrophobicContact SD-CG1 3.75Å; V364-I410 HydrophobicContact CG1-CG2 3.75Å; V364-I410 HydrophobicContact CG2-CG2 4.44Å; Y367-I410 HydrophobicContact CD1-CD1 4.35Å; Y367-I410 HydrophobicContact CE1-CD1 3.96Å; Y367-I410 HydrophobicContact CE1-CG1 4.46Å; L403-I410 HydrophobicContact CD2-CD1 4.43Å; H406-I410 HydrophobicContact CB-CD1 4.07Å; H406-I410 HydrophobicContact CB-CG1 4.28Å; H406-I410 VanDerWaalsContact O-CG1 3.31Å; H406-I410 WeakPolarHBondContact O-CG1 3.27Å; H406-I410 PolarHBondContact O-N 3Å; I410-G414 PolarHBondContact O-N 3.38Å; I410-F434 HydrophobicContact CB-CZ 4.1Å; I410-F434 HydrophobicContact CD1-CE2 4.35Å; I410-F434 HydrophobicContact CD1-CZ 4.32Å; I410-F434 HydrophobicContact CG2-CE2 4.07Å; I410-F434 HydrophobicContact CG2-CZ 3.85Å
411	L	95.1	Very high	93.9	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-42.1	-177.4	-61.6	176.2	0	0	0	112.1	L407 T408 A409 K413 L415 L430 F434 V443 L444 Q447	L407-L411 WeakPolarHBondContact O-CG 3.36Å; L407-L411 PolarHBondContact O-N 3.43Å; T408-L411 PolarHBondContact O-N 2.99Å; A409-L411 PolarHBondContact O-N 3.11Å; L411-K413 VanDerWaalsContact C-N 3.34Å; L411-K413 PolarHBondContact O-N 3.3Å; L411-L415 HydrophobicContact CB-CB 4.31Å; L411-L415 HydrophobicContact CD2-CB 4.19Å; L411-L415 HydrophobicContact CD2-CD1 4.26Å; L411-L415 HydrophobicContact CD2-CD2 4.19Å; L411-L415 HydrophobicContact CD2-CG 4.44Å; L411-L415 WeakPolarHBondContact O-CB 3.49Å; L411-L415 PolarHBondContact O-N 3.47Å; L411-L430 HydrophobicContact CD2-CD1 4.13Å; L411-L430 HydrophobicContact CD2-CD2 4.15Å; L411-F434 HydrophobicContact CD1-CE1 3.74Å; L411-F434 HydrophobicContact CD1-CZ 4.5Å; L411-F434 HydrophobicContact CD2-CE1 3.73Å; L411-F434 HydrophobicContact CD2-CZ 3.86Å; L411-F434 HydrophobicContact CG-CE1 3.69Å; L411-F434 HydrophobicContact CG-CZ 3.96Å; L411-V443 HydrophobicContact CD1-CB 4.45Å; L411-V443 HydrophobicContact CD1-CG1 3.8Å; L411-L444 HydrophobicContact CD1-CB 4.44Å; L411-L444 HydrophobicContact CD2-CD1 3.77Å; L411-Q447 HydrophobicContact CB-CG 4.05Å; L411-Q447 HydrophobicContact CD1-CB 4.26Å; L411-Q447 HydrophobicContact CD1-CG 3.85Å
412	Q	91.7	Very high	93.9	Very high	137 Å²	137	44.7 Å²	44.7	64%	0.64	24%	0.237	S	C	*	.	H	α-helix	trans	-63.2	-38.5	178.6	-76.3	177.1	-12.1	0	0	112.6	T408 A409	T408-Q412 HydrophobicContact CG2-CG 4.24Å; T408-Q412 WeakPolarHBondContact O-CB 3.17Å; T408-Q412 VanDerWaalsContact O-CG 3.28Å; T408-Q412 WeakPolarHBondContact O-CG 3.47Å; T408-Q412 PolarHBondContact O-N 3.02Å; A409-Q412 PolarHBondContact O-N 3.44Å
413	K	90.5	Very high	93.9	Very high	92 Å²	92	49.2 Å²	49.2	40%	0.4	26%	0.255	S	S	.	.	H	α-helix	trans	-76.7	-42.4	-179.6	-171.4	-176.9	-179.1	-174.2	0	112.3	M359 R362 V364 A409 L411	M359-K413 PolarHBondContact O-NZ 3.26Å; R362-K413 PolarHBondContact O-NZ 2.86Å; V364-K413 HydrophobicContact CG2-CB 4.22Å; V364-K413 HydrophobicContact CG2-CD 4.35Å; V364-K413 HydrophobicContact CG2-CG 4.39Å; A409-K413 WeakPolarHBondContact O-CB 3.44Å; A409-K413 PolarHBondContact O-N 3.39Å; L411-K413 VanDerWaalsContact C-N 3.34Å; L411-K413 PolarHBondContact O-N 3.3Å
414	G	90.2	Very high	93.9	Very high	5 Å²	5	51 Å²	51	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-122.4	-20.8	-163.5	0	0	0	0	0	117.6	I410 T416 H417 L418	I410-G414 PolarHBondContact O-N 3.38Å; G414-T416 PolarHBondContact O-N 3.17Å; G414-H417 PolarHBondContact O-N 3.38Å; G414-L418 WeakPolarHBondContact O-CG 3.4Å; G414-L418 PolarHBondContact O-N 2.99Å
415	L	93.9	Very high	94	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-46.2	-169.8	-177.9	67	0	0	0	112.1	L411 H417 L418 L419 L427 L430 L444 Q447	L411-L415 HydrophobicContact CB-CB 4.31Å; L411-L415 HydrophobicContact CD2-CB 4.19Å; L411-L415 HydrophobicContact CD2-CD1 4.26Å; L411-L415 HydrophobicContact CD2-CD2 4.19Å; L411-L415 HydrophobicContact CD2-CG 4.44Å; L411-L415 WeakPolarHBondContact O-CB 3.49Å; L411-L415 PolarHBondContact O-N 3.47Å; L415-H417 VanDerWaalsContact C-N 3.33Å; L415-H417 PolarHBondContact O-N 2.84Å; L415-L418 PolarHBondContact O-N 3.27Å; L415-L419 HydrophobicContact CD1-CD1 4.03Å; L415-L419 HydrophobicContact CD1-CG 4.13Å; L415-L419 HydrophobicContact CD2-CD1 4.3Å; L415-L419 HydrophobicContact CG-CD1 3.8Å; L415-L419 HydrophobicContact CG-CG 4.26Å; L415-L419 WeakPolarHBondContact O-CB 3.4Å; L415-L419 VanDerWaalsContact O-CG 3.27Å; L415-L419 WeakPolarHBondContact O-CG 3.36Å; L415-L419 PolarHBondContact O-N 3.04Å; L415-L427 HydrophobicContact CD1-CD2 4.23Å; L415-L430 HydrophobicContact CD1-CD1 4.41Å; L415-L444 HydrophobicContact CD1-CD1 4.04Å; L415-L444 HydrophobicContact CD2-CD1 4.21Å; L415-Q447 HydrophobicContact CD2-CB 3.57Å
416	T	93.4	Very high	94.1	Very high	78 Å²	78	52.9 Å²	52.9	48%	0.479	27%	0.266	S	S	.	.	H	α-helix	trans	-57.2	-47	-179.9	-52.8	0	0	0	0	111.4	G414 L419 D420 Y451	G414-T416 PolarHBondContact O-N 3.17Å; T416-L419 PolarHBondContact O-N 3.37Å; T416-D420 WeakPolarHBondContact O-CB 3.26Å; T416-D420 PolarHBondContact O-N 3Å; T416-Y451 HydrophobicContact CG2-CD2 4.18Å; T416-Y451 HydrophobicContact CG2-CE2 4.16Å
417	H	94	Very high	94.2	Very high	90 Å²	90	51.7 Å²	51.7	42%	0.417	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-44.8	178.9	-179.9	-93.4	0	0	0	112.4	G414 L415 L419 D420 E421	G414-H417 PolarHBondContact O-N 3.38Å; L415-H417 VanDerWaalsContact C-N 3.33Å; L415-H417 PolarHBondContact O-N 2.84Å; H417-L419 VanDerWaalsContact C-N 3.28Å; H417-L419 PolarHBondContact O-N 3.38Å; H417-D420 PolarHBondContact O-N 3.13Å; H417-E421 IonicContact CE1-OE1 3.34Å; H417-E421 IonicContact CE1-OE2 2.6Å; H417-E421 PolarHBondContact CE1-OE2 2.75Å; H417-E421 IonicContact ND1-OE2 3.88Å; H417-E421 VanDerWaalsContact NE2-CD 3.28Å; H417-E421 IonicContact NE2-OE1 2.73Å; H417-E421 PolarHBondContact NE2-OE1 3.17Å; H417-E421 IonicContact NE2-OE2 3.77Å; H417-E421 WeakPolarHBondContact O-CB 3.46Å; H417-E421 PolarHBondContact O-N 3.06Å
418	L	95.2	Very high	94.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.6	-40.9	176.1	-72.7	175.7	0	0	0	112.3	V364 P365 G414 L415 N422 R423 D426 L427 L430	V364-L418 HydrophobicContact CG1-CD1 4.21Å; P365-L418 HydrophobicContact CG-CD2 3.87Å; G414-L418 WeakPolarHBondContact O-CG 3.4Å; G414-L418 PolarHBondContact O-N 2.99Å; L415-L418 PolarHBondContact O-N 3.27Å; L418-N422 PolarHBondContact O-N 2.83Å; L418-R423 HydrophobicContact CD2-CB 3.97Å; L418-R423 HydrophobicContact CD2-CG 4.39Å; L418-R423 PolarHBondContact O-N 3.11Å; L418-D426 HydrophobicContact CD2-CB 3.56Å; L418-L427 HydrophobicContact CB-CD2 3.83Å; L418-L427 HydrophobicContact CB-CG 4.23Å; L418-L427 HydrophobicContact CD1-CD2 4.39Å; L418-L430 HydrophobicContact CD1-CD1 3.85Å
419	L	95.3	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-72.2	-45.1	179.5	-68.5	177.9	0	0	0	111.6	L415 T416 H417 N422 L427 W448 Y451 K479 I483	L415-L419 HydrophobicContact CD1-CD1 4.03Å; L415-L419 HydrophobicContact CD1-CG 4.13Å; L415-L419 HydrophobicContact CD2-CD1 4.3Å; L415-L419 HydrophobicContact CG-CD1 3.8Å; L415-L419 HydrophobicContact CG-CG 4.26Å; L415-L419 WeakPolarHBondContact O-CB 3.4Å; L415-L419 VanDerWaalsContact O-CG 3.27Å; L415-L419 WeakPolarHBondContact O-CG 3.36Å; L415-L419 PolarHBondContact O-N 3.04Å; T416-L419 PolarHBondContact O-N 3.37Å; H417-L419 VanDerWaalsContact C-N 3.28Å; H417-L419 PolarHBondContact O-N 3.38Å; L419-N422 PolarHBondContact O-N 3.31Å; L419-L427 HydrophobicContact CD2-CD1 3.83Å; L419-L427 HydrophobicContact CD2-CD2 3.67Å; L419-L427 HydrophobicContact CD2-CG 4.42Å; L419-L427 HydrophobicContact CG-CD2 4.26Å; L419-W448 HydrophobicContact CD1-CE3 3.87Å; L419-W448 HydrophobicContact CD1-CZ3 3.97Å; L419-W448 HydrophobicContact CD2-CE3 4.12Å; L419-W448 HydrophobicContact CD2-CZ3 3.55Å; L419-W448 HydrophobicContact CG-CZ3 4.42Å; L419-Y451 HydrophobicContact CB-CD1 4.43Å; L419-Y451 HydrophobicContact CB-CD2 4.33Å; L419-Y451 HydrophobicContact CB-CE1 3.86Å; L419-Y451 HydrophobicContact CB-CE2 3.73Å; L419-Y451 VanDerWaalsContact CB-CZ 3.47Å; L419-Y451 HydrophobicContact CD1-CD1 3.42Å; L419-Y451 VanDerWaalsContact CD1-CD1 3.42Å; L419-Y451 HydrophobicContact CD1-CD2 3.82Å; L419-Y451 HydrophobicContact CD1-CE1 3.71Å; L419-Y451 HydrophobicContact CD1-CE2 4.06Å; L419-Y451 HydrophobicContact CD1-CG 3.48Å; L419-Y451 VanDerWaalsContact CD1-CG 3.48Å; L419-Y451 HydrophobicContact CG-CE1 4.34Å; L419-K479 WeakPolarHBondContact O-CE 3.47Å; L419-K479 PolarHBondContact O-NZ 2.97Å; L419-I483 HydrophobicContact CD2-CD1 4.04Å
420	D	92.9	Very high	94.8	Very high	75 Å²	75	47.7 Å²	47.7	40%	0.401	23%	0.233	S	C	.	.	H	α-helix	trans	-62	-49	179.6	-74.8	-26.6	0	0	0	111.5	T416 H417 N422 Y451 K479	T416-D420 WeakPolarHBondContact O-CB 3.26Å; T416-D420 PolarHBondContact O-N 3Å; H417-D420 PolarHBondContact O-N 3.13Å; D420-N422 PolarHBondContact O-N 3.47Å; D420-Y451 PolarHBondContact OD1-OH 3.38Å; D420-K479 PolarHBondContact O-NZ 3.09Å
421	E	94.8	Very high	94.9	Very high	100 Å²	100	48.7 Å²	48.7	47%	0.467	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-3.5	177.4	-66.5	-160.6	154.1	0	0	114.2	H417 R423	H417-E421 IonicContact CE1-OE1 3.34Å; H417-E421 IonicContact CE1-OE2 2.6Å; H417-E421 PolarHBondContact CE1-OE2 2.75Å; H417-E421 IonicContact ND1-OE2 3.88Å; H417-E421 VanDerWaalsContact NE2-CD 3.28Å; H417-E421 IonicContact NE2-OE1 2.73Å; H417-E421 PolarHBondContact NE2-OE1 3.17Å; H417-E421 IonicContact NE2-OE2 3.77Å; H417-E421 WeakPolarHBondContact O-CB 3.46Å; H417-E421 PolarHBondContact O-N 3.06Å; E421-R423 HydrophobicContact CB-CG 3.98Å; E421-R423 PolarHBondContact O-N 3.31Å; E421-R423 IonicContact OE2-CZ 2.97Å; E421-R423 IonicContact OE2-NE 2.69Å; E421-R423 PolarHBondContact OE2-NE 3.48Å; E421-R423 IonicContact OE2-NH2 3.16Å; E421-R423 PolarHBondContact OE2-NH2 3.06Å
422	N	93.9	Very high	95	Very high	62 Å²	62	53.5 Å²	53.5	33%	0.332	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	44	179.3	-163.1	52.4	0	0	0	113.3	L418 L419 D420 I424	L418-N422 PolarHBondContact O-N 2.83Å; L419-N422 PolarHBondContact O-N 3.31Å; D420-N422 PolarHBondContact O-N 3.47Å; N422-I424 VanDerWaalsContact C-N 3.33Å; N422-I424 PolarHBondContact O-N 3.1Å; N422-I424 WeakPolarHBondContact OD1-CD1 3.47Å
423	R	95.5	Very high	95.2	Very high	96 Å²	96	47.1 Å²	47.1	36%	0.362	23%	0.229	S	C	.	.			trans	-77.6	79	-179.7	-63.4	-154.5	-178.8	-168	-0.9	112.1	L418 E421 Q425 D426 L427	L418-R423 HydrophobicContact CD2-CB 3.97Å; L418-R423 HydrophobicContact CD2-CG 4.39Å; L418-R423 PolarHBondContact O-N 3.11Å; E421-R423 HydrophobicContact CB-CG 3.98Å; E421-R423 PolarHBondContact O-N 3.31Å; E421-R423 IonicContact OE2-CZ 2.97Å; E421-R423 IonicContact OE2-NE 2.69Å; E421-R423 PolarHBondContact OE2-NE 3.48Å; E421-R423 IonicContact OE2-NH2 3.16Å; E421-R423 PolarHBondContact OE2-NH2 3.06Å; R423-Q425 VanDerWaalsContact C-N 3.32Å; R423-Q425 PolarHBondContact O-N 3.08Å; R423-D426 HydrophobicContact CB-CB 4.09Å; R423-D426 WeakPolarHBondContact CD-OD2 3.33Å; R423-D426 IonicContact NH1-OD2 2.82Å; R423-D426 PolarHBondContact O-N 3.28Å; R423-L427 WeakPolarHBondContact O-CB 3.45Å; R423-L427 VanDerWaalsContact O-CG 3.29Å; R423-L427 WeakPolarHBondContact O-CG 3.43Å; R423-L427 PolarHBondContact O-N 3.17Å
424	I	96.1	Very high	95.5	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.185	21%	0.21	C	C	.	.	H	α-helix	trans	-56.5	-41	-174.3	-57.5	-54.9	0	0	0	113.1	N422 S428 I483 I486 C487	N422-I424 VanDerWaalsContact C-N 3.33Å; N422-I424 PolarHBondContact O-N 3.1Å; N422-I424 WeakPolarHBondContact OD1-CD1 3.47Å; I424-S428 WeakPolarHBondContact O-CB 3.05Å; I424-S428 PolarHBondContact O-N 3.36Å; I424-S428 PolarHBondContact O-OG 3.28Å; I424-I483 HydrophobicContact CD1-CG1 4.01Å; I424-I486 HydrophobicContact CG2-CB 4.37Å; I424-I486 HydrophobicContact CG2-CG2 3.72Å; I424-C487 PolarHBondContact O-SG 2.92Å
425	Q	95.4	Very high	95.8	Very high	165 Å²	165	45.1 Å²	45.1	77%	0.771	23%	0.226	S	C	*	.	H	α-helix	trans	-64.9	-49.4	-179.2	-66.5	177.4	-4.6	0	0	111.3	R423 L427 S428 L429	R423-Q425 VanDerWaalsContact C-N 3.32Å; R423-Q425 PolarHBondContact O-N 3.08Å; Q425-L427 PolarHBondContact O-N 2.83Å; Q425-S428 WeakPolarHBondContact O-CB 3.4Å; Q425-S428 PolarHBondContact O-N 2.89Å; Q425-L429 PolarHBondContact O-N 3.5Å
426	D	96.9	Very high	95.8	Very high	15 Å²	15	51.1 Å²	51.1	8%	0.08	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-39.4	179.4	-64.2	-39.3	0	0	0	112	H369 L418 R423 L429 L430	H369-D426 IonicContact CE1-OD1 3.08Å; H369-D426 PolarHBondContact CE1-OD1 2.99Å; H369-D426 IonicContact ND1-OD1 3.59Å; L418-D426 HydrophobicContact CD2-CB 3.56Å; R423-D426 HydrophobicContact CB-CB 4.09Å; R423-D426 WeakPolarHBondContact CD-OD2 3.33Å; R423-D426 IonicContact NH1-OD2 2.82Å; R423-D426 PolarHBondContact O-N 3.28Å; D426-L429 PolarHBondContact O-N 3.42Å; D426-L430 VanDerWaalsContact O-CB 3.28Å; D426-L430 WeakPolarHBondContact O-CB 3.36Å; D426-L430 PolarHBondContact O-N 3.45Å
427	L	97.4	Very high	95.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-38.2	176.4	-72.5	168	0	0	0	112.2	L415 L418 L419 R423 Q425 L430 Y431 I483 C487	L415-L427 HydrophobicContact CD1-CD2 4.23Å; L418-L427 HydrophobicContact CB-CD2 3.83Å; L418-L427 HydrophobicContact CB-CG 4.23Å; L418-L427 HydrophobicContact CD1-CD2 4.39Å; L419-L427 HydrophobicContact CD2-CD1 3.83Å; L419-L427 HydrophobicContact CD2-CD2 3.67Å; L419-L427 HydrophobicContact CD2-CG 4.42Å; L419-L427 HydrophobicContact CG-CD2 4.26Å; R423-L427 WeakPolarHBondContact O-CB 3.45Å; R423-L427 VanDerWaalsContact O-CG 3.29Å; R423-L427 WeakPolarHBondContact O-CG 3.43Å; R423-L427 PolarHBondContact O-N 3.17Å; Q425-L427 PolarHBondContact O-N 2.83Å; L427-L430 PolarHBondContact O-N 3.44Å; L427-Y431 PolarHBondContact O-N 3.46Å; L427-I483 HydrophobicContact CD1-CD1 4.31Å; L427-I483 HydrophobicContact CD1-CG1 4.36Å; L427-I483 HydrophobicContact CD1-CG2 4.25Å; L427-C487 HydrophobicContact CB-CB 3.91Å
428	S	97.6	Very high	95.6	Very high	24 Å²	24	55.9 Å²	55.9	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-45.4	175.3	-57.6	0	0	0	0	110.7	I424 Q425 Y431 Q432 C487	I424-S428 WeakPolarHBondContact O-CB 3.05Å; I424-S428 PolarHBondContact O-N 3.36Å; I424-S428 PolarHBondContact O-OG 3.28Å; Q425-S428 WeakPolarHBondContact O-CB 3.4Å; Q425-S428 PolarHBondContact O-N 2.89Å; S428-Y431 PolarHBondContact O-N 3.44Å; S428-Q432 WeakPolarHBondContact O-CG 3.23Å; S428-Q432 PolarHBondContact O-N 3.03Å; S428-C487 WeakPolarHBondContact OG-CA 3.25Å
429	L	97.7	Very high	95.4	Very high	18 Å²	18	57.4 Å²	57.4	9%	0.094	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-44.4	176.5	-179	59.9	0	0	0	111.4	L368 N372 Q425 D426 Y431 Q432 L433	L368-L429 HydrophobicContact CB-CD2 3.88Å; L368-L429 HydrophobicContact CB-CG 4.28Å; N372-L429 HydrophobicContact CB-CD1 4.02Å; Q425-L429 PolarHBondContact O-N 3.5Å; D426-L429 PolarHBondContact O-N 3.42Å; L429-Y431 VanDerWaalsContact C-N 3.33Å; L429-Y431 PolarHBondContact O-N 3.16Å; L429-Q432 PolarHBondContact O-N 3.33Å; L429-L433 HydrophobicContact CD1-CD1 3.94Å; L429-L433 HydrophobicContact CD1-CG 4.07Å; L429-L433 HydrophobicContact CG-CD1 3.89Å; L429-L433 HydrophobicContact CG-CG 4.41Å; L429-L433 WeakPolarHBondContact O-CB 3.44Å; L429-L433 WeakPolarHBondContact O-CG 3.5Å; L429-L433 PolarHBondContact O-N 3Å
430	L	97.3	Very high	95.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-55.7	-49.3	175.7	-173.2	153	0	0	0	110.7	L368 L411 L415 L418 D426 L427 Q432 L433 F434 L444	L368-L430 HydrophobicContact CD1-CB 3.73Å; L368-L430 HydrophobicContact CD1-CD1 4.05Å; L368-L430 HydrophobicContact CD1-CG 4.1Å; L411-L430 HydrophobicContact CD2-CD1 4.13Å; L411-L430 HydrophobicContact CD2-CD2 4.15Å; L415-L430 HydrophobicContact CD1-CD1 4.41Å; L418-L430 HydrophobicContact CD1-CD1 3.85Å; D426-L430 VanDerWaalsContact O-CB 3.28Å; D426-L430 WeakPolarHBondContact O-CB 3.36Å; D426-L430 PolarHBondContact O-N 3.45Å; L427-L430 PolarHBondContact O-N 3.44Å; L430-Q432 PolarHBondContact O-N 3.45Å; L430-L433 PolarHBondContact O-N 2.87Å; L430-F434 HydrophobicContact CD2-CD2 4.05Å; L430-F434 HydrophobicContact CD2-CE2 4.27Å; L430-F434 HydrophobicContact CD2-CG 4.2Å; L430-F434 HydrophobicContact CG-CD2 4.03Å; L430-F434 HydrophobicContact CG-CE2 3.99Å; L430-F434 VanDerWaalsContact O-CB 3.32Å; L430-F434 WeakPolarHBondContact O-CB 3.28Å; L430-F434 WeakPolarHBondContact O-CD2 3.4Å; L430-F434 PolarHBondContact O-N 2.98Å; L430-L444 HydrophobicContact CD2-CD1 3.65Å; L430-L444 HydrophobicContact CD2-CD2 3.68Å; L430-L444 HydrophobicContact CD2-CG 4.27Å
431	Y	97.7	Very high	95.5	Very high	23 Å²	23	55.5 Å²	55.5	9%	0.09	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-42.9	-180	178.3	-107.5	0	0	0	112.7	L427 S428 L429 F434 S435 V441 L444 C487 F488 L489 N491 F494	L427-Y431 PolarHBondContact O-N 3.46Å; S428-Y431 PolarHBondContact O-N 3.44Å; L429-Y431 VanDerWaalsContact C-N 3.33Å; L429-Y431 PolarHBondContact O-N 3.16Å; Y431-F434 PolarHBondContact O-N 3.42Å; Y431-S435 WeakPolarHBondContact O-CB 3.5Å; Y431-S435 PolarHBondContact O-N 3.49Å; Y431-S435 PolarHBondContact O-OG 2.66Å; Y431-V441 HydrophobicContact CE2-CG1 4.5Å; Y431-L444 HydrophobicContact CD2-CD2 3.98Å; Y431-C487 WeakPolarHBondContact CB-O 3.24Å; Y431-C487 VanDerWaalsContact CD1-O 3.28Å; Y431-C487 WeakPolarHBondContact CD1-O 3.32Å; Y431-F488 HydrophobicContact CD1-CD1 4.5Å; Y431-F488 HydrophobicContact CD2-CB 4.36Å; Y431-F488 AromaticContact CD2-CD1 3.68Å; Y431-F488 HydrophobicContact CD2-CD1 3.68Å; Y431-F488 HydrophobicContact CD2-CE1 4.37Å; Y431-F488 HydrophobicContact CD2-CG 4.27Å; Y431-F488 HydrophobicContact CE2-CB 4.34Å; Y431-F488 HydrophobicContact CE2-CD1 4.45Å; Y431-F488 AromaticContact CG-CD1 3.71Å; Y431-F488 HydrophobicContact CG-CD1 3.71Å; Y431-F488 HydrophobicContact CG-CE1 4.47Å; Y431-L489 HydrophobicContact CD1-CG 4.48Å; Y431-L489 HydrophobicContact CE1-CB 4.44Å; Y431-L489 HydrophobicContact CE1-CD1 4.14Å; Y431-L489 HydrophobicContact CE1-CG 4.17Å; Y431-N491 PolarHBondContact OH-ND2 3Å; Y431-F494 AromaticContact CE2-CE2 3.93Å; Y431-F494 HydrophobicContact CE2-CE2 3.93Å; Y431-F494 HydrophobicContact CE2-CZ 4.4Å
432	Q	96.8	Very high	95.6	Very high	104 Å²	104	57.7 Å²	57.7	49%	0.486	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-45.4	177.1	-72.6	175.8	-0.1	0	0	112	S428 L429 L430 S435	S428-Q432 WeakPolarHBondContact O-CG 3.23Å; S428-Q432 PolarHBondContact O-N 3.03Å; L429-Q432 PolarHBondContact O-N 3.33Å; L430-Q432 PolarHBondContact O-N 3.45Å; Q432-S435 PolarHBondContact O-N 3.3Å
433	L	96.7	Very high	95.7	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-44.2	179	-68.7	174	0	0	0	111.7	L368 V371 L375 L403 L429 L430 S435 R436	L368-L433 HydrophobicContact CB-CD1 4.04Å; L368-L433 HydrophobicContact CD2-CD1 3.82Å; L368-L433 HydrophobicContact CG-CD1 4.49Å; V371-L433 HydrophobicContact CG1-CD2 4.35Å; L375-L433 HydrophobicContact CD1-CD2 3.81Å; L403-L433 HydrophobicContact CD1-CB 3.91Å; L403-L433 HydrophobicContact CD1-CD2 4.28Å; L403-L433 HydrophobicContact CD2-CB 4.26Å; L429-L433 HydrophobicContact CD1-CD1 3.94Å; L429-L433 HydrophobicContact CD1-CG 4.07Å; L429-L433 HydrophobicContact CG-CD1 3.89Å; L429-L433 HydrophobicContact CG-CG 4.41Å; L429-L433 WeakPolarHBondContact O-CB 3.44Å; L429-L433 WeakPolarHBondContact O-CG 3.5Å; L429-L433 PolarHBondContact O-N 3Å; L430-L433 PolarHBondContact O-N 2.87Å; L433-S435 PolarHBondContact O-N 3.43Å; L433-R436 WeakPolarHBondContact O-CB 3.44Å; L433-R436 PolarHBondContact O-N 2.98Å; L433-R436 VanDerWaalsContact O-N 3.16Å
434	F	96.5	Very high	95.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.9	-23.9	179	-84.1	-123.7	0	0	0	112.8	L407 I410 L411 L430 Y431 R436 V437 G440 L444	L407-F434 HydrophobicContact CB-CE1 4.22Å; L407-F434 HydrophobicContact CD2-CD1 3.68Å; L407-F434 HydrophobicContact CD2-CD2 4.39Å; L407-F434 HydrophobicContact CD2-CE1 3.52Å; L407-F434 HydrophobicContact CD2-CE2 4.27Å; L407-F434 HydrophobicContact CD2-CG 4.11Å; L407-F434 HydrophobicContact CD2-CZ 3.85Å; L407-F434 HydrophobicContact CG-CE1 4.47Å; I410-F434 HydrophobicContact CB-CZ 4.1Å; I410-F434 HydrophobicContact CD1-CE2 4.35Å; I410-F434 HydrophobicContact CD1-CZ 4.32Å; I410-F434 HydrophobicContact CG2-CE2 4.07Å; I410-F434 HydrophobicContact CG2-CZ 3.85Å; L411-F434 HydrophobicContact CD1-CE1 3.74Å; L411-F434 HydrophobicContact CD1-CZ 4.5Å; L411-F434 HydrophobicContact CD2-CE1 3.73Å; L411-F434 HydrophobicContact CD2-CZ 3.86Å; L411-F434 HydrophobicContact CG-CE1 3.69Å; L411-F434 HydrophobicContact CG-CZ 3.96Å; L430-F434 HydrophobicContact CD2-CD2 4.05Å; L430-F434 HydrophobicContact CD2-CE2 4.27Å; L430-F434 HydrophobicContact CD2-CG 4.2Å; L430-F434 HydrophobicContact CG-CD2 4.03Å; L430-F434 HydrophobicContact CG-CE2 3.99Å; L430-F434 VanDerWaalsContact O-CB 3.32Å; L430-F434 WeakPolarHBondContact O-CB 3.28Å; L430-F434 WeakPolarHBondContact O-CD2 3.4Å; L430-F434 PolarHBondContact O-N 2.98Å; Y431-F434 PolarHBondContact O-N 3.42Å; F434-R436 VanDerWaalsContact C-N 3.26Å; F434-R436 PolarHBondContact O-N 2.9Å; F434-V437 PolarHBondContact O-N 3.4Å; F434-G440 WeakPolarHBondContact O-CA 2.95Å; F434-L444 HydrophobicContact CD1-CB 4.18Å
435	S	96.1	Very high	95.8	Very high	56 Å²	56	51.6 Å²	51.6	39%	0.392	25%	0.249	S	C	.	.	H	α-helix	trans	-70.1	-21.8	175.3	-64	0	0	0	0	113.5	Y431 Q432 L433	Y431-S435 WeakPolarHBondContact O-CB 3.5Å; Y431-S435 PolarHBondContact O-N 3.49Å; Y431-S435 PolarHBondContact O-OG 2.66Å; Q432-S435 PolarHBondContact O-N 3.3Å; L433-S435 PolarHBondContact O-N 3.43Å
436	R	93.9	Very high	95.8	Very high	130 Å²	130	49.1 Å²	49.1	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-76.7	-30.5	177.5	-65.6	167.8	169.4	-95.1	2.2	112.6	E399 L433 F434	E399-R436 HydrophobicContact CG-CB 4.37Å; E399-R436 WeakPolarHBondContact OE1-CB 3.39Å; E399-R436 WeakPolarHBondContact OE1-CD 3.19Å; E399-R436 IonicContact OE1-NH1 3.49Å; E399-R436 PolarHBondContact OE1-NH1 3.49Å; E399-R436 VanDerWaalsContact OE1-NH1 3.17Å; L433-R436 WeakPolarHBondContact O-CB 3.44Å; L433-R436 PolarHBondContact O-N 2.98Å; L433-R436 VanDerWaalsContact O-N 3.16Å; F434-R436 VanDerWaalsContact C-N 3.26Å; F434-R436 PolarHBondContact O-N 2.9Å
437	V	94.1	Very high	95.7	Very high	20 Å²	20	51.1 Å²	51.1	12%	0.121	25%	0.247	C	C	.	.	S	Bend	trans	-90.6	134.4	-175.3	-173.8	0	0	0	0	111.3	E399 L403 L407 F434 G439 G440	E399-V437 HydrophobicContact CB-CG2 4.44Å; L403-V437 HydrophobicContact CB-CG2 3.58Å; L403-V437 HydrophobicContact CD1-CG2 4.02Å; L403-V437 HydrophobicContact CG-CG2 4.48Å; L407-V437 HydrophobicContact CD1-CG1 3.93Å; L407-V437 HydrophobicContact CD2-CB 4.41Å; L407-V437 HydrophobicContact CD2-CG1 4.46Å; F434-V437 PolarHBondContact O-N 3.4Å; V437-G439 PolarHBondContact O-N 2.96Å; V437-G440 PolarHBondContact O-N 2.71Å
438	R	90.1	Very high	95.7	Very high	247 Å²	247	51.1 Å²	51.1	93%	0.932	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	121.3	174.4	-170.7	178.5	-175.3	178	1.5	110.5	G440	R438-G440 VanDerWaalsContact C-N 3.27Å; R438-G440 PolarHBondContact O-N 3.29Å
439	G	91.8	Very high	95.6	Very high	32 Å²	32	51.5 Å²	51.5	33%	0.33	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-9.1	-178.2	0	0	0	0	0	114.8	V437 V441 Q442 V443	V437-G439 PolarHBondContact O-N 2.96Å; G439-V441 PolarHBondContact O-N 3.3Å; G439-Q442 WeakPolarHBondContact O-CB 3.33Å; G439-Q442 PolarHBondContact O-N 3.02Å; G439-Q442 VanDerWaalsContact O-N 3.08Å; G439-V443 WeakPolarHBondContact O-CG2 3.29Å; G439-V443 PolarHBondContact O-N 3.25Å
440	G	94.6	Very high	95.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-48.9	-179.2	0	0	0	0	0	112.9	F434 V437 R438 Q442 V443 L444	F434-G440 WeakPolarHBondContact O-CA 2.95Å; V437-G440 PolarHBondContact O-N 2.71Å; R438-G440 VanDerWaalsContact C-N 3.27Å; R438-G440 PolarHBondContact O-N 3.29Å; G440-Q442 VanDerWaalsContact C-N 3.26Å; G440-Q442 PolarHBondContact O-N 2.88Å; G440-V443 PolarHBondContact O-N 3.2Å; G440-L444 WeakPolarHBondContact O-CB 3.47Å; G440-L444 PolarHBondContact O-N 2.99Å
441	V	95.5	Very high	95.5	Very high	36 Å²	36	56.4 Å²	56.4	22%	0.218	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-36.4	176.2	-174.9	0	0	0	0	112.3	Y431 G439 L445 F494	Y431-V441 HydrophobicContact CE2-CG1 4.5Å; G439-V441 PolarHBondContact O-N 3.3Å; V441-L445 VanDerWaalsContact O-CB 3.31Å; V441-L445 WeakPolarHBondContact O-CB 3.43Å; V441-L445 PolarHBondContact O-N 3.47Å; V441-F494 HydrophobicContact CG1-CE2 3.88Å; V441-F494 HydrophobicContact CG1-CZ 4.4Å
442	Q	95.4	Very high	95.5	Very high	146 Å²	146	55.3 Å²	55.3	68%	0.682	26%	0.264	S	S	*	.	H	α-helix	trans	-69.7	-43	-179.4	-176.5	178.2	4.6	0	0	111.6	G439 G440 L445 Q446	G439-Q442 WeakPolarHBondContact O-CB 3.33Å; G439-Q442 PolarHBondContact O-N 3.02Å; G439-Q442 VanDerWaalsContact O-N 3.08Å; G440-Q442 VanDerWaalsContact C-N 3.26Å; G440-Q442 PolarHBondContact O-N 2.88Å; Q442-L445 PolarHBondContact O-N 2.68Å; Q442-Q446 PolarHBondContact O-N 3.47Å
443	V	95.9	Very high	95.5	Very high	34 Å²	34	52.6 Å²	52.6	21%	0.206	25%	0.25	C	S	.	.	H	α-helix	trans	-66.9	-41	177.3	-176.1	0	0	0	0	110.5	L411 G439 G440 L445 Q446 Q447	L411-V443 HydrophobicContact CD1-CB 4.45Å; L411-V443 HydrophobicContact CD1-CG1 3.8Å; G439-V443 WeakPolarHBondContact O-CG2 3.29Å; G439-V443 PolarHBondContact O-N 3.25Å; G440-V443 PolarHBondContact O-N 3.2Å; V443-L445 PolarHBondContact O-N 3.02Å; V443-Q446 PolarHBondContact O-N 3.22Å; V443-Q447 PolarHBondContact O-N 2.93Å; V443-Q447 VanDerWaalsContact O-N 3.1Å
444	L	97.1	Very high	95.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-45.1	173.7	176.9	58.7	0	0	0	111.6	L411 L415 L430 Y431 F434 G440 Q446 Q447 W448 F488 F494	L411-L444 HydrophobicContact CD1-CB 4.44Å; L411-L444 HydrophobicContact CD2-CD1 3.77Å; L415-L444 HydrophobicContact CD1-CD1 4.04Å; L415-L444 HydrophobicContact CD2-CD1 4.21Å; L430-L444 HydrophobicContact CD2-CD1 3.65Å; L430-L444 HydrophobicContact CD2-CD2 3.68Å; L430-L444 HydrophobicContact CD2-CG 4.27Å; Y431-L444 HydrophobicContact CD2-CD2 3.98Å; F434-L444 HydrophobicContact CD1-CB 4.18Å; G440-L444 WeakPolarHBondContact O-CB 3.47Å; G440-L444 PolarHBondContact O-N 2.99Å; L444-Q446 VanDerWaalsContact C-N 3.3Å; L444-Q446 PolarHBondContact O-N 3.01Å; L444-Q447 PolarHBondContact O-N 3.29Å; L444-W448 VanDerWaalsContact O-CB 3.24Å; L444-W448 WeakPolarHBondContact O-CB 3.34Å; L444-W448 PolarHBondContact O-N 2.75Å; L444-F488 HydrophobicContact CD2-CE1 4.31Å; L444-F494 HydrophobicContact CB-CZ 4.45Å; L444-F494 HydrophobicContact CD2-CE1 4.42Å; L444-F494 HydrophobicContact CD2-CZ 3.98Å; L444-F494 HydrophobicContact CG-CE1 4.1Å; L444-F494 HydrophobicContact CG-CZ 3.91Å
445	L	96.8	Very high	95.4	Very high	32 Å²	32	58.5 Å²	58.5	17%	0.168	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-41	177.7	-170.7	70.6	0	0	0	111.8	V441 Q442 V443 W448 I449 K493 F494 A497	V441-L445 VanDerWaalsContact O-CB 3.31Å; V441-L445 WeakPolarHBondContact O-CB 3.43Å; V441-L445 PolarHBondContact O-N 3.47Å; Q442-L445 PolarHBondContact O-N 2.68Å; V443-L445 PolarHBondContact O-N 3.02Å; L445-W448 WeakPolarHBondContact O-CB 3.48Å; L445-W448 PolarHBondContact O-N 3.3Å; L445-I449 HydrophobicContact CG-CD1 4.29Å; L445-I449 WeakPolarHBondContact O-CD1 3.27Å; L445-I449 VanDerWaalsContact O-CG1 3.27Å; L445-I449 WeakPolarHBondContact O-CG1 3.5Å; L445-I449 PolarHBondContact O-N 3.43Å; L445-K493 HydrophobicContact CD2-CB 4.32Å; L445-F494 HydrophobicContact CB-CE1 4.4Å; L445-F494 HydrophobicContact CB-CZ 4.16Å; L445-F494 HydrophobicContact CD1-CB 4.3Å; L445-F494 HydrophobicContact CD1-CD1 3.63Å; L445-F494 HydrophobicContact CD1-CD2 3.83Å; L445-F494 HydrophobicContact CD1-CE1 3.78Å; L445-F494 HydrophobicContact CD1-CE2 3.97Å; L445-F494 HydrophobicContact CD1-CG 3.66Å; L445-F494 HydrophobicContact CD1-CZ 3.94Å; L445-A497 HydrophobicContact CD1-CB 3.62Å; L445-A497 HydrophobicContact CG-CB 4.18Å
446	Q	95.6	Very high	95.4	Very high	113 Å²	113	55.9 Å²	55.9	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-62.8	-48.7	177.3	-173	-178.2	14.2	0	0	111.7	Q442 V443 L444 W448 I449 E450	Q442-Q446 PolarHBondContact O-N 3.47Å; V443-Q446 PolarHBondContact O-N 3.22Å; L444-Q446 VanDerWaalsContact C-N 3.3Å; L444-Q446 PolarHBondContact O-N 3.01Å; Q446-W448 VanDerWaalsContact C-N 3.32Å; Q446-W448 PolarHBondContact O-N 3.27Å; Q446-I449 PolarHBondContact O-N 3Å; Q446-E450 PolarHBondContact O-N 3.41Å; Q446-E450 VanDerWaalsContact O-N 3.11Å
447	Q	95.5	Very high	95.4	Very high	57 Å²	57	50.4 Å²	50.4	27%	0.266	25%	0.251	S	S	.	.	H	α-helix	trans	-67.8	-33.7	179.3	-65	-57.8	-53	0	0	112.2	L411 L415 V443 L444 E450 Y451	L411-Q447 HydrophobicContact CB-CG 4.05Å; L411-Q447 HydrophobicContact CD1-CB 4.26Å; L411-Q447 HydrophobicContact CD1-CG 3.85Å; L415-Q447 HydrophobicContact CD2-CB 3.57Å; V443-Q447 PolarHBondContact O-N 2.93Å; V443-Q447 VanDerWaalsContact O-N 3.1Å; L444-Q447 PolarHBondContact O-N 3.29Å; Q447-E450 PolarHBondContact O-N 3.39Å; Q447-Y451 WeakPolarHBondContact O-CB 3.49Å; Q447-Y451 PolarHBondContact O-N 3.28Å
448	W	96.1	Very high	95.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-45.7	172.1	172.5	-108.6	0	0	0	112.6	L419 L444 L445 Q446 Y451 I452 V480 I483 I484 F488 F494	L419-W448 HydrophobicContact CD1-CE3 3.87Å; L419-W448 HydrophobicContact CD1-CZ3 3.97Å; L419-W448 HydrophobicContact CD2-CE3 4.12Å; L419-W448 HydrophobicContact CD2-CZ3 3.55Å; L419-W448 HydrophobicContact CG-CZ3 4.42Å; L444-W448 VanDerWaalsContact O-CB 3.24Å; L444-W448 WeakPolarHBondContact O-CB 3.34Å; L444-W448 PolarHBondContact O-N 2.75Å; L445-W448 WeakPolarHBondContact O-CB 3.48Å; L445-W448 PolarHBondContact O-N 3.3Å; Q446-W448 VanDerWaalsContact C-N 3.32Å; Q446-W448 PolarHBondContact O-N 3.27Å; W448-Y451 PolarHBondContact O-N 2.97Å; W448-I452 HydrophobicContact CD2-CD1 3.95Å; W448-I452 HydrophobicContact CD2-CG1 4.41Å; W448-I452 VanDerWaalsContact CE2-CD1 3.41Å; W448-I452 HydrophobicContact CG-CD1 4.32Å; W448-I452 HydrophobicContact CH2-CD1 4.44Å; W448-I452 HydrophobicContact CZ2-CD1 3.74Å; W448-I452 WeakPolarHBondContact O-CG1 3.38Å; W448-I452 PolarHBondContact O-N 3.27Å; W448-V480 HydrophobicContact CH2-CB 4.46Å; W448-V480 HydrophobicContact CH2-CG1 3.96Å; W448-V480 HydrophobicContact CH2-CG2 4.4Å; W448-V480 HydrophobicContact CZ2-CG1 3.6Å; W448-I483 HydrophobicContact CH2-CB 4.19Å; W448-I483 HydrophobicContact CH2-CD1 4.47Å; W448-I483 HydrophobicContact CH2-CG2 3.89Å; W448-I483 HydrophobicContact CZ3-CG2 4.15Å; W448-I484 HydrophobicContact CZ2-CD1 3.96Å; W448-I484 HydrophobicContact CZ2-CG1 3.74Å; W448-F488 AromaticContact CD2-CE2 3.94Å; W448-F488 HydrophobicContact CD2-CE2 3.94Å; W448-F488 AromaticContact CE2-CE2 3.99Å; W448-F488 AromaticContact CE3-CE2 3.98Å; W448-F488 HydrophobicContact CE3-CE2 3.98Å; W448-F488 HydrophobicContact CE3-CZ 4.31Å; W448-F488 HydrophobicContact CH2-CE2 4.1Å; W448-F488 HydrophobicContact CZ2-CE2 4.04Å; W448-F488 HydrophobicContact CZ3-CE2 4.08Å; W448-F488 HydrophobicContact CZ3-CZ 4.47Å; W448-F494 HydrophobicContact CB-CD1 4.42Å; W448-F494 HydrophobicContact CB-CE1 4.11Å; W448-F494 AromaticContact CD1-CD1 3.56Å; W448-F494 HydrophobicContact CD2-CD1 4.38Å; W448-F494 AromaticContact CG-CD1 3.89Å; W448-F494 HydrophobicContact CG-CD1 3.89Å; W448-F494 HydrophobicContact CG-CE1 4.06Å; W448-F494 AromaticContact NE1-CD1 3.79Å
449	I	96.6	Very high	95.7	Very high	32 Å²	32	41.5 Å²	41.5	16%	0.164	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-48.3	176.2	-70.2	163	0	0	0	110.7	L445 Q446 Y451 I452 K453 A497 A501	L445-I449 HydrophobicContact CG-CD1 4.29Å; L445-I449 WeakPolarHBondContact O-CD1 3.27Å; L445-I449 VanDerWaalsContact O-CG1 3.27Å; L445-I449 WeakPolarHBondContact O-CG1 3.5Å; L445-I449 PolarHBondContact O-N 3.43Å; Q446-I449 PolarHBondContact O-N 3Å; I449-Y451 PolarHBondContact O-N 3.01Å; I449-I452 PolarHBondContact O-N 3.41Å; I449-K453 HydrophobicContact CG2-CD 3.94Å; I449-K453 HydrophobicContact CG2-CG 4.48Å; I449-K453 WeakPolarHBondContact O-CB 3.2Å; I449-K453 WeakPolarHBondContact O-CG 3.27Å; I449-K453 PolarHBondContact O-N 2.67Å; I449-A497 HydrophobicContact CD1-CB 3.77Å; I449-A497 HydrophobicContact CG1-CB 3.7Å; I449-A501 HydrophobicContact CG2-CB 4.33Å
450	E	95.7	Very high	95.8	Very high	100 Å²	100	40 Å²	40	47%	0.467	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-41.6	-179.7	-70.4	-57.5	149.6	0	0	111.8	Q446 Q447 K453 A454	Q446-E450 PolarHBondContact O-N 3.41Å; Q446-E450 VanDerWaalsContact O-N 3.11Å; Q447-E450 PolarHBondContact O-N 3.39Å; E450-K453 PolarHBondContact O-N 3.06Å; E450-A454 VanDerWaalsContact O-CB 3.23Å; E450-A454 WeakPolarHBondContact O-CB 3.46Å; E450-A454 PolarHBondContact O-N 3.35Å
451	Y	96.6	Very high	95.8	Very high	20 Å²	20	43.8 Å²	43.8	8%	0.078	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-49.8	173.9	169.8	-91.2	0	0	0	111.7	T416 L419 D420 Q447 W448 I449 K453 A454 F455 F476	T416-Y451 HydrophobicContact CG2-CD2 4.18Å; T416-Y451 HydrophobicContact CG2-CE2 4.16Å; L419-Y451 HydrophobicContact CB-CD1 4.43Å; L419-Y451 HydrophobicContact CB-CD2 4.33Å; L419-Y451 HydrophobicContact CB-CE1 3.86Å; L419-Y451 HydrophobicContact CB-CE2 3.73Å; L419-Y451 VanDerWaalsContact CB-CZ 3.47Å; L419-Y451 HydrophobicContact CD1-CD1 3.42Å; L419-Y451 VanDerWaalsContact CD1-CD1 3.42Å; L419-Y451 HydrophobicContact CD1-CD2 3.82Å; L419-Y451 HydrophobicContact CD1-CE1 3.71Å; L419-Y451 HydrophobicContact CD1-CE2 4.06Å; L419-Y451 HydrophobicContact CD1-CG 3.48Å; L419-Y451 VanDerWaalsContact CD1-CG 3.48Å; L419-Y451 HydrophobicContact CG-CE1 4.34Å; D420-Y451 PolarHBondContact OD1-OH 3.38Å; Q447-Y451 WeakPolarHBondContact O-CB 3.49Å; Q447-Y451 PolarHBondContact O-N 3.28Å; W448-Y451 PolarHBondContact O-N 2.97Å; I449-Y451 PolarHBondContact O-N 3.01Å; Y451-K453 VanDerWaalsContact C-N 3.31Å; Y451-K453 PolarHBondContact O-N 3.28Å; Y451-A454 PolarHBondContact O-N 2.97Å; Y451-F455 WeakPolarHBondContact O-CB 3.26Å; Y451-F455 PolarHBondContact O-N 3.32Å; Y451-F476 HydrophobicContact CE1-CE2 4.23Å; Y451-F476 HydrophobicContact CE1-CZ 4.42Å
452	I	97.6	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-45.6	179.2	-70.8	172.5	0	0	0	110.6	W448 I449 G456 F476 V480 M498 A501 F502 F505	W448-I452 HydrophobicContact CD2-CD1 3.95Å; W448-I452 HydrophobicContact CD2-CG1 4.41Å; W448-I452 VanDerWaalsContact CE2-CD1 3.41Å; W448-I452 HydrophobicContact CG-CD1 4.32Å; W448-I452 HydrophobicContact CH2-CD1 4.44Å; W448-I452 HydrophobicContact CZ2-CD1 3.74Å; W448-I452 WeakPolarHBondContact O-CG1 3.38Å; W448-I452 PolarHBondContact O-N 3.27Å; I449-I452 PolarHBondContact O-N 3.41Å; I452-G456 WeakPolarHBondContact O-CA 3.15Å; I452-G456 PolarHBondContact O-N 3.4Å; I452-F476 HydrophobicContact CG1-CZ 4.42Å; I452-F476 HydrophobicContact CG2-CE1 4.22Å; I452-F476 HydrophobicContact CG2-CZ 4.4Å; I452-V480 HydrophobicContact CD1-CG1 3.97Å; I452-V480 HydrophobicContact CG1-CG2 4.47Å; I452-M498 HydrophobicContact CD1-CB 4.13Å; I452-M498 HydrophobicContact CD1-CG 4.14Å; I452-A501 HydrophobicContact CB-CB 4.08Å; I452-A501 HydrophobicContact CG2-CB 3.67Å; I452-F502 HydrophobicContact CG2-CD2 3.71Å; I452-F502 HydrophobicContact CG2-CE2 3.68Å; I452-F505 HydrophobicContact CG2-CD1 4.08Å; I452-F505 HydrophobicContact CG2-CE1 3.78Å
453	K	96.6	Very high	95.3	Very high	47 Å²	47	42 Å²	42	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-42.5	179.3	-73.7	177.3	-179.5	174.9	0	111.7	I449 E450 Y451 S457 A501 T504	I449-K453 HydrophobicContact CG2-CD 3.94Å; I449-K453 HydrophobicContact CG2-CG 4.48Å; I449-K453 WeakPolarHBondContact O-CB 3.2Å; I449-K453 WeakPolarHBondContact O-CG 3.27Å; I449-K453 PolarHBondContact O-N 2.67Å; E450-K453 PolarHBondContact O-N 3.06Å; Y451-K453 VanDerWaalsContact C-N 3.31Å; Y451-K453 PolarHBondContact O-N 3.28Å; K453-S457 WeakPolarHBondContact O-CB 3.44Å; K453-S457 PolarHBondContact O-N 2.87Å; K453-S457 PolarHBondContact O-OG 3.33Å; K453-A501 HydrophobicContact CG-CB 4.07Å; K453-T504 HydrophobicContact CD-CG2 4.38Å
454	A	95.6	Very high	95	Very high	59 Å²	59	48.6 Å²	48.6	49%	0.488	25%	0.254	S	S	.	.	H	α-helix	trans	-66.1	-56	-180	0	0	0	0	0	111.1	E450 Y451 S457 T458	E450-A454 VanDerWaalsContact O-CB 3.23Å; E450-A454 WeakPolarHBondContact O-CB 3.46Å; E450-A454 PolarHBondContact O-N 3.35Å; Y451-A454 PolarHBondContact O-N 2.97Å; A454-S457 WeakPolarHBondContact O-CB 3.4Å; A454-S457 PolarHBondContact O-N 3.25Å; A454-T458 WeakPolarHBondContact O-CG2 3.48Å; A454-T458 PolarHBondContact O-N 3Å
455	F	95.8	Very high	94.7	Very high	68 Å²	68	52.1 Å²	52.1	30%	0.298	27%	0.27	S	S	.	.	H	α-helix	trans	-61.4	-48.8	180	-171	-90.5	0	0	0	111.3	Y451 S457 T458 I459 F476	Y451-F455 WeakPolarHBondContact O-CB 3.26Å; Y451-F455 PolarHBondContact O-N 3.32Å; F455-S457 VanDerWaalsContact C-N 3.3Å; F455-S457 PolarHBondContact O-N 3.38Å; F455-T458 WeakPolarHBondContact O-CB 3.39Å; F455-T458 PolarHBondContact O-N 3.02Å; F455-T458 PolarHBondContact O-OG1 3.39Å; F455-I459 HydrophobicContact CD1-CD1 3.99Å; F455-I459 HydrophobicContact CE1-CD1 3.81Å; F455-I459 HydrophobicContact CE1-CG1 4.36Å; F455-I459 PolarHBondContact O-N 3Å; F455-F476 HydrophobicContact CB-CE2 4.41Å; F455-F476 HydrophobicContact CB-CZ 4.08Å; F455-F476 HydrophobicContact CD1-CD1 4.1Å; F455-F476 AromaticContact CD1-CD2 3.5Å; F455-F476 HydrophobicContact CD1-CD2 3.5Å; F455-F476 VanDerWaalsContact CD1-CD2 3.5Å; F455-F476 AromaticContact CD1-CE1 3.93Å; F455-F476 HydrophobicContact CD1-CE1 3.93Å; F455-F476 AromaticContact CD1-CE2 3.31Å; F455-F476 HydrophobicContact CD1-CE2 3.31Å; F455-F476 AromaticContact CD1-CG 3.9Å; F455-F476 HydrophobicContact CD1-CG 3.9Å; F455-F476 AromaticContact CD1-CZ 3.54Å; F455-F476 HydrophobicContact CD1-CZ 3.54Å; F455-F476 HydrophobicContact CE1-CB 4.44Å; F455-F476 AromaticContact CE1-CD2 3.5Å; F455-F476 HydrophobicContact CE1-CD2 3.5Å; F455-F476 VanDerWaalsContact CE1-CD2 3.5Å; F455-F476 AromaticContact CE1-CE2 3.78Å; F455-F476 HydrophobicContact CE1-CE2 3.78Å; F455-F476 AromaticContact CE1-CG 3.91Å; F455-F476 HydrophobicContact CE1-CG 3.91Å; F455-F476 HydrophobicContact CE1-CZ 4.39Å; F455-F476 HydrophobicContact CG-CE2 4.06Å; F455-F476 HydrophobicContact CG-CZ 4.17Å
456	G	95.8	Very high	94.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-37	177.6	0	0	0	0	0	113.4	I452 T458 I459 V460 F505	I452-G456 WeakPolarHBondContact O-CA 3.15Å; I452-G456 PolarHBondContact O-N 3.4Å; G456-T458 VanDerWaalsContact C-N 3.28Å; G456-T458 PolarHBondContact O-N 2.93Å; G456-I459 WeakPolarHBondContact O-CB 3.43Å; G456-I459 PolarHBondContact O-N 3.21Å; G456-I459 VanDerWaalsContact O-N 3.17Å; G456-V460 PolarHBondContact O-N 3.17Å; G456-F505 VanDerWaalsContact CA-CE2 3.47Å; G456-F505 WeakPolarHBondContact O-CD2 3.46Å
457	S	95.3	Very high	94.3	Very high	16 Å²	16	56.4 Å²	56.4	11%	0.112	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-36.2	173.7	-69.9	0	0	0	0	112.3	K453 A454 F455 I459 V460 I461	K453-S457 WeakPolarHBondContact O-CB 3.44Å; K453-S457 PolarHBondContact O-N 2.87Å; K453-S457 PolarHBondContact O-OG 3.33Å; A454-S457 WeakPolarHBondContact O-CB 3.4Å; A454-S457 PolarHBondContact O-N 3.25Å; F455-S457 VanDerWaalsContact C-N 3.3Å; F455-S457 PolarHBondContact O-N 3.38Å; S457-I459 VanDerWaalsContact C-N 3.26Å; S457-I459 PolarHBondContact O-N 2.97Å; S457-V460 PolarHBondContact O-N 2.88Å; S457-I461 VanDerWaalsContact O-CB 3.27Å; S457-I461 WeakPolarHBondContact O-CB 3.28Å; S457-I461 WeakPolarHBondContact O-CG1 3.27Å; S457-I461 PolarHBondContact O-N 3.21Å
458	T	94.6	Very high	94.2	Very high	76 Å²	76	56.9 Å²	56.9	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-29.9	177.5	74.7	0	0	0	0	112.8	A454 F455 G456	A454-T458 WeakPolarHBondContact O-CG2 3.48Å; A454-T458 PolarHBondContact O-N 3Å; F455-T458 WeakPolarHBondContact O-CB 3.39Å; F455-T458 PolarHBondContact O-N 3.02Å; F455-T458 PolarHBondContact O-OG1 3.39Å; G456-T458 VanDerWaalsContact C-N 3.28Å; G456-T458 PolarHBondContact O-N 2.93Å
459	I	95.1	Very high	94.2	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.015	29%	0.294	C	S	.	.	H	α-helix	trans	-71.1	-47	177.1	-59.6	172.1	0	0	0	109.9	F455 G456 S457 M469 E472 L473 F476	F455-I459 HydrophobicContact CD1-CD1 3.99Å; F455-I459 HydrophobicContact CE1-CD1 3.81Å; F455-I459 HydrophobicContact CE1-CG1 4.36Å; F455-I459 PolarHBondContact O-N 3Å; G456-I459 WeakPolarHBondContact O-CB 3.43Å; G456-I459 PolarHBondContact O-N 3.21Å; G456-I459 VanDerWaalsContact O-N 3.17Å; S457-I459 VanDerWaalsContact C-N 3.26Å; S457-I459 PolarHBondContact O-N 2.97Å; I459-M469 HydrophobicContact CG2-CG 4.3Å; I459-M469 WeakPolarHBondContact O-CE 3.31Å; I459-E472 HydrophobicContact CD1-CB 4.43Å; I459-E472 HydrophobicContact CG2-CB 3.78Å; I459-L473 HydrophobicContact CB-CD2 4.49Å; I459-L473 HydrophobicContact CD1-CD2 4.48Å; I459-L473 HydrophobicContact CG2-CD2 4.04Å; I459-L473 HydrophobicContact CG2-CG 3.94Å; I459-F476 HydrophobicContact CD1-CB 3.96Å; I459-F476 HydrophobicContact CD1-CD1 4Å; I459-F476 HydrophobicContact CD1-CG 4.08Å
460	V	95	Very high	94.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-88.9	-29.5	-170	-57.2	0	0	0	0	114.4	G456 S457 M469 L473 F505 R509	G456-V460 PolarHBondContact O-N 3.17Å; S457-V460 PolarHBondContact O-N 2.88Å; V460-M469 HydrophobicContact CB-SD 4.33Å; V460-M469 HydrophobicContact CG1-CG 4.49Å; V460-M469 HydrophobicContact CG1-SD 4.31Å; V460-M469 VanDerWaalsContact O-CE 3.28Å; V460-M469 WeakPolarHBondContact O-CE 3.43Å; V460-L473 HydrophobicContact CG1-CD1 4.11Å; V460-L473 HydrophobicContact CG1-CD2 3.93Å; V460-L473 HydrophobicContact CG1-CG 4.39Å; V460-F505 HydrophobicContact CG1-CD2 4.33Å; V460-F505 HydrophobicContact CG1-CE2 4.21Å; V460-F505 HydrophobicContact CG2-CD2 4.27Å; V460-F505 WeakPolarHBondContact CG2-O 3.5Å; V460-R509 HydrophobicContact CG2-CB 4.48Å; V460-R509 WeakPolarHBondContact O-CD 3.44Å
461	I	93.4	Very high	94.1	Very high	80 Å²	80	55 Å²	55	41%	0.41	29%	0.285	S	S	.	.	H	α-helix	trans	-76.4	-38	-170.3	-67.9	173.7	0	0	0	112.6	S457 P463 K508	S457-I461 VanDerWaalsContact O-CB 3.27Å; S457-I461 WeakPolarHBondContact O-CB 3.28Å; S457-I461 WeakPolarHBondContact O-CG1 3.27Å; S457-I461 PolarHBondContact O-N 3.21Å; I461-P463 VanDerWaalsContact O-CD 3.26Å; I461-P463 WeakPolarHBondContact O-CD 3.47Å; I461-K508 HydrophobicContact CD1-CD 4.01Å
462	N	90.3	Very high	94	Very high	61 Å²	61	56.7 Å²	56.7	33%	0.326	29%	0.294	S	S	.	.			trans	-77	115.5	-172.9	-173.4	-7.3	0	0	0	111.6	E464 K465	N462-E464 PolarHBondContact O-N 3.31Å; N462-E464 WeakPolarHBondContact OD1-CB 3.33Å; N462-E464 PolarHBondContact OD1-N 3.42Å; N462-K465 HydrophobicContact CB-CG 4.45Å; N462-K465 PolarHBondContact O-N 3.32Å; N462-K465 VanDerWaalsContact O-N 3.14Å
463	P	91.1	Very high	94	Very high	85 Å²	85	56.8 Å²	56.8	55%	0.552	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-61.6	-25.8	178.9	-21.7	34.5	0	0	0	114.4	I461 K465 D466	I461-P463 VanDerWaalsContact O-CD 3.26Å; I461-P463 WeakPolarHBondContact O-CD 3.47Å; P463-K465 PolarHBondContact O-N 2.65Å; P463-D466 VanDerWaalsContact O-CB 3.29Å; P463-D466 WeakPolarHBondContact O-CB 3.18Å; P463-D466 PolarHBondContact O-N 3.14Å; P463-D466 VanDerWaalsContact O-N 3.17Å
464	E	90	Very high	94	Very high	171 Å²	171	55.1 Å²	55.1	80%	0.799	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-65.5	-27	178.9	-62.4	-178.6	162.7	0	0	112.1	N462 D466	N462-E464 PolarHBondContact O-N 3.31Å; N462-E464 WeakPolarHBondContact OD1-CB 3.33Å; N462-E464 PolarHBondContact OD1-N 3.42Å; E464-D466 VanDerWaalsContact C-N 3.35Å
465	K	90.4	Very high	94	Very high	75 Å²	75	56.3 Å²	56.3	33%	0.326	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-87.2	3.4	177.6	-67.3	-168.7	167.6	-161.2	0	113.9	N462 P463 K467 T468 M469 E472	N462-K465 HydrophobicContact CB-CG 4.45Å; N462-K465 PolarHBondContact O-N 3.32Å; N462-K465 VanDerWaalsContact O-N 3.14Å; P463-K465 PolarHBondContact O-N 2.65Å; K465-K467 PolarHBondContact O-N 3.44Å; K465-T468 PolarHBondContact O-N 3.47Å; K465-T468 PolarHBondContact O-OG1 3.38Å; K465-M469 PolarHBondContact O-N 3.34Å; K465-E472 IonicContact NZ-OE2 2.82Å
466	D	92.3	Very high	94.1	Very high	31 Å²	31	53.4 Å²	53.4	17%	0.166	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.2	-177.9	-81.7	5.4	0	0	0	113.8	P463 E464 M469 R509 K512 L516	P463-D466 VanDerWaalsContact O-CB 3.29Å; P463-D466 WeakPolarHBondContact O-CB 3.18Å; P463-D466 PolarHBondContact O-N 3.14Å; P463-D466 VanDerWaalsContact O-N 3.17Å; E464-D466 VanDerWaalsContact C-N 3.35Å; D466-M469 VanDerWaalsContact OD1-CE 3.25Å; D466-M469 WeakPolarHBondContact OD1-CE 3.37Å; D466-R509 VanDerWaalsContact CG-NH2 3.29Å; D466-R509 IonicContact OD1-CZ 3.7Å; D466-R509 IonicContact OD1-NH1 3.62Å; D466-R509 PolarHBondContact OD1-NH1 2.92Å; D466-R509 IonicContact OD1-NH2 3.31Å; D466-R509 PolarHBondContact OD1-NH2 3.36Å; D466-R509 IonicContact OD2-CZ 3.96Å; D466-R509 IonicContact OD2-NH1 3.59Å; D466-R509 IonicContact OD2-NH2 3.82Å; D466-R509 PolarHBondContact OD2-NH2 3.02Å; D466-K512 WeakPolarHBondContact OD2-CE 2.95Å; D466-L516 HydrophobicContact CB-CD1 3.96Å; D466-L516 HydrophobicContact CB-CD2 4.48Å
467	K	90.4	Very high	94.1	Very high	204 Å²	204	54.1 Å²	54.1	89%	0.887	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-35	179.2	-66	-179.8	-177.7	171.3	0	113.3	K465	K465-K467 PolarHBondContact O-N 3.44Å
468	T	94.2	Very high	94.2	Very high	66 Å²	66	56.2 Å²	56.2	41%	0.405	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-12.8	-176.4	54.2	0	0	0	0	112.8	K465 V470 Q471 E472	K465-T468 PolarHBondContact O-N 3.47Å; K465-T468 PolarHBondContact O-OG1 3.38Å; T468-V470 PolarHBondContact O-N 3.2Å; T468-V470 VanDerWaalsContact O-N 3.17Å; T468-Q471 PolarHBondContact O-N 2.84Å; T468-E472 VanDerWaalsContact CB-OE1 3.27Å; T468-E472 WeakPolarHBondContact CB-OE1 3.44Å; T468-E472 PolarHBondContact O-N 2.9Å; T468-E472 PolarHBondContact OG1-OE1 3.48Å
469	M	95.8	Very high	94.3	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-43.7	-53	-174.4	-178.8	174.5	-57.6	0	0	114.8	I459 V460 K465 D466 Q471 E472 L473 L516	I459-M469 HydrophobicContact CG2-CG 4.3Å; I459-M469 WeakPolarHBondContact O-CE 3.31Å; V460-M469 HydrophobicContact CB-SD 4.33Å; V460-M469 HydrophobicContact CG1-CG 4.49Å; V460-M469 HydrophobicContact CG1-SD 4.31Å; V460-M469 VanDerWaalsContact O-CE 3.28Å; V460-M469 WeakPolarHBondContact O-CE 3.43Å; K465-M469 PolarHBondContact O-N 3.34Å; D466-M469 VanDerWaalsContact OD1-CE 3.25Å; D466-M469 WeakPolarHBondContact OD1-CE 3.37Å; M469-Q471 VanDerWaalsContact C-N 3.34Å; M469-Q471 PolarHBondContact O-N 3.13Å; M469-E472 PolarHBondContact O-N 3.47Å; M469-L473 HydrophobicContact CG-CD1 4.16Å; M469-L473 WeakPolarHBondContact O-CB 3.5Å; M469-L473 VanDerWaalsContact O-CG 3.28Å; M469-L473 WeakPolarHBondContact O-CG 3.38Å; M469-L473 PolarHBondContact O-N 3.38Å; M469-L516 HydrophobicContact CB-CD1 4.26Å; M469-L516 HydrophobicContact CE-CD1 4.1Å; M469-L516 HydrophobicContact CG-CD1 4.48Å; M469-L516 HydrophobicContact SD-CD1 3.64Å
470	V	95.6	Very high	94.4	Very high	12 Å²	12	54.9 Å²	54.9	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-39	-175.9	-178.1	0	0	0	0	111.3	T468 L473 L474 L516 I517 H520	T468-V470 PolarHBondContact O-N 3.2Å; T468-V470 VanDerWaalsContact O-N 3.17Å; V470-L473 PolarHBondContact O-N 3.48Å; V470-L474 HydrophobicContact CG1-CD1 4.29Å; V470-L474 VanDerWaalsContact O-CG 3.29Å; V470-L474 WeakPolarHBondContact O-CG 3.42Å; V470-L474 PolarHBondContact O-N 2.99Å; V470-L474 VanDerWaalsContact O-N 3.11Å; V470-L516 HydrophobicContact CG2-CB 3.92Å; V470-I517 HydrophobicContact CG1-CG1 4.09Å; V470-I517 HydrophobicContact CG2-CG1 3.82Å; V470-H520 HydrophobicContact CB-CB 4.17Å; V470-H520 HydrophobicContact CG1-CB 3.93Å; V470-H520 HydrophobicContact CG2-CB 4.15Å
471	Q	94.6	Very high	94.5	Very high	80 Å²	80	57.4 Å²	57.4	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-67.9	-46.7	177.4	-171.6	62.7	54.2	0	0	110.7	T468 M469 L473 L474 D475	T468-Q471 PolarHBondContact O-N 2.84Å; M469-Q471 VanDerWaalsContact C-N 3.34Å; M469-Q471 PolarHBondContact O-N 3.13Å; Q471-L473 VanDerWaalsContact C-N 3.27Å; Q471-L473 PolarHBondContact O-N 3.4Å; Q471-L474 PolarHBondContact O-N 2.71Å; Q471-L474 VanDerWaalsContact O-N 3.11Å; Q471-D475 PolarHBondContact NE2-OD1 2.68Å; Q471-D475 PolarHBondContact O-N 2.89Å
472	E	96	Very high	94.6	Very high	56 Å²	56	57.7 Å²	57.7	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-36.3	175.9	-74.8	179.6	-141.6	0	0	112	I459 K465 T468 M469 F476	I459-E472 HydrophobicContact CD1-CB 4.43Å; I459-E472 HydrophobicContact CG2-CB 3.78Å; K465-E472 IonicContact NZ-OE2 2.82Å; T468-E472 VanDerWaalsContact CB-OE1 3.27Å; T468-E472 WeakPolarHBondContact CB-OE1 3.44Å; T468-E472 PolarHBondContact O-N 2.9Å; T468-E472 PolarHBondContact OG1-OE1 3.48Å; M469-E472 PolarHBondContact O-N 3.47Å; E472-F476 WeakPolarHBondContact O-CB 2.79Å; E472-F476 PolarHBondContact O-N 3.1Å
473	L	96.8	Very high	95	Very high	2 Å²	2	55 Å²	55	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-41	174.5	-76.8	174.4	0	0	0	112.9	I459 V460 M469 V470 Q471 K477 F505 I506	I459-L473 HydrophobicContact CB-CD2 4.49Å; I459-L473 HydrophobicContact CD1-CD2 4.48Å; I459-L473 HydrophobicContact CG2-CD2 4.04Å; I459-L473 HydrophobicContact CG2-CG 3.94Å; V460-L473 HydrophobicContact CG1-CD1 4.11Å; V460-L473 HydrophobicContact CG1-CD2 3.93Å; V460-L473 HydrophobicContact CG1-CG 4.39Å; M469-L473 HydrophobicContact CG-CD1 4.16Å; M469-L473 WeakPolarHBondContact O-CB 3.5Å; M469-L473 VanDerWaalsContact O-CG 3.28Å; M469-L473 WeakPolarHBondContact O-CG 3.38Å; M469-L473 PolarHBondContact O-N 3.38Å; V470-L473 PolarHBondContact O-N 3.48Å; Q471-L473 VanDerWaalsContact C-N 3.27Å; Q471-L473 PolarHBondContact O-N 3.4Å; L473-K477 WeakPolarHBondContact O-CB 3.22Å; L473-K477 PolarHBondContact O-N 2.87Å; L473-F505 HydrophobicContact CD2-CE2 3.64Å; L473-F505 HydrophobicContact CD2-CZ 4Å; L473-I506 HydrophobicContact CD2-CG1 4.44Å
474	L	96	Very high	95.3	Very high	12 Å²	12	51.2 Å²	51.2	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-48.2	177.6	-69.7	167.4	0	0	0	110.6	V470 Q471 F476 K477 D478 K543 I544 I547	V470-L474 HydrophobicContact CG1-CD1 4.29Å; V470-L474 VanDerWaalsContact O-CG 3.29Å; V470-L474 WeakPolarHBondContact O-CG 3.42Å; V470-L474 PolarHBondContact O-N 2.99Å; V470-L474 VanDerWaalsContact O-N 3.11Å; Q471-L474 PolarHBondContact O-N 2.71Å; Q471-L474 VanDerWaalsContact O-N 3.11Å; L474-F476 VanDerWaalsContact C-N 3.31Å; L474-F476 PolarHBondContact O-N 3.44Å; L474-K477 WeakPolarHBondContact O-CB 3.5Å; L474-K477 PolarHBondContact O-N 3.24Å; L474-D478 PolarHBondContact O-N 3.41Å; L474-K543 HydrophobicContact CD2-CB 3.89Å; L474-I544 HydrophobicContact CD1-CG1 4.13Å; L474-I544 HydrophobicContact CD2-CG1 4.33Å; L474-I547 HydrophobicContact CD2-CG1 3.78Å
475	D	96	Very high	95.6	Very high	83 Å²	83	46.6 Å²	46.6	44%	0.444	23%	0.228	S	C	.	.	H	α-helix	trans	-63.3	-40.3	179.5	-60.1	-18.1	0	0	0	110.9	Q471 D478 K479	Q471-D475 PolarHBondContact NE2-OD1 2.68Å; Q471-D475 PolarHBondContact O-N 2.89Å; D475-D478 PolarHBondContact O-N 3.41Å; D475-K479 WeakPolarHBondContact O-CB 3.47Å; D475-K479 PolarHBondContact O-N 2.88Å
476	F	97.1	Very high	95.9	Very high	7 Å²	7	46.5 Å²	46.5	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-41.5	175.1	-178.2	-130.3	0	0	0	112	Y451 I452 F455 I459 E472 L474 K479 V480 F502 F505	Y451-F476 HydrophobicContact CE1-CE2 4.23Å; Y451-F476 HydrophobicContact CE1-CZ 4.42Å; I452-F476 HydrophobicContact CG1-CZ 4.42Å; I452-F476 HydrophobicContact CG2-CE1 4.22Å; I452-F476 HydrophobicContact CG2-CZ 4.4Å; F455-F476 HydrophobicContact CB-CE2 4.41Å; F455-F476 HydrophobicContact CB-CZ 4.08Å; F455-F476 HydrophobicContact CD1-CD1 4.1Å; F455-F476 AromaticContact CD1-CD2 3.5Å; F455-F476 HydrophobicContact CD1-CD2 3.5Å; F455-F476 VanDerWaalsContact CD1-CD2 3.5Å; F455-F476 AromaticContact CD1-CE1 3.93Å; F455-F476 HydrophobicContact CD1-CE1 3.93Å; F455-F476 AromaticContact CD1-CE2 3.31Å; F455-F476 HydrophobicContact CD1-CE2 3.31Å; F455-F476 AromaticContact CD1-CG 3.9Å; F455-F476 HydrophobicContact CD1-CG 3.9Å; F455-F476 AromaticContact CD1-CZ 3.54Å; F455-F476 HydrophobicContact CD1-CZ 3.54Å; F455-F476 HydrophobicContact CE1-CB 4.44Å; F455-F476 AromaticContact CE1-CD2 3.5Å; F455-F476 HydrophobicContact CE1-CD2 3.5Å; F455-F476 VanDerWaalsContact CE1-CD2 3.5Å; F455-F476 AromaticContact CE1-CE2 3.78Å; F455-F476 HydrophobicContact CE1-CE2 3.78Å; F455-F476 AromaticContact CE1-CG 3.91Å; F455-F476 HydrophobicContact CE1-CG 3.91Å; F455-F476 HydrophobicContact CE1-CZ 4.39Å; F455-F476 HydrophobicContact CG-CE2 4.06Å; F455-F476 HydrophobicContact CG-CZ 4.17Å; I459-F476 HydrophobicContact CD1-CB 3.96Å; I459-F476 HydrophobicContact CD1-CD1 4Å; I459-F476 HydrophobicContact CD1-CG 4.08Å; E472-F476 WeakPolarHBondContact O-CB 2.79Å; E472-F476 PolarHBondContact O-N 3.1Å; L474-F476 VanDerWaalsContact C-N 3.31Å; L474-F476 PolarHBondContact O-N 3.44Å; F476-K479 PolarHBondContact O-N 2.98Å; F476-V480 HydrophobicContact CD2-CG2 3.96Å; F476-V480 HydrophobicContact CE1-CG2 4.32Å; F476-V480 HydrophobicContact CE2-CG2 3.56Å; F476-V480 HydrophobicContact CG-CG2 4.48Å; F476-V480 HydrophobicContact CZ-CG2 3.76Å; F476-V480 WeakPolarHBondContact O-CB 3.11Å; F476-V480 VanDerWaalsContact O-CG2 3.25Å; F476-V480 WeakPolarHBondContact O-CG2 3.23Å; F476-V480 PolarHBondContact O-N 2.85Å; F476-F502 HydrophobicContact CD1-CE1 4.16Å; F476-F502 HydrophobicContact CD1-CE2 4.46Å; F476-F502 AromaticContact CD1-CZ 3.64Å; F476-F502 HydrophobicContact CD1-CZ 3.64Å; F476-F502 HydrophobicContact CE1-CE2 4.17Å; F476-F502 AromaticContact CE1-CZ 3.79Å; F476-F502 HydrophobicContact CE1-CZ 3.79Å; F476-F502 HydrophobicContact CG-CZ 4.46Å; F476-F505 HydrophobicContact CD1-CZ 4.41Å; F476-F505 HydrophobicContact CE1-CE1 4.31Å; F476-F505 HydrophobicContact CE1-CZ 4.3Å
477	K	96.9	Very high	96.1	Very high	16 Å²	16	45.1 Å²	45.1	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-44.5	175.9	-177.7	60.9	166.5	72.3	0	111.9	L473 L474 K479 V480 D481 M498 F502 I547	L473-K477 WeakPolarHBondContact O-CB 3.22Å; L473-K477 PolarHBondContact O-N 2.87Å; L474-K477 WeakPolarHBondContact O-CB 3.5Å; L474-K477 PolarHBondContact O-N 3.24Å; K477-K479 PolarHBondContact O-N 3.43Å; K477-V480 PolarHBondContact O-N 2.86Å; K477-D481 IonicContact NZ-OD1 3.12Å; K477-D481 PolarHBondContact NZ-OD1 2.91Å; K477-D481 IonicContact NZ-OD2 3.63Å; K477-D481 PolarHBondContact NZ-OD2 3.43Å; K477-D481 WeakPolarHBondContact O-CB 3.28Å; K477-D481 PolarHBondContact O-N 3.03Å; K477-M498 HydrophobicContact CD-SD 4.04Å; K477-M498 VanDerWaalsContact CE-SD 3.55Å; K477-F502 HydrophobicContact CB-CE1 3.94Å; K477-F502 HydrophobicContact CB-CZ 4.13Å; K477-F502 HydrophobicContact CD-CD1 4.2Å; K477-F502 HydrophobicContact CD-CE1 3.76Å; K477-F502 HydrophobicContact CD-CE2 4.2Å; K477-F502 HydrophobicContact CD-CZ 3.75Å; K477-F502 HydrophobicContact CG-CE1 4.39Å; K477-I547 HydrophobicContact CB-CD1 3.84Å; K477-I547 HydrophobicContact CD-CD1 4.43Å; K477-I547 HydrophobicContact CG-CD1 3.88Å
478	D	96.6	Very high	96.4	Very high	60 Å²	60	35.4 Å²	35.4	32%	0.321	18%	0.181	S	C	.	.	H	α-helix	trans	-60	-45.7	176.6	-76.1	-25.9	0	0	0	111.1	L474 D475 V480 D481 H482 K543	L474-D478 PolarHBondContact O-N 3.41Å; D475-D478 PolarHBondContact O-N 3.41Å; D478-V480 PolarHBondContact O-N 3.18Å; D478-D481 PolarHBondContact O-N 3.27Å; D478-H482 WeakPolarHBondContact O-CB 3.45Å; D478-H482 PolarHBondContact O-N 3.21Å; D478-K543 IonicContact OD1-NZ 3.93Å; D478-K543 PolarHBondContact OD1-NZ 2.88Å; D478-K543 IonicContact OD2-NZ 3.54Å; D478-K543 PolarHBondContact OD2-NZ 3.46Å
479	K	96.5	Very high	96.5	Very high	49 Å²	49	37.8 Å²	37.8	21%	0.213	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-48.1	175.9	179.2	178.7	177.3	179	0	111.7	L419 D420 D475 F476 K477 H482 I483	L419-K479 WeakPolarHBondContact O-CE 3.47Å; L419-K479 PolarHBondContact O-NZ 2.97Å; D420-K479 PolarHBondContact O-NZ 3.09Å; D475-K479 WeakPolarHBondContact O-CB 3.47Å; D475-K479 PolarHBondContact O-N 2.88Å; F476-K479 PolarHBondContact O-N 2.98Å; K477-K479 PolarHBondContact O-N 3.43Å; K479-H482 PolarHBondContact O-N 2.88Å; K479-I483 HydrophobicContact CG-CD1 4.1Å; K479-I483 WeakPolarHBondContact O-CG1 3.19Å; K479-I483 PolarHBondContact O-N 2.94Å; K479-I483 VanDerWaalsContact O-N 3.1Å
480	V	97.4	Very high	96.4	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-44.7	-179.4	168.4	0	0	0	0	111.4	W448 I452 F476 K477 D478 H482 I483 I484 M498 F502	W448-V480 HydrophobicContact CH2-CB 4.46Å; W448-V480 HydrophobicContact CH2-CG1 3.96Å; W448-V480 HydrophobicContact CH2-CG2 4.4Å; W448-V480 HydrophobicContact CZ2-CG1 3.6Å; I452-V480 HydrophobicContact CD1-CG1 3.97Å; I452-V480 HydrophobicContact CG1-CG2 4.47Å; F476-V480 HydrophobicContact CD2-CG2 3.96Å; F476-V480 HydrophobicContact CE1-CG2 4.32Å; F476-V480 HydrophobicContact CE2-CG2 3.56Å; F476-V480 HydrophobicContact CG-CG2 4.48Å; F476-V480 HydrophobicContact CZ-CG2 3.76Å; F476-V480 WeakPolarHBondContact O-CB 3.11Å; F476-V480 VanDerWaalsContact O-CG2 3.25Å; F476-V480 WeakPolarHBondContact O-CG2 3.23Å; F476-V480 PolarHBondContact O-N 2.85Å; K477-V480 PolarHBondContact O-N 2.86Å; D478-V480 PolarHBondContact O-N 3.18Å; V480-H482 VanDerWaalsContact C-N 3.34Å; V480-H482 PolarHBondContact O-N 3Å; V480-I483 PolarHBondContact O-N 3.17Å; V480-I484 HydrophobicContact CG1-CD1 4.07Å; V480-I484 WeakPolarHBondContact O-CG1 3.2Å; V480-I484 PolarHBondContact O-N 3.25Å; V480-I484 VanDerWaalsContact O-N 3.08Å; V480-M498 HydrophobicContact CG1-CB 4.43Å; V480-M498 HydrophobicContact CG1-CG 3.49Å; V480-M498 VanDerWaalsContact CG1-CG 3.49Å; V480-F502 HydrophobicContact CB-CE2 4.39Å; V480-F502 HydrophobicContact CG1-CE2 4.11Å; V480-F502 HydrophobicContact CG2-CE2 4.3Å; V480-F502 HydrophobicContact CG2-CZ 4.4Å
481	D	96.6	Very high	96.5	Very high	53 Å²	53	45 Å²	45	28%	0.283	22%	0.223	S	C	.	.	H	α-helix	trans	-61.6	-43	176.7	-76.4	-21.9	0	0	0	111.6	K477 D478 I483 I484 D485 M498	K477-D481 IonicContact NZ-OD1 3.12Å; K477-D481 PolarHBondContact NZ-OD1 2.91Å; K477-D481 IonicContact NZ-OD2 3.63Å; K477-D481 PolarHBondContact NZ-OD2 3.43Å; K477-D481 WeakPolarHBondContact O-CB 3.28Å; K477-D481 PolarHBondContact O-N 3.03Å; D478-D481 PolarHBondContact O-N 3.27Å; D481-I483 VanDerWaalsContact C-N 3.34Å; D481-I483 PolarHBondContact O-N 3.43Å; D481-I484 PolarHBondContact O-N 3Å; D481-D485 WeakPolarHBondContact O-CB 3.38Å; D481-D485 PolarHBondContact O-N 3.17Å; D481-M498 WeakPolarHBondContact OD1-CE 3.33Å
482	H	97.1	Very high	96.5	Very high	86 Å²	86	47 Å²	47	40%	0.398	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-41.7	179.1	-173.5	67.8	0	0	0	112.5	D478 K479 V480 D485 I486	D478-H482 WeakPolarHBondContact O-CB 3.45Å; D478-H482 PolarHBondContact O-N 3.21Å; K479-H482 PolarHBondContact O-N 2.88Å; V480-H482 VanDerWaalsContact C-N 3.34Å; V480-H482 PolarHBondContact O-N 3Å; H482-D485 PolarHBondContact O-N 2.9Å; H482-I486 WeakPolarHBondContact CE1-CD1 3.29Å; H482-I486 PolarHBondContact O-N 3Å
483	I	97.3	Very high	96.6	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.015	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-42.7	175.2	-67.5	166.1	0	0	0	110.6	L419 I424 L427 W448 K479 V480 D481 D485 C487 F488	L419-I483 HydrophobicContact CD2-CD1 4.04Å; I424-I483 HydrophobicContact CD1-CG1 4.01Å; L427-I483 HydrophobicContact CD1-CD1 4.31Å; L427-I483 HydrophobicContact CD1-CG1 4.36Å; L427-I483 HydrophobicContact CD1-CG2 4.25Å; W448-I483 HydrophobicContact CH2-CB 4.19Å; W448-I483 HydrophobicContact CH2-CD1 4.47Å; W448-I483 HydrophobicContact CH2-CG2 3.89Å; W448-I483 HydrophobicContact CZ3-CG2 4.15Å; K479-I483 HydrophobicContact CG-CD1 4.1Å; K479-I483 WeakPolarHBondContact O-CG1 3.19Å; K479-I483 PolarHBondContact O-N 2.94Å; K479-I483 VanDerWaalsContact O-N 3.1Å; V480-I483 PolarHBondContact O-N 3.17Å; D481-I483 VanDerWaalsContact C-N 3.34Å; D481-I483 PolarHBondContact O-N 3.43Å; I483-D485 VanDerWaalsContact C-N 3.31Å; I483-D485 PolarHBondContact O-N 2.91Å; I483-C487 HydrophobicContact CG2-CB 4.07Å; I483-C487 WeakPolarHBondContact O-CA 3.35Å; I483-C487 WeakPolarHBondContact O-CB 3.28Å; I483-C487 PolarHBondContact O-N 3.47Å; I483-F488 HydrophobicContact CG2-CD2 4.37Å; I483-F488 HydrophobicContact CG2-CE2 3.9Å; I483-F488 HydrophobicContact CG2-CZ 3.98Å; I483-F488 PolarHBondContact O-N 2.92Å
484	I	97.6	Very high	96.6	Very high	7 Å²	7	50.7 Å²	50.7	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-41.1	177.5	-66.1	167.1	0	0	0	110.8	W448 V480 D481 F488 L489 K490 F494 V495 M498	W448-I484 HydrophobicContact CZ2-CD1 3.96Å; W448-I484 HydrophobicContact CZ2-CG1 3.74Å; V480-I484 HydrophobicContact CG1-CD1 4.07Å; V480-I484 WeakPolarHBondContact O-CG1 3.2Å; V480-I484 PolarHBondContact O-N 3.25Å; V480-I484 VanDerWaalsContact O-N 3.08Å; D481-I484 PolarHBondContact O-N 3Å; I484-F488 HydrophobicContact CG1-CD2 4.14Å; I484-F488 CarbonylContact O-C 3.55Å; I484-L489 PolarHBondContact O-N 3.3Å; I484-K490 PolarHBondContact O-N 3.44Å; I484-F494 HydrophobicContact CG1-CB 4.33Å; I484-F494 HydrophobicContact CG2-CB 4.43Å; I484-V495 HydrophobicContact CG2-CG2 3.73Å; I484-M498 HydrophobicContact CD1-CB 3.89Å; I484-M498 HydrophobicContact CD1-CE 4.27Å; I484-M498 HydrophobicContact CD1-CG 4.09Å
485	D	97.1	Very high	96.6	Very high	74 Å²	74	51.5 Å²	51.5	40%	0.396	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-49.6	-177.2	-159.9	55.5	0	0	0	112	D481 H482 I483 K490	D481-D485 WeakPolarHBondContact O-CB 3.38Å; D481-D485 PolarHBondContact O-N 3.17Å; H482-D485 PolarHBondContact O-N 2.9Å; I483-D485 VanDerWaalsContact C-N 3.31Å; I483-D485 PolarHBondContact O-N 2.91Å; D485-K490 WeakPolarHBondContact OD1-CD 3.25Å; D485-K490 WeakPolarHBondContact OD1-CE 3.43Å; D485-K490 WeakPolarHBondContact OD1-CG 3.45Å; D485-K490 IonicContact OD1-NZ 3.29Å; D485-K490 PolarHBondContact OD1-NZ 3.43Å; D485-K490 IonicContact OD2-NZ 2.7Å
486	I	96.3	Very high	96.7	Very high	73 Å²	73	51.8 Å²	51.8	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-90.8	-56.8	-174.6	-58.2	-170	0	0	0	111.7	I424 H482	I424-I486 HydrophobicContact CG2-CB 4.37Å; I424-I486 HydrophobicContact CG2-CG2 3.72Å; H482-I486 WeakPolarHBondContact CE1-CD1 3.29Å; H482-I486 PolarHBondContact O-N 3Å
487	C	97.1	Very high	96.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-38.8	-170.6	-50.5	0	0	0	0	112.3	I424 L427 S428 Y431 I483	I424-C487 PolarHBondContact O-SG 2.92Å; L427-C487 HydrophobicContact CB-CB 3.91Å; S428-C487 WeakPolarHBondContact OG-CA 3.25Å; Y431-C487 WeakPolarHBondContact CB-O 3.24Å; Y431-C487 VanDerWaalsContact CD1-O 3.28Å; Y431-C487 WeakPolarHBondContact CD1-O 3.32Å; I483-C487 HydrophobicContact CG2-CB 4.07Å; I483-C487 WeakPolarHBondContact O-CA 3.35Å; I483-C487 WeakPolarHBondContact O-CB 3.28Å; I483-C487 PolarHBondContact O-N 3.47Å
488	F	96.6	Very high	96.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-101.7	11.7	-176.3	-53.3	-26.4	0	0	0	113.4	Y431 L444 W448 I483 I484 K490 N491 F494	Y431-F488 HydrophobicContact CD1-CD1 4.5Å; Y431-F488 HydrophobicContact CD2-CB 4.36Å; Y431-F488 AromaticContact CD2-CD1 3.68Å; Y431-F488 HydrophobicContact CD2-CD1 3.68Å; Y431-F488 HydrophobicContact CD2-CE1 4.37Å; Y431-F488 HydrophobicContact CD2-CG 4.27Å; Y431-F488 HydrophobicContact CE2-CB 4.34Å; Y431-F488 HydrophobicContact CE2-CD1 4.45Å; Y431-F488 AromaticContact CG-CD1 3.71Å; Y431-F488 HydrophobicContact CG-CD1 3.71Å; Y431-F488 HydrophobicContact CG-CE1 4.47Å; L444-F488 HydrophobicContact CD2-CE1 4.31Å; W448-F488 AromaticContact CD2-CE2 3.94Å; W448-F488 HydrophobicContact CD2-CE2 3.94Å; W448-F488 AromaticContact CE2-CE2 3.99Å; W448-F488 AromaticContact CE3-CE2 3.98Å; W448-F488 HydrophobicContact CE3-CE2 3.98Å; W448-F488 HydrophobicContact CE3-CZ 4.31Å; W448-F488 HydrophobicContact CH2-CE2 4.1Å; W448-F488 HydrophobicContact CZ2-CE2 4.04Å; W448-F488 HydrophobicContact CZ3-CE2 4.08Å; W448-F488 HydrophobicContact CZ3-CZ 4.47Å; I483-F488 HydrophobicContact CG2-CD2 4.37Å; I483-F488 HydrophobicContact CG2-CE2 3.9Å; I483-F488 HydrophobicContact CG2-CZ 3.98Å; I483-F488 PolarHBondContact O-N 2.92Å; I484-F488 HydrophobicContact CG1-CD2 4.14Å; I484-F488 CarbonylContact O-C 3.55Å; F488-K490 VanDerWaalsContact C-N 3.26Å; F488-K490 PolarHBondContact O-N 2.95Å; F488-N491 VanDerWaalsContact O-CB 3.26Å; F488-N491 WeakPolarHBondContact O-CB 3.48Å; F488-N491 PolarHBondContact O-N 3.11Å; F488-F494 HydrophobicContact CB-CG 4.47Å; F488-F494 HydrophobicContact CD2-CB 4.17Å; F488-F494 AromaticContact CD2-CD1 3.38Å; F488-F494 HydrophobicContact CD2-CD1 3.38Å; F488-F494 HydrophobicContact CD2-CD2 4.48Å; F488-F494 AromaticContact CD2-CE1 3.83Å; F488-F494 HydrophobicContact CD2-CE1 3.83Å; F488-F494 AromaticContact CD2-CG 3.76Å; F488-F494 HydrophobicContact CD2-CG 3.76Å; F488-F494 AromaticContact CE2-CD1 3.52Å; F488-F494 HydrophobicContact CE2-CD1 3.52Å; F488-F494 AromaticContact CE2-CE1 3.71Å; F488-F494 HydrophobicContact CE2-CE1 3.71Å; F488-F494 HydrophobicContact CE2-CG 4.37Å; F488-F494 HydrophobicContact CG-CD1 4.2Å; F488-F494 HydrophobicContact CG-CE1 4.41Å; F488-F494 HydrophobicContact CG-CG 4.34Å; F488-F494 HydrophobicContact CZ-CD1 4.43Å; F488-F494 HydrophobicContact CZ-CE1 4.19Å
489	L	95.4	Very high	96.6	Very high	116 Å²	116	52.8 Å²	52.8	61%	0.607	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	40.2	173.9	-52.3	177.5	0	0	0	113.1	Y431 I484 N491	Y431-L489 HydrophobicContact CD1-CG 4.48Å; Y431-L489 HydrophobicContact CE1-CB 4.44Å; Y431-L489 HydrophobicContact CE1-CD1 4.14Å; Y431-L489 HydrophobicContact CE1-CG 4.17Å; I484-L489 PolarHBondContact O-N 3.3Å; L489-N491 VanDerWaalsContact C-N 3.26Å; L489-N491 PolarHBondContact O-N 3.38Å
490	K	94.9	Very high	96.6	Very high	129 Å²	129	56.1 Å²	56.1	56%	0.561	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	36.1	-176.6	-55.9	178.7	-162.6	-105.5	0	113.8	I484 D485 F488 E492	I484-K490 PolarHBondContact O-N 3.44Å; D485-K490 WeakPolarHBondContact OD1-CD 3.25Å; D485-K490 WeakPolarHBondContact OD1-CE 3.43Å; D485-K490 WeakPolarHBondContact OD1-CG 3.45Å; D485-K490 IonicContact OD1-NZ 3.29Å; D485-K490 PolarHBondContact OD1-NZ 3.43Å; D485-K490 IonicContact OD2-NZ 2.7Å; F488-K490 VanDerWaalsContact C-N 3.26Å; F488-K490 PolarHBondContact O-N 2.95Å; K490-E492 PolarHBondContact O-N 3.5Å; K490-E492 VanDerWaalsContact O-N 3.11Å
491	N	96.2	Very high	96.6	Very high	37 Å²	37	56 Å²	56	20%	0.198	27%	0.272	C	S	.	.			trans	-63.6	115.4	177.6	-174.3	-29.8	0	0	0	111.5	Y431 F488 L489 K493 F494 V495	Y431-N491 PolarHBondContact OH-ND2 3Å; F488-N491 VanDerWaalsContact O-CB 3.26Å; F488-N491 WeakPolarHBondContact O-CB 3.48Å; F488-N491 PolarHBondContact O-N 3.11Å; L489-N491 VanDerWaalsContact C-N 3.26Å; L489-N491 PolarHBondContact O-N 3.38Å; N491-K493 PolarHBondContact O-N 2.92Å; N491-K493 VanDerWaalsContact O-N 3.09Å; N491-K493 WeakPolarHBondContact OD1-CB 3.35Å; N491-K493 PolarHBondContact OD1-N 3.18Å; N491-F494 HydrophobicContact CB-CD2 3.95Å; N491-F494 WeakPolarHBondContact O-CB 3.26Å; N491-F494 PolarHBondContact O-N 2.96Å; N491-V495 PolarHBondContact O-N 3.38Å
492	E	96.1	Very high	96.6	Very high	120 Å²	120	53.5 Å²	53.5	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-54.6	-30.1	-178.5	-71.5	-61.1	145.3	0	0	114.1	K490 F494 V495 N496	K490-E492 PolarHBondContact O-N 3.5Å; K490-E492 VanDerWaalsContact O-N 3.11Å; E492-F494 VanDerWaalsContact C-N 3.31Å; E492-F494 PolarHBondContact O-N 3.48Å; E492-V495 PolarHBondContact O-N 3.44Å; E492-N496 WeakPolarHBondContact O-CB 3.32Å; E492-N496 VanDerWaalsContact O-CG 3.29Å; E492-N496 PolarHBondContact O-N 2.97Å; E492-N496 PolarHBondContact O-ND2 2.88Å
493	K	96.4	Very high	96.5	Very high	137 Å²	137	52.7 Å²	52.7	60%	0.596	26%	0.256	S	S	*	.	H	α-helix	trans	-63.2	-39.5	176	-64.9	-178.1	-179.7	177.5	0	111.5	L445 N491 A497	L445-K493 HydrophobicContact CD2-CB 4.32Å; N491-K493 PolarHBondContact O-N 2.92Å; N491-K493 VanDerWaalsContact O-N 3.09Å; N491-K493 WeakPolarHBondContact OD1-CB 3.35Å; N491-K493 PolarHBondContact OD1-N 3.18Å; K493-A497 WeakPolarHBondContact O-CB 3.49Å; K493-A497 PolarHBondContact O-N 3.44Å
494	F	97.6	Very high	96.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-72.7	-36	177.1	-76.3	-97.9	0	0	0	111.9	Y431 V441 L444 L445 W448 I484 F488 N491 E492 M498	Y431-F494 AromaticContact CE2-CE2 3.93Å; Y431-F494 HydrophobicContact CE2-CE2 3.93Å; Y431-F494 HydrophobicContact CE2-CZ 4.4Å; V441-F494 HydrophobicContact CG1-CE2 3.88Å; V441-F494 HydrophobicContact CG1-CZ 4.4Å; L444-F494 HydrophobicContact CB-CZ 4.45Å; L444-F494 HydrophobicContact CD2-CE1 4.42Å; L444-F494 HydrophobicContact CD2-CZ 3.98Å; L444-F494 HydrophobicContact CG-CE1 4.1Å; L444-F494 HydrophobicContact CG-CZ 3.91Å; L445-F494 HydrophobicContact CB-CE1 4.4Å; L445-F494 HydrophobicContact CB-CZ 4.16Å; L445-F494 HydrophobicContact CD1-CB 4.3Å; L445-F494 HydrophobicContact CD1-CD1 3.63Å; L445-F494 HydrophobicContact CD1-CD2 3.83Å; L445-F494 HydrophobicContact CD1-CE1 3.78Å; L445-F494 HydrophobicContact CD1-CE2 3.97Å; L445-F494 HydrophobicContact CD1-CG 3.66Å; L445-F494 HydrophobicContact CD1-CZ 3.94Å; W448-F494 HydrophobicContact CB-CD1 4.42Å; W448-F494 HydrophobicContact CB-CE1 4.11Å; W448-F494 AromaticContact CD1-CD1 3.56Å; W448-F494 HydrophobicContact CD2-CD1 4.38Å; W448-F494 AromaticContact CG-CD1 3.89Å; W448-F494 HydrophobicContact CG-CD1 3.89Å; W448-F494 HydrophobicContact CG-CE1 4.06Å; W448-F494 AromaticContact NE1-CD1 3.79Å; I484-F494 HydrophobicContact CG1-CB 4.33Å; I484-F494 HydrophobicContact CG2-CB 4.43Å; F488-F494 HydrophobicContact CB-CG 4.47Å; F488-F494 HydrophobicContact CD2-CB 4.17Å; F488-F494 AromaticContact CD2-CD1 3.38Å; F488-F494 HydrophobicContact CD2-CD1 3.38Å; F488-F494 HydrophobicContact CD2-CD2 4.48Å; F488-F494 AromaticContact CD2-CE1 3.83Å; F488-F494 HydrophobicContact CD2-CE1 3.83Å; F488-F494 AromaticContact CD2-CG 3.76Å; F488-F494 HydrophobicContact CD2-CG 3.76Å; F488-F494 AromaticContact CE2-CD1 3.52Å; F488-F494 HydrophobicContact CE2-CD1 3.52Å; F488-F494 AromaticContact CE2-CE1 3.71Å; F488-F494 HydrophobicContact CE2-CE1 3.71Å; F488-F494 HydrophobicContact CE2-CG 4.37Å; F488-F494 HydrophobicContact CG-CD1 4.2Å; F488-F494 HydrophobicContact CG-CE1 4.41Å; F488-F494 HydrophobicContact CG-CG 4.34Å; F488-F494 HydrophobicContact CZ-CD1 4.43Å; F488-F494 HydrophobicContact CZ-CE1 4.19Å; N491-F494 HydrophobicContact CB-CD2 3.95Å; N491-F494 WeakPolarHBondContact O-CB 3.26Å; N491-F494 PolarHBondContact O-N 2.96Å; E492-F494 VanDerWaalsContact C-N 3.31Å; E492-F494 PolarHBondContact O-N 3.48Å; F494-M498 WeakPolarHBondContact O-CB 3.12Å; F494-M498 PolarHBondContact O-N 3.08Å
495	V	97	Very high	96.3	Very high	29 Å²	29	55.4 Å²	55.4	18%	0.176	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-48	173.5	177.2	0	0	0	0	110.7	I484 N491 E492 M498 K499	I484-V495 HydrophobicContact CG2-CG2 3.73Å; N491-V495 PolarHBondContact O-N 3.38Å; E492-V495 PolarHBondContact O-N 3.44Å; V495-M498 PolarHBondContact O-N 3.38Å; V495-K499 HydrophobicContact CG1-CD 4.4Å; V495-K499 WeakPolarHBondContact O-CG 3.14Å; V495-K499 PolarHBondContact O-N 3.1Å
496	N	96.3	Very high	96.3	Very high	88 Å²	88	52 Å²	52	47%	0.471	25%	0.254	S	S	.	.	H	α-helix	trans	-67.7	-43.8	-179.7	-68.4	-25.1	0	0	0	112	E492 M498 K499 E500	E492-N496 WeakPolarHBondContact O-CB 3.32Å; E492-N496 VanDerWaalsContact O-CG 3.29Å; E492-N496 PolarHBondContact O-N 2.97Å; E492-N496 PolarHBondContact O-ND2 2.88Å; N496-M498 VanDerWaalsContact C-N 3.31Å; N496-M498 PolarHBondContact O-N 3.32Å; N496-K499 PolarHBondContact O-N 2.88Å; N496-E500 PolarHBondContact O-N 3.33Å
497	A	96.5	Very high	96.2	Very high	8 Å²	8	50.2 Å²	50.2	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-40.6	174.5	0	0	0	0	0	112.6	L445 I449 K493 A501	L445-A497 HydrophobicContact CD1-CB 3.62Å; L445-A497 HydrophobicContact CG-CB 4.18Å; I449-A497 HydrophobicContact CD1-CB 3.77Å; I449-A497 HydrophobicContact CG1-CB 3.7Å; K493-A497 WeakPolarHBondContact O-CB 3.49Å; K493-A497 PolarHBondContact O-N 3.44Å; A497-A501 VanDerWaalsContact O-CB 3.23Å; A497-A501 WeakPolarHBondContact O-CB 3.47Å; A497-A501 PolarHBondContact O-N 2.97Å
498	M	97.3	Very high	95.9	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-46.3	175.1	173.9	-82	-69.5	0	0	111.3	I452 K477 V480 D481 I484 F494 V495 N496 E500 A501 F502	I452-M498 HydrophobicContact CD1-CB 4.13Å; I452-M498 HydrophobicContact CD1-CG 4.14Å; K477-M498 HydrophobicContact CD-SD 4.04Å; K477-M498 VanDerWaalsContact CE-SD 3.55Å; V480-M498 HydrophobicContact CG1-CB 4.43Å; V480-M498 HydrophobicContact CG1-CG 3.49Å; V480-M498 VanDerWaalsContact CG1-CG 3.49Å; D481-M498 WeakPolarHBondContact OD1-CE 3.33Å; I484-M498 HydrophobicContact CD1-CB 3.89Å; I484-M498 HydrophobicContact CD1-CE 4.27Å; I484-M498 HydrophobicContact CD1-CG 4.09Å; F494-M498 WeakPolarHBondContact O-CB 3.12Å; F494-M498 PolarHBondContact O-N 3.08Å; V495-M498 PolarHBondContact O-N 3.38Å; N496-M498 VanDerWaalsContact C-N 3.31Å; N496-M498 PolarHBondContact O-N 3.32Å; M498-E500 PolarHBondContact O-N 3.49Å; M498-A501 PolarHBondContact O-N 3.37Å; M498-F502 HydrophobicContact CG-CD2 3.72Å; M498-F502 HydrophobicContact CG-CE2 3.83Å; M498-F502 WeakPolarHBondContact O-CB 3.46Å; M498-F502 WeakPolarHBondContact O-CD2 3.38Å; M498-F502 PolarHBondContact O-N 2.83Å; M498-F502 HydrophobicContact SD-CD2 3.71Å; M498-F502 HydrophobicContact SD-CE2 4.08Å; M498-F502 HydrophobicContact SD-CG 4.32Å
499	K	95.8	Very high	95.7	Very high	93 Å²	93	58.3 Å²	58.3	40%	0.404	28%	0.279	S	S	.	.	H	α-helix	trans	-56.9	-48.8	177.5	-71.9	169.3	-177.1	167.6	0	111.4	V495 N496 F502 E503 F550	V495-K499 HydrophobicContact CG1-CD 4.4Å; V495-K499 WeakPolarHBondContact O-CG 3.14Å; V495-K499 PolarHBondContact O-N 3.1Å; N496-K499 PolarHBondContact O-N 2.88Å; K499-F502 PolarHBondContact O-N 3.01Å; K499-E503 WeakPolarHBondContact O-CB 3.23Å; K499-E503 PolarHBondContact O-N 3.11Å; K499-F550 HydrophobicContact CB-CE1 4.04Å; K499-F550 HydrophobicContact CG-CE1 4.11Å; K499-F550 HydrophobicContact CG-CZ 4.32Å
500	E	95.1	Very high	95.4	Very high	118 Å²	118	57.5 Å²	57.5	55%	0.551	28%	0.281	S	S	*	.	H	α-helix	trans	-63.1	-42.8	177.9	-171	-168	145.5	0	0	111.8	N496 M498 E503 T504	N496-E500 PolarHBondContact O-N 3.33Å; M498-E500 PolarHBondContact O-N 3.49Å; E500-E503 PolarHBondContact O-N 3.2Å; E500-T504 WeakPolarHBondContact O-CB 3.44Å; E500-T504 PolarHBondContact O-N 3.44Å; E500-T504 PolarHBondContact O-OG1 2.86Å
501	A	97.5	Very high	95	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-45.2	178.3	0	0	0	0	0	112	I449 I452 K453 A497 M498 T504 F505	I449-A501 HydrophobicContact CG2-CB 4.33Å; I452-A501 HydrophobicContact CB-CB 4.08Å; I452-A501 HydrophobicContact CG2-CB 3.67Å; K453-A501 HydrophobicContact CG-CB 4.07Å; A497-A501 VanDerWaalsContact O-CB 3.23Å; A497-A501 WeakPolarHBondContact O-CB 3.47Å; A497-A501 PolarHBondContact O-N 2.97Å; M498-A501 PolarHBondContact O-N 3.37Å; A501-T504 WeakPolarHBondContact O-CB 3.44Å; A501-T504 PolarHBondContact O-N 3.49Å; A501-F505 WeakPolarHBondContact O-CD1 3.09Å; A501-F505 PolarHBondContact O-N 2.73Å
502	F	97.5	Very high	94.9	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-47	176.2	-93.5	-103.2	0	0	0	112.1	I452 F476 K477 V480 M498 K499 T504 F505 I506 I547 F550	I452-F502 HydrophobicContact CG2-CD2 3.71Å; I452-F502 HydrophobicContact CG2-CE2 3.68Å; F476-F502 HydrophobicContact CD1-CE1 4.16Å; F476-F502 HydrophobicContact CD1-CE2 4.46Å; F476-F502 AromaticContact CD1-CZ 3.64Å; F476-F502 HydrophobicContact CD1-CZ 3.64Å; F476-F502 HydrophobicContact CE1-CE2 4.17Å; F476-F502 AromaticContact CE1-CZ 3.79Å; F476-F502 HydrophobicContact CE1-CZ 3.79Å; F476-F502 HydrophobicContact CG-CZ 4.46Å; K477-F502 HydrophobicContact CB-CE1 3.94Å; K477-F502 HydrophobicContact CB-CZ 4.13Å; K477-F502 HydrophobicContact CD-CD1 4.2Å; K477-F502 HydrophobicContact CD-CE1 3.76Å; K477-F502 HydrophobicContact CD-CE2 4.2Å; K477-F502 HydrophobicContact CD-CZ 3.75Å; K477-F502 HydrophobicContact CG-CE1 4.39Å; V480-F502 HydrophobicContact CB-CE2 4.39Å; V480-F502 HydrophobicContact CG1-CE2 4.11Å; V480-F502 HydrophobicContact CG2-CE2 4.3Å; V480-F502 HydrophobicContact CG2-CZ 4.4Å; M498-F502 HydrophobicContact CG-CD2 3.72Å; M498-F502 HydrophobicContact CG-CE2 3.83Å; M498-F502 WeakPolarHBondContact O-CB 3.46Å; M498-F502 WeakPolarHBondContact O-CD2 3.38Å; M498-F502 PolarHBondContact O-N 2.83Å; M498-F502 HydrophobicContact SD-CD2 3.71Å; M498-F502 HydrophobicContact SD-CE2 4.08Å; M498-F502 HydrophobicContact SD-CG 4.32Å; K499-F502 PolarHBondContact O-N 3.01Å; F502-T504 VanDerWaalsContact C-N 3.31Å; F502-T504 PolarHBondContact O-N 2.72Å; F502-F505 VanDerWaalsContact CA-CE1 3.44Å; F502-F505 HydrophobicContact CB-CE1 4.12Å; F502-F505 AromaticContact CD1-CE1 3.8Å; F502-F505 HydrophobicContact CD1-CE1 3.8Å; F502-F505 AromaticContact CD1-CZ 3.64Å; F502-F505 HydrophobicContact CD1-CZ 3.64Å; F502-F505 AromaticContact CD2-CE1 3.89Å; F502-F505 HydrophobicContact CD2-CE1 3.89Å; F502-F505 HydrophobicContact CE1-CE1 4.12Å; F502-F505 AromaticContact CE1-CZ 3.8Å; F502-F505 HydrophobicContact CE1-CZ 3.8Å; F502-F505 HydrophobicContact CE2-CE1 4.21Å; F502-F505 AromaticContact CG-CE1 3.67Å; F502-F505 HydrophobicContact CG-CE1 3.67Å; F502-F505 HydrophobicContact CG-CZ 4.03Å; F502-F505 HydrophobicContact CZ-CE1 4.32Å; F502-F505 HydrophobicContact CZ-CZ 4.32Å; F502-I506 HydrophobicContact CD1-CD1 4.15Å; F502-I506 VanDerWaalsContact O-CB 3.31Å; F502-I506 WeakPolarHBondContact O-CB 3.19Å; F502-I506 WeakPolarHBondContact O-CD1 3.48Å; F502-I506 WeakPolarHBondContact O-CG1 3.33Å; F502-I506 PolarHBondContact O-N 2.74Å; F502-I506 VanDerWaalsContact O-N 3.1Å; F502-I547 HydrophobicContact CE1-CD1 4.48Å; F502-F550 HydrophobicContact CB-CD1 4.38Å; F502-F550 HydrophobicContact CB-CD2 3.88Å; F502-F550 HydrophobicContact CB-CE1 4.46Å; F502-F550 HydrophobicContact CB-CE2 3.96Å; F502-F550 HydrophobicContact CB-CG 4.12Å; F502-F550 HydrophobicContact CB-CZ 4.26Å; F502-F550 HydrophobicContact CD1-CD2 4.3Å; F502-F550 HydrophobicContact CD1-CE2 4.26Å; F502-F550 HydrophobicContact CG-CD2 4.47Å; F502-F550 HydrophobicContact CG-CE2 4.31Å
503	E	95.2	Very high	94.8	Very high	70 Å²	70	47.9 Å²	47.9	33%	0.327	24%	0.238	S	C	.	.	H	α-helix	trans	-59.7	-42.5	174.4	-168.3	-179.7	144.4	0	0	111.7	K499 E500 N507 F550 Y552	K499-E503 WeakPolarHBondContact O-CB 3.23Å; K499-E503 PolarHBondContact O-N 3.11Å; E500-E503 PolarHBondContact O-N 3.2Å; E503-N507 WeakPolarHBondContact O-CB 3.47Å; E503-N507 PolarHBondContact O-N 3.37Å; E503-N507 PolarHBondContact O-ND2 2.68Å; E503-F550 HydrophobicContact CB-CB 4.42Å; E503-F550 HydrophobicContact CB-CD1 4.3Å; E503-Y552 HydrophobicContact CG-CE1 3.77Å; E503-Y552 WeakPolarHBondContact OE1-CE1 3.41Å; E503-Y552 VanDerWaalsContact OE1-CZ 3.27Å; E503-Y552 PolarHBondContact OE1-OH 3.29Å
504	T	94.8	Very high	94.7	Very high	64 Å²	64	41.4 Å²	41.4	39%	0.393	21%	0.21	S	C	.	.	H	α-helix	trans	-63.5	-52.1	-179.4	-56.5	0	0	0	0	112.2	K453 E500 A501 F502 K508	K453-T504 HydrophobicContact CD-CG2 4.38Å; E500-T504 WeakPolarHBondContact O-CB 3.44Å; E500-T504 PolarHBondContact O-N 3.44Å; E500-T504 PolarHBondContact O-OG1 2.86Å; A501-T504 WeakPolarHBondContact O-CB 3.44Å; A501-T504 PolarHBondContact O-N 3.49Å; F502-T504 VanDerWaalsContact C-N 3.31Å; F502-T504 PolarHBondContact O-N 2.72Å; T504-K508 PolarHBondContact O-N 3.27Å
505	F	96.3	Very high	94.6	Very high	3 Å²	3	42 Å²	42	1%	0.013	21%	0.213	C	C	.	.	H	α-helix	trans	-76.9	-36	-172.3	80.5	-109.2	0	0	0	112.4	I452 G456 V460 L473 F476 A501 F502 N507 K508	I452-F505 HydrophobicContact CG2-CD1 4.08Å; I452-F505 HydrophobicContact CG2-CE1 3.78Å; G456-F505 VanDerWaalsContact CA-CE2 3.47Å; G456-F505 WeakPolarHBondContact O-CD2 3.46Å; V460-F505 HydrophobicContact CG1-CD2 4.33Å; V460-F505 HydrophobicContact CG1-CE2 4.21Å; V460-F505 HydrophobicContact CG2-CD2 4.27Å; V460-F505 WeakPolarHBondContact CG2-O 3.5Å; L473-F505 HydrophobicContact CD2-CE2 3.64Å; L473-F505 HydrophobicContact CD2-CZ 4Å; F476-F505 HydrophobicContact CD1-CZ 4.41Å; F476-F505 HydrophobicContact CE1-CE1 4.31Å; F476-F505 HydrophobicContact CE1-CZ 4.3Å; A501-F505 WeakPolarHBondContact O-CD1 3.09Å; A501-F505 PolarHBondContact O-N 2.73Å; F502-F505 VanDerWaalsContact CA-CE1 3.44Å; F502-F505 HydrophobicContact CB-CE1 4.12Å; F502-F505 AromaticContact CD1-CE1 3.8Å; F502-F505 HydrophobicContact CD1-CE1 3.8Å; F502-F505 AromaticContact CD1-CZ 3.64Å; F502-F505 HydrophobicContact CD1-CZ 3.64Å; F502-F505 AromaticContact CD2-CE1 3.89Å; F502-F505 HydrophobicContact CD2-CE1 3.89Å; F502-F505 HydrophobicContact CE1-CE1 4.12Å; F502-F505 AromaticContact CE1-CZ 3.8Å; F502-F505 HydrophobicContact CE1-CZ 3.8Å; F502-F505 HydrophobicContact CE2-CE1 4.21Å; F502-F505 AromaticContact CG-CE1 3.67Å; F502-F505 HydrophobicContact CG-CE1 3.67Å; F502-F505 HydrophobicContact CG-CZ 4.03Å; F502-F505 HydrophobicContact CZ-CE1 4.32Å; F502-F505 HydrophobicContact CZ-CZ 4.32Å; F505-N507 VanDerWaalsContact C-N 3.26Å; F505-N507 PolarHBondContact O-N 3.37Å; F505-K508 WeakPolarHBondContact O-CB 3.2Å; F505-K508 PolarHBondContact O-N 2.76Å; F505-K508 VanDerWaalsContact O-N 3.13Å
506	I	96.3	Very high	94.5	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-43.3	178.4	-71	172.1	0	0	0	109.5	L473 F502 K508 R509 P513 I547 F550 I551	L473-I506 HydrophobicContact CD2-CG1 4.44Å; F502-I506 HydrophobicContact CD1-CD1 4.15Å; F502-I506 VanDerWaalsContact O-CB 3.31Å; F502-I506 WeakPolarHBondContact O-CB 3.19Å; F502-I506 WeakPolarHBondContact O-CD1 3.48Å; F502-I506 WeakPolarHBondContact O-CG1 3.33Å; F502-I506 PolarHBondContact O-N 2.74Å; F502-I506 VanDerWaalsContact O-N 3.1Å; I506-K508 VanDerWaalsContact C-N 3.25Å; I506-K508 PolarHBondContact O-N 2.99Å; I506-R509 PolarHBondContact O-N 2.83Å; I506-P513 HydrophobicContact CG2-CB 4.01Å; I506-P513 HydrophobicContact CG2-CG 4.37Å; I506-I547 HydrophobicContact CD1-CG2 4.12Å; I506-F550 HydrophobicContact CD1-CB 3.92Å; I506-F550 HydrophobicContact CD1-CD2 4.23Å; I506-I551 HydrophobicContact CG2-CG1 4.16Å
507	N	93.4	Very high	94.5	Very high	36 Å²	36	37.5 Å²	37.5	19%	0.193	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.1	-178.3	-65.2	-55.6	0	0	0	114.1	E503 F505 R509 F550 Y552	E503-N507 WeakPolarHBondContact O-CB 3.47Å; E503-N507 PolarHBondContact O-N 3.37Å; E503-N507 PolarHBondContact O-ND2 2.68Å; F505-N507 VanDerWaalsContact C-N 3.26Å; F505-N507 PolarHBondContact O-N 3.37Å; N507-R509 PolarHBondContact O-N 3.29Å; N507-F550 PolarHBondContact ND2-O 3.43Å; N507-Y552 HydrophobicContact CB-CD2 3.6Å; N507-Y552 HydrophobicContact CB-CE2 3.79Å; N507-Y552 HydrophobicContact CB-CG 4.24Å; N507-Y552 PolarHBondContact OD1-N 3.22Å
508	K	92.3	Very high	94.4	Very high	134 Å²	134	37.1 Å²	37.1	58%	0.583	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28	170.9	-168.9	170.2	175	-178.8	0	111.8	I461 T504 F505 I506 P510	I461-K508 HydrophobicContact CD1-CD 4.01Å; T504-K508 PolarHBondContact O-N 3.27Å; F505-K508 WeakPolarHBondContact O-CB 3.2Å; F505-K508 PolarHBondContact O-N 2.76Å; F505-K508 VanDerWaalsContact O-N 3.13Å; I506-K508 VanDerWaalsContact C-N 3.25Å; I506-K508 PolarHBondContact O-N 2.99Å; K508-P510 WeakPolarHBondContact O-CD 3.36Å
509	R	91.9	Very high	94.2	Very high	38 Å²	38	39.3 Å²	39.3	14%	0.143	19%	0.194	C	C	.	.	S	Bend	trans	-98.5	112.7	170.1	-172.1	164.6	-177.8	-134.8	14.6	110.9	V460 D466 I506 N507 N511 K512 P513	V460-R509 HydrophobicContact CG2-CB 4.48Å; V460-R509 WeakPolarHBondContact O-CD 3.44Å; D466-R509 VanDerWaalsContact CG-NH2 3.29Å; D466-R509 IonicContact OD1-CZ 3.7Å; D466-R509 IonicContact OD1-NH1 3.62Å; D466-R509 PolarHBondContact OD1-NH1 2.92Å; D466-R509 IonicContact OD1-NH2 3.31Å; D466-R509 PolarHBondContact OD1-NH2 3.36Å; D466-R509 IonicContact OD2-CZ 3.96Å; D466-R509 IonicContact OD2-NH1 3.59Å; D466-R509 IonicContact OD2-NH2 3.82Å; D466-R509 PolarHBondContact OD2-NH2 3.02Å; I506-R509 PolarHBondContact O-N 2.83Å; N507-R509 PolarHBondContact O-N 3.29Å; R509-N511 PolarHBondContact O-N 3.23Å; R509-K512 HydrophobicContact CG-CB 4.25Å; R509-P513 HydrophobicContact CB-CG 4.22Å; R509-P513 VanDerWaalsContact O-CD 3.23Å; R509-P513 WeakPolarHBondContact O-CD 3.31Å
510	P	88.5	Confident	94	Very high	99 Å²	99	36.5 Å²	36.5	64%	0.643	18%	0.182	S	C	*	.			trans	-67	134.8	-177.1	-20.7	32.7	0	0	0	112.7	K508 K512	K508-P510 WeakPolarHBondContact O-CD 3.36Å; P510-K512 PolarHBondContact O-N 3.05Å
511	N	87.9	Confident	93.9	Very high	38 Å²	38	30.9 Å²	30.9	20%	0.203	16%	0.156	C	C	.	.	S	Bend	trans	61.4	-33	167.5	-48.9	-56.5	0	0	0	117.4	R509 A514 E515 V556 F798 R801	R509-N511 PolarHBondContact O-N 3.23Å; N511-A514 WeakPolarHBondContact O-CB 3.46Å; N511-A514 PolarHBondContact O-N 3.03Å; N511-E515 PolarHBondContact O-N 3.11Å; N511-E515 VanDerWaalsContact O-N 3.12Å; N511-V556 HydrophobicContact CB-CG1 4.31Å; N511-V556 HydrophobicContact CB-CG2 4.01Å; N511-F798 WeakPolarHBondContact ND2-CZ 3.4Å; N511-R801 PolarHBondContact OD1-NH1 3.33Å; N511-R801 PolarHBondContact OD1-NH2 3.23Å
512	K	92.3	Very high	93.6	Very high	41 Å²	41	31.5 Å²	31.5	18%	0.178	16%	0.159	C	C	.	.	H	α-helix	trans	-67.4	-38.9	-173.3	-163.8	56.9	164	-174.4	0	114.2	D466 R509 P510 A514 E515 L516	D466-K512 WeakPolarHBondContact OD2-CE 2.95Å; R509-K512 HydrophobicContact CG-CB 4.25Å; P510-K512 PolarHBondContact O-N 3.05Å; K512-A514 VanDerWaalsContact C-N 3.27Å; K512-A514 PolarHBondContact O-N 3.28Å; K512-E515 HydrophobicContact CD-CB 4.41Å; K512-E515 WeakPolarHBondContact CD-OE2 3.29Å; K512-E515 VanDerWaalsContact NZ-CD 3.26Å; K512-E515 IonicContact NZ-OE1 3.2Å; K512-E515 PolarHBondContact NZ-OE1 2.57Å; K512-E515 IonicContact NZ-OE2 2.78Å; K512-E515 PolarHBondContact NZ-OE2 2.66Å; K512-E515 PolarHBondContact O-N 2.93Å; K512-L516 HydrophobicContact CD-CD1 4.47Å; K512-L516 HydrophobicContact CD-CG 4.23Å; K512-L516 HydrophobicContact CG-CD1 4.03Å; K512-L516 HydrophobicContact CG-CG 4.25Å; K512-L516 WeakPolarHBondContact O-CB 3.35Å; K512-L516 WeakPolarHBondContact O-CG 3.37Å; K512-L516 PolarHBondContact O-N 3.31Å
513	P	94.9	Very high	93.2	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.032	18%	0.182	C	C	.	.	H	α-helix	trans	-56.6	-41.4	171.2	-26.4	35.9	0	0	0	112.5	I506 R509 L516 I517	I506-P513 HydrophobicContact CG2-CB 4.01Å; I506-P513 HydrophobicContact CG2-CG 4.37Å; R509-P513 HydrophobicContact CB-CG 4.22Å; R509-P513 VanDerWaalsContact O-CD 3.23Å; R509-P513 WeakPolarHBondContact O-CD 3.31Å; P513-L516 PolarHBondContact O-N 2.76Å; P513-I517 WeakPolarHBondContact O-CB 3.34Å; P513-I517 WeakPolarHBondContact O-CD1 3.14Å; P513-I517 VanDerWaalsContact O-CG1 3.24Å; P513-I517 WeakPolarHBondContact O-CG1 3.12Å; P513-I517 PolarHBondContact O-N 2.83Å
514	A	94.8	Very high	92.9	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-44.8	178	0	0	0	0	0	112.4	N511 K512 A518 I551 G553 V556 F557	N511-A514 WeakPolarHBondContact O-CB 3.46Å; N511-A514 PolarHBondContact O-N 3.03Å; K512-A514 VanDerWaalsContact C-N 3.27Å; K512-A514 PolarHBondContact O-N 3.28Å; A514-A518 PolarHBondContact O-N 2.6Å; A514-A518 VanDerWaalsContact O-N 3.11Å; A514-I551 HydrophobicContact CB-CG2 3.81Å; A514-G553 VanDerWaalsContact CB-O 3.27Å; A514-G553 WeakPolarHBondContact CB-O 3.41Å; A514-V556 HydrophobicContact CB-CB 4.02Å; A514-V556 HydrophobicContact CB-CG1 4.16Å; A514-F557 HydrophobicContact CB-CB 4.22Å
515	E	94.2	Very high	92.6	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.056	16%	0.158	C	C	.	.	H	α-helix	trans	-59.3	-51	174.6	-179.8	-158.6	136.4	0	0	111.4	N511 K512 I517 A518 K519 V556 F560 Q790	N511-E515 PolarHBondContact O-N 3.11Å; N511-E515 VanDerWaalsContact O-N 3.12Å; K512-E515 HydrophobicContact CD-CB 4.41Å; K512-E515 WeakPolarHBondContact CD-OE2 3.29Å; K512-E515 VanDerWaalsContact NZ-CD 3.26Å; K512-E515 IonicContact NZ-OE1 3.2Å; K512-E515 PolarHBondContact NZ-OE1 2.57Å; K512-E515 IonicContact NZ-OE2 2.78Å; K512-E515 PolarHBondContact NZ-OE2 2.66Å; K512-E515 PolarHBondContact O-N 2.93Å; E515-I517 VanDerWaalsContact C-N 3.3Å; E515-I517 PolarHBondContact O-N 3.11Å; E515-A518 WeakPolarHBondContact O-CB 3.17Å; E515-A518 PolarHBondContact O-N 2.9Å; E515-K519 HydrophobicContact CG-CD 4.22Å; E515-K519 WeakPolarHBondContact O-CG 3.13Å; E515-K519 PolarHBondContact O-N 3.48Å; E515-K519 WeakPolarHBondContact OE1-CE 3.31Å; E515-K519 IonicContact OE1-NZ 3.16Å; E515-K519 PolarHBondContact OE1-NZ 2.77Å; E515-V556 HydrophobicContact CB-CG1 4.41Å; E515-F560 HydrophobicContact CB-CD2 3.95Å; E515-F560 HydrophobicContact CB-CE2 3.92Å; E515-F560 HydrophobicContact CB-CZ 4.49Å; E515-F560 HydrophobicContact CG-CD1 4.1Å; E515-F560 HydrophobicContact CG-CD2 3.78Å; E515-F560 HydrophobicContact CG-CE1 3.97Å; E515-F560 HydrophobicContact CG-CE2 3.65Å; E515-F560 HydrophobicContact CG-CG 4.03Å; E515-F560 HydrophobicContact CG-CZ 3.75Å; E515-Q790 VanDerWaalsContact CD-NE2 3.32Å; E515-Q790 PolarHBondContact OE1-NE2 3.44Å; E515-Q790 PolarHBondContact OE2-NE2 2.95Å
516	L	95	Very high	92.1	Very high	22 Å²	22	33.4 Å²	33.4	12%	0.115	17%	0.168	C	C	.	.	H	α-helix	trans	-66.3	-34.6	-175.9	-68.4	175.5	0	0	0	111.8	D466 M469 V470 K512 P513 K519 H520	D466-L516 HydrophobicContact CB-CD1 3.96Å; D466-L516 HydrophobicContact CB-CD2 4.48Å; M469-L516 HydrophobicContact CB-CD1 4.26Å; M469-L516 HydrophobicContact CE-CD1 4.1Å; M469-L516 HydrophobicContact CG-CD1 4.48Å; M469-L516 HydrophobicContact SD-CD1 3.64Å; V470-L516 HydrophobicContact CG2-CB 3.92Å; K512-L516 HydrophobicContact CD-CD1 4.47Å; K512-L516 HydrophobicContact CD-CG 4.23Å; K512-L516 HydrophobicContact CG-CD1 4.03Å; K512-L516 HydrophobicContact CG-CG 4.25Å; K512-L516 WeakPolarHBondContact O-CB 3.35Å; K512-L516 WeakPolarHBondContact O-CG 3.37Å; K512-L516 PolarHBondContact O-N 3.31Å; P513-L516 PolarHBondContact O-N 2.76Å; L516-K519 PolarHBondContact O-N 2.87Å; L516-H520 VanDerWaalsContact O-CB 3.29Å; L516-H520 WeakPolarHBondContact O-CB 3.35Å; L516-H520 PolarHBondContact O-N 2.8Å
517	I	96.1	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.5	-42.2	174.4	-72.7	168.3	0	0	0	110.9	V470 P513 E515 K519 H520 V521 I544 I547 I551 F557	V470-I517 HydrophobicContact CG1-CG1 4.09Å; V470-I517 HydrophobicContact CG2-CG1 3.82Å; P513-I517 WeakPolarHBondContact O-CB 3.34Å; P513-I517 WeakPolarHBondContact O-CD1 3.14Å; P513-I517 VanDerWaalsContact O-CG1 3.24Å; P513-I517 WeakPolarHBondContact O-CG1 3.12Å; P513-I517 PolarHBondContact O-N 2.83Å; E515-I517 VanDerWaalsContact C-N 3.3Å; E515-I517 PolarHBondContact O-N 3.11Å; I517-K519 PolarHBondContact O-N 2.66Å; I517-H520 PolarHBondContact O-N 2.93Å; I517-V521 WeakPolarHBondContact O-CG2 3.39Å; I517-V521 PolarHBondContact O-N 2.96Å; I517-I544 HydrophobicContact CG2-CG2 3.77Å; I517-I547 HydrophobicContact CD1-CG2 3.86Å; I517-I551 HydrophobicContact CD1-CD1 3.34Å; I517-I551 HydrophobicContact CD1-CG1 4.34Å; I517-I551 HydrophobicContact CG1-CD1 4.49Å; I517-F557 HydrophobicContact CG2-CD2 4.07Å; I517-F557 HydrophobicContact CG2-CE2 3.93Å
518	A	94.9	Very high	89.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-46.1	173.6	0	0	0	0	0	111.9	A514 E515 H520 V521 D522 F557 F560	A514-A518 PolarHBondContact O-N 2.6Å; A514-A518 VanDerWaalsContact O-N 3.11Å; E515-A518 WeakPolarHBondContact O-CB 3.17Å; E515-A518 PolarHBondContact O-N 2.9Å; A518-H520 VanDerWaalsContact C-N 3.33Å; A518-H520 PolarHBondContact O-N 2.66Å; A518-V521 PolarHBondContact O-N 3.29Å; A518-D522 PolarHBondContact O-N 2.82Å; A518-F557 HydrophobicContact CB-CD2 3.63Å; A518-F557 HydrophobicContact CB-CE2 3.88Å; A518-F557 HydrophobicContact CB-CG 4.31Å; A518-F560 HydrophobicContact CB-CB 3.77Å
519	K	92.6	Very high	87.7	Confident	50 Å²	50	33.6 Å²	33.6	22%	0.217	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-36.7	176.9	-72	179.6	173.9	-178	0	112.8	E515 L516 I517 D522 S523 E785	E515-K519 HydrophobicContact CG-CD 4.22Å; E515-K519 WeakPolarHBondContact O-CG 3.13Å; E515-K519 PolarHBondContact O-N 3.48Å; E515-K519 WeakPolarHBondContact OE1-CE 3.31Å; E515-K519 IonicContact OE1-NZ 3.16Å; E515-K519 PolarHBondContact OE1-NZ 2.77Å; L516-K519 PolarHBondContact O-N 2.87Å; I517-K519 PolarHBondContact O-N 2.66Å; K519-D522 PolarHBondContact O-N 2.89Å; K519-S523 PolarHBondContact O-N 3.16Å; K519-E785 WeakPolarHBondContact CE-OE2 3.4Å; K519-E785 IonicContact NZ-OE2 2.72Å; K519-E785 PolarHBondContact NZ-OE2 3.34Å
520	H	93.1	Very high	86	Confident	35 Å²	35	41.2 Å²	41.2	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-47.6	176.6	-168.7	89.1	0	0	0	110.5	V470 L516 I517 A518 D522 S523 K524	V470-H520 HydrophobicContact CB-CB 4.17Å; V470-H520 HydrophobicContact CG1-CB 3.93Å; V470-H520 HydrophobicContact CG2-CB 4.15Å; L516-H520 VanDerWaalsContact O-CB 3.29Å; L516-H520 WeakPolarHBondContact O-CB 3.35Å; L516-H520 PolarHBondContact O-N 2.8Å; I517-H520 PolarHBondContact O-N 2.93Å; A518-H520 VanDerWaalsContact C-N 3.33Å; A518-H520 PolarHBondContact O-N 2.66Å; H520-D522 VanDerWaalsContact C-N 3.34Å; H520-D522 PolarHBondContact O-N 3.42Å; H520-S523 WeakPolarHBondContact O-CB 3.2Å; H520-S523 PolarHBondContact O-N 3.48Å; H520-K524 VanDerWaalsContact NE2-CE 3.29Å; H520-K524 WeakPolarHBondContact NE2-CE 3.11Å; H520-K524 VanDerWaalsContact O-CG 3.3Å; H520-K524 WeakPolarHBondContact O-CG 3.39Å; H520-K524 PolarHBondContact O-N 3.04Å; H520-K524 VanDerWaalsContact O-N 3.12Å
521	V	93	Very high	84.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-44.4	175.1	176.8	0	0	0	0	111.1	I517 A518 S523 K524 L525 L541 I544 Y561 M583	I517-V521 WeakPolarHBondContact O-CG2 3.39Å; I517-V521 PolarHBondContact O-N 2.96Å; A518-V521 PolarHBondContact O-N 3.29Å; V521-S523 VanDerWaalsContact C-N 3.33Å; V521-S523 PolarHBondContact O-N 2.97Å; V521-K524 PolarHBondContact O-N 3.44Å; V521-K524 VanDerWaalsContact O-N 3.12Å; V521-L525 HydrophobicContact CG1-CD1 3.63Å; V521-L525 HydrophobicContact CG1-CG 4.25Å; V521-L525 WeakPolarHBondContact O-CG 3.39Å; V521-L525 PolarHBondContact O-N 2.98Å; V521-L541 HydrophobicContact CG1-CD2 4.22Å; V521-I544 HydrophobicContact CG2-CD1 4.11Å; V521-I544 HydrophobicContact CG2-CG2 3.74Å; V521-Y561 HydrophobicContact CG1-CD2 4.39Å; V521-Y561 HydrophobicContact CG1-CE2 3.76Å; V521-M583 HydrophobicContact CG1-CE 4.08Å; V521-M583 HydrophobicContact CG1-CG 4.35Å; V521-M583 HydrophobicContact CG1-SD 4.29Å; V521-M583 HydrophobicContact CG2-CE 4.22Å
522	D	90.8	Very high	83.5	Confident	12 Å²	12	45.2 Å²	45.2	6%	0.064	25%	0.248	C	C	.	.	H	α-helix	trans	-57.1	-45.1	175.3	171.1	67.5	0	0	0	112.1	A518 K519 H520 K524 L525 R526 D564 R568	A518-D522 PolarHBondContact O-N 2.82Å; K519-D522 PolarHBondContact O-N 2.89Å; H520-D522 VanDerWaalsContact C-N 3.34Å; H520-D522 PolarHBondContact O-N 3.42Å; D522-K524 PolarHBondContact O-N 3.11Å; D522-L525 PolarHBondContact O-N 3.42Å; D522-R526 VanDerWaalsContact CG-NE 3.35Å; D522-R526 WeakPolarHBondContact O-CG 3.44Å; D522-R526 PolarHBondContact O-N 3.18Å; D522-R526 IonicContact OD1-CZ 2.73Å; D522-R526 IonicContact OD1-NE 3.83Å; D522-R526 PolarHBondContact OD1-NE 3.26Å; D522-R526 IonicContact OD1-NH2 3.7Å; D522-R526 PolarHBondContact OD1-NH2 2.71Å; D522-R526 IonicContact OD2-CZ 2.66Å; D522-R526 IonicContact OD2-NE 3.77Å; D522-R526 PolarHBondContact OD2-NE 3.23Å; D522-R526 IonicContact OD2-NH2 3.06Å; D522-R526 PolarHBondContact OD2-NH2 3.11Å; D522-D564 HydrophobicContact CB-CB 3.93Å; D522-R568 WeakPolarHBondContact OD1-CD 3.41Å; D522-R568 IonicContact OD1-CZ 2.76Å; D522-R568 IonicContact OD1-NE 3.66Å; D522-R568 IonicContact OD1-NH1 3.64Å; D522-R568 PolarHBondContact OD1-NH1 3.48Å
523	S	89.2	Confident	83.2	Confident	68 Å²	68	47.1 Å²	47.1	48%	0.476	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-37.1	177.3	-172.6	0	0	0	0	112.3	K519 H520 V521	K519-S523 PolarHBondContact O-N 3.16Å; H520-S523 WeakPolarHBondContact O-CB 3.2Å; H520-S523 PolarHBondContact O-N 3.48Å; V521-S523 VanDerWaalsContact C-N 3.33Å; V521-S523 PolarHBondContact O-N 2.97Å
524	K	88.3	Confident	82.7	Confident	50 Å²	50	52.5 Å²	52.5	22%	0.217	29%	0.292	C	S	.	.	H	α-helix	trans	-77	-29	-177.7	-62.4	-65.9	-164.4	175.2	0	112.8	H520 V521 D522 N529 L537 M540	H520-K524 VanDerWaalsContact NE2-CE 3.29Å; H520-K524 WeakPolarHBondContact NE2-CE 3.11Å; H520-K524 VanDerWaalsContact O-CG 3.3Å; H520-K524 WeakPolarHBondContact O-CG 3.39Å; H520-K524 PolarHBondContact O-N 3.04Å; H520-K524 VanDerWaalsContact O-N 3.12Å; V521-K524 PolarHBondContact O-N 3.44Å; V521-K524 VanDerWaalsContact O-N 3.12Å; D522-K524 PolarHBondContact O-N 3.11Å; K524-N529 PolarHBondContact O-ND2 3.24Å; K524-L537 HydrophobicContact CB-CD1 4.23Å; K524-M540 HydrophobicContact CB-CE 4.16Å; K524-M540 HydrophobicContact CB-SD 3.82Å; K524-M540 HydrophobicContact CD-CE 3.53Å; K524-M540 HydrophobicContact CD-SD 3.59Å; K524-M540 VanDerWaalsContact CD-SD 3.59Å; K524-M540 HydrophobicContact CG-CE 3.95Å; K524-M540 HydrophobicContact CG-SD 3.41Å; K524-M540 WeakPolarHBondContact CG-SD 3.49Å
525	L	88.8	Confident	82.4	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.3	178.8	-67.6	174.2	0	0	0	114.5	V521 D522 L537 L541 S574 A575 A579 M583	V521-L525 HydrophobicContact CG1-CD1 3.63Å; V521-L525 HydrophobicContact CG1-CG 4.25Å; V521-L525 WeakPolarHBondContact O-CG 3.39Å; V521-L525 PolarHBondContact O-N 2.98Å; D522-L525 PolarHBondContact O-N 3.42Å; L525-L537 HydrophobicContact CD2-CD2 4.39Å; L525-L541 HydrophobicContact CD2-CD1 4.47Å; L525-S574 CarbonylContact O-C 3.43Å; L525-S574 WeakPolarHBondContact O-CA 3.48Å; L525-A575 WeakPolarHBondContact O-CB 3.46Å; L525-A575 PolarHBondContact O-N 3.42Å; L525-A579 HydrophobicContact CD2-CB 4.01Å; L525-M583 HydrophobicContact CD1-CG 4.48Å
526	R	86.6	Confident	82.1	Confident	58 Å²	58	62.9 Å²	62.9	22%	0.219	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-82.5	143.2	177.2	-79.5	170.3	-172.1	-103.4	1	112.5	D522 G528 N529 K573	D522-R526 VanDerWaalsContact CG-NE 3.35Å; D522-R526 WeakPolarHBondContact O-CG 3.44Å; D522-R526 PolarHBondContact O-N 3.18Å; D522-R526 IonicContact OD1-CZ 2.73Å; D522-R526 IonicContact OD1-NE 3.83Å; D522-R526 PolarHBondContact OD1-NE 3.26Å; D522-R526 IonicContact OD1-NH2 3.7Å; D522-R526 PolarHBondContact OD1-NH2 2.71Å; D522-R526 IonicContact OD2-CZ 2.66Å; D522-R526 IonicContact OD2-NE 3.77Å; D522-R526 PolarHBondContact OD2-NE 3.23Å; D522-R526 IonicContact OD2-NH2 3.06Å; D522-R526 PolarHBondContact OD2-NH2 3.11Å; R526-G528 PolarHBondContact O-N 3.28Å; R526-N529 PolarHBondContact O-N 2.88Å; R526-N529 VanDerWaalsContact O-N 3.11Å; R526-K573 CarbonylContact C-O 3.53Å; R526-K573 WeakPolarHBondContact CA-O 2.99Å
527	A	65.3	Low	81.8	Confident	57 Å²	57	62.4 Å²	62.4	47%	0.471	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	6.2	-177.5	0	0	0	0	0	116.9	K573	A527-K573 WeakPolarHBondContact CB-O 3.4Å; A527-K573 PolarHBondContact N-O 3.48Å
528	G	61.4	Low	81.5	Confident	66 Å²	66	65.2 Å²	65.2	68%	0.68	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-7.1	175	0	0	0	0	0	114.3	R526 K530	R526-G528 PolarHBondContact O-N 3.28Å; G528-K530 PolarHBondContact O-N 3.22Å
529	N	62.8	Low	81.3	Confident	53 Å²	53	70.6 Å²	70.6	28%	0.283	37%	0.374	S	S	.	.			trans	-85	56.2	-173.8	-149.1	31.4	0	0	0	111.6	K524 R526 E531	K524-N529 PolarHBondContact O-ND2 3.24Å; R526-N529 PolarHBondContact O-N 2.88Å; R526-N529 VanDerWaalsContact O-N 3.11Å; N529-E531 PolarHBondContact O-N 2.79Å
530	K	56.6	Low	81.3	Confident	197 Å²	197	69.7 Å²	69.7	86%	0.857	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	0.4	-172.9	-74.1	-173.6	174.7	-173.7	0	115.4	G528	G528-K530 PolarHBondContact O-N 3.22Å
531	E	56.2	Low	81.2	Confident	186 Å²	186	68 Å²	68	87%	0.869	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-11	-173.9	-66.7	178.8	176.7	0	0	113.6	N529	N529-E531 PolarHBondContact O-N 2.79Å
532	A	67.3	Low	81.3	Confident	35 Å²	35	71.5 Å²	71.5	29%	0.289	38%	0.381	S	S	.	.	S	Bend	trans	-110.2	131.3	179.6	0	0	0	0	0	111.2	E536	A532-E536 HydrophobicContact CB-CB 4.47Å
533	T	84.6	Confident	81.4	Confident	81 Å²	81	75 Å²	75	50%	0.497	40%	0.396	S	S	.	.			trans	-67.2	159.1	166.2	58.3	0	0	0	0	110.7	E535 E536 L537	T533-E535 PolarHBondContact O-N 2.76Å; T533-E536 PolarHBondContact N-OE2 2.87Å; T533-E536 PolarHBondContact O-N 3.12Å; T533-E536 VanDerWaalsContact OG1-CD 3.23Å; T533-E536 VanDerWaalsContact OG1-CG 3.25Å; T533-E536 WeakPolarHBondContact OG1-CG 3.24Å; T533-E536 PolarHBondContact OG1-N 3.23Å; T533-E536 PolarHBondContact OG1-OE2 3.44Å; T533-L537 WeakPolarHBondContact O-CB 3.41Å; T533-L537 PolarHBondContact O-N 3.48Å
534	D	84.7	Confident	81.7	Confident	119 Å²	119	71.8 Å²	71.8	64%	0.636	37%	0.374	S	S	*	.	H	α-helix	trans	-57.6	-32.7	176.6	-72.8	-16.7	0	0	0	111.8	E538	D534-E538 WeakPolarHBondContact O-CB 3.38Å; D534-E538 PolarHBondContact O-N 3.39Å
535	E	88.1	Confident	82	Confident	126 Å²	126	69.7 Å²	69.7	59%	0.589	37%	0.365	S	S	*	.	H	α-helix	trans	-69.8	-43.6	177.1	-167.5	-172.1	154.5	0	0	112.6	T533 L537 E538 K539	T533-E535 PolarHBondContact O-N 2.76Å; E535-L537 VanDerWaalsContact C-N 3.33Å; E535-E538 PolarHBondContact O-N 2.91Å; E535-K539 WeakPolarHBondContact O-CG 3.47Å; E535-K539 PolarHBondContact O-N 3.4Å; E535-K539 WeakPolarHBondContact OE1-CE 3.05Å; E535-K539 IonicContact OE1-NZ 2.87Å; E535-K539 PolarHBondContact OE1-NZ 3.44Å
536	E	88	Confident	82.2	Confident	105 Å²	105	72.6 Å²	72.6	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-37.9	176	-71	163.3	148.3	0	0	111.5	A532 T533 M540	A532-E536 HydrophobicContact CB-CB 4.47Å; T533-E536 PolarHBondContact N-OE2 2.87Å; T533-E536 PolarHBondContact O-N 3.12Å; T533-E536 VanDerWaalsContact OG1-CD 3.23Å; T533-E536 VanDerWaalsContact OG1-CG 3.25Å; T533-E536 WeakPolarHBondContact OG1-CG 3.24Å; T533-E536 PolarHBondContact OG1-N 3.23Å; T533-E536 PolarHBondContact OG1-OE2 3.44Å; E536-M540 VanDerWaalsContact O-CB 3.3Å; E536-M540 WeakPolarHBondContact O-CB 3.2Å; E536-M540 PolarHBondContact O-N 3.2Å
537	L	88.8	Confident	82.7	Confident	11 Å²	11	70 Å²	70	6%	0.058	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-46.2	174	-178	60.7	0	0	0	110.6	K524 L525 T533 E535 M540 L541 A579	K524-L537 HydrophobicContact CB-CD1 4.23Å; L525-L537 HydrophobicContact CD2-CD2 4.39Å; T533-L537 WeakPolarHBondContact O-CB 3.41Å; T533-L537 PolarHBondContact O-N 3.48Å; E535-L537 VanDerWaalsContact C-N 3.33Å; L537-M540 HydrophobicContact CD1-CE 3.8Å; L537-M540 HydrophobicContact CD1-SD 4.37Å; L537-M540 WeakPolarHBondContact O-CB 3.38Å; L537-M540 PolarHBondContact O-N 2.94Å; L537-L541 HydrophobicContact CG-CD1 4.49Å; L537-L541 VanDerWaalsContact O-CG 3.32Å; L537-L541 WeakPolarHBondContact O-CG 3.42Å; L537-L541 PolarHBondContact O-N 3.17Å; L537-A579 HydrophobicContact CD2-CB 3.93Å
538	E	90.8	Very high	84.1	Confident	59 Å²	59	67.4 Å²	67.4	28%	0.276	35%	0.348	S	S	.	.	H	α-helix	trans	-61.7	-47.2	178.4	-171.4	68.1	-173.5	0	0	111.9	D534 E535 M540 L541 D542 S582 K586	D534-E538 WeakPolarHBondContact O-CB 3.38Å; D534-E538 PolarHBondContact O-N 3.39Å; E535-E538 PolarHBondContact O-N 2.91Å; E538-M540 VanDerWaalsContact C-N 3.28Å; E538-M540 PolarHBondContact O-N 3.12Å; E538-L541 PolarHBondContact O-N 3.28Å; E538-L541 VanDerWaalsContact O-N 3.15Å; E538-D542 PolarHBondContact O-N 3.26Å; E538-S582 VanDerWaalsContact CD-OG 3.31Å; E538-S582 PolarHBondContact OE1-OG 2.81Å; E538-S582 PolarHBondContact OE2-OG 2.88Å; E538-K586 WeakPolarHBondContact OE1-CE 3.33Å; E538-K586 IonicContact OE1-NZ 2.62Å; E538-K586 PolarHBondContact OE1-NZ 3Å
539	K	91.5	Very high	85.6	Confident	113 Å²	113	70.2 Å²	70.2	49%	0.491	34%	0.338	S	S	.	.	H	α-helix	trans	-58.5	-40.5	175.2	-74.9	175.7	-173.3	162.5	0	112	E535 D542 K543	E535-K539 WeakPolarHBondContact O-CG 3.47Å; E535-K539 PolarHBondContact O-N 3.4Å; E535-K539 WeakPolarHBondContact OE1-CE 3.05Å; E535-K539 IonicContact OE1-NZ 2.87Å; E535-K539 PolarHBondContact OE1-NZ 3.44Å; K539-D542 PolarHBondContact O-N 3.22Å; K539-K543 WeakPolarHBondContact O-CG 3.39Å; K539-K543 PolarHBondContact O-N 3.13Å; K539-K543 VanDerWaalsContact O-N 3.07Å
540	M	90.6	Very high	87.1	Confident	32 Å²	32	68.6 Å²	68.6	16%	0.158	33%	0.329	C	S	.	.	H	α-helix	trans	-66.4	-42.6	177	-178.1	-134.6	-56.6	0	0	111.7	K524 E536 L537 E538 D542 K543 I544	K524-M540 HydrophobicContact CB-CE 4.16Å; K524-M540 HydrophobicContact CB-SD 3.82Å; K524-M540 HydrophobicContact CD-CE 3.53Å; K524-M540 HydrophobicContact CD-SD 3.59Å; K524-M540 VanDerWaalsContact CD-SD 3.59Å; K524-M540 HydrophobicContact CG-CE 3.95Å; K524-M540 HydrophobicContact CG-SD 3.41Å; K524-M540 WeakPolarHBondContact CG-SD 3.49Å; E536-M540 VanDerWaalsContact O-CB 3.3Å; E536-M540 WeakPolarHBondContact O-CB 3.2Å; E536-M540 PolarHBondContact O-N 3.2Å; L537-M540 HydrophobicContact CD1-CE 3.8Å; L537-M540 HydrophobicContact CD1-SD 4.37Å; L537-M540 WeakPolarHBondContact O-CB 3.38Å; L537-M540 PolarHBondContact O-N 2.94Å; E538-M540 VanDerWaalsContact C-N 3.28Å; E538-M540 PolarHBondContact O-N 3.12Å; M540-D542 VanDerWaalsContact C-N 3.31Å; M540-D542 PolarHBondContact O-N 3.22Å; M540-K543 PolarHBondContact O-N 3.19Å; M540-I544 HydrophobicContact CG-CD1 4.09Å; M540-I544 WeakPolarHBondContact O-CG1 3.27Å; M540-I544 PolarHBondContact O-N 2.77Å; M540-I544 HydrophobicContact SD-CD1 4Å
541	L	92.4	Very high	88.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-41.4	175.1	-67.8	179.4	0	0	0	110.9	V521 L525 L537 E538 K543 I544 M545 M583 K586	V521-L541 HydrophobicContact CG1-CD2 4.22Å; L525-L541 HydrophobicContact CD2-CD1 4.47Å; L537-L541 HydrophobicContact CG-CD1 4.49Å; L537-L541 VanDerWaalsContact O-CG 3.32Å; L537-L541 WeakPolarHBondContact O-CG 3.42Å; L537-L541 PolarHBondContact O-N 3.17Å; E538-L541 PolarHBondContact O-N 3.28Å; E538-L541 VanDerWaalsContact O-N 3.15Å; L541-K543 PolarHBondContact O-N 2.66Å; L541-I544 PolarHBondContact O-N 2.71Å; L541-M545 WeakPolarHBondContact O-CB 3.41Å; L541-M545 VanDerWaalsContact O-CG 3.26Å; L541-M545 WeakPolarHBondContact O-CG 3.47Å; L541-M545 PolarHBondContact O-N 2.78Å; L541-M583 HydrophobicContact CD1-CB 4.45Å; L541-M583 HydrophobicContact CD1-SD 4.41Å; L541-M583 HydrophobicContact CD2-SD 3.92Å; L541-K586 HydrophobicContact CB-CD 4.43Å
542	D	94.2	Very high	90.3	Very high	72 Å²	72	55.1 Å²	55.1	39%	0.385	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-45.2	174.7	-77.2	-31.9	0	0	0	112.5	E538 K539 M540 I544 M545 I546 K586	E538-D542 PolarHBondContact O-N 3.26Å; K539-D542 PolarHBondContact O-N 3.22Å; M540-D542 VanDerWaalsContact C-N 3.31Å; M540-D542 PolarHBondContact O-N 3.22Å; D542-I544 VanDerWaalsContact C-N 3.34Å; D542-I544 PolarHBondContact O-N 3.49Å; D542-M545 PolarHBondContact O-N 3.22Å; D542-M545 VanDerWaalsContact O-N 3.17Å; D542-I546 WeakPolarHBondContact O-CG1 2.96Å; D542-I546 PolarHBondContact O-N 3.41Å; D542-K586 WeakPolarHBondContact OD1-CE 3.35Å; D542-K586 IonicContact OD1-NZ 2.84Å; D542-K586 PolarHBondContact OD1-NZ 3.06Å; D542-K586 IonicContact OD2-NZ 3.62Å
543	K	94.2	Very high	91.1	Very high	85 Å²	85	53.7 Å²	53.7	37%	0.37	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-42.3	175.7	-70.1	-172.8	176.4	-160.7	0	112.2	L474 D478 K539 M540 L541 M545 I546 I547	L474-K543 HydrophobicContact CD2-CB 3.89Å; D478-K543 IonicContact OD1-NZ 3.93Å; D478-K543 PolarHBondContact OD1-NZ 2.88Å; D478-K543 IonicContact OD2-NZ 3.54Å; D478-K543 PolarHBondContact OD2-NZ 3.46Å; K539-K543 WeakPolarHBondContact O-CG 3.39Å; K539-K543 PolarHBondContact O-N 3.13Å; K539-K543 VanDerWaalsContact O-N 3.07Å; M540-K543 PolarHBondContact O-N 3.19Å; L541-K543 PolarHBondContact O-N 2.66Å; K543-M545 VanDerWaalsContact C-N 3.29Å; K543-M545 PolarHBondContact O-N 3.11Å; K543-I546 WeakPolarHBondContact O-CB 3.04Å; K543-I546 PolarHBondContact O-N 2.97Å; K543-I547 PolarHBondContact O-N 3.45Å
544	I	94.8	Very high	91.5	Very high	1 Å²	1	52 Å²	52	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-40.4	175.9	-67.2	164	0	0	0	110.5	L474 I517 V521 M540 L541 D542 I546 I547 F548	L474-I544 HydrophobicContact CD1-CG1 4.13Å; L474-I544 HydrophobicContact CD2-CG1 4.33Å; I517-I544 HydrophobicContact CG2-CG2 3.77Å; V521-I544 HydrophobicContact CG2-CD1 4.11Å; V521-I544 HydrophobicContact CG2-CG2 3.74Å; M540-I544 HydrophobicContact CG-CD1 4.09Å; M540-I544 WeakPolarHBondContact O-CG1 3.27Å; M540-I544 PolarHBondContact O-N 2.77Å; M540-I544 HydrophobicContact SD-CD1 4Å; L541-I544 PolarHBondContact O-N 2.71Å; D542-I544 VanDerWaalsContact C-N 3.34Å; D542-I544 PolarHBondContact O-N 3.49Å; I544-I546 VanDerWaalsContact C-N 3.3Å; I544-I546 PolarHBondContact O-N 2.7Å; I544-I547 PolarHBondContact O-N 2.62Å; I544-I547 VanDerWaalsContact O-N 3.16Å; I544-F548 WeakPolarHBondContact O-CB 3.38Å; I544-F548 PolarHBondContact O-N 2.99Å
545	M	94.9	Very high	91.7	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.03	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-33.2	178.3	-72	-54.1	-54.7	0	0	112.6	L541 D542 K543 F548 R549 M583 K586 L587 E590	L541-M545 WeakPolarHBondContact O-CB 3.41Å; L541-M545 VanDerWaalsContact O-CG 3.26Å; L541-M545 WeakPolarHBondContact O-CG 3.47Å; L541-M545 PolarHBondContact O-N 2.78Å; D542-M545 PolarHBondContact O-N 3.22Å; D542-M545 VanDerWaalsContact O-N 3.17Å; K543-M545 VanDerWaalsContact C-N 3.29Å; K543-M545 PolarHBondContact O-N 3.11Å; M545-F548 HydrophobicContact CE-CB 4.45Å; M545-F548 HydrophobicContact CE-CD1 3.5Å; M545-F548 VanDerWaalsContact CE-CD1 3.5Å; M545-F548 HydrophobicContact CE-CE1 4.01Å; M545-F548 HydrophobicContact CE-CG 4.16Å; M545-F548 WeakPolarHBondContact O-CB 3.47Å; M545-F548 PolarHBondContact O-N 3.24Å; M545-F548 HydrophobicContact SD-CB 4.46Å; M545-F548 HydrophobicContact SD-CD1 4.36Å; M545-F548 HydrophobicContact SD-CG 4.48Å; M545-R549 WeakPolarHBondContact O-CG 3.24Å; M545-R549 PolarHBondContact O-N 3.42Å; M545-R549 VanDerWaalsContact O-N 3.17Å; M545-M583 HydrophobicContact SD-CE 3.53Å; M545-M583 VanDerWaalsContact SD-CE 3.53Å; M545-M583 HydrophobicContact SD-SD 4.28Å; M545-K586 HydrophobicContact CE-CB 4.44Å; M545-K586 HydrophobicContact CG-CB 4.04Å; M545-K586 HydrophobicContact CG-CD 4.09Å; M545-K586 HydrophobicContact SD-CB 4.4Å; M545-L587 HydrophobicContact CE-CD2 4.01Å; M545-L587 HydrophobicContact SD-CD2 4.07Å; M545-E590 HydrophobicContact CE-CB 4.05Å; M545-E590 HydrophobicContact CE-CG 3.43Å; M545-E590 VanDerWaalsContact CE-CG 3.43Å
546	I	93.4	Very high	91.9	Very high	62 Å²	62	41.9 Å²	41.9	32%	0.318	19%	0.19	S	C	.	.	H	α-helix	trans	-61.3	-46	171.7	-65.9	167.4	0	0	0	110.7	D542 K543 I544 R549 F550	D542-I546 WeakPolarHBondContact O-CG1 2.96Å; D542-I546 PolarHBondContact O-N 3.41Å; K543-I546 WeakPolarHBondContact O-CB 3.04Å; K543-I546 PolarHBondContact O-N 2.97Å; I544-I546 VanDerWaalsContact C-N 3.3Å; I544-I546 PolarHBondContact O-N 2.7Å; I546-R549 WeakPolarHBondContact O-CB 3.47Å; I546-R549 PolarHBondContact O-N 2.83Å; I546-F550 HydrophobicContact CG2-CE2 4.27Å
547	I	95.4	Very high	92.3	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-38.9	176.7	-57.8	-59.4	0	0	0	111.3	L474 K477 F502 I506 I517 K543 I544 R549 F550	L474-I547 HydrophobicContact CD2-CG1 3.78Å; K477-I547 HydrophobicContact CB-CD1 3.84Å; K477-I547 HydrophobicContact CD-CD1 4.43Å; K477-I547 HydrophobicContact CG-CD1 3.88Å; F502-I547 HydrophobicContact CE1-CD1 4.48Å; I506-I547 HydrophobicContact CD1-CG2 4.12Å; I517-I547 HydrophobicContact CD1-CG2 3.86Å; K543-I547 PolarHBondContact O-N 3.45Å; I544-I547 PolarHBondContact O-N 2.62Å; I544-I547 VanDerWaalsContact O-N 3.16Å; I547-R549 PolarHBondContact O-N 3.33Å; I547-F550 HydrophobicContact CD1-CD2 4.48Å; I547-F550 HydrophobicContact CD1-CE2 4.48Å; I547-F550 WeakPolarHBondContact O-CB 3.37Å; I547-F550 PolarHBondContact O-N 3.41Å
548	F	95	Very high	92.5	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-57.7	-33.8	178.4	171.9	-96.1	0	0	0	113	I544 M545 F550 I551 K554 F557 L587 E590 C591	I544-F548 WeakPolarHBondContact O-CB 3.38Å; I544-F548 PolarHBondContact O-N 2.99Å; M545-F548 HydrophobicContact CE-CB 4.45Å; M545-F548 HydrophobicContact CE-CD1 3.5Å; M545-F548 VanDerWaalsContact CE-CD1 3.5Å; M545-F548 HydrophobicContact CE-CE1 4.01Å; M545-F548 HydrophobicContact CE-CG 4.16Å; M545-F548 WeakPolarHBondContact O-CB 3.47Å; M545-F548 PolarHBondContact O-N 3.24Å; M545-F548 HydrophobicContact SD-CB 4.46Å; M545-F548 HydrophobicContact SD-CD1 4.36Å; M545-F548 HydrophobicContact SD-CG 4.48Å; F548-F550 PolarHBondContact O-N 3.17Å; F548-I551 HydrophobicContact CD2-CD1 4.29Å; F548-I551 PolarHBondContact O-N 3.29Å; F548-K554 HydrophobicContact CE1-CD 3.96Å; F548-K554 HydrophobicContact CE1-CG 4.42Å; F548-K554 HydrophobicContact CE2-CB 4.33Å; F548-K554 HydrophobicContact CE2-CD 4.43Å; F548-K554 HydrophobicContact CE2-CG 4Å; F548-K554 HydrophobicContact CZ-CB 4.12Å; F548-K554 HydrophobicContact CZ-CD 3.71Å; F548-K554 HydrophobicContact CZ-CG 3.75Å; F548-F557 HydrophobicContact CD2-CD1 4.32Å; F548-F557 HydrophobicContact CD2-CD2 4.18Å; F548-F557 HydrophobicContact CD2-CE2 4.44Å; F548-F557 HydrophobicContact CD2-CG 4.12Å; F548-F557 HydrophobicContact CE2-CB 4.05Å; F548-F557 AromaticContact CE2-CD1 3.59Å; F548-F557 HydrophobicContact CE2-CD1 3.59Å; F548-F557 HydrophobicContact CE2-CD2 4.18Å; F548-F557 HydrophobicContact CE2-CE1 4.09Å; F548-F557 AromaticContact CE2-CG 3.66Å; F548-F557 HydrophobicContact CE2-CG 3.66Å; F548-F557 HydrophobicContact CZ-CD1 4.32Å; F548-L587 HydrophobicContact CE1-CD2 4.27Å; F548-L587 HydrophobicContact CZ-CD2 4.13Å; F548-E590 HydrophobicContact CE1-CB 4.3Å; F548-C591 WeakPolarHBondContact CE1-SG 3.48Å; F548-C591 VanDerWaalsContact CZ-SG 3.52Å
549	R	93.9	Very high	92.5	Very high	126 Å²	126	35.9 Å²	35.9	48%	0.475	16%	0.164	S	C	.	.	H	α-helix	trans	-55.6	-38.9	175.7	-73.1	174.1	180	162.6	4.4	112.1	M545 I546 I547 I551 K554 E590	M545-R549 WeakPolarHBondContact O-CG 3.24Å; M545-R549 PolarHBondContact O-N 3.42Å; M545-R549 VanDerWaalsContact O-N 3.17Å; I546-R549 WeakPolarHBondContact O-CB 3.47Å; I546-R549 PolarHBondContact O-N 2.83Å; I547-R549 PolarHBondContact O-N 3.33Å; R549-I551 VanDerWaalsContact C-N 3.25Å; R549-I551 PolarHBondContact O-N 3.26Å; R549-K554 PolarHBondContact O-NZ 3.16Å; R549-K554 VanDerWaalsContact O-NZ 3.13Å; R549-E590 WeakPolarHBondContact CD-OE2 3.38Å; R549-E590 VanDerWaalsContact CG-OE2 3.25Å; R549-E590 WeakPolarHBondContact CG-OE2 3.4Å; R549-E590 IonicContact CZ-OE1 3.54Å; R549-E590 VanDerWaalsContact CZ-OE1 3.29Å; R549-E590 IonicContact CZ-OE2 3.28Å; R549-E590 IonicContact NE-OE1 3.96Å; R549-E590 PolarHBondContact NE-OE1 3.4Å; R549-E590 VanDerWaalsContact NE-OE1 3.12Å; R549-E590 IonicContact NE-OE2 3.05Å; R549-E590 PolarHBondContact NE-OE2 3.49Å; R549-E590 IonicContact NH2-OE1 3.3Å; R549-E590 PolarHBondContact NH2-OE1 3.22Å; R549-E590 IonicContact NH2-OE2 2.74Å
550	F	93.9	Very high	92.6	Very high	18 Å²	18	30.5 Å²	30.5	8%	0.079	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-5.4	-177.1	-56.5	-48.9	0	0	0	114.6	K499 F502 E503 I506 N507 I546 I547 F548	K499-F550 HydrophobicContact CB-CE1 4.04Å; K499-F550 HydrophobicContact CG-CE1 4.11Å; K499-F550 HydrophobicContact CG-CZ 4.32Å; F502-F550 HydrophobicContact CB-CD1 4.38Å; F502-F550 HydrophobicContact CB-CD2 3.88Å; F502-F550 HydrophobicContact CB-CE1 4.46Å; F502-F550 HydrophobicContact CB-CE2 3.96Å; F502-F550 HydrophobicContact CB-CG 4.12Å; F502-F550 HydrophobicContact CB-CZ 4.26Å; F502-F550 HydrophobicContact CD1-CD2 4.3Å; F502-F550 HydrophobicContact CD1-CE2 4.26Å; F502-F550 HydrophobicContact CG-CD2 4.47Å; F502-F550 HydrophobicContact CG-CE2 4.31Å; E503-F550 HydrophobicContact CB-CB 4.42Å; E503-F550 HydrophobicContact CB-CD1 4.3Å; I506-F550 HydrophobicContact CD1-CB 3.92Å; I506-F550 HydrophobicContact CD1-CD2 4.23Å; N507-F550 PolarHBondContact ND2-O 3.43Å; I546-F550 HydrophobicContact CG2-CE2 4.27Å; I547-F550 HydrophobicContact CD1-CD2 4.48Å; I547-F550 HydrophobicContact CD1-CE2 4.48Å; I547-F550 WeakPolarHBondContact O-CB 3.37Å; I547-F550 PolarHBondContact O-N 3.41Å; F548-F550 PolarHBondContact O-N 3.17Å
551	I	92.6	Very high	92.8	Very high	4 Å²	4	29 Å²	29	2%	0.021	13%	0.133	C	C	.	.			trans	-91.3	135.5	-175.4	-57.8	169	0	0	0	111.2	I506 A514 I517 F548 R549 K554	I506-I551 HydrophobicContact CG2-CG1 4.16Å; A514-I551 HydrophobicContact CB-CG2 3.81Å; I517-I551 HydrophobicContact CD1-CD1 3.34Å; I517-I551 HydrophobicContact CD1-CG1 4.34Å; I517-I551 HydrophobicContact CG1-CD1 4.49Å; F548-I551 HydrophobicContact CD2-CD1 4.29Å; F548-I551 PolarHBondContact O-N 3.29Å; R549-I551 VanDerWaalsContact C-N 3.25Å; R549-I551 PolarHBondContact O-N 3.26Å; I551-K554 PolarHBondContact O-NZ 3.03Å
552	Y	87.7	Confident	92.9	Very high	97 Å²	97	30.5 Å²	30.5	38%	0.38	14%	0.14	S	C	.	.	S	Bend	trans	-79.2	-46.9	170.9	-63.7	-23.4	0	0	0	113.1	E503 N507 K554 P835	E503-Y552 HydrophobicContact CG-CE1 3.77Å; E503-Y552 WeakPolarHBondContact OE1-CE1 3.41Å; E503-Y552 VanDerWaalsContact OE1-CZ 3.27Å; E503-Y552 PolarHBondContact OE1-OH 3.29Å; N507-Y552 HydrophobicContact CB-CD2 3.6Å; N507-Y552 HydrophobicContact CB-CE2 3.79Å; N507-Y552 HydrophobicContact CB-CG 4.24Å; N507-Y552 PolarHBondContact OD1-N 3.22Å; Y552-K554 PolarHBondContact O-N 3.34Å; Y552-P835 HydrophobicContact CD2-CG 4.14Å; Y552-P835 HydrophobicContact CG-CG 4.48Å
553	G	84.4	Confident	92.7	Very high	5 Å²	5	27.7 Å²	27.7	5%	0.052	13%	0.125	C	C	.	.			trans	-74.6	54.1	-177.6	0	0	0	0	0	115.6	A514 D555 V556 F557	A514-G553 VanDerWaalsContact CB-O 3.27Å; A514-G553 WeakPolarHBondContact CB-O 3.41Å; G553-D555 VanDerWaalsContact C-OD1 3.28Å; G553-D555 WeakPolarHBondContact CA-OD1 3.48Å; G553-D555 PolarHBondContact O-N 3.37Å; G553-V556 WeakPolarHBondContact O-CB 3.24Å; G553-V556 PolarHBondContact O-N 2.83Å; G553-V556 VanDerWaalsContact O-N 3.13Å; G553-F557 PolarHBondContact O-N 2.96Å
554	K	91.4	Very high	92.5	Very high	46 Å²	46	24 Å²	24	20%	0.2	11%	0.108	C	C	.	.	H	α-helix	trans	-64.8	-25.6	-178.9	-65.7	-176.2	169.9	74.5	0	113.2	F548 R549 I551 Y552 F557 E558 F595	F548-K554 HydrophobicContact CE1-CD 3.96Å; F548-K554 HydrophobicContact CE1-CG 4.42Å; F548-K554 HydrophobicContact CE2-CB 4.33Å; F548-K554 HydrophobicContact CE2-CD 4.43Å; F548-K554 HydrophobicContact CE2-CG 4Å; F548-K554 HydrophobicContact CZ-CB 4.12Å; F548-K554 HydrophobicContact CZ-CD 3.71Å; F548-K554 HydrophobicContact CZ-CG 3.75Å; R549-K554 PolarHBondContact O-NZ 3.16Å; R549-K554 VanDerWaalsContact O-NZ 3.13Å; I551-K554 PolarHBondContact O-NZ 3.03Å; Y552-K554 PolarHBondContact O-N 3.34Å; K554-F557 WeakPolarHBondContact O-CB 3.29Å; K554-F557 PolarHBondContact O-N 2.82Å; K554-E558 PolarHBondContact O-N 3.46Å; K554-F595 HydrophobicContact CB-CE2 4.28Å; K554-F595 WeakPolarHBondContact O-CZ 3.31Å
555	D	90	Very high	92.4	Very high	24 Å²	24	23.9 Å²	23.9	13%	0.128	11%	0.108	C	C	.	.	H	α-helix	trans	-66.3	-35.4	172.3	61	-25.8	0	0	0	113	G553 E558 A559 V797 R801	G553-D555 VanDerWaalsContact C-OD1 3.28Å; G553-D555 WeakPolarHBondContact CA-OD1 3.48Å; G553-D555 PolarHBondContact O-N 3.37Å; D555-E558 PolarHBondContact O-N 3.26Å; D555-A559 PolarHBondContact O-N 3.43Å; D555-V797 WeakPolarHBondContact OD2-CG1 3.43Å; D555-R801 IonicContact OD1-CZ 2.8Å; D555-R801 IonicContact OD1-NE 2.83Å; D555-R801 IonicContact OD1-NH2 3.85Å; D555-R801 PolarHBondContact OD1-NH2 2.87Å; D555-R801 WeakPolarHBondContact OD2-CG 3.29Å; D555-R801 IonicContact OD2-CZ 3.18Å; D555-R801 IonicContact OD2-NE 2.99Å; D555-R801 PolarHBondContact OD2-NE 2.84Å; D555-R801 IonicContact OD2-NH2 3.89Å; D555-R801 PolarHBondContact OD2-NH2 2.92Å
556	V	92.8	Very high	92.2	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-64.1	-47.2	171.4	178.3	0	0	0	0	109.4	N511 A514 E515 G553 E558 A559 F560 V797 R801	N511-V556 HydrophobicContact CB-CG1 4.31Å; N511-V556 HydrophobicContact CB-CG2 4.01Å; A514-V556 HydrophobicContact CB-CB 4.02Å; A514-V556 HydrophobicContact CB-CG1 4.16Å; E515-V556 HydrophobicContact CB-CG1 4.41Å; G553-V556 WeakPolarHBondContact O-CB 3.24Å; G553-V556 PolarHBondContact O-N 2.83Å; G553-V556 VanDerWaalsContact O-N 3.13Å; V556-E558 VanDerWaalsContact C-N 3.33Å; V556-E558 PolarHBondContact O-N 3.46Å; V556-A559 PolarHBondContact O-N 3.36Å; V556-F560 HydrophobicContact CG1-CD2 3.75Å; V556-F560 HydrophobicContact CG1-CE2 3.73Å; V556-F560 VanDerWaalsContact O-CD2 3.27Å; V556-F560 WeakPolarHBondContact O-CD2 3.48Å; V556-F560 PolarHBondContact O-N 3.44Å; V556-F560 VanDerWaalsContact O-N 3.15Å; V556-V797 HydrophobicContact CG2-CG1 3.84Å; V556-R801 VanDerWaalsContact CG2-NH2 3.33Å
557	F	94.6	Very high	91.8	Very high	1 Å²	1	22.4 Å²	22.4	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-56	-48.3	174	172.3	-84.9	0	0	0	110.9	A514 I517 A518 F548 G553 K554 A559 F560 Y561 M583 L587 F595	A514-F557 HydrophobicContact CB-CB 4.22Å; I517-F557 HydrophobicContact CG2-CD2 4.07Å; I517-F557 HydrophobicContact CG2-CE2 3.93Å; A518-F557 HydrophobicContact CB-CD2 3.63Å; A518-F557 HydrophobicContact CB-CE2 3.88Å; A518-F557 HydrophobicContact CB-CG 4.31Å; F548-F557 HydrophobicContact CD2-CD1 4.32Å; F548-F557 HydrophobicContact CD2-CD2 4.18Å; F548-F557 HydrophobicContact CD2-CE2 4.44Å; F548-F557 HydrophobicContact CD2-CG 4.12Å; F548-F557 HydrophobicContact CE2-CB 4.05Å; F548-F557 AromaticContact CE2-CD1 3.59Å; F548-F557 HydrophobicContact CE2-CD1 3.59Å; F548-F557 HydrophobicContact CE2-CD2 4.18Å; F548-F557 HydrophobicContact CE2-CE1 4.09Å; F548-F557 AromaticContact CE2-CG 3.66Å; F548-F557 HydrophobicContact CE2-CG 3.66Å; F548-F557 HydrophobicContact CZ-CD1 4.32Å; G553-F557 PolarHBondContact O-N 2.96Å; K554-F557 WeakPolarHBondContact O-CB 3.29Å; K554-F557 PolarHBondContact O-N 2.82Å; F557-A559 VanDerWaalsContact C-N 3.33Å; F557-A559 PolarHBondContact O-N 3.46Å; F557-F560 PolarHBondContact O-N 3.17Å; F557-Y561 HydrophobicContact CE1-CD2 4.08Å; F557-Y561 AromaticContact CE1-CG 3.98Å; F557-Y561 HydrophobicContact CE1-CG 3.98Å; F557-Y561 HydrophobicContact CE2-CD2 4.38Å; F557-Y561 AromaticContact CZ-CD2 3.65Å; F557-Y561 HydrophobicContact CZ-CD2 3.65Å; F557-Y561 HydrophobicContact CZ-CE2 4.35Å; F557-Y561 HydrophobicContact CZ-CG 4.03Å; F557-Y561 WeakPolarHBondContact O-CB 3.39Å; F557-Y561 PolarHBondContact O-N 3.07Å; F557-M583 HydrophobicContact CZ-CE 4.13Å; F557-L587 HydrophobicContact CD1-CD2 4.44Å; F557-L587 HydrophobicContact CE1-CD1 4.04Å; F557-L587 HydrophobicContact CE1-CD2 3.57Å; F557-L587 HydrophobicContact CE1-CG 4.48Å; F557-L587 HydrophobicContact CZ-CD2 4.08Å; F557-F595 HydrophobicContact CD1-CZ 4.37Å
558	E	93.3	Very high	91.4	Very high	32 Å²	32	22.2 Å²	22.2	15%	0.15	10%	0.098	C	C	.	.	H	α-helix	trans	-55.8	-46.7	178.6	-165.5	-154.6	140	0	0	111.7	K554 D555 V556 Y561 K562 F595	K554-E558 PolarHBondContact O-N 3.46Å; D555-E558 PolarHBondContact O-N 3.26Å; V556-E558 VanDerWaalsContact C-N 3.33Å; V556-E558 PolarHBondContact O-N 3.46Å; E558-Y561 PolarHBondContact O-N 2.97Å; E558-K562 WeakPolarHBondContact O-CB 3.35Å; E558-K562 PolarHBondContact O-N 3.4Å; E558-F595 HydrophobicContact CB-CE1 4.42Å; E558-F595 HydrophobicContact CB-CE2 3.7Å; E558-F595 HydrophobicContact CB-CZ 3.59Å; E558-F595 HydrophobicContact CG-CE1 4.37Å; E558-F595 HydrophobicContact CG-CE2 4.03Å; E558-F595 HydrophobicContact CG-CZ 3.96Å
559	A	92	Very high	91.1	Very high	16 Å²	16	23.8 Å²	23.8	13%	0.132	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-47.7	-176.8	0	0	0	0	0	112.2	D555 V556 F557 K563 T793 V797	D555-A559 PolarHBondContact O-N 3.43Å; V556-A559 PolarHBondContact O-N 3.36Å; F557-A559 VanDerWaalsContact C-N 3.33Å; F557-A559 PolarHBondContact O-N 3.46Å; A559-K563 WeakPolarHBondContact O-CB 3.32Å; A559-K563 PolarHBondContact O-N 2.88Å; A559-T793 HydrophobicContact CB-CG2 4.12Å; A559-V797 HydrophobicContact CB-CG2 3.34Å
560	F	93.1	Very high	90.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.8	-45.7	176.5	-76.5	-75.2	0	0	0	111.5	E515 A518 V556 F557 K562 K563 D564 E785 Q790 T793	E515-F560 HydrophobicContact CB-CD2 3.95Å; E515-F560 HydrophobicContact CB-CE2 3.92Å; E515-F560 HydrophobicContact CB-CZ 4.49Å; E515-F560 HydrophobicContact CG-CD1 4.1Å; E515-F560 HydrophobicContact CG-CD2 3.78Å; E515-F560 HydrophobicContact CG-CE1 3.97Å; E515-F560 HydrophobicContact CG-CE2 3.65Å; E515-F560 HydrophobicContact CG-CG 4.03Å; E515-F560 HydrophobicContact CG-CZ 3.75Å; A518-F560 HydrophobicContact CB-CB 3.77Å; V556-F560 HydrophobicContact CG1-CD2 3.75Å; V556-F560 HydrophobicContact CG1-CE2 3.73Å; V556-F560 VanDerWaalsContact O-CD2 3.27Å; V556-F560 WeakPolarHBondContact O-CD2 3.48Å; V556-F560 PolarHBondContact O-N 3.44Å; V556-F560 VanDerWaalsContact O-N 3.15Å; F557-F560 PolarHBondContact O-N 3.17Å; F560-K562 PolarHBondContact O-N 3.26Å; F560-K563 WeakPolarHBondContact O-CB 3.44Å; F560-K563 PolarHBondContact O-N 2.97Å; F560-D564 PolarHBondContact O-N 3.44Å; F560-E785 WeakPolarHBondContact CE1-OE1 3.44Å; F560-Q790 HydrophobicContact CE1-CG 4.06Å; F560-Q790 HydrophobicContact CZ-CG 4.22Å; F560-T793 HydrophobicContact CD1-CG2 4.15Å; F560-T793 HydrophobicContact CE1-CG2 3.98Å; F560-T793 HydrophobicContact CE2-CG2 4.39Å; F560-T793 HydrophobicContact CG-CG2 4.42Å; F560-T793 HydrophobicContact CZ-CG2 4.1Å
561	Y	94.9	Very high	89.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-45.8	178.9	-174.4	-89.7	0	0	0	112.1	V521 F557 E558 K563 D564 L565 M583 L584 L587 L599	V521-Y561 HydrophobicContact CG1-CD2 4.39Å; V521-Y561 HydrophobicContact CG1-CE2 3.76Å; F557-Y561 HydrophobicContact CE1-CD2 4.08Å; F557-Y561 AromaticContact CE1-CG 3.98Å; F557-Y561 HydrophobicContact CE1-CG 3.98Å; F557-Y561 HydrophobicContact CE2-CD2 4.38Å; F557-Y561 AromaticContact CZ-CD2 3.65Å; F557-Y561 HydrophobicContact CZ-CD2 3.65Å; F557-Y561 HydrophobicContact CZ-CE2 4.35Å; F557-Y561 HydrophobicContact CZ-CG 4.03Å; F557-Y561 WeakPolarHBondContact O-CB 3.39Å; F557-Y561 PolarHBondContact O-N 3.07Å; E558-Y561 PolarHBondContact O-N 2.97Å; Y561-K563 VanDerWaalsContact C-N 3.32Å; Y561-K563 PolarHBondContact O-N 2.98Å; Y561-D564 PolarHBondContact O-N 3.06Å; Y561-L565 HydrophobicContact CE1-CB 4.42Å; Y561-L565 HydrophobicContact CE1-CD2 4.26Å; Y561-L565 WeakPolarHBondContact O-CB 3.43Å; Y561-L565 PolarHBondContact O-N 3.48Å; Y561-M583 HydrophobicContact CE2-CG 4.14Å; Y561-M583 VanDerWaalsContact OH-CG 3.26Å; Y561-M583 WeakPolarHBondContact OH-CG 3.49Å; Y561-L584 HydrophobicContact CE1-CD2 4.39Å; Y561-L587 HydrophobicContact CD1-CD1 4.36Å; Y561-L587 HydrophobicContact CE1-CD1 4.06Å; Y561-L599 HydrophobicContact CD1-CD1 3.93Å; Y561-L599 HydrophobicContact CD1-CD2 4.15Å; Y561-L599 HydrophobicContact CE1-CD1 4.06Å
562	K	93.7	Very high	88.5	Confident	32 Å²	32	21.4 Å²	21.4	14%	0.139	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-43.1	177.5	-178.1	172.3	64.7	-168.3	0	111.7	E558 F560 A566 L599 M602 P642	E558-K562 WeakPolarHBondContact O-CB 3.35Å; E558-K562 PolarHBondContact O-N 3.4Å; F560-K562 PolarHBondContact O-N 3.26Å; K562-A566 WeakPolarHBondContact O-CB 3.47Å; K562-A566 PolarHBondContact O-N 3.27Å; K562-L599 HydrophobicContact CB-CD2 3.71Å; K562-L599 HydrophobicContact CG-CD2 3.88Å; K562-M602 HydrophobicContact CD-SD 4.48Å; K562-M602 HydrophobicContact CG-SD 3.78Å; K562-P642 HydrophobicContact CG-CG 4.33Å
563	K	90.6	Very high	87.5	Confident	14 Å²	14	18.6 Å²	18.6	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-65.2	-46	179.1	-170.2	-178.9	76.2	155	0	111.8	A559 F560 Y561 A566 K567 P642 E785 E789 T793	A559-K563 WeakPolarHBondContact O-CB 3.32Å; A559-K563 PolarHBondContact O-N 2.88Å; F560-K563 WeakPolarHBondContact O-CB 3.44Å; F560-K563 PolarHBondContact O-N 2.97Å; Y561-K563 VanDerWaalsContact C-N 3.32Å; Y561-K563 PolarHBondContact O-N 2.98Å; K563-A566 WeakPolarHBondContact O-CB 3.3Å; K563-A566 PolarHBondContact O-N 3.28Å; K563-K567 PolarHBondContact O-N 3.22Å; K563-P642 HydrophobicContact CB-CG 4.45Å; K563-E785 IonicContact NZ-OE1 3.91Å; K563-E785 PolarHBondContact NZ-OE1 3.25Å; K563-E789 HydrophobicContact CD-CG 4.49Å; K563-E789 WeakPolarHBondContact CD-OE1 3.16Å; K563-E789 VanDerWaalsContact CE-OE1 3.25Å; K563-E789 WeakPolarHBondContact CE-OE1 3.41Å; K563-E789 IonicContact NZ-OE1 3.88Å; K563-E789 PolarHBondContact NZ-OE1 2.96Å; K563-T793 PolarHBondContact NZ-OG1 3.49Å
564	D	90.5	Very high	87.1	Confident	6 Å²	6	20 Å²	20	3%	0.032	12%	0.118	C	C	.	.	H	α-helix	trans	-69.5	-38.9	179.5	-72	-25.8	0	0	0	111.7	D522 F560 Y561 A566 K567 R568	D522-D564 HydrophobicContact CB-CB 3.93Å; F560-D564 PolarHBondContact O-N 3.44Å; Y561-D564 PolarHBondContact O-N 3.06Å; D564-A566 VanDerWaalsContact C-N 3.31Å; D564-A566 PolarHBondContact O-N 3.12Å; D564-K567 WeakPolarHBondContact O-CB 3.46Å; D564-K567 PolarHBondContact O-N 3.19Å; D564-R568 WeakPolarHBondContact O-CG 3.41Å; D564-R568 PolarHBondContact O-N 3.5Å
565	L	91.8	Very high	86.1	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.4	-44.3	171.2	178	65.1	0	0	0	111.3	Y561 K567 R568 L569 E580 L599 M602 F603	Y561-L565 HydrophobicContact CE1-CB 4.42Å; Y561-L565 HydrophobicContact CE1-CD2 4.26Å; Y561-L565 WeakPolarHBondContact O-CB 3.43Å; Y561-L565 PolarHBondContact O-N 3.48Å; L565-K567 VanDerWaalsContact C-N 3.3Å; L565-K567 PolarHBondContact O-N 3.4Å; L565-R568 PolarHBondContact O-N 3.12Å; L565-R568 VanDerWaalsContact O-N 3.1Å; L565-L569 HydrophobicContact CD1-CD1 4.06Å; L565-L569 HydrophobicContact CD1-CD2 4.41Å; L565-L569 HydrophobicContact CD1-CG 3.94Å; L565-L569 HydrophobicContact CD2-CD1 4.43Å; L565-L569 HydrophobicContact CG-CD1 3.91Å; L565-L569 HydrophobicContact CG-CG 4.2Å; L565-L569 WeakPolarHBondContact O-CG 3.3Å; L565-L569 PolarHBondContact O-N 2.87Å; L565-E580 WeakPolarHBondContact CD1-OE2 3.29Å; L565-L599 HydrophobicContact CD2-CB 4.32Å; L565-L599 HydrophobicContact CD2-CD2 3.87Å; L565-M602 HydrophobicContact CB-CE 4.29Å; L565-M602 HydrophobicContact CD2-CE 3.99Å; L565-M602 HydrophobicContact CD2-SD 4.26Å; L565-M602 HydrophobicContact CG-CE 3.98Å; L565-F603 HydrophobicContact CD1-CE2 4.01Å; L565-F603 HydrophobicContact CD1-CZ 4.11Å; L565-F603 HydrophobicContact CD2-CE2 3.98Å
566	A	90.3	Very high	85.7	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-42.9	177.4	0	0	0	0	0	111.8	K562 K563 D564 R568 L570 M602 W641 P642 Y644	K562-A566 WeakPolarHBondContact O-CB 3.47Å; K562-A566 PolarHBondContact O-N 3.27Å; K563-A566 WeakPolarHBondContact O-CB 3.3Å; K563-A566 PolarHBondContact O-N 3.28Å; D564-A566 VanDerWaalsContact C-N 3.31Å; D564-A566 PolarHBondContact O-N 3.12Å; A566-R568 PolarHBondContact O-N 3.32Å; A566-L570 WeakPolarHBondContact O-CB 3.44Å; A566-L570 WeakPolarHBondContact O-CG 3.11Å; A566-L570 PolarHBondContact O-N 3.12Å; A566-M602 HydrophobicContact CB-CE 3.69Å; A566-W641 HydrophobicContact CB-CE3 3.76Å; A566-W641 HydrophobicContact CB-CZ3 3.78Å; A566-P642 HydrophobicContact CB-CG 4.02Å; A566-Y644 VanDerWaalsContact CB-OH 3.29Å; A566-Y644 WeakPolarHBondContact CB-OH 3.35Å
567	K	86.1	Confident	85.2	Confident	36 Å²	36	24 Å²	24	16%	0.157	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-39.4	174.6	-67.7	179.4	-178	-179	0	111.9	K563 D564 L565 V571 E789	K563-K567 PolarHBondContact O-N 3.22Å; D564-K567 WeakPolarHBondContact O-CB 3.46Å; D564-K567 PolarHBondContact O-N 3.19Å; L565-K567 VanDerWaalsContact C-N 3.3Å; L565-K567 PolarHBondContact O-N 3.4Å; K567-V571 WeakPolarHBondContact O-CB 3.41Å; K567-V571 WeakPolarHBondContact O-CG2 3.35Å; K567-V571 PolarHBondContact O-N 3.46Å; K567-E789 VanDerWaalsContact CE-OE1 3.29Å; K567-E789 WeakPolarHBondContact CE-OE1 3.29Å; K567-E789 VanDerWaalsContact NZ-CD 3.27Å; K567-E789 IonicContact NZ-OE1 3.72Å; K567-E789 PolarHBondContact NZ-OE1 2.85Å; K567-E789 IonicContact NZ-OE2 3.66Å; K567-E789 PolarHBondContact NZ-OE2 2.88Å
568	R	87.4	Confident	84.9	Confident	1 Å²	1	29.7 Å²	29.7	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-68.5	-44.7	178.8	-68.7	-166	-54.5	-86.3	4.9	112.5	D522 D564 L565 A566 G572 K573 E580	D522-R568 WeakPolarHBondContact OD1-CD 3.41Å; D522-R568 IonicContact OD1-CZ 2.76Å; D522-R568 IonicContact OD1-NE 3.66Å; D522-R568 IonicContact OD1-NH1 3.64Å; D522-R568 PolarHBondContact OD1-NH1 3.48Å; D564-R568 WeakPolarHBondContact O-CG 3.41Å; D564-R568 PolarHBondContact O-N 3.5Å; L565-R568 PolarHBondContact O-N 3.12Å; L565-R568 VanDerWaalsContact O-N 3.1Å; A566-R568 PolarHBondContact O-N 3.32Å; R568-G572 PolarHBondContact O-N 3.33Å; R568-K573 PolarHBondContact O-N 3.25Å; R568-E580 IonicContact CZ-OE1 3.46Å; R568-E580 IonicContact CZ-OE2 2.88Å; R568-E580 IonicContact NE-OE1 2.85Å; R568-E580 PolarHBondContact NE-OE1 2.7Å; R568-E580 IonicContact NE-OE2 3.36Å; R568-E580 IonicContact NH2-OE1 2.7Å; R568-E580 IonicContact NH2-OE2 2.77Å; R568-E580 PolarHBondContact NH2-OE2 2.97Å
569	L	87.3	Confident	84.7	Confident	34 Å²	34	28.7 Å²	28.7	18%	0.178	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-49.1	179.5	-70.3	178	0	0	0	112.2	L565 M602 F603 M606 W641	L565-L569 HydrophobicContact CD1-CD1 4.06Å; L565-L569 HydrophobicContact CD1-CD2 4.41Å; L565-L569 HydrophobicContact CD1-CG 3.94Å; L565-L569 HydrophobicContact CD2-CD1 4.43Å; L565-L569 HydrophobicContact CG-CD1 3.91Å; L565-L569 HydrophobicContact CG-CG 4.2Å; L565-L569 WeakPolarHBondContact O-CG 3.3Å; L565-L569 PolarHBondContact O-N 2.87Å; L569-M602 HydrophobicContact CD1-CB 4.22Å; L569-M602 HydrophobicContact CD1-CE 4.24Å; L569-F603 HydrophobicContact CD1-CE2 4.41Å; L569-F603 HydrophobicContact CD2-CD1 4.48Å; L569-F603 HydrophobicContact CD2-CE1 3.86Å; L569-F603 HydrophobicContact CD2-CZ 3.93Å; L569-M606 HydrophobicContact CB-CG 4.4Å; L569-M606 HydrophobicContact CB-SD 4.24Å; L569-M606 HydrophobicContact CD1-CG 4.19Å; L569-W641 HydrophobicContact CB-CH2 4.33Å; L569-W641 HydrophobicContact CD1-CH2 4.05Å
570	L	84.5	Confident	84.6	Confident	16 Å²	16	28 Å²	28	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-76.9	-28.9	-173.3	-64.5	173.9	0	0	0	113.6	A566 M606 N634 L636 W641 L681	A566-L570 WeakPolarHBondContact O-CB 3.44Å; A566-L570 WeakPolarHBondContact O-CG 3.11Å; A566-L570 PolarHBondContact O-N 3.12Å; L570-M606 HydrophobicContact CD2-CE 4.06Å; L570-M606 HydrophobicContact CD2-SD 4.16Å; L570-N634 HydrophobicContact CD2-CB 4.28Å; L570-L636 HydrophobicContact CD1-CD1 4.05Å; L570-L636 HydrophobicContact CD2-CD1 4.16Å; L570-L636 HydrophobicContact CD2-CD2 3.99Å; L570-W641 HydrophobicContact CD1-CE3 4.24Å; L570-W641 HydrophobicContact CD1-CZ3 3.77Å; L570-W641 HydrophobicContact CD2-CH2 4.06Å; L570-W641 HydrophobicContact CD2-CZ3 4.04Å; L570-W641 HydrophobicContact CG-CH2 4.19Å; L570-W641 HydrophobicContact CG-CZ3 3.74Å; L570-L681 HydrophobicContact CD1-CB 4.45Å; L570-L681 HydrophobicContact CD1-CD1 3.85Å; L570-L681 HydrophobicContact CD1-CD2 4.22Å; L570-L681 HydrophobicContact CD1-CG 4.4Å
571	V	75.7	Confident	84.4	Confident	20 Å²	20	32.5 Å²	32.5	12%	0.121	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	7.9	-175.6	-164.5	0	0	0	0	112.7	K567 K777 M783	K567-V571 WeakPolarHBondContact O-CB 3.41Å; K567-V571 WeakPolarHBondContact O-CG2 3.35Å; K567-V571 PolarHBondContact O-N 3.46Å; V571-K777 PolarHBondContact O-NZ 3.18Å; V571-K777 VanDerWaalsContact O-NZ 3.16Å; V571-M783 HydrophobicContact CB-CE 3.55Å; V571-M783 HydrophobicContact CB-SD 4.05Å; V571-M783 HydrophobicContact CG1-CE 3.6Å; V571-M783 HydrophobicContact CG1-SD 3.37Å; V571-M783 WeakPolarHBondContact CG1-SD 3.47Å; V571-M783 HydrophobicContact CG2-CE 3.84Å; V571-M783 HydrophobicContact CG2-SD 4.39Å
572	G	67.4	Low	84.4	Confident	62 Å²	62	33.8 Å²	33.8	64%	0.639	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	55.5	173	0	0	0	0	0	112.4	R568	R568-G572 PolarHBondContact O-N 3.33Å
573	K	66.1	Low	84.4	Confident	39 Å²	39	32.2 Å²	32.2	17%	0.17	20%	0.196	C	C	.	.			trans	-125.4	10.3	-175.5	-70.2	-158.9	-179.1	176.3	0	114.9	R526 A527 R568 K777 M783	R526-K573 CarbonylContact C-O 3.53Å; R526-K573 WeakPolarHBondContact CA-O 2.99Å; A527-K573 WeakPolarHBondContact CB-O 3.4Å; A527-K573 PolarHBondContact N-O 3.48Å; R568-K573 PolarHBondContact O-N 3.25Å; K573-K777 VanDerWaalsContact CE-CE 3.43Å; K573-K777 VanDerWaalsContact CE-NZ 3.35Å; K573-M783 HydrophobicContact CD-CE 3.59Å; K573-M783 HydrophobicContact CD-SD 3.9Å; K573-M783 WeakPolarHBondContact CE-SD 3.26Å; K573-M783 HydrophobicContact CG-CE 4.28Å; K573-M783 PolarHBondContact NZ-SD 2.92Å
574	S	75.6	Confident	84.5	Confident	33 Å²	33	32.2 Å²	32.2	23%	0.231	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-70.2	141.7	174.4	-62.3	0	0	0	0	111.4	L525 E580	L525-S574 CarbonylContact O-C 3.43Å; L525-S574 WeakPolarHBondContact O-CA 3.48Å; S574-E580 WeakPolarHBondContact CB-OE1 3.26Å; S574-E580 PolarHBondContact OG-OE1 2.79Å
575	A	70.8	Confident	84.7	Confident	49 Å²	49	35.7 Å²	35.7	41%	0.405	22%	0.221	S	C	.	.	S	Bend	trans	-68.5	-45.6	177.1	0	0	0	0	0	111.5	L525	L525-A575 WeakPolarHBondContact O-CB 3.46Å; L525-A575 PolarHBondContact O-N 3.42Å
576	S	81.8	Confident	84.9	Confident	23 Å²	23	37.2 Å²	37.2	16%	0.161	23%	0.228	C	C	.	.			trans	-149.7	140.4	177.4	168.9	0	0	0	0	109.6	D578 A579 E580	S576-D578 VanDerWaalsContact C-N 3.31Å; S576-D578 PolarHBondContact OG-N 3.42Å; S576-A579 PolarHBondContact OG-N 2.84Å; S576-E580 VanDerWaalsContact O-CG 3.3Å; S576-E580 WeakPolarHBondContact O-CG 3.36Å; S576-E580 PolarHBondContact O-N 3.08Å
577	V	82.8	Confident	85.1	Confident	91 Å²	91	37.2 Å²	37.2	55%	0.552	23%	0.228	S	C	*	.	H	α-helix	trans	-68.4	-37.2	174.5	176.9	0	0	0	0	110.2	E580 K581	V577-E580 PolarHBondContact O-N 2.92Å; V577-K581 HydrophobicContact CG1-CD 4.5Å; V577-K581 PolarHBondContact O-N 2.81Å
578	D	87	Confident	85.5	Confident	120 Å²	120	39.3 Å²	39.3	64%	0.642	24%	0.237	S	C	*	.	H	α-helix	trans	-70.3	-37.9	-179.6	-62	-35.2	0	0	0	111.1	S576 E580 K581 S582	S576-D578 VanDerWaalsContact C-N 3.31Å; S576-D578 PolarHBondContact OG-N 3.42Å; D578-E580 VanDerWaalsContact C-N 3.34Å; D578-E580 PolarHBondContact O-N 3.32Å; D578-K581 PolarHBondContact O-N 3.28Å; D578-S582 WeakPolarHBondContact O-CB 3.48Å; D578-S582 PolarHBondContact O-N 2.98Å
579	A	88.5	Confident	85.7	Confident	10 Å²	10	46.6 Å²	46.6	8%	0.083	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-39.8	173.5	0	0	0	0	0	112.3	L525 L537 S576 S582 M583	L525-A579 HydrophobicContact CD2-CB 4.01Å; L537-A579 HydrophobicContact CD2-CB 3.93Å; S576-A579 PolarHBondContact OG-N 2.84Å; A579-S582 PolarHBondContact O-N 3.04Å; A579-M583 PolarHBondContact O-N 3.14Å
580	E	89.8	Confident	85.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-39	176.8	-61.7	-93.9	-159.3	0	0	111.6	L565 R568 S574 S576 V577 D578 M583 L584 F603	L565-E580 WeakPolarHBondContact CD1-OE2 3.29Å; R568-E580 IonicContact CZ-OE1 3.46Å; R568-E580 IonicContact CZ-OE2 2.88Å; R568-E580 IonicContact NE-OE1 2.85Å; R568-E580 PolarHBondContact NE-OE1 2.7Å; R568-E580 IonicContact NE-OE2 3.36Å; R568-E580 IonicContact NH2-OE1 2.7Å; R568-E580 IonicContact NH2-OE2 2.77Å; R568-E580 PolarHBondContact NH2-OE2 2.97Å; S574-E580 WeakPolarHBondContact CB-OE1 3.26Å; S574-E580 PolarHBondContact OG-OE1 2.79Å; S576-E580 VanDerWaalsContact O-CG 3.3Å; S576-E580 WeakPolarHBondContact O-CG 3.36Å; S576-E580 PolarHBondContact O-N 3.08Å; V577-E580 PolarHBondContact O-N 2.92Å; D578-E580 VanDerWaalsContact C-N 3.34Å; D578-E580 PolarHBondContact O-N 3.32Å; E580-M583 PolarHBondContact O-N 3.08Å; E580-L584 PolarHBondContact O-N 3.07Å; E580-L584 VanDerWaalsContact O-N 3.11Å; E580-F603 HydrophobicContact CB-CE1 4.39Å; E580-F603 HydrophobicContact CB-CZ 3.76Å
581	K	90.8	Very high	86.1	Confident	96 Å²	96	47.8 Å²	47.8	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-40.4	173.8	-73.8	-177.3	176.8	-175.4	0	111.8	V577 D578 L584 S585 E607	V577-K581 HydrophobicContact CG1-CD 4.5Å; V577-K581 PolarHBondContact O-N 2.81Å; D578-K581 PolarHBondContact O-N 3.28Å; K581-L584 PolarHBondContact O-N 3.26Å; K581-S585 PolarHBondContact O-N 3Å; K581-E607 IonicContact NZ-OE1 2.78Å
582	S	93.4	Very high	86.7	Confident	26 Å²	26	48.4 Å²	48.4	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-58.4	-50	174	178.8	0	0	0	0	110.7	E538 D578 A579 L584 S585 K586	E538-S582 VanDerWaalsContact CD-OG 3.31Å; E538-S582 PolarHBondContact OE1-OG 2.81Å; E538-S582 PolarHBondContact OE2-OG 2.88Å; D578-S582 WeakPolarHBondContact O-CB 3.48Å; D578-S582 PolarHBondContact O-N 2.98Å; A579-S582 PolarHBondContact O-N 3.04Å; S582-L584 VanDerWaalsContact C-N 3.32Å; S582-L584 PolarHBondContact O-N 3Å; S582-S585 WeakPolarHBondContact O-CA 3.18Å; S582-S585 VanDerWaalsContact O-CB 3.31Å; S582-S585 WeakPolarHBondContact O-CB 3.27Å; S582-S585 PolarHBondContact O-N 3.07Å; S582-K586 WeakPolarHBondContact O-CG 3.25Å; S582-K586 PolarHBondContact O-N 3.44Å; S582-K586 WeakPolarHBondContact OG-CE 3.37Å
583	M	94.2	Very high	87.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-41.4	178.1	-172.3	61.8	-167.3	0	0	112.4	V521 L525 L541 M545 F557 Y561 A579 E580 K586 L587	V521-M583 HydrophobicContact CG1-CE 4.08Å; V521-M583 HydrophobicContact CG1-CG 4.35Å; V521-M583 HydrophobicContact CG1-SD 4.29Å; V521-M583 HydrophobicContact CG2-CE 4.22Å; L525-M583 HydrophobicContact CD1-CG 4.48Å; L541-M583 HydrophobicContact CD1-CB 4.45Å; L541-M583 HydrophobicContact CD1-SD 4.41Å; L541-M583 HydrophobicContact CD2-SD 3.92Å; M545-M583 HydrophobicContact SD-CE 3.53Å; M545-M583 VanDerWaalsContact SD-CE 3.53Å; M545-M583 HydrophobicContact SD-SD 4.28Å; F557-M583 HydrophobicContact CZ-CE 4.13Å; Y561-M583 HydrophobicContact CE2-CG 4.14Å; Y561-M583 VanDerWaalsContact OH-CG 3.26Å; Y561-M583 WeakPolarHBondContact OH-CG 3.49Å; A579-M583 PolarHBondContact O-N 3.14Å; E580-M583 PolarHBondContact O-N 3.08Å; M583-K586 PolarHBondContact O-N 3.33Å; M583-L587 HydrophobicContact CE-CD1 4.17Å; M583-L587 HydrophobicContact CE-CD2 4.09Å; M583-L587 HydrophobicContact CE-CG 4.01Å; M583-L587 HydrophobicContact CG-CD1 4.38Å; M583-L587 WeakPolarHBondContact O-CG 3.46Å; M583-L587 PolarHBondContact O-N 3.01Å
584	L	93.4	Very high	88.9	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.068	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-40.5	173.9	-73.9	-176.4	0	0	0	112.9	Y561 E580 K581 S582 K586 L587 K588 L599 F603	Y561-L584 HydrophobicContact CE1-CD2 4.39Å; E580-L584 PolarHBondContact O-N 3.07Å; E580-L584 VanDerWaalsContact O-N 3.11Å; K581-L584 PolarHBondContact O-N 3.26Å; S582-L584 VanDerWaalsContact C-N 3.32Å; S582-L584 PolarHBondContact O-N 3Å; L584-K586 VanDerWaalsContact C-N 3.34Å; L584-L587 PolarHBondContact O-N 3.03Å; L584-K588 WeakPolarHBondContact O-CB 3.33Å; L584-K588 PolarHBondContact O-N 3.04Å; L584-L599 HydrophobicContact CD2-CB 3.5Å; L584-L599 VanDerWaalsContact CD2-CB 3.5Å; L584-L599 HydrophobicContact CD2-CD1 3.6Å; L584-L599 HydrophobicContact CD2-CG 4.17Å; L584-F603 HydrophobicContact CD1-CD2 3.42Å; L584-F603 VanDerWaalsContact CD1-CD2 3.42Å; L584-F603 HydrophobicContact CD1-CE2 3.37Å; L584-F603 HydrophobicContact CD1-CG 4.45Å; L584-F603 HydrophobicContact CD1-CZ 4.36Å; L584-F603 HydrophobicContact CG-CE2 4.3Å
585	S	94.8	Very high	89.5	Confident	79 Å²	79	50.7 Å²	50.7	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-59.9	-45.5	176	-169.4	0	0	0	0	111.3	K581 S582 K588 H589	K581-S585 PolarHBondContact O-N 3Å; S582-S585 WeakPolarHBondContact O-CA 3.18Å; S582-S585 VanDerWaalsContact O-CB 3.31Å; S582-S585 WeakPolarHBondContact O-CB 3.27Å; S582-S585 PolarHBondContact O-N 3.07Å; S585-K588 WeakPolarHBondContact O-CB 3.47Å; S585-K588 PolarHBondContact O-N 2.8Å; S585-H589 PolarHBondContact O-N 2.89Å
586	K	95.1	Very high	90.6	Very high	33 Å²	33	48.4 Å²	48.4	14%	0.143	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-46	176.3	-64	178.2	-165.4	-66.5	0	111.8	E538 L541 D542 M545 S582 M583 L584 K588 H589 E590	E538-K586 WeakPolarHBondContact OE1-CE 3.33Å; E538-K586 IonicContact OE1-NZ 2.62Å; E538-K586 PolarHBondContact OE1-NZ 3Å; L541-K586 HydrophobicContact CB-CD 4.43Å; D542-K586 WeakPolarHBondContact OD1-CE 3.35Å; D542-K586 IonicContact OD1-NZ 2.84Å; D542-K586 PolarHBondContact OD1-NZ 3.06Å; D542-K586 IonicContact OD2-NZ 3.62Å; M545-K586 HydrophobicContact CE-CB 4.44Å; M545-K586 HydrophobicContact CG-CB 4.04Å; M545-K586 HydrophobicContact CG-CD 4.09Å; M545-K586 HydrophobicContact SD-CB 4.4Å; S582-K586 WeakPolarHBondContact O-CG 3.25Å; S582-K586 PolarHBondContact O-N 3.44Å; S582-K586 WeakPolarHBondContact OG-CE 3.37Å; M583-K586 PolarHBondContact O-N 3.33Å; L584-K586 VanDerWaalsContact C-N 3.34Å; K586-K588 VanDerWaalsContact C-N 3.29Å; K586-K588 PolarHBondContact O-N 2.94Å; K586-H589 PolarHBondContact O-N 2.93Å; K586-E590 WeakPolarHBondContact O-CG 3.44Å; K586-E590 PolarHBondContact O-N 3.19Å; K586-E590 VanDerWaalsContact O-N 3.09Å
587	L	94.8	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-37.5	176.1	-71.4	171.1	0	0	0	112.4	M545 F548 F557 Y561 M583 L584 E590 C591 F595 T596 L599	M545-L587 HydrophobicContact CE-CD2 4.01Å; M545-L587 HydrophobicContact SD-CD2 4.07Å; F548-L587 HydrophobicContact CE1-CD2 4.27Å; F548-L587 HydrophobicContact CZ-CD2 4.13Å; F557-L587 HydrophobicContact CD1-CD2 4.44Å; F557-L587 HydrophobicContact CE1-CD1 4.04Å; F557-L587 HydrophobicContact CE1-CD2 3.57Å; F557-L587 HydrophobicContact CE1-CG 4.48Å; F557-L587 HydrophobicContact CZ-CD2 4.08Å; Y561-L587 HydrophobicContact CD1-CD1 4.36Å; Y561-L587 HydrophobicContact CE1-CD1 4.06Å; M583-L587 HydrophobicContact CE-CD1 4.17Å; M583-L587 HydrophobicContact CE-CD2 4.09Å; M583-L587 HydrophobicContact CE-CG 4.01Å; M583-L587 HydrophobicContact CG-CD1 4.38Å; M583-L587 WeakPolarHBondContact O-CG 3.46Å; M583-L587 PolarHBondContact O-N 3.01Å; L584-L587 PolarHBondContact O-N 3.03Å; L587-E590 PolarHBondContact O-N 3.05Å; L587-C591 WeakPolarHBondContact O-CB 3.22Å; L587-C591 PolarHBondContact O-N 3.04Å; L587-F595 HydrophobicContact CD2-CE1 4.35Å; L587-T596 HydrophobicContact CB-CG2 3.81Å; L587-L599 HydrophobicContact CD1-CD1 4.41Å
588	K	94	Very high	91.6	Very high	80 Å²	80	49.6 Å²	49.6	35%	0.348	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-41.3	177.5	-173.4	177.8	-165.8	149.2	0	111.7	L584 S585 K586 G592 T596 E600	L584-K588 WeakPolarHBondContact O-CB 3.33Å; L584-K588 PolarHBondContact O-N 3.04Å; S585-K588 WeakPolarHBondContact O-CB 3.47Å; S585-K588 PolarHBondContact O-N 2.8Å; K586-K588 VanDerWaalsContact C-N 3.29Å; K586-K588 PolarHBondContact O-N 2.94Å; K588-G592 CarbonylContact O-C 3.54Å; K588-G592 WeakPolarHBondContact O-CA 3.42Å; K588-G592 PolarHBondContact O-N 3.38Å; K588-T596 HydrophobicContact CB-CG2 3.87Å; K588-E600 WeakPolarHBondContact CD-OE1 3.39Å; K588-E600 WeakPolarHBondContact CE-OE1 3.34Å; K588-E600 IonicContact NZ-OE1 2.98Å; K588-E600 PolarHBondContact NZ-OE1 3.47Å; K588-E600 IonicContact NZ-OE2 2.85Å; K588-E600 PolarHBondContact NZ-OE2 3.42Å
589	H	93	Very high	92	Very high	154 Å²	154	43.9 Å²	43.9	71%	0.713	26%	0.256	S	S	*	.	H	α-helix	trans	-61.8	-45.1	176.2	-174.7	72.4	0	0	0	111.5	S585 K586	S585-H589 PolarHBondContact O-N 2.89Å; K586-H589 PolarHBondContact O-N 2.93Å
590	E	90.1	Very high	92.2	Very high	58 Å²	58	45.7 Å²	45.7	27%	0.271	26%	0.263	S	S	.	.	H	α-helix	trans	-76.9	-40.2	-177.4	-64.8	-55.6	141.6	0	0	114.4	M545 F548 R549 K586 L587	M545-E590 HydrophobicContact CE-CB 4.05Å; M545-E590 HydrophobicContact CE-CG 3.43Å; M545-E590 VanDerWaalsContact CE-CG 3.43Å; F548-E590 HydrophobicContact CE1-CB 4.3Å; R549-E590 WeakPolarHBondContact CD-OE2 3.38Å; R549-E590 VanDerWaalsContact CG-OE2 3.25Å; R549-E590 WeakPolarHBondContact CG-OE2 3.4Å; R549-E590 IonicContact CZ-OE1 3.54Å; R549-E590 VanDerWaalsContact CZ-OE1 3.29Å; R549-E590 IonicContact CZ-OE2 3.28Å; R549-E590 IonicContact NE-OE1 3.96Å; R549-E590 PolarHBondContact NE-OE1 3.4Å; R549-E590 VanDerWaalsContact NE-OE1 3.12Å; R549-E590 IonicContact NE-OE2 3.05Å; R549-E590 PolarHBondContact NE-OE2 3.49Å; R549-E590 IonicContact NH2-OE1 3.3Å; R549-E590 PolarHBondContact NH2-OE1 3.22Å; R549-E590 IonicContact NH2-OE2 2.74Å; K586-E590 WeakPolarHBondContact O-CG 3.44Å; K586-E590 PolarHBondContact O-N 3.19Å; K586-E590 VanDerWaalsContact O-N 3.09Å; L587-E590 PolarHBondContact O-N 3.05Å
591	C	88.6	Confident	92.5	Very high	17 Å²	17	45.8 Å²	45.8	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-107	-14.9	-170.4	-62.7	0	0	0	0	114.2	F548 L587 F595	F548-C591 WeakPolarHBondContact CE1-SG 3.48Å; F548-C591 VanDerWaalsContact CZ-SG 3.52Å; L587-C591 WeakPolarHBondContact O-CB 3.22Å; L587-C591 PolarHBondContact O-N 3.04Å; C591-F595 HydrophobicContact CB-CB 3.55Å; C591-F595 HydrophobicContact CB-CD1 3.47Å; C591-F595 VanDerWaalsContact CB-CD1 3.47Å; C591-F595 HydrophobicContact CB-CD2 4.05Å; C591-F595 HydrophobicContact CB-CE1 4.13Å; C591-F595 HydrophobicContact CB-CG 3.42Å; C591-F595 VanDerWaalsContact CB-CG 3.42Å
592	G	89.1	Confident	92.7	Very high	32 Å²	32	41.2 Å²	41.2	33%	0.33	24%	0.244	S	C	.	.			trans	87.9	166.3	-174	0	0	0	0	0	114	K588 A594 F595	K588-G592 CarbonylContact O-C 3.54Å; K588-G592 WeakPolarHBondContact O-CA 3.42Å; K588-G592 PolarHBondContact O-N 3.38Å; G592-A594 VanDerWaalsContact C-N 3.33Å; G592-A594 PolarHBondContact O-N 3Å; G592-F595 WeakPolarHBondContact O-CB 3.37Å; G592-F595 PolarHBondContact O-N 3.17Å
593	A	90.4	Very high	92.6	Very high	57 Å²	57	41 Å²	41	47%	0.471	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-29	-172.8	0	0	0	0	0	114.8	F595 T596 S597	A593-F595 VanDerWaalsContact C-N 3.29Å; A593-F595 PolarHBondContact O-N 2.95Å; A593-T596 PolarHBondContact O-N 3.34Å; A593-T596 PolarHBondContact O-OG1 3.34Å; A593-S597 WeakPolarHBondContact O-CB 3.47Å; A593-S597 PolarHBondContact O-N 3.29Å
594	A	88.2	Confident	92.6	Very high	96 Å²	96	47.3 Å²	47.3	79%	0.793	27%	0.268	S	S	*	.	H	α-helix	trans	-65.3	-35	178.6	0	0	0	0	0	112.1	G592	G592-A594 VanDerWaalsContact C-N 3.33Å; G592-A594 PolarHBondContact O-N 3Å
595	F	88.6	Confident	92.7	Very high	30 Å²	30	47.2 Å²	47.2	13%	0.132	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-40.7	178.9	-175.7	-95.9	0	0	0	111.8	K554 F557 E558 L587 C591 G592 A593	K554-F595 HydrophobicContact CB-CE2 4.28Å; K554-F595 WeakPolarHBondContact O-CZ 3.31Å; F557-F595 HydrophobicContact CD1-CZ 4.37Å; E558-F595 HydrophobicContact CB-CE1 4.42Å; E558-F595 HydrophobicContact CB-CE2 3.7Å; E558-F595 HydrophobicContact CB-CZ 3.59Å; E558-F595 HydrophobicContact CG-CE1 4.37Å; E558-F595 HydrophobicContact CG-CE2 4.03Å; E558-F595 HydrophobicContact CG-CZ 3.96Å; L587-F595 HydrophobicContact CD2-CE1 4.35Å; C591-F595 HydrophobicContact CB-CB 3.55Å; C591-F595 HydrophobicContact CB-CD1 3.47Å; C591-F595 VanDerWaalsContact CB-CD1 3.47Å; C591-F595 HydrophobicContact CB-CD2 4.05Å; C591-F595 HydrophobicContact CB-CE1 4.13Å; C591-F595 HydrophobicContact CB-CG 3.42Å; C591-F595 VanDerWaalsContact CB-CG 3.42Å; G592-F595 WeakPolarHBondContact O-CB 3.37Å; G592-F595 PolarHBondContact O-N 3.17Å; A593-F595 VanDerWaalsContact C-N 3.29Å; A593-F595 PolarHBondContact O-N 2.95Å
596	T	93.7	Very high	92.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-88.1	-10.6	-178.9	58.9	0	0	0	0	114.1	L587 K588 A593 K598 L599 E600	L587-T596 HydrophobicContact CB-CG2 3.81Å; K588-T596 HydrophobicContact CB-CG2 3.87Å; A593-T596 PolarHBondContact O-N 3.34Å; A593-T596 PolarHBondContact O-OG1 3.34Å; T596-K598 VanDerWaalsContact C-N 3.31Å; T596-K598 PolarHBondContact O-N 3.33Å; T596-L599 WeakPolarHBondContact O-CA 3.23Å; T596-L599 WeakPolarHBondContact O-CB 3.3Å; T596-L599 PolarHBondContact O-N 3.18Å; T596-E600 PolarHBondContact O-N 2.88Å; T596-E600 PolarHBondContact OG1-OE1 3.23Å
597	S	93.3	Very high	92.4	Very high	57 Å²	57	47.2 Å²	47.2	40%	0.399	26%	0.259	S	S	.	.	H	α-helix	trans	-51.5	-44.9	-173.4	178	0	0	0	0	113.7	A593 G601	A593-S597 WeakPolarHBondContact O-CB 3.47Å; A593-S597 PolarHBondContact O-N 3.29Å; S597-G601 PolarHBondContact O-N 2.93Å
598	K	93.2	Very high	92.4	Very high	82 Å²	82	51 Å²	51	36%	0.357	28%	0.279	S	S	.	.	H	α-helix	trans	-66	-42.4	177.7	-65.9	177	-175.6	164.9	0	111.6	T596 G601 M602 Y640	T596-K598 VanDerWaalsContact C-N 3.31Å; T596-K598 PolarHBondContact O-N 3.33Å; K598-G601 WeakPolarHBondContact O-CA 3.45Å; K598-G601 PolarHBondContact O-N 2.92Å; K598-M602 WeakPolarHBondContact O-CG 3.48Å; K598-M602 PolarHBondContact O-N 3.38Å; K598-Y640 HydrophobicContact CG-CD1 4.3Å
599	L	94.6	Very high	92.4	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-43.7	179.4	-55.3	173.3	0	0	0	111.4	Y561 K562 L565 L584 L587 T596 G601 M602 F603	Y561-L599 HydrophobicContact CD1-CD1 3.93Å; Y561-L599 HydrophobicContact CD1-CD2 4.15Å; Y561-L599 HydrophobicContact CE1-CD1 4.06Å; K562-L599 HydrophobicContact CB-CD2 3.71Å; K562-L599 HydrophobicContact CG-CD2 3.88Å; L565-L599 HydrophobicContact CD2-CB 4.32Å; L565-L599 HydrophobicContact CD2-CD2 3.87Å; L584-L599 HydrophobicContact CD2-CB 3.5Å; L584-L599 VanDerWaalsContact CD2-CB 3.5Å; L584-L599 HydrophobicContact CD2-CD1 3.6Å; L584-L599 HydrophobicContact CD2-CG 4.17Å; L587-L599 HydrophobicContact CD1-CD1 4.41Å; T596-L599 WeakPolarHBondContact O-CA 3.23Å; T596-L599 WeakPolarHBondContact O-CB 3.3Å; T596-L599 PolarHBondContact O-N 3.18Å; L599-G601 VanDerWaalsContact C-N 3.28Å; L599-G601 PolarHBondContact O-N 3.31Å; L599-M602 HydrophobicContact CD2-SD 4.15Å; L599-M602 WeakPolarHBondContact O-CB 3.46Å; L599-M602 PolarHBondContact O-N 3.02Å; L599-M602 VanDerWaalsContact O-N 3.17Å; L599-F603 WeakPolarHBondContact O-CD2 3.43Å; L599-F603 PolarHBondContact O-N 2.97Å
600	E	94.1	Very high	92.3	Very high	48 Å²	48	46.6 Å²	46.6	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-38.9	172.8	-68.9	178.8	-154.2	0	0	111.2	K588 T596 M602 F603 K604	K588-E600 WeakPolarHBondContact CD-OE1 3.39Å; K588-E600 WeakPolarHBondContact CE-OE1 3.34Å; K588-E600 IonicContact NZ-OE1 2.98Å; K588-E600 PolarHBondContact NZ-OE1 3.47Å; K588-E600 IonicContact NZ-OE2 2.85Å; K588-E600 PolarHBondContact NZ-OE2 3.42Å; T596-E600 PolarHBondContact O-N 2.88Å; T596-E600 PolarHBondContact OG1-OE1 3.23Å; E600-M602 VanDerWaalsContact C-N 3.33Å; E600-M602 PolarHBondContact O-N 3.46Å; E600-F603 PolarHBondContact O-N 3.36Å; E600-K604 WeakPolarHBondContact O-CG 3.47Å; E600-K604 PolarHBondContact O-N 2.88Å
601	G	95.3	Very high	92.6	Very high	3 Å²	3	48.5 Å²	48.5	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-41	172.8	0	0	0	0	0	113	S597 K598 L599 F603 K604 D605	S597-G601 PolarHBondContact O-N 2.93Å; K598-G601 WeakPolarHBondContact O-CA 3.45Å; K598-G601 PolarHBondContact O-N 2.92Å; L599-G601 VanDerWaalsContact C-N 3.28Å; L599-G601 PolarHBondContact O-N 3.31Å; G601-F603 VanDerWaalsContact C-N 3.33Å; G601-F603 PolarHBondContact O-N 3.13Å; G601-K604 PolarHBondContact O-N 3.01Å; G601-D605 PolarHBondContact O-N 3.37Å
602	M	94.9	Very high	92.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-40.4	175.7	-64.5	165.7	61.5	0	0	112	K562 L565 A566 L569 K598 L599 E600 D605 M606 W641	K562-M602 HydrophobicContact CD-SD 4.48Å; K562-M602 HydrophobicContact CG-SD 3.78Å; L565-M602 HydrophobicContact CB-CE 4.29Å; L565-M602 HydrophobicContact CD2-CE 3.99Å; L565-M602 HydrophobicContact CD2-SD 4.26Å; L565-M602 HydrophobicContact CG-CE 3.98Å; A566-M602 HydrophobicContact CB-CE 3.69Å; L569-M602 HydrophobicContact CD1-CB 4.22Å; L569-M602 HydrophobicContact CD1-CE 4.24Å; K598-M602 WeakPolarHBondContact O-CG 3.48Å; K598-M602 PolarHBondContact O-N 3.38Å; L599-M602 HydrophobicContact CD2-SD 4.15Å; L599-M602 WeakPolarHBondContact O-CB 3.46Å; L599-M602 PolarHBondContact O-N 3.02Å; L599-M602 VanDerWaalsContact O-N 3.17Å; E600-M602 VanDerWaalsContact C-N 3.33Å; E600-M602 PolarHBondContact O-N 3.46Å; M602-D605 PolarHBondContact O-N 2.94Å; M602-M606 WeakPolarHBondContact O-CG 3.46Å; M602-M606 PolarHBondContact O-N 3.22Å; M602-W641 HydrophobicContact CB-CD2 4.47Å; M602-W641 HydrophobicContact CB-CH2 4.18Å; M602-W641 HydrophobicContact CB-CZ2 3.67Å; M602-W641 HydrophobicContact CE-CD2 4.26Å; M602-W641 HydrophobicContact CE-CE3 3.82Å; M602-W641 HydrophobicContact CE-CH2 4.19Å; M602-W641 HydrophobicContact CE-CZ3 3.8Å; M602-W641 HydrophobicContact CG-CD2 3.89Å; M602-W641 HydrophobicContact CG-CE3 4.4Å; M602-W641 HydrophobicContact CG-CG 4.19Å; M602-W641 HydrophobicContact CG-CZ2 4.02Å; M602-W641 WeakPolarHBondContact O-CZ2 3.41Å
603	F	92.1	Very high	93.1	Very high	22 Å²	22	46.9 Å²	46.9	10%	0.096	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-43.1	175.1	-84.3	-87.4	0	0	0	112.4	L565 L569 E580 L584 L599 E600 G601 D605 M606 E607	L565-F603 HydrophobicContact CD1-CE2 4.01Å; L565-F603 HydrophobicContact CD1-CZ 4.11Å; L565-F603 HydrophobicContact CD2-CE2 3.98Å; L569-F603 HydrophobicContact CD1-CE2 4.41Å; L569-F603 HydrophobicContact CD2-CD1 4.48Å; L569-F603 HydrophobicContact CD2-CE1 3.86Å; L569-F603 HydrophobicContact CD2-CZ 3.93Å; E580-F603 HydrophobicContact CB-CE1 4.39Å; E580-F603 HydrophobicContact CB-CZ 3.76Å; L584-F603 HydrophobicContact CD1-CD2 3.42Å; L584-F603 VanDerWaalsContact CD1-CD2 3.42Å; L584-F603 HydrophobicContact CD1-CE2 3.37Å; L584-F603 HydrophobicContact CD1-CG 4.45Å; L584-F603 HydrophobicContact CD1-CZ 4.36Å; L584-F603 HydrophobicContact CG-CE2 4.3Å; L599-F603 WeakPolarHBondContact O-CD2 3.43Å; L599-F603 PolarHBondContact O-N 2.97Å; E600-F603 PolarHBondContact O-N 3.36Å; G601-F603 VanDerWaalsContact C-N 3.33Å; G601-F603 PolarHBondContact O-N 3.13Å; F603-D605 VanDerWaalsContact C-N 3.29Å; F603-D605 PolarHBondContact O-N 2.98Å; F603-M606 WeakPolarHBondContact O-CB 3.43Å; F603-M606 PolarHBondContact O-N 3.41Å; F603-M606 VanDerWaalsContact O-N 3.11Å; F603-E607 PolarHBondContact O-N 3.33Å
604	K	94.2	Very high	93.3	Very high	132 Å²	132	48.1 Å²	48.1	57%	0.574	25%	0.254	S	S	*	.	H	α-helix	trans	-59.5	-41.1	175.7	-70.3	175.2	-176.1	176.3	0	111.7	E600 G601 M606 E607 L608	E600-K604 WeakPolarHBondContact O-CG 3.47Å; E600-K604 PolarHBondContact O-N 2.88Å; G601-K604 PolarHBondContact O-N 3.01Å; K604-M606 VanDerWaalsContact C-N 3.31Å; K604-M606 PolarHBondContact O-N 3.26Å; K604-E607 PolarHBondContact O-N 2.94Å; K604-L608 VanDerWaalsContact O-CB 3.29Å; K604-L608 WeakPolarHBondContact O-CB 3.27Å; K604-L608 PolarHBondContact O-N 3.11Å
605	D	95.3	Very high	93.6	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.053	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-37.8	175.8	-76.4	-18.5	0	0	0	111.7	G601 M602 F603 S609 T637 W641	G601-D605 PolarHBondContact O-N 3.37Å; M602-D605 PolarHBondContact O-N 2.94Å; F603-D605 VanDerWaalsContact C-N 3.29Å; F603-D605 PolarHBondContact O-N 2.98Å; D605-S609 WeakPolarHBondContact O-CB 3.44Å; D605-S609 PolarHBondContact O-N 2.98Å; D605-S609 PolarHBondContact O-OG 3.39Å; D605-T637 PolarHBondContact OD1-OG1 3.31Å; D605-T637 VanDerWaalsContact OD2-CB 3.27Å; D605-T637 WeakPolarHBondContact OD2-CB 3.42Å; D605-T637 PolarHBondContact OD2-N 3.48Å; D605-T637 PolarHBondContact OD2-OG1 3Å; D605-W641 HydrophobicContact CB-CZ2 4.26Å; D605-W641 PolarHBondContact OD2-NE1 3.45Å
606	M	91.8	Very high	93.8	Very high	18 Å²	18	46.2 Å²	46.2	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-40.5	175.8	-64.9	-63.8	84.2	0	0	112.8	L569 L570 M602 F603 K604 K610 N634 L636 W641	L569-M606 HydrophobicContact CB-CG 4.4Å; L569-M606 HydrophobicContact CB-SD 4.24Å; L569-M606 HydrophobicContact CD1-CG 4.19Å; L570-M606 HydrophobicContact CD2-CE 4.06Å; L570-M606 HydrophobicContact CD2-SD 4.16Å; M602-M606 WeakPolarHBondContact O-CG 3.46Å; M602-M606 PolarHBondContact O-N 3.22Å; F603-M606 WeakPolarHBondContact O-CB 3.43Å; F603-M606 PolarHBondContact O-N 3.41Å; F603-M606 VanDerWaalsContact O-N 3.11Å; K604-M606 VanDerWaalsContact C-N 3.31Å; K604-M606 PolarHBondContact O-N 3.26Å; M606-K610 WeakPolarHBondContact O-CG 3.49Å; M606-K610 PolarHBondContact O-N 3.04Å; M606-N634 HydrophobicContact CE-CB 3.97Å; M606-L636 HydrophobicContact CE-CD2 3.33Å; M606-W641 HydrophobicContact CE-CH2 3.69Å; M606-W641 HydrophobicContact CE-CZ2 3.6Å; M606-W641 HydrophobicContact CG-CH2 4.33Å; M606-W641 HydrophobicContact CG-CZ2 4.41Å; M606-W641 HydrophobicContact SD-CH2 3.98Å; M606-W641 HydrophobicContact SD-CZ2 4.35Å
607	E	91.3	Very high	93.6	Very high	95 Å²	95	50.3 Å²	50.3	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-49.9	176.3	-69.1	175.4	176.7	0	0	110.7	K581 F603 K604 S609 K610 D611	K581-E607 IonicContact NZ-OE1 2.78Å; F603-E607 PolarHBondContact O-N 3.33Å; K604-E607 PolarHBondContact O-N 2.94Å; E607-S609 VanDerWaalsContact C-N 3.28Å; E607-S609 PolarHBondContact O-N 3.37Å; E607-K610 WeakPolarHBondContact O-CB 3.36Å; E607-K610 PolarHBondContact O-N 3.42Å; E607-K610 VanDerWaalsContact O-N 3.07Å; E607-D611 PolarHBondContact O-N 3.49Å
608	L	94.1	Very high	93.5	Very high	78 Å²	78	52.8 Å²	52.8	41%	0.408	25%	0.252	S	S	.	.	H	α-helix	trans	-60.6	-37.8	178.2	-178.7	62.4	0	0	0	112.3	K604 K610 D611 I612	K604-L608 VanDerWaalsContact O-CB 3.29Å; K604-L608 WeakPolarHBondContact O-CB 3.27Å; K604-L608 PolarHBondContact O-N 3.11Å; L608-K610 VanDerWaalsContact C-N 3.3Å; L608-K610 PolarHBondContact O-N 3.43Å; L608-D611 PolarHBondContact O-N 3.18Å; L608-I612 HydrophobicContact CD1-CD1 4.2Å; L608-I612 HydrophobicContact CD1-CG1 4.34Å; L608-I612 HydrophobicContact CD2-CD1 4.4Å; L608-I612 HydrophobicContact CG-CD1 3.84Å; L608-I612 HydrophobicContact CG-CG1 4.39Å; L608-I612 VanDerWaalsContact O-CG1 3.28Å; L608-I612 WeakPolarHBondContact O-CG1 3.29Å; L608-I612 PolarHBondContact O-N 3.34Å
609	S	94.4	Very high	93.3	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.014	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-39.3	176.2	-67.5	0	0	0	0	112.2	D605 E607 I612 M613 I635	D605-S609 WeakPolarHBondContact O-CB 3.44Å; D605-S609 PolarHBondContact O-N 2.98Å; D605-S609 PolarHBondContact O-OG 3.39Å; E607-S609 VanDerWaalsContact C-N 3.28Å; E607-S609 PolarHBondContact O-N 3.37Å; S609-I612 PolarHBondContact O-N 2.69Å; S609-M613 WeakPolarHBondContact O-CB 3.49Å; S609-M613 VanDerWaalsContact O-CG 3.29Å; S609-M613 WeakPolarHBondContact O-CG 3.49Å; S609-M613 PolarHBondContact O-N 3.04Å; S609-I635 PolarHBondContact OG-N 3.12Å; S609-I635 PolarHBondContact OG-O 2.66Å
610	K	92.1	Very high	92.9	Very high	141 Å²	141	54.2 Å²	54.2	61%	0.613	26%	0.257	S	S	*	.	H	α-helix	trans	-63.6	-44.3	176.3	-69.4	171.2	-176.9	177	0	111	M606 E607 L608 M613 V614	M606-K610 WeakPolarHBondContact O-CG 3.49Å; M606-K610 PolarHBondContact O-N 3.04Å; E607-K610 WeakPolarHBondContact O-CB 3.36Å; E607-K610 PolarHBondContact O-N 3.42Å; E607-K610 VanDerWaalsContact O-N 3.07Å; L608-K610 VanDerWaalsContact C-N 3.3Å; L608-K610 PolarHBondContact O-N 3.43Å; K610-M613 PolarHBondContact O-N 3.13Å; K610-V614 WeakPolarHBondContact O-CG2 3.32Å; K610-V614 PolarHBondContact O-N 3.49Å
611	D	94.4	Very high	92.5	Very high	97 Å²	97	58.9 Å²	58.9	52%	0.519	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-43.8	178.5	-66.8	-19.6	0	0	0	111.8	E607 L608 M613 V614 Q615	E607-D611 PolarHBondContact O-N 3.49Å; L608-D611 PolarHBondContact O-N 3.18Å; D611-M613 VanDerWaalsContact C-N 3.29Å; D611-M613 PolarHBondContact O-N 3.32Å; D611-V614 PolarHBondContact O-N 3.44Å; D611-Q615 WeakPolarHBondContact O-CG 3.25Å; D611-Q615 PolarHBondContact O-N 3.5Å
612	I	95.4	Very high	91.9	Very high	5 Å²	5	64 Å²	64	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-40.1	175.3	-68.5	170.9	0	0	0	110.6	L608 S609 Q615 F616 F662 F665 Y666	L608-I612 HydrophobicContact CD1-CD1 4.2Å; L608-I612 HydrophobicContact CD1-CG1 4.34Å; L608-I612 HydrophobicContact CD2-CD1 4.4Å; L608-I612 HydrophobicContact CG-CD1 3.84Å; L608-I612 HydrophobicContact CG-CG1 4.39Å; L608-I612 VanDerWaalsContact O-CG1 3.28Å; L608-I612 WeakPolarHBondContact O-CG1 3.29Å; L608-I612 PolarHBondContact O-N 3.34Å; S609-I612 PolarHBondContact O-N 2.69Å; I612-Q615 PolarHBondContact O-N 3.18Å; I612-F616 WeakPolarHBondContact O-CB 3.18Å; I612-F616 PolarHBondContact O-N 3.26Å; I612-F662 HydrophobicContact CG2-CZ 4.49Å; I612-F665 HydrophobicContact CG2-CE1 4.16Å; I612-Y666 HydrophobicContact CD1-CE2 4.04Å; I612-Y666 HydrophobicContact CG2-CD2 4.38Å
613	M	94.9	Very high	91.2	Very high	11 Å²	11	69 Å²	69	5%	0.054	34%	0.336	C	S	.	.	H	α-helix	trans	-66.4	-35.6	178.3	-80.2	-54.7	-44.5	0	0	113.3	S609 K610 D611 Q615 F616 K617 L631 T632 V633 F662	S609-M613 WeakPolarHBondContact O-CB 3.49Å; S609-M613 VanDerWaalsContact O-CG 3.29Å; S609-M613 WeakPolarHBondContact O-CG 3.49Å; S609-M613 PolarHBondContact O-N 3.04Å; K610-M613 PolarHBondContact O-N 3.13Å; D611-M613 VanDerWaalsContact C-N 3.29Å; D611-M613 PolarHBondContact O-N 3.32Å; M613-Q615 VanDerWaalsContact C-N 3.34Å; M613-F616 HydrophobicContact CE-CB 4.45Å; M613-F616 HydrophobicContact CE-CD1 3.72Å; M613-F616 PolarHBondContact O-N 3.01Å; M613-F616 HydrophobicContact SD-CD1 4.34Å; M613-K617 HydrophobicContact CE-CG 4.44Å; M613-K617 WeakPolarHBondContact O-CB 3.11Å; M613-K617 WeakPolarHBondContact O-CG 3.41Å; M613-K617 PolarHBondContact O-N 2.81Å; M613-L631 WeakPolarHBondContact CE-O 3.25Å; M613-T632 HydrophobicContact CG-CG2 4.33Å; M613-V633 VanDerWaalsContact CG-O 3.26Å; M613-V633 WeakPolarHBondContact CG-O 3.5Å; M613-V633 HydrophobicContact SD-CB 3.82Å; M613-V633 HydrophobicContact SD-CG2 4.13Å; M613-V633 PolarHBondContact SD-N 2.78Å; M613-F662 HydrophobicContact SD-CE2 3.95Å
614	V	94.3	Very high	90.4	Very high	82 Å²	82	74.8 Å²	74.8	50%	0.497	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-46.7	172.1	172.4	0	0	0	0	110.2	K610 D611 F616 K617 Q618	K610-V614 WeakPolarHBondContact O-CG2 3.32Å; K610-V614 PolarHBondContact O-N 3.49Å; D611-V614 PolarHBondContact O-N 3.44Å; V614-F616 VanDerWaalsContact C-N 3.33Å; V614-F616 PolarHBondContact O-N 3.15Å; V614-K617 PolarHBondContact O-N 3.36Å; V614-Q618 WeakPolarHBondContact O-CG 3.37Å; V614-Q618 PolarHBondContact O-N 2.9Å; V614-Q618 VanDerWaalsContact O-N 3.07Å
615	Q	93.7	Very high	89.3	Confident	79 Å²	79	71.1 Å²	71.1	37%	0.369	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-36.5	178	-64.1	177.2	32.4	0	0	112.6	D611 I612 M613 Q618 Y619 F665	D611-Q615 WeakPolarHBondContact O-CG 3.25Å; D611-Q615 PolarHBondContact O-N 3.5Å; I612-Q615 PolarHBondContact O-N 3.18Å; M613-Q615 VanDerWaalsContact C-N 3.34Å; Q615-Q618 PolarHBondContact O-N 2.7Å; Q615-Y619 WeakPolarHBondContact O-CB 3.44Å; Q615-Y619 PolarHBondContact O-N 3.35Å; Q615-F665 HydrophobicContact CB-CZ 4Å
616	F	93.1	Very high	87.9	Confident	8 Å²	8	75.6 Å²	75.6	4%	0.035	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-44.2	176.3	179.3	-113.6	0	0	0	111.5	I612 M613 V614 Q618 Y619 M620 L631 I661 F662 F665	I612-F616 WeakPolarHBondContact O-CB 3.18Å; I612-F616 PolarHBondContact O-N 3.26Å; M613-F616 HydrophobicContact CE-CB 4.45Å; M613-F616 HydrophobicContact CE-CD1 3.72Å; M613-F616 PolarHBondContact O-N 3.01Å; M613-F616 HydrophobicContact SD-CD1 4.34Å; V614-F616 VanDerWaalsContact C-N 3.33Å; V614-F616 PolarHBondContact O-N 3.15Å; F616-Q618 VanDerWaalsContact C-N 3.3Å; F616-Q618 PolarHBondContact O-N 3.41Å; F616-Y619 HydrophobicContact CD2-CD1 4.38Å; F616-Y619 HydrophobicContact CE2-CD1 4.45Å; F616-Y619 WeakPolarHBondContact O-CB 3.49Å; F616-Y619 PolarHBondContact O-N 3.43Å; F616-M620 HydrophobicContact CD1-CG 4.25Å; F616-M620 HydrophobicContact CD2-CG 4.3Å; F616-M620 HydrophobicContact CE1-CG 3.85Å; F616-M620 HydrophobicContact CE1-SD 4.29Å; F616-M620 HydrophobicContact CE2-CE 4.35Å; F616-M620 HydrophobicContact CE2-CG 3.89Å; F616-M620 HydrophobicContact CE2-SD 3.92Å; F616-M620 HydrophobicContact CG-CG 4.48Å; F616-M620 HydrophobicContact CZ-CG 3.66Å; F616-M620 HydrophobicContact CZ-SD 3.61Å; F616-M620 WeakPolarHBondContact O-CG 3.32Å; F616-M620 PolarHBondContact O-N 3.33Å; F616-L631 HydrophobicContact CE1-CD2 4.47Å; F616-I661 HydrophobicContact CE2-CG2 4.12Å; F616-I661 HydrophobicContact CZ-CG2 4.18Å; F616-F662 HydrophobicContact CB-CE2 4.46Å; F616-F662 AromaticContact CD1-CD2 3.88Å; F616-F662 HydrophobicContact CD1-CD2 3.88Å; F616-F662 HydrophobicContact CD1-CE2 4.44Å; F616-F662 AromaticContact CD2-CD2 3.84Å; F616-F662 HydrophobicContact CD2-CD2 3.84Å; F616-F662 HydrophobicContact CD2-CE2 4.48Å; F616-F662 HydrophobicContact CE1-CB 4.5Å; F616-F662 AromaticContact CE1-CD2 3.95Å; F616-F662 HydrophobicContact CE1-CD2 3.95Å; F616-F662 HydrophobicContact CE2-CB 4.05Å; F616-F662 AromaticContact CE2-CD2 3.93Å; F616-F662 HydrophobicContact CE2-CD2 3.93Å; F616-F662 HydrophobicContact CE2-CG 4.45Å; F616-F662 AromaticContact CG-CD2 3.8Å; F616-F662 HydrophobicContact CG-CD2 3.8Å; F616-F662 HydrophobicContact CG-CE2 4.2Å; F616-F662 HydrophobicContact CZ-CB 3.89Å; F616-F662 AromaticContact CZ-CD2 3.97Å; F616-F662 HydrophobicContact CZ-CD2 3.97Å; F616-F662 HydrophobicContact CZ-CG 4.45Å; F616-F665 HydrophobicContact CB-CD1 4.1Å; F616-F665 HydrophobicContact CB-CE1 3.65Å; F616-F665 HydrophobicContact CB-CZ 3.94Å; F616-F665 HydrophobicContact CD2-CB 4Å; F616-F665 AromaticContact CD2-CD1 3.5Å; F616-F665 HydrophobicContact CD2-CD1 3.5Å; F616-F665 HydrophobicContact CD2-CD2 4.19Å; F616-F665 AromaticContact CD2-CE1 3.96Å; F616-F665 HydrophobicContact CD2-CE1 3.96Å; F616-F665 AromaticContact CD2-CG 3.63Å; F616-F665 HydrophobicContact CD2-CG 3.63Å; F616-F665 HydrophobicContact CD2-CZ 4.46Å; F616-F665 HydrophobicContact CE2-CB 4.14Å; F616-F665 HydrophobicContact CE2-CD1 4.38Å; F616-F665 HydrophobicContact CE2-CG 4.28Å; F616-F665 HydrophobicContact CG-CD1 4.2Å; F616-F665 HydrophobicContact CG-CE1 4.25Å
617	K	90.1	Very high	86.6	Confident	86 Å²	86	77 Å²	77	37%	0.374	40%	0.404	S	S	.	.	H	α-helix	trans	-59.6	-41.1	175.8	-75.1	-175.7	173.6	-166.2	0	111.5	M613 V614 M620 Q621 E630	M613-K617 HydrophobicContact CE-CG 4.44Å; M613-K617 WeakPolarHBondContact O-CB 3.11Å; M613-K617 WeakPolarHBondContact O-CG 3.41Å; M613-K617 PolarHBondContact O-N 2.81Å; V614-K617 PolarHBondContact O-N 3.36Å; K617-M620 PolarHBondContact O-N 3.35Å; K617-Q621 WeakPolarHBondContact O-CG 3.49Å; K617-Q621 PolarHBondContact O-N 2.99Å; K617-Q621 VanDerWaalsContact O-N 3.08Å; K617-E630 IonicContact NZ-OE1 2.83Å; K617-E630 PolarHBondContact NZ-OE1 3.42Å
618	Q	89.9	Confident	86	Confident	108 Å²	108	79.9 Å²	79.9	51%	0.505	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-45.3	173.5	-71.1	172.3	-10.1	0	0	112.3	V614 Q615 F616 M620 Q621 C622	V614-Q618 WeakPolarHBondContact O-CG 3.37Å; V614-Q618 PolarHBondContact O-N 2.9Å; V614-Q618 VanDerWaalsContact O-N 3.07Å; Q615-Q618 PolarHBondContact O-N 2.7Å; F616-Q618 VanDerWaalsContact C-N 3.3Å; F616-Q618 PolarHBondContact O-N 3.41Å; Q618-M620 VanDerWaalsContact C-N 3.3Å; Q618-M620 PolarHBondContact O-N 3.28Å; Q618-Q621 PolarHBondContact O-N 2.85Å; Q618-C622 PolarHBondContact O-N 3.18Å; Q618-C622 PolarHBondContact O-SG 3.23Å; Q618-C622 VanDerWaalsContact O-SG 3.36Å
619	Y	88.6	Confident	85.7	Confident	84 Å²	84	79.5 Å²	79.5	33%	0.329	42%	0.42	S	S	.	.	H	α-helix	trans	-58.8	-41.4	175.8	173.4	-104.2	0	0	0	112	Q615 F616 C622 Q623 F665	Q615-Y619 WeakPolarHBondContact O-CB 3.44Å; Q615-Y619 PolarHBondContact O-N 3.35Å; F616-Y619 HydrophobicContact CD2-CD1 4.38Å; F616-Y619 HydrophobicContact CE2-CD1 4.45Å; F616-Y619 WeakPolarHBondContact O-CB 3.49Å; F616-Y619 PolarHBondContact O-N 3.43Å; Y619-C622 PolarHBondContact O-N 3.43Å; Y619-Q623 HydrophobicContact CD2-CG 4.23Å; Y619-Q623 HydrophobicContact CE1-CG 4.15Å; Y619-Q623 HydrophobicContact CE2-CG 3.8Å; Y619-Q623 WeakPolarHBondContact O-CG 3.36Å; Y619-Q623 PolarHBondContact O-N 2.97Å; Y619-F665 HydrophobicContact CD1-CB 4.18Å; Y619-F665 AromaticContact CD1-CD2 3.58Å; Y619-F665 HydrophobicContact CD1-CD2 3.58Å; Y619-F665 HydrophobicContact CD1-CE2 4.32Å; Y619-F665 HydrophobicContact CD1-CG 4.17Å; Y619-F665 HydrophobicContact CD2-CD2 4.19Å; Y619-F665 HydrophobicContact CE1-CB 4.12Å; Y619-F665 HydrophobicContact CE1-CD2 4.17Å; Y619-F665 AromaticContact CG-CD2 3.61Å; Y619-F665 HydrophobicContact CG-CD2 3.61Å; Y619-F665 AromaticContact CG-CE2 3.99Å; Y619-F665 HydrophobicContact CG-CE2 3.99Å
620	M	87.3	Confident	85.5	Confident	29 Å²	29	86.7 Å²	86.7	14%	0.143	45%	0.453	C	S	.	.	H	α-helix	trans	-64.8	-38.3	176.4	-67.4	-75	74.4	0	0	113.5	F616 K617 Q618 Q623 N624 I625 I661	F616-M620 HydrophobicContact CD1-CG 4.25Å; F616-M620 HydrophobicContact CD2-CG 4.3Å; F616-M620 HydrophobicContact CE1-CG 3.85Å; F616-M620 HydrophobicContact CE1-SD 4.29Å; F616-M620 HydrophobicContact CE2-CE 4.35Å; F616-M620 HydrophobicContact CE2-CG 3.89Å; F616-M620 HydrophobicContact CE2-SD 3.92Å; F616-M620 HydrophobicContact CG-CG 4.48Å; F616-M620 HydrophobicContact CZ-CG 3.66Å; F616-M620 HydrophobicContact CZ-SD 3.61Å; F616-M620 WeakPolarHBondContact O-CG 3.32Å; F616-M620 PolarHBondContact O-N 3.33Å; K617-M620 PolarHBondContact O-N 3.35Å; Q618-M620 VanDerWaalsContact C-N 3.3Å; Q618-M620 PolarHBondContact O-N 3.28Å; M620-Q623 HydrophobicContact CE-CB 4.44Å; M620-Q623 PolarHBondContact O-N 3.37Å; M620-N624 PolarHBondContact O-N 2.94Å; M620-I625 HydrophobicContact CE-CD1 3.4Å; M620-I625 HydrophobicContact CE-CG1 4.09Å; M620-I625 HydrophobicContact SD-CD1 4.25Å; M620-I661 HydrophobicContact CE-CG2 3.44Å; M620-I661 VanDerWaalsContact CE-CG2 3.44Å; M620-I661 HydrophobicContact SD-CG2 3.59Å; M620-I661 VanDerWaalsContact SD-CG2 3.59Å
621	Q	85.2	Confident	85.5	Confident	147 Å²	147	82.1 Å²	82.1	69%	0.687	44%	0.435	S	S	*	.	H	α-helix	trans	-64.5	-43.1	174.2	-71.3	168.8	-6	0	0	111.5	K617 Q618 Q623 N624	K617-Q621 WeakPolarHBondContact O-CG 3.49Å; K617-Q621 PolarHBondContact O-N 2.99Å; K617-Q621 VanDerWaalsContact O-N 3.08Å; Q618-Q621 PolarHBondContact O-N 2.85Å; Q621-Q623 VanDerWaalsContact C-N 3.34Å; Q621-Q623 PolarHBondContact O-N 2.83Å; Q621-N624 PolarHBondContact O-N 2.89Å
622	C	83.4	Confident	85.3	Confident	110 Å²	110	81.6 Å²	81.6	74%	0.743	44%	0.435	S	S	*	.	H	α-helix	trans	-66.3	-33.4	178.2	-66.1	0	0	0	0	113.4	Q618 Y619 N624	Q618-C622 PolarHBondContact O-N 3.18Å; Q618-C622 PolarHBondContact O-SG 3.23Å; Q618-C622 VanDerWaalsContact O-SG 3.36Å; Y619-C622 PolarHBondContact O-N 3.43Å; C622-N624 PolarHBondContact O-N 2.74Å
623	Q	79	Confident	85.3	Confident	104 Å²	104	81.8 Å²	81.8	49%	0.486	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.7	178.4	-67.3	-68.1	-30.4	0	0	113.1	Y619 M620 Q621 I625	Y619-Q623 HydrophobicContact CD2-CG 4.23Å; Y619-Q623 HydrophobicContact CE1-CG 4.15Å; Y619-Q623 HydrophobicContact CE2-CG 3.8Å; Y619-Q623 WeakPolarHBondContact O-CG 3.36Å; Y619-Q623 PolarHBondContact O-N 2.97Å; M620-Q623 HydrophobicContact CE-CB 4.44Å; M620-Q623 PolarHBondContact O-N 3.37Å; Q621-Q623 VanDerWaalsContact C-N 3.34Å; Q621-Q623 PolarHBondContact O-N 2.83Å; Q623-I625 HydrophobicContact CB-CD1 4.01Å; Q623-I625 HydrophobicContact CB-CG1 3.69Å; Q623-I625 PolarHBondContact O-N 2.95Å; Q623-I625 VanDerWaalsContact O-N 3.1Å
624	N	75.6	Confident	85.2	Confident	145 Å²	145	84.4 Å²	84.4	78%	0.775	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	37.7	-179.3	-151.2	22.3	0	0	0	113.3	M620 Q621 C622 P626	M620-N624 PolarHBondContact O-N 2.94Å; Q621-N624 PolarHBondContact O-N 2.89Å; C622-N624 PolarHBondContact O-N 2.74Å; N624-P626 WeakPolarHBondContact O-CD 3.26Å
625	I	72.1	Confident	85.3	Confident	54 Å²	54	81.7 Å²	81.7	28%	0.277	43%	0.433	S	S	.	.			trans	-80.8	112.2	-178.4	-54.3	-169.6	0	0	0	108.2	M620 Q623 G627 I661	M620-I625 HydrophobicContact CE-CD1 3.4Å; M620-I625 HydrophobicContact CE-CG1 4.09Å; M620-I625 HydrophobicContact SD-CD1 4.25Å; Q623-I625 HydrophobicContact CB-CD1 4.01Å; Q623-I625 HydrophobicContact CB-CG1 3.69Å; Q623-I625 PolarHBondContact O-N 2.95Å; Q623-I625 VanDerWaalsContact O-N 3.1Å; I625-G627 PolarHBondContact O-N 3.23Å; I625-I661 HydrophobicContact CD1-CD1 4.14Å; I625-I661 HydrophobicContact CD1-CG2 4.42Å; I625-I661 HydrophobicContact CG2-CD1 4.4Å
626	P	65.9	Low	85.3	Confident	105 Å²	105	80.3 Å²	80.3	68%	0.682	43%	0.428	S	S	*	.			trans	-66.3	133.3	172.9	26.8	-31.9	0	0	0	109.6	N624 R657	N624-P626 WeakPolarHBondContact O-CD 3.26Å; P626-R657 PolarHBondContact O-NH2 2.72Å
627	G	64.9	Low	85.4	Confident	48 Å²	48	82.9 Å²	82.9	50%	0.495	45%	0.445	S	S	.	.			trans	-139.4	118.8	178.8	0	0	0	0	0	110.8	I625	I625-G627 PolarHBondContact O-N 3.23Å
628	N	78	Confident	85.5	Confident	155 Å²	155	85.6 Å²	85.6	83%	0.829	46%	0.46	S	S	*	.	S	Bend	trans	-78.7	-9	173.7	-67.8	-13.5	0	0	0	112.6
629	I	88.6	Confident	85.5	Confident	70 Å²	70	83.4 Å²	83.4	36%	0.359	47%	0.466	S	S	.	.	S	Bend	trans	-118.3	124.8	-176.6	-56	172.9	0	0	0	109.2	L631 E654 M655 L658	I629-L631 PolarHBondContact O-N 2.81Å; I629-E654 HydrophobicContact CD1-CB 4.13Å; I629-M655 HydrophobicContact CD1-CG 4.35Å; I629-L658 HydrophobicContact CB-CD1 3.79Å; I629-L658 HydrophobicContact CD1-CD1 4.27Å; I629-L658 HydrophobicContact CG2-CD1 4.07Å
630	E	89.4	Confident	85.7	Confident	153 Å²	153	83.8 Å²	83.8	72%	0.715	47%	0.468	S	S	*	.			trans	-80	112.8	170	-173.9	179.9	-173.5	0	0	110.2	K617	K617-E630 IonicContact NZ-OE1 2.83Å; K617-E630 PolarHBondContact NZ-OE1 3.42Å
631	L	90.9	Very high	86	Confident	44 Å²	44	82.9 Å²	82.9	23%	0.23	46%	0.463	C	S	.	.			trans	-97	129.9	175.9	179.5	65	0	0	0	111.1	M613 F616 I629 V633 L658 F662	M613-L631 WeakPolarHBondContact CE-O 3.25Å; F616-L631 HydrophobicContact CE1-CD2 4.47Å; I629-L631 PolarHBondContact O-N 2.81Å; L631-V633 HydrophobicContact CD1-CG2 3.97Å; L631-V633 HydrophobicContact CD2-CG2 3.77Å; L631-V633 HydrophobicContact CG-CG2 3.71Å; L631-L658 HydrophobicContact CD2-CB 4.12Å; L631-F662 HydrophobicContact CD2-CB 4.33Å
632	T	92.1	Very high	86.3	Confident	87 Å²	87	76.8 Å²	76.8	53%	0.534	44%	0.436	S	S	.	.			trans	-124.4	127.6	165.4	-59.8	0	0	0	0	108.9	M613	M613-T632 HydrophobicContact CG-CG2 4.33Å
633	V	94.1	Very high	86.5	Confident	8 Å²	8	75.3 Å²	75.3	5%	0.048	42%	0.424	C	S	.	.			trans	-116.7	133.3	-176.5	-171.1	0	0	0	0	109.8	M613 L631 I635 F662 W677	M613-V633 VanDerWaalsContact CG-O 3.26Å; M613-V633 WeakPolarHBondContact CG-O 3.5Å; M613-V633 HydrophobicContact SD-CB 3.82Å; M613-V633 HydrophobicContact SD-CG2 4.13Å; M613-V633 PolarHBondContact SD-N 2.78Å; L631-V633 HydrophobicContact CD1-CG2 3.97Å; L631-V633 HydrophobicContact CD2-CG2 3.77Å; L631-V633 HydrophobicContact CG-CG2 3.71Å; V633-I635 HydrophobicContact CG1-CD1 3.79Å; V633-I635 HydrophobicContact CG1-CG1 4.38Å; V633-F662 HydrophobicContact CB-CD2 4.31Å; V633-F662 HydrophobicContact CB-CE1 4.19Å; V633-F662 HydrophobicContact CB-CE2 3.87Å; V633-F662 HydrophobicContact CB-CZ 3.8Å; V633-F662 HydrophobicContact CG1-CD1 4.28Å; V633-F662 HydrophobicContact CG1-CE1 3.77Å; V633-F662 HydrophobicContact CG1-CE2 4.35Å; V633-F662 HydrophobicContact CG1-CZ 3.79Å; V633-F662 HydrophobicContact CG2-CD1 4.2Å; V633-F662 HydrophobicContact CG2-CD2 3.8Å; V633-F662 HydrophobicContact CG2-CE1 4.31Å; V633-F662 HydrophobicContact CG2-CE2 3.88Å; V633-F662 HydrophobicContact CG2-CG 3.97Å; V633-F662 HydrophobicContact CG2-CZ 4.14Å; V633-W677 HydrophobicContact CG1-CH2 3.8Å; V633-W677 HydrophobicContact CG1-CZ3 3.96Å; V633-W677 HydrophobicContact CG2-CH2 3.85Å; V633-W677 HydrophobicContact CG2-CZ3 4.4Å
634	N	93.6	Very high	86.9	Confident	66 Å²	66	72.9 Å²	72.9	35%	0.353	41%	0.411	S	S	.	.			trans	-104.8	123.7	168	-66.1	-48.5	0	0	0	109	L570 M606 L636	L570-N634 HydrophobicContact CD2-CB 4.28Å; M606-N634 HydrophobicContact CE-CB 3.97Å; N634-L636 HydrophobicContact CB-CD2 4.09Å
635	I	95.1	Very high	87.4	Confident	26 Å²	26	71.5 Å²	71.5	13%	0.133	41%	0.407	C	S	.	.			trans	-99.6	122.2	179.1	-58.2	-65.7	0	0	0	109.1	S609 V633 F662 Y666 L675	S609-I635 PolarHBondContact OG-N 3.12Å; S609-I635 PolarHBondContact OG-O 2.66Å; V633-I635 HydrophobicContact CG1-CD1 3.79Å; V633-I635 HydrophobicContact CG1-CG1 4.38Å; I635-F662 HydrophobicContact CD1-CE1 3.61Å; I635-F662 HydrophobicContact CD1-CZ 3.8Å; I635-F662 HydrophobicContact CG1-CE1 4.37Å; I635-F662 HydrophobicContact CG1-CZ 4.06Å; I635-Y666 HydrophobicContact CB-CE2 4.35Å; I635-Y666 HydrophobicContact CD1-CD2 4.34Å; I635-Y666 HydrophobicContact CD1-CE2 4.27Å; I635-Y666 HydrophobicContact CG1-CD2 4.21Å; I635-Y666 HydrophobicContact CG1-CE2 3.88Å; I635-Y666 HydrophobicContact CG2-CE2 3.87Å; I635-L675 HydrophobicContact CD1-CD2 4.18Å
636	L	95.1	Very high	88.2	Confident	49 Å²	49	72 Å²	72	26%	0.257	41%	0.414	S	S	.	.			trans	-115.5	131.6	-170.1	-43.6	-176.9	0	0	0	109.9	L570 M606 N634 M638 W641 L681	L570-L636 HydrophobicContact CD1-CD1 4.05Å; L570-L636 HydrophobicContact CD2-CD1 4.16Å; L570-L636 HydrophobicContact CD2-CD2 3.99Å; M606-L636 HydrophobicContact CE-CD2 3.33Å; N634-L636 HydrophobicContact CB-CD2 4.09Å; L636-M638 PolarHBondContact O-N 3.28Å; L636-W641 HydrophobicContact CB-CD2 4.12Å; L636-W641 HydrophobicContact CB-CG 3.99Å; L636-W641 HydrophobicContact CD1-CD2 4.01Å; L636-W641 HydrophobicContact CD1-CE3 4.03Å; L636-W641 HydrophobicContact CD1-CG 4.44Å; L636-W641 HydrophobicContact CD1-CZ3 4.39Å; L636-W641 HydrophobicContact CD2-CD2 4.26Å; L636-W641 HydrophobicContact CD2-CH2 4.02Å; L636-W641 HydrophobicContact CD2-CZ2 3.65Å; L636-W641 HydrophobicContact CD2-CZ3 4.46Å; L636-W641 HydrophobicContact CG-CD2 4.35Å; L636-L681 HydrophobicContact CD1-CD1 4.35Å
637	T	95.6	Very high	89.2	Confident	62 Å²	62	68.1 Å²	68.1	38%	0.38	39%	0.387	S	S	.	.			trans	-76.6	111.4	175.4	-60.7	0	0	0	0	109.7	D605 G639 Y640 W641	D605-T637 PolarHBondContact OD1-OG1 3.31Å; D605-T637 VanDerWaalsContact OD2-CB 3.27Å; D605-T637 WeakPolarHBondContact OD2-CB 3.42Å; D605-T637 PolarHBondContact OD2-N 3.48Å; D605-T637 PolarHBondContact OD2-OG1 3Å; T637-G639 PolarHBondContact O-N 3.25Å; T637-Y640 HydrophobicContact CG2-CD2 3.87Å; T637-Y640 HydrophobicContact CG2-CE2 4.02Å; T637-Y640 HydrophobicContact CG2-CG 4.35Å; T637-Y640 PolarHBondContact O-N 2.98Å; T637-W641 VanDerWaalsContact O-CD1 3.31Å
638	M	91.8	Very high	90.4	Very high	144 Å²	144	74.5 Å²	74.5	71%	0.709	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-31.8	-170.9	-169	179	-176.8	0	0	115.1	L636	L636-M638 PolarHBondContact O-N 3.28Å
639	G	90.3	Very high	91.2	Very high	61 Å²	61	68.1 Å²	68.1	63%	0.629	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.9	179.4	0	0	0	0	0	115.9	T637	T637-G639 PolarHBondContact O-N 3.25Å
640	Y	92.2	Very high	91.4	Very high	92 Å²	92	70.3 Å²	70.3	36%	0.361	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-34.2	179.5	-63.3	-27.6	0	0	0	112.7	K598 T637	K598-Y640 HydrophobicContact CG-CD1 4.3Å; T637-Y640 HydrophobicContact CG2-CD2 3.87Å; T637-Y640 HydrophobicContact CG2-CE2 4.02Å; T637-Y640 HydrophobicContact CG2-CG 4.35Å; T637-Y640 PolarHBondContact O-N 2.98Å
641	W	93.5	Very high	91.7	Very high	10 Å²	10	64.4 Å²	64.4	4%	0.038	35%	0.352	C	S	.	.	S	Bend	trans	-88	160.8	-174.4	-66.7	74.9	0	0	0	111.8	A566 L569 L570 M602 D605 M606 L636 T637 Y644	A566-W641 HydrophobicContact CB-CE3 3.76Å; A566-W641 HydrophobicContact CB-CZ3 3.78Å; L569-W641 HydrophobicContact CB-CH2 4.33Å; L569-W641 HydrophobicContact CD1-CH2 4.05Å; L570-W641 HydrophobicContact CD1-CE3 4.24Å; L570-W641 HydrophobicContact CD1-CZ3 3.77Å; L570-W641 HydrophobicContact CD2-CH2 4.06Å; L570-W641 HydrophobicContact CD2-CZ3 4.04Å; L570-W641 HydrophobicContact CG-CH2 4.19Å; L570-W641 HydrophobicContact CG-CZ3 3.74Å; M602-W641 HydrophobicContact CB-CD2 4.47Å; M602-W641 HydrophobicContact CB-CH2 4.18Å; M602-W641 HydrophobicContact CB-CZ2 3.67Å; M602-W641 HydrophobicContact CE-CD2 4.26Å; M602-W641 HydrophobicContact CE-CE3 3.82Å; M602-W641 HydrophobicContact CE-CH2 4.19Å; M602-W641 HydrophobicContact CE-CZ3 3.8Å; M602-W641 HydrophobicContact CG-CD2 3.89Å; M602-W641 HydrophobicContact CG-CE3 4.4Å; M602-W641 HydrophobicContact CG-CG 4.19Å; M602-W641 HydrophobicContact CG-CZ2 4.02Å; M602-W641 WeakPolarHBondContact O-CZ2 3.41Å; D605-W641 HydrophobicContact CB-CZ2 4.26Å; D605-W641 PolarHBondContact OD2-NE1 3.45Å; M606-W641 HydrophobicContact CE-CH2 3.69Å; M606-W641 HydrophobicContact CE-CZ2 3.6Å; M606-W641 HydrophobicContact CG-CH2 4.33Å; M606-W641 HydrophobicContact CG-CZ2 4.41Å; M606-W641 HydrophobicContact SD-CH2 3.98Å; M606-W641 HydrophobicContact SD-CZ2 4.35Å; L636-W641 HydrophobicContact CB-CD2 4.12Å; L636-W641 HydrophobicContact CB-CG 3.99Å; L636-W641 HydrophobicContact CD1-CD2 4.01Å; L636-W641 HydrophobicContact CD1-CE3 4.03Å; L636-W641 HydrophobicContact CD1-CG 4.44Å; L636-W641 HydrophobicContact CD1-CZ3 4.39Å; L636-W641 HydrophobicContact CD2-CD2 4.26Å; L636-W641 HydrophobicContact CD2-CH2 4.02Å; L636-W641 HydrophobicContact CD2-CZ2 3.65Å; L636-W641 HydrophobicContact CD2-CZ3 4.46Å; L636-W641 HydrophobicContact CG-CD2 4.35Å; T637-W641 VanDerWaalsContact O-CD1 3.31Å; W641-Y644 HydrophobicContact CB-CE2 4.3Å
642	P	91.1	Very high	91.8	Very high	19 Å²	19	64.2 Å²	64.2	12%	0.123	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-53.3	146.6	167.2	-23.2	32.7	0	0	0	111.5	K562 K563 A566 Y644	K562-P642 HydrophobicContact CG-CG 4.33Å; K563-P642 HydrophobicContact CB-CG 4.45Å; A566-P642 HydrophobicContact CB-CG 4.02Å; P642-Y644 HydrophobicContact CB-CE1 4.27Å; P642-Y644 HydrophobicContact CB-CE2 4.38Å; P642-Y644 WeakPolarHBondContact O-CD2 3.43Å; P642-Y644 WeakPolarHBondContact O-CE2 3.23Å; P642-Y644 PolarHBondContact O-N 2.72Å
643	T	88.1	Confident	91.7	Very high	80 Å²	80	65.5 Å²	65.5	49%	0.491	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-72.2	122.4	172.6	-45.4	0	0	0	0	109.5
644	Y	86.8	Confident	91.5	Very high	52 Å²	52	70.3 Å²	70.3	20%	0.204	39%	0.386	C	S	.	.			trans	-104.6	137.5	175.1	-56.3	-75.6	0	0	0	109.8	A566 W641 P642 P646 L681	A566-Y644 VanDerWaalsContact CB-OH 3.29Å; A566-Y644 WeakPolarHBondContact CB-OH 3.35Å; W641-Y644 HydrophobicContact CB-CE2 4.3Å; P642-Y644 HydrophobicContact CB-CE1 4.27Å; P642-Y644 HydrophobicContact CB-CE2 4.38Å; P642-Y644 WeakPolarHBondContact O-CD2 3.43Å; P642-Y644 WeakPolarHBondContact O-CE2 3.23Å; P642-Y644 PolarHBondContact O-N 2.72Å; Y644-P646 WeakPolarHBondContact O-CD 3.48Å; Y644-L681 HydrophobicContact CD1-CD1 4.15Å; Y644-L681 HydrophobicContact CD1-CD2 4.04Å; Y644-L681 HydrophobicContact CD1-CG 4.37Å; Y644-L681 HydrophobicContact CD2-CD1 3.8Å; Y644-L681 HydrophobicContact CE1-CD1 4.06Å; Y644-L681 HydrophobicContact CE1-CD2 3.71Å; Y644-L681 HydrophobicContact CE1-CG 4.37Å; Y644-L681 HydrophobicContact CE2-CD1 3.67Å; Y644-L681 HydrophobicContact CG-CD1 4.03Å
645	V	86.6	Confident	91.4	Very high	117 Å²	117	69 Å²	69	71%	0.709	38%	0.378	S	S	*	.			trans	-78.7	120.3	173.5	-177.7	0	0	0	0	107.7	M647	V645-M647 PolarHBondContact O-N 3.01Å
646	P	87.7	Confident	91.3	Very high	63 Å²	63	71.1 Å²	71.1	41%	0.409	39%	0.391	S	S	.	.			trans	-62.9	135.4	173.8	-17.2	30.3	0	0	0	109.9	Y644 Q676	Y644-P646 WeakPolarHBondContact O-CD 3.48Å; P646-Q676 VanDerWaalsContact CG-NE2 3.34Å
647	M	88.8	Confident	91.2	Very high	25 Å²	25	74.1 Å²	74.1	12%	0.123	40%	0.4	C	S	.	.			trans	-119.4	124.4	174.2	-176.1	-178	-66.9	0	0	108.3	V645 V649 S679 T680 F703 I728 E729 E732	V645-M647 PolarHBondContact O-N 3.01Å; M647-V649 HydrophobicContact CG-CG1 4.19Å; M647-V649 HydrophobicContact SD-CG1 4.34Å; M647-S679 PolarHBondContact O-OG 3.11Å; M647-T680 HydrophobicContact CB-CG2 4.5Å; M647-F703 HydrophobicContact CE-CZ 4.21Å; M647-F703 HydrophobicContact SD-CE1 3.72Å; M647-F703 HydrophobicContact SD-CE2 4.21Å; M647-F703 HydrophobicContact SD-CZ 3.45Å; M647-F703 WeakPolarHBondContact SD-CZ 3.5Å; M647-I728 HydrophobicContact SD-CG2 4.28Å; M647-E729 HydrophobicContact CE-CB 4.18Å; M647-E729 HydrophobicContact CE-CG 4.13Å; M647-E729 HydrophobicContact CG-CG 4.48Å; M647-E729 HydrophobicContact SD-CG 4.47Å; M647-E732 HydrophobicContact CE-CB 4.18Å; M647-E732 HydrophobicContact CE-CG 4.42Å
648	E	88.9	Confident	91	Very high	181 Å²	181	72 Å²	72	85%	0.846	39%	0.386	S	S	*	.			trans	-74.9	132	173.2	-63.6	-166.6	167.3	0	0	109.1
649	V	94.1	Very high	91.1	Very high	21 Å²	21	67 Å²	67	13%	0.127	36%	0.361	C	S	.	.			trans	-142.5	151.4	178.6	-65.8	0	0	0	0	109.3	M647 L651 F703 L706 I728	M647-V649 HydrophobicContact CG-CG1 4.19Å; M647-V649 HydrophobicContact SD-CG1 4.34Å; V649-L651 HydrophobicContact CG2-CD2 3.95Å; V649-L651 HydrophobicContact CG2-CG 4.23Å; V649-L651 PolarHBondContact O-N 2.84Å; V649-F703 HydrophobicContact CG1-CD1 4.14Å; V649-F703 HydrophobicContact CG1-CE1 3.74Å; V649-L706 HydrophobicContact CB-CD1 3.79Å; V649-L706 HydrophobicContact CG1-CD1 4.41Å; V649-L706 HydrophobicContact CG2-CD1 3.98Å; V649-I728 HydrophobicContact CG1-CG1 4.12Å
650	H	94.7	Very high	91.2	Very high	116 Å²	116	68.4 Å²	68.4	54%	0.537	35%	0.351	S	S	.	.			trans	-82.8	100.4	177.7	-58.2	146.1	0	0	0	110.3	L706 V724 A725 T726	H650-L706 WeakPolarHBondContact O-CD2 3.16Å; H650-V724 PolarHBondContact ND1-O 3.19Å; H650-A725 WeakPolarHBondContact CB-O 3.48Å; H650-A725 PolarHBondContact ND1-O 2.99Å; H650-T726 PolarHBondContact N-O 2.8Å
651	L	93.9	Very high	91.2	Very high	30 Å²	30	65.5 Å²	65.5	16%	0.157	34%	0.341	C	S	.	.			trans	-82.9	142.1	176	-64.1	179.9	0	0	0	111.2	V649 M655 V656 L702 L706	V649-L651 HydrophobicContact CG2-CD2 3.95Å; V649-L651 HydrophobicContact CG2-CG 4.23Å; V649-L651 PolarHBondContact O-N 2.84Å; L651-M655 HydrophobicContact CB-CB 4.45Å; L651-V656 HydrophobicContact CB-CG2 3.7Å; L651-L702 HydrophobicContact CD2-CD1 4Å; L651-L702 HydrophobicContact CD2-CD2 4.14Å; L651-L702 HydrophobicContact CD2-CG 4.36Å; L651-L706 HydrophobicContact CD2-CD1 4.43Å; L651-L706 HydrophobicContact CD2-CD2 4.13Å
652	P	92.9	Very high	91.2	Very high	40 Å²	40	65.1 Å²	65.1	26%	0.26	34%	0.34	S	S	.	.			trans	-54.7	144.1	170.7	-25.6	33	0	0	0	111.7	E654 M655 V656 L706 L709	P652-E654 PolarHBondContact O-N 3.25Å; P652-E654 VanDerWaalsContact O-N 3.08Å; P652-M655 HydrophobicContact CB-CG 4.43Å; P652-M655 HydrophobicContact CG-CG 4.48Å; P652-M655 HydrophobicContact CG-SD 4.1Å; P652-M655 WeakPolarHBondContact O-CB 3.48Å; P652-M655 PolarHBondContact O-N 2.83Å; P652-V656 PolarHBondContact O-N 3.08Å; P652-L706 HydrophobicContact CG-CD2 4.38Å; P652-L709 HydrophobicContact CG-CD1 3.8Å
653	P	91.1	Very high	91.4	Very high	114 Å²	114	67.3 Å²	67.3	74%	0.74	35%	0.347	S	S	*	.	H	α-helix	trans	-53.5	-35.4	-177.1	-28.8	35.2	0	0	0	114.1	M655 V656 R657	P653-M655 VanDerWaalsContact C-N 3.34Å; P653-M655 PolarHBondContact O-N 2.82Å; P653-V656 PolarHBondContact O-N 3.32Å; P653-R657 WeakPolarHBondContact O-CB 3.33Å; P653-R657 PolarHBondContact O-N 3.29Å
654	E	89.6	Confident	91.6	Very high	109 Å²	109	67.5 Å²	67.5	51%	0.509	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-39.4	176.6	-62.5	-167.5	163.7	0	0	112.8	I629 P652 L658	I629-E654 HydrophobicContact CD1-CB 4.13Å; P652-E654 PolarHBondContact O-N 3.25Å; P652-E654 VanDerWaalsContact O-N 3.08Å; E654-L658 WeakPolarHBondContact O-CG 3.46Å; E654-L658 PolarHBondContact O-N 2.91Å
655	M	92.3	Very high	92	Very high	39 Å²	39	65.7 Å²	65.7	19%	0.192	34%	0.342	C	S	.	.	H	α-helix	trans	-71.5	-40.7	178.3	-64.5	-174.8	69.3	0	0	111.3	I629 L651 P652 P653 R657 L658 Q659 L702	I629-M655 HydrophobicContact CD1-CG 4.35Å; L651-M655 HydrophobicContact CB-CB 4.45Å; P652-M655 HydrophobicContact CB-CG 4.43Å; P652-M655 HydrophobicContact CG-CG 4.48Å; P652-M655 HydrophobicContact CG-SD 4.1Å; P652-M655 WeakPolarHBondContact O-CB 3.48Å; P652-M655 PolarHBondContact O-N 2.83Å; P653-M655 VanDerWaalsContact C-N 3.34Å; P653-M655 PolarHBondContact O-N 2.82Å; M655-R657 VanDerWaalsContact C-N 3.32Å; M655-R657 PolarHBondContact O-N 3.2Å; M655-L658 PolarHBondContact O-N 2.7Å; M655-Q659 WeakPolarHBondContact O-CG 3.39Å; M655-Q659 PolarHBondContact O-N 2.71Å; M655-L702 HydrophobicContact CE-CD1 3.66Å
656	V	93.4	Very high	92.4	Very high	69 Å²	69	60.4 Å²	60.4	42%	0.418	31%	0.309	S	S	.	.	H	α-helix	trans	-60.4	-44	175.7	178.7	0	0	0	0	110.6	L651 P652 P653 L658 Q659 E660	L651-V656 HydrophobicContact CB-CG2 3.7Å; P652-V656 PolarHBondContact O-N 3.08Å; P653-V656 PolarHBondContact O-N 3.32Å; V656-L658 VanDerWaalsContact C-N 3.33Å; V656-L658 PolarHBondContact O-N 3.36Å; V656-Q659 PolarHBondContact O-N 3.31Å; V656-E660 PolarHBondContact O-N 2.94Å
657	R	91.8	Very high	92.7	Very high	113 Å²	113	60.1 Å²	60.1	43%	0.426	30%	0.304	S	S	.	.	H	α-helix	trans	-56.7	-46.4	176	-171.9	-176.5	72.6	102.7	-5.4	111.7	P626 P653 M655 E660 I661	P626-R657 PolarHBondContact O-NH2 2.72Å; P653-R657 WeakPolarHBondContact O-CB 3.33Å; P653-R657 PolarHBondContact O-N 3.29Å; M655-R657 VanDerWaalsContact C-N 3.32Å; M655-R657 PolarHBondContact O-N 3.2Å; R657-E660 PolarHBondContact O-N 3.44Å; R657-I661 HydrophobicContact CG-CD1 4.01Å; R657-I661 VanDerWaalsContact O-CG1 3.26Å; R657-I661 WeakPolarHBondContact O-CG1 3.32Å; R657-I661 PolarHBondContact O-N 2.66Å
658	L	91.5	Very high	92.9	Very high	18 Å²	18	62 Å²	62	9%	0.094	33%	0.329	C	S	.	.	H	α-helix	trans	-66	-38.2	178.6	-70.1	172.1	0	0	0	112.5	I629 L631 E654 M655 V656 F662	I629-L658 HydrophobicContact CB-CD1 3.79Å; I629-L658 HydrophobicContact CD1-CD1 4.27Å; I629-L658 HydrophobicContact CG2-CD1 4.07Å; L631-L658 HydrophobicContact CD2-CB 4.12Å; E654-L658 WeakPolarHBondContact O-CG 3.46Å; E654-L658 PolarHBondContact O-N 2.91Å; M655-L658 PolarHBondContact O-N 2.7Å; V656-L658 VanDerWaalsContact C-N 3.33Å; V656-L658 PolarHBondContact O-N 3.36Å; L658-F662 WeakPolarHBondContact O-CB 3.34Å; L658-F662 PolarHBondContact O-N 2.75Å
659	Q	93.3	Very high	93	Very high	39 Å²	39	58.2 Å²	58.2	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-42.8	174.4	-75.5	-173.1	-22.8	0	0	111.9	M655 V656 F662 K663 W677	M655-Q659 WeakPolarHBondContact O-CG 3.39Å; M655-Q659 PolarHBondContact O-N 2.71Å; V656-Q659 PolarHBondContact O-N 3.31Å; Q659-F662 PolarHBondContact O-N 2.81Å; Q659-K663 VanDerWaalsContact O-CB 3.24Å; Q659-K663 WeakPolarHBondContact O-CB 3.33Å; Q659-K663 PolarHBondContact O-N 3.24Å; Q659-W677 HydrophobicContact CB-CZ2 3.84Å; Q659-W677 HydrophobicContact CG-CD2 4.18Å; Q659-W677 HydrophobicContact CG-CE3 4.48Å; Q659-W677 HydrophobicContact CG-CH2 4.04Å; Q659-W677 HydrophobicContact CG-CZ2 3.68Å; Q659-W677 HydrophobicContact CG-CZ3 4.42Å
660	E	92.6	Very high	92.9	Very high	90 Å²	90	59.6 Å²	59.6	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-72.9	-36.9	-178.4	-160.7	61.3	-156.5	0	0	112.4	V656 R657 K663 T664	V656-E660 PolarHBondContact O-N 2.94Å; R657-E660 PolarHBondContact O-N 3.44Å; E660-K663 VanDerWaalsContact CD-NZ 3.34Å; E660-K663 PolarHBondContact O-N 3.32Å; E660-K663 IonicContact OE1-NZ 2.7Å; E660-K663 PolarHBondContact OE1-NZ 3.01Å; E660-K663 IonicContact OE2-NZ 2.84Å; E660-K663 PolarHBondContact OE2-NZ 2.9Å; E660-T664 WeakPolarHBondContact O-CB 3.44Å; E660-T664 PolarHBondContact O-N 3.15Å; E660-T664 PolarHBondContact O-OG1 3Å
661	I	92.7	Very high	92.8	Very high	31 Å²	31	59.1 Å²	59.1	16%	0.159	33%	0.325	C	S	.	.	H	α-helix	trans	-59.4	-48.8	171.9	-70.8	167.7	0	0	0	110.3	F616 M620 I625 R657 T664 F665	F616-I661 HydrophobicContact CE2-CG2 4.12Å; F616-I661 HydrophobicContact CZ-CG2 4.18Å; M620-I661 HydrophobicContact CE-CG2 3.44Å; M620-I661 VanDerWaalsContact CE-CG2 3.44Å; M620-I661 HydrophobicContact SD-CG2 3.59Å; M620-I661 VanDerWaalsContact SD-CG2 3.59Å; I625-I661 HydrophobicContact CD1-CD1 4.14Å; I625-I661 HydrophobicContact CD1-CG2 4.42Å; I625-I661 HydrophobicContact CG2-CD1 4.4Å; R657-I661 HydrophobicContact CG-CD1 4.01Å; R657-I661 VanDerWaalsContact O-CG1 3.26Å; R657-I661 WeakPolarHBondContact O-CG1 3.32Å; R657-I661 PolarHBondContact O-N 2.66Å; I661-T664 PolarHBondContact O-N 2.94Å; I661-F665 PolarHBondContact O-N 2.77Å
662	F	94.1	Very high	92.6	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-43.5	177.5	178.5	-87.6	0	0	0	111.8	I612 M613 F616 L631 V633 I635 L658 Q659 T664 F665 Y666 L675 W677	I612-F662 HydrophobicContact CG2-CZ 4.49Å; M613-F662 HydrophobicContact SD-CE2 3.95Å; F616-F662 HydrophobicContact CB-CE2 4.46Å; F616-F662 AromaticContact CD1-CD2 3.88Å; F616-F662 HydrophobicContact CD1-CD2 3.88Å; F616-F662 HydrophobicContact CD1-CE2 4.44Å; F616-F662 AromaticContact CD2-CD2 3.84Å; F616-F662 HydrophobicContact CD2-CD2 3.84Å; F616-F662 HydrophobicContact CD2-CE2 4.48Å; F616-F662 HydrophobicContact CE1-CB 4.5Å; F616-F662 AromaticContact CE1-CD2 3.95Å; F616-F662 HydrophobicContact CE1-CD2 3.95Å; F616-F662 HydrophobicContact CE2-CB 4.05Å; F616-F662 AromaticContact CE2-CD2 3.93Å; F616-F662 HydrophobicContact CE2-CD2 3.93Å; F616-F662 HydrophobicContact CE2-CG 4.45Å; F616-F662 AromaticContact CG-CD2 3.8Å; F616-F662 HydrophobicContact CG-CD2 3.8Å; F616-F662 HydrophobicContact CG-CE2 4.2Å; F616-F662 HydrophobicContact CZ-CB 3.89Å; F616-F662 AromaticContact CZ-CD2 3.97Å; F616-F662 HydrophobicContact CZ-CD2 3.97Å; F616-F662 HydrophobicContact CZ-CG 4.45Å; L631-F662 HydrophobicContact CD2-CB 4.33Å; V633-F662 HydrophobicContact CB-CD2 4.31Å; V633-F662 HydrophobicContact CB-CE1 4.19Å; V633-F662 HydrophobicContact CB-CE2 3.87Å; V633-F662 HydrophobicContact CB-CZ 3.8Å; V633-F662 HydrophobicContact CG1-CD1 4.28Å; V633-F662 HydrophobicContact CG1-CE1 3.77Å; V633-F662 HydrophobicContact CG1-CE2 4.35Å; V633-F662 HydrophobicContact CG1-CZ 3.79Å; V633-F662 HydrophobicContact CG2-CD1 4.2Å; V633-F662 HydrophobicContact CG2-CD2 3.8Å; V633-F662 HydrophobicContact CG2-CE1 4.31Å; V633-F662 HydrophobicContact CG2-CE2 3.88Å; V633-F662 HydrophobicContact CG2-CG 3.97Å; V633-F662 HydrophobicContact CG2-CZ 4.14Å; I635-F662 HydrophobicContact CD1-CE1 3.61Å; I635-F662 HydrophobicContact CD1-CZ 3.8Å; I635-F662 HydrophobicContact CG1-CE1 4.37Å; I635-F662 HydrophobicContact CG1-CZ 4.06Å; L658-F662 WeakPolarHBondContact O-CB 3.34Å; L658-F662 PolarHBondContact O-N 2.75Å; Q659-F662 PolarHBondContact O-N 2.81Å; F662-T664 PolarHBondContact O-N 3.25Å; F662-F665 WeakPolarHBondContact O-CB 3.4Å; F662-F665 PolarHBondContact O-N 2.59Å; F662-Y666 HydrophobicContact CE1-CD2 4.38Å; F662-Y666 HydrophobicContact CE1-CG 4.45Å; F662-Y666 HydrophobicContact CZ-CD2 4.26Å; F662-Y666 WeakPolarHBondContact O-CB 3.36Å; F662-Y666 PolarHBondContact O-N 2.76Å; F662-L675 HydrophobicContact CE1-CD1 4.49Å; F662-W677 HydrophobicContact CD1-CH2 4.22Å; F662-W677 HydrophobicContact CD1-CZ2 4.05Å
663	K	94.3	Very high	92.7	Very high	66 Å²	66	66.4 Å²	66.4	29%	0.287	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-43.8	178.7	174.7	172.1	157.4	-129.8	0	111.8	Q659 E660 Y666 L667 L675	Q659-K663 VanDerWaalsContact O-CB 3.24Å; Q659-K663 WeakPolarHBondContact O-CB 3.33Å; Q659-K663 PolarHBondContact O-N 3.24Å; E660-K663 VanDerWaalsContact CD-NZ 3.34Å; E660-K663 PolarHBondContact O-N 3.32Å; E660-K663 IonicContact OE1-NZ 2.7Å; E660-K663 PolarHBondContact OE1-NZ 3.01Å; E660-K663 IonicContact OE2-NZ 2.84Å; E660-K663 PolarHBondContact OE2-NZ 2.9Å; K663-Y666 PolarHBondContact O-N 3.31Å; K663-L667 HydrophobicContact CG-CD1 3.82Å; K663-L667 HydrophobicContact CG-CG 4.39Å; K663-L667 WeakPolarHBondContact O-CB 3.35Å; K663-L667 VanDerWaalsContact O-CG 3.29Å; K663-L667 WeakPolarHBondContact O-CG 3.46Å; K663-L667 PolarHBondContact O-N 3.14Å; K663-L675 HydrophobicContact CB-CD1 4.36Å; K663-L675 HydrophobicContact CG-CD1 4.28Å
664	T	92.9	Very high	92.8	Very high	84 Å²	84	70.3 Å²	70.3	52%	0.515	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-46.6	176.1	-56.4	0	0	0	0	111.1	E660 I661 F662 Y666 G668	E660-T664 WeakPolarHBondContact O-CB 3.44Å; E660-T664 PolarHBondContact O-N 3.15Å; E660-T664 PolarHBondContact O-OG1 3Å; I661-T664 PolarHBondContact O-N 2.94Å; F662-T664 PolarHBondContact O-N 3.25Å; T664-Y666 PolarHBondContact O-N 2.92Å; T664-G668 PolarHBondContact O-N 2.77Å
665	F	94.4	Very high	93	Very high	13 Å²	13	67 Å²	67	6%	0.057	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-47.7	174.9	164.1	-95.9	0	0	0	112.3	I612 Q615 F616 Y619 I661 F662 K669	I612-F665 HydrophobicContact CG2-CE1 4.16Å; Q615-F665 HydrophobicContact CB-CZ 4Å; F616-F665 HydrophobicContact CB-CD1 4.1Å; F616-F665 HydrophobicContact CB-CE1 3.65Å; F616-F665 HydrophobicContact CB-CZ 3.94Å; F616-F665 HydrophobicContact CD2-CB 4Å; F616-F665 AromaticContact CD2-CD1 3.5Å; F616-F665 HydrophobicContact CD2-CD1 3.5Å; F616-F665 HydrophobicContact CD2-CD2 4.19Å; F616-F665 AromaticContact CD2-CE1 3.96Å; F616-F665 HydrophobicContact CD2-CE1 3.96Å; F616-F665 AromaticContact CD2-CG 3.63Å; F616-F665 HydrophobicContact CD2-CG 3.63Å; F616-F665 HydrophobicContact CD2-CZ 4.46Å; F616-F665 HydrophobicContact CE2-CB 4.14Å; F616-F665 HydrophobicContact CE2-CD1 4.38Å; F616-F665 HydrophobicContact CE2-CG 4.28Å; F616-F665 HydrophobicContact CG-CD1 4.2Å; F616-F665 HydrophobicContact CG-CE1 4.25Å; Y619-F665 HydrophobicContact CD1-CB 4.18Å; Y619-F665 AromaticContact CD1-CD2 3.58Å; Y619-F665 HydrophobicContact CD1-CD2 3.58Å; Y619-F665 HydrophobicContact CD1-CE2 4.32Å; Y619-F665 HydrophobicContact CD1-CG 4.17Å; Y619-F665 HydrophobicContact CD2-CD2 4.19Å; Y619-F665 HydrophobicContact CE1-CB 4.12Å; Y619-F665 HydrophobicContact CE1-CD2 4.17Å; Y619-F665 AromaticContact CG-CD2 3.61Å; Y619-F665 HydrophobicContact CG-CD2 3.61Å; Y619-F665 AromaticContact CG-CE2 3.99Å; Y619-F665 HydrophobicContact CG-CE2 3.99Å; I661-F665 PolarHBondContact O-N 2.77Å; F662-F665 WeakPolarHBondContact O-CB 3.4Å; F662-F665 PolarHBondContact O-N 2.59Å; F665-K669 HydrophobicContact CE2-CD 3.88Å; F665-K669 HydrophobicContact CZ-CD 3.87Å; F665-K669 PolarHBondContact O-N 3.11Å
666	Y	95.4	Very high	93.1	Very high	6 Å²	6	70.4 Å²	70.4	2%	0.024	38%	0.38	C	S	.	.	H	α-helix	trans	-66.7	-48.6	-176.5	-176.3	-86.9	0	0	0	111.7	I612 I635 F662 K663 T664 G668 K669 H670 R673 L675	I612-Y666 HydrophobicContact CD1-CE2 4.04Å; I612-Y666 HydrophobicContact CG2-CD2 4.38Å; I635-Y666 HydrophobicContact CB-CE2 4.35Å; I635-Y666 HydrophobicContact CD1-CD2 4.34Å; I635-Y666 HydrophobicContact CD1-CE2 4.27Å; I635-Y666 HydrophobicContact CG1-CD2 4.21Å; I635-Y666 HydrophobicContact CG1-CE2 3.88Å; I635-Y666 HydrophobicContact CG2-CE2 3.87Å; F662-Y666 HydrophobicContact CE1-CD2 4.38Å; F662-Y666 HydrophobicContact CE1-CG 4.45Å; F662-Y666 HydrophobicContact CZ-CD2 4.26Å; F662-Y666 WeakPolarHBondContact O-CB 3.36Å; F662-Y666 PolarHBondContact O-N 2.76Å; K663-Y666 PolarHBondContact O-N 3.31Å; T664-Y666 PolarHBondContact O-N 2.92Å; Y666-G668 VanDerWaalsContact C-N 3.3Å; Y666-G668 PolarHBondContact O-N 2.78Å; Y666-K669 PolarHBondContact O-N 3.09Å; Y666-H670 HydrophobicContact CD1-CB 4.35Å; Y666-H670 AromaticContact CD2-CD2 3.83Å; Y666-H670 HydrophobicContact CE1-CB 3.95Å; Y666-H670 AromaticContact CE2-CD2 3.62Å; Y666-H670 AromaticContact CZ-CD2 3.81Å; Y666-H670 WeakPolarHBondContact O-CB 3.48Å; Y666-H670 PolarHBondContact O-N 2.95Å; Y666-R673 HydrophobicContact CE1-CB 4.36Å; Y666-R673 PolarHBondContact OH-NH1 2.87Å; Y666-L675 HydrophobicContact CD1-CD1 3.68Å; Y666-L675 HydrophobicContact CD1-CD2 3.79Å; Y666-L675 HydrophobicContact CD1-CG 3.89Å; Y666-L675 HydrophobicContact CE1-CD1 4.43Å; Y666-L675 HydrophobicContact CE1-CD2 3.67Å; Y666-L675 HydrophobicContact CE1-CG 4.2Å; Y666-L675 HydrophobicContact CG-CD1 3.97Å; Y666-L675 HydrophobicContact CG-CD2 4.46Å
667	L	94.9	Very high	93.1	Very high	57 Å²	57	71.2 Å²	71.2	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-68	-31	-179.3	-66.1	178	0	0	0	112.2	K663 K669 H670 R673 L675	K663-L667 HydrophobicContact CG-CD1 3.82Å; K663-L667 HydrophobicContact CG-CG 4.39Å; K663-L667 WeakPolarHBondContact O-CB 3.35Å; K663-L667 VanDerWaalsContact O-CG 3.29Å; K663-L667 WeakPolarHBondContact O-CG 3.46Å; K663-L667 PolarHBondContact O-N 3.14Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 3.03Å; L667-H670 CarbonylContact O-C 3.51Å; L667-R673 WeakPolarHBondContact CD2-O 3.34Å; L667-L675 HydrophobicContact CD2-CG 4.47Å
668	G	92.5	Very high	93.1	Very high	64 Å²	64	67.8 Å²	67.8	66%	0.66	36%	0.364	S	S	*	.	H	α-helix	trans	-65.6	-29.7	173.5	0	0	0	0	0	113.7	T664 Y666	T664-G668 PolarHBondContact O-N 2.77Å; Y666-G668 VanDerWaalsContact C-N 3.3Å; Y666-G668 PolarHBondContact O-N 2.78Å
669	K	91.4	Very high	93.1	Very high	102 Å²	102	67.6 Å²	67.6	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-93	-27.3	175.9	-75.3	-173.2	169.5	-175.9	0	113.9	F665 Y666 L667	F665-K669 HydrophobicContact CE2-CD 3.88Å; F665-K669 HydrophobicContact CZ-CD 3.87Å; F665-K669 PolarHBondContact O-N 3.11Å; Y666-K669 PolarHBondContact O-N 3.09Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 3.03Å
670	H	91.9	Very high	92.8	Very high	51 Å²	51	68.4 Å²	68.4	24%	0.236	37%	0.372	C	S	.	.	S	Bend	trans	-123.2	75.4	-174.6	-61.6	-73.9	0	0	0	111.1	Y666 L667 R673	Y666-H670 HydrophobicContact CD1-CB 4.35Å; Y666-H670 AromaticContact CD2-CD2 3.83Å; Y666-H670 HydrophobicContact CE1-CB 3.95Å; Y666-H670 AromaticContact CE2-CD2 3.62Å; Y666-H670 AromaticContact CZ-CD2 3.81Å; Y666-H670 WeakPolarHBondContact O-CB 3.48Å; Y666-H670 PolarHBondContact O-N 2.95Å; L667-H670 CarbonylContact O-C 3.51Å; H670-R673 HydrophobicContact CB-CG 4.38Å
671	S	91.2	Very high	92.5	Very high	106 Å²	106	66.3 Å²	66.3	74%	0.741	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	145	178.1	-52.8	0	0	0	0	112.6	R673	S671-R673 VanDerWaalsContact C-N 3.33Å; S671-R673 PolarHBondContact O-N 3.37Å
672	G	90.8	Very high	92.3	Very high	92 Å²	92	66 Å²	66	95%	0.948	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	9.4	177.5	0	0	0	0	0	115.1
673	R	94.3	Very high	92.1	Very high	130 Å²	130	69.7 Å²	69.7	49%	0.491	39%	0.385	S	S	.	.			trans	-103.6	156.2	175.8	-59.5	-167.3	-177.2	-172.8	-4.4	111.9	Y666 L667 H670 S671	Y666-R673 HydrophobicContact CE1-CB 4.36Å; Y666-R673 PolarHBondContact OH-NH1 2.87Å; L667-R673 WeakPolarHBondContact CD2-O 3.34Å; H670-R673 HydrophobicContact CB-CG 4.38Å; S671-R673 VanDerWaalsContact C-N 3.33Å; S671-R673 PolarHBondContact O-N 3.37Å
674	K	93.1	Very high	92	Very high	197 Å²	197	67.8 Å²	67.8	86%	0.857	38%	0.38	S	S	*	.			trans	-121.2	135.5	170.2	-176.7	178.3	178.3	-178.9	0	108.9
675	L	94	Very high	91.9	Very high	38 Å²	38	66.8 Å²	66.8	20%	0.199	37%	0.374	C	S	.	.			trans	-99.5	144.1	173.9	-66.8	-179.8	0	0	0	110.5	I635 F662 K663 Y666 L667	I635-L675 HydrophobicContact CD1-CD2 4.18Å; F662-L675 HydrophobicContact CE1-CD1 4.49Å; K663-L675 HydrophobicContact CB-CD1 4.36Å; K663-L675 HydrophobicContact CG-CD1 4.28Å; Y666-L675 HydrophobicContact CD1-CD1 3.68Å; Y666-L675 HydrophobicContact CD1-CD2 3.79Å; Y666-L675 HydrophobicContact CD1-CG 3.89Å; Y666-L675 HydrophobicContact CE1-CD1 4.43Å; Y666-L675 HydrophobicContact CE1-CD2 3.67Å; Y666-L675 HydrophobicContact CE1-CG 4.2Å; Y666-L675 HydrophobicContact CG-CD1 3.97Å; Y666-L675 HydrophobicContact CG-CD2 4.46Å; L667-L675 HydrophobicContact CD2-CG 4.47Å
676	Q	94.3	Very high	91.9	Very high	112 Å²	112	67.8 Å²	67.8	52%	0.523	38%	0.379	S	S	.	.			trans	-135.6	117.1	171.6	-176.6	179.1	54.2	0	0	108.1	P646	P646-Q676 VanDerWaalsContact CG-NE2 3.34Å
677	W	93.5	Very high	91.7	Very high	86 Å²	86	76 Å²	76	33%	0.326	42%	0.415	S	S	.	.			trans	-74.5	141.2	179	-72.4	100.1	0	0	0	111	V633 Q659 F662	V633-W677 HydrophobicContact CG1-CH2 3.8Å; V633-W677 HydrophobicContact CG1-CZ3 3.96Å; V633-W677 HydrophobicContact CG2-CH2 3.85Å; V633-W677 HydrophobicContact CG2-CZ3 4.4Å; Q659-W677 HydrophobicContact CB-CZ2 3.84Å; Q659-W677 HydrophobicContact CG-CD2 4.18Å; Q659-W677 HydrophobicContact CG-CE3 4.48Å; Q659-W677 HydrophobicContact CG-CH2 4.04Å; Q659-W677 HydrophobicContact CG-CZ2 3.68Å; Q659-W677 HydrophobicContact CG-CZ3 4.42Å; F662-W677 HydrophobicContact CD1-CH2 4.22Å; F662-W677 HydrophobicContact CD1-CZ2 4.05Å
678	Q	92.9	Very high	91.5	Very high	40 Å²	40	74.1 Å²	74.1	19%	0.187	41%	0.408	C	S	.	.			trans	-118.5	93.3	-179	-67.5	-65.4	-20.5	0	0	110	T680 L681	Q678-T680 PolarHBondContact O-N 3.19Å; Q678-L681 HydrophobicContact CB-CD1 4.02Å; Q678-L681 HydrophobicContact CB-CG 4.32Å; Q678-L681 PolarHBondContact O-N 3Å
679	S	90.4	Very high	91.2	Very high	14 Å²	14	78.1 Å²	78.1	10%	0.098	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-60.9	-33	-176	-53.7	0	0	0	0	113	M647 L681 G682	M647-S679 PolarHBondContact O-OG 3.11Å; S679-L681 PolarHBondContact O-N 2.92Å; S679-G682 PolarHBondContact O-N 3.31Å; S679-G682 VanDerWaalsContact O-N 3.13Å
680	T	86.7	Confident	90.8	Very high	56 Å²	56	73.8 Å²	73.8	34%	0.344	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-60.8	-25.2	179.2	51.5	0	0	0	0	114	M647 Q678 F703	M647-T680 HydrophobicContact CB-CG2 4.5Å; Q678-T680 PolarHBondContact O-N 3.19Å; T680-F703 HydrophobicContact CG2-CE2 4.05Å; T680-F703 HydrophobicContact CG2-CZ 3.73Å
681	L	87.3	Confident	89.7	Confident	47 Å²	47	79.4 Å²	79.4	25%	0.246	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-98.8	-8.3	-178.5	-55.8	175.8	0	0	0	112.6	L570 L636 Y644 Q678 S679	L570-L681 HydrophobicContact CD1-CB 4.45Å; L570-L681 HydrophobicContact CD1-CD1 3.85Å; L570-L681 HydrophobicContact CD1-CD2 4.22Å; L570-L681 HydrophobicContact CD1-CG 4.4Å; L636-L681 HydrophobicContact CD1-CD1 4.35Å; Y644-L681 HydrophobicContact CD1-CD1 4.15Å; Y644-L681 HydrophobicContact CD1-CD2 4.04Å; Y644-L681 HydrophobicContact CD1-CG 4.37Å; Y644-L681 HydrophobicContact CD2-CD1 3.8Å; Y644-L681 HydrophobicContact CE1-CD1 4.06Å; Y644-L681 HydrophobicContact CE1-CD2 3.71Å; Y644-L681 HydrophobicContact CE1-CG 4.37Å; Y644-L681 HydrophobicContact CE2-CD1 3.67Å; Y644-L681 HydrophobicContact CG-CD1 4.03Å; Q678-L681 HydrophobicContact CB-CD1 4.02Å; Q678-L681 HydrophobicContact CB-CG 4.32Å; Q678-L681 PolarHBondContact O-N 3Å; S679-L681 PolarHBondContact O-N 2.92Å
682	G	88.9	Confident	88.4	Confident	24 Å²	24	82 Å²	82	25%	0.247	42%	0.415	C	S	.	.			trans	-69.6	143.1	-178.1	0	0	0	0	0	112.3	S679 S701 L702	S679-G682 PolarHBondContact O-N 3.31Å; S679-G682 VanDerWaalsContact O-N 3.13Å; G682-S701 WeakPolarHBondContact O-CA 3.3Å; G682-L702 PolarHBondContact O-N 2.96Å
683	H	89.7	Confident	87.1	Confident	78 Å²	78	80.3 Å²	80.3	36%	0.361	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.3	170.5	69.6	-85.6	0	0	0	110.4	V700	H683-V700 CarbonylContact C-O 3.54Å; H683-V700 VanDerWaalsContact CA-O 3.26Å; H683-V700 WeakPolarHBondContact CA-O 3.34Å; H683-V700 VanDerWaalsContact CB-O 3.31Å; H683-V700 WeakPolarHBondContact CB-O 3.27Å
684	C	90.9	Very high	86.1	Confident	27 Å²	27	76.1 Å²	76.1	18%	0.182	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	164.2	-176.3	-51.7	0	0	0	0	110.5	Q699 V700 T705	C684-Q699 WeakPolarHBondContact O-CA 3.19Å; C684-V700 PolarHBondContact N-O 2.81Å; C684-V700 PolarHBondContact O-N 2.87Å; C684-T705 HydrophobicContact CB-CG2 4.45Å; C684-T705 WeakPolarHBondContact CB-OG1 3.33Å
685	V	92.2	Very high	85.7	Confident	63 Å²	63	73.2 Å²	73.2	38%	0.382	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.4	167.7	-178.3	0	0	0	0	107.3	E697 L698	V685-E697 HydrophobicContact CG1-CB 4.05Å; V685-E697 HydrophobicContact CG1-CG 4.3Å; V685-L698 CarbonylContact C-O 3.59Å; V685-L698 WeakPolarHBondContact CA-O 3.46Å
686	L	92.9	Very high	85.5	Confident	33 Å²	33	73.2 Å²	73.2	17%	0.173	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.8	177.9	-58.7	-178.5	0	0	0	110.2	E697 L698 V700 T705 L708	L686-E697 CarbonylContact O-C 3.53Å; L686-E697 VanDerWaalsContact O-CA 3.31Å; L686-E697 WeakPolarHBondContact O-CA 3.48Å; L686-L698 HydrophobicContact CB-CB 4.45Å; L686-L698 PolarHBondContact N-O 3.38Å; L686-L698 PolarHBondContact O-N 3.23Å; L686-V700 HydrophobicContact CD1-CG2 3.73Å; L686-V700 HydrophobicContact CG-CG2 3.79Å; L686-T705 HydrophobicContact CD1-CG2 4.26Å; L686-T705 HydrophobicContact CD2-CG2 3.86Å; L686-T705 HydrophobicContact CG-CG2 4.5Å; L686-L708 HydrophobicContact CD1-CB 4.06Å; L686-L708 HydrophobicContact CD1-CD1 3.9Å
687	K	91.9	Very high	85.4	Confident	179 Å²	179	70.1 Å²	70.1	78%	0.778	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	113.6	167.5	-67.1	176.9	-177.3	173.8	0	107.3	E697	K687-E697 HydrophobicContact CG-CG 4.37Å
688	A	89.9	Confident	85.3	Confident	18 Å²	18	66.2 Å²	66.2	15%	0.149	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.3	179.3	0	0	0	0	0	109.8	F690 K695 K696 L698	A688-F690 HydrophobicContact CB-CD2 4.23Å; A688-F690 HydrophobicContact CB-CE2 3.48Å; A688-F690 VanDerWaalsContact CB-CE2 3.48Å; A688-F690 HydrophobicContact CB-CZ 3.85Å; A688-K695 WeakPolarHBondContact O-CA 3.48Å; A688-K696 PolarHBondContact N-O 3.17Å; A688-K696 PolarHBondContact O-N 3.49Å; A688-L698 HydrophobicContact CB-CD1 3.9Å; A688-L698 HydrophobicContact CB-CG 4.03Å
689	E	87.1	Confident	85.1	Confident	148 Å²	148	65.8 Å²	65.8	69%	0.692	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	108.8	176.8	-174.5	152.3	-143.9	0	0	109.1	K695	E689-K695 WeakPolarHBondContact OE1-CE 3.49Å; E689-K695 IonicContact OE1-NZ 3.76Å
690	F	82.4	Confident	85.2	Confident	11 Å²	11	65.1 Å²	65.1	5%	0.048	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.4	177.8	-61.7	-82.2	0	0	0	109.2	A688 E692 K693 K696 V747 F769	A688-F690 HydrophobicContact CB-CD2 4.23Å; A688-F690 HydrophobicContact CB-CE2 3.48Å; A688-F690 VanDerWaalsContact CB-CE2 3.48Å; A688-F690 HydrophobicContact CB-CZ 3.85Å; F690-E692 VanDerWaalsContact C-N 3.26Å; F690-E692 PolarHBondContact O-N 2.95Å; F690-K693 PolarHBondContact O-N 3.21Å; F690-K696 HydrophobicContact CD2-CB 4.48Å; F690-K696 HydrophobicContact CD2-CG 4.17Å; F690-K696 HydrophobicContact CE2-CB 4.19Å; F690-K696 HydrophobicContact CE2-CG 4.24Å; F690-V747 HydrophobicContact CE1-CG1 4.38Å; F690-V747 HydrophobicContact CZ-CG1 4.12Å; F690-F769 HydrophobicContact CD1-CB 4.35Å; F690-F769 HydrophobicContact CE1-CB 4.16Å; F690-F769 HydrophobicContact CE1-CD1 4.27Å; F690-F769 AromaticContact CE2-CD1 3.97Å; F690-F769 HydrophobicContact CE2-CD1 3.97Å; F690-F769 HydrophobicContact CE2-CE1 4.48Å; F690-F769 AromaticContact CZ-CD1 3.84Å; F690-F769 HydrophobicContact CZ-CD1 3.84Å; F690-F769 HydrophobicContact CZ-CE1 4.48Å; F690-F769 HydrophobicContact CZ-CG 4.47Å
691	K	69.5	Low	85.4	Confident	168 Å²	168	62.8 Å²	62.8	73%	0.73	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-37.1	-166.5	-69.7	174.8	-178.6	163.5	0	115.2	D767	K691-D767 IonicContact NZ-OD2 3.55Å
692	E	62.8	Low	85.6	Confident	160 Å²	160	61.1 Å²	61.1	75%	0.748	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-6.3	-174.7	-64.5	-170.3	163.5	0	0	115.3	F690	F690-E692 VanDerWaalsContact C-N 3.26Å; F690-E692 PolarHBondContact O-N 2.95Å
693	K	63.5	Low	85.8	Confident	57 Å²	57	60.2 Å²	60.2	25%	0.248	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134	14.8	-162.1	-57.4	-173.3	-171.3	131.3	0	115.1	F690 D768 K770	F690-K693 PolarHBondContact O-N 3.21Å; K693-D768 PolarHBondContact NZ-O 3.15Å; K693-D768 IonicContact NZ-OD1 2.66Å; K693-D768 PolarHBondContact NZ-OD1 2.96Å; K693-K770 HydrophobicContact CD-CD 4.28Å; K693-K770 HydrophobicContact CD-CG 3.78Å; K693-K770 VanDerWaalsContact CE-CE 3.43Å
694	G	73.3	Confident	86	Confident	42 Å²	42	56.5 Å²	56.5	43%	0.433	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	81.5	174.5	169.5	0	0	0	0	0	114.3
695	K	85.7	Confident	86.2	Confident	136 Å²	136	55.3 Å²	55.3	59%	0.591	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.6	-178.2	-63	-179.2	178.1	-176.6	0	110.6	A688 E689 F774	A688-K695 WeakPolarHBondContact O-CA 3.48Å; E689-K695 WeakPolarHBondContact OE1-CE 3.49Å; E689-K695 IonicContact OE1-NZ 3.76Å; K695-F774 WeakPolarHBondContact O-CD2 3.27Å; K695-F774 WeakPolarHBondContact O-CE2 3.42Å
696	K	89.4	Confident	86.3	Confident	39 Å²	39	52.7 Å²	52.7	17%	0.17	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	156	175.7	-60.4	-66.5	177.2	176.2	0	110.2	A688 F690 H771	A688-K696 PolarHBondContact N-O 3.17Å; A688-K696 PolarHBondContact O-N 3.49Å; F690-K696 HydrophobicContact CD2-CB 4.48Å; F690-K696 HydrophobicContact CD2-CG 4.17Å; F690-K696 HydrophobicContact CE2-CB 4.19Å; F690-K696 HydrophobicContact CE2-CG 4.24Å; K696-H771 PolarHBondContact NZ-O 2.79Å
697	E	91.8	Very high	86.4	Confident	46 Å²	46	51.1 Å²	51.1	22%	0.215	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.2	171.5	-74.2	-173.9	171.6	0	0	110.5	V685 L686 K687 F774 R775 I776	V685-E697 HydrophobicContact CG1-CB 4.05Å; V685-E697 HydrophobicContact CG1-CG 4.3Å; L686-E697 CarbonylContact O-C 3.53Å; L686-E697 VanDerWaalsContact O-CA 3.31Å; L686-E697 WeakPolarHBondContact O-CA 3.48Å; K687-E697 HydrophobicContact CG-CG 4.37Å; E697-F774 HydrophobicContact CB-CE1 4.19Å; E697-F774 HydrophobicContact CG-CD1 4.49Å; E697-F774 HydrophobicContact CG-CE1 3.66Å; E697-F774 HydrophobicContact CG-CZ 4.01Å; E697-F774 PolarHBondContact N-O 3.09Å; E697-R775 HydrophobicContact CB-CB 4.39Å; E697-R775 HydrophobicContact CB-CG 4.16Å; E697-R775 CarbonylContact O-C 3.56Å; E697-R775 VanDerWaalsContact O-CA 3.31Å; E697-R775 WeakPolarHBondContact O-CA 3.33Å; E697-I776 PolarHBondContact O-N 3.49Å
698	L	91.4	Very high	86.5	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.3	179.3	-50.3	-176.1	0	0	0	108.9	V685 L686 A688 V700 L708 V747 I776 I778	V685-L698 CarbonylContact C-O 3.59Å; V685-L698 WeakPolarHBondContact CA-O 3.46Å; L686-L698 HydrophobicContact CB-CB 4.45Å; L686-L698 PolarHBondContact N-O 3.38Å; L686-L698 PolarHBondContact O-N 3.23Å; A688-L698 HydrophobicContact CB-CD1 3.9Å; A688-L698 HydrophobicContact CB-CG 4.03Å; L698-V700 HydrophobicContact CB-CG1 3.9Å; L698-V700 PolarHBondContact O-N 2.85Å; L698-L708 HydrophobicContact CD1-CD1 4.31Å; L698-V747 HydrophobicContact CD1-CG1 4.06Å; L698-V747 HydrophobicContact CD1-CG2 4.24Å; L698-I776 HydrophobicContact CD2-CB 4.09Å; L698-I776 HydrophobicContact CD2-CD1 4Å; L698-I776 HydrophobicContact CD2-CG1 4.4Å; L698-I778 HydrophobicContact CB-CD1 4.42Å; L698-I778 HydrophobicContact CD1-CD1 4.32Å; L698-I778 HydrophobicContact CD2-CD1 4Å; L698-I778 HydrophobicContact CG-CD1 4.48Å
699	Q	89.9	Confident	86.7	Confident	32 Å²	32	45.7 Å²	45.7	15%	0.15	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	106.6	167.3	-174.8	179.5	-1.1	0	0	108.7	C684 I776 I778	C684-Q699 WeakPolarHBondContact O-CA 3.19Å; Q699-I776 PolarHBondContact N-O 3.48Å; Q699-I778 PolarHBondContact O-N 3.4Å
700	V	91.1	Very high	87.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	158.2	-169.6	-70.4	0	0	0	0	110.6	H683 C684 L686 L698 Q704 T705 L708 I778	H683-V700 CarbonylContact C-O 3.54Å; H683-V700 VanDerWaalsContact CA-O 3.26Å; H683-V700 WeakPolarHBondContact CA-O 3.34Å; H683-V700 VanDerWaalsContact CB-O 3.31Å; H683-V700 WeakPolarHBondContact CB-O 3.27Å; C684-V700 PolarHBondContact N-O 2.81Å; C684-V700 PolarHBondContact O-N 2.87Å; L686-V700 HydrophobicContact CD1-CG2 3.73Å; L686-V700 HydrophobicContact CG-CG2 3.79Å; L698-V700 HydrophobicContact CB-CG1 3.9Å; L698-V700 PolarHBondContact O-N 2.85Å; V700-Q704 HydrophobicContact CB-CB 3.74Å; V700-Q704 HydrophobicContact CG1-CB 4.26Å; V700-T705 VanDerWaalsContact CG2-OG1 3.32Å; V700-T705 WeakPolarHBondContact CG2-OG1 3.33Å; V700-L708 HydrophobicContact CG1-CD1 4.07Å; V700-I778 HydrophobicContact CG1-CB 4.21Å; V700-I778 HydrophobicContact CG1-CD1 4.45Å
701	S	91.5	Very high	87.6	Confident	6 Å²	6	41 Å²	41	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	166.9	169.3	68.9	0	0	0	0	111.3	G682 F703 Q704 T705 Q782	G682-S701 WeakPolarHBondContact O-CA 3.3Å; S701-F703 VanDerWaalsContact C-N 3.31Å; S701-F703 PolarHBondContact O-N 3.09Å; S701-Q704 PolarHBondContact O-N 2.98Å; S701-Q704 WeakPolarHBondContact OG-CB 3.47Å; S701-Q704 VanDerWaalsContact OG-CG 3.28Å; S701-Q704 WeakPolarHBondContact OG-CG 3.41Å; S701-Q704 PolarHBondContact OG-N 2.81Å; S701-Q704 VanDerWaalsContact OG-N 3.17Å; S701-T705 PolarHBondContact O-N 2.9Å; S701-T705 PolarHBondContact O-OG1 2.87Å; S701-T705 VanDerWaalsContact O-OG1 3.05Å; S701-Q782 PolarHBondContact OG-OE1 3.33Å
702	L	92.1	Very high	88.7	Confident	12 Å²	12	39.1 Å²	39.1	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-42.2	175	-177.3	60.3	0	0	0	111.9	L651 M655 G682 Q704 T705 L706	L651-L702 HydrophobicContact CD2-CD1 4Å; L651-L702 HydrophobicContact CD2-CD2 4.14Å; L651-L702 HydrophobicContact CD2-CG 4.36Å; M655-L702 HydrophobicContact CE-CD1 3.66Å; G682-L702 PolarHBondContact O-N 2.96Å; L702-Q704 PolarHBondContact O-N 3Å; L702-T705 VanDerWaalsContact O-CB 3.29Å; L702-T705 WeakPolarHBondContact O-CB 3.27Å; L702-T705 PolarHBondContact O-N 3.39Å; L702-T705 VanDerWaalsContact O-N 3.1Å; L702-L706 WeakPolarHBondContact O-CG 3.27Å; L702-L706 PolarHBondContact O-N 2.91Å
703	F	93.2	Very high	89.9	Confident	5 Å²	5	40.7 Å²	40.7	2%	0.022	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-44.1	176.7	-58.6	-32.9	0	0	0	112.1	M647 V649 T680 S701 T705 L706 V707 I728 E732 T736	M647-F703 HydrophobicContact CE-CZ 4.21Å; M647-F703 HydrophobicContact SD-CE1 3.72Å; M647-F703 HydrophobicContact SD-CE2 4.21Å; M647-F703 HydrophobicContact SD-CZ 3.45Å; M647-F703 WeakPolarHBondContact SD-CZ 3.5Å; V649-F703 HydrophobicContact CG1-CD1 4.14Å; V649-F703 HydrophobicContact CG1-CE1 3.74Å; T680-F703 HydrophobicContact CG2-CE2 4.05Å; T680-F703 HydrophobicContact CG2-CZ 3.73Å; S701-F703 VanDerWaalsContact C-N 3.31Å; S701-F703 PolarHBondContact O-N 3.09Å; F703-T705 VanDerWaalsContact C-N 3.29Å; F703-T705 PolarHBondContact O-N 3.22Å; F703-L706 PolarHBondContact O-N 3.05Å; F703-V707 WeakPolarHBondContact O-CG2 3.37Å; F703-V707 PolarHBondContact O-N 2.99Å; F703-I728 HydrophobicContact CB-CD1 3.88Å; F703-I728 HydrophobicContact CD1-CD1 4.21Å; F703-I728 HydrophobicContact CD1-CG1 4.14Å; F703-I728 HydrophobicContact CG-CD1 4.33Å; F703-E732 HydrophobicContact CD2-CG 3.62Å; F703-E732 HydrophobicContact CE2-CG 3.6Å; F703-T736 HydrophobicContact CB-CG2 4Å
704	Q	93.3	Very high	91.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-37.5	174	-72.1	174.1	-26.4	0	0	111.8	V700 S701 L702 L708 T736 S739 L740 I778	V700-Q704 HydrophobicContact CB-CB 3.74Å; V700-Q704 HydrophobicContact CG1-CB 4.26Å; S701-Q704 PolarHBondContact O-N 2.98Å; S701-Q704 WeakPolarHBondContact OG-CB 3.47Å; S701-Q704 VanDerWaalsContact OG-CG 3.28Å; S701-Q704 WeakPolarHBondContact OG-CG 3.41Å; S701-Q704 PolarHBondContact OG-N 2.81Å; S701-Q704 VanDerWaalsContact OG-N 3.17Å; L702-Q704 PolarHBondContact O-N 3Å; Q704-L708 WeakPolarHBondContact O-CB 3.35Å; Q704-L708 VanDerWaalsContact O-CG 3.26Å; Q704-L708 WeakPolarHBondContact O-CG 3.35Å; Q704-L708 PolarHBondContact O-N 3.06Å; Q704-T736 HydrophobicContact CB-CG2 4.38Å; Q704-T736 HydrophobicContact CG-CG2 3.77Å; Q704-S739 PolarHBondContact NE2-OG 3.36Å; Q704-L740 HydrophobicContact CB-CD1 4.34Å; Q704-L740 HydrophobicContact CB-CD2 4.2Å; Q704-L740 HydrophobicContact CG-CD1 4.24Å; Q704-L740 HydrophobicContact CG-CD2 4.02Å; Q704-L740 HydrophobicContact CG-CG 4.12Å; Q704-I778 PolarHBondContact NE2-O 2.85Å
705	T	94.3	Very high	91.7	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-48.9	176.1	-63	0	0	0	0	112	C684 L686 V700 S701 L702 F703 V707 L708 L709	C684-T705 HydrophobicContact CB-CG2 4.45Å; C684-T705 WeakPolarHBondContact CB-OG1 3.33Å; L686-T705 HydrophobicContact CD1-CG2 4.26Å; L686-T705 HydrophobicContact CD2-CG2 3.86Å; L686-T705 HydrophobicContact CG-CG2 4.5Å; V700-T705 VanDerWaalsContact CG2-OG1 3.32Å; V700-T705 WeakPolarHBondContact CG2-OG1 3.33Å; S701-T705 PolarHBondContact O-N 2.9Å; S701-T705 PolarHBondContact O-OG1 2.87Å; S701-T705 VanDerWaalsContact O-OG1 3.05Å; L702-T705 VanDerWaalsContact O-CB 3.29Å; L702-T705 WeakPolarHBondContact O-CB 3.27Å; L702-T705 PolarHBondContact O-N 3.39Å; L702-T705 VanDerWaalsContact O-N 3.1Å; F703-T705 VanDerWaalsContact C-N 3.29Å; F703-T705 PolarHBondContact O-N 3.22Å; T705-V707 VanDerWaalsContact C-N 3.32Å; T705-V707 PolarHBondContact O-N 3.05Å; T705-L708 PolarHBondContact O-N 2.73Å; T705-L709 HydrophobicContact CG2-CD1 3.72Å; T705-L709 HydrophobicContact CG2-CG 4.12Å; T705-L709 WeakPolarHBondContact O-CB 3.34Å; T705-L709 VanDerWaalsContact O-CG 3.28Å; T705-L709 WeakPolarHBondContact O-CG 3.45Å; T705-L709 PolarHBondContact O-N 2.99Å
706	L	94.9	Very high	92	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-44.7	-178.9	-62.6	-179.1	0	0	0	111.4	V649 H650 L651 P652 L702 F703 L709 T726	V649-L706 HydrophobicContact CB-CD1 3.79Å; V649-L706 HydrophobicContact CG1-CD1 4.41Å; V649-L706 HydrophobicContact CG2-CD1 3.98Å; H650-L706 WeakPolarHBondContact O-CD2 3.16Å; L651-L706 HydrophobicContact CD2-CD1 4.43Å; L651-L706 HydrophobicContact CD2-CD2 4.13Å; P652-L706 HydrophobicContact CG-CD2 4.38Å; L702-L706 WeakPolarHBondContact O-CG 3.27Å; L702-L706 PolarHBondContact O-N 2.91Å; F703-L706 PolarHBondContact O-N 3.05Å; L706-L709 PolarHBondContact O-N 3.05Å; L706-T726 HydrophobicContact CB-CG2 3.94Å
707	V	95.2	Very high	92.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-47.2	176.4	175.4	0	0	0	0	111.5	F703 T705 L709 M710 F711 I722 T726 I728 L733 T736 L737 L740 L748	F703-V707 WeakPolarHBondContact O-CG2 3.37Å; F703-V707 PolarHBondContact O-N 2.99Å; T705-V707 VanDerWaalsContact C-N 3.32Å; T705-V707 PolarHBondContact O-N 3.05Å; V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 2.74Å; V707-M710 WeakPolarHBondContact O-CB 3.45Å; V707-M710 PolarHBondContact O-N 2.66Å; V707-F711 HydrophobicContact CG1-CE2 4.32Å; V707-F711 WeakPolarHBondContact O-CD2 3.08Å; V707-I722 HydrophobicContact CG1-CG2 4.23Å; V707-I722 HydrophobicContact CG2-CG2 3.82Å; V707-T726 HydrophobicContact CG2-CG2 4.28Å; V707-I728 HydrophobicContact CG2-CD1 4.23Å; V707-L733 HydrophobicContact CG2-CD1 4.1Å; V707-T736 HydrophobicContact CG2-CG2 4.23Å; V707-L737 HydrophobicContact CG1-CD2 3.77Å; V707-L740 HydrophobicContact CB-CD1 4.21Å; V707-L740 HydrophobicContact CG1-CD1 3.96Å; V707-L748 HydrophobicContact CG1-CD1 4.15Å
708	L	94.6	Very high	92.5	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-68.2	-32.5	-176.8	-72.1	171.9	0	0	0	112.9	L686 L698 V700 Q704 T705 M710 F711 L740 V747 L748	L686-L708 HydrophobicContact CD1-CB 4.06Å; L686-L708 HydrophobicContact CD1-CD1 3.9Å; L698-L708 HydrophobicContact CD1-CD1 4.31Å; V700-L708 HydrophobicContact CG1-CD1 4.07Å; Q704-L708 WeakPolarHBondContact O-CB 3.35Å; Q704-L708 VanDerWaalsContact O-CG 3.26Å; Q704-L708 WeakPolarHBondContact O-CG 3.35Å; Q704-L708 PolarHBondContact O-N 3.06Å; T705-L708 PolarHBondContact O-N 2.73Å; L708-M710 VanDerWaalsContact C-N 3.26Å; L708-M710 PolarHBondContact O-N 3.46Å; L708-F711 PolarHBondContact O-N 2.76Å; L708-L740 HydrophobicContact CD1-CD2 4.05Å; L708-L740 HydrophobicContact CD2-CD1 4.43Å; L708-L740 HydrophobicContact CD2-CD2 4.36Å; L708-L740 HydrophobicContact CG-CD1 4.28Å; L708-L740 HydrophobicContact CG-CD2 4.31Å; L708-V747 HydrophobicContact CD2-CG1 3.95Å; L708-L748 HydrophobicContact CD2-CD1 4.49Å; L708-L748 HydrophobicContact CD2-CD2 4.08Å; L708-L748 HydrophobicContact CD2-CG 4.25Å
709	L	94.1	Very high	92.6	Very high	61 Å²	61	41.6 Å²	41.6	32%	0.319	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-27.7	179.1	-74.7	174.8	0	0	0	112.9	P652 T705 L706 V707 F711 N712	P652-L709 HydrophobicContact CG-CD1 3.8Å; T705-L709 HydrophobicContact CG2-CD1 3.72Å; T705-L709 HydrophobicContact CG2-CG 4.12Å; T705-L709 WeakPolarHBondContact O-CB 3.34Å; T705-L709 VanDerWaalsContact O-CG 3.28Å; T705-L709 WeakPolarHBondContact O-CG 3.45Å; T705-L709 PolarHBondContact O-N 2.99Å; L706-L709 PolarHBondContact O-N 3.05Å; V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 2.74Å; L709-F711 PolarHBondContact O-N 3.33Å; L709-N712 WeakPolarHBondContact O-CB 3.42Å; L709-N712 PolarHBondContact O-N 2.92Å; L709-N712 PolarHBondContact O-ND2 3.31Å; L709-N712 VanDerWaalsContact O-ND2 3.15Å
710	M	94.3	Very high	92.8	Very high	32 Å²	32	45.2 Å²	45.2	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-31.9	175.9	-63.8	179.3	62.7	0	0	112.3	V707 L708 N712 E713 G714 F717 I722 A725 T726	V707-M710 WeakPolarHBondContact O-CB 3.45Å; V707-M710 PolarHBondContact O-N 2.66Å; L708-M710 VanDerWaalsContact C-N 3.26Å; L708-M710 PolarHBondContact O-N 3.46Å; M710-N712 PolarHBondContact O-N 3.19Å; M710-E713 PolarHBondContact O-N 3.42Å; M710-G714 PolarHBondContact O-N 2.9Å; M710-F717 HydrophobicContact CB-CD2 4.33Å; M710-F717 HydrophobicContact CB-CE2 3.81Å; M710-F717 HydrophobicContact CB-CZ 4.12Å; M710-F717 HydrophobicContact CE-CD1 3.95Å; M710-F717 HydrophobicContact CE-CD2 4.34Å; M710-F717 HydrophobicContact CE-CE1 4.06Å; M710-F717 HydrophobicContact CE-CE2 4.46Å; M710-F717 HydrophobicContact CE-CG 4.09Å; M710-F717 HydrophobicContact CE-CZ 4.31Å; M710-F717 WeakPolarHBondContact O-CE2 3.41Å; M710-F717 WeakPolarHBondContact O-CZ 3.45Å; M710-I722 HydrophobicContact CE-CG1 4.26Å; M710-I722 HydrophobicContact SD-CB 4.37Å; M710-I722 HydrophobicContact SD-CG1 4.28Å; M710-I722 HydrophobicContact SD-CG2 4.12Å; M710-A725 HydrophobicContact CE-CB 3.39Å; M710-A725 HydrophobicContact SD-CB 3.76Å; M710-T726 HydrophobicContact SD-CG2 3.69Å
711	F	93.4	Very high	92.9	Very high	29 Å²	29	50 Å²	50	13%	0.127	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	1	-178.8	-67.5	-84.3	0	0	0	114.2	V707 L708 L709 G714 F717 L748 F763 C765	V707-F711 HydrophobicContact CG1-CE2 4.32Å; V707-F711 WeakPolarHBondContact O-CD2 3.08Å; L708-F711 PolarHBondContact O-N 2.76Å; L709-F711 PolarHBondContact O-N 3.33Å; F711-G714 CarbonylContact C-O 3.54Å; F711-G714 VanDerWaalsContact CA-O 3.31Å; F711-G714 WeakPolarHBondContact CA-O 3.41Å; F711-F717 HydrophobicContact CD1-CD2 4.03Å; F711-F717 HydrophobicContact CD1-CE2 4.02Å; F711-F717 AromaticContact CE1-CD2 3.64Å; F711-F717 HydrophobicContact CE1-CD2 3.64Å; F711-F717 HydrophobicContact CE1-CE2 4.11Å; F711-F717 HydrophobicContact CE2-CD2 4.25Å; F711-F717 HydrophobicContact CG-CD2 4.49Å; F711-F717 HydrophobicContact CG-CE2 4.3Å; F711-F717 AromaticContact CZ-CD2 3.77Å; F711-F717 HydrophobicContact CZ-CD2 3.77Å; F711-F717 HydrophobicContact CZ-CE2 4.49Å; F711-L748 HydrophobicContact CD2-CD2 4.01Å; F711-L748 HydrophobicContact CE1-CD2 4.4Å; F711-L748 HydrophobicContact CE2-CD1 3.97Å; F711-L748 HydrophobicContact CE2-CD2 3.69Å; F711-L748 HydrophobicContact CG-CD2 4.49Å; F711-L748 HydrophobicContact CZ-CD1 4.33Å; F711-L748 HydrophobicContact CZ-CD2 3.9Å; F711-F763 WeakPolarHBondContact CE1-O 3.39Å; F711-F763 HydrophobicContact CZ-CB 4.14Å; F711-C765 HydrophobicContact CD1-CB 4.43Å
712	N	91.8	Very high	93.1	Very high	128 Å²	128	49.8 Å²	49.8	68%	0.684	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-24.6	168.3	-65.5	-47.1	0	0	0	112.2	L709 M710	L709-N712 WeakPolarHBondContact O-CB 3.42Å; L709-N712 PolarHBondContact O-N 2.92Å; L709-N712 PolarHBondContact O-ND2 3.31Å; L709-N712 VanDerWaalsContact O-ND2 3.15Å; M710-N712 PolarHBondContact O-N 3.19Å
713	E	89.6	Confident	93.2	Very high	194 Å²	194	52.1 Å²	52.1	91%	0.907	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-4.7	-175	-64.3	-179.1	-171.2	0	0	113.1	M710	M710-E713 PolarHBondContact O-N 3.42Å
714	G	87.7	Confident	93.3	Very high	21 Å²	21	56.6 Å²	56.6	22%	0.216	28%	0.284	C	S	.	.			trans	-153.1	160.5	176	0	0	0	0	0	113.3	M710 F711	M710-G714 PolarHBondContact O-N 2.9Å; F711-G714 CarbonylContact C-O 3.54Å; F711-G714 VanDerWaalsContact CA-O 3.31Å; F711-G714 WeakPolarHBondContact CA-O 3.41Å
715	E	85.8	Confident	93.3	Very high	166 Å²	166	58.7 Å²	58.7	78%	0.776	30%	0.302	S	S	*	.	S	Bend	trans	-99	-35.2	-172	-62.3	-172.5	161.9	0	0	113.8	S764	E715-S764 WeakPolarHBondContact O-CA 3.42Å
716	E	93.1	Very high	93.3	Very high	84 Å²	84	58.8 Å²	58.8	39%	0.393	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	135.1	-176.6	-177.6	177.1	86.5	0	0	110.1	K762 F763	E716-K762 VanDerWaalsContact CD-CD 3.45Å; E716-K762 HydrophobicContact CG-CB 4.14Å; E716-K762 HydrophobicContact CG-CD 4.07Å; E716-K762 WeakPolarHBondContact OE1-CD 3.36Å; E716-K762 IonicContact OE1-NZ 3.73Å; E716-K762 PolarHBondContact OE1-NZ 2.97Å; E716-F763 WeakPolarHBondContact CA-O 3.34Å
717	F	95.6	Very high	93.2	Very high	36 Å²	36	59.7 Å²	59.7	16%	0.158	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.2	175.7	-58.6	-77.6	0	0	0	111.2	M710 F711 E721 I722 K762 F763	M710-F717 HydrophobicContact CB-CD2 4.33Å; M710-F717 HydrophobicContact CB-CE2 3.81Å; M710-F717 HydrophobicContact CB-CZ 4.12Å; M710-F717 HydrophobicContact CE-CD1 3.95Å; M710-F717 HydrophobicContact CE-CD2 4.34Å; M710-F717 HydrophobicContact CE-CE1 4.06Å; M710-F717 HydrophobicContact CE-CE2 4.46Å; M710-F717 HydrophobicContact CE-CG 4.09Å; M710-F717 HydrophobicContact CE-CZ 4.31Å; M710-F717 WeakPolarHBondContact O-CE2 3.41Å; M710-F717 WeakPolarHBondContact O-CZ 3.45Å; F711-F717 HydrophobicContact CD1-CD2 4.03Å; F711-F717 HydrophobicContact CD1-CE2 4.02Å; F711-F717 AromaticContact CE1-CD2 3.64Å; F711-F717 HydrophobicContact CE1-CD2 3.64Å; F711-F717 HydrophobicContact CE1-CE2 4.11Å; F711-F717 HydrophobicContact CE2-CD2 4.25Å; F711-F717 HydrophobicContact CG-CD2 4.49Å; F711-F717 HydrophobicContact CG-CE2 4.3Å; F711-F717 AromaticContact CZ-CD2 3.77Å; F711-F717 HydrophobicContact CZ-CD2 3.77Å; F711-F717 HydrophobicContact CZ-CE2 4.49Å; F717-E721 HydrophobicContact CB-CB 4.5Å; F717-I722 HydrophobicContact CB-CD1 4Å; F717-I722 HydrophobicContact CB-CG1 3.63Å; F717-I722 HydrophobicContact CG-CG1 4.44Å; F717-K762 CarbonylContact O-C 3.55Å; F717-K762 WeakPolarHBondContact O-CA 3.31Å; F717-F763 PolarHBondContact N-O 3.49Å; F717-F763 PolarHBondContact O-N 3.28Å
718	T	94.9	Very high	93.2	Very high	32 Å²	32	59.8 Å²	59.8	20%	0.196	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	160.3	168.7	61.2	0	0	0	0	111.3	E720 E721 I722 D761 K762	T718-E720 PolarHBondContact O-N 3.31Å; T718-E721 WeakPolarHBondContact CB-OE2 3.37Å; T718-E721 PolarHBondContact N-OE2 3.47Å; T718-E721 PolarHBondContact O-N 3.46Å; T718-E721 VanDerWaalsContact OG1-CG 3.23Å; T718-E721 WeakPolarHBondContact OG1-CG 3.46Å; T718-E721 PolarHBondContact OG1-N 2.95Å; T718-E721 PolarHBondContact OG1-OE2 2.87Å; T718-I722 WeakPolarHBondContact O-CG1 3.38Å; T718-I722 PolarHBondContact O-N 3.32Å; T718-I722 VanDerWaalsContact O-N 3.11Å; T718-D761 CarbonylContact C-O 3.59Å; T718-D761 WeakPolarHBondContact CA-O 3.26Å; T718-K762 HydrophobicContact CG2-CD 4.46Å; T718-K762 HydrophobicContact CG2-CG 4Å
719	L	93.9	Very high	93.1	Very high	3 Å²	3	64 Å²	64	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-51.2	-42.4	173.5	178.3	64	0	0	0	112.7	I722 K723 L733 L737 V757 D761 F763	L719-I722 PolarHBondContact O-N 3.07Å; L719-K723 WeakPolarHBondContact O-CB 3.49Å; L719-K723 PolarHBondContact O-N 2.96Å; L719-L733 HydrophobicContact CD1-CD2 3.8Å; L719-L733 HydrophobicContact CD1-CG 4.02Å; L719-L737 HydrophobicContact CD1-CD1 3.36Å; L719-V757 HydrophobicContact CD1-CG1 4.04Å; L719-V757 HydrophobicContact CD2-CG1 4.2Å; L719-D761 PolarHBondContact N-O 3.16Å; L719-F763 HydrophobicContact CB-CE2 4.47Å
720	E	93.6	Very high	92.9	Very high	109 Å²	109	63.4 Å²	63.4	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-69.9	-41.2	-177.1	-169.6	59.6	-153.2	0	0	112	T718 I722 K723 V724	T718-E720 PolarHBondContact O-N 3.31Å; E720-I722 VanDerWaalsContact C-N 3.33Å; E720-I722 PolarHBondContact O-N 3.2Å; E720-K723 WeakPolarHBondContact O-CB 3.29Å; E720-K723 PolarHBondContact O-N 3.46Å; E720-V724 WeakPolarHBondContact O-CG2 3.48Å; E720-V724 PolarHBondContact O-N 3.36Å
721	E	94.3	Very high	92.7	Very high	101 Å²	101	66 Å²	66	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-41.5	175.6	-72.4	162.5	151	0	0	111.5	F717 T718 K723 A725	F717-E721 HydrophobicContact CB-CB 4.5Å; T718-E721 WeakPolarHBondContact CB-OE2 3.37Å; T718-E721 PolarHBondContact N-OE2 3.47Å; T718-E721 PolarHBondContact O-N 3.46Å; T718-E721 VanDerWaalsContact OG1-CG 3.23Å; T718-E721 WeakPolarHBondContact OG1-CG 3.46Å; T718-E721 PolarHBondContact OG1-N 2.95Å; T718-E721 PolarHBondContact OG1-OE2 2.87Å; E721-K723 VanDerWaalsContact C-N 3.35Å; E721-A725 VanDerWaalsContact O-CB 3.29Å; E721-A725 WeakPolarHBondContact O-CB 3.21Å; E721-A725 PolarHBondContact O-N 3.3Å
722	I	95.1	Very high	92.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-41.7	176.1	-62.1	171.3	0	0	0	110.7	V707 M710 F717 T718 L719 E720 A725 T726 L733 L737 F763	V707-I722 HydrophobicContact CG1-CG2 4.23Å; V707-I722 HydrophobicContact CG2-CG2 3.82Å; M710-I722 HydrophobicContact CE-CG1 4.26Å; M710-I722 HydrophobicContact SD-CB 4.37Å; M710-I722 HydrophobicContact SD-CG1 4.28Å; M710-I722 HydrophobicContact SD-CG2 4.12Å; F717-I722 HydrophobicContact CB-CD1 4Å; F717-I722 HydrophobicContact CB-CG1 3.63Å; F717-I722 HydrophobicContact CG-CG1 4.44Å; T718-I722 WeakPolarHBondContact O-CG1 3.38Å; T718-I722 PolarHBondContact O-N 3.32Å; T718-I722 VanDerWaalsContact O-N 3.11Å; L719-I722 PolarHBondContact O-N 3.07Å; E720-I722 VanDerWaalsContact C-N 3.33Å; E720-I722 PolarHBondContact O-N 3.2Å; I722-A725 PolarHBondContact O-N 3.43Å; I722-T726 HydrophobicContact CG2-CG2 4.17Å; I722-T726 WeakPolarHBondContact O-CB 3.43Å; I722-T726 WeakPolarHBondContact O-CG2 3.37Å; I722-T726 PolarHBondContact O-N 3.37Å; I722-T726 PolarHBondContact O-OG1 2.8Å; I722-L733 HydrophobicContact CG2-CD1 3.81Å; I722-L733 HydrophobicContact CG2-CD2 4.47Å; I722-L737 HydrophobicContact CD1-CD1 4.41Å; I722-L737 HydrophobicContact CD1-CD2 3.97Å; I722-F763 HydrophobicContact CD1-CB 4.23Å; I722-F763 HydrophobicContact CD1-CD2 3.9Å; I722-F763 HydrophobicContact CD1-CG 4.3Å
723	K	94.8	Very high	92.5	Very high	62 Å²	62	60 Å²	60	27%	0.27	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-49.5	178.8	-174.6	178.2	-179.4	173.1	0	111.9	L719 E720 E721 G727 D730 L733	L719-K723 WeakPolarHBondContact O-CB 3.49Å; L719-K723 PolarHBondContact O-N 2.96Å; E720-K723 WeakPolarHBondContact O-CB 3.29Å; E720-K723 PolarHBondContact O-N 3.46Å; E721-K723 VanDerWaalsContact C-N 3.35Å; K723-G727 WeakPolarHBondContact O-CA 3.26Å; K723-G727 PolarHBondContact O-N 2.89Å; K723-D730 IonicContact NZ-OD1 2.57Å; K723-D730 PolarHBondContact NZ-OD1 3.42Å; K723-L733 HydrophobicContact CB-CD2 3.57Å; K723-L733 HydrophobicContact CG-CD2 4.08Å
724	V	94.5	Very high	92.6	Very high	98 Å²	98	53.4 Å²	53.4	59%	0.594	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-45.2	178.8	173.5	0	0	0	0	111.1	H650 E720	H650-V724 PolarHBondContact ND1-O 3.19Å; E720-V724 WeakPolarHBondContact O-CG2 3.48Å; E720-V724 PolarHBondContact O-N 3.36Å
725	A	93.5	Very high	92.6	Very high	45 Å²	45	54.5 Å²	54.5	37%	0.372	29%	0.285	S	S	.	.	H	α-helix	trans	-66.6	-42.3	-177.6	0	0	0	0	0	112.7	H650 M710 E721 I722	H650-A725 WeakPolarHBondContact CB-O 3.48Å; H650-A725 PolarHBondContact ND1-O 2.99Å; M710-A725 HydrophobicContact CE-CB 3.39Å; M710-A725 HydrophobicContact SD-CB 3.76Å; E721-A725 VanDerWaalsContact O-CB 3.29Å; E721-A725 WeakPolarHBondContact O-CB 3.21Å; E721-A725 PolarHBondContact O-N 3.3Å; I722-A725 PolarHBondContact O-N 3.43Å
726	T	94	Very high	92.9	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-91.1	-23.6	-174.1	62.5	0	0	0	0	114.2	H650 L706 V707 M710 I722 I728	H650-T726 PolarHBondContact N-O 2.8Å; L706-T726 HydrophobicContact CB-CG2 3.94Å; V707-T726 HydrophobicContact CG2-CG2 4.28Å; M710-T726 HydrophobicContact SD-CG2 3.69Å; I722-T726 HydrophobicContact CG2-CG2 4.17Å; I722-T726 WeakPolarHBondContact O-CB 3.43Å; I722-T726 WeakPolarHBondContact O-CG2 3.37Å; I722-T726 PolarHBondContact O-N 3.37Å; I722-T726 PolarHBondContact O-OG1 2.8Å; T726-I728 HydrophobicContact CG2-CD1 4.37Å; T726-I728 PolarHBondContact O-N 3.47Å; T726-I728 WeakPolarHBondContact OG1-CD1 3.42Å; T726-I728 WeakPolarHBondContact OG1-CG1 3.47Å
727	G	94.1	Very high	92.8	Very high	28 Å²	28	42.6 Å²	42.6	29%	0.289	23%	0.229	S	C	.	.			trans	72.1	12.2	-175.5	0	0	0	0	0	114.4	K723	K723-G727 WeakPolarHBondContact O-CA 3.26Å; K723-G727 PolarHBondContact O-N 2.89Å
728	I	94.1	Very high	92.6	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	23%	0.234	C	C	.	.			trans	-76.1	136.1	-177.8	-58.1	164.9	0	0	0	109.9	M647 V649 F703 V707 T726 E732 L733	M647-I728 HydrophobicContact SD-CG2 4.28Å; V649-I728 HydrophobicContact CG1-CG1 4.12Å; F703-I728 HydrophobicContact CB-CD1 3.88Å; F703-I728 HydrophobicContact CD1-CD1 4.21Å; F703-I728 HydrophobicContact CD1-CG1 4.14Å; F703-I728 HydrophobicContact CG-CD1 4.33Å; V707-I728 HydrophobicContact CG2-CD1 4.23Å; T726-I728 HydrophobicContact CG2-CD1 4.37Å; T726-I728 PolarHBondContact O-N 3.47Å; T726-I728 WeakPolarHBondContact OG1-CD1 3.42Å; T726-I728 WeakPolarHBondContact OG1-CG1 3.47Å; I728-E732 HydrophobicContact CG2-CB 4.21Å; I728-E732 HydrophobicContact CG2-CG 4.43Å; I728-L733 HydrophobicContact CB-CB 4.2Å; I728-L733 HydrophobicContact CB-CD1 4.4Å; I728-L733 HydrophobicContact CD1-CD1 4.27Å; I728-L733 HydrophobicContact CG2-CB 3.85Å
729	E	92.3	Very high	92.3	Very high	110 Å²	110	42.2 Å²	42.2	51%	0.514	23%	0.226	S	C	.	.			trans	-58.3	144.4	174.5	-68.3	-176.3	173.3	0	0	112.3	M647 S731 E732 L733	M647-E729 HydrophobicContact CE-CB 4.18Å; M647-E729 HydrophobicContact CE-CG 4.13Å; M647-E729 HydrophobicContact CG-CG 4.48Å; M647-E729 HydrophobicContact SD-CG 4.47Å; E729-S731 VanDerWaalsContact C-N 3.34Å; E729-S731 PolarHBondContact O-N 3.27Å; E729-E732 PolarHBondContact O-N 3.47Å; E729-L733 WeakPolarHBondContact O-CB 3.31Å; E729-L733 PolarHBondContact O-N 3.36Å
730	D	91.1	Very high	92.1	Very high	48 Å²	48	42.1 Å²	42.1	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-53.6	-46.3	-170.8	-161.5	86.1	0	0	0	113.7	K723 L733 R734	K723-D730 IonicContact NZ-OD1 2.57Å; K723-D730 PolarHBondContact NZ-OD1 3.42Å; D730-L733 PolarHBondContact O-N 2.99Å; D730-R734 WeakPolarHBondContact O-CG 3.49Å; D730-R734 PolarHBondContact O-N 3.38Å; D730-R734 IonicContact OD1-NH2 3.17Å; D730-R734 PolarHBondContact OD1-NH2 2.69Å; D730-R734 IonicContact OD2-CZ 3.17Å; D730-R734 VanDerWaalsContact OD2-CZ 3.28Å; D730-R734 IonicContact OD2-NE 3.54Å; D730-R734 PolarHBondContact OD2-NE 2.95Å; D730-R734 IonicContact OD2-NH2 2.75Å; D730-R734 PolarHBondContact OD2-NH2 3.44Å
731	S	88.6	Confident	91.9	Very high	87 Å²	87	37.3 Å²	37.3	61%	0.608	20%	0.204	S	C	*	.	H	α-helix	trans	-62.9	-44.8	-178.8	56.3	0	0	0	0	112.5	E729 R735	E729-S731 VanDerWaalsContact C-N 3.34Å; E729-S731 PolarHBondContact O-N 3.27Å; S731-R735 PolarHBondContact O-N 3.09Å
732	E	89	Confident	91.4	Very high	30 Å²	30	33.9 Å²	33.9	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-76.5	-32.3	178.7	-171.5	58.7	-147	0	0	111.5	M647 F703 I728 E729 R735 T736 Q782	M647-E732 HydrophobicContact CE-CB 4.18Å; M647-E732 HydrophobicContact CE-CG 4.42Å; F703-E732 HydrophobicContact CD2-CG 3.62Å; F703-E732 HydrophobicContact CE2-CG 3.6Å; I728-E732 HydrophobicContact CG2-CB 4.21Å; I728-E732 HydrophobicContact CG2-CG 4.43Å; E729-E732 PolarHBondContact O-N 3.47Å; E732-R735 PolarHBondContact O-N 3.11Å; E732-R735 IonicContact OE1-CZ 2.6Å; E732-R735 IonicContact OE1-NE 2.96Å; E732-R735 PolarHBondContact OE1-NE 3.38Å; E732-R735 IonicContact OE1-NH2 2.66Å; E732-R735 PolarHBondContact OE1-NH2 2.93Å; E732-R735 IonicContact OE2-CZ 2.66Å; E732-R735 VanDerWaalsContact OE2-CZ 3.28Å; E732-R735 IonicContact OE2-NE 2.66Å; E732-R735 PolarHBondContact OE2-NE 3.41Å; E732-R735 IonicContact OE2-NH2 2.9Å; E732-R735 PolarHBondContact OE2-NH2 2.84Å; E732-R735 VanDerWaalsContact OE2-NH2 3.08Å; E732-T736 VanDerWaalsContact O-CB 3.32Å; E732-T736 WeakPolarHBondContact O-CB 3.47Å; E732-T736 PolarHBondContact O-N 2.97Å; E732-T736 PolarHBondContact O-OG1 3.47Å; E732-Q782 PolarHBondContact OE1-NE2 3.02Å
733	L	92.6	Very high	90.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.2	-47.3	176.1	179.4	59	0	0	0	111.2	V707 L719 I722 K723 I728 E729 D730 R735 T736 L737	V707-L733 HydrophobicContact CG2-CD1 4.1Å; L719-L733 HydrophobicContact CD1-CD2 3.8Å; L719-L733 HydrophobicContact CD1-CG 4.02Å; I722-L733 HydrophobicContact CG2-CD1 3.81Å; I722-L733 HydrophobicContact CG2-CD2 4.47Å; K723-L733 HydrophobicContact CB-CD2 3.57Å; K723-L733 HydrophobicContact CG-CD2 4.08Å; I728-L733 HydrophobicContact CB-CB 4.2Å; I728-L733 HydrophobicContact CB-CD1 4.4Å; I728-L733 HydrophobicContact CD1-CD1 4.27Å; I728-L733 HydrophobicContact CG2-CB 3.85Å; E729-L733 WeakPolarHBondContact O-CB 3.31Å; E729-L733 PolarHBondContact O-N 3.36Å; D730-L733 PolarHBondContact O-N 2.99Å; L733-R735 VanDerWaalsContact C-N 3.29Å; L733-R735 PolarHBondContact O-N 3.17Å; L733-T736 WeakPolarHBondContact O-CB 3.44Å; L733-T736 PolarHBondContact O-N 3.32Å; L733-T736 VanDerWaalsContact O-N 3.11Å; L733-L737 HydrophobicContact CD1-CD1 3.88Å; L733-L737 HydrophobicContact CD1-CG 4.06Å; L733-L737 HydrophobicContact CG-CD1 3.89Å; L733-L737 HydrophobicContact CG-CG 4.48Å; L733-L737 WeakPolarHBondContact O-CG 3.49Å; L733-L737 PolarHBondContact O-N 2.98Å
734	R	91.9	Very high	89.9	Confident	55 Å²	55	41.4 Å²	41.4	21%	0.208	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-43.7	175.4	-72	-178.6	-161.7	-83.4	-9.2	111.5	D730 L737 Q738 V757 D759	D730-R734 WeakPolarHBondContact O-CG 3.49Å; D730-R734 PolarHBondContact O-N 3.38Å; D730-R734 IonicContact OD1-NH2 3.17Å; D730-R734 PolarHBondContact OD1-NH2 2.69Å; D730-R734 IonicContact OD2-CZ 3.17Å; D730-R734 VanDerWaalsContact OD2-CZ 3.28Å; D730-R734 IonicContact OD2-NE 3.54Å; D730-R734 PolarHBondContact OD2-NE 2.95Å; D730-R734 IonicContact OD2-NH2 2.75Å; D730-R734 PolarHBondContact OD2-NH2 3.44Å; R734-L737 PolarHBondContact O-N 2.88Å; R734-Q738 VanDerWaalsContact O-CB 3.24Å; R734-Q738 WeakPolarHBondContact O-CB 3.28Å; R734-Q738 PolarHBondContact O-N 3.22Å; R734-V757 HydrophobicContact CB-CB 4.27Å; R734-V757 HydrophobicContact CG-CB 4.26Å; R734-V757 HydrophobicContact CG-CG1 4.13Å; R734-V757 PolarHBondContact NH1-O 3.23Å; R734-D759 IonicContact CZ-OD1 3.31Å; R734-D759 IonicContact NH1-OD1 3.36Å; R734-D759 PolarHBondContact NH1-OD1 2.99Å; R734-D759 IonicContact NH2-OD1 3.7Å; R734-D759 PolarHBondContact NH2-OD1 3.46Å
735	R	88.9	Confident	89	Confident	45 Å²	45	37.5 Å²	37.5	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-40.1	176.7	-164.8	177.2	76.7	161.9	3.5	112.2	S731 E732 L733 Q738 S739 I781 Q782	S731-R735 PolarHBondContact O-N 3.09Å; E732-R735 PolarHBondContact O-N 3.11Å; E732-R735 IonicContact OE1-CZ 2.6Å; E732-R735 IonicContact OE1-NE 2.96Å; E732-R735 PolarHBondContact OE1-NE 3.38Å; E732-R735 IonicContact OE1-NH2 2.66Å; E732-R735 PolarHBondContact OE1-NH2 2.93Å; E732-R735 IonicContact OE2-CZ 2.66Å; E732-R735 VanDerWaalsContact OE2-CZ 3.28Å; E732-R735 IonicContact OE2-NE 2.66Å; E732-R735 PolarHBondContact OE2-NE 3.41Å; E732-R735 IonicContact OE2-NH2 2.9Å; E732-R735 PolarHBondContact OE2-NH2 2.84Å; E732-R735 VanDerWaalsContact OE2-NH2 3.08Å; L733-R735 VanDerWaalsContact C-N 3.29Å; L733-R735 PolarHBondContact O-N 3.17Å; R735-Q738 PolarHBondContact O-N 3.25Å; R735-S739 PolarHBondContact O-N 3.45Å; R735-I781 HydrophobicContact CG-CG2 3.78Å; R735-Q782 VanDerWaalsContact NH2-CA 3.35Å; R735-Q782 PolarHBondContact NH2-O 3.38Å
736	T	91	Very high	88.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-50.1	175.8	-61.1	0	0	0	0	110.3	F703 Q704 V707 E732 L733 S739 L740 Q782	F703-T736 HydrophobicContact CB-CG2 4Å; Q704-T736 HydrophobicContact CB-CG2 4.38Å; Q704-T736 HydrophobicContact CG-CG2 3.77Å; V707-T736 HydrophobicContact CG2-CG2 4.23Å; E732-T736 VanDerWaalsContact O-CB 3.32Å; E732-T736 WeakPolarHBondContact O-CB 3.47Å; E732-T736 PolarHBondContact O-N 2.97Å; E732-T736 PolarHBondContact O-OG1 3.47Å; L733-T736 WeakPolarHBondContact O-CB 3.44Å; L733-T736 PolarHBondContact O-N 3.32Å; L733-T736 VanDerWaalsContact O-N 3.11Å; T736-S739 WeakPolarHBondContact O-CB 3.5Å; T736-S739 PolarHBondContact O-N 3.28Å; T736-S739 PolarHBondContact O-OG 3.33Å; T736-L740 HydrophobicContact CG2-CD1 4.4Å; T736-L740 WeakPolarHBondContact O-CG 3.37Å; T736-L740 PolarHBondContact O-N 3.11Å; T736-Q782 PolarHBondContact OG1-NE2 2.97Å
737	L	92.1	Very high	88.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-38.8	178.4	-71.4	168.2	0	0	0	112.7	V707 L719 I722 L733 R734 S739 L740 A741 L748 V757 F763	V707-L737 HydrophobicContact CG1-CD2 3.77Å; L719-L737 HydrophobicContact CD1-CD1 3.36Å; I722-L737 HydrophobicContact CD1-CD1 4.41Å; I722-L737 HydrophobicContact CD1-CD2 3.97Å; L733-L737 HydrophobicContact CD1-CD1 3.88Å; L733-L737 HydrophobicContact CD1-CG 4.06Å; L733-L737 HydrophobicContact CG-CD1 3.89Å; L733-L737 HydrophobicContact CG-CG 4.48Å; L733-L737 WeakPolarHBondContact O-CG 3.49Å; L733-L737 PolarHBondContact O-N 2.98Å; R734-L737 PolarHBondContact O-N 2.88Å; L737-S739 PolarHBondContact O-N 3.17Å; L737-L740 PolarHBondContact O-N 3.03Å; L737-L740 VanDerWaalsContact O-N 3.12Å; L737-A741 WeakPolarHBondContact O-CB 3.19Å; L737-A741 PolarHBondContact O-N 3.4Å; L737-L748 HydrophobicContact CD2-CD1 4.34Å; L737-V757 HydrophobicContact CB-CG2 4.12Å; L737-V757 HydrophobicContact CD1-CG1 4.42Å; L737-F763 HydrophobicContact CB-CE1 3.96Å; L737-F763 HydrophobicContact CB-CZ 3.98Å; L737-F763 HydrophobicContact CD1-CD2 4.31Å; L737-F763 HydrophobicContact CD1-CE2 3.79Å; L737-F763 HydrophobicContact CD1-CZ 3.9Å; L737-F763 HydrophobicContact CD2-CD1 4.09Å; L737-F763 HydrophobicContact CD2-CD2 4.29Å; L737-F763 HydrophobicContact CD2-CE1 4.19Å; L737-F763 HydrophobicContact CD2-CE2 4.41Å; L737-F763 HydrophobicContact CD2-CG 4.15Å; L737-F763 HydrophobicContact CD2-CZ 4.36Å; L737-F763 HydrophobicContact CG-CE1 4.45Å; L737-F763 HydrophobicContact CG-CZ 4.31Å
738	Q	89.7	Confident	88.3	Confident	56 Å²	56	41.1 Å²	41.1	26%	0.262	20%	0.202	S	C	.	.	I	π-helix	trans	-57.5	-39.3	173.7	-168.8	-178.7	46.5	0	0	111	R734 R735 C742 G743 K755 V757	R734-Q738 VanDerWaalsContact O-CB 3.24Å; R734-Q738 WeakPolarHBondContact O-CB 3.28Å; R734-Q738 PolarHBondContact O-N 3.22Å; R735-Q738 PolarHBondContact O-N 3.25Å; Q738-C742 HydrophobicContact CG-CB 3.86Å; Q738-C742 CarbonylContact O-C 3.55Å; Q738-C742 WeakPolarHBondContact O-CA 3.3Å; Q738-C742 WeakPolarHBondContact O-CB 3.39Å; Q738-C742 PolarHBondContact O-N 3.5Å; Q738-G743 PolarHBondContact O-N 2.93Å; Q738-G743 VanDerWaalsContact O-N 3.08Å; Q738-K755 PolarHBondContact NE2-O 3.27Å; Q738-V757 HydrophobicContact CB-CG2 4.28Å
739	S	88.8	Confident	88.1	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.028	21%	0.212	C	C	.	.	I	π-helix	trans	-68.8	-32.3	177.9	78.5	0	0	0	0	114.3	Q704 R735 T736 L737	Q704-S739 PolarHBondContact NE2-OG 3.36Å; R735-S739 PolarHBondContact O-N 3.45Å; T736-S739 WeakPolarHBondContact O-CB 3.5Å; T736-S739 PolarHBondContact O-N 3.28Å; T736-S739 PolarHBondContact O-OG 3.33Å; L737-S739 PolarHBondContact O-N 3.17Å
740	L	90.4	Very high	88.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-84.8	-33.6	-179.3	-66.7	172.7	0	0	0	112.9	Q704 V707 L708 T736 L737 R746 V747 L748 I778	Q704-L740 HydrophobicContact CB-CD1 4.34Å; Q704-L740 HydrophobicContact CB-CD2 4.2Å; Q704-L740 HydrophobicContact CG-CD1 4.24Å; Q704-L740 HydrophobicContact CG-CD2 4.02Å; Q704-L740 HydrophobicContact CG-CG 4.12Å; V707-L740 HydrophobicContact CB-CD1 4.21Å; V707-L740 HydrophobicContact CG1-CD1 3.96Å; L708-L740 HydrophobicContact CD1-CD2 4.05Å; L708-L740 HydrophobicContact CD2-CD1 4.43Å; L708-L740 HydrophobicContact CD2-CD2 4.36Å; L708-L740 HydrophobicContact CG-CD1 4.28Å; L708-L740 HydrophobicContact CG-CD2 4.31Å; T736-L740 HydrophobicContact CG2-CD1 4.4Å; T736-L740 WeakPolarHBondContact O-CG 3.37Å; T736-L740 PolarHBondContact O-N 3.11Å; L737-L740 PolarHBondContact O-N 3.03Å; L737-L740 VanDerWaalsContact O-N 3.12Å; L740-R746 CarbonylContact O-C 3.44Å; L740-R746 WeakPolarHBondContact O-CA 3.35Å; L740-V747 PolarHBondContact O-N 3.42Å; L740-L748 HydrophobicContact CB-CB 4.47Å; L740-L748 HydrophobicContact CB-CD1 3.85Å; L740-L748 HydrophobicContact CB-CG 4.11Å; L740-L748 HydrophobicContact CD1-CD1 3.96Å; L740-L748 PolarHBondContact O-N 2.57Å; L740-L748 VanDerWaalsContact O-N 3.09Å; L740-I778 HydrophobicContact CD2-CG2 4.06Å
741	A	89.2	Confident	88.2	Confident	8 Å²	8	39.3 Å²	39.3	7%	0.066	20%	0.196	C	C	.	.	I	π-helix	trans	-111.1	-37.2	-171.4	0	0	0	0	0	114.8	L737 R746 L748 K750 F763	L737-A741 WeakPolarHBondContact O-CB 3.19Å; L737-A741 PolarHBondContact O-N 3.4Å; A741-R746 WeakPolarHBondContact O-CG 3.33Å; A741-L748 WeakPolarHBondContact CA-O 3.33Å; A741-L748 HydrophobicContact CB-CB 4.04Å; A741-K750 HydrophobicContact CB-CB 4.11Å; A741-F763 HydrophobicContact CB-CD1 4.02Å; A741-F763 HydrophobicContact CB-CE1 3.99Å
742	C	83.8	Confident	88.2	Confident	29 Å²	29	39.2 Å²	39.2	20%	0.196	19%	0.194	C	C	.	.	I	π-helix	trans	-101.3	-13.7	-172.9	-55.7	0	0	0	0	113	Q738 S754	Q738-C742 HydrophobicContact CG-CB 3.86Å; Q738-C742 CarbonylContact O-C 3.55Å; Q738-C742 WeakPolarHBondContact O-CA 3.3Å; Q738-C742 WeakPolarHBondContact O-CB 3.39Å; Q738-C742 PolarHBondContact O-N 3.5Å; C742-S754 PolarHBondContact SG-O 2.95Å; C742-S754 VanDerWaalsContact SG-O 3.42Å
743	G	79.3	Confident	88.1	Confident	18 Å²	18	46.5 Å²	46.5	19%	0.186	23%	0.225	C	C	.	.	S	Bend	trans	-71.8	-167.5	-178	0	0	0	0	0	115.4	Q738 R746	Q738-G743 PolarHBondContact O-N 2.93Å; Q738-G743 VanDerWaalsContact O-N 3.08Å; G743-R746 WeakPolarHBondContact O-CG 3.41Å; G743-R746 PolarHBondContact O-NE 2.8Å
744	K	78.3	Confident	87.9	Confident	203 Å²	203	49.3 Å²	49.3	88%	0.883	24%	0.244	S	C	*	.	S	Bend	trans	-71.5	-41.4	176.1	-68.6	-174.6	178.9	-178.3	0	112.1
745	A	76.4	Confident	87.5	Confident	15 Å²	15	54.9 Å²	54.9	12%	0.124	27%	0.27	C	S	.	.	S	Bend	trans	-98.4	95.7	175	0	0	0	0	0	108.1	V747 F769 I776 I778	A745-V747 PolarHBondContact O-N 3.24Å; A745-F769 HydrophobicContact CB-CE2 4.15Å; A745-F769 HydrophobicContact CB-CZ 4.26Å; A745-I776 HydrophobicContact CB-CG2 4.32Å; A745-I778 HydrophobicContact CB-CD1 4.34Å; A745-I778 HydrophobicContact CB-CG1 4.18Å
746	R	85.8	Confident	87.4	Confident	148 Å²	148	57 Å²	57	56%	0.558	29%	0.285	S	S	*	.			trans	-90.6	79.8	-176	-58.5	-176.8	-177.7	174.7	-4.4	110.4	L740 A741 G743 L748 N766 F769	L740-R746 CarbonylContact O-C 3.44Å; L740-R746 WeakPolarHBondContact O-CA 3.35Å; A741-R746 WeakPolarHBondContact O-CG 3.33Å; G743-R746 WeakPolarHBondContact O-CG 3.41Å; G743-R746 PolarHBondContact O-NE 2.8Å; R746-L748 VanDerWaalsContact C-N 3.29Å; R746-N766 WeakPolarHBondContact O-CB 3.16Å; R746-N766 PolarHBondContact O-ND2 2.67Å; R746-F769 VanDerWaalsContact O-CD2 3.27Å; R746-F769 WeakPolarHBondContact O-CD2 3.49Å
747	V	88.9	Confident	87.3	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	29%	0.287	C	S	.	.			trans	-74.9	-27.2	178.6	178.9	0	0	0	0	110.9	F690 L698 L708 L740 A745 N766 F769 I778	F690-V747 HydrophobicContact CE1-CG1 4.38Å; F690-V747 HydrophobicContact CZ-CG1 4.12Å; L698-V747 HydrophobicContact CD1-CG1 4.06Å; L698-V747 HydrophobicContact CD1-CG2 4.24Å; L708-V747 HydrophobicContact CD2-CG1 3.95Å; L740-V747 PolarHBondContact O-N 3.42Å; A745-V747 PolarHBondContact O-N 3.24Å; V747-N766 VanDerWaalsContact O-CB 3.26Å; V747-N766 WeakPolarHBondContact O-CB 3.3Å; V747-N766 PolarHBondContact O-N 3.02Å; V747-F769 HydrophobicContact CG2-CD2 4.34Å; V747-F769 HydrophobicContact CG2-CE1 4.3Å; V747-F769 HydrophobicContact CG2-CE2 3.98Å; V747-F769 HydrophobicContact CG2-CZ 3.95Å; V747-I778 HydrophobicContact CG2-CD1 3.38Å
748	L	91.9	Very high	87.3	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	156.1	171.6	-60.4	179.9	0	0	0	110.7	V707 L708 F711 L737 L740 A741 R746 S764	V707-L748 HydrophobicContact CG1-CD1 4.15Å; L708-L748 HydrophobicContact CD2-CD1 4.49Å; L708-L748 HydrophobicContact CD2-CD2 4.08Å; L708-L748 HydrophobicContact CD2-CG 4.25Å; F711-L748 HydrophobicContact CD2-CD2 4.01Å; F711-L748 HydrophobicContact CE1-CD2 4.4Å; F711-L748 HydrophobicContact CE2-CD1 3.97Å; F711-L748 HydrophobicContact CE2-CD2 3.69Å; F711-L748 HydrophobicContact CG-CD2 4.49Å; F711-L748 HydrophobicContact CZ-CD1 4.33Å; F711-L748 HydrophobicContact CZ-CD2 3.9Å; L737-L748 HydrophobicContact CD2-CD1 4.34Å; L740-L748 HydrophobicContact CB-CB 4.47Å; L740-L748 HydrophobicContact CB-CD1 3.85Å; L740-L748 HydrophobicContact CB-CG 4.11Å; L740-L748 HydrophobicContact CD1-CD1 3.96Å; L740-L748 PolarHBondContact O-N 2.57Å; L740-L748 VanDerWaalsContact O-N 3.09Å; A741-L748 WeakPolarHBondContact CA-O 3.33Å; A741-L748 HydrophobicContact CB-CB 4.04Å; R746-L748 VanDerWaalsContact C-N 3.29Å; L748-S764 CarbonylContact C-O 3.57Å; L748-S764 WeakPolarHBondContact CA-O 3.46Å
749	T	91.3	Very high	87.2	Confident	36 Å²	36	65.8 Å²	65.8	22%	0.221	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127	170.5	-59	0	0	0	0	108.9	F763 S764	T749-F763 WeakPolarHBondContact O-CA 3.4Å; T749-S764 PolarHBondContact N-O 2.78Å; T749-S764 PolarHBondContact O-N 3.36Å
750	K	93.9	Very high	87.2	Confident	6 Å²	6	68.4 Å²	68.4	3%	0.026	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.6	174.5	-166.7	178.4	90.7	78.5	0	111.1	A741 P752 K753 S754 D756 V757 D761 K762 F763	A741-K750 HydrophobicContact CB-CB 4.11Å; K750-P752 WeakPolarHBondContact CE-O 3.47Å; K750-P752 PolarHBondContact NZ-O 3.31Å; K750-P752 CarbonylContact O-C 3.54Å; K750-K753 VanDerWaalsContact O-CG 3.31Å; K750-K753 WeakPolarHBondContact O-CG 2.98Å; K750-S754 WeakPolarHBondContact CE-OG 3.46Å; K750-S754 PolarHBondContact NZ-OG 2.64Å; K750-D756 WeakPolarHBondContact CE-O 3.31Å; K750-D756 PolarHBondContact NZ-O 3.25Å; K750-D756 VanDerWaalsContact NZ-O 3.16Å; K750-V757 HydrophobicContact CD-CG2 4.25Å; K750-D761 HydrophobicContact CD-CB 4.46Å; K750-D761 WeakPolarHBondContact CD-OD2 3.39Å; K750-D761 HydrophobicContact CG-CB 4.31Å; K750-D761 IonicContact NZ-OD1 3.25Å; K750-D761 PolarHBondContact NZ-OD1 2.8Å; K750-D761 IonicContact NZ-OD2 3.12Å; K750-D761 PolarHBondContact NZ-OD2 2.81Å; K750-K762 CarbonylContact C-O 3.43Å; K750-K762 WeakPolarHBondContact CA-O 3.11Å; K750-F763 HydrophobicContact CB-CD1 4.24Å; K750-F763 HydrophobicContact CB-CE1 3.96Å; K750-F763 HydrophobicContact CD-CE1 3.86Å; K750-F763 HydrophobicContact CD-CZ 3.98Å; K750-F763 HydrophobicContact CG-CD1 4.21Å; K750-F763 HydrophobicContact CG-CE1 3.61Å; K750-F763 HydrophobicContact CG-CZ 3.92Å
751	I	90.7	Very high	87.3	Confident	80 Å²	80	68.7 Å²	68.7	41%	0.41	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	117.1	176.8	-55.7	171.9	0	0	0	108.2	K762	I751-K762 HydrophobicContact CB-CB 4.38Å; I751-K762 PolarHBondContact N-O 3.44Å; I751-K762 PolarHBondContact O-N 3.41Å
752	P	88.1	Confident	87.5	Confident	86 Å²	86	72.1 Å²	72.1	56%	0.558	37%	0.373	S	S	*	.	S	Bend	cis	-68.9	155.9	-5.1	28.6	-36.3	0	0	0	113.7	K750 S754 D761	K750-P752 WeakPolarHBondContact CE-O 3.47Å; K750-P752 PolarHBondContact NZ-O 3.31Å; K750-P752 CarbonylContact O-C 3.54Å; P752-S754 PolarHBondContact O-N 2.86Å; P752-D761 WeakPolarHBondContact CD-OD1 3.41Å
753	K	87	Confident	88.1	Confident	183 Å²	183	70.8 Å²	70.8	80%	0.796	36%	0.364	S	S	*	.			trans	-75.2	112.8	177.8	-69.4	178	-179.1	172.2	0	110.6	K750	K750-K753 VanDerWaalsContact O-CG 3.31Å; K750-K753 WeakPolarHBondContact O-CG 2.98Å
754	S	88.1	Confident	88.7	Confident	59 Å²	59	71.1 Å²	71.1	41%	0.413	36%	0.364	S	S	.	.			trans	-144.1	178.2	169.7	65.2	0	0	0	0	110.2	C742 K750 P752 D756	C742-S754 PolarHBondContact SG-O 2.95Å; C742-S754 VanDerWaalsContact SG-O 3.42Å; K750-S754 WeakPolarHBondContact CE-OG 3.46Å; K750-S754 PolarHBondContact NZ-OG 2.64Å; P752-S754 PolarHBondContact O-N 2.86Å; S754-D756 PolarHBondContact OG-O 3.38Å
755	K	84.6	Confident	89.3	Confident	171 Å²	171	64 Å²	64	74%	0.743	34%	0.338	S	S	*	.	S	Bend	trans	-80.9	-25.5	178.4	-71.8	-176.8	179.4	175.1	0	113.1	Q738	Q738-K755 PolarHBondContact NE2-O 3.27Å
756	D	86.5	Confident	89.9	Confident	89 Å²	89	64.7 Å²	64.7	48%	0.476	34%	0.34	S	S	.	.	S	Bend	trans	-112.5	157.9	-173.8	-55.5	-55.4	0	0	0	110	K750 S754	K750-D756 WeakPolarHBondContact CE-O 3.31Å; K750-D756 PolarHBondContact NZ-O 3.25Å; K750-D756 VanDerWaalsContact NZ-O 3.16Å; S754-D756 PolarHBondContact OG-O 3.38Å
757	V	89.3	Confident	89.7	Confident	9 Å²	9	61.4 Å²	61.4	6%	0.055	33%	0.333	C	S	.	.			trans	-104.4	115.5	-179.1	175.4	0	0	0	0	108.3	L719 R734 L737 Q738 K750 D761 F763	L719-V757 HydrophobicContact CD1-CG1 4.04Å; L719-V757 HydrophobicContact CD2-CG1 4.2Å; R734-V757 HydrophobicContact CB-CB 4.27Å; R734-V757 HydrophobicContact CG-CB 4.26Å; R734-V757 HydrophobicContact CG-CG1 4.13Å; R734-V757 PolarHBondContact NH1-O 3.23Å; L737-V757 HydrophobicContact CB-CG2 4.12Å; L737-V757 HydrophobicContact CD1-CG1 4.42Å; Q738-V757 HydrophobicContact CB-CG2 4.28Å; K750-V757 HydrophobicContact CD-CG2 4.25Å; V757-D761 WeakPolarHBondContact CA-OD2 3.47Å; V757-F763 HydrophobicContact CG1-CE2 4.32Å; V757-F763 HydrophobicContact CG1-CZ 3.73Å; V757-F763 HydrophobicContact CG2-CE1 4.45Å; V757-F763 HydrophobicContact CG2-CZ 4.09Å
758	E	91.6	Very high	89.3	Confident	109 Å²	109	66.3 Å²	66.3	51%	0.509	36%	0.36	S	S	.	.			trans	-110.8	166.2	-175.7	-59.9	-58.9	156.5	0	0	111.4	D761	E758-D761 PolarHBondContact N-OD2 2.98Å; E758-D761 VanDerWaalsContact O-CB 3.31Å; E758-D761 WeakPolarHBondContact O-CB 3.35Å; E758-D761 PolarHBondContact O-N 3.38Å
759	D	88.6	Confident	88.9	Confident	124 Å²	124	66.9 Å²	66.9	66%	0.663	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	136.1	176.4	-63.5	-17.4	0	0	0	111	R734 D761	R734-D759 IonicContact CZ-OD1 3.31Å; R734-D759 IonicContact NH1-OD1 3.36Å; R734-D759 PolarHBondContact NH1-OD1 2.99Å; R734-D759 IonicContact NH2-OD1 3.7Å; R734-D759 PolarHBondContact NH2-OD1 3.46Å; D759-D761 VanDerWaalsContact C-N 3.29Å; D759-D761 PolarHBondContact O-N 3.45Å
760	G	86.9	Confident	88.3	Confident	59 Å²	59	72.9 Å²	72.9	61%	0.608	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-2.3	-176.2	0	0	0	0	0	115
761	D	93.6	Very high	87.8	Confident	5 Å²	5	76 Å²	76	3%	0.027	40%	0.4	C	S	.	.			trans	-59.9	140.2	170.3	-81.2	-27	0	0	0	111.3	T718 L719 K750 P752 V757 E758 D759 F763	T718-D761 CarbonylContact C-O 3.59Å; T718-D761 WeakPolarHBondContact CA-O 3.26Å; L719-D761 PolarHBondContact N-O 3.16Å; K750-D761 HydrophobicContact CD-CB 4.46Å; K750-D761 WeakPolarHBondContact CD-OD2 3.39Å; K750-D761 HydrophobicContact CG-CB 4.31Å; K750-D761 IonicContact NZ-OD1 3.25Å; K750-D761 PolarHBondContact NZ-OD1 2.8Å; K750-D761 IonicContact NZ-OD2 3.12Å; K750-D761 PolarHBondContact NZ-OD2 2.81Å; P752-D761 WeakPolarHBondContact CD-OD1 3.41Å; V757-D761 WeakPolarHBondContact CA-OD2 3.47Å; E758-D761 PolarHBondContact N-OD2 2.98Å; E758-D761 VanDerWaalsContact O-CB 3.31Å; E758-D761 WeakPolarHBondContact O-CB 3.35Å; E758-D761 PolarHBondContact O-N 3.38Å; D759-D761 VanDerWaalsContact C-N 3.29Å; D759-D761 PolarHBondContact O-N 3.45Å; D761-F763 HydrophobicContact CB-CE2 3.89Å; D761-F763 HydrophobicContact CB-CZ 4.07Å
762	K	93.8	Very high	87.5	Confident	81 Å²	81	82.3 Å²	82.3	35%	0.352	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	147.2	175.4	-60.2	-164.1	176.4	-172.7	0	112	E716 F717 T718 K750 I751	E716-K762 VanDerWaalsContact CD-CD 3.45Å; E716-K762 HydrophobicContact CG-CB 4.14Å; E716-K762 HydrophobicContact CG-CD 4.07Å; E716-K762 WeakPolarHBondContact OE1-CD 3.36Å; E716-K762 IonicContact OE1-NZ 3.73Å; E716-K762 PolarHBondContact OE1-NZ 2.97Å; F717-K762 CarbonylContact O-C 3.55Å; F717-K762 WeakPolarHBondContact O-CA 3.31Å; T718-K762 HydrophobicContact CG2-CD 4.46Å; T718-K762 HydrophobicContact CG2-CG 4Å; K750-K762 CarbonylContact C-O 3.43Å; K750-K762 WeakPolarHBondContact CA-O 3.11Å; I751-K762 HydrophobicContact CB-CB 4.38Å; I751-K762 PolarHBondContact N-O 3.44Å; I751-K762 PolarHBondContact O-N 3.41Å
763	F	95.5	Very high	87.4	Confident	0 Å²	0	83.2 Å²	83.2	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.4	-178	-60.5	-89.5	0	0	0	110.1	F711 E716 F717 L719 I722 L737 A741 T749 K750 V757 D761	F711-F763 WeakPolarHBondContact CE1-O 3.39Å; F711-F763 HydrophobicContact CZ-CB 4.14Å; E716-F763 WeakPolarHBondContact CA-O 3.34Å; F717-F763 PolarHBondContact N-O 3.49Å; F717-F763 PolarHBondContact O-N 3.28Å; L719-F763 HydrophobicContact CB-CE2 4.47Å; I722-F763 HydrophobicContact CD1-CB 4.23Å; I722-F763 HydrophobicContact CD1-CD2 3.9Å; I722-F763 HydrophobicContact CD1-CG 4.3Å; L737-F763 HydrophobicContact CB-CE1 3.96Å; L737-F763 HydrophobicContact CB-CZ 3.98Å; L737-F763 HydrophobicContact CD1-CD2 4.31Å; L737-F763 HydrophobicContact CD1-CE2 3.79Å; L737-F763 HydrophobicContact CD1-CZ 3.9Å; L737-F763 HydrophobicContact CD2-CD1 4.09Å; L737-F763 HydrophobicContact CD2-CD2 4.29Å; L737-F763 HydrophobicContact CD2-CE1 4.19Å; L737-F763 HydrophobicContact CD2-CE2 4.41Å; L737-F763 HydrophobicContact CD2-CG 4.15Å; L737-F763 HydrophobicContact CD2-CZ 4.36Å; L737-F763 HydrophobicContact CG-CE1 4.45Å; L737-F763 HydrophobicContact CG-CZ 4.31Å; A741-F763 HydrophobicContact CB-CD1 4.02Å; A741-F763 HydrophobicContact CB-CE1 3.99Å; T749-F763 WeakPolarHBondContact O-CA 3.4Å; K750-F763 HydrophobicContact CB-CD1 4.24Å; K750-F763 HydrophobicContact CB-CE1 3.96Å; K750-F763 HydrophobicContact CD-CE1 3.86Å; K750-F763 HydrophobicContact CD-CZ 3.98Å; K750-F763 HydrophobicContact CG-CD1 4.21Å; K750-F763 HydrophobicContact CG-CE1 3.61Å; K750-F763 HydrophobicContact CG-CZ 3.92Å; V757-F763 HydrophobicContact CG1-CE2 4.32Å; V757-F763 HydrophobicContact CG1-CZ 3.73Å; V757-F763 HydrophobicContact CG2-CE1 4.45Å; V757-F763 HydrophobicContact CG2-CZ 4.09Å; D761-F763 HydrophobicContact CB-CE2 3.89Å; D761-F763 HydrophobicContact CB-CZ 4.07Å
764	S	92.8	Very high	87.4	Confident	26 Å²	26	79.8 Å²	79.8	18%	0.182	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	157.6	174.8	59.9	0	0	0	0	111.4	E715 L748 T749 N766	E715-S764 WeakPolarHBondContact O-CA 3.42Å; L748-S764 CarbonylContact C-O 3.57Å; L748-S764 WeakPolarHBondContact CA-O 3.46Å; T749-S764 PolarHBondContact N-O 2.78Å; T749-S764 PolarHBondContact O-N 3.36Å; S764-N766 PolarHBondContact O-N 3.42Å
765	C	90.1	Very high	87.4	Confident	52 Å²	52	83.4 Å²	83.4	35%	0.351	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133.9	176.3	-166.6	0	0	0	0	110.6	F711 D767	F711-C765 HydrophobicContact CD1-CB 4.43Å; C765-D767 PolarHBondContact O-N 2.82Å
766	N	89	Confident	87.5	Confident	31 Å²	31	75.5 Å²	75.5	17%	0.166	38%	0.379	C	S	.	.			trans	-84.4	90.6	177.1	-176.3	12.2	0	0	0	110.8	R746 V747 S764 D768 F769	R746-N766 WeakPolarHBondContact O-CB 3.16Å; R746-N766 PolarHBondContact O-ND2 2.67Å; V747-N766 VanDerWaalsContact O-CB 3.26Å; V747-N766 WeakPolarHBondContact O-CB 3.3Å; V747-N766 PolarHBondContact O-N 3.02Å; S764-N766 PolarHBondContact O-N 3.42Å; N766-D768 PolarHBondContact O-N 3.17Å; N766-D768 VanDerWaalsContact O-N 3.07Å; N766-D768 WeakPolarHBondContact OD1-CA 3.25Å; N766-D768 WeakPolarHBondContact OD1-CB 3.36Å; N766-D768 PolarHBondContact OD1-N 3.47Å; N766-D768 VanDerWaalsContact OD1-N 3.08Å; N766-F769 HydrophobicContact CB-CB 4.43Å; N766-F769 WeakPolarHBondContact O-CB 3.45Å; N766-F769 PolarHBondContact O-N 3.23Å; N766-F769 VanDerWaalsContact O-N 3.14Å
767	D	81.9	Confident	87.4	Confident	78 Å²	78	74 Å²	74	42%	0.417	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.7	174.6	-75.4	-27.2	0	0	0	112.7	K691 C765	K691-D767 IonicContact NZ-OD2 3.55Å; C765-D767 PolarHBondContact O-N 2.82Å
768	D	81.1	Confident	87.1	Confident	108 Å²	108	73.9 Å²	73.9	58%	0.578	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.9	-177.9	-100.6	-38.6	0	0	0	115.5	K693 N766 K770	K693-D768 PolarHBondContact NZ-O 3.15Å; K693-D768 IonicContact NZ-OD1 2.66Å; K693-D768 PolarHBondContact NZ-OD1 2.96Å; N766-D768 PolarHBondContact O-N 3.17Å; N766-D768 VanDerWaalsContact O-N 3.07Å; N766-D768 WeakPolarHBondContact OD1-CA 3.25Å; N766-D768 WeakPolarHBondContact OD1-CB 3.36Å; N766-D768 PolarHBondContact OD1-N 3.47Å; N766-D768 VanDerWaalsContact OD1-N 3.08Å; D768-K770 WeakPolarHBondContact O-CG 3.13Å; D768-K770 PolarHBondContact O-N 2.81Å
769	F	82.9	Confident	85.9	Confident	13 Å²	13	69.3 Å²	69.3	6%	0.057	35%	0.347	C	S	.	.			trans	-52.9	123.6	-172.2	-178.6	-109.6	0	0	0	113.5	F690 A745 R746 V747 N766 H771 I776	F690-F769 HydrophobicContact CD1-CB 4.35Å; F690-F769 HydrophobicContact CE1-CB 4.16Å; F690-F769 HydrophobicContact CE1-CD1 4.27Å; F690-F769 AromaticContact CE2-CD1 3.97Å; F690-F769 HydrophobicContact CE2-CD1 3.97Å; F690-F769 HydrophobicContact CE2-CE1 4.48Å; F690-F769 AromaticContact CZ-CD1 3.84Å; F690-F769 HydrophobicContact CZ-CD1 3.84Å; F690-F769 HydrophobicContact CZ-CE1 4.48Å; F690-F769 HydrophobicContact CZ-CG 4.47Å; A745-F769 HydrophobicContact CB-CE2 4.15Å; A745-F769 HydrophobicContact CB-CZ 4.26Å; R746-F769 VanDerWaalsContact O-CD2 3.27Å; R746-F769 WeakPolarHBondContact O-CD2 3.49Å; V747-F769 HydrophobicContact CG2-CD2 4.34Å; V747-F769 HydrophobicContact CG2-CE1 4.3Å; V747-F769 HydrophobicContact CG2-CE2 3.98Å; V747-F769 HydrophobicContact CG2-CZ 3.95Å; N766-F769 HydrophobicContact CB-CB 4.43Å; N766-F769 WeakPolarHBondContact O-CB 3.45Å; N766-F769 PolarHBondContact O-N 3.23Å; N766-F769 VanDerWaalsContact O-N 3.14Å; F769-H771 HydrophobicContact CE1-CB 4.02Å; F769-H771 HydrophobicContact CZ-CB 3.93Å; F769-I776 HydrophobicContact CE1-CD1 3.53Å; F769-I776 HydrophobicContact CZ-CD1 3.77Å
770	K	77.9	Confident	84.9	Confident	162 Å²	162	68.8 Å²	68.8	70%	0.704	34%	0.34	S	S	*	.			trans	-121.7	129.2	176.6	-53.3	-162.2	-174.4	-175.1	0	110.9	K693 D768	K693-K770 HydrophobicContact CD-CD 4.28Å; K693-K770 HydrophobicContact CD-CG 3.78Å; K693-K770 VanDerWaalsContact CE-CE 3.43Å; D768-K770 WeakPolarHBondContact O-CG 3.13Å; D768-K770 PolarHBondContact O-N 2.81Å
771	H	84	Confident	83.7	Confident	70 Å²	70	68.2 Å²	68.2	32%	0.324	32%	0.323	S	S	.	.			trans	-147.1	138.6	172.8	-163.7	-90.1	0	0	0	111.9	K696 F769 L773 I776	K696-H771 PolarHBondContact NZ-O 2.79Å; F769-H771 HydrophobicContact CE1-CB 4.02Å; F769-H771 HydrophobicContact CZ-CB 3.93Å; H771-L773 PolarHBondContact ND1-N 2.87Å; H771-L773 VanDerWaalsContact ND1-N 3.15Å; H771-L773 PolarHBondContact ND1-O 3.31Å; H771-L773 PolarHBondContact O-N 2.83Å; H771-I776 HydrophobicContact CB-CD1 3.54Å; H771-I776 HydrophobicContact CB-CG1 4.38Å
772	K	84.6	Confident	82.1	Confident	213 Å²	213	69 Å²	69	93%	0.926	33%	0.327	S	S	*	.	S	Bend	trans	-65.8	-37	-176.1	-64.4	-175.1	-179.3	-176.1	0	112.8
773	L	85.6	Confident	80.7	Confident	106 Å²	106	66 Å²	66	56%	0.555	31%	0.314	S	S	*	.			trans	-86.2	148.7	-179	-54.3	178.6	0	0	0	111.8	H771	H771-L773 PolarHBondContact ND1-N 2.87Å; H771-L773 VanDerWaalsContact ND1-N 3.15Å; H771-L773 PolarHBondContact ND1-O 3.31Å; H771-L773 PolarHBondContact O-N 2.83Å
774	F	86.8	Confident	79.6	Confident	110 Å²	110	73.2 Å²	73.2	48%	0.482	35%	0.345	S	S	.	.	S	Bend	trans	-73.6	-47	172.3	177.2	-100.1	0	0	0	112.1	K695 E697	K695-F774 WeakPolarHBondContact O-CD2 3.27Å; K695-F774 WeakPolarHBondContact O-CE2 3.42Å; E697-F774 HydrophobicContact CB-CE1 4.19Å; E697-F774 HydrophobicContact CG-CD1 4.49Å; E697-F774 HydrophobicContact CG-CE1 3.66Å; E697-F774 HydrophobicContact CG-CZ 4.01Å; E697-F774 PolarHBondContact N-O 3.09Å
775	R	87.7	Confident	78.9	Confident	135 Å²	135	74.2 Å²	74.2	51%	0.509	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.9	176.2	-167.7	167.2	179.6	175.9	1.6	110.3	E697	E697-R775 HydrophobicContact CB-CB 4.39Å; E697-R775 HydrophobicContact CB-CG 4.16Å; E697-R775 CarbonylContact O-C 3.56Å; E697-R775 VanDerWaalsContact O-CA 3.31Å; E697-R775 WeakPolarHBondContact O-CA 3.33Å
776	I	88.2	Confident	78.5	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.1	-168.9	-49.2	174.7	0	0	0	108.8	E697 L698 Q699 A745 F769 H771 I778	E697-I776 PolarHBondContact O-N 3.49Å; L698-I776 HydrophobicContact CD2-CB 4.09Å; L698-I776 HydrophobicContact CD2-CD1 4Å; L698-I776 HydrophobicContact CD2-CG1 4.4Å; Q699-I776 PolarHBondContact N-O 3.48Å; A745-I776 HydrophobicContact CB-CG2 4.32Å; F769-I776 HydrophobicContact CE1-CD1 3.53Å; F769-I776 HydrophobicContact CZ-CD1 3.77Å; H771-I776 HydrophobicContact CB-CD1 3.54Å; H771-I776 HydrophobicContact CB-CG1 4.38Å; I776-I778 HydrophobicContact CG2-CD1 4.37Å; I776-I778 HydrophobicContact CG2-CG1 3.96Å
777	K	84.9	Confident	78.3	Confident	57 Å²	57	77.3 Å²	77.3	25%	0.248	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.8	178.6	-168.8	167.4	-171.8	161.6	0	110.5	V571 K573	V571-K777 PolarHBondContact O-NZ 3.18Å; V571-K777 VanDerWaalsContact O-NZ 3.16Å; K573-K777 VanDerWaalsContact CE-CE 3.43Å; K573-K777 VanDerWaalsContact CE-NZ 3.35Å
778	I	80.9	Confident	78.3	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.036	38%	0.376	C	S	.	.			trans	-103.2	7.2	-175.5	-48.8	179.4	0	0	0	111.3	L698 Q699 V700 Q704 L740 A745 V747 I776 Q780	L698-I778 HydrophobicContact CB-CD1 4.42Å; L698-I778 HydrophobicContact CD1-CD1 4.32Å; L698-I778 HydrophobicContact CD2-CD1 4Å; L698-I778 HydrophobicContact CG-CD1 4.48Å; Q699-I778 PolarHBondContact O-N 3.4Å; V700-I778 HydrophobicContact CG1-CB 4.21Å; V700-I778 HydrophobicContact CG1-CD1 4.45Å; Q704-I778 PolarHBondContact NE2-O 2.85Å; L740-I778 HydrophobicContact CD2-CG2 4.06Å; A745-I778 HydrophobicContact CB-CD1 4.34Å; A745-I778 HydrophobicContact CB-CG1 4.18Å; V747-I778 HydrophobicContact CG2-CD1 3.38Å; I776-I778 HydrophobicContact CG2-CD1 4.37Å; I776-I778 HydrophobicContact CG2-CG1 3.96Å; I778-Q780 VanDerWaalsContact C-N 3.26Å; I778-Q780 PolarHBondContact O-N 2.87Å; I778-Q780 VanDerWaalsContact O-N 3.14Å
779	N	68.1	Low	78.3	Confident	13 Å²	13	77.4 Å²	77.4	7%	0.07	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	37.4	-179.9	-156.8	-11.7	0	0	0	113	Q782 M783	N779-Q782 WeakPolarHBondContact OD1-CB 3.49Å; N779-Q782 PolarHBondContact OD1-OE1 3.17Å; N779-M783 WeakPolarHBondContact O-CG 3.3Å
780	Q	66.7	Low	78.5	Confident	113 Å²	113	79 Å²	79	53%	0.528	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-36.3	-174.5	-69.2	-176.8	24.1	0	0	113.4	I778	I778-Q780 VanDerWaalsContact C-N 3.26Å; I778-Q780 PolarHBondContact O-N 2.87Å; I778-Q780 VanDerWaalsContact O-N 3.14Å
781	I	62.2	Low	78.9	Confident	48 Å²	48	74 Å²	74	25%	0.246	36%	0.356	C	S	.	.	S	Bend	trans	-76.2	-41.2	-177.2	-55.3	-164.8	0	0	0	110.6	R735 M783 K784	R735-I781 HydrophobicContact CG-CG2 3.78Å; I781-M783 PolarHBondContact O-N 3.18Å; I781-K784 PolarHBondContact O-N 3.42Å
782	Q	59.9	Low	79.1	Confident	22 Å²	22	73.8 Å²	73.8	10%	0.103	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.8	-178.5	-67.4	177.7	-54.4	0	0	114.5	S701 E732 R735 T736 N779	S701-Q782 PolarHBondContact OG-OE1 3.33Å; E732-Q782 PolarHBondContact OE1-NE2 3.02Å; R735-Q782 VanDerWaalsContact NH2-CA 3.35Å; R735-Q782 PolarHBondContact NH2-O 3.38Å; T736-Q782 PolarHBondContact OG1-NE2 2.97Å; N779-Q782 WeakPolarHBondContact OD1-CB 3.49Å; N779-Q782 PolarHBondContact OD1-OE1 3.17Å
783	M	65.1	Low	79.1	Confident	16 Å²	16	64.5 Å²	64.5	8%	0.079	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.3	176.9	-70.5	-166.7	75.1	0	0	113.9	V571 K573 N779 I781	V571-M783 HydrophobicContact CB-CE 3.55Å; V571-M783 HydrophobicContact CB-SD 4.05Å; V571-M783 HydrophobicContact CG1-CE 3.6Å; V571-M783 HydrophobicContact CG1-SD 3.37Å; V571-M783 WeakPolarHBondContact CG1-SD 3.47Å; V571-M783 HydrophobicContact CG2-CE 3.84Å; V571-M783 HydrophobicContact CG2-SD 4.39Å; K573-M783 HydrophobicContact CD-CE 3.59Å; K573-M783 HydrophobicContact CD-SD 3.9Å; K573-M783 WeakPolarHBondContact CE-SD 3.26Å; K573-M783 HydrophobicContact CG-CE 4.28Å; K573-M783 PolarHBondContact NZ-SD 2.92Å; N779-M783 WeakPolarHBondContact O-CG 3.3Å; I781-M783 PolarHBondContact O-N 3.18Å
784	K	72.5	Confident	79.2	Confident	152 Å²	152	61.3 Å²	61.3	66%	0.661	31%	0.309	S	S	*	.	S	Bend	trans	-77.4	133.8	169.1	-69	-172.9	176	-175.2	0	108.6	I781 T786	I781-K784 PolarHBondContact O-N 3.42Å; K784-T786 PolarHBondContact O-N 2.94Å
785	E	78	Confident	79.2	Confident	47 Å²	47	60.8 Å²	60.8	22%	0.22	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-60.5	132.7	167.8	177.1	-175.7	-138	0	0	109.4	K519 F560 K563 E789 Q790	K519-E785 WeakPolarHBondContact CE-OE2 3.4Å; K519-E785 IonicContact NZ-OE2 2.72Å; K519-E785 PolarHBondContact NZ-OE2 3.34Å; F560-E785 WeakPolarHBondContact CE1-OE1 3.44Å; K563-E785 IonicContact NZ-OE1 3.91Å; K563-E785 PolarHBondContact NZ-OE1 3.25Å; E785-E789 WeakPolarHBondContact CA-OE2 3.38Å; E785-E789 HydrophobicContact CG-CB 4.29Å; E785-Q790 HydrophobicContact CG-CB 4.13Å; E785-Q790 WeakPolarHBondContact OE1-CA 3.44Å; E785-Q790 WeakPolarHBondContact OE1-CB 3.48Å
786	T	81.6	Confident	79.2	Confident	40 Å²	40	59.1 Å²	59.1	25%	0.245	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-88.2	161.8	173.1	80.6	0	0	0	0	110.7	K784 E788 E789 Q790	K784-T786 PolarHBondContact O-N 2.94Å; T786-E788 WeakPolarHBondContact CB-OE2 3.48Å; T786-E788 PolarHBondContact O-N 3Å; T786-E788 PolarHBondContact OG1-OE2 3.3Å; T786-E789 PolarHBondContact O-N 2.9Å; T786-E789 PolarHBondContact OG1-N 3.33Å; T786-E789 VanDerWaalsContact OG1-N 3.12Å; T786-Q790 PolarHBondContact O-N 2.89Å
787	V	83.9	Confident	79.2	Confident	108 Å²	108	59.3 Å²	59.3	66%	0.655	30%	0.303	S	S	*	.	H	α-helix	trans	-63.8	-36	179.1	179.8	0	0	0	0	110.5	Q790 A791	V787-Q790 PolarHBondContact O-N 3.5Å; V787-A791 WeakPolarHBondContact O-CB 3.04Å; V787-A791 PolarHBondContact O-N 3.36Å
788	E	82.5	Confident	79.3	Confident	137 Å²	137	60.3 Å²	60.3	64%	0.64	31%	0.307	S	S	*	.	H	α-helix	trans	-65.4	-43.7	175.9	-52.7	74.6	-159.7	0	0	110.9	T786 Q790 A791 S792	T786-E788 WeakPolarHBondContact CB-OE2 3.48Å; T786-E788 PolarHBondContact O-N 3Å; T786-E788 PolarHBondContact OG1-OE2 3.3Å; E788-Q790 VanDerWaalsContact C-N 3.33Å; E788-Q790 PolarHBondContact O-N 3.43Å; E788-A791 PolarHBondContact O-N 3.43Å; E788-S792 WeakPolarHBondContact O-CB 3.07Å; E788-S792 PolarHBondContact O-N 3.25Å
789	E	81	Confident	79.6	Confident	52 Å²	52	64 Å²	64	24%	0.243	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-39.9	177.2	-164.2	-163	146.6	0	0	111.3	K563 K567 E785 T786 T793	K563-E789 HydrophobicContact CD-CG 4.49Å; K563-E789 WeakPolarHBondContact CD-OE1 3.16Å; K563-E789 VanDerWaalsContact CE-OE1 3.25Å; K563-E789 WeakPolarHBondContact CE-OE1 3.41Å; K563-E789 IonicContact NZ-OE1 3.88Å; K563-E789 PolarHBondContact NZ-OE1 2.96Å; K567-E789 VanDerWaalsContact CE-OE1 3.29Å; K567-E789 WeakPolarHBondContact CE-OE1 3.29Å; K567-E789 VanDerWaalsContact NZ-CD 3.27Å; K567-E789 IonicContact NZ-OE1 3.72Å; K567-E789 PolarHBondContact NZ-OE1 2.85Å; K567-E789 IonicContact NZ-OE2 3.66Å; K567-E789 PolarHBondContact NZ-OE2 2.88Å; E785-E789 WeakPolarHBondContact CA-OE2 3.38Å; E785-E789 HydrophobicContact CG-CB 4.29Å; T786-E789 PolarHBondContact O-N 2.9Å; T786-E789 PolarHBondContact OG1-N 3.33Å; T786-E789 VanDerWaalsContact OG1-N 3.12Å; E789-T793 WeakPolarHBondContact O-CB 3.33Å; E789-T793 PolarHBondContact O-N 3.04Å; E789-T793 PolarHBondContact O-OG1 2.88Å
790	Q	85.6	Confident	80.5	Confident	45 Å²	45	66.9 Å²	66.9	21%	0.21	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-52	175.9	-174.2	-177.5	-6.8	0	0	111	E515 F560 E785 T786 V787 E788 S792 T793 T794	E515-Q790 VanDerWaalsContact CD-NE2 3.32Å; E515-Q790 PolarHBondContact OE1-NE2 3.44Å; E515-Q790 PolarHBondContact OE2-NE2 2.95Å; F560-Q790 HydrophobicContact CE1-CG 4.06Å; F560-Q790 HydrophobicContact CZ-CG 4.22Å; E785-Q790 HydrophobicContact CG-CB 4.13Å; E785-Q790 WeakPolarHBondContact OE1-CA 3.44Å; E785-Q790 WeakPolarHBondContact OE1-CB 3.48Å; T786-Q790 PolarHBondContact O-N 2.89Å; V787-Q790 PolarHBondContact O-N 3.5Å; E788-Q790 VanDerWaalsContact C-N 3.33Å; E788-Q790 PolarHBondContact O-N 3.43Å; Q790-S792 VanDerWaalsContact C-N 3.34Å; Q790-S792 PolarHBondContact O-N 3.23Å; Q790-T793 PolarHBondContact O-N 2.96Å; Q790-T794 PolarHBondContact O-N 3.1Å; Q790-T794 PolarHBondContact O-OG1 3Å
791	A	86.9	Confident	81.6	Confident	58 Å²	58	62.2 Å²	62.2	48%	0.479	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-42.4	179.5	0	0	0	0	0	111.8	V787 E788 T793 T794 E795	V787-A791 WeakPolarHBondContact O-CB 3.04Å; V787-A791 PolarHBondContact O-N 3.36Å; E788-A791 PolarHBondContact O-N 3.43Å; A791-T793 PolarHBondContact O-N 3.3Å; A791-T794 PolarHBondContact O-N 3.13Å; A791-E795 WeakPolarHBondContact O-CB 3.41Å; A791-E795 PolarHBondContact O-N 3.2Å
792	S	87.6	Confident	82.9	Confident	65 Å²	65	64.1 Å²	64.1	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-41.2	176.1	-178.1	0	0	0	0	112.4	E788 Q790 T794 E795 R796	E788-S792 WeakPolarHBondContact O-CB 3.07Å; E788-S792 PolarHBondContact O-N 3.25Å; Q790-S792 VanDerWaalsContact C-N 3.34Å; Q790-S792 PolarHBondContact O-N 3.23Å; S792-T794 VanDerWaalsContact C-N 3.34Å; S792-T794 PolarHBondContact O-N 3.24Å; S792-E795 PolarHBondContact O-N 2.98Å; S792-R796 PolarHBondContact O-N 3.03Å
793	T	86.1	Confident	84.4	Confident	19 Å²	19	70.8 Å²	70.8	12%	0.117	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-45.2	176.3	-55.9	0	0	0	0	110.4	A559 F560 K563 E789 Q790 A791 R796 V797	A559-T793 HydrophobicContact CB-CG2 4.12Å; F560-T793 HydrophobicContact CD1-CG2 4.15Å; F560-T793 HydrophobicContact CE1-CG2 3.98Å; F560-T793 HydrophobicContact CE2-CG2 4.39Å; F560-T793 HydrophobicContact CG-CG2 4.42Å; F560-T793 HydrophobicContact CZ-CG2 4.1Å; K563-T793 PolarHBondContact NZ-OG1 3.49Å; E789-T793 WeakPolarHBondContact O-CB 3.33Å; E789-T793 PolarHBondContact O-N 3.04Å; E789-T793 PolarHBondContact O-OG1 2.88Å; Q790-T793 PolarHBondContact O-N 2.96Å; A791-T793 PolarHBondContact O-N 3.3Å; T793-R796 PolarHBondContact O-N 3.1Å; T793-V797 WeakPolarHBondContact O-CG2 3.34Å; T793-V797 PolarHBondContact O-N 3.43Å
794	T	86.9	Confident	85.5	Confident	38 Å²	38	74.4 Å²	74.4	23%	0.233	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-45.9	177.7	-61.5	0	0	0	0	112.4	Q790 A791 S792 R796 V797 F798	Q790-T794 PolarHBondContact O-N 3.1Å; Q790-T794 PolarHBondContact O-OG1 3Å; A791-T794 PolarHBondContact O-N 3.13Å; S792-T794 VanDerWaalsContact C-N 3.34Å; S792-T794 PolarHBondContact O-N 3.24Å; T794-R796 VanDerWaalsContact C-N 3.32Å; T794-R796 PolarHBondContact O-N 2.91Å; T794-V797 PolarHBondContact O-N 2.88Å; T794-F798 HydrophobicContact CG2-CD2 3.9Å; T794-F798 HydrophobicContact CG2-CE2 3.4Å; T794-F798 VanDerWaalsContact CG2-CE2 3.4Å; T794-F798 HydrophobicContact CG2-CZ 4.32Å; T794-F798 VanDerWaalsContact O-CD2 3.24Å; T794-F798 WeakPolarHBondContact O-CD2 3.41Å; T794-F798 PolarHBondContact O-N 3.05Å
795	E	87.8	Confident	86.4	Confident	99 Å²	99	67.6 Å²	67.6	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-42.7	179.1	179.7	54.8	-148.3	0	0	111.6	A791 S792 V797 F798 Q799	A791-E795 WeakPolarHBondContact O-CB 3.41Å; A791-E795 PolarHBondContact O-N 3.2Å; S792-E795 PolarHBondContact O-N 2.98Å; E795-V797 VanDerWaalsContact C-N 3.32Å; E795-V797 PolarHBondContact O-N 3.49Å; E795-F798 PolarHBondContact O-N 3.07Å; E795-F798 VanDerWaalsContact O-N 3.11Å; E795-Q799 WeakPolarHBondContact O-CG 3.42Å; E795-Q799 PolarHBondContact O-N 3.3Å; E795-Q799 PolarHBondContact OE1-NE2 3.15Å
796	R	87.5	Confident	87.1	Confident	101 Å²	101	65.9 Å²	65.9	38%	0.381	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-39.9	176.5	-174.5	174.9	-73.3	152.9	-2.5	112.3	S792 T793 T794 F798 Q799 D800	S792-R796 PolarHBondContact O-N 3.03Å; T793-R796 PolarHBondContact O-N 3.1Å; T794-R796 VanDerWaalsContact C-N 3.32Å; T794-R796 PolarHBondContact O-N 2.91Å; R796-F798 VanDerWaalsContact C-N 3.3Å; R796-F798 PolarHBondContact O-N 3.28Å; R796-Q799 PolarHBondContact O-N 3.19Å; R796-D800 WeakPolarHBondContact O-CB 3.43Å; R796-D800 PolarHBondContact O-N 2.94Å
797	V	88.6	Confident	87.6	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-42	175.5	175.3	0	0	0	0	110.7	D555 V556 A559 T793 T794 E795 Q799 D800 R801	D555-V797 WeakPolarHBondContact OD2-CG1 3.43Å; V556-V797 HydrophobicContact CG2-CG1 3.84Å; A559-V797 HydrophobicContact CB-CG2 3.34Å; T793-V797 WeakPolarHBondContact O-CG2 3.34Å; T793-V797 PolarHBondContact O-N 3.43Å; T794-V797 PolarHBondContact O-N 2.88Å; E795-V797 VanDerWaalsContact C-N 3.32Å; E795-V797 PolarHBondContact O-N 3.49Å; V797-Q799 VanDerWaalsContact C-N 3.35Å; V797-Q799 PolarHBondContact O-N 3.18Å; V797-D800 PolarHBondContact O-N 3.05Å; V797-R801 WeakPolarHBondContact O-CG 3.45Å; V797-R801 PolarHBondContact O-N 3.24Å
798	F	86.3	Confident	88	Confident	78 Å²	78	61.3 Å²	61.3	34%	0.342	31%	0.308	S	S	.	.	H	α-helix	trans	-65.2	-37.9	177.3	-71.5	-58.9	0	0	0	112.9	N511 T794 E795 R796 R801 Q802	N511-F798 WeakPolarHBondContact ND2-CZ 3.4Å; T794-F798 HydrophobicContact CG2-CD2 3.9Å; T794-F798 HydrophobicContact CG2-CE2 3.4Å; T794-F798 VanDerWaalsContact CG2-CE2 3.4Å; T794-F798 HydrophobicContact CG2-CZ 4.32Å; T794-F798 VanDerWaalsContact O-CD2 3.24Å; T794-F798 WeakPolarHBondContact O-CD2 3.41Å; T794-F798 PolarHBondContact O-N 3.05Å; E795-F798 PolarHBondContact O-N 3.07Å; E795-F798 VanDerWaalsContact O-N 3.11Å; R796-F798 VanDerWaalsContact C-N 3.3Å; R796-F798 PolarHBondContact O-N 3.28Å; F798-R801 PolarHBondContact O-N 2.8Å; F798-Q802 PolarHBondContact O-N 2.83Å
799	Q	87.1	Confident	88.6	Confident	85 Å²	85	54.8 Å²	54.8	40%	0.397	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-44.7	173.8	-67	175.8	14	0	0	111.4	E795 R796 V797 R801 Q802 Y803	E795-Q799 WeakPolarHBondContact O-CG 3.42Å; E795-Q799 PolarHBondContact O-N 3.3Å; E795-Q799 PolarHBondContact OE1-NE2 3.15Å; R796-Q799 PolarHBondContact O-N 3.19Å; V797-Q799 VanDerWaalsContact C-N 3.35Å; V797-Q799 PolarHBondContact O-N 3.18Å; Q799-R801 VanDerWaalsContact C-N 3.27Å; Q799-R801 PolarHBondContact O-N 3.17Å; Q799-Q802 WeakPolarHBondContact O-CB 3.31Å; Q799-Q802 PolarHBondContact O-N 2.69Å; Q799-Y803 WeakPolarHBondContact O-CD2 3.44Å; Q799-Y803 PolarHBondContact O-N 3.32Å
800	D	86.8	Confident	89.2	Confident	73 Å²	73	53.9 Å²	53.9	39%	0.39	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-37.3	177.3	-77.1	-9.1	0	0	0	112.1	R796 V797 Q802 Y803 Q804	R796-D800 WeakPolarHBondContact O-CB 3.43Å; R796-D800 PolarHBondContact O-N 2.94Å; V797-D800 PolarHBondContact O-N 3.05Å; D800-Q802 VanDerWaalsContact C-N 3.28Å; D800-Q802 PolarHBondContact O-N 2.85Å; D800-Y803 PolarHBondContact O-N 2.94Å; D800-Q804 WeakPolarHBondContact O-CG 3.28Å; D800-Q804 PolarHBondContact O-N 3.18Å; D800-Q804 VanDerWaalsContact O-N 3.07Å
801	R	90	Very high	89.6	Confident	16 Å²	16	59.1 Å²	59.1	6%	0.06	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-37.2	174	-75.4	178.8	177.2	174.4	3.7	112.4	N511 D555 V556 V797 F798 Q799 Q804 I805 F834	N511-R801 PolarHBondContact OD1-NH1 3.33Å; N511-R801 PolarHBondContact OD1-NH2 3.23Å; D555-R801 IonicContact OD1-CZ 2.8Å; D555-R801 IonicContact OD1-NE 2.83Å; D555-R801 IonicContact OD1-NH2 3.85Å; D555-R801 PolarHBondContact OD1-NH2 2.87Å; D555-R801 WeakPolarHBondContact OD2-CG 3.29Å; D555-R801 IonicContact OD2-CZ 3.18Å; D555-R801 IonicContact OD2-NE 2.99Å; D555-R801 PolarHBondContact OD2-NE 2.84Å; D555-R801 IonicContact OD2-NH2 3.89Å; D555-R801 PolarHBondContact OD2-NH2 2.92Å; V556-R801 VanDerWaalsContact CG2-NH2 3.33Å; V797-R801 WeakPolarHBondContact O-CG 3.45Å; V797-R801 PolarHBondContact O-N 3.24Å; F798-R801 PolarHBondContact O-N 2.8Å; Q799-R801 VanDerWaalsContact C-N 3.27Å; Q799-R801 PolarHBondContact O-N 3.17Å; R801-Q804 PolarHBondContact O-N 2.93Å; R801-I805 WeakPolarHBondContact O-CD1 3.32Å; R801-I805 VanDerWaalsContact O-CG1 3.23Å; R801-I805 WeakPolarHBondContact O-CG1 3.49Å; R801-I805 PolarHBondContact O-N 2.81Å; R801-F834 HydrophobicContact CB-CD2 4.3Å; R801-F834 HydrophobicContact CB-CE1 4.44Å; R801-F834 HydrophobicContact CB-CE2 3.62Å; R801-F834 HydrophobicContact CB-CZ 3.71Å; R801-F834 HydrophobicContact CG-CD1 4.12Å; R801-F834 HydrophobicContact CG-CD2 3.77Å; R801-F834 HydrophobicContact CG-CE1 3.93Å; R801-F834 HydrophobicContact CG-CE2 3.54Å; R801-F834 HydrophobicContact CG-CG 4.06Å; R801-F834 HydrophobicContact CG-CZ 3.64Å
802	Q	89.6	Confident	90	Very high	87 Å²	87	56.6 Å²	56.6	41%	0.407	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-43	178.9	-60.6	-175.1	24	0	0	111.6	F798 Q799 D800 Q804 I805 D806	F798-Q802 PolarHBondContact O-N 2.83Å; Q799-Q802 WeakPolarHBondContact O-CB 3.31Å; Q799-Q802 PolarHBondContact O-N 2.69Å; D800-Q802 VanDerWaalsContact C-N 3.28Å; D800-Q802 PolarHBondContact O-N 2.85Å; Q802-Q804 VanDerWaalsContact C-N 3.34Å; Q802-Q804 PolarHBondContact O-N 3.46Å; Q802-I805 PolarHBondContact O-N 3.47Å; Q802-D806 PolarHBondContact O-N 2.93Å
803	Y	90.6	Very high	90.3	Very high	163 Å²	163	53.6 Å²	53.6	64%	0.639	25%	0.25	S	S	*	.	H	α-helix	trans	-66.6	-36	176.1	-61.8	-61.4	0	0	0	112.3	Q799 D800 D806 A807	Q799-Y803 WeakPolarHBondContact O-CD2 3.44Å; Q799-Y803 PolarHBondContact O-N 3.32Å; D800-Y803 PolarHBondContact O-N 2.94Å; Y803-D806 PolarHBondContact O-N 3.25Å; Y803-A807 WeakPolarHBondContact O-CB 3.26Å; Y803-A807 PolarHBondContact O-N 2.96Å
804	Q	89.1	Confident	90.7	Very high	92 Å²	92	58.6 Å²	58.6	43%	0.43	27%	0.27	S	S	.	.	H	α-helix	trans	-66.3	-40.2	174.4	-71.5	-177	59.9	0	0	112.2	D800 R801 Q802 A807 A808 L832 F834	D800-Q804 WeakPolarHBondContact O-CG 3.28Å; D800-Q804 PolarHBondContact O-N 3.18Å; D800-Q804 VanDerWaalsContact O-N 3.07Å; R801-Q804 PolarHBondContact O-N 2.93Å; Q802-Q804 VanDerWaalsContact C-N 3.34Å; Q802-Q804 PolarHBondContact O-N 3.46Å; Q804-A807 PolarHBondContact O-N 2.78Å; Q804-A808 WeakPolarHBondContact O-CB 3.48Å; Q804-A808 PolarHBondContact O-N 3.28Å; Q804-L832 HydrophobicContact CB-CD2 4.48Å; Q804-F834 HydrophobicContact CB-CE1 4.19Å; Q804-F834 HydrophobicContact CB-CZ 4.09Å
805	I	92.1	Very high	91	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-50.7	173.7	-69.8	160.7	0	0	0	109.9	R801 Q802 A807 A808 I809 L832 F834 V836 L841 R844	R801-I805 WeakPolarHBondContact O-CD1 3.32Å; R801-I805 VanDerWaalsContact O-CG1 3.23Å; R801-I805 WeakPolarHBondContact O-CG1 3.49Å; R801-I805 PolarHBondContact O-N 2.81Å; Q802-I805 PolarHBondContact O-N 3.47Å; I805-A807 PolarHBondContact O-N 3.17Å; I805-A808 PolarHBondContact O-N 2.99Å; I805-I809 HydrophobicContact CG2-CD1 3.64Å; I805-I809 HydrophobicContact CG2-CG1 4.32Å; I805-I809 WeakPolarHBondContact O-CG1 3.35Å; I805-I809 PolarHBondContact O-N 3.43Å; I805-L832 HydrophobicContact CB-CD1 4.41Å; I805-L832 HydrophobicContact CG1-CD1 3.56Å; I805-F834 HydrophobicContact CD1-CE2 4.27Å; I805-F834 HydrophobicContact CG1-CE2 4.18Å; I805-F834 HydrophobicContact CG1-CZ 4.25Å; I805-V836 HydrophobicContact CD1-CG1 3.76Å; I805-V836 HydrophobicContact CD1-CG2 3.99Å; I805-V836 HydrophobicContact CG1-CG1 4.45Å; I805-V836 HydrophobicContact CG1-CG2 4.16Å; I805-L841 HydrophobicContact CG2-CD1 3.47Å; I805-L841 VanDerWaalsContact CG2-CD1 3.47Å; I805-R844 HydrophobicContact CB-CG 4.32Å; I805-R844 HydrophobicContact CG2-CB 3.87Å; I805-R844 HydrophobicContact CG2-CG 3.73Å
806	D	92.7	Very high	91.3	Very high	12 Å²	12	64.4 Å²	64.4	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-49.8	178.3	-80.1	8.1	0	0	0	112	Q802 Y803 A808 I809 V810 R844 R851	Q802-D806 PolarHBondContact O-N 2.93Å; Y803-D806 PolarHBondContact O-N 3.25Å; D806-A808 VanDerWaalsContact C-N 3.27Å; D806-A808 PolarHBondContact O-N 3.42Å; D806-I809 PolarHBondContact O-N 3.23Å; D806-V810 WeakPolarHBondContact O-CB 3.31Å; D806-V810 VanDerWaalsContact O-CG2 3.3Å; D806-V810 WeakPolarHBondContact O-CG2 3.22Å; D806-V810 PolarHBondContact O-N 3.24Å; D806-R844 IonicContact OD1-CZ 2.79Å; D806-R844 VanDerWaalsContact OD1-CZ 3.3Å; D806-R844 IonicContact OD1-NE 3.28Å; D806-R844 PolarHBondContact OD1-NE 3.25Å; D806-R844 IonicContact OD1-NH2 3.37Å; D806-R844 PolarHBondContact OD1-NH2 3.45Å; D806-R844 IonicContact OD2-CZ 3.24Å; D806-R844 IonicContact OD2-NE 2.66Å; D806-R844 IonicContact OD2-NH2 3.19Å; D806-R844 PolarHBondContact OD2-NH2 3.2Å; D806-R851 IonicContact OD1-NH2 3.69Å; D806-R851 IonicContact OD2-CZ 2.8Å; D806-R851 IonicContact OD2-NH1 2.64Å; D806-R851 IonicContact OD2-NH2 3.38Å; D806-R851 PolarHBondContact OD2-NH2 3.35Å
807	A	91.2	Very high	91.5	Very high	48 Å²	48	64.9 Å²	64.9	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-33.3	-179.5	0	0	0	0	0	112.5	Y803 Q804 I805 R811	Y803-A807 WeakPolarHBondContact O-CB 3.26Å; Y803-A807 PolarHBondContact O-N 2.96Å; Q804-A807 PolarHBondContact O-N 2.78Å; I805-A807 PolarHBondContact O-N 3.17Å; A807-R811 VanDerWaalsContact O-CB 3.26Å; A807-R811 WeakPolarHBondContact O-CB 3.34Å; A807-R811 PolarHBondContact O-N 2.85Å
808	A	92.9	Very high	91.7	Very high	3 Å²	3	67.3 Å²	67.3	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-68.5	-51	174.4	0	0	0	0	0	111.2	Q804 I805 D806 V810 R811 I812 L832	Q804-A808 WeakPolarHBondContact O-CB 3.48Å; Q804-A808 PolarHBondContact O-N 3.28Å; I805-A808 PolarHBondContact O-N 2.99Å; D806-A808 VanDerWaalsContact C-N 3.27Å; D806-A808 PolarHBondContact O-N 3.42Å; A808-V810 PolarHBondContact O-N 3.31Å; A808-R811 PolarHBondContact O-N 3.24Å; A808-I812 WeakPolarHBondContact O-CG1 2.81Å; A808-I812 PolarHBondContact O-N 3.05Å; A808-L832 HydrophobicContact CB-CD2 3.99Å
809	I	93.9	Very high	92.1	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-57	-50.6	178.5	-64.5	164.5	0	0	0	110.4	I805 D806 R811 I812 M813 L824 V828 L841 R844 I845 L848 M854	I805-I809 HydrophobicContact CG2-CD1 3.64Å; I805-I809 HydrophobicContact CG2-CG1 4.32Å; I805-I809 WeakPolarHBondContact O-CG1 3.35Å; I805-I809 PolarHBondContact O-N 3.43Å; D806-I809 PolarHBondContact O-N 3.23Å; I809-R811 VanDerWaalsContact C-N 3.28Å; I809-R811 PolarHBondContact O-N 3.4Å; I809-I812 PolarHBondContact O-N 3.06Å; I809-M813 HydrophobicContact CG2-CG 4.06Å; I809-M813 WeakPolarHBondContact O-CB 3.39Å; I809-M813 WeakPolarHBondContact O-CG 3.44Å; I809-M813 PolarHBondContact O-N 3.43Å; I809-L824 HydrophobicContact CG2-CD1 4.46Å; I809-L824 HydrophobicContact CG2-CD2 4.39Å; I809-V828 HydrophobicContact CG1-CG2 3.89Å; I809-L841 HydrophobicContact CD1-CD1 3.74Å; I809-L841 HydrophobicContact CG1-CD1 4.33Å; I809-R844 HydrophobicContact CD1-CB 4.24Å; I809-I845 HydrophobicContact CD1-CG1 4.08Å; I809-L848 HydrophobicContact CB-CD1 3.68Å; I809-L848 HydrophobicContact CD1-CD1 3.76Å; I809-L848 HydrophobicContact CG1-CD1 4.36Å; I809-L848 HydrophobicContact CG2-CD1 3.48Å; I809-L848 VanDerWaalsContact CG2-CD1 3.48Å; I809-M854 HydrophobicContact CG2-SD 3.78Å
810	V	94.4	Very high	92.5	Very high	32 Å²	32	62.6 Å²	62.6	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-40.1	-179.4	172.5	0	0	0	0	111.1	D806 A808 K814 L848 Y853	D806-V810 WeakPolarHBondContact O-CB 3.31Å; D806-V810 VanDerWaalsContact O-CG2 3.3Å; D806-V810 WeakPolarHBondContact O-CG2 3.22Å; D806-V810 PolarHBondContact O-N 3.24Å; A808-V810 PolarHBondContact O-N 3.31Å; V810-K814 WeakPolarHBondContact O-CB 3.46Å; V810-K814 PolarHBondContact O-N 3.36Å; V810-L848 HydrophobicContact CG2-CD1 4.3Å; V810-L848 HydrophobicContact CG2-CD2 3.63Å; V810-Y853 HydrophobicContact CG1-CD1 4.06Å; V810-Y853 HydrophobicContact CG1-CE1 4.41Å; V810-Y853 HydrophobicContact CG2-CD1 3.82Å; V810-Y853 HydrophobicContact CG2-CE1 4.41Å; V810-Y853 HydrophobicContact CG2-CG 4.2Å
811	R	94.1	Very high	92.7	Very high	156 Å²	156	61.2 Å²	61.2	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-66.1	-44.6	178.3	-168.5	-173.4	-49.1	171.4	4.8	112.2	A807 A808 I809 M815 Q831	A807-R811 VanDerWaalsContact O-CB 3.26Å; A807-R811 WeakPolarHBondContact O-CB 3.34Å; A807-R811 PolarHBondContact O-N 2.85Å; A808-R811 PolarHBondContact O-N 3.24Å; I809-R811 VanDerWaalsContact C-N 3.28Å; I809-R811 PolarHBondContact O-N 3.4Å; R811-M815 WeakPolarHBondContact O-CB 3.27Å; R811-M815 PolarHBondContact O-N 2.83Å; R811-Q831 VanDerWaalsContact NH1-NE2 3.17Å
812	I	94.2	Very high	92.8	Very high	5 Å²	5	66.9 Å²	66.9	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-52.1	177	-69.7	162.8	0	0	0	109.9	A808 I809 K814 M815 R816 L819 L824 E827 V828	A808-I812 WeakPolarHBondContact O-CG1 2.81Å; A808-I812 PolarHBondContact O-N 3.05Å; I809-I812 PolarHBondContact O-N 3.06Å; I812-K814 VanDerWaalsContact C-N 3.34Å; I812-K814 PolarHBondContact O-N 3.17Å; I812-M815 PolarHBondContact O-N 3.16Å; I812-M815 VanDerWaalsContact O-N 3.09Å; I812-R816 HydrophobicContact CG2-CG 4.3Å; I812-R816 PolarHBondContact O-N 3.11Å; I812-L819 HydrophobicContact CG2-CD2 3.75Å; I812-L824 HydrophobicContact CB-CD1 4.28Å; I812-L824 HydrophobicContact CG2-CD1 3.76Å; I812-E827 HydrophobicContact CD1-CB 3.85Å; I812-E827 HydrophobicContact CG1-CB 4.45Å; I812-E827 HydrophobicContact CG2-CB 4.39Å; I812-E827 VanDerWaalsContact CG2-OE2 3.27Å; I812-E827 WeakPolarHBondContact CG2-OE2 3.15Å; I812-V828 HydrophobicContact CD1-CG2 3.69Å
813	M	94.6	Very high	92.9	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-41	-179.2	-71.5	-56	-58.6	0	0	111.8	I809 M815 K817 L819 L824 M854 Y864 Y866	I809-M813 HydrophobicContact CG2-CG 4.06Å; I809-M813 WeakPolarHBondContact O-CB 3.39Å; I809-M813 WeakPolarHBondContact O-CG 3.44Å; I809-M813 PolarHBondContact O-N 3.43Å; M813-M815 VanDerWaalsContact C-N 3.26Å; M813-M815 PolarHBondContact O-N 2.85Å; M813-K817 VanDerWaalsContact O-CA 3.25Å; M813-K817 WeakPolarHBondContact O-CA 3.39Å; M813-K817 PolarHBondContact O-N 2.89Å; M813-L819 HydrophobicContact SD-CB 4.1Å; M813-L824 HydrophobicContact CG-CD1 4.39Å; M813-L824 HydrophobicContact SD-CD1 4.16Å; M813-L824 HydrophobicContact SD-CD2 4.27Å; M813-M854 HydrophobicContact CE-CE 4.16Å; M813-M854 HydrophobicContact CG-CE 4.06Å; M813-M854 HydrophobicContact CG-SD 4.24Å; M813-M854 HydrophobicContact SD-CE 4.09Å; M813-Y864 WeakPolarHBondContact CE-O 3.44Å; M813-Y866 HydrophobicContact CB-CD2 3.79Å; M813-Y866 HydrophobicContact CB-CG 4.36Å; M813-Y866 WeakPolarHBondContact O-CB 3.14Å
814	K	94.4	Very high	93	Very high	124 Å²	124	58.9 Å²	58.9	54%	0.539	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-35.3	175.4	-177.8	173.5	-179.7	173.6	0	112.7	V810 I812 K817 Y866	V810-K814 WeakPolarHBondContact O-CB 3.46Å; V810-K814 PolarHBondContact O-N 3.36Å; I812-K814 VanDerWaalsContact C-N 3.34Å; I812-K814 PolarHBondContact O-N 3.17Å; K814-K817 WeakPolarHBondContact O-CD 3.49Å; K814-K817 WeakPolarHBondContact O-CE 3.46Å; K814-K817 PolarHBondContact O-NZ 3.3Å; K814-Y866 HydrophobicContact CB-CD2 4.36Å; K814-Y866 HydrophobicContact CB-CE1 4.15Å; K814-Y866 HydrophobicContact CB-CE2 3.88Å; K814-Y866 HydrophobicContact CG-CE1 4.08Å
815	M	93.6	Very high	93	Very high	129 Å²	129	55.5 Å²	55.5	64%	0.635	27%	0.273	S	S	*	.	H	α-helix	trans	-79.4	-46.7	-179.7	-176.4	177.6	70.4	0	0	112.3	R811 I812 M813	R811-M815 WeakPolarHBondContact O-CB 3.27Å; R811-M815 PolarHBondContact O-N 2.83Å; I812-M815 PolarHBondContact O-N 3.16Å; I812-M815 VanDerWaalsContact O-N 3.09Å; M813-M815 VanDerWaalsContact C-N 3.26Å; M813-M815 PolarHBondContact O-N 2.85Å
816	R	92.8	Very high	92.9	Very high	131 Å²	131	57.8 Å²	57.8	49%	0.494	29%	0.29	S	S	.	.	H	α-helix	trans	-85.3	-21.9	-174.4	-62.9	-64.2	-163.7	173.3	3.8	113.8	I812 T818 L819 E827	I812-R816 HydrophobicContact CG2-CG 4.3Å; I812-R816 PolarHBondContact O-N 3.11Å; R816-T818 PolarHBondContact O-N 3.45Å; R816-L819 HydrophobicContact CB-CD1 4.1Å; R816-L819 HydrophobicContact CG-CD1 4.1Å; R816-L819 HydrophobicContact CG-CD2 4.43Å; R816-E827 IonicContact CZ-OE1 2.71Å; R816-E827 VanDerWaalsContact CZ-OE1 3.28Å; R816-E827 IonicContact NE-OE1 3.96Å; R816-E827 PolarHBondContact NE-OE1 2.67Å; R816-E827 IonicContact NE-OE2 3.74Å; R816-E827 IonicContact NH2-OE1 3.92Å; R816-E827 PolarHBondContact NH2-OE1 3.44Å
817	K	92.8	Very high	92.9	Very high	111 Å²	111	58.8 Å²	58.8	48%	0.483	29%	0.294	S	S	.	.	S	Bend	trans	63.5	-43.5	-174.5	-55.2	-55.2	-171.9	-171.1	0	115.2	M813 K814 N865 Y866	M813-K817 VanDerWaalsContact O-CA 3.25Å; M813-K817 WeakPolarHBondContact O-CA 3.39Å; M813-K817 PolarHBondContact O-N 2.89Å; K814-K817 WeakPolarHBondContact O-CD 3.49Å; K814-K817 WeakPolarHBondContact O-CE 3.46Å; K814-K817 PolarHBondContact O-NZ 3.3Å; K817-N865 CarbonylContact O-C 3.52Å; K817-N865 WeakPolarHBondContact O-CA 3.44Å; K817-Y866 HydrophobicContact CD-CD1 4.1Å; K817-Y866 WeakPolarHBondContact O-CB 3.33Å; K817-Y866 PolarHBondContact O-N 3.36Å
818	T	93	Very high	92.9	Very high	58 Å²	58	56.6 Å²	56.6	36%	0.356	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.9	179.1	-61.6	0	0	0	0	109.3	R816 Q863 Y864 N865	R816-T818 PolarHBondContact O-N 3.45Å; T818-Q863 HydrophobicContact CG2-CG 3.82Å; T818-Y864 VanDerWaalsContact CA-O 3.3Å; T818-Y864 WeakPolarHBondContact CA-O 3.43Å; T818-N865 WeakPolarHBondContact CB-OD1 3.33Å; T818-N865 WeakPolarHBondContact CG2-OD1 3.41Å; T818-N865 PolarHBondContact OG1-OD1 3.05Å
819	L	94.9	Very high	92.5	Very high	12 Å²	12	60.7 Å²	60.7	6%	0.063	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.1	-177.7	-150	66	0	0	0	111.6	I812 M813 R816 L823 L824 Y864	I812-L819 HydrophobicContact CG2-CD2 3.75Å; M813-L819 HydrophobicContact SD-CB 4.1Å; R816-L819 HydrophobicContact CB-CD1 4.1Å; R816-L819 HydrophobicContact CG-CD1 4.1Å; R816-L819 HydrophobicContact CG-CD2 4.43Å; L819-L823 HydrophobicContact CD1-CB 4.34Å; L819-L823 HydrophobicContact CD1-CD2 3.47Å; L819-L823 VanDerWaalsContact CD1-CD2 3.47Å; L819-L823 HydrophobicContact CD1-CG 3.82Å; L819-L823 HydrophobicContact CD2-CG 4.38Å; L819-L823 HydrophobicContact CG-CB 4.13Å; L819-L823 HydrophobicContact CG-CD2 4.18Å; L819-L823 HydrophobicContact CG-CG 4.08Å; L819-L824 HydrophobicContact CD2-CB 3.83Å; L819-L824 HydrophobicContact CD2-CD1 4.07Å; L819-L824 HydrophobicContact CG-CB 4.41Å; L819-Y864 PolarHBondContact N-O 3.46Å; L819-Y864 PolarHBondContact O-N 3.23Å
820	S	94.8	Very high	92.1	Very high	52 Å²	52	67 Å²	67	36%	0.364	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	154.6	172.4	71.8	0	0	0	0	111	N822 L823 L824 N862	S820-N822 PolarHBondContact O-N 2.88Å; S820-L823 PolarHBondContact O-N 3.33Å; S820-L823 WeakPolarHBondContact OG-CB 3.47Å; S820-L823 PolarHBondContact OG-N 2.98Å; S820-L824 WeakPolarHBondContact O-CB 3.45Å; S820-L824 PolarHBondContact O-N 3.08Å; S820-N862 CarbonylContact C-O 3.46Å; S820-N862 WeakPolarHBondContact CA-O 3.38Å
821	H	91.7	Very high	91.7	Very high	45 Å²	45	68.8 Å²	68.8	21%	0.208	33%	0.332	C	S	.	.	H	α-helix	trans	-54.6	-51.8	-179.8	-176.9	84.5	0	0	0	111.7	L823 L824 M825 N862 Y864	H821-L823 VanDerWaalsContact C-N 3.29Å; H821-L823 PolarHBondContact O-N 3.39Å; H821-L824 PolarHBondContact O-N 3.25Å; H821-M825 WeakPolarHBondContact O-CG 3.46Å; H821-M825 PolarHBondContact O-N 2.98Å; H821-N862 PolarHBondContact N-O 3.1Å; H821-Y864 HydrophobicContact CB-CE2 3.79Å; H821-Y864 AromaticContact ND1-CE2 3.5Å; H821-Y864 AromaticContact ND1-CZ 3.73Å; H821-Y864 PolarHBondContact ND1-OH 3.45Å
822	N	90.9	Very high	91.2	Very high	134 Å²	134	62.3 Å²	62.3	72%	0.717	31%	0.309	S	S	*	.	H	α-helix	trans	-61	-37.4	-178.6	-70.3	-30.5	0	0	0	112.9	S820 S826	S820-N822 PolarHBondContact O-N 2.88Å; N822-S826 WeakPolarHBondContact O-CB 3.46Å; N822-S826 PolarHBondContact O-N 3.45Å
823	L	92.3	Very high	90.2	Very high	82 Å²	82	69.4 Å²	69.4	43%	0.429	34%	0.339	S	S	.	.	H	α-helix	trans	-73.8	-39.1	179.3	-172.7	57.5	0	0	0	111.5	L819 S820 H821 S826 E827	L819-L823 HydrophobicContact CD1-CB 4.34Å; L819-L823 HydrophobicContact CD1-CD2 3.47Å; L819-L823 VanDerWaalsContact CD1-CD2 3.47Å; L819-L823 HydrophobicContact CD1-CG 3.82Å; L819-L823 HydrophobicContact CD2-CG 4.38Å; L819-L823 HydrophobicContact CG-CB 4.13Å; L819-L823 HydrophobicContact CG-CD2 4.18Å; L819-L823 HydrophobicContact CG-CG 4.08Å; S820-L823 PolarHBondContact O-N 3.33Å; S820-L823 WeakPolarHBondContact OG-CB 3.47Å; S820-L823 PolarHBondContact OG-N 2.98Å; H821-L823 VanDerWaalsContact C-N 3.29Å; H821-L823 PolarHBondContact O-N 3.39Å; L823-S826 PolarHBondContact O-N 3.18Å; L823-E827 PolarHBondContact O-N 2.91Å
824	L	92.2	Very high	89.6	Confident	1 Å²	1	70 Å²	70	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-59.4	-47	171.5	179.6	60.7	0	0	0	111.1	I809 I812 M813 L819 S820 H821 S826 E827 V828 I845 M854 Y864	I809-L824 HydrophobicContact CG2-CD1 4.46Å; I809-L824 HydrophobicContact CG2-CD2 4.39Å; I812-L824 HydrophobicContact CB-CD1 4.28Å; I812-L824 HydrophobicContact CG2-CD1 3.76Å; M813-L824 HydrophobicContact CG-CD1 4.39Å; M813-L824 HydrophobicContact SD-CD1 4.16Å; M813-L824 HydrophobicContact SD-CD2 4.27Å; L819-L824 HydrophobicContact CD2-CB 3.83Å; L819-L824 HydrophobicContact CD2-CD1 4.07Å; L819-L824 HydrophobicContact CG-CB 4.41Å; S820-L824 WeakPolarHBondContact O-CB 3.45Å; S820-L824 PolarHBondContact O-N 3.08Å; H821-L824 PolarHBondContact O-N 3.25Å; L824-S826 VanDerWaalsContact C-N 3.32Å; L824-S826 PolarHBondContact O-N 3.23Å; L824-E827 PolarHBondContact O-N 3.47Å; L824-V828 HydrophobicContact CD1-CG2 3.99Å; L824-V828 HydrophobicContact CG-CG2 4.31Å; L824-V828 WeakPolarHBondContact O-CB 3.45Å; L824-V828 WeakPolarHBondContact O-CG2 3.49Å; L824-V828 PolarHBondContact O-N 2.85Å; L824-I845 HydrophobicContact CD2-CD1 4.13Å; L824-M854 HydrophobicContact CD2-CE 4.16Å; L824-Y864 HydrophobicContact CD2-CD2 3.98Å; L824-Y864 HydrophobicContact CD2-CE2 4.27Å
825	M	90.1	Very high	88.9	Confident	20 Å²	20	67.8 Å²	67.8	10%	0.099	34%	0.34	C	S	.	.	H	α-helix	trans	-58.3	-46.8	178	-63.7	-70.5	-73.9	0	0	110.6	H821 V828 Y829 P838 L841 I845	H821-M825 WeakPolarHBondContact O-CG 3.46Å; H821-M825 PolarHBondContact O-N 2.98Å; M825-V828 PolarHBondContact O-N 2.98Å; M825-Y829 HydrophobicContact CB-CD2 4.48Å; M825-Y829 HydrophobicContact CB-CE2 4.27Å; M825-Y829 HydrophobicContact CE-CE2 4.18Å; M825-Y829 WeakPolarHBondContact O-CD2 3.19Å; M825-Y829 PolarHBondContact O-N 3.25Å; M825-P838 HydrophobicContact CE-CB 4.35Å; M825-L841 HydrophobicContact CE-CB 4.26Å; M825-L841 HydrophobicContact CE-CD2 3.52Å; M825-L841 HydrophobicContact CE-CG 4.1Å; M825-L841 HydrophobicContact SD-CB 4.34Å; M825-L841 HydrophobicContact SD-CD2 3.2Å; M825-L841 WeakPolarHBondContact SD-CD2 3.37Å; M825-L841 HydrophobicContact SD-CG 3.61Å; M825-I845 HydrophobicContact SD-CD1 4.45Å
826	S	89.8	Confident	88.4	Confident	57 Å²	57	62.4 Å²	62.4	40%	0.399	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-47	177.2	-173.4	0	0	0	0	112.6	N822 L823 L824 V828 Y829 N830	N822-S826 WeakPolarHBondContact O-CB 3.46Å; N822-S826 PolarHBondContact O-N 3.45Å; L823-S826 PolarHBondContact O-N 3.18Å; L824-S826 VanDerWaalsContact C-N 3.32Å; L824-S826 PolarHBondContact O-N 3.23Å; S826-V828 PolarHBondContact O-N 2.83Å; S826-Y829 PolarHBondContact O-N 3.07Å; S826-N830 VanDerWaalsContact O-CG 3.27Å; S826-N830 PolarHBondContact O-N 3.37Å; S826-N830 PolarHBondContact O-ND2 3.24Å; S826-N830 VanDerWaalsContact O-ND2 3.13Å
827	E	91.7	Very high	88.1	Confident	33 Å²	33	63.2 Å²	63.2	15%	0.154	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-39.4	177.6	-72.8	-161.8	-172	0	0	112.2	I812 R816 L823 L824 N830 Q831	I812-E827 HydrophobicContact CD1-CB 3.85Å; I812-E827 HydrophobicContact CG1-CB 4.45Å; I812-E827 HydrophobicContact CG2-CB 4.39Å; I812-E827 VanDerWaalsContact CG2-OE2 3.27Å; I812-E827 WeakPolarHBondContact CG2-OE2 3.15Å; R816-E827 IonicContact CZ-OE1 2.71Å; R816-E827 VanDerWaalsContact CZ-OE1 3.28Å; R816-E827 IonicContact NE-OE1 3.96Å; R816-E827 PolarHBondContact NE-OE1 2.67Å; R816-E827 IonicContact NE-OE2 3.74Å; R816-E827 IonicContact NH2-OE1 3.92Å; R816-E827 PolarHBondContact NH2-OE1 3.44Å; L823-E827 PolarHBondContact O-N 2.91Å; L824-E827 PolarHBondContact O-N 3.47Å; E827-N830 PolarHBondContact O-N 3.36Å; E827-Q831 WeakPolarHBondContact O-CB 3.29Å; E827-Q831 PolarHBondContact O-N 3.39Å
828	V	90.9	Very high	87.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-44.8	176.2	172.4	0	0	0	0	111.1	I809 I812 L824 M825 S826 N830 Q831 L832 L841	I809-V828 HydrophobicContact CG1-CG2 3.89Å; I812-V828 HydrophobicContact CD1-CG2 3.69Å; L824-V828 HydrophobicContact CD1-CG2 3.99Å; L824-V828 HydrophobicContact CG-CG2 4.31Å; L824-V828 WeakPolarHBondContact O-CB 3.45Å; L824-V828 WeakPolarHBondContact O-CG2 3.49Å; L824-V828 PolarHBondContact O-N 2.85Å; M825-V828 PolarHBondContact O-N 2.98Å; S826-V828 PolarHBondContact O-N 2.83Å; V828-N830 VanDerWaalsContact C-N 3.3Å; V828-N830 PolarHBondContact O-N 2.9Å; V828-Q831 PolarHBondContact O-N 3.2Å; V828-L832 HydrophobicContact CG1-CD1 3.44Å; V828-L832 VanDerWaalsContact CG1-CD1 3.44Å; V828-L832 HydrophobicContact CG1-CG 4.04Å; V828-L832 WeakPolarHBondContact O-CB 3.49Å; V828-L832 VanDerWaalsContact O-CG 3.3Å; V828-L832 WeakPolarHBondContact O-CG 3.48Å; V828-L832 PolarHBondContact O-N 2.88Å; V828-L841 HydrophobicContact CB-CD2 4.34Å; V828-L841 HydrophobicContact CG1-CD1 3.99Å; V828-L841 HydrophobicContact CG1-CD2 3.94Å
829	Y	86	Confident	87.5	Confident	89 Å²	89	62 Å²	62	35%	0.349	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-35.7	176.2	-75.5	-57.7	0	0	0	112.6	M825 S826 V836	M825-Y829 HydrophobicContact CB-CD2 4.48Å; M825-Y829 HydrophobicContact CB-CE2 4.27Å; M825-Y829 HydrophobicContact CE-CE2 4.18Å; M825-Y829 WeakPolarHBondContact O-CD2 3.19Å; M825-Y829 PolarHBondContact O-N 3.25Å; S826-Y829 PolarHBondContact O-N 3.07Å; Y829-V836 HydrophobicContact CE1-CB 4.09Å; Y829-V836 WeakPolarHBondContact CE1-O 3.46Å; Y829-V836 PolarHBondContact OH-O 2.99Å
830	N	85	Confident	87.1	Confident	135 Å²	135	64.7 Å²	64.7	72%	0.722	35%	0.346	S	S	*	.	H	α-helix	trans	-71.4	-31.8	176.3	-71.5	-31.2	0	0	0	112.7	S826 E827 V828	S826-N830 VanDerWaalsContact O-CG 3.27Å; S826-N830 PolarHBondContact O-N 3.37Å; S826-N830 PolarHBondContact O-ND2 3.24Å; S826-N830 VanDerWaalsContact O-ND2 3.13Å; E827-N830 PolarHBondContact O-N 3.36Å; V828-N830 VanDerWaalsContact C-N 3.3Å; V828-N830 PolarHBondContact O-N 2.9Å
831	Q	85.9	Confident	86.8	Confident	69 Å²	69	62.3 Å²	62.3	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-83.2	-34.6	-178.7	-167.9	177.7	2.5	0	0	112.9	R811 E827 V828	R811-Q831 VanDerWaalsContact NH1-NE2 3.17Å; E827-Q831 WeakPolarHBondContact O-CB 3.29Å; E827-Q831 PolarHBondContact O-N 3.39Å; V828-Q831 PolarHBondContact O-N 3.2Å
832	L	84	Confident	86.7	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.105	34%	0.343	C	S	.	.			trans	-83.8	131.5	-177.7	-63.8	178.4	0	0	0	111.2	Q804 I805 A808 V828 F834 V836	Q804-L832 HydrophobicContact CB-CD2 4.48Å; I805-L832 HydrophobicContact CB-CD1 4.41Å; I805-L832 HydrophobicContact CG1-CD1 3.56Å; A808-L832 HydrophobicContact CB-CD2 3.99Å; V828-L832 HydrophobicContact CG1-CD1 3.44Å; V828-L832 VanDerWaalsContact CG1-CD1 3.44Å; V828-L832 HydrophobicContact CG1-CG 4.04Å; V828-L832 WeakPolarHBondContact O-CB 3.49Å; V828-L832 VanDerWaalsContact O-CG 3.3Å; V828-L832 WeakPolarHBondContact O-CG 3.48Å; V828-L832 PolarHBondContact O-N 2.88Å; L832-F834 VanDerWaalsContact C-N 3.28Å; L832-F834 HydrophobicContact CB-CZ 4.45Å; L832-F834 HydrophobicContact CD1-CE2 4.27Å; L832-F834 HydrophobicContact CD1-CZ 4.22Å; L832-F834 HydrophobicContact CD2-CE1 4.16Å; L832-F834 HydrophobicContact CD2-CZ 3.92Å; L832-F834 HydrophobicContact CG-CZ 4.44Å; L832-F834 PolarHBondContact O-N 3.34Å; L832-V836 HydrophobicContact CD1-CG2 3.58Å
833	K	72.3	Confident	86.8	Confident	154 Å²	154	66.1 Å²	66.1	67%	0.67	34%	0.338	S	S	*	.	S	Bend	trans	-88	13.2	-179.3	-62	-167.1	177.1	-170.6	0	113.8
834	F	82.1	Confident	86.8	Confident	12 Å²	12	64.2 Å²	64.2	5%	0.053	33%	0.325	C	S	.	.	S	Bend	trans	-138.8	156	-178.3	53.8	-98	0	0	0	111.2	R801 Q804 I805 L832 V836	R801-F834 HydrophobicContact CB-CD2 4.3Å; R801-F834 HydrophobicContact CB-CE1 4.44Å; R801-F834 HydrophobicContact CB-CE2 3.62Å; R801-F834 HydrophobicContact CB-CZ 3.71Å; R801-F834 HydrophobicContact CG-CD1 4.12Å; R801-F834 HydrophobicContact CG-CD2 3.77Å; R801-F834 HydrophobicContact CG-CE1 3.93Å; R801-F834 HydrophobicContact CG-CE2 3.54Å; R801-F834 HydrophobicContact CG-CG 4.06Å; R801-F834 HydrophobicContact CG-CZ 3.64Å; Q804-F834 HydrophobicContact CB-CE1 4.19Å; Q804-F834 HydrophobicContact CB-CZ 4.09Å; I805-F834 HydrophobicContact CD1-CE2 4.27Å; I805-F834 HydrophobicContact CG1-CE2 4.18Å; I805-F834 HydrophobicContact CG1-CZ 4.25Å; L832-F834 VanDerWaalsContact C-N 3.28Å; L832-F834 HydrophobicContact CB-CZ 4.45Å; L832-F834 HydrophobicContact CD1-CE2 4.27Å; L832-F834 HydrophobicContact CD1-CZ 4.22Å; L832-F834 HydrophobicContact CD2-CE1 4.16Å; L832-F834 HydrophobicContact CD2-CZ 3.92Å; L832-F834 HydrophobicContact CG-CZ 4.44Å; L832-F834 PolarHBondContact O-N 3.34Å; F834-V836 HydrophobicContact CD2-CG2 3.79Å; F834-V836 HydrophobicContact CE2-CG2 3.55Å; F834-V836 PolarHBondContact O-N 3.45Å
835	P	79.9	Confident	86.8	Confident	78 Å²	78	64.2 Å²	64.2	51%	0.506	33%	0.325	S	S	.	.			trans	-67.4	131	179.2	-18	32.6	0	0	0	111.3	Y552	Y552-P835 HydrophobicContact CD2-CG 4.14Å; Y552-P835 HydrophobicContact CG-CG 4.48Å
836	V	84.3	Confident	87	Confident	16 Å²	16	66.1 Å²	66.1	10%	0.097	33%	0.334	C	S	.	.			trans	-116.7	131.9	174.7	-175.7	0	0	0	0	109.2	I805 Y829 L832 F834 L841	I805-V836 HydrophobicContact CD1-CG1 3.76Å; I805-V836 HydrophobicContact CD1-CG2 3.99Å; I805-V836 HydrophobicContact CG1-CG1 4.45Å; I805-V836 HydrophobicContact CG1-CG2 4.16Å; Y829-V836 HydrophobicContact CE1-CB 4.09Å; Y829-V836 WeakPolarHBondContact CE1-O 3.46Å; Y829-V836 PolarHBondContact OH-O 2.99Å; L832-V836 HydrophobicContact CD1-CG2 3.58Å; F834-V836 HydrophobicContact CD2-CG2 3.79Å; F834-V836 HydrophobicContact CE2-CG2 3.55Å; F834-V836 PolarHBondContact O-N 3.45Å; V836-L841 HydrophobicContact CG1-CB 3.96Å
837	K	85.7	Confident	87.2	Confident	148 Å²	148	65 Å²	65	64%	0.643	33%	0.326	S	S	*	.			trans	-76.6	138.2	174.1	-62	178.4	-179.3	174.6	0	109.2	A839 D840 L841	K837-A839 PolarHBondContact O-N 3.03Å; K837-A839 VanDerWaalsContact O-N 3.11Å; K837-D840 HydrophobicContact CB-CB 4.45Å; K837-D840 WeakPolarHBondContact CB-OD2 3.26Å; K837-D840 PolarHBondContact O-N 3.03Å; K837-L841 PolarHBondContact O-N 2.85Å; K837-L841 VanDerWaalsContact O-N 3.11Å
838	P	86.1	Confident	87.3	Confident	84 Å²	84	63.5 Å²	63.5	55%	0.545	32%	0.319	S	S	.	.	H	α-helix	trans	-53.6	-35.6	177.1	-27.6	33.3	0	0	0	113.8	M825 L841 K842	M825-P838 HydrophobicContact CE-CB 4.35Å; P838-L841 PolarHBondContact O-N 3.29Å; P838-K842 PolarHBondContact O-N 3.46Å
839	A	87.4	Confident	87.4	Confident	61 Å²	61	65 Å²	65	50%	0.504	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-39.7	177.3	0	0	0	0	0	113	K837 K843	K837-A839 PolarHBondContact O-N 3.03Å; K837-A839 VanDerWaalsContact O-N 3.11Å; A839-K843 WeakPolarHBondContact O-CG 3.18Å; A839-K843 PolarHBondContact O-N 3.42Å; A839-K843 VanDerWaalsContact O-N 3.11Å
840	D	86.6	Confident	87.8	Confident	68 Å²	68	67 Å²	67	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-70.2	-40.7	178.9	-62.6	-29.6	0	0	0	110.1	K837 K842 K843 R844	K837-D840 HydrophobicContact CB-CB 4.45Å; K837-D840 WeakPolarHBondContact CB-OD2 3.26Å; K837-D840 PolarHBondContact O-N 3.03Å; D840-K842 PolarHBondContact O-N 2.94Å; D840-K843 WeakPolarHBondContact O-CB 3.41Å; D840-K843 PolarHBondContact O-N 2.91Å; D840-R844 WeakPolarHBondContact O-CG 3.24Å; D840-R844 PolarHBondContact O-N 3.21Å
841	L	88.8	Confident	88.2	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-63.6	-41.6	176.9	-169.9	50.3	0	0	0	111.9	I805 I809 M825 V828 V836 K837 P838 K843 R844 I845	I805-L841 HydrophobicContact CG2-CD1 3.47Å; I805-L841 VanDerWaalsContact CG2-CD1 3.47Å; I809-L841 HydrophobicContact CD1-CD1 3.74Å; I809-L841 HydrophobicContact CG1-CD1 4.33Å; M825-L841 HydrophobicContact CE-CB 4.26Å; M825-L841 HydrophobicContact CE-CD2 3.52Å; M825-L841 HydrophobicContact CE-CG 4.1Å; M825-L841 HydrophobicContact SD-CB 4.34Å; M825-L841 HydrophobicContact SD-CD2 3.2Å; M825-L841 WeakPolarHBondContact SD-CD2 3.37Å; M825-L841 HydrophobicContact SD-CG 3.61Å; V828-L841 HydrophobicContact CB-CD2 4.34Å; V828-L841 HydrophobicContact CG1-CD1 3.99Å; V828-L841 HydrophobicContact CG1-CD2 3.94Å; V836-L841 HydrophobicContact CG1-CB 3.96Å; K837-L841 PolarHBondContact O-N 2.85Å; K837-L841 VanDerWaalsContact O-N 3.11Å; P838-L841 PolarHBondContact O-N 3.29Å; L841-K843 PolarHBondContact O-N 3.43Å; L841-R844 PolarHBondContact O-N 2.85Å; L841-I845 HydrophobicContact CG-CD1 4.5Å; L841-I845 WeakPolarHBondContact O-CG1 3.44Å; L841-I845 PolarHBondContact O-N 3.31Å
842	K	89.2	Confident	88.5	Confident	117 Å²	117	68.1 Å²	68.1	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-58.7	-47.4	172.8	-174	177	179.2	-179.6	0	111.5	P838 D840 R844 I845 E846	P838-K842 PolarHBondContact O-N 3.46Å; D840-K842 PolarHBondContact O-N 2.94Å; K842-R844 VanDerWaalsContact C-N 3.27Å; K842-R844 PolarHBondContact O-N 3.27Å; K842-I845 PolarHBondContact O-N 3.02Å; K842-I845 VanDerWaalsContact O-N 3.17Å; K842-E846 WeakPolarHBondContact O-CG 3.48Å; K842-E846 PolarHBondContact O-N 3.28Å
843	K	91.9	Very high	88.8	Confident	143 Å²	143	71.7 Å²	71.7	62%	0.622	36%	0.357	S	S	*	.	H	α-helix	trans	-57.9	-39.3	175.9	-72.9	175.6	179.5	179.3	0	112.3	A839 D840 L841 S847	A839-K843 WeakPolarHBondContact O-CG 3.18Å; A839-K843 PolarHBondContact O-N 3.42Å; A839-K843 VanDerWaalsContact O-N 3.11Å; D840-K843 WeakPolarHBondContact O-CB 3.41Å; D840-K843 PolarHBondContact O-N 2.91Å; L841-K843 PolarHBondContact O-N 3.43Å; K843-S847 WeakPolarHBondContact O-CB 3.41Å; K843-S847 PolarHBondContact O-N 2.97Å
844	R	93.4	Very high	89.8	Confident	41 Å²	41	64.5 Å²	64.5	16%	0.155	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-39.9	176.6	-63.7	-39.9	-54.1	167.8	17.7	112.4	I805 D806 I809 D840 L841 K842 S847 L848	I805-R844 HydrophobicContact CB-CG 4.32Å; I805-R844 HydrophobicContact CG2-CB 3.87Å; I805-R844 HydrophobicContact CG2-CG 3.73Å; D806-R844 IonicContact OD1-CZ 2.79Å; D806-R844 VanDerWaalsContact OD1-CZ 3.3Å; D806-R844 IonicContact OD1-NE 3.28Å; D806-R844 PolarHBondContact OD1-NE 3.25Å; D806-R844 IonicContact OD1-NH2 3.37Å; D806-R844 PolarHBondContact OD1-NH2 3.45Å; D806-R844 IonicContact OD2-CZ 3.24Å; D806-R844 IonicContact OD2-NE 2.66Å; D806-R844 IonicContact OD2-NH2 3.19Å; D806-R844 PolarHBondContact OD2-NH2 3.2Å; I809-R844 HydrophobicContact CD1-CB 4.24Å; D840-R844 WeakPolarHBondContact O-CG 3.24Å; D840-R844 PolarHBondContact O-N 3.21Å; L841-R844 PolarHBondContact O-N 2.85Å; K842-R844 VanDerWaalsContact C-N 3.27Å; K842-R844 PolarHBondContact O-N 3.27Å; R844-S847 PolarHBondContact NH2-OG 3.36Å; R844-S847 PolarHBondContact O-N 3.44Å; R844-L848 WeakPolarHBondContact O-CG 3.32Å; R844-L848 PolarHBondContact O-N 2.86Å
845	I	92.4	Very high	90.3	Very high	1 Å²	1	67.9 Å²	67.9	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-48.3	175.2	-67.3	167.4	0	0	0	110.8	I809 L824 M825 L841 K842 S847 L848 I849 M854 Y864	I809-I845 HydrophobicContact CD1-CG1 4.08Å; L824-I845 HydrophobicContact CD2-CD1 4.13Å; M825-I845 HydrophobicContact SD-CD1 4.45Å; L841-I845 HydrophobicContact CG-CD1 4.5Å; L841-I845 WeakPolarHBondContact O-CG1 3.44Å; L841-I845 PolarHBondContact O-N 3.31Å; K842-I845 PolarHBondContact O-N 3.02Å; K842-I845 VanDerWaalsContact O-N 3.17Å; I845-S847 VanDerWaalsContact C-N 3.29Å; I845-S847 PolarHBondContact O-N 3.45Å; I845-L848 PolarHBondContact O-N 3.2Å; I845-I849 HydrophobicContact CG2-CD1 3.93Å; I845-I849 WeakPolarHBondContact O-CG1 3.29Å; I845-I849 PolarHBondContact O-N 2.85Å; I845-M854 HydrophobicContact CG2-CE 4.16Å; I845-M854 HydrophobicContact CG2-SD 4.39Å; I845-Y864 HydrophobicContact CG2-CD1 4.44Å; I845-Y864 HydrophobicContact CG2-CE1 3.79Å; I845-Y864 HydrophobicContact CG2-CE2 4.45Å
846	E	92.9	Very high	91	Very high	60 Å²	60	68.3 Å²	68.3	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-43.3	176.9	-54.8	-61.7	178.4	0	0	110.7	K842 L848 I849 D850 R856	K842-E846 WeakPolarHBondContact O-CG 3.48Å; K842-E846 PolarHBondContact O-N 3.28Å; E846-L848 PolarHBondContact O-N 2.93Å; E846-I849 WeakPolarHBondContact O-CB 3.42Å; E846-I849 PolarHBondContact O-N 3.43Å; E846-D850 VanDerWaalsContact O-CG 3.27Å; E846-D850 PolarHBondContact O-N 3.06Å; E846-R856 IonicContact OE1-CZ 2.71Å; E846-R856 IonicContact OE1-NH2 3.67Å; E846-R856 PolarHBondContact OE1-NH2 3.5Å; E846-R856 IonicContact OE2-CZ 2.68Å; E846-R856 IonicContact OE2-NE 2.89Å; E846-R856 IonicContact OE2-NH2 3.62Å; E846-R856 PolarHBondContact OE2-NH2 3.39Å
847	S	93.8	Very high	91.4	Very high	34 Å²	34	69.6 Å²	69.6	24%	0.238	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-27	176	178	0	0	0	0	114	K843 R844 I845 R851	K843-S847 WeakPolarHBondContact O-CB 3.41Å; K843-S847 PolarHBondContact O-N 2.97Å; R844-S847 PolarHBondContact NH2-OG 3.36Å; R844-S847 PolarHBondContact O-N 3.44Å; I845-S847 VanDerWaalsContact C-N 3.29Å; I845-S847 PolarHBondContact O-N 3.45Å; S847-R851 WeakPolarHBondContact O-CB 3.28Å; S847-R851 VanDerWaalsContact O-CG 3.27Å; S847-R851 WeakPolarHBondContact O-CG 3.26Å; S847-R851 PolarHBondContact O-N 3.47Å; S847-R851 PolarHBondContact O-NE 2.93Å
848	L	94.6	Very high	91.3	Very high	1 Å²	1	71.8 Å²	71.8	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-81.3	-28.9	174.4	-75	168.6	0	0	0	112.2	I809 V810 R844 I845 E846 D852 Y853 M854	I809-L848 HydrophobicContact CB-CD1 3.68Å; I809-L848 HydrophobicContact CD1-CD1 3.76Å; I809-L848 HydrophobicContact CG1-CD1 4.36Å; I809-L848 HydrophobicContact CG2-CD1 3.48Å; I809-L848 VanDerWaalsContact CG2-CD1 3.48Å; V810-L848 HydrophobicContact CG2-CD1 4.3Å; V810-L848 HydrophobicContact CG2-CD2 3.63Å; R844-L848 WeakPolarHBondContact O-CG 3.32Å; R844-L848 PolarHBondContact O-N 2.86Å; I845-L848 PolarHBondContact O-N 3.2Å; E846-L848 PolarHBondContact O-N 2.93Å; L848-D852 PolarHBondContact O-N 3.49Å; L848-Y853 HydrophobicContact CD2-CD2 4.03Å; L848-Y853 HydrophobicContact CD2-CG 4.02Å; L848-Y853 PolarHBondContact O-N 2.96Å; L848-M854 HydrophobicContact CB-CG 4.07Å; L848-M854 HydrophobicContact CB-SD 3.99Å; L848-M854 HydrophobicContact CD1-SD 4.34Å
849	I	93.4	Very high	91.4	Very high	32 Å²	32	76.9 Å²	76.9	16%	0.164	37%	0.365	C	S	.	.	H	α-helix	trans	-69.1	-48	171.5	-64.8	164.5	0	0	0	110.3	I845 E846 R851 D852 M854 R856 Y864	I845-I849 HydrophobicContact CG2-CD1 3.93Å; I845-I849 WeakPolarHBondContact O-CG1 3.29Å; I845-I849 PolarHBondContact O-N 2.85Å; E846-I849 WeakPolarHBondContact O-CB 3.42Å; E846-I849 PolarHBondContact O-N 3.43Å; I849-R851 PolarHBondContact O-N 3.44Å; I849-R851 VanDerWaalsContact O-N 3.09Å; I849-D852 PolarHBondContact O-N 2.89Å; I849-M854 VanDerWaalsContact CA-O 3.27Å; I849-M854 WeakPolarHBondContact CA-O 3.47Å; I849-M854 HydrophobicContact CG1-CG 3.91Å; I849-M854 WeakPolarHBondContact CG1-O 3.39Å; I849-R856 HydrophobicContact CD1-CG 4.02Å; I849-Y864 HydrophobicContact CD1-CD1 4.39Å; I849-Y864 HydrophobicContact CD1-CE1 4.1Å
850	D	93.5	Very high	91.5	Very high	131 Å²	131	76.9 Å²	76.9	70%	0.701	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.4	178.2	-64.4	-22.8	0	0	0	113.2	E846	E846-D850 VanDerWaalsContact O-CG 3.27Å; E846-D850 PolarHBondContact O-N 3.06Å
851	R	93.6	Very high	91.3	Very high	107 Å²	107	77.2 Å²	77.2	40%	0.404	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	12.3	177.3	-69.8	-175.4	-65.4	161.9	-6.7	113.2	D806 S847 I849 Y853	D806-R851 IonicContact OD1-NH2 3.69Å; D806-R851 IonicContact OD2-CZ 2.8Å; D806-R851 IonicContact OD2-NH1 2.64Å; D806-R851 IonicContact OD2-NH2 3.38Å; D806-R851 PolarHBondContact OD2-NH2 3.35Å; S847-R851 WeakPolarHBondContact O-CB 3.28Å; S847-R851 VanDerWaalsContact O-CG 3.27Å; S847-R851 WeakPolarHBondContact O-CG 3.26Å; S847-R851 PolarHBondContact O-N 3.47Å; S847-R851 PolarHBondContact O-NE 2.93Å; I849-R851 PolarHBondContact O-N 3.44Å; I849-R851 VanDerWaalsContact O-N 3.09Å; R851-Y853 HydrophobicContact CB-CD2 3.75Å; R851-Y853 HydrophobicContact CB-CE2 4.03Å; R851-Y853 WeakPolarHBondContact O-CD2 3.36Å; R851-Y853 PolarHBondContact O-N 3.44Å
852	D	92.1	Very high	91.4	Very high	121 Å²	121	82 Å²	82	65%	0.647	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	25.5	177	-56.9	-52.8	0	0	0	115.1	L848 I849	L848-D852 PolarHBondContact O-N 3.49Å; I849-D852 PolarHBondContact O-N 2.89Å
853	Y	91.3	Very high	91.6	Very high	95 Å²	95	79.4 Å²	79.4	37%	0.373	38%	0.38	S	S	.	.	S	Bend	trans	-79.5	-28.1	173	-79.8	-89.8	0	0	0	112.4	V810 L848 R851 Y866 V867 A868	V810-Y853 HydrophobicContact CG1-CD1 4.06Å; V810-Y853 HydrophobicContact CG1-CE1 4.41Å; V810-Y853 HydrophobicContact CG2-CD1 3.82Å; V810-Y853 HydrophobicContact CG2-CE1 4.41Å; V810-Y853 HydrophobicContact CG2-CG 4.2Å; L848-Y853 HydrophobicContact CD2-CD2 4.03Å; L848-Y853 HydrophobicContact CD2-CG 4.02Å; L848-Y853 PolarHBondContact O-N 2.96Å; R851-Y853 HydrophobicContact CB-CD2 3.75Å; R851-Y853 HydrophobicContact CB-CE2 4.03Å; R851-Y853 WeakPolarHBondContact O-CD2 3.36Å; R851-Y853 PolarHBondContact O-N 3.44Å; Y853-Y866 VanDerWaalsContact O-CD2 3.3Å; Y853-Y866 WeakPolarHBondContact O-CD2 3.48Å; Y853-V867 PolarHBondContact O-N 3.32Å; Y853-A868 HydrophobicContact CD1-CB 4.27Å
854	M	93.2	Very high	91.7	Very high	4 Å²	4	72.8 Å²	72.8	2%	0.02	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	158	-179.6	59.5	-170.7	-65.1	0	0	109.9	I809 M813 L824 I845 L848 I849 Y864 N865	I809-M854 HydrophobicContact CG2-SD 3.78Å; M813-M854 HydrophobicContact CE-CE 4.16Å; M813-M854 HydrophobicContact CG-CE 4.06Å; M813-M854 HydrophobicContact CG-SD 4.24Å; M813-M854 HydrophobicContact SD-CE 4.09Å; L824-M854 HydrophobicContact CD2-CE 4.16Å; I845-M854 HydrophobicContact CG2-CE 4.16Å; I845-M854 HydrophobicContact CG2-SD 4.39Å; L848-M854 HydrophobicContact CB-CG 4.07Å; L848-M854 HydrophobicContact CB-SD 3.99Å; L848-M854 HydrophobicContact CD1-SD 4.34Å; I849-M854 VanDerWaalsContact CA-O 3.27Å; I849-M854 WeakPolarHBondContact CA-O 3.47Å; I849-M854 HydrophobicContact CG1-CG 3.91Å; I849-M854 WeakPolarHBondContact CG1-O 3.39Å; M854-Y864 HydrophobicContact CE-CD1 3.71Å; M854-Y864 HydrophobicContact CE-CD2 3.98Å; M854-Y864 HydrophobicContact CE-CE1 4.47Å; M854-Y864 HydrophobicContact CE-CG 3.43Å; M854-Y864 VanDerWaalsContact CE-CG 3.43Å; M854-N865 CarbonylContact C-O 3.59Å; M854-N865 WeakPolarHBondContact CA-O 3.32Å; M854-N865 WeakPolarHBondContact CB-O 3.45Å
855	E	92.8	Very high	91.7	Very high	82 Å²	82	72.1 Å²	72.1	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	162.3	175.4	67	-177.7	-169.6	0	0	110.8	Y864 N865 V867	E855-Y864 CarbonylContact O-C 3.51Å; E855-Y864 VanDerWaalsContact O-CA 3.27Å; E855-Y864 WeakPolarHBondContact O-CA 3.5Å; E855-N865 HydrophobicContact CG-CB 4.03Å; E855-N865 PolarHBondContact N-O 3.08Å; E855-N865 PolarHBondContact O-N 3.22Å; E855-V867 HydrophobicContact CB-CG2 3.73Å; E855-V867 HydrophobicContact CG-CG2 3.46Å; E855-V867 VanDerWaalsContact CG-CG2 3.46Å
856	R	93.8	Very high	91.8	Very high	88 Å²	88	74.1 Å²	74.1	33%	0.332	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	141.6	168.5	-68.7	175.5	-174.9	-95.6	2.7	109	E846 I849 S861 Y864	E846-R856 IonicContact OE1-CZ 2.71Å; E846-R856 IonicContact OE1-NH2 3.67Å; E846-R856 PolarHBondContact OE1-NH2 3.5Å; E846-R856 IonicContact OE2-CZ 2.68Å; E846-R856 IonicContact OE2-NE 2.89Å; E846-R856 IonicContact OE2-NH2 3.62Å; E846-R856 PolarHBondContact OE2-NH2 3.39Å; I849-R856 HydrophobicContact CD1-CG 4.02Å; R856-S861 PolarHBondContact NH1-O 3.4Å; R856-Y864 HydrophobicContact CG-CD1 4Å; R856-Y864 HydrophobicContact CG-CE1 3.85Å
857	D	91.9	Very high	91.6	Very high	43 Å²	43	74.5 Å²	74.5	23%	0.23	36%	0.364	C	S	.	.			trans	-60.9	145.2	173.5	-167.9	-86.4	0	0	0	111	E859 N860 Q863 N865	D857-E859 VanDerWaalsContact C-N 3.3Å; D857-E859 PolarHBondContact O-N 2.89Å; D857-E859 PolarHBondContact OD1-N 3.35Å; D857-N860 PolarHBondContact OD1-N 3.17Å; D857-Q863 HydrophobicContact CB-CB 3.88Å; D857-Q863 HydrophobicContact CB-CG 4.13Å; D857-Q863 PolarHBondContact N-O 3.48Å; D857-N865 PolarHBondContact OD2-ND2 3.38Å
858	K	85.2	Confident	90.6	Very high	194 Å²	194	77.4 Å²	77.4	84%	0.843	39%	0.391	S	S	*	.	S	Bend	trans	-69.9	-28.1	-174.3	-65.2	-179.5	-177.9	175.9	0	112.6
859	E	87.3	Confident	90.4	Very high	190 Å²	190	81.3 Å²	81.3	89%	0.888	41%	0.41	S	S	*	.	S	Bend	trans	-103.9	-24.5	-177.6	-59.5	-168.8	175.8	0	0	112.1	D857	D857-E859 VanDerWaalsContact C-N 3.3Å; D857-E859 PolarHBondContact O-N 2.89Å; D857-E859 PolarHBondContact OD1-N 3.35Å
860	N	89.4	Confident	90.3	Very high	61 Å²	61	83.8 Å²	83.8	33%	0.326	42%	0.423	S	S	.	.			trans	-132.8	106.7	-176.1	-173.3	-2.7	0	0	0	113.6	D857 N862 Q863	D857-N860 PolarHBondContact OD1-N 3.17Å; N860-N862 PolarHBondContact O-N 3.07Å; N860-N862 WeakPolarHBondContact OD1-CB 3.29Å; N860-N862 PolarHBondContact OD1-N 3.31Å; N860-Q863 HydrophobicContact CB-CB 4.11Å; N860-Q863 PolarHBondContact O-N 3.28Å
861	S	83.3	Confident	90.1	Very high	75 Å²	75	81.2 Å²	81.2	52%	0.524	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.7	178.9	65	0	0	0	0	115.1	R856 Q863	R856-S861 PolarHBondContact NH1-O 3.4Å; S861-Q863 VanDerWaalsContact C-N 3.33Å
862	N	89.9	Confident	89.9	Confident	103 Å²	103	79.7 Å²	79.7	55%	0.551	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	9.3	176.6	-66	-36.5	0	0	0	113	S820 H821 N860	S820-N862 CarbonylContact C-O 3.46Å; S820-N862 WeakPolarHBondContact CA-O 3.38Å; H821-N862 PolarHBondContact N-O 3.1Å; N860-N862 PolarHBondContact O-N 3.07Å; N860-N862 WeakPolarHBondContact OD1-CB 3.29Å; N860-N862 PolarHBondContact OD1-N 3.31Å
863	Q	92.8	Very high	89.7	Confident	61 Å²	61	77.1 Å²	77.1	29%	0.285	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.5	-179.2	-172.2	166.7	-3.7	0	0	110	T818 D857 N860 S861	T818-Q863 HydrophobicContact CG2-CG 3.82Å; D857-Q863 HydrophobicContact CB-CB 3.88Å; D857-Q863 HydrophobicContact CB-CG 4.13Å; D857-Q863 PolarHBondContact N-O 3.48Å; N860-Q863 HydrophobicContact CB-CB 4.11Å; N860-Q863 PolarHBondContact O-N 3.28Å; S861-Q863 VanDerWaalsContact C-N 3.33Å
864	Y	95.1	Very high	89.6	Confident	5 Å²	5	75.9 Å²	75.9	2%	0.02	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143.3	179.9	-56.5	-71.8	0	0	0	110.5	M813 T818 L819 H821 L824 I845 I849 M854 E855 R856	M813-Y864 WeakPolarHBondContact CE-O 3.44Å; T818-Y864 VanDerWaalsContact CA-O 3.3Å; T818-Y864 WeakPolarHBondContact CA-O 3.43Å; L819-Y864 PolarHBondContact N-O 3.46Å; L819-Y864 PolarHBondContact O-N 3.23Å; H821-Y864 HydrophobicContact CB-CE2 3.79Å; H821-Y864 AromaticContact ND1-CE2 3.5Å; H821-Y864 AromaticContact ND1-CZ 3.73Å; H821-Y864 PolarHBondContact ND1-OH 3.45Å; L824-Y864 HydrophobicContact CD2-CD2 3.98Å; L824-Y864 HydrophobicContact CD2-CE2 4.27Å; I845-Y864 HydrophobicContact CG2-CD1 4.44Å; I845-Y864 HydrophobicContact CG2-CE1 3.79Å; I845-Y864 HydrophobicContact CG2-CE2 4.45Å; I849-Y864 HydrophobicContact CD1-CD1 4.39Å; I849-Y864 HydrophobicContact CD1-CE1 4.1Å; M854-Y864 HydrophobicContact CE-CD1 3.71Å; M854-Y864 HydrophobicContact CE-CD2 3.98Å; M854-Y864 HydrophobicContact CE-CE1 4.47Å; M854-Y864 HydrophobicContact CE-CG 3.43Å; M854-Y864 VanDerWaalsContact CE-CG 3.43Å; E855-Y864 CarbonylContact O-C 3.51Å; E855-Y864 VanDerWaalsContact O-CA 3.27Å; E855-Y864 WeakPolarHBondContact O-CA 3.5Å; R856-Y864 HydrophobicContact CG-CD1 4Å; R856-Y864 HydrophobicContact CG-CE1 3.85Å
865	N	92.9	Very high	89.4	Confident	26 Å²	26	81.1 Å²	81.1	14%	0.139	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.3	175.4	-64.7	-43.9	0	0	0	109.6	K817 T818 M854 E855 D857	K817-N865 CarbonylContact O-C 3.52Å; K817-N865 WeakPolarHBondContact O-CA 3.44Å; T818-N865 WeakPolarHBondContact CB-OD1 3.33Å; T818-N865 WeakPolarHBondContact CG2-OD1 3.41Å; T818-N865 PolarHBondContact OG1-OD1 3.05Å; M854-N865 CarbonylContact C-O 3.59Å; M854-N865 WeakPolarHBondContact CA-O 3.32Å; M854-N865 WeakPolarHBondContact CB-O 3.45Å; E855-N865 HydrophobicContact CG-CB 4.03Å; E855-N865 PolarHBondContact N-O 3.08Å; E855-N865 PolarHBondContact O-N 3.22Å; D857-N865 PolarHBondContact OD2-ND2 3.38Å
866	Y	94.1	Very high	89.1	Confident	43 Å²	43	81 Å²	81	17%	0.169	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.2	177.6	177.9	-102.7	0	0	0	110.6	M813 K814 K817 Y853 A868	M813-Y866 HydrophobicContact CB-CD2 3.79Å; M813-Y866 HydrophobicContact CB-CG 4.36Å; M813-Y866 WeakPolarHBondContact O-CB 3.14Å; K814-Y866 HydrophobicContact CB-CD2 4.36Å; K814-Y866 HydrophobicContact CB-CE1 4.15Å; K814-Y866 HydrophobicContact CB-CE2 3.88Å; K814-Y866 HydrophobicContact CG-CE1 4.08Å; K817-Y866 HydrophobicContact CD-CD1 4.1Å; K817-Y866 WeakPolarHBondContact O-CB 3.33Å; K817-Y866 PolarHBondContact O-N 3.36Å; Y853-Y866 VanDerWaalsContact O-CD2 3.3Å; Y853-Y866 WeakPolarHBondContact O-CD2 3.48Å; Y866-A868 WeakPolarHBondContact CE1-O 3.47Å; Y866-A868 HydrophobicContact CE2-CB 4.23Å; Y866-A868 PolarHBondContact OH-O 3.02Å
867	V	88.5	Confident	88.7	Confident	68 Å²	68	80.4 Å²	80.4	41%	0.412	43%	0.432	S	S	.	.			trans	-115.1	-20.4	-166.8	-176.3	0	0	0	0	113.6	Y853 E855	Y853-V867 PolarHBondContact O-N 3.32Å; E855-V867 HydrophobicContact CB-CG2 3.73Å; E855-V867 HydrophobicContact CG-CG2 3.46Å; E855-V867 VanDerWaalsContact CG-CG2 3.46Å
868	A	74.4	Confident	88.4	Confident	96 Å²	96	83.8 Å²	83.8	79%	0.793	45%	0.45	S	S	*	.			trans	-90.9	0	-168.7	0	0	0	0	0	117.3	Y853 Y866	Y853-A868 HydrophobicContact CD1-CB 4.27Å; Y866-A868 WeakPolarHBondContact CE1-O 3.47Å; Y866-A868 HydrophobicContact CE2-CB 4.23Å; Y866-A868 PolarHBondContact OH-O 3.02Å

Retrieved 868 of 868 residues in 858.2 ms (Link to these results)

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