A0A096NWD9_PAPAN Loading...

Helicase POLQ-like

Single-stranded 3'-5' DNA helicase that plays a key role in homology-driven double-strand break (DSB) repair. Involved in different DSB repair mechanisms that are guided by annealing of extensive stretches of complementary bases at break ends, such as microhomology-mediated end-joining (MMEJ), single-strand annealing (SSA) or synthesis-dependent strand annealing (SDSA). Possesses both DNA unwinding and annealing activities. Forms a complex with RAD51, stimulating HELQ DNA helicase activity and ability to unwing DNA. Efficiently unwinds substrates containing 3' overhangs or a D-loop. In contrast, interaction with the replication protein A (RPA/RP-A) complex inhibits DNA unwinding by HELQ but strongly stimulates DNA strand annealing. Triggers displacement of RPA from single-stranded DNA to facilitate annealing of complementary sequences.

AlphaFold DB , UniProt , Accession A0A096NWD9, Species PAPAN (Papio anubis, Olive baboon), Gene HELQ, Length 1,101 aa.

						>A0A096NWD9_PAPAN|A0A096NWD9|HELQ
MDEGGSRIRRRVSLPKRNRPSLGCIFVAPTAAELEPGDEGKEEEEMVAENRRRKTAGVLPVEVQPLLLSDSPECLVLGGGDTNPDLLRRMPTDRGVGDQHNDSEEDMFGDYDSFTENSFIAPVDDLEQKYMQLPEHKKHATDFATENLYSESIKNKLSITTIGNLTELQTDKHTENQSGYEGVTVEPGADLLYDVPSSQAIYFENLQKSSNDLGNCSMKERDWKSSSHNTVNEELPHNCIEQPQQNDETSSKVRNSSDMNRRKSIKDHLKSAMTGNAKAQTPIFSRSKQLKDTLLSEEINVAKKTIESSSNDLGPFYSLPSKVRDLYAQFKGIEKLYEWQHTCLTLNSVQERKNLIYSLPTSGGKTLVAEILMLQELLCCRKDVLMILPYVAIVQEKISGLSSFGVELGFFVEEYAGSKGRFPPTKRREKKSLYIATIEKGHSLVNSLIETGRIDSLGLVVVDELHMIGEGSRGATLEMTLAKILYTSRTTQIIGMSATLNNVEDLQKFLQAEYYTSQFRPVELKEYLKINDTIYEIDSKAENGMTFSRLLNYKYSDTLKKMDPDHLVALVTEVIPNYSCLVFCPSKKNCENVAEMICKFLSKEYLKHKEKEKCEVIKNLKNIGNGNLCPVLKRTIPFGVAYHHSGLTSDERKLLEEAYSTGVLCLFTCTSTLAAGVNLPARRVILRAPYVAKEFLKRNQYKQMIGRAGRAGIDTIGESILILQEKDKQQILELITRPLENCYSHLVQEFTKGIQTLFLSLIGLKIATNLDDIYHFMNGTFFGVQQKILLKEKSLWEITVESLRYLTEKGLLQKDTICKSEEEVQYNFHITKLGRASFKGTIDLAYCDILYRDLKKGLEGLVLESLLHLIYLTTPYDLVSQSNPDWMIYFRQFSQLSPAEQNVAAILGVSESFLGKKASGQAIRKKVDKDIVNRLYLSFVLYTLLKETNIWTVSEKFNMPRGYIQNLLTGAASFSSCVLHFCEELEEFWVYRALLVELTKKLTYCVKAELIPLMEVTGVLEGRARQLYSAGYKSLMHLANANPEVLIKTIDHLSRRQAKQIIASAKMLLHEKAEALQEEVEELLRLPSDFPGAVASSTDKA
					

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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	28.7	Very low	31.1	Very low	222 Å²	222	177.5 Å²	177.5	100%	1.094	88%	0.875	S	S	*	*				0	92.9	0	-74.9	177.5	170.9	0	0	110
2	D	32.1	Very low	30.8	Very low	142 Å²	142	174.8 Å²	174.8	76%	0.759	88%	0.875	S	S	*	*			cis	-168.6	-179.4	-37.9	-93.1	-31.6	0	0	0	108.7
3	E	36.9	Very low	30.5	Very low	195 Å²	195	168.7 Å²	168.7	91%	0.911	86%	0.859	S	S	*	*			trans	71.7	133.9	-177.6	-48.6	-172.7	173	0	0	113.9
4	G	29.2	Very low	30.6	Very low	81 Å²	81	168.1 Å²	168.1	84%	0.835	86%	0.858	S	S	*	*			cis	116.7	135.1	2.6	0	0	0	0	0	111.5
5	G	29.6	Very low	30.9	Very low	75 Å²	75	165.1 Å²	165.1	77%	0.773	85%	0.854	S	S	*	*			cis	153.4	78.8	-6.2	0	0	0	0	0	114.1
6	S	30.7	Very low	30.8	Very low	106 Å²	106	165.9 Å²	165.9	74%	0.741	85%	0.849	S	S	*	*			trans	-161.8	126.2	165	-89.9	0	0	0	0	111
7	R	33.6	Very low	30.8	Very low	235 Å²	235	168.9 Å²	168.9	89%	0.887	85%	0.847	S	S	*	*				77.3	120.9	66.3	-74.6	176.2	174.2	-174.3	1.7	113.6
8	I	32.1	Very low	30.6	Very low	176 Å²	176	167.6 Å²	167.6	90%	0.903	84%	0.843	S	S	*	*				-155.9	150.4	124.9	-103.8	155.6	0	0	0	109
9	R	31.8	Very low	30.7	Very low	234 Å²	234	170.7 Å²	170.7	88%	0.883	84%	0.844	S	S	*	*			trans	-105.1	154.2	179.9	-65.1	168.3	166	167.8	-7.3	110.3
10	R	29.2	Very low	31.2	Very low	253 Å²	253	168.3 Å²	168.3	96%	0.955	84%	0.841	S	S	*	*				-160.8	154.7	127.8	-110.9	162.9	-171.7	-176.4	2	113.2
11	R	28.2	Very low	31.1	Very low	233 Å²	233	164.7 Å²	164.7	88%	0.879	83%	0.832	S	S	*	*			trans	-87.8	161.5	170.2	-61.2	169.7	171.6	165.4	-6.5	109.2
12	V	27.6	Very low	31.2	Very low	146 Å²	146	162.9 Å²	162.9	89%	0.885	83%	0.826	S	S	*	*				178.6	163.9	115.9	150.5	0	0	0	0	109.7
13	S	27.2	Very low	31	Very low	95 Å²	95	159.4 Å²	159.4	66%	0.664	82%	0.824	S	S	*	*			trans	-102.5	156.3	-164.4	53.1	0	0	0	0	115.9
14	L	31.2	Very low	30.5	Very low	160 Å²	160	155.6 Å²	155.6	84%	0.838	82%	0.817	S	S	*	*			trans	33.1	134.9	143.6	-72.9	168.1	0	0	0	120.4
15	P	35.9	Very low	30.4	Very low	123 Å²	123	159.1 Å²	159.1	80%	0.799	82%	0.815	S	S	*	*				-147.8	134.6	102	35.7	-19.2	0	0	0	118.7
16	K	28.7	Very low	30.3	Very low	178 Å²	178	164.1 Å²	164.1	77%	0.774	82%	0.816	S	S	*	*			trans	28.6	138.3	133.6	-72.7	178.3	178.2	172.4	0	123.9
17	R	31.5	Very low	30	Very low	217 Å²	217	164.7 Å²	164.7	82%	0.819	82%	0.815	S	S	*	*			trans	76.8	153.6	145.2	-72.9	178.4	172.6	170.9	-5.2	117.3
18	N	27.3	Very low	30	Very low	146 Å²	146	158.1 Å²	158.1	78%	0.781	81%	0.811	S	S	*	*			cis	-150.7	173.2	7.1	-126.3	6.4	0	0	0	113
19	R	32.2	Very low	30.3	Very low	227 Å²	227	154.7 Å²	154.7	86%	0.857	80%	0.8	S	S	*	*			trans	-87.6	165.3	167.3	-64.3	-179.7	172.7	171.2	-4.8	111.8
20	P	41.2	Very low	30.1	Very low	121 Å²	121	150 Å²	150	79%	0.786	80%	0.798	S	S	*	*				-129.7	166.1	82.2	17.9	3.5	0	0	0	112.9
21	S	28.8	Very low	30.3	Very low	93 Å²	93	142.9 Å²	142.9	65%	0.65	79%	0.793	S	S	*	*			cis	99.1	100.1	6.3	82	0	0	0	0	119.1
22	L	31	Very low	30.3	Very low	184 Å²	184	136.7 Å²	136.7	96%	0.963	79%	0.792	S	S	*	*			trans	-176.5	144.9	153.6	-94.2	150	0	0	0	105.3
23	G	26.5	Very low	30.5	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	79%	0.792	S	S	*	*			cis	124.4	135.6	7.3	0	0	0	0	0	109.5
24	C	26.3	Very low	30.5	Very low	116 Å²	116	142.1 Å²	142.1	78%	0.784	80%	0.801	S	S	*	*			cis	-166.7	-166.4	-3.4	-161.8	0	0	0	0	108.5
25	I	27.4	Very low	30.5	Very low	154 Å²	154	142.8 Å²	142.8	79%	0.79	80%	0.8	S	S	*	*			trans	74.8	145.6	157.1	-66.4	155.2	0	0	0	117.2
26	F	26.9	Very low	31.2	Very low	180 Å²	180	142.4 Å²	142.4	79%	0.789	80%	0.797	S	S	*	*			cis	-175.1	170.8	-33	-137.7	-78.1	0	0	0	108.9
27	V	26.4	Very low	31	Very low	118 Å²	118	137.3 Å²	137.3	72%	0.715	80%	0.795	S	S	*	*			trans	71.7	132.2	160.8	179.1	0	0	0	0	118.4	P29	V27-P29 HydrophobicContact CG1-CG 4.48Å
28	A	33	Very low	30.8	Very low	98 Å²	98	134.1 Å²	134.1	81%	0.81	80%	0.795	S	S	*	*			trans	-123	145.3	152	0	0	0	0	0	108.6
29	P	38.8	Very low	30.9	Very low	103 Å²	103	136 Å²	136	67%	0.669	80%	0.799	S	S	*	*			trans	-130.6	132.8	168.8	36.7	-22.1	0	0	0	115	V27	V27-P29 HydrophobicContact CG1-CG 4.48Å
30	T	27.8	Very low	30.6	Very low	137 Å²	137	128.3 Å²	128.3	84%	0.84	79%	0.79	S	S	*	*			trans	48	137.3	139.2	58.8	0	0	0	0	122.8
31	A	32.3	Very low	29.9	Very low	102 Å²	102	130.8 Å²	130.8	84%	0.843	79%	0.788	S	S	*	*			trans	-76.8	167	162.6	0	0	0	0	0	112.9
32	A	28.2	Very low	29.9	Very low	104 Å²	104	132.1 Å²	132.1	86%	0.86	79%	0.785	S	S	*	*			trans	-144.4	133.2	162.3	0	0	0	0	0	109.6
33	E	31.4	Very low	29.9	Very low	191 Å²	191	131 Å²	131	89%	0.893	77%	0.774	S	S	*	*			trans	-93.8	148.4	165.5	-62.9	170.1	125.6	0	0	108.7
34	L	28	Very low	30	Very low	164 Å²	164	135 Å²	135	86%	0.859	77%	0.774	S	S	*	*			trans	-164.9	99.2	158.6	-112.7	172.9	0	0	0	111.7
35	E	30	Very low	30.2	Very low	173 Å²	173	136.3 Å²	136.3	81%	0.808	77%	0.769	S	S	*	*			trans	47.6	157.7	138.8	-68.5	-69.4	102.7	0	0	123.2
36	P	52	Low	30.3	Very low	115 Å²	115	135.9 Å²	135.9	75%	0.747	77%	0.765	S	S	*	*			trans	-113.6	179.3	-169.1	43.3	-34	0	0	0	115.6
37	G	24	Very low	30.4	Very low	71 Å²	71	133.1 Å²	133.1	73%	0.732	76%	0.763	S	S	*	*			trans	102.5	161.9	164.2	0	0	0	0	0	115.6
38	D	27.4	Very low	30.5	Very low	151 Å²	151	131.7 Å²	131.7	81%	0.807	76%	0.764	S	S	*	*			cis	-163	171.3	-19.1	-148.5	-22.1	0	0	0	109.7
39	E	28.8	Very low	30.4	Very low	185 Å²	185	134.5 Å²	134.5	86%	0.864	76%	0.76	S	S	*	*			trans	62.5	148	166.4	-60.3	-175.8	173.7	0	0	118.5
40	G	26.4	Very low	30	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	75%	0.753	S	S	*	*			cis	170.4	-164.2	-3.4	0	0	0	0	0	112.6
41	K	26.2	Very low	30.1	Very low	173 Å²	173	136.7 Å²	136.7	75%	0.752	75%	0.747	S	S	*	*			trans	76.9	139	171.7	-55.9	-167.5	161.1	-71	0	117.9
42	E	29.3	Very low	30	Very low	122 Å²	122	141.7 Å²	141.7	57%	0.57	74%	0.744	S	S	*	*			cis	-168.8	144.9	-19.9	-119.6	148.2	-155	0	0	110.3
43	E	29.9	Very low	30.2	Very low	160 Å²	160	147.1 Å²	147.1	75%	0.748	74%	0.742	S	S	*	*			trans	60	157.6	140.3	-72.5	167	174.1	0	0	121.2
44	E	30.4	Very low	30.2	Very low	152 Å²	152	147 Å²	147	71%	0.71	74%	0.739	S	S	*	*			cis	-157.7	162.6	6.4	-133.7	-177.3	171.6	0	0	112.9
45	E	30.1	Very low	30.3	Very low	145 Å²	145	145 Å²	145	68%	0.678	73%	0.733	S	S	*	*			trans	56.2	153.5	148.2	-63.2	-125.6	126.4	0	0	122.4
46	M	29.9	Very low	30.3	Very low	144 Å²	144	141.7 Å²	141.7	71%	0.709	74%	0.736	S	S	*	*			cis	-167.3	-179.1	-7.4	-115.3	-77.3	-171.6	0	0	112.9
47	V	27.5	Very low	29	Very low	122 Å²	122	139.5 Å²	139.5	74%	0.739	73%	0.734	S	S	*	*			trans	90.8	97.2	156.7	-162.8	0	0	0	0	121.4
48	A	29.1	Very low	29.2	Very low	89 Å²	89	143 Å²	143	74%	0.736	74%	0.741	S	S	*	*				46.6	155.6	117.4	0	0	0	0	0	123.1
49	E	30.5	Very low	29.4	Very low	157 Å²	157	143.6 Å²	143.6	73%	0.734	74%	0.743	S	S	*	*			cis	-167.8	164.2	-7.6	-135.3	-155.1	146.7	0	0	114
50	N	30.3	Very low	30.4	Very low	97 Å²	97	140 Å²	140	52%	0.519	74%	0.736	S	S	.	*			trans	73.5	125.5	144.1	-94.8	-42.3	0	0	0	126.3
51	R	31	Very low	30.3	Very low	188 Å²	188	142.8 Å²	142.8	71%	0.709	74%	0.74	S	S	*	*				100.9	95.7	128.3	-75.7	166.1	-167.8	-158.6	3.7	125.7
52	R	30.5	Very low	30.2	Very low	208 Å²	208	142.2 Å²	142.2	79%	0.785	74%	0.74	S	S	*	*				80.3	140.8	108.2	-83	-175.3	174.2	176	-2.1	124.4
53	R	30.3	Very low	30	Very low	217 Å²	217	142.5 Å²	142.5	82%	0.819	75%	0.75	S	S	*	*			trans	87	121.8	157.2	-72.6	170.5	177.6	-179.2	-2.3	116.2
54	K	32.8	Very low	29.8	Very low	188 Å²	188	143.2 Å²	143.2	82%	0.817	75%	0.753	S	S	*	*				84.4	137.3	60.8	-81.6	-158.8	172.5	-166	0	111.9
55	T	30.1	Very low	30.6	Very low	122 Å²	122	140.5 Å²	140.5	75%	0.748	75%	0.749	S	S	*	*			cis	-163.8	162	10.7	-2.2	0	0	0	0	113.9
56	A	29	Very low	30.4	Very low	105 Å²	105	141.7 Å²	141.7	87%	0.868	76%	0.759	S	S	*	*			trans	73	142.9	155.4	0	0	0	0	0	119.9
57	G	26	Very low	30.1	Very low	68 Å²	68	141.4 Å²	141.4	70%	0.701	76%	0.759	S	S	*	*			cis	169.2	-179.2	-10	0	0	0	0	0	116.1
58	V	27	Very low	30.1	Very low	146 Å²	146	143 Å²	143	89%	0.885	76%	0.763	S	S	*	*			trans	79.2	100	161.5	-168.1	0	0	0	0	119.2
59	L	32	Very low	29.8	Very low	162 Å²	162	142.9 Å²	142.9	85%	0.848	76%	0.757	S	S	*	*			trans	-84.9	173.5	140.9	-77.1	168.4	0	0	0	108.5
60	P	49.2	Very low	29.5	Very low	111 Å²	111	142.6 Å²	142.6	72%	0.721	76%	0.76	S	S	*	*			cis	-148.5	-145.5	28.2	33.4	-5	0	0	0	115.1
61	V	25.7	Very low	29.5	Very low	122 Å²	122	143.1 Å²	143.1	74%	0.739	77%	0.772	S	S	*	*			trans	86	133.3	161.5	-179.7	0	0	0	0	117.1
62	E	23.8	Very low	30	Very low	162 Å²	162	139.2 Å²	139.2	76%	0.757	77%	0.771	S	S	*	*			cis	-170.6	159.7	-28.2	-118.5	-178.1	157.2	0	0	111.1
63	V	25	Very low	29.8	Very low	128 Å²	128	137.8 Å²	137.8	78%	0.776	77%	0.773	S	S	*	*			trans	62.6	152.6	145.4	175.1	0	0	0	0	121.6
64	Q	24.8	Very low	29.5	Very low	175 Å²	175	133 Å²	133	82%	0.818	77%	0.772	S	S	*	*			trans	-92.3	-145.7	-178.8	-60	172.7	-30.4	0	0	111.8
65	P	47.7	Very low	29.1	Very low	95 Å²	95	132 Å²	132	62%	0.617	77%	0.774	S	S	*	*				-123.1	164.8	-79.3	32.4	-16.1	0	0	0	114.7
66	L	25.5	Very low	29	Very low	170 Å²	170	132 Å²	132	89%	0.89	77%	0.773	S	S	*	*			trans	-142.8	116	152.1	-84	170.4	0	0	0	106.8
67	L	25.1	Very low	29	Very low	137 Å²	137	135.2 Å²	135.2	72%	0.717	78%	0.775	S	S	*	*			cis	80.1	133.8	37.5	-99.2	175.4	0	0	0	116.3
68	L	26	Very low	28.9	Very low	155 Å²	155	135.7 Å²	135.7	81%	0.812	78%	0.78	S	S	*	*			trans	75.5	143.7	171	-56.1	167.4	0	0	0	117.7
69	S	24.3	Very low	28.8	Very low	87 Å²	87	133 Å²	133	61%	0.608	78%	0.781	S	S	*	*			cis	-167.8	-169.5	-20.7	54.4	0	0	0	0	111.6
70	D	24.1	Very low	28.5	Very low	151 Å²	151	128.5 Å²	128.5	81%	0.807	78%	0.775	S	S	*	*			trans	92.2	83.2	155.6	-58	3.5	0	0	0	120
71	S	28.4	Very low	27.4	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	78%	0.779	S	S	*	*			trans	-72	157.7	135.2	63.7	0	0	0	0	110.1
72	P	42.3	Very low	27.4	Very low	106 Å²	106	131 Å²	131	69%	0.688	78%	0.783	S	S	*	*				-156.8	-169.6	71.4	44.4	-23.7	0	0	0	117
73	E	25.8	Very low	27.9	Very low	178 Å²	178	130.8 Å²	130.8	83%	0.832	79%	0.787	S	S	*	*			trans	70.3	126	164	-65.6	173.3	-169.2	0	0	118
74	C	24.7	Very low	28.7	Very low	117 Å²	117	129.8 Å²	129.8	79%	0.791	78%	0.783	S	S	*	*			cis	99.9	106.9	23.1	-70.1	0	0	0	0	115.3
75	L	25.1	Very low	28.8	Very low	167 Å²	167	128 Å²	128	87%	0.874	78%	0.779	S	S	*	*			trans	176.2	98.3	142.5	-95	167.7	0	0	0	106.3
76	V	27.1	Very low	27.8	Very low	120 Å²	120	130.8 Å²	130.8	73%	0.727	79%	0.788	S	S	*	*				84.8	143.2	68.9	172.2	0	0	0	0	113.2
77	L	28.7	Very low	27.8	Very low	174 Å²	174	129.6 Å²	129.6	91%	0.911	78%	0.782	S	S	*	*			trans	85.2	123.5	-172.7	-51	-177.9	0	0	0	115.5
78	G	24.3	Very low	27.8	Very low	78 Å²	78	132.1 Å²	132.1	80%	0.804	78%	0.782	S	S	*	*			cis	158.8	114.6	-13.7	0	0	0	0	0	115
79	G	25.3	Very low	27.7	Very low	88 Å²	88	134.8 Å²	134.8	91%	0.907	78%	0.781	S	S	*	*			trans	82.2	152.4	173.4	0	0	0	0	0	115.3
80	G	25.1	Very low	27.8	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	79%	0.79	S	S	*	*			cis	179.2	146.6	-7.3	0	0	0	0	0	113.6
81	D	25.9	Very low	28.3	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	79%	0.789	S	S	*	*			trans	53.3	119.3	152.2	-60.2	-24.7	0	0	0	123.9
82	T	26.9	Very low	28.1	Very low	135 Å²	135	137.1 Å²	137.1	83%	0.828	79%	0.786	S	S	*	*			trans	76.1	122.5	132.4	59.1	0	0	0	0	123.1
83	N	34	Very low	27.2	Very low	157 Å²	157	137.8 Å²	137.8	84%	0.84	78%	0.784	S	S	*	*			trans	-57.4	162	144.6	-86	-25.8	0	0	0	111.2
84	P	42.4	Very low	27.1	Very low	107 Å²	107	139.7 Å²	139.7	70%	0.695	78%	0.783	S	S	*	*			cis	-149.9	-167.8	36.6	43.1	-21.5	0	0	0	117.1
85	D	25.6	Very low	27	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	78%	0.783	S	S	*	*			trans	35.1	125.4	147.7	-74.5	-40.8	0	0	0	122.7
86	L	26.6	Very low	27	Very low	154 Å²	154	136.9 Å²	136.9	81%	0.806	78%	0.784	S	S	*	*			trans	171.7	119.1	138.6	-93.6	157.7	0	0	0	107.1
87	L	25.6	Very low	26.9	Very low	146 Å²	146	134.5 Å²	134.5	76%	0.764	78%	0.784	S	S	*	*			cis	72.6	130.7	24.6	-117.3	-177.6	0	0	0	115.1
88	R	25	Very low	26.7	Very low	190 Å²	190	133.9 Å²	133.9	72%	0.717	78%	0.781	S	S	*	*			trans	92	142.2	-178.8	-58.5	174.1	176.4	178.2	1.7	115.1
89	R	24.2	Very low	26.7	Very low	210 Å²	210	138.6 Å²	138.6	79%	0.792	78%	0.783	S	S	*	*			cis	-155.5	154.7	3.2	-126.3	165.4	-169.8	174	-0.3	112.6
90	M	26.2	Very low	26.6	Very low	163 Å²	163	142.4 Å²	142.4	80%	0.803	78%	0.777	S	S	*	*			trans	-76.5	167.5	167	-63.1	178.7	170.5	0	0	112.2
91	P	35.4	Very low	26.5	Very low	120 Å²	120	146.3 Å²	146.3	78%	0.779	78%	0.781	S	S	*	*				-133.9	120.7	97.2	13.5	8.3	0	0	0	113.3
92	T	23.6	Very low	26.3	Very low	113 Å²	113	146.3 Å²	146.3	69%	0.693	78%	0.781	S	S	*	*				79.3	111	85.2	60.9	0	0	0	0	118.3
93	D	24.3	Very low	26.2	Very low	121 Å²	121	145.1 Å²	145.1	65%	0.647	78%	0.778	S	S	*	*				90.7	138	129.3	-156.2	20.2	0	0	0	121.1
94	R	23.9	Very low	25.7	Very low	217 Å²	217	146.9 Å²	146.9	82%	0.819	78%	0.781	S	S	*	*			trans	61.4	123	170.2	-38.3	-173.2	-168.7	-172.7	1.2	117.9
95	G	22	Very low	25	Very low	76 Å²	76	147.5 Å²	147.5	78%	0.784	78%	0.775	S	S	*	*			cis	109.5	106.4	4.6	0	0	0	0	0	113.4
96	V	24.8	Very low	25.2	Very low	150 Å²	150	144.2 Å²	144.2	91%	0.909	76%	0.757	S	S	*	*			trans	-157	138.6	152.4	148.7	0	0	0	0	104.4
97	G	24.7	Very low	25.4	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	74%	0.735	S	S	*	*			trans	-91.7	164.7	-176.5	0	0	0	0	0	113.6
98	D	25.4	Very low	25.8	Very low	160 Å²	160	139.4 Å²	139.4	86%	0.856	73%	0.726	S	S	*	*			trans	-141.9	172.5	158.9	-140.1	-30	0	0	0	110.4
99	Q	24.5	Very low	25.9	Very low	178 Å²	178	131.3 Å²	131.3	83%	0.832	70%	0.702	S	S	*	*			trans	-88.3	150	-155.9	-62.7	174.9	-15.6	0	0	115.2
100	H	22.8	Very low	26.2	Very low	168 Å²	168	123.9 Å²	123.9	78%	0.778	68%	0.678	S	S	*	*			trans	-57.6	144	166.9	-72.9	-80.6	0	0	0	111.8
101	N	22.5	Very low	26.5	Very low	151 Å²	151	122.7 Å²	122.7	81%	0.807	67%	0.665	S	S	*	*			trans	-163	49.9	156.2	-110.4	-12.4	0	0	0	112.2	S103	N101-S103 PolarHBondContact O-N 3.22Å; N101-S103 PolarHBondContact O-OG 2.96Å
102	D	22.1	Very low	26	Very low	149 Å²	149	122 Å²	122	80%	0.797	66%	0.655	S	S	*	*			trans	-73.4	110.5	169.6	-58.7	-58.5	0	0	0	108.9
103	S	24.6	Very low	26.2	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	65%	0.654	S	S	*	*			trans	-124.1	76.7	-175.9	36.1	0	0	0	0	110.3	N101 E105	N101-S103 PolarHBondContact O-N 3.22Å; N101-S103 PolarHBondContact O-OG 2.96Å; S103-E105 PolarHBondContact O-N 2.89Å
104	E	24.6	Very low	26.1	Very low	194 Å²	194	124.4 Å²	124.4	91%	0.907	66%	0.663	S	S	*	*			trans	-89.7	84	176.7	-65.8	-168.8	149	0	0	111.9
105	E	27.1	Very low	26.3	Very low	121 Å²	121	120.9 Å²	120.9	57%	0.565	67%	0.665	S	S	*	*			trans	-166.9	119.8	152.2	-125.2	178	-179.3	0	0	113.3	S103 Q748	S103-E105 PolarHBondContact O-N 2.89Å; E105-Q748 PolarHBondContact OE1-NE2 3.14Å; E105-Q748 PolarHBondContact OE2-NE2 3.42Å
106	D	29	Very low	26.4	Very low	67 Å²	67	125.7 Å²	125.7	36%	0.358	67%	0.667	S	S	.	*			trans	-167.7	46	153.1	-152.4	-6.6	0	0	0	112.4	F108 G109 Y111 Q881	D106-F108 PolarHBondContact O-N 3.28Å; D106-G109 PolarHBondContact O-N 2.73Å; D106-Y111 HydrophobicContact CB-CE2 3.89Å; D106-Y111 WeakPolarHBondContact OD2-CE2 3.35Å; D106-Y111 PolarHBondContact OD2-OH 3.41Å; D106-Q881 PolarHBondContact OD2-NE2 3.36Å
107	M	32.1	Very low	26.4	Very low	69 Å²	69	126.6 Å²	126.6	34%	0.34	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76	18.6	-163	-121.3	-73.9	-104.4	0	0	116.7	E694	M107-E694 WeakPolarHBondContact CE-OE2 3.43Å; M107-E694 WeakPolarHBondContact CG-OE1 3.4Å
108	F	33.1	Very low	26.4	Very low	130 Å²	130	127.5 Å²	127.5	57%	0.57	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	13.3	156.6	-81.8	-67.8	0	0	0	113.4	D106	D106-F108 PolarHBondContact O-N 3.28Å
109	G	27.1	Very low	26.2	Very low	20 Å²	20	130.3 Å²	130.3	21%	0.206	67%	0.667	C	S	.	*	S	Bend	trans	-73.4	132.2	164.8	0	0	0	0	0	111.2	D106 Y111	D106-G109 PolarHBondContact O-N 2.73Å; G109-Y111 PolarHBondContact O-N 2.92Å; G109-Y111 VanDerWaalsContact O-N 3.1Å
110	D	30.4	Very low	26.2	Very low	55 Å²	55	129.3 Å²	129.3	29%	0.294	67%	0.666	S	S	.	*			trans	-85.2	77.8	-172.4	-82.1	-53	0	0	0	112.9	K587 S645	D110-K587 VanDerWaalsContact CB-NZ 3.29Å; D110-K587 WeakPolarHBondContact OD1-CE 3.46Å; D110-K587 IonicContact OD1-NZ 3.73Å; D110-K587 PolarHBondContact OD1-NZ 3.24Å; D110-K587 IonicContact OD2-NZ 3.54Å; D110-K587 PolarHBondContact OD2-NZ 3.02Å; D110-S645 VanDerWaalsContact CG-OG 3.25Å; D110-S645 PolarHBondContact OD1-OG 3.46Å; D110-S645 WeakPolarHBondContact OD2-CB 3.01Å; D110-S645 PolarHBondContact OD2-OG 2.82Å
111	Y	32.4	Very low	26.2	Very low	137 Å²	137	125.6 Å²	125.6	54%	0.537	67%	0.665	S	S	.	*			trans	-81.6	127.9	178	-73.2	-92.1	0	0	0	114.3	D106 G109 Q881	D106-Y111 HydrophobicContact CB-CE2 3.89Å; D106-Y111 WeakPolarHBondContact OD2-CE2 3.35Å; D106-Y111 PolarHBondContact OD2-OH 3.41Å; G109-Y111 PolarHBondContact O-N 2.92Å; G109-Y111 VanDerWaalsContact O-N 3.1Å; Y111-Q881 HydrophobicContact CE1-CG 4.49Å; Y111-Q881 HydrophobicContact CE2-CG 4.32Å
112	D	24.9	Very low	26.8	Very low	107 Å²	107	123.5 Å²	123.5	57%	0.572	66%	0.659	S	S	*	*			trans	-170.2	116.1	152.4	-116	-21.3	0	0	0	111.5
113	S	27.2	Very low	26.9	Very low	94 Å²	94	123.4 Å²	123.4	66%	0.657	66%	0.663	S	S	*	*			trans	-160.2	130.8	160	73.3	0	0	0	0	112
114	F	23.3	Very low	26.9	Very low	190 Å²	190	125 Å²	125	83%	0.833	66%	0.663	S	S	*	*			trans	-99.3	148.1	177.3	-77.1	-104.5	0	0	0	112.3
115	T	26.9	Very low	27	Very low	143 Å²	143	123 Å²	123	88%	0.877	66%	0.659	S	S	*	*			trans	-144.1	149.2	141.4	46.3	0	0	0	0	109.4
116	E	25.5	Very low	26.9	Very low	177 Å²	177	125 Å²	125	83%	0.827	67%	0.673	S	S	*	*			trans	-83.3	162.8	-168.6	-57.9	161.8	125.4	0	0	113.9
117	N	24.4	Very low	26.7	Very low	169 Å²	169	131 Å²	131	90%	0.904	70%	0.699	S	S	*	*				-157	143.6	128.6	-107	-45.5	0	0	0	111.3
118	S	23.9	Very low	26.4	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	73%	0.728	S	S	*	*			trans	-85.9	146.8	-167.7	-48.8	0	0	0	0	113.8
119	F	22.4	Very low	26	Very low	218 Å²	218	139.7 Å²	139.7	96%	0.956	74%	0.737	S	S	*	*			trans	-138.6	127.9	143	-93.9	-77.7	0	0	0	109.7
120	I	23.2	Very low	26	Very low	158 Å²	158	148.6 Å²	148.6	81%	0.81	77%	0.766	S	S	*	*			trans	-131.6	153.3	179	-73.1	178.3	0	0	0	107.9
121	A	24.1	Very low	25.8	Very low	90 Å²	90	154.2 Å²	154.2	74%	0.744	79%	0.793	S	S	*	*			trans	86.5	153.1	170.4	0	0	0	0	0	117.2
122	P	34.5	Very low	25.5	Very low	106 Å²	106	156.5 Å²	156.5	69%	0.688	81%	0.808	S	S	*	*			cis	-116.4	146.6	-5.6	37.4	-25.1	0	0	0	114.1
123	V	25.4	Very low	25.5	Very low	147 Å²	147	159.5 Å²	159.5	89%	0.891	82%	0.823	S	S	*	*			trans	-138	106.9	145.9	-178.5	0	0	0	0	106.1
124	D	24.2	Very low	25.9	Very low	143 Å²	143	159.6 Å²	159.6	77%	0.765	82%	0.822	S	S	*	*			trans	-94.3	175.4	168.2	-85.9	-57.6	0	0	0	110.2
125	D	25.5	Very low	25.9	Very low	152 Å²	152	160.1 Å²	160.1	81%	0.813	83%	0.827	S	S	*	*			trans	75	147.5	176	-74.3	-35.4	0	0	0	118.8
126	L	25.1	Very low	25.9	Very low	165 Å²	165	162.1 Å²	162.1	86%	0.864	83%	0.826	S	S	*	*	S	Bend	trans	65	74.4	-179	-65.5	138.1	0	0	0	116.2
127	E	26.2	Very low	25.8	Very low	192 Å²	192	163.1 Å²	163.1	90%	0.897	83%	0.827	S	S	*	*				-172.2	71.9	100.8	-97.8	-171.7	166.9	0	0	113.2
128	Q	24.5	Very low	25.9	Very low	205 Å²	205	163.6 Å²	163.6	96%	0.958	82%	0.822	S	S	*	*			trans	-93.9	92.6	154.5	-78.7	-162.8	7.1	0	0	110.3
129	K	26.1	Very low	26	Very low	177 Å²	177	166.9 Å²	166.9	77%	0.77	83%	0.827	S	S	*	*			trans	-148.7	143.6	159.4	-115.6	171.7	-172.6	172.7	0	111.2
130	Y	26.8	Very low	26.2	Very low	207 Å²	207	160.7 Å²	160.7	81%	0.812	82%	0.816	S	S	*	*	S	Bend	trans	80.6	134	-178.9	-56.8	-73.6	0	0	0	117.7
131	M	25.5	Very low	26.3	Very low	173 Å²	173	158.7 Å²	158.7	85%	0.852	81%	0.811	S	S	*	*			trans	69.9	67.1	166.9	-43.5	-43.2	-80.5	0	0	118.5
132	Q	25.1	Very low	26.4	Very low	185 Å²	185	160.4 Å²	160.4	86%	0.864	81%	0.808	S	S	*	*			trans	-83	151.3	135.2	-69	-176.5	-3.2	0	0	109.7
133	L	26.2	Very low	26	Very low	169 Å²	169	165 Å²	165	89%	0.885	82%	0.817	S	S	*	*				-176	157.9	129.2	-92.4	171.8	0	0	0	107.7
134	P	34.9	Very low	26.2	Very low	97 Å²	97	161.5 Å²	161.5	63%	0.63	80%	0.804	S	S	*	*			trans	-132.6	172.9	-130	42.2	-27.5	0	0	0	116
135	E	23.6	Very low	26.3	Very low	200 Å²	200	160.7 Å²	160.7	94%	0.935	81%	0.805	S	S	*	*			trans	-108.4	147.2	160	-66.5	-165.6	143.6	0	0	111.6
136	H	26.8	Very low	26.4	Very low	185 Å²	185	161 Å²	161	86%	0.856	80%	0.801	S	S	*	*			trans	-100.3	134.5	-167.5	-105.2	-84.7	0	0	0	113.6
137	K	24.4	Very low	26.4	Very low	198 Å²	198	158.3 Å²	158.3	86%	0.861	79%	0.788	S	S	*	*			trans	-76.9	142.1	163.1	-78.8	-173.9	174.9	-178.4	0	112.1
138	K	24.9	Very low	26.4	Very low	180 Å²	180	155.6 Å²	155.6	78%	0.783	78%	0.778	S	S	*	*			trans	174.7	147	143.3	-98.1	165.9	175.5	-171.5	0	108.5
139	H	26.7	Very low	26.4	Very low	157 Å²	157	156.2 Å²	156.2	73%	0.727	77%	0.773	S	S	*	*			cis	-151.1	160.7	8.8	-111.6	-68.7	0	0	0	110.8
140	A	25.9	Very low	26.4	Very low	88 Å²	88	152.1 Å²	152.1	73%	0.727	77%	0.767	S	S	*	*			trans	67	146.6	155.2	0	0	0	0	0	119.1
141	T	27	Very low	26.3	Very low	116 Å²	116	150.5 Å²	150.5	71%	0.712	77%	0.767	S	S	*	*			cis	-148.5	139.1	-5.2	30.5	0	0	0	0	111
142	D	25.1	Very low	26.2	Very low	126 Å²	126	146.6 Å²	146.6	67%	0.674	76%	0.757	S	S	*	*			trans	49	113.9	133	-49.2	-20.2	0	0	0	120.5
143	F	26.7	Very low	26.2	Very low	202 Å²	202	143.9 Å²	143.9	89%	0.886	75%	0.747	S	S	*	*				78.2	137.8	80.1	-79.3	-58.4	0	0	0	114.3
144	A	28.3	Very low	26.2	Very low	74 Å²	74	144.1 Å²	144.1	61%	0.612	74%	0.741	S	S	*	*			cis	-160.9	-164.6	-0.9	0	0	0	0	0	111.6
145	T	27.1	Very low	25.8	Very low	127 Å²	127	145.3 Å²	145.3	78%	0.779	74%	0.742	S	S	*	*			trans	71.6	145.6	164.7	68.6	0	0	0	0	119.9
146	E	27	Very low	25.8	Very low	157 Å²	157	143.6 Å²	143.6	73%	0.734	73%	0.731	S	S	*	*			cis	-161	163.5	-24.3	-117.6	-171.2	144.3	0	0	112.9
147	N	26	Very low	25.7	Very low	110 Å²	110	142.1 Å²	142.1	59%	0.588	73%	0.729	S	S	*	*			trans	52.1	108.4	145.5	-63.6	-28.9	0	0	0	124.2
148	L	25.7	Very low	25.6	Very low	134 Å²	134	136.9 Å²	136.9	70%	0.702	72%	0.717	S	S	*	*				51.4	120.9	110	-63.3	169.8	0	0	0	121.9
149	Y	24.2	Very low	25.6	Very low	218 Å²	218	135.5 Å²	135.5	86%	0.855	72%	0.717	S	S	*	*			trans	63.4	165.1	146.9	-77.2	-103.3	0	0	0	116.5
150	S	26.5	Very low	25.5	Very low	91 Å²	91	134.1 Å²	134.1	64%	0.636	72%	0.719	S	S	*	*			cis	-158.5	162	-2.4	31.7	0	0	0	0	110.6
151	E	24.3	Very low	25.4	Very low	174 Å²	174	135 Å²	135	81%	0.813	72%	0.716	S	S	*	*			trans	65.7	132.1	156.6	-72.6	-179.4	159.7	0	0	118.6
152	S	23.5	Very low	25.3	Very low	91 Å²	91	137.7 Å²	137.7	64%	0.636	72%	0.724	S	S	*	*				77.4	145.5	63.8	115.5	0	0	0	0	113.3
153	I	26.5	Very low	25.3	Very low	127 Å²	127	134.7 Å²	134.7	65%	0.651	72%	0.724	S	S	*	*			cis	-170.4	155.4	-9.4	-124	171.9	0	0	0	107.4
154	K	25.8	Very low	25.3	Very low	174 Å²	174	132.2 Å²	132.2	76%	0.757	72%	0.72	S	S	*	*			trans	66	163.1	169.5	-74.8	157.2	-160.9	159.6	0	115.3
155	N	25	Very low	25.3	Very low	122 Å²	122	135.8 Å²	135.8	65%	0.652	73%	0.727	S	S	*	*			cis	-159.5	156.1	1.7	-125.8	-18	0	0	0	112.3
156	K	25.5	Very low	25.2	Very low	165 Å²	165	135 Å²	135	72%	0.717	72%	0.723	S	S	*	*			trans	62.9	124.8	146.4	-70.3	-170.8	175.9	-172.9	0	119.7
157	L	23.9	Very low	25.3	Very low	153 Å²	153	135.2 Å²	135.2	80%	0.801	72%	0.724	S	S	*	*				62.6	136.2	97.7	-67.1	165.7	0	0	0	114.6
158	S	23.2	Very low	25.3	Very low	89 Å²	89	135.9 Å²	135.9	62%	0.622	73%	0.727	S	S	*	*			cis	-174.4	154.3	7.4	43.6	0	0	0	0	114
159	I	23.9	Very low	25.4	Very low	150 Å²	150	137 Å²	137	77%	0.769	73%	0.728	S	S	*	*			trans	53.4	120.7	145.3	-58.4	158.9	0	0	0	120.3
160	T	24	Very low	25.5	Very low	128 Å²	128	132 Å²	132	79%	0.785	72%	0.721	S	S	*	*			trans	175.6	115.2	137.7	29.4	0	0	0	0	108.8
161	T	24.5	Very low	25.4	Very low	107 Å²	107	133.1 Å²	133.1	66%	0.656	72%	0.72	S	S	*	*				77.3	116.2	76.6	61.4	0	0	0	0	117.8
162	I	25.2	Very low	25.6	Very low	172 Å²	172	132 Å²	132	88%	0.882	71%	0.712	S	S	*	*			trans	67.4	138.5	148	-54.3	161	0	0	0	117.1
163	G	24.7	Very low	25.9	Very low	64 Å²	64	135.2 Å²	135.2	66%	0.66	72%	0.716	S	S	*	*			cis	159	161.6	-8.8	0	0	0	0	0	114.2
164	N	26.3	Very low	25.9	Very low	150 Å²	150	134.1 Å²	134.1	80%	0.802	72%	0.716	S	S	*	*			trans	77.2	128.1	158.4	-73.9	4.8	0	0	0	124.4
165	L	27.9	Very low	26	Very low	148 Å²	148	133.4 Å²	133.4	78%	0.775	72%	0.715	S	S	*	*			trans	62.9	158.2	150.5	-76	79.2	0	0	0	118.3
166	T	26.4	Very low	26.1	Very low	111 Å²	111	132.4 Å²	132.4	68%	0.681	71%	0.71	S	S	*	*			cis	-150.9	167.1	17.8	-21	0	0	0	0	113.3
167	E	27.7	Very low	26.3	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.752	71%	0.712	S	S	*	*			trans	-13.4	165.1	147.5	-68.8	179	148.5	0	0	120.8
168	L	27	Very low	26.6	Very low	125 Å²	125	130.2 Å²	130.2	65%	0.654	71%	0.71	S	S	*	*			cis	-167.9	162	4.9	-118.8	165.6	0	0	0	113.2
169	Q	27.2	Very low	26.8	Very low	157 Å²	157	129 Å²	129	73%	0.734	71%	0.711	S	S	*	*			trans	78.4	124.2	141.5	-107.2	165.8	20.2	0	0	128.2
170	T	26.4	Very low	27.2	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	72%	0.717	S	S	*	*			trans	82.4	129.6	130.7	36.1	0	0	0	0	128.9
171	D	25.3	Very low	27.4	Very low	114 Å²	114	134.8 Å²	134.8	61%	0.61	72%	0.718	S	S	*	*			trans	83.8	110	130.6	-84.3	5.6	0	0	0	127.4
172	K	28.8	Very low	27.6	Very low	149 Å²	149	133.1 Å²	133.1	65%	0.648	72%	0.723	S	S	*	*				82	131	117.5	-76	174.6	-171.8	142.8	0	126
173	H	28.3	Very low	27.9	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.736	71%	0.714	S	S	*	*			trans	68.2	154.8	138.7	-68	-42.3	0	0	0	119.6
174	T	25.9	Very low	27.9	Very low	105 Å²	105	133.1 Å²	133.1	64%	0.644	72%	0.717	S	S	*	*			cis	-161.8	159.6	0.8	4.5	0	0	0	0	112.1
175	E	28.2	Very low	28	Very low	159 Å²	159	132 Å²	132	74%	0.743	72%	0.716	S	S	*	*			trans	65.4	160.8	144.6	-73.4	-173.6	-153.4	0	0	121.7
176	N	27.2	Very low	27.8	Very low	101 Å²	101	133.3 Å²	133.3	54%	0.54	72%	0.718	S	S	.	*			cis	-161	153.5	-15.8	-122.3	-35.2	0	0	0	112.7
177	Q	30.8	Very low	28.5	Very low	163 Å²	163	133.6 Å²	133.6	76%	0.762	72%	0.722	S	S	*	*			trans	55.5	159.1	144.7	-73.3	164.2	46.3	0	0	121.6
178	S	29.6	Very low	28.5	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	72%	0.722	S	S	*	*			cis	-172	169.7	-12.7	50.8	0	0	0	0	108.1
179	G	26.7	Very low	28.5	Very low	63 Å²	63	127.7 Å²	127.7	65%	0.649	73%	0.726	S	S	*	*			cis	159.8	172.9	-1.9	0	0	0	0	0	111.9
180	Y	32.7	Very low	28.6	Very low	226 Å²	226	126.6 Å²	126.6	89%	0.886	73%	0.725	S	S	*	*			trans	72.9	140	171.3	-65.2	-82.1	0	0	0	119.9
181	E	28.6	Very low	28.6	Very low	175 Å²	175	128 Å²	128	82%	0.818	73%	0.727	S	S	*	*			cis	-101.8	-170	-2.7	-69.2	-162.6	75.1	0	0	111.4
182	G	28.5	Very low	28.7	Very low	72 Å²	72	128 Å²	128	74%	0.742	73%	0.727	S	S	*	*			cis	112.1	157.3	13.6	0	0	0	0	0	111.2
183	V	30.9	Very low	28.6	Very low	116 Å²	116	130 Å²	130	70%	0.703	73%	0.732	S	S	*	*			cis	-160.7	147.8	1.7	-179.7	0	0	0	0	105.4
184	T	26.6	Very low	28.5	Very low	119 Å²	119	128.2 Å²	128.2	73%	0.73	73%	0.728	S	S	*	*			cis	-155.4	159.3	15.9	7.1	0	0	0	0	110.7
185	V	26.9	Very low	28.5	Very low	128 Å²	128	128.9 Å²	128.9	78%	0.776	73%	0.731	S	S	*	*			trans	43.6	112	138.6	-177.5	0	0	0	0	118.9
186	E	24	Very low	28.8	Very low	175 Å²	175	126 Å²	126	82%	0.818	73%	0.726	S	S	*	*			cis	71.7	163.7	33.5	-101.5	-161.3	-125.2	0	0	116.7
187	P	41.1	Very low	28.7	Very low	116 Å²	116	126.2 Å²	126.2	75%	0.753	74%	0.735	S	S	*	*			cis	-114.1	-174	-6.9	39.5	-24.4	0	0	0	112.3
188	G	27.8	Very low	28.5	Very low	73 Å²	73	122.9 Å²	122.9	75%	0.753	73%	0.73	S	S	*	*			cis	152.1	161.1	1.2	0	0	0	0	0	108.9
189	A	28.1	Very low	28.3	Very low	90 Å²	90	126.5 Å²	126.5	74%	0.744	74%	0.735	S	S	*	*			cis	-159.3	159	-6.7	0	0	0	0	0	110.6
190	D	27.4	Very low	28.2	Very low	134 Å²	134	127.8 Å²	127.8	72%	0.717	74%	0.74	S	S	*	*			trans	44.6	134.2	148.3	-55.8	-21.3	0	0	0	122.4
191	L	28.1	Very low	27.8	Very low	142 Å²	142	125 Å²	125	74%	0.743	74%	0.738	S	S	*	*			cis	70	141.6	45.6	-52.5	174.4	0	0	0	112.8
192	L	26.3	Very low	27.6	Very low	115 Å²	115	125.7 Å²	125.7	60%	0.602	74%	0.735	S	S	*	*			cis	-167.8	161.1	-11.1	-115.3	175.1	0	0	0	110.8
193	Y	28.1	Very low	27.4	Very low	191 Å²	191	129.9 Å²	129.9	75%	0.749	73%	0.733	S	S	*	*			trans	61.8	164.3	158.5	-69.6	-53.7	0	0	0	118.3
194	D	24.3	Very low	27	Very low	122 Å²	122	131.2 Å²	131.2	65%	0.652	73%	0.732	S	S	*	*			cis	-152.6	150.2	4	-131.1	-10.1	0	0	0	113.9
195	V	26.7	Very low	26.9	Very low	119 Å²	119	131.3 Å²	131.3	72%	0.721	73%	0.728	S	S	*	*				36.4	151.5	126.9	158.8	0	0	0	0	121.9
196	P	35.6	Very low	26.7	Very low	98 Å²	98	132.1 Å²	132.1	64%	0.636	73%	0.727	S	S	*	*			cis	-142.3	-168.8	-31.2	41.7	-21.5	0	0	0	114.9
197	S	25	Very low	26.8	Very low	105 Å²	105	130.2 Å²	130.2	73%	0.734	72%	0.718	S	S	*	*			trans	67	167.7	147.8	76.2	0	0	0	0	118.5
198	S	25.9	Very low	25.9	Very low	94 Å²	94	132.6 Å²	132.6	66%	0.657	72%	0.717	S	S	*	*			cis	-164.5	161.9	-17.2	35.3	0	0	0	0	111.4
199	Q	25.4	Very low	25.7	Very low	183 Å²	183	134 Å²	134	86%	0.855	72%	0.715	S	S	*	*			trans	60.4	109.5	153.9	-71.4	172.2	6	0	0	121.4
200	A	24.2	Very low	25.5	Very low	91 Å²	91	134.1 Å²	134.1	75%	0.752	71%	0.711	S	S	*	*				43.1	160.3	119.3	0	0	0	0	0	123.7
201	I	25.4	Very low	25.4	Very low	166 Å²	166	133.8 Å²	133.8	85%	0.851	71%	0.709	S	S	*	*			trans	79.8	140.1	176.8	-53.2	172	0	0	0	113
202	Y	22.7	Very low	25.3	Very low	190 Å²	190	132.8 Å²	132.8	75%	0.745	70%	0.704	S	S	*	*			cis	-171.4	161.5	-34.4	-146.8	-75.2	0	0	0	105.9
203	F	24.5	Very low	25.3	Very low	160 Å²	160	134.6 Å²	134.6	70%	0.702	71%	0.714	S	S	*	*			trans	72.1	113.7	165.8	-83.2	-68	0	0	0	120.5
204	E	23.6	Very low	25.1	Very low	144 Å²	144	128.6 Å²	128.6	67%	0.673	71%	0.71	S	S	*	*			trans	60.3	135.7	131.3	-80	-172.4	116.9	0	0	125.3
205	N	23.9	Very low	25.1	Very low	122 Å²	122	130.1 Å²	130.1	65%	0.652	72%	0.718	S	S	*	*				30.6	124.5	128.4	-50.9	-32	0	0	0	117.7
206	L	23.4	Very low	25	Very low	145 Å²	145	130.3 Å²	130.3	76%	0.759	72%	0.723	S	S	*	*				-157	148.6	61.5	-114.9	98.9	0	0	0	114.6
207	Q	24.8	Very low	24.5	Very low	135 Å²	135	130 Å²	130	63%	0.631	72%	0.723	S	S	*	*			trans	29.1	143.2	140.8	-63.2	-170.6	9	0	0	123.4
208	K	23.5	Very low	24.5	Very low	165 Å²	165	132.6 Å²	132.6	72%	0.717	73%	0.726	S	S	*	*			trans	75.5	123.6	153.5	-69	151.9	177.7	157.5	0	115
209	S	22.6	Very low	24.6	Very low	102 Å²	102	135.1 Å²	135.1	71%	0.713	73%	0.725	S	S	*	*			cis	68.4	127.8	47.5	88	0	0	0	0	112.1
210	S	24.8	Very low	24.7	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	71%	0.709	S	S	*	*			cis	-167.1	-166.1	4.4	42.5	0	0	0	0	109.5
211	N	24.6	Very low	24.8	Very low	126 Å²	126	136.5 Å²	136.5	67%	0.674	71%	0.707	S	S	*	*			trans	76.3	146	165.4	-62.5	53.2	0	0	0	114.5
212	D	25.8	Very low	24.9	Very low	121 Å²	121	133.5 Å²	133.5	65%	0.647	69%	0.693	S	S	*	*			cis	-156.1	167.7	-2.6	-130.5	-35.1	0	0	0	114.3
213	L	26.2	Very low	25	Very low	154 Å²	154	133.7 Å²	133.7	81%	0.806	69%	0.693	S	S	*	*			trans	60.6	145	154.3	-69.8	157	0	0	0	119.4
214	G	24.6	Very low	25.1	Very low	65 Å²	65	133 Å²	133	67%	0.67	69%	0.689	S	S	*	*			cis	-164.7	179.7	5	0	0	0	0	0	115.3
215	N	24.9	Very low	25.2	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	69%	0.69	S	S	*	*			trans	-89.4	153.8	-166.9	-61.1	-67.2	0	0	0	114.7
216	C	23	Very low	25.3	Very low	123 Å²	123	129.9 Å²	129.9	83%	0.831	69%	0.693	S	S	*	*				-160.1	123.2	122.2	-144.7	0	0	0	0	108.7
217	S	26.2	Very low	25.5	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	69%	0.689	S	S	*	*			cis	81.9	105	32.3	-171.3	0	0	0	0	115.6
218	M	24.5	Very low	25.6	Very low	161 Å²	161	128.7 Å²	128.7	79%	0.793	69%	0.694	S	S	*	*			trans	-160.2	117.1	138.8	-83.9	-118.5	169.4	0	0	106.6
219	K	28.7	Very low	25.7	Very low	146 Å²	146	126.5 Å²	126.5	64%	0.635	69%	0.69	S	S	*	*				70.5	134.8	84	-71.2	172.3	167	-92.4	0	112
220	E	27.7	Very low	25.8	Very low	111 Å²	111	127.6 Å²	127.6	52%	0.519	69%	0.693	S	S	.	*			cis	-163.2	-178.5	4.4	-117.2	162.8	-149.5	0	0	107.9
221	R	26.4	Very low	25.8	Very low	192 Å²	192	128.7 Å²	128.7	73%	0.725	70%	0.695	S	S	*	*			cis	-160	146.4	14.2	-143.6	172.1	-94	177.9	-7.1	110.6
222	D	26	Very low	25.8	Very low	104 Å²	104	128.7 Å²	128.7	56%	0.556	70%	0.695	S	S	*	*			trans	31.4	151.9	133.4	-58.7	-11.9	0	0	0	123
223	W	25	Very low	25.8	Very low	193 Å²	193	131 Å²	131	73%	0.731	70%	0.702	S	S	*	*			cis	-171.7	178.7	1.2	-102.7	-8.3	0	0	0	106.7
224	K	25.9	Very low	25.7	Very low	146 Å²	146	131.1 Å²	131.1	64%	0.635	70%	0.698	S	S	*	*			cis	-165.3	-176.2	-4.4	-115.3	165.6	-176.7	162.2	0	105.3
225	S	26.9	Very low	25.7	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	70%	0.702	S	S	*	*			cis	-175.4	157.3	-5.5	39.5	0	0	0	0	106.6
226	S	26	Very low	26.5	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	69%	0.693	S	S	*	*			cis	-179.4	-179.6	-15.1	53.2	0	0	0	0	109.2
227	S	27	Very low	26.5	Very low	97 Å²	97	133.8 Å²	133.8	68%	0.678	69%	0.689	S	S	*	*			trans	84.5	144.7	156.2	89	0	0	0	0	118.3
228	H	26.6	Very low	26.4	Very low	158 Å²	158	135.7 Å²	135.7	73%	0.731	69%	0.692	S	S	*	*			cis	-148.9	145	1.9	-112.7	-46.2	0	0	0	112.8
229	N	26.4	Very low	26.2	Very low	118 Å²	118	133.3 Å²	133.3	63%	0.631	69%	0.69	S	S	*	*			trans	67.7	114.4	139.7	-63	-0	0	0	0	122.1
230	T	23.9	Very low	26	Very low	126 Å²	126	132.5 Å²	132.5	77%	0.773	69%	0.691	S	S	*	*				87.6	148.9	97	65.6	0	0	0	0	114.6
231	V	24.9	Very low	25.6	Very low	117 Å²	117	135.9 Å²	135.9	71%	0.709	71%	0.707	S	S	*	*			cis	-162.6	161.3	9.5	97	0	0	0	0	112.6
232	N	24.6	Very low	25.6	Very low	125 Å²	125	135.2 Å²	135.2	67%	0.668	71%	0.712	S	S	*	*			trans	64.1	148.2	163.8	-68.7	23.4	0	0	0	119.7
233	E	25.8	Very low	26.5	Very low	169 Å²	169	134.5 Å²	134.5	79%	0.79	71%	0.713	S	S	*	*			cis	77.8	143.3	32	-65.9	-178.9	175.4	0	0	115.4
234	E	24	Very low	26.8	Very low	157 Å²	157	133 Å²	133	73%	0.734	71%	0.714	S	S	*	*			cis	-167.6	170.2	-29	-151.7	-171.2	-144.4	0	0	109
235	L	25.4	Very low	27.2	Very low	141 Å²	141	133.4 Å²	133.4	74%	0.738	72%	0.718	S	S	*	*			trans	70.4	173.6	159.7	-57.9	173.4	0	0	0	118.7
236	P	42.1	Very low	27.4	Very low	100 Å²	100	134.1 Å²	134.1	65%	0.649	71%	0.714	S	S	*	*				-142.3	179.4	-63.8	44.1	-28.8	0	0	0	117.1
237	H	23.5	Very low	27.4	Very low	158 Å²	158	135.3 Å²	135.3	73%	0.731	71%	0.713	S	S	*	*			trans	67.1	112.7	147.7	-78.3	-54.4	0	0	0	124.3
238	N	22.4	Very low	27.6	Very low	130 Å²	130	138.8 Å²	138.8	70%	0.695	72%	0.718	S	S	*	*				53.1	135.4	117.9	-68.7	6.6	0	0	0	124
239	C	21.5	Very low	27.9	Very low	111 Å²	111	137.1 Å²	137.1	75%	0.75	72%	0.719	S	S	*	*			trans	69.8	154.5	146.2	-67.9	0	0	0	0	117.5
240	I	23.2	Very low	28.1	Very low	129 Å²	129	136.2 Å²	136.2	66%	0.662	72%	0.722	S	S	*	*			cis	-161.2	169.4	-23.9	-114.5	168.1	0	0	0	105.5
241	E	20.8	Very low	28.4	Very low	181 Å²	181	134.3 Å²	134.3	85%	0.846	71%	0.714	S	S	*	*			trans	66	112.1	163.1	-86.4	151	-143.6	0	0	121.8
242	Q	24.8	Very low	28.6	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	72%	0.72	S	S	*	*			trans	-37.6	173.2	133.6	-94.3	-175.4	23.2	0	0	116.1
243	P	46.1	Very low	28.7	Very low	89 Å²	89	137.9 Å²	137.9	58%	0.578	72%	0.724	S	S	*	*			cis	-145.1	-163.5	-14	37.2	-15.4	0	0	0	114.9
244	Q	30.5	Very low	28.8	Very low	160 Å²	160	139.9 Å²	139.9	75%	0.748	73%	0.725	S	S	*	*			trans	73	150.6	155.3	-70.2	176.4	11.3	0	0	116.9
245	Q	34	Very low	28.7	Very low	155 Å²	155	139.2 Å²	139.2	72%	0.724	73%	0.726	S	S	*	*			cis	-147.4	-163.7	-1.5	-126.7	168.4	-8.5	0	0	108.3
246	N	31.5	Very low	28.7	Very low	113 Å²	113	137 Å²	137	60%	0.604	72%	0.722	S	S	*	*			cis	-154.9	-158	10.6	-152.1	46.4	0	0	0	112.4
247	D	26.3	Very low	27.9	Very low	129 Å²	129	136.5 Å²	136.5	69%	0.69	72%	0.721	S	S	*	*			trans	74	126.5	156.7	-57.9	-12.7	0	0	0	119.9
248	E	31.6	Very low	28.1	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.794	72%	0.723	S	S	*	*			cis	-149.4	-177.3	-12.4	-131.5	-160.1	156.8	0	0	113.6
249	T	32.3	Very low	28.4	Very low	123 Å²	123	136.3 Å²	136.3	76%	0.755	72%	0.723	S	S	*	*			trans	-78	178.1	-160.1	74.4	0	0	0	0	115.9
250	S	30.9	Very low	29.2	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	73%	0.726	S	S	*	*			cis	-164.5	172.4	13.7	113.2	0	0	0	0	110
251	S	30	Very low	29.8	Very low	86 Å²	86	143.6 Å²	143.6	60%	0.601	74%	0.737	S	S	*	*			cis	179.1	179.6	-23.5	62	0	0	0	0	109.9
252	K	29.7	Very low	30.9	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.835	74%	0.743	S	S	*	*			trans	63.3	115	156.9	-78.9	174.9	179.5	172.6	0	118.8
253	V	27.1	Very low	31.7	Very low	124 Å²	124	146.8 Å²	146.8	75%	0.752	74%	0.739	S	S	*	*				-177.9	140.2	58.3	131	0	0	0	0	113.6
254	R	26.2	Very low	32.3	Very low	212 Å²	212	145.7 Å²	145.7	80%	0.8	73%	0.733	S	S	*	*			trans	54	127.4	154.2	-72.7	179.1	175.1	170.2	-1.6	124.4
255	N	23.6	Very low	33.4	Very low	142 Å²	142	145 Å²	145	76%	0.759	73%	0.733	S	S	*	*			trans	66.2	151.8	131.7	-60	20.4	0	0	0	120.2
256	S	23.8	Very low	34.5	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	73%	0.733	S	S	*	*			cis	-169.5	176.2	-20.1	55	0	0	0	0	110.4
257	S	26.5	Very low	35.6	Very low	90 Å²	90	144 Å²	144	63%	0.629	73%	0.725	S	S	*	*			trans	59.9	105.5	147.4	58.1	0	0	0	0	121.6
258	D	28	Very low	37	Very low	142 Å²	142	144.6 Å²	144.6	76%	0.759	72%	0.723	S	S	*	*				78.1	160	116.7	-78.4	-67.2	0	0	0	125.7
259	M	27.5	Very low	38	Very low	142 Å²	142	142 Å²	142	70%	0.7	71%	0.714	S	S	*	*			trans	76.6	94.1	161.6	-66.4	-51.3	103.6	0	0	121.3
260	N	37.8	Very low	39.2	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	71%	0.71	S	S	*	*				17.3	107	119.7	-80.2	-42.4	0	0	0	118.2
261	R	36	Very low	40.3	Very low	241 Å²	241	142.4 Å²	142.4	91%	0.909	70%	0.703	S	S	*	*			trans	-134.3	120.5	142.5	-82.7	-170.4	169.3	175	-2.7	110.3	K263	R261-K263 PolarHBondContact O-N 3.23Å
262	R	44.8	Very low	41.5	Very low	256 Å²	256	141 Å²	141	97%	0.966	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-60.4	117	172.2	-71.1	177.2	174.6	165.8	-2.8	109
263	K	42	Very low	42.3	Very low	171 Å²	171	138.1 Å²	138.1	74%	0.743	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-79.9	153.6	165.6	-69	-176.6	178.5	177.6	0	109.6	R261	R261-K263 PolarHBondContact O-N 3.23Å
264	S	59.2	Low	43.4	Very low	66 Å²	66	135.9 Å²	135.9	46%	0.462	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-73.4	150	-179.5	-174.4	0	0	0	0	110.5	K266 D267 H268	S264-K266 PolarHBondContact O-N 3.27Å; S264-K266 VanDerWaalsContact O-N 3.14Å; S264-K266 PolarHBondContact OG-N 3.41Å; S264-D267 WeakPolarHBondContact CB-OD2 3.36Å; S264-D267 PolarHBondContact N-OD2 3.13Å; S264-D267 WeakPolarHBondContact O-CB 3.49Å; S264-D267 PolarHBondContact O-N 3.42Å; S264-H268 PolarHBondContact O-N 2.89Å
265	I	52.3	Low	44.2	Very low	145 Å²	145	127.8 Å²	127.8	74%	0.744	66%	0.657	S	S	*	*	H	α-helix	trans	-55.5	-31.7	172	-63.5	170.7	0	0	0	110.3	D267 H268 L269	I265-D267 VanDerWaalsContact C-N 3.27Å; I265-D267 PolarHBondContact O-N 3.49Å; I265-H268 PolarHBondContact O-N 3.05Å; I265-L269 PolarHBondContact O-N 3.33Å
266	K	57.8	Low	45.2	Very low	166 Å²	166	127.6 Å²	127.6	72%	0.722	66%	0.655	S	S	*	*	H	α-helix	trans	-57.6	-35.8	173.3	-167	174.1	-170	175.8	0	113.2	S264 K270	S264-K266 PolarHBondContact O-N 3.27Å; S264-K266 VanDerWaalsContact O-N 3.14Å; S264-K266 PolarHBondContact OG-N 3.41Å; K266-K270 WeakPolarHBondContact O-CB 3.43Å; K266-K270 PolarHBondContact O-N 3.44Å; K266-K270 VanDerWaalsContact O-N 3.13Å
267	D	54.4	Low	46.1	Very low	83 Å²	83	127.1 Å²	127.1	44%	0.444	66%	0.658	S	S	.	*	H	α-helix	trans	-76.7	-38.2	-179.1	-53.8	-44.3	0	0	0	111.2	S264 I265 K270 S271	S264-D267 WeakPolarHBondContact CB-OD2 3.36Å; S264-D267 PolarHBondContact N-OD2 3.13Å; S264-D267 WeakPolarHBondContact O-CB 3.49Å; S264-D267 PolarHBondContact O-N 3.42Å; I265-D267 VanDerWaalsContact C-N 3.27Å; I265-D267 PolarHBondContact O-N 3.49Å; D267-K270 PolarHBondContact O-N 3.19Å; D267-S271 WeakPolarHBondContact O-CB 3.44Å; D267-S271 PolarHBondContact O-N 3.31Å
268	H	56.5	Low	46.7	Very low	140 Å²	140	131.2 Å²	131.2	65%	0.648	66%	0.664	S	S	*	*	H	α-helix	trans	-63.3	-43.4	173.1	-99.4	-62	0	0	0	111.9	S264 I265 K270 S271 A272	S264-H268 PolarHBondContact O-N 2.89Å; I265-H268 PolarHBondContact O-N 3.05Å; H268-K270 PolarHBondContact O-N 3.3Å; H268-S271 PolarHBondContact O-N 2.99Å; H268-A272 PolarHBondContact O-N 3.1Å
269	L	50.8	Low	46.9	Very low	115 Å²	115	128.5 Å²	128.5	60%	0.602	66%	0.661	S	S	*	*	H	α-helix	trans	-61.8	-44.9	176.6	-144.4	85.1	0	0	0	111.3	I265 S271 A272 M273	I265-L269 PolarHBondContact O-N 3.33Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.22Å; L269-A272 PolarHBondContact O-N 3.21Å; L269-M273 WeakPolarHBondContact O-CG 3.49Å; L269-M273 PolarHBondContact O-N 3.43Å
270	K	59.1	Low	47.4	Very low	154 Å²	154	130.7 Å²	130.7	67%	0.67	67%	0.67	S	S	*	*	H	α-helix	trans	-64.1	-35.7	177.4	-160.1	176.7	-173.3	-176.8	0	112.2	K266 D267 H268 T274	K266-K270 WeakPolarHBondContact O-CB 3.43Å; K266-K270 PolarHBondContact O-N 3.44Å; K266-K270 VanDerWaalsContact O-N 3.13Å; D267-K270 PolarHBondContact O-N 3.19Å; H268-K270 PolarHBondContact O-N 3.3Å; K270-T274 WeakPolarHBondContact O-CB 3.49Å; K270-T274 WeakPolarHBondContact O-CG2 3.4Å; K270-T274 PolarHBondContact O-N 3.11Å; K270-T274 VanDerWaalsContact O-N 3.11Å; K270-T274 PolarHBondContact O-OG1 3.13Å
271	S	54.3	Low	47.1	Very low	77 Å²	77	128.6 Å²	128.6	54%	0.538	66%	0.663	S	S	.	*	H	α-helix	trans	-68.5	-39	173.9	-166.4	0	0	0	0	112.7	D267 H268 L269 T274 G275	D267-S271 WeakPolarHBondContact O-CB 3.44Å; D267-S271 PolarHBondContact O-N 3.31Å; H268-S271 PolarHBondContact O-N 2.99Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.22Å; S271-T274 WeakPolarHBondContact CA-OG1 3.25Å; S271-T274 PolarHBondContact O-OG1 3.46Å; S271-G275 PolarHBondContact O-N 3.09Å
272	A	53.7	Low	47	Very low	56 Å²	56	122.3 Å²	122.3	46%	0.463	65%	0.653	S	S	.	*	H	α-helix	trans	-67.2	-45.7	177.2	0	0	0	0	0	111.6	H268 L269 T274 G275 N276	H268-A272 PolarHBondContact O-N 3.1Å; L269-A272 PolarHBondContact O-N 3.21Å; A272-T274 VanDerWaalsContact C-N 3.35Å; A272-T274 PolarHBondContact O-N 3Å; A272-G275 PolarHBondContact O-N 3.01Å; A272-N276 PolarHBondContact O-N 3.41Å; A272-N276 VanDerWaalsContact O-N 3.09Å
273	M	46.3	Very low	46.8	Very low	132 Å²	132	118.3 Å²	118.3	65%	0.65	65%	0.649	S	S	*	*	H	α-helix	trans	-63.7	-37.9	177.5	-66.4	-179	78.4	0	0	112.5	L269 A277	L269-M273 WeakPolarHBondContact O-CG 3.49Å; L269-M273 PolarHBondContact O-N 3.43Å; M273-A277 WeakPolarHBondContact O-CB 3.33Å; M273-A277 PolarHBondContact O-N 2.93Å; M273-A277 VanDerWaalsContact O-N 3.1Å
274	T	50.7	Low	46.6	Very low	78 Å²	78	116.8 Å²	116.8	48%	0.479	64%	0.643	S	S	.	*	H	α-helix	trans	-76.5	-20.4	176	48	0	0	0	0	114.1	K270 S271 A272	K270-T274 WeakPolarHBondContact O-CB 3.49Å; K270-T274 WeakPolarHBondContact O-CG2 3.4Å; K270-T274 PolarHBondContact O-N 3.11Å; K270-T274 VanDerWaalsContact O-N 3.11Å; K270-T274 PolarHBondContact O-OG1 3.13Å; S271-T274 WeakPolarHBondContact CA-OG1 3.25Å; S271-T274 PolarHBondContact O-OG1 3.46Å; A272-T274 VanDerWaalsContact C-N 3.35Å; A272-T274 PolarHBondContact O-N 3Å
275	G	43.7	Very low	45.9	Very low	42 Å²	42	117.2 Å²	117.2	43%	0.433	65%	0.645	S	S	.	*	H	α-helix	trans	-67.8	-51.8	166.4	0	0	0	0	0	111.7	S271 A272 A277 K278	S271-G275 PolarHBondContact O-N 3.09Å; A272-G275 PolarHBondContact O-N 3.01Å; G275-A277 VanDerWaalsContact C-N 3.27Å; G275-A277 PolarHBondContact O-N 2.96Å; G275-K278 PolarHBondContact O-N 3.36Å
276	N	44.4	Very low	45.6	Very low	137 Å²	137	120.4 Å²	120.4	73%	0.733	65%	0.648	S	S	*	*	H	α-helix	trans	-61.6	-34.8	179	-69.5	-4	0	0	0	112.5	A272 K278	A272-N276 PolarHBondContact O-N 3.41Å; A272-N276 VanDerWaalsContact O-N 3.09Å; N276-K278 PolarHBondContact O-N 2.97Å
277	A	41.6	Very low	45.1	Very low	86 Å²	86	116.1 Å²	116.1	71%	0.711	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	0.2	175	0	0	0	0	0	114.9	M273 G275	M273-A277 WeakPolarHBondContact O-CB 3.33Å; M273-A277 PolarHBondContact O-N 2.93Å; M273-A277 VanDerWaalsContact O-N 3.1Å; G275-A277 VanDerWaalsContact C-N 3.27Å; G275-A277 PolarHBondContact O-N 2.96Å
278	K	39.2	Very low	45	Very low	176 Å²	176	117.7 Å²	117.7	77%	0.765	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	9.2	179.3	-75.8	-171.2	172.6	-172.6	0	114.4	G275 N276 Q280	G275-K278 PolarHBondContact O-N 3.36Å; N276-K278 PolarHBondContact O-N 2.97Å; K278-Q280 PolarHBondContact O-N 3.09Å
279	A	33.7	Very low	44.7	Very low	84 Å²	84	116.6 Å²	116.6	69%	0.694	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-62.2	117.3	168.5	0	0	0	0	0	109.6
280	Q	36.4	Very low	44.6	Very low	188 Å²	188	116.2 Å²	116.2	88%	0.879	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-66.8	136.1	179.7	-70.3	178.8	-17.9	0	0	110.4	K278	K278-Q280 PolarHBondContact O-N 3.09Å
281	T	31.5	Very low	44.5	Very low	108 Å²	108	115.1 Å²	115.1	66%	0.663	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-64.7	131.4	173.9	33.1	0	0	0	0	110.3	F284	T281-F284 HydrophobicContact CG2-CE2 4.34Å
282	P	34.6	Very low	44.5	Very low	108 Å²	108	115 Å²	115	70%	0.701	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-65.4	146.7	172.8	28.7	-34.2	0	0	0	110	F284	P282-F284 PolarHBondContact O-N 2.97Å; P282-F284 VanDerWaalsContact O-N 3.13Å
283	I	41.3	Very low	44.7	Very low	173 Å²	173	115.7 Å²	115.7	89%	0.887	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-59.6	118.1	-177.5	-62.8	172.7	0	0	0	109.4	S285	I283-S285 PolarHBondContact O-N 3.3Å
284	F	37.2	Very low	45.4	Very low	139 Å²	139	113.9 Å²	113.9	61%	0.61	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-66.5	129.9	-171.9	-74.5	-101.2	0	0	0	111.9	T281 P282	T281-F284 HydrophobicContact CG2-CE2 4.34Å; P282-F284 PolarHBondContact O-N 2.97Å; P282-F284 VanDerWaalsContact O-N 3.13Å
285	S	43.8	Very low	45.7	Very low	74 Å²	74	114.3 Å²	114.3	52%	0.517	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-81.6	133.2	174.1	63	0	0	0	0	111.1	I283 S287 K288	I283-S285 PolarHBondContact O-N 3.3Å; S285-S287 PolarHBondContact O-N 3.3Å; S285-K288 PolarHBondContact O-N 3.08Å
286	R	47	Very low	46.4	Very low	213 Å²	213	114.8 Å²	114.8	80%	0.804	61%	0.61	S	S	*	*	H	α-helix	trans	-50.4	-30.9	178.1	-88.6	179.1	166.3	165.4	-5.1	113.8	K288 Q289 L290	R286-K288 VanDerWaalsContact C-N 3.31Å; R286-K288 PolarHBondContact O-N 3.15Å; R286-Q289 PolarHBondContact O-N 2.61Å; R286-L290 PolarHBondContact O-N 3.25Å
287	S	47.1	Very low	47.2	Very low	75 Å²	75	114 Å²	114	52%	0.524	60%	0.602	S	S	.	*	H	α-helix	trans	-61	-35.2	177	-175.8	0	0	0	0	113	S285 K291	S285-S287 PolarHBondContact O-N 3.3Å; S287-K291 WeakPolarHBondContact O-CG 3.41Å; S287-K291 PolarHBondContact O-N 3.45Å; S287-K291 VanDerWaalsContact O-N 3.15Å
288	K	52.4	Low	48	Very low	116 Å²	116	115.9 Å²	115.9	50%	0.504	60%	0.596	S	S	.	*	H	α-helix	trans	-74.7	-44.1	176	-162.9	-174.4	171.8	-174	0	111.5	S285 R286 L290 K291 D292	S285-K288 PolarHBondContact O-N 3.08Å; R286-K288 VanDerWaalsContact C-N 3.31Å; R286-K288 PolarHBondContact O-N 3.15Å; K288-L290 VanDerWaalsContact C-N 3.29Å; K288-L290 PolarHBondContact O-N 3.28Å; K288-K291 CarbonylContact O-C 3.57Å; K288-K291 PolarHBondContact O-N 2.71Å; K288-D292 VanDerWaalsContact CE-OD2 3.3Å; K288-D292 WeakPolarHBondContact CE-OD2 3.46Å; K288-D292 WeakPolarHBondContact O-CB 3.3Å; K288-D292 VanDerWaalsContact O-CG 3.29Å; K288-D292 PolarHBondContact O-N 2.82Å
289	Q	49.4	Very low	49.1	Very low	117 Å²	117	112 Å²	112	55%	0.547	58%	0.583	S	S	.	*	H	α-helix	trans	-57.4	-42.2	174.2	-80.2	-178.3	-42.6	0	0	112.1	R286 K291 D292 T293	R286-Q289 PolarHBondContact O-N 2.61Å; Q289-K291 VanDerWaalsContact C-N 3.33Å; Q289-K291 PolarHBondContact O-N 3.03Å; Q289-D292 PolarHBondContact O-N 3.29Å; Q289-T293 WeakPolarHBondContact O-CG2 3.08Å; Q289-T293 PolarHBondContact O-N 3.48Å; Q289-T293 PolarHBondContact O-OG1 3.39Å; Q289-T293 VanDerWaalsContact O-OG1 3.1Å
290	L	50.1	Low	50.1	Low	107 Å²	107	112.1 Å²	112.1	56%	0.56	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-36.8	174.7	-88.2	160.9	0	0	0	113.2	R286 K288 T293 L294	R286-L290 PolarHBondContact O-N 3.25Å; K288-L290 VanDerWaalsContact C-N 3.29Å; K288-L290 PolarHBondContact O-N 3.28Å; L290-T293 WeakPolarHBondContact CA-OG1 3.44Å; L290-T293 PolarHBondContact O-OG1 3.04Å; L290-L294 WeakPolarHBondContact O-CB 3.38Å; L290-L294 WeakPolarHBondContact O-CD1 3.37Å; L290-L294 WeakPolarHBondContact O-CG 3.35Å; L290-L294 PolarHBondContact O-N 3.29Å
291	K	56.9	Low	51.3	Low	132 Å²	132	107.5 Å²	107.5	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-71.9	-40	173.9	-76.3	-179.7	172	-174.2	0	112.5	S287 K288 Q289 L294 L295	S287-K291 WeakPolarHBondContact O-CG 3.41Å; S287-K291 PolarHBondContact O-N 3.45Å; S287-K291 VanDerWaalsContact O-N 3.15Å; K288-K291 CarbonylContact O-C 3.57Å; K288-K291 PolarHBondContact O-N 2.71Å; Q289-K291 VanDerWaalsContact C-N 3.33Å; Q289-K291 PolarHBondContact O-N 3.03Å; K291-L294 PolarHBondContact O-N 2.94Å; K291-L295 VanDerWaalsContact O-CB 3.25Å; K291-L295 WeakPolarHBondContact O-CB 3.45Å; K291-L295 VanDerWaalsContact O-CG 3.23Å; K291-L295 WeakPolarHBondContact O-CG 3.34Å; K291-L295 PolarHBondContact O-N 3.38Å
292	D	53.1	Low	52	Low	75 Å²	75	104.5 Å²	104.5	40%	0.401	54%	0.543	S	S	.	.	H	α-helix	trans	-69.7	-33.7	177.9	-64.1	-19.9	0	0	0	110.6	K288 Q289 S296	K288-D292 VanDerWaalsContact CE-OD2 3.3Å; K288-D292 WeakPolarHBondContact CE-OD2 3.46Å; K288-D292 WeakPolarHBondContact O-CB 3.3Å; K288-D292 VanDerWaalsContact O-CG 3.29Å; K288-D292 PolarHBondContact O-N 2.82Å; Q289-D292 PolarHBondContact O-N 3.29Å; D292-S296 VanDerWaalsContact O-CB 3.3Å; D292-S296 WeakPolarHBondContact O-CB 3.33Å; D292-S296 PolarHBondContact O-N 3.23Å
293	T	58.3	Low	52.5	Low	69 Å²	69	104.6 Å²	104.6	42%	0.423	53%	0.532	S	S	.	.	H	α-helix	trans	-69.8	-46.4	170.4	53.5	0	0	0	0	111.9	Q289 L290 L295 S296 E297	Q289-T293 WeakPolarHBondContact O-CG2 3.08Å; Q289-T293 PolarHBondContact O-N 3.48Å; Q289-T293 PolarHBondContact O-OG1 3.39Å; Q289-T293 VanDerWaalsContact O-OG1 3.1Å; L290-T293 WeakPolarHBondContact CA-OG1 3.44Å; L290-T293 PolarHBondContact O-OG1 3.04Å; T293-L295 VanDerWaalsContact C-N 3.35Å; T293-L295 PolarHBondContact O-N 3.27Å; T293-S296 WeakPolarHBondContact CA-OG 3.36Å; T293-S296 CarbonylContact O-C 3.49Å; T293-S296 WeakPolarHBondContact O-CA 3.29Å; T293-S296 PolarHBondContact O-N 2.82Å; T293-S296 PolarHBondContact O-OG 3.13Å; T293-E297 PolarHBondContact O-N 3.11Å
294	L	61.6	Low	52.4	Low	94 Å²	94	103.4 Å²	103.4	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-42.7	176.3	-76.4	168.5	0	0	0	111.5	L290 K291 S296 E297 E298	L290-L294 WeakPolarHBondContact O-CB 3.38Å; L290-L294 WeakPolarHBondContact O-CD1 3.37Å; L290-L294 WeakPolarHBondContact O-CG 3.35Å; L290-L294 PolarHBondContact O-N 3.29Å; K291-L294 PolarHBondContact O-N 2.94Å; L294-S296 VanDerWaalsContact C-N 3.31Å; L294-S296 PolarHBondContact O-N 3.3Å; L294-E297 PolarHBondContact O-N 3.38Å; L294-E298 WeakPolarHBondContact O-CB 3.48Å; L294-E298 WeakPolarHBondContact O-CG 3.4Å; L294-E298 PolarHBondContact O-N 2.85Å
295	L	56.3	Low	52.7	Low	88 Å²	88	100.8 Å²	100.8	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-37.1	171.9	-75.7	166.7	0	0	0	111.6	K291 T293 I299	K291-L295 VanDerWaalsContact O-CB 3.25Å; K291-L295 WeakPolarHBondContact O-CB 3.45Å; K291-L295 VanDerWaalsContact O-CG 3.23Å; K291-L295 WeakPolarHBondContact O-CG 3.34Å; K291-L295 PolarHBondContact O-N 3.38Å; T293-L295 VanDerWaalsContact C-N 3.35Å; T293-L295 PolarHBondContact O-N 3.27Å; L295-I299 WeakPolarHBondContact O-CB 3.49Å; L295-I299 WeakPolarHBondContact O-CD1 3.3Å; L295-I299 WeakPolarHBondContact O-CG1 3.45Å; L295-I299 PolarHBondContact O-N 3.2Å
296	S	58.6	Low	52.7	Low	52 Å²	52	103 Å²	103	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-70.1	-31.1	174.9	80.3	0	0	0	0	113	D292 T293 L294 N300	D292-S296 VanDerWaalsContact O-CB 3.3Å; D292-S296 WeakPolarHBondContact O-CB 3.33Å; D292-S296 PolarHBondContact O-N 3.23Å; T293-S296 WeakPolarHBondContact CA-OG 3.36Å; T293-S296 CarbonylContact O-C 3.49Å; T293-S296 WeakPolarHBondContact O-CA 3.29Å; T293-S296 PolarHBondContact O-N 2.82Å; T293-S296 PolarHBondContact O-OG 3.13Å; L294-S296 VanDerWaalsContact C-N 3.31Å; L294-S296 PolarHBondContact O-N 3.3Å; S296-N300 WeakPolarHBondContact O-CB 3.48Å; S296-N300 PolarHBondContact O-N 3.4Å; S296-N300 PolarHBondContact O-ND2 3.16Å; S296-N300 VanDerWaalsContact O-ND2 3.08Å
297	E	61.3	Low	52.4	Low	121 Å²	121	98.4 Å²	98.4	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-74.3	-43.9	172.6	-74.8	-171.9	113.9	0	0	111	T293 L294 I299 N300 V301	T293-E297 PolarHBondContact O-N 3.11Å; L294-E297 PolarHBondContact O-N 3.38Å; E297-I299 VanDerWaalsContact C-N 3.33Å; E297-I299 PolarHBondContact O-N 2.85Å; E297-N300 CarbonylContact O-C 3.5Å; E297-N300 PolarHBondContact O-N 3.43Å; E297-V301 WeakPolarHBondContact O-CB 3.46Å; E297-V301 VanDerWaalsContact O-CG2 3.26Å; E297-V301 WeakPolarHBondContact O-CG2 3.45Å; E297-V301 PolarHBondContact O-N 3.25Å
298	E	58.4	Low	51.9	Low	124 Å²	124	99.4 Å²	99.4	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-40.4	171.9	-73.8	179	167.3	0	0	111.5	L294 V301 A302	L294-E298 WeakPolarHBondContact O-CB 3.48Å; L294-E298 WeakPolarHBondContact O-CG 3.4Å; L294-E298 PolarHBondContact O-N 2.85Å; E298-V301 PolarHBondContact O-N 3.42Å; E298-A302 WeakPolarHBondContact O-CB 3.32Å; E298-A302 PolarHBondContact O-N 3.05Å
299	I	62.5	Low	51.4	Low	95 Å²	95	98.2 Å²	98.2	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-68.4	-37.7	173.3	-73.2	162.1	0	0	0	111.2	L295 E297 K303	L295-I299 WeakPolarHBondContact O-CB 3.49Å; L295-I299 WeakPolarHBondContact O-CD1 3.3Å; L295-I299 WeakPolarHBondContact O-CG1 3.45Å; L295-I299 PolarHBondContact O-N 3.2Å; E297-I299 VanDerWaalsContact C-N 3.33Å; E297-I299 PolarHBondContact O-N 2.85Å; I299-K303 HydrophobicContact CG2-CD 4.36Å; I299-K303 HydrophobicContact CG2-CG 4.48Å; I299-K303 VanDerWaalsContact O-CB 3.27Å; I299-K303 WeakPolarHBondContact O-CB 3.43Å; I299-K303 VanDerWaalsContact O-CG 3.27Å; I299-K303 WeakPolarHBondContact O-CG 3.43Å; I299-K303 PolarHBondContact O-N 2.94Å
300	N	54.6	Low	51	Low	86 Å²	86	96.2 Å²	96.2	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-74.4	-29.5	175.8	-78.9	-32.6	0	0	0	112.8	S296 E297 K304	S296-N300 WeakPolarHBondContact O-CB 3.48Å; S296-N300 PolarHBondContact O-N 3.4Å; S296-N300 PolarHBondContact O-ND2 3.16Å; S296-N300 VanDerWaalsContact O-ND2 3.08Å; E297-N300 CarbonylContact O-C 3.5Å; E297-N300 PolarHBondContact O-N 3.43Å; N300-K304 VanDerWaalsContact O-CB 3.25Å; N300-K304 WeakPolarHBondContact O-CB 3.35Å; N300-K304 VanDerWaalsContact O-CG 3.24Å; N300-K304 WeakPolarHBondContact O-CG 3.24Å; N300-K304 PolarHBondContact O-N 3.17Å
301	V	60.4	Low	50.8	Low	91 Å²	91	97.7 Å²	97.7	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-72.6	-42	170.7	168.1	0	0	0	0	109.8	E297 E298 K304 T305	E297-V301 WeakPolarHBondContact O-CB 3.46Å; E297-V301 VanDerWaalsContact O-CG2 3.26Å; E297-V301 WeakPolarHBondContact O-CG2 3.45Å; E297-V301 PolarHBondContact O-N 3.25Å; E298-V301 PolarHBondContact O-N 3.42Å; V301-K304 PolarHBondContact O-N 3.02Å; V301-T305 VanDerWaalsContact O-CB 3.3Å; V301-T305 WeakPolarHBondContact O-CB 3.25Å; V301-T305 PolarHBondContact O-N 2.93Å; V301-T305 PolarHBondContact O-OG1 3.19Å
302	A	46.6	Very low	50.1	Low	46 Å²	46	95 Å²	95	38%	0.38	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-45.5	173.3	0	0	0	0	0	111.3	E298 T305 I306	E298-A302 WeakPolarHBondContact O-CB 3.32Å; E298-A302 PolarHBondContact O-N 3.05Å; A302-T305 WeakPolarHBondContact O-CB 3.42Å; A302-T305 PolarHBondContact O-N 3.45Å; A302-T305 VanDerWaalsContact O-N 3.17Å; A302-I306 WeakPolarHBondContact O-CB 3.36Å; A302-I306 WeakPolarHBondContact O-CD1 3.27Å; A302-I306 VanDerWaalsContact O-CG1 3.25Å; A302-I306 WeakPolarHBondContact O-CG1 3.47Å; A302-I306 PolarHBondContact O-N 3.34Å
303	K	44.8	Very low	49.7	Very low	110 Å²	110	97 Å²	97	48%	0.478	53%	0.531	S	S	.	.	H	α-helix	trans	-58.3	-50.7	171.9	-80.2	-177.5	175.5	-169.2	0	111.5	I299 T305 I306 E307	I299-K303 HydrophobicContact CG2-CD 4.36Å; I299-K303 HydrophobicContact CG2-CG 4.48Å; I299-K303 VanDerWaalsContact O-CB 3.27Å; I299-K303 WeakPolarHBondContact O-CB 3.43Å; I299-K303 VanDerWaalsContact O-CG 3.27Å; I299-K303 WeakPolarHBondContact O-CG 3.43Å; I299-K303 PolarHBondContact O-N 2.94Å; K303-T305 PolarHBondContact O-N 3.1Å; K303-I306 CarbonylContact O-C 3.59Å; K303-I306 PolarHBondContact O-N 2.81Å; K303-I306 VanDerWaalsContact O-N 3.15Å; K303-E307 VanDerWaalsContact O-CB 3.29Å; K303-E307 WeakPolarHBondContact O-CB 3.41Å; K303-E307 VanDerWaalsContact O-CG 3.23Å; K303-E307 WeakPolarHBondContact O-CG 3.11Å; K303-E307 PolarHBondContact O-N 3.3Å
304	K	40.8	Very low	49.3	Very low	147 Å²	147	93.9 Å²	93.9	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-60	-32.1	174.8	-79.2	177.3	177.4	-178.6	0	113	N300 V301 S308	N300-K304 VanDerWaalsContact O-CB 3.25Å; N300-K304 WeakPolarHBondContact O-CB 3.35Å; N300-K304 VanDerWaalsContact O-CG 3.24Å; N300-K304 WeakPolarHBondContact O-CG 3.24Å; N300-K304 PolarHBondContact O-N 3.17Å; V301-K304 PolarHBondContact O-N 3.02Å; K304-S308 WeakPolarHBondContact O-CB 3.48Å; K304-S308 PolarHBondContact O-N 3.45Å; K304-S308 PolarHBondContact O-OG 3.15Å; K304-S308 VanDerWaalsContact O-OG 3.12Å
305	T	42.2	Very low	49.4	Very low	84 Å²	84	95.8 Å²	95.8	52%	0.515	53%	0.531	S	S	.	.	H	α-helix	trans	-70.8	-44.2	176.2	-56.4	0	0	0	0	110.7	V301 A302 K303 S308 S309	V301-T305 VanDerWaalsContact O-CB 3.3Å; V301-T305 WeakPolarHBondContact O-CB 3.25Å; V301-T305 PolarHBondContact O-N 2.93Å; V301-T305 PolarHBondContact O-OG1 3.19Å; A302-T305 WeakPolarHBondContact O-CB 3.42Å; A302-T305 PolarHBondContact O-N 3.45Å; A302-T305 VanDerWaalsContact O-N 3.17Å; K303-T305 PolarHBondContact O-N 3.1Å; T305-S308 WeakPolarHBondContact CA-OG 3.34Å; T305-S308 PolarHBondContact O-N 2.78Å; T305-S308 PolarHBondContact O-OG 3.06Å; T305-S309 PolarHBondContact O-N 2.82Å; T305-S309 VanDerWaalsContact O-N 3.12Å
306	I	43.5	Very low	50	Low	120 Å²	120	93.3 Å²	93.3	62%	0.615	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-46.2	174.4	-68	161.7	0	0	0	110.4	A302 K303 S308 S309	A302-I306 WeakPolarHBondContact O-CB 3.36Å; A302-I306 WeakPolarHBondContact O-CD1 3.27Å; A302-I306 VanDerWaalsContact O-CG1 3.25Å; A302-I306 WeakPolarHBondContact O-CG1 3.47Å; A302-I306 PolarHBondContact O-N 3.34Å; K303-I306 CarbonylContact O-C 3.59Å; K303-I306 PolarHBondContact O-N 2.81Å; K303-I306 VanDerWaalsContact O-N 3.15Å; I306-S308 PolarHBondContact O-N 3.26Å; I306-S309 WeakPolarHBondContact O-CB 3.25Å; I306-S309 PolarHBondContact O-N 3.46Å; I306-S309 VanDerWaalsContact O-N 3.07Å; I306-S309 PolarHBondContact O-OG 3.08Å
307	E	40.6	Very low	50.8	Low	118 Å²	118	93.3 Å²	93.3	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-64.2	-38.8	176	-70.8	161	-172.6	0	0	111.3	K303 S309 S310	K303-E307 VanDerWaalsContact O-CB 3.29Å; K303-E307 WeakPolarHBondContact O-CB 3.41Å; K303-E307 VanDerWaalsContact O-CG 3.23Å; K303-E307 WeakPolarHBondContact O-CG 3.11Å; K303-E307 PolarHBondContact O-N 3.3Å; E307-S309 PolarHBondContact O-N 3.36Å; E307-S310 WeakPolarHBondContact O-CB 3.23Å; E307-S310 PolarHBondContact O-N 2.83Å; E307-S310 VanDerWaalsContact O-N 3.08Å; E307-S310 PolarHBondContact O-OG 2.95Å
308	S	38.2	Very low	51.4	Low	95 Å²	95	91 Å²	91	66%	0.664	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-10.6	172.8	74.2	0	0	0	0	114.6	K304 T305 I306 S310	K304-S308 WeakPolarHBondContact O-CB 3.48Å; K304-S308 PolarHBondContact O-N 3.45Å; K304-S308 PolarHBondContact O-OG 3.15Å; K304-S308 VanDerWaalsContact O-OG 3.12Å; T305-S308 WeakPolarHBondContact CA-OG 3.34Å; T305-S308 PolarHBondContact O-N 2.78Å; T305-S308 PolarHBondContact O-OG 3.06Å; I306-S308 PolarHBondContact O-N 3.26Å; S308-S310 VanDerWaalsContact C-N 3.31Å
309	S	41.3	Very low	52.5	Low	91 Å²	91	85 Å²	85	64%	0.636	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	2	170	77.2	0	0	0	0	113.3	T305 I306 E307	T305-S309 PolarHBondContact O-N 2.82Å; T305-S309 VanDerWaalsContact O-N 3.12Å; I306-S309 WeakPolarHBondContact O-CB 3.25Å; I306-S309 PolarHBondContact O-N 3.46Å; I306-S309 VanDerWaalsContact O-N 3.07Å; I306-S309 PolarHBondContact O-OG 3.08Å; E307-S309 PolarHBondContact O-N 3.36Å
310	S	42	Very low	53.3	Low	76 Å²	76	82.3 Å²	82.3	53%	0.531	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	130.2	173.7	65.6	0	0	0	0	112.1	E307 S308	E307-S310 WeakPolarHBondContact O-CB 3.23Å; E307-S310 PolarHBondContact O-N 2.83Å; E307-S310 VanDerWaalsContact O-N 3.08Å; E307-S310 PolarHBondContact O-OG 2.95Å; S308-S310 VanDerWaalsContact C-N 3.31Å
311	N	44.2	Very low	54.5	Low	137 Å²	137	80.3 Å²	80.3	73%	0.733	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	32.7	168.8	-50.7	-15.7	0	0	0	118.3	L313	N311-L313 PolarHBondContact O-N 3.27Å; N311-L313 VanDerWaalsContact O-N 3.11Å
312	D	42.4	Very low	55.7	Low	76 Å²	76	80.1 Å²	80.1	41%	0.406	45%	0.451	S	S	.	.			trans	-73	84	143.7	176.4	42.4	0	0	0	108.8	G314 P320 S321	D312-G314 PolarHBondContact O-N 3.15Å; D312-P320 VanDerWaalsContact O-CA 3.26Å; D312-P320 WeakPolarHBondContact O-CA 3.22Å; D312-P320 WeakPolarHBondContact O-CB 3.49Å; D312-S321 WeakPolarHBondContact OD2-CB 3.31Å; D312-S321 PolarHBondContact OD2-N 3.15Å; D312-S321 PolarHBondContact OD2-OG 2.65Å
313	L	45.6	Very low	57.5	Low	116 Å²	116	78 Å²	78	61%	0.607	43%	0.433	S	S	*	.			trans	-79.1	75.2	164.6	-75.9	172.4	0	0	0	108.2	N311 C379	N311-L313 PolarHBondContact O-N 3.27Å; N311-L313 VanDerWaalsContact O-N 3.11Å; L313-C379 HydrophobicContact CD2-CB 4.5Å
314	G	49.7	Very low	59.4	Low	5 Å²	5	78 Å²	78	5%	0.052	43%	0.43	C	S	.	.			trans	-64.3	166.1	-169.2	0	0	0	0	0	114.7	D312 F316 L319	D312-G314 PolarHBondContact O-N 3.15Å; G314-F316 PolarHBondContact O-N 3Å; G314-L319 CarbonylContact C-O 3.56Å; G314-L319 WeakPolarHBondContact CA-O 3.36Å; G314-L319 PolarHBondContact N-O 3.34Å
315	P	62.5	Low	61.6	Low	133 Å²	133	74.8 Å²	74.8	86%	0.864	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	4.9	-175.6	30.3	-37.2	0	0	0	114.6	Y317	P315-Y317 PolarHBondContact O-N 3.45Å
316	F	70.7	Confident	63.7	Low	36 Å²	36	71 Å²	71	16%	0.158	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-91.5	77.2	-179.3	-174.2	-106	0	0	0	110.1	G314 S318 L319 R324 Y327 I371	G314-F316 PolarHBondContact O-N 3Å; F316-S318 VanDerWaalsContact C-N 3.31Å; F316-S318 PolarHBondContact O-N 2.97Å; F316-L319 HydrophobicContact CD1-CB 4.25Å; F316-L319 HydrophobicContact CD1-CD1 4.23Å; F316-L319 HydrophobicContact CE1-CD1 4.35Å; F316-L319 VanDerWaalsContact O-CB 3.32Å; F316-L319 WeakPolarHBondContact O-CB 3.24Å; F316-L319 PolarHBondContact O-N 3.11Å; F316-R324 HydrophobicContact CB-CB 4.47Å; F316-R324 HydrophobicContact CD1-CB 4.13Å; F316-R324 HydrophobicContact CD2-CB 4.14Å; F316-R324 HydrophobicContact CD2-CG 4.15Å; F316-R324 HydrophobicContact CE1-CB 4.42Å; F316-R324 HydrophobicContact CE2-CB 4.42Å; F316-R324 HydrophobicContact CE2-CG 4.28Å; F316-R324 HydrophobicContact CG-CB 3.99Å; F316-Y327 HydrophobicContact CE1-CD2 4.32Å; F316-I371 HydrophobicContact CZ-CD1 4.34Å
317	Y	74.9	Confident	65.8	Low	52 Å²	52	65.5 Å²	65.5	20%	0.204	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	45.3	178.5	-50.6	-84	0	0	0	113.3	P315 L319 L336 H341 L344 T345	P315-Y317 PolarHBondContact O-N 3.45Å; Y317-L319 PolarHBondContact O-N 3.12Å; Y317-L336 HydrophobicContact CD2-CD1 4.42Å; Y317-L336 HydrophobicContact CE2-CD1 3.54Å; Y317-H341 PolarHBondContact OH-CD2 3.11Å; Y317-L344 HydrophobicContact CD1-CB 3.64Å; Y317-L344 HydrophobicContact CD1-CD1 4Å; Y317-L344 HydrophobicContact CD1-CG 4.41Å; Y317-L344 HydrophobicContact CD2-CD1 4.19Å; Y317-L344 HydrophobicContact CE1-CB 3.74Å; Y317-L344 HydrophobicContact CE1-CD1 3.95Å; Y317-L344 HydrophobicContact CE2-CD1 4.16Å; Y317-L344 HydrophobicContact CG-CB 4.42Å; Y317-L344 HydrophobicContact CG-CD1 4.11Å; Y317-T345 HydrophobicContact CE1-CG2 4.35Å
318	S	73.1	Confident	68	Low	72 Å²	72	61.9 Å²	61.9	50%	0.503	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	21.4	-178.3	-51.9	0	0	0	0	115.2	F316 C379	F316-S318 VanDerWaalsContact C-N 3.31Å; F316-S318 PolarHBondContact O-N 2.97Å; S318-C379 PolarHBondContact O-SG 2.61Å
319	L	81.3	Confident	70.2	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-105.5	151.8	172.2	-69.8	164.3	0	0	0	112.1	G314 F316 Y317 V323 I371 L374 Q375 L378	G314-L319 CarbonylContact C-O 3.56Å; G314-L319 WeakPolarHBondContact CA-O 3.36Å; G314-L319 PolarHBondContact N-O 3.34Å; F316-L319 HydrophobicContact CD1-CB 4.25Å; F316-L319 HydrophobicContact CD1-CD1 4.23Å; F316-L319 HydrophobicContact CE1-CD1 4.35Å; F316-L319 VanDerWaalsContact O-CB 3.32Å; F316-L319 WeakPolarHBondContact O-CB 3.24Å; F316-L319 PolarHBondContact O-N 3.11Å; Y317-L319 PolarHBondContact O-N 3.12Å; L319-V323 HydrophobicContact CB-CB 4.32Å; L319-V323 HydrophobicContact CB-CG2 4.38Å; L319-V323 HydrophobicContact CD1-CG1 4.14Å; L319-I371 HydrophobicContact CD1-CG2 3.89Å; L319-L374 HydrophobicContact CD1-CB 4.44Å; L319-L374 HydrophobicContact CD2-CB 4Å; L319-Q375 HydrophobicContact CD2-CB 4.18Å; L319-L378 HydrophobicContact CD2-CD1 4.37Å
320	P	80.3	Confident	72.1	Confident	37 Å²	37	63.2 Å²	63.2	24%	0.24	34%	0.343	C	S	.	.			trans	-57.3	145.2	173.7	-24.1	33.7	0	0	0	113.5	D312 K322 V323	D312-P320 VanDerWaalsContact O-CA 3.26Å; D312-P320 WeakPolarHBondContact O-CA 3.22Å; D312-P320 WeakPolarHBondContact O-CB 3.49Å; P320-K322 PolarHBondContact O-N 3.04Å; P320-K322 VanDerWaalsContact O-N 3.13Å; P320-V323 HydrophobicContact CB-CG2 4.47Å; P320-V323 WeakPolarHBondContact O-CB 3.11Å; P320-V323 PolarHBondContact O-N 3.25Å
321	S	79.4	Confident	74	Confident	45 Å²	45	62.8 Å²	62.8	32%	0.315	33%	0.332	S	S	.	.	H	α-helix	trans	-52	-37.5	178.9	53.4	0	0	0	0	113.5	D312 V323 R324 D325	D312-S321 WeakPolarHBondContact OD2-CB 3.31Å; D312-S321 PolarHBondContact OD2-N 3.15Å; D312-S321 PolarHBondContact OD2-OG 2.65Å; S321-V323 PolarHBondContact O-N 2.77Å; S321-V323 VanDerWaalsContact O-N 3.12Å; S321-R324 WeakPolarHBondContact O-CB 3.48Å; S321-R324 PolarHBondContact O-N 3.41Å; S321-D325 PolarHBondContact O-N 3.3Å
322	K	84.8	Confident	75.9	Confident	87 Å²	87	59.2 Å²	59.2	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-51.3	-35.1	174	-172	179.4	-177.3	-173.4	0	112.9	P320 D325 L326 E407 L408	P320-K322 PolarHBondContact O-N 3.04Å; P320-K322 VanDerWaalsContact O-N 3.13Å; K322-D325 PolarHBondContact O-N 3.33Å; K322-L326 HydrophobicContact CG-CD1 4.15Å; K322-L326 HydrophobicContact CG-CG 4.27Å; K322-L326 VanDerWaalsContact O-CG 3.31Å; K322-L326 WeakPolarHBondContact O-CG 3.46Å; K322-L326 PolarHBondContact O-N 2.78Å; K322-E407 WeakPolarHBondContact CE-OE2 3.3Å; K322-E407 PolarHBondContact NZ-O 2.98Å; K322-E407 IonicContact NZ-OE2 2.75Å; K322-E407 PolarHBondContact NZ-OE2 3.49Å; K322-L408 HydrophobicContact CD-CD2 4.19Å; K322-L408 HydrophobicContact CG-CD2 4.44Å
323	V	85.2	Confident	77.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-44	-177.3	-179.7	0	0	0	0	111.4	L319 P320 S321 D325 L326 Y327 L374 L378 L408	L319-V323 HydrophobicContact CB-CB 4.32Å; L319-V323 HydrophobicContact CB-CG2 4.38Å; L319-V323 HydrophobicContact CD1-CG1 4.14Å; P320-V323 HydrophobicContact CB-CG2 4.47Å; P320-V323 WeakPolarHBondContact O-CB 3.11Å; P320-V323 PolarHBondContact O-N 3.25Å; S321-V323 PolarHBondContact O-N 2.77Å; S321-V323 VanDerWaalsContact O-N 3.12Å; V323-D325 VanDerWaalsContact C-N 3.29Å; V323-D325 PolarHBondContact O-N 2.98Å; V323-L326 PolarHBondContact O-N 3.24Å; V323-Y327 HydrophobicContact CG1-CD2 3.89Å; V323-Y327 HydrophobicContact CG1-CE2 3.72Å; V323-Y327 VanDerWaalsContact O-CD2 3.26Å; V323-Y327 WeakPolarHBondContact O-CD2 3.25Å; V323-Y327 PolarHBondContact O-N 2.81Å; V323-L374 HydrophobicContact CG1-CD1 3.71Å; V323-L378 HydrophobicContact CG2-CD1 3.93Å; V323-L408 HydrophobicContact CG2-CD1 4.14Å; V323-L408 HydrophobicContact CG2-CD2 4.02Å
324	R	84.4	Confident	79.7	Confident	111 Å²	111	60.5 Å²	60.5	42%	0.419	33%	0.328	S	S	.	.	H	α-helix	trans	-57.1	-44.8	173.1	178.6	-159.8	65.6	-153.7	-8.9	110.9	F316 S321 L326 Y327 A328	F316-R324 HydrophobicContact CB-CB 4.47Å; F316-R324 HydrophobicContact CD1-CB 4.13Å; F316-R324 HydrophobicContact CD2-CB 4.14Å; F316-R324 HydrophobicContact CD2-CG 4.15Å; F316-R324 HydrophobicContact CE1-CB 4.42Å; F316-R324 HydrophobicContact CE2-CB 4.42Å; F316-R324 HydrophobicContact CE2-CG 4.28Å; F316-R324 HydrophobicContact CG-CB 3.99Å; S321-R324 WeakPolarHBondContact O-CB 3.48Å; S321-R324 PolarHBondContact O-N 3.41Å; R324-L326 VanDerWaalsContact C-N 3.35Å; R324-L326 PolarHBondContact O-N 3.22Å; R324-Y327 WeakPolarHBondContact O-CB 3.31Å; R324-Y327 PolarHBondContact O-N 3.25Å; R324-Y327 VanDerWaalsContact O-N 3.13Å; R324-A328 PolarHBondContact O-N 2.88Å
325	D	86.5	Confident	81.4	Confident	79 Å²	79	69 Å²	69	42%	0.422	36%	0.364	S	S	.	.	H	α-helix	trans	-70.6	-33.1	-175.2	-60.3	-15.7	0	0	0	111.5	S321 K322 V323 A328 Q329	S321-D325 PolarHBondContact O-N 3.3Å; K322-D325 PolarHBondContact O-N 3.33Å; V323-D325 VanDerWaalsContact C-N 3.29Å; V323-D325 PolarHBondContact O-N 2.98Å; D325-A328 PolarHBondContact O-N 3.25Å; D325-Q329 VanDerWaalsContact O-CB 3.3Å; D325-Q329 WeakPolarHBondContact O-CB 3.25Å; D325-Q329 PolarHBondContact O-N 3.45Å
326	L	86.9	Confident	82.5	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-68.7	-34.8	168.8	-66.7	173.4	0	0	0	112.8	K322 V323 R324 Q329 F330 F404 E407 L408	K322-L326 HydrophobicContact CG-CD1 4.15Å; K322-L326 HydrophobicContact CG-CG 4.27Å; K322-L326 VanDerWaalsContact O-CG 3.31Å; K322-L326 WeakPolarHBondContact O-CG 3.46Å; K322-L326 PolarHBondContact O-N 2.78Å; V323-L326 PolarHBondContact O-N 3.24Å; R324-L326 VanDerWaalsContact C-N 3.35Å; R324-L326 PolarHBondContact O-N 3.22Å; L326-Q329 PolarHBondContact O-N 2.61Å; L326-F330 HydrophobicContact CB-CD2 4.36Å; L326-F330 HydrophobicContact CD2-CD2 4.32Å; L326-F330 HydrophobicContact CD2-CE2 3.74Å; L326-F330 HydrophobicContact CD2-CZ 3.93Å; L326-F330 WeakPolarHBondContact O-CB 3.42Å; L326-F330 PolarHBondContact O-N 2.89Å; L326-F404 HydrophobicContact CB-CD1 4.1Å; L326-F404 HydrophobicContact CB-CE1 3.75Å; L326-F404 HydrophobicContact CD1-CD1 4.42Å; L326-E407 HydrophobicContact CD1-CB 3.84Å; L326-E407 HydrophobicContact CD2-CB 4.2Å; L326-E407 HydrophobicContact CD2-CG 4.08Å; L326-L408 HydrophobicContact CD1-CD1 3.89Å; L326-L408 HydrophobicContact CD1-CD2 3.8Å; L326-L408 HydrophobicContact CD1-CG 3.72Å
327	Y	87.9	Confident	83.4	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.016	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-41.6	172.6	-88.7	-69.2	0	0	0	112	F316 V323 R324 K331 G332 I333 L367 E370 I371 L374 F404	F316-Y327 HydrophobicContact CE1-CD2 4.32Å; V323-Y327 HydrophobicContact CG1-CD2 3.89Å; V323-Y327 HydrophobicContact CG1-CE2 3.72Å; V323-Y327 VanDerWaalsContact O-CD2 3.26Å; V323-Y327 WeakPolarHBondContact O-CD2 3.25Å; V323-Y327 PolarHBondContact O-N 2.81Å; R324-Y327 WeakPolarHBondContact O-CB 3.31Å; R324-Y327 PolarHBondContact O-N 3.25Å; R324-Y327 VanDerWaalsContact O-N 3.13Å; Y327-K331 HydrophobicContact CD1-CD 4.01Å; Y327-K331 HydrophobicContact CD1-CG 4.45Å; Y327-K331 HydrophobicContact CE1-CD 4.08Å; Y327-K331 CarbonylContact O-C 3.53Å; Y327-K331 WeakPolarHBondContact O-CA 3.36Å; Y327-K331 WeakPolarHBondContact O-CB 3.35Å; Y327-K331 PolarHBondContact O-N 3.29Å; Y327-G332 PolarHBondContact O-N 3.38Å; Y327-G332 VanDerWaalsContact O-N 3.14Å; Y327-I333 HydrophobicContact CD1-CD1 4.36Å; Y327-I333 PolarHBondContact O-N 2.96Å; Y327-L367 HydrophobicContact CD1-CD1 4.04Å; Y327-L367 HydrophobicContact CE1-CD1 3.51Å; Y327-E370 VanDerWaalsContact OH-CB 3.28Å; Y327-E370 WeakPolarHBondContact OH-CB 3.33Å; Y327-I371 HydrophobicContact CE2-CG1 4.22Å; Y327-L374 HydrophobicContact CE2-CD1 3.83Å; Y327-F404 HydrophobicContact CD1-CE1 4.37Å; Y327-F404 HydrophobicContact CD1-CZ 4.2Å; Y327-F404 HydrophobicContact CD2-CE1 4.44Å; Y327-F404 HydrophobicContact CE1-CE1 4.49Å; Y327-F404 HydrophobicContact CE1-CZ 4.39Å; Y327-F404 HydrophobicContact CG-CE1 4.34Å
328	A	86.1	Confident	84	Confident	42 Å²	42	72.3 Å²	72.3	35%	0.347	37%	0.368	S	S	.	.	H	α-helix	trans	-62.9	-49.9	171.3	0	0	0	0	0	111.2	R324 D325 G332	R324-A328 PolarHBondContact O-N 2.88Å; D325-A328 PolarHBondContact O-N 3.25Å; A328-G332 VanDerWaalsContact O-CA 3.26Å; A328-G332 WeakPolarHBondContact O-CA 3.5Å; A328-G332 PolarHBondContact O-N 3.06Å
329	Q	85.4	Confident	84.9	Confident	140 Å²	140	69.4 Å²	69.4	65%	0.654	35%	0.346	S	S	*	.	H	α-helix	trans	-68.4	-39.7	-174.9	-167.9	-173.5	38.9	0	0	114.5	D325 L326	D325-Q329 VanDerWaalsContact O-CB 3.3Å; D325-Q329 WeakPolarHBondContact O-CB 3.25Å; D325-Q329 PolarHBondContact O-N 3.45Å; L326-Q329 PolarHBondContact O-N 2.61Å
330	F	81.3	Confident	85.4	Confident	73 Å²	73	69.6 Å²	69.6	32%	0.32	35%	0.347	S	S	.	.	H	α-helix	trans	-99.7	-24.9	-174.2	-64.7	-22	0	0	0	114.2	L326 F404 E407	L326-F330 HydrophobicContact CB-CD2 4.36Å; L326-F330 HydrophobicContact CD2-CD2 4.32Å; L326-F330 HydrophobicContact CD2-CE2 3.74Å; L326-F330 HydrophobicContact CD2-CZ 3.93Å; L326-F330 WeakPolarHBondContact O-CB 3.42Å; L326-F330 PolarHBondContact O-N 2.89Å; F330-F404 HydrophobicContact CB-CE2 3.95Å; F330-F404 HydrophobicContact CB-CZ 3.98Å; F330-F404 HydrophobicContact CD2-CD1 4.5Å; F330-F404 AromaticContact CD2-CD2 3.98Å; F330-F404 HydrophobicContact CD2-CD2 3.98Å; F330-F404 HydrophobicContact CD2-CE1 4.3Å; F330-F404 AromaticContact CD2-CE2 3.75Å; F330-F404 HydrophobicContact CD2-CE2 3.75Å; F330-F404 HydrophobicContact CD2-CG 4.36Å; F330-F404 AromaticContact CD2-CZ 3.92Å; F330-F404 HydrophobicContact CD2-CZ 3.92Å; F330-F404 HydrophobicContact CG-CE2 4.37Å; F330-F404 HydrophobicContact CG-CZ 4.47Å; F330-E407 HydrophobicContact CE2-CG 4.28Å; F330-E407 HydrophobicContact CZ-CG 4.12Å
331	K	81.2	Confident	85.8	Confident	68 Å²	68	72.4 Å²	72.4	30%	0.296	36%	0.357	S	S	.	.	H	α-helix	trans	-121.3	-9.9	-178.2	-57.1	-163.1	-175.5	-168.7	0	114.5	Y327 I333 E370 F404	Y327-K331 HydrophobicContact CD1-CD 4.01Å; Y327-K331 HydrophobicContact CD1-CG 4.45Å; Y327-K331 HydrophobicContact CE1-CD 4.08Å; Y327-K331 CarbonylContact O-C 3.53Å; Y327-K331 WeakPolarHBondContact O-CA 3.36Å; Y327-K331 WeakPolarHBondContact O-CB 3.35Å; Y327-K331 PolarHBondContact O-N 3.29Å; K331-I333 VanDerWaalsContact C-N 3.29Å; K331-I333 HydrophobicContact CB-CD1 3.69Å; K331-I333 HydrophobicContact CB-CG1 3.82Å; K331-I333 HydrophobicContact CD-CD1 4.13Å; K331-E370 IonicContact NZ-OE1 3.04Å; K331-E370 PolarHBondContact NZ-OE1 3.28Å; K331-E370 IonicContact NZ-OE2 2.7Å; K331-E370 PolarHBondContact NZ-OE2 3.11Å; K331-F404 HydrophobicContact CD-CZ 4.43Å; K331-F404 HydrophobicContact CG-CE2 4.37Å; K331-F404 HydrophobicContact CG-CZ 4.22Å
332	G	83.4	Confident	86.2	Confident	61 Å²	61	73 Å²	73	63%	0.629	36%	0.359	S	S	*	.			trans	70.9	23.4	-176.9	0	0	0	0	0	113.6	Y327 A328	Y327-G332 PolarHBondContact O-N 3.38Å; Y327-G332 VanDerWaalsContact O-N 3.14Å; A328-G332 VanDerWaalsContact O-CA 3.26Å; A328-G332 WeakPolarHBondContact O-CA 3.5Å; A328-G332 PolarHBondContact O-N 3.06Å
333	I	84.5	Confident	86.5	Confident	47 Å²	47	68.9 Å²	68.9	24%	0.241	34%	0.341	C	S	.	.			trans	-98.9	102.3	-174.8	-58.2	173.6	0	0	0	109.2	Y327 K331 L336 L367	Y327-I333 HydrophobicContact CD1-CD1 4.36Å; Y327-I333 PolarHBondContact O-N 2.96Å; K331-I333 VanDerWaalsContact C-N 3.29Å; K331-I333 HydrophobicContact CB-CD1 3.69Å; K331-I333 HydrophobicContact CB-CG1 3.82Å; K331-I333 HydrophobicContact CD-CD1 4.13Å; I333-L336 HydrophobicContact CG2-CD2 4.22Å; I333-L367 HydrophobicContact CD1-CD1 3.81Å; I333-L367 HydrophobicContact CD1-CD2 3.93Å; I333-L367 HydrophobicContact CG2-CD2 4.14Å
334	E	83.6	Confident	86.7	Confident	173 Å²	173	69.5 Å²	69.5	81%	0.808	34%	0.344	S	S	*	.			trans	-91.9	-28.5	176.6	-62	-177.5	174.8	0	0	113.3
335	K	85.3	Confident	86.8	Confident	182 Å²	182	66.8 Å²	66.8	79%	0.791	34%	0.34	S	S	*	.			trans	-141.5	147	-176.6	-65.4	-177.1	-178.6	177.3	0	110.5
336	L	87	Confident	86.9	Confident	37 Å²	37	64.6 Å²	64.6	19%	0.194	33%	0.328	C	S	.	.			trans	-89.5	159	171.4	-56.3	-171.7	0	0	0	110.5	Y317 I333 Q340 L344 L367 I371	Y317-L336 HydrophobicContact CD2-CD1 4.42Å; Y317-L336 HydrophobicContact CE2-CD1 3.54Å; I333-L336 HydrophobicContact CG2-CD2 4.22Å; L336-Q340 HydrophobicContact CB-CB 4.13Å; L336-L344 HydrophobicContact CD1-CD1 3.7Å; L336-L367 HydrophobicContact CD2-CD2 3.5Å; L336-L367 HydrophobicContact CD2-CG 4.17Å; L336-I371 HydrophobicContact CD1-CD1 3.85Å; L336-I371 HydrophobicContact CD2-CD1 4.24Å
337	Y	89.1	Confident	86.9	Confident	87 Å²	87	69.7 Å²	69.7	34%	0.341	36%	0.355	S	S	.	.			trans	-70.9	152.3	167.4	-59.2	-54.6	0	0	0	110.9	W339 Q340 H341 F519 P521	Y337-W339 VanDerWaalsContact C-N 3.28Å; Y337-W339 AromaticContact CD2-NE1 3.92Å; Y337-W339 PolarHBondContact O-N 3.21Å; Y337-Q340 HydrophobicContact CD2-CG 4.46Å; Y337-Q340 WeakPolarHBondContact O-CA 3.22Å; Y337-Q340 WeakPolarHBondContact O-CB 3.33Å; Y337-Q340 PolarHBondContact O-N 3.31Å; Y337-H341 PolarHBondContact O-N 3.13Å; Y337-H341 VanDerWaalsContact O-N 3.08Å; Y337-F519 AromaticContact CD1-CE1 3.85Å; Y337-F519 HydrophobicContact CD1-CE1 3.85Å; Y337-F519 AromaticContact CD1-CZ 3.55Å; Y337-F519 HydrophobicContact CD1-CZ 3.55Å; Y337-F519 AromaticContact CD2-CE1 3.65Å; Y337-F519 HydrophobicContact CD2-CE1 3.65Å; Y337-F519 HydrophobicContact CD2-CZ 4.24Å; Y337-F519 HydrophobicContact CE1-CE1 4.17Å; Y337-F519 AromaticContact CE1-CZ 3.91Å; Y337-F519 HydrophobicContact CE1-CZ 3.91Å; Y337-F519 AromaticContact CE2-CE1 3.98Å; Y337-F519 HydrophobicContact CE2-CE1 3.98Å; Y337-F519 AromaticContact CG-CE1 3.59Å; Y337-F519 HydrophobicContact CG-CE1 3.59Å; Y337-F519 AromaticContact CG-CZ 3.75Å; Y337-F519 HydrophobicContact CG-CZ 3.75Å; Y337-P521 HydrophobicContact CE2-CG 3.89Å; Y337-P521 WeakPolarHBondContact OH-CG 3.42Å
338	E	88.3	Confident	86.7	Confident	168 Å²	168	69.6 Å²	69.6	79%	0.785	36%	0.355	S	S	*	.	H	α-helix	trans	-54.9	-41.7	-179.9	-175.1	173.8	-151.9	0	0	112.6	Q340 H341 T342	E338-Q340 VanDerWaalsContact C-N 3.29Å; E338-Q340 PolarHBondContact O-N 3.14Å; E338-H341 PolarHBondContact O-N 2.72Å; E338-T342 PolarHBondContact O-N 3.03Å; E338-T342 PolarHBondContact O-OG1 2.58Å; E338-T342 VanDerWaalsContact O-OG1 3.1Å
339	W	90.9	Very high	86.8	Confident	10 Å²	10	68 Å²	68	4%	0.038	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-35	175.7	83.8	-100.9	0	0	0	112.7	Y337 C343 Y357 L359 G363 V368 Y515 F519	Y337-W339 VanDerWaalsContact C-N 3.28Å; Y337-W339 AromaticContact CD2-NE1 3.92Å; Y337-W339 PolarHBondContact O-N 3.21Å; W339-C343 HydrophobicContact CE3-CB 4.22Å; W339-C343 HydrophobicContact CZ3-CB 4.27Å; W339-C343 WeakPolarHBondContact O-CB 3.45Å; W339-C343 PolarHBondContact O-N 3.5Å; W339-Y357 HydrophobicContact CH2-CE2 4.38Å; W339-Y357 HydrophobicContact CZ3-CD2 4.42Å; W339-L359 HydrophobicContact CD2-CD1 4.49Å; W339-L359 HydrophobicContact CD2-CD2 3.34Å; W339-L359 VanDerWaalsContact CE2-CD2 3.43Å; W339-L359 HydrophobicContact CE3-CD1 3.9Å; W339-L359 HydrophobicContact CE3-CD2 3.59Å; W339-L359 HydrophobicContact CE3-CG 4.43Å; W339-L359 HydrophobicContact CG-CD2 3.84Å; W339-L359 HydrophobicContact CH2-CD1 3.99Å; W339-L359 HydrophobicContact CH2-CD2 4.08Å; W339-L359 HydrophobicContact CZ2-CD2 3.82Å; W339-L359 HydrophobicContact CZ3-CD1 3.63Å; W339-L359 HydrophobicContact CZ3-CD2 3.96Å; W339-L359 HydrophobicContact CZ3-CG 4.48Å; W339-G363 VanDerWaalsContact CZ2-O 3.26Å; W339-G363 WeakPolarHBondContact CZ2-O 3.48Å; W339-G363 PolarHBondContact NE1-O 3.18Å; W339-V368 HydrophobicContact CH2-CG2 3.69Å; W339-V368 HydrophobicContact CZ3-CG2 3.8Å; W339-Y515 AromaticContact CE3-CE1 3.92Å; W339-Y515 HydrophobicContact CE3-CE1 3.92Å; W339-F519 AromaticContact CD1-CD1 3.27Å; W339-F519 AromaticContact CD1-CE1 3.9Å; W339-F519 AromaticContact CD1-CG 3.63Å; W339-F519 HydrophobicContact CG-CB 4.49Å; W339-F519 HydrophobicContact CG-CD1 4.48Å; W339-F519 AromaticContact NE1-CD1 3.45Å; W339-F519 AromaticContact NE1-CE1 3.95Å
340	Q	91.4	Very high	86.7	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.019	34%	0.34	C	S	.	.	H	α-helix	trans	-70.4	-42.7	179.2	-63.9	175	-40.1	0	0	110.5	L336 Y337 E338 C343 L344 G364 V368	L336-Q340 HydrophobicContact CB-CB 4.13Å; Y337-Q340 HydrophobicContact CD2-CG 4.46Å; Y337-Q340 WeakPolarHBondContact O-CA 3.22Å; Y337-Q340 WeakPolarHBondContact O-CB 3.33Å; Y337-Q340 PolarHBondContact O-N 3.31Å; E338-Q340 VanDerWaalsContact C-N 3.29Å; E338-Q340 PolarHBondContact O-N 3.14Å; Q340-C343 PolarHBondContact O-N 3.41Å; Q340-L344 WeakPolarHBondContact O-CB 3.44Å; Q340-L344 VanDerWaalsContact O-CG 3.28Å; Q340-L344 WeakPolarHBondContact O-CG 3.3Å; Q340-L344 PolarHBondContact O-N 3.24Å; Q340-G364 PolarHBondContact NE2-O 3.02Å; Q340-V368 HydrophobicContact CB-CG2 3.85Å; Q340-V368 HydrophobicContact CG-CG2 3.82Å
341	H	88.7	Confident	86.9	Confident	96 Å²	96	69.7 Å²	69.7	44%	0.444	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-56	171.6	178.5	-64	0	0	0	110	Y317 Y337 E338 C343 L344 T345	Y317-H341 PolarHBondContact OH-CD2 3.11Å; Y337-H341 PolarHBondContact O-N 3.13Å; Y337-H341 VanDerWaalsContact O-N 3.08Å; E338-H341 PolarHBondContact O-N 2.72Å; H341-C343 VanDerWaalsContact C-N 3.31Å; H341-C343 PolarHBondContact O-N 3.03Å; H341-L344 PolarHBondContact O-N 2.79Å; H341-L344 VanDerWaalsContact O-N 3.14Å; H341-T345 WeakPolarHBondContact O-CG2 3.23Å; H341-T345 PolarHBondContact O-N 3.44Å; H341-T345 PolarHBondContact O-OG1 3.11Å
342	T	89.4	Confident	87.3	Confident	58 Å²	58	70.4 Å²	70.4	36%	0.356	35%	0.351	S	S	.	.	H	α-helix	trans	-53.5	-46.8	-180	-62.7	0	0	0	0	112	E338 T345 L346 Y515	E338-T342 PolarHBondContact O-N 3.03Å; E338-T342 PolarHBondContact O-OG1 2.58Å; E338-T342 VanDerWaalsContact O-OG1 3.1Å; T342-T345 WeakPolarHBondContact CA-OG1 3.25Å; T342-T345 PolarHBondContact O-N 2.85Å; T342-T345 PolarHBondContact O-OG1 3.42Å; T342-L346 PolarHBondContact O-N 3.34Å; T342-Y515 HydrophobicContact CG2-CE2 4.1Å
343	C	90	Very high	87.7	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.9	-43.6	178.3	-173.3	0	0	0	0	112.7	W339 Q340 H341 T345 L346 Y515	W339-C343 HydrophobicContact CE3-CB 4.22Å; W339-C343 HydrophobicContact CZ3-CB 4.27Å; W339-C343 WeakPolarHBondContact O-CB 3.45Å; W339-C343 PolarHBondContact O-N 3.5Å; Q340-C343 PolarHBondContact O-N 3.41Å; H341-C343 VanDerWaalsContact C-N 3.31Å; H341-C343 PolarHBondContact O-N 3.03Å; C343-T345 VanDerWaalsContact C-N 3.28Å; C343-T345 PolarHBondContact O-N 3.07Å; C343-L346 WeakPolarHBondContact O-CG 3.34Å; C343-L346 PolarHBondContact O-N 2.89Å; C343-Y515 HydrophobicContact CB-CD1 4.33Å; C343-Y515 HydrophobicContact CB-CE1 4.26Å
344	L	88.4	Confident	88.2	Confident	13 Å²	13	71.4 Å²	71.4	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-68.2	-25.7	175.5	-71.3	167.7	0	0	0	113.1	Y317 L336 Q340 H341 V368 I371 L372	Y317-L344 HydrophobicContact CD1-CB 3.64Å; Y317-L344 HydrophobicContact CD1-CD1 4Å; Y317-L344 HydrophobicContact CD1-CG 4.41Å; Y317-L344 HydrophobicContact CD2-CD1 4.19Å; Y317-L344 HydrophobicContact CE1-CB 3.74Å; Y317-L344 HydrophobicContact CE1-CD1 3.95Å; Y317-L344 HydrophobicContact CE2-CD1 4.16Å; Y317-L344 HydrophobicContact CG-CB 4.42Å; Y317-L344 HydrophobicContact CG-CD1 4.11Å; L336-L344 HydrophobicContact CD1-CD1 3.7Å; Q340-L344 WeakPolarHBondContact O-CB 3.44Å; Q340-L344 VanDerWaalsContact O-CG 3.28Å; Q340-L344 WeakPolarHBondContact O-CG 3.3Å; Q340-L344 PolarHBondContact O-N 3.24Å; H341-L344 PolarHBondContact O-N 2.79Å; H341-L344 VanDerWaalsContact O-N 3.14Å; L344-V368 HydrophobicContact CD2-CG1 3.93Å; L344-V368 HydrophobicContact CG-CG1 4.23Å; L344-I371 HydrophobicContact CD1-CD1 3.82Å; L344-I371 HydrophobicContact CD1-CG2 4.13Å; L344-I371 HydrophobicContact CD2-CB 4.27Å; L344-I371 HydrophobicContact CD2-CG2 3.76Å; L344-L372 HydrophobicContact CD2-CD1 4.28Å; L344-L372 HydrophobicContact CD2-CD2 3.8Å; L344-L372 HydrophobicContact CD2-CG 3.87Å
345	T	88.1	Confident	88.8	Confident	54 Å²	54	63.2 Å²	63.2	33%	0.331	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.3	178	52.5	0	0	0	0	115.1	Y317 H341 T342 C343 N347 Q350	Y317-T345 HydrophobicContact CE1-CG2 4.35Å; H341-T345 WeakPolarHBondContact O-CG2 3.23Å; H341-T345 PolarHBondContact O-N 3.44Å; H341-T345 PolarHBondContact O-OG1 3.11Å; T342-T345 WeakPolarHBondContact CA-OG1 3.25Å; T342-T345 PolarHBondContact O-N 2.85Å; T342-T345 PolarHBondContact O-OG1 3.42Å; C343-T345 VanDerWaalsContact C-N 3.28Å; C343-T345 PolarHBondContact O-N 3.07Å; T345-N347 PolarHBondContact O-N 3.44Å; T345-Q350 PolarHBondContact O-NE2 3.07Å
346	L	88.6	Confident	89.3	Confident	33 Å²	33	54.5 Å²	54.5	17%	0.173	26%	0.261	C	S	.	.			trans	-58	137.4	179.6	-68.3	173.5	0	0	0	111.9	T342 C343 S348 V349 Q350 L355 Y515	T342-L346 PolarHBondContact O-N 3.34Å; C343-L346 WeakPolarHBondContact O-CG 3.34Å; C343-L346 PolarHBondContact O-N 2.89Å; L346-S348 PolarHBondContact O-N 3.4Å; L346-V349 HydrophobicContact CB-CG2 4.14Å; L346-V349 WeakPolarHBondContact O-CB 3.23Å; L346-V349 PolarHBondContact O-N 3.44Å; L346-Q350 PolarHBondContact O-N 3.15Å; L346-L355 HydrophobicContact CD1-CD1 4.27Å; L346-Y515 HydrophobicContact CD1-CD2 4.1Å; L346-Y515 HydrophobicContact CD1-CG 4.4Å
347	N	86.4	Confident	89.6	Confident	114 Å²	114	52.8 Å²	52.8	61%	0.61	25%	0.252	S	S	*	.	H	α-helix	trans	-57.1	-36.4	178.3	-67.1	3.7	0	0	0	111.8	T345 V349 Q350 E351	T345-N347 PolarHBondContact O-N 3.44Å; N347-V349 VanDerWaalsContact C-N 3.33Å; N347-V349 PolarHBondContact O-N 2.95Å; N347-Q350 WeakPolarHBondContact O-CB 3.33Å; N347-Q350 PolarHBondContact O-N 3.25Å; N347-E351 WeakPolarHBondContact O-CB 3.49Å; N347-E351 VanDerWaalsContact O-CG 3.28Å; N347-E351 WeakPolarHBondContact O-CG 3.41Å; N347-E351 PolarHBondContact O-N 3.47Å
348	S	84.4	Confident	89.7	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-34.3	175.2	36.6	0	0	0	0	114	L346 E351 R352 K353 E513	L346-S348 PolarHBondContact O-N 3.4Å; S348-E351 CarbonylContact O-C 3.43Å; S348-R352 PolarHBondContact O-N 3.42Å; S348-R352 VanDerWaalsContact O-N 3.09Å; S348-K353 PolarHBondContact O-N 3.13Å; S348-E513 WeakPolarHBondContact CB-OE2 3.47Å; S348-E513 PolarHBondContact OG-OE1 3.44Å; S348-E513 PolarHBondContact OG-OE2 3.02Å
349	V	86.4	Confident	89.7	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-68.7	-41.2	173.6	174.5	0	0	0	0	110.2	L346 N347 R352 L355 L372	L346-V349 HydrophobicContact CB-CG2 4.14Å; L346-V349 WeakPolarHBondContact O-CB 3.23Å; L346-V349 PolarHBondContact O-N 3.44Å; N347-V349 VanDerWaalsContact C-N 3.33Å; N347-V349 PolarHBondContact O-N 2.95Å; V349-R352 PolarHBondContact O-N 3.4Å; V349-L355 HydrophobicContact CG2-CD2 3.83Å; V349-L372 HydrophobicContact CG1-CD1 4.39Å; V349-L372 HydrophobicContact CG1-CD2 3.65Å
350	Q	83.8	Confident	89.3	Confident	135 Å²	135	42 Å²	42	63%	0.631	21%	0.208	S	C	*	.	H	α-helix	trans	-66.1	-38.4	175.6	-57.6	179.3	31.3	0	0	112.2	T345 L346 N347 R352	T345-Q350 PolarHBondContact O-NE2 3.07Å; L346-Q350 PolarHBondContact O-N 3.15Å; N347-Q350 WeakPolarHBondContact O-CB 3.33Å; N347-Q350 PolarHBondContact O-N 3.25Å; Q350-R352 PolarHBondContact O-N 2.95Å
351	E	86.1	Confident	88.6	Confident	113 Å²	113	43.9 Å²	43.9	53%	0.528	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	1.1	175	-69.2	172.7	179	0	0	113.7	N347 S348 K353	N347-E351 WeakPolarHBondContact O-CB 3.49Å; N347-E351 VanDerWaalsContact O-CG 3.28Å; N347-E351 WeakPolarHBondContact O-CG 3.41Å; N347-E351 PolarHBondContact O-N 3.47Å; S348-E351 CarbonylContact O-C 3.43Å; E351-K353 HydrophobicContact CB-CD 4.45Å; E351-K353 HydrophobicContact CB-CG 4.35Å; E351-K353 PolarHBondContact O-N 3.27Å; E351-K353 WeakPolarHBondContact OE2-CD 3.3Å; E351-K353 WeakPolarHBondContact OE2-CE 3.5Å; E351-K353 IonicContact OE2-NZ 2.77Å; E351-K353 PolarHBondContact OE2-NZ 3.25Å
352	R	89.1	Confident	88	Confident	84 Å²	84	41.4 Å²	41.4	32%	0.317	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	27.9	-176.3	-62.4	179.9	57.5	125.3	5.2	115.5	S348 V349 Q350 E376 C380 G458	S348-R352 PolarHBondContact O-N 3.42Å; S348-R352 VanDerWaalsContact O-N 3.09Å; V349-R352 PolarHBondContact O-N 3.4Å; Q350-R352 PolarHBondContact O-N 2.95Å; R352-E376 IonicContact CZ-OE1 2.72Å; R352-E376 IonicContact CZ-OE2 2.83Å; R352-E376 VanDerWaalsContact CZ-OE2 3.26Å; R352-E376 VanDerWaalsContact NH1-CD 3.31Å; R352-E376 IonicContact NH1-OE1 3.34Å; R352-E376 PolarHBondContact NH1-OE1 2.84Å; R352-E376 VanDerWaalsContact NH1-OE1 3.11Å; R352-E376 IonicContact NH1-OE2 3.19Å; R352-E376 PolarHBondContact NH1-OE2 2.97Å; R352-E376 VanDerWaalsContact NH2-CD 3.28Å; R352-E376 IonicContact NH2-OE1 2.85Å; R352-E376 PolarHBondContact NH2-OE1 2.88Å; R352-E376 IonicContact NH2-OE2 3.23Å; R352-E376 PolarHBondContact NH2-OE2 2.93Å; R352-C380 PolarHBondContact NH1-SG 3Å; R352-G458 PolarHBondContact NH2-O 2.88Å
353	K	91.9	Very high	87.4	Confident	108 Å²	108	38.7 Å²	38.7	47%	0.47	20%	0.197	S	C	.	.			trans	-67.5	156	171.3	-73	171.5	172.1	162.1	0	111	S348 E351 Q492	S348-K353 PolarHBondContact O-N 3.13Å; E351-K353 HydrophobicContact CB-CD 4.45Å; E351-K353 HydrophobicContact CB-CG 4.35Å; E351-K353 PolarHBondContact O-N 3.27Å; E351-K353 WeakPolarHBondContact OE2-CD 3.3Å; E351-K353 WeakPolarHBondContact OE2-CE 3.5Å; E351-K353 IonicContact OE2-NZ 2.77Å; E351-K353 PolarHBondContact OE2-NZ 3.25Å; K353-Q492 PolarHBondContact O-NE2 2.71Å
354	N	95.8	Very high	87.1	Confident	20 Å²	20	39.9 Å²	39.9	11%	0.107	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	145.4	174.4	-65.6	-16.8	0	0	0	110.4	I493 L510 A512 E513	N354-I493 VanDerWaalsContact CA-O 3.28Å; N354-I493 WeakPolarHBondContact CA-O 3.29Å; N354-I493 WeakPolarHBondContact CB-O 3.46Å; N354-I493 PolarHBondContact OD1-N 2.86Å; N354-L510 WeakPolarHBondContact CB-O 3.39Å; N354-L510 PolarHBondContact ND2-O 2.8Å; N354-A512 HydrophobicContact CB-CB 3.78Å; N354-A512 VanDerWaalsContact O-CA 3.27Å; N354-A512 WeakPolarHBondContact O-CA 3.23Å; N354-E513 PolarHBondContact O-N 3.06Å
355	L	95.4	Very high	87.1	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.6	-173.2	179.3	67.4	0	0	0	111.3	L346 V349 Y357 I493 I494 G495 E513	L346-L355 HydrophobicContact CD1-CD1 4.27Å; V349-L355 HydrophobicContact CG2-CD2 3.83Å; L355-Y357 HydrophobicContact CD2-CD1 3.96Å; L355-Y357 HydrophobicContact CG-CD1 4.22Å; L355-I493 PolarHBondContact N-O 3.15Å; L355-I494 HydrophobicContact CB-CG1 4.46Å; L355-I494 CarbonylContact O-C 3.51Å; L355-I494 VanDerWaalsContact O-CA 3.31Å; L355-I494 WeakPolarHBondContact O-CA 3.37Å; L355-G495 PolarHBondContact O-N 3.3Å; L355-E513 HydrophobicContact CD1-CB 4.39Å
356	I	95.3	Very high	87.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.5	165.8	-58.6	169.1	0	0	0	107.6	L465 G495 L500 L506 Q507 L510 A512 E513 Y514 Y515	I356-L465 HydrophobicContact CD1-CD2 4.43Å; I356-L465 HydrophobicContact CG1-CD2 4.21Å; I356-L465 HydrophobicContact CG2-CD2 4.17Å; I356-G495 CarbonylContact C-O 3.59Å; I356-G495 WeakPolarHBondContact CA-O 3.15Å; I356-L500 HydrophobicContact CG2-CD1 3.69Å; I356-L506 HydrophobicContact CD1-CB 3.89Å; I356-Q507 HydrophobicContact CD1-CG 4.17Å; I356-L510 HydrophobicContact CD1-CD1 4.11Å; I356-L510 HydrophobicContact CG1-CD1 4.17Å; I356-A512 HydrophobicContact CD1-CB 4.05Å; I356-A512 HydrophobicContact CG1-CB 3.89Å; I356-E513 PolarHBondContact N-O 2.85Å; I356-Y514 HydrophobicContact CB-CD2 4.18Å; I356-Y514 HydrophobicContact CG2-CD2 3.96Å; I356-Y514 HydrophobicContact CG2-CE2 4.33Å; I356-Y514 WeakPolarHBondContact O-CA 3.27Å; I356-Y515 PolarHBondContact O-N 3.34Å
357	Y	93.8	Very high	87.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.6	169.9	63.3	-93.2	0	0	0	114.5	W339 L355 L359 K365 V368 A369 I494 G495 M496 S497 Y515	W339-Y357 HydrophobicContact CH2-CE2 4.38Å; W339-Y357 HydrophobicContact CZ3-CD2 4.42Å; L355-Y357 HydrophobicContact CD2-CD1 3.96Å; L355-Y357 HydrophobicContact CG-CD1 4.22Å; Y357-L359 HydrophobicContact CD2-CD1 3.87Å; Y357-K365 HydrophobicContact CD2-CD 4.43Å; Y357-K365 HydrophobicContact CD2-CG 4.48Å; Y357-K365 HydrophobicContact CE2-CB 3.94Å; Y357-K365 HydrophobicContact CE2-CD 4.41Å; Y357-K365 HydrophobicContact CE2-CG 4.2Å; Y357-K365 PolarHBondContact OH-O 3.43Å; Y357-V368 HydrophobicContact CE1-CG1 4.22Å; Y357-A369 PolarHBondContact OH-N 3.42Å; Y357-I494 HydrophobicContact CD1-CG2 4.22Å; Y357-I494 HydrophobicContact CE1-CG2 3.62Å; Y357-G495 PolarHBondContact N-O 3Å; Y357-M496 HydrophobicContact CD1-CB 4.47Å; Y357-M496 HydrophobicContact CD2-CB 3.94Å; Y357-M496 HydrophobicContact CE1-CB 4.11Å; Y357-M496 HydrophobicContact CE2-CB 3.53Å; Y357-M496 HydrophobicContact CE2-CG 4.49Å; Y357-M496 HydrophobicContact CE2-SD 4.22Å; Y357-M496 HydrophobicContact CG-CB 4.4Å; Y357-M496 WeakPolarHBondContact O-CA 3.29Å; Y357-M496 PolarHBondContact OH-SD 3.17Å; Y357-M496 VanDerWaalsContact OH-SD 3.38Å; Y357-S497 PolarHBondContact O-N 3.11Å; Y357-Y515 VanDerWaalsContact CA-O 3.26Å; Y357-Y515 WeakPolarHBondContact CA-O 3.32Å
358	S	90.8	Very high	87.6	Confident	11 Å²	11	32.7 Å²	32.7	8%	0.077	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115.6	-176.9	-174.7	0	0	0	0	110.9	S497 Y514 Y515 T516 S517	S358-S497 WeakPolarHBondContact CA-O 3.47Å; S358-Y514 WeakPolarHBondContact CB-OH 3.26Å; S358-Y515 PolarHBondContact N-O 2.99Å; S358-T516 VanDerWaalsContact O-CA 3.32Å; S358-T516 WeakPolarHBondContact O-CA 3.45Å; S358-T516 WeakPolarHBondContact O-CB 3.28Å; S358-T516 PolarHBondContact O-OG1 2.94Å; S358-S517 PolarHBondContact O-N 3.39Å
359	L	88.8	Confident	88.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.17	C	C	.	.			trans	-143.9	148.3	177.1	-71	97.7	0	0	0	110.9	W339 Y357 K365 S497 A498 Y515 S517	W339-L359 HydrophobicContact CD2-CD1 4.49Å; W339-L359 HydrophobicContact CD2-CD2 3.34Å; W339-L359 VanDerWaalsContact CE2-CD2 3.43Å; W339-L359 HydrophobicContact CE3-CD1 3.9Å; W339-L359 HydrophobicContact CE3-CD2 3.59Å; W339-L359 HydrophobicContact CE3-CG 4.43Å; W339-L359 HydrophobicContact CG-CD2 3.84Å; W339-L359 HydrophobicContact CH2-CD1 3.99Å; W339-L359 HydrophobicContact CH2-CD2 4.08Å; W339-L359 HydrophobicContact CZ2-CD2 3.82Å; W339-L359 HydrophobicContact CZ3-CD1 3.63Å; W339-L359 HydrophobicContact CZ3-CD2 3.96Å; W339-L359 HydrophobicContact CZ3-CG 4.48Å; Y357-L359 HydrophobicContact CD2-CD1 3.87Å; L359-K365 HydrophobicContact CB-CD 4.2Å; L359-K365 HydrophobicContact CB-CG 4.08Å; L359-K365 PolarHBondContact O-NZ 2.8Å; L359-S497 PolarHBondContact N-O 3.33Å; L359-A498 WeakPolarHBondContact O-CA 3.41Å; L359-Y515 HydrophobicContact CD1-CD1 4.35Å; L359-Y515 HydrophobicContact CD1-CE1 4.42Å; L359-S517 WeakPolarHBondContact CG-O 3.45Å
360	P	82.5	Confident	88.4	Confident	27 Å²	27	32.9 Å²	32.9	18%	0.175	17%	0.17	C	C	.	.			trans	-49.2	152.9	177.4	-29.4	35.4	0	0	0	115.1	G363 S517	P360-G363 PolarHBondContact O-N 3Å; P360-S517 VanDerWaalsContact CD-O 3.26Å; P360-S517 WeakPolarHBondContact CD-O 3.46Å
361	T	76.6	Confident	88.8	Confident	43 Å²	43	26.5 Å²	26.5	26%	0.264	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	143	167	-48.6	0	0	0	0	110	G363	T361-G363 VanDerWaalsContact C-N 3.27Å; T361-G363 PolarHBondContact O-N 2.98Å
362	S	75.6	Confident	89.1	Confident	44 Å²	44	21.6 Å²	21.6	31%	0.308	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	-7.2	-165.5	78.4	0	0	0	0	117.5	G364 R520 P521	S362-G364 PolarHBondContact O-N 3.45Å; S362-R520 WeakPolarHBondContact OG-CG 3.48Å; S362-R520 PolarHBondContact OG-NE 3.07Å; S362-P521 VanDerWaalsContact O-CD 3.29Å; S362-P521 WeakPolarHBondContact O-CD 3.33Å; S362-P521 WeakPolarHBondContact O-CG 3.39Å
363	G	76.8	Confident	89.4	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.01	10%	0.103	C	C	.	.	S	Bend	trans	-60.8	-14.4	-179.1	0	0	0	0	0	116.8	W339 P360 T361	W339-G363 VanDerWaalsContact CZ2-O 3.26Å; W339-G363 WeakPolarHBondContact CZ2-O 3.48Å; W339-G363 PolarHBondContact NE1-O 3.18Å; P360-G363 PolarHBondContact O-N 3Å; T361-G363 VanDerWaalsContact C-N 3.27Å; T361-G363 PolarHBondContact O-N 2.98Å
364	G	84.1	Confident	89.4	Confident	26 Å²	26	12.8 Å²	12.8	27%	0.268	8%	0.082	S	C	.	.			trans	96.5	20.2	179.8	0	0	0	0	0	115.4	Q340 S362 T366 L367	Q340-G364 PolarHBondContact NE2-O 3.02Å; S362-G364 PolarHBondContact O-N 3.45Å; G364-T366 PolarHBondContact O-N 2.81Å; G364-L367 PolarHBondContact O-N 2.91Å
365	K	89.6	Confident	89.2	Confident	13 Å²	13	14.2 Å²	14.2	6%	0.057	9%	0.088	C	C	.	.	H	α-helix	trans	-48.1	-49	-173	-68	-159.2	-62.7	-92.7	0	115.2	Y357 L359 L367 V368 M496 S497 A498	Y357-K365 HydrophobicContact CD2-CD 4.43Å; Y357-K365 HydrophobicContact CD2-CG 4.48Å; Y357-K365 HydrophobicContact CE2-CB 3.94Å; Y357-K365 HydrophobicContact CE2-CD 4.41Å; Y357-K365 HydrophobicContact CE2-CG 4.2Å; Y357-K365 PolarHBondContact OH-O 3.43Å; L359-K365 HydrophobicContact CB-CD 4.2Å; L359-K365 HydrophobicContact CB-CG 4.08Å; L359-K365 PolarHBondContact O-NZ 2.8Å; K365-L367 PolarHBondContact O-N 3.45Å; K365-V368 PolarHBondContact O-N 2.64Å; K365-M496 HydrophobicContact CB-SD 4.01Å; K365-M496 HydrophobicContact CD-CB 4.27Å; K365-S497 VanDerWaalsContact CD-O 3.25Å; K365-S497 WeakPolarHBondContact CD-O 3.34Å; K365-S497 WeakPolarHBondContact CE-O 3.28Å; K365-S497 PolarHBondContact NZ-O 3.1Å; K365-S497 VanDerWaalsContact NZ-O 3.12Å; K365-A498 VanDerWaalsContact NZ-N 3.18Å
366	T	90.4	Very high	89	Confident	30 Å²	30	14.6 Å²	14.6	18%	0.184	9%	0.09	C	C	.	.	H	α-helix	trans	-62.2	-27.5	-172.9	-35.6	0	0	0	0	113.3	G364 V368 A369 E370 M386 K397 M496	G364-T366 PolarHBondContact O-N 2.81Å; T366-V368 VanDerWaalsContact C-N 3.35Å; T366-V368 PolarHBondContact O-N 2.72Å; T366-A369 PolarHBondContact O-N 3.04Å; T366-E370 HydrophobicContact CG2-CG 4.26Å; T366-E370 VanDerWaalsContact O-CG 3.32Å; T366-E370 WeakPolarHBondContact O-CG 3.14Å; T366-E370 PolarHBondContact O-N 3.06Å; T366-M386 HydrophobicContact CG2-CE 3.83Å; T366-K397 HydrophobicContact CG2-CD 4.45Å; T366-M496 HydrophobicContact CG2-CE 4.22Å
367	L	90.9	Very high	88.9	Confident	19 Å²	19	14.9 Å²	14.9	10%	0.099	9%	0.091	C	C	.	.	H	α-helix	trans	-67.4	-34.7	-176.5	-175.6	61.1	0	0	0	112.7	Y327 I333 L336 G364 K365 E370 I371	Y327-L367 HydrophobicContact CD1-CD1 4.04Å; Y327-L367 HydrophobicContact CE1-CD1 3.51Å; I333-L367 HydrophobicContact CD1-CD1 3.81Å; I333-L367 HydrophobicContact CD1-CD2 3.93Å; I333-L367 HydrophobicContact CG2-CD2 4.14Å; L336-L367 HydrophobicContact CD2-CD2 3.5Å; L336-L367 HydrophobicContact CD2-CG 4.17Å; G364-L367 PolarHBondContact O-N 2.91Å; K365-L367 PolarHBondContact O-N 3.45Å; L367-E370 PolarHBondContact O-N 3.37Å; L367-I371 HydrophobicContact CG-CD1 4.38Å; L367-I371 WeakPolarHBondContact O-CG1 3.33Å; L367-I371 PolarHBondContact O-N 3.04Å; L367-I371 VanDerWaalsContact O-N 3.12Å
368	V	92.2	Very high	88.7	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-64.8	-47.1	173.8	173.5	0	0	0	0	109.8	W339 Q340 L344 Y357 K365 T366 E370 I371 L372	W339-V368 HydrophobicContact CH2-CG2 3.69Å; W339-V368 HydrophobicContact CZ3-CG2 3.8Å; Q340-V368 HydrophobicContact CB-CG2 3.85Å; Q340-V368 HydrophobicContact CG-CG2 3.82Å; L344-V368 HydrophobicContact CD2-CG1 3.93Å; L344-V368 HydrophobicContact CG-CG1 4.23Å; Y357-V368 HydrophobicContact CE1-CG1 4.22Å; K365-V368 PolarHBondContact O-N 2.64Å; T366-V368 VanDerWaalsContact C-N 3.35Å; T366-V368 PolarHBondContact O-N 2.72Å; V368-E370 PolarHBondContact O-N 2.98Å; V368-I371 PolarHBondContact O-N 3.46Å; V368-L372 HydrophobicContact CG1-CD1 4.14Å; V368-L372 WeakPolarHBondContact O-CG 3.41Å; V368-L372 PolarHBondContact O-N 3.27Å; V368-L372 VanDerWaalsContact O-N 3.16Å
369	A	93.8	Very high	88.5	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.4	-46.1	174.5	0	0	0	0	0	112.2	Y357 T366 I371 L372 M373 V461 M496	Y357-A369 PolarHBondContact OH-N 3.42Å; T366-A369 PolarHBondContact O-N 3.04Å; A369-I371 VanDerWaalsContact C-N 3.31Å; A369-I371 PolarHBondContact O-N 3.26Å; A369-L372 PolarHBondContact O-N 3.39Å; A369-M373 WeakPolarHBondContact O-CB 3.22Å; A369-M373 VanDerWaalsContact O-CG 3.25Å; A369-M373 WeakPolarHBondContact O-CG 3.27Å; A369-M373 PolarHBondContact O-N 3.07Å; A369-V461 HydrophobicContact CB-CG1 3.81Å; A369-V461 HydrophobicContact CB-CG2 4.38Å; A369-M496 HydrophobicContact CB-CE 3.8Å; A369-M496 HydrophobicContact CB-SD 4.06Å
370	E	93.4	Very high	88.4	Confident	14 Å²	14	21.2 Å²	21.2	7%	0.065	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-37.2	179.4	-70.9	173.2	159.3	0	0	113.2	Y327 K331 T366 L367 V368 M373 L374 L401	Y327-E370 VanDerWaalsContact OH-CB 3.28Å; Y327-E370 WeakPolarHBondContact OH-CB 3.33Å; K331-E370 IonicContact NZ-OE1 3.04Å; K331-E370 PolarHBondContact NZ-OE1 3.28Å; K331-E370 IonicContact NZ-OE2 2.7Å; K331-E370 PolarHBondContact NZ-OE2 3.11Å; T366-E370 HydrophobicContact CG2-CG 4.26Å; T366-E370 VanDerWaalsContact O-CG 3.32Å; T366-E370 WeakPolarHBondContact O-CG 3.14Å; T366-E370 PolarHBondContact O-N 3.06Å; L367-E370 PolarHBondContact O-N 3.37Å; V368-E370 PolarHBondContact O-N 2.98Å; E370-M373 HydrophobicContact CB-CE 4.38Å; E370-M373 HydrophobicContact CG-CE 3.97Å; E370-L374 VanDerWaalsContact O-CG 3.31Å; E370-L374 WeakPolarHBondContact O-CG 3.28Å; E370-L374 PolarHBondContact O-N 3Å; E370-L374 VanDerWaalsContact O-N 3.08Å; E370-L401 HydrophobicContact CG-CD2 4.46Å
371	I	92.1	Very high	88.8	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-47.5	174	-73.4	167.4	0	0	0	110.6	F316 L319 Y327 L336 L344 L367 V368 A369 L374 Q375	F316-I371 HydrophobicContact CZ-CD1 4.34Å; L319-I371 HydrophobicContact CD1-CG2 3.89Å; Y327-I371 HydrophobicContact CE2-CG1 4.22Å; L336-I371 HydrophobicContact CD1-CD1 3.85Å; L336-I371 HydrophobicContact CD2-CD1 4.24Å; L344-I371 HydrophobicContact CD1-CD1 3.82Å; L344-I371 HydrophobicContact CD1-CG2 4.13Å; L344-I371 HydrophobicContact CD2-CB 4.27Å; L344-I371 HydrophobicContact CD2-CG2 3.76Å; L367-I371 HydrophobicContact CG-CD1 4.38Å; L367-I371 WeakPolarHBondContact O-CG1 3.33Å; L367-I371 PolarHBondContact O-N 3.04Å; L367-I371 VanDerWaalsContact O-N 3.12Å; V368-I371 PolarHBondContact O-N 3.46Å; A369-I371 VanDerWaalsContact C-N 3.31Å; A369-I371 PolarHBondContact O-N 3.26Å; I371-L374 PolarHBondContact O-N 2.96Å; I371-Q375 PolarHBondContact O-N 3.43Å
372	L	93.1	Very high	89.5	Confident	9 Å²	9	28.3 Å²	28.3	5%	0.047	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-34.4	180	-61.7	173.7	0	0	0	112.7	L344 V349 V368 A369 Q375 E376 L459 I494	L344-L372 HydrophobicContact CD2-CD1 4.28Å; L344-L372 HydrophobicContact CD2-CD2 3.8Å; L344-L372 HydrophobicContact CD2-CG 3.87Å; V349-L372 HydrophobicContact CG1-CD1 4.39Å; V349-L372 HydrophobicContact CG1-CD2 3.65Å; V368-L372 HydrophobicContact CG1-CD1 4.14Å; V368-L372 WeakPolarHBondContact O-CG 3.41Å; V368-L372 PolarHBondContact O-N 3.27Å; V368-L372 VanDerWaalsContact O-N 3.16Å; A369-L372 PolarHBondContact O-N 3.39Å; L372-Q375 PolarHBondContact O-N 3.42Å; L372-E376 PolarHBondContact O-N 2.87Å; L372-E376 VanDerWaalsContact O-N 3.08Å; L372-L459 HydrophobicContact CB-CD2 4.32Å; L372-I494 HydrophobicContact CB-CD1 4.29Å; L372-I494 HydrophobicContact CD1-CD1 3.51Å
373	M	95	Very high	90.4	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.015	14%	0.14	C	C	.	.	H	α-helix	trans	-62.7	-43.5	171.5	-68.5	-167.1	-64.8	0	0	111.8	A369 E370 Q375 E376 L377 V384 M386 L401 L433 L459 V461	A369-M373 WeakPolarHBondContact O-CB 3.22Å; A369-M373 VanDerWaalsContact O-CG 3.25Å; A369-M373 WeakPolarHBondContact O-CG 3.27Å; A369-M373 PolarHBondContact O-N 3.07Å; E370-M373 HydrophobicContact CB-CE 4.38Å; E370-M373 HydrophobicContact CG-CE 3.97Å; M373-Q375 VanDerWaalsContact C-N 3.31Å; M373-Q375 PolarHBondContact O-N 2.92Å; M373-E376 PolarHBondContact O-N 3.12Å; M373-L377 WeakPolarHBondContact O-CB 3.39Å; M373-L377 WeakPolarHBondContact O-CD1 3.5Å; M373-L377 VanDerWaalsContact O-CG 3.23Å; M373-L377 WeakPolarHBondContact O-CG 3.25Å; M373-L377 PolarHBondContact O-N 3.3Å; M373-L377 VanDerWaalsContact O-N 3.11Å; M373-V384 HydrophobicContact CB-CG1 4.04Å; M373-V384 HydrophobicContact CG-CG1 3.65Å; M373-V384 HydrophobicContact SD-CG1 3.97Å; M373-M386 HydrophobicContact CE-CE 4.28Å; M373-M386 HydrophobicContact CE-SD 3.9Å; M373-M386 HydrophobicContact SD-CB 3.96Å; M373-M386 HydrophobicContact SD-CG 4.17Å; M373-M386 HydrophobicContact SD-SD 4.26Å; M373-L401 HydrophobicContact CE-CD1 4.39Å; M373-L433 HydrophobicContact SD-CD1 3.8Å; M373-L459 HydrophobicContact CG-CD2 4.01Å; M373-V461 HydrophobicContact CG-CG2 3.72Å; M373-V461 HydrophobicContact SD-CB 4.4Å; M373-V461 HydrophobicContact SD-CG2 3.96Å
374	L	92.6	Very high	91.3	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-33.9	175.3	-70.3	172.2	0	0	0	112.1	L319 V323 Y327 E370 I371 L378 L408 F410	L319-L374 HydrophobicContact CD1-CB 4.44Å; L319-L374 HydrophobicContact CD2-CB 4Å; V323-L374 HydrophobicContact CG1-CD1 3.71Å; Y327-L374 HydrophobicContact CE2-CD1 3.83Å; E370-L374 VanDerWaalsContact O-CG 3.31Å; E370-L374 WeakPolarHBondContact O-CG 3.28Å; E370-L374 PolarHBondContact O-N 3Å; E370-L374 VanDerWaalsContact O-N 3.08Å; I371-L374 PolarHBondContact O-N 2.96Å; L374-L378 VanDerWaalsContact O-CB 3.3Å; L374-L378 WeakPolarHBondContact O-CB 3.47Å; L374-L378 VanDerWaalsContact O-CG 3.28Å; L374-L378 WeakPolarHBondContact O-CG 3.42Å; L374-L378 PolarHBondContact O-N 3.1Å; L374-L408 HydrophobicContact CD2-CD1 4.14Å; L374-F410 HydrophobicContact CD2-CE1 3.47Å; L374-F410 VanDerWaalsContact CD2-CE1 3.47Å; L374-F410 HydrophobicContact CD2-CZ 3.57Å
375	Q	90.8	Very high	92	Very high	50 Å²	50	25.6 Å²	25.6	23%	0.234	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-44.2	177.6	-172	-178.3	-7.5	0	0	111	L319 I371 L372 M373 C379 C380	L319-Q375 HydrophobicContact CD2-CB 4.18Å; I371-Q375 PolarHBondContact O-N 3.43Å; L372-Q375 PolarHBondContact O-N 3.42Å; M373-Q375 VanDerWaalsContact C-N 3.31Å; M373-Q375 PolarHBondContact O-N 2.92Å; Q375-C379 WeakPolarHBondContact O-CA 3.49Å; Q375-C379 VanDerWaalsContact O-CB 3.26Å; Q375-C379 WeakPolarHBondContact O-CB 3.3Å; Q375-C379 PolarHBondContact O-N 3.41Å; Q375-C380 PolarHBondContact O-N 3Å
376	E	91.9	Very high	92.4	Very high	8 Å²	8	25 Å²	25	4%	0.037	12%	0.124	C	C	.	.	H	α-helix	trans	-69.1	-40.2	178.9	-167.9	64.3	-171.2	0	0	112.7	R352 L372 M373 C380 R381 K382 V384 G458 L459	R352-E376 IonicContact CZ-OE1 2.72Å; R352-E376 IonicContact CZ-OE2 2.83Å; R352-E376 VanDerWaalsContact CZ-OE2 3.26Å; R352-E376 VanDerWaalsContact NH1-CD 3.31Å; R352-E376 IonicContact NH1-OE1 3.34Å; R352-E376 PolarHBondContact NH1-OE1 2.84Å; R352-E376 VanDerWaalsContact NH1-OE1 3.11Å; R352-E376 IonicContact NH1-OE2 3.19Å; R352-E376 PolarHBondContact NH1-OE2 2.97Å; R352-E376 VanDerWaalsContact NH2-CD 3.28Å; R352-E376 IonicContact NH2-OE1 2.85Å; R352-E376 PolarHBondContact NH2-OE1 2.88Å; R352-E376 IonicContact NH2-OE2 3.23Å; R352-E376 PolarHBondContact NH2-OE2 2.93Å; L372-E376 PolarHBondContact O-N 2.87Å; L372-E376 VanDerWaalsContact O-N 3.08Å; M373-E376 PolarHBondContact O-N 3.12Å; E376-C380 HydrophobicContact CG-CB 4.47Å; E376-C380 CarbonylContact O-C 3.56Å; E376-C380 PolarHBondContact O-N 3.36Å; E376-C380 VanDerWaalsContact OE2-CB 3.3Å; E376-C380 WeakPolarHBondContact OE2-CB 3.44Å; E376-C380 PolarHBondContact OE2-SG 3.43Å; E376-C380 VanDerWaalsContact OE2-SG 3.41Å; E376-R381 PolarHBondContact O-N 3.28Å; E376-K382 HydrophobicContact CG-CB 4.08Å; E376-K382 PolarHBondContact O-N 2.82Å; E376-K382 WeakPolarHBondContact OE1-CB 3.46Å; E376-V384 HydrophobicContact CB-CG2 3.8Å; E376-V384 HydrophobicContact CG-CG2 3.89Å; E376-G458 WeakPolarHBondContact OE1-CA 3.14Å; E376-L459 HydrophobicContact CB-CB 4.16Å; E376-L459 HydrophobicContact CB-CD2 4.46Å; E376-L459 HydrophobicContact CG-CB 3.93Å
377	L	92.1	Very high	92.7	Very high	6 Å²	6	23.6 Å²	23.6	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-65.5	-47.3	177.8	-71.6	164.1	0	0	0	112.5	M373 R381 V384 F410 K431 L433	M373-L377 WeakPolarHBondContact O-CB 3.39Å; M373-L377 WeakPolarHBondContact O-CD1 3.5Å; M373-L377 VanDerWaalsContact O-CG 3.23Å; M373-L377 WeakPolarHBondContact O-CG 3.25Å; M373-L377 PolarHBondContact O-N 3.3Å; M373-L377 VanDerWaalsContact O-N 3.11Å; L377-R381 WeakPolarHBondContact O-CA 3.47Å; L377-V384 HydrophobicContact CD2-CB 4.27Å; L377-V384 HydrophobicContact CD2-CG2 3.94Å; L377-V384 HydrophobicContact CG-CB 4.33Å; L377-V384 HydrophobicContact CG-CG2 3.75Å; L377-F410 HydrophobicContact CD1-CD2 3.94Å; L377-F410 HydrophobicContact CD1-CE2 4.05Å; L377-F410 HydrophobicContact CD1-CG 4.2Å; L377-F410 HydrophobicContact CD1-CZ 4.39Å; L377-K431 HydrophobicContact CD2-CB 3.8Å; L377-L433 HydrophobicContact CD1-CB 4.09Å; L377-L433 HydrophobicContact CD2-CB 4.48Å
378	L	89.9	Confident	92.9	Very high	40 Å²	40	22.8 Å²	22.8	21%	0.209	11%	0.111	C	C	.	.	H	α-helix	trans	-90	-46	-170.4	-59.2	177.4	0	0	0	112.8	L319 V323 L374 L408 F410	L319-L378 HydrophobicContact CD2-CD1 4.37Å; V323-L378 HydrophobicContact CG2-CD1 3.93Å; L374-L378 VanDerWaalsContact O-CB 3.3Å; L374-L378 WeakPolarHBondContact O-CB 3.47Å; L374-L378 VanDerWaalsContact O-CG 3.28Å; L374-L378 WeakPolarHBondContact O-CG 3.42Å; L374-L378 PolarHBondContact O-N 3.1Å; L378-L408 HydrophobicContact CD1-CD1 4.34Å; L378-L408 HydrophobicContact CD1-CD2 4.48Å; L378-L408 HydrophobicContact CD2-CB 4.19Å; L378-F410 HydrophobicContact CD2-CD1 4.32Å
379	C	87.1	Confident	92.7	Very high	48 Å²	48	22.8 Å²	22.8	32%	0.324	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-43.4	-171.7	-54.3	0	0	0	0	111.4	L313 S318 Q375	L313-C379 HydrophobicContact CD2-CB 4.5Å; S318-C379 PolarHBondContact O-SG 2.61Å; Q375-C379 WeakPolarHBondContact O-CA 3.49Å; Q375-C379 VanDerWaalsContact O-CB 3.26Å; Q375-C379 WeakPolarHBondContact O-CB 3.3Å; Q375-C379 PolarHBondContact O-N 3.41Å
380	C	86.1	Confident	92.4	Very high	58 Å²	58	25.9 Å²	25.9	39%	0.392	12%	0.123	S	C	.	.	S	Bend	trans	-89.4	-12.7	178.3	-59.7	0	0	0	0	113.9	R352 Q375 E376 K382	R352-C380 PolarHBondContact NH1-SG 3Å; Q375-C380 PolarHBondContact O-N 3Å; E376-C380 HydrophobicContact CG-CB 4.47Å; E376-C380 CarbonylContact O-C 3.56Å; E376-C380 PolarHBondContact O-N 3.36Å; E376-C380 VanDerWaalsContact OE2-CB 3.3Å; E376-C380 WeakPolarHBondContact OE2-CB 3.44Å; E376-C380 PolarHBondContact OE2-SG 3.43Å; E376-C380 VanDerWaalsContact OE2-SG 3.41Å; C380-K382 PolarHBondContact O-N 3.2Å
381	R	89.6	Confident	92	Very high	172 Å²	172	28 Å²	28	65%	0.649	14%	0.138	S	C	*	.			trans	51.4	41	178.7	-60.2	-173.5	179.3	-173.4	0.7	113.5	E376 L377 K431	E376-R381 PolarHBondContact O-N 3.28Å; L377-R381 WeakPolarHBondContact O-CA 3.47Å; R381-K431 WeakPolarHBondContact O-CD 3.46Å; R381-K431 WeakPolarHBondContact O-CE 3.22Å; R381-K431 PolarHBondContact O-NZ 2.71Å
382	K	92.1	Very high	91.5	Very high	46 Å²	46	30 Å²	30	20%	0.2	15%	0.154	C	C	.	.			trans	-107.6	161.4	169.3	-76.1	-160	173.8	-154.6	0	111	E376 C380 D455 S456 T490	E376-K382 HydrophobicContact CG-CB 4.08Å; E376-K382 PolarHBondContact O-N 2.82Å; E376-K382 WeakPolarHBondContact OE1-CB 3.46Å; C380-K382 PolarHBondContact O-N 3.2Å; K382-D455 WeakPolarHBondContact CE-O 3.49Å; K382-D455 PolarHBondContact NZ-O 3.29Å; K382-S456 WeakPolarHBondContact CB-O 3.42Å; K382-T490 PolarHBondContact NZ-OG1 2.98Å
383	D	94.4	Very high	91.1	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.08	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	159.9	171	-69.3	-16.8	0	0	0	110.4	K431 S432 Y434 S456 G458	D383-K431 WeakPolarHBondContact OD1-CD 2.95Å; D383-S432 PolarHBondContact OD1-N 2.86Å; D383-Y434 HydrophobicContact CB-CD2 4.44Å; D383-Y434 HydrophobicContact CB-CE2 3.66Å; D383-Y434 PolarHBondContact OD2-OH 3.34Å; D383-S456 PolarHBondContact N-O 2.99Å; D383-G458 PolarHBondContact O-N 3.02Å
384	V	96.7	Very high	90.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.1	-176	178	0	0	0	0	110.4	M373 E376 L377 S432 L433 Y434 L459	M373-V384 HydrophobicContact CB-CG1 4.04Å; M373-V384 HydrophobicContact CG-CG1 3.65Å; M373-V384 HydrophobicContact SD-CG1 3.97Å; E376-V384 HydrophobicContact CB-CG2 3.8Å; E376-V384 HydrophobicContact CG-CG2 3.89Å; L377-V384 HydrophobicContact CD2-CB 4.27Å; L377-V384 HydrophobicContact CD2-CG2 3.94Å; L377-V384 HydrophobicContact CG-CB 4.33Å; L377-V384 HydrophobicContact CG-CG2 3.75Å; V384-S432 PolarHBondContact N-O 3.1Å; V384-S432 VanDerWaalsContact N-O 3.12Å; V384-L433 HydrophobicContact CB-CD1 3.83Å; V384-L433 HydrophobicContact CG1-CD1 3.68Å; V384-L433 WeakPolarHBondContact O-CA 3.41Å; V384-Y434 WeakPolarHBondContact O-CD2 3.42Å; V384-Y434 PolarHBondContact O-N 2.82Å; V384-L459 WeakPolarHBondContact CA-O 3.25Å; V384-L459 HydrophobicContact CG1-CB 4.25Å; V384-L459 HydrophobicContact CG1-CD2 4.28Å; V384-L459 HydrophobicContact CG1-CG 4.31Å; V384-L459 HydrophobicContact CG2-CB 4.25Å
385	L	97.5	Very high	90.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.7	176.3	170.7	57.8	0	0	0	110.3	I387 Y434 A436 L444 V445 L457 L459 V460 V461	L385-I387 HydrophobicContact CD1-CG1 4.21Å; L385-I387 HydrophobicContact CD2-CD1 4.19Å; L385-I387 HydrophobicContact CD2-CG1 4.12Å; L385-I387 HydrophobicContact CG-CD1 4.48Å; L385-I387 HydrophobicContact CG-CG1 3.89Å; L385-Y434 WeakPolarHBondContact CA-O 3.32Å; L385-A436 HydrophobicContact CD1-CB 3.83Å; L385-L444 HydrophobicContact CD1-CD2 4.06Å; L385-V445 HydrophobicContact CD2-CG2 3.96Å; L385-L457 HydrophobicContact CB-CD1 3.76Å; L385-L457 HydrophobicContact CB-CD2 4.47Å; L385-L459 PolarHBondContact N-O 2.86Å; L385-V460 HydrophobicContact CB-CG2 4.31Å; L385-V460 CarbonylContact O-C 3.57Å; L385-V460 WeakPolarHBondContact O-CA 3.27Å; L385-V461 PolarHBondContact O-N 2.99Å
386	M	97.7	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.5	168.8	-165.5	-174.3	-161.9	0	0	109.8	T366 M373 L388 K397 Y434 I435 A436 V461 M496	T366-M386 HydrophobicContact CG2-CE 3.83Å; M373-M386 HydrophobicContact CE-CE 4.28Å; M373-M386 HydrophobicContact CE-SD 3.9Å; M373-M386 HydrophobicContact SD-CB 3.96Å; M373-M386 HydrophobicContact SD-CG 4.17Å; M373-M386 HydrophobicContact SD-SD 4.26Å; M386-L388 HydrophobicContact CE-CD2 3.9Å; M386-L388 HydrophobicContact CG-CD2 4.36Å; M386-L388 HydrophobicContact CG-CG 4.23Å; M386-L388 HydrophobicContact SD-CD1 4.16Å; M386-L388 HydrophobicContact SD-CD2 4.17Å; M386-L388 HydrophobicContact SD-CG 4.3Å; M386-K397 HydrophobicContact SD-CG 4.21Å; M386-Y434 PolarHBondContact N-O 3.3Å; M386-I435 HydrophobicContact CB-CG1 4.5Å; M386-A436 PolarHBondContact O-N 3.19Å; M386-V461 HydrophobicContact CE-CG1 4.36Å; M386-V461 HydrophobicContact CG-CB 4.26Å; M386-V461 HydrophobicContact CG-CG1 4.27Å; M386-M496 HydrophobicContact CE-CE 3.76Å
387	I	97.4	Very high	90.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.8	175	-53.9	-176.7	0	0	0	108.9	L385 I438 V460 V461 V462 D463 L477 T480	L385-I387 HydrophobicContact CD1-CG1 4.21Å; L385-I387 HydrophobicContact CD2-CD1 4.19Å; L385-I387 HydrophobicContact CD2-CG1 4.12Å; L385-I387 HydrophobicContact CG-CD1 4.48Å; L385-I387 HydrophobicContact CG-CG1 3.89Å; I387-I438 HydrophobicContact CG2-CB 4.4Å; I387-I438 HydrophobicContact CG2-CG1 3.94Å; I387-V460 HydrophobicContact CD1-CG1 4.1Å; I387-V460 HydrophobicContact CG1-CG1 4.43Å; I387-V461 PolarHBondContact N-O 3.09Å; I387-V462 HydrophobicContact CD1-CG2 4.48Å; I387-D463 PolarHBondContact O-N 3.11Å; I387-L477 HydrophobicContact CD1-CD1 4.36Å; I387-L477 HydrophobicContact CG2-CD1 4.28Å; I387-T480 HydrophobicContact CD1-CG2 4.32Å
388	L	94.6	Very high	90	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.6	-177	-67	168.5	0	0	0	110.6	M386 Y390 I393 V394 K397 I435 A436 T437 D463	M386-L388 HydrophobicContact CE-CD2 3.9Å; M386-L388 HydrophobicContact CG-CD2 4.36Å; M386-L388 HydrophobicContact CG-CG 4.23Å; M386-L388 HydrophobicContact SD-CD1 4.16Å; M386-L388 HydrophobicContact SD-CD2 4.17Å; M386-L388 HydrophobicContact SD-CG 4.3Å; L388-Y390 PolarHBondContact O-N 3.12Å; L388-I393 HydrophobicContact CD1-CG2 4.17Å; L388-I393 HydrophobicContact CD2-CG2 3.93Å; L388-V394 HydrophobicContact CB-CG2 3.83Å; L388-V394 HydrophobicContact CD1-CB 4.32Å; L388-V394 HydrophobicContact CD1-CG2 3.86Å; L388-V394 HydrophobicContact CG-CG2 4.43Å; L388-K397 HydrophobicContact CD1-CB 4.22Å; L388-K397 HydrophobicContact CD1-CG 3.75Å; L388-I435 HydrophobicContact CD1-CG2 3.54Å; L388-A436 PolarHBondContact N-O 3.03Å; L388-T437 WeakPolarHBondContact O-CA 3.44Å; L388-D463 HydrophobicContact CD2-CB 3.56Å
389	P	89.8	Confident	89.6	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.013	17%	0.167	C	C	.	.	S	Bend	trans	-74.2	-17.9	-174.9	25.9	-33.5	0	0	0	114.9	I393 E464 M467 R473	P389-I393 HydrophobicContact CG-CD1 4.28Å; P389-E464 HydrophobicContact CG-CB 4.36Å; P389-M467 HydrophobicContact CB-CG 4.08Å; P389-M467 HydrophobicContact CB-SD 4.34Å; P389-R473 VanDerWaalsContact O-CZ 3.28Å; P389-R473 PolarHBondContact O-NH1 3.39Å; P389-R473 PolarHBondContact O-NH2 3.24Å
390	Y	87.1	Confident	89.5	Confident	64 Å²	64	31.3 Å²	31.3	25%	0.251	16%	0.162	S	C	.	.			trans	-143.6	144.4	-175.9	-51.6	-80	0	0	0	113.9	L388 A392 I393 V394 A675	L388-Y390 PolarHBondContact O-N 3.12Å; Y390-A392 PolarHBondContact O-N 3.29Å; Y390-I393 HydrophobicContact CD2-CD1 4Å; Y390-I393 PolarHBondContact O-N 2.71Å; Y390-V394 PolarHBondContact O-N 2.89Å; Y390-V394 VanDerWaalsContact O-N 3.11Å; Y390-A675 HydrophobicContact CE2-CB 3.65Å
391	V	84.8	Confident	89.7	Confident	60 Å²	60	28.8 Å²	28.8	36%	0.364	15%	0.145	S	C	.	.	H	α-helix	trans	-53.7	-36.2	176.9	179.5	0	0	0	0	112.7	V394 Q395 A416 T437	V391-V394 PolarHBondContact O-N 2.67Å; V391-Q395 WeakPolarHBondContact O-CG 3.49Å; V391-Q395 PolarHBondContact O-N 3.49Å; V391-A416 HydrophobicContact CG1-CB 4.14Å; V391-A416 HydrophobicContact CG2-CB 4.26Å; V391-T437 HydrophobicContact CG2-CG2 3.82Å
392	A	81.2	Confident	89.6	Confident	43 Å²	43	20.7 Å²	20.7	36%	0.355	12%	0.115	S	C	.	.	H	α-helix	trans	-63	-42.5	177.7	0	0	0	0	0	112.4	Y390 Q395 E396 G676 V677	Y390-A392 PolarHBondContact O-N 3.29Å; A392-Q395 PolarHBondContact O-N 3.17Å; A392-E396 PolarHBondContact O-N 2.78Å; A392-G676 VanDerWaalsContact CB-O 3.31Å; A392-G676 WeakPolarHBondContact CB-O 3.2Å; A392-V677 HydrophobicContact CB-CG2 4.39Å
393	I	85.8	Confident	89.3	Confident	24 Å²	24	19.7 Å²	19.7	12%	0.123	11%	0.113	C	C	.	.	H	α-helix	trans	-70	-39.5	176.5	-48.9	-179.8	0	0	0	110.4	L388 P389 Y390 Q395 E396 K397 G676	L388-I393 HydrophobicContact CD1-CG2 4.17Å; L388-I393 HydrophobicContact CD2-CG2 3.93Å; P389-I393 HydrophobicContact CG-CD1 4.28Å; Y390-I393 HydrophobicContact CD2-CD1 4Å; Y390-I393 PolarHBondContact O-N 2.71Å; I393-Q395 VanDerWaalsContact C-N 3.31Å; I393-Q395 PolarHBondContact O-N 2.89Å; I393-E396 WeakPolarHBondContact O-CB 3.31Å; I393-E396 PolarHBondContact O-N 2.82Å; I393-E396 VanDerWaalsContact O-N 3.14Å; I393-K397 HydrophobicContact CG2-CG 4.24Å; I393-K397 WeakPolarHBondContact O-CG 3.33Å; I393-K397 PolarHBondContact O-N 2.82Å; I393-G676 WeakPolarHBondContact CG1-O 3.5Å
394	V	90.4	Very high	89.1	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-53.1	-50.4	173.1	171.6	0	0	0	0	110.4	L388 Y390 V391 E396 K397 I398 E414 A416 I435 T437	L388-V394 HydrophobicContact CB-CG2 3.83Å; L388-V394 HydrophobicContact CD1-CB 4.32Å; L388-V394 HydrophobicContact CD1-CG2 3.86Å; L388-V394 HydrophobicContact CG-CG2 4.43Å; Y390-V394 PolarHBondContact O-N 2.89Å; Y390-V394 VanDerWaalsContact O-N 3.11Å; V391-V394 PolarHBondContact O-N 2.67Å; V394-E396 PolarHBondContact O-N 3.09Å; V394-K397 PolarHBondContact O-N 2.99Å; V394-I398 HydrophobicContact CG1-CD1 3.5Å; V394-I398 VanDerWaalsContact CG1-CD1 3.5Å; V394-I398 HydrophobicContact CG1-CG1 4.39Å; V394-I398 WeakPolarHBondContact O-CD1 3.44Å; V394-I398 VanDerWaalsContact O-CG1 3.26Å; V394-I398 WeakPolarHBondContact O-CG1 3.39Å; V394-I398 PolarHBondContact O-N 2.73Å; V394-E414 HydrophobicContact CG1-CG 4.32Å; V394-A416 HydrophobicContact CB-CB 4.26Å; V394-A416 HydrophobicContact CG1-CB 3.84Å; V394-A416 HydrophobicContact CG2-CB 4.42Å; V394-I435 HydrophobicContact CB-CG2 4.39Å; V394-I435 HydrophobicContact CG1-CB 4.49Å; V394-I435 HydrophobicContact CG1-CG2 3.94Å; V394-I435 HydrophobicContact CG2-CG2 4.45Å; V394-T437 HydrophobicContact CG2-CG2 4.08Å
395	Q	84.9	Confident	88.6	Confident	37 Å²	37	19.1 Å²	19.1	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-67.5	-32.7	178.9	-71	-179.6	-5.3	0	0	113.3	V391 A392 I393 S399 E414	V391-Q395 WeakPolarHBondContact O-CG 3.49Å; V391-Q395 PolarHBondContact O-N 3.49Å; A392-Q395 PolarHBondContact O-N 3.17Å; I393-Q395 VanDerWaalsContact C-N 3.31Å; I393-Q395 PolarHBondContact O-N 2.89Å; Q395-S399 VanDerWaalsContact O-CB 3.24Å; Q395-S399 WeakPolarHBondContact O-CB 3.43Å; Q395-S399 PolarHBondContact O-N 3.34Å; Q395-S399 VanDerWaalsContact O-N 3.08Å; Q395-S399 PolarHBondContact O-OG 3.04Å; Q395-E414 WeakPolarHBondContact CG-OE1 3.49Å; Q395-E414 PolarHBondContact NE2-OE1 3.28Å
396	E	84.2	Confident	88.1	Confident	67 Å²	67	22.1 Å²	22.1	31%	0.313	13%	0.129	S	C	.	.	H	α-helix	trans	-61.2	-50.4	170.6	-170	-160.6	104	0	0	111.2	A392 I393 V394 S399 G400 N678	A392-E396 PolarHBondContact O-N 2.78Å; I393-E396 WeakPolarHBondContact O-CB 3.31Å; I393-E396 PolarHBondContact O-N 2.82Å; I393-E396 VanDerWaalsContact O-N 3.14Å; V394-E396 PolarHBondContact O-N 3.09Å; E396-S399 PolarHBondContact O-N 2.81Å; E396-G400 PolarHBondContact O-N 3Å; E396-N678 WeakPolarHBondContact OE2-CB 3.26Å
397	K	89	Confident	87.6	Confident	22 Å²	22	26.3 Å²	26.3	10%	0.096	15%	0.149	C	C	.	.	H	α-helix	trans	-68	-42.7	-177.2	-60.1	-42.6	177.6	-162.2	0	112.3	T366 M386 L388 I393 V394 S399 G400 L401 I435	T366-K397 HydrophobicContact CG2-CD 4.45Å; M386-K397 HydrophobicContact SD-CG 4.21Å; L388-K397 HydrophobicContact CD1-CB 4.22Å; L388-K397 HydrophobicContact CD1-CG 3.75Å; I393-K397 HydrophobicContact CG2-CG 4.24Å; I393-K397 WeakPolarHBondContact O-CG 3.33Å; I393-K397 PolarHBondContact O-N 2.82Å; V394-K397 PolarHBondContact O-N 2.99Å; K397-S399 PolarHBondContact O-N 3Å; K397-G400 CarbonylContact O-C 3.57Å; K397-G400 PolarHBondContact O-N 3.36Å; K397-G400 VanDerWaalsContact O-N 3.1Å; K397-L401 WeakPolarHBondContact O-CB 3.41Å; K397-L401 WeakPolarHBondContact O-CG 3.23Å; K397-L401 PolarHBondContact O-N 3.36Å; K397-I435 HydrophobicContact CB-CD1 4.17Å; K397-I435 HydrophobicContact CB-CG2 4.34Å
398	I	88.9	Confident	87.2	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-58.5	-50.9	174.1	-62.3	156.2	0	0	0	109.9	V394 G400 L401 S402 V412 E414 I435 T1017	V394-I398 HydrophobicContact CG1-CD1 3.5Å; V394-I398 VanDerWaalsContact CG1-CD1 3.5Å; V394-I398 HydrophobicContact CG1-CG1 4.39Å; V394-I398 WeakPolarHBondContact O-CD1 3.44Å; V394-I398 VanDerWaalsContact O-CG1 3.26Å; V394-I398 WeakPolarHBondContact O-CG1 3.39Å; V394-I398 PolarHBondContact O-N 2.73Å; I398-G400 PolarHBondContact O-N 3.1Å; I398-G400 VanDerWaalsContact O-N 3.11Å; I398-L401 PolarHBondContact O-N 3Å; I398-S402 PolarHBondContact O-N 3.5Å; I398-S402 PolarHBondContact O-OG 3.26Å; I398-V412 HydrophobicContact CB-CG1 4.28Å; I398-V412 HydrophobicContact CG1-CG1 4.12Å; I398-V412 HydrophobicContact CG2-CG1 3.98Å; I398-E414 HydrophobicContact CD1-CB 3.55Å; I398-E414 HydrophobicContact CD1-CG 3.48Å; I398-E414 VanDerWaalsContact CD1-CG 3.48Å; I398-I435 HydrophobicContact CD1-CB 4.44Å; I398-I435 HydrophobicContact CG1-CB 3.96Å; I398-I435 HydrophobicContact CG1-CD1 3.86Å; I398-I435 HydrophobicContact CG1-CG1 4.33Å; I398-I435 HydrophobicContact CG1-CG2 4.24Å; I398-T1017 HydrophobicContact CG2-CG2 3.94Å
399	S	83.3	Confident	86.9	Confident	20 Å²	20	29.4 Å²	29.4	14%	0.14	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-23.8	178.6	-54.2	0	0	0	0	113.1	Q395 E396 K397 Q1060	Q395-S399 VanDerWaalsContact O-CB 3.24Å; Q395-S399 WeakPolarHBondContact O-CB 3.43Å; Q395-S399 PolarHBondContact O-N 3.34Å; Q395-S399 VanDerWaalsContact O-N 3.08Å; Q395-S399 PolarHBondContact O-OG 3.04Å; E396-S399 PolarHBondContact O-N 2.81Å; K397-S399 PolarHBondContact O-N 3Å; S399-Q1060 WeakPolarHBondContact O-CG 3.32Å; S399-Q1060 PolarHBondContact O-NE2 3.19Å
400	G	84.2	Confident	86.9	Confident	22 Å²	22	29.6 Å²	29.6	23%	0.227	17%	0.174	C	C	.	.	H	α-helix	trans	-82.2	-34	173	0	0	0	0	0	114.4	E396 K397 I398 F404	E396-G400 PolarHBondContact O-N 3Å; K397-G400 CarbonylContact O-C 3.57Å; K397-G400 PolarHBondContact O-N 3.36Å; K397-G400 VanDerWaalsContact O-N 3.1Å; I398-G400 PolarHBondContact O-N 3.1Å; I398-G400 VanDerWaalsContact O-N 3.11Å; G400-F404 WeakPolarHBondContact O-CD2 3.35Å
401	L	89.4	Confident	87.1	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-102	-20.1	-169.9	-64.4	173.8	0	0	0	114.1	E370 M373 K397 I398 S403 F404 G405 V412 L433 I435	E370-L401 HydrophobicContact CG-CD2 4.46Å; M373-L401 HydrophobicContact CE-CD1 4.39Å; K397-L401 WeakPolarHBondContact O-CB 3.41Å; K397-L401 WeakPolarHBondContact O-CG 3.23Å; K397-L401 PolarHBondContact O-N 3.36Å; I398-L401 PolarHBondContact O-N 3Å; L401-S403 PolarHBondContact O-N 3.47Å; L401-F404 HydrophobicContact CD2-CD2 4.32Å; L401-F404 WeakPolarHBondContact O-CA 3.29Å; L401-F404 WeakPolarHBondContact O-CB 3.42Å; L401-F404 PolarHBondContact O-N 3.26Å; L401-G405 PolarHBondContact O-N 3.45Å; L401-V412 HydrophobicContact CB-CG2 4.4Å; L401-L433 HydrophobicContact CD1-CD2 3.83Å; L401-I435 HydrophobicContact CD1-CD1 4.04Å
402	S	88.1	Confident	87.4	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-54.6	-36.9	175.3	-62.8	0	0	0	0	112.9	I398 F404 G405 V406	I398-S402 PolarHBondContact O-N 3.5Å; I398-S402 PolarHBondContact O-OG 3.26Å; S402-F404 VanDerWaalsContact C-N 3.32Å; S402-F404 PolarHBondContact O-N 3.4Å; S402-G405 PolarHBondContact O-N 3.45Å; S402-V406 WeakPolarHBondContact O-CG2 3.46Å; S402-V406 PolarHBondContact O-N 3.16Å; S402-V406 VanDerWaalsContact O-N 3.11Å
403	S	87.1	Confident	87.8	Confident	25 Å²	25	22.8 Å²	22.8	18%	0.175	13%	0.134	C	C	.	.	H	α-helix	trans	-64.3	-35	175.7	-53.4	0	0	0	0	113	L401 E407	L401-S403 PolarHBondContact O-N 3.47Å; S403-E407 PolarHBondContact O-N 3.03Å
404	F	88.6	Confident	88.1	Confident	1 Å²	1	22.7 Å²	22.7	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-72.6	-41.9	174.9	-71.2	-98.7	0	0	0	110.6	L326 Y327 F330 K331 G400 L401 S402 V406 E407 L408 F410	L326-F404 HydrophobicContact CB-CD1 4.1Å; L326-F404 HydrophobicContact CB-CE1 3.75Å; L326-F404 HydrophobicContact CD1-CD1 4.42Å; Y327-F404 HydrophobicContact CD1-CE1 4.37Å; Y327-F404 HydrophobicContact CD1-CZ 4.2Å; Y327-F404 HydrophobicContact CD2-CE1 4.44Å; Y327-F404 HydrophobicContact CE1-CE1 4.49Å; Y327-F404 HydrophobicContact CE1-CZ 4.39Å; Y327-F404 HydrophobicContact CG-CE1 4.34Å; F330-F404 HydrophobicContact CB-CE2 3.95Å; F330-F404 HydrophobicContact CB-CZ 3.98Å; F330-F404 HydrophobicContact CD2-CD1 4.5Å; F330-F404 AromaticContact CD2-CD2 3.98Å; F330-F404 HydrophobicContact CD2-CD2 3.98Å; F330-F404 HydrophobicContact CD2-CE1 4.3Å; F330-F404 AromaticContact CD2-CE2 3.75Å; F330-F404 HydrophobicContact CD2-CE2 3.75Å; F330-F404 HydrophobicContact CD2-CG 4.36Å; F330-F404 AromaticContact CD2-CZ 3.92Å; F330-F404 HydrophobicContact CD2-CZ 3.92Å; F330-F404 HydrophobicContact CG-CE2 4.37Å; F330-F404 HydrophobicContact CG-CZ 4.47Å; K331-F404 HydrophobicContact CD-CZ 4.43Å; K331-F404 HydrophobicContact CG-CE2 4.37Å; K331-F404 HydrophobicContact CG-CZ 4.22Å; G400-F404 WeakPolarHBondContact O-CD2 3.35Å; L401-F404 HydrophobicContact CD2-CD2 4.32Å; L401-F404 WeakPolarHBondContact O-CA 3.29Å; L401-F404 WeakPolarHBondContact O-CB 3.42Å; L401-F404 PolarHBondContact O-N 3.26Å; S402-F404 VanDerWaalsContact C-N 3.32Å; S402-F404 PolarHBondContact O-N 3.4Å; F404-V406 PolarHBondContact O-N 3.49Å; F404-E407 PolarHBondContact O-N 3.36Å; F404-L408 HydrophobicContact CB-CD1 4.27Å; F404-L408 HydrophobicContact CD1-CD1 4.21Å; F404-L408 VanDerWaalsContact O-CB 3.28Å; F404-L408 WeakPolarHBondContact O-CB 3.38Å; F404-L408 WeakPolarHBondContact O-CG 3.49Å; F404-L408 PolarHBondContact O-N 2.91Å; F404-F410 HydrophobicContact CB-CE1 4.42Å; F404-F410 HydrophobicContact CB-CZ 4.01Å
405	G	87.9	Confident	88.1	Confident	2 Å²	2	22.9 Å²	22.9	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-58.3	-43.2	177.7	0	0	0	0	0	113.5	L401 S402 G409 F410	L401-G405 PolarHBondContact O-N 3.45Å; S402-G405 PolarHBondContact O-N 3.45Å; G405-G409 WeakPolarHBondContact O-CA 3.46Å; G405-G409 PolarHBondContact O-N 3.43Å; G405-F410 CarbonylContact C-O 3.51Å; G405-F410 WeakPolarHBondContact CA-O 3.44Å; G405-F410 PolarHBondContact O-N 3.02Å; G405-F410 VanDerWaalsContact O-N 3.11Å
406	V	86.9	Confident	88.2	Confident	62 Å²	62	21.2 Å²	21.2	38%	0.376	13%	0.126	S	C	.	.	H	α-helix	trans	-64.4	-39	175.5	175.7	0	0	0	0	112.2	S402 F404 M1067	S402-V406 WeakPolarHBondContact O-CG2 3.46Å; S402-V406 PolarHBondContact O-N 3.16Å; S402-V406 VanDerWaalsContact O-N 3.11Å; F404-V406 PolarHBondContact O-N 3.49Å; V406-M1067 HydrophobicContact CG2-CE 3.95Å
407	E	87.3	Confident	88	Confident	89 Å²	89	19.1 Å²	19.1	42%	0.416	12%	0.123	S	C	.	.	H	α-helix	trans	-81.9	-22.2	-178.3	-80.1	-66.7	159	0	0	114.5	K322 L326 F330 S403 F404	K322-E407 WeakPolarHBondContact CE-OE2 3.3Å; K322-E407 PolarHBondContact NZ-O 2.98Å; K322-E407 IonicContact NZ-OE2 2.75Å; K322-E407 PolarHBondContact NZ-OE2 3.49Å; L326-E407 HydrophobicContact CD1-CB 3.84Å; L326-E407 HydrophobicContact CD2-CB 4.2Å; L326-E407 HydrophobicContact CD2-CG 4.08Å; F330-E407 HydrophobicContact CE2-CG 4.28Å; F330-E407 HydrophobicContact CZ-CG 4.12Å; S403-E407 PolarHBondContact O-N 3.03Å; F404-E407 PolarHBondContact O-N 3.36Å
408	L	88.6	Confident	87.1	Confident	31 Å²	31	21 Å²	21	16%	0.162	14%	0.138	C	C	.	.	H	α-helix	trans	-116.3	-3.3	-173.6	-62.8	168.8	0	0	0	113.5	K322 V323 L326 L374 L378 F404 F410	K322-L408 HydrophobicContact CD-CD2 4.19Å; K322-L408 HydrophobicContact CG-CD2 4.44Å; V323-L408 HydrophobicContact CG2-CD1 4.14Å; V323-L408 HydrophobicContact CG2-CD2 4.02Å; L326-L408 HydrophobicContact CD1-CD1 3.89Å; L326-L408 HydrophobicContact CD1-CD2 3.8Å; L326-L408 HydrophobicContact CD1-CG 3.72Å; L374-L408 HydrophobicContact CD2-CD1 4.14Å; L378-L408 HydrophobicContact CD1-CD1 4.34Å; L378-L408 HydrophobicContact CD1-CD2 4.48Å; L378-L408 HydrophobicContact CD2-CB 4.19Å; F404-L408 HydrophobicContact CB-CD1 4.27Å; F404-L408 HydrophobicContact CD1-CD1 4.21Å; F404-L408 VanDerWaalsContact O-CB 3.28Å; F404-L408 WeakPolarHBondContact O-CB 3.38Å; F404-L408 WeakPolarHBondContact O-CG 3.49Å; F404-L408 PolarHBondContact O-N 2.91Å; L408-F410 HydrophobicContact CB-CD1 3.87Å; L408-F410 HydrophobicContact CB-CE1 3.77Å; L408-F410 HydrophobicContact CD1-CE1 4.05Å
409	G	87.3	Confident	86.6	Confident	36 Å²	36	23.1 Å²	23.1	37%	0.371	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	35	170.8	0	0	0	0	0	115.4	G405 K430	G405-G409 WeakPolarHBondContact O-CA 3.46Å; G405-G409 PolarHBondContact O-N 3.43Å; G409-K430 WeakPolarHBondContact O-CB 3.18Å; G409-K430 WeakPolarHBondContact O-CD 3.4Å; G409-K430 WeakPolarHBondContact O-CG 3.27Å
410	F	90.8	Very high	86.5	Confident	6 Å²	6	23.7 Å²	23.7	3%	0.026	16%	0.157	C	C	.	.			trans	-131.1	154.5	175.7	68.2	-96.6	0	0	0	112.3	L374 L377 L378 F404 G405 L408 V412 L433 M1067	L374-F410 HydrophobicContact CD2-CE1 3.47Å; L374-F410 VanDerWaalsContact CD2-CE1 3.47Å; L374-F410 HydrophobicContact CD2-CZ 3.57Å; L377-F410 HydrophobicContact CD1-CD2 3.94Å; L377-F410 HydrophobicContact CD1-CE2 4.05Å; L377-F410 HydrophobicContact CD1-CG 4.2Å; L377-F410 HydrophobicContact CD1-CZ 4.39Å; L378-F410 HydrophobicContact CD2-CD1 4.32Å; F404-F410 HydrophobicContact CB-CE1 4.42Å; F404-F410 HydrophobicContact CB-CZ 4.01Å; G405-F410 CarbonylContact C-O 3.51Å; G405-F410 WeakPolarHBondContact CA-O 3.44Å; G405-F410 PolarHBondContact O-N 3.02Å; G405-F410 VanDerWaalsContact O-N 3.11Å; L408-F410 HydrophobicContact CB-CD1 3.87Å; L408-F410 HydrophobicContact CB-CE1 3.77Å; L408-F410 HydrophobicContact CD1-CE1 4.05Å; F410-V412 HydrophobicContact CD2-CG2 4.1Å; F410-V412 HydrophobicContact CE2-CG2 3.71Å; F410-L433 HydrophobicContact CD2-CB 4.33Å; F410-L433 HydrophobicContact CE2-CB 4.41Å; F410-L433 HydrophobicContact CE2-CD2 4.24Å; F410-M1067 WeakPolarHBondContact O-CE 3.09Å
411	F	89.6	Confident	86.3	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	150.8	178.6	-74.6	-83.3	0	0	0	112.5	E413 R427 K430 K431 L433 M1067 H1070 E1071 E1074	F411-E413 HydrophobicContact CB-CG 4.35Å; F411-R427 VanDerWaalsContact CD2-NE 3.3Å; F411-K430 HydrophobicContact CD2-CB 4Å; F411-K430 HydrophobicContact CD2-CD 4.48Å; F411-K430 HydrophobicContact CE2-CB 3.87Å; F411-K430 HydrophobicContact CE2-CD 3.76Å; F411-K430 HydrophobicContact CE2-CG 4.36Å; F411-K430 HydrophobicContact CZ-CD 4.42Å; F411-K431 PolarHBondContact N-O 3.24Å; F411-L433 WeakPolarHBondContact O-CB 3.44Å; F411-L433 PolarHBondContact O-N 3.36Å; F411-M1067 HydrophobicContact CB-SD 4.46Å; F411-M1067 HydrophobicContact CD1-CG 4.34Å; F411-M1067 HydrophobicContact CD1-SD 3.45Å; F411-M1067 WeakPolarHBondContact CD1-SD 3.39Å; F411-M1067 HydrophobicContact CE1-SD 3.9Å; F411-M1067 HydrophobicContact CG-SD 4.22Å; F411-H1070 HydrophobicContact CE1-CB 4Å; F411-H1070 HydrophobicContact CZ-CB 4.18Å; F411-E1071 HydrophobicContact CD1-CB 4.17Å; F411-E1071 HydrophobicContact CD1-CG 4.31Å; F411-E1071 HydrophobicContact CE1-CB 3.95Å; F411-E1071 HydrophobicContact CE1-CG 4.45Å; F411-E1074 VanDerWaalsContact CE2-OE1 3.27Å; F411-E1074 WeakPolarHBondContact CE2-OE1 3.49Å; F411-E1074 WeakPolarHBondContact CE2-OE2 3.21Å; F411-E1074 HydrophobicContact CZ-CG 4.27Å; F411-E1074 WeakPolarHBondContact CZ-OE1 3.42Å; F411-E1074 VanDerWaalsContact CZ-OE2 3.31Å; F411-E1074 WeakPolarHBondContact CZ-OE2 3.49Å
412	V	91.8	Very high	85.9	Confident	10 Å²	10	31.2 Å²	31.2	6%	0.061	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	110	172.4	-174.6	0	0	0	0	107.5	I398 L401 F410 L433 I435 M1067	I398-V412 HydrophobicContact CB-CG1 4.28Å; I398-V412 HydrophobicContact CG1-CG1 4.12Å; I398-V412 HydrophobicContact CG2-CG1 3.98Å; L401-V412 HydrophobicContact CB-CG2 4.4Å; F410-V412 HydrophobicContact CD2-CG2 4.1Å; F410-V412 HydrophobicContact CE2-CG2 3.71Å; V412-L433 WeakPolarHBondContact CA-O 3.32Å; V412-L433 HydrophobicContact CG2-CD2 4.45Å; V412-I435 HydrophobicContact CG1-CD1 3.61Å; V412-I435 HydrophobicContact CG1-CG1 4.19Å; V412-M1067 HydrophobicContact CG2-CE 4.46Å
413	E	90.8	Very high	85.7	Confident	9 Å²	9	34.3 Å²	34.3	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.4	-169.4	-60	-175.3	-164.6	0	0	111.8	F411 Y415 R427 S432 L433 Y434 I435	F411-E413 HydrophobicContact CB-CG 4.35Å; E413-Y415 HydrophobicContact CB-CD2 4.14Å; E413-Y415 HydrophobicContact CB-CE2 3.7Å; E413-Y415 PolarHBondContact OE2-OH 3.21Å; E413-R427 IonicContact OE1-CZ 3Å; E413-R427 IonicContact OE1-NE 3.85Å; E413-R427 PolarHBondContact OE1-NE 3.09Å; E413-R427 IonicContact OE1-NH2 3.68Å; E413-R427 PolarHBondContact OE1-NH2 3.37Å; E413-S432 PolarHBondContact OE1-OG 2.9Å; E413-L433 PolarHBondContact N-O 3.49Å; E413-Y434 HydrophobicContact CB-CD1 4.3Å; E413-I435 PolarHBondContact O-N 3.42Å
414	E	91.1	Very high	85.6	Confident	23 Å²	23	33.3 Å²	33.3	11%	0.107	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.3	-176.2	-172.4	170.3	-173.1	0	0	112.4	V394 Q395 I398 A416 K419 G420 T1017	V394-E414 HydrophobicContact CG1-CG 4.32Å; Q395-E414 WeakPolarHBondContact CG-OE1 3.49Å; Q395-E414 PolarHBondContact NE2-OE1 3.28Å; I398-E414 HydrophobicContact CD1-CB 3.55Å; I398-E414 HydrophobicContact CD1-CG 3.48Å; I398-E414 VanDerWaalsContact CD1-CG 3.48Å; E414-A416 HydrophobicContact CG-CB 4.32Å; E414-K419 HydrophobicContact CB-CD 4.34Å; E414-K419 HydrophobicContact CG-CB 4.26Å; E414-K419 HydrophobicContact CG-CD 3.92Å; E414-K419 CarbonylContact O-C 3.54Å; E414-K419 WeakPolarHBondContact OE2-CD 3.44Å; E414-K419 WeakPolarHBondContact OE2-CE 3.29Å; E414-K419 IonicContact OE2-NZ 2.89Å; E414-K419 PolarHBondContact OE2-NZ 3.46Å; E414-G420 WeakPolarHBondContact O-CA 3.32Å; E414-G420 PolarHBondContact O-N 3Å; E414-G420 VanDerWaalsContact O-N 3.09Å; E414-T1017 WeakPolarHBondContact OE2-CG2 3.31Å
415	Y	91.1	Very high	85.3	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	69.3	176.8	-78.8	-94.2	0	0	0	110.5	E413 R421 F422 Y434 I435 A436 T437 K440 L444	E413-Y415 HydrophobicContact CB-CD2 4.14Å; E413-Y415 HydrophobicContact CB-CE2 3.7Å; E413-Y415 PolarHBondContact OE2-OH 3.21Å; Y415-R421 WeakPolarHBondContact CE1-O 3.19Å; Y415-R421 PolarHBondContact OH-O 2.61Å; Y415-F422 AromaticContact CD1-CE1 3.86Å; Y415-F422 HydrophobicContact CD1-CE1 3.86Å; Y415-F422 HydrophobicContact CD1-CE2 4.41Å; Y415-F422 AromaticContact CD1-CZ 3.66Å; Y415-F422 HydrophobicContact CD1-CZ 3.66Å; Y415-F422 HydrophobicContact CE1-CD1 4.3Å; Y415-F422 AromaticContact CE1-CE1 3.8Å; Y415-F422 HydrophobicContact CE1-CE1 3.8Å; Y415-F422 AromaticContact CE1-CZ 3.95Å; Y415-F422 HydrophobicContact CE1-CZ 3.95Å; Y415-Y434 HydrophobicContact CD2-CD1 4.33Å; Y415-Y434 AromaticContact CE2-CD1 3.75Å; Y415-Y434 HydrophobicContact CE2-CD1 3.75Å; Y415-Y434 HydrophobicContact CE2-CE1 4.48Å; Y415-I435 PolarHBondContact N-O 3.46Å; Y415-A436 VanDerWaalsContact O-CA 3.23Å; Y415-A436 WeakPolarHBondContact O-CA 3.39Å; Y415-T437 PolarHBondContact O-N 3.3Å; Y415-T437 VanDerWaalsContact O-N 3.1Å; Y415-K440 WeakPolarHBondContact O-CB 3.43Å; Y415-K440 WeakPolarHBondContact O-CG 3.43Å; Y415-L444 HydrophobicContact CD1-CD1 4.43Å; Y415-L444 HydrophobicContact CE1-CD1 3.92Å
416	A	86.9	Confident	84.7	Confident	3 Å²	3	39.7 Å²	39.7	3%	0.025	22%	0.221	C	C	.	.	S	Bend	trans	-144.8	140	-176.1	0	0	0	0	0	113	V391 V394 E414 S418 K419 T437	V391-A416 HydrophobicContact CG1-CB 4.14Å; V391-A416 HydrophobicContact CG2-CB 4.26Å; V394-A416 HydrophobicContact CB-CB 4.26Å; V394-A416 HydrophobicContact CG1-CB 3.84Å; V394-A416 HydrophobicContact CG2-CB 4.42Å; E414-A416 HydrophobicContact CG-CB 4.32Å; A416-S418 PolarHBondContact O-N 3.11Å; A416-K419 WeakPolarHBondContact O-CB 3.33Å; A416-K419 PolarHBondContact O-N 3.21Å; A416-T437 HydrophobicContact CB-CG2 3.93Å
417	G	78.8	Confident	84.1	Confident	23 Å²	23	38.1 Å²	38.1	24%	0.237	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	-117.7	178.7	0	0	0	0	0	112.6	K440	G417-K440 WeakPolarHBondContact O-CE 3.26Å; G417-K440 PolarHBondContact O-NZ 2.89Å
418	S	71.4	Confident	83.2	Confident	61 Å²	61	40.7 Å²	40.7	43%	0.427	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.9	174.8	51.2	0	0	0	0	114.5	A416 T1003	A416-S418 PolarHBondContact O-N 3.11Å; S418-T1003 VanDerWaalsContact OG-CG2 3.27Å; S418-T1003 WeakPolarHBondContact OG-CG2 3.37Å
419	K	78.5	Confident	82.4	Confident	49 Å²	49	47.2 Å²	47.2	21%	0.213	24%	0.244	C	C	.	.			trans	-94.7	163.6	-179.8	-65.2	-177.5	174.7	-165.5	0	113.3	E414 A416 E1015	E414-K419 HydrophobicContact CB-CD 4.34Å; E414-K419 HydrophobicContact CG-CB 4.26Å; E414-K419 HydrophobicContact CG-CD 3.92Å; E414-K419 CarbonylContact O-C 3.54Å; E414-K419 WeakPolarHBondContact OE2-CD 3.44Å; E414-K419 WeakPolarHBondContact OE2-CE 3.29Å; E414-K419 IonicContact OE2-NZ 2.89Å; E414-K419 PolarHBondContact OE2-NZ 3.46Å; A416-K419 WeakPolarHBondContact O-CB 3.33Å; A416-K419 PolarHBondContact O-N 3.21Å; K419-E1015 PolarHBondContact NZ-O 2.9Å
420	G	80.6	Confident	82.1	Confident	32 Å²	32	48.9 Å²	48.9	33%	0.33	24%	0.241	S	C	.	.			trans	106.9	131.5	-175.5	0	0	0	0	0	112.2	E414	E414-G420 WeakPolarHBondContact O-CA 3.32Å; E414-G420 PolarHBondContact O-N 3Å; E414-G420 VanDerWaalsContact O-N 3.09Å
421	R	80.4	Confident	82.1	Confident	118 Å²	118	51 Å²	51	45%	0.445	25%	0.25	S	C	.	.			trans	-91.4	126.9	176.6	-168.4	-175.5	-171.8	178.4	6	109	Y415 P423 T425 E1079	Y415-R421 WeakPolarHBondContact CE1-O 3.19Å; Y415-R421 PolarHBondContact OH-O 2.61Å; R421-P423 CarbonylContact C-O 3.46Å; R421-P423 CarbonylContact O-C 3.6Å; R421-P423 VanDerWaalsContact O-C 3.3Å; R421-T425 PolarHBondContact NH1-OG1 3.17Å; R421-E1079 IonicContact CZ-OE1 3.64Å; R421-E1079 IonicContact NH1-OE1 3.67Å; R421-E1079 IonicContact NH2-OE1 3.73Å; R421-E1079 PolarHBondContact NH2-OE1 2.73Å
422	F	80.7	Confident	82.2	Confident	66 Å²	66	50.8 Å²	50.8	29%	0.289	25%	0.249	S	C	.	.	S	Bend	trans	-117	125.4	172.3	-60.5	-73.9	0	0	0	109.3	Y415 K440 L444	Y415-F422 AromaticContact CD1-CE1 3.86Å; Y415-F422 HydrophobicContact CD1-CE1 3.86Å; Y415-F422 HydrophobicContact CD1-CE2 4.41Å; Y415-F422 AromaticContact CD1-CZ 3.66Å; Y415-F422 HydrophobicContact CD1-CZ 3.66Å; Y415-F422 HydrophobicContact CE1-CD1 4.3Å; Y415-F422 AromaticContact CE1-CE1 3.8Å; Y415-F422 HydrophobicContact CE1-CE1 3.8Å; Y415-F422 AromaticContact CE1-CZ 3.95Å; Y415-F422 HydrophobicContact CE1-CZ 3.95Å; F422-K440 HydrophobicContact CE2-CD 4.01Å; F422-K440 HydrophobicContact CZ-CD 3.91Å; F422-L444 HydrophobicContact CE1-CB 4.09Å; F422-L444 HydrophobicContact CE1-CD1 4.43Å
423	P	83.8	Confident	82.4	Confident	67 Å²	67	50.4 Å²	50.4	44%	0.435	25%	0.247	S	C	.	.	S	Bend	cis	-66.8	159.3	-10.3	31.3	-36.4	0	0	0	113	R421 S447 T451	R421-P423 CarbonylContact C-O 3.46Å; R421-P423 CarbonylContact O-C 3.6Å; R421-P423 VanDerWaalsContact O-C 3.3Å; P423-S447 VanDerWaalsContact CA-OG 3.29Å; P423-S447 WeakPolarHBondContact CA-OG 3.18Å; P423-S447 WeakPolarHBondContact CB-OG 3.14Å; P423-T451 HydrophobicContact CB-CG2 3.98Å
424	P	85.6	Confident	82.6	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.026	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-65.5	142.7	173.1	27.1	-34.8	0	0	0	110.8	Y434 L444 L448 R453	P424-Y434 HydrophobicContact CB-CE1 4.13Å; P424-L444 HydrophobicContact CB-CD1 4.02Å; P424-L444 HydrophobicContact CG-CD1 3.69Å; P424-L448 HydrophobicContact CG-CD2 3.86Å; P424-L448 HydrophobicContact CG-CG 4.38Å; P424-R453 VanDerWaalsContact O-CZ 3.27Å; P424-R453 PolarHBondContact O-NH1 2.89Å; P424-R453 PolarHBondContact O-NH2 3.47Å
425	T	81.1	Confident	82.9	Confident	12 Å²	12	49 Å²	49	7%	0.074	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-58.9	146.9	177.4	-46.1	0	0	0	0	111	R421 R427 A1075 E1078	R421-T425 PolarHBondContact NH1-OG1 3.17Å; T425-R427 PolarHBondContact O-N 2.72Å; T425-A1075 HydrophobicContact CG2-CB 4.21Å; T425-E1078 VanDerWaalsContact CG2-OE2 3.29Å; T425-E1078 WeakPolarHBondContact CG2-OE2 3.49Å
426	K	75.9	Confident	83.1	Confident	126 Å²	126	48.9 Å²	48.9	55%	0.548	24%	0.24	S	C	.	.			trans	-106.2	68.4	-168.1	-168.7	-166.2	173.8	173.5	0	112.4	E1078	K426-E1078 WeakPolarHBondContact CB-OE1 3.37Å; K426-E1078 PolarHBondContact N-OE2 3.01Å; K426-E1078 VanDerWaalsContact O-OE1 3.08Å
427	R	74.7	Confident	83.4	Confident	29 Å²	29	49 Å²	49	11%	0.109	24%	0.24	C	C	.	.			trans	-54.8	139.4	177.8	-53.7	-174.3	-162.5	-69.9	-15.9	112.4	F411 E413 T425 K430 S432 E1074	F411-R427 VanDerWaalsContact CD2-NE 3.3Å; E413-R427 IonicContact OE1-CZ 3Å; E413-R427 IonicContact OE1-NE 3.85Å; E413-R427 PolarHBondContact OE1-NE 3.09Å; E413-R427 IonicContact OE1-NH2 3.68Å; E413-R427 PolarHBondContact OE1-NH2 3.37Å; T425-R427 PolarHBondContact O-N 2.72Å; R427-K430 VanDerWaalsContact CB-O 3.24Å; R427-K430 WeakPolarHBondContact CB-O 3.27Å; R427-S432 PolarHBondContact NE-OG 3.29Å; R427-S432 VanDerWaalsContact NE-OG 3.09Å; R427-E1074 IonicContact CZ-OE2 2.68Å; R427-E1074 IonicContact NH1-OE2 3.41Å; R427-E1074 PolarHBondContact NH1-OE2 2.96Å
428	R	67.9	Low	84.1	Confident	143 Å²	143	48.1 Å²	48.1	54%	0.54	23%	0.23	S	C	.	.	S	Bend	trans	-99.3	-51.5	177.2	-64	-175.4	-171.1	159.1	15.8	113	E1081	R428-E1081 IonicContact CZ-OE2 3.93Å; R428-E1081 IonicContact NH1-OE2 2.7Å; R428-E1081 PolarHBondContact NH1-OE2 2.74Å; R428-E1081 IonicContact NH2-OE2 2.73Å; R428-E1081 PolarHBondContact NH2-OE2 2.91Å
429	E	71.3	Confident	85	Confident	168 Å²	168	48.5 Å²	48.5	79%	0.785	23%	0.225	S	C	*	.	S	Bend	trans	-79.7	-58.4	-174	-60.1	-171.7	151.9	0	0	112.2
430	K	81.1	Confident	85.5	Confident	71 Å²	71	48.1 Å²	48.1	31%	0.309	22%	0.223	S	C	.	.	S	Bend	trans	-93	152	-176.8	-56.1	-171.9	-164.7	65.1	0	110.5	G409 F411 R427 E1074	G409-K430 WeakPolarHBondContact O-CB 3.18Å; G409-K430 WeakPolarHBondContact O-CD 3.4Å; G409-K430 WeakPolarHBondContact O-CG 3.27Å; F411-K430 HydrophobicContact CD2-CB 4Å; F411-K430 HydrophobicContact CD2-CD 4.48Å; F411-K430 HydrophobicContact CE2-CB 3.87Å; F411-K430 HydrophobicContact CE2-CD 3.76Å; F411-K430 HydrophobicContact CE2-CG 4.36Å; F411-K430 HydrophobicContact CZ-CD 4.42Å; R427-K430 VanDerWaalsContact CB-O 3.24Å; R427-K430 WeakPolarHBondContact CB-O 3.27Å; K430-E1074 WeakPolarHBondContact CD-OE1 3.48Å; K430-E1074 IonicContact NZ-OE1 3.24Å; K430-E1074 PolarHBondContact NZ-OE1 3.41Å
431	K	90.6	Very high	86.2	Confident	49 Å²	49	46.6 Å²	46.6	21%	0.213	21%	0.207	C	C	.	.			trans	-99.1	156.3	177.7	-59.5	-66.6	146.3	160	0	111.4	L377 R381 D383 F411	L377-K431 HydrophobicContact CD2-CB 3.8Å; R381-K431 WeakPolarHBondContact O-CD 3.46Å; R381-K431 WeakPolarHBondContact O-CE 3.22Å; R381-K431 PolarHBondContact O-NZ 2.71Å; D383-K431 WeakPolarHBondContact OD1-CD 2.95Å; F411-K431 PolarHBondContact N-O 3.24Å
432	S	92.4	Very high	86.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.3	177.7	-74.1	0	0	0	0	111.5	D383 V384 E413 R427 Y434	D383-S432 PolarHBondContact OD1-N 2.86Å; V384-S432 PolarHBondContact N-O 3.1Å; V384-S432 VanDerWaalsContact N-O 3.12Å; E413-S432 PolarHBondContact OE1-OG 2.9Å; R427-S432 PolarHBondContact NE-OG 3.29Å; R427-S432 VanDerWaalsContact NE-OG 3.09Å; S432-Y434 VanDerWaalsContact CB-CE1 3.47Å
433	L	95.4	Very high	87.3	Confident	3 Å²	3	40 Å²	40	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	102.6	161.4	177.4	60.3	0	0	0	108.1	M373 L377 V384 L401 F410 F411 V412 E413 I435	M373-L433 HydrophobicContact SD-CD1 3.8Å; L377-L433 HydrophobicContact CD1-CB 4.09Å; L377-L433 HydrophobicContact CD2-CB 4.48Å; V384-L433 HydrophobicContact CB-CD1 3.83Å; V384-L433 HydrophobicContact CG1-CD1 3.68Å; V384-L433 WeakPolarHBondContact O-CA 3.41Å; L401-L433 HydrophobicContact CD1-CD2 3.83Å; F410-L433 HydrophobicContact CD2-CB 4.33Å; F410-L433 HydrophobicContact CE2-CB 4.41Å; F410-L433 HydrophobicContact CE2-CD2 4.24Å; F411-L433 WeakPolarHBondContact O-CB 3.44Å; F411-L433 PolarHBondContact O-N 3.36Å; V412-L433 WeakPolarHBondContact CA-O 3.32Å; V412-L433 HydrophobicContact CG2-CD2 4.45Å; E413-L433 PolarHBondContact N-O 3.49Å; L433-I435 HydrophobicContact CD2-CD1 4.07Å; L433-I435 HydrophobicContact CD2-CG1 4.33Å; L433-I435 HydrophobicContact CG-CD1 4.24Å; L433-I435 HydrophobicContact CG-CG1 3.95Å
434	Y	95.8	Very high	87.7	Confident	3 Å²	3	36.8 Å²	36.8	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	120.8	175	-49.6	-69.5	0	0	0	108.9	D383 V384 L385 M386 E413 Y415 P424 S432 L444	D383-Y434 HydrophobicContact CB-CD2 4.44Å; D383-Y434 HydrophobicContact CB-CE2 3.66Å; D383-Y434 PolarHBondContact OD2-OH 3.34Å; V384-Y434 WeakPolarHBondContact O-CD2 3.42Å; V384-Y434 PolarHBondContact O-N 2.82Å; L385-Y434 WeakPolarHBondContact CA-O 3.32Å; M386-Y434 PolarHBondContact N-O 3.3Å; E413-Y434 HydrophobicContact CB-CD1 4.3Å; Y415-Y434 HydrophobicContact CD2-CD1 4.33Å; Y415-Y434 AromaticContact CE2-CD1 3.75Å; Y415-Y434 HydrophobicContact CE2-CD1 3.75Å; Y415-Y434 HydrophobicContact CE2-CE1 4.48Å; P424-Y434 HydrophobicContact CB-CE1 4.13Å; S432-Y434 VanDerWaalsContact CB-CE1 3.47Å; Y434-L444 HydrophobicContact CD1-CD2 4.1Å; Y434-L444 HydrophobicContact CD2-CD2 3.99Å; Y434-L444 HydrophobicContact CG-CD2 3.63Å
435	I	96.3	Very high	88.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	112.6	177.1	-52.6	-173	0	0	0	108.3	M386 L388 V394 K397 I398 L401 V412 E413 Y415 L433	M386-I435 HydrophobicContact CB-CG1 4.5Å; L388-I435 HydrophobicContact CD1-CG2 3.54Å; V394-I435 HydrophobicContact CB-CG2 4.39Å; V394-I435 HydrophobicContact CG1-CB 4.49Å; V394-I435 HydrophobicContact CG1-CG2 3.94Å; V394-I435 HydrophobicContact CG2-CG2 4.45Å; K397-I435 HydrophobicContact CB-CD1 4.17Å; K397-I435 HydrophobicContact CB-CG2 4.34Å; I398-I435 HydrophobicContact CD1-CB 4.44Å; I398-I435 HydrophobicContact CG1-CB 3.96Å; I398-I435 HydrophobicContact CG1-CD1 3.86Å; I398-I435 HydrophobicContact CG1-CG1 4.33Å; I398-I435 HydrophobicContact CG1-CG2 4.24Å; L401-I435 HydrophobicContact CD1-CD1 4.04Å; V412-I435 HydrophobicContact CG1-CD1 3.61Å; V412-I435 HydrophobicContact CG1-CG1 4.19Å; E413-I435 PolarHBondContact O-N 3.42Å; Y415-I435 PolarHBondContact N-O 3.46Å; L433-I435 HydrophobicContact CD2-CD1 4.07Å; L433-I435 HydrophobicContact CD2-CG1 4.33Å; L433-I435 HydrophobicContact CG-CD1 4.24Å; L433-I435 HydrophobicContact CG-CG1 3.95Å
436	A	95.9	Very high	88.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	155.1	-163.8	0	0	0	0	0	114.1	L385 M386 L388 Y415 K440	L385-A436 HydrophobicContact CD1-CB 3.83Å; M386-A436 PolarHBondContact O-N 3.19Å; L388-A436 PolarHBondContact N-O 3.03Å; Y415-A436 VanDerWaalsContact O-CA 3.23Å; Y415-A436 WeakPolarHBondContact O-CA 3.39Å; A436-K440 HydrophobicContact CB-CB 4.39Å
437	T	94.2	Very high	89.4	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.031	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	165.8	158.7	69.8	0	0	0	0	110.6	L388 V391 V394 Y415 A416 E439 K440 G441	L388-T437 WeakPolarHBondContact O-CA 3.44Å; V391-T437 HydrophobicContact CG2-CG2 3.82Å; V394-T437 HydrophobicContact CG2-CG2 4.08Å; Y415-T437 PolarHBondContact O-N 3.3Å; Y415-T437 VanDerWaalsContact O-N 3.1Å; A416-T437 HydrophobicContact CB-CG2 3.93Å; T437-E439 VanDerWaalsContact C-N 3.26Å; T437-E439 WeakPolarHBondContact CB-OE2 3.29Å; T437-E439 PolarHBondContact O-N 3.04Å; T437-E439 PolarHBondContact OG1-OE2 3.45Å; T437-K440 PolarHBondContact O-N 2.82Å; T437-G441 PolarHBondContact O-N 2.87Å
438	I	93.6	Very high	90.2	Very high	4 Å²	4	30 Å²	30	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-50.9	-46.3	178.9	-61.5	173.2	0	0	0	111.8	I387 G441 H442 M467 R473 T476 L477	I387-I438 HydrophobicContact CG2-CB 4.4Å; I387-I438 HydrophobicContact CG2-CG1 3.94Å; I438-G441 PolarHBondContact O-N 3.36Å; I438-H442 PolarHBondContact O-N 3.04Å; I438-M467 HydrophobicContact CD1-CB 4.44Å; I438-R473 HydrophobicContact CD1-CB 4.42Å; I438-T476 HydrophobicContact CG2-CG2 4.09Å; I438-L477 HydrophobicContact CG2-CB 3.82Å
439	E	89.1	Confident	91.4	Very high	70 Å²	70	24.1 Å²	24.1	33%	0.327	12%	0.116	S	C	.	.	H	α-helix	trans	-69.5	-42.2	-175	-47.5	72.8	-156.8	0	0	111	T437 H442 S443 R473	T437-E439 VanDerWaalsContact C-N 3.26Å; T437-E439 WeakPolarHBondContact CB-OE2 3.29Å; T437-E439 PolarHBondContact O-N 3.04Å; T437-E439 PolarHBondContact OG1-OE2 3.45Å; E439-H442 WeakPolarHBondContact O-CB 3.38Å; E439-H442 PolarHBondContact O-N 3.49Å; E439-S443 PolarHBondContact O-N 3.29Å; E439-S443 PolarHBondContact O-OG 2.86Å; E439-S443 VanDerWaalsContact O-OG 3.06Å; E439-R473 IonicContact OE1-CZ 2.78Å; E439-R473 IonicContact OE1-NE 3.63Å; E439-R473 PolarHBondContact OE1-NE 3.02Å; E439-R473 IonicContact OE1-NH2 3.84Å; E439-R473 PolarHBondContact OE1-NH2 2.89Å; E439-R473 IonicContact OE2-NH2 3.42Å
440	K	90.3	Very high	92.3	Very high	40 Å²	40	20.1 Å²	20.1	17%	0.174	10%	0.097	C	C	.	.	H	α-helix	trans	-75.9	-30.7	178.3	-67.7	-69.6	-175	174.2	0	112.7	Y415 G417 F422 A436 T437 S443 L444	Y415-K440 WeakPolarHBondContact O-CB 3.43Å; Y415-K440 WeakPolarHBondContact O-CG 3.43Å; G417-K440 WeakPolarHBondContact O-CE 3.26Å; G417-K440 PolarHBondContact O-NZ 2.89Å; F422-K440 HydrophobicContact CE2-CD 4.01Å; F422-K440 HydrophobicContact CZ-CD 3.91Å; A436-K440 HydrophobicContact CB-CB 4.39Å; T437-K440 PolarHBondContact O-N 2.82Å; K440-S443 PolarHBondContact O-N 3.39Å; K440-L444 VanDerWaalsContact O-CB 3.27Å; K440-L444 WeakPolarHBondContact O-CB 3.45Å; K440-L444 PolarHBondContact O-N 3.12Å
441	G	94.1	Very high	92.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.8	-44.2	169.9	0	0	0	0	0	111	T437 I438 L444 V445	T437-G441 PolarHBondContact O-N 2.87Å; I438-G441 PolarHBondContact O-N 3.36Å; G441-L444 PolarHBondContact O-N 3.25Å; G441-V445 WeakPolarHBondContact O-CG2 3.28Å; G441-V445 PolarHBondContact O-N 3.11Å
442	H	92.9	Very high	92.7	Very high	17 Å²	17	20.4 Å²	20.4	8%	0.079	12%	0.123	C	C	.	.	H	α-helix	trans	-57.9	-50	171	-171.4	118.6	0	0	0	111.6	I438 E439 L444 V445 N446 T476 T480 K483	I438-H442 PolarHBondContact O-N 3.04Å; E439-H442 WeakPolarHBondContact O-CB 3.38Å; E439-H442 PolarHBondContact O-N 3.49Å; H442-L444 VanDerWaalsContact C-N 3.3Å; H442-L444 PolarHBondContact O-N 3.2Å; H442-V445 PolarHBondContact O-N 3.24Å; H442-N446 PolarHBondContact CD2-ND2 3Å; H442-N446 PolarHBondContact NE2-ND2 2.78Å; H442-N446 WeakPolarHBondContact O-CB 3.43Å; H442-N446 PolarHBondContact O-N 2.68Å; H442-N446 PolarHBondContact O-OD1 3.14Å; H442-T476 HydrophobicContact CB-CG2 3.83Å; H442-T476 PolarHBondContact ND1-O 2.8Å; H442-T476 VanDerWaalsContact ND1-O 3.16Å; H442-T480 WeakPolarHBondContact CA-OG1 3.22Å; H442-T480 VanDerWaalsContact CB-OG1 3.27Å; H442-T480 WeakPolarHBondContact CB-OG1 3.44Å; H442-T480 PolarHBondContact ND1-OG1 3.24Å; H442-T480 VanDerWaalsContact ND1-OG1 3.12Å; H442-K483 PolarHBondContact CE1-NZ 3.04Å; H442-K483 PolarHBondContact NE2-NZ 3.43Å
443	S	90.9	Very high	92.6	Very high	28 Å²	28	22.1 Å²	22.1	20%	0.196	13%	0.129	C	C	.	.	H	α-helix	trans	-60	-37.7	176.6	-54.4	0	0	0	0	113.1	E439 K440 N446 S447	E439-S443 PolarHBondContact O-N 3.29Å; E439-S443 PolarHBondContact O-OG 2.86Å; E439-S443 VanDerWaalsContact O-OG 3.06Å; K440-S443 PolarHBondContact O-N 3.39Å; S443-N446 PolarHBondContact O-N 2.94Å; S443-S447 WeakPolarHBondContact O-CB 3.49Å; S443-S447 PolarHBondContact O-N 2.98Å
444	L	92.8	Very high	92.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-69.6	-45.8	179.6	-177.5	63.8	0	0	0	111.5	L385 Y415 F422 P424 Y434 K440 G441 H442 N446 S447 L448	L385-L444 HydrophobicContact CD1-CD2 4.06Å; Y415-L444 HydrophobicContact CD1-CD1 4.43Å; Y415-L444 HydrophobicContact CE1-CD1 3.92Å; F422-L444 HydrophobicContact CE1-CB 4.09Å; F422-L444 HydrophobicContact CE1-CD1 4.43Å; P424-L444 HydrophobicContact CB-CD1 4.02Å; P424-L444 HydrophobicContact CG-CD1 3.69Å; Y434-L444 HydrophobicContact CD1-CD2 4.1Å; Y434-L444 HydrophobicContact CD2-CD2 3.99Å; Y434-L444 HydrophobicContact CG-CD2 3.63Å; K440-L444 VanDerWaalsContact O-CB 3.27Å; K440-L444 WeakPolarHBondContact O-CB 3.45Å; K440-L444 PolarHBondContact O-N 3.12Å; G441-L444 PolarHBondContact O-N 3.25Å; H442-L444 VanDerWaalsContact C-N 3.3Å; H442-L444 PolarHBondContact O-N 3.2Å; L444-N446 VanDerWaalsContact C-N 3.32Å; L444-N446 PolarHBondContact O-N 2.91Å; L444-S447 PolarHBondContact O-N 3.21Å; L444-S447 VanDerWaalsContact O-N 3.16Å; L444-L448 HydrophobicContact CG-CD1 4.21Å; L444-L448 WeakPolarHBondContact O-CG 3.49Å; L444-L448 PolarHBondContact O-N 2.85Å
445	V	94.1	Very high	92.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-43.9	173.8	169.1	0	0	0	0	110.5	L385 G441 H442 S447 L448 I449 I454 T480 I484	L385-V445 HydrophobicContact CD2-CG2 3.96Å; G441-V445 WeakPolarHBondContact O-CG2 3.28Å; G441-V445 PolarHBondContact O-N 3.11Å; H442-V445 PolarHBondContact O-N 3.24Å; V445-S447 VanDerWaalsContact C-N 3.32Å; V445-S447 PolarHBondContact O-N 3.22Å; V445-L448 PolarHBondContact O-N 2.72Å; V445-I449 HydrophobicContact CG1-CD1 3.86Å; V445-I449 VanDerWaalsContact O-CG1 3.3Å; V445-I449 WeakPolarHBondContact O-CG1 3.47Å; V445-I449 PolarHBondContact O-N 3.46Å; V445-I454 HydrophobicContact CG1-CD1 4.37Å; V445-T480 HydrophobicContact CB-CG2 4.15Å; V445-T480 HydrophobicContact CG1-CG2 4.47Å; V445-T480 HydrophobicContact CG2-CG2 3.81Å; V445-I484 HydrophobicContact CG1-CG1 4.08Å; V445-I484 HydrophobicContact CG2-CD1 4.09Å; V445-I484 HydrophobicContact CG2-CG1 4.2Å
446	N	92.9	Very high	91.9	Very high	13 Å²	13	28.2 Å²	28.2	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-57.3	-44.6	174.1	-68.2	-4.6	0	0	0	111.9	H442 S443 L444 I449 E450 K483 L764 F838	H442-N446 PolarHBondContact CD2-ND2 3Å; H442-N446 PolarHBondContact NE2-ND2 2.78Å; H442-N446 WeakPolarHBondContact O-CB 3.43Å; H442-N446 PolarHBondContact O-N 2.68Å; H442-N446 PolarHBondContact O-OD1 3.14Å; S443-N446 PolarHBondContact O-N 2.94Å; L444-N446 VanDerWaalsContact C-N 3.32Å; L444-N446 PolarHBondContact O-N 2.91Å; N446-I449 PolarHBondContact O-N 3.08Å; N446-E450 PolarHBondContact O-N 3.15Å; N446-K483 PolarHBondContact OD1-NZ 2.83Å; N446-L764 HydrophobicContact CB-CD1 4.09Å; N446-L764 HydrophobicContact CB-CD2 4.32Å; N446-L764 VanDerWaalsContact O-CD2 3.26Å; N446-L764 WeakPolarHBondContact O-CD2 3.38Å; N446-F838 HydrophobicContact CB-CZ 4.21Å; N446-F838 WeakPolarHBondContact ND2-CE2 3.33Å
447	S	91.4	Very high	91.8	Very high	14 Å²	14	28.2 Å²	28.2	10%	0.098	17%	0.165	C	C	.	.	H	α-helix	trans	-71.4	-34	-179.7	-165.9	0	0	0	0	113.3	P423 S443 L444 V445 I449 T451	P423-S447 VanDerWaalsContact CA-OG 3.29Å; P423-S447 WeakPolarHBondContact CA-OG 3.18Å; P423-S447 WeakPolarHBondContact CB-OG 3.14Å; S443-S447 WeakPolarHBondContact O-CB 3.49Å; S443-S447 PolarHBondContact O-N 2.98Å; L444-S447 PolarHBondContact O-N 3.21Å; L444-S447 VanDerWaalsContact O-N 3.16Å; V445-S447 VanDerWaalsContact C-N 3.32Å; V445-S447 PolarHBondContact O-N 3.22Å; S447-I449 VanDerWaalsContact C-N 3.32Å; S447-T451 WeakPolarHBondContact O-CB 3.36Å; S447-T451 WeakPolarHBondContact O-CG2 3.29Å; S447-T451 PolarHBondContact O-N 3.17Å; S447-T451 PolarHBondContact O-OG1 3.08Å
448	L	92	Very high	91.8	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-67.1	-33.5	171.8	-72.3	171.6	0	0	0	111.7	P424 L444 V445 G452 R453 I454 L457	P424-L448 HydrophobicContact CG-CD2 3.86Å; P424-L448 HydrophobicContact CG-CG 4.38Å; L444-L448 HydrophobicContact CG-CD1 4.21Å; L444-L448 WeakPolarHBondContact O-CG 3.49Å; L444-L448 PolarHBondContact O-N 2.85Å; V445-L448 PolarHBondContact O-N 2.72Å; L448-G452 PolarHBondContact O-N 3.29Å; L448-R453 HydrophobicContact CD2-CB 3.97Å; L448-R453 PolarHBondContact O-N 3.16Å; L448-I454 HydrophobicContact CB-CD1 4.27Å; L448-I454 PolarHBondContact O-N 3.14Å; L448-L457 HydrophobicContact CD1-CD2 4.46Å
449	I	93.1	Very high	91.9	Very high	21 Å²	21	27.9 Å²	27.9	11%	0.108	16%	0.163	C	C	.	.	H	α-helix	trans	-73.6	-49.1	173.3	-64.7	169	0	0	0	110.9	V445 N446 S447 T451 G452 I454 K483 T487 L764 I766	V445-I449 HydrophobicContact CG1-CD1 3.86Å; V445-I449 VanDerWaalsContact O-CG1 3.3Å; V445-I449 WeakPolarHBondContact O-CG1 3.47Å; V445-I449 PolarHBondContact O-N 3.46Å; N446-I449 PolarHBondContact O-N 3.08Å; S447-I449 VanDerWaalsContact C-N 3.32Å; I449-T451 PolarHBondContact O-N 2.78Å; I449-G452 PolarHBondContact O-N 3.36Å; I449-I454 HydrophobicContact CG1-CB 4.05Å; I449-I454 HydrophobicContact CG1-CD1 4.27Å; I449-I454 HydrophobicContact CG1-CG1 4.12Å; I449-K483 HydrophobicContact CD1-CB 4.36Å; I449-T487 HydrophobicContact CG1-CG2 4.49Å; I449-L764 HydrophobicContact CB-CD1 4.41Å; I449-L764 HydrophobicContact CB-CD2 4.42Å; I449-L764 HydrophobicContact CD1-CD1 4.46Å; I449-L764 HydrophobicContact CG2-CB 4.02Å; I449-L764 HydrophobicContact CG2-CD1 4.33Å; I449-L764 HydrophobicContact CG2-CD2 4.34Å; I449-L764 HydrophobicContact CG2-CG 4.47Å; I449-I766 HydrophobicContact CD1-CD1 3.96Å; I449-I766 HydrophobicContact CG2-CD1 4.18Å; I449-I766 HydrophobicContact CG2-CG1 4.02Å
450	E	90.3	Very high	92.3	Very high	83 Å²	83	24.5 Å²	24.5	39%	0.388	15%	0.148	S	C	.	.	H	α-helix	trans	-60.1	-29.9	177.6	-170.4	175.8	-156.2	0	0	112.2	N446 L764 R835 K839	N446-E450 PolarHBondContact O-N 3.15Å; E450-L764 HydrophobicContact CB-CD2 3.95Å; E450-R835 IonicContact OE1-CZ 2.67Å; E450-R835 IonicContact OE1-NH2 3.08Å; E450-R835 PolarHBondContact OE1-NH2 2.85Å; E450-K839 WeakPolarHBondContact OE1-CE 3.38Å; E450-K839 IonicContact OE1-NZ 3.63Å; E450-K839 PolarHBondContact OE1-NZ 2.8Å; E450-K839 WeakPolarHBondContact OE2-CE 3.37Å; E450-K839 IonicContact OE2-NZ 3.04Å; E450-K839 PolarHBondContact OE2-NZ 2.78Å; E450-K839 VanDerWaalsContact OE2-NZ 3.12Å
451	T	89.7	Confident	92.7	Very high	58 Å²	58	22.6 Å²	22.6	36%	0.356	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	6.3	175.6	60	0	0	0	0	115	P423 S447 I449 R453	P423-T451 HydrophobicContact CB-CG2 3.98Å; S447-T451 WeakPolarHBondContact O-CB 3.36Å; S447-T451 WeakPolarHBondContact O-CG2 3.29Å; S447-T451 PolarHBondContact O-N 3.17Å; S447-T451 PolarHBondContact O-OG1 3.08Å; I449-T451 PolarHBondContact O-N 2.78Å; T451-R453 VanDerWaalsContact C-N 3.31Å; T451-R453 PolarHBondContact O-N 3.26Å; T451-R453 PolarHBondContact OG1-NE 3.22Å; T451-R453 PolarHBondContact OG1-NH2 2.91Å; T451-R453 VanDerWaalsContact OG1-NH2 3.17Å
452	G	89.5	Confident	92.8	Very high	68 Å²	68	22.7 Å²	22.7	70%	0.701	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	32.4	176.5	0	0	0	0	0	114.4	L448 I449	L448-G452 PolarHBondContact O-N 3.29Å; I449-G452 PolarHBondContact O-N 3.36Å
453	R	90.2	Very high	92.8	Very high	36 Å²	36	22.6 Å²	22.6	14%	0.136	14%	0.14	C	C	.	.			trans	-116.4	1.4	-174.1	-75.1	-172.3	-65.7	166	-8.7	114.9	P424 L448 T451 D455 S456	P424-R453 VanDerWaalsContact O-CZ 3.27Å; P424-R453 PolarHBondContact O-NH1 2.89Å; P424-R453 PolarHBondContact O-NH2 3.47Å; L448-R453 HydrophobicContact CD2-CB 3.97Å; L448-R453 PolarHBondContact O-N 3.16Å; T451-R453 VanDerWaalsContact C-N 3.31Å; T451-R453 PolarHBondContact O-N 3.26Å; T451-R453 PolarHBondContact OG1-NE 3.22Å; T451-R453 PolarHBondContact OG1-NH2 2.91Å; T451-R453 VanDerWaalsContact OG1-NH2 3.17Å; R453-D455 PolarHBondContact O-N 2.89Å; R453-S456 WeakPolarHBondContact O-CB 3.44Å; R453-S456 PolarHBondContact O-N 2.92Å; R453-S456 PolarHBondContact O-OG 3.12Å; R453-S456 VanDerWaalsContact O-OG 3.05Å
454	I	91	Very high	92.8	Very high	9 Å²	9	23.2 Å²	23.2	5%	0.046	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-52.6	-34	-174	-169.2	60.8	0	0	0	113.6	V445 L448 I449 S456 L457 T487	V445-I454 HydrophobicContact CG1-CD1 4.37Å; L448-I454 HydrophobicContact CB-CD1 4.27Å; L448-I454 PolarHBondContact O-N 3.14Å; I449-I454 HydrophobicContact CG1-CB 4.05Å; I449-I454 HydrophobicContact CG1-CD1 4.27Å; I449-I454 HydrophobicContact CG1-CG1 4.12Å; I454-S456 PolarHBondContact O-N 3.45Å; I454-L457 HydrophobicContact CD1-CD2 4.12Å; I454-L457 VanDerWaalsContact O-CB 3.22Å; I454-L457 WeakPolarHBondContact O-CB 3.48Å; I454-L457 PolarHBondContact O-N 2.97Å; I454-T487 HydrophobicContact CG2-CG2 3.94Å
455	D	90.4	Very high	92.8	Very high	86 Å²	86	23.2 Å²	23.2	46%	0.46	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-69	-10.5	177.8	-61.4	-57.8	0	0	0	115.2	K382 R453 L457 S488	K382-D455 WeakPolarHBondContact CE-O 3.49Å; K382-D455 PolarHBondContact NZ-O 3.29Å; R453-D455 PolarHBondContact O-N 2.89Å; D455-L457 PolarHBondContact O-N 3.18Å; D455-S488 WeakPolarHBondContact OD1-CB 3.5Å; D455-S488 PolarHBondContact OD1-OG 3.42Å
456	S	90.4	Very high	92.6	Very high	40 Å²	40	23.4 Å²	23.4	28%	0.28	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-71.9	-18.9	169	78.4	0	0	0	0	112.6	K382 D383 R453 I454	K382-S456 WeakPolarHBondContact CB-O 3.42Å; D383-S456 PolarHBondContact N-O 2.99Å; R453-S456 WeakPolarHBondContact O-CB 3.44Å; R453-S456 PolarHBondContact O-N 2.92Å; R453-S456 PolarHBondContact O-OG 3.12Å; R453-S456 VanDerWaalsContact O-OG 3.05Å; I454-S456 PolarHBondContact O-N 3.45Å
457	L	94.1	Very high	92.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	113.9	177.6	-171.2	61.3	0	0	0	109.9	L385 L448 I454 D455 V460 T491	L385-L457 HydrophobicContact CB-CD1 3.76Å; L385-L457 HydrophobicContact CB-CD2 4.47Å; L448-L457 HydrophobicContact CD1-CD2 4.46Å; I454-L457 HydrophobicContact CD1-CD2 4.12Å; I454-L457 VanDerWaalsContact O-CB 3.22Å; I454-L457 WeakPolarHBondContact O-CB 3.48Å; I454-L457 PolarHBondContact O-N 2.97Å; D455-L457 PolarHBondContact O-N 3.18Å; L457-V460 HydrophobicContact CD1-CG2 4.46Å; L457-V460 HydrophobicContact CD2-CG2 3.64Å; L457-V460 HydrophobicContact CG-CG2 4.02Å; L457-T491 HydrophobicContact CD2-CG2 4.35Å; L457-T491 HydrophobicContact CG-CG2 4.03Å; L457-T491 WeakPolarHBondContact O-CB 3.15Å; L457-T491 PolarHBondContact O-OG1 3.33Å
458	G	94.4	Very high	92.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-32.6	-174.9	0	0	0	0	0	114.8	R352 E376 D383 T491 Q492	R352-G458 PolarHBondContact NH2-O 2.88Å; E376-G458 WeakPolarHBondContact OE1-CA 3.14Å; D383-G458 PolarHBondContact O-N 3.02Å; G458-T491 WeakPolarHBondContact O-CA 3.48Å; G458-Q492 PolarHBondContact O-N 3.06Å
459	L	96.5	Very high	92.1	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	136.5	-176.7	172.7	64.4	0	0	0	110.6	L372 M373 E376 V384 L385 V461 Q492 I494	L372-L459 HydrophobicContact CB-CD2 4.32Å; M373-L459 HydrophobicContact CG-CD2 4.01Å; E376-L459 HydrophobicContact CB-CB 4.16Å; E376-L459 HydrophobicContact CB-CD2 4.46Å; E376-L459 HydrophobicContact CG-CB 3.93Å; V384-L459 WeakPolarHBondContact CA-O 3.25Å; V384-L459 HydrophobicContact CG1-CB 4.25Å; V384-L459 HydrophobicContact CG1-CD2 4.28Å; V384-L459 HydrophobicContact CG1-CG 4.31Å; V384-L459 HydrophobicContact CG2-CB 4.25Å; L385-L459 PolarHBondContact N-O 2.86Å; L459-V461 HydrophobicContact CD1-CG2 4.32Å; L459-V461 HydrophobicContact CD2-CG2 4Å; L459-V461 HydrophobicContact CG-CG2 4.02Å; L459-Q492 CarbonylContact C-O 3.54Å; L459-Q492 WeakPolarHBondContact CA-O 3.35Å; L459-Q492 HydrophobicContact CD1-CB 4.08Å; L459-Q492 HydrophobicContact CD1-CG 4.28Å; L459-I494 HydrophobicContact CD1-CB 4.23Å; L459-I494 HydrophobicContact CD1-CD1 3.63Å; L459-I494 HydrophobicContact CD1-CG1 3.66Å
460	V	97.8	Very high	91.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.1	168.9	179.2	0	0	0	0	108.9	L385 I387 L457 V462 L481 I484 T491 Q492 I493 I494	L385-V460 HydrophobicContact CB-CG2 4.31Å; L385-V460 CarbonylContact O-C 3.57Å; L385-V460 WeakPolarHBondContact O-CA 3.27Å; I387-V460 HydrophobicContact CD1-CG1 4.1Å; I387-V460 HydrophobicContact CG1-CG1 4.43Å; L457-V460 HydrophobicContact CD1-CG2 4.46Å; L457-V460 HydrophobicContact CD2-CG2 3.64Å; L457-V460 HydrophobicContact CG-CG2 4.02Å; V460-V462 HydrophobicContact CG1-CG2 4.41Å; V460-L481 HydrophobicContact CG1-CD2 4.41Å; V460-I484 HydrophobicContact CG1-CD1 4.24Å; V460-I484 HydrophobicContact CG2-CD1 3.94Å; V460-T491 HydrophobicContact CG2-CG2 3.71Å; V460-Q492 PolarHBondContact N-O 3.47Å; V460-I493 WeakPolarHBondContact O-CA 3.27Å; V460-I494 PolarHBondContact O-N 2.83Å
461	V	97.7	Very high	91.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.4	173.9	177.3	0	0	0	0	109.1	A369 M373 L385 M386 I387 L459 I494 M496	A369-V461 HydrophobicContact CB-CG1 3.81Å; A369-V461 HydrophobicContact CB-CG2 4.38Å; M373-V461 HydrophobicContact CG-CG2 3.72Å; M373-V461 HydrophobicContact SD-CB 4.4Å; M373-V461 HydrophobicContact SD-CG2 3.96Å; L385-V461 PolarHBondContact O-N 2.99Å; M386-V461 HydrophobicContact CE-CG1 4.36Å; M386-V461 HydrophobicContact CG-CB 4.26Å; M386-V461 HydrophobicContact CG-CG1 4.27Å; I387-V461 PolarHBondContact N-O 3.09Å; L459-V461 HydrophobicContact CD1-CG2 4.32Å; L459-V461 HydrophobicContact CD2-CG2 4Å; L459-V461 HydrophobicContact CG-CG2 4.02Å; V461-I494 CarbonylContact C-O 3.54Å; V461-I494 WeakPolarHBondContact CA-O 3.48Å; V461-M496 HydrophobicContact CG1-CE 3.75Å
462	V	96.9	Very high	90.9	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.1	173	-175.9	0	0	0	0	109.1	I387 V460 L465 L477 L481 I494 M496	I387-V462 HydrophobicContact CD1-CG2 4.48Å; V460-V462 HydrophobicContact CG1-CG2 4.41Å; V462-L465 HydrophobicContact CB-CD1 4.4Å; V462-L465 HydrophobicContact CG1-CB 4.41Å; V462-L465 HydrophobicContact CG1-CD1 3.99Å; V462-L477 HydrophobicContact CG1-CD1 4.06Å; V462-L477 HydrophobicContact CG1-CD2 4.05Å; V462-L477 HydrophobicContact CG2-CD1 4.38Å; V462-L481 HydrophobicContact CG2-CD1 4.35Å; V462-L481 HydrophobicContact CG2-CD2 3.9Å; V462-I494 PolarHBondContact N-O 3.17Å; V462-M496 PolarHBondContact O-N 3.2Å
463	D	93.4	Very high	90.9	Very high	15 Å²	15	22.9 Å²	22.9	8%	0.08	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	147	170	-153.6	-6.2	0	0	0	111	I387 L388 L465 M496	I387-D463 PolarHBondContact O-N 3.11Å; L388-D463 HydrophobicContact CD2-CB 3.56Å; D463-L465 PolarHBondContact O-N 2.75Å; D463-M496 HydrophobicContact CB-CE 3.75Å; D463-M496 HydrophobicContact CB-CG 4.41Å
464	E	90.2	Very high	90.9	Very high	40 Å²	40	21.1 Å²	21.1	19%	0.187	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.1	59.3	-169.2	-57.5	-61.1	-176.1	0	0	114	P389 H466 M467 M496 S497 A498	P389-E464 HydrophobicContact CG-CB 4.36Å; E464-H466 PolarHBondContact O-N 3.11Å; E464-H466 IonicContact OE2-CE1 3.6Å; E464-H466 PolarHBondContact OE2-CE1 2.8Å; E464-H466 IonicContact OE2-ND1 3.65Å; E464-H466 PolarHBondContact OE2-ND1 2.85Å; E464-M467 HydrophobicContact CB-CG 4.22Å; E464-M467 WeakPolarHBondContact O-CB 3.31Å; E464-M467 WeakPolarHBondContact O-CG 3.46Å; E464-M467 PolarHBondContact O-N 2.92Å; E464-M496 CarbonylContact C-O 3.6Å; E464-M496 VanDerWaalsContact CA-O 3.28Å; E464-M496 WeakPolarHBondContact CA-O 3.47Å; E464-M496 PolarHBondContact N-O 3.41Å; E464-S497 WeakPolarHBondContact OE2-CA 3.27Å; E464-A498 PolarHBondContact OE2-N 3.09Å
465	L	93	Very high	90.9	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-50.1	-23.5	-179.9	179.9	64.9	0	0	0	114.3	I356 V462 D463 M467 I468 L481 M496 L510	I356-L465 HydrophobicContact CD1-CD2 4.43Å; I356-L465 HydrophobicContact CG1-CD2 4.21Å; I356-L465 HydrophobicContact CG2-CD2 4.17Å; V462-L465 HydrophobicContact CB-CD1 4.4Å; V462-L465 HydrophobicContact CG1-CB 4.41Å; V462-L465 HydrophobicContact CG1-CD1 3.99Å; D463-L465 PolarHBondContact O-N 2.75Å; L465-M467 PolarHBondContact O-N 3.42Å; L465-M467 VanDerWaalsContact O-N 3.11Å; L465-I468 WeakPolarHBondContact O-CB 3.35Å; L465-I468 VanDerWaalsContact O-CG2 3.23Å; L465-I468 WeakPolarHBondContact O-CG2 3.06Å; L465-I468 PolarHBondContact O-N 3.42Å; L465-L481 HydrophobicContact CD1-CD1 4.31Å; L465-M496 PolarHBondContact N-O 3.22Å; L465-L510 HydrophobicContact CD1-CD1 4.42Å; L465-L510 HydrophobicContact CD2-CD1 3.96Å
466	H	88.8	Confident	91	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.019	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-57.6	-23.2	175.5	64.9	-95.9	0	0	0	113.9	E464 I468 G469 E470 S497 T499 L500 Q703	E464-H466 PolarHBondContact O-N 3.11Å; E464-H466 IonicContact OE2-CE1 3.6Å; E464-H466 PolarHBondContact OE2-CE1 2.8Å; E464-H466 IonicContact OE2-ND1 3.65Å; E464-H466 PolarHBondContact OE2-ND1 2.85Å; H466-I468 PolarHBondContact O-N 3.16Å; H466-G469 PolarHBondContact O-N 3.41Å; H466-E470 IonicContact CD2-OE1 3.93Å; H466-S497 PolarHBondContact ND1-OG 3.04Å; H466-T499 VanDerWaalsContact CB-O 3.22Å; H466-T499 WeakPolarHBondContact CB-O 3.37Å; H466-L500 HydrophobicContact CB-CD2 3.78Å; H466-Q703 PolarHBondContact NE2-NE2 3.38Å
467	M	88.6	Confident	91.2	Very high	7 Å²	7	16.7 Å²	16.7	3%	0.034	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-56.3	-16.9	171.7	-63.4	-67.1	-40.9	0	0	113.7	P389 I438 E464 L465 G469 E470 G474	P389-M467 HydrophobicContact CB-CG 4.08Å; P389-M467 HydrophobicContact CB-SD 4.34Å; I438-M467 HydrophobicContact CD1-CB 4.44Å; E464-M467 HydrophobicContact CB-CG 4.22Å; E464-M467 WeakPolarHBondContact O-CB 3.31Å; E464-M467 WeakPolarHBondContact O-CG 3.46Å; E464-M467 PolarHBondContact O-N 2.92Å; L465-M467 PolarHBondContact O-N 3.42Å; L465-M467 VanDerWaalsContact O-N 3.11Å; M467-G469 PolarHBondContact O-N 2.94Å; M467-E470 HydrophobicContact CE-CB 4.08Å; M467-E470 HydrophobicContact CE-CG 4.46Å; M467-E470 WeakPolarHBondContact CE-OE2 3.1Å; M467-E470 PolarHBondContact O-N 3.39Å; M467-E470 VanDerWaalsContact O-N 3.09Å; M467-G474 WeakPolarHBondContact O-CA 3.34Å
468	I	90.6	Very high	91.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-60.1	-26.8	170.5	-159.8	172.5	0	0	0	112.2	L465 H466 G474 L477 E478 L506 F509 C742 F781	L465-I468 WeakPolarHBondContact O-CB 3.35Å; L465-I468 VanDerWaalsContact O-CG2 3.23Å; L465-I468 WeakPolarHBondContact O-CG2 3.06Å; L465-I468 PolarHBondContact O-N 3.42Å; H466-I468 PolarHBondContact O-N 3.16Å; I468-G474 CarbonylContact O-C 3.57Å; I468-G474 WeakPolarHBondContact O-CA 3.48Å; I468-L477 HydrophobicContact CB-CD2 4.12Å; I468-E478 HydrophobicContact CD1-CB 4.15Å; I468-E478 HydrophobicContact CD1-CG 4.49Å; I468-E478 HydrophobicContact CG1-CB 4.09Å; I468-L506 HydrophobicContact CD1-CD2 4.38Å; I468-L506 HydrophobicContact CG2-CD2 3.9Å; I468-F509 HydrophobicContact CD1-CD1 4.24Å; I468-F509 HydrophobicContact CD1-CE1 3.7Å; I468-C742 HydrophobicContact CG2-CB 4.43Å; I468-F781 HydrophobicContact CD1-CD1 4.11Å; I468-F781 HydrophobicContact CD1-CG 4.43Å; I468-F781 HydrophobicContact CG1-CD1 4.33Å; I468-F781 HydrophobicContact CG2-CE1 4.32Å
469	G	87.1	Confident	91.2	Very high	20 Å²	20	17 Å²	17	21%	0.206	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-91.7	20.3	173.9	0	0	0	0	0	114.8	H466 M467 Y743 H745	H466-G469 PolarHBondContact O-N 3.41Å; M467-G469 PolarHBondContact O-N 2.94Å; G469-Y743 WeakPolarHBondContact CA-O 3.36Å; G469-H745 PolarHBondContact O-CE1 3.11Å
470	E	83	Confident	91.2	Very high	68 Å²	68	17 Å²	17	32%	0.318	10%	0.098	S	C	.	.	S	Bend	trans	-125.2	88.3	-179.2	-64	-168.4	-170.4	0	0	112.6	H466 M467 G474	H466-E470 IonicContact CD2-OE1 3.93Å; M467-E470 HydrophobicContact CE-CB 4.08Å; M467-E470 HydrophobicContact CE-CG 4.46Å; M467-E470 WeakPolarHBondContact CE-OE2 3.1Å; M467-E470 PolarHBondContact O-N 3.39Å; M467-E470 VanDerWaalsContact O-N 3.09Å; E470-G474 PolarHBondContact O-N 3.15Å
471	G	83.4	Confident	91.1	Very high	10 Å²	10	17 Å²	17	10%	0.103	10%	0.098	C	C	.	.	H	α-helix	trans	60.6	-151	164.1	0	0	0	0	0	115.8	R473 G474 A475 H745	G471-R473 PolarHBondContact O-N 3.04Å; G471-G474 PolarHBondContact O-N 3.17Å; G471-A475 PolarHBondContact O-N 2.85Å; G471-H745 VanDerWaalsContact CA-CD2 3.45Å; G471-H745 WeakPolarHBondContact CA-CD2 3.47Å; G471-H745 PolarHBondContact N-CD2 3.16Å; G471-H745 VanDerWaalsContact N-CD2 3.27Å; G471-H745 WeakPolarHBondContact O-CB 3.41Å
472	S	82.7	Confident	91	Very high	81 Å²	81	17.1 Å²	17.1	57%	0.566	10%	0.099	S	C	*	.	H	α-helix	trans	-57.2	-28.7	178.1	61.4	0	0	0	0	114.1	T476	S472-T476 WeakPolarHBondContact O-CB 3.33Å; S472-T476 PolarHBondContact O-N 3.23Å; S472-T476 PolarHBondContact O-OG1 2.99Å
473	R	88	Confident	90.9	Very high	60 Å²	60	17 Å²	17	23%	0.226	10%	0.099	C	C	.	.	H	α-helix	trans	-73.1	-42.2	175.5	-55.5	-168.2	74.5	-147.2	2.9	111.4	P389 I438 E439 G471 T476 L477	P389-R473 VanDerWaalsContact O-CZ 3.28Å; P389-R473 PolarHBondContact O-NH1 3.39Å; P389-R473 PolarHBondContact O-NH2 3.24Å; I438-R473 HydrophobicContact CD1-CB 4.42Å; E439-R473 IonicContact OE1-CZ 2.78Å; E439-R473 IonicContact OE1-NE 3.63Å; E439-R473 PolarHBondContact OE1-NE 3.02Å; E439-R473 IonicContact OE1-NH2 3.84Å; E439-R473 PolarHBondContact OE1-NH2 2.89Å; E439-R473 IonicContact OE2-NH2 3.42Å; G471-R473 PolarHBondContact O-N 3.04Å; R473-T476 WeakPolarHBondContact O-CB 3.35Å; R473-T476 PolarHBondContact O-N 3.12Å; R473-L477 PolarHBondContact O-N 3.27Å
474	G	91.2	Very high	91	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.4	-45	173	0	0	0	0	0	112.4	M467 I468 E470 G471 T476 L477 E478	M467-G474 WeakPolarHBondContact O-CA 3.34Å; I468-G474 CarbonylContact O-C 3.57Å; I468-G474 WeakPolarHBondContact O-CA 3.48Å; E470-G474 PolarHBondContact O-N 3.15Å; G471-G474 PolarHBondContact O-N 3.17Å; G474-T476 VanDerWaalsContact C-N 3.34Å; G474-T476 PolarHBondContact O-N 2.74Å; G474-L477 PolarHBondContact O-N 2.76Å; G474-E478 WeakPolarHBondContact O-CB 3.49Å; G474-E478 PolarHBondContact O-N 3.41Å
475	A	91.1	Very high	91.2	Very high	5 Å²	5	16.4 Å²	16.4	4%	0.041	10%	0.096	C	C	.	.	H	α-helix	trans	-55.7	-45.5	171	0	0	0	0	0	112.1	G471 L477 E478 M479 H745 L746	G471-A475 PolarHBondContact O-N 2.85Å; A475-L477 PolarHBondContact O-N 2.76Å; A475-E478 PolarHBondContact O-N 3.21Å; A475-M479 HydrophobicContact CB-CE 4.32Å; A475-M479 VanDerWaalsContact O-CG 3.27Å; A475-M479 WeakPolarHBondContact O-CG 3.46Å; A475-M479 PolarHBondContact O-N 3.36Å; A475-H745 HydrophobicContact CB-CB 4.32Å; A475-L746 HydrophobicContact CB-CD2 4.12Å
476	T	92.4	Very high	91.1	Very high	36 Å²	36	20.2 Å²	20.2	22%	0.221	11%	0.111	C	C	.	.	H	α-helix	trans	-63.7	-38.9	178.4	-59.5	0	0	0	0	112.5	I438 H442 S472 R473 G474 T480	I438-T476 HydrophobicContact CG2-CG2 4.09Å; H442-T476 HydrophobicContact CB-CG2 3.83Å; H442-T476 PolarHBondContact ND1-O 2.8Å; H442-T476 VanDerWaalsContact ND1-O 3.16Å; S472-T476 WeakPolarHBondContact O-CB 3.33Å; S472-T476 PolarHBondContact O-N 3.23Å; S472-T476 PolarHBondContact O-OG1 2.99Å; R473-T476 WeakPolarHBondContact O-CB 3.35Å; R473-T476 PolarHBondContact O-N 3.12Å; G474-T476 VanDerWaalsContact C-N 3.34Å; G474-T476 PolarHBondContact O-N 2.74Å; T476-T480 PolarHBondContact O-N 2.7Å; T476-T480 PolarHBondContact O-OG1 3.04Å
477	L	94.9	Very high	91.3	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-65.8	-47.1	175.2	-179.4	58.7	0	0	0	111.3	I387 I438 V462 I468 R473 G474 A475 M479 T480 L481	I387-L477 HydrophobicContact CD1-CD1 4.36Å; I387-L477 HydrophobicContact CG2-CD1 4.28Å; I438-L477 HydrophobicContact CG2-CB 3.82Å; V462-L477 HydrophobicContact CG1-CD1 4.06Å; V462-L477 HydrophobicContact CG1-CD2 4.05Å; V462-L477 HydrophobicContact CG2-CD1 4.38Å; I468-L477 HydrophobicContact CB-CD2 4.12Å; R473-L477 PolarHBondContact O-N 3.27Å; G474-L477 PolarHBondContact O-N 2.76Å; A475-L477 PolarHBondContact O-N 2.76Å; L477-M479 PolarHBondContact O-N 3.2Å; L477-T480 WeakPolarHBondContact O-CB 3.39Å; L477-T480 PolarHBondContact O-N 3.32Å; L477-T480 VanDerWaalsContact O-N 3.09Å; L477-L481 HydrophobicContact CD1-CD1 4.07Å; L477-L481 HydrophobicContact CD1-CG 4.3Å; L477-L481 HydrophobicContact CG-CD1 4.09Å; L477-L481 WeakPolarHBondContact O-CG 3.3Å; L477-L481 PolarHBondContact O-N 3.46Å
478	E	95.3	Very high	91.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.1	-49.9	176.8	-177.2	-176.7	163.8	0	0	112	I468 G474 A475 T480 L481 A482 F509 S744 L746 T780 F781 F782	I468-E478 HydrophobicContact CD1-CB 4.15Å; I468-E478 HydrophobicContact CD1-CG 4.49Å; I468-E478 HydrophobicContact CG1-CB 4.09Å; G474-E478 WeakPolarHBondContact O-CB 3.49Å; G474-E478 PolarHBondContact O-N 3.41Å; A475-E478 PolarHBondContact O-N 3.21Å; E478-T480 PolarHBondContact O-N 3.16Å; E478-L481 PolarHBondContact O-N 2.82Å; E478-A482 WeakPolarHBondContact O-CB 3.47Å; E478-A482 PolarHBondContact O-N 3.09Å; E478-F509 HydrophobicContact CG-CZ 4.1Å; E478-S744 PolarHBondContact OE1-OG 3.18Å; E478-S744 VanDerWaalsContact OE2-CB 3.22Å; E478-S744 WeakPolarHBondContact OE2-CB 3.44Å; E478-S744 PolarHBondContact OE2-OG 3.1Å; E478-L746 HydrophobicContact CG-CD1 4.42Å; E478-L746 WeakPolarHBondContact OE1-CD1 3.38Å; E478-T780 WeakPolarHBondContact OE1-CB 3.49Å; E478-F781 HydrophobicContact CG-CB 3.87Å; E478-F781 WeakPolarHBondContact OE1-CA 3.21Å; E478-F781 WeakPolarHBondContact OE1-CB 3.45Å; E478-F781 PolarHBondContact OE1-N 3.42Å; E478-F782 PolarHBondContact OE1-N 2.95Å
479	M	93.6	Very high	90.8	Very high	7 Å²	7	34.1 Å²	34.1	3%	0.034	17%	0.169	C	C	.	.	H	α-helix	trans	-55.6	-35.9	175.8	-66.9	180	-148.4	0	0	112.2	A475 L477 K483 L746 G753 L757	A475-M479 HydrophobicContact CB-CE 4.32Å; A475-M479 VanDerWaalsContact O-CG 3.27Å; A475-M479 WeakPolarHBondContact O-CG 3.46Å; A475-M479 PolarHBondContact O-N 3.36Å; L477-M479 PolarHBondContact O-N 3.2Å; M479-K483 WeakPolarHBondContact O-CB 3.25Å; M479-K483 WeakPolarHBondContact O-CE 3.46Å; M479-K483 WeakPolarHBondContact O-CG 3.21Å; M479-K483 PolarHBondContact O-N 3.06Å; M479-L746 HydrophobicContact CE-CD2 3.6Å; M479-L746 HydrophobicContact CG-CD2 3.77Å; M479-G753 WeakPolarHBondContact CE-O 3.42Å; M479-L757 HydrophobicContact CB-CD1 4.17Å; M479-L757 HydrophobicContact CE-CB 4.45Å; M479-L757 HydrophobicContact CG-CB 4.01Å; M479-L757 HydrophobicContact CG-CD1 3.98Å; M479-L757 HydrophobicContact CG-CG 4.37Å; M479-L757 HydrophobicContact SD-CB 3.94Å
480	T	95.3	Very high	90.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-49.7	-179.1	-52.8	0	0	0	0	110.5	I387 H442 V445 T476 L477 E478 K483 I484	I387-T480 HydrophobicContact CD1-CG2 4.32Å; H442-T480 WeakPolarHBondContact CA-OG1 3.22Å; H442-T480 VanDerWaalsContact CB-OG1 3.27Å; H442-T480 WeakPolarHBondContact CB-OG1 3.44Å; H442-T480 PolarHBondContact ND1-OG1 3.24Å; H442-T480 VanDerWaalsContact ND1-OG1 3.12Å; V445-T480 HydrophobicContact CB-CG2 4.15Å; V445-T480 HydrophobicContact CG1-CG2 4.47Å; V445-T480 HydrophobicContact CG2-CG2 3.81Å; T476-T480 PolarHBondContact O-N 2.7Å; T476-T480 PolarHBondContact O-OG1 3.04Å; L477-T480 WeakPolarHBondContact O-CB 3.39Å; L477-T480 PolarHBondContact O-N 3.32Å; L477-T480 VanDerWaalsContact O-N 3.09Å; E478-T480 PolarHBondContact O-N 3.16Å; T480-K483 PolarHBondContact O-N 3.46Å; T480-I484 HydrophobicContact CG2-CD1 4.16Å; T480-I484 WeakPolarHBondContact O-CD1 3.33Å; T480-I484 WeakPolarHBondContact O-CG1 3.28Å; T480-I484 PolarHBondContact O-N 2.86Å; T480-I484 VanDerWaalsContact O-N 3.09Å
481	L	96.3	Very high	91.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.6	-41.6	-178.3	-62.7	172.7	0	0	0	111.8	V460 V462 L465 L477 E478 K483 I484 L485 I493 F509 L510	V460-L481 HydrophobicContact CG1-CD2 4.41Å; V462-L481 HydrophobicContact CG2-CD1 4.35Å; V462-L481 HydrophobicContact CG2-CD2 3.9Å; L465-L481 HydrophobicContact CD1-CD1 4.31Å; L477-L481 HydrophobicContact CD1-CD1 4.07Å; L477-L481 HydrophobicContact CD1-CG 4.3Å; L477-L481 HydrophobicContact CG-CD1 4.09Å; L477-L481 WeakPolarHBondContact O-CG 3.3Å; L477-L481 PolarHBondContact O-N 3.46Å; E478-L481 PolarHBondContact O-N 2.82Å; L481-K483 VanDerWaalsContact C-N 3.34Å; L481-K483 PolarHBondContact O-N 3.34Å; L481-I484 HydrophobicContact CD2-CD1 4.33Å; L481-I484 PolarHBondContact O-N 2.99Å; L481-L485 WeakPolarHBondContact O-CG 3.49Å; L481-L485 PolarHBondContact O-N 3.42Å; L481-I493 HydrophobicContact CD2-CD1 4.23Å; L481-I493 HydrophobicContact CD2-CG2 4.12Å; L481-F509 HydrophobicContact CB-CE1 4.3Å; L481-F509 HydrophobicContact CB-CZ 4Å; L481-L510 HydrophobicContact CB-CD2 4.22Å; L481-L510 HydrophobicContact CD1-CD2 4.16Å
482	A	95.5	Very high	92	Very high	3 Å²	3	33.9 Å²	33.9	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-40.9	174.3	0	0	0	0	0	112.1	E478 L485 Y486 F509 F776 T780	E478-A482 WeakPolarHBondContact O-CB 3.47Å; E478-A482 PolarHBondContact O-N 3.09Å; A482-L485 PolarHBondContact O-N 2.9Å; A482-Y486 WeakPolarHBondContact O-CB 3.45Å; A482-Y486 PolarHBondContact O-N 3.47Å; A482-F509 HydrophobicContact CB-CE2 4.12Å; A482-F509 HydrophobicContact CB-CZ 4.38Å; A482-F776 HydrophobicContact CB-CE1 3.86Å; A482-F776 HydrophobicContact CB-CZ 3.6Å; A482-T780 HydrophobicContact CB-CG2 4.11Å
483	K	94.7	Very high	92.7	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.8	-37.5	176.1	-80.2	-178.8	-74.9	-179.3	0	112.7	H442 N446 I449 M479 T480 L481 T487 S760 L761 L764 I766 F776	H442-K483 PolarHBondContact CE1-NZ 3.04Å; H442-K483 PolarHBondContact NE2-NZ 3.43Å; N446-K483 PolarHBondContact OD1-NZ 2.83Å; I449-K483 HydrophobicContact CD1-CB 4.36Å; M479-K483 WeakPolarHBondContact O-CB 3.25Å; M479-K483 WeakPolarHBondContact O-CE 3.46Å; M479-K483 WeakPolarHBondContact O-CG 3.21Å; M479-K483 PolarHBondContact O-N 3.06Å; T480-K483 PolarHBondContact O-N 3.46Å; L481-K483 VanDerWaalsContact C-N 3.34Å; L481-K483 PolarHBondContact O-N 3.34Å; K483-T487 VanDerWaalsContact O-CB 3.24Å; K483-T487 WeakPolarHBondContact O-CB 3.42Å; K483-T487 PolarHBondContact O-N 3.48Å; K483-T487 VanDerWaalsContact O-N 3.1Å; K483-T487 PolarHBondContact O-OG1 3.2Å; K483-S760 PolarHBondContact NZ-OG 3.32Å; K483-L761 HydrophobicContact CD-CD2 4.29Å; K483-L761 HydrophobicContact CG-CD2 4Å; K483-L764 HydrophobicContact CD-CD1 4.28Å; K483-I766 HydrophobicContact CD-CD1 3.84Å; K483-I766 HydrophobicContact CG-CD1 3.92Å; K483-F776 HydrophobicContact CB-CZ 4.5Å; K483-F776 HydrophobicContact CG-CE2 4.03Å; K483-F776 HydrophobicContact CG-CZ 3.77Å
484	I	94.9	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-53.7	174	-66	154.3	0	0	0	110	V445 V460 T480 L481 Y486 T487 S488 T491 I493	V445-I484 HydrophobicContact CG1-CG1 4.08Å; V445-I484 HydrophobicContact CG2-CD1 4.09Å; V445-I484 HydrophobicContact CG2-CG1 4.2Å; V460-I484 HydrophobicContact CG1-CD1 4.24Å; V460-I484 HydrophobicContact CG2-CD1 3.94Å; T480-I484 HydrophobicContact CG2-CD1 4.16Å; T480-I484 WeakPolarHBondContact O-CD1 3.33Å; T480-I484 WeakPolarHBondContact O-CG1 3.28Å; T480-I484 PolarHBondContact O-N 2.86Å; T480-I484 VanDerWaalsContact O-N 3.09Å; L481-I484 HydrophobicContact CD2-CD1 4.33Å; L481-I484 PolarHBondContact O-N 2.99Å; I484-Y486 VanDerWaalsContact C-N 3.32Å; I484-Y486 PolarHBondContact O-N 2.82Å; I484-T487 PolarHBondContact O-N 2.99Å; I484-S488 PolarHBondContact O-N 2.94Å; I484-T491 HydrophobicContact CG2-CG2 3.86Å; I484-I493 HydrophobicContact CB-CD1 4.42Å; I484-I493 HydrophobicContact CG2-CD1 4.05Å; I484-I493 HydrophobicContact CG2-CG1 4.37Å
485	L	94.1	Very high	93.3	Very high	42 Å²	42	27.2 Å²	27.2	22%	0.22	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-39.3	-178.2	-73	166.5	0	0	0	113.4	L481 A482 I493 F509 L510	L481-L485 WeakPolarHBondContact O-CG 3.49Å; L481-L485 PolarHBondContact O-N 3.42Å; A482-L485 PolarHBondContact O-N 2.9Å; L485-I493 HydrophobicContact CD1-CD1 4.35Å; L485-I493 HydrophobicContact CD2-CD1 3.76Å; L485-I493 HydrophobicContact CG-CD1 3.72Å; L485-F509 HydrophobicContact CD1-CE2 4.21Å; L485-F509 WeakPolarHBondContact CD1-O 3.46Å; L485-L510 HydrophobicContact CD1-CD2 4.09Å
486	Y	92.8	Very high	93.3	Very high	81 Å²	81	27 Å²	27	32%	0.318	13%	0.127	S	C	.	.	H	α-helix	trans	-74.4	-37.8	177.9	-170.3	-87.3	0	0	0	112.5	A482 I484 I766 F776	A482-Y486 WeakPolarHBondContact O-CB 3.45Å; A482-Y486 PolarHBondContact O-N 3.47Å; I484-Y486 VanDerWaalsContact C-N 3.32Å; I484-Y486 PolarHBondContact O-N 2.82Å; Y486-I766 HydrophobicContact CD1-CG2 3.52Å; Y486-I766 HydrophobicContact CE1-CG2 3.68Å; Y486-F776 AromaticContact CD1-CD2 3.97Å; Y486-F776 HydrophobicContact CD1-CD2 3.97Å; Y486-F776 HydrophobicContact CD1-CE2 4.38Å; Y486-F776 HydrophobicContact CD2-CB 4.31Å; Y486-F776 AromaticContact CD2-CD2 3.62Å; Y486-F776 HydrophobicContact CD2-CD2 3.62Å; Y486-F776 HydrophobicContact CD2-CE2 4.34Å; Y486-F776 HydrophobicContact CD2-CG 4.35Å; Y486-F776 HydrophobicContact CE1-CD2 4.45Å; Y486-F776 HydrophobicContact CE2-CB 4.16Å; Y486-F776 HydrophobicContact CE2-CD2 4.14Å; Y486-F776 AromaticContact CG-CD2 3.53Å; Y486-F776 HydrophobicContact CG-CD2 3.53Å; Y486-F776 AromaticContact CG-CE2 3.89Å; Y486-F776 HydrophobicContact CG-CE2 3.89Å
487	T	91.4	Very high	93.2	Very high	49 Å²	49	25.3 Å²	25.3	30%	0.301	12%	0.116	S	C	.	.	H	α-helix	trans	-91.6	-41.9	-168.3	-42.5	0	0	0	0	113.8	I449 I454 K483 I484	I449-T487 HydrophobicContact CG1-CG2 4.49Å; I454-T487 HydrophobicContact CG2-CG2 3.94Å; K483-T487 VanDerWaalsContact O-CB 3.24Å; K483-T487 WeakPolarHBondContact O-CB 3.42Å; K483-T487 PolarHBondContact O-N 3.48Å; K483-T487 VanDerWaalsContact O-N 3.1Å; K483-T487 PolarHBondContact O-OG1 3.2Å; I484-T487 PolarHBondContact O-N 2.99Å
488	S	87.4	Confident	92.6	Very high	5 Å²	5	26 Å²	26	4%	0.035	12%	0.123	C	C	.	.			trans	-120	124.9	177.2	-168.8	0	0	0	0	112.5	D455 I484 T490	D455-S488 WeakPolarHBondContact OD1-CB 3.5Å; D455-S488 PolarHBondContact OD1-OG 3.42Å; I484-S488 PolarHBondContact O-N 2.94Å; S488-T490 PolarHBondContact O-N 2.87Å; S488-T490 PolarHBondContact OG-N 3.35Å; S488-T490 PolarHBondContact OG-OG1 3.16Å; S488-T490 VanDerWaalsContact OG-OG1 3.12Å
489	R	82.7	Confident	91.4	Very high	248 Å²	248	26.5 Å²	26.5	94%	0.936	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	5.6	174.2	-57.6	-179.7	-176	174.5	0.8	113.2
490	T	87.7	Confident	90.8	Very high	68 Å²	68	26.7 Å²	26.7	42%	0.417	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-6	-173	73.5	0	0	0	0	114.3	K382 S488	K382-T490 PolarHBondContact NZ-OG1 2.98Å; S488-T490 PolarHBondContact O-N 2.87Å; S488-T490 PolarHBondContact OG-N 3.35Å; S488-T490 PolarHBondContact OG-OG1 3.16Å; S488-T490 VanDerWaalsContact OG-OG1 3.12Å
491	T	94.3	Very high	90.2	Very high	11 Å²	11	29.1 Å²	29.1	7%	0.067	14%	0.14	C	C	.	.			trans	-90.8	118.2	178.3	-51.4	0	0	0	0	109.7	L457 G458 V460 I484	L457-T491 HydrophobicContact CD2-CG2 4.35Å; L457-T491 HydrophobicContact CG-CG2 4.03Å; L457-T491 WeakPolarHBondContact O-CB 3.15Å; L457-T491 PolarHBondContact O-OG1 3.33Å; G458-T491 WeakPolarHBondContact O-CA 3.48Å; V460-T491 HydrophobicContact CG2-CG2 3.71Å; I484-T491 HydrophobicContact CG2-CG2 3.86Å
492	Q	95.4	Very high	89.6	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.065	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	142.8	173	-170	178.5	16.5	0	0	109.9	K353 G458 L459 V460 I494	K353-Q492 PolarHBondContact O-NE2 2.71Å; G458-Q492 PolarHBondContact O-N 3.06Å; L459-Q492 CarbonylContact C-O 3.54Å; L459-Q492 WeakPolarHBondContact CA-O 3.35Å; L459-Q492 HydrophobicContact CD1-CB 4.08Å; L459-Q492 HydrophobicContact CD1-CG 4.28Å; V460-Q492 PolarHBondContact N-O 3.47Å; Q492-I494 HydrophobicContact CG-CG1 4.34Å
493	I	96.8	Very high	89.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.4	174.4	-60.1	179.6	0	0	0	109.4	N354 L355 V460 L481 I484 L485	N354-I493 VanDerWaalsContact CA-O 3.28Å; N354-I493 WeakPolarHBondContact CA-O 3.29Å; N354-I493 WeakPolarHBondContact CB-O 3.46Å; N354-I493 PolarHBondContact OD1-N 2.86Å; L355-I493 PolarHBondContact N-O 3.15Å; V460-I493 WeakPolarHBondContact O-CA 3.27Å; L481-I493 HydrophobicContact CD2-CD1 4.23Å; L481-I493 HydrophobicContact CD2-CG2 4.12Å; I484-I493 HydrophobicContact CB-CD1 4.42Å; I484-I493 HydrophobicContact CG2-CD1 4.05Å; I484-I493 HydrophobicContact CG2-CG1 4.37Å; L485-I493 HydrophobicContact CD1-CD1 4.35Å; L485-I493 HydrophobicContact CD2-CD1 3.76Å; L485-I493 HydrophobicContact CG-CD1 3.72Å
494	I	96.6	Very high	89	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116	177	-62.3	-174.8	0	0	0	109.5	L355 Y357 L372 L459 V460 V461 V462 Q492	L355-I494 HydrophobicContact CB-CG1 4.46Å; L355-I494 CarbonylContact O-C 3.51Å; L355-I494 VanDerWaalsContact O-CA 3.31Å; L355-I494 WeakPolarHBondContact O-CA 3.37Å; Y357-I494 HydrophobicContact CD1-CG2 4.22Å; Y357-I494 HydrophobicContact CE1-CG2 3.62Å; L372-I494 HydrophobicContact CB-CD1 4.29Å; L372-I494 HydrophobicContact CD1-CD1 3.51Å; L459-I494 HydrophobicContact CD1-CB 4.23Å; L459-I494 HydrophobicContact CD1-CD1 3.63Å; L459-I494 HydrophobicContact CD1-CG1 3.66Å; V460-I494 PolarHBondContact O-N 2.83Å; V461-I494 CarbonylContact C-O 3.54Å; V461-I494 WeakPolarHBondContact CA-O 3.48Å; V462-I494 PolarHBondContact N-O 3.17Å; Q492-I494 HydrophobicContact CG-CG1 4.34Å
495	G	95.6	Very high	88.9	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.6	176.3	0	0	0	0	0	112	L355 I356 Y357	L355-G495 PolarHBondContact O-N 3.3Å; I356-G495 CarbonylContact C-O 3.59Å; I356-G495 WeakPolarHBondContact CA-O 3.15Å; Y357-G495 PolarHBondContact N-O 3Å
496	M	92.6	Very high	88.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.2	174.2	62.8	-177.9	160.5	0	0	111.5	Y357 K365 T366 A369 M386 V461 V462 D463 E464 L465	Y357-M496 HydrophobicContact CD1-CB 4.47Å; Y357-M496 HydrophobicContact CD2-CB 3.94Å; Y357-M496 HydrophobicContact CE1-CB 4.11Å; Y357-M496 HydrophobicContact CE2-CB 3.53Å; Y357-M496 HydrophobicContact CE2-CG 4.49Å; Y357-M496 HydrophobicContact CE2-SD 4.22Å; Y357-M496 HydrophobicContact CG-CB 4.4Å; Y357-M496 WeakPolarHBondContact O-CA 3.29Å; Y357-M496 PolarHBondContact OH-SD 3.17Å; Y357-M496 VanDerWaalsContact OH-SD 3.38Å; K365-M496 HydrophobicContact CB-SD 4.01Å; K365-M496 HydrophobicContact CD-CB 4.27Å; T366-M496 HydrophobicContact CG2-CE 4.22Å; A369-M496 HydrophobicContact CB-CE 3.8Å; A369-M496 HydrophobicContact CB-SD 4.06Å; M386-M496 HydrophobicContact CE-CE 3.76Å; V461-M496 HydrophobicContact CG1-CE 3.75Å; V462-M496 PolarHBondContact O-N 3.2Å; D463-M496 HydrophobicContact CB-CE 3.75Å; D463-M496 HydrophobicContact CB-CG 4.41Å; E464-M496 CarbonylContact C-O 3.6Å; E464-M496 VanDerWaalsContact CA-O 3.28Å; E464-M496 WeakPolarHBondContact CA-O 3.47Å; E464-M496 PolarHBondContact N-O 3.41Å; L465-M496 PolarHBondContact N-O 3.22Å
497	S	90.2	Very high	88.9	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	158.3	-175.9	-174.3	0	0	0	0	112.8	Y357 S358 L359 K365 E464 H466 T499	Y357-S497 PolarHBondContact O-N 3.11Å; S358-S497 WeakPolarHBondContact CA-O 3.47Å; L359-S497 PolarHBondContact N-O 3.33Å; K365-S497 VanDerWaalsContact CD-O 3.25Å; K365-S497 WeakPolarHBondContact CD-O 3.34Å; K365-S497 WeakPolarHBondContact CE-O 3.28Å; K365-S497 PolarHBondContact NZ-O 3.1Å; K365-S497 VanDerWaalsContact NZ-O 3.12Å; E464-S497 WeakPolarHBondContact OE2-CA 3.27Å; H466-S497 PolarHBondContact ND1-OG 3.04Å; S497-T499 PolarHBondContact OG-N 2.73Å
498	A	80.7	Confident	89.1	Confident	17 Å²	17	37.8 Å²	37.8	14%	0.14	18%	0.179	C	C	.	.	S	Bend	trans	-89.9	-30.9	169	0	0	0	0	0	114.4	L359 K365 E464	L359-A498 WeakPolarHBondContact O-CA 3.41Å; K365-A498 VanDerWaalsContact NZ-N 3.18Å; E464-A498 PolarHBondContact OE2-N 3.09Å
499	T	71.6	Confident	89.4	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.055	18%	0.178	C	C	.	.			trans	-141.5	86.5	-167.1	44.9	0	0	0	0	110.3	H466 S497 K702 L739	H466-T499 VanDerWaalsContact CB-O 3.22Å; H466-T499 WeakPolarHBondContact CB-O 3.37Å; S497-T499 PolarHBondContact OG-N 2.73Å; T499-K702 HydrophobicContact CG2-CB 4.42Å; T499-L739 HydrophobicContact CG2-CD1 4.09Å; T499-L739 HydrophobicContact CG2-CD2 3.87Å
500	L	81.3	Confident	89.9	Confident	12 Å²	12	26.1 Å²	26.1	6%	0.063	13%	0.134	C	C	.	.			trans	-111.9	140.7	169.7	-65.3	173.1	0	0	0	110.2	I356 H466 V503 L506	I356-L500 HydrophobicContact CG2-CD1 3.69Å; H466-L500 HydrophobicContact CB-CD2 3.78Å; L500-V503 HydrophobicContact CB-CG2 3.86Å; L500-L506 HydrophobicContact CD1-CD1 4.45Å; L500-L506 HydrophobicContact CD2-CD1 3.81Å
501	N	81.4	Confident	90.2	Very high	51 Å²	51	30.3 Å²	30.3	27%	0.273	15%	0.149	S	C	.	.			trans	-132.6	163.8	162.2	-163.2	8.8	0	0	0	108.9	V503 L739 N741	N501-V503 VanDerWaalsContact C-N 3.32Å; N501-V503 PolarHBondContact O-N 3.25Å; N501-L739 HydrophobicContact CB-CB 4.02Å; N501-L739 PolarHBondContact ND2-O 3.14Å; N501-N741 PolarHBondContact ND2-OD1 3.38Å; N501-N741 VanDerWaalsContact ND2-OD1 3.13Å
502	N	84	Confident	90.2	Very high	35 Å²	35	30.2 Å²	30.2	19%	0.187	15%	0.15	C	C	.	.			trans	54.3	46.5	-171	-166.7	23.1	0	0	0	112.6	E504 D505 N741	N502-E504 PolarHBondContact O-N 2.96Å; N502-D505 PolarHBondContact ND2-OD2 3.01Å; N502-D505 PolarHBondContact O-N 3.39Å; N502-N741 HydrophobicContact CB-CB 4.22Å
503	V	87.1	Confident	90.1	Very high	18 Å²	18	33.3 Å²	33.3	11%	0.109	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-28.4	-173.8	179.5	0	0	0	0	112.3	L500 N501 D505 L506 Q507 Y514	L500-V503 HydrophobicContact CB-CG2 3.86Å; N501-V503 VanDerWaalsContact C-N 3.32Å; N501-V503 PolarHBondContact O-N 3.25Å; V503-D505 VanDerWaalsContact C-N 3.28Å; V503-D505 PolarHBondContact O-N 2.98Å; V503-L506 WeakPolarHBondContact O-CB 3.25Å; V503-L506 PolarHBondContact O-N 3.24Å; V503-L506 VanDerWaalsContact O-N 3.09Å; V503-Q507 HydrophobicContact CG1-CG 4.08Å; V503-Q507 WeakPolarHBondContact O-CG 3.3Å; V503-Q507 PolarHBondContact O-N 3.28Å; V503-Y514 HydrophobicContact CB-CE1 4.43Å; V503-Y514 HydrophobicContact CG1-CD1 3.82Å; V503-Y514 HydrophobicContact CG1-CD2 3.58Å; V503-Y514 HydrophobicContact CG1-CE1 4.04Å; V503-Y514 HydrophobicContact CG1-CE2 3.8Å; V503-Y514 HydrophobicContact CG1-CG 3.57Å; V503-Y514 HydrophobicContact CG2-CE1 4.32Å; V503-Y514 HydrophobicContact CG2-CE2 4.24Å
504	E	91.2	Very high	89.9	Confident	127 Å²	127	36.5 Å²	36.5	59%	0.593	18%	0.176	S	C	*	.	H	α-helix	trans	-55.7	-40.2	178.1	-62.1	-177.8	-162.4	0	0	113	N502 Q507 K508	N502-E504 PolarHBondContact O-N 2.96Å; E504-Q507 PolarHBondContact O-N 3.36Å; E504-K508 WeakPolarHBondContact O-CD 3.46Å; E504-K508 VanDerWaalsContact O-CE 3.3Å; E504-K508 WeakPolarHBondContact O-CE 3.25Å; E504-K508 WeakPolarHBondContact O-CG 3.24Å; E504-K508 PolarHBondContact O-N 3.31Å; E504-K508 IonicContact OE2-NZ 3.44Å
505	D	92.5	Very high	89.7	Confident	11 Å²	11	38.3 Å²	38.3	6%	0.059	18%	0.184	C	C	.	.	H	α-helix	trans	-70.8	-34.3	179.5	-70.5	-9.4	0	0	0	111.8	N502 V503 K508 F509 F781 V784 Q785	N502-D505 PolarHBondContact ND2-OD2 3.01Å; N502-D505 PolarHBondContact O-N 3.39Å; V503-D505 VanDerWaalsContact C-N 3.28Å; V503-D505 PolarHBondContact O-N 2.98Å; D505-K508 PolarHBondContact O-N 2.89Å; D505-K508 IonicContact OD1-NZ 2.74Å; D505-K508 PolarHBondContact OD1-NZ 3.45Å; D505-F509 WeakPolarHBondContact O-CB 3.47Å; D505-F509 PolarHBondContact O-N 2.93Å; D505-F781 HydrophobicContact CB-CE2 3.81Å; D505-V784 HydrophobicContact CB-CG1 4.02Å; D505-Q785 HydrophobicContact CB-CG 4.28Å; D505-Q785 PolarHBondContact OD2-NE2 3.01Å
506	L	92.8	Very high	89.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.6	-35.2	173	-68.3	168.2	0	0	0	111.7	I356 I468 L500 V503 L510 C742 F781	I356-L506 HydrophobicContact CD1-CB 3.89Å; I468-L506 HydrophobicContact CD1-CD2 4.38Å; I468-L506 HydrophobicContact CG2-CD2 3.9Å; L500-L506 HydrophobicContact CD1-CD1 4.45Å; L500-L506 HydrophobicContact CD2-CD1 3.81Å; V503-L506 WeakPolarHBondContact O-CB 3.25Å; V503-L506 PolarHBondContact O-N 3.24Å; V503-L506 VanDerWaalsContact O-N 3.09Å; L506-L510 WeakPolarHBondContact O-CB 3.23Å; L506-L510 PolarHBondContact O-N 3.11Å; L506-C742 HydrophobicContact CD1-CB 4.33Å; L506-F781 HydrophobicContact CD2-CD2 4.06Å; L506-F781 HydrophobicContact CD2-CE1 4.07Å; L506-F781 HydrophobicContact CD2-CE2 3.52Å; L506-F781 HydrophobicContact CD2-CZ 3.52Å; L506-F781 HydrophobicContact CG-CE2 3.88Å; L506-F781 HydrophobicContact CG-CZ 3.96Å
507	Q	93.9	Very high	89.2	Confident	58 Å²	58	42.7 Å²	42.7	27%	0.271	21%	0.211	S	C	.	.	H	α-helix	trans	-67.6	-40.8	172.5	-71.5	-173.6	-100.8	0	0	112.3	I356 V503 E504 Q511 A512 Y514	I356-Q507 HydrophobicContact CD1-CG 4.17Å; V503-Q507 HydrophobicContact CG1-CG 4.08Å; V503-Q507 WeakPolarHBondContact O-CG 3.3Å; V503-Q507 PolarHBondContact O-N 3.28Å; E504-Q507 PolarHBondContact O-N 3.36Å; Q507-Q511 WeakPolarHBondContact O-CA 3.29Å; Q507-Q511 PolarHBondContact O-N 3.33Å; Q507-A512 WeakPolarHBondContact CG-O 3.44Å; Q507-A512 PolarHBondContact NE2-O 2.82Å; Q507-A512 PolarHBondContact O-N 2.63Å; Q507-A512 VanDerWaalsContact O-N 3.12Å; Q507-Y514 VanDerWaalsContact CD-CB 3.42Å
508	K	94.3	Very high	89	Confident	107 Å²	107	50 Å²	50	47%	0.465	25%	0.246	S	C	.	.	H	α-helix	trans	-61.3	-46.8	173.7	-68.6	159.6	-147.2	158.9	0	110.8	E504 D505 V784	E504-K508 WeakPolarHBondContact O-CD 3.46Å; E504-K508 VanDerWaalsContact O-CE 3.3Å; E504-K508 WeakPolarHBondContact O-CE 3.25Å; E504-K508 WeakPolarHBondContact O-CG 3.24Å; E504-K508 PolarHBondContact O-N 3.31Å; E504-K508 IonicContact OE2-NZ 3.44Å; D505-K508 PolarHBondContact O-N 2.89Å; D505-K508 IonicContact OD1-NZ 2.74Å; D505-K508 PolarHBondContact OD1-NZ 3.45Å; K508-V784 HydrophobicContact CB-CG1 4.04Å; K508-V784 HydrophobicContact CB-CG2 4.34Å; K508-V784 HydrophobicContact CD-CG1 4.12Å
509	F	94.8	Very high	89.3	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-53.7	178.9	168.9	-129	0	0	0	112.9	I468 E478 L481 A482 L485 D505 Q511 G779 F781 V784	I468-F509 HydrophobicContact CD1-CD1 4.24Å; I468-F509 HydrophobicContact CD1-CE1 3.7Å; E478-F509 HydrophobicContact CG-CZ 4.1Å; L481-F509 HydrophobicContact CB-CE1 4.3Å; L481-F509 HydrophobicContact CB-CZ 4Å; A482-F509 HydrophobicContact CB-CE2 4.12Å; A482-F509 HydrophobicContact CB-CZ 4.38Å; L485-F509 HydrophobicContact CD1-CE2 4.21Å; L485-F509 WeakPolarHBondContact CD1-O 3.46Å; D505-F509 WeakPolarHBondContact O-CB 3.47Å; D505-F509 PolarHBondContact O-N 2.93Å; F509-Q511 VanDerWaalsContact C-N 3.29Å; F509-Q511 PolarHBondContact O-N 3.35Å; F509-G779 WeakPolarHBondContact CD2-O 3.49Å; F509-G779 WeakPolarHBondContact CE2-O 3.39Å; F509-F781 HydrophobicContact CB-CB 4.34Å; F509-F781 HydrophobicContact CB-CD2 3.96Å; F509-F781 HydrophobicContact CD1-CB 3.71Å; F509-F781 HydrophobicContact CD1-CD2 4.18Å; F509-F781 HydrophobicContact CD1-CG 4.17Å; F509-F781 HydrophobicContact CD2-CB 4.11Å; F509-F781 HydrophobicContact CE1-CB 3.98Å; F509-F781 HydrophobicContact CE2-CB 4.36Å; F509-F781 HydrophobicContact CG-CB 3.79Å; F509-F781 HydrophobicContact CG-CD2 4.23Å; F509-F781 HydrophobicContact CG-CG 4.41Å; F509-F781 HydrophobicContact CZ-CB 4.29Å; F509-V784 HydrophobicContact CB-CG2 4.22Å
510	L	94.1	Very high	89.9	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-83.2	-1.6	-176.8	-60.9	-176.3	0	0	0	113.9	N354 I356 L465 L481 L485 L506 A512	N354-L510 WeakPolarHBondContact CB-O 3.39Å; N354-L510 PolarHBondContact ND2-O 2.8Å; I356-L510 HydrophobicContact CD1-CD1 4.11Å; I356-L510 HydrophobicContact CG1-CD1 4.17Å; L465-L510 HydrophobicContact CD1-CD1 4.42Å; L465-L510 HydrophobicContact CD2-CD1 3.96Å; L481-L510 HydrophobicContact CB-CD2 4.22Å; L481-L510 HydrophobicContact CD1-CD2 4.16Å; L485-L510 HydrophobicContact CD1-CD2 4.09Å; L506-L510 WeakPolarHBondContact O-CB 3.23Å; L506-L510 PolarHBondContact O-N 3.11Å; L510-A512 HydrophobicContact CB-CB 3.93Å; L510-A512 PolarHBondContact O-N 2.91Å
511	Q	93.7	Very high	90	Very high	155 Å²	155	55.8 Å²	55.8	72%	0.724	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	45	-174.9	-56.4	-178.7	5.9	0	0	111.9	Q507 F509	Q507-Q511 WeakPolarHBondContact O-CA 3.29Å; Q507-Q511 PolarHBondContact O-N 3.33Å; F509-Q511 VanDerWaalsContact C-N 3.29Å; F509-Q511 PolarHBondContact O-N 3.35Å
512	A	93.7	Very high	90.2	Very high	10 Å²	10	53.7 Å²	53.7	8%	0.083	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	146.6	-161.7	0	0	0	0	0	114.2	N354 I356 Q507 L510	N354-A512 HydrophobicContact CB-CB 3.78Å; N354-A512 VanDerWaalsContact O-CA 3.27Å; N354-A512 WeakPolarHBondContact O-CA 3.23Å; I356-A512 HydrophobicContact CD1-CB 4.05Å; I356-A512 HydrophobicContact CG1-CB 3.89Å; Q507-A512 WeakPolarHBondContact CG-O 3.44Å; Q507-A512 PolarHBondContact NE2-O 2.82Å; Q507-A512 PolarHBondContact O-N 2.63Å; Q507-A512 VanDerWaalsContact O-N 3.12Å; L510-A512 HydrophobicContact CB-CB 3.93Å; L510-A512 PolarHBondContact O-N 2.91Å
513	E	93.9	Very high	90.4	Very high	78 Å²	78	57.2 Å²	57.2	36%	0.364	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	152.7	164	-165.8	174.9	132.7	0	0	110.2	S348 N354 L355 I356	S348-E513 WeakPolarHBondContact CB-OE2 3.47Å; S348-E513 PolarHBondContact OG-OE1 3.44Å; S348-E513 PolarHBondContact OG-OE2 3.02Å; N354-E513 PolarHBondContact O-N 3.06Å; L355-E513 HydrophobicContact CD1-CB 4.39Å; I356-E513 PolarHBondContact N-O 2.85Å
514	Y	92.8	Very high	90.6	Very high	68 Å²	68	58 Å²	58	27%	0.267	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.7	177.8	175.5	-125.5	0	0	0	112.1	I356 S358 V503 Q507 T516	I356-Y514 HydrophobicContact CB-CD2 4.18Å; I356-Y514 HydrophobicContact CG2-CD2 3.96Å; I356-Y514 HydrophobicContact CG2-CE2 4.33Å; I356-Y514 WeakPolarHBondContact O-CA 3.27Å; S358-Y514 WeakPolarHBondContact CB-OH 3.26Å; V503-Y514 HydrophobicContact CB-CE1 4.43Å; V503-Y514 HydrophobicContact CG1-CD1 3.82Å; V503-Y514 HydrophobicContact CG1-CD2 3.58Å; V503-Y514 HydrophobicContact CG1-CE1 4.04Å; V503-Y514 HydrophobicContact CG1-CE2 3.8Å; V503-Y514 HydrophobicContact CG1-CG 3.57Å; V503-Y514 HydrophobicContact CG2-CE1 4.32Å; V503-Y514 HydrophobicContact CG2-CE2 4.24Å; Q507-Y514 VanDerWaalsContact CD-CB 3.42Å; Y514-T516 HydrophobicContact CE1-CG2 3.92Å; Y514-T516 WeakPolarHBondContact OH-CB 3.37Å
515	Y	91.9	Very high	90.6	Very high	39 Å²	39	54.3 Å²	54.3	15%	0.153	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.5	171.3	-177.6	-92.6	0	0	0	110.9	W339 T342 C343 L346 I356 Y357 S358 L359	W339-Y515 AromaticContact CE3-CE1 3.92Å; W339-Y515 HydrophobicContact CE3-CE1 3.92Å; T342-Y515 HydrophobicContact CG2-CE2 4.1Å; C343-Y515 HydrophobicContact CB-CD1 4.33Å; C343-Y515 HydrophobicContact CB-CE1 4.26Å; L346-Y515 HydrophobicContact CD1-CD2 4.1Å; L346-Y515 HydrophobicContact CD1-CG 4.4Å; I356-Y515 PolarHBondContact O-N 3.34Å; Y357-Y515 VanDerWaalsContact CA-O 3.26Å; Y357-Y515 WeakPolarHBondContact CA-O 3.32Å; S358-Y515 PolarHBondContact N-O 2.99Å; L359-Y515 HydrophobicContact CD1-CD1 4.35Å; L359-Y515 HydrophobicContact CD1-CE1 4.42Å
516	T	90.6	Very high	90.6	Very high	62 Å²	62	55.3 Å²	55.3	38%	0.38	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	149.3	173.6	-169.9	0	0	0	0	112.7	S358 Y514	S358-T516 VanDerWaalsContact O-CA 3.32Å; S358-T516 WeakPolarHBondContact O-CA 3.45Å; S358-T516 WeakPolarHBondContact O-CB 3.28Å; S358-T516 PolarHBondContact O-OG1 2.94Å; Y514-T516 HydrophobicContact CE1-CG2 3.92Å; Y514-T516 WeakPolarHBondContact OH-CB 3.37Å
517	S	87.8	Confident	90.6	Very high	30 Å²	30	56.8 Å²	56.8	21%	0.21	27%	0.269	C	S	.	.			trans	-152.9	143.9	173.3	174.8	0	0	0	0	109.7	S358 L359 P360 F519	S358-S517 PolarHBondContact O-N 3.39Å; L359-S517 WeakPolarHBondContact CG-O 3.45Å; P360-S517 VanDerWaalsContact CD-O 3.26Å; P360-S517 WeakPolarHBondContact CD-O 3.46Å; S517-F519 PolarHBondContact O-N 3.48Å; S517-F519 WeakPolarHBondContact OG-CB 3.39Å; S517-F519 PolarHBondContact OG-N 3.3Å
518	Q	84.5	Confident	90.5	Very high	155 Å²	155	54.1 Å²	54.1	72%	0.724	26%	0.256	S	S	*	.			trans	-87.7	11.5	175.7	-58.2	-57.1	-32.8	0	0	112.7	R520	Q518-R520 PolarHBondContact O-N 3.44Å
519	F	87.3	Confident	90.4	Very high	72 Å²	72	49.2 Å²	49.2	32%	0.316	24%	0.235	S	C	.	.			trans	-59.8	133.9	179.9	177.8	-90.2	0	0	0	112.6	Y337 W339 S517 P521	Y337-F519 AromaticContact CD1-CE1 3.85Å; Y337-F519 HydrophobicContact CD1-CE1 3.85Å; Y337-F519 AromaticContact CD1-CZ 3.55Å; Y337-F519 HydrophobicContact CD1-CZ 3.55Å; Y337-F519 AromaticContact CD2-CE1 3.65Å; Y337-F519 HydrophobicContact CD2-CE1 3.65Å; Y337-F519 HydrophobicContact CD2-CZ 4.24Å; Y337-F519 HydrophobicContact CE1-CE1 4.17Å; Y337-F519 AromaticContact CE1-CZ 3.91Å; Y337-F519 HydrophobicContact CE1-CZ 3.91Å; Y337-F519 AromaticContact CE2-CE1 3.98Å; Y337-F519 HydrophobicContact CE2-CE1 3.98Å; Y337-F519 AromaticContact CG-CE1 3.59Å; Y337-F519 HydrophobicContact CG-CE1 3.59Å; Y337-F519 AromaticContact CG-CZ 3.75Å; Y337-F519 HydrophobicContact CG-CZ 3.75Å; W339-F519 AromaticContact CD1-CD1 3.27Å; W339-F519 AromaticContact CD1-CE1 3.9Å; W339-F519 AromaticContact CD1-CG 3.63Å; W339-F519 HydrophobicContact CG-CB 4.49Å; W339-F519 HydrophobicContact CG-CD1 4.48Å; W339-F519 AromaticContact NE1-CD1 3.45Å; W339-F519 AromaticContact NE1-CE1 3.95Å; S517-F519 PolarHBondContact O-N 3.48Å; S517-F519 WeakPolarHBondContact OG-CB 3.39Å; S517-F519 PolarHBondContact OG-N 3.3Å; F519-P521 HydrophobicContact CE1-CG 3.98Å
520	R	84.2	Confident	90.1	Very high	50 Å²	50	49 Å²	49	19%	0.189	23%	0.234	C	C	.	.			trans	-139.6	135.7	172.1	-165.5	177.8	176.9	151	-8.8	109.2	S362 Q518 V522 L524 I705 G706 A708	S362-R520 WeakPolarHBondContact OG-CG 3.48Å; S362-R520 PolarHBondContact OG-NE 3.07Å; Q518-R520 PolarHBondContact O-N 3.44Å; R520-V522 WeakPolarHBondContact CD-O 3.48Å; R520-V522 VanDerWaalsContact CG-O 3.27Å; R520-V522 WeakPolarHBondContact CG-O 3.24Å; R520-V522 PolarHBondContact NE-O 3.39Å; R520-V522 PolarHBondContact O-N 3.23Å; R520-L524 VanDerWaalsContact NH1-CD2 3.3Å; R520-I705 PolarHBondContact NH2-O 3.08Å; R520-G706 PolarHBondContact NH2-O 3.14Å; R520-A708 PolarHBondContact NH2-O 2.72Å
521	P	83.5	Confident	89.7	Confident	37 Å²	37	53.5 Å²	53.5	24%	0.24	26%	0.258	C	S	.	.	S	Bend	trans	-66.9	-15.6	-179.2	-23.1	33.8	0	0	0	115.5	Y337 S362 F519 A711	Y337-P521 HydrophobicContact CE2-CG 3.89Å; Y337-P521 WeakPolarHBondContact OH-CG 3.42Å; S362-P521 VanDerWaalsContact O-CD 3.29Å; S362-P521 WeakPolarHBondContact O-CD 3.33Å; S362-P521 WeakPolarHBondContact O-CG 3.39Å; F519-P521 HydrophobicContact CE1-CG 3.98Å; P521-A711 HydrophobicContact CB-CB 3.99Å; P521-A711 HydrophobicContact CG-CB 4.36Å
522	V	86.1	Confident	89.3	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.036	24%	0.241	C	C	.	.	S	Bend	trans	-139.3	131.9	-178.9	-174.6	0	0	0	0	107.8	R520 A711 D714	R520-V522 WeakPolarHBondContact CD-O 3.48Å; R520-V522 VanDerWaalsContact CG-O 3.27Å; R520-V522 WeakPolarHBondContact CG-O 3.24Å; R520-V522 PolarHBondContact NE-O 3.39Å; R520-V522 PolarHBondContact O-N 3.23Å; V522-A711 HydrophobicContact CG2-CB 4.49Å; V522-D714 WeakPolarHBondContact CG1-O 3.5Å; V522-D714 WeakPolarHBondContact CG2-O 3.14Å
523	E	88.3	Confident	89	Confident	109 Å²	109	50.4 Å²	50.4	51%	0.509	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	136.3	176.2	-171.5	-171	154.3	0	0	110.4	K525 G717	E523-K525 WeakPolarHBondContact OE1-CE 3.41Å; E523-K525 IonicContact OE1-NZ 3.27Å; E523-K525 PolarHBondContact OE1-NZ 3.29Å; E523-G717 PolarHBondContact O-N 3.26Å
524	L	90.1	Very high	88.9	Confident	35 Å²	35	46.8 Å²	46.8	18%	0.183	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.3	170.7	175.2	62	0	0	0	109.8	R520 E526 I705 A708 G717	R520-L524 VanDerWaalsContact NH1-CD2 3.3Å; L524-E526 HydrophobicContact CD2-CG 3.89Å; L524-E526 HydrophobicContact CG-CG 3.93Å; L524-I705 HydrophobicContact CD2-CB 4.34Å; L524-I705 HydrophobicContact CD2-CD1 3.99Å; L524-I705 HydrophobicContact CD2-CG1 3.85Å; L524-A708 HydrophobicContact CD1-CB 3.71Å; L524-G717 WeakPolarHBondContact CA-O 3.46Å
525	K	91.8	Very high	88.7	Confident	49 Å²	49	46.3 Å²	46.3	21%	0.213	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.2	167.4	-66.7	-171.5	166.4	-62.9	0	110	E523 Y527 E536 I716 G717 S719	E523-K525 WeakPolarHBondContact OE1-CE 3.41Å; E523-K525 IonicContact OE1-NZ 3.27Å; E523-K525 PolarHBondContact OE1-NZ 3.29Å; K525-Y527 HydrophobicContact CB-CD2 4.39Å; K525-Y527 HydrophobicContact CB-CE2 3.6Å; K525-Y527 WeakPolarHBondContact CD-OH 3.36Å; K525-E536 WeakPolarHBondContact CD-OE1 3.33Å; K525-E536 IonicContact NZ-OE1 2.7Å; K525-E536 PolarHBondContact NZ-OE1 3.5Å; K525-I716 HydrophobicContact CB-CG2 4.48Å; K525-I716 HydrophobicContact CD-CG2 4.08Å; K525-I716 HydrophobicContact CG-CG2 4.02Å; K525-G717 PolarHBondContact N-O 2.99Å; K525-S719 PolarHBondContact O-N 3.11Å
526	E	92.6	Very high	88.6	Confident	33 Å²	33	46.5 Å²	46.5	15%	0.154	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.8	179.7	-58.6	-174.7	-147.6	0	0	109.8	L524 I537 Y701 K702 I705	L524-E526 HydrophobicContact CD2-CG 3.89Å; L524-E526 HydrophobicContact CG-CG 3.93Å; E526-I537 HydrophobicContact CB-CB 4.24Å; E526-I537 HydrophobicContact CB-CD1 3.57Å; E526-I537 HydrophobicContact CB-CG1 4.44Å; E526-I537 WeakPolarHBondContact O-CB 3.14Å; E526-I537 PolarHBondContact O-N 3.32Å; E526-Y701 WeakPolarHBondContact OE2-CE1 3.26Å; E526-Y701 PolarHBondContact OE2-OH 2.92Å; E526-K702 IonicContact OE1-NZ 3.84Å; E526-K702 PolarHBondContact OE1-NZ 3.4Å; E526-K702 IonicContact OE2-NZ 2.79Å; E526-K702 PolarHBondContact OE2-NZ 2.99Å; E526-I705 HydrophobicContact CG-CD1 3.94Å; E526-I705 WeakPolarHBondContact OE1-CD1 3.35Å; E526-I705 WeakPolarHBondContact OE2-CD1 3.35Å
527	Y	93.2	Very high	88.4	Confident	31 Å²	31	45 Å²	45	12%	0.122	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.9	-177.7	-64.3	-78.7	0	0	0	112.3	K525 I534 Y535 E536 E718 S719 I720 L721	K525-Y527 HydrophobicContact CB-CD2 4.39Å; K525-Y527 HydrophobicContact CB-CE2 3.6Å; K525-Y527 WeakPolarHBondContact CD-OH 3.36Å; Y527-I534 HydrophobicContact CD1-CG2 3.82Å; Y527-I534 HydrophobicContact CG-CG2 4.14Å; Y527-Y535 CarbonylContact C-O 3.42Å; Y527-Y535 WeakPolarHBondContact CA-O 2.96Å; Y527-Y535 WeakPolarHBondContact CD1-O 3.49Å; Y527-E536 HydrophobicContact CD1-CB 3.89Å; Y527-E536 HydrophobicContact CD1-CG 4.05Å; Y527-E536 HydrophobicContact CE1-CB 3.61Å; Y527-E536 HydrophobicContact CE1-CG 3.54Å; Y527-E536 WeakPolarHBondContact CE1-OE2 3.31Å; Y527-E536 VanDerWaalsContact CZ-OE2 3.28Å; Y527-E536 PolarHBondContact OH-OE2 2.76Å; Y527-E718 HydrophobicContact CE2-CG 4.42Å; Y527-S719 WeakPolarHBondContact CA-O 3Å; Y527-S719 WeakPolarHBondContact CB-O 3.4Å; Y527-S719 PolarHBondContact N-O 2.78Å; Y527-I720 HydrophobicContact CD2-CG1 4.45Å; Y527-I720 WeakPolarHBondContact O-CA 3.35Å; Y527-L721 PolarHBondContact O-N 2.83Å
528	L	92	Very high	87.9	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.1	172.7	-58.6	177.8	0	0	0	109.7	I534 Y535 I537 M545 L721 L723 I731 I735	L528-I534 WeakPolarHBondContact O-CA 3.31Å; L528-Y535 PolarHBondContact N-O 3.48Å; L528-Y535 PolarHBondContact O-N 3.19Å; L528-I537 HydrophobicContact CD1-CD1 4.1Å; L528-I537 HydrophobicContact CD1-CG1 3.94Å; L528-I537 HydrophobicContact CD2-CD1 3.91Å; L528-I537 HydrophobicContact CG-CD1 3.72Å; L528-I537 HydrophobicContact CG-CG1 3.86Å; L528-M545 HydrophobicContact CD1-CE 3.36Å; L528-M545 HydrophobicContact CD1-CG 4.4Å; L528-M545 HydrophobicContact CD1-SD 3.93Å; L528-L721 WeakPolarHBondContact CA-O 3.39Å; L528-L721 HydrophobicContact CD2-CB 3.86Å; L528-L721 HydrophobicContact CD2-CD2 3.97Å; L528-L721 HydrophobicContact CD2-CG 4.11Å; L528-L723 HydrophobicContact CB-CD1 4.34Å; L528-L723 HydrophobicContact CD1-CD1 4.26Å; L528-L723 HydrophobicContact CD2-CD1 4.1Å; L528-L723 HydrophobicContact CG-CD1 4.46Å; L528-I731 HydrophobicContact CD1-CG2 4.29Å; L528-I731 HydrophobicContact CD2-CG2 4.09Å; L528-I735 HydrophobicContact CD1-CD1 4.27Å; L528-I735 HydrophobicContact CD2-CD1 4.34Å
529	K	91.9	Very high	87.1	Confident	5 Å²	5	44.6 Å²	44.6	2%	0.022	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.7	170.8	178.3	174.9	-175.6	-72.5	0	109.3	N531 T533 I534 D565 L570 I720 L721 I722 L723	K529-N531 WeakPolarHBondContact CE-O 3.45Å; K529-N531 WeakPolarHBondContact CG-O 3.3Å; K529-N531 PolarHBondContact NZ-O 2.87Å; K529-T533 WeakPolarHBondContact CA-O 3.47Å; K529-I534 HydrophobicContact CB-CG1 4.45Å; K529-D565 VanDerWaalsContact CE-O 3.32Å; K529-D565 WeakPolarHBondContact CE-O 3.44Å; K529-D565 PolarHBondContact NZ-O 3.28Å; K529-L570 HydrophobicContact CD-CD1 3.92Å; K529-I720 HydrophobicContact CB-CG2 4.24Å; K529-L721 PolarHBondContact N-O 2.8Å; K529-I722 HydrophobicContact CB-CG1 4.4Å; K529-I722 HydrophobicContact CD-CG1 4.43Å; K529-L723 PolarHBondContact O-N 3.44Å
530	I	88.3	Confident	86.2	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.5	171.7	-50.7	177	0	0	0	106.3	D532 T533 Y535 L723 K728	I530-D532 PolarHBondContact O-N 3.32Å; I530-D532 VanDerWaalsContact O-N 3.14Å; I530-T533 PolarHBondContact N-O 3.42Å; I530-T533 PolarHBondContact O-N 2.7Å; I530-T533 PolarHBondContact O-OG1 3.36Å; I530-T533 VanDerWaalsContact O-OG1 3.08Å; I530-Y535 HydrophobicContact CB-CE2 4.28Å; I530-Y535 HydrophobicContact CD1-CD2 4.35Å; I530-Y535 HydrophobicContact CD1-CE2 4.21Å; I530-Y535 HydrophobicContact CG1-CD2 4.42Å; I530-Y535 HydrophobicContact CG1-CE2 4.35Å; I530-L723 HydrophobicContact CG1-CB 4.33Å; I530-K728 HydrophobicContact CD1-CB 4.47Å; I530-K728 HydrophobicContact CD1-CD 3.71Å; I530-K728 HydrophobicContact CD1-CG 3.86Å
531	N	85.1	Confident	85.6	Confident	97 Å²	97	49.2 Å²	49.2	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-121.1	-170.2	-53.9	-42.2	0	0	0	110	K529 E725	K529-N531 WeakPolarHBondContact CE-O 3.45Å; K529-N531 WeakPolarHBondContact CG-O 3.3Å; K529-N531 PolarHBondContact NZ-O 2.87Å; N531-E725 PolarHBondContact ND2-OE2 2.83Å
532	D	85.2	Confident	84.6	Confident	68 Å²	68	57 Å²	57	36%	0.364	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-0.5	178.3	-73.5	-32.4	0	0	0	115.5	I530 L550 L551 H566	I530-D532 PolarHBondContact O-N 3.32Å; I530-D532 VanDerWaalsContact O-N 3.14Å; D532-L550 HydrophobicContact CB-CD1 4.09Å; D532-L551 WeakPolarHBondContact O-CB 3.42Å; D532-L551 PolarHBondContact O-N 3.17Å; D532-H566 IonicContact OD1-CE1 3.85Å; D532-H566 PolarHBondContact OD1-CE1 2.89Å; D532-H566 VanDerWaalsContact OD1-CE1 3.27Å; D532-H566 IonicContact OD1-CG 3.66Å; D532-H566 IonicContact OD1-ND1 3.07Å; D532-H566 PolarHBondContact OD1-ND1 3.43Å; D532-H566 IonicContact OD2-CE1 3.1Å
533	T	88.3	Confident	83.6	Confident	32 Å²	32	62.8 Å²	62.8	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.2	179.2	49.8	0	0	0	0	111.7	K529 I530 Y535 F547 L550	K529-T533 WeakPolarHBondContact CA-O 3.47Å; I530-T533 PolarHBondContact N-O 3.42Å; I530-T533 PolarHBondContact O-N 2.7Å; I530-T533 PolarHBondContact O-OG1 3.36Å; I530-T533 VanDerWaalsContact O-OG1 3.08Å; T533-Y535 WeakPolarHBondContact OG1-CE2 3.45Å; T533-Y535 PolarHBondContact OG1-OH 2.86Å; T533-F547 HydrophobicContact CG2-CE2 3.92Å; T533-L550 HydrophobicContact CG2-CD1 3.85Å
534	I	90.7	Very high	82.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.4	176	-59	174.7	0	0	0	108.2	Y527 L528 K529 S548 R549 L551 L570	Y527-I534 HydrophobicContact CD1-CG2 3.82Å; Y527-I534 HydrophobicContact CG-CG2 4.14Å; L528-I534 WeakPolarHBondContact O-CA 3.31Å; K529-I534 HydrophobicContact CB-CG1 4.45Å; I534-S548 WeakPolarHBondContact O-CA 3.04Å; I534-S548 WeakPolarHBondContact O-CB 3.36Å; I534-S548 PolarHBondContact O-N 3.48Å; I534-R549 HydrophobicContact CB-CG 4.11Å; I534-R549 HydrophobicContact CD1-CG 4.2Å; I534-R549 PolarHBondContact N-O 3.44Å; I534-R549 PolarHBondContact O-N 2.85Å; I534-R549 VanDerWaalsContact O-N 3.13Å; I534-L551 HydrophobicContact CD1-CD1 4.06Å; I534-L570 HydrophobicContact CD1-CD2 3.94Å
535	Y	89.6	Confident	82.4	Confident	58 Å²	58	57.6 Å²	57.6	23%	0.227	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.1	178.1	-57.7	-88.4	0	0	0	110.2	Y527 L528 I530 T533 M545 T546 F547	Y527-Y535 CarbonylContact C-O 3.42Å; Y527-Y535 WeakPolarHBondContact CA-O 2.96Å; Y527-Y535 WeakPolarHBondContact CD1-O 3.49Å; L528-Y535 PolarHBondContact N-O 3.48Å; L528-Y535 PolarHBondContact O-N 3.19Å; I530-Y535 HydrophobicContact CB-CE2 4.28Å; I530-Y535 HydrophobicContact CD1-CD2 4.35Å; I530-Y535 HydrophobicContact CD1-CE2 4.21Å; I530-Y535 HydrophobicContact CG1-CD2 4.42Å; I530-Y535 HydrophobicContact CG1-CE2 4.35Å; T533-Y535 WeakPolarHBondContact OG1-CE2 3.45Å; T533-Y535 PolarHBondContact OG1-OH 2.86Å; Y535-M545 HydrophobicContact CG-SD 4.31Å; Y535-T546 CarbonylContact C-O 3.38Å; Y535-T546 WeakPolarHBondContact CA-O 3.15Å; Y535-T546 WeakPolarHBondContact CB-O 3.42Å; Y535-F547 HydrophobicContact CD1-CB 4.29Å; Y535-F547 HydrophobicContact CE1-CB 4.29Å; Y535-F547 HydrophobicContact CE1-CD2 4.18Å
536	E	89.9	Confident	82	Confident	44 Å²	44	58 Å²	58	21%	0.206	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.4	169.3	-160.4	157	155.1	0	0	108.3	K525 Y527 D538 M545 T546	K525-E536 WeakPolarHBondContact CD-OE1 3.33Å; K525-E536 IonicContact NZ-OE1 2.7Å; K525-E536 PolarHBondContact NZ-OE1 3.5Å; Y527-E536 HydrophobicContact CD1-CB 3.89Å; Y527-E536 HydrophobicContact CD1-CG 4.05Å; Y527-E536 HydrophobicContact CE1-CB 3.61Å; Y527-E536 HydrophobicContact CE1-CG 3.54Å; Y527-E536 WeakPolarHBondContact CE1-OE2 3.31Å; Y527-E536 VanDerWaalsContact CZ-OE2 3.28Å; Y527-E536 PolarHBondContact OH-OE2 2.76Å; E536-D538 PolarHBondContact O-N 3.49Å; E536-M545 WeakPolarHBondContact O-CA 3.39Å; E536-T546 PolarHBondContact N-O 3.4Å; E536-T546 PolarHBondContact O-N 2.78Å; E536-T546 PolarHBondContact O-OG1 2.66Å
537	I	85.1	Confident	81.7	Confident	31 Å²	31	62.3 Å²	62.3	16%	0.159	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	115.7	177.7	-69.4	155.5	0	0	0	108.2	E526 L528 I735	E526-I537 HydrophobicContact CB-CB 4.24Å; E526-I537 HydrophobicContact CB-CD1 3.57Å; E526-I537 HydrophobicContact CB-CG1 4.44Å; E526-I537 WeakPolarHBondContact O-CB 3.14Å; E526-I537 PolarHBondContact O-N 3.32Å; L528-I537 HydrophobicContact CD1-CD1 4.1Å; L528-I537 HydrophobicContact CD1-CG1 3.94Å; L528-I537 HydrophobicContact CD2-CD1 3.91Å; L528-I537 HydrophobicContact CG-CD1 3.72Å; L528-I537 HydrophobicContact CG-CG1 3.86Å; I537-I735 HydrophobicContact CD1-CD1 3.66Å; I537-I735 HydrophobicContact CG1-CD1 4.34Å; I537-I735 HydrophobicContact CG2-CG2 3.91Å
538	D	78.4	Confident	81.3	Confident	60 Å²	60	63 Å²	63	32%	0.321	33%	0.334	S	S	.	.			trans	-129.7	113.5	173.8	-176.5	3	0	0	0	109.7	E536 K540 A541 G544 T546	E536-D538 PolarHBondContact O-N 3.49Å; D538-K540 PolarHBondContact O-N 3.39Å; D538-K540 VanDerWaalsContact O-N 3.08Å; D538-K540 WeakPolarHBondContact OD1-CB 3.38Å; D538-K540 WeakPolarHBondContact OD1-CG 3.48Å; D538-K540 PolarHBondContact OD1-N 2.86Å; D538-A541 HydrophobicContact CB-CB 4.47Å; D538-A541 PolarHBondContact O-N 3.23Å; D538-A541 VanDerWaalsContact O-N 3.15Å; D538-G544 PolarHBondContact N-O 3.06Å; D538-G544 CarbonylContact O-C 3.59Å; D538-T546 HydrophobicContact CB-CG2 4.15Å
539	S	67.4	Low	81.1	Confident	116 Å²	116	66.8 Å²	66.8	81%	0.811	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-6.1	177.2	-48.4	0	0	0	0	114.1
540	K	68.5	Low	80.7	Confident	192 Å²	192	71.3 Å²	71.3	84%	0.835	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-12.8	176.1	-58.6	173	-176.2	172.2	0	113.7	D538	D538-K540 PolarHBondContact O-N 3.39Å; D538-K540 VanDerWaalsContact O-N 3.08Å; D538-K540 WeakPolarHBondContact OD1-CB 3.38Å; D538-K540 WeakPolarHBondContact OD1-CG 3.48Å; D538-K540 PolarHBondContact OD1-N 2.86Å
541	A	72.3	Confident	80.3	Confident	27 Å²	27	71.6 Å²	71.6	22%	0.223	37%	0.373	C	S	.	.	S	Bend	trans	-84.2	143.1	178.9	0	0	0	0	0	111.1	D538 N543 G544 T546	D538-A541 HydrophobicContact CB-CB 4.47Å; D538-A541 PolarHBondContact O-N 3.23Å; D538-A541 VanDerWaalsContact O-N 3.15Å; A541-N543 PolarHBondContact O-N 3.13Å; A541-G544 PolarHBondContact O-N 3.17Å; A541-T546 HydrophobicContact CB-CG2 3.87Å
542	E	61.9	Low	79.4	Confident	199 Å²	199	73.9 Å²	73.9	93%	0.93	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.2	-178.3	-61.8	-179.9	147.2	0	0	113.6
543	N	65	Low	78.5	Confident	128 Å²	128	75.7 Å²	75.7	68%	0.684	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	7.8	179	-67.8	-62.4	0	0	0	113.9	A541 M545	A541-N543 PolarHBondContact O-N 3.13Å; N543-M545 PolarHBondContact O-N 3.45Å; N543-M545 VanDerWaalsContact O-N 3.08Å
544	G	72.1	Confident	77.4	Confident	18 Å²	18	83.3 Å²	83.3	19%	0.186	42%	0.418	C	S	.	.	S	Bend	trans	64.5	6.1	-173.9	0	0	0	0	0	115.4	D538 A541	D538-G544 PolarHBondContact N-O 3.06Å; D538-G544 CarbonylContact O-C 3.59Å; A541-G544 PolarHBondContact O-N 3.17Å
545	M	80.5	Confident	76.3	Confident	18 Å²	18	84.2 Å²	84.2	9%	0.089	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.6	-175	-58.9	-171.4	-165.1	0	0	110.2	L528 Y535 E536 N543 K728 L732	L528-M545 HydrophobicContact CD1-CE 3.36Å; L528-M545 HydrophobicContact CD1-CG 4.4Å; L528-M545 HydrophobicContact CD1-SD 3.93Å; Y535-M545 HydrophobicContact CG-SD 4.31Å; E536-M545 WeakPolarHBondContact O-CA 3.39Å; N543-M545 PolarHBondContact O-N 3.45Å; N543-M545 VanDerWaalsContact O-N 3.08Å; M545-K728 HydrophobicContact CE-CG 3.89Å; M545-L732 HydrophobicContact CE-CD1 3.87Å; M545-L732 HydrophobicContact CE-CD2 3.57Å; M545-L732 HydrophobicContact CE-CG 3.56Å; M545-L732 HydrophobicContact CG-CD2 4.15Å
546	T	84.1	Confident	75.2	Confident	57 Å²	57	84.2 Å²	84.2	35%	0.35	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.1	166.6	58.3	0	0	0	0	110.1	Y535 E536 D538 A541 S548	Y535-T546 CarbonylContact C-O 3.38Å; Y535-T546 WeakPolarHBondContact CA-O 3.15Å; Y535-T546 WeakPolarHBondContact CB-O 3.42Å; E536-T546 PolarHBondContact N-O 3.4Å; E536-T546 PolarHBondContact O-N 2.78Å; E536-T546 PolarHBondContact O-OG1 2.66Å; D538-T546 HydrophobicContact CB-CG2 4.15Å; A541-T546 HydrophobicContact CB-CG2 3.87Å; T546-S548 PolarHBondContact O-N 2.87Å
547	F	85.1	Confident	74	Confident	124 Å²	124	87.3 Å²	87.3	54%	0.544	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	123.6	175	173.3	-98.1	0	0	0	110	T533 Y535 R549	T533-F547 HydrophobicContact CG2-CE2 3.92Å; Y535-F547 HydrophobicContact CD1-CB 4.29Å; Y535-F547 HydrophobicContact CE1-CB 4.29Å; Y535-F547 HydrophobicContact CE1-CD2 4.18Å; F547-R549 VanDerWaalsContact CZ-C 3.46Å
548	S	86.1	Confident	73	Confident	46 Å²	46	90.8 Å²	90.8	32%	0.322	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-57.2	180	-174.5	0	0	0	0	111.4	I534 T546	I534-S548 WeakPolarHBondContact O-CA 3.04Å; I534-S548 WeakPolarHBondContact O-CB 3.36Å; I534-S548 PolarHBondContact O-N 3.48Å; T546-S548 PolarHBondContact O-N 2.87Å
549	R	87.9	Confident	72.4	Confident	79 Å²	79	90.2 Å²	90.2	30%	0.298	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	162.5	-179.7	62.2	-174.6	-179.3	112.4	-6.1	113.9	I534 F547 E573	I534-R549 HydrophobicContact CB-CG 4.11Å; I534-R549 HydrophobicContact CD1-CG 4.2Å; I534-R549 PolarHBondContact N-O 3.44Å; I534-R549 PolarHBondContact O-N 2.85Å; I534-R549 VanDerWaalsContact O-N 3.13Å; F547-R549 VanDerWaalsContact CZ-C 3.46Å; R549-E573 IonicContact CZ-OE1 2.85Å; R549-E573 IonicContact CZ-OE2 2.68Å; R549-E573 IonicContact NH1-OE1 2.96Å; R549-E573 PolarHBondContact NH1-OE1 2.97Å; R549-E573 IonicContact NH1-OE2 3.89Å; R549-E573 IonicContact NH2-OE1 3.13Å; R549-E573 PolarHBondContact NH2-OE1 3.35Å; R549-E573 IonicContact NH2-OE2 3.27Å; R549-E573 PolarHBondContact NH2-OE2 2.8Å
550	L	83.6	Confident	72.6	Confident	100 Å²	100	89.1 Å²	89.1	52%	0.524	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	139.5	165.8	-171.2	74.8	0	0	0	110.1	D532 T533 N552	D532-L550 HydrophobicContact CB-CD1 4.09Å; T533-L550 HydrophobicContact CG2-CD1 3.85Å; L550-N552 VanDerWaalsContact C-N 3.33Å; L550-N552 PolarHBondContact O-N 2.74Å
551	L	79.1	Confident	72.8	Confident	9 Å²	9	88.8 Å²	88.8	5%	0.047	45%	0.447	C	S	.	.			trans	-80.4	73.5	175.5	-172.2	108.3	0	0	0	111.7	D532 I534 Y553 Y555 H566 A569 L570	D532-L551 WeakPolarHBondContact O-CB 3.42Å; D532-L551 PolarHBondContact O-N 3.17Å; I534-L551 HydrophobicContact CD1-CD1 4.06Å; L551-Y553 PolarHBondContact O-N 3.15Å; L551-Y555 HydrophobicContact CD2-CE2 4.45Å; L551-H566 HydrophobicContact CD2-CB 3.43Å; L551-H566 VanDerWaalsContact CD2-CB 3.43Å; L551-A569 HydrophobicContact CD1-CB 4.13Å; L551-A569 HydrophobicContact CD2-CB 3.98Å; L551-A569 HydrophobicContact CG-CB 4.28Å; L551-L570 HydrophobicContact CD1-CD2 3.43Å; L551-L570 VanDerWaalsContact CD1-CD2 3.43Å; L551-L570 HydrophobicContact CD1-CG 3.95Å
552	N	66	Low	72.9	Confident	145 Å²	145	93.3 Å²	93.3	78%	0.775	47%	0.465	S	S	*	.			trans	-77.9	80.7	-179.9	-171.3	2.2	0	0	0	112.5	L550	L550-N552 VanDerWaalsContact C-N 3.33Å; L550-N552 PolarHBondContact O-N 2.74Å
553	Y	67.5	Low	73.9	Confident	105 Å²	105	83.8 Å²	83.8	41%	0.412	42%	0.42	S	S	.	.			trans	-116.3	136.5	174.6	-164.6	-86.9	0	0	0	111.6	L551 Y555 A569	L551-Y553 PolarHBondContact O-N 3.15Å; Y553-Y555 VanDerWaalsContact C-N 3.33Å; Y553-Y555 HydrophobicContact CD1-CD1 4.37Å; Y553-Y555 AromaticContact CD1-CD2 3.77Å; Y553-Y555 HydrophobicContact CD1-CD2 3.77Å; Y553-Y555 HydrophobicContact CD1-CE1 4.23Å; Y553-Y555 AromaticContact CD1-CE2 3.59Å; Y553-Y555 HydrophobicContact CD1-CE2 3.59Å; Y553-Y555 HydrophobicContact CD1-CG 4.16Å; Y553-Y555 AromaticContact CD1-CZ 3.83Å; Y553-Y555 HydrophobicContact CE1-CE1 4.49Å; Y553-Y555 HydrophobicContact CG-CD2 4.41Å; Y553-Y555 HydrophobicContact CG-CE2 4.02Å; Y553-Y555 PolarHBondContact O-N 3.26Å; Y553-A569 HydrophobicContact CD1-CB 4.19Å; Y553-A569 HydrophobicContact CD2-CB 3.64Å; Y553-A569 HydrophobicContact CE2-CB 4.28Å; Y553-A569 HydrophobicContact CG-CB 3.57Å
554	K	63.6	Low	74.5	Confident	193 Å²	193	81.8 Å²	81.8	84%	0.839	41%	0.414	S	S	*	.			trans	-81.5	70.5	-173.8	-66.5	-173	179.7	-178.7	0	112.8
555	Y	67.7	Low	75	Confident	20 Å²	20	82.7 Å²	82.7	8%	0.078	42%	0.415	C	S	.	.			trans	-70.5	126.1	168.3	-67.3	-85.6	0	0	0	111.2	L551 Y553 L559 K560 D563 H566 A569	L551-Y555 HydrophobicContact CD2-CE2 4.45Å; Y553-Y555 VanDerWaalsContact C-N 3.33Å; Y553-Y555 HydrophobicContact CD1-CD1 4.37Å; Y553-Y555 AromaticContact CD1-CD2 3.77Å; Y553-Y555 HydrophobicContact CD1-CD2 3.77Å; Y553-Y555 HydrophobicContact CD1-CE1 4.23Å; Y553-Y555 AromaticContact CD1-CE2 3.59Å; Y553-Y555 HydrophobicContact CD1-CE2 3.59Å; Y553-Y555 HydrophobicContact CD1-CG 4.16Å; Y553-Y555 AromaticContact CD1-CZ 3.83Å; Y553-Y555 HydrophobicContact CE1-CE1 4.49Å; Y553-Y555 HydrophobicContact CG-CD2 4.41Å; Y553-Y555 HydrophobicContact CG-CE2 4.02Å; Y553-Y555 PolarHBondContact O-N 3.26Å; Y555-L559 HydrophobicContact CD1-CB 3.82Å; Y555-L559 HydrophobicContact CD1-CD1 4.48Å; Y555-K560 HydrophobicContact CG-CG 4.48Å; Y555-K560 WeakPolarHBondContact O-CE 3.41Å; Y555-D563 PolarHBondContact OH-OD2 2.96Å; Y555-H566 AromaticContact CD2-CD2 3.39Å; Y555-H566 WeakPolarHBondContact CD2-CD2 3.46Å; Y555-H566 AromaticContact CD2-CG 3.9Å; Y555-H566 AromaticContact CD2-NE2 3.53Å; Y555-H566 AromaticContact CE1-CD2 3.97Å; Y555-H566 HydrophobicContact CE2-CB 3.6Å; Y555-H566 AromaticContact CE2-CD2 3.22Å; Y555-H566 WeakPolarHBondContact CE2-CD2 3.16Å; Y555-H566 AromaticContact CE2-CG 3.39Å; Y555-H566 AromaticContact CE2-NE2 3.86Å; Y555-H566 AromaticContact CG-CD2 3.85Å; Y555-H566 AromaticContact CG-NE2 3.92Å; Y555-H566 AromaticContact CZ-CD2 3.54Å; Y555-H566 AromaticContact CZ-CG 3.84Å; Y555-H566 WeakPolarHBondContact OH-CA 3.44Å; Y555-H566 WeakPolarHBondContact OH-CB 3.46Å; Y555-H566 PolarHBondContact OH-O 3.07Å; Y555-H566 VanDerWaalsContact OH-O 3.07Å; Y555-A569 HydrophobicContact CE2-CB 4.11Å; Y555-A569 WeakPolarHBondContact OH-CB 3.26Å; Y555-A569 PolarHBondContact OH-N 3.47Å
556	S	67.7	Low	75.3	Confident	58 Å²	58	82.8 Å²	82.8	41%	0.406	42%	0.415	S	S	.	.			trans	-74.4	160.3	161.4	60.6	0	0	0	0	110.6	T558 L559 K560	S556-T558 PolarHBondContact O-N 3.48Å; S556-T558 VanDerWaalsContact O-N 3.15Å; S556-T558 PolarHBondContact OG-OG1 2.9Å; S556-L559 WeakPolarHBondContact O-CA 3.4Å; S556-L559 WeakPolarHBondContact O-CB 2.82Å; S556-L559 PolarHBondContact O-N 3.25Å; S556-L559 WeakPolarHBondContact OG-CG 3.41Å; S556-K560 PolarHBondContact O-N 2.68Å; S556-K560 VanDerWaalsContact O-N 3.13Å
557	D	64.8	Low	75.6	Confident	109 Å²	109	80.1 Å²	80.1	58%	0.583	40%	0.399	S	S	*	.	H	α-helix	trans	-71	-15.7	-168.4	-49.2	-63.3	0	0	0	114	K560 K561	D557-K560 IonicContact OD1-NZ 2.82Å; D557-K560 PolarHBondContact OD1-NZ 3.05Å; D557-K561 WeakPolarHBondContact O-CG 3.41Å
558	T	63.1	Low	75.7	Confident	104 Å²	104	74.4 Å²	74.4	64%	0.638	37%	0.374	S	S	*	.	H	α-helix	trans	-72.6	-34.7	166.5	46	0	0	0	0	112.6	S556	S556-T558 PolarHBondContact O-N 3.48Å; S556-T558 VanDerWaalsContact O-N 3.15Å; S556-T558 PolarHBondContact OG-OG1 2.9Å
559	L	67.1	Low	75.8	Confident	47 Å²	47	72.2 Å²	72.2	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-74.8	-42.3	178.4	-58.2	175.3	0	0	0	111.3	Y555 S556 K561 M562 D563 F600	Y555-L559 HydrophobicContact CD1-CB 3.82Å; Y555-L559 HydrophobicContact CD1-CD1 4.48Å; S556-L559 WeakPolarHBondContact O-CA 3.4Å; S556-L559 WeakPolarHBondContact O-CB 2.82Å; S556-L559 PolarHBondContact O-N 3.25Å; S556-L559 WeakPolarHBondContact OG-CG 3.41Å; L559-K561 PolarHBondContact O-N 2.95Å; L559-M562 PolarHBondContact O-N 3.06Å; L559-D563 PolarHBondContact O-N 3.4Å; L559-F600 HydrophobicContact CD2-CD1 3.35Å; L559-F600 HydrophobicContact CD2-CE1 3.26Å; L559-F600 HydrophobicContact CD2-CG 4.23Å; L559-F600 HydrophobicContact CD2-CZ 4.04Å
560	K	70.8	Confident	75.9	Confident	93 Å²	93	68.5 Å²	68.5	40%	0.404	35%	0.345	S	S	.	.	H	α-helix	trans	-56.1	-32.5	176.5	-63.5	179.8	-171.9	154.5	0	113.2	Y555 S556 D557 M562	Y555-K560 HydrophobicContact CG-CG 4.48Å; Y555-K560 WeakPolarHBondContact O-CE 3.41Å; S556-K560 PolarHBondContact O-N 2.68Å; S556-K560 VanDerWaalsContact O-N 3.13Å; D557-K560 IonicContact OD1-NZ 2.82Å; D557-K560 PolarHBondContact OD1-NZ 3.05Å; K560-M562 VanDerWaalsContact C-N 3.31Å
561	K	73.3	Confident	76.4	Confident	185 Å²	185	63.7 Å²	63.7	80%	0.804	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.5	176.5	-73.1	-177.6	178.3	-174.9	0	114.2	D557 L559	D557-K561 WeakPolarHBondContact O-CG 3.41Å; L559-K561 PolarHBondContact O-N 2.95Å
562	M	74.1	Confident	76.9	Confident	122 Å²	122	64.9 Å²	64.9	60%	0.601	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-33.6	179.8	-74.1	-169.4	161.9	0	0	113.1	L559 K560 P564 M596 F600	L559-M562 PolarHBondContact O-N 3.06Å; K560-M562 VanDerWaalsContact C-N 3.31Å; M562-P564 VanDerWaalsContact C-CD 3.46Å; M562-P564 WeakPolarHBondContact O-CD 3.36Å; M562-M596 VanDerWaalsContact O-SD 3.35Å; M562-F600 HydrophobicContact CB-CE2 4.14Å; M562-F600 HydrophobicContact CB-CZ 3.66Å; M562-F600 HydrophobicContact CG-CZ 4.31Å; M562-F600 HydrophobicContact SD-CE1 4.32Å; M562-F600 HydrophobicContact SD-CZ 3.76Å
563	D	81.8	Confident	78	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.31	C	S	.	.			trans	-121.3	71.8	175	-177	21.9	0	0	0	110.8	Y555 L559 D565 H566 L567 V568 M596	Y555-D563 PolarHBondContact OH-OD2 2.96Å; L559-D563 PolarHBondContact O-N 3.4Å; D563-D565 PolarHBondContact O-N 3.02Å; D563-H566 PolarHBondContact O-CD2 3.03Å; D563-H566 VanDerWaalsContact O-CD2 3.29Å; D563-H566 PolarHBondContact O-N 3.47Å; D563-H566 VanDerWaalsContact O-N 3.13Å; D563-H566 PolarHBondContact OD1-N 3.14Å; D563-H566 VanDerWaalsContact OD2-C 3.28Å; D563-H566 WeakPolarHBondContact OD2-CA 3.34Å; D563-L567 VanDerWaalsContact CG-N 3.3Å; D563-L567 WeakPolarHBondContact OD1-CB 3.43Å; D563-L567 PolarHBondContact OD1-N 3.45Å; D563-L567 PolarHBondContact OD2-N 3.41Å; D563-V568 HydrophobicContact CB-CG2 4.41Å; D563-V568 WeakPolarHBondContact OD2-CB 3.41Å; D563-V568 VanDerWaalsContact OD2-CG2 3.22Å; D563-V568 WeakPolarHBondContact OD2-CG2 3.36Å; D563-V568 PolarHBondContact OD2-N 3.46Å; D563-M596 HydrophobicContact CB-CE 4.05Å; D563-M596 HydrophobicContact CB-SD 4.38Å
564	P	78.8	Confident	79.1	Confident	86 Å²	86	57.4 Å²	57.4	56%	0.558	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.4	178.9	30	-36.9	0	0	0	112.7	M562 H566	M562-P564 VanDerWaalsContact C-CD 3.46Å; M562-P564 WeakPolarHBondContact O-CD 3.36Å; P564-H566 PolarHBondContact O-N 2.94Å
565	D	82.2	Confident	80.3	Confident	36 Å²	36	48.5 Å²	48.5	19%	0.193	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.4	176.9	-55.8	-36.4	0	0	0	112	K529 D563 L567 R687 I722	K529-D565 VanDerWaalsContact CE-O 3.32Å; K529-D565 WeakPolarHBondContact CE-O 3.44Å; K529-D565 PolarHBondContact NZ-O 3.28Å; D563-D565 PolarHBondContact O-N 3.02Å; D565-L567 HydrophobicContact CB-CB 4.48Å; D565-L567 PolarHBondContact O-N 2.87Å; D565-R687 IonicContact OD2-CZ 2.94Å; D565-R687 IonicContact OD2-NE 3.19Å; D565-R687 PolarHBondContact OD2-NE 3.01Å; D565-R687 IonicContact OD2-NH2 3.44Å; D565-R687 PolarHBondContact OD2-NH2 3.47Å; D565-I722 HydrophobicContact CB-CD1 4.34Å; D565-I722 HydrophobicContact CB-CG2 4.49Å
566	H	86.9	Confident	81.2	Confident	21 Å²	21	49.3 Å²	49.3	10%	0.097	26%	0.261	C	S	.	.			trans	50	35.7	-171.3	-64.3	157	0	0	0	113.7	D532 L551 Y555 D563 P564 V568 A569	D532-H566 IonicContact OD1-CE1 3.85Å; D532-H566 PolarHBondContact OD1-CE1 2.89Å; D532-H566 VanDerWaalsContact OD1-CE1 3.27Å; D532-H566 IonicContact OD1-CG 3.66Å; D532-H566 IonicContact OD1-ND1 3.07Å; D532-H566 PolarHBondContact OD1-ND1 3.43Å; D532-H566 IonicContact OD2-CE1 3.1Å; L551-H566 HydrophobicContact CD2-CB 3.43Å; L551-H566 VanDerWaalsContact CD2-CB 3.43Å; Y555-H566 AromaticContact CD2-CD2 3.39Å; Y555-H566 WeakPolarHBondContact CD2-CD2 3.46Å; Y555-H566 AromaticContact CD2-CG 3.9Å; Y555-H566 AromaticContact CD2-NE2 3.53Å; Y555-H566 AromaticContact CE1-CD2 3.97Å; Y555-H566 HydrophobicContact CE2-CB 3.6Å; Y555-H566 AromaticContact CE2-CD2 3.22Å; Y555-H566 WeakPolarHBondContact CE2-CD2 3.16Å; Y555-H566 AromaticContact CE2-CG 3.39Å; Y555-H566 AromaticContact CE2-NE2 3.86Å; Y555-H566 AromaticContact CG-CD2 3.85Å; Y555-H566 AromaticContact CG-NE2 3.92Å; Y555-H566 AromaticContact CZ-CD2 3.54Å; Y555-H566 AromaticContact CZ-CG 3.84Å; Y555-H566 WeakPolarHBondContact OH-CA 3.44Å; Y555-H566 WeakPolarHBondContact OH-CB 3.46Å; Y555-H566 PolarHBondContact OH-O 3.07Å; Y555-H566 VanDerWaalsContact OH-O 3.07Å; D563-H566 PolarHBondContact O-CD2 3.03Å; D563-H566 VanDerWaalsContact O-CD2 3.29Å; D563-H566 PolarHBondContact O-N 3.47Å; D563-H566 VanDerWaalsContact O-N 3.13Å; D563-H566 PolarHBondContact OD1-N 3.14Å; D563-H566 VanDerWaalsContact OD2-C 3.28Å; D563-H566 WeakPolarHBondContact OD2-CA 3.34Å; P564-H566 PolarHBondContact O-N 2.94Å; H566-V568 VanDerWaalsContact C-N 3.34Å; H566-V568 PolarHBondContact O-N 2.88Å; H566-A569 PolarHBondContact O-N 2.94Å
567	L	89.6	Confident	82.2	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-33.5	-177.8	176.7	62	0	0	0	113	D563 D565 A569 L570 V571 V582 V593 M596 I597 I685 I722	D563-L567 VanDerWaalsContact CG-N 3.3Å; D563-L567 WeakPolarHBondContact OD1-CB 3.43Å; D563-L567 PolarHBondContact OD1-N 3.45Å; D563-L567 PolarHBondContact OD2-N 3.41Å; D565-L567 HydrophobicContact CB-CB 4.48Å; D565-L567 PolarHBondContact O-N 2.87Å; L567-A569 VanDerWaalsContact C-N 3.35Å; L567-A569 PolarHBondContact O-N 3.09Å; L567-L570 PolarHBondContact O-N 3.19Å; L567-V571 HydrophobicContact CD1-CG2 4.26Å; L567-V571 HydrophobicContact CG-CG2 4.49Å; L567-V571 WeakPolarHBondContact O-CG2 3.3Å; L567-V571 PolarHBondContact O-N 3.31Å; L567-V571 VanDerWaalsContact O-N 3.1Å; L567-V582 HydrophobicContact CD1-CG1 4.11Å; L567-V582 HydrophobicContact CD1-CG2 4.39Å; L567-V582 HydrophobicContact CD2-CG1 4.12Å; L567-V593 HydrophobicContact CD2-CG1 3.56Å; L567-M596 HydrophobicContact CD2-CE 4.34Å; L567-I597 HydrophobicContact CD2-CD1 4.37Å; L567-I685 HydrophobicContact CD1-CD1 4.12Å; L567-I685 HydrophobicContact CD1-CG2 3.89Å; L567-I722 HydrophobicContact CD1-CD1 4.24Å
568	V	88.7	Confident	83.4	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.024	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-45.1	-179.6	174.6	0	0	0	0	110.6	D563 H566 L570 V571 T572 I597 F600	D563-V568 HydrophobicContact CB-CG2 4.41Å; D563-V568 WeakPolarHBondContact OD2-CB 3.41Å; D563-V568 VanDerWaalsContact OD2-CG2 3.22Å; D563-V568 WeakPolarHBondContact OD2-CG2 3.36Å; D563-V568 PolarHBondContact OD2-N 3.46Å; H566-V568 VanDerWaalsContact C-N 3.34Å; H566-V568 PolarHBondContact O-N 2.88Å; V568-L570 PolarHBondContact O-N 3.28Å; V568-V571 PolarHBondContact O-N 3.27Å; V568-V571 VanDerWaalsContact O-N 3.16Å; V568-T572 HydrophobicContact CG1-CG2 4.06Å; V568-T572 WeakPolarHBondContact O-CG2 3.49Å; V568-T572 PolarHBondContact O-N 3.43Å; V568-T572 PolarHBondContact O-OG1 2.64Å; V568-T572 VanDerWaalsContact O-OG1 3.07Å; V568-I597 HydrophobicContact CG2-CG1 4.31Å; V568-F600 HydrophobicContact CG1-CB 4.1Å; V568-F600 HydrophobicContact CG2-CB 4.25Å; V568-F600 HydrophobicContact CG2-CD2 3.69Å; V568-F600 HydrophobicContact CG2-CG 4.41Å
569	A	87.5	Confident	84.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-55.8	-52.6	176	0	0	0	0	0	111.5	L551 Y553 Y555 H566 L567 V571 T572 E573	L551-A569 HydrophobicContact CD1-CB 4.13Å; L551-A569 HydrophobicContact CD2-CB 3.98Å; L551-A569 HydrophobicContact CG-CB 4.28Å; Y553-A569 HydrophobicContact CD1-CB 4.19Å; Y553-A569 HydrophobicContact CD2-CB 3.64Å; Y553-A569 HydrophobicContact CE2-CB 4.28Å; Y553-A569 HydrophobicContact CG-CB 3.57Å; Y555-A569 HydrophobicContact CE2-CB 4.11Å; Y555-A569 WeakPolarHBondContact OH-CB 3.26Å; Y555-A569 PolarHBondContact OH-N 3.47Å; H566-A569 PolarHBondContact O-N 2.94Å; L567-A569 VanDerWaalsContact C-N 3.35Å; L567-A569 PolarHBondContact O-N 3.09Å; A569-V571 PolarHBondContact O-N 3.12Å; A569-V571 VanDerWaalsContact O-N 3.16Å; A569-T572 WeakPolarHBondContact CA-OG1 3.45Å; A569-T572 PolarHBondContact O-N 2.87Å; A569-T572 PolarHBondContact O-OG1 2.77Å; A569-T572 VanDerWaalsContact O-OG1 3.08Å; A569-E573 PolarHBondContact O-N 3.39Å
570	L	90.9	Very high	86.1	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-29.6	178.6	-66	178.9	0	0	0	113.5	K529 I534 L551 L567 V568 R683 I685 I720 I722	K529-L570 HydrophobicContact CD-CD1 3.92Å; I534-L570 HydrophobicContact CD1-CD2 3.94Å; L551-L570 HydrophobicContact CD1-CD2 3.43Å; L551-L570 VanDerWaalsContact CD1-CD2 3.43Å; L551-L570 HydrophobicContact CD1-CG 3.95Å; L567-L570 PolarHBondContact O-N 3.19Å; V568-L570 PolarHBondContact O-N 3.28Å; L570-R683 PolarHBondContact O-NH1 3.45Å; L570-I685 HydrophobicContact CB-CD1 3.78Å; L570-I685 HydrophobicContact CD1-CD1 4.49Å; L570-I720 HydrophobicContact CD1-CG2 4.14Å; L570-I720 HydrophobicContact CD2-CD1 3.84Å; L570-I722 HydrophobicContact CD1-CD1 4.01Å; L570-I722 HydrophobicContact CD1-CG1 4.35Å
571	V	92.3	Very high	87.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-80.8	-46.8	176.9	165.2	0	0	0	0	111.1	L567 V568 A569 E573 V574 I575 V582 I597 L666 I685	L567-V571 HydrophobicContact CD1-CG2 4.26Å; L567-V571 HydrophobicContact CG-CG2 4.49Å; L567-V571 WeakPolarHBondContact O-CG2 3.3Å; L567-V571 PolarHBondContact O-N 3.31Å; L567-V571 VanDerWaalsContact O-N 3.1Å; V568-V571 PolarHBondContact O-N 3.27Å; V568-V571 VanDerWaalsContact O-N 3.16Å; A569-V571 PolarHBondContact O-N 3.12Å; A569-V571 VanDerWaalsContact O-N 3.16Å; V571-E573 PolarHBondContact O-N 3.17Å; V571-V574 PolarHBondContact O-N 3.06Å; V571-I575 HydrophobicContact CG1-CD1 3.58Å; V571-I575 HydrophobicContact CG1-CG1 3.86Å; V571-I575 HydrophobicContact CG1-CG2 4.47Å; V571-I575 WeakPolarHBondContact O-CG1 3.42Å; V571-I575 PolarHBondContact O-N 3.41Å; V571-I575 VanDerWaalsContact O-N 3.12Å; V571-V582 HydrophobicContact CG2-CG2 4.09Å; V571-I597 HydrophobicContact CG1-CG2 4.38Å; V571-I597 HydrophobicContact CG2-CD1 4.27Å; V571-L666 HydrophobicContact CG1-CD1 4.1Å; V571-L666 HydrophobicContact CG1-CD2 3.69Å; V571-L666 HydrophobicContact CG2-CD1 4.2Å; V571-I685 HydrophobicContact CG2-CD1 4.02Å
572	T	89.8	Confident	88.4	Confident	33 Å²	33	32.8 Å²	32.8	20%	0.202	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-15.9	-177.4	55.4	0	0	0	0	115	V568 A569 V574 L601	V568-T572 HydrophobicContact CG1-CG2 4.06Å; V568-T572 WeakPolarHBondContact O-CG2 3.49Å; V568-T572 PolarHBondContact O-N 3.43Å; V568-T572 PolarHBondContact O-OG1 2.64Å; V568-T572 VanDerWaalsContact O-OG1 3.07Å; A569-T572 WeakPolarHBondContact CA-OG1 3.45Å; A569-T572 PolarHBondContact O-N 2.87Å; A569-T572 PolarHBondContact O-OG1 2.77Å; A569-T572 VanDerWaalsContact O-OG1 3.08Å; T572-V574 PolarHBondContact O-N 2.96Å; T572-L601 HydrophobicContact CG2-CD2 3.68Å
573	E	89.3	Confident	89.4	Confident	87 Å²	87	27.4 Å²	27.4	41%	0.407	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.1	167.7	-73.6	175.5	-173.7	0	0	113.4	R549 A569 V571 R683	R549-E573 IonicContact CZ-OE1 2.85Å; R549-E573 IonicContact CZ-OE2 2.68Å; R549-E573 IonicContact NH1-OE1 2.96Å; R549-E573 PolarHBondContact NH1-OE1 2.97Å; R549-E573 IonicContact NH1-OE2 3.89Å; R549-E573 IonicContact NH2-OE1 3.13Å; R549-E573 PolarHBondContact NH2-OE1 3.35Å; R549-E573 IonicContact NH2-OE2 3.27Å; R549-E573 PolarHBondContact NH2-OE2 2.8Å; A569-E573 PolarHBondContact O-N 3.39Å; V571-E573 PolarHBondContact O-N 3.17Å; E573-R683 IonicContact OE2-CZ 3.17Å; E573-R683 IonicContact OE2-NH1 2.78Å; E573-R683 PolarHBondContact OE2-NH1 3.31Å; E573-R683 IonicContact OE2-NH2 2.71Å; E573-R683 PolarHBondContact OE2-NH2 2.7Å
574	V	90.2	Very high	90	Very high	7 Å²	7	27.7 Å²	27.7	4%	0.042	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-46.8	-167.6	-178.3	0	0	0	0	111.6	V571 T572 N577 Y578 C580 R682 R683	V571-V574 PolarHBondContact O-N 3.06Å; T572-V574 PolarHBondContact O-N 2.96Å; V574-N577 PolarHBondContact O-N 2.92Å; V574-Y578 PolarHBondContact O-N 2.74Å; V574-C580 HydrophobicContact CG1-CB 4.17Å; V574-R682 HydrophobicContact CG1-CB 4.43Å; V574-R682 HydrophobicContact CG1-CG 4.43Å; V574-R683 HydrophobicContact CG1-CB 4.31Å; V574-R683 HydrophobicContact CG2-CB 3.99Å; V574-R683 HydrophobicContact CG2-CG 4.49Å; V574-R683 VanDerWaalsContact CG2-CZ 3.45Å
575	I	90.3	Very high	90.5	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.026	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	149.6	-179.8	67.8	166.6	0	0	0	111.4	V571 C580 L601 Y605 C665 L666	V571-I575 HydrophobicContact CG1-CD1 3.58Å; V571-I575 HydrophobicContact CG1-CG1 3.86Å; V571-I575 HydrophobicContact CG1-CG2 4.47Å; V571-I575 WeakPolarHBondContact O-CG1 3.42Å; V571-I575 PolarHBondContact O-N 3.41Å; V571-I575 VanDerWaalsContact O-N 3.12Å; I575-C580 HydrophobicContact CG2-CB 4.4Å; I575-L601 HydrophobicContact CD1-CD1 3.96Å; I575-L601 HydrophobicContact CD1-CD2 3.93Å; I575-Y605 HydrophobicContact CB-CE1 4.38Å; I575-Y605 HydrophobicContact CD1-CD1 4.49Å; I575-Y605 HydrophobicContact CD1-CE1 3.85Å; I575-Y605 HydrophobicContact CG1-CE1 3.83Å; I575-Y605 PolarHBondContact O-OH 2.82Å; I575-Y605 VanDerWaalsContact O-OH 3.14Å; I575-C665 HydrophobicContact CB-CB 4.19Å; I575-C665 HydrophobicContact CG2-CB 3.85Å; I575-L666 HydrophobicContact CG2-CB 4.42Å
576	P	86.7	Confident	90.9	Very high	37 Å²	37	24.7 Å²	24.7	24%	0.24	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	cis	-85.8	-8.4	1.3	36.1	-35.7	0	0	0	114.5	Y578 Y605	P576-Y578 PolarHBondContact O-N 3.44Å; P576-Y605 HydrophobicContact CB-CD1 4.4Å; P576-Y605 HydrophobicContact CB-CE1 4.15Å; P576-Y605 HydrophobicContact CG-CE1 4.26Å
577	N	87.6	Confident	91.1	Very high	136 Å²	136	25.8 Å²	25.8	73%	0.727	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.7	-169.1	-64.6	-21.8	0	0	0	113.8	V574	V574-N577 PolarHBondContact O-N 2.92Å
578	Y	90.7	Very high	91.1	Very high	106 Å²	106	30.9 Å²	30.9	42%	0.416	16%	0.156	S	C	.	.	S	Bend	trans	-126.6	160.1	-178.6	-65.3	-88.5	0	0	0	110.5	V574 P576 R682	V574-Y578 PolarHBondContact O-N 2.74Å; P576-Y578 PolarHBondContact O-N 3.44Å; Y578-R682 HydrophobicContact CD1-CB 4.08Å; Y578-R682 HydrophobicContact CD1-CG 3.86Å; Y578-R682 HydrophobicContact CG-CB 4.26Å; Y578-R682 HydrophobicContact CG-CG 4.01Å
579	S	92.4	Very high	91.3	Very high	8 Å²	8	32.5 Å²	32.5	6%	0.056	17%	0.165	C	C	.	.			trans	-92.2	143.1	179.9	61.6	0	0	0	0	112.7	C665 A681 R682 R683	S579-C665 CarbonylContact C-O 3.41Å; S579-C665 WeakPolarHBondContact CA-O 3.19Å; S579-A681 WeakPolarHBondContact OG-CA 3.41Å; S579-R682 WeakPolarHBondContact O-CB 3.49Å; S579-R682 PolarHBondContact O-N 2.85Å; S579-R683 PolarHBondContact O-N 3.09Å
580	C	95.2	Very high	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.8	-179.5	-175.8	0	0	0	0	112.2	V574 I575 Y659 C665 L666 F667 R683	V574-C580 HydrophobicContact CG1-CB 4.17Å; I575-C580 HydrophobicContact CG2-CB 4.4Å; C580-Y659 PolarHBondContact N-OH 2.82Å; C580-Y659 WeakPolarHBondContact O-CE2 3.42Å; C580-Y659 PolarHBondContact O-OH 3.1Å; C580-C665 PolarHBondContact N-O 2.9Å; C580-L666 HydrophobicContact CB-CD1 3.73Å; C580-L666 WeakPolarHBondContact O-CA 3.49Å; C580-F667 PolarHBondContact O-N 3.01Å; C580-R683 VanDerWaalsContact CA-O 3.23Å; C580-R683 WeakPolarHBondContact CA-O 3.38Å; C580-R683 PolarHBondContact SG-O 2.85Å
581	L	95.8	Very high	91.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.4	170.7	-62.6	176.2	0	0	0	109.2	Y659 F667 L673 A681 R683 V684 I685 R707	L581-Y659 HydrophobicContact CD2-CE1 4.14Å; L581-Y659 HydrophobicContact CD2-CE2 4.11Å; L581-Y659 WeakPolarHBondContact CD2-OH 3.36Å; L581-F667 HydrophobicContact CD2-CB 3.87Å; L581-F667 HydrophobicContact CD2-CD2 3.81Å; L581-F667 HydrophobicContact CD2-CG 4.34Å; L581-L673 HydrophobicContact CD2-CD2 4.18Å; L581-A681 HydrophobicContact CD1-CB 4.09Å; L581-A681 HydrophobicContact CG-CB 3.77Å; L581-R683 PolarHBondContact N-O 2.71Å; L581-V684 HydrophobicContact CB-CG2 4.42Å; L581-V684 HydrophobicContact CD1-CG2 4.39Å; L581-V684 CarbonylContact O-C 3.34Å; L581-V684 WeakPolarHBondContact O-CA 3.01Å; L581-I685 PolarHBondContact O-N 2.84Å; L581-R707 HydrophobicContact CD1-CB 4.31Å
582	V	95.9	Very high	91.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	102.5	176.2	-178.7	0	0	0	0	109.1	L567 V571 L666 F667 T668 C669 I685	L567-V582 HydrophobicContact CD1-CG1 4.11Å; L567-V582 HydrophobicContact CD1-CG2 4.39Å; L567-V582 HydrophobicContact CD2-CG1 4.12Å; V571-V582 HydrophobicContact CG2-CG2 4.09Å; V582-L666 HydrophobicContact CG2-CD1 3.86Å; V582-F667 PolarHBondContact N-O 3.43Å; V582-T668 HydrophobicContact CB-CG2 4.31Å; V582-T668 CarbonylContact O-C 3.47Å; V582-T668 WeakPolarHBondContact O-CA 3.32Å; V582-C669 PolarHBondContact O-N 3Å; V582-I685 CarbonylContact C-O 3.51Å; V582-I685 WeakPolarHBondContact CA-O 3.41Å; V582-I685 HydrophobicContact CG2-CB 4.25Å; V582-I685 HydrophobicContact CG2-CD1 4.33Å
583	F	95.3	Very high	91.9	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	126.9	173.7	-73.8	-76.2	0	0	0	110.7	C669 L673 A674 V684 I685 L686 R687 M704	F583-C669 CarbonylContact C-O 3.33Å; F583-C669 VanDerWaalsContact CA-O 3.29Å; F583-C669 WeakPolarHBondContact CA-O 3.37Å; F583-L673 HydrophobicContact CE1-CB 4.33Å; F583-A674 HydrophobicContact CE1-CB 4.08Å; F583-A674 HydrophobicContact CZ-CB 4.17Å; F583-V684 HydrophobicContact CD2-CG1 3.77Å; F583-V684 HydrophobicContact CE2-CG1 3.78Å; F583-I685 PolarHBondContact N-O 2.76Å; F583-L686 HydrophobicContact CB-CG 4.22Å; F583-L686 HydrophobicContact CD2-CD1 4.07Å; F583-R687 WeakPolarHBondContact O-CB 3.46Å; F583-R687 PolarHBondContact O-N 3.3Å; F583-M704 HydrophobicContact CB-SD 4.21Å; F583-M704 HydrophobicContact CD1-CG 4.28Å; F583-M704 HydrophobicContact CD1-SD 4.07Å; F583-M704 HydrophobicContact CD2-CB 4.06Å; F583-M704 HydrophobicContact CD2-CG 4.1Å; F583-M704 HydrophobicContact CD2-SD 4.15Å; F583-M704 HydrophobicContact CE1-CG 4.14Å; F583-M704 HydrophobicContact CE2-CB 3.81Å; F583-M704 HydrophobicContact CE2-CG 3.95Å; F583-M704 HydrophobicContact CG-CG 4.27Å; F583-M704 HydrophobicContact CG-SD 3.88Å; F583-M704 HydrophobicContact CZ-CB 4.24Å; F583-M704 HydrophobicContact CZ-CG 3.98Å
584	C	93.3	Very high	92.2	Very high	7 Å²	7	32.5 Å²	32.5	5%	0.047	17%	0.165	C	C	.	.			trans	-122.8	148.1	178.2	-59	0	0	0	0	111.1	S586 N589 C669	C584-S586 PolarHBondContact O-N 2.99Å; C584-N589 HydrophobicContact CB-CB 4.19Å; C584-C669 PolarHBondContact N-O 3.37Å
585	P	90.4	Very high	92.3	Very high	24 Å²	24	33.6 Å²	33.6	16%	0.156	17%	0.17	C	C	.	.	S	Bend	trans	-63.4	-30.8	-173.5	-26.6	35	0	0	0	116.2	A688 Y690 A692	P585-A688 HydrophobicContact CG-CB 3.98Å; P585-Y690 WeakPolarHBondContact CB-O 3.33Å; P585-Y690 WeakPolarHBondContact CG-O 3.43Å; P585-A692 WeakPolarHBondContact O-CA 3.49Å; P585-A692 PolarHBondContact O-N 3.42Å
586	S	90.5	Very high	92.4	Very high	34 Å²	34	34.5 Å²	34.5	24%	0.238	17%	0.174	C	C	.	.	S	Bend	trans	-140.6	159.3	-175.9	78.3	0	0	0	0	113.2	C584 K588 N589 C590	C584-S586 PolarHBondContact O-N 2.99Å; S586-K588 PolarHBondContact O-N 3.19Å; S586-N589 VanDerWaalsContact O-CB 3.28Å; S586-N589 WeakPolarHBondContact O-CB 3.27Å; S586-N589 PolarHBondContact O-N 2.94Å; S586-N589 VanDerWaalsContact O-N 3.09Å; S586-C590 PolarHBondContact O-N 2.99Å; S586-C590 VanDerWaalsContact O-N 3.14Å; S586-C590 PolarHBondContact O-SG 3.38Å; S586-C590 VanDerWaalsContact O-SG 3.38Å
587	K	90.1	Very high	92.6	Very high	44 Å²	44	32.7 Å²	32.7	19%	0.191	16%	0.163	C	C	.	.	H	α-helix	trans	-53.9	-49.8	-177.5	-63.6	-178	-178.5	-171.6	0	112.7	D110 N589 C590 E591 H644 S645 T670	D110-K587 VanDerWaalsContact CB-NZ 3.29Å; D110-K587 WeakPolarHBondContact OD1-CE 3.46Å; D110-K587 IonicContact OD1-NZ 3.73Å; D110-K587 PolarHBondContact OD1-NZ 3.24Å; D110-K587 IonicContact OD2-NZ 3.54Å; D110-K587 PolarHBondContact OD2-NZ 3.02Å; K587-N589 VanDerWaalsContact C-N 3.26Å; K587-N589 PolarHBondContact O-N 3.22Å; K587-C590 WeakPolarHBondContact O-CB 3.29Å; K587-C590 PolarHBondContact O-N 2.98Å; K587-C590 VanDerWaalsContact O-N 3.13Å; K587-E591 PolarHBondContact O-N 2.86Å; K587-H644 HydrophobicContact CG-CB 4.24Å; K587-H644 PolarHBondContact O-CD2 3.32Å; K587-S645 WeakPolarHBondContact CE-OG 3.12Å; K587-S645 PolarHBondContact NZ-OG 2.9Å; K587-S645 VanDerWaalsContact NZ-OG 3.13Å; K587-T670 HydrophobicContact CG-CG2 4.29Å
588	K	90.6	Very high	92.8	Very high	108 Å²	108	26.9 Å²	26.9	47%	0.47	13%	0.132	S	C	.	.	H	α-helix	trans	-66.6	-30.5	-178.6	-164.2	70.7	-147.1	167.6	0	112	S586 E591 N592	S586-K588 PolarHBondContact O-N 3.19Å; K588-E591 IonicContact NZ-OE2 3.48Å; K588-E591 PolarHBondContact NZ-OE2 3.41Å; K588-E591 PolarHBondContact O-N 3.09Å; K588-N592 VanDerWaalsContact CE-OD1 3.28Å; K588-N592 WeakPolarHBondContact CE-OD1 3.17Å; K588-N592 WeakPolarHBondContact O-CB 3.29Å; K588-N592 PolarHBondContact O-N 3.5Å; K588-N592 PolarHBondContact O-ND2 3Å; K588-N592 PolarHBondContact O-OD1 3.24Å
589	N	91.8	Very high	92.6	Very high	38 Å²	38	28.2 Å²	28.2	20%	0.203	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-43.7	172.6	-160	-26.5	0	0	0	110.7	C584 S586 K587 E591 N592 V593 R687	C584-N589 HydrophobicContact CB-CB 4.19Å; S586-N589 VanDerWaalsContact O-CB 3.28Å; S586-N589 WeakPolarHBondContact O-CB 3.27Å; S586-N589 PolarHBondContact O-N 2.94Å; S586-N589 VanDerWaalsContact O-N 3.09Å; K587-N589 VanDerWaalsContact C-N 3.26Å; K587-N589 PolarHBondContact O-N 3.22Å; N589-E591 PolarHBondContact O-N 3.06Å; N589-N592 PolarHBondContact O-N 2.95Å; N589-V593 WeakPolarHBondContact O-CB 3.44Å; N589-V593 VanDerWaalsContact O-CG2 3.25Å; N589-V593 WeakPolarHBondContact O-CG2 3.46Å; N589-V593 PolarHBondContact O-N 2.94Å; N589-V593 VanDerWaalsContact OD1-CG2 3.27Å; N589-V593 WeakPolarHBondContact OD1-CG2 3.38Å; N589-R687 PolarHBondContact OD1-NH1 3.49Å
590	C	93.1	Very high	92.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.2	-49.3	174.6	-54.3	0	0	0	0	112.6	S586 K587 A594 T668	S586-C590 PolarHBondContact O-N 2.99Å; S586-C590 VanDerWaalsContact O-N 3.14Å; S586-C590 PolarHBondContact O-SG 3.38Å; S586-C590 VanDerWaalsContact O-SG 3.38Å; K587-C590 WeakPolarHBondContact O-CB 3.29Å; K587-C590 PolarHBondContact O-N 2.98Å; K587-C590 VanDerWaalsContact O-N 3.13Å; C590-A594 WeakPolarHBondContact O-CB 3.12Å; C590-A594 PolarHBondContact O-N 2.82Å; C590-T668 WeakPolarHBondContact O-CB 3.46Å; C590-T668 PolarHBondContact O-OG1 3.46Å
591	E	94.4	Very high	91.9	Very high	29 Å²	29	31.1 Å²	31.1	14%	0.136	15%	0.153	C	C	.	.	H	α-helix	trans	-60.8	-47.8	177.9	-67	-168.4	149.2	0	0	111.9	K587 K588 N589 V593 A594 E595 Y642	K587-E591 PolarHBondContact O-N 2.86Å; K588-E591 IonicContact NZ-OE2 3.48Å; K588-E591 PolarHBondContact NZ-OE2 3.41Å; K588-E591 PolarHBondContact O-N 3.09Å; N589-E591 PolarHBondContact O-N 3.06Å; E591-V593 PolarHBondContact O-N 3.32Å; E591-A594 PolarHBondContact O-N 3.17Å; E591-E595 PolarHBondContact O-N 3.24Å; E591-E595 VanDerWaalsContact O-N 3.08Å; E591-Y642 HydrophobicContact CG-CD1 4.33Å; E591-Y642 HydrophobicContact CG-CD2 3.77Å; E591-Y642 HydrophobicContact CG-CE1 4.13Å; E591-Y642 HydrophobicContact CG-CE2 3.5Å; E591-Y642 HydrophobicContact CG-CG 4.14Å; E591-Y642 WeakPolarHBondContact OE1-CE2 3.45Å; E591-Y642 PolarHBondContact OE1-OH 3.27Å
592	N	93.6	Very high	91.3	Very high	90 Å²	90	33.2 Å²	33.2	48%	0.481	17%	0.168	S	C	.	.	H	α-helix	trans	-64.7	-40.9	-178	-69.9	-5.2	0	0	0	111.9	K588 N589 E595 M596	K588-N592 VanDerWaalsContact CE-OD1 3.28Å; K588-N592 WeakPolarHBondContact CE-OD1 3.17Å; K588-N592 WeakPolarHBondContact O-CB 3.29Å; K588-N592 PolarHBondContact O-N 3.5Å; K588-N592 PolarHBondContact O-ND2 3Å; K588-N592 PolarHBondContact O-OD1 3.24Å; N589-N592 PolarHBondContact O-N 2.95Å; N592-E595 PolarHBondContact O-N 2.92Å; N592-M596 VanDerWaalsContact O-CB 3.27Å; N592-M596 WeakPolarHBondContact O-CB 3.46Å; N592-M596 PolarHBondContact O-N 3.16Å
593	V	93.4	Very high	90.9	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-38	177	174.7	0	0	0	0	111.3	L567 N589 E591 M596 I597 T668	L567-V593 HydrophobicContact CD2-CG1 3.56Å; N589-V593 WeakPolarHBondContact O-CB 3.44Å; N589-V593 VanDerWaalsContact O-CG2 3.25Å; N589-V593 WeakPolarHBondContact O-CG2 3.46Å; N589-V593 PolarHBondContact O-N 2.94Å; N589-V593 VanDerWaalsContact OD1-CG2 3.27Å; N589-V593 WeakPolarHBondContact OD1-CG2 3.38Å; E591-V593 PolarHBondContact O-N 3.32Å; V593-M596 WeakPolarHBondContact O-CB 3.42Å; V593-M596 PolarHBondContact O-N 3.19Å; V593-I597 HydrophobicContact CG1-CD1 3.74Å; V593-I597 HydrophobicContact CG1-CG1 4.28Å; V593-I597 WeakPolarHBondContact O-CG1 3.41Å; V593-I597 PolarHBondContact O-N 3.45Å; V593-T668 HydrophobicContact CB-CG2 4.01Å; V593-T668 HydrophobicContact CG1-CG2 3.61Å
594	A	94.6	Very high	90.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-44.5	175.6	0	0	0	0	0	111.5	C590 E591 C598 T635 V640 T668	C590-A594 WeakPolarHBondContact O-CB 3.12Å; C590-A594 PolarHBondContact O-N 2.82Å; E591-A594 PolarHBondContact O-N 3.17Å; A594-C598 PolarHBondContact O-N 2.98Å; A594-C598 PolarHBondContact O-SG 3.4Å; A594-T635 HydrophobicContact CB-CG2 3.94Å; A594-V640 HydrophobicContact CB-CG1 4.11Å; A594-T668 HydrophobicContact CB-CG2 4.31Å
595	E	93.6	Very high	90.1	Very high	31 Å²	31	49.3 Å²	49.3	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-40.2	172.3	-77.6	-140.8	157.4	0	0	113.2	E591 N592 C598 K599 V631 R634	E591-E595 PolarHBondContact O-N 3.24Å; E591-E595 VanDerWaalsContact O-N 3.08Å; N592-E595 PolarHBondContact O-N 2.92Å; E595-C598 PolarHBondContact O-N 2.94Å; E595-K599 WeakPolarHBondContact O-CD 3.16Å; E595-K599 VanDerWaalsContact O-CG 3.31Å; E595-K599 WeakPolarHBondContact O-CG 3.21Å; E595-K599 PolarHBondContact O-N 2.98Å; E595-K599 VanDerWaalsContact O-N 3.16Å; E595-K599 IonicContact OE2-NZ 2.76Å; E595-K599 PolarHBondContact OE2-NZ 2.93Å; E595-V631 HydrophobicContact CG-CG1 4Å; E595-V631 HydrophobicContact CG-CG2 4.4Å; E595-R634 WeakPolarHBondContact OE1-CD 3.42Å; E595-R634 IonicContact OE1-CZ 2.61Å; E595-R634 IonicContact OE1-NE 3.92Å; E595-R634 IonicContact OE1-NH1 2.74Å; E595-R634 PolarHBondContact OE1-NH1 2.78Å; E595-R634 IonicContact OE2-NH1 3.12Å
596	M	91.6	Very high	89.9	Confident	23 Å²	23	51 Å²	51	11%	0.113	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-52.9	179.9	-177.5	-174.7	89.6	0	0	110.7	M562 D563 L567 N592 V593 C598 K599 F600	M562-M596 VanDerWaalsContact O-SD 3.35Å; D563-M596 HydrophobicContact CB-CE 4.05Å; D563-M596 HydrophobicContact CB-SD 4.38Å; L567-M596 HydrophobicContact CD2-CE 4.34Å; N592-M596 VanDerWaalsContact O-CB 3.27Å; N592-M596 WeakPolarHBondContact O-CB 3.46Å; N592-M596 PolarHBondContact O-N 3.16Å; V593-M596 WeakPolarHBondContact O-CB 3.42Å; V593-M596 PolarHBondContact O-N 3.19Å; M596-C598 VanDerWaalsContact C-N 3.31Å; M596-C598 PolarHBondContact O-N 3.03Å; M596-K599 WeakPolarHBondContact O-CB 3Å; M596-K599 PolarHBondContact O-N 3.44Å; M596-K599 VanDerWaalsContact O-N 3.08Å; M596-F600 HydrophobicContact CG-CD2 4.16Å; M596-F600 HydrophobicContact CG-CE2 3.61Å; M596-F600 WeakPolarHBondContact O-CD2 3.49Å
597	I	91.4	Very high	89.8	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-43.3	179.4	-67.3	171.7	0	0	0	110.4	L567 V568 V571 V593 K599 F600 L601 L666	L567-I597 HydrophobicContact CD2-CD1 4.37Å; V568-I597 HydrophobicContact CG2-CG1 4.31Å; V571-I597 HydrophobicContact CG1-CG2 4.38Å; V571-I597 HydrophobicContact CG2-CD1 4.27Å; V593-I597 HydrophobicContact CG1-CD1 3.74Å; V593-I597 HydrophobicContact CG1-CG1 4.28Å; V593-I597 WeakPolarHBondContact O-CG1 3.41Å; V593-I597 PolarHBondContact O-N 3.45Å; I597-K599 PolarHBondContact O-N 2.94Å; I597-F600 PolarHBondContact O-N 2.73Å; I597-L601 HydrophobicContact CG2-CD1 3.93Å; I597-L601 HydrophobicContact CG2-CD2 4.36Å; I597-L601 HydrophobicContact CG2-CG 3.98Å; I597-L601 WeakPolarHBondContact O-CG 3.45Å; I597-L601 PolarHBondContact O-N 2.99Å; I597-L666 HydrophobicContact CD1-CD2 3.84Å; I597-L666 HydrophobicContact CG2-CD2 3.99Å
598	C	90.4	Very high	89.7	Confident	13 Å²	13	58.1 Å²	58.1	9%	0.088	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-19.6	178.7	-63.8	0	0	0	0	114.6	A594 E595 M596 F600 F638 V640	A594-C598 PolarHBondContact O-N 2.98Å; A594-C598 PolarHBondContact O-SG 3.4Å; E595-C598 PolarHBondContact O-N 2.94Å; M596-C598 VanDerWaalsContact C-N 3.31Å; M596-C598 PolarHBondContact O-N 3.03Å; C598-F600 VanDerWaalsContact C-N 3.28Å; C598-F638 HydrophobicContact CB-CD2 3.85Å; C598-F638 HydrophobicContact CB-CE2 4.18Å; C598-F638 HydrophobicContact CB-CG 4.26Å; C598-V640 VanDerWaalsContact SG-CB 3.6Å
599	K	88.1	Confident	89.6	Confident	135 Å²	135	55.9 Å²	55.9	59%	0.587	26%	0.264	S	S	*	.	H	α-helix	trans	-76.5	-16.2	172.3	-70.2	157.6	-168.8	164.8	0	112.5	E595 M596 I597	E595-K599 WeakPolarHBondContact O-CD 3.16Å; E595-K599 VanDerWaalsContact O-CG 3.31Å; E595-K599 WeakPolarHBondContact O-CG 3.21Å; E595-K599 PolarHBondContact O-N 2.98Å; E595-K599 VanDerWaalsContact O-N 3.16Å; E595-K599 IonicContact OE2-NZ 2.76Å; E595-K599 PolarHBondContact OE2-NZ 2.93Å; M596-K599 WeakPolarHBondContact O-CB 3Å; M596-K599 PolarHBondContact O-N 3.44Å; M596-K599 VanDerWaalsContact O-N 3.08Å; I597-K599 PolarHBondContact O-N 2.94Å
600	F	84.5	Confident	89.5	Confident	54 Å²	54	59.4 Å²	59.4	24%	0.237	28%	0.279	C	S	.	.	H	α-helix	trans	-115.6	-15.8	-173.8	-55.4	-44.1	0	0	0	114.6	L559 M562 V568 M596 I597 C598	L559-F600 HydrophobicContact CD2-CD1 3.35Å; L559-F600 HydrophobicContact CD2-CE1 3.26Å; L559-F600 HydrophobicContact CD2-CG 4.23Å; L559-F600 HydrophobicContact CD2-CZ 4.04Å; M562-F600 HydrophobicContact CB-CE2 4.14Å; M562-F600 HydrophobicContact CB-CZ 3.66Å; M562-F600 HydrophobicContact CG-CZ 4.31Å; M562-F600 HydrophobicContact SD-CE1 4.32Å; M562-F600 HydrophobicContact SD-CZ 3.76Å; V568-F600 HydrophobicContact CG1-CB 4.1Å; V568-F600 HydrophobicContact CG2-CB 4.25Å; V568-F600 HydrophobicContact CG2-CD2 3.69Å; V568-F600 HydrophobicContact CG2-CG 4.41Å; M596-F600 HydrophobicContact CG-CD2 4.16Å; M596-F600 HydrophobicContact CG-CE2 3.61Å; M596-F600 WeakPolarHBondContact O-CD2 3.49Å; I597-F600 PolarHBondContact O-N 2.73Å; C598-F600 VanDerWaalsContact C-N 3.28Å
601	L	86.8	Confident	89.3	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.073	31%	0.313	C	S	.	.	S	Bend	trans	-67.8	146.2	171	-66.8	177.6	0	0	0	112	T572 I575 I597 Y605 F638 V640	T572-L601 HydrophobicContact CG2-CD2 3.68Å; I575-L601 HydrophobicContact CD1-CD1 3.96Å; I575-L601 HydrophobicContact CD1-CD2 3.93Å; I597-L601 HydrophobicContact CG2-CD1 3.93Å; I597-L601 HydrophobicContact CG2-CD2 4.36Å; I597-L601 HydrophobicContact CG2-CG 3.98Å; I597-L601 WeakPolarHBondContact O-CG 3.45Å; I597-L601 PolarHBondContact O-N 2.99Å; L601-Y605 HydrophobicContact CB-CD2 4.08Å; L601-Y605 HydrophobicContact CB-CE2 4.45Å; L601-Y605 HydrophobicContact CB-CG 4.3Å; L601-Y605 HydrophobicContact CD1-CD1 4.29Å; L601-Y605 HydrophobicContact CD1-CG 4.45Å; L601-Y605 HydrophobicContact CD2-CD2 4.47Å; L601-Y605 HydrophobicContact CD2-CE1 4.22Å; L601-Y605 HydrophobicContact CD2-CE2 4.1Å; L601-F638 HydrophobicContact CB-CD1 3.87Å; L601-F638 HydrophobicContact CB-CE1 4.32Å; L601-F638 HydrophobicContact CD1-CB 4.06Å; L601-F638 HydrophobicContact CD1-CD1 4.38Å; L601-V640 HydrophobicContact CD1-CG2 3.85Å
602	S	83.8	Confident	89.1	Confident	45 Å²	45	69.4 Å²	69.4	32%	0.315	32%	0.323	S	S	.	.			trans	-66.2	156.6	177.2	85.2	0	0	0	0	111.3	E604 Y605	S602-E604 WeakPolarHBondContact CB-OE2 3.45Å; S602-E604 PolarHBondContact O-N 2.82Å; S602-E604 WeakPolarHBondContact OG-CB 3.43Å; S602-E604 PolarHBondContact OG-N 3.14Å; S602-E604 PolarHBondContact OG-OE2 2.75Å; S602-Y605 WeakPolarHBondContact O-CD2 3.28Å; S602-Y605 PolarHBondContact O-N 3.03Å; S602-Y605 WeakPolarHBondContact OG-CD2 3.4Å
603	K	87.1	Confident	89	Confident	178 Å²	178	65.3 Å²	65.3	77%	0.774	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-66.7	-6.3	176.2	-67.5	-176.9	179.5	178.3	0	113.6	L606	K603-L606 HydrophobicContact CB-CD1 4.3Å; K603-L606 HydrophobicContact CG-CD1 4.48Å; K603-L606 WeakPolarHBondContact O-CB 3.13Å; K603-L606 PolarHBondContact O-N 3.48Å
604	E	85.6	Confident	88.9	Confident	142 Å²	142	68.2 Å²	68.2	66%	0.664	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-73.2	-31.7	177.9	-59.3	157.1	131.8	0	0	111.4	S602 L606 K607 H608	S602-E604 WeakPolarHBondContact CB-OE2 3.45Å; S602-E604 PolarHBondContact O-N 2.82Å; S602-E604 WeakPolarHBondContact OG-CB 3.43Å; S602-E604 PolarHBondContact OG-N 3.14Å; S602-E604 PolarHBondContact OG-OE2 2.75Å; E604-L606 PolarHBondContact O-N 3.24Å; E604-L606 VanDerWaalsContact O-N 3.11Å; E604-K607 WeakPolarHBondContact O-CB 3.46Å; E604-K607 PolarHBondContact O-N 3.04Å; E604-H608 PolarHBondContact O-N 3.12Å
605	Y	86	Confident	88.5	Confident	33 Å²	33	71 Å²	71	13%	0.129	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-57.4	-24.8	174.1	-75.2	-97.6	0	0	0	112.9	I575 P576 L601 S602 K613	I575-Y605 HydrophobicContact CB-CE1 4.38Å; I575-Y605 HydrophobicContact CD1-CD1 4.49Å; I575-Y605 HydrophobicContact CD1-CE1 3.85Å; I575-Y605 HydrophobicContact CG1-CE1 3.83Å; I575-Y605 PolarHBondContact O-OH 2.82Å; I575-Y605 VanDerWaalsContact O-OH 3.14Å; P576-Y605 HydrophobicContact CB-CD1 4.4Å; P576-Y605 HydrophobicContact CB-CE1 4.15Å; P576-Y605 HydrophobicContact CG-CE1 4.26Å; L601-Y605 HydrophobicContact CB-CD2 4.08Å; L601-Y605 HydrophobicContact CB-CE2 4.45Å; L601-Y605 HydrophobicContact CB-CG 4.3Å; L601-Y605 HydrophobicContact CD1-CD1 4.29Å; L601-Y605 HydrophobicContact CD1-CG 4.45Å; L601-Y605 HydrophobicContact CD2-CD2 4.47Å; L601-Y605 HydrophobicContact CD2-CE1 4.22Å; L601-Y605 HydrophobicContact CD2-CE2 4.1Å; S602-Y605 WeakPolarHBondContact O-CD2 3.28Å; S602-Y605 PolarHBondContact O-N 3.03Å; S602-Y605 WeakPolarHBondContact OG-CD2 3.4Å; Y605-K613 PolarHBondContact O-NZ 3.2Å
606	L	87.6	Confident	88.2	Confident	58 Å²	58	70.2 Å²	70.2	30%	0.304	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-66.4	-36.8	174.5	-59.6	174.2	0	0	0	112.4	K603 E604 P637 F638	K603-L606 HydrophobicContact CB-CD1 4.3Å; K603-L606 HydrophobicContact CG-CD1 4.48Å; K603-L606 WeakPolarHBondContact O-CB 3.13Å; K603-L606 PolarHBondContact O-N 3.48Å; E604-L606 PolarHBondContact O-N 3.24Å; E604-L606 VanDerWaalsContact O-N 3.11Å; L606-P637 HydrophobicContact CD2-CB 3.6Å; L606-F638 HydrophobicContact CD2-CD1 4.05Å; L606-F638 HydrophobicContact CD2-CD2 3.93Å; L606-F638 HydrophobicContact CD2-CE1 3.92Å; L606-F638 HydrophobicContact CD2-CE2 3.79Å; L606-F638 HydrophobicContact CD2-CG 4.06Å; L606-F638 HydrophobicContact CD2-CZ 3.78Å; L606-F638 HydrophobicContact CG-CD1 4.44Å; L606-F638 HydrophobicContact CG-CE1 4.13Å; L606-F638 HydrophobicContact CG-CZ 4.3Å
607	K	88.1	Confident	88.2	Confident	162 Å²	162	70.3 Å²	70.3	70%	0.704	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-30.1	-179.5	-58.8	-177.3	-179.8	179	0	112.2	E604 K609 E610	E604-K607 WeakPolarHBondContact O-CB 3.46Å; E604-K607 PolarHBondContact O-N 3.04Å; K607-K609 PolarHBondContact O-N 2.97Å; K607-K609 VanDerWaalsContact O-N 3.12Å; K607-E610 PolarHBondContact O-N 2.88Å
608	H	88	Confident	88	Confident	66 Å²	66	76 Å²	76	31%	0.306	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	113.9	177.9	-179.6	-96.5	0	0	0	110.4	E604 E610 K613	E604-H608 PolarHBondContact O-N 3.12Å; H608-E610 VanDerWaalsContact C-N 3.27Å; H608-E610 PolarHBondContact O-N 2.99Å; H608-K613 WeakPolarHBondContact O-CD 3.45Å; H608-K613 WeakPolarHBondContact O-CE 3.45Å; H608-K613 PolarHBondContact O-NZ 3.08Å
609	K	87.8	Confident	87.7	Confident	62 Å²	62	76.3 Å²	76.3	27%	0.27	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	36	-179.3	-65.9	-177.2	153.5	-136.5	0	114.6	K607 K611 E612 K613 T661 G662	K607-K609 PolarHBondContact O-N 2.97Å; K607-K609 VanDerWaalsContact O-N 3.12Å; K609-K611 VanDerWaalsContact C-N 3.33Å; K609-K611 PolarHBondContact O-N 2.88Å; K609-E612 HydrophobicContact CB-CB 4.39Å; K609-E612 WeakPolarHBondContact CD-OE2 3.38Å; K609-E612 WeakPolarHBondContact CE-OE2 3.3Å; K609-E612 IonicContact NZ-OE2 2.64Å; K609-E612 PolarHBondContact NZ-OE2 3.29Å; K609-E612 PolarHBondContact O-N 3.46Å; K609-K613 WeakPolarHBondContact O-CG 3.5Å; K609-K613 PolarHBondContact O-N 2.98Å; K609-T661 PolarHBondContact NZ-O 2.81Å; K609-G662 WeakPolarHBondContact CD-O 3.24Å; K609-G662 VanDerWaalsContact CE-O 3.3Å; K609-G662 WeakPolarHBondContact CE-O 3.36Å; K609-G662 PolarHBondContact NZ-O 2.92Å; K609-G662 VanDerWaalsContact NZ-O 3.07Å
610	E	90.6	Very high	87.7	Confident	112 Å²	112	70 Å²	70	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-51.2	-46.7	-176.1	-174.4	174.4	-164.8	0	0	113.4	K607 H608 K613 C614	K607-E610 PolarHBondContact O-N 2.88Å; H608-E610 VanDerWaalsContact C-N 3.27Å; H608-E610 PolarHBondContact O-N 2.99Å; E610-K613 PolarHBondContact O-N 2.92Å; E610-C614 PolarHBondContact O-N 3.09Å; E610-C614 PolarHBondContact O-SG 3.46Å; E610-C614 VanDerWaalsContact O-SG 3.34Å
611	K	88.9	Confident	87.8	Confident	166 Å²	166	71.5 Å²	71.5	72%	0.722	34%	0.336	S	S	*	.	H	α-helix	trans	-58.7	-55.3	179.4	-65.1	-179.1	179.6	179.4	0	112	K609 K613 C614 E615	K609-K611 VanDerWaalsContact C-N 3.33Å; K609-K611 PolarHBondContact O-N 2.88Å; K611-K613 VanDerWaalsContact C-N 3.26Å; K611-K613 PolarHBondContact O-N 3.44Å; K611-C614 WeakPolarHBondContact O-CB 3.36Å; K611-C614 PolarHBondContact O-N 3.16Å; K611-C614 VanDerWaalsContact O-N 3.07Å; K611-E615 VanDerWaalsContact O-CG 3.27Å; K611-E615 WeakPolarHBondContact O-CG 3.27Å; K611-E615 PolarHBondContact O-N 2.85Å
612	E	89.3	Confident	87.6	Confident	73 Å²	73	74.5 Å²	74.5	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-57.2	-39.2	179.4	-64	152.2	-119.6	0	0	111.4	K609 E615 V616 V663	K609-E612 HydrophobicContact CB-CB 4.39Å; K609-E612 WeakPolarHBondContact CD-OE2 3.38Å; K609-E612 WeakPolarHBondContact CE-OE2 3.3Å; K609-E612 IonicContact NZ-OE2 2.64Å; K609-E612 PolarHBondContact NZ-OE2 3.29Å; K609-E612 PolarHBondContact O-N 3.46Å; E612-E615 WeakPolarHBondContact O-CB 3.47Å; E612-E615 PolarHBondContact O-N 3.44Å; E612-V616 WeakPolarHBondContact O-CG2 3.26Å; E612-V616 PolarHBondContact O-N 2.74Å; E612-V663 HydrophobicContact CB-CB 4.4Å; E612-V663 HydrophobicContact CB-CG1 3.65Å; E612-V663 HydrophobicContact CB-CG2 3.84Å; E612-V663 HydrophobicContact CG-CG2 4.41Å
613	K	92	Very high	87.5	Confident	3 Å²	3	73.9 Å²	73.9	1%	0.013	35%	0.345	C	S	.	.	H	α-helix	trans	-67.8	-41.1	175.2	-70.2	166.8	168.5	179.2	0	113	Y605 H608 K609 E610 K611 E615 V616 I617 I636 P637 V663	Y605-K613 PolarHBondContact O-NZ 3.2Å; H608-K613 WeakPolarHBondContact O-CD 3.45Å; H608-K613 WeakPolarHBondContact O-CE 3.45Å; H608-K613 PolarHBondContact O-NZ 3.08Å; K609-K613 WeakPolarHBondContact O-CG 3.5Å; K609-K613 PolarHBondContact O-N 2.98Å; E610-K613 PolarHBondContact O-N 2.92Å; K611-K613 VanDerWaalsContact C-N 3.26Å; K611-K613 PolarHBondContact O-N 3.44Å; K613-E615 PolarHBondContact O-N 2.88Å; K613-V616 PolarHBondContact O-N 2.61Å; K613-I617 WeakPolarHBondContact O-CG1 3.49Å; K613-I617 PolarHBondContact O-N 3.1Å; K613-I636 HydrophobicContact CB-CG2 4.4Å; K613-P637 WeakPolarHBondContact CD-O 3.33Å; K613-P637 WeakPolarHBondContact CE-O 3.46Å; K613-P637 PolarHBondContact NZ-O 3.11Å; K613-V663 HydrophobicContact CG-CG1 3.8Å
614	C	90.2	Very high	87.1	Confident	62 Å²	62	65.4 Å²	65.4	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-33.5	173.7	-71.6	0	0	0	0	111.9	E610 K611 I617 K618	E610-C614 PolarHBondContact O-N 3.09Å; E610-C614 PolarHBondContact O-SG 3.46Å; E610-C614 VanDerWaalsContact O-SG 3.34Å; K611-C614 WeakPolarHBondContact O-CB 3.36Å; K611-C614 PolarHBondContact O-N 3.16Å; K611-C614 VanDerWaalsContact O-N 3.07Å; C614-I617 PolarHBondContact O-N 3.24Å; C614-K618 WeakPolarHBondContact O-CG 3.23Å; C614-K618 PolarHBondContact O-N 2.97Å
615	E	86.3	Confident	86.7	Confident	60 Å²	60	62 Å²	62	28%	0.28	30%	0.295	S	S	.	.	H	α-helix	trans	-69.6	-45.4	175.9	-66.8	163.6	-167.6	0	0	111.7	K611 E612 K613 I617 K618 N619 H1052	K611-E615 VanDerWaalsContact O-CG 3.27Å; K611-E615 WeakPolarHBondContact O-CG 3.27Å; K611-E615 PolarHBondContact O-N 2.85Å; E612-E615 WeakPolarHBondContact O-CB 3.47Å; E612-E615 PolarHBondContact O-N 3.44Å; K613-E615 PolarHBondContact O-N 2.88Å; E615-I617 VanDerWaalsContact C-N 3.28Å; E615-I617 PolarHBondContact O-N 3.38Å; E615-K618 WeakPolarHBondContact O-CB 3.08Å; E615-K618 PolarHBondContact O-N 3.17Å; E615-K618 VanDerWaalsContact O-N 3.12Å; E615-N619 VanDerWaalsContact O-CG 3.3Å; E615-N619 PolarHBondContact O-N 3.01Å; E615-N619 PolarHBondContact O-ND2 3.32Å; E615-H1052 WeakPolarHBondContact CG-CE1 3.47Å; E615-H1052 IonicContact OE1-CE1 3.49Å; E615-H1052 IonicContact OE2-CE1 3.33Å; E615-H1052 PolarHBondContact OE2-CE1 3.21Å; E615-H1052 IonicContact OE2-ND1 3.17Å; E615-H1052 PolarHBondContact OE2-ND1 3.08Å; E615-H1052 VanDerWaalsContact OE2-ND1 3.07Å
616	V	88.9	Confident	86.4	Confident	13 Å²	13	63 Å²	63	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-53.1	-45	169.3	167.3	0	0	0	0	111.2	E612 K613 N619 L620 I636 L654 A658 V663	E612-V616 WeakPolarHBondContact O-CG2 3.26Å; E612-V616 PolarHBondContact O-N 2.74Å; K613-V616 PolarHBondContact O-N 2.61Å; V616-N619 PolarHBondContact O-N 3.4Å; V616-L620 HydrophobicContact CG1-CD1 4.1Å; V616-L620 WeakPolarHBondContact O-CG 3.39Å; V616-L620 PolarHBondContact O-N 2.96Å; V616-I636 HydrophobicContact CB-CG2 4.43Å; V616-I636 HydrophobicContact CG1-CD1 4.12Å; V616-I636 HydrophobicContact CG1-CG2 3.95Å; V616-L654 HydrophobicContact CB-CD2 4.47Å; V616-L654 HydrophobicContact CG1-CD2 3.82Å; V616-A658 HydrophobicContact CG1-CB 4.48Å; V616-A658 HydrophobicContact CG2-CB 3.74Å; V616-V663 HydrophobicContact CG2-CG1 4.18Å
617	I	91.3	Very high	86.3	Confident	26 Å²	26	63 Å²	63	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-37.5	177.9	-71.2	169.6	0	0	0	112.5	K613 C614 E615 K621 L628 I636 P637	K613-I617 WeakPolarHBondContact O-CG1 3.49Å; K613-I617 PolarHBondContact O-N 3.1Å; C614-I617 PolarHBondContact O-N 3.24Å; E615-I617 VanDerWaalsContact C-N 3.28Å; E615-I617 PolarHBondContact O-N 3.38Å; I617-K621 WeakPolarHBondContact O-CG 3.19Å; I617-K621 PolarHBondContact O-N 3.07Å; I617-L628 HydrophobicContact CG2-CD2 3.88Å; I617-I636 HydrophobicContact CD1-CB 4.2Å; I617-I636 HydrophobicContact CD1-CG2 3.97Å; I617-I636 HydrophobicContact CG1-CB 4.12Å; I617-I636 HydrophobicContact CG1-CG2 3.75Å; I617-P637 HydrophobicContact CD1-CG 3.96Å
618	K	87.2	Confident	86.2	Confident	119 Å²	119	56.5 Å²	56.5	52%	0.517	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-48.2	173.3	-72.8	169.8	-177.1	176.9	0	110.9	C614 E615 L620 K621 N622	C614-K618 WeakPolarHBondContact O-CG 3.23Å; C614-K618 PolarHBondContact O-N 2.97Å; E615-K618 WeakPolarHBondContact O-CB 3.08Å; E615-K618 PolarHBondContact O-N 3.17Å; E615-K618 VanDerWaalsContact O-N 3.12Å; K618-L620 PolarHBondContact O-N 2.95Å; K618-K621 WeakPolarHBondContact O-CB 3.27Å; K618-K621 PolarHBondContact O-N 3.16Å; K618-K621 VanDerWaalsContact O-N 3.16Å; K618-N622 VanDerWaalsContact O-CG 3.27Å; K618-N622 PolarHBondContact O-N 3.26Å; K618-N622 PolarHBondContact O-OD1 2.93Å
619	N	84.2	Confident	86.2	Confident	20 Å²	20	53.8 Å²	53.8	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-38.5	-176.1	-65.8	-26.4	0	0	0	112.3	E615 V616 K621 N622 I623 L654 H1052	E615-N619 VanDerWaalsContact O-CG 3.3Å; E615-N619 PolarHBondContact O-N 3.01Å; E615-N619 PolarHBondContact O-ND2 3.32Å; V616-N619 PolarHBondContact O-N 3.4Å; N619-K621 VanDerWaalsContact C-N 3.34Å; N619-K621 PolarHBondContact O-N 3.36Å; N619-N622 PolarHBondContact O-N 3.29Å; N619-I623 WeakPolarHBondContact O-CG1 3.5Å; N619-I623 PolarHBondContact O-N 3.49Å; N619-L654 HydrophobicContact CB-CD1 3.46Å; N619-L654 VanDerWaalsContact CB-CD1 3.46Å; N619-H1052 PolarHBondContact ND2-CD2 3.1Å; N619-H1052 VanDerWaalsContact ND2-CD2 3.3Å
620	L	87.6	Confident	86.3	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-39.9	172.5	-73	169.6	0	0	0	112.5	V616 K618 G624 L628 L632 I636 E651 L654 L655	V616-L620 HydrophobicContact CG1-CD1 4.1Å; V616-L620 WeakPolarHBondContact O-CG 3.39Å; V616-L620 PolarHBondContact O-N 2.96Å; K618-L620 PolarHBondContact O-N 2.95Å; L620-G624 PolarHBondContact O-N 2.9Å; L620-L628 HydrophobicContact CB-CD1 3.66Å; L620-L628 HydrophobicContact CD1-CD1 4.12Å; L620-L632 HydrophobicContact CD1-CD1 4.41Å; L620-I636 HydrophobicContact CD1-CD1 3.4Å; L620-I636 VanDerWaalsContact CD1-CD1 3.4Å; L620-E651 HydrophobicContact CD2-CB 4.22Å; L620-E651 HydrophobicContact CD2-CG 4.02Å; L620-L654 HydrophobicContact CD1-CD2 4.48Å; L620-L654 HydrophobicContact CD2-CD2 3.98Å; L620-L654 HydrophobicContact CG-CD2 3.88Å; L620-L655 HydrophobicContact CD1-CD2 4.24Å
621	K	87.4	Confident	86.4	Confident	85 Å²	85	50.3 Å²	50.3	37%	0.37	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-41.7	172.3	-70.6	171.4	177.6	-175.9	0	112.3	I617 K618 N619 I623 G624 N625 G626 L628	I617-K621 WeakPolarHBondContact O-CG 3.19Å; I617-K621 PolarHBondContact O-N 3.07Å; K618-K621 WeakPolarHBondContact O-CB 3.27Å; K618-K621 PolarHBondContact O-N 3.16Å; K618-K621 VanDerWaalsContact O-N 3.16Å; N619-K621 VanDerWaalsContact C-N 3.34Å; N619-K621 PolarHBondContact O-N 3.36Å; K621-I623 VanDerWaalsContact C-N 3.34Å; K621-I623 PolarHBondContact O-N 3.33Å; K621-G624 CarbonylContact O-C 3.53Å; K621-G624 PolarHBondContact O-N 3.32Å; K621-N625 PolarHBondContact O-N 3.1Å; K621-N625 VanDerWaalsContact O-N 3.17Å; K621-G626 PolarHBondContact O-N 2.85Å; K621-L628 HydrophobicContact CG-CB 3.86Å; K621-L628 HydrophobicContact CG-CD2 4.19Å
622	N	82.4	Confident	86.7	Confident	77 Å²	77	42.4 Å²	42.4	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-42.4	179.7	-67.4	-13.3	0	0	0	111.1	K618 N619 R1025	K618-N622 VanDerWaalsContact O-CG 3.27Å; K618-N622 PolarHBondContact O-N 3.26Å; K618-N622 PolarHBondContact O-OD1 2.93Å; N619-N622 PolarHBondContact O-N 3.29Å; N622-R1025 PolarHBondContact O-NH1 3.28Å
623	I	80.5	Confident	86.9	Confident	31 Å²	31	45.2 Å²	45.2	16%	0.159	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-54.1	170.7	-68.8	164.3	0	0	0	109.7	N619 K621 N625 D650 L654 R1025	N619-I623 WeakPolarHBondContact O-CG1 3.5Å; N619-I623 PolarHBondContact O-N 3.49Å; K621-I623 VanDerWaalsContact C-N 3.34Å; K621-I623 PolarHBondContact O-N 3.33Å; I623-N625 PolarHBondContact O-N 2.63Å; I623-D650 HydrophobicContact CD1-CB 4.29Å; I623-D650 HydrophobicContact CG2-CB 3.58Å; I623-L654 HydrophobicContact CD1-CB 4.38Å; I623-L654 HydrophobicContact CD1-CD1 3.63Å; I623-R1025 PolarHBondContact O-NH2 2.83Å
624	G	78.8	Confident	86.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	18.1	-177.7	0	0	0	0	0	116.8	L620 K621 G626 N627	L620-G624 PolarHBondContact O-N 2.9Å; K621-G624 CarbonylContact O-C 3.53Å; K621-G624 PolarHBondContact O-N 3.32Å; G624-G626 PolarHBondContact O-N 2.85Å; G624-N627 WeakPolarHBondContact O-CB 3.39Å; G624-N627 PolarHBondContact O-N 3.17Å
625	N	77.5	Confident	87.2	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.374	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	36.3	179.1	-65.3	-39	0	0	0	113.8	K621 I623 N949 R1025	K621-N625 PolarHBondContact O-N 3.1Å; K621-N625 VanDerWaalsContact O-N 3.17Å; I623-N625 PolarHBondContact O-N 2.63Å; N625-N949 PolarHBondContact ND2-OD1 2.89Å; N625-R1025 PolarHBondContact OD1-NH1 3Å; N625-R1025 PolarHBondContact OD1-NH2 3.09Å
626	G	79.9	Confident	87.6	Confident	53 Å²	53	46.6 Å²	46.6	55%	0.546	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	100.8	-26.5	-175.3	0	0	0	0	0	113.8	K621 G624	K621-G626 PolarHBondContact O-N 2.85Å; G624-G626 PolarHBondContact O-N 2.85Å
627	N	84.7	Confident	87.9	Confident	60 Å²	60	47.7 Å²	47.7	32%	0.321	25%	0.247	S	C	.	.			trans	-78.3	151.8	-179.6	-67.3	-17.2	0	0	0	112.2	G624 W951	G624-N627 WeakPolarHBondContact O-CB 3.39Å; G624-N627 PolarHBondContact O-N 3.17Å; N627-W951 HydrophobicContact CB-CD2 3.89Å; N627-W951 HydrophobicContact CB-CE3 3.75Å; N627-W951 HydrophobicContact CB-CG 4.29Å; N627-W951 HydrophobicContact CB-CZ3 4.22Å
628	L	87.5	Confident	88	Confident	25 Å²	25	48 Å²	48	13%	0.131	25%	0.248	C	C	.	.			trans	-150	136	177.6	174.6	65.8	0	0	0	109	I617 L620 K621 L632 K633	I617-L628 HydrophobicContact CG2-CD2 3.88Å; L620-L628 HydrophobicContact CB-CD1 3.66Å; L620-L628 HydrophobicContact CD1-CD1 4.12Å; K621-L628 HydrophobicContact CG-CB 3.86Å; K621-L628 HydrophobicContact CG-CD2 4.19Å; L628-L632 HydrophobicContact CD1-CB 4.41Å; L628-K633 HydrophobicContact CD2-CB 3.77Å; L628-K633 HydrophobicContact CD2-CG 4.04Å; L628-K633 HydrophobicContact CG-CB 4.17Å
629	C	88	Confident	88.3	Confident	8 Å²	8	42.4 Å²	42.4	5%	0.054	22%	0.224	C	C	.	.			trans	-57.8	129.7	178.3	179.3	0	0	0	0	111.6	V631 L632 K633 Y642 W951	C629-V631 PolarHBondContact O-N 3.09Å; C629-L632 HydrophobicContact CB-CB 4.18Å; C629-L632 HydrophobicContact CB-CD1 4.19Å; C629-L632 HydrophobicContact CB-CG 4.13Å; C629-L632 PolarHBondContact O-N 3.12Å; C629-K633 WeakPolarHBondContact O-CB 3.4Å; C629-K633 PolarHBondContact O-N 2.8Å; C629-Y642 PolarHBondContact SG-OH 2.74Å; C629-W951 HydrophobicContact CB-CH2 4.33Å
630	P	90.1	Very high	88.8	Confident	85 Å²	85	41.5 Å²	41.5	55%	0.552	22%	0.219	S	C	*	.	H	α-helix	trans	-55.7	-33.5	178.6	-28.6	36	0	0	0	114.6	R634	P630-R634 WeakPolarHBondContact O-CD 3.34Å; P630-R634 WeakPolarHBondContact O-CG 3.48Å; P630-R634 PolarHBondContact O-N 2.64Å
631	V	92.8	Very high	89.3	Confident	16 Å²	16	41.3 Å²	41.3	10%	0.097	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-55.2	176.7	177.6	0	0	0	0	110.2	E595 C629 K633 R634 T635 Y642	E595-V631 HydrophobicContact CG-CG1 4Å; E595-V631 HydrophobicContact CG-CG2 4.4Å; C629-V631 PolarHBondContact O-N 3.09Å; V631-K633 PolarHBondContact O-N 3.5Å; V631-R634 WeakPolarHBondContact O-CA 3.37Å; V631-R634 WeakPolarHBondContact O-CB 3.5Å; V631-R634 PolarHBondContact O-N 2.71Å; V631-T635 HydrophobicContact CG1-CG2 4.02Å; V631-T635 WeakPolarHBondContact O-CG2 3.22Å; V631-T635 PolarHBondContact O-N 3.18Å; V631-Y642 HydrophobicContact CB-CE1 3.79Å; V631-Y642 HydrophobicContact CG1-CD1 3.77Å; V631-Y642 HydrophobicContact CG1-CE1 3.54Å
632	L	93.9	Very high	89.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-36.9	178.2	-67.2	-179.1	0	0	0	112.6	L620 L628 C629 R634 T635 I636 A641 Y642 L647 L655	L620-L632 HydrophobicContact CD1-CD1 4.41Å; L628-L632 HydrophobicContact CD1-CB 4.41Å; C629-L632 HydrophobicContact CB-CB 4.18Å; C629-L632 HydrophobicContact CB-CD1 4.19Å; C629-L632 HydrophobicContact CB-CG 4.13Å; C629-L632 PolarHBondContact O-N 3.12Å; L632-R634 PolarHBondContact O-N 2.8Å; L632-T635 PolarHBondContact O-N 3.38Å; L632-I636 HydrophobicContact CB-CD1 3.87Å; L632-I636 HydrophobicContact CB-CG1 4.45Å; L632-I636 HydrophobicContact CD2-CD1 4.31Å; L632-I636 WeakPolarHBondContact O-CB 3.43Å; L632-I636 VanDerWaalsContact O-CG1 3.3Å; L632-I636 WeakPolarHBondContact O-CG1 3.25Å; L632-I636 PolarHBondContact O-N 3.12Å; L632-I636 VanDerWaalsContact O-N 3.11Å; L632-A641 HydrophobicContact CD2-CB 4.07Å; L632-Y642 HydrophobicContact CD2-CD1 3.56Å; L632-Y642 HydrophobicContact CD2-CE1 3.46Å; L632-Y642 VanDerWaalsContact CD2-CE1 3.46Å; L632-Y642 HydrophobicContact CD2-CG 4.5Å; L632-Y642 HydrophobicContact CG-CD1 4.24Å; L632-Y642 HydrophobicContact CG-CE1 3.61Å; L632-L647 HydrophobicContact CD1-CD2 4.49Å; L632-L655 HydrophobicContact CD1-CD1 4.27Å; L632-L655 HydrophobicContact CD2-CD1 4.31Å
633	K	93.4	Very high	90.2	Very high	133 Å²	133	33.8 Å²	33.8	58%	0.578	18%	0.182	S	C	*	.	H	α-helix	trans	-59.1	-29.2	173.8	-174.4	180	174.9	-175.7	0	113.1	L628 C629 V631	L628-K633 HydrophobicContact CD2-CB 3.77Å; L628-K633 HydrophobicContact CD2-CG 4.04Å; L628-K633 HydrophobicContact CG-CB 4.17Å; C629-K633 WeakPolarHBondContact O-CB 3.4Å; C629-K633 PolarHBondContact O-N 2.8Å; V631-K633 PolarHBondContact O-N 3.5Å
634	R	93	Very high	90.7	Very high	153 Å²	153	32.8 Å²	32.8	58%	0.577	18%	0.176	S	C	*	.	H	α-helix	trans	-90.1	-37	178.1	-69.5	166.5	174.1	171.7	-0.7	112.9	E595 P630 V631 L632	E595-R634 WeakPolarHBondContact OE1-CD 3.42Å; E595-R634 IonicContact OE1-CZ 2.61Å; E595-R634 IonicContact OE1-NE 3.92Å; E595-R634 IonicContact OE1-NH1 2.74Å; E595-R634 PolarHBondContact OE1-NH1 2.78Å; E595-R634 IonicContact OE2-NH1 3.12Å; P630-R634 WeakPolarHBondContact O-CD 3.34Å; P630-R634 WeakPolarHBondContact O-CG 3.48Å; P630-R634 PolarHBondContact O-N 2.64Å; V631-R634 WeakPolarHBondContact O-CA 3.37Å; V631-R634 WeakPolarHBondContact O-CB 3.5Å; V631-R634 PolarHBondContact O-N 2.71Å; L632-R634 PolarHBondContact O-N 2.8Å
635	T	95.3	Very high	91.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-88.8	-38.5	-169.7	67.9	0	0	0	0	113.6	A594 V631 L632 P637 F638 V640	A594-T635 HydrophobicContact CB-CG2 3.94Å; V631-T635 HydrophobicContact CG1-CG2 4.02Å; V631-T635 WeakPolarHBondContact O-CG2 3.22Å; V631-T635 PolarHBondContact O-N 3.18Å; L632-T635 PolarHBondContact O-N 3.38Å; T635-P637 VanDerWaalsContact C-CD 3.43Å; T635-P637 VanDerWaalsContact C-N 3.35Å; T635-F638 PolarHBondContact O-N 2.9Å; T635-V640 CarbonylContact C-O 3.54Å; T635-V640 WeakPolarHBondContact CB-O 3.24Å; T635-V640 PolarHBondContact O-N 3.17Å; T635-V640 VanDerWaalsContact O-O 3.07Å; T635-V640 PolarHBondContact OG1-O 2.85Å
636	I	95.4	Very high	91.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-58.1	-37.1	-176.2	-67.2	172.3	0	0	0	113.3	K613 V616 I617 L620 L632 F638 G639 V640 A641 L655 L664	K613-I636 HydrophobicContact CB-CG2 4.4Å; V616-I636 HydrophobicContact CB-CG2 4.43Å; V616-I636 HydrophobicContact CG1-CD1 4.12Å; V616-I636 HydrophobicContact CG1-CG2 3.95Å; I617-I636 HydrophobicContact CD1-CB 4.2Å; I617-I636 HydrophobicContact CD1-CG2 3.97Å; I617-I636 HydrophobicContact CG1-CB 4.12Å; I617-I636 HydrophobicContact CG1-CG2 3.75Å; L620-I636 HydrophobicContact CD1-CD1 3.4Å; L620-I636 VanDerWaalsContact CD1-CD1 3.4Å; L632-I636 HydrophobicContact CB-CD1 3.87Å; L632-I636 HydrophobicContact CB-CG1 4.45Å; L632-I636 HydrophobicContact CD2-CD1 4.31Å; L632-I636 WeakPolarHBondContact O-CB 3.43Å; L632-I636 VanDerWaalsContact O-CG1 3.3Å; L632-I636 WeakPolarHBondContact O-CG1 3.25Å; L632-I636 PolarHBondContact O-N 3.12Å; L632-I636 VanDerWaalsContact O-N 3.11Å; I636-F638 PolarHBondContact O-N 3.41Å; I636-G639 PolarHBondContact O-N 3.11Å; I636-V640 WeakPolarHBondContact CA-O 3.4Å; I636-V640 PolarHBondContact N-O 3.43Å; I636-V640 VanDerWaalsContact N-O 3.14Å; I636-A641 HydrophobicContact CG1-CB 4.42Å; I636-L655 HydrophobicContact CD1-CD2 4.04Å; I636-L664 HydrophobicContact CG1-CD2 4.34Å; I636-L664 HydrophobicContact CG2-CD2 4.17Å
637	P	94.6	Very high	92.1	Very high	36 Å²	36	27.6 Å²	27.6	23%	0.234	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-54.8	-31.6	172.8	-28.6	37.7	0	0	0	114.2	L606 K613 I617 T635 G639	L606-P637 HydrophobicContact CD2-CB 3.6Å; K613-P637 WeakPolarHBondContact CD-O 3.33Å; K613-P637 WeakPolarHBondContact CE-O 3.46Å; K613-P637 PolarHBondContact NZ-O 3.11Å; I617-P637 HydrophobicContact CD1-CG 3.96Å; T635-P637 VanDerWaalsContact C-CD 3.43Å; T635-P637 VanDerWaalsContact C-N 3.35Å; P637-G639 VanDerWaalsContact C-N 3.34Å
638	F	93.6	Very high	92.4	Very high	34 Å²	34	25 Å²	25	15%	0.149	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-81.8	-10.5	175.6	-66.8	-91.5	0	0	0	113.5	C598 L601 L606 T635 I636 V640	C598-F638 HydrophobicContact CB-CD2 3.85Å; C598-F638 HydrophobicContact CB-CE2 4.18Å; C598-F638 HydrophobicContact CB-CG 4.26Å; L601-F638 HydrophobicContact CB-CD1 3.87Å; L601-F638 HydrophobicContact CB-CE1 4.32Å; L601-F638 HydrophobicContact CD1-CB 4.06Å; L601-F638 HydrophobicContact CD1-CD1 4.38Å; L606-F638 HydrophobicContact CD2-CD1 4.05Å; L606-F638 HydrophobicContact CD2-CD2 3.93Å; L606-F638 HydrophobicContact CD2-CE1 3.92Å; L606-F638 HydrophobicContact CD2-CE2 3.79Å; L606-F638 HydrophobicContact CD2-CG 4.06Å; L606-F638 HydrophobicContact CD2-CZ 3.78Å; L606-F638 HydrophobicContact CG-CD1 4.44Å; L606-F638 HydrophobicContact CG-CE1 4.13Å; L606-F638 HydrophobicContact CG-CZ 4.3Å; T635-F638 PolarHBondContact O-N 2.9Å; I636-F638 PolarHBondContact O-N 3.41Å; F638-V640 HydrophobicContact CB-CG2 4.25Å
639	G	93.7	Very high	92.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.01	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	14.4	-171.7	0	0	0	0	0	113.6	I636 P637 L664 C665 L666	I636-G639 PolarHBondContact O-N 3.11Å; P637-G639 VanDerWaalsContact C-N 3.34Å; G639-L664 CarbonylContact O-C 3.38Å; G639-L664 WeakPolarHBondContact O-CA 3.43Å; G639-C665 PolarHBondContact O-N 3.26Å; G639-C665 PolarHBondContact O-SG 2.98Å; G639-L666 PolarHBondContact O-N 3.32Å
640	V	95.9	Very high	92.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.3	-178	-179.7	0	0	0	0	109.9	A594 C598 L601 T635 I636 F638 L666	A594-V640 HydrophobicContact CB-CG1 4.11Å; C598-V640 VanDerWaalsContact SG-CB 3.6Å; L601-V640 HydrophobicContact CD1-CG2 3.85Å; T635-V640 CarbonylContact C-O 3.54Å; T635-V640 WeakPolarHBondContact CB-O 3.24Å; T635-V640 PolarHBondContact O-N 3.17Å; T635-V640 VanDerWaalsContact O-O 3.07Å; T635-V640 PolarHBondContact OG1-O 2.85Å; I636-V640 WeakPolarHBondContact CA-O 3.4Å; I636-V640 PolarHBondContact N-O 3.43Å; I636-V640 VanDerWaalsContact N-O 3.14Å; F638-V640 HydrophobicContact CB-CG2 4.25Å; V640-L666 HydrophobicContact CB-CD2 4.47Å; V640-L666 HydrophobicContact CG1-CB 4.46Å; V640-L666 HydrophobicContact CG1-CD2 3.9Å; V640-L666 HydrophobicContact CG1-CG 4.36Å; V640-L666 HydrophobicContact CG2-CB 4.17Å; V640-L666 HydrophobicContact CG2-CD2 3.9Å
641	A	96.4	Very high	92	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	175	167.5	0	0	0	0	0	110.7	L632 I636 L655 L664 L666 F667 T668	L632-A641 HydrophobicContact CD2-CB 4.07Å; I636-A641 HydrophobicContact CG1-CB 4.42Å; A641-L655 HydrophobicContact CB-CD2 3.96Å; A641-L664 HydrophobicContact CB-CD1 3.89Å; A641-L664 HydrophobicContact CB-CD2 4.44Å; A641-L666 PolarHBondContact N-O 2.97Å; A641-F667 HydrophobicContact CB-CD1 3.96Å; A641-F667 HydrophobicContact CB-CE1 3.92Å; A641-F667 WeakPolarHBondContact O-CA 3.41Å; A641-T668 PolarHBondContact O-N 3.14Å
642	Y	95.2	Very high	91.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	154.9	170.3	68.8	-84.6	0	0	0	110.3	E591 C629 V631 L632 H644 L647 T668	E591-Y642 HydrophobicContact CG-CD1 4.33Å; E591-Y642 HydrophobicContact CG-CD2 3.77Å; E591-Y642 HydrophobicContact CG-CE1 4.13Å; E591-Y642 HydrophobicContact CG-CE2 3.5Å; E591-Y642 HydrophobicContact CG-CG 4.14Å; E591-Y642 WeakPolarHBondContact OE1-CE2 3.45Å; E591-Y642 PolarHBondContact OE1-OH 3.27Å; C629-Y642 PolarHBondContact SG-OH 2.74Å; V631-Y642 HydrophobicContact CB-CE1 3.79Å; V631-Y642 HydrophobicContact CG1-CD1 3.77Å; V631-Y642 HydrophobicContact CG1-CE1 3.54Å; L632-Y642 HydrophobicContact CD2-CD1 3.56Å; L632-Y642 HydrophobicContact CD2-CE1 3.46Å; L632-Y642 VanDerWaalsContact CD2-CE1 3.46Å; L632-Y642 HydrophobicContact CD2-CG 4.5Å; L632-Y642 HydrophobicContact CG-CD1 4.24Å; L632-Y642 HydrophobicContact CG-CE1 3.61Å; Y642-H644 AromaticContact CD2-CD2 3.83Å; Y642-H644 AromaticContact CD2-CE1 3.97Å; Y642-H644 AromaticContact CD2-NE2 3.61Å; Y642-H644 AromaticContact CE2-CE1 3.5Å; Y642-H644 AromaticContact CE2-NE2 3.39Å; Y642-H644 WeakPolarHBondContact CE2-NE2 3.41Å; Y642-L647 HydrophobicContact CE2-CD1 4.41Å; Y642-L647 HydrophobicContact CE2-CD2 3.76Å; Y642-L647 HydrophobicContact CE2-CG 4.17Å; Y642-L647 WeakPolarHBondContact O-CD1 3.15Å; Y642-T668 CarbonylContact C-O 3.54Å; Y642-T668 WeakPolarHBondContact CA-O 3.48Å; Y642-T668 VanDerWaalsContact CB-OG1 3.24Å; Y642-T668 WeakPolarHBondContact CB-OG1 3.43Å
643	H	93.5	Very high	91.4	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.019	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	118.2	-178.2	-173.4	-61.8	0	0	0	111.4	E656 F667 T668 C669 T670 L673	H643-E656 IonicContact CD2-OE1 2.74Å; H643-E656 IonicContact CE1-OE1 3.4Å; H643-E656 IonicContact NE2-OE1 2.62Å; H643-E656 PolarHBondContact NE2-OE1 3.16Å; H643-F667 HydrophobicContact CB-CD1 4.44Å; H643-T668 PolarHBondContact N-O 3.41Å; H643-C669 HydrophobicContact CB-CB 4.22Å; H643-C669 WeakPolarHBondContact O-CA 3.43Å; H643-C669 WeakPolarHBondContact O-CB 3.49Å; H643-T670 PolarHBondContact O-N 3.38Å; H643-L673 HydrophobicContact CB-CD2 4.49Å
644	H	91.4	Very high	91.1	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.042	11%	0.106	C	C	.	.			trans	-161.4	165.6	175.8	60.3	36.1	0	0	0	111.5	K587 Y642 G646 L647 T670	K587-H644 HydrophobicContact CG-CB 4.24Å; K587-H644 PolarHBondContact O-CD2 3.32Å; Y642-H644 AromaticContact CD2-CD2 3.83Å; Y642-H644 AromaticContact CD2-CE1 3.97Å; Y642-H644 AromaticContact CD2-NE2 3.61Å; Y642-H644 AromaticContact CE2-CE1 3.5Å; Y642-H644 AromaticContact CE2-NE2 3.39Å; Y642-H644 WeakPolarHBondContact CE2-NE2 3.41Å; H644-G646 WeakPolarHBondContact ND1-CA 3.33Å; H644-G646 PolarHBondContact ND1-N 3.08Å; H644-G646 VanDerWaalsContact ND1-N 3.14Å; H644-G646 PolarHBondContact O-N 2.96Å; H644-L647 WeakPolarHBondContact O-CB 3.38Å; H644-L647 PolarHBondContact O-N 3Å; H644-T670 WeakPolarHBondContact CA-OG1 3.47Å; H644-T670 HydrophobicContact CB-CG2 4.05Å; H644-T670 WeakPolarHBondContact CB-OG1 3.34Å
645	S	86.6	Confident	91.1	Very high	10 Å²	10	15.2 Å²	15.2	7%	0.07	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-16.8	177.4	47.9	0	0	0	0	116.1	D110 K587 L647 G962	D110-S645 VanDerWaalsContact CG-OG 3.25Å; D110-S645 PolarHBondContact OD1-OG 3.46Å; D110-S645 WeakPolarHBondContact OD2-CB 3.01Å; D110-S645 PolarHBondContact OD2-OG 2.82Å; K587-S645 WeakPolarHBondContact CE-OG 3.12Å; K587-S645 PolarHBondContact NZ-OG 2.9Å; K587-S645 VanDerWaalsContact NZ-OG 3.13Å; S645-L647 PolarHBondContact O-N 2.88Å; S645-G962 WeakPolarHBondContact O-CA 3.5Å
646	G	89.6	Confident	90.8	Very high	5 Å²	5	16.5 Å²	16.5	5%	0.052	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.9	171.2	0	0	0	0	0	115.4	H644 G962	H644-G646 WeakPolarHBondContact ND1-CA 3.33Å; H644-G646 PolarHBondContact ND1-N 3.08Å; H644-G646 VanDerWaalsContact ND1-N 3.14Å; H644-G646 PolarHBondContact O-N 2.96Å; G646-G962 PolarHBondContact O-N 3.27Å
647	L	90.6	Very high	90.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-86.6	150.4	173	-62.1	179.9	0	0	0	110.6	L632 Y642 H644 S645 E651 R652 L655	L632-L647 HydrophobicContact CD1-CD2 4.49Å; Y642-L647 HydrophobicContact CE2-CD1 4.41Å; Y642-L647 HydrophobicContact CE2-CD2 3.76Å; Y642-L647 HydrophobicContact CE2-CG 4.17Å; Y642-L647 WeakPolarHBondContact O-CD1 3.15Å; H644-L647 WeakPolarHBondContact O-CB 3.38Å; H644-L647 PolarHBondContact O-N 3Å; S645-L647 PolarHBondContact O-N 2.88Å; L647-E651 HydrophobicContact CB-CB 4.4Å; L647-R652 HydrophobicContact CB-CG 3.81Å; L647-R652 HydrophobicContact CD1-CG 4.22Å; L647-R652 PolarHBondContact O-NE 2.86Å; L647-L655 HydrophobicContact CD1-CD1 3.86Å
648	T	89.3	Confident	90.1	Very high	6 Å²	6	17.9 Å²	17.9	4%	0.037	9%	0.089	C	C	.	.			trans	-66.1	160.6	170.1	63.4	0	0	0	0	111.5	D650 E651 R652 I950 R961	T648-D650 VanDerWaalsContact C-N 3.33Å; T648-D650 PolarHBondContact O-N 2.98Å; T648-E651 WeakPolarHBondContact CB-OE2 3.35Å; T648-E651 PolarHBondContact N-OE2 2.9Å; T648-E651 PolarHBondContact O-N 2.84Å; T648-E651 VanDerWaalsContact OG1-CG 3.24Å; T648-E651 WeakPolarHBondContact OG1-CG 3.34Å; T648-E651 PolarHBondContact OG1-N 3.12Å; T648-E651 PolarHBondContact OG1-OE2 3.19Å; T648-R652 WeakPolarHBondContact O-CG 3.43Å; T648-R652 PolarHBondContact O-N 3.29Å; T648-I950 HydrophobicContact CG2-CG2 4.41Å; T648-R961 HydrophobicContact CG2-CB 4.11Å; T648-R961 HydrophobicContact CG2-CG 4.01Å
649	S	84.4	Confident	90	Very high	36 Å²	36	16.5 Å²	16.5	25%	0.252	8%	0.083	S	C	.	.	H	α-helix	trans	-66.8	-34.5	-179.9	-54	0	0	0	0	112.3	R652 K653 Q965	S649-R652 PolarHBondContact O-N 3.42Å; S649-R652 PolarHBondContact OG-NH2 2.98Å; S649-K653 WeakPolarHBondContact O-CG 3.47Å; S649-K653 PolarHBondContact O-N 2.78Å; S649-Q965 PolarHBondContact OG-OE1 2.8Å
650	D	84.6	Confident	89.7	Confident	23 Å²	23	20.9 Å²	20.9	12%	0.123	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-47.2	172.8	-64.3	53.8	0	0	0	111.7	I623 T648 L654 L1020	I623-D650 HydrophobicContact CD1-CB 4.29Å; I623-D650 HydrophobicContact CG2-CB 3.58Å; T648-D650 VanDerWaalsContact C-N 3.33Å; T648-D650 PolarHBondContact O-N 2.98Å; D650-L654 WeakPolarHBondContact O-CB 3.29Å; D650-L654 PolarHBondContact O-N 2.98Å; D650-L1020 HydrophobicContact CB-CD1 4.36Å; D650-L1020 WeakPolarHBondContact OD2-CB 3.3Å
651	E	89.9	Confident	89.2	Confident	3 Å²	3	24.6 Å²	24.6	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-60.8	-45.8	174.6	-72.9	170.6	107.7	0	0	111.6	L620 L647 T648 L654 L655 R961	L620-E651 HydrophobicContact CD2-CB 4.22Å; L620-E651 HydrophobicContact CD2-CG 4.02Å; L647-E651 HydrophobicContact CB-CB 4.4Å; T648-E651 WeakPolarHBondContact CB-OE2 3.35Å; T648-E651 PolarHBondContact N-OE2 2.9Å; T648-E651 PolarHBondContact O-N 2.84Å; T648-E651 VanDerWaalsContact OG1-CG 3.24Å; T648-E651 WeakPolarHBondContact OG1-CG 3.34Å; T648-E651 PolarHBondContact OG1-N 3.12Å; T648-E651 PolarHBondContact OG1-OE2 3.19Å; E651-L654 PolarHBondContact O-N 3.24Å; E651-L655 WeakPolarHBondContact O-CB 3.28Å; E651-L655 VanDerWaalsContact O-CG 3.3Å; E651-L655 WeakPolarHBondContact O-CG 3.3Å; E651-L655 PolarHBondContact O-N 3.02Å; E651-R961 VanDerWaalsContact CD-NE 3.29Å; E651-R961 IonicContact OE1-CZ 3.67Å; E651-R961 VanDerWaalsContact OE1-CZ 3.27Å; E651-R961 IonicContact OE1-NE 3.67Å; E651-R961 PolarHBondContact OE1-NE 2.84Å; E651-R961 IonicContact OE1-NH2 2.73Å; E651-R961 PolarHBondContact OE1-NH2 3.05Å; E651-R961 IonicContact OE2-CZ 2.65Å; E651-R961 IonicContact OE2-NE 3.49Å; E651-R961 PolarHBondContact OE2-NE 3.05Å; E651-R961 IonicContact OE2-NH2 3.18Å
652	R	89.1	Confident	88.8	Confident	56 Å²	56	26.1 Å²	26.1	21%	0.211	15%	0.151	C	C	.	.	H	α-helix	trans	-59.4	-53.6	179.8	-76.9	-175.6	-71.5	158.2	-0.4	111.5	L647 T648 S649 L654 L655 E656	L647-R652 HydrophobicContact CB-CG 3.81Å; L647-R652 HydrophobicContact CD1-CG 4.22Å; L647-R652 PolarHBondContact O-NE 2.86Å; T648-R652 WeakPolarHBondContact O-CG 3.43Å; T648-R652 PolarHBondContact O-N 3.29Å; S649-R652 PolarHBondContact O-N 3.42Å; S649-R652 PolarHBondContact OG-NH2 2.98Å; R652-L654 VanDerWaalsContact C-N 3.29Å; R652-L654 PolarHBondContact O-N 3.48Å; R652-L655 PolarHBondContact O-N 3.46Å; R652-E656 WeakPolarHBondContact O-CB 3.2Å; R652-E656 WeakPolarHBondContact O-CG 3.39Å; R652-E656 PolarHBondContact O-N 3.1Å
653	K	84.8	Confident	88.6	Confident	70 Å²	70	26.6 Å²	26.6	30%	0.304	16%	0.155	S	C	.	.	H	α-helix	trans	-59.9	-36.7	179.8	-70.8	-171.3	-170.3	-178.9	0	113.2	S649 E656 E657 L1020	S649-K653 WeakPolarHBondContact O-CG 3.47Å; S649-K653 PolarHBondContact O-N 2.78Å; K653-E656 PolarHBondContact O-N 3.07Å; K653-E657 PolarHBondContact O-N 3.3Å; K653-L1020 HydrophobicContact CD-CD1 3.9Å
654	L	87.1	Confident	88.7	Confident	26 Å²	26	26.4 Å²	26.4	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-69.3	-43	177.6	-172.3	151.3	0	0	0	112.1	V616 N619 L620 I623 D650 E651 R652 E656 E657 A658	V616-L654 HydrophobicContact CB-CD2 4.47Å; V616-L654 HydrophobicContact CG1-CD2 3.82Å; N619-L654 HydrophobicContact CB-CD1 3.46Å; N619-L654 VanDerWaalsContact CB-CD1 3.46Å; L620-L654 HydrophobicContact CD1-CD2 4.48Å; L620-L654 HydrophobicContact CD2-CD2 3.98Å; L620-L654 HydrophobicContact CG-CD2 3.88Å; I623-L654 HydrophobicContact CD1-CB 4.38Å; I623-L654 HydrophobicContact CD1-CD1 3.63Å; D650-L654 WeakPolarHBondContact O-CB 3.29Å; D650-L654 PolarHBondContact O-N 2.98Å; E651-L654 PolarHBondContact O-N 3.24Å; R652-L654 VanDerWaalsContact C-N 3.29Å; R652-L654 PolarHBondContact O-N 3.48Å; L654-E656 VanDerWaalsContact C-N 3.34Å; L654-E657 PolarHBondContact O-N 2.67Å; L654-A658 WeakPolarHBondContact O-CB 3.28Å; L654-A658 PolarHBondContact O-N 2.96Å
655	L	91.8	Very high	88.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-42.5	173.6	-69.5	172.8	0	0	0	110.9	L620 L632 I636 A641 L647 E651 R652 E657 A658 Y659 L664 F667	L620-L655 HydrophobicContact CD1-CD2 4.24Å; L632-L655 HydrophobicContact CD1-CD1 4.27Å; L632-L655 HydrophobicContact CD2-CD1 4.31Å; I636-L655 HydrophobicContact CD1-CD2 4.04Å; A641-L655 HydrophobicContact CB-CD2 3.96Å; L647-L655 HydrophobicContact CD1-CD1 3.86Å; E651-L655 WeakPolarHBondContact O-CB 3.28Å; E651-L655 VanDerWaalsContact O-CG 3.3Å; E651-L655 WeakPolarHBondContact O-CG 3.3Å; E651-L655 PolarHBondContact O-N 3.02Å; R652-L655 PolarHBondContact O-N 3.46Å; L655-E657 PolarHBondContact O-N 2.95Å; L655-A658 PolarHBondContact O-N 3.31Å; L655-Y659 WeakPolarHBondContact O-CB 3.47Å; L655-Y659 PolarHBondContact O-N 3.12Å; L655-L664 HydrophobicContact CB-CD1 4.43Å; L655-L664 HydrophobicContact CD2-CD1 3.78Å; L655-F667 HydrophobicContact CB-CE1 3.99Å; L655-F667 HydrophobicContact CB-CZ 3.99Å; L655-F667 WeakPolarHBondContact O-CZ 3.28Å
656	E	89.3	Confident	89.2	Confident	28 Å²	28	25.8 Å²	25.8	13%	0.131	15%	0.15	C	C	.	.	H	α-helix	trans	-59.1	-43.5	176.5	-70.1	158.4	-163.3	0	0	112	H643 R652 K653 L654 Y659 S660 L679	H643-E656 IonicContact CD2-OE1 2.74Å; H643-E656 IonicContact CE1-OE1 3.4Å; H643-E656 IonicContact NE2-OE1 2.62Å; H643-E656 PolarHBondContact NE2-OE1 3.16Å; R652-E656 WeakPolarHBondContact O-CB 3.2Å; R652-E656 WeakPolarHBondContact O-CG 3.39Å; R652-E656 PolarHBondContact O-N 3.1Å; K653-E656 PolarHBondContact O-N 3.07Å; L654-E656 VanDerWaalsContact C-N 3.34Å; E656-Y659 PolarHBondContact O-N 2.91Å; E656-S660 WeakPolarHBondContact O-CB 3.48Å; E656-S660 PolarHBondContact O-N 3.28Å; E656-L679 HydrophobicContact CB-CD1 4Å; E656-L679 HydrophobicContact CG-CD1 3.83Å
657	E	86	Confident	89.5	Confident	59 Å²	59	25.6 Å²	25.6	28%	0.276	15%	0.148	S	C	.	.	H	α-helix	trans	-65.2	-43	173.3	-179.5	166.2	-146.5	0	0	111.9	K653 L654 L655 Y659 S660 T661 S1054 Q1057	K653-E657 PolarHBondContact O-N 3.3Å; L654-E657 PolarHBondContact O-N 2.67Å; L655-E657 PolarHBondContact O-N 2.95Å; E657-Y659 VanDerWaalsContact C-N 3.26Å; E657-Y659 PolarHBondContact O-N 3.32Å; E657-S660 PolarHBondContact O-N 2.84Å; E657-T661 HydrophobicContact CG-CG2 4.5Å; E657-T661 WeakPolarHBondContact O-CB 3.37Å; E657-T661 WeakPolarHBondContact O-CG2 3.23Å; E657-T661 PolarHBondContact O-N 3.38Å; E657-T661 PolarHBondContact O-OG1 2.92Å; E657-S1054 PolarHBondContact OE1-OG 3.16Å; E657-Q1057 VanDerWaalsContact OE1-CD 3.22Å; E657-Q1057 PolarHBondContact OE1-NE2 2.78Å; E657-Q1057 PolarHBondContact OE1-OE1 2.85Å; E657-Q1057 PolarHBondContact OE2-NE2 2.72Å
658	A	90.1	Very high	89.7	Confident	5 Å²	5	25.6 Å²	25.6	4%	0.041	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-28.9	176.5	0	0	0	0	0	112.9	V616 L654 L655 T661 G662 V663 L664	V616-A658 HydrophobicContact CG1-CB 4.48Å; V616-A658 HydrophobicContact CG2-CB 3.74Å; L654-A658 WeakPolarHBondContact O-CB 3.28Å; L654-A658 PolarHBondContact O-N 2.96Å; L655-A658 PolarHBondContact O-N 3.31Å; A658-T661 WeakPolarHBondContact CA-OG1 3.48Å; A658-T661 PolarHBondContact O-OG1 3.47Å; A658-G662 PolarHBondContact O-N 3.33Å; A658-V663 HydrophobicContact CB-CB 4.36Å; A658-V663 WeakPolarHBondContact O-CA 3.18Å; A658-V663 WeakPolarHBondContact O-CB 3.41Å; A658-V663 PolarHBondContact O-N 2.97Å; A658-L664 HydrophobicContact CB-CD1 3.83Å; A658-L664 HydrophobicContact CB-CG 3.93Å; A658-L664 PolarHBondContact O-N 3.42Å
659	Y	91.6	Very high	89.9	Confident	6 Å²	6	25.3 Å²	25.3	2%	0.024	15%	0.146	C	C	.	.	H	α-helix	trans	-78.1	-44.6	172.5	-172.4	-88.2	0	0	0	112.1	C580 L581 L655 E656 E657 T661 G662 L664 F667 L679 A681	C580-Y659 PolarHBondContact N-OH 2.82Å; C580-Y659 WeakPolarHBondContact O-CE2 3.42Å; C580-Y659 PolarHBondContact O-OH 3.1Å; L581-Y659 HydrophobicContact CD2-CE1 4.14Å; L581-Y659 HydrophobicContact CD2-CE2 4.11Å; L581-Y659 WeakPolarHBondContact CD2-OH 3.36Å; L655-Y659 WeakPolarHBondContact O-CB 3.47Å; L655-Y659 PolarHBondContact O-N 3.12Å; E656-Y659 PolarHBondContact O-N 2.91Å; E657-Y659 VanDerWaalsContact C-N 3.26Å; E657-Y659 PolarHBondContact O-N 3.32Å; Y659-T661 VanDerWaalsContact C-N 3.26Å; Y659-T661 PolarHBondContact O-N 3.37Å; Y659-G662 PolarHBondContact O-N 2.79Å; Y659-L664 HydrophobicContact CD2-CB 4.28Å; Y659-F667 VanDerWaalsContact CB-CE2 3.45Å; Y659-F667 HydrophobicContact CD1-CD2 4.29Å; Y659-F667 HydrophobicContact CD1-CE2 4.08Å; Y659-F667 HydrophobicContact CD2-CD1 4.31Å; Y659-F667 AromaticContact CD2-CD2 3.49Å; Y659-F667 HydrophobicContact CD2-CD2 3.49Å; Y659-F667 VanDerWaalsContact CD2-CD2 3.49Å; Y659-F667 HydrophobicContact CD2-CE1 4.39Å; Y659-F667 AromaticContact CD2-CE2 3.61Å; Y659-F667 HydrophobicContact CD2-CE2 3.61Å; Y659-F667 AromaticContact CD2-CG 3.88Å; Y659-F667 HydrophobicContact CD2-CG 3.88Å; Y659-F667 HydrophobicContact CD2-CZ 4.07Å; Y659-F667 HydrophobicContact CE2-CB 4.45Å; Y659-F667 AromaticContact CE2-CD2 3.8Å; Y659-F667 HydrophobicContact CE2-CD2 3.8Å; Y659-F667 HydrophobicContact CE2-CE2 4.34Å; Y659-F667 HydrophobicContact CE2-CG 4.1Å; Y659-F667 AromaticContact CG-CD2 3.76Å; Y659-F667 HydrophobicContact CG-CD2 3.76Å; Y659-F667 AromaticContact CG-CE2 3.44Å; Y659-F667 HydrophobicContact CG-CE2 3.44Å; Y659-F667 VanDerWaalsContact CG-CE2 3.44Å; Y659-F667 AromaticContact CG-CZ 3.99Å; Y659-F667 HydrophobicContact CG-CZ 3.99Å; Y659-L679 HydrophobicContact CD1-CD1 4.31Å; Y659-L679 HydrophobicContact CD1-CD2 4.37Å; Y659-A681 VanDerWaalsContact OH-CB 3.26Å; Y659-A681 WeakPolarHBondContact OH-CB 3.49Å
660	S	86.6	Confident	90.3	Very high	93 Å²	93	24 Å²	24	65%	0.65	14%	0.137	S	C	*	.	H	α-helix	trans	-61	-34.1	177.6	-173.8	0	0	0	0	112.6	E656 E657 G662	E656-S660 WeakPolarHBondContact O-CB 3.48Å; E656-S660 PolarHBondContact O-N 3.28Å; E657-S660 PolarHBondContact O-N 2.84Å; S660-G662 VanDerWaalsContact C-N 3.32Å
661	T	86.1	Confident	90.3	Very high	78 Å²	78	24.1 Å²	24.1	48%	0.479	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.1	173.7	52.8	0	0	0	0	114.2	K609 E657 A658 Y659 V663	K609-T661 PolarHBondContact NZ-O 2.81Å; E657-T661 HydrophobicContact CG-CG2 4.5Å; E657-T661 WeakPolarHBondContact O-CB 3.37Å; E657-T661 WeakPolarHBondContact O-CG2 3.23Å; E657-T661 PolarHBondContact O-N 3.38Å; E657-T661 PolarHBondContact O-OG1 2.92Å; A658-T661 WeakPolarHBondContact CA-OG1 3.48Å; A658-T661 PolarHBondContact O-OG1 3.47Å; Y659-T661 VanDerWaalsContact C-N 3.26Å; Y659-T661 PolarHBondContact O-N 3.37Å; T661-V663 VanDerWaalsContact C-N 3.29Å; T661-V663 PolarHBondContact O-N 3.03Å
662	G	88.3	Confident	89.8	Confident	31 Å²	31	26 Å²	26	32%	0.32	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	30.6	-180	0	0	0	0	0	114.1	K609 A658 Y659 S660	K609-G662 WeakPolarHBondContact CD-O 3.24Å; K609-G662 VanDerWaalsContact CE-O 3.3Å; K609-G662 WeakPolarHBondContact CE-O 3.36Å; K609-G662 PolarHBondContact NZ-O 2.92Å; K609-G662 VanDerWaalsContact NZ-O 3.07Å; A658-G662 PolarHBondContact O-N 3.33Å; Y659-G662 PolarHBondContact O-N 2.79Å; S660-G662 VanDerWaalsContact C-N 3.32Å
663	V	90.9	Very high	89.5	Confident	11 Å²	11	23.4 Å²	23.4	7%	0.067	14%	0.141	C	C	.	.	S	Bend	trans	-79	-40	166	-177.4	0	0	0	0	109.7	E612 K613 V616 A658 T661	E612-V663 HydrophobicContact CB-CB 4.4Å; E612-V663 HydrophobicContact CB-CG1 3.65Å; E612-V663 HydrophobicContact CB-CG2 3.84Å; E612-V663 HydrophobicContact CG-CG2 4.41Å; K613-V663 HydrophobicContact CG-CG1 3.8Å; V616-V663 HydrophobicContact CG2-CG1 4.18Å; A658-V663 HydrophobicContact CB-CB 4.36Å; A658-V663 WeakPolarHBondContact O-CA 3.18Å; A658-V663 WeakPolarHBondContact O-CB 3.41Å; A658-V663 PolarHBondContact O-N 2.97Å; T661-V663 VanDerWaalsContact C-N 3.29Å; T661-V663 PolarHBondContact O-N 3.03Å
664	L	93.8	Very high	88.9	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.13	C	C	.	.			trans	-95.7	134.9	163.5	-56.6	174.6	0	0	0	108.7	I636 G639 A641 L655 A658 Y659 F667	I636-L664 HydrophobicContact CG1-CD2 4.34Å; I636-L664 HydrophobicContact CG2-CD2 4.17Å; G639-L664 CarbonylContact O-C 3.38Å; G639-L664 WeakPolarHBondContact O-CA 3.43Å; A641-L664 HydrophobicContact CB-CD1 3.89Å; A641-L664 HydrophobicContact CB-CD2 4.44Å; L655-L664 HydrophobicContact CB-CD1 4.43Å; L655-L664 HydrophobicContact CD2-CD1 3.78Å; A658-L664 HydrophobicContact CB-CD1 3.83Å; A658-L664 HydrophobicContact CB-CG 3.93Å; A658-L664 PolarHBondContact O-N 3.42Å; Y659-L664 HydrophobicContact CD2-CB 4.28Å; L664-F667 HydrophobicContact CD1-CE1 3.92Å; L664-F667 HydrophobicContact CD1-CZ 4.43Å
665	C	93.5	Very high	88	Confident	6 Å²	6	20.2 Å²	20.2	4%	0.041	13%	0.132	C	C	.	.			trans	-106	-14.1	176.9	55.3	0	0	0	0	112.5	I575 S579 C580 G639	I575-C665 HydrophobicContact CB-CB 4.19Å; I575-C665 HydrophobicContact CG2-CB 3.85Å; S579-C665 CarbonylContact C-O 3.41Å; S579-C665 WeakPolarHBondContact CA-O 3.19Å; C580-C665 PolarHBondContact N-O 2.9Å; G639-C665 PolarHBondContact O-N 3.26Å; G639-C665 PolarHBondContact O-SG 2.98Å
666	L	95.4	Very high	86.8	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	132.1	-175.7	-175.1	68	0	0	0	112.3	V571 I575 C580 V582 I597 G639 V640 A641	V571-L666 HydrophobicContact CG1-CD1 4.1Å; V571-L666 HydrophobicContact CG1-CD2 3.69Å; V571-L666 HydrophobicContact CG2-CD1 4.2Å; I575-L666 HydrophobicContact CG2-CB 4.42Å; C580-L666 HydrophobicContact CB-CD1 3.73Å; C580-L666 WeakPolarHBondContact O-CA 3.49Å; V582-L666 HydrophobicContact CG2-CD1 3.86Å; I597-L666 HydrophobicContact CD1-CD2 3.84Å; I597-L666 HydrophobicContact CG2-CD2 3.99Å; G639-L666 PolarHBondContact O-N 3.32Å; V640-L666 HydrophobicContact CB-CD2 4.47Å; V640-L666 HydrophobicContact CG1-CB 4.46Å; V640-L666 HydrophobicContact CG1-CD2 3.9Å; V640-L666 HydrophobicContact CG1-CG 4.36Å; V640-L666 HydrophobicContact CG2-CB 4.17Å; V640-L666 HydrophobicContact CG2-CD2 3.9Å; A641-L666 PolarHBondContact N-O 2.97Å
667	F	95.6	Very high	86	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.7	159.4	-75.1	-42.6	0	0	0	111.8	C580 L581 V582 A641 H643 L655 Y659 L664 L673 L679	C580-F667 PolarHBondContact O-N 3.01Å; L581-F667 HydrophobicContact CD2-CB 3.87Å; L581-F667 HydrophobicContact CD2-CD2 3.81Å; L581-F667 HydrophobicContact CD2-CG 4.34Å; V582-F667 PolarHBondContact N-O 3.43Å; A641-F667 HydrophobicContact CB-CD1 3.96Å; A641-F667 HydrophobicContact CB-CE1 3.92Å; A641-F667 WeakPolarHBondContact O-CA 3.41Å; H643-F667 HydrophobicContact CB-CD1 4.44Å; L655-F667 HydrophobicContact CB-CE1 3.99Å; L655-F667 HydrophobicContact CB-CZ 3.99Å; L655-F667 WeakPolarHBondContact O-CZ 3.28Å; Y659-F667 VanDerWaalsContact CB-CE2 3.45Å; Y659-F667 HydrophobicContact CD1-CD2 4.29Å; Y659-F667 HydrophobicContact CD1-CE2 4.08Å; Y659-F667 HydrophobicContact CD2-CD1 4.31Å; Y659-F667 AromaticContact CD2-CD2 3.49Å; Y659-F667 HydrophobicContact CD2-CD2 3.49Å; Y659-F667 VanDerWaalsContact CD2-CD2 3.49Å; Y659-F667 HydrophobicContact CD2-CE1 4.39Å; Y659-F667 AromaticContact CD2-CE2 3.61Å; Y659-F667 HydrophobicContact CD2-CE2 3.61Å; Y659-F667 AromaticContact CD2-CG 3.88Å; Y659-F667 HydrophobicContact CD2-CG 3.88Å; Y659-F667 HydrophobicContact CD2-CZ 4.07Å; Y659-F667 HydrophobicContact CE2-CB 4.45Å; Y659-F667 AromaticContact CE2-CD2 3.8Å; Y659-F667 HydrophobicContact CE2-CD2 3.8Å; Y659-F667 HydrophobicContact CE2-CE2 4.34Å; Y659-F667 HydrophobicContact CE2-CG 4.1Å; Y659-F667 AromaticContact CG-CD2 3.76Å; Y659-F667 HydrophobicContact CG-CD2 3.76Å; Y659-F667 AromaticContact CG-CE2 3.44Å; Y659-F667 HydrophobicContact CG-CE2 3.44Å; Y659-F667 VanDerWaalsContact CG-CE2 3.44Å; Y659-F667 AromaticContact CG-CZ 3.99Å; Y659-F667 HydrophobicContact CG-CZ 3.99Å; L664-F667 HydrophobicContact CD1-CE1 3.92Å; L664-F667 HydrophobicContact CD1-CZ 4.43Å; F667-L673 HydrophobicContact CD2-CD2 4.19Å; F667-L679 HydrophobicContact CE2-CD1 3.93Å
668	T	95.6	Very high	85.6	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.1	154.5	59.1	0	0	0	0	108.8	V582 C590 V593 A594 A641 Y642 H643	V582-T668 HydrophobicContact CB-CG2 4.31Å; V582-T668 CarbonylContact O-C 3.47Å; V582-T668 WeakPolarHBondContact O-CA 3.32Å; C590-T668 WeakPolarHBondContact O-CB 3.46Å; C590-T668 PolarHBondContact O-OG1 3.46Å; V593-T668 HydrophobicContact CB-CG2 4.01Å; V593-T668 HydrophobicContact CG1-CG2 3.61Å; A594-T668 HydrophobicContact CB-CG2 4.31Å; A641-T668 PolarHBondContact O-N 3.14Å; Y642-T668 CarbonylContact C-O 3.54Å; Y642-T668 WeakPolarHBondContact CA-O 3.48Å; Y642-T668 VanDerWaalsContact CB-OG1 3.24Å; Y642-T668 WeakPolarHBondContact CB-OG1 3.43Å; H643-T668 PolarHBondContact N-O 3.41Å
669	C	94.3	Very high	85.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.2	-167.5	55.1	0	0	0	0	114.3	V582 F583 C584 H643 L673	V582-C669 PolarHBondContact O-N 3Å; F583-C669 CarbonylContact C-O 3.33Å; F583-C669 VanDerWaalsContact CA-O 3.29Å; F583-C669 WeakPolarHBondContact CA-O 3.37Å; C584-C669 PolarHBondContact N-O 3.37Å; H643-C669 HydrophobicContact CB-CB 4.22Å; H643-C669 WeakPolarHBondContact O-CA 3.43Å; H643-C669 WeakPolarHBondContact O-CB 3.49Å; C669-L673 HydrophobicContact CB-CB 4.06Å; C669-L673 HydrophobicContact CB-CD2 3.73Å
670	T	91.3	Very high	85.1	Confident	9 Å²	9	25.5 Å²	25.5	6%	0.055	17%	0.168	C	C	.	.			trans	-80.7	167.2	168.3	40.8	0	0	0	0	111.2	K587 H643 H644 T672 L673	K587-T670 HydrophobicContact CG-CG2 4.29Å; H643-T670 PolarHBondContact O-N 3.38Å; H644-T670 WeakPolarHBondContact CA-OG1 3.47Å; H644-T670 HydrophobicContact CB-CG2 4.05Å; H644-T670 WeakPolarHBondContact CB-OG1 3.34Å; T670-T672 PolarHBondContact O-N 3.37Å; T670-T672 PolarHBondContact OG1-OG1 3.38Å; T670-L673 PolarHBondContact O-N 3.17Å; T670-L673 VanDerWaalsContact O-N 3.08Å
671	S	85.2	Confident	85.3	Confident	26 Å²	26	21 Å²	21	18%	0.182	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-49.9	-25.3	172	52.8	0	0	0	0	113.8	L673 A674 V691	S671-L673 PolarHBondContact O-N 3.5Å; S671-A674 WeakPolarHBondContact O-CB 3.49Å; S671-A674 PolarHBondContact O-N 3.46Å; S671-V691 WeakPolarHBondContact OG-CG1 3.38Å
672	T	79.3	Confident	85.6	Confident	43 Å²	43	18.7 Å²	18.7	26%	0.264	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-56.5	-18.4	174.5	60.8	0	0	0	0	115.2	T670	T670-T672 PolarHBondContact O-N 3.37Å; T670-T672 PolarHBondContact OG1-OG1 3.38Å
673	L	83.1	Confident	86	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-88.6	-15	172.5	-172.3	61.6	0	0	0	112.7	L581 F583 H643 F667 C669 T670 S671 A675 L679 R707	L581-L673 HydrophobicContact CD2-CD2 4.18Å; F583-L673 HydrophobicContact CE1-CB 4.33Å; H643-L673 HydrophobicContact CB-CD2 4.49Å; F667-L673 HydrophobicContact CD2-CD2 4.19Å; C669-L673 HydrophobicContact CB-CB 4.06Å; C669-L673 HydrophobicContact CB-CD2 3.73Å; T670-L673 PolarHBondContact O-N 3.17Å; T670-L673 VanDerWaalsContact O-N 3.08Å; S671-L673 PolarHBondContact O-N 3.5Å; L673-A675 VanDerWaalsContact C-N 3.25Å; L673-A675 PolarHBondContact O-N 3.01Å; L673-L679 HydrophobicContact CD1-CD1 4.47Å; L673-R707 PolarHBondContact O-NE 2.95Å; L673-R707 PolarHBondContact O-NH1 3.39Å; L673-R707 PolarHBondContact O-NH2 3.33Å; L673-R707 VanDerWaalsContact O-NH2 3.15Å
674	A	72.9	Confident	86.2	Confident	9 Å²	9	17.4 Å²	17.4	7%	0.074	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.7	178.6	0	0	0	0	0	111.8	F583 S671 M704 R707	F583-A674 HydrophobicContact CE1-CB 4.08Å; F583-A674 HydrophobicContact CZ-CB 4.17Å; S671-A674 WeakPolarHBondContact O-CB 3.49Å; S671-A674 PolarHBondContact O-N 3.46Å; A674-M704 HydrophobicContact CB-CG 3.6Å; A674-R707 VanDerWaalsContact O-CZ 3.25Å; A674-R707 PolarHBondContact O-NE 2.91Å; A674-R707 PolarHBondContact O-NH2 3.45Å
675	A	67.9	Low	86.3	Confident	21 Å²	21	17.4 Å²	17.4	17%	0.174	10%	0.104	C	C	.	.	S	Bend	trans	-110.7	164.9	173.3	0	0	0	0	0	111.6	Y390 L673 V677	Y390-A675 HydrophobicContact CE2-CB 3.65Å; L673-A675 VanDerWaalsContact C-N 3.25Å; L673-A675 PolarHBondContact O-N 3.01Å; A675-V677 PolarHBondContact O-N 2.63Å
676	G	66.4	Low	86.4	Confident	10 Å²	10	17.3 Å²	17.3	10%	0.103	10%	0.103	C	C	.	.	S	Bend	trans	86.2	-20.9	164.5	0	0	0	0	0	119.2	A392 I393	A392-G676 VanDerWaalsContact CB-O 3.31Å; A392-G676 WeakPolarHBondContact CB-O 3.2Å; I393-G676 WeakPolarHBondContact CG1-O 3.5Å
677	V	72.9	Confident	86.2	Confident	31 Å²	31	19.6 Å²	19.6	19%	0.188	11%	0.112	C	C	.	.	S	Bend	trans	-140	137.3	178.6	-167.8	0	0	0	0	111.8	A392 A675 L679 R707	A392-V677 HydrophobicContact CB-CG2 4.39Å; A675-V677 PolarHBondContact O-N 2.63Å; V677-L679 HydrophobicContact CG1-CG 4.1Å; V677-L679 PolarHBondContact O-N 2.97Å; V677-L679 VanDerWaalsContact O-N 3.1Å; V677-R707 VanDerWaalsContact O-CZ 3.25Å; V677-R707 PolarHBondContact O-NH1 3.06Å; V677-R707 PolarHBondContact O-NH2 2.7Å
678	N	76.3	Confident	85.9	Confident	115 Å²	115	20.8 Å²	20.8	62%	0.615	12%	0.122	S	C	*	.			trans	-81.9	79.6	176.4	-173.5	16.3	0	0	0	112.9	E396	E396-N678 WeakPolarHBondContact OE2-CB 3.26Å
679	L	84.6	Confident	85.6	Confident	9 Å²	9	21 Å²	21	5%	0.047	12%	0.123	C	C	.	.			trans	-119.4	101.3	173.1	-73.9	-173.7	0	0	0	111.3	E656 Y659 F667 L673 V677 R707	E656-L679 HydrophobicContact CB-CD1 4Å; E656-L679 HydrophobicContact CG-CD1 3.83Å; Y659-L679 HydrophobicContact CD1-CD1 4.31Å; Y659-L679 HydrophobicContact CD1-CD2 4.37Å; F667-L679 HydrophobicContact CE2-CD1 3.93Å; L673-L679 HydrophobicContact CD1-CD1 4.47Å; V677-L679 HydrophobicContact CG1-CG 4.1Å; V677-L679 PolarHBondContact O-N 2.97Å; V677-L679 VanDerWaalsContact O-N 3.1Å; L679-R707 PolarHBondContact O-NH1 3.25Å; L679-R707 VanDerWaalsContact O-NH1 3.14Å
680	P	86.6	Confident	85.3	Confident	43 Å²	43	24.2 Å²	24.2	28%	0.279	14%	0.135	S	C	.	.			trans	-88.9	156.5	169.9	32.6	-30.8	0	0	0	112.8	R707 R710	P680-R707 CarbonylContact C-O 3.49Å; P680-R707 VanDerWaalsContact CA-O 3.24Å; P680-R707 WeakPolarHBondContact CA-O 3.38Å; P680-R710 HydrophobicContact CB-CG 3.97Å; P680-R710 HydrophobicContact CG-CB 4.48Å; P680-R710 HydrophobicContact CG-CG 4.05Å
681	A	91.8	Very high	84.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-142.3	157.3	-177.7	0	0	0	0	0	111.9	S579 L581 Y659 R707 A708 G709	S579-A681 WeakPolarHBondContact OG-CA 3.41Å; L581-A681 HydrophobicContact CD1-CB 4.09Å; L581-A681 HydrophobicContact CG-CB 3.77Å; Y659-A681 VanDerWaalsContact OH-CB 3.26Å; Y659-A681 WeakPolarHBondContact OH-CB 3.49Å; A681-R707 PolarHBondContact N-O 3.43Å; A681-A708 CarbonylContact O-C 3.5Å; A681-A708 VanDerWaalsContact O-CA 3.29Å; A681-A708 WeakPolarHBondContact O-CA 3.48Å; A681-G709 PolarHBondContact O-N 3.07Å
682	R	92.9	Very high	84.7	Confident	29 Å²	29	26.7 Å²	26.7	11%	0.109	16%	0.156	C	C	.	.	S	Bend	trans	-63.9	-46.2	176.8	173.5	64.8	-168.1	-155.6	5.8	111.3	V574 Y578 S579 D714 T715 I716 E718	V574-R682 HydrophobicContact CG1-CB 4.43Å; V574-R682 HydrophobicContact CG1-CG 4.43Å; Y578-R682 HydrophobicContact CD1-CB 4.08Å; Y578-R682 HydrophobicContact CD1-CG 3.86Å; Y578-R682 HydrophobicContact CG-CB 4.26Å; Y578-R682 HydrophobicContact CG-CG 4.01Å; S579-R682 WeakPolarHBondContact O-CB 3.49Å; S579-R682 PolarHBondContact O-N 2.85Å; R682-D714 WeakPolarHBondContact CA-OD2 3.11Å; R682-D714 WeakPolarHBondContact CD-OD1 3.31Å; R682-T715 PolarHBondContact NH1-OG1 3.23Å; R682-T715 VanDerWaalsContact NH1-OG1 3.08Å; R682-I716 VanDerWaalsContact CD-O 3.26Å; R682-I716 WeakPolarHBondContact CD-O 3.22Å; R682-I716 PolarHBondContact NE-O 3.14Å; R682-I716 VanDerWaalsContact NE-O 3.15Å; R682-I716 PolarHBondContact NH1-O 3.22Å; R682-I716 VanDerWaalsContact NH1-O 3.16Å; R682-E718 IonicContact CZ-OE1 2.63Å; R682-E718 IonicContact NE-OE1 3.68Å; R682-E718 PolarHBondContact NE-OE1 2.82Å; R682-E718 IonicContact NH2-OE1 3.76Å; R682-E718 PolarHBondContact NH2-OE1 3.03Å; R682-E718 PolarHBondContact O-N 3.27Å
683	R	95.1	Very high	84.9	Confident	15 Å²	15	33.7 Å²	33.7	6%	0.057	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.4	179.9	-172.8	179.1	-71.6	179.7	-6	112	L570 E573 V574 S579 C580 L581 I685 E718 I720	L570-R683 PolarHBondContact O-NH1 3.45Å; E573-R683 IonicContact OE2-CZ 3.17Å; E573-R683 IonicContact OE2-NH1 2.78Å; E573-R683 PolarHBondContact OE2-NH1 3.31Å; E573-R683 IonicContact OE2-NH2 2.71Å; E573-R683 PolarHBondContact OE2-NH2 2.7Å; V574-R683 HydrophobicContact CG1-CB 4.31Å; V574-R683 HydrophobicContact CG2-CB 3.99Å; V574-R683 HydrophobicContact CG2-CG 4.49Å; V574-R683 VanDerWaalsContact CG2-CZ 3.45Å; S579-R683 PolarHBondContact O-N 3.09Å; C580-R683 VanDerWaalsContact CA-O 3.23Å; C580-R683 WeakPolarHBondContact CA-O 3.38Å; C580-R683 PolarHBondContact SG-O 2.85Å; L581-R683 PolarHBondContact N-O 2.71Å; R683-I685 HydrophobicContact CG-CG1 4.12Å; R683-E718 CarbonylContact C-O 3.51Å; R683-E718 VanDerWaalsContact CA-O 3.3Å; R683-E718 WeakPolarHBondContact CA-O 3.32Å; R683-E718 HydrophobicContact CB-CB 4.32Å; R683-E718 HydrophobicContact CG-CB 4.06Å; R683-E718 IonicContact CZ-OE2 3.41Å; R683-E718 IonicContact NE-OE2 2.76Å; R683-E718 PolarHBondContact NE-OE2 3.18Å; R683-E718 IonicContact NH2-OE2 2.71Å; R683-E718 PolarHBondContact NH2-OE2 2.87Å; R683-I720 HydrophobicContact CG-CD1 4.44Å; R683-I720 HydrophobicContact CG-CG1 4.48Å
684	V	95.9	Very high	85	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.9	169.2	175.1	0	0	0	0	108.5	L581 F583 L686 R707 A708 E718 S719 I720	L581-V684 HydrophobicContact CB-CG2 4.42Å; L581-V684 HydrophobicContact CD1-CG2 4.39Å; L581-V684 CarbonylContact O-C 3.34Å; L581-V684 WeakPolarHBondContact O-CA 3.01Å; F583-V684 HydrophobicContact CD2-CG1 3.77Å; F583-V684 HydrophobicContact CE2-CG1 3.78Å; V684-L686 HydrophobicContact CG1-CD1 3.76Å; V684-R707 HydrophobicContact CG2-CB 4.17Å; V684-A708 HydrophobicContact CB-CB 4.25Å; V684-A708 HydrophobicContact CG2-CB 3.83Å; V684-E718 PolarHBondContact N-O 2.95Å; V684-S719 CarbonylContact O-C 3.6Å; V684-S719 VanDerWaalsContact O-CA 3.32Å; V684-S719 WeakPolarHBondContact O-CA 3.24Å; V684-I720 PolarHBondContact O-N 2.82Å
685	I	95.9	Very high	85.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.4	176.2	-54	177.4	0	0	0	108.2	L567 L570 V571 L581 V582 F583 R683 I720 I722	L567-I685 HydrophobicContact CD1-CD1 4.12Å; L567-I685 HydrophobicContact CD1-CG2 3.89Å; L570-I685 HydrophobicContact CB-CD1 3.78Å; L570-I685 HydrophobicContact CD1-CD1 4.49Å; V571-I685 HydrophobicContact CG2-CD1 4.02Å; L581-I685 PolarHBondContact O-N 2.84Å; V582-I685 CarbonylContact C-O 3.51Å; V582-I685 WeakPolarHBondContact CA-O 3.41Å; V582-I685 HydrophobicContact CG2-CB 4.25Å; V582-I685 HydrophobicContact CG2-CD1 4.33Å; F583-I685 PolarHBondContact N-O 2.76Å; R683-I685 HydrophobicContact CG-CG1 4.12Å; I685-I720 CarbonylContact C-O 3.54Å; I685-I720 VanDerWaalsContact CA-O 3.23Å; I685-I720 WeakPolarHBondContact CA-O 3.43Å; I685-I720 HydrophobicContact CG1-CB 4.49Å; I685-I722 HydrophobicContact CG2-CD1 4.12Å; I685-I722 HydrophobicContact CG2-CG1 4.31Å
686	L	95	Very high	86.6	Confident	3 Å²	3	40 Å²	40	2%	0.016	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.8	169.2	-79.5	64.8	0	0	0	107.3	F583 V684 A688 L696 Y701 M704 I705 I720 L721 I722	F583-L686 HydrophobicContact CB-CG 4.22Å; F583-L686 HydrophobicContact CD2-CD1 4.07Å; V684-L686 HydrophobicContact CG1-CD1 3.76Å; L686-A688 VanDerWaalsContact C-N 3.28Å; L686-A688 PolarHBondContact O-N 2.89Å; L686-L696 HydrophobicContact CD2-CD2 3.77Å; L686-Y701 HydrophobicContact CD2-CD2 3.8Å; L686-Y701 HydrophobicContact CD2-CE2 4.14Å; L686-M704 HydrophobicContact CD1-CB 4.29Å; L686-M704 HydrophobicContact CD2-SD 4Å; L686-M704 HydrophobicContact CG-SD 4.15Å; L686-I705 HydrophobicContact CD1-CG2 4.2Å; L686-I720 PolarHBondContact N-O 3.48Å; L686-L721 HydrophobicContact CB-CB 4.25Å; L686-L721 HydrophobicContact CB-CD1 3.55Å; L686-L721 HydrophobicContact CB-CG 4.48Å; L686-L721 HydrophobicContact CD2-CD1 4.2Å; L686-I722 PolarHBondContact O-N 2.7Å
687	R	91.9	Very high	87.5	Confident	49 Å²	49	44.3 Å²	44.3	19%	0.185	22%	0.223	C	C	.	.	S	Bend	trans	-68.3	-26.3	-175.8	-174.1	175.2	-178.6	-164.3	3.1	113.1	D565 F583 N589	D565-R687 IonicContact OD2-CZ 2.94Å; D565-R687 IonicContact OD2-NE 3.19Å; D565-R687 PolarHBondContact OD2-NE 3.01Å; D565-R687 IonicContact OD2-NH2 3.44Å; D565-R687 PolarHBondContact OD2-NH2 3.47Å; F583-R687 WeakPolarHBondContact O-CB 3.46Å; F583-R687 PolarHBondContact O-N 3.3Å; N589-R687 PolarHBondContact OD1-NH1 3.49Å
688	A	89.3	Confident	88	Confident	25 Å²	25	44.7 Å²	44.7	21%	0.207	22%	0.221	C	C	.	.	S	Bend	trans	-157.1	159.4	179.1	0	0	0	0	0	110.4	P585 L686 Y690	P585-A688 HydrophobicContact CG-CB 3.98Å; L686-A688 VanDerWaalsContact C-N 3.28Å; L686-A688 PolarHBondContact O-N 2.89Å; A688-Y690 HydrophobicContact CB-CD2 4.21Å; A688-Y690 PolarHBondContact O-N 2.77Å
689	P	89.9	Confident	88.2	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.019	20%	0.197	C	C	.	.	S	Bend	trans	-78.7	25.4	177.7	34	-36.7	0	0	0	114	F695 L696 L721 L723 D727 I731	P689-F695 HydrophobicContact CB-CD2 4.38Å; P689-F695 HydrophobicContact CB-CE2 3.92Å; P689-F695 HydrophobicContact CB-CZ 4.44Å; P689-F695 HydrophobicContact CG-CE2 4.28Å; P689-L696 WeakPolarHBondContact O-CD1 3.38Å; P689-L696 PolarHBondContact O-N 3.38Å; P689-L721 HydrophobicContact CB-CD1 4.45Å; P689-L723 HydrophobicContact CB-CD2 4.08Å; P689-L723 HydrophobicContact CG-CD2 4Å; P689-D727 HydrophobicContact CG-CB 3.96Å; P689-I731 HydrophobicContact CB-CD1 3.76Å; P689-I731 HydrophobicContact CB-CG1 3.88Å
690	Y	87.4	Confident	88.2	Confident	68 Å²	68	41.2 Å²	41.2	27%	0.267	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.2	-175	-55	-79.7	0	0	0	113.6	P585 A688 E694 F695 D727	P585-Y690 WeakPolarHBondContact CB-O 3.33Å; P585-Y690 WeakPolarHBondContact CG-O 3.43Å; A688-Y690 HydrophobicContact CB-CD2 4.21Å; A688-Y690 PolarHBondContact O-N 2.77Å; Y690-E694 CarbonylContact C-O 3.54Å; Y690-E694 WeakPolarHBondContact CA-O 3.4Å; Y690-E694 WeakPolarHBondContact CB-O 3.43Å; Y690-F695 HydrophobicContact CD1-CB 4.44Å; Y690-F695 HydrophobicContact CD1-CD2 4.29Å; Y690-F695 AromaticContact CE1-CD2 3.93Å; Y690-F695 HydrophobicContact CE1-CD2 3.93Å; Y690-D727 PolarHBondContact OH-OD1 3Å
691	V	82.3	Confident	88.3	Confident	17 Å²	17	39.2 Å²	39.2	10%	0.103	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.2	165	-179.8	0	0	0	0	107.5	S671 K693 E694 L696 M704	S671-V691 WeakPolarHBondContact OG-CG1 3.38Å; V691-K693 PolarHBondContact O-N 3.07Å; V691-E694 PolarHBondContact N-O 3.03Å; V691-E694 PolarHBondContact O-N 3.38Å; V691-L696 HydrophobicContact CG2-CD1 3.72Å; V691-L696 HydrophobicContact CG2-CG 4.02Å; V691-M704 HydrophobicContact CG2-CE 4.17Å
692	A	82.3	Confident	88.1	Confident	70 Å²	70	41.6 Å²	41.6	58%	0.579	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	-90.5	-165.5	0	0	0	0	0	113.1	P585	P585-A692 WeakPolarHBondContact O-CA 3.49Å; P585-A692 PolarHBondContact O-N 3.42Å
693	K	81.8	Confident	87.7	Confident	190 Å²	190	42 Å²	42	83%	0.826	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.7	-13.7	176.3	-62.8	175.7	-175.5	170.2	0	113.5	V691	V691-K693 PolarHBondContact O-N 3.07Å
694	E	84.9	Confident	87.5	Confident	98 Å²	98	41.5 Å²	41.5	46%	0.458	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	149.5	-178.3	-71	177.7	-135.9	0	0	111.1	M107 Y690 V691	M107-E694 WeakPolarHBondContact CE-OE2 3.43Å; M107-E694 WeakPolarHBondContact CG-OE1 3.4Å; Y690-E694 CarbonylContact C-O 3.54Å; Y690-E694 WeakPolarHBondContact CA-O 3.4Å; Y690-E694 WeakPolarHBondContact CB-O 3.43Å; V691-E694 PolarHBondContact N-O 3.03Å; V691-E694 PolarHBondContact O-N 3.38Å
695	F	88.7	Confident	87.3	Confident	57 Å²	57	41.6 Å²	41.6	25%	0.25	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	143.1	175.1	-167.7	-94.9	0	0	0	110.5	P689 Y690 K697 Q730 I731 L734	P689-F695 HydrophobicContact CB-CD2 4.38Å; P689-F695 HydrophobicContact CB-CE2 3.92Å; P689-F695 HydrophobicContact CB-CZ 4.44Å; P689-F695 HydrophobicContact CG-CE2 4.28Å; Y690-F695 HydrophobicContact CD1-CB 4.44Å; Y690-F695 HydrophobicContact CD1-CD2 4.29Å; Y690-F695 AromaticContact CE1-CD2 3.93Å; Y690-F695 HydrophobicContact CE1-CD2 3.93Å; F695-K697 PolarHBondContact O-N 3.08Å; F695-Q730 HydrophobicContact CE1-CB 4.18Å; F695-Q730 HydrophobicContact CE2-CB 3.79Å; F695-Q730 HydrophobicContact CZ-CB 3.42Å; F695-Q730 VanDerWaalsContact CZ-CB 3.42Å; F695-I731 HydrophobicContact CE1-CD1 3.99Å; F695-I731 HydrophobicContact CE2-CD1 4.25Å; F695-I731 HydrophobicContact CE2-CG1 4.29Å; F695-I731 HydrophobicContact CZ-CD1 3.48Å; F695-I731 VanDerWaalsContact CZ-CD1 3.48Å; F695-I731 HydrophobicContact CZ-CG1 3.72Å; F695-L734 HydrophobicContact CE1-CB 4.36Å; F695-L734 HydrophobicContact CE1-CD1 4.41Å; F695-L734 HydrophobicContact CE1-CD2 4.06Å
696	L	86.3	Confident	86.9	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.037	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-59.4	130.2	-177.1	-98	81.6	0	0	0	112.3	L686 P689 V691 Y701 M704 L734	L686-L696 HydrophobicContact CD2-CD2 3.77Å; P689-L696 WeakPolarHBondContact O-CD1 3.38Å; P689-L696 PolarHBondContact O-N 3.38Å; V691-L696 HydrophobicContact CG2-CD1 3.72Å; V691-L696 HydrophobicContact CG2-CG 4.02Å; L696-Y701 HydrophobicContact CD2-CD2 4.41Å; L696-M704 HydrophobicContact CD2-CE 4.01Å; L696-M704 HydrophobicContact CD2-SD 3.91Å; L696-L734 HydrophobicContact CB-CD2 4.3Å; L696-L734 VanDerWaalsContact O-CD1 3.27Å; L696-L734 WeakPolarHBondContact O-CD1 3.45Å; L696-L734 WeakPolarHBondContact O-CD2 3.36Å
697	K	85.6	Confident	86.6	Confident	102 Å²	102	42.9 Å²	42.9	44%	0.443	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-71.9	152.8	165.7	-65.4	-170.3	179.3	-172.9	0	111	F695 N699 Q700 Y701	F695-K697 PolarHBondContact O-N 3.08Å; K697-N699 VanDerWaalsContact C-N 3.29Å; K697-N699 PolarHBondContact O-N 3.44Å; K697-Q700 HydrophobicContact CB-CG 4.22Å; K697-Q700 WeakPolarHBondContact O-CB 3.44Å; K697-Q700 PolarHBondContact O-N 3.16Å; K697-Q700 VanDerWaalsContact O-N 3.16Å; K697-Y701 PolarHBondContact O-N 3.32Å
698	R	83.9	Confident	86.5	Confident	39 Å²	39	40.6 Å²	40.6	15%	0.147	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-37.4	-173.7	-176.6	179.4	165.6	88.7	-14.8	111.9	Y701 K702 L734 I735 R737 P738 L739 E740	R698-Y701 PolarHBondContact O-N 3.42Å; R698-K702 PolarHBondContact O-N 2.87Å; R698-L734 HydrophobicContact CB-CD1 3.95Å; R698-L734 HydrophobicContact CB-CG 4.42Å; R698-L734 PolarHBondContact NH1-O 3.11Å; R698-I735 PolarHBondContact NH1-O 3.14Å; R698-R737 VanDerWaalsContact CD-O 3.23Å; R698-R737 WeakPolarHBondContact CD-O 3.49Å; R698-R737 PolarHBondContact NE-O 2.96Å; R698-R737 PolarHBondContact NH1-O 3.28Å; R698-R737 VanDerWaalsContact NH1-O 3.15Å; R698-R737 PolarHBondContact NH2-O 2.89Å; R698-P738 WeakPolarHBondContact CD-O 3.24Å; R698-L739 HydrophobicContact CG-CD2 4.04Å; R698-E740 PolarHBondContact N-OE1 3.37Å
699	N	80.4	Confident	86.4	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.102	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-46.7	177	-63.6	-1.6	0	0	0	110.8	K697 Y701 K702 Q703 L739	K697-N699 VanDerWaalsContact C-N 3.29Å; K697-N699 PolarHBondContact O-N 3.44Å; N699-Y701 PolarHBondContact O-N 3.41Å; N699-K702 PolarHBondContact O-N 3.04Å; N699-Q703 WeakPolarHBondContact O-CB 3.47Å; N699-Q703 VanDerWaalsContact O-CG 3.32Å; N699-Q703 WeakPolarHBondContact O-CG 3.4Å; N699-Q703 PolarHBondContact O-N 2.77Å; N699-L739 WeakPolarHBondContact OD1-CD2 3.17Å
700	Q	84.4	Confident	86.1	Confident	32 Å²	32	41.6 Å²	41.6	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-44.2	177.1	-64.2	172.2	-21.5	0	0	111.9	K697 Q703 M704	K697-Q700 HydrophobicContact CB-CG 4.22Å; K697-Q700 WeakPolarHBondContact O-CB 3.44Å; K697-Q700 PolarHBondContact O-N 3.16Å; K697-Q700 VanDerWaalsContact O-N 3.16Å; Q700-Q703 PolarHBondContact O-N 3.49Å; Q700-M704 WeakPolarHBondContact O-CG 3.41Å; Q700-M704 PolarHBondContact O-N 3.06Å
701	Y	88.8	Confident	85.7	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-50.6	174.9	174	-110.5	0	0	0	111.4	E526 L686 L696 K697 R698 N699 Q703 M704 I705 L721 I735	E526-Y701 WeakPolarHBondContact OE2-CE1 3.26Å; E526-Y701 PolarHBondContact OE2-OH 2.92Å; L686-Y701 HydrophobicContact CD2-CD2 3.8Å; L686-Y701 HydrophobicContact CD2-CE2 4.14Å; L696-Y701 HydrophobicContact CD2-CD2 4.41Å; K697-Y701 PolarHBondContact O-N 3.32Å; R698-Y701 PolarHBondContact O-N 3.42Å; N699-Y701 PolarHBondContact O-N 3.41Å; Y701-Q703 PolarHBondContact O-N 3.02Å; Y701-M704 PolarHBondContact O-N 3.4Å; Y701-I705 HydrophobicContact CD1-CD1 4.21Å; Y701-I705 HydrophobicContact CD2-CG2 4.11Å; Y701-I705 HydrophobicContact CE1-CD1 3.63Å; Y701-I705 HydrophobicContact CE2-CD1 4.36Å; Y701-I705 HydrophobicContact CE2-CG2 3.7Å; Y701-I705 WeakPolarHBondContact O-CG2 3.45Å; Y701-I705 PolarHBondContact O-N 3.06Å; Y701-I705 VanDerWaalsContact O-N 3.11Å; Y701-L721 HydrophobicContact CE2-CD2 4.03Å; Y701-I735 HydrophobicContact CE1-CG1 4.07Å
702	K	86.8	Confident	85.4	Confident	50 Å²	50	43.9 Å²	43.9	22%	0.217	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-31.5	179.1	-67.5	-52.8	-169.3	-176.1	0	113.4	T499 E526 R698 N699 I705 G706	T499-K702 HydrophobicContact CG2-CB 4.42Å; E526-K702 IonicContact OE1-NZ 3.84Å; E526-K702 PolarHBondContact OE1-NZ 3.4Å; E526-K702 IonicContact OE2-NZ 2.79Å; E526-K702 PolarHBondContact OE2-NZ 2.99Å; R698-K702 PolarHBondContact O-N 2.87Å; N699-K702 PolarHBondContact O-N 3.04Å; K702-I705 HydrophobicContact CD-CD1 3.56Å; K702-I705 HydrophobicContact CD-CG1 4.23Å; K702-G706 WeakPolarHBondContact O-CA 3.33Å; K702-G706 PolarHBondContact O-N 3.06Å
703	Q	86.2	Confident	85.4	Confident	36 Å²	36	46.1 Å²	46.1	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-43.5	170.6	-74.5	174.2	3.6	0	0	112.4	H466 N699 Q700 Y701	H466-Q703 PolarHBondContact NE2-NE2 3.38Å; N699-Q703 WeakPolarHBondContact O-CB 3.47Å; N699-Q703 VanDerWaalsContact O-CG 3.32Å; N699-Q703 WeakPolarHBondContact O-CG 3.4Å; N699-Q703 PolarHBondContact O-N 2.77Å; Q700-Q703 PolarHBondContact O-N 3.49Å; Y701-Q703 PolarHBondContact O-N 3.02Å
704	M	89.9	Confident	85.5	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-52.7	178.8	-72	-179	-158	0	0	112.1	F583 A674 L686 V691 L696 Q700 Y701 G706 R707	F583-M704 HydrophobicContact CB-SD 4.21Å; F583-M704 HydrophobicContact CD1-CG 4.28Å; F583-M704 HydrophobicContact CD1-SD 4.07Å; F583-M704 HydrophobicContact CD2-CB 4.06Å; F583-M704 HydrophobicContact CD2-CG 4.1Å; F583-M704 HydrophobicContact CD2-SD 4.15Å; F583-M704 HydrophobicContact CE1-CG 4.14Å; F583-M704 HydrophobicContact CE2-CB 3.81Å; F583-M704 HydrophobicContact CE2-CG 3.95Å; F583-M704 HydrophobicContact CG-CG 4.27Å; F583-M704 HydrophobicContact CG-SD 3.88Å; F583-M704 HydrophobicContact CZ-CB 4.24Å; F583-M704 HydrophobicContact CZ-CG 3.98Å; A674-M704 HydrophobicContact CB-CG 3.6Å; L686-M704 HydrophobicContact CD1-CB 4.29Å; L686-M704 HydrophobicContact CD2-SD 4Å; L686-M704 HydrophobicContact CG-SD 4.15Å; V691-M704 HydrophobicContact CG2-CE 4.17Å; L696-M704 HydrophobicContact CD2-CE 4.01Å; L696-M704 HydrophobicContact CD2-SD 3.91Å; Q700-M704 WeakPolarHBondContact O-CG 3.41Å; Q700-M704 PolarHBondContact O-N 3.06Å; Y701-M704 PolarHBondContact O-N 3.4Å; M704-G706 VanDerWaalsContact C-N 3.27Å; M704-G706 PolarHBondContact O-N 3.49Å; M704-R707 WeakPolarHBondContact O-CB 3.32Å; M704-R707 PolarHBondContact O-N 2.73Å
705	I	90.9	Very high	85.5	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-74.8	-19.2	-177.2	76.9	-177	0	0	0	112.5	R520 L524 E526 L686 Y701 K702 R707 A708 S719	R520-I705 PolarHBondContact NH2-O 3.08Å; L524-I705 HydrophobicContact CD2-CB 4.34Å; L524-I705 HydrophobicContact CD2-CD1 3.99Å; L524-I705 HydrophobicContact CD2-CG1 3.85Å; E526-I705 HydrophobicContact CG-CD1 3.94Å; E526-I705 WeakPolarHBondContact OE1-CD1 3.35Å; E526-I705 WeakPolarHBondContact OE2-CD1 3.35Å; L686-I705 HydrophobicContact CD1-CG2 4.2Å; Y701-I705 HydrophobicContact CD1-CD1 4.21Å; Y701-I705 HydrophobicContact CD2-CG2 4.11Å; Y701-I705 HydrophobicContact CE1-CD1 3.63Å; Y701-I705 HydrophobicContact CE2-CD1 4.36Å; Y701-I705 HydrophobicContact CE2-CG2 3.7Å; Y701-I705 WeakPolarHBondContact O-CG2 3.45Å; Y701-I705 PolarHBondContact O-N 3.06Å; Y701-I705 VanDerWaalsContact O-N 3.11Å; K702-I705 HydrophobicContact CD-CD1 3.56Å; K702-I705 HydrophobicContact CD-CG1 4.23Å; I705-R707 PolarHBondContact O-N 2.86Å; I705-A708 PolarHBondContact O-N 2.96Å; I705-A708 VanDerWaalsContact O-N 3.09Å; I705-S719 WeakPolarHBondContact CG2-OG 3.48Å
706	G	87.4	Confident	85.5	Confident	6 Å²	6	37.8 Å²	37.8	6%	0.062	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-10.1	170.8	0	0	0	0	0	114.2	R520 K702 M704	R520-G706 PolarHBondContact NH2-O 3.14Å; K702-G706 WeakPolarHBondContact O-CA 3.33Å; K702-G706 PolarHBondContact O-N 3.06Å; M704-G706 VanDerWaalsContact C-N 3.27Å; M704-G706 PolarHBondContact O-N 3.49Å
707	R	88.6	Confident	85.8	Confident	25 Å²	25	37.5 Å²	37.5	9%	0.094	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.2	176.9	-63.8	172.4	168.4	-84.4	-7.6	114.3	L581 L673 A674 V677 L679 P680 A681 V684 M704 I705	L581-R707 HydrophobicContact CD1-CB 4.31Å; L673-R707 PolarHBondContact O-NE 2.95Å; L673-R707 PolarHBondContact O-NH1 3.39Å; L673-R707 PolarHBondContact O-NH2 3.33Å; L673-R707 VanDerWaalsContact O-NH2 3.15Å; A674-R707 VanDerWaalsContact O-CZ 3.25Å; A674-R707 PolarHBondContact O-NE 2.91Å; A674-R707 PolarHBondContact O-NH2 3.45Å; V677-R707 VanDerWaalsContact O-CZ 3.25Å; V677-R707 PolarHBondContact O-NH1 3.06Å; V677-R707 PolarHBondContact O-NH2 2.7Å; L679-R707 PolarHBondContact O-NH1 3.25Å; L679-R707 VanDerWaalsContact O-NH1 3.14Å; P680-R707 CarbonylContact C-O 3.49Å; P680-R707 VanDerWaalsContact CA-O 3.24Å; P680-R707 WeakPolarHBondContact CA-O 3.38Å; A681-R707 PolarHBondContact N-O 3.43Å; V684-R707 HydrophobicContact CG2-CB 4.17Å; M704-R707 WeakPolarHBondContact O-CB 3.32Å; M704-R707 PolarHBondContact O-N 2.73Å; I705-R707 PolarHBondContact O-N 2.86Å
708	A	90.8	Very high	86.3	Confident	1 Å²	1	34 Å²	34	1%	0.008	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-75.9	137.9	174.9	0	0	0	0	0	111.4	R520 L524 A681 V684 I705 E718	R520-A708 PolarHBondContact NH2-O 2.72Å; L524-A708 HydrophobicContact CD1-CB 3.71Å; A681-A708 CarbonylContact O-C 3.5Å; A681-A708 VanDerWaalsContact O-CA 3.29Å; A681-A708 WeakPolarHBondContact O-CA 3.48Å; V684-A708 HydrophobicContact CB-CB 4.25Å; V684-A708 HydrophobicContact CG2-CB 3.83Å; I705-A708 PolarHBondContact O-N 2.96Å; I705-A708 VanDerWaalsContact O-N 3.09Å; A708-E718 WeakPolarHBondContact CB-O 3.27Å
709	G	87.7	Confident	86.8	Confident	2 Å²	2	32.2 Å²	32.2	2%	0.021	19%	0.192	C	C	.	.	S	Bend	trans	86.2	108.7	-176.1	0	0	0	0	0	113	A681 A711 G717	A681-G709 PolarHBondContact O-N 3.07Å; G709-A711 PolarHBondContact O-N 3.08Å; G709-G717 VanDerWaalsContact N-CA 3.31Å
710	R	82.3	Confident	87.5	Confident	47 Å²	47	31.4 Å²	31.4	18%	0.177	19%	0.188	C	C	.	.			trans	-83.7	109.6	172.7	-59.4	171.5	-66.8	167.5	7.9	110	P680 G712 I713 D714	P680-R710 HydrophobicContact CB-CG 3.97Å; P680-R710 HydrophobicContact CG-CB 4.48Å; P680-R710 HydrophobicContact CG-CG 4.05Å; R710-G712 PolarHBondContact O-N 2.75Å; R710-I713 HydrophobicContact CB-CB 4.08Å; R710-I713 HydrophobicContact CB-CD1 4.39Å; R710-I713 PolarHBondContact O-N 2.87Å; R710-D714 WeakPolarHBondContact CB-OD2 3.34Å; R710-D714 WeakPolarHBondContact CG-OD2 3.3Å; R710-D714 IonicContact CZ-OD1 2.71Å; R710-D714 IonicContact CZ-OD2 3.87Å; R710-D714 PolarHBondContact N-OD2 3.45Å; R710-D714 IonicContact NE-OD1 3.19Å; R710-D714 PolarHBondContact NE-OD1 2.97Å; R710-D714 IonicContact NE-OD2 2.68Å; R710-D714 PolarHBondContact NE-OD2 3.27Å; R710-D714 IonicContact NH2-OD1 3.88Å; R710-D714 PolarHBondContact NH2-OD1 2.67Å; R710-D714 IonicContact NH2-OD2 2.76Å; R710-D714 PolarHBondContact O-N 2.98Å
711	A	79.7	Confident	88	Confident	48 Å²	48	30 Å²	30	40%	0.397	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	130.8	178.2	0	0	0	0	0	112	P521 V522 G709 I713	P521-A711 HydrophobicContact CB-CB 3.99Å; P521-A711 HydrophobicContact CG-CB 4.36Å; V522-A711 HydrophobicContact CG2-CB 4.49Å; G709-A711 PolarHBondContact O-N 3.08Å; A711-I713 VanDerWaalsContact C-N 3.27Å; A711-I713 PolarHBondContact O-N 2.7Å
712	G	76.4	Confident	88.2	Confident	85 Å²	85	30.4 Å²	30.4	88%	0.876	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	1.9	-177.5	0	0	0	0	0	115.8	R710	R710-G712 PolarHBondContact O-N 2.75Å
713	I	80.8	Confident	88.3	Confident	117 Å²	117	28.4 Å²	28.4	60%	0.6	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129	-49.3	179.4	-54.2	175.5	0	0	0	111.4	R710 A711	R710-I713 HydrophobicContact CB-CB 4.08Å; R710-I713 HydrophobicContact CB-CD1 4.39Å; R710-I713 PolarHBondContact O-N 2.87Å; A711-I713 VanDerWaalsContact C-N 3.27Å; A711-I713 PolarHBondContact O-N 2.7Å
714	D	84.9	Confident	88.4	Confident	9 Å²	9	31.9 Å²	31.9	5%	0.048	19%	0.192	C	C	.	.			trans	-96.2	138.3	-178.8	-63.1	-42.6	0	0	0	111.6	V522 R682 R710	V522-D714 WeakPolarHBondContact CG1-O 3.5Å; V522-D714 WeakPolarHBondContact CG2-O 3.14Å; R682-D714 WeakPolarHBondContact CA-OD2 3.11Å; R682-D714 WeakPolarHBondContact CD-OD1 3.31Å; R710-D714 WeakPolarHBondContact CB-OD2 3.34Å; R710-D714 WeakPolarHBondContact CG-OD2 3.3Å; R710-D714 IonicContact CZ-OD1 2.71Å; R710-D714 IonicContact CZ-OD2 3.87Å; R710-D714 PolarHBondContact N-OD2 3.45Å; R710-D714 IonicContact NE-OD1 3.19Å; R710-D714 PolarHBondContact NE-OD1 2.97Å; R710-D714 IonicContact NE-OD2 2.68Å; R710-D714 PolarHBondContact NE-OD2 3.27Å; R710-D714 IonicContact NH2-OD1 3.88Å; R710-D714 PolarHBondContact NH2-OD1 2.67Å; R710-D714 IonicContact NH2-OD2 2.76Å; R710-D714 PolarHBondContact O-N 2.98Å
715	T	85.3	Confident	88.1	Confident	115 Å²	115	37.1 Å²	37.1	71%	0.706	22%	0.216	S	C	*	.	S	Bend	trans	-73	-32.5	172.5	47.9	0	0	0	0	113.7	R682	R682-T715 PolarHBondContact NH1-OG1 3.23Å; R682-T715 VanDerWaalsContact NH1-OG1 3.08Å
716	I	88.6	Confident	88	Confident	46 Å²	46	43.2 Å²	43.2	24%	0.236	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	142.5	-176.1	-56.1	175.3	0	0	0	107.2	K525 R682 E718	K525-I716 HydrophobicContact CB-CG2 4.48Å; K525-I716 HydrophobicContact CD-CG2 4.08Å; K525-I716 HydrophobicContact CG-CG2 4.02Å; R682-I716 VanDerWaalsContact CD-O 3.26Å; R682-I716 WeakPolarHBondContact CD-O 3.22Å; R682-I716 PolarHBondContact NE-O 3.14Å; R682-I716 VanDerWaalsContact NE-O 3.15Å; R682-I716 PolarHBondContact NH1-O 3.22Å; R682-I716 VanDerWaalsContact NH1-O 3.16Å; I716-E718 HydrophobicContact CG2-CG 4.44Å
717	G	92.9	Very high	88	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.3	165.1	0	0	0	0	0	110.5	E523 L524 K525 G709	E523-G717 PolarHBondContact O-N 3.26Å; L524-G717 WeakPolarHBondContact CA-O 3.46Å; K525-G717 PolarHBondContact N-O 2.99Å; G709-G717 VanDerWaalsContact N-CA 3.31Å
718	E	94.4	Very high	87.8	Confident	30 Å²	30	45.2 Å²	45.2	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133	-178.9	-67.6	158.3	-139.8	0	0	110.6	Y527 R682 R683 V684 A708 I716	Y527-E718 HydrophobicContact CE2-CG 4.42Å; R682-E718 IonicContact CZ-OE1 2.63Å; R682-E718 IonicContact NE-OE1 3.68Å; R682-E718 PolarHBondContact NE-OE1 2.82Å; R682-E718 IonicContact NH2-OE1 3.76Å; R682-E718 PolarHBondContact NH2-OE1 3.03Å; R682-E718 PolarHBondContact O-N 3.27Å; R683-E718 CarbonylContact C-O 3.51Å; R683-E718 VanDerWaalsContact CA-O 3.3Å; R683-E718 WeakPolarHBondContact CA-O 3.32Å; R683-E718 HydrophobicContact CB-CB 4.32Å; R683-E718 HydrophobicContact CG-CB 4.06Å; R683-E718 IonicContact CZ-OE2 3.41Å; R683-E718 IonicContact NE-OE2 2.76Å; R683-E718 PolarHBondContact NE-OE2 3.18Å; R683-E718 IonicContact NH2-OE2 2.71Å; R683-E718 PolarHBondContact NH2-OE2 2.87Å; V684-E718 PolarHBondContact N-O 2.95Å; A708-E718 WeakPolarHBondContact CB-O 3.27Å; I716-E718 HydrophobicContact CG2-CG 4.44Å
719	S	95.1	Very high	87.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.8	169.9	173.4	0	0	0	0	109.8	K525 Y527 V684 I705	K525-S719 PolarHBondContact O-N 3.11Å; Y527-S719 WeakPolarHBondContact CA-O 3Å; Y527-S719 WeakPolarHBondContact CB-O 3.4Å; Y527-S719 PolarHBondContact N-O 2.78Å; V684-S719 CarbonylContact O-C 3.6Å; V684-S719 VanDerWaalsContact O-CA 3.32Å; V684-S719 WeakPolarHBondContact O-CA 3.24Å; I705-S719 WeakPolarHBondContact CG2-OG 3.48Å
720	I	95.2	Very high	87.5	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	111.7	176	-47.8	-174.5	0	0	0	109.8	Y527 K529 L570 R683 V684 I685 L686	Y527-I720 HydrophobicContact CD2-CG1 4.45Å; Y527-I720 WeakPolarHBondContact O-CA 3.35Å; K529-I720 HydrophobicContact CB-CG2 4.24Å; L570-I720 HydrophobicContact CD1-CG2 4.14Å; L570-I720 HydrophobicContact CD2-CD1 3.84Å; R683-I720 HydrophobicContact CG-CD1 4.44Å; R683-I720 HydrophobicContact CG-CG1 4.48Å; V684-I720 PolarHBondContact O-N 2.82Å; I685-I720 CarbonylContact C-O 3.54Å; I685-I720 VanDerWaalsContact CA-O 3.23Å; I685-I720 WeakPolarHBondContact CA-O 3.43Å; I685-I720 HydrophobicContact CG1-CB 4.49Å; L686-I720 PolarHBondContact N-O 3.48Å
721	L	94.4	Very high	87.8	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.6	172.2	166.8	61.6	0	0	0	109.6	Y527 L528 K529 L686 P689 Y701 L723 I731	Y527-L721 PolarHBondContact O-N 2.83Å; L528-L721 WeakPolarHBondContact CA-O 3.39Å; L528-L721 HydrophobicContact CD2-CB 3.86Å; L528-L721 HydrophobicContact CD2-CD2 3.97Å; L528-L721 HydrophobicContact CD2-CG 4.11Å; K529-L721 PolarHBondContact N-O 2.8Å; L686-L721 HydrophobicContact CB-CB 4.25Å; L686-L721 HydrophobicContact CB-CD1 3.55Å; L686-L721 HydrophobicContact CB-CG 4.48Å; L686-L721 HydrophobicContact CD2-CD1 4.2Å; P689-L721 HydrophobicContact CB-CD1 4.45Å; Y701-L721 HydrophobicContact CE2-CD2 4.03Å; L721-L723 HydrophobicContact CD1-CD2 4.03Å; L721-L723 HydrophobicContact CD2-CD2 3.93Å; L721-L723 HydrophobicContact CG-CD2 3.68Å; L721-L723 HydrophobicContact CG-CG 4.17Å; L721-I731 HydrophobicContact CD2-CD1 3.89Å; L721-I731 HydrophobicContact CD2-CG1 4.17Å; L721-I731 HydrophobicContact CD2-CG2 3.9Å
722	I	92.8	Very high	88	Confident	10 Å²	10	55.1 Å²	55.1	5%	0.051	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.5	177.5	-51.6	-179.9	0	0	0	108.9	K529 D565 L567 L570 I685 L686	K529-I722 HydrophobicContact CB-CG1 4.4Å; K529-I722 HydrophobicContact CD-CG1 4.43Å; D565-I722 HydrophobicContact CB-CD1 4.34Å; D565-I722 HydrophobicContact CB-CG2 4.49Å; L567-I722 HydrophobicContact CD1-CD1 4.24Å; L570-I722 HydrophobicContact CD1-CD1 4.01Å; L570-I722 HydrophobicContact CD1-CG1 4.35Å; I685-I722 HydrophobicContact CG2-CD1 4.12Å; I685-I722 HydrophobicContact CG2-CG1 4.31Å; L686-I722 PolarHBondContact O-N 2.7Å
723	L	90.1	Very high	88.4	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.042	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.2	-174.3	-59.8	-179.6	0	0	0	112.3	L528 K529 I530 P689 L721 D727 I731	L528-L723 HydrophobicContact CB-CD1 4.34Å; L528-L723 HydrophobicContact CD1-CD1 4.26Å; L528-L723 HydrophobicContact CD2-CD1 4.1Å; L528-L723 HydrophobicContact CG-CD1 4.46Å; K529-L723 PolarHBondContact O-N 3.44Å; I530-L723 HydrophobicContact CG1-CB 4.33Å; P689-L723 HydrophobicContact CB-CD2 4.08Å; P689-L723 HydrophobicContact CG-CD2 4Å; L721-L723 HydrophobicContact CD1-CD2 4.03Å; L721-L723 HydrophobicContact CD2-CD2 3.93Å; L721-L723 HydrophobicContact CG-CD2 3.68Å; L721-L723 HydrophobicContact CG-CG 4.17Å; L723-D727 HydrophobicContact CD2-CB 4.38Å; L723-I731 HydrophobicContact CD1-CB 4.19Å; L723-I731 HydrophobicContact CD1-CG1 4.49Å; L723-I731 HydrophobicContact CD1-CG2 3.97Å; L723-I731 HydrophobicContact CD2-CB 4.36Å; L723-I731 HydrophobicContact CD2-CG1 3.76Å; L723-I731 HydrophobicContact CD2-CG2 4.46Å
724	Q	87.5	Confident	88.6	Confident	110 Å²	110	51.4 Å²	51.4	51%	0.514	25%	0.249	S	C	.	.			trans	-91.3	155.7	160.8	-57.5	-176.9	-16.1	0	0	109.3	K726 D727	Q724-K726 HydrophobicContact CB-CD 4.41Å; Q724-K726 HydrophobicContact CB-CG 4.29Å; Q724-K726 PolarHBondContact O-N 3.49Å; Q724-D727 WeakPolarHBondContact CB-OD2 3.3Å; Q724-D727 PolarHBondContact N-OD2 3.46Å; Q724-D727 PolarHBondContact O-N 3.46Å
725	E	85.1	Confident	88.5	Confident	116 Å²	116	52 Å²	52	54%	0.542	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-47.5	-40.4	-178.5	-137.7	79.6	-129.3	0	0	113	N531 D727 K728	N531-E725 PolarHBondContact ND2-OE2 2.83Å; E725-D727 VanDerWaalsContact C-N 3.34Å; E725-D727 PolarHBondContact O-N 2.79Å; E725-K728 WeakPolarHBondContact O-CB 3.5Å
726	K	87.3	Confident	88.2	Confident	128 Å²	128	51.3 Å²	51.3	56%	0.557	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-63.5	-31.7	-178.9	80.8	-165.6	-172.5	-164.9	0	113.9	Q724	Q724-K726 HydrophobicContact CB-CD 4.41Å; Q724-K726 HydrophobicContact CB-CG 4.29Å; Q724-K726 PolarHBondContact O-N 3.49Å
727	D	87.8	Confident	87.8	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-87.1	-13.6	-170.9	-54.9	-44.5	0	0	0	111.8	P689 Y690 L723 Q724 E725 Q729 Q730 I731	P689-D727 HydrophobicContact CG-CB 3.96Å; Y690-D727 PolarHBondContact OH-OD1 3Å; L723-D727 HydrophobicContact CD2-CB 4.38Å; Q724-D727 WeakPolarHBondContact CB-OD2 3.3Å; Q724-D727 PolarHBondContact N-OD2 3.46Å; Q724-D727 PolarHBondContact O-N 3.46Å; E725-D727 VanDerWaalsContact C-N 3.34Å; E725-D727 PolarHBondContact O-N 2.79Å; D727-Q729 VanDerWaalsContact C-N 3.34Å; D727-Q729 PolarHBondContact O-N 2.87Å; D727-Q730 PolarHBondContact O-N 3.04Å; D727-I731 PolarHBondContact O-N 2.87Å
728	K	85.6	Confident	86.9	Confident	70 Å²	70	59.9 Å²	59.9	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-54.5	-44.2	-171.6	-173.6	-175.9	-173.9	175.5	0	113.3	I530 M545 E725 L732	I530-K728 HydrophobicContact CD1-CB 4.47Å; I530-K728 HydrophobicContact CD1-CD 3.71Å; I530-K728 HydrophobicContact CD1-CG 3.86Å; M545-K728 HydrophobicContact CE-CG 3.89Å; E725-K728 WeakPolarHBondContact O-CB 3.5Å; K728-L732 WeakPolarHBondContact O-CG 3.2Å; K728-L732 PolarHBondContact O-N 3.48Å
729	Q	85.4	Confident	86	Confident	162 Å²	162	60.3 Å²	60.3	76%	0.757	29%	0.291	S	S	*	.	H	α-helix	trans	-69.9	-44.2	-178.3	-71.6	-178.6	-21.8	0	0	111.9	D727 I731 L732 E733	D727-Q729 VanDerWaalsContact C-N 3.34Å; D727-Q729 PolarHBondContact O-N 2.87Å; Q729-I731 VanDerWaalsContact C-N 3.3Å; Q729-I731 PolarHBondContact O-N 3.1Å; Q729-L732 PolarHBondContact O-N 3.4Å; Q729-E733 PolarHBondContact O-N 2.85Å
730	Q	86.7	Confident	85	Confident	102 Å²	102	63.6 Å²	63.6	48%	0.477	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-35.9	179.2	-63.4	-178.7	-20.2	0	0	111.8	F695 D727 E733 L734	F695-Q730 HydrophobicContact CE1-CB 4.18Å; F695-Q730 HydrophobicContact CE2-CB 3.79Å; F695-Q730 HydrophobicContact CZ-CB 3.42Å; F695-Q730 VanDerWaalsContact CZ-CB 3.42Å; D727-Q730 PolarHBondContact O-N 3.04Å; Q730-E733 PolarHBondContact O-N 3.11Å; Q730-L734 WeakPolarHBondContact O-CB 3.45Å; Q730-L734 PolarHBondContact O-N 2.57Å
731	I	86.8	Confident	84.4	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-74.7	-35	175.3	-75.5	-61.7	0	0	0	112.8	L528 P689 F695 L721 L723 D727 Q729 E733 L734 I735	L528-I731 HydrophobicContact CD1-CG2 4.29Å; L528-I731 HydrophobicContact CD2-CG2 4.09Å; P689-I731 HydrophobicContact CB-CD1 3.76Å; P689-I731 HydrophobicContact CB-CG1 3.88Å; F695-I731 HydrophobicContact CE1-CD1 3.99Å; F695-I731 HydrophobicContact CE2-CD1 4.25Å; F695-I731 HydrophobicContact CE2-CG1 4.29Å; F695-I731 HydrophobicContact CZ-CD1 3.48Å; F695-I731 VanDerWaalsContact CZ-CD1 3.48Å; F695-I731 HydrophobicContact CZ-CG1 3.72Å; L721-I731 HydrophobicContact CD2-CD1 3.89Å; L721-I731 HydrophobicContact CD2-CG1 4.17Å; L721-I731 HydrophobicContact CD2-CG2 3.9Å; L723-I731 HydrophobicContact CD1-CB 4.19Å; L723-I731 HydrophobicContact CD1-CG1 4.49Å; L723-I731 HydrophobicContact CD1-CG2 3.97Å; L723-I731 HydrophobicContact CD2-CB 4.36Å; L723-I731 HydrophobicContact CD2-CG1 3.76Å; L723-I731 HydrophobicContact CD2-CG2 4.46Å; D727-I731 PolarHBondContact O-N 2.87Å; Q729-I731 VanDerWaalsContact C-N 3.3Å; Q729-I731 PolarHBondContact O-N 3.1Å; I731-E733 VanDerWaalsContact C-N 3.34Å; I731-L734 HydrophobicContact CD1-CB 4.35Å; I731-L734 HydrophobicContact CD1-CD2 3.66Å; I731-L734 PolarHBondContact O-N 2.97Å; I731-I735 HydrophobicContact CG2-CD1 3.57Å; I731-I735 HydrophobicContact CG2-CG1 4.36Å; I731-I735 WeakPolarHBondContact O-CB 3.45Å; I731-I735 WeakPolarHBondContact O-CD1 3.49Å; I731-I735 VanDerWaalsContact O-CG1 3.24Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.3Å
732	L	84.4	Confident	84	Confident	41 Å²	41	66.7 Å²	66.7	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-43.2	169	-82.3	173.2	0	0	0	111.6	M545 K728 Q729 I735 T736	M545-L732 HydrophobicContact CE-CD1 3.87Å; M545-L732 HydrophobicContact CE-CD2 3.57Å; M545-L732 HydrophobicContact CE-CG 3.56Å; M545-L732 HydrophobicContact CG-CD2 4.15Å; K728-L732 WeakPolarHBondContact O-CG 3.2Å; K728-L732 PolarHBondContact O-N 3.48Å; Q729-L732 PolarHBondContact O-N 3.4Å; L732-I735 PolarHBondContact O-N 2.73Å; L732-T736 WeakPolarHBondContact O-CB 3.46Å; L732-T736 WeakPolarHBondContact O-CG2 3.48Å; L732-T736 PolarHBondContact O-N 3.08Å; L732-T736 PolarHBondContact O-OG1 3.02Å
733	E	85.1	Confident	83.8	Confident	105 Å²	105	70 Å²	70	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-48.5	172.6	-164.7	-164.8	140.1	0	0	110.8	Q729 Q730 I731 I735 T736 R737	Q729-E733 PolarHBondContact O-N 2.85Å; Q730-E733 PolarHBondContact O-N 3.11Å; I731-E733 VanDerWaalsContact C-N 3.34Å; E733-I735 PolarHBondContact O-N 2.99Å; E733-T736 PolarHBondContact O-N 2.75Å; E733-T736 VanDerWaalsContact O-N 3.15Å; E733-T736 PolarHBondContact O-OG1 3.03Å; E733-R737 WeakPolarHBondContact O-CB 3.27Å; E733-R737 PolarHBondContact O-N 3.12Å; E733-R737 IonicContact OE1-NH1 3.68Å; E733-R737 PolarHBondContact OE1-NH1 3.45Å; E733-R737 VanDerWaalsContact OE1-NH1 3.13Å
734	L	85.4	Confident	83.8	Confident	19 Å²	19	70.1 Å²	70.1	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-35.2	179.4	-167.1	71.8	0	0	0	113.2	F695 L696 R698 Q730 I731	F695-L734 HydrophobicContact CE1-CB 4.36Å; F695-L734 HydrophobicContact CE1-CD1 4.41Å; F695-L734 HydrophobicContact CE1-CD2 4.06Å; L696-L734 HydrophobicContact CB-CD2 4.3Å; L696-L734 VanDerWaalsContact O-CD1 3.27Å; L696-L734 WeakPolarHBondContact O-CD1 3.45Å; L696-L734 WeakPolarHBondContact O-CD2 3.36Å; R698-L734 HydrophobicContact CB-CD1 3.95Å; R698-L734 HydrophobicContact CB-CG 4.42Å; R698-L734 PolarHBondContact NH1-O 3.11Å; Q730-L734 WeakPolarHBondContact O-CB 3.45Å; Q730-L734 PolarHBondContact O-N 2.57Å; I731-L734 HydrophobicContact CD1-CB 4.35Å; I731-L734 HydrophobicContact CD1-CD2 3.66Å; I731-L734 PolarHBondContact O-N 2.97Å
735	I	82.4	Confident	83.8	Confident	20 Å²	20	67 Å²	67	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-80.7	-30.5	-179.8	-69.8	165.7	0	0	0	112.1	L528 I537 R698 Y701 I731 L732 E733	L528-I735 HydrophobicContact CD1-CD1 4.27Å; L528-I735 HydrophobicContact CD2-CD1 4.34Å; I537-I735 HydrophobicContact CD1-CD1 3.66Å; I537-I735 HydrophobicContact CG1-CD1 4.34Å; I537-I735 HydrophobicContact CG2-CG2 3.91Å; R698-I735 PolarHBondContact NH1-O 3.14Å; Y701-I735 HydrophobicContact CE1-CG1 4.07Å; I731-I735 HydrophobicContact CG2-CD1 3.57Å; I731-I735 HydrophobicContact CG2-CG1 4.36Å; I731-I735 WeakPolarHBondContact O-CB 3.45Å; I731-I735 WeakPolarHBondContact O-CD1 3.49Å; I731-I735 VanDerWaalsContact O-CG1 3.24Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.3Å; L732-I735 PolarHBondContact O-N 2.73Å; E733-I735 PolarHBondContact O-N 2.99Å
736	T	80.1	Confident	83.8	Confident	101 Å²	101	61.5 Å²	61.5	62%	0.62	30%	0.297	S	S	*	.	H	α-helix	trans	-91.9	-37.3	-178.6	50.6	0	0	0	0	114	L732 E733	L732-T736 WeakPolarHBondContact O-CB 3.46Å; L732-T736 WeakPolarHBondContact O-CG2 3.48Å; L732-T736 PolarHBondContact O-N 3.08Å; L732-T736 PolarHBondContact O-OG1 3.02Å; E733-T736 PolarHBondContact O-N 2.75Å; E733-T736 VanDerWaalsContact O-N 3.15Å; E733-T736 PolarHBondContact O-OG1 3.03Å
737	R	78.6	Confident	83.5	Confident	137 Å²	137	57.2 Å²	57.2	52%	0.517	28%	0.282	S	S	.	.	S	Bend	trans	-55.5	144.2	178.4	-176.8	175.9	173.4	151.1	-6.5	111.7	R698 E733	R698-R737 VanDerWaalsContact CD-O 3.23Å; R698-R737 WeakPolarHBondContact CD-O 3.49Å; R698-R737 PolarHBondContact NE-O 2.96Å; R698-R737 PolarHBondContact NH1-O 3.28Å; R698-R737 VanDerWaalsContact NH1-O 3.15Å; R698-R737 PolarHBondContact NH2-O 2.89Å; E733-R737 WeakPolarHBondContact O-CB 3.27Å; E733-R737 PolarHBondContact O-N 3.12Å; E733-R737 IonicContact OE1-NH1 3.68Å; E733-R737 PolarHBondContact OE1-NH1 3.45Å; E733-R737 VanDerWaalsContact OE1-NH1 3.13Å
738	P	75.1	Confident	82.6	Confident	89 Å²	89	59.7 Å²	59.7	58%	0.578	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-60.4	164.5	173	25	-35.2	0	0	0	112.7	R698	R698-P738 WeakPolarHBondContact CD-O 3.24Å
739	L	74.6	Confident	81.3	Confident	39 Å²	39	61.6 Å²	61.6	20%	0.204	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-60.4	152.1	171.7	-69.4	170.2	0	0	0	110.8	T499 N501 R698 N699	T499-L739 HydrophobicContact CG2-CD1 4.09Å; T499-L739 HydrophobicContact CG2-CD2 3.87Å; N501-L739 HydrophobicContact CB-CB 4.02Å; N501-L739 PolarHBondContact ND2-O 3.14Å; R698-L739 HydrophobicContact CG-CD2 4.04Å; N699-L739 WeakPolarHBondContact OD1-CD2 3.17Å
740	E	74.8	Confident	80.1	Confident	70 Å²	70	63.4 Å²	63.4	33%	0.327	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-66.1	139.3	177.8	-73	160.2	-129	0	0	110.5	R698	R698-E740 PolarHBondContact N-OE1 3.37Å
741	N	83.1	Confident	79.4	Confident	62 Å²	62	59.8 Å²	59.8	33%	0.332	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-69.2	136.4	178.7	-75.5	-3.8	0	0	0	110.3	N501 N502 Y743	N501-N741 PolarHBondContact ND2-OD1 3.38Å; N501-N741 VanDerWaalsContact ND2-OD1 3.13Å; N502-N741 HydrophobicContact CB-CB 4.22Å; N741-Y743 HydrophobicContact CB-CD2 4.32Å; N741-Y743 HydrophobicContact CB-CE1 4.04Å; N741-Y743 HydrophobicContact CB-CE2 3.72Å; N741-Y743 PolarHBondContact ND2-OH 2.97Å; N741-Y743 PolarHBondContact O-N 2.89Å
742	C	86	Confident	79.1	Confident	7 Å²	7	61.8 Å²	61.8	5%	0.047	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-71.8	124.8	168	-63.7	0	0	0	0	109.2	I468 L506 F781 Q785	I468-C742 HydrophobicContact CG2-CB 4.43Å; L506-C742 HydrophobicContact CD1-CB 4.33Å; C742-F781 HydrophobicContact CB-CE1 4.43Å; C742-F781 HydrophobicContact CB-CZ 4.24Å; C742-F781 WeakPolarHBondContact O-CZ 3.39Å; C742-Q785 PolarHBondContact O-NE2 3.4Å
743	Y	89.1	Confident	79.1	Confident	80 Å²	80	60.3 Å²	60.3	31%	0.314	30%	0.297	S	S	.	.			trans	-124.2	146	175.7	-67.2	-55.7	0	0	0	111.4	G469 N741 H745 Q785 I788 L789	G469-Y743 WeakPolarHBondContact CA-O 3.36Å; N741-Y743 HydrophobicContact CB-CD2 4.32Å; N741-Y743 HydrophobicContact CB-CE1 4.04Å; N741-Y743 HydrophobicContact CB-CE2 3.72Å; N741-Y743 PolarHBondContact ND2-OH 2.97Å; N741-Y743 PolarHBondContact O-N 2.89Å; Y743-H745 PolarHBondContact O-CE1 2.96Å; Y743-H745 PolarHBondContact O-ND1 2.86Å; Y743-Q785 VanDerWaalsContact CA-OE1 3.27Å; Y743-I788 HydrophobicContact CE1-CG2 4.18Å; Y743-L789 HydrophobicContact CD1-CD2 3.96Å; Y743-L789 HydrophobicContact CG-CD2 4Å
744	S	90	Very high	79.3	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.063	27%	0.274	C	S	.	.			trans	-62.7	136.9	172.2	177.1	0	0	0	0	112.1	E478 L746 F782	E478-S744 PolarHBondContact OE1-OG 3.18Å; E478-S744 VanDerWaalsContact OE2-CB 3.22Å; E478-S744 WeakPolarHBondContact OE2-CB 3.44Å; E478-S744 PolarHBondContact OE2-OG 3.1Å; S744-L746 PolarHBondContact OG-N 3.34Å; S744-F782 WeakPolarHBondContact OG-CB 3.44Å
745	H	87.7	Confident	79.5	Confident	46 Å²	46	55 Å²	55	21%	0.213	27%	0.272	C	S	.	.			trans	-104.4	11	176	-71.3	68.2	0	0	0	113.2	G469 G471 A475 Y743 V747 Q748	G469-H745 PolarHBondContact O-CE1 3.11Å; G471-H745 VanDerWaalsContact CA-CD2 3.45Å; G471-H745 WeakPolarHBondContact CA-CD2 3.47Å; G471-H745 PolarHBondContact N-CD2 3.16Å; G471-H745 VanDerWaalsContact N-CD2 3.27Å; G471-H745 WeakPolarHBondContact O-CB 3.41Å; A475-H745 HydrophobicContact CB-CB 4.32Å; Y743-H745 PolarHBondContact O-CE1 2.96Å; Y743-H745 PolarHBondContact O-ND1 2.86Å; H745-V747 PolarHBondContact O-N 3.33Å; H745-V747 VanDerWaalsContact O-N 3.17Å; H745-Q748 PolarHBondContact CD2-OE1 3.33Å; H745-Q748 VanDerWaalsContact O-CB 3.27Å; H745-Q748 WeakPolarHBondContact O-CB 3.43Å; H745-Q748 PolarHBondContact O-N 2.93Å; H745-Q748 VanDerWaalsContact O-N 3.13Å
746	L	85.1	Confident	79.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.6	179	-73.8	-178.1	0	0	0	113.9	A475 E478 M479 S744 G753 I754 L757 T780 F782	A475-L746 HydrophobicContact CB-CD2 4.12Å; E478-L746 HydrophobicContact CG-CD1 4.42Å; E478-L746 WeakPolarHBondContact OE1-CD1 3.38Å; M479-L746 HydrophobicContact CE-CD2 3.6Å; M479-L746 HydrophobicContact CG-CD2 3.77Å; S744-L746 PolarHBondContact OG-N 3.34Å; L746-G753 CarbonylContact O-C 3.41Å; L746-G753 VanDerWaalsContact O-CA 3.26Å; L746-G753 WeakPolarHBondContact O-CA 3.21Å; L746-G753 PolarHBondContact O-N 3.28Å; L746-I754 HydrophobicContact CB-CG1 3.91Å; L746-I754 PolarHBondContact O-N 3.47Å; L746-I754 VanDerWaalsContact O-N 3.12Å; L746-L757 HydrophobicContact CD1-CD2 4.18Å; L746-T780 HydrophobicContact CD1-CG2 4.38Å; L746-F782 HydrophobicContact CB-CB 4.34Å; L746-F782 HydrophobicContact CD1-CB 3.92Å
747	V	80.6	Confident	80.4	Confident	38 Å²	38	52 Å²	52	23%	0.23	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.1	-179.1	172.1	0	0	0	0	113.2	H745 T751 I754 F782 L790	H745-V747 PolarHBondContact O-N 3.33Å; H745-V747 VanDerWaalsContact O-N 3.17Å; V747-T751 PolarHBondContact O-N 2.99Å; V747-I754 HydrophobicContact CG2-CD1 4.19Å; V747-F782 HydrophobicContact CG2-CD1 4.49Å; V747-F782 HydrophobicContact CG2-CD2 3.7Å; V747-F782 HydrophobicContact CG2-CE1 4.12Å; V747-F782 HydrophobicContact CG2-CE2 3.29Å; V747-F782 HydrophobicContact CG2-CG 4.32Å; V747-F782 HydrophobicContact CG2-CZ 3.53Å; V747-L790 HydrophobicContact CG1-CD1 3.83Å; V747-L790 HydrophobicContact CG1-CG 4.4Å; V747-L790 HydrophobicContact CG2-CD1 3.94Å
748	Q	68	Low	81	Confident	55 Å²	55	45.5 Å²	45.5	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-57.8	151.2	-173	-161.1	172.3	17.6	0	0	112.4	E105 H745 K752	E105-Q748 PolarHBondContact OE1-NE2 3.14Å; E105-Q748 PolarHBondContact OE2-NE2 3.42Å; H745-Q748 PolarHBondContact CD2-OE1 3.33Å; H745-Q748 VanDerWaalsContact O-CB 3.27Å; H745-Q748 WeakPolarHBondContact O-CB 3.43Å; H745-Q748 PolarHBondContact O-N 2.93Å; H745-Q748 VanDerWaalsContact O-N 3.13Å; Q748-K752 PolarHBondContact O-N 3.42Å
749	E	59.7	Low	81.8	Confident	110 Å²	110	41.4 Å²	41.4	51%	0.514	20%	0.203	S	C	.	.	H	α-helix	trans	47.4	64.3	-175	-63.5	-172.2	101.4	0	0	113.1	T751 K752	E749-T751 PolarHBondContact O-N 2.97Å; E749-K752 HydrophobicContact CB-CB 4.12Å; E749-K752 HydrophobicContact CB-CD 3.81Å; E749-K752 HydrophobicContact CG-CD 4.47Å; E749-K752 WeakPolarHBondContact O-CB 3.48Å; E749-K752 PolarHBondContact O-N 3.07Å; E749-K752 IonicContact OE1-NZ 3.14Å; E749-K752 WeakPolarHBondContact OE2-CD 3.39Å; E749-K752 WeakPolarHBondContact OE2-CE 3.04Å; E749-K752 IonicContact OE2-NZ 2.8Å; E749-K752 PolarHBondContact OE2-NZ 3.04Å
750	F	60.2	Low	82.6	Confident	201 Å²	201	39.6 Å²	39.6	88%	0.882	19%	0.194	S	C	*	.	H	α-helix	trans	54.7	47	177	-56.2	-89.6	0	0	0	114.2	K752 Q755	F750-K752 VanDerWaalsContact C-N 3.28Å; F750-K752 PolarHBondContact O-N 3.29Å; F750-Q755 PolarHBondContact O-NE2 3.36Å
751	T	71.9	Confident	83.4	Confident	25 Å²	25	36.3 Å²	36.3	15%	0.153	18%	0.178	C	C	.	.	H	α-helix	trans	66.3	16.7	179.5	70.5	0	0	0	0	116	V747 E749 G753 I754 Q755 I798	V747-T751 PolarHBondContact O-N 2.99Å; E749-T751 PolarHBondContact O-N 2.97Å; T751-G753 PolarHBondContact O-N 2.98Å; T751-G753 VanDerWaalsContact O-N 3.13Å; T751-I754 HydrophobicContact CG2-CD1 4.44Å; T751-I754 PolarHBondContact O-N 3.41Å; T751-Q755 WeakPolarHBondContact O-CG 3.26Å; T751-Q755 PolarHBondContact O-N 3.01Å; T751-Q755 PolarHBondContact OG1-NE2 3.11Å; T751-I798 HydrophobicContact CG2-CG2 4.4Å
752	K	80	Confident	83.9	Confident	43 Å²	43	33.6 Å²	33.6	19%	0.187	16%	0.164	C	C	.	.	H	α-helix	trans	-49.7	-37.2	177.3	178.1	-176.7	-175.9	175.9	0	113.9	Q748 E749 F750 T756 D843	Q748-K752 PolarHBondContact O-N 3.42Å; E749-K752 HydrophobicContact CB-CB 4.12Å; E749-K752 HydrophobicContact CB-CD 3.81Å; E749-K752 HydrophobicContact CG-CD 4.47Å; E749-K752 WeakPolarHBondContact O-CB 3.48Å; E749-K752 PolarHBondContact O-N 3.07Å; E749-K752 IonicContact OE1-NZ 3.14Å; E749-K752 WeakPolarHBondContact OE2-CD 3.39Å; E749-K752 WeakPolarHBondContact OE2-CE 3.04Å; E749-K752 IonicContact OE2-NZ 2.8Å; E749-K752 PolarHBondContact OE2-NZ 3.04Å; F750-K752 VanDerWaalsContact C-N 3.28Å; F750-K752 PolarHBondContact O-N 3.29Å; K752-T756 WeakPolarHBondContact O-CB 3.4Å; K752-T756 PolarHBondContact O-N 3.05Å; K752-T756 PolarHBondContact O-OG1 3.36Å; K752-D843 WeakPolarHBondContact CE-OD1 3.45Å; K752-D843 WeakPolarHBondContact CE-OD2 3.41Å; K752-D843 IonicContact NZ-OD1 3.16Å; K752-D843 IonicContact NZ-OD2 2.8Å; K752-D843 PolarHBondContact NZ-OD2 3.24Å
753	G	84.9	Confident	84	Confident	11 Å²	11	33.9 Å²	33.9	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-51.2	173.5	0	0	0	0	0	112.8	M479 L746 T751 Q755 T756 L757	M479-G753 WeakPolarHBondContact CE-O 3.42Å; L746-G753 CarbonylContact O-C 3.41Å; L746-G753 VanDerWaalsContact O-CA 3.26Å; L746-G753 WeakPolarHBondContact O-CA 3.21Å; L746-G753 PolarHBondContact O-N 3.28Å; T751-G753 PolarHBondContact O-N 2.98Å; T751-G753 VanDerWaalsContact O-N 3.13Å; G753-Q755 VanDerWaalsContact C-N 3.33Å; G753-Q755 PolarHBondContact O-N 3.43Å; G753-T756 PolarHBondContact O-N 2.98Å; G753-L757 WeakPolarHBondContact O-CB 3.33Å; G753-L757 PolarHBondContact O-N 3.25Å
754	I	89.1	Confident	84.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-42.2	176.6	-59.6	177.6	0	0	0	111.2	L746 V747 T751 T756 L757 F758 M777 F782 I798	L746-I754 HydrophobicContact CB-CG1 3.91Å; L746-I754 PolarHBondContact O-N 3.47Å; L746-I754 VanDerWaalsContact O-N 3.12Å; V747-I754 HydrophobicContact CG2-CD1 4.19Å; T751-I754 HydrophobicContact CG2-CD1 4.44Å; T751-I754 PolarHBondContact O-N 3.41Å; I754-T756 PolarHBondContact O-N 3.19Å; I754-L757 WeakPolarHBondContact O-CB 3.33Å; I754-L757 PolarHBondContact O-N 3.25Å; I754-F758 HydrophobicContact CG2-CD1 4.29Å; I754-F758 HydrophobicContact CG2-CD2 4.07Å; I754-F758 HydrophobicContact CG2-CE1 3.85Å; I754-F758 HydrophobicContact CG2-CE2 3.6Å; I754-F758 HydrophobicContact CG2-CG 4.41Å; I754-F758 HydrophobicContact CG2-CZ 3.47Å; I754-F758 VanDerWaalsContact CG2-CZ 3.47Å; I754-F758 WeakPolarHBondContact O-CG 3.41Å; I754-F758 PolarHBondContact O-N 2.89Å; I754-M777 HydrophobicContact CD1-CE 4.04Å; I754-M777 HydrophobicContact CG1-CE 4.11Å; I754-M777 HydrophobicContact CG2-CE 4.12Å; I754-M777 HydrophobicContact CG2-SD 4.48Å; I754-F782 HydrophobicContact CD1-CD1 4.21Å; I754-F782 HydrophobicContact CD1-CE1 4.09Å; I754-I798 HydrophobicContact CD1-CG2 3.48Å; I754-I798 VanDerWaalsContact CD1-CG2 3.48Å
755	Q	89.4	Confident	84.1	Confident	13 Å²	13	38.8 Å²	38.8	6%	0.061	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-43.9	177.2	-66.3	165.5	24.1	0	0	111.9	F750 T751 G753 F758 L759 Y805 L806 L844	F750-Q755 PolarHBondContact O-NE2 3.36Å; T751-Q755 WeakPolarHBondContact O-CG 3.26Å; T751-Q755 PolarHBondContact O-N 3.01Å; T751-Q755 PolarHBondContact OG1-NE2 3.11Å; G753-Q755 VanDerWaalsContact C-N 3.33Å; G753-Q755 PolarHBondContact O-N 3.43Å; Q755-F758 PolarHBondContact O-N 3Å; Q755-L759 PolarHBondContact O-N 3.45Å; Q755-L759 VanDerWaalsContact O-N 3.08Å; Q755-Y805 HydrophobicContact CG-CD1 4.26Å; Q755-L806 HydrophobicContact CB-CD1 4.43Å; Q755-L806 HydrophobicContact CB-CD2 4.12Å; Q755-L806 HydrophobicContact CB-CG 4.31Å; Q755-L806 HydrophobicContact CG-CG 4.49Å; Q755-L844 HydrophobicContact CB-CD1 3.55Å
756	T	89.3	Confident	84.2	Confident	56 Å²	56	37.8 Å²	37.8	34%	0.344	19%	0.186	S	C	.	.	H	α-helix	trans	-65.3	-40	176.4	-55.4	0	0	0	0	111.5	K752 G753 I754 S760	K752-T756 WeakPolarHBondContact O-CB 3.4Å; K752-T756 PolarHBondContact O-N 3.05Å; K752-T756 PolarHBondContact O-OG1 3.36Å; G753-T756 PolarHBondContact O-N 2.98Å; I754-T756 PolarHBondContact O-N 3.19Å; T756-S760 PolarHBondContact O-N 3.33Å
757	L	91.5	Very high	84.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-50.5	173.5	172.9	58.4	0	0	0	111.3	M479 L746 G753 I754 L759 S760 L761 F776 M777 T780	M479-L757 HydrophobicContact CB-CD1 4.17Å; M479-L757 HydrophobicContact CE-CB 4.45Å; M479-L757 HydrophobicContact CG-CB 4.01Å; M479-L757 HydrophobicContact CG-CD1 3.98Å; M479-L757 HydrophobicContact CG-CG 4.37Å; M479-L757 HydrophobicContact SD-CB 3.94Å; L746-L757 HydrophobicContact CD1-CD2 4.18Å; G753-L757 WeakPolarHBondContact O-CB 3.33Å; G753-L757 PolarHBondContact O-N 3.25Å; I754-L757 WeakPolarHBondContact O-CB 3.33Å; I754-L757 PolarHBondContact O-N 3.25Å; L757-L759 PolarHBondContact O-N 3.09Å; L757-S760 CarbonylContact O-C 3.56Å; L757-S760 WeakPolarHBondContact O-CA 2.92Å; L757-S760 WeakPolarHBondContact O-CB 3.41Å; L757-S760 PolarHBondContact O-N 2.66Å; L757-L761 HydrophobicContact CD1-CD1 4.1Å; L757-L761 HydrophobicContact CD1-CD2 4.1Å; L757-L761 HydrophobicContact CD1-CG 3.87Å; L757-L761 HydrophobicContact CG-CD1 4.08Å; L757-L761 HydrophobicContact CG-CG 4.27Å; L757-L761 WeakPolarHBondContact O-CG 3.14Å; L757-L761 PolarHBondContact O-N 3.43Å; L757-F776 HydrophobicContact CD1-CE1 3.82Å; L757-F776 HydrophobicContact CD1-CZ 4.28Å; L757-F776 HydrophobicContact CD2-CD1 4.42Å; L757-F776 HydrophobicContact CD2-CE1 4.02Å; L757-F776 HydrophobicContact CG-CE1 4.37Å; L757-M777 HydrophobicContact CD2-SD 3.76Å; L757-T780 HydrophobicContact CD2-CG2 4.21Å
758	F	92.1	Very high	84.7	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-40.9	-179.1	-70.4	-7	0	0	0	112.8	I754 Q755 S760 L761 I762 I773 M777 T799 L803 L806	I754-F758 HydrophobicContact CG2-CD1 4.29Å; I754-F758 HydrophobicContact CG2-CD2 4.07Å; I754-F758 HydrophobicContact CG2-CE1 3.85Å; I754-F758 HydrophobicContact CG2-CE2 3.6Å; I754-F758 HydrophobicContact CG2-CG 4.41Å; I754-F758 HydrophobicContact CG2-CZ 3.47Å; I754-F758 VanDerWaalsContact CG2-CZ 3.47Å; I754-F758 WeakPolarHBondContact O-CG 3.41Å; I754-F758 PolarHBondContact O-N 2.89Å; Q755-F758 PolarHBondContact O-N 3Å; F758-S760 VanDerWaalsContact C-N 3.26Å; F758-S760 PolarHBondContact O-N 3.24Å; F758-L761 HydrophobicContact CD1-CD1 4.18Å; F758-L761 PolarHBondContact O-N 3.18Å; F758-I762 WeakPolarHBondContact O-CG1 3.19Å; F758-I762 PolarHBondContact O-N 3.03Å; F758-I773 HydrophobicContact CD1-CG2 3.8Å; F758-I773 HydrophobicContact CE1-CG2 3.44Å; F758-I773 VanDerWaalsContact CE1-CG2 3.44Å; F758-I773 HydrophobicContact CE2-CG2 4.31Å; F758-I773 HydrophobicContact CG-CG2 4.37Å; F758-I773 HydrophobicContact CZ-CG2 3.74Å; F758-M777 HydrophobicContact CE1-CG 3.56Å; F758-M777 HydrophobicContact CE1-SD 3.52Å; F758-M777 VanDerWaalsContact CE1-SD 3.52Å; F758-M777 HydrophobicContact CZ-CG 3.82Å; F758-M777 HydrophobicContact CZ-SD 4.04Å; F758-T799 HydrophobicContact CE2-CG2 4.03Å; F758-T799 HydrophobicContact CZ-CG2 3.76Å; F758-L803 HydrophobicContact CB-CD2 4.2Å; F758-L803 HydrophobicContact CD2-CD2 3.62Å; F758-L803 HydrophobicContact CD2-CG 3.68Å; F758-L803 HydrophobicContact CE2-CD1 4.43Å; F758-L803 HydrophobicContact CE2-CD2 4.25Å; F758-L803 HydrophobicContact CE2-CG 3.83Å; F758-L803 HydrophobicContact CG-CD2 4.14Å; F758-L806 HydrophobicContact CB-CD1 3.8Å
759	L	90.9	Very high	85.8	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-37.2	173.5	-162.7	67.6	0	0	0	111.4	Q755 L757 G763 L811 L812 I830 F838 L844	Q755-L759 PolarHBondContact O-N 3.45Å; Q755-L759 VanDerWaalsContact O-N 3.08Å; L757-L759 PolarHBondContact O-N 3.09Å; L759-G763 WeakPolarHBondContact O-CA 3.2Å; L759-G763 PolarHBondContact O-N 3Å; L759-L811 HydrophobicContact CD1-CB 4.01Å; L759-L812 HydrophobicContact CD1-CD2 4.04Å; L759-L812 HydrophobicContact CD1-CG 4.48Å; L759-I830 HydrophobicContact CD1-CD1 3.76Å; L759-I830 HydrophobicContact CD1-CG1 3.93Å; L759-I830 HydrophobicContact CG-CD1 4.05Å; L759-F838 HydrophobicContact CD2-CB 4.22Å; L759-F838 HydrophobicContact CG-CB 4.2Å; L759-L844 HydrophobicContact CD2-CD2 4.01Å
760	S	91.4	Very high	87.2	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-70	-39.4	172.8	178.6	0	0	0	0	113.9	K483 T756 L757 F758 L764 F838	K483-S760 PolarHBondContact NZ-OG 3.32Å; T756-S760 PolarHBondContact O-N 3.33Å; L757-S760 CarbonylContact O-C 3.56Å; L757-S760 WeakPolarHBondContact O-CA 2.92Å; L757-S760 WeakPolarHBondContact O-CB 3.41Å; L757-S760 PolarHBondContact O-N 2.66Å; F758-S760 VanDerWaalsContact C-N 3.26Å; F758-S760 PolarHBondContact O-N 3.24Å; S760-L764 VanDerWaalsContact O-CB 3.25Å; S760-L764 WeakPolarHBondContact O-CB 3.49Å; S760-L764 WeakPolarHBondContact O-CG 3.26Å; S760-L764 PolarHBondContact O-N 3.19Å; S760-F838 WeakPolarHBondContact OG-CE2 3.19Å
761	L	92.6	Very high	88.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-48	-179	-68.7	177	0	0	0	111.5	K483 L757 F758 K765 I766 F776	K483-L761 HydrophobicContact CD-CD2 4.29Å; K483-L761 HydrophobicContact CG-CD2 4Å; L757-L761 HydrophobicContact CD1-CD1 4.1Å; L757-L761 HydrophobicContact CD1-CD2 4.1Å; L757-L761 HydrophobicContact CD1-CG 3.87Å; L757-L761 HydrophobicContact CG-CD1 4.08Å; L757-L761 HydrophobicContact CG-CG 4.27Å; L757-L761 WeakPolarHBondContact O-CG 3.14Å; L757-L761 PolarHBondContact O-N 3.43Å; F758-L761 HydrophobicContact CD1-CD1 4.18Å; F758-L761 PolarHBondContact O-N 3.18Å; L761-K765 PolarHBondContact O-N 2.73Å; L761-K765 VanDerWaalsContact O-N 3.09Å; L761-I766 HydrophobicContact CD2-CB 4.15Å; L761-I766 HydrophobicContact CD2-CD1 4.07Å; L761-I766 HydrophobicContact CD2-CG2 4.07Å; L761-I766 PolarHBondContact O-N 2.99Å; L761-F776 HydrophobicContact CD1-CB 4.17Å; L761-F776 HydrophobicContact CD1-CD1 3.54Å; L761-F776 HydrophobicContact CD1-CD2 4.25Å; L761-F776 HydrophobicContact CD1-CE1 4.04Å; L761-F776 HydrophobicContact CD1-CG 3.69Å; L761-F776 HydrophobicContact CD2-CD1 4.11Å; L761-F776 HydrophobicContact CD2-CD2 3.68Å; L761-F776 HydrophobicContact CD2-CE1 3.97Å; L761-F776 HydrophobicContact CD2-CE2 3.52Å; L761-F776 HydrophobicContact CD2-CG 3.99Å; L761-F776 HydrophobicContact CD2-CZ 3.68Å; L761-F776 HydrophobicContact CG-CD1 4.43Å
762	I	92.4	Very high	89.5	Confident	6 Å²	6	27.9 Å²	27.9	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-72.2	-39.9	-179.9	-62.3	159.5	0	0	0	109.9	F758 L764 K765 A767 I773 L803 L812 F828 I830	F758-I762 WeakPolarHBondContact O-CG1 3.19Å; F758-I762 PolarHBondContact O-N 3.03Å; I762-L764 VanDerWaalsContact C-N 3.32Å; I762-L764 PolarHBondContact O-N 3.4Å; I762-K765 PolarHBondContact O-N 2.84Å; I762-A767 WeakPolarHBondContact CG1-O 3.3Å; I762-I773 HydrophobicContact CD1-CD1 4.01Å; I762-I773 HydrophobicContact CG1-CD1 4.1Å; I762-L803 HydrophobicContact CD1-CD2 3.98Å; I762-L812 HydrophobicContact CB-CD2 4.24Å; I762-L812 HydrophobicContact CD1-CD1 3.52Å; I762-L812 HydrophobicContact CD1-CD2 3.77Å; I762-L812 HydrophobicContact CD1-CG 4.31Å; I762-L812 HydrophobicContact CG2-CD2 4.02Å; I762-F828 HydrophobicContact CD1-CB 3.69Å; I762-F828 HydrophobicContact CD1-CG 4.38Å; I762-F828 HydrophobicContact CG1-CB 4.32Å; I762-F828 HydrophobicContact CG2-CB 4.43Å; I762-F828 VanDerWaalsContact CG2-O 3.3Å; I762-F828 WeakPolarHBondContact CG2-O 3.22Å; I762-I830 HydrophobicContact CG2-CB 4.33Å
763	G	89.1	Confident	90.1	Very high	12 Å²	12	25.9 Å²	25.9	12%	0.124	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-34.6	176.5	0	0	0	0	0	114.2	L759	L759-G763 WeakPolarHBondContact O-CA 3.2Å; L759-G763 PolarHBondContact O-N 3Å
764	L	90.3	Very high	90.4	Very high	16 Å²	16	29 Å²	29	8%	0.084	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.9	173.4	-67.1	172.9	0	0	0	113.8	N446 I449 E450 K483 S760 I762 I766 F838	N446-L764 HydrophobicContact CB-CD1 4.09Å; N446-L764 HydrophobicContact CB-CD2 4.32Å; N446-L764 VanDerWaalsContact O-CD2 3.26Å; N446-L764 WeakPolarHBondContact O-CD2 3.38Å; I449-L764 HydrophobicContact CB-CD1 4.41Å; I449-L764 HydrophobicContact CB-CD2 4.42Å; I449-L764 HydrophobicContact CD1-CD1 4.46Å; I449-L764 HydrophobicContact CG2-CB 4.02Å; I449-L764 HydrophobicContact CG2-CD1 4.33Å; I449-L764 HydrophobicContact CG2-CD2 4.34Å; I449-L764 HydrophobicContact CG2-CG 4.47Å; E450-L764 HydrophobicContact CB-CD2 3.95Å; K483-L764 HydrophobicContact CD-CD1 4.28Å; S760-L764 VanDerWaalsContact O-CB 3.25Å; S760-L764 WeakPolarHBondContact O-CB 3.49Å; S760-L764 WeakPolarHBondContact O-CG 3.26Å; S760-L764 PolarHBondContact O-N 3.19Å; I762-L764 VanDerWaalsContact C-N 3.32Å; I762-L764 PolarHBondContact O-N 3.4Å; L764-I766 HydrophobicContact CB-CD1 3.81Å; L764-I766 HydrophobicContact CB-CG1 3.8Å; L764-I766 HydrophobicContact CD1-CD1 3.8Å; L764-I766 HydrophobicContact CG-CD1 4.48Å; L764-I766 PolarHBondContact O-N 3.28Å; L764-F838 HydrophobicContact CD1-CZ 4.09Å; L764-F838 HydrophobicContact CD2-CE1 4.09Å; L764-F838 HydrophobicContact CD2-CZ 3.8Å; L764-F838 HydrophobicContact CG-CE1 4.18Å; L764-F838 HydrophobicContact CG-CZ 3.67Å
765	K	90.3	Very high	90.6	Very high	176 Å²	176	35 Å²	35	77%	0.765	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	31.7	-174.5	-51.5	-178.9	-178.3	-178.8	0	114.1	L761 I762	L761-K765 PolarHBondContact O-N 2.73Å; L761-K765 VanDerWaalsContact O-N 3.09Å; I762-K765 PolarHBondContact O-N 2.84Å
766	I	89.4	Confident	90.8	Very high	25 Å²	25	34.5 Å²	34.5	13%	0.128	17%	0.173	C	C	.	.	S	Bend	trans	-72.4	-42.1	175.2	-62.6	168.2	0	0	0	110	I449 K483 Y486 L761 L764 F776	I449-I766 HydrophobicContact CD1-CD1 3.96Å; I449-I766 HydrophobicContact CG2-CD1 4.18Å; I449-I766 HydrophobicContact CG2-CG1 4.02Å; K483-I766 HydrophobicContact CD-CD1 3.84Å; K483-I766 HydrophobicContact CG-CD1 3.92Å; Y486-I766 HydrophobicContact CD1-CG2 3.52Å; Y486-I766 HydrophobicContact CE1-CG2 3.68Å; L761-I766 HydrophobicContact CD2-CB 4.15Å; L761-I766 HydrophobicContact CD2-CD1 4.07Å; L761-I766 HydrophobicContact CD2-CG2 4.07Å; L761-I766 PolarHBondContact O-N 2.99Å; L764-I766 HydrophobicContact CB-CD1 3.81Å; L764-I766 HydrophobicContact CB-CG1 3.8Å; L764-I766 HydrophobicContact CD1-CD1 3.8Å; L764-I766 HydrophobicContact CG-CD1 4.48Å; L764-I766 PolarHBondContact O-N 3.28Å; I766-F776 HydrophobicContact CG2-CD2 4.38Å; I766-F776 HydrophobicContact CG2-CE2 4.5Å
767	A	89.2	Confident	91	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.025	16%	0.156	C	C	.	.			trans	-145.7	127.4	175.5	0	0	0	0	0	109	I762 D772 I773	I762-A767 WeakPolarHBondContact CG1-O 3.3Å; A767-D772 HydrophobicContact CB-CB 3.76Å; A767-I773 HydrophobicContact CB-CG1 3.79Å
768	T	87.3	Confident	91	Very high	38 Å²	38	35.4 Å²	35.4	23%	0.233	18%	0.175	C	C	.	.			trans	-116	-20.7	-179.4	54.1	0	0	0	0	113.4	F828	T768-F828 PolarHBondContact O-N 2.7Å
769	N	90.4	Very high	90.9	Very high	30 Å²	30	37.3 Å²	37.3	16%	0.16	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-102.9	150	-174.2	-41.2	-37	0	0	0	108.7	D771 D772 I773 N827	N769-D771 PolarHBondContact O-N 2.79Å; N769-D772 WeakPolarHBondContact CB-OD2 3.31Å; N769-D772 PolarHBondContact ND2-OD2 3.26Å; N769-D772 PolarHBondContact O-N 2.73Å; N769-I773 WeakPolarHBondContact O-CG1 3.37Å; N769-I773 PolarHBondContact O-N 3.47Å; N769-I773 VanDerWaalsContact O-N 3.09Å; N769-N827 VanDerWaalsContact OD1-CG 3.28Å; N769-N827 PolarHBondContact OD1-ND2 2.68Å; N769-N827 PolarHBondContact OD1-OD1 2.76Å
770	L	89	Confident	91.1	Very high	17 Å²	17	37.1 Å²	37.1	9%	0.089	19%	0.194	C	C	.	.	H	α-helix	trans	-55.2	-39.4	-176.6	-174.9	60.1	0	0	0	112.8	I773 Y774 W796 T799 V800 L803 Y826 F828	L770-I773 PolarHBondContact O-N 2.85Å; L770-Y774 WeakPolarHBondContact O-CB 3.32Å; L770-Y774 PolarHBondContact O-N 3.16Å; L770-W796 HydrophobicContact CD2-CH2 3.46Å; L770-W796 VanDerWaalsContact CD2-CH2 3.46Å; L770-W796 HydrophobicContact CD2-CZ2 3.61Å; L770-W796 HydrophobicContact CD2-CZ3 4.32Å; L770-W796 HydrophobicContact CG-CH2 3.63Å; L770-W796 HydrophobicContact CG-CZ2 4.23Å; L770-W796 HydrophobicContact CG-CZ3 4.03Å; L770-T799 HydrophobicContact CD1-CG2 4.16Å; L770-V800 HydrophobicContact CD1-CG2 4.23Å; L770-V800 HydrophobicContact CD2-CG2 4.36Å; L770-L803 HydrophobicContact CD1-CD1 3.51Å; L770-Y826 HydrophobicContact CD2-CD2 4.34Å; L770-Y826 PolarHBondContact N-O 3.08Å; L770-F828 HydrophobicContact CB-CE2 4.34Å; L770-F828 HydrophobicContact CD1-CE2 4.36Å
771	D	89.3	Confident	91.2	Very high	77 Å²	77	37 Å²	37	41%	0.412	19%	0.194	S	C	.	.	H	α-helix	trans	-68.7	-41	-178	-43.1	-76	0	0	0	112.2	N769 Y774 H775 Q825	N769-D771 PolarHBondContact O-N 2.79Å; D771-Y774 PolarHBondContact O-N 3.12Å; D771-H775 WeakPolarHBondContact O-CB 3.26Å; D771-H775 PolarHBondContact O-N 3.2Å; D771-Q825 PolarHBondContact OD2-NE2 3.2Å
772	D	91.1	Very high	91.2	Very high	57 Å²	57	37 Å²	37	31%	0.305	19%	0.194	S	C	.	.	H	α-helix	trans	-68.7	-38	177.3	-61	-47.7	0	0	0	111.4	A767 N769 H775 F776	A767-D772 HydrophobicContact CB-CB 3.76Å; N769-D772 WeakPolarHBondContact CB-OD2 3.31Å; N769-D772 PolarHBondContact ND2-OD2 3.26Å; N769-D772 PolarHBondContact O-N 2.73Å; D772-H775 PolarHBondContact O-N 3.09Å; D772-F776 WeakPolarHBondContact O-CB 3.26Å; D772-F776 PolarHBondContact O-N 3.09Å
773	I	92.4	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.8	-41.4	174.9	-63.8	165	0	0	0	110	F758 I762 A767 N769 L770 F776 M777 T799 L803 F828	F758-I773 HydrophobicContact CD1-CG2 3.8Å; F758-I773 HydrophobicContact CE1-CG2 3.44Å; F758-I773 VanDerWaalsContact CE1-CG2 3.44Å; F758-I773 HydrophobicContact CE2-CG2 4.31Å; F758-I773 HydrophobicContact CG-CG2 4.37Å; F758-I773 HydrophobicContact CZ-CG2 3.74Å; I762-I773 HydrophobicContact CD1-CD1 4.01Å; I762-I773 HydrophobicContact CG1-CD1 4.1Å; A767-I773 HydrophobicContact CB-CG1 3.79Å; N769-I773 WeakPolarHBondContact O-CG1 3.37Å; N769-I773 PolarHBondContact O-N 3.47Å; N769-I773 VanDerWaalsContact O-N 3.09Å; L770-I773 PolarHBondContact O-N 2.85Å; I773-F776 WeakPolarHBondContact O-CB 3.47Å; I773-F776 PolarHBondContact O-N 2.96Å; I773-M777 WeakPolarHBondContact O-CG 3.31Å; I773-M777 PolarHBondContact O-N 2.79Å; I773-T799 HydrophobicContact CG2-CG2 4Å; I773-L803 HydrophobicContact CD1-CD1 4.19Å; I773-L803 HydrophobicContact CD1-CD2 4.23Å; I773-L803 HydrophobicContact CG2-CD1 4.41Å; I773-F828 HydrophobicContact CD1-CD2 4.17Å
774	Y	92.1	Very high	91.3	Very high	78 Å²	78	39.2 Å²	39.2	31%	0.306	21%	0.208	S	C	.	.	H	α-helix	trans	-65	-43.1	173.8	-179.8	-110.5	0	0	0	112.1	L770 D771 F776 M777 N778 L795 W796	L770-Y774 WeakPolarHBondContact O-CB 3.32Å; L770-Y774 PolarHBondContact O-N 3.16Å; D771-Y774 PolarHBondContact O-N 3.12Å; Y774-F776 VanDerWaalsContact C-N 3.31Å; Y774-F776 PolarHBondContact O-N 3.11Å; Y774-M777 PolarHBondContact O-N 3.01Å; Y774-N778 WeakPolarHBondContact CD1-ND2 3.32Å; Y774-N778 VanDerWaalsContact CE1-ND2 3.29Å; Y774-N778 WeakPolarHBondContact CE1-ND2 3.25Å; Y774-N778 PolarHBondContact O-N 3.39Å; Y774-N778 PolarHBondContact O-ND2 3.2Å; Y774-L795 HydrophobicContact CD2-CG 4.4Å; Y774-L795 HydrophobicContact CE2-CB 3.98Å; Y774-L795 HydrophobicContact CE2-CD2 4.07Å; Y774-L795 HydrophobicContact CE2-CG 3.99Å; Y774-W796 HydrophobicContact CD1-CE3 4.17Å; Y774-W796 HydrophobicContact CD1-CZ3 4.39Å; Y774-W796 HydrophobicContact CD2-CB 4.42Å; Y774-W796 AromaticContact CD2-CE3 3.77Å; Y774-W796 HydrophobicContact CD2-CE3 3.77Å; Y774-W796 HydrophobicContact CE2-CB 4.02Å; Y774-W796 HydrophobicContact CE2-CE3 4.23Å; Y774-W796 AromaticContact CG-CE3 3.72Å; Y774-W796 HydrophobicContact CG-CE3 3.72Å; Y774-W796 HydrophobicContact CG-CZ3 4.06Å
775	H	92.5	Very high	91.4	Very high	126 Å²	126	38.4 Å²	38.4	58%	0.583	20%	0.204	S	C	*	.	H	α-helix	trans	-60.7	-40.8	173.4	-172.5	-46.3	0	0	0	111.4	D771 D772 N778 G779	D771-H775 WeakPolarHBondContact O-CB 3.26Å; D771-H775 PolarHBondContact O-N 3.2Å; D772-H775 PolarHBondContact O-N 3.09Å; H775-N778 PolarHBondContact O-N 2.86Å; H775-G779 PolarHBondContact O-N 3.21Å
776	F	94.4	Very high	91.2	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-47.5	173.5	-172.9	-77.6	0	0	0	111	A482 K483 Y486 L757 L761 I766 D772 I773 Y774 N778 G779 T780	A482-F776 HydrophobicContact CB-CE1 3.86Å; A482-F776 HydrophobicContact CB-CZ 3.6Å; K483-F776 HydrophobicContact CB-CZ 4.5Å; K483-F776 HydrophobicContact CG-CE2 4.03Å; K483-F776 HydrophobicContact CG-CZ 3.77Å; Y486-F776 AromaticContact CD1-CD2 3.97Å; Y486-F776 HydrophobicContact CD1-CD2 3.97Å; Y486-F776 HydrophobicContact CD1-CE2 4.38Å; Y486-F776 HydrophobicContact CD2-CB 4.31Å; Y486-F776 AromaticContact CD2-CD2 3.62Å; Y486-F776 HydrophobicContact CD2-CD2 3.62Å; Y486-F776 HydrophobicContact CD2-CE2 4.34Å; Y486-F776 HydrophobicContact CD2-CG 4.35Å; Y486-F776 HydrophobicContact CE1-CD2 4.45Å; Y486-F776 HydrophobicContact CE2-CB 4.16Å; Y486-F776 HydrophobicContact CE2-CD2 4.14Å; Y486-F776 AromaticContact CG-CD2 3.53Å; Y486-F776 HydrophobicContact CG-CD2 3.53Å; Y486-F776 AromaticContact CG-CE2 3.89Å; Y486-F776 HydrophobicContact CG-CE2 3.89Å; L757-F776 HydrophobicContact CD1-CE1 3.82Å; L757-F776 HydrophobicContact CD1-CZ 4.28Å; L757-F776 HydrophobicContact CD2-CD1 4.42Å; L757-F776 HydrophobicContact CD2-CE1 4.02Å; L757-F776 HydrophobicContact CG-CE1 4.37Å; L761-F776 HydrophobicContact CD1-CB 4.17Å; L761-F776 HydrophobicContact CD1-CD1 3.54Å; L761-F776 HydrophobicContact CD1-CD2 4.25Å; L761-F776 HydrophobicContact CD1-CE1 4.04Å; L761-F776 HydrophobicContact CD1-CG 3.69Å; L761-F776 HydrophobicContact CD2-CD1 4.11Å; L761-F776 HydrophobicContact CD2-CD2 3.68Å; L761-F776 HydrophobicContact CD2-CE1 3.97Å; L761-F776 HydrophobicContact CD2-CE2 3.52Å; L761-F776 HydrophobicContact CD2-CG 3.99Å; L761-F776 HydrophobicContact CD2-CZ 3.68Å; L761-F776 HydrophobicContact CG-CD1 4.43Å; I766-F776 HydrophobicContact CG2-CD2 4.38Å; I766-F776 HydrophobicContact CG2-CE2 4.5Å; D772-F776 WeakPolarHBondContact O-CB 3.26Å; D772-F776 PolarHBondContact O-N 3.09Å; I773-F776 WeakPolarHBondContact O-CB 3.47Å; I773-F776 PolarHBondContact O-N 2.96Å; Y774-F776 VanDerWaalsContact C-N 3.31Å; Y774-F776 PolarHBondContact O-N 3.11Å; F776-N778 VanDerWaalsContact C-N 3.31Å; F776-N778 PolarHBondContact O-N 3.39Å; F776-G779 WeakPolarHBondContact O-CA 3.3Å; F776-G779 PolarHBondContact O-N 3.27Å; F776-T780 HydrophobicContact CD1-CG2 4.05Å; F776-T780 HydrophobicContact CE1-CG2 3.79Å; F776-T780 PolarHBondContact O-N 2.79Å
777	M	92.7	Very high	90.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-37.1	-179.8	-76.1	-59.8	-68.4	0	0	113.1	I754 L757 F758 I773 Y774 G779 T780 F782 G783 L795	I754-M777 HydrophobicContact CD1-CE 4.04Å; I754-M777 HydrophobicContact CG1-CE 4.11Å; I754-M777 HydrophobicContact CG2-CE 4.12Å; I754-M777 HydrophobicContact CG2-SD 4.48Å; L757-M777 HydrophobicContact CD2-SD 3.76Å; F758-M777 HydrophobicContact CE1-CG 3.56Å; F758-M777 HydrophobicContact CE1-SD 3.52Å; F758-M777 VanDerWaalsContact CE1-SD 3.52Å; F758-M777 HydrophobicContact CZ-CG 3.82Å; F758-M777 HydrophobicContact CZ-SD 4.04Å; I773-M777 WeakPolarHBondContact O-CG 3.31Å; I773-M777 PolarHBondContact O-N 2.79Å; Y774-M777 PolarHBondContact O-N 3.01Å; M777-G779 PolarHBondContact O-N 3.4Å; M777-T780 PolarHBondContact O-N 3.21Å; M777-T780 VanDerWaalsContact O-N 3.1Å; M777-T780 PolarHBondContact O-OG1 3.29Å; M777-T780 HydrophobicContact SD-CG2 4.21Å; M777-F782 HydrophobicContact CE-CD1 3.8Å; M777-F782 HydrophobicContact CE-CE1 4.38Å; M777-G783 WeakPolarHBondContact O-CA 3.36Å; M777-L795 HydrophobicContact CB-CD1 4.19Å; M777-L795 HydrophobicContact CB-CD2 4.1Å; M777-L795 HydrophobicContact CB-CG 4.23Å; M777-L795 HydrophobicContact CE-CD1 4.01Å
778	N	91.9	Very high	90.6	Very high	74 Å²	74	41.9 Å²	41.9	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-26.3	173.2	-74.9	-76.5	0	0	0	112.9	Y774 H775 F776	Y774-N778 WeakPolarHBondContact CD1-ND2 3.32Å; Y774-N778 VanDerWaalsContact CE1-ND2 3.29Å; Y774-N778 WeakPolarHBondContact CE1-ND2 3.25Å; Y774-N778 PolarHBondContact O-N 3.39Å; Y774-N778 PolarHBondContact O-ND2 3.2Å; H775-N778 PolarHBondContact O-N 2.86Å; F776-N778 VanDerWaalsContact C-N 3.31Å; F776-N778 PolarHBondContact O-N 3.39Å
779	G	91.3	Very high	90.3	Very high	41 Å²	41	43 Å²	43	42%	0.423	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	4.3	175.2	0	0	0	0	0	115.4	F509 H775 F776 M777	F509-G779 WeakPolarHBondContact CD2-O 3.49Å; F509-G779 WeakPolarHBondContact CE2-O 3.39Å; H775-G779 PolarHBondContact O-N 3.21Å; F776-G779 WeakPolarHBondContact O-CA 3.3Å; F776-G779 PolarHBondContact O-N 3.27Å; M777-G779 PolarHBondContact O-N 3.4Å
780	T	94.5	Very high	89.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-87.3	161.9	174.9	64.4	0	0	0	0	111.7	E478 A482 L746 L757 F776 M777 F782 G783 V784	E478-T780 WeakPolarHBondContact OE1-CB 3.49Å; A482-T780 HydrophobicContact CB-CG2 4.11Å; L746-T780 HydrophobicContact CD1-CG2 4.38Å; L757-T780 HydrophobicContact CD2-CG2 4.21Å; F776-T780 HydrophobicContact CD1-CG2 4.05Å; F776-T780 HydrophobicContact CE1-CG2 3.79Å; F776-T780 PolarHBondContact O-N 2.79Å; M777-T780 PolarHBondContact O-N 3.21Å; M777-T780 VanDerWaalsContact O-N 3.1Å; M777-T780 PolarHBondContact O-OG1 3.29Å; M777-T780 HydrophobicContact SD-CG2 4.21Å; T780-F782 VanDerWaalsContact C-N 3.26Å; T780-F782 PolarHBondContact O-N 2.89Å; T780-G783 WeakPolarHBondContact O-CA 3.19Å; T780-G783 PolarHBondContact O-N 3.4Å; T780-G783 PolarHBondContact OG1-N 3.24Å; T780-V784 PolarHBondContact O-N 2.89Å; T780-V784 VanDerWaalsContact O-N 3.11Å
781	F	93.8	Very high	89.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-34.4	173.5	-175.1	-132.8	0	0	0	110.3	I468 E478 D505 L506 F509 C742 G783 V784 Q785	I468-F781 HydrophobicContact CD1-CD1 4.11Å; I468-F781 HydrophobicContact CD1-CG 4.43Å; I468-F781 HydrophobicContact CG1-CD1 4.33Å; I468-F781 HydrophobicContact CG2-CE1 4.32Å; E478-F781 HydrophobicContact CG-CB 3.87Å; E478-F781 WeakPolarHBondContact OE1-CA 3.21Å; E478-F781 WeakPolarHBondContact OE1-CB 3.45Å; E478-F781 PolarHBondContact OE1-N 3.42Å; D505-F781 HydrophobicContact CB-CE2 3.81Å; L506-F781 HydrophobicContact CD2-CD2 4.06Å; L506-F781 HydrophobicContact CD2-CE1 4.07Å; L506-F781 HydrophobicContact CD2-CE2 3.52Å; L506-F781 HydrophobicContact CD2-CZ 3.52Å; L506-F781 HydrophobicContact CG-CE2 3.88Å; L506-F781 HydrophobicContact CG-CZ 3.96Å; F509-F781 HydrophobicContact CB-CB 4.34Å; F509-F781 HydrophobicContact CB-CD2 3.96Å; F509-F781 HydrophobicContact CD1-CB 3.71Å; F509-F781 HydrophobicContact CD1-CD2 4.18Å; F509-F781 HydrophobicContact CD1-CG 4.17Å; F509-F781 HydrophobicContact CD2-CB 4.11Å; F509-F781 HydrophobicContact CE1-CB 3.98Å; F509-F781 HydrophobicContact CE2-CB 4.36Å; F509-F781 HydrophobicContact CG-CB 3.79Å; F509-F781 HydrophobicContact CG-CD2 4.23Å; F509-F781 HydrophobicContact CG-CG 4.41Å; F509-F781 HydrophobicContact CZ-CB 4.29Å; C742-F781 HydrophobicContact CB-CE1 4.43Å; C742-F781 HydrophobicContact CB-CZ 4.24Å; C742-F781 WeakPolarHBondContact O-CZ 3.39Å; F781-G783 VanDerWaalsContact C-N 3.33Å; F781-G783 PolarHBondContact O-N 3.19Å; F781-V784 PolarHBondContact O-N 3.25Å; F781-Q785 HydrophobicContact CD2-CG 4.41Å; F781-Q785 HydrophobicContact CE2-CG 4.23Å; F781-Q785 VanDerWaalsContact CZ-NE2 3.32Å; F781-Q785 WeakPolarHBondContact O-CB 3.45Å; F781-Q785 WeakPolarHBondContact O-CG 3.43Å; F781-Q785 PolarHBondContact O-N 2.97Å
782	F	92.8	Very high	88.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-43.4	165.8	-179	-116.8	0	0	0	112.4	E478 S744 L746 V747 I754 M777 T780 V784 Q785 Q786 L789 L790 L795 I798	E478-F782 PolarHBondContact OE1-N 2.95Å; S744-F782 WeakPolarHBondContact OG-CB 3.44Å; L746-F782 HydrophobicContact CB-CB 4.34Å; L746-F782 HydrophobicContact CD1-CB 3.92Å; V747-F782 HydrophobicContact CG2-CD1 4.49Å; V747-F782 HydrophobicContact CG2-CD2 3.7Å; V747-F782 HydrophobicContact CG2-CE1 4.12Å; V747-F782 HydrophobicContact CG2-CE2 3.29Å; V747-F782 HydrophobicContact CG2-CG 4.32Å; V747-F782 HydrophobicContact CG2-CZ 3.53Å; I754-F782 HydrophobicContact CD1-CD1 4.21Å; I754-F782 HydrophobicContact CD1-CE1 4.09Å; M777-F782 HydrophobicContact CE-CD1 3.8Å; M777-F782 HydrophobicContact CE-CE1 4.38Å; T780-F782 VanDerWaalsContact C-N 3.26Å; T780-F782 PolarHBondContact O-N 2.89Å; F782-V784 VanDerWaalsContact C-N 3.33Å; F782-V784 PolarHBondContact O-N 3.3Å; F782-Q785 CarbonylContact O-C 3.3Å; F782-Q785 PolarHBondContact O-N 2.87Å; F782-Q785 VanDerWaalsContact O-N 3.08Å; F782-Q786 HydrophobicContact CE1-CB 4.4Å; F782-Q786 HydrophobicContact CE1-CG 4.43Å; F782-Q786 HydrophobicContact CE2-CB 4.29Å; F782-Q786 HydrophobicContact CZ-CB 4.05Å; F782-Q786 HydrophobicContact CZ-CG 4.01Å; F782-Q786 WeakPolarHBondContact O-CA 3.34Å; F782-Q786 WeakPolarHBondContact O-CB 3.46Å; F782-Q786 PolarHBondContact O-N 3.41Å; F782-L789 HydrophobicContact CD2-CD1 4.04Å; F782-L789 HydrophobicContact CE2-CB 4.32Å; F782-L789 HydrophobicContact CE2-CD1 4.34Å; F782-L790 HydrophobicContact CZ-CD1 4.11Å; F782-L795 HydrophobicContact CD1-CD1 3.87Å; F782-L795 HydrophobicContact CE1-CD1 3.55Å; F782-I798 HydrophobicContact CE1-CD1 4.17Å; F782-I798 HydrophobicContact CZ-CD1 3.93Å
783	G	91.4	Very high	88.3	Confident	16 Å²	16	58 Å²	58	17%	0.165	29%	0.287	C	S	.	.	H	α-helix	trans	-57	-44.5	176.7	0	0	0	0	0	112.6	M777 T780 F781 Q785	M777-G783 WeakPolarHBondContact O-CA 3.36Å; T780-G783 WeakPolarHBondContact O-CA 3.19Å; T780-G783 PolarHBondContact O-N 3.4Å; T780-G783 PolarHBondContact OG1-N 3.24Å; F781-G783 VanDerWaalsContact C-N 3.33Å; F781-G783 PolarHBondContact O-N 3.19Å; G783-Q785 VanDerWaalsContact C-N 3.35Å; G783-Q785 PolarHBondContact O-N 3.14Å
784	V	91.9	Very high	88	Confident	47 Å²	47	60 Å²	60	29%	0.285	30%	0.301	S	S	.	.	H	α-helix	trans	-62.3	-40.8	173.5	177.7	0	0	0	0	111.6	D505 K508 F509 T780 F781 F782	D505-V784 HydrophobicContact CB-CG1 4.02Å; K508-V784 HydrophobicContact CB-CG1 4.04Å; K508-V784 HydrophobicContact CB-CG2 4.34Å; K508-V784 HydrophobicContact CD-CG1 4.12Å; F509-V784 HydrophobicContact CB-CG2 4.22Å; T780-V784 PolarHBondContact O-N 2.89Å; T780-V784 VanDerWaalsContact O-N 3.11Å; F781-V784 PolarHBondContact O-N 3.25Å; F782-V784 VanDerWaalsContact C-N 3.33Å; F782-V784 PolarHBondContact O-N 3.3Å
785	Q	91.1	Very high	87.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-97.6	1.7	-172.4	-64.8	-171	-34.7	0	0	115.5	D505 C742 Y743 F781 F782 G783 K787 I788 L789	D505-Q785 HydrophobicContact CB-CG 4.28Å; D505-Q785 PolarHBondContact OD2-NE2 3.01Å; C742-Q785 PolarHBondContact O-NE2 3.4Å; Y743-Q785 VanDerWaalsContact CA-OE1 3.27Å; F781-Q785 HydrophobicContact CD2-CG 4.41Å; F781-Q785 HydrophobicContact CE2-CG 4.23Å; F781-Q785 VanDerWaalsContact CZ-NE2 3.32Å; F781-Q785 WeakPolarHBondContact O-CB 3.45Å; F781-Q785 WeakPolarHBondContact O-CG 3.43Å; F781-Q785 PolarHBondContact O-N 2.97Å; F782-Q785 CarbonylContact O-C 3.3Å; F782-Q785 PolarHBondContact O-N 2.87Å; F782-Q785 VanDerWaalsContact O-N 3.08Å; G783-Q785 VanDerWaalsContact C-N 3.35Å; G783-Q785 PolarHBondContact O-N 3.14Å; Q785-K787 VanDerWaalsContact C-N 3.28Å; Q785-K787 PolarHBondContact O-N 2.67Å; Q785-K787 VanDerWaalsContact O-N 3.17Å; Q785-I788 WeakPolarHBondContact O-CA 3.38Å; Q785-I788 WeakPolarHBondContact O-CB 3.36Å; Q785-I788 PolarHBondContact O-N 3.13Å; Q785-L789 HydrophobicContact CB-CD1 3.88Å; Q785-L789 HydrophobicContact CB-CG 4.31Å; Q785-L789 PolarHBondContact O-N 2.76Å
786	Q	86.1	Confident	87.5	Confident	26 Å²	26	55.5 Å²	55.5	12%	0.121	28%	0.279	C	S	.	.	H	α-helix	trans	-55.1	-41.9	-171.9	170.4	-85.2	-22.6	0	0	112.2	F782 I788 L789 L790 K793 L795	F782-Q786 HydrophobicContact CE1-CB 4.4Å; F782-Q786 HydrophobicContact CE1-CG 4.43Å; F782-Q786 HydrophobicContact CE2-CB 4.29Å; F782-Q786 HydrophobicContact CZ-CB 4.05Å; F782-Q786 HydrophobicContact CZ-CG 4.01Å; F782-Q786 WeakPolarHBondContact O-CA 3.34Å; F782-Q786 WeakPolarHBondContact O-CB 3.46Å; F782-Q786 PolarHBondContact O-N 3.41Å; Q786-I788 PolarHBondContact O-N 2.8Å; Q786-L789 PolarHBondContact O-N 3.31Å; Q786-L790 PolarHBondContact NE2-O 3.01Å; Q786-L790 VanDerWaalsContact NE2-O 3.17Å; Q786-L790 CarbonylContact O-C 3.44Å; Q786-L790 PolarHBondContact O-N 3.14Å; Q786-K793 PolarHBondContact NE2-O 2.81Å; Q786-L795 HydrophobicContact CG-CB 4.29Å
787	K	83.4	Confident	87.2	Confident	168 Å²	168	59.7 Å²	59.7	73%	0.73	30%	0.299	S	S	*	.	H	α-helix	trans	-66.9	-17.2	178.5	-60.4	-177.9	-178.2	176.5	0	114.2	Q785 K791	Q785-K787 VanDerWaalsContact C-N 3.28Å; Q785-K787 PolarHBondContact O-N 2.67Å; Q785-K787 VanDerWaalsContact O-N 3.17Å; K787-K791 VanDerWaalsContact O-CG 3.3Å; K787-K791 WeakPolarHBondContact O-CG 3.42Å
788	I	83.6	Confident	87	Confident	83 Å²	83	59.8 Å²	59.8	43%	0.426	30%	0.299	S	S	.	.	H	α-helix	trans	-88.9	-47.5	175.9	-54.4	175.6	0	0	0	109.2	Y743 Q785 Q786	Y743-I788 HydrophobicContact CE1-CG2 4.18Å; Q785-I788 WeakPolarHBondContact O-CA 3.38Å; Q785-I788 WeakPolarHBondContact O-CB 3.36Å; Q785-I788 PolarHBondContact O-N 3.13Å; Q786-I788 PolarHBondContact O-N 2.8Å
789	L	81.4	Confident	86.9	Confident	60 Å²	60	56.3 Å²	56.3	31%	0.314	28%	0.28	S	S	.	.	H	α-helix	trans	-84.9	-40.1	-170.1	-63.7	171.8	0	0	0	114.2	Y743 F782 Q785 Q786	Y743-L789 HydrophobicContact CD1-CD2 3.96Å; Y743-L789 HydrophobicContact CG-CD2 4Å; F782-L789 HydrophobicContact CD2-CD1 4.04Å; F782-L789 HydrophobicContact CE2-CB 4.32Å; F782-L789 HydrophobicContact CE2-CD1 4.34Å; Q785-L789 HydrophobicContact CB-CD1 3.88Å; Q785-L789 HydrophobicContact CB-CG 4.31Å; Q785-L789 PolarHBondContact O-N 2.76Å; Q786-L789 PolarHBondContact O-N 3.31Å
790	L	80.7	Confident	86.8	Confident	51 Å²	51	57.2 Å²	57.2	27%	0.267	28%	0.278	S	S	.	.			trans	-134.1	85.7	-179.5	-74.7	-178.8	0	0	0	110.6	V747 F782 Q786 E792 I798	V747-L790 HydrophobicContact CG1-CD1 3.83Å; V747-L790 HydrophobicContact CG1-CG 4.4Å; V747-L790 HydrophobicContact CG2-CD1 3.94Å; F782-L790 HydrophobicContact CZ-CD1 4.11Å; Q786-L790 PolarHBondContact NE2-O 3.01Å; Q786-L790 VanDerWaalsContact NE2-O 3.17Å; Q786-L790 CarbonylContact O-C 3.44Å; Q786-L790 PolarHBondContact O-N 3.14Å; L790-E792 VanDerWaalsContact C-N 3.28Å; L790-E792 PolarHBondContact O-N 3.13Å; L790-I798 HydrophobicContact CB-CD1 4.42Å; L790-I798 HydrophobicContact CD1-CD1 3.6Å; L790-I798 HydrophobicContact CD1-CG1 4.43Å
791	K	77.4	Confident	86.6	Confident	177 Å²	177	60.6 Å²	60.6	77%	0.77	29%	0.294	S	S	*	.	S	Bend	trans	-71.2	-20.9	178.5	-67.5	174.4	-175.9	176.4	0	114	K787	K787-K791 VanDerWaalsContact O-CG 3.3Å; K787-K791 WeakPolarHBondContact O-CG 3.42Å
792	E	78.6	Confident	86.4	Confident	187 Å²	187	60.7 Å²	60.7	87%	0.874	29%	0.294	S	S	*	.	S	Bend	trans	-91.9	-23.2	-169.2	-60.7	-178.9	171.6	0	0	114.3	L790	L790-E792 VanDerWaalsContact C-N 3.28Å; L790-E792 PolarHBondContact O-N 3.13Å
793	K	80.3	Confident	86.3	Confident	82 Å²	82	60.8 Å²	60.8	36%	0.357	29%	0.294	S	S	.	.	S	Bend	trans	-124.1	137.5	-178.8	-72.9	-174.4	171.7	-177.5	0	110.9	Q786 E797 I798 E801	Q786-K793 PolarHBondContact NE2-O 2.81Å; K793-E797 VanDerWaalsContact CA-OE2 3.27Å; K793-E797 WeakPolarHBondContact CA-OE2 3.14Å; K793-I798 HydrophobicContact CB-CD1 4.16Å; K793-I798 HydrophobicContact CB-CG1 3.96Å; K793-I798 HydrophobicContact CD-CG1 4.35Å; K793-E801 VanDerWaalsContact NZ-CD 3.31Å; K793-E801 IonicContact NZ-OE1 2.72Å; K793-E801 PolarHBondContact NZ-OE1 3.37Å; K793-E801 IonicContact NZ-OE2 2.7Å; K793-E801 PolarHBondContact NZ-OE2 3.34Å
794	S	87.3	Confident	86.3	Confident	42 Å²	42	65.8 Å²	65.8	29%	0.294	31%	0.308	S	S	.	.			trans	-70.8	156.3	171.6	73.4	0	0	0	0	112	W796 E797 I798	S794-W796 PolarHBondContact O-N 3.12Å; S794-E797 WeakPolarHBondContact CB-OE1 3.36Å; S794-E797 PolarHBondContact N-OE1 3.28Å; S794-E797 PolarHBondContact N-OE2 3.46Å; S794-E797 VanDerWaalsContact N-OE2 3.15Å; S794-E797 PolarHBondContact O-N 2.75Å; S794-E797 WeakPolarHBondContact OG-CG 3.41Å; S794-E797 PolarHBondContact OG-N 2.91Å; S794-E797 PolarHBondContact OG-OE1 2.99Å; S794-I798 WeakPolarHBondContact O-CG1 3.46Å; S794-I798 PolarHBondContact O-N 2.95Å; S794-I798 VanDerWaalsContact O-N 3.16Å
795	L	86.5	Confident	86.1	Confident	9 Å²	9	67.6 Å²	67.6	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-29	173.6	-173.7	64.3	0	0	0	112.2	Y774 M777 F782 Q786 T799	Y774-L795 HydrophobicContact CD2-CG 4.4Å; Y774-L795 HydrophobicContact CE2-CB 3.98Å; Y774-L795 HydrophobicContact CE2-CD2 4.07Å; Y774-L795 HydrophobicContact CE2-CG 3.99Å; M777-L795 HydrophobicContact CB-CD1 4.19Å; M777-L795 HydrophobicContact CB-CD2 4.1Å; M777-L795 HydrophobicContact CB-CG 4.23Å; M777-L795 HydrophobicContact CE-CD1 4.01Å; F782-L795 HydrophobicContact CD1-CD1 3.87Å; F782-L795 HydrophobicContact CE1-CD1 3.55Å; Q786-L795 HydrophobicContact CG-CB 4.29Å; L795-T799 WeakPolarHBondContact O-CB 3.48Å; L795-T799 PolarHBondContact O-N 2.68Å; L795-T799 VanDerWaalsContact O-N 3.09Å; L795-T799 PolarHBondContact O-OG1 2.76Å
796	W	87.4	Confident	86.1	Confident	101 Å²	101	67.6 Å²	67.6	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-68.7	-48.5	175.7	-179.5	-100.7	0	0	0	112.1	L770 Y774 S794 I798 T799 V800	L770-W796 HydrophobicContact CD2-CH2 3.46Å; L770-W796 VanDerWaalsContact CD2-CH2 3.46Å; L770-W796 HydrophobicContact CD2-CZ2 3.61Å; L770-W796 HydrophobicContact CD2-CZ3 4.32Å; L770-W796 HydrophobicContact CG-CH2 3.63Å; L770-W796 HydrophobicContact CG-CZ2 4.23Å; L770-W796 HydrophobicContact CG-CZ3 4.03Å; Y774-W796 HydrophobicContact CD1-CE3 4.17Å; Y774-W796 HydrophobicContact CD1-CZ3 4.39Å; Y774-W796 HydrophobicContact CD2-CB 4.42Å; Y774-W796 AromaticContact CD2-CE3 3.77Å; Y774-W796 HydrophobicContact CD2-CE3 3.77Å; Y774-W796 HydrophobicContact CE2-CB 4.02Å; Y774-W796 HydrophobicContact CE2-CE3 4.23Å; Y774-W796 AromaticContact CG-CE3 3.72Å; Y774-W796 HydrophobicContact CG-CE3 3.72Å; Y774-W796 HydrophobicContact CG-CZ3 4.06Å; S794-W796 PolarHBondContact O-N 3.12Å; W796-I798 VanDerWaalsContact C-N 3.34Å; W796-I798 PolarHBondContact O-N 3.03Å; W796-T799 WeakPolarHBondContact O-CB 3.36Å; W796-T799 PolarHBondContact O-N 3.04Å; W796-T799 VanDerWaalsContact O-N 3.17Å; W796-V800 HydrophobicContact CD2-CG2 4.44Å; W796-V800 WeakPolarHBondContact O-CG2 3.38Å; W796-V800 PolarHBondContact O-N 3.19Å
797	E	87.6	Confident	86.3	Confident	90 Å²	90	68.5 Å²	68.5	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-46.7	175.8	-71.7	143.9	-123.2	0	0	111.7	K793 S794 T799 V800 E801	K793-E797 VanDerWaalsContact CA-OE2 3.27Å; K793-E797 WeakPolarHBondContact CA-OE2 3.14Å; S794-E797 WeakPolarHBondContact CB-OE1 3.36Å; S794-E797 PolarHBondContact N-OE1 3.28Å; S794-E797 PolarHBondContact N-OE2 3.46Å; S794-E797 VanDerWaalsContact N-OE2 3.15Å; S794-E797 PolarHBondContact O-N 2.75Å; S794-E797 WeakPolarHBondContact OG-CG 3.41Å; S794-E797 PolarHBondContact OG-N 2.91Å; S794-E797 PolarHBondContact OG-OE1 2.99Å; E797-T799 VanDerWaalsContact C-N 3.27Å; E797-T799 PolarHBondContact O-N 3.1Å; E797-V800 PolarHBondContact O-N 2.67Å; E797-E801 WeakPolarHBondContact O-CB 3.48Å; E797-E801 PolarHBondContact O-N 3.25Å
798	I	87.7	Confident	86.7	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-39.3	178.8	-61.8	163	0	0	0	110.7	T751 I754 F782 L790 K793 S794 W796 S802	T751-I798 HydrophobicContact CG2-CG2 4.4Å; I754-I798 HydrophobicContact CD1-CG2 3.48Å; I754-I798 VanDerWaalsContact CD1-CG2 3.48Å; F782-I798 HydrophobicContact CE1-CD1 4.17Å; F782-I798 HydrophobicContact CZ-CD1 3.93Å; L790-I798 HydrophobicContact CB-CD1 4.42Å; L790-I798 HydrophobicContact CD1-CD1 3.6Å; L790-I798 HydrophobicContact CD1-CG1 4.43Å; K793-I798 HydrophobicContact CB-CD1 4.16Å; K793-I798 HydrophobicContact CB-CG1 3.96Å; K793-I798 HydrophobicContact CD-CG1 4.35Å; S794-I798 WeakPolarHBondContact O-CG1 3.46Å; S794-I798 PolarHBondContact O-N 2.95Å; S794-I798 VanDerWaalsContact O-N 3.16Å; W796-I798 VanDerWaalsContact C-N 3.34Å; W796-I798 PolarHBondContact O-N 3.03Å; I798-S802 WeakPolarHBondContact O-CB 3.34Å; I798-S802 PolarHBondContact O-N 2.69Å; I798-S802 PolarHBondContact O-OG 3.05Å
799	T	89.8	Confident	86.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-50.8	176.3	-62.5	0	0	0	0	111.2	F758 L770 I773 L795 W796 E797 S802 L803	F758-T799 HydrophobicContact CE2-CG2 4.03Å; F758-T799 HydrophobicContact CZ-CG2 3.76Å; L770-T799 HydrophobicContact CD1-CG2 4.16Å; I773-T799 HydrophobicContact CG2-CG2 4Å; L795-T799 WeakPolarHBondContact O-CB 3.48Å; L795-T799 PolarHBondContact O-N 2.68Å; L795-T799 VanDerWaalsContact O-N 3.09Å; L795-T799 PolarHBondContact O-OG1 2.76Å; W796-T799 WeakPolarHBondContact O-CB 3.36Å; W796-T799 PolarHBondContact O-N 3.04Å; W796-T799 VanDerWaalsContact O-N 3.17Å; E797-T799 VanDerWaalsContact C-N 3.27Å; E797-T799 PolarHBondContact O-N 3.1Å; T799-S802 PolarHBondContact O-N 2.86Å; T799-L803 HydrophobicContact CG2-CD1 3.94Å; T799-L803 WeakPolarHBondContact O-CB 3.39Å; T799-L803 WeakPolarHBondContact O-CG 3.37Å; T799-L803 PolarHBondContact O-N 2.83Å
800	V	90.1	Very high	87.2	Confident	61 Å²	61	64.8 Å²	64.8	37%	0.37	31%	0.308	S	S	.	.	H	α-helix	trans	-65.3	-40.1	-179.8	173.1	0	0	0	0	111.9	L770 W796 E797 R804	L770-V800 HydrophobicContact CD1-CG2 4.23Å; L770-V800 HydrophobicContact CD2-CG2 4.36Å; W796-V800 HydrophobicContact CD2-CG2 4.44Å; W796-V800 WeakPolarHBondContact O-CG2 3.38Å; W796-V800 PolarHBondContact O-N 3.19Å; E797-V800 PolarHBondContact O-N 2.67Å; V800-R804 VanDerWaalsContact O-CB 3.29Å; V800-R804 WeakPolarHBondContact O-CB 3.48Å; V800-R804 PolarHBondContact O-N 3.11Å
801	E	89.5	Confident	87.6	Confident	71 Å²	71	62.6 Å²	62.6	33%	0.332	30%	0.297	S	S	.	.	H	α-helix	trans	-65.7	-43.4	178.3	-173.3	173.1	-146.9	0	0	112	K793 E797 R804 Y805	K793-E801 VanDerWaalsContact NZ-CD 3.31Å; K793-E801 IonicContact NZ-OE1 2.72Å; K793-E801 PolarHBondContact NZ-OE1 3.37Å; K793-E801 IonicContact NZ-OE2 2.7Å; K793-E801 PolarHBondContact NZ-OE2 3.34Å; E797-E801 WeakPolarHBondContact O-CB 3.48Å; E797-E801 PolarHBondContact O-N 3.25Å; E801-R804 PolarHBondContact O-N 3.04Å; E801-Y805 PolarHBondContact O-N 3.48Å
802	S	89.8	Confident	88.3	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-68.3	-40	178.1	-54.9	0	0	0	0	112.1	I798 T799 Y805 L806	I798-S802 WeakPolarHBondContact O-CB 3.34Å; I798-S802 PolarHBondContact O-N 2.69Å; I798-S802 PolarHBondContact O-OG 3.05Å; T799-S802 PolarHBondContact O-N 2.86Å; S802-Y805 PolarHBondContact O-N 3.37Å; S802-L806 WeakPolarHBondContact O-CG 3.49Å; S802-L806 PolarHBondContact O-N 2.96Å
803	L	90.7	Very high	88.9	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-38.1	174.5	-71.4	169.1	0	0	0	112	F758 I762 L770 I773 T799 L806 T807 L812 F828	F758-L803 HydrophobicContact CB-CD2 4.2Å; F758-L803 HydrophobicContact CD2-CD2 3.62Å; F758-L803 HydrophobicContact CD2-CG 3.68Å; F758-L803 HydrophobicContact CE2-CD1 4.43Å; F758-L803 HydrophobicContact CE2-CD2 4.25Å; F758-L803 HydrophobicContact CE2-CG 3.83Å; F758-L803 HydrophobicContact CG-CD2 4.14Å; I762-L803 HydrophobicContact CD1-CD2 3.98Å; L770-L803 HydrophobicContact CD1-CD1 3.51Å; I773-L803 HydrophobicContact CD1-CD1 4.19Å; I773-L803 HydrophobicContact CD1-CD2 4.23Å; I773-L803 HydrophobicContact CG2-CD1 4.41Å; T799-L803 HydrophobicContact CG2-CD1 3.94Å; T799-L803 WeakPolarHBondContact O-CB 3.39Å; T799-L803 WeakPolarHBondContact O-CG 3.37Å; T799-L803 PolarHBondContact O-N 2.83Å; L803-L806 PolarHBondContact O-N 2.58Å; L803-T807 WeakPolarHBondContact O-CB 3.39Å; L803-T807 PolarHBondContact O-N 3.01Å; L803-T807 PolarHBondContact O-OG1 3.36Å; L803-L812 HydrophobicContact CD2-CD1 3.82Å; L803-F828 HydrophobicContact CB-CE1 4.1Å; L803-F828 HydrophobicContact CB-CZ 4.12Å; L803-F828 HydrophobicContact CD1-CD2 4.48Å; L803-F828 HydrophobicContact CD1-CE2 3.92Å; L803-F828 HydrophobicContact CD1-CZ 3.97Å; L803-F828 HydrophobicContact CD2-CD1 4.47Å; L803-F828 HydrophobicContact CG-CZ 4.47Å
804	R	90.7	Very high	89.2	Confident	121 Å²	121	50.8 Å²	50.8	46%	0.457	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-49.1	172	179.2	179.2	64.3	78.6	3	110.8	V800 E801 L806 T807 E808	V800-R804 VanDerWaalsContact O-CB 3.29Å; V800-R804 WeakPolarHBondContact O-CB 3.48Å; V800-R804 PolarHBondContact O-N 3.11Å; E801-R804 PolarHBondContact O-N 3.04Å; R804-L806 PolarHBondContact O-N 2.9Å; R804-T807 WeakPolarHBondContact O-CB 3.5Å; R804-T807 PolarHBondContact O-N 2.95Å; R804-T807 VanDerWaalsContact O-N 3.1Å; R804-E808 WeakPolarHBondContact CD-OE1 3.42Å; R804-E808 HydrophobicContact CG-CG 4.33Å; R804-E808 WeakPolarHBondContact CG-OE1 3.4Å; R804-E808 IonicContact CZ-OE1 3.14Å; R804-E808 IonicContact NE-OE1 2.67Å; R804-E808 IonicContact NH1-OE1 3.84Å; R804-E808 PolarHBondContact NH1-OE1 3.12Å; R804-E808 IonicContact NH1-OE2 3.33Å; R804-E808 PolarHBondContact NH1-OE2 3.13Å; R804-E808 WeakPolarHBondContact O-CG 3.45Å; R804-E808 PolarHBondContact O-N 3.27Å
805	Y	89.5	Confident	89	Confident	85 Å²	85	51.2 Å²	51.2	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-57.6	-46.7	178	179.3	-91.6	0	0	0	112.7	Q755 E801 S802 T807 E808 K809	Q755-Y805 HydrophobicContact CG-CD1 4.26Å; E801-Y805 PolarHBondContact O-N 3.48Å; S802-Y805 PolarHBondContact O-N 3.37Å; Y805-T807 PolarHBondContact O-N 3.47Å; Y805-E808 PolarHBondContact O-N 2.89Å; Y805-K809 HydrophobicContact CD1-CG 4.24Å; Y805-K809 HydrophobicContact CE1-CG 3.8Å; Y805-K809 WeakPolarHBondContact O-CB 3.11Å; Y805-K809 WeakPolarHBondContact O-CG 3.15Å; Y805-K809 PolarHBondContact O-N 3.22Å; Y805-K809 WeakPolarHBondContact OH-CE 3.35Å
806	L	90.3	Very high	88.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-29.7	176.8	-73.2	173.4	0	0	0	113.4	Q755 F758 S802 L803 R804 G810 L811 L812 L844	Q755-L806 HydrophobicContact CB-CD1 4.43Å; Q755-L806 HydrophobicContact CB-CD2 4.12Å; Q755-L806 HydrophobicContact CB-CG 4.31Å; Q755-L806 HydrophobicContact CG-CG 4.49Å; F758-L806 HydrophobicContact CB-CD1 3.8Å; S802-L806 WeakPolarHBondContact O-CG 3.49Å; S802-L806 PolarHBondContact O-N 2.96Å; L803-L806 PolarHBondContact O-N 2.58Å; R804-L806 PolarHBondContact O-N 2.9Å; L806-G810 PolarHBondContact O-N 3.38Å; L806-L811 HydrophobicContact CD2-CB 4.4Å; L806-L811 HydrophobicContact CD2-CD1 3.94Å; L806-L811 PolarHBondContact O-N 3.13Å; L806-L812 HydrophobicContact CB-CB 4.43Å; L806-L812 HydrophobicContact CB-CD1 3.7Å; L806-L812 HydrophobicContact CB-CG 3.92Å; L806-L812 HydrophobicContact CD1-CD1 3.76Å; L806-L812 HydrophobicContact CD1-CG 4.4Å; L806-L812 HydrophobicContact CG-CD1 4.4Å; L806-L812 PolarHBondContact O-N 3.48Å; L806-L812 VanDerWaalsContact O-N 3.17Å; L806-L844 HydrophobicContact CD2-CD1 4.27Å
807	T	91.1	Very high	87.7	Confident	45 Å²	45	53.4 Å²	53.4	28%	0.276	27%	0.265	S	S	.	.	H	α-helix	trans	-76.3	-42.6	174.8	-50.6	0	0	0	0	111.1	L803 R804 Y805 K809 G810 K814	L803-T807 WeakPolarHBondContact O-CB 3.39Å; L803-T807 PolarHBondContact O-N 3.01Å; L803-T807 PolarHBondContact O-OG1 3.36Å; R804-T807 WeakPolarHBondContact O-CB 3.5Å; R804-T807 PolarHBondContact O-N 2.95Å; R804-T807 VanDerWaalsContact O-N 3.1Å; Y805-T807 PolarHBondContact O-N 3.47Å; T807-K809 PolarHBondContact O-N 2.83Å; T807-G810 PolarHBondContact O-N 3Å; T807-K814 HydrophobicContact CG2-CB 4.23Å
808	E	90.1	Very high	86.2	Confident	128 Å²	128	53.5 Å²	53.5	60%	0.598	27%	0.274	S	S	*	.	H	α-helix	trans	-62.8	-30.6	173.9	-73.3	170.1	-174.3	0	0	112.3	R804 Y805 G810	R804-E808 WeakPolarHBondContact CD-OE1 3.42Å; R804-E808 HydrophobicContact CG-CG 4.33Å; R804-E808 WeakPolarHBondContact CG-OE1 3.4Å; R804-E808 IonicContact CZ-OE1 3.14Å; R804-E808 IonicContact NE-OE1 2.67Å; R804-E808 IonicContact NH1-OE1 3.84Å; R804-E808 PolarHBondContact NH1-OE1 3.12Å; R804-E808 IonicContact NH1-OE2 3.33Å; R804-E808 PolarHBondContact NH1-OE2 3.13Å; R804-E808 WeakPolarHBondContact O-CG 3.45Å; R804-E808 PolarHBondContact O-N 3.27Å; Y805-E808 PolarHBondContact O-N 2.89Å; E808-G810 VanDerWaalsContact C-N 3.33Å
809	K	87.1	Confident	84.7	Confident	69 Å²	69	59.7 Å²	59.7	30%	0.3	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.4	170.2	-78.8	-67.9	-158.9	174.4	0	114.8	Y805 T807 L811 D848	Y805-K809 HydrophobicContact CD1-CG 4.24Å; Y805-K809 HydrophobicContact CE1-CG 3.8Å; Y805-K809 WeakPolarHBondContact O-CB 3.11Å; Y805-K809 WeakPolarHBondContact O-CG 3.15Å; Y805-K809 PolarHBondContact O-N 3.22Å; Y805-K809 WeakPolarHBondContact OH-CE 3.35Å; T807-K809 PolarHBondContact O-N 2.83Å; K809-L811 HydrophobicContact CB-CD1 4.23Å; K809-L811 HydrophobicContact CB-CG 4.06Å; K809-L811 PolarHBondContact O-N 2.99Å; K809-D848 IonicContact NZ-OD2 2.76Å; K809-D848 PolarHBondContact NZ-OD2 3.17Å
810	G	88.9	Confident	83	Confident	36 Å²	36	62.6 Å²	62.6	37%	0.371	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	18.5	-177.4	0	0	0	0	0	115	L806 T807 E808 T831	L806-G810 PolarHBondContact O-N 3.38Å; T807-G810 PolarHBondContact O-N 3Å; E808-G810 VanDerWaalsContact C-N 3.33Å; G810-T831 WeakPolarHBondContact O-CB 3.32Å; G810-T831 WeakPolarHBondContact O-CG2 3.05Å; G810-T831 PolarHBondContact O-OG1 2.77Å
811	L	90.1	Very high	81.2	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.026	35%	0.349	C	S	.	.	S	Bend	trans	-85.3	-28.7	175.1	-58.8	177.6	0	0	0	111.4	L759 L806 K809 T831 L833 L844	L759-L811 HydrophobicContact CD1-CB 4.01Å; L806-L811 HydrophobicContact CD2-CB 4.4Å; L806-L811 HydrophobicContact CD2-CD1 3.94Å; L806-L811 PolarHBondContact O-N 3.13Å; K809-L811 HydrophobicContact CB-CD1 4.23Å; K809-L811 HydrophobicContact CB-CG 4.06Å; K809-L811 PolarHBondContact O-N 2.99Å; L811-T831 PolarHBondContact O-N 2.85Å; L811-T831 PolarHBondContact O-OG1 3.34Å; L811-L833 HydrophobicContact CD2-CB 4.44Å; L811-L833 HydrophobicContact CD2-CD2 3.96Å; L811-L833 HydrophobicContact CD2-CG 3.81Å; L811-L844 HydrophobicContact CD1-CD2 3.95Å
812	L	92.4	Very high	79.4	Confident	3 Å²	3	74.8 Å²	74.8	2%	0.016	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.4	168.8	-63.2	179.2	0	0	0	110.7	L759 I762 L803 L806 F828 H829 I830	L759-L812 HydrophobicContact CD1-CD2 4.04Å; L759-L812 HydrophobicContact CD1-CG 4.48Å; I762-L812 HydrophobicContact CB-CD2 4.24Å; I762-L812 HydrophobicContact CD1-CD1 3.52Å; I762-L812 HydrophobicContact CD1-CD2 3.77Å; I762-L812 HydrophobicContact CD1-CG 4.31Å; I762-L812 HydrophobicContact CG2-CD2 4.02Å; L803-L812 HydrophobicContact CD2-CD1 3.82Å; L806-L812 HydrophobicContact CB-CB 4.43Å; L806-L812 HydrophobicContact CB-CD1 3.7Å; L806-L812 HydrophobicContact CB-CG 3.92Å; L806-L812 HydrophobicContact CD1-CD1 3.76Å; L806-L812 HydrophobicContact CD1-CG 4.4Å; L806-L812 HydrophobicContact CG-CD1 4.4Å; L806-L812 PolarHBondContact O-N 3.48Å; L806-L812 VanDerWaalsContact O-N 3.17Å; L812-F828 HydrophobicContact CD1-CD1 4.4Å; L812-H829 WeakPolarHBondContact CA-O 3.2Å; L812-I830 HydrophobicContact CD2-CB 4.39Å; L812-I830 HydrophobicContact CD2-CG1 4.39Å
813	Q	89.5	Confident	77.6	Confident	108 Å²	108	80.9 Å²	80.9	51%	0.505	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.4	162.2	179.2	173.8	-33.5	0	0	108.6	D815 F828 H829 T831	Q813-D815 PolarHBondContact NE2-OD1 3.3Å; Q813-F828 WeakPolarHBondContact O-CA 3.21Å; Q813-H829 PolarHBondContact N-O 3.26Å; Q813-H829 PolarHBondContact O-N 3.11Å; Q813-T831 HydrophobicContact CB-CG2 4.31Å
814	K	86.8	Confident	76.2	Confident	87 Å²	87	84.1 Å²	84.1	38%	0.378	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.2	177.6	178.1	-174.1	174.7	-178.8	0	109.1	T807 Y826 F828	T807-K814 HydrophobicContact CG2-CB 4.23Å; K814-Y826 HydrophobicContact CD-CD1 4.41Å; K814-F828 HydrophobicContact CB-CD1 4.22Å; K814-F828 HydrophobicContact CB-CE1 4.08Å; K814-F828 HydrophobicContact CD-CE1 4.29Å; K814-F828 HydrophobicContact CG-CD1 4.45Å; K814-F828 HydrophobicContact CG-CE1 4Å; K814-F828 HydrophobicContact CG-CZ 4.44Å
815	D	83.4	Confident	75.3	Confident	52 Å²	52	80.4 Å²	80.4	28%	0.278	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	142.6	173.6	-60.1	-39.6	0	0	0	109.9	Q813 N827 H829	Q813-D815 PolarHBondContact NE2-OD1 3.3Å; D815-N827 PolarHBondContact N-O 3.24Å; D815-N827 PolarHBondContact O-N 3.28Å; D815-H829 IonicContact OD2-CE1 2.67Å; D815-H829 PolarHBondContact OD2-CE1 2.62Å; D815-H829 IonicContact OD2-CG 3.26Å; D815-H829 IonicContact OD2-ND1 2.61Å; D815-H829 PolarHBondContact OD2-ND1 2.74Å
816	T	78.1	Confident	74.7	Confident	81 Å²	81	80.2 Å²	80.2	50%	0.497	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.1	-174.7	-54.6	0	0	0	0	109.7	V824 Y826	T816-V824 HydrophobicContact CG2-CG1 3.45Å; T816-V824 VanDerWaalsContact CG2-CG1 3.45Å; T816-Y826 HydrophobicContact CG2-CD1 4.31Å; T816-Y826 HydrophobicContact CG2-CE1 4.12Å
817	I	67.8	Low	74.6	Confident	75 Å²	75	81.3 Å²	81.3	39%	0.385	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	101.2	177.8	-53.7	-178.4	0	0	0	108.4	K819 Q825 N827	I817-K819 HydrophobicContact CG2-CG 4.4Å; I817-K819 PolarHBondContact O-N 3.24Å; I817-Q825 PolarHBondContact N-O 2.95Å; I817-Q825 PolarHBondContact O-N 2.82Å; I817-Q825 VanDerWaalsContact O-N 3.11Å; I817-N827 HydrophobicContact CD1-CB 4.21Å
818	C	57.7	Low	74.5	Confident	91 Å²	91	79.6 Å²	79.6	62%	0.615	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	119.2	170.8	-54.2	0	0	0	0	109
819	K	56.3	Low	74.5	Confident	132 Å²	132	77.9 Å²	77.9	57%	0.574	40%	0.396	S	S	*	.	S	Bend	trans	-98	-23.8	175.2	-73.7	176.3	172.6	173.1	0	112.6	I817 E823	I817-K819 HydrophobicContact CG2-CG 4.4Å; I817-K819 PolarHBondContact O-N 3.24Å; K819-E823 PolarHBondContact N-O 3.46Å; K819-E823 VanDerWaalsContact N-O 3.14Å
820	S	53	Low	74.7	Confident	61 Å²	61	76.7 Å²	76.7	43%	0.427	39%	0.392	S	S	.	.	S	Bend	trans	-148.8	-175.4	171.6	67.4	0	0	0	0	109.1	E822 E823	S820-E822 PolarHBondContact O-N 3.41Å; S820-E822 PolarHBondContact OG-N 3.08Å; S820-E823 WeakPolarHBondContact OG-CB 3.46Å; S820-E823 PolarHBondContact OG-N 3.28Å
821	E	52.9	Low	74.9	Confident	203 Å²	203	76.5 Å²	76.5	95%	0.949	38%	0.384	S	S	*	.	S	Bend	trans	-72	-13.3	173.3	-63.2	-171	138.7	0	0	113.1
822	E	50.5	Low	75	Confident	185 Å²	185	82.3 Å²	82.3	86%	0.864	41%	0.409	S	S	*	.	S	Bend	trans	-117.1	-25	-176.4	-61.1	-174.2	150	0	0	113.5	S820	S820-E822 PolarHBondContact O-N 3.41Å; S820-E822 PolarHBondContact OG-N 3.08Å
823	E	52.2	Low	74.9	Confident	130 Å²	130	84.1 Å²	84.1	61%	0.607	42%	0.419	S	S	*	.			trans	-99.3	101.2	178	-67.9	-167.9	158.7	0	0	112.8	K819 S820	K819-E823 PolarHBondContact N-O 3.46Å; K819-E823 VanDerWaalsContact N-O 3.14Å; S820-E823 WeakPolarHBondContact OG-CB 3.46Å; S820-E823 PolarHBondContact OG-N 3.28Å
824	V	62	Low	74.9	Confident	69 Å²	69	79 Å²	79	42%	0.418	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	97.1	173.4	-175.9	0	0	0	0	109.6	T816 Y826	T816-V824 HydrophobicContact CG2-CG1 3.45Å; T816-V824 VanDerWaalsContact CG2-CG1 3.45Å; V824-Y826 HydrophobicContact CG1-CD1 4.23Å; V824-Y826 HydrophobicContact CG1-CE1 3.53Å
825	Q	70.8	Confident	75.1	Confident	44 Å²	44	78.9 Å²	78.9	21%	0.206	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138.6	174.9	-161.2	165.1	35.6	0	0	111.1	D771 I817	D771-Q825 PolarHBondContact OD2-NE2 3.2Å; I817-Q825 PolarHBondContact N-O 2.95Å; I817-Q825 PolarHBondContact O-N 2.82Å; I817-Q825 VanDerWaalsContact O-N 3.11Å
826	Y	78.4	Confident	75.4	Confident	81 Å²	81	76.4 Å²	76.4	32%	0.318	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.8	179.5	-58.5	-55.3	0	0	0	110.8	L770 K814 T816 V824	L770-Y826 HydrophobicContact CD2-CD2 4.34Å; L770-Y826 PolarHBondContact N-O 3.08Å; K814-Y826 HydrophobicContact CD-CD1 4.41Å; T816-Y826 HydrophobicContact CG2-CD1 4.31Å; T816-Y826 HydrophobicContact CG2-CE1 4.12Å; V824-Y826 HydrophobicContact CG1-CD1 4.23Å; V824-Y826 HydrophobicContact CG1-CE1 3.53Å
827	N	86.8	Confident	75.9	Confident	22 Å²	22	72.6 Å²	72.6	12%	0.118	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.7	175.5	-77.3	45.1	0	0	0	109	N769 D815 I817	N769-N827 VanDerWaalsContact OD1-CG 3.28Å; N769-N827 PolarHBondContact OD1-ND2 2.68Å; N769-N827 PolarHBondContact OD1-OD1 2.76Å; D815-N827 PolarHBondContact N-O 3.24Å; D815-N827 PolarHBondContact O-N 3.28Å; I817-N827 HydrophobicContact CD1-CB 4.21Å
828	F	89.6	Confident	76.8	Confident	10 Å²	10	70.1 Å²	70.1	4%	0.044	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132.2	179.6	-62.7	-89.8	0	0	0	110.3	I762 T768 L770 I773 L803 L812 Q813 K814	I762-F828 HydrophobicContact CD1-CB 3.69Å; I762-F828 HydrophobicContact CD1-CG 4.38Å; I762-F828 HydrophobicContact CG1-CB 4.32Å; I762-F828 HydrophobicContact CG2-CB 4.43Å; I762-F828 VanDerWaalsContact CG2-O 3.3Å; I762-F828 WeakPolarHBondContact CG2-O 3.22Å; T768-F828 PolarHBondContact O-N 2.7Å; L770-F828 HydrophobicContact CB-CE2 4.34Å; L770-F828 HydrophobicContact CD1-CE2 4.36Å; I773-F828 HydrophobicContact CD1-CD2 4.17Å; L803-F828 HydrophobicContact CB-CE1 4.1Å; L803-F828 HydrophobicContact CB-CZ 4.12Å; L803-F828 HydrophobicContact CD1-CD2 4.48Å; L803-F828 HydrophobicContact CD1-CE2 3.92Å; L803-F828 HydrophobicContact CD1-CZ 3.97Å; L803-F828 HydrophobicContact CD2-CD1 4.47Å; L803-F828 HydrophobicContact CG-CZ 4.47Å; L812-F828 HydrophobicContact CD1-CD1 4.4Å; Q813-F828 WeakPolarHBondContact O-CA 3.21Å; K814-F828 HydrophobicContact CB-CD1 4.22Å; K814-F828 HydrophobicContact CB-CE1 4.08Å; K814-F828 HydrophobicContact CD-CE1 4.29Å; K814-F828 HydrophobicContact CG-CD1 4.45Å; K814-F828 HydrophobicContact CG-CE1 4Å; K814-F828 HydrophobicContact CG-CZ 4.44Å
829	H	90.1	Very high	78.1	Confident	92 Å²	92	68.5 Å²	68.5	43%	0.426	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.6	175.6	-64.4	122.9	0	0	0	109.8	L812 Q813 D815	L812-H829 WeakPolarHBondContact CA-O 3.2Å; Q813-H829 PolarHBondContact N-O 3.26Å; Q813-H829 PolarHBondContact O-N 3.11Å; D815-H829 IonicContact OD2-CE1 2.67Å; D815-H829 PolarHBondContact OD2-CE1 2.62Å; D815-H829 IonicContact OD2-CG 3.26Å; D815-H829 IonicContact OD2-ND1 2.61Å; D815-H829 PolarHBondContact OD2-ND1 2.74Å
830	I	92.1	Very high	79.3	Confident	43 Å²	43	62.2 Å²	62.2	22%	0.221	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.4	-179.7	-162.3	166.3	0	0	0	110.7	L759 I762 L812 R835 F838	L759-I830 HydrophobicContact CD1-CD1 3.76Å; L759-I830 HydrophobicContact CD1-CG1 3.93Å; L759-I830 HydrophobicContact CG-CD1 4.05Å; I762-I830 HydrophobicContact CG2-CB 4.33Å; L812-I830 HydrophobicContact CD2-CB 4.39Å; L812-I830 HydrophobicContact CD2-CG1 4.39Å; I830-R835 HydrophobicContact CD1-CB 4.23Å; I830-R835 HydrophobicContact CG1-CB 4.37Å; I830-R835 HydrophobicContact CG2-CB 4.34Å; I830-F838 HydrophobicContact CD1-CB 4.41Å
831	T	92.7	Very high	80.8	Confident	33 Å²	33	63.2 Å²	63.2	20%	0.202	30%	0.301	C	S	.	.			trans	-78.8	167	175.3	72.4	0	0	0	0	110.8	G810 L811 Q813 L833 G834 R835	G810-T831 WeakPolarHBondContact O-CB 3.32Å; G810-T831 WeakPolarHBondContact O-CG2 3.05Å; G810-T831 PolarHBondContact O-OG1 2.77Å; L811-T831 PolarHBondContact O-N 2.85Å; L811-T831 PolarHBondContact O-OG1 3.34Å; Q813-T831 HydrophobicContact CB-CG2 4.31Å; T831-L833 PolarHBondContact O-N 2.9Å; T831-G834 PolarHBondContact O-N 3.43Å; T831-G834 VanDerWaalsContact O-N 3.16Å; T831-G834 PolarHBondContact OG1-N 2.71Å; T831-G834 VanDerWaalsContact OG1-N 3.09Å; T831-R835 PolarHBondContact O-N 3.32Å
832	K	91.1	Very high	82.3	Confident	127 Å²	127	54 Å²	54	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-56.3	-41.4	173.7	-71.1	-165.6	-179.2	-176.4	0	111.7	R835 A836 L985 E986	K832-R835 PolarHBondContact O-N 2.95Å; K832-A836 WeakPolarHBondContact O-CB 3.2Å; K832-A836 PolarHBondContact O-N 2.87Å; K832-L985 HydrophobicContact CB-CD2 4.04Å; K832-E986 IonicContact NZ-OE1 2.96Å; K832-E986 PolarHBondContact NZ-OE1 3.06Å; K832-E986 IonicContact NZ-OE2 3.51Å
833	L	90.6	Very high	83.9	Confident	40 Å²	40	47.6 Å²	47.6	21%	0.209	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-46.7	175.2	-176.1	63.2	0	0	0	111.2	L811 T831 R835 A836 S837 Y851 F981 L985	L811-L833 HydrophobicContact CD2-CB 4.44Å; L811-L833 HydrophobicContact CD2-CD2 3.96Å; L811-L833 HydrophobicContact CD2-CG 3.81Å; T831-L833 PolarHBondContact O-N 2.9Å; L833-R835 VanDerWaalsContact C-N 3.32Å; L833-R835 PolarHBondContact O-N 2.84Å; L833-A836 WeakPolarHBondContact O-CB 3.41Å; L833-A836 PolarHBondContact O-N 3.45Å; L833-S837 PolarHBondContact O-N 3.26Å; L833-S837 PolarHBondContact O-OG 3.4Å; L833-Y851 HydrophobicContact CD1-CD2 4.03Å; L833-F981 HydrophobicContact CD1-CE2 4.11Å; L833-F981 HydrophobicContact CD1-CZ 3.74Å; L833-L985 HydrophobicContact CD1-CD1 4.39Å
834	G	90.4	Very high	85.4	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.3	-43.2	175.1	0	0	0	0	0	113.3	T831 S837 F838	T831-G834 PolarHBondContact O-N 3.43Å; T831-G834 VanDerWaalsContact O-N 3.16Å; T831-G834 PolarHBondContact OG1-N 2.71Å; T831-G834 VanDerWaalsContact OG1-N 3.09Å; G834-S837 PolarHBondContact O-N 3.31Å; G834-F838 WeakPolarHBondContact O-CB 3.24Å; G834-F838 PolarHBondContact O-N 2.83Å
835	R	89.7	Confident	86.4	Confident	85 Å²	85	41.6 Å²	41.6	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-67.8	-38.1	178.5	-167.6	172.2	-173.3	-132.9	8.1	111.8	E450 I830 T831 K832 L833 K839 E984	E450-R835 IonicContact OE1-CZ 2.67Å; E450-R835 IonicContact OE1-NH2 3.08Å; E450-R835 PolarHBondContact OE1-NH2 2.85Å; I830-R835 HydrophobicContact CD1-CB 4.23Å; I830-R835 HydrophobicContact CG1-CB 4.37Å; I830-R835 HydrophobicContact CG2-CB 4.34Å; T831-R835 PolarHBondContact O-N 3.32Å; K832-R835 PolarHBondContact O-N 2.95Å; L833-R835 VanDerWaalsContact C-N 3.32Å; L833-R835 PolarHBondContact O-N 2.84Å; R835-K839 WeakPolarHBondContact O-CB 3.5Å; R835-K839 PolarHBondContact O-N 2.8Å; R835-E984 VanDerWaalsContact CD-OE2 3.22Å; R835-E984 WeakPolarHBondContact CD-OE2 3.35Å; R835-E984 HydrophobicContact CG-CG 4.46Å; R835-E984 IonicContact CZ-OE1 2.69Å; R835-E984 IonicContact CZ-OE2 2.76Å; R835-E984 IonicContact NE-OE1 3.82Å; R835-E984 IonicContact NE-OE2 3.63Å; R835-E984 PolarHBondContact NE-OE2 3.21Å; R835-E984 VanDerWaalsContact NH1-CD 3.33Å; R835-E984 IonicContact NH1-OE1 3.75Å; R835-E984 PolarHBondContact NH1-OE1 3.44Å; R835-E984 IonicContact NH1-OE2 2.79Å; R835-E984 PolarHBondContact NH1-OE2 3.5Å; R835-E984 IonicContact NH2-OE1 2.64Å
836	A	89.8	Confident	87.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-46.9	173.3	0	0	0	0	0	112.2	K832 L833 F838 K839 G840 F981 E984 L985	K832-A836 WeakPolarHBondContact O-CB 3.2Å; K832-A836 PolarHBondContact O-N 2.87Å; L833-A836 WeakPolarHBondContact O-CB 3.41Å; L833-A836 PolarHBondContact O-N 3.45Å; A836-F838 PolarHBondContact O-N 2.98Å; A836-K839 PolarHBondContact O-N 3.33Å; A836-G840 WeakPolarHBondContact O-CA 3.33Å; A836-G840 PolarHBondContact O-N 3.3Å; A836-F981 VanDerWaalsContact C-CD2 3.48Å; A836-F981 HydrophobicContact CB-CD2 3.75Å; A836-F981 HydrophobicContact CB-CE2 3.89Å; A836-F981 HydrophobicContact CB-CG 4.21Å; A836-F981 HydrophobicContact CB-CZ 4.48Å; A836-F981 WeakPolarHBondContact O-CD2 3.47Å; A836-E984 HydrophobicContact CB-CB 3.99Å; A836-L985 HydrophobicContact CB-CD1 3.88Å; A836-L985 HydrophobicContact CB-CD2 4.21Å; A836-L985 HydrophobicContact CB-CG 3.74Å
837	S	89.4	Confident	87.7	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-43.2	177.1	-52.6	0	0	0	0	112	L833 G834 T841 I842 C847	L833-S837 PolarHBondContact O-N 3.26Å; L833-S837 PolarHBondContact O-OG 3.4Å; G834-S837 PolarHBondContact O-N 3.31Å; S837-T841 PolarHBondContact O-N 2.89Å; S837-T841 VanDerWaalsContact O-N 3.08Å; S837-I842 PolarHBondContact O-N 3.38Å; S837-C847 PolarHBondContact OG-SG 2.93Å
838	F	86.6	Confident	87.8	Confident	22 Å²	22	41.1 Å²	41.1	10%	0.096	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-54	175.2	165.6	-117.8	0	0	0	112.4	N446 L759 S760 L764 I830 G834 A836 T841	N446-F838 HydrophobicContact CB-CZ 4.21Å; N446-F838 WeakPolarHBondContact ND2-CE2 3.33Å; L759-F838 HydrophobicContact CD2-CB 4.22Å; L759-F838 HydrophobicContact CG-CB 4.2Å; S760-F838 WeakPolarHBondContact OG-CE2 3.19Å; L764-F838 HydrophobicContact CD1-CZ 4.09Å; L764-F838 HydrophobicContact CD2-CE1 4.09Å; L764-F838 HydrophobicContact CD2-CZ 3.8Å; L764-F838 HydrophobicContact CG-CE1 4.18Å; L764-F838 HydrophobicContact CG-CZ 3.67Å; I830-F838 HydrophobicContact CD1-CB 4.41Å; G834-F838 WeakPolarHBondContact O-CB 3.24Å; G834-F838 PolarHBondContact O-N 2.83Å; A836-F838 PolarHBondContact O-N 2.98Å; F838-T841 PolarHBondContact O-N 3.35Å; F838-T841 VanDerWaalsContact O-N 3.12Å
839	K	84.3	Confident	87.8	Confident	57 Å²	57	43.9 Å²	43.9	25%	0.248	22%	0.221	C	C	.	.	H	α-helix	trans	-72.5	-33.6	-177.7	-73.4	-158.2	-176.8	179.6	0	114	E450 R835 A836 T841 E984	E450-K839 WeakPolarHBondContact OE1-CE 3.38Å; E450-K839 IonicContact OE1-NZ 3.63Å; E450-K839 PolarHBondContact OE1-NZ 2.8Å; E450-K839 WeakPolarHBondContact OE2-CE 3.37Å; E450-K839 IonicContact OE2-NZ 3.04Å; E450-K839 PolarHBondContact OE2-NZ 2.78Å; E450-K839 VanDerWaalsContact OE2-NZ 3.12Å; R835-K839 WeakPolarHBondContact O-CB 3.5Å; R835-K839 PolarHBondContact O-N 2.8Å; A836-K839 PolarHBondContact O-N 3.33Å; K839-T841 PolarHBondContact O-N 3.48Å; K839-E984 HydrophobicContact CB-CG 4.47Å; K839-E984 HydrophobicContact CD-CG 3.95Å; K839-E984 VanDerWaalsContact CD-OE1 3.28Å; K839-E984 WeakPolarHBondContact CD-OE1 3.16Å; K839-E984 VanDerWaalsContact CE-OE1 3.27Å; K839-E984 WeakPolarHBondContact CE-OE1 3.42Å; K839-E984 IonicContact NZ-OE1 2.68Å; K839-E984 PolarHBondContact NZ-OE1 3.06Å
840	G	83.3	Confident	88	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-12.1	170.2	0	0	0	0	0	113.1	A836 I842 C977	A836-G840 WeakPolarHBondContact O-CA 3.33Å; A836-G840 PolarHBondContact O-N 3.3Å; G840-I842 PolarHBondContact O-N 2.87Å; G840-C977 WeakPolarHBondContact CA-O 3.45Å; G840-C977 WeakPolarHBondContact O-CA 3.48Å; G840-C977 WeakPolarHBondContact O-CB 3.39Å
841	T	83.1	Confident	88	Confident	82 Å²	82	40.2 Å²	40.2	50%	0.503	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	39.3	-170.9	54.1	0	0	0	0	112.2	S837 F838 K839	S837-T841 PolarHBondContact O-N 2.89Å; S837-T841 VanDerWaalsContact O-N 3.08Å; F838-T841 PolarHBondContact O-N 3.35Å; F838-T841 VanDerWaalsContact O-N 3.12Å; K839-T841 PolarHBondContact O-N 3.48Å
842	I	85.1	Confident	88	Confident	11 Å²	11	46.4 Å²	46.4	6%	0.056	22%	0.221	C	C	.	.			trans	-84.5	132	-177.8	-58.5	-61.4	0	0	0	109.4	S837 G840 L844 C847 L850 F974 C977 F981	S837-I842 PolarHBondContact O-N 3.38Å; G840-I842 PolarHBondContact O-N 2.87Å; I842-L844 PolarHBondContact O-N 3.23Å; I842-C847 HydrophobicContact CG2-CB 4.48Å; I842-L850 HydrophobicContact CD1-CD2 3.76Å; I842-L850 HydrophobicContact CG1-CD2 3.91Å; I842-L850 HydrophobicContact CG2-CD2 4.01Å; I842-F974 HydrophobicContact CD1-CE2 3.97Å; I842-C977 HydrophobicContact CD1-CB 3.71Å; I842-F981 HydrophobicContact CG1-CB 4.26Å; I842-F981 HydrophobicContact CG1-CD2 3.92Å; I842-F981 HydrophobicContact CG1-CG 4.35Å
843	D	83.5	Confident	88	Confident	50 Å²	50	41.8 Å²	41.8	27%	0.267	20%	0.203	S	C	.	.			trans	-55.2	129.9	173.2	-167.9	-41.8	0	0	0	110.9	K752 A845 Y846 C847	K752-D843 WeakPolarHBondContact CE-OD1 3.45Å; K752-D843 WeakPolarHBondContact CE-OD2 3.41Å; K752-D843 IonicContact NZ-OD1 3.16Å; K752-D843 IonicContact NZ-OD2 2.8Å; K752-D843 PolarHBondContact NZ-OD2 3.24Å; D843-A845 PolarHBondContact O-N 3.49Å; D843-A845 VanDerWaalsContact O-N 3.16Å; D843-A845 WeakPolarHBondContact OD1-CB 3.27Å; D843-A845 PolarHBondContact OD1-N 3.04Å; D843-Y846 HydrophobicContact CB-CD2 3.76Å; D843-Y846 HydrophobicContact CB-CE2 4.44Å; D843-Y846 PolarHBondContact O-N 3.04Å; D843-C847 PolarHBondContact O-N 2.84Å
844	L	84.3	Confident	88.1	Confident	11 Å²	11	40 Å²	40	6%	0.058	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-26.9	-179.3	-55.6	-177.8	0	0	0	112.6	Q755 L759 L806 L811 I842	Q755-L844 HydrophobicContact CB-CD1 3.55Å; L759-L844 HydrophobicContact CD2-CD2 4.01Å; L806-L844 HydrophobicContact CD2-CD1 4.27Å; L811-L844 HydrophobicContact CD1-CD2 3.95Å; I842-L844 PolarHBondContact O-N 3.23Å
845	A	83.4	Confident	88.3	Confident	61 Å²	61	43.6 Å²	43.6	50%	0.504	21%	0.209	S	C	.	.	H	α-helix	trans	-69.5	-35.1	174.1	0	0	0	0	0	112.9	D843	D843-A845 PolarHBondContact O-N 3.49Å; D843-A845 VanDerWaalsContact O-N 3.16Å; D843-A845 WeakPolarHBondContact OD1-CB 3.27Å; D843-A845 PolarHBondContact OD1-N 3.04Å
846	Y	86.7	Confident	88.3	Confident	81 Å²	81	43.8 Å²	43.8	32%	0.318	21%	0.212	S	C	.	.	H	α-helix	trans	-95.3	-13.3	-178.8	-57.9	-50.6	0	0	0	113.7	D843 D848 I849 L850 Y876	D843-Y846 HydrophobicContact CB-CD2 3.76Å; D843-Y846 HydrophobicContact CB-CE2 4.44Å; D843-Y846 PolarHBondContact O-N 3.04Å; Y846-D848 PolarHBondContact O-N 3Å; Y846-I849 HydrophobicContact CD1-CD1 4.37Å; Y846-I849 WeakPolarHBondContact O-CB 3.36Å; Y846-I849 PolarHBondContact O-N 2.91Å; Y846-L850 WeakPolarHBondContact O-CB 3.33Å; Y846-L850 PolarHBondContact O-N 3.27Å; Y846-Y876 HydrophobicContact CD1-CD2 4.39Å; Y846-Y876 HydrophobicContact CD1-CG 4.02Å; Y846-Y876 HydrophobicContact CD2-CD2 4.39Å; Y846-Y876 HydrophobicContact CD2-CG 4.47Å; Y846-Y876 HydrophobicContact CE1-CG 4.45Å; Y846-Y876 AromaticContact CG-CD2 3.99Å; Y846-Y876 HydrophobicContact CG-CD2 3.99Å; Y846-Y876 HydrophobicContact CG-CG 4.05Å
847	C	88.3	Confident	88.3	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-48.2	-53.1	179	175.1	0	0	0	0	113.7	S837 I842 D843 I849 L850 Y851	S837-C847 PolarHBondContact OG-SG 2.93Å; I842-C847 HydrophobicContact CG2-CB 4.48Å; D843-C847 PolarHBondContact O-N 2.84Å; C847-I849 PolarHBondContact O-N 2.89Å; C847-L850 PolarHBondContact O-N 2.88Å; C847-Y851 WeakPolarHBondContact O-CB 3.28Å; C847-Y851 PolarHBondContact O-N 3.46Å
848	D	89.2	Confident	88.2	Confident	55 Å²	55	46.7 Å²	46.7	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-66.6	-25.3	-179.4	-65.2	-28.1	0	0	0	113.3	K809 Y846 R852	K809-D848 IonicContact NZ-OD2 2.76Å; K809-D848 PolarHBondContact NZ-OD2 3.17Å; Y846-D848 PolarHBondContact O-N 3Å; D848-R852 WeakPolarHBondContact O-CB 3.43Å; D848-R852 PolarHBondContact O-N 3.01Å
849	I	90.8	Very high	88.3	Confident	68 Å²	68	53.2 Å²	53.2	35%	0.349	26%	0.258	S	S	.	.	H	α-helix	trans	-82.2	-47.7	-179.9	-59.1	176.2	0	0	0	109.1	Y846 C847 Y851 R852 D853 Y876	Y846-I849 HydrophobicContact CD1-CD1 4.37Å; Y846-I849 WeakPolarHBondContact O-CB 3.36Å; Y846-I849 PolarHBondContact O-N 2.91Å; C847-I849 PolarHBondContact O-N 2.89Å; I849-Y851 PolarHBondContact O-N 3.49Å; I849-R852 WeakPolarHBondContact O-CB 3.46Å; I849-R852 PolarHBondContact O-N 3.36Å; I849-D853 WeakPolarHBondContact O-CB 3.32Å; I849-D853 PolarHBondContact O-N 2.9Å; I849-Y876 HydrophobicContact CG2-CE1 3.71Å
850	L	92.7	Very high	88.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.2	-46.9	175.9	178.2	63.8	0	0	0	111.6	I842 Y846 C847 R852 D853 L854 Y876 F974 V978 F981	I842-L850 HydrophobicContact CD1-CD2 3.76Å; I842-L850 HydrophobicContact CG1-CD2 3.91Å; I842-L850 HydrophobicContact CG2-CD2 4.01Å; Y846-L850 WeakPolarHBondContact O-CB 3.33Å; Y846-L850 PolarHBondContact O-N 3.27Å; C847-L850 PolarHBondContact O-N 2.88Å; L850-R852 VanDerWaalsContact C-N 3.27Å; L850-R852 PolarHBondContact O-N 3.23Å; L850-D853 PolarHBondContact O-N 2.95Å; L850-L854 HydrophobicContact CD1-CD1 3.9Å; L850-L854 HydrophobicContact CD1-CG 3.95Å; L850-L854 HydrophobicContact CG-CD1 3.84Å; L850-L854 HydrophobicContact CG-CG 4.33Å; L850-L854 WeakPolarHBondContact O-CB 3.26Å; L850-L854 VanDerWaalsContact O-CG 3.26Å; L850-L854 WeakPolarHBondContact O-CG 3.43Å; L850-L854 PolarHBondContact O-N 3.18Å; L850-Y876 WeakPolarHBondContact CA-OH 3.46Å; L850-Y876 HydrophobicContact CB-CE2 4.25Å; L850-Y876 HydrophobicContact CD1-CE2 4.44Å; L850-F974 HydrophobicContact CD1-CZ 4.37Å; L850-V978 HydrophobicContact CD1-CG1 4.22Å; L850-V978 HydrophobicContact CD1-CG2 3.84Å; L850-V978 HydrophobicContact CD2-CG2 4.03Å; L850-F981 HydrophobicContact CD2-CD1 4.17Å; L850-F981 HydrophobicContact CD2-CE1 4.4Å; L850-F981 HydrophobicContact CD2-CG 4.22Å
851	Y	93	Very high	88.6	Confident	59 Å²	59	53.5 Å²	53.5	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-42.3	176.7	-178.7	-93.3	0	0	0	111.7	L833 C847 I849 K855 F981 L985 E987 F988	L833-Y851 HydrophobicContact CD1-CD2 4.03Å; C847-Y851 WeakPolarHBondContact O-CB 3.28Å; C847-Y851 PolarHBondContact O-N 3.46Å; I849-Y851 PolarHBondContact O-N 3.49Å; Y851-K855 HydrophobicContact CE1-CD 3.84Å; Y851-K855 VanDerWaalsContact O-CB 3.25Å; Y851-K855 WeakPolarHBondContact O-CB 3.4Å; Y851-K855 PolarHBondContact O-N 3.34Å; Y851-K855 PolarHBondContact OH-NZ 3.45Å; Y851-F981 HydrophobicContact CD2-CZ 4.45Å; Y851-L985 HydrophobicContact CD2-CD1 4.31Å; Y851-L985 HydrophobicContact CE2-CD1 4.4Å; Y851-E987 VanDerWaalsContact CE2-OE1 3.24Å; Y851-E987 WeakPolarHBondContact CE2-OE1 3.34Å; Y851-E987 VanDerWaalsContact CZ-OE1 3.32Å; Y851-E987 PolarHBondContact OH-OE1 3.32Å; Y851-E987 PolarHBondContact OH-OE2 2.87Å; Y851-F988 AromaticContact CD2-CE2 3.69Å; Y851-F988 HydrophobicContact CD2-CE2 3.69Å; Y851-F988 AromaticContact CD2-CZ 3.85Å; Y851-F988 HydrophobicContact CD2-CZ 3.85Å; Y851-F988 AromaticContact CE2-CE2 3.71Å; Y851-F988 HydrophobicContact CE2-CE2 3.71Å; Y851-F988 AromaticContact CE2-CZ 3.74Å; Y851-F988 HydrophobicContact CE2-CZ 3.74Å
852	R	91.9	Very high	88.8	Confident	162 Å²	162	50.5 Å²	50.5	61%	0.611	25%	0.25	S	S	*	.	H	α-helix	trans	-69.2	-43.1	178.1	-169.8	-172.8	-52.9	158.4	8.7	112.7	D848 I849 L850 K855 K856	D848-R852 WeakPolarHBondContact O-CB 3.43Å; D848-R852 PolarHBondContact O-N 3.01Å; I849-R852 WeakPolarHBondContact O-CB 3.46Å; I849-R852 PolarHBondContact O-N 3.36Å; L850-R852 VanDerWaalsContact C-N 3.27Å; L850-R852 PolarHBondContact O-N 3.23Å; R852-K855 PolarHBondContact O-N 3.48Å; R852-K856 WeakPolarHBondContact O-CB 3.42Å; R852-K856 PolarHBondContact O-N 3.41Å
853	D	91.9	Very high	88.9	Confident	31 Å²	31	55.4 Å²	55.4	17%	0.166	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-46.9	177.4	-82.6	-12	0	0	0	110.9	I849 L850 K855 G857 L872 Y876 R934	I849-D853 WeakPolarHBondContact O-CB 3.32Å; I849-D853 PolarHBondContact O-N 2.9Å; L850-D853 PolarHBondContact O-N 2.95Å; D853-K855 PolarHBondContact O-N 3.43Å; D853-G857 PolarHBondContact O-N 2.94Å; D853-L872 HydrophobicContact CB-CD2 3.97Å; D853-Y876 PolarHBondContact OD2-OH 3.32Å; D853-R934 IonicContact OD2-CZ 3.84Å; D853-R934 IonicContact OD2-NH1 3.92Å; D853-R934 PolarHBondContact OD2-NH1 3Å
854	L	93.4	Very high	89.2	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-42.6	176.3	-69.9	170.6	0	0	0	111.8	L850 G857 L858 L872 V978 F981 F988 Y991	L850-L854 HydrophobicContact CD1-CD1 3.9Å; L850-L854 HydrophobicContact CD1-CG 3.95Å; L850-L854 HydrophobicContact CG-CD1 3.84Å; L850-L854 HydrophobicContact CG-CG 4.33Å; L850-L854 WeakPolarHBondContact O-CB 3.26Å; L850-L854 VanDerWaalsContact O-CG 3.26Å; L850-L854 WeakPolarHBondContact O-CG 3.43Å; L850-L854 PolarHBondContact O-N 3.18Å; L854-G857 WeakPolarHBondContact O-CA 3.37Å; L854-G857 PolarHBondContact O-N 2.93Å; L854-L858 PolarHBondContact O-N 2.79Å; L854-L872 HydrophobicContact CD2-CD1 4.49Å; L854-V978 HydrophobicContact CD1-CG1 4.3Å; L854-V978 HydrophobicContact CD2-CG1 4.01Å; L854-F981 HydrophobicContact CD1-CD1 3.88Å; L854-F981 HydrophobicContact CD1-CE1 3.93Å; L854-F988 HydrophobicContact CB-CD1 4.2Å; L854-F988 HydrophobicContact CB-CE1 3.68Å; L854-F988 HydrophobicContact CB-CE2 4.29Å; L854-F988 HydrophobicContact CB-CZ 3.74Å; L854-F988 HydrophobicContact CD1-CD2 4.34Å; L854-F988 HydrophobicContact CD1-CE2 4.18Å; L854-F988 HydrophobicContact CD1-CZ 4.46Å; L854-Y991 HydrophobicContact CB-CE2 3.91Å; L854-Y991 HydrophobicContact CD2-CD2 3.87Å; L854-Y991 HydrophobicContact CD2-CE2 3.75Å; L854-Y991 HydrophobicContact CD2-CG 4.29Å; L854-Y991 HydrophobicContact CG-CE2 4.43Å; L854-Y991 WeakPolarHBondContact O-CE2 3.46Å; L854-Y991 PolarHBondContact O-OH 3.06Å
855	K	93.1	Very high	89.4	Confident	77 Å²	77	60.6 Å²	60.6	34%	0.335	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-47	179.8	-164.5	167.2	-167	114.5	0	112.1	Y851 R852 D853 G857 L858 E859 E987 F988	Y851-K855 HydrophobicContact CE1-CD 3.84Å; Y851-K855 VanDerWaalsContact O-CB 3.25Å; Y851-K855 WeakPolarHBondContact O-CB 3.4Å; Y851-K855 PolarHBondContact O-N 3.34Å; Y851-K855 PolarHBondContact OH-NZ 3.45Å; R852-K855 PolarHBondContact O-N 3.48Å; D853-K855 PolarHBondContact O-N 3.43Å; K855-G857 PolarHBondContact O-N 3.33Å; K855-L858 WeakPolarHBondContact O-CB 3.28Å; K855-L858 PolarHBondContact O-N 3.03Å; K855-L858 VanDerWaalsContact O-N 3.11Å; K855-E859 PolarHBondContact O-N 2.96Å; K855-E987 IonicContact NZ-OE1 2.72Å; K855-E987 IonicContact NZ-OE2 3.7Å; K855-E987 PolarHBondContact NZ-OE2 3.22Å; K855-F988 HydrophobicContact CB-CE1 4.35Å; K855-F988 HydrophobicContact CB-CZ 4.4Å
856	K	90.7	Very high	89.7	Confident	89 Å²	89	60.6 Å²	60.6	39%	0.387	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-34.4	170.6	-171.6	-166.7	169.5	-160	0	111.6	R852 E859 I906	R852-K856 WeakPolarHBondContact O-CB 3.42Å; R852-K856 PolarHBondContact O-N 3.41Å; K856-E859 WeakPolarHBondContact O-CB 3.4Å; K856-E859 PolarHBondContact O-N 3.14Å; K856-I906 PolarHBondContact NZ-O 3.1Å
857	G	88.6	Confident	90	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-41.2	173.7	0	0	0	0	0	112.5	D853 L854 K855 E859 G860 L861 Y991	D853-G857 PolarHBondContact O-N 2.94Å; L854-G857 WeakPolarHBondContact O-CA 3.37Å; L854-G857 PolarHBondContact O-N 2.93Å; K855-G857 PolarHBondContact O-N 3.33Å; G857-E859 VanDerWaalsContact C-N 3.29Å; G857-E859 PolarHBondContact O-N 3.29Å; G857-G860 CarbonylContact O-C 3.35Å; G857-G860 PolarHBondContact O-N 2.84Å; G857-G860 VanDerWaalsContact O-N 3.16Å; G857-L861 WeakPolarHBondContact O-CA 3.3Å; G857-L861 VanDerWaalsContact O-CB 3.3Å; G857-L861 WeakPolarHBondContact O-CB 3.31Å; G857-L861 PolarHBondContact O-N 2.97Å; G857-Y991 VanDerWaalsContact CA-OH 3.25Å; G857-Y991 WeakPolarHBondContact CA-OH 3.41Å
858	L	89.2	Confident	90.3	Very high	61 Å²	61	57 Å²	57	32%	0.319	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-32.3	176.3	-68.8	-177.9	0	0	0	112.8	L854 K855 G860 E987 F988 V990 Y991	L854-L858 PolarHBondContact O-N 2.79Å; K855-L858 WeakPolarHBondContact O-CB 3.28Å; K855-L858 PolarHBondContact O-N 3.03Å; K855-L858 VanDerWaalsContact O-N 3.11Å; L858-G860 PolarHBondContact O-N 3.34Å; L858-E987 WeakPolarHBondContact CD1-O 3.49Å; L858-F988 HydrophobicContact CD1-CD1 3.79Å; L858-F988 HydrophobicContact CD1-CE1 3.97Å; L858-F988 HydrophobicContact CG-CD1 4.33Å; L858-F988 HydrophobicContact CG-CE1 4.5Å; L858-V990 HydrophobicContact CD2-CB 4.28Å; L858-V990 HydrophobicContact CD2-CG2 4.41Å; L858-Y991 HydrophobicContact CD2-CD2 4.23Å; L858-Y991 HydrophobicContact CD2-CE2 3.6Å; L858-Y991 HydrophobicContact CG-CE2 3.82Å; L858-Y991 PolarHBondContact N-OH 3.44Å; L858-Y991 VanDerWaalsContact N-OH 3.13Å
859	E	88.8	Confident	90.5	Very high	160 Å²	160	54.7 Å²	54.7	75%	0.748	26%	0.264	S	S	*	.	H	α-helix	trans	-67.6	-17.6	177.2	-62.4	169.1	-179.3	0	0	113	K855 K856 G857	K855-E859 PolarHBondContact O-N 2.96Å; K856-E859 WeakPolarHBondContact O-CB 3.4Å; K856-E859 PolarHBondContact O-N 3.14Å; G857-E859 VanDerWaalsContact C-N 3.29Å; G857-E859 PolarHBondContact O-N 3.29Å
860	G	84.9	Confident	90.6	Very high	28 Å²	28	51.4 Å²	51.4	29%	0.289	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-158.1	43.5	-171.4	0	0	0	0	0	114.9	G857 L858 V862	G857-G860 CarbonylContact O-C 3.35Å; G857-G860 PolarHBondContact O-N 2.84Å; G857-G860 VanDerWaalsContact O-N 3.16Å; L858-G860 PolarHBondContact O-N 3.34Å; G860-V862 PolarHBondContact O-N 3.05Å
861	L	88.4	Confident	90.7	Very high	34 Å²	34	51.7 Å²	51.7	18%	0.178	25%	0.248	C	C	.	.			trans	-75.1	96.6	-173.9	-167.6	58.8	0	0	0	112.3	G857 L863 L869 V990 Y991 L994	G857-L861 WeakPolarHBondContact O-CA 3.3Å; G857-L861 VanDerWaalsContact O-CB 3.3Å; G857-L861 WeakPolarHBondContact O-CB 3.31Å; G857-L861 PolarHBondContact O-N 2.97Å; L861-L863 HydrophobicContact CD2-CD2 3.76Å; L861-L863 HydrophobicContact CD2-CG 4.43Å; L861-L863 HydrophobicContact CG-CD2 3.85Å; L861-L863 HydrophobicContact CG-CG 4.23Å; L861-L863 PolarHBondContact O-N 2.78Å; L861-L863 VanDerWaalsContact O-N 3.11Å; L861-L869 HydrophobicContact CD1-CD2 4.03Å; L861-V990 HydrophobicContact CD2-CG1 4.21Å; L861-Y991 HydrophobicContact CD1-CE1 4.15Å; L861-Y991 HydrophobicContact CD2-CE1 4.01Å; L861-L994 HydrophobicContact CD2-CD1 3.84Å
862	V	87.6	Confident	90.7	Very high	20 Å²	20	49.1 Å²	49.1	12%	0.121	24%	0.238	C	C	.	.			trans	-62.4	109.1	167.2	-177.7	0	0	0	0	110	G860 E864 V903 I906	G860-V862 PolarHBondContact O-N 3.05Å; V862-E864 HydrophobicContact CG1-CB 4.48Å; V862-V903 HydrophobicContact CB-CG2 3.91Å; V862-V903 HydrophobicContact CG1-CG2 3.98Å; V862-V903 HydrophobicContact CG2-CG2 4Å; V862-I906 HydrophobicContact CG2-CD1 3.75Å
863	L	87.4	Confident	90.8	Very high	113 Å²	113	41.4 Å²	41.4	59%	0.592	21%	0.209	S	C	*	.			trans	-97.2	-11.8	179.4	-69	175.1	0	0	0	114.2	L861 S865 L994	L861-L863 HydrophobicContact CD2-CD2 3.76Å; L861-L863 HydrophobicContact CD2-CG 4.43Å; L861-L863 HydrophobicContact CG-CD2 3.85Å; L861-L863 HydrophobicContact CG-CG 4.23Å; L861-L863 PolarHBondContact O-N 2.78Å; L861-L863 VanDerWaalsContact O-N 3.11Å; L863-S865 PolarHBondContact O-N 2.85Å; L863-L994 HydrophobicContact CD2-CD1 3.69Å; L863-L994 HydrophobicContact CD2-CD2 4.33Å
864	E	88.2	Confident	90.9	Very high	163 Å²	163	39.9 Å²	39.9	76%	0.762	20%	0.201	S	C	*	.	S	Bend	trans	-64.5	-24	177.3	-169.2	-178.7	156.9	0	0	112.5	V862 A899	V862-E864 HydrophobicContact CG1-CB 4.48Å; E864-A899 HydrophobicContact CB-CB 4.39Å; E864-A899 VanDerWaalsContact CD-CB 3.45Å; E864-A899 HydrophobicContact CG-CB 4.28Å; E864-A899 VanDerWaalsContact OE2-CB 3.25Å; E864-A899 WeakPolarHBondContact OE2-CB 3.46Å
865	S	89.1	Confident	90.8	Very high	7 Å²	7	40 Å²	40	5%	0.049	20%	0.202	C	C	.	.	S	Bend	trans	-137.2	139.7	177.3	177	0	0	0	0	111.5	L863 L867 Y942	L863-S865 PolarHBondContact O-N 2.85Å; S865-L867 PolarHBondContact O-N 3.04Å; S865-L867 VanDerWaalsContact O-N 3.13Å; S865-L867 WeakPolarHBondContact OG-CB 3.38Å; S865-L867 PolarHBondContact OG-N 3.3Å; S865-Y942 PolarHBondContact OG-OH 2.76Å
866	L	90.8	Very high	90.6	Very high	62 Å²	62	37.5 Å²	37.5	33%	0.325	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.2	173.4	-62.4	177.3	0	0	0	113.3	H868 L869 I870 Y942 K1001	L866-H868 VanDerWaalsContact C-N 3.28Å; L866-H868 PolarHBondContact O-N 2.93Å; L866-L869 HydrophobicContact CD2-CD1 4.14Å; L866-L869 PolarHBondContact O-N 2.99Å; L866-L869 VanDerWaalsContact O-N 3.11Å; L866-I870 HydrophobicContact CB-CD1 3.88Å; L866-I870 HydrophobicContact CB-CG1 4.43Å; L866-I870 WeakPolarHBondContact O-CD1 3.13Å; L866-I870 VanDerWaalsContact O-CG1 3.31Å; L866-I870 WeakPolarHBondContact O-CG1 3.49Å; L866-I870 PolarHBondContact O-N 3.07Å; L866-Y942 HydrophobicContact CB-CE2 4.27Å; L866-K1001 HydrophobicContact CD1-CD 4.44Å
867	L	93.1	Very high	90.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-53.1	-39.9	-175.9	177.1	59.1	0	0	0	113.5	S865 I870 Y871 L896 E900 V903 F939 Y942	S865-L867 PolarHBondContact O-N 3.04Å; S865-L867 VanDerWaalsContact O-N 3.13Å; S865-L867 WeakPolarHBondContact OG-CB 3.38Å; S865-L867 PolarHBondContact OG-N 3.3Å; L867-I870 PolarHBondContact O-N 3.06Å; L867-Y871 PolarHBondContact O-N 3.17Å; L867-L896 HydrophobicContact CD2-CD1 4.23Å; L867-E900 HydrophobicContact CD2-CB 3.98Å; L867-E900 HydrophobicContact CD2-CG 4.38Å; L867-V903 HydrophobicContact CD2-CB 4.32Å; L867-V903 HydrophobicContact CG-CG1 4.36Å; L867-F939 HydrophobicContact CD1-CD1 3.8Å; L867-F939 HydrophobicContact CD1-CE1 4.03Å; L867-F939 HydrophobicContact CD2-CE1 4.1Å; L867-Y942 HydrophobicContact CB-CD1 4.12Å; L867-Y942 HydrophobicContact CB-CE1 4.15Å; L867-Y942 HydrophobicContact CB-CG 4.34Å; L867-Y942 HydrophobicContact CD1-CD1 4.07Å; L867-Y942 HydrophobicContact CD1-CG 4.19Å; L867-Y942 HydrophobicContact CG-CD1 4.47Å
868	H	92.9	Very high	90.1	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.028	20%	0.199	C	C	.	.	H	α-helix	trans	-71.3	-40.1	179.4	-166.1	-169.7	0	0	0	112.2	L866 Y871 L872 V903	L866-H868 VanDerWaalsContact C-N 3.28Å; L866-H868 PolarHBondContact O-N 2.93Å; H868-Y871 PolarHBondContact O-N 3.46Å; H868-L872 WeakPolarHBondContact O-CG 3.42Å; H868-L872 PolarHBondContact O-N 3.38Å; H868-L872 VanDerWaalsContact O-N 3.14Å; H868-V903 HydrophobicContact CB-CG1 3.71Å; H868-V903 HydrophobicContact CB-CG2 4.1Å
869	L	93.3	Very high	89.8	Confident	6 Å²	6	35.9 Å²	35.9	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-41.1	174.4	-65.3	168.9	0	0	0	111.3	L861 L866 Y871 L872 T873 Y991 L994 L998	L861-L869 HydrophobicContact CD1-CD2 4.03Å; L866-L869 HydrophobicContact CD2-CD1 4.14Å; L866-L869 PolarHBondContact O-N 2.99Å; L866-L869 VanDerWaalsContact O-N 3.11Å; L869-Y871 VanDerWaalsContact C-N 3.3Å; L869-Y871 PolarHBondContact O-N 3.27Å; L869-L872 PolarHBondContact O-N 3.17Å; L869-T873 PolarHBondContact O-N 3.13Å; L869-T873 PolarHBondContact O-OG1 3.49Å; L869-Y991 HydrophobicContact CD2-CD1 4.05Å; L869-Y991 HydrophobicContact CD2-CE1 4.11Å; L869-L994 HydrophobicContact CD1-CB 4.05Å; L869-L994 HydrophobicContact CD1-CD1 4.22Å; L869-L994 HydrophobicContact CD2-CB 4.33Å; L869-L994 HydrophobicContact CD2-CD1 4.04Å; L869-L998 HydrophobicContact CB-CD2 3.7Å
870	I	94.5	Very high	89.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.7	175.8	-68.6	160.8	0	0	0	111.1	L866 L867 T873 T874 L941 Y942 L945 L998	L866-I870 HydrophobicContact CB-CD1 3.88Å; L866-I870 HydrophobicContact CB-CG1 4.43Å; L866-I870 WeakPolarHBondContact O-CD1 3.13Å; L866-I870 VanDerWaalsContact O-CG1 3.31Å; L866-I870 WeakPolarHBondContact O-CG1 3.49Å; L866-I870 PolarHBondContact O-N 3.07Å; L867-I870 PolarHBondContact O-N 3.06Å; I870-T873 CarbonylContact O-C 3.56Å; I870-T873 PolarHBondContact O-N 3.42Å; I870-T873 PolarHBondContact O-OG1 3Å; I870-T874 PolarHBondContact O-N 2.73Å; I870-T874 PolarHBondContact O-OG1 3.17Å; I870-L941 HydrophobicContact CG2-CB 3.71Å; I870-L941 HydrophobicContact CG2-CD1 4.15Å; I870-Y942 HydrophobicContact CD1-CD2 3.48Å; I870-Y942 VanDerWaalsContact CD1-CD2 3.48Å; I870-Y942 HydrophobicContact CD1-CE2 4.35Å; I870-Y942 HydrophobicContact CD1-CG 4.17Å; I870-L945 HydrophobicContact CD1-CD1 3.62Å; I870-L945 HydrophobicContact CG1-CD1 4.14Å; I870-L998 HydrophobicContact CG1-CD1 3.99Å; I870-L998 HydrophobicContact CG1-CD2 4.32Å
871	Y	94.3	Very high	88.8	Confident	5 Å²	5	32.7 Å²	32.7	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-47.2	174	174.3	-89.9	0	0	0	111.7	L867 H868 L869 T873 T874 L907 R934 L935 S938	L867-Y871 PolarHBondContact O-N 3.17Å; H868-Y871 PolarHBondContact O-N 3.46Å; L869-Y871 VanDerWaalsContact C-N 3.3Å; L869-Y871 PolarHBondContact O-N 3.27Å; Y871-T873 PolarHBondContact O-N 2.91Å; Y871-T874 WeakPolarHBondContact O-CB 3.18Å; Y871-T874 PolarHBondContact O-N 3.09Å; Y871-T874 VanDerWaalsContact O-N 3.09Å; Y871-L907 HydrophobicContact CD1-CD1 3.89Å; Y871-L907 HydrophobicContact CD1-CD2 3.79Å; Y871-L907 HydrophobicContact CD2-CD1 3.64Å; Y871-L907 HydrophobicContact CE1-CD1 4.08Å; Y871-L907 HydrophobicContact CE1-CD2 3.43Å; Y871-L907 VanDerWaalsContact CE1-CD2 3.43Å; Y871-L907 HydrophobicContact CE1-CG 4.4Å; Y871-L907 HydrophobicContact CE2-CD1 3.82Å; Y871-L907 HydrophobicContact CE2-CD2 4.43Å; Y871-L907 HydrophobicContact CG-CD1 3.69Å; Y871-L907 HydrophobicContact CG-CD2 4.45Å; Y871-R934 HydrophobicContact CD2-CG 4.24Å; Y871-R934 HydrophobicContact CE2-CB 3.96Å; Y871-R934 HydrophobicContact CE2-CG 3.87Å; Y871-R934 VanDerWaalsContact O-CZ 3.25Å; Y871-R934 PolarHBondContact O-NE 3.37Å; Y871-R934 PolarHBondContact O-NH2 3.2Å; Y871-L935 HydrophobicContact CD2-CB 4.28Å; Y871-L935 HydrophobicContact CD2-CD1 4.25Å; Y871-L935 HydrophobicContact CE2-CB 4.27Å; Y871-S938 WeakPolarHBondContact CA-OG 3.27Å; Y871-S938 WeakPolarHBondContact CD2-OG 3.49Å
872	L	92.9	Very high	88.3	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-32.1	176.8	-65.5	170.5	0	0	0	112.3	D853 L854 H868 L869 R934 Y991	D853-L872 HydrophobicContact CB-CD2 3.97Å; L854-L872 HydrophobicContact CD2-CD1 4.49Å; H868-L872 WeakPolarHBondContact O-CG 3.42Å; H868-L872 PolarHBondContact O-N 3.38Å; H868-L872 VanDerWaalsContact O-N 3.14Å; L869-L872 PolarHBondContact O-N 3.17Å; L872-R934 PolarHBondContact O-NH2 3.19Å; L872-R934 VanDerWaalsContact O-NH2 3.1Å; L872-Y991 HydrophobicContact CD1-CE1 3.73Å
873	T	93.3	Very high	88	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	12.1	175.6	66.2	0	0	0	0	114.7	L869 I870 Y871 L995 L998	L869-T873 PolarHBondContact O-N 3.13Å; L869-T873 PolarHBondContact O-OG1 3.49Å; I870-T873 CarbonylContact O-C 3.56Å; I870-T873 PolarHBondContact O-N 3.42Å; I870-T873 PolarHBondContact O-OG1 3Å; Y871-T873 PolarHBondContact O-N 2.91Å; T873-L995 HydrophobicContact CG2-CD2 3.56Å; T873-L998 HydrophobicContact CG2-CD2 4.29Å
874	T	93.9	Very high	88	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-79.5	125.7	170.3	-65.4	0	0	0	0	108	I870 Y871 R934 L937 S938 L941	I870-T874 PolarHBondContact O-N 2.73Å; I870-T874 PolarHBondContact O-OG1 3.17Å; Y871-T874 WeakPolarHBondContact O-CB 3.18Å; Y871-T874 PolarHBondContact O-N 3.09Å; Y871-T874 VanDerWaalsContact O-N 3.09Å; T874-R934 HydrophobicContact CG2-CG 3.66Å; T874-R934 PolarHBondContact O-NE 3.08Å; T874-R934 PolarHBondContact O-NH2 3.09Å; T874-L937 HydrophobicContact CG2-CB 3.89Å; T874-S938 PolarHBondContact OG1-OG 3.41Å; T874-L941 HydrophobicContact CG2-CD1 4.46Å
875	P	91.7	Very high	88	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.013	14%	0.143	C	C	.	.			trans	-60.6	151	-177	-19.7	31	0	0	0	112.3	D877 L878 V879 A971 F974	P875-D877 WeakPolarHBondContact CB-OD1 3.28Å; P875-L878 HydrophobicContact CB-CD1 4.38Å; P875-L878 HydrophobicContact CB-CG 4.37Å; P875-L878 HydrophobicContact CG-CD1 4.14Å; P875-V879 WeakPolarHBondContact O-CG2 3.38Å; P875-A971 HydrophobicContact CG-CB 4.47Å; P875-F974 HydrophobicContact CB-CB 4.32Å; P875-F974 HydrophobicContact CB-CG 4.33Å; P875-F974 HydrophobicContact CG-CB 3.92Å; P875-F974 HydrophobicContact CG-CG 4.36Å
876	Y	89.3	Confident	88.1	Confident	26 Å²	26	28.9 Å²	28.9	10%	0.102	15%	0.152	C	C	.	.	S	Bend	trans	-85.1	-32.4	-178.7	-67.2	-80.7	0	0	0	112.6	Y846 I849 L850 D853 V879 R934 F974	Y846-Y876 HydrophobicContact CD1-CD2 4.39Å; Y846-Y876 HydrophobicContact CD1-CG 4.02Å; Y846-Y876 HydrophobicContact CD2-CD2 4.39Å; Y846-Y876 HydrophobicContact CD2-CG 4.47Å; Y846-Y876 HydrophobicContact CE1-CG 4.45Å; Y846-Y876 AromaticContact CG-CD2 3.99Å; Y846-Y876 HydrophobicContact CG-CD2 3.99Å; Y846-Y876 HydrophobicContact CG-CG 4.05Å; I849-Y876 HydrophobicContact CG2-CE1 3.71Å; L850-Y876 WeakPolarHBondContact CA-OH 3.46Å; L850-Y876 HydrophobicContact CB-CE2 4.25Å; L850-Y876 HydrophobicContact CD1-CE2 4.44Å; D853-Y876 PolarHBondContact OD2-OH 3.32Å; Y876-V879 VanDerWaalsContact O-CB 3.29Å; Y876-V879 WeakPolarHBondContact O-CB 3.5Å; Y876-V879 VanDerWaalsContact O-CG2 3.29Å; Y876-V879 WeakPolarHBondContact O-CG2 3.45Å; Y876-V879 PolarHBondContact O-N 3.09Å; Y876-R934 VanDerWaalsContact CE1-NH1 3.29Å; Y876-R934 VanDerWaalsContact CZ-CZ 3.49Å; Y876-R934 VanDerWaalsContact CZ-NH2 3.27Å; Y876-R934 PolarHBondContact OH-NH1 3.49Å; Y876-R934 PolarHBondContact OH-NH2 3.28Å; Y876-F974 HydrophobicContact CD2-CE1 4.38Å; Y876-F974 HydrophobicContact CD2-CE2 4.4Å; Y876-F974 AromaticContact CD2-CZ 3.78Å; Y876-F974 HydrophobicContact CD2-CZ 3.78Å; Y876-F974 HydrophobicContact CE2-CE1 4.24Å; Y876-F974 AromaticContact CE2-CZ 3.7Å; Y876-F974 HydrophobicContact CE2-CZ 3.7Å
877	D	84.2	Confident	88.2	Confident	85 Å²	85	30.9 Å²	30.9	46%	0.455	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-44.4	178.3	51.8	-58.4	0	0	0	112.6	P875 V879 S880	P875-D877 WeakPolarHBondContact CB-OD1 3.28Å; D877-V879 PolarHBondContact O-N 3.43Å; D877-V879 VanDerWaalsContact O-N 3.14Å; D877-S880 PolarHBondContact O-OG 3.25Å; D877-S880 VanDerWaalsContact O-OG 3.06Å
878	L	83.5	Confident	88.1	Confident	25 Å²	25	31.9 Å²	31.9	13%	0.131	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-7	-178.4	-57.9	-179.8	0	0	0	114.2	P875 L937 L967	P875-L878 HydrophobicContact CB-CD1 4.38Å; P875-L878 HydrophobicContact CB-CG 4.37Å; P875-L878 HydrophobicContact CG-CD1 4.14Å; L878-L937 HydrophobicContact CB-CD1 4.22Å; L878-L967 HydrophobicContact CD1-CD1 3.68Å
879	V	84.4	Confident	88.1	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-74.5	-30.3	-174.4	-177.6	0	0	0	0	112.3	P875 Y876 D877 S882 D930 N933 R934	P875-V879 WeakPolarHBondContact O-CG2 3.38Å; Y876-V879 VanDerWaalsContact O-CB 3.29Å; Y876-V879 WeakPolarHBondContact O-CB 3.5Å; Y876-V879 VanDerWaalsContact O-CG2 3.29Å; Y876-V879 WeakPolarHBondContact O-CG2 3.45Å; Y876-V879 PolarHBondContact O-N 3.09Å; D877-V879 PolarHBondContact O-N 3.43Å; D877-V879 VanDerWaalsContact O-N 3.14Å; V879-S882 PolarHBondContact O-N 3.36Å; V879-D930 HydrophobicContact CG1-CB 3.88Å; V879-D930 VanDerWaalsContact CG1-O 3.27Å; V879-D930 WeakPolarHBondContact CG1-O 3.36Å; V879-N933 HydrophobicContact CG1-CB 3.53Å; V879-N933 PolarHBondContact O-ND2 3.47Å; V879-R934 HydrophobicContact CG1-CB 4.3Å; V879-R934 HydrophobicContact CG2-CB 3.84Å; V879-R934 HydrophobicContact CG2-CG 4.03Å
880	S	77.9	Confident	88.1	Confident	70 Å²	70	33.9 Å²	33.9	49%	0.49	17%	0.174	S	C	.	.	H	α-helix	trans	-65.8	-46.4	177.6	57.4	0	0	0	0	111.9	D877 S882	D877-S880 PolarHBondContact O-OG 3.25Å; D877-S880 VanDerWaalsContact O-OG 3.06Å; S880-S882 PolarHBondContact O-N 3.13Å
881	Q	73.4	Confident	88	Confident	50 Å²	50	40.5 Å²	40.5	23%	0.234	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-18.6	179.8	-63	175.6	4	0	0	113.2	D106 Y111 N883	D106-Q881 PolarHBondContact OD2-NE2 3.36Å; Y111-Q881 HydrophobicContact CE1-CG 4.49Å; Y111-Q881 HydrophobicContact CE2-CG 4.32Å; Q881-N883 PolarHBondContact O-N 3.39Å
882	S	79	Confident	87.8	Confident	4 Å²	4	41 Å²	41	3%	0.028	20%	0.202	C	C	.	.			trans	-77.9	117.6	-178.8	173.4	0	0	0	0	112.5	V879 S880 N933	V879-S882 PolarHBondContact O-N 3.36Å; S880-S882 PolarHBondContact O-N 3.13Å; S882-N933 PolarHBondContact O-ND2 2.9Å
883	N	81.8	Confident	87.8	Confident	115 Å²	115	41 Å²	41	62%	0.615	20%	0.202	S	C	*	.			trans	-114.6	104.3	164.1	-170.5	23.1	0	0	0	109.7	Q881	Q881-N883 PolarHBondContact O-N 3.39Å
884	P	86.2	Confident	87.7	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.032	22%	0.222	C	C	.	.			trans	-74.8	133.5	-175.8	29	-34.3	0	0	0	112.4	W886 Y889 N933 Y936	P884-W886 HydrophobicContact CG-CD2 4.37Å; P884-W886 HydrophobicContact CG-CE3 4.42Å; P884-W886 HydrophobicContact CG-CH2 3.81Å; P884-W886 HydrophobicContact CG-CZ2 3.73Å; P884-W886 HydrophobicContact CG-CZ3 4.16Å; P884-W886 PolarHBondContact O-N 2.78Å; P884-Y889 HydrophobicContact CB-CD1 3.85Å; P884-Y889 HydrophobicContact CB-CE1 4.4Å; P884-Y889 HydrophobicContact CG-CD1 4.32Å; P884-N933 WeakPolarHBondContact CD-OD1 3.41Å; P884-Y936 HydrophobicContact CB-CD1 3.61Å; P884-Y936 HydrophobicContact CB-CD2 4.08Å; P884-Y936 HydrophobicContact CB-CE1 3.78Å; P884-Y936 HydrophobicContact CB-CE2 4.25Å; P884-Y936 HydrophobicContact CB-CG 3.75Å
885	D	89.6	Confident	87.5	Confident	70 Å²	70	49.8 Å²	49.8	37%	0.374	25%	0.249	S	C	.	.			trans	-67.2	111.2	159	178.1	-42.1	0	0	0	107.8	M887 I888 Y889	D885-M887 VanDerWaalsContact C-N 3.26Å; D885-M887 PolarHBondContact O-N 2.93Å; D885-M887 WeakPolarHBondContact OD1-CA 3.33Å; D885-M887 WeakPolarHBondContact OD1-CB 3.15Å; D885-M887 PolarHBondContact OD1-N 2.96Å; D885-I888 HydrophobicContact CB-CB 3.98Å; D885-I888 HydrophobicContact CB-CD1 3.95Å; D885-I888 HydrophobicContact CB-CG1 4.05Å; D885-I888 PolarHBondContact O-N 2.65Å; D885-I888 PolarHBondContact OD1-N 3.42Å; D885-Y889 VanDerWaalsContact O-CB 3.29Å; D885-Y889 WeakPolarHBondContact O-CB 3.37Å; D885-Y889 PolarHBondContact O-N 3.46Å
886	W	91.1	Very high	87.4	Confident	63 Å²	63	50.8 Å²	50.8	24%	0.239	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-26.3	-174.6	-61	100.8	0	0	0	113.7	P884 Y889 F890 L914 K917 A918 V932	P884-W886 HydrophobicContact CG-CD2 4.37Å; P884-W886 HydrophobicContact CG-CE3 4.42Å; P884-W886 HydrophobicContact CG-CH2 3.81Å; P884-W886 HydrophobicContact CG-CZ2 3.73Å; P884-W886 HydrophobicContact CG-CZ3 4.16Å; P884-W886 PolarHBondContact O-N 2.78Å; W886-Y889 AromaticContact CE3-CD1 3.98Å; W886-Y889 HydrophobicContact CE3-CD1 3.98Å; W886-Y889 AromaticContact CZ3-CD1 3.96Å; W886-Y889 HydrophobicContact CZ3-CD1 3.96Å; W886-Y889 HydrophobicContact CZ3-CE1 4.11Å; W886-F890 VanDerWaalsContact O-CB 3.32Å; W886-F890 WeakPolarHBondContact O-CB 3.23Å; W886-F890 PolarHBondContact O-N 3.26Å; W886-L914 HydrophobicContact CZ3-CD2 4.38Å; W886-K917 HydrophobicContact CB-CB 4.12Å; W886-K917 HydrophobicContact CD2-CB 3.62Å; W886-K917 HydrophobicContact CD2-CD 4.16Å; W886-K917 HydrophobicContact CD2-CG 3.95Å; W886-K917 HydrophobicContact CE3-CB 3.44Å; W886-K917 VanDerWaalsContact CE3-CB 3.44Å; W886-K917 HydrophobicContact CE3-CD 4.29Å; W886-K917 HydrophobicContact CE3-CG 3.63Å; W886-K917 HydrophobicContact CG-CB 3.92Å; W886-K917 HydrophobicContact CH2-CD 4.36Å; W886-K917 HydrophobicContact CH2-CG 4.22Å; W886-K917 HydrophobicContact CZ2-CD 4.23Å; W886-K917 HydrophobicContact CZ2-CG 4.5Å; W886-K917 HydrophobicContact CZ3-CB 4.12Å; W886-K917 HydrophobicContact CZ3-CD 4.38Å; W886-K917 HydrophobicContact CZ3-CG 3.78Å; W886-A918 HydrophobicContact CB-CB 4.46Å; W886-A918 WeakPolarHBondContact O-CB 3.4Å; W886-V932 HydrophobicContact CH2-CG1 3.65Å; W886-V932 HydrophobicContact CZ3-CG1 3.64Å
887	M	91.1	Very high	87.5	Confident	104 Å²	104	51.5 Å²	51.5	51%	0.512	26%	0.263	S	S	.	.	H	α-helix	trans	-80	-38.1	178.9	-172	60.1	179.3	0	0	111.1	D885 R891 A918	D885-M887 VanDerWaalsContact C-N 3.26Å; D885-M887 PolarHBondContact O-N 2.93Å; D885-M887 WeakPolarHBondContact OD1-CA 3.33Å; D885-M887 WeakPolarHBondContact OD1-CB 3.15Å; D885-M887 PolarHBondContact OD1-N 2.96Å; M887-R891 VanDerWaalsContact O-CB 3.3Å; M887-R891 WeakPolarHBondContact O-CB 3.4Å; M887-R891 PolarHBondContact O-N 3.42Å; M887-A918 HydrophobicContact SD-CB 4.27Å
888	I	91.9	Very high	87.8	Confident	22 Å²	22	52.8 Å²	52.8	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-50.3	167.7	-67.6	179.5	0	0	0	109.8	D885 F890 R891 Q892 K956 F957 N958	D885-I888 HydrophobicContact CB-CB 3.98Å; D885-I888 HydrophobicContact CB-CD1 3.95Å; D885-I888 HydrophobicContact CB-CG1 4.05Å; D885-I888 PolarHBondContact O-N 2.65Å; D885-I888 PolarHBondContact OD1-N 3.42Å; I888-F890 PolarHBondContact O-N 3.18Å; I888-R891 WeakPolarHBondContact O-CB 3.42Å; I888-R891 PolarHBondContact O-N 3.18Å; I888-R891 VanDerWaalsContact O-N 3.11Å; I888-Q892 HydrophobicContact CG2-CG 4.21Å; I888-Q892 WeakPolarHBondContact O-CG 3.44Å; I888-Q892 PolarHBondContact O-N 3.26Å; I888-K956 WeakPolarHBondContact CG2-O 3.24Å; I888-F957 HydrophobicContact CG2-CD1 4.15Å; I888-N958 HydrophobicContact CD1-CB 3.88Å
889	Y	93	Very high	88	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.9	-48.2	-179.3	-167.3	174.3	0	0	0	111.5	P884 D885 W886 R891 Q892 F893 L914 V932 L935 Y936 F939	P884-Y889 HydrophobicContact CB-CD1 3.85Å; P884-Y889 HydrophobicContact CB-CE1 4.4Å; P884-Y889 HydrophobicContact CG-CD1 4.32Å; D885-Y889 VanDerWaalsContact O-CB 3.29Å; D885-Y889 WeakPolarHBondContact O-CB 3.37Å; D885-Y889 PolarHBondContact O-N 3.46Å; W886-Y889 AromaticContact CE3-CD1 3.98Å; W886-Y889 HydrophobicContact CE3-CD1 3.98Å; W886-Y889 AromaticContact CZ3-CD1 3.96Å; W886-Y889 HydrophobicContact CZ3-CD1 3.96Å; W886-Y889 HydrophobicContact CZ3-CE1 4.11Å; Y889-R891 PolarHBondContact O-N 3.01Å; Y889-Q892 PolarHBondContact O-N 3.27Å; Y889-F893 WeakPolarHBondContact O-CB 3.35Å; Y889-F893 PolarHBondContact O-N 3.27Å; Y889-L914 HydrophobicContact CD1-CD2 3.94Å; Y889-L914 HydrophobicContact CD2-CD1 4.36Å; Y889-L914 HydrophobicContact CD2-CD2 4.28Å; Y889-L914 HydrophobicContact CE1-CD2 3.83Å; Y889-L914 HydrophobicContact CE2-CD1 4.21Å; Y889-L914 HydrophobicContact CE2-CD2 4.15Å; Y889-L914 HydrophobicContact CG-CD2 4.18Å; Y889-V932 HydrophobicContact CE1-CG1 3.79Å; Y889-V932 WeakPolarHBondContact CE1-O 3.27Å; Y889-V932 PolarHBondContact OH-O 3.1Å; Y889-L935 WeakPolarHBondContact OH-CB 3.38Å; Y889-Y936 AromaticContact CD1-CD2 3.75Å; Y889-Y936 HydrophobicContact CD1-CD2 3.75Å; Y889-Y936 HydrophobicContact CD1-CE2 4.49Å; Y889-Y936 HydrophobicContact CD1-CG 4.19Å; Y889-Y936 AromaticContact CD2-CD2 3.71Å; Y889-Y936 HydrophobicContact CD2-CD2 3.71Å; Y889-Y936 HydrophobicContact CD2-CE2 4.44Å; Y889-Y936 HydrophobicContact CE1-CD2 4.16Å; Y889-Y936 HydrophobicContact CE1-CG 4.26Å; Y889-Y936 HydrophobicContact CE2-CD2 4.14Å; Y889-Y936 AromaticContact CG-CD2 3.49Å; Y889-Y936 HydrophobicContact CG-CD2 3.49Å; Y889-Y936 VanDerWaalsContact CG-CD2 3.49Å; Y889-Y936 HydrophobicContact CG-CE2 4.03Å; Y889-Y936 HydrophobicContact CG-CG 4.36Å; Y889-Y936 PolarHBondContact OH-N 3.37Å; Y889-F939 AromaticContact CD2-CD2 3.98Å; Y889-F939 HydrophobicContact CD2-CD2 3.98Å; Y889-F939 AromaticContact CD2-CE2 3.9Å; Y889-F939 HydrophobicContact CD2-CE2 3.9Å; Y889-F939 AromaticContact CE2-CD2 3.83Å; Y889-F939 HydrophobicContact CE2-CD2 3.83Å; Y889-F939 AromaticContact CE2-CE2 3.56Å; Y889-F939 HydrophobicContact CE2-CE2 3.56Å; Y889-F939 HydrophobicContact CE2-CZ 4.21Å
890	F	92.9	Very high	88.3	Confident	54 Å²	54	52.7 Å²	52.7	24%	0.237	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-42.4	175.6	-177.2	-111.9	0	0	0	112.2	W886 I888 Q892 F893 S894 E911 L914 A918	W886-F890 VanDerWaalsContact O-CB 3.32Å; W886-F890 WeakPolarHBondContact O-CB 3.23Å; W886-F890 PolarHBondContact O-N 3.26Å; I888-F890 PolarHBondContact O-N 3.18Å; F890-Q892 PolarHBondContact O-N 2.97Å; F890-F893 WeakPolarHBondContact O-CB 3.44Å; F890-F893 PolarHBondContact O-N 3.3Å; F890-S894 PolarHBondContact O-N 3.14Å; F890-S894 PolarHBondContact O-OG 3.35Å; F890-S894 VanDerWaalsContact O-OG 3.14Å; F890-E911 HydrophobicContact CE2-CG 3.92Å; F890-L914 HydrophobicContact CD2-CB 3.91Å; F890-A918 HydrophobicContact CB-CB 3.88Å; F890-A918 HydrophobicContact CG-CB 4.29Å
891	R	92.2	Very high	88.9	Confident	139 Å²	139	52.1 Å²	52.1	53%	0.525	27%	0.267	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176	-175.5	-172.6	-61.5	173.9	2.1	112.7	M887 I888 Y889 S894 Q895	M887-R891 VanDerWaalsContact O-CB 3.3Å; M887-R891 WeakPolarHBondContact O-CB 3.4Å; M887-R891 PolarHBondContact O-N 3.42Å; I888-R891 WeakPolarHBondContact O-CB 3.42Å; I888-R891 PolarHBondContact O-N 3.18Å; I888-R891 VanDerWaalsContact O-N 3.11Å; Y889-R891 PolarHBondContact O-N 3.01Å; R891-S894 PolarHBondContact O-N 3.01Å; R891-Q895 WeakPolarHBondContact O-CG 3.4Å; R891-Q895 PolarHBondContact O-N 3.12Å
892	Q	91.4	Very high	89.6	Confident	15 Å²	15	53.7 Å²	53.7	7%	0.07	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-40.4	177.9	-61.7	-62.9	-19.7	0	0	110.8	I888 Y889 F890 S894 Q895 F939 F957	I888-Q892 HydrophobicContact CG2-CG 4.21Å; I888-Q892 WeakPolarHBondContact O-CG 3.44Å; I888-Q892 PolarHBondContact O-N 3.26Å; Y889-Q892 PolarHBondContact O-N 3.27Å; F890-Q892 PolarHBondContact O-N 2.97Å; Q892-S894 PolarHBondContact O-N 3Å; Q892-Q895 PolarHBondContact O-N 3.02Å; Q892-Q895 VanDerWaalsContact O-N 3.11Å; Q892-F939 HydrophobicContact CB-CD2 4.35Å; Q892-F957 HydrophobicContact CB-CE1 4.49Å; Q892-F957 HydrophobicContact CB-CZ 4.48Å; Q892-F957 HydrophobicContact CG-CD1 4.49Å; Q892-F957 HydrophobicContact CG-CE1 3.79Å; Q892-F957 HydrophobicContact CG-CE2 4.5Å; Q892-F957 HydrophobicContact CG-CZ 3.8Å
893	F	91.9	Very high	90.2	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-46.9	173	-179.6	-82.1	0	0	0	112	Y889 F890 Q895 L896 Q901 A904 E911 L914 F939	Y889-F893 WeakPolarHBondContact O-CB 3.35Å; Y889-F893 PolarHBondContact O-N 3.27Å; F890-F893 WeakPolarHBondContact O-CB 3.44Å; F890-F893 PolarHBondContact O-N 3.3Å; F893-Q895 PolarHBondContact O-N 3.35Å; F893-Q895 VanDerWaalsContact O-N 3.13Å; F893-L896 VanDerWaalsContact O-CB 3.31Å; F893-L896 WeakPolarHBondContact O-CB 3.29Å; F893-L896 PolarHBondContact O-N 3.34Å; F893-Q901 HydrophobicContact CE1-CG 4.02Å; F893-Q901 HydrophobicContact CE2-CG 4.42Å; F893-Q901 HydrophobicContact CZ-CB 4.02Å; F893-Q901 HydrophobicContact CZ-CG 3.88Å; F893-A904 HydrophobicContact CD2-CB 4.42Å; F893-A904 HydrophobicContact CE2-CB 3.73Å; F893-E911 HydrophobicContact CD1-CB 4.36Å; F893-E911 HydrophobicContact CD1-CG 4.16Å; F893-E911 HydrophobicContact CE1-CB 3.52Å; F893-E911 HydrophobicContact CE1-CG 3.67Å; F893-E911 HydrophobicContact CZ-CB 3.9Å; F893-L914 HydrophobicContact CB-CD1 3.86Å; F893-L914 HydrophobicContact CD1-CD1 4.49Å; F893-L914 HydrophobicContact CD2-CD1 3.45Å; F893-L914 VanDerWaalsContact CD2-CD1 3.45Å; F893-L914 HydrophobicContact CE2-CD1 4.13Å; F893-L914 HydrophobicContact CG-CD1 3.66Å; F893-F939 HydrophobicContact CB-CE2 4.12Å; F893-F939 HydrophobicContact CD2-CE2 4.31Å; F893-F939 HydrophobicContact CD2-CZ 4.19Å
894	S	90.9	Very high	90.6	Very high	60 Å²	60	48 Å²	48	42%	0.42	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.5	178.8	-58.4	0	0	0	0	114.3	F890 R891 Q892	F890-S894 PolarHBondContact O-N 3.14Å; F890-S894 PolarHBondContact O-OG 3.35Å; F890-S894 VanDerWaalsContact O-OG 3.14Å; R891-S894 PolarHBondContact O-N 3.01Å; Q892-S894 PolarHBondContact O-N 3Å
895	Q	90	Very high	90.7	Very high	123 Å²	123	50.6 Å²	50.6	58%	0.575	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-5.1	174.6	-69.1	177.3	9.5	0	0	113.2	R891 Q892 F893	R891-Q895 WeakPolarHBondContact O-CG 3.4Å; R891-Q895 PolarHBondContact O-N 3.12Å; Q892-Q895 PolarHBondContact O-N 3.02Å; Q892-Q895 VanDerWaalsContact O-N 3.11Å; F893-Q895 PolarHBondContact O-N 3.35Å; F893-Q895 VanDerWaalsContact O-N 3.13Å
896	L	89.9	Confident	90.6	Very high	23 Å²	23	49.7 Å²	49.7	12%	0.12	26%	0.263	C	S	.	.	S	Bend	trans	-77.2	149.5	177.1	-64.7	-178.9	0	0	0	112.3	L867 F893 E900 Q901 F939	L867-L896 HydrophobicContact CD2-CD1 4.23Å; F893-L896 VanDerWaalsContact O-CB 3.31Å; F893-L896 WeakPolarHBondContact O-CB 3.29Å; F893-L896 PolarHBondContact O-N 3.34Å; L896-E900 VanDerWaalsContact CA-OE2 3.29Å; L896-E900 WeakPolarHBondContact CA-OE2 3.38Å; L896-E900 HydrophobicContact CB-CB 3.77Å; L896-E900 HydrophobicContact CD1-CB 4.31Å; L896-E900 HydrophobicContact CD2-CB 4.17Å; L896-E900 WeakPolarHBondContact CD2-OE2 3.47Å; L896-E900 HydrophobicContact CG-CB 4.29Å; L896-Q901 HydrophobicContact CB-CG 3.85Å; L896-Q901 PolarHBondContact O-NE2 3.46Å; L896-F939 HydrophobicContact CD1-CE1 3.83Å; L896-F939 HydrophobicContact CD1-CE2 3.87Å; L896-F939 HydrophobicContact CD1-CZ 3.44Å; L896-F939 VanDerWaalsContact CD1-CZ 3.44Å
897	S	91.3	Very high	90.4	Very high	41 Å²	41	47.5 Å²	47.5	29%	0.287	26%	0.255	S	S	.	.			trans	-67.4	161.8	172.5	81.1	0	0	0	0	112.1	A899 E900 Q901	S897-A899 PolarHBondContact O-N 3.16Å; S897-E900 PolarHBondContact N-OE2 2.82Å; S897-E900 WeakPolarHBondContact O-CB 3.49Å; S897-E900 PolarHBondContact O-N 3.18Å; S897-E900 WeakPolarHBondContact OG-CG 3.11Å; S897-E900 PolarHBondContact OG-N 2.86Å; S897-Q901 WeakPolarHBondContact O-CG 3.44Å; S897-Q901 PolarHBondContact O-N 3.48Å
898	P	89.6	Confident	90.1	Very high	112 Å²	112	43.9 Å²	43.9	73%	0.727	25%	0.245	S	C	*	.	H	α-helix	trans	-56.3	-34.8	176.9	-26.9	36	0	0	0	113.9	N902	P898-N902 WeakPolarHBondContact O-CB 3.5Å; P898-N902 PolarHBondContact O-N 3.23Å
899	A	87.8	Confident	89.9	Confident	15 Å²	15	42.9 Å²	42.9	12%	0.124	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-38.5	175.9	0	0	0	0	0	112.5	E864 S897 N902 V903	E864-A899 HydrophobicContact CB-CB 4.39Å; E864-A899 VanDerWaalsContact CD-CB 3.45Å; E864-A899 HydrophobicContact CG-CB 4.28Å; E864-A899 VanDerWaalsContact OE2-CB 3.25Å; E864-A899 WeakPolarHBondContact OE2-CB 3.46Å; S897-A899 PolarHBondContact O-N 3.16Å; A899-N902 WeakPolarHBondContact O-CB 3.41Å; A899-N902 PolarHBondContact O-N 3.19Å; A899-V903 PolarHBondContact O-N 3.25Å
900	E	90.8	Very high	89.6	Confident	15 Å²	15	45 Å²	45	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-69	-40.8	174.8	-70.3	165.6	171.5	0	0	111.6	L867 L896 S897 N902 V903 Y942 K946	L867-E900 HydrophobicContact CD2-CB 3.98Å; L867-E900 HydrophobicContact CD2-CG 4.38Å; L896-E900 VanDerWaalsContact CA-OE2 3.29Å; L896-E900 WeakPolarHBondContact CA-OE2 3.38Å; L896-E900 HydrophobicContact CB-CB 3.77Å; L896-E900 HydrophobicContact CD1-CB 4.31Å; L896-E900 HydrophobicContact CD2-CB 4.17Å; L896-E900 WeakPolarHBondContact CD2-OE2 3.47Å; L896-E900 HydrophobicContact CG-CB 4.29Å; S897-E900 PolarHBondContact N-OE2 2.82Å; S897-E900 WeakPolarHBondContact O-CB 3.49Å; S897-E900 PolarHBondContact O-N 3.18Å; S897-E900 WeakPolarHBondContact OG-CG 3.11Å; S897-E900 PolarHBondContact OG-N 2.86Å; E900-N902 VanDerWaalsContact C-N 3.29Å; E900-N902 PolarHBondContact O-N 3.44Å; E900-V903 WeakPolarHBondContact O-CB 3.22Å; E900-V903 PolarHBondContact O-N 3.04Å; E900-Y942 HydrophobicContact CG-CE1 4.27Å; E900-Y942 WeakPolarHBondContact OE1-CE1 3.4Å; E900-Y942 PolarHBondContact OE1-OH 3.26Å; E900-K946 IonicContact OE1-NZ 2.73Å; E900-K946 PolarHBondContact OE1-NZ 3.22Å; E900-K946 IonicContact OE2-NZ 3.21Å
901	Q	90.7	Very high	89.3	Confident	58 Å²	58	47.4 Å²	47.4	27%	0.271	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-33.4	173.5	-67.3	178.8	11.2	0	0	112.1	F893 L896 S897 V903 A904 A905	F893-Q901 HydrophobicContact CE1-CG 4.02Å; F893-Q901 HydrophobicContact CE2-CG 4.42Å; F893-Q901 HydrophobicContact CZ-CB 4.02Å; F893-Q901 HydrophobicContact CZ-CG 3.88Å; L896-Q901 HydrophobicContact CB-CG 3.85Å; L896-Q901 PolarHBondContact O-NE2 3.46Å; S897-Q901 WeakPolarHBondContact O-CG 3.44Å; S897-Q901 PolarHBondContact O-N 3.48Å; Q901-V903 VanDerWaalsContact C-N 3.3Å; Q901-V903 PolarHBondContact O-N 2.81Å; Q901-A904 WeakPolarHBondContact O-CB 3.38Å; Q901-A904 PolarHBondContact O-N 2.81Å; Q901-A905 PolarHBondContact O-N 3.07Å; Q901-A905 VanDerWaalsContact O-N 3.15Å
902	N	89.4	Confident	89.1	Confident	83 Å²	83	44.4 Å²	44.4	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-32.5	174.2	-171.2	39.5	0	0	0	112.6	P898 A899 E900 A904 A905 I906	P898-N902 WeakPolarHBondContact O-CB 3.5Å; P898-N902 PolarHBondContact O-N 3.23Å; A899-N902 WeakPolarHBondContact O-CB 3.41Å; A899-N902 PolarHBondContact O-N 3.19Å; E900-N902 VanDerWaalsContact C-N 3.29Å; E900-N902 PolarHBondContact O-N 3.44Å; N902-A904 VanDerWaalsContact C-N 3.35Å; N902-A904 PolarHBondContact O-N 3.35Å; N902-A905 WeakPolarHBondContact O-CB 3.37Å; N902-A905 PolarHBondContact O-N 2.92Å; N902-I906 VanDerWaalsContact O-CG1 3.32Å; N902-I906 WeakPolarHBondContact O-CG1 3.48Å; N902-I906 PolarHBondContact O-N 2.87Å
903	V	90.6	Very high	88.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-47.3	173.5	-177.7	0	0	0	0	110.7	V862 L867 H868 A899 E900 Q901 A905 I906 L907	V862-V903 HydrophobicContact CB-CG2 3.91Å; V862-V903 HydrophobicContact CG1-CG2 3.98Å; V862-V903 HydrophobicContact CG2-CG2 4Å; L867-V903 HydrophobicContact CD2-CB 4.32Å; L867-V903 HydrophobicContact CG-CG1 4.36Å; H868-V903 HydrophobicContact CB-CG1 3.71Å; H868-V903 HydrophobicContact CB-CG2 4.1Å; A899-V903 PolarHBondContact O-N 3.25Å; E900-V903 WeakPolarHBondContact O-CB 3.22Å; E900-V903 PolarHBondContact O-N 3.04Å; Q901-V903 VanDerWaalsContact C-N 3.3Å; Q901-V903 PolarHBondContact O-N 2.81Å; V903-A905 VanDerWaalsContact C-N 3.31Å; V903-A905 PolarHBondContact O-N 3.41Å; V903-I906 PolarHBondContact O-N 3.14Å; V903-L907 HydrophobicContact CG1-CD1 4.17Å; V903-L907 WeakPolarHBondContact O-CG 3.49Å; V903-L907 PolarHBondContact O-N 3.33Å
904	A	90.1	Very high	88.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-38.3	176.9	0	0	0	0	0	112.2	F893 Q901 N902 L907 G908 V909 L935	F893-A904 HydrophobicContact CD2-CB 4.42Å; F893-A904 HydrophobicContact CE2-CB 3.73Å; Q901-A904 WeakPolarHBondContact O-CB 3.38Å; Q901-A904 PolarHBondContact O-N 2.81Å; N902-A904 VanDerWaalsContact C-N 3.35Å; N902-A904 PolarHBondContact O-N 3.35Å; A904-L907 CarbonylContact O-C 3.58Å; A904-L907 PolarHBondContact O-N 3.12Å; A904-G908 PolarHBondContact O-N 2.82Å; A904-V909 CarbonylContact C-O 3.54Å; A904-V909 VanDerWaalsContact C-O 3.31Å; A904-V909 PolarHBondContact O-N 2.77Å; A904-L935 HydrophobicContact CB-CD2 3.84Å
905	A	88.1	Confident	88.6	Confident	59 Å²	59	42.5 Å²	42.5	49%	0.488	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-41.7	175.5	0	0	0	0	0	112.8	Q901 N902 V903 L907 G908	Q901-A905 PolarHBondContact O-N 3.07Å; Q901-A905 VanDerWaalsContact O-N 3.15Å; N902-A905 WeakPolarHBondContact O-CB 3.37Å; N902-A905 PolarHBondContact O-N 2.92Å; V903-A905 VanDerWaalsContact C-N 3.31Å; V903-A905 PolarHBondContact O-N 3.41Å; A905-L907 VanDerWaalsContact C-N 3.27Å; A905-L907 PolarHBondContact O-N 2.95Å; A905-G908 WeakPolarHBondContact O-CA 3.49Å; A905-G908 PolarHBondContact O-N 2.77Å
906	I	87.2	Confident	88.6	Confident	52 Å²	52	41 Å²	41	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-34.7	174.1	-68.8	162.6	0	0	0	111.4	K856 V862 N902 V903 G908	K856-I906 PolarHBondContact NZ-O 3.1Å; V862-I906 HydrophobicContact CG2-CD1 3.75Å; N902-I906 VanDerWaalsContact O-CG1 3.32Å; N902-I906 WeakPolarHBondContact O-CG1 3.48Å; N902-I906 PolarHBondContact O-N 2.87Å; V903-I906 PolarHBondContact O-N 3.14Å; I906-G908 PolarHBondContact O-N 2.89Å
907	L	86.7	Confident	88.4	Confident	17 Å²	17	43.9 Å²	43.9	9%	0.089	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.5	172.7	-63	173	0	0	0	113.3	Y871 V903 A904 A905 I931 L935	Y871-L907 HydrophobicContact CD1-CD1 3.89Å; Y871-L907 HydrophobicContact CD1-CD2 3.79Å; Y871-L907 HydrophobicContact CD2-CD1 3.64Å; Y871-L907 HydrophobicContact CE1-CD1 4.08Å; Y871-L907 HydrophobicContact CE1-CD2 3.43Å; Y871-L907 VanDerWaalsContact CE1-CD2 3.43Å; Y871-L907 HydrophobicContact CE1-CG 4.4Å; Y871-L907 HydrophobicContact CE2-CD1 3.82Å; Y871-L907 HydrophobicContact CE2-CD2 4.43Å; Y871-L907 HydrophobicContact CG-CD1 3.69Å; Y871-L907 HydrophobicContact CG-CD2 4.45Å; V903-L907 HydrophobicContact CG1-CD1 4.17Å; V903-L907 WeakPolarHBondContact O-CG 3.49Å; V903-L907 PolarHBondContact O-N 3.33Å; A904-L907 CarbonylContact O-C 3.58Å; A904-L907 PolarHBondContact O-N 3.12Å; A905-L907 VanDerWaalsContact C-N 3.27Å; A905-L907 PolarHBondContact O-N 2.95Å; L907-I931 HydrophobicContact CB-CG2 4.34Å; L907-L935 HydrophobicContact CD1-CD1 3.82Å; L907-L935 HydrophobicContact CD1-CD2 4.49Å
908	G	85.3	Confident	88.3	Confident	28 Å²	28	43.3 Å²	43.3	29%	0.289	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	3.7	176.1	0	0	0	0	0	115.4	A904 A905 I906	A904-G908 PolarHBondContact O-N 2.82Å; A905-G908 WeakPolarHBondContact O-CA 3.49Å; A905-G908 PolarHBondContact O-N 2.77Å; I906-G908 PolarHBondContact O-N 2.89Å
909	V	88.2	Confident	88.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.246	C	C	.	.			trans	-94.9	100.7	179.7	-174	0	0	0	0	109.3	A904 F913 L914 V927 I931 V932 L935	A904-V909 CarbonylContact C-O 3.54Å; A904-V909 VanDerWaalsContact C-O 3.31Å; A904-V909 PolarHBondContact O-N 2.77Å; V909-F913 HydrophobicContact CG1-CD1 4.23Å; V909-L914 HydrophobicContact CG1-CD1 4.1Å; V909-L914 HydrophobicContact CG1-CD2 3.97Å; V909-L914 HydrophobicContact CG1-CG 3.93Å; V909-V927 HydrophobicContact CG2-CG1 4.46Å; V909-I931 HydrophobicContact CG2-CG2 4.3Å; V909-V932 HydrophobicContact CG2-CG2 3.82Å; V909-L935 HydrophobicContact CB-CD2 3.85Å; V909-L935 HydrophobicContact CG1-CD2 4.14Å; V909-L935 HydrophobicContact CG2-CD2 3.85Å
910	S	86.5	Confident	88	Confident	45 Å²	45	43.9 Å²	43.9	32%	0.315	27%	0.274	S	S	.	.			trans	-86.6	151.6	178.5	63.4	0	0	0	0	112.6	S912 F913 L914	S910-S912 PolarHBondContact O-N 2.97Å; S910-S912 PolarHBondContact OG-OG 2.96Å; S910-F913 WeakPolarHBondContact O-CA 3.36Å; S910-F913 WeakPolarHBondContact O-CB 3.29Å; S910-F913 PolarHBondContact O-N 3.49Å; S910-F913 PolarHBondContact OG-N 3.42Å; S910-L914 PolarHBondContact O-N 2.73Å
911	E	87.4	Confident	87.7	Confident	104 Å²	104	48.5 Å²	48.5	49%	0.486	30%	0.296	S	S	.	.	H	α-helix	trans	-48.1	-45.4	169.2	-174.8	-172.3	-170.4	0	0	111.6	F890 F893 F913 L914 G915	F890-E911 HydrophobicContact CE2-CG 3.92Å; F893-E911 HydrophobicContact CD1-CB 4.36Å; F893-E911 HydrophobicContact CD1-CG 4.16Å; F893-E911 HydrophobicContact CE1-CB 3.52Å; F893-E911 HydrophobicContact CE1-CG 3.67Å; F893-E911 HydrophobicContact CZ-CB 3.9Å; E911-F913 PolarHBondContact O-N 3.33Å; E911-L914 PolarHBondContact O-N 3.07Å; E911-L914 VanDerWaalsContact O-N 3.11Å; E911-G915 PolarHBondContact O-N 3.43Å
912	S	86.7	Confident	86.8	Confident	77 Å²	77	50.5 Å²	50.5	54%	0.538	32%	0.322	S	S	.	.	H	α-helix	trans	-66.6	-11.9	178.9	60.3	0	0	0	0	115.3	S910 K916	S910-S912 PolarHBondContact O-N 2.97Å; S910-S912 PolarHBondContact OG-OG 2.96Å; S912-K916 VanDerWaalsContact O-CD 3.29Å; S912-K916 WeakPolarHBondContact O-CD 3.46Å; S912-K916 VanDerWaalsContact O-CG 3.31Å; S912-K916 WeakPolarHBondContact O-CG 3.5Å
913	F	88.8	Confident	86.2	Confident	19 Å²	19	49.2 Å²	49.2	8%	0.083	32%	0.315	C	S	.	.	H	α-helix	trans	-87.5	-47.9	168.1	169.3	-87	0	0	0	110.2	V909 S910 E911 K916 K917 I923 V927 V932	V909-F913 HydrophobicContact CG1-CD1 4.23Å; S910-F913 WeakPolarHBondContact O-CA 3.36Å; S910-F913 WeakPolarHBondContact O-CB 3.29Å; S910-F913 PolarHBondContact O-N 3.49Å; S910-F913 PolarHBondContact OG-N 3.42Å; E911-F913 PolarHBondContact O-N 3.33Å; F913-K916 PolarHBondContact O-N 2.78Å; F913-K917 HydrophobicContact CE1-CG 4.2Å; F913-K917 HydrophobicContact CZ-CG 4.35Å; F913-K917 PolarHBondContact O-N 3.11Å; F913-I923 HydrophobicContact CD2-CD1 3.7Å; F913-I923 HydrophobicContact CD2-CG2 3.84Å; F913-I923 HydrophobicContact CE2-CD1 3.83Å; F913-I923 HydrophobicContact CE2-CG2 4.08Å; F913-I923 HydrophobicContact CG-CD1 4.24Å; F913-I923 HydrophobicContact CZ-CD1 4.48Å; F913-V927 HydrophobicContact CD2-CB 4.35Å; F913-V927 HydrophobicContact CD2-CG2 3.66Å; F913-V927 HydrophobicContact CE2-CB 3.77Å; F913-V927 HydrophobicContact CE2-CG2 3.58Å; F913-V927 HydrophobicContact CG-CG2 4.35Å; F913-V927 HydrophobicContact CZ-CB 3.98Å; F913-V927 HydrophobicContact CZ-CG2 4.2Å; F913-V932 HydrophobicContact CE1-CG1 4.12Å; F913-V932 HydrophobicContact CE1-CG2 3.82Å; F913-V932 HydrophobicContact CZ-CG2 4.08Å
914	L	89	Confident	85.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-63.2	-46.1	179.5	-65.9	175.7	0	0	0	112.1	W886 Y889 F890 F893 V909 S910 E911 K916 K917 A918	W886-L914 HydrophobicContact CZ3-CD2 4.38Å; Y889-L914 HydrophobicContact CD1-CD2 3.94Å; Y889-L914 HydrophobicContact CD2-CD1 4.36Å; Y889-L914 HydrophobicContact CD2-CD2 4.28Å; Y889-L914 HydrophobicContact CE1-CD2 3.83Å; Y889-L914 HydrophobicContact CE2-CD1 4.21Å; Y889-L914 HydrophobicContact CE2-CD2 4.15Å; Y889-L914 HydrophobicContact CG-CD2 4.18Å; F890-L914 HydrophobicContact CD2-CB 3.91Å; F893-L914 HydrophobicContact CB-CD1 3.86Å; F893-L914 HydrophobicContact CD1-CD1 4.49Å; F893-L914 HydrophobicContact CD2-CD1 3.45Å; F893-L914 VanDerWaalsContact CD2-CD1 3.45Å; F893-L914 HydrophobicContact CE2-CD1 4.13Å; F893-L914 HydrophobicContact CG-CD1 3.66Å; V909-L914 HydrophobicContact CG1-CD1 4.1Å; V909-L914 HydrophobicContact CG1-CD2 3.97Å; V909-L914 HydrophobicContact CG1-CG 3.93Å; S910-L914 PolarHBondContact O-N 2.73Å; E911-L914 PolarHBondContact O-N 3.07Å; E911-L914 VanDerWaalsContact O-N 3.11Å; L914-K916 PolarHBondContact O-N 3.31Å; L914-K917 WeakPolarHBondContact O-CB 3.38Å; L914-K917 PolarHBondContact O-N 3.29Å; L914-K917 VanDerWaalsContact O-N 3.12Å; L914-A918 WeakPolarHBondContact O-CB 3.14Å; L914-A918 PolarHBondContact O-N 3.45Å
915	G	87.4	Confident	84.2	Confident	20 Å²	20	68 Å²	68	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-28.6	176.7	0	0	0	0	0	113.4	E911 S919	E911-G915 PolarHBondContact O-N 3.43Å; G915-S919 WeakPolarHBondContact O-CB 3.45Å; G915-S919 PolarHBondContact O-N 2.88Å; G915-S919 VanDerWaalsContact O-N 3.15Å; G915-S919 PolarHBondContact O-OG 3.15Å
916	K	88.2	Confident	83.4	Confident	92 Å²	92	75.2 Å²	75.2	40%	0.4	41%	0.41	S	S	.	.	H	α-helix	trans	-76.3	-37.8	173.2	-74.3	-179.4	-175.3	171.2	0	112.5	S912 F913 L914 S919 G920 Q921 I923	S912-K916 VanDerWaalsContact O-CD 3.29Å; S912-K916 WeakPolarHBondContact O-CD 3.46Å; S912-K916 VanDerWaalsContact O-CG 3.31Å; S912-K916 WeakPolarHBondContact O-CG 3.5Å; F913-K916 PolarHBondContact O-N 2.78Å; L914-K916 PolarHBondContact O-N 3.31Å; K916-S919 PolarHBondContact O-N 2.91Å; K916-S919 PolarHBondContact O-OG 3.44Å; K916-G920 PolarHBondContact O-N 3.11Å; K916-Q921 HydrophobicContact CB-CB 4.17Å; K916-Q921 HydrophobicContact CG-CB 4.35Å; K916-Q921 PolarHBondContact O-N 3.21Å; K916-I923 HydrophobicContact CB-CD1 3.94Å; K916-I923 HydrophobicContact CB-CG1 3.99Å
917	K	87.1	Confident	83.2	Confident	83 Å²	83	74.1 Å²	74.1	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-60.9	-48.8	169.7	-81.2	-61	-161.9	168.8	0	111.7	W886 F913 L914 S919 G920 I923	W886-K917 HydrophobicContact CB-CB 4.12Å; W886-K917 HydrophobicContact CD2-CB 3.62Å; W886-K917 HydrophobicContact CD2-CD 4.16Å; W886-K917 HydrophobicContact CD2-CG 3.95Å; W886-K917 HydrophobicContact CE3-CB 3.44Å; W886-K917 VanDerWaalsContact CE3-CB 3.44Å; W886-K917 HydrophobicContact CE3-CD 4.29Å; W886-K917 HydrophobicContact CE3-CG 3.63Å; W886-K917 HydrophobicContact CG-CB 3.92Å; W886-K917 HydrophobicContact CH2-CD 4.36Å; W886-K917 HydrophobicContact CH2-CG 4.22Å; W886-K917 HydrophobicContact CZ2-CD 4.23Å; W886-K917 HydrophobicContact CZ2-CG 4.5Å; W886-K917 HydrophobicContact CZ3-CB 4.12Å; W886-K917 HydrophobicContact CZ3-CD 4.38Å; W886-K917 HydrophobicContact CZ3-CG 3.78Å; F913-K917 HydrophobicContact CE1-CG 4.2Å; F913-K917 HydrophobicContact CZ-CG 4.35Å; F913-K917 PolarHBondContact O-N 3.11Å; L914-K917 WeakPolarHBondContact O-CB 3.38Å; L914-K917 PolarHBondContact O-N 3.29Å; L914-K917 VanDerWaalsContact O-N 3.12Å; K917-S919 VanDerWaalsContact C-N 3.27Å; K917-S919 PolarHBondContact O-N 3.4Å; K917-G920 PolarHBondContact O-N 2.88Å; K917-I923 HydrophobicContact CD-CD1 3.95Å; K917-I923 HydrophobicContact CG-CD1 3.7Å
918	A	88.3	Confident	83.1	Confident	29 Å²	29	77.6 Å²	77.6	24%	0.24	42%	0.424	C	S	.	.	H	α-helix	trans	-61.3	-33.2	-180	0	0	0	0	0	113.2	W886 M887 F890 L914	W886-A918 HydrophobicContact CB-CB 4.46Å; W886-A918 WeakPolarHBondContact O-CB 3.4Å; M887-A918 HydrophobicContact SD-CB 4.27Å; F890-A918 HydrophobicContact CB-CB 3.88Å; F890-A918 HydrophobicContact CG-CB 4.29Å; L914-A918 WeakPolarHBondContact O-CB 3.14Å; L914-A918 PolarHBondContact O-N 3.45Å
919	S	87.6	Confident	83.1	Confident	69 Å²	69	82 Å²	82	48%	0.483	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	11.2	176	55.6	0	0	0	0	114.5	G915 K916 K917 Q921	G915-S919 WeakPolarHBondContact O-CB 3.45Å; G915-S919 PolarHBondContact O-N 2.88Å; G915-S919 VanDerWaalsContact O-N 3.15Å; G915-S919 PolarHBondContact O-OG 3.15Å; K916-S919 PolarHBondContact O-N 2.91Å; K916-S919 PolarHBondContact O-OG 3.44Å; K917-S919 VanDerWaalsContact C-N 3.27Å; K917-S919 PolarHBondContact O-N 3.4Å; S919-Q921 PolarHBondContact O-N 2.97Å; S919-Q921 VanDerWaalsContact O-N 3.17Å
920	G	83.6	Confident	83	Confident	70 Å²	70	86.2 Å²	86.2	72%	0.722	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	11.5	178.2	0	0	0	0	0	115.4	K916 K917	K916-G920 PolarHBondContact O-N 3.11Å; K917-G920 PolarHBondContact O-N 2.88Å
921	Q	83.9	Confident	83.2	Confident	112 Å²	112	86.5 Å²	86.5	52%	0.523	46%	0.456	S	S	.	.			trans	-77.4	139.8	-174.3	-65.4	-175.3	11.1	0	0	112.5	K916 S919 I923	K916-Q921 HydrophobicContact CB-CB 4.17Å; K916-Q921 HydrophobicContact CG-CB 4.35Å; K916-Q921 PolarHBondContact O-N 3.21Å; S919-Q921 PolarHBondContact O-N 2.97Å; S919-Q921 VanDerWaalsContact O-N 3.17Å; Q921-I923 WeakPolarHBondContact O-CG1 3.31Å; Q921-I923 PolarHBondContact O-N 3.02Å
922	A	72.3	Confident	83.3	Confident	101 Å²	101	81.7 Å²	81.7	84%	0.835	43%	0.433	S	S	*	.			trans	-63.9	130.4	176.1	0	0	0	0	0	112.1
923	I	78	Confident	83.6	Confident	55 Å²	55	78.1 Å²	78.1	28%	0.282	41%	0.408	S	S	.	.			trans	-106	127.4	-173	-58.8	-171.7	0	0	0	111	F913 K916 K917 Q921 K925	F913-I923 HydrophobicContact CD2-CD1 3.7Å; F913-I923 HydrophobicContact CD2-CG2 3.84Å; F913-I923 HydrophobicContact CE2-CD1 3.83Å; F913-I923 HydrophobicContact CE2-CG2 4.08Å; F913-I923 HydrophobicContact CG-CD1 4.24Å; F913-I923 HydrophobicContact CZ-CD1 4.48Å; K916-I923 HydrophobicContact CB-CD1 3.94Å; K916-I923 HydrophobicContact CB-CG1 3.99Å; K917-I923 HydrophobicContact CD-CD1 3.95Å; K917-I923 HydrophobicContact CG-CD1 3.7Å; Q921-I923 WeakPolarHBondContact O-CG1 3.31Å; Q921-I923 PolarHBondContact O-N 3.02Å; I923-K925 WeakPolarHBondContact CG2-O 3.1Å
924	R	65.8	Low	83.8	Confident	256 Å²	256	77.4 Å²	77.4	97%	0.966	41%	0.405	S	S	*	.	S	Bend	trans	-82.7	-23.4	-179.4	-63	-176.5	-177.8	175.9	0.1	114.7
925	K	71.5	Confident	84	Confident	138 Å²	138	77.3 Å²	77.3	60%	0.6	40%	0.404	S	S	*	.	S	Bend	trans	-96.5	110.5	177.7	-171.5	-174.9	-178.3	-168.1	0	108.8	I923 V927	I923-K925 WeakPolarHBondContact CG2-O 3.1Å; K925-V927 HydrophobicContact CD-CG2 4.5Å; K925-V927 PolarHBondContact O-N 3.04Å; K925-V927 VanDerWaalsContact O-N 3.13Å
926	K	73	Confident	84.3	Confident	212 Å²	212	76.5 Å²	76.5	92%	0.922	40%	0.395	S	S	*	.			trans	-69.7	107.1	171	-164.5	179.2	-176.3	-174.7	0	108
927	V	81.2	Confident	84.6	Confident	29 Å²	29	72.1 Å²	72.1	18%	0.176	38%	0.376	C	S	.	.			trans	-92.2	150	165	-174.8	0	0	0	0	106.8	V909 F913 K925 V932	V909-V927 HydrophobicContact CG2-CG1 4.46Å; F913-V927 HydrophobicContact CD2-CB 4.35Å; F913-V927 HydrophobicContact CD2-CG2 3.66Å; F913-V927 HydrophobicContact CE2-CB 3.77Å; F913-V927 HydrophobicContact CE2-CG2 3.58Å; F913-V927 HydrophobicContact CG-CG2 4.35Å; F913-V927 HydrophobicContact CZ-CB 3.98Å; F913-V927 HydrophobicContact CZ-CG2 4.2Å; K925-V927 HydrophobicContact CD-CG2 4.5Å; K925-V927 PolarHBondContact O-N 3.04Å; K925-V927 VanDerWaalsContact O-N 3.13Å; V927-V932 HydrophobicContact CB-CG2 4.37Å; V927-V932 HydrophobicContact CG1-CG2 3.7Å
928	D	84.6	Confident	85	Confident	89 Å²	89	68.2 Å²	68.2	48%	0.476	36%	0.359	S	S	.	.			trans	-60.5	136.7	174.5	-158.4	-30.5	0	0	0	110.7	D930 I931 V932	D928-D930 VanDerWaalsContact C-N 3.3Å; D928-D930 PolarHBondContact OD1-N 2.92Å; D928-D930 VanDerWaalsContact OD1-N 3.09Å; D928-I931 HydrophobicContact CB-CB 4.21Å; D928-I931 HydrophobicContact CB-CD1 3.88Å; D928-I931 HydrophobicContact CB-CG1 3.96Å; D928-V932 VanDerWaalsContact O-CG2 3.28Å; D928-V932 WeakPolarHBondContact O-CG2 3.27Å; D928-V932 PolarHBondContact O-N 3.11Å
929	K	86.1	Confident	85.3	Confident	122 Å²	122	67 Å²	67	53%	0.53	35%	0.348	S	S	.	.	H	α-helix	trans	-67	-39.1	177.4	-173.9	-164.5	170	-155.6	0	109.7	V932 N933	K929-V932 PolarHBondContact O-N 3.04Å; K929-N933 WeakPolarHBondContact O-CB 3.25Å; K929-N933 PolarHBondContact O-N 3.26Å
930	D	86.6	Confident	85.6	Confident	87 Å²	87	63.7 Å²	63.7	47%	0.465	33%	0.325	S	S	.	.	H	α-helix	trans	-76.7	-37.1	-166.7	-61.6	-15.6	0	0	0	110.7	V879 D928 V932 N933 R934	V879-D930 HydrophobicContact CG1-CB 3.88Å; V879-D930 VanDerWaalsContact CG1-O 3.27Å; V879-D930 WeakPolarHBondContact CG1-O 3.36Å; D928-D930 VanDerWaalsContact C-N 3.3Å; D928-D930 PolarHBondContact OD1-N 2.92Å; D928-D930 VanDerWaalsContact OD1-N 3.09Å; D930-V932 VanDerWaalsContact C-N 3.33Å; D930-V932 PolarHBondContact O-N 3.48Å; D930-N933 PolarHBondContact O-N 2.83Å; D930-R934 WeakPolarHBondContact O-CB 3.28Å; D930-R934 PolarHBondContact O-N 3.06Å
931	I	89.5	Confident	86.1	Confident	52 Å²	52	60.4 Å²	60.4	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-58.7	-44.5	168.7	-62.3	177.9	0	0	0	110.9	L907 V909 D928 L935	L907-I931 HydrophobicContact CB-CG2 4.34Å; V909-I931 HydrophobicContact CG2-CG2 4.3Å; D928-I931 HydrophobicContact CB-CB 4.21Å; D928-I931 HydrophobicContact CB-CD1 3.88Å; D928-I931 HydrophobicContact CB-CG1 3.96Å; I931-L935 VanDerWaalsContact O-CB 3.29Å; I931-L935 WeakPolarHBondContact O-CB 3.47Å; I931-L935 PolarHBondContact O-N 2.92Å
932	V	90.7	Very high	86.6	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-40.2	-178.6	172.1	0	0	0	0	111.7	W886 Y889 V909 F913 V927 D928 K929 D930 Y936	W886-V932 HydrophobicContact CH2-CG1 3.65Å; W886-V932 HydrophobicContact CZ3-CG1 3.64Å; Y889-V932 HydrophobicContact CE1-CG1 3.79Å; Y889-V932 WeakPolarHBondContact CE1-O 3.27Å; Y889-V932 PolarHBondContact OH-O 3.1Å; V909-V932 HydrophobicContact CG2-CG2 3.82Å; F913-V932 HydrophobicContact CE1-CG1 4.12Å; F913-V932 HydrophobicContact CE1-CG2 3.82Å; F913-V932 HydrophobicContact CZ-CG2 4.08Å; V927-V932 HydrophobicContact CB-CG2 4.37Å; V927-V932 HydrophobicContact CG1-CG2 3.7Å; D928-V932 VanDerWaalsContact O-CG2 3.28Å; D928-V932 WeakPolarHBondContact O-CG2 3.27Å; D928-V932 PolarHBondContact O-N 3.11Å; K929-V932 PolarHBondContact O-N 3.04Å; D930-V932 VanDerWaalsContact C-N 3.33Å; D930-V932 PolarHBondContact O-N 3.48Å; V932-Y936 PolarHBondContact O-N 2.87Å
933	N	92.1	Very high	87.6	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.011	24%	0.236	C	C	.	.	H	α-helix	trans	-67.6	-46.6	175.1	-85.7	9.8	0	0	0	111.7	V879 S882 P884 K929 D930 L935 Y936 L937	V879-N933 HydrophobicContact CG1-CB 3.53Å; V879-N933 PolarHBondContact O-ND2 3.47Å; S882-N933 PolarHBondContact O-ND2 2.9Å; P884-N933 WeakPolarHBondContact CD-OD1 3.41Å; K929-N933 WeakPolarHBondContact O-CB 3.25Å; K929-N933 PolarHBondContact O-N 3.26Å; D930-N933 PolarHBondContact O-N 2.83Å; N933-L935 VanDerWaalsContact C-N 3.31Å; N933-L935 PolarHBondContact O-N 2.84Å; N933-Y936 WeakPolarHBondContact O-CB 3.43Å; N933-Y936 PolarHBondContact O-N 3.03Å; N933-Y936 VanDerWaalsContact O-N 3.08Å; N933-L937 PolarHBondContact O-N 3.24Å
934	R	93.1	Very high	88.3	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-38.9	179	-168.4	179	-175.7	-150.3	5.6	111.7	D853 Y871 L872 T874 Y876 V879 D930 Y936 L937 S938	D853-R934 IonicContact OD2-CZ 3.84Å; D853-R934 IonicContact OD2-NH1 3.92Å; D853-R934 PolarHBondContact OD2-NH1 3Å; Y871-R934 HydrophobicContact CD2-CG 4.24Å; Y871-R934 HydrophobicContact CE2-CB 3.96Å; Y871-R934 HydrophobicContact CE2-CG 3.87Å; Y871-R934 VanDerWaalsContact O-CZ 3.25Å; Y871-R934 PolarHBondContact O-NE 3.37Å; Y871-R934 PolarHBondContact O-NH2 3.2Å; L872-R934 PolarHBondContact O-NH2 3.19Å; L872-R934 VanDerWaalsContact O-NH2 3.1Å; T874-R934 HydrophobicContact CG2-CG 3.66Å; T874-R934 PolarHBondContact O-NE 3.08Å; T874-R934 PolarHBondContact O-NH2 3.09Å; Y876-R934 VanDerWaalsContact CE1-NH1 3.29Å; Y876-R934 VanDerWaalsContact CZ-CZ 3.49Å; Y876-R934 VanDerWaalsContact CZ-NH2 3.27Å; Y876-R934 PolarHBondContact OH-NH1 3.49Å; Y876-R934 PolarHBondContact OH-NH2 3.28Å; V879-R934 HydrophobicContact CG1-CB 4.3Å; V879-R934 HydrophobicContact CG2-CB 3.84Å; V879-R934 HydrophobicContact CG2-CG 4.03Å; D930-R934 WeakPolarHBondContact O-CB 3.28Å; D930-R934 PolarHBondContact O-N 3.06Å; R934-Y936 VanDerWaalsContact C-N 3.35Å; R934-Y936 PolarHBondContact O-N 2.54Å; R934-L937 PolarHBondContact O-N 3.37Å; R934-S938 PolarHBondContact O-N 2.92Å; R934-S938 PolarHBondContact O-OG 2.8Å
935	L	93.1	Very high	89.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-34.2	173.6	-177.2	62	0	0	0	112.8	Y871 Y889 A904 L907 V909 I931 N933 S938 F939	Y871-L935 HydrophobicContact CD2-CB 4.28Å; Y871-L935 HydrophobicContact CD2-CD1 4.25Å; Y871-L935 HydrophobicContact CE2-CB 4.27Å; Y889-L935 WeakPolarHBondContact OH-CB 3.38Å; A904-L935 HydrophobicContact CB-CD2 3.84Å; L907-L935 HydrophobicContact CD1-CD1 3.82Å; L907-L935 HydrophobicContact CD1-CD2 4.49Å; V909-L935 HydrophobicContact CB-CD2 3.85Å; V909-L935 HydrophobicContact CG1-CD2 4.14Å; V909-L935 HydrophobicContact CG2-CD2 3.85Å; I931-L935 VanDerWaalsContact O-CB 3.29Å; I931-L935 WeakPolarHBondContact O-CB 3.47Å; I931-L935 PolarHBondContact O-N 2.92Å; N933-L935 VanDerWaalsContact C-N 3.31Å; N933-L935 PolarHBondContact O-N 2.84Å; L935-S938 VanDerWaalsContact O-CB 3.31Å; L935-S938 WeakPolarHBondContact O-CB 3.48Å; L935-S938 PolarHBondContact O-N 2.74Å; L935-F939 HydrophobicContact CD1-CD1 4.14Å; L935-F939 HydrophobicContact CD1-CE1 3.52Å; L935-F939 HydrophobicContact CD1-CZ 4.27Å; L935-F939 HydrophobicContact CD2-CE1 4.5Å; L935-F939 HydrophobicContact CD2-CZ 4.46Å; L935-F939 HydrophobicContact CG-CD1 4.41Å; L935-F939 HydrophobicContact CG-CE1 3.79Å; L935-F939 HydrophobicContact CG-CZ 4.12Å; L935-F939 VanDerWaalsContact O-CD1 3.23Å; L935-F939 WeakPolarHBondContact O-CD1 3.42Å; L935-F939 PolarHBondContact O-N 3.03Å
936	Y	93.9	Very high	90.3	Very high	3 Å²	3	38.2 Å²	38.2	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-46.5	173.3	-177.3	-117	0	0	0	111.8	P884 Y889 V932 N933 R934 S938 F939 V940 F957 M959	P884-Y936 HydrophobicContact CB-CD1 3.61Å; P884-Y936 HydrophobicContact CB-CD2 4.08Å; P884-Y936 HydrophobicContact CB-CE1 3.78Å; P884-Y936 HydrophobicContact CB-CE2 4.25Å; P884-Y936 HydrophobicContact CB-CG 3.75Å; Y889-Y936 AromaticContact CD1-CD2 3.75Å; Y889-Y936 HydrophobicContact CD1-CD2 3.75Å; Y889-Y936 HydrophobicContact CD1-CE2 4.49Å; Y889-Y936 HydrophobicContact CD1-CG 4.19Å; Y889-Y936 AromaticContact CD2-CD2 3.71Å; Y889-Y936 HydrophobicContact CD2-CD2 3.71Å; Y889-Y936 HydrophobicContact CD2-CE2 4.44Å; Y889-Y936 HydrophobicContact CE1-CD2 4.16Å; Y889-Y936 HydrophobicContact CE1-CG 4.26Å; Y889-Y936 HydrophobicContact CE2-CD2 4.14Å; Y889-Y936 AromaticContact CG-CD2 3.49Å; Y889-Y936 HydrophobicContact CG-CD2 3.49Å; Y889-Y936 VanDerWaalsContact CG-CD2 3.49Å; Y889-Y936 HydrophobicContact CG-CE2 4.03Å; Y889-Y936 HydrophobicContact CG-CG 4.36Å; Y889-Y936 PolarHBondContact OH-N 3.37Å; V932-Y936 PolarHBondContact O-N 2.87Å; N933-Y936 WeakPolarHBondContact O-CB 3.43Å; N933-Y936 PolarHBondContact O-N 3.03Å; N933-Y936 VanDerWaalsContact O-N 3.08Å; R934-Y936 VanDerWaalsContact C-N 3.35Å; R934-Y936 PolarHBondContact O-N 2.54Å; Y936-S938 PolarHBondContact O-N 3.08Å; Y936-F939 WeakPolarHBondContact O-CB 3.28Å; Y936-F939 PolarHBondContact O-N 3.34Å; Y936-V940 PolarHBondContact O-N 3.21Å; Y936-V940 VanDerWaalsContact O-N 3.11Å; Y936-F957 AromaticContact CE2-CD1 3.87Å; Y936-F957 HydrophobicContact CE2-CD1 3.87Å; Y936-F957 HydrophobicContact CE2-CE1 4.07Å; Y936-F957 AromaticContact CZ-CD1 3.89Å; Y936-M959 HydrophobicContact CD1-CE 4.35Å; Y936-M959 HydrophobicContact CE1-CE 3.63Å
937	L	94.6	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-35	173.5	-63.8	178.1	0	0	0	111.8	T874 L878 N933 R934 F939 V940 L941 Y963 L967	T874-L937 HydrophobicContact CG2-CB 3.89Å; L878-L937 HydrophobicContact CB-CD1 4.22Å; N933-L937 PolarHBondContact O-N 3.24Å; R934-L937 PolarHBondContact O-N 3.37Å; L937-F939 VanDerWaalsContact C-N 3.31Å; L937-F939 PolarHBondContact O-N 3.48Å; L937-V940 PolarHBondContact O-N 3.08Å; L937-L941 WeakPolarHBondContact O-CG 3.45Å; L937-L941 PolarHBondContact O-N 3.16Å; L937-Y963 HydrophobicContact CD2-CE1 4.49Å; L937-L967 HydrophobicContact CB-CD1 4.24Å; L937-L967 HydrophobicContact CB-CD2 4.34Å; L937-L967 HydrophobicContact CD1-CD1 4.31Å; L937-L967 HydrophobicContact CD2-CD1 4.26Å; L937-L967 HydrophobicContact CD2-CD2 3.9Å
938	S	94.8	Very high	91	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-37.2	172.6	-52	0	0	0	0	112	Y871 T874 R934 L935 Y936 Y942	Y871-S938 WeakPolarHBondContact CA-OG 3.27Å; Y871-S938 WeakPolarHBondContact CD2-OG 3.49Å; T874-S938 PolarHBondContact OG1-OG 3.41Å; R934-S938 PolarHBondContact O-N 2.92Å; R934-S938 PolarHBondContact O-OG 2.8Å; L935-S938 VanDerWaalsContact O-CB 3.31Å; L935-S938 WeakPolarHBondContact O-CB 3.48Å; L935-S938 PolarHBondContact O-N 2.74Å; Y936-S938 PolarHBondContact O-N 3.08Å; S938-Y942 WeakPolarHBondContact O-CB 3.28Å; S938-Y942 PolarHBondContact O-N 3.12Å
939	F	94.5	Very high	91.2	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.018	14%	0.142	C	C	.	.	H	α-helix	trans	-67.7	-42.5	175.5	-70.3	8.1	0	0	0	111.1	L867 Y889 Q892 F893 L896 L935 Y936 L937 L941 Y942 T943 F957	L867-F939 HydrophobicContact CD1-CD1 3.8Å; L867-F939 HydrophobicContact CD1-CE1 4.03Å; L867-F939 HydrophobicContact CD2-CE1 4.1Å; Y889-F939 AromaticContact CD2-CD2 3.98Å; Y889-F939 HydrophobicContact CD2-CD2 3.98Å; Y889-F939 AromaticContact CD2-CE2 3.9Å; Y889-F939 HydrophobicContact CD2-CE2 3.9Å; Y889-F939 AromaticContact CE2-CD2 3.83Å; Y889-F939 HydrophobicContact CE2-CD2 3.83Å; Y889-F939 AromaticContact CE2-CE2 3.56Å; Y889-F939 HydrophobicContact CE2-CE2 3.56Å; Y889-F939 HydrophobicContact CE2-CZ 4.21Å; Q892-F939 HydrophobicContact CB-CD2 4.35Å; F893-F939 HydrophobicContact CB-CE2 4.12Å; F893-F939 HydrophobicContact CD2-CE2 4.31Å; F893-F939 HydrophobicContact CD2-CZ 4.19Å; L896-F939 HydrophobicContact CD1-CE1 3.83Å; L896-F939 HydrophobicContact CD1-CE2 3.87Å; L896-F939 HydrophobicContact CD1-CZ 3.44Å; L896-F939 VanDerWaalsContact CD1-CZ 3.44Å; L935-F939 HydrophobicContact CD1-CD1 4.14Å; L935-F939 HydrophobicContact CD1-CE1 3.52Å; L935-F939 HydrophobicContact CD1-CZ 4.27Å; L935-F939 HydrophobicContact CD2-CE1 4.5Å; L935-F939 HydrophobicContact CD2-CZ 4.46Å; L935-F939 HydrophobicContact CG-CD1 4.41Å; L935-F939 HydrophobicContact CG-CE1 3.79Å; L935-F939 HydrophobicContact CG-CZ 4.12Å; L935-F939 VanDerWaalsContact O-CD1 3.23Å; L935-F939 WeakPolarHBondContact O-CD1 3.42Å; L935-F939 PolarHBondContact O-N 3.03Å; Y936-F939 WeakPolarHBondContact O-CB 3.28Å; Y936-F939 PolarHBondContact O-N 3.34Å; L937-F939 VanDerWaalsContact C-N 3.31Å; L937-F939 PolarHBondContact O-N 3.48Å; F939-L941 PolarHBondContact O-N 2.67Å; F939-Y942 PolarHBondContact O-N 3.36Å; F939-T943 PolarHBondContact O-N 3.23Å; F939-T943 PolarHBondContact O-OG1 3.08Å; F939-T943 VanDerWaalsContact O-OG1 3.11Å; F939-F957 HydrophobicContact CB-CE1 4.26Å; F939-F957 HydrophobicContact CB-CZ 4.28Å
940	V	94.7	Very high	91.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.8	-50.1	174.8	179.7	0	0	0	0	110.6	Y936 L937 Y942 L944 V953 F957 M959 I964 L967	Y936-V940 PolarHBondContact O-N 3.21Å; Y936-V940 VanDerWaalsContact O-N 3.11Å; L937-V940 PolarHBondContact O-N 3.08Å; V940-Y942 VanDerWaalsContact C-N 3.34Å; V940-Y942 PolarHBondContact O-N 3.42Å; V940-L944 VanDerWaalsContact O-CB 3.3Å; V940-L944 WeakPolarHBondContact O-CB 3.36Å; V940-L944 PolarHBondContact O-N 3.32Å; V940-V953 HydrophobicContact CG1-CG1 3.9Å; V940-F957 HydrophobicContact CG2-CB 4.45Å; V940-F957 HydrophobicContact CG2-CD1 3.54Å; V940-F957 HydrophobicContact CG2-CD2 4.41Å; V940-F957 HydrophobicContact CG2-CE1 3.71Å; V940-F957 HydrophobicContact CG2-CG 3.9Å; V940-F957 HydrophobicContact CG2-CZ 4.23Å; V940-M959 HydrophobicContact CG1-SD 4.47Å; V940-M959 HydrophobicContact CG2-SD 3.99Å; V940-I964 HydrophobicContact CG1-CG1 4.14Å; V940-I964 HydrophobicContact CG1-CG2 4.43Å; V940-L967 HydrophobicContact CB-CD2 4.05Å; V940-L967 HydrophobicContact CG1-CD2 3.87Å
941	L	94.4	Very high	91.5	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-39.5	176.8	-73.4	167.6	0	0	0	112.5	I870 T874 L937 F939 L944 L945 L967 L968 A971 L1002	I870-L941 HydrophobicContact CG2-CB 3.71Å; I870-L941 HydrophobicContact CG2-CD1 4.15Å; T874-L941 HydrophobicContact CG2-CD1 4.46Å; L937-L941 WeakPolarHBondContact O-CG 3.45Å; L937-L941 PolarHBondContact O-N 3.16Å; F939-L941 PolarHBondContact O-N 2.67Å; L941-L944 PolarHBondContact O-N 3.04Å; L941-L945 WeakPolarHBondContact O-CG 3.27Å; L941-L945 PolarHBondContact O-N 2.71Å; L941-L967 HydrophobicContact CD1-CD1 4.37Å; L941-L967 HydrophobicContact CD1-CG 4.36Å; L941-L967 HydrophobicContact CD2-CD2 4.5Å; L941-L967 HydrophobicContact CD2-CG 4.03Å; L941-L967 HydrophobicContact CG-CD2 4.18Å; L941-L967 HydrophobicContact CG-CG 4.07Å; L941-L968 HydrophobicContact CD2-CB 4.4Å; L941-L968 HydrophobicContact CD2-CD1 4.22Å; L941-A971 HydrophobicContact CD1-CB 3.63Å; L941-A971 HydrophobicContact CD2-CB 3.84Å; L941-A971 HydrophobicContact CG-CB 4.41Å; L941-L1002 HydrophobicContact CD2-CD2 4.36Å
942	Y	94.1	Very high	91.6	Very high	23 Å²	23	21.3 Å²	21.3	9%	0.09	11%	0.106	C	C	.	.	H	α-helix	trans	-72.7	-41.7	-177.9	-173.8	-131.1	0	0	0	113.1	S865 L866 L867 I870 E900 S938 F939 V940 L944 L945 K946	S865-Y942 PolarHBondContact OG-OH 2.76Å; L866-Y942 HydrophobicContact CB-CE2 4.27Å; L867-Y942 HydrophobicContact CB-CD1 4.12Å; L867-Y942 HydrophobicContact CB-CE1 4.15Å; L867-Y942 HydrophobicContact CB-CG 4.34Å; L867-Y942 HydrophobicContact CD1-CD1 4.07Å; L867-Y942 HydrophobicContact CD1-CG 4.19Å; L867-Y942 HydrophobicContact CG-CD1 4.47Å; I870-Y942 HydrophobicContact CD1-CD2 3.48Å; I870-Y942 VanDerWaalsContact CD1-CD2 3.48Å; I870-Y942 HydrophobicContact CD1-CE2 4.35Å; I870-Y942 HydrophobicContact CD1-CG 4.17Å; E900-Y942 HydrophobicContact CG-CE1 4.27Å; E900-Y942 WeakPolarHBondContact OE1-CE1 3.4Å; E900-Y942 PolarHBondContact OE1-OH 3.26Å; S938-Y942 WeakPolarHBondContact O-CB 3.28Å; S938-Y942 PolarHBondContact O-N 3.12Å; F939-Y942 PolarHBondContact O-N 3.36Å; V940-Y942 VanDerWaalsContact C-N 3.34Å; V940-Y942 PolarHBondContact O-N 3.42Å; Y942-L944 VanDerWaalsContact C-N 3.3Å; Y942-L944 PolarHBondContact O-N 3.26Å; Y942-L945 PolarHBondContact O-N 2.86Å; Y942-K946 HydrophobicContact CE1-CD 4.23Å; Y942-K946 PolarHBondContact O-N 2.84Å; Y942-K946 WeakPolarHBondContact OH-CE 3.19Å; Y942-K946 PolarHBondContact OH-NZ 3.38Å
943	T	93.5	Very high	91.7	Very high	19 Å²	19	21.2 Å²	21.2	12%	0.117	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-39.3	171.4	-54.1	0	0	0	0	110.7	F939 L945 K946 E947 V953 K956 F957	F939-T943 PolarHBondContact O-N 3.23Å; F939-T943 PolarHBondContact O-OG1 3.08Å; F939-T943 VanDerWaalsContact O-OG1 3.11Å; T943-L945 PolarHBondContact O-N 2.94Å; T943-K946 PolarHBondContact O-N 3.45Å; T943-K946 VanDerWaalsContact O-N 3.16Å; T943-E947 HydrophobicContact CG2-CG 4.35Å; T943-E947 WeakPolarHBondContact CG2-OE1 3.41Å; T943-E947 WeakPolarHBondContact O-CB 3.25Å; T943-E947 PolarHBondContact O-N 3.3Å; T943-V953 HydrophobicContact CG2-CG2 4.16Å; T943-K956 HydrophobicContact CG2-CD 4.36Å; T943-F957 HydrophobicContact CG2-CE2 4.16Å
944	L	92.6	Very high	91.7	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-63.2	-40.9	176.5	-171.7	63.9	0	0	0	112.7	V940 L941 Y942 K946 E947 T948 I950 V953 I964 L968	V940-L944 VanDerWaalsContact O-CB 3.3Å; V940-L944 WeakPolarHBondContact O-CB 3.36Å; V940-L944 PolarHBondContact O-N 3.32Å; L941-L944 PolarHBondContact O-N 3.04Å; Y942-L944 VanDerWaalsContact C-N 3.3Å; Y942-L944 PolarHBondContact O-N 3.26Å; L944-K946 VanDerWaalsContact C-N 3.34Å; L944-E947 PolarHBondContact O-N 3.18Å; L944-T948 WeakPolarHBondContact O-CA 3.26Å; L944-T948 PolarHBondContact O-N 3.16Å; L944-I950 HydrophobicContact CD1-CB 4.44Å; L944-I950 HydrophobicContact CD1-CG1 3.91Å; L944-V953 HydrophobicContact CB-CG2 4.08Å; L944-V953 HydrophobicContact CD1-CB 4.33Å; L944-V953 HydrophobicContact CD1-CG2 3.81Å; L944-I964 HydrophobicContact CD1-CG2 4.37Å; L944-I964 HydrophobicContact CD2-CG2 3.7Å; L944-L968 HydrophobicContact CD2-CB 4.08Å; L944-L968 HydrophobicContact CD2-CD1 4.18Å; L944-L968 HydrophobicContact CD2-CD2 3.97Å; L944-L968 HydrophobicContact CD2-CG 4.3Å
945	L	90.4	Very high	91.6	Very high	36 Å²	36	28 Å²	28	19%	0.188	14%	0.14	C	C	.	.	H	α-helix	trans	-69.2	-26.6	173.3	-76.4	171.9	0	0	0	113.8	I870 L941 Y942 T943 L998 K1001 L1002	I870-L945 HydrophobicContact CD1-CD1 3.62Å; I870-L945 HydrophobicContact CG1-CD1 4.14Å; L941-L945 WeakPolarHBondContact O-CG 3.27Å; L941-L945 PolarHBondContact O-N 2.71Å; Y942-L945 PolarHBondContact O-N 2.86Å; T943-L945 PolarHBondContact O-N 2.94Å; L945-L998 HydrophobicContact CD1-CD1 4.24Å; L945-K1001 HydrophobicContact CD2-CB 4.12Å; L945-K1001 WeakPolarHBondContact CD2-O 3.28Å; L945-L1002 HydrophobicContact CD1-CD2 3.79Å; L945-L1002 HydrophobicContact CD1-CG 4.38Å; L945-L1002 HydrophobicContact CG-CD2 4.36Å
946	K	88.3	Confident	91.5	Very high	115 Å²	115	31.6 Å²	31.6	50%	0.5	16%	0.155	S	C	.	.	H	α-helix	trans	-75.5	-38.7	172.5	-83.6	179.8	169.9	167.4	0	112.6	E900 Y942 T943 L944	E900-K946 IonicContact OE1-NZ 2.73Å; E900-K946 PolarHBondContact OE1-NZ 3.22Å; E900-K946 IonicContact OE2-NZ 3.21Å; Y942-K946 HydrophobicContact CE1-CD 4.23Å; Y942-K946 PolarHBondContact O-N 2.84Å; Y942-K946 WeakPolarHBondContact OH-CE 3.19Å; Y942-K946 PolarHBondContact OH-NZ 3.38Å; T943-K946 PolarHBondContact O-N 3.45Å; T943-K946 VanDerWaalsContact O-N 3.16Å; L944-K946 VanDerWaalsContact C-N 3.34Å
947	E	85.1	Confident	91.5	Very high	61 Å²	61	31.6 Å²	31.6	29%	0.285	16%	0.156	S	C	.	.	H	α-helix	trans	-102.2	-22.1	-169.4	-68	177.5	-169.2	0	0	114.2	T943 L944 N949 T952 K956	T943-E947 HydrophobicContact CG2-CG 4.35Å; T943-E947 WeakPolarHBondContact CG2-OE1 3.41Å; T943-E947 WeakPolarHBondContact O-CB 3.25Å; T943-E947 PolarHBondContact O-N 3.3Å; L944-E947 PolarHBondContact O-N 3.18Å; E947-N949 PolarHBondContact O-N 2.55Å; E947-N949 VanDerWaalsContact O-N 3.09Å; E947-T952 VanDerWaalsContact OE2-CG2 3.25Å; E947-T952 WeakPolarHBondContact OE2-CG2 3.48Å; E947-K956 IonicContact OE1-NZ 2.79Å; E947-K956 PolarHBondContact OE1-NZ 2.84Å; E947-K956 IonicContact OE2-NZ 3.66Å
948	T	84.8	Confident	91.3	Very high	52 Å²	52	38 Å²	38	32%	0.319	19%	0.19	S	C	.	.			trans	53.8	23	-176.6	61.7	0	0	0	0	114.5	L944	L944-T948 WeakPolarHBondContact O-CA 3.26Å; L944-T948 PolarHBondContact O-N 3.16Å
949	N	87.4	Confident	91.1	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.144	20%	0.195	C	C	.	.			trans	-134.6	106.1	-177.5	-171.2	-2.3	0	0	0	112.1	N625 E947 W951 T952 V953	N625-N949 PolarHBondContact ND2-OD1 2.89Å; E947-N949 PolarHBondContact O-N 2.55Å; E947-N949 VanDerWaalsContact O-N 3.09Å; N949-W951 PolarHBondContact O-N 2.91Å; N949-W951 PolarHBondContact OD1-N 3.14Å; N949-W951 VanDerWaalsContact OD1-N 3.16Å; N949-T952 PolarHBondContact ND2-OG1 3.27Å; N949-T952 VanDerWaalsContact ND2-OG1 3.15Å; N949-T952 PolarHBondContact O-N 3.24Å; N949-V953 PolarHBondContact O-N 2.87Å
950	I	90.6	Very high	90.9	Very high	27 Å²	27	42.3 Å²	42.3	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-32.7	-179.2	-59	170.1	0	0	0	111.8	T648 L944 S954 R961 I964 Q965	T648-I950 HydrophobicContact CG2-CG2 4.41Å; L944-I950 HydrophobicContact CD1-CB 4.44Å; L944-I950 HydrophobicContact CD1-CG1 3.91Å; I950-S954 WeakPolarHBondContact O-CB 3.32Å; I950-S954 PolarHBondContact O-N 2.82Å; I950-R961 HydrophobicContact CG2-CB 3.79Å; I950-R961 WeakPolarHBondContact CG2-O 3.42Å; I950-I964 HydrophobicContact CG2-CB 4.2Å; I950-I964 HydrophobicContact CG2-CG2 4.06Å; I950-Q965 HydrophobicContact CD1-CB 4.29Å; I950-Q965 HydrophobicContact CD1-CG 4.34Å
951	W	90.1	Very high	90.8	Very high	24 Å²	24	43.5 Å²	43.5	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-68.6	-45	-179.4	-73.4	81.4	0	0	0	112.4	N627 C629 N949 V953 S954 E955 R961	N627-W951 HydrophobicContact CB-CD2 3.89Å; N627-W951 HydrophobicContact CB-CE3 3.75Å; N627-W951 HydrophobicContact CB-CG 4.29Å; N627-W951 HydrophobicContact CB-CZ3 4.22Å; C629-W951 HydrophobicContact CB-CH2 4.33Å; N949-W951 PolarHBondContact O-N 2.91Å; N949-W951 PolarHBondContact OD1-N 3.14Å; N949-W951 VanDerWaalsContact OD1-N 3.16Å; W951-V953 VanDerWaalsContact C-N 3.31Å; W951-V953 PolarHBondContact O-N 2.92Å; W951-S954 WeakPolarHBondContact O-CB 3.2Å; W951-S954 PolarHBondContact O-N 2.81Å; W951-E955 PolarHBondContact O-N 3.15Å; W951-R961 VanDerWaalsContact CZ2-NE 3.32Å
952	T	90.4	Very high	90.6	Very high	45 Å²	45	43.5 Å²	43.5	28%	0.276	22%	0.221	S	C	.	.	H	α-helix	trans	-64.3	-37.7	179.1	-49.5	0	0	0	0	111.4	E947 N949 K956	E947-T952 VanDerWaalsContact OE2-CG2 3.25Å; E947-T952 WeakPolarHBondContact OE2-CG2 3.48Å; N949-T952 PolarHBondContact ND2-OG1 3.27Å; N949-T952 VanDerWaalsContact ND2-OG1 3.15Å; N949-T952 PolarHBondContact O-N 3.24Å; T952-K956 HydrophobicContact CG2-CD 4.4Å; T952-K956 WeakPolarHBondContact O-CB 3.22Å; T952-K956 VanDerWaalsContact O-CG 3.28Å; T952-K956 WeakPolarHBondContact O-CG 3.4Å; T952-K956 PolarHBondContact O-N 3.42Å
953	V	92.6	Very high	90.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-40.2	173.9	-175.6	0	0	0	0	111.7	V940 T943 L944 N949 W951 E955 K956 F957 I964	V940-V953 HydrophobicContact CG1-CG1 3.9Å; T943-V953 HydrophobicContact CG2-CG2 4.16Å; L944-V953 HydrophobicContact CB-CG2 4.08Å; L944-V953 HydrophobicContact CD1-CB 4.33Å; L944-V953 HydrophobicContact CD1-CG2 3.81Å; N949-V953 PolarHBondContact O-N 2.87Å; W951-V953 VanDerWaalsContact C-N 3.31Å; W951-V953 PolarHBondContact O-N 2.92Å; V953-E955 VanDerWaalsContact C-N 3.31Å; V953-E955 PolarHBondContact O-N 3.38Å; V953-K956 PolarHBondContact O-N 2.99Å; V953-F957 HydrophobicContact CG1-CD2 3.65Å; V953-F957 HydrophobicContact CG1-CE2 4Å; V953-F957 WeakPolarHBondContact O-CD2 3.22Å; V953-F957 PolarHBondContact O-N 3.2Å; V953-I964 HydrophobicContact CB-CD1 4.32Å; V953-I964 HydrophobicContact CG1-CD1 3.99Å; V953-I964 HydrophobicContact CG1-CG2 4.46Å
954	S	92.3	Very high	90.4	Very high	21 Å²	21	42.9 Å²	42.9	15%	0.147	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-43.9	175.4	-177.4	0	0	0	0	112	I950 W951 N958 M959 R961 I964	I950-S954 WeakPolarHBondContact O-CB 3.32Å; I950-S954 PolarHBondContact O-N 2.82Å; W951-S954 WeakPolarHBondContact O-CB 3.2Å; W951-S954 PolarHBondContact O-N 2.81Å; S954-N958 WeakPolarHBondContact O-CA 3.36Å; S954-N958 PolarHBondContact O-N 3.09Å; S954-N958 VanDerWaalsContact O-N 3.07Å; S954-M959 WeakPolarHBondContact CA-O 3.49Å; S954-M959 WeakPolarHBondContact CB-O 3.4Å; S954-M959 PolarHBondContact O-N 2.81Å; S954-M959 VanDerWaalsContact O-N 3.1Å; S954-M959 PolarHBondContact OG-O 3.18Å; S954-R961 PolarHBondContact OG-N 3.4Å; S954-I964 VanDerWaalsContact CA-CD1 3.41Å
955	E	91.1	Very high	90.3	Very high	128 Å²	128	44.1 Å²	44.1	60%	0.598	22%	0.222	S	C	*	.	H	α-helix	trans	-71.5	-42.2	175.6	-69.3	169	-173.4	0	0	112.3	W951 V953 F957	W951-E955 PolarHBondContact O-N 3.15Å; V953-E955 VanDerWaalsContact C-N 3.31Å; V953-E955 PolarHBondContact O-N 3.38Å; E955-F957 PolarHBondContact O-N 3.23Å
956	K	91.8	Very high	90.2	Very high	75 Å²	75	45.5 Å²	45.5	33%	0.326	23%	0.23	S	C	.	.	H	α-helix	trans	-65.6	-32.7	-179.8	-82.4	-177.8	175	-166.5	0	114.9	I888 T943 E947 T952 V953	I888-K956 WeakPolarHBondContact CG2-O 3.24Å; T943-K956 HydrophobicContact CG2-CD 4.36Å; E947-K956 IonicContact OE1-NZ 2.79Å; E947-K956 PolarHBondContact OE1-NZ 2.84Å; E947-K956 IonicContact OE2-NZ 3.66Å; T952-K956 HydrophobicContact CG2-CD 4.4Å; T952-K956 WeakPolarHBondContact O-CB 3.22Å; T952-K956 VanDerWaalsContact O-CG 3.28Å; T952-K956 WeakPolarHBondContact O-CG 3.4Å; T952-K956 PolarHBondContact O-N 3.42Å; V953-K956 PolarHBondContact O-N 2.99Å
957	F	92.4	Very high	90.4	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-107.9	1.7	-177.5	-71.3	-94.1	0	0	0	113.7	I888 Q892 Y936 F939 V940 T943 V953 E955 M959	I888-F957 HydrophobicContact CG2-CD1 4.15Å; Q892-F957 HydrophobicContact CB-CE1 4.49Å; Q892-F957 HydrophobicContact CB-CZ 4.48Å; Q892-F957 HydrophobicContact CG-CD1 4.49Å; Q892-F957 HydrophobicContact CG-CE1 3.79Å; Q892-F957 HydrophobicContact CG-CE2 4.5Å; Q892-F957 HydrophobicContact CG-CZ 3.8Å; Y936-F957 AromaticContact CE2-CD1 3.87Å; Y936-F957 HydrophobicContact CE2-CD1 3.87Å; Y936-F957 HydrophobicContact CE2-CE1 4.07Å; Y936-F957 AromaticContact CZ-CD1 3.89Å; F939-F957 HydrophobicContact CB-CE1 4.26Å; F939-F957 HydrophobicContact CB-CZ 4.28Å; V940-F957 HydrophobicContact CG2-CB 4.45Å; V940-F957 HydrophobicContact CG2-CD1 3.54Å; V940-F957 HydrophobicContact CG2-CD2 4.41Å; V940-F957 HydrophobicContact CG2-CE1 3.71Å; V940-F957 HydrophobicContact CG2-CG 3.9Å; V940-F957 HydrophobicContact CG2-CZ 4.23Å; T943-F957 HydrophobicContact CG2-CE2 4.16Å; V953-F957 HydrophobicContact CG1-CD2 3.65Å; V953-F957 HydrophobicContact CG1-CE2 4Å; V953-F957 WeakPolarHBondContact O-CD2 3.22Å; V953-F957 PolarHBondContact O-N 3.2Å; E955-F957 PolarHBondContact O-N 3.23Å; F957-M959 HydrophobicContact CB-CG 4.32Å; F957-M959 HydrophobicContact CB-SD 4.32Å; F957-M959 PolarHBondContact O-N 3.25Å
958	N	91.4	Very high	90.8	Very high	133 Å²	133	37.9 Å²	37.9	71%	0.711	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.4	-175.5	-166.4	31.8	0	0	0	113.2	I888 S954	I888-N958 HydrophobicContact CD1-CB 3.88Å; S954-N958 WeakPolarHBondContact O-CA 3.36Å; S954-N958 PolarHBondContact O-N 3.09Å; S954-N958 VanDerWaalsContact O-N 3.07Å
959	M	91.3	Very high	90.9	Very high	24 Å²	24	38.9 Å²	38.9	12%	0.118	20%	0.203	C	C	.	.			trans	-114.9	143.7	-175.1	-83.2	-178.4	164	0	0	111.4	Y936 V940 S954 F957 R961 Y963 I964	Y936-M959 HydrophobicContact CD1-CE 4.35Å; Y936-M959 HydrophobicContact CE1-CE 3.63Å; V940-M959 HydrophobicContact CG1-SD 4.47Å; V940-M959 HydrophobicContact CG2-SD 3.99Å; S954-M959 WeakPolarHBondContact CA-O 3.49Å; S954-M959 WeakPolarHBondContact CB-O 3.4Å; S954-M959 PolarHBondContact O-N 2.81Å; S954-M959 VanDerWaalsContact O-N 3.1Å; S954-M959 PolarHBondContact OG-O 3.18Å; F957-M959 HydrophobicContact CB-CG 4.32Å; F957-M959 HydrophobicContact CB-SD 4.32Å; F957-M959 PolarHBondContact O-N 3.25Å; M959-R961 PolarHBondContact O-N 3.03Å; M959-Y963 HydrophobicContact CE-CE1 4.06Å; M959-Y963 HydrophobicContact SD-CD1 4.17Å; M959-Y963 HydrophobicContact SD-CE1 4.15Å; M959-I964 HydrophobicContact CB-CD1 3.91Å; M959-I964 HydrophobicContact CB-CG1 4.05Å
960	P	90.4	Very high	91	Very high	72 Å²	72	38.7 Å²	38.7	47%	0.468	21%	0.207	S	C	.	.			trans	-58.2	128.2	173.8	-23.8	34.1	0	0	0	112.1	G962 Y963 I964	P960-G962 PolarHBondContact O-N 3.38Å; P960-G962 VanDerWaalsContact O-N 3.16Å; P960-Y963 WeakPolarHBondContact O-CA 3.26Å; P960-Y963 WeakPolarHBondContact O-CB 3.43Å; P960-Y963 PolarHBondContact O-N 2.96Å; P960-I964 PolarHBondContact O-N 3.18Å; P960-I964 VanDerWaalsContact O-N 3.16Å
961	R	91.4	Very high	91.1	Very high	25 Å²	25	37.4 Å²	37.4	9%	0.094	20%	0.2	C	C	.	.	H	α-helix	trans	-53.4	-35.1	179.8	58.2	-171.1	-176.4	-78.7	4.3	114.5	T648 E651 I950 W951 S954 M959 I964 Q965	T648-R961 HydrophobicContact CG2-CB 4.11Å; T648-R961 HydrophobicContact CG2-CG 4.01Å; E651-R961 VanDerWaalsContact CD-NE 3.29Å; E651-R961 IonicContact OE1-CZ 3.67Å; E651-R961 VanDerWaalsContact OE1-CZ 3.27Å; E651-R961 IonicContact OE1-NE 3.67Å; E651-R961 PolarHBondContact OE1-NE 2.84Å; E651-R961 IonicContact OE1-NH2 2.73Å; E651-R961 PolarHBondContact OE1-NH2 3.05Å; E651-R961 IonicContact OE2-CZ 2.65Å; E651-R961 IonicContact OE2-NE 3.49Å; E651-R961 PolarHBondContact OE2-NE 3.05Å; E651-R961 IonicContact OE2-NH2 3.18Å; I950-R961 HydrophobicContact CG2-CB 3.79Å; I950-R961 WeakPolarHBondContact CG2-O 3.42Å; W951-R961 VanDerWaalsContact CZ2-NE 3.32Å; S954-R961 PolarHBondContact OG-N 3.4Å; M959-R961 PolarHBondContact O-N 3.03Å; R961-I964 PolarHBondContact O-N 3.34Å; R961-Q965 PolarHBondContact O-N 2.85Å; R961-Q965 VanDerWaalsContact O-N 3.09Å
962	G	90.3	Very high	91.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.6	-36.1	172.2	0	0	0	0	0	114.1	S645 G646 P960 Q965 N966	S645-G962 WeakPolarHBondContact O-CA 3.5Å; G646-G962 PolarHBondContact O-N 3.27Å; P960-G962 PolarHBondContact O-N 3.38Å; P960-G962 VanDerWaalsContact O-N 3.16Å; G962-Q965 PolarHBondContact O-N 3.12Å; G962-N966 VanDerWaalsContact O-CG 3.25Å; G962-N966 PolarHBondContact O-N 2.88Å; G962-N966 PolarHBondContact O-OD1 3.42Å
963	Y	90.4	Very high	91	Very high	29 Å²	29	36.1 Å²	36.1	11%	0.114	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-40.8	174.4	179.7	-95.6	0	0	0	111.2	L937 M959 P960 Q965 N966 L967	L937-Y963 HydrophobicContact CD2-CE1 4.49Å; M959-Y963 HydrophobicContact CE-CE1 4.06Å; M959-Y963 HydrophobicContact SD-CD1 4.17Å; M959-Y963 HydrophobicContact SD-CE1 4.15Å; P960-Y963 WeakPolarHBondContact O-CA 3.26Å; P960-Y963 WeakPolarHBondContact O-CB 3.43Å; P960-Y963 PolarHBondContact O-N 2.96Å; Y963-Q965 VanDerWaalsContact C-N 3.34Å; Y963-Q965 PolarHBondContact O-N 3.41Å; Y963-N966 PolarHBondContact O-N 2.73Å; Y963-L967 WeakPolarHBondContact O-CB 3.23Å; Y963-L967 PolarHBondContact O-N 3.02Å
964	I	92.9	Very high	90.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-40.7	174.1	-67	166.6	0	0	0	111.3	V940 L944 I950 V953 S954 M959 P960 R961 L967 L968	V940-I964 HydrophobicContact CG1-CG1 4.14Å; V940-I964 HydrophobicContact CG1-CG2 4.43Å; L944-I964 HydrophobicContact CD1-CG2 4.37Å; L944-I964 HydrophobicContact CD2-CG2 3.7Å; I950-I964 HydrophobicContact CG2-CB 4.2Å; I950-I964 HydrophobicContact CG2-CG2 4.06Å; V953-I964 HydrophobicContact CB-CD1 4.32Å; V953-I964 HydrophobicContact CG1-CD1 3.99Å; V953-I964 HydrophobicContact CG1-CG2 4.46Å; S954-I964 VanDerWaalsContact CA-CD1 3.41Å; M959-I964 HydrophobicContact CB-CD1 3.91Å; M959-I964 HydrophobicContact CB-CG1 4.05Å; P960-I964 PolarHBondContact O-N 3.18Å; P960-I964 VanDerWaalsContact O-N 3.16Å; R961-I964 PolarHBondContact O-N 3.34Å; I964-L967 PolarHBondContact O-N 2.88Å; I964-L968 WeakPolarHBondContact O-CB 3.32Å; I964-L968 PolarHBondContact O-N 2.83Å
965	Q	90.4	Very high	90.9	Very high	27 Å²	27	36.4 Å²	36.4	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-37.3	175.5	-166.8	175.4	54	0	0	112.3	S649 I950 R961 G962 Y963 T969	S649-Q965 PolarHBondContact OG-OE1 2.8Å; I950-Q965 HydrophobicContact CD1-CB 4.29Å; I950-Q965 HydrophobicContact CD1-CG 4.34Å; R961-Q965 PolarHBondContact O-N 2.85Å; R961-Q965 VanDerWaalsContact O-N 3.09Å; G962-Q965 PolarHBondContact O-N 3.12Å; Y963-Q965 VanDerWaalsContact C-N 3.34Å; Y963-Q965 PolarHBondContact O-N 3.41Å; Q965-T969 WeakPolarHBondContact O-CB 3.42Å; Q965-T969 PolarHBondContact O-N 3.4Å; Q965-T969 PolarHBondContact O-OG1 2.92Å
966	N	89.4	Confident	90.7	Very high	66 Å²	66	31.9 Å²	31.9	35%	0.353	18%	0.178	S	C	.	.	H	α-helix	trans	-64.7	-45.9	173.9	-69.4	-6.6	0	0	0	111.2	G962 Y963 L968 T969 G970	G962-N966 VanDerWaalsContact O-CG 3.25Å; G962-N966 PolarHBondContact O-N 2.88Å; G962-N966 PolarHBondContact O-OD1 3.42Å; Y963-N966 PolarHBondContact O-N 2.73Å; N966-L968 PolarHBondContact O-N 3.12Å; N966-T969 PolarHBondContact O-N 3.33Å; N966-T969 VanDerWaalsContact O-N 3.14Å; N966-G970 PolarHBondContact O-N 2.93Å
967	L	92.1	Very high	90.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-57.8	-44.9	175.6	175.9	63.4	0	0	0	111.8	L878 L937 V940 L941 Y963 I964 G970 A971	L878-L967 HydrophobicContact CD1-CD1 3.68Å; L937-L967 HydrophobicContact CB-CD1 4.24Å; L937-L967 HydrophobicContact CB-CD2 4.34Å; L937-L967 HydrophobicContact CD1-CD1 4.31Å; L937-L967 HydrophobicContact CD2-CD1 4.26Å; L937-L967 HydrophobicContact CD2-CD2 3.9Å; V940-L967 HydrophobicContact CB-CD2 4.05Å; V940-L967 HydrophobicContact CG1-CD2 3.87Å; L941-L967 HydrophobicContact CD1-CD1 4.37Å; L941-L967 HydrophobicContact CD1-CG 4.36Å; L941-L967 HydrophobicContact CD2-CD2 4.5Å; L941-L967 HydrophobicContact CD2-CG 4.03Å; L941-L967 HydrophobicContact CG-CD2 4.18Å; L941-L967 HydrophobicContact CG-CG 4.07Å; Y963-L967 WeakPolarHBondContact O-CB 3.23Å; Y963-L967 PolarHBondContact O-N 3.02Å; I964-L967 PolarHBondContact O-N 2.88Å; L967-G970 PolarHBondContact O-N 2.87Å; L967-A971 VanDerWaalsContact O-CB 3.25Å; L967-A971 WeakPolarHBondContact O-CB 3.49Å; L967-A971 PolarHBondContact O-N 2.97Å
968	L	92.2	Very high	90.6	Very high	15 Å²	15	29.4 Å²	29.4	8%	0.079	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-44.4	174.1	178.5	67.1	0	0	0	112	L941 L944 I964 N966 A971 A972 L1002 C1005	L941-L968 HydrophobicContact CD2-CB 4.4Å; L941-L968 HydrophobicContact CD2-CD1 4.22Å; L944-L968 HydrophobicContact CD2-CB 4.08Å; L944-L968 HydrophobicContact CD2-CD1 4.18Å; L944-L968 HydrophobicContact CD2-CD2 3.97Å; L944-L968 HydrophobicContact CD2-CG 4.3Å; I964-L968 WeakPolarHBondContact O-CB 3.32Å; I964-L968 PolarHBondContact O-N 2.83Å; N966-L968 PolarHBondContact O-N 3.12Å; L968-A971 PolarHBondContact O-N 3.18Å; L968-A972 VanDerWaalsContact O-CB 3.31Å; L968-A972 WeakPolarHBondContact O-CB 3.22Å; L968-A972 PolarHBondContact O-N 3.16Å; L968-L1002 HydrophobicContact CD1-CB 4.48Å; L968-L1002 HydrophobicContact CD1-CD2 3.98Å; L968-L1002 VanDerWaalsContact CD1-O 3.27Å; L968-L1002 WeakPolarHBondContact CD1-O 3.32Å; L968-C1005 HydrophobicContact CD1-CB 4.12Å; L968-C1005 HydrophobicContact CD2-CB 3.51Å; L968-C1005 HydrophobicContact CG-CB 4.4Å
969	T	88.3	Confident	90.6	Very high	73 Å²	73	23.7 Å²	23.7	45%	0.448	14%	0.14	S	C	.	.	H	α-helix	trans	-67.8	-40.1	-179.3	-53.5	0	0	0	0	111.7	Q965 N966 S973	Q965-T969 WeakPolarHBondContact O-CB 3.42Å; Q965-T969 PolarHBondContact O-N 3.4Å; Q965-T969 PolarHBondContact O-OG1 2.92Å; N966-T969 PolarHBondContact O-N 3.33Å; N966-T969 VanDerWaalsContact O-N 3.14Å; T969-S973 WeakPolarHBondContact O-CB 3.46Å; T969-S973 PolarHBondContact O-N 2.95Å; T969-S973 PolarHBondContact O-OG 2.64Å
970	G	89.3	Confident	90.4	Very high	22 Å²	22	25.5 Å²	25.5	23%	0.227	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-48.2	173.2	0	0	0	0	0	111.7	N966 L967 A972 S973 F974	N966-G970 PolarHBondContact O-N 2.93Å; L967-G970 PolarHBondContact O-N 2.87Å; G970-A972 PolarHBondContact O-N 2.88Å; G970-S973 PolarHBondContact O-N 2.91Å; G970-F974 WeakPolarHBondContact O-CB 3.36Å; G970-F974 PolarHBondContact O-N 3.14Å
971	A	92.6	Very high	90.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.5	-40.2	176.3	0	0	0	0	0	112.7	P875 L941 L967 L968 S975 L1002	P875-A971 HydrophobicContact CG-CB 4.47Å; L941-A971 HydrophobicContact CD1-CB 3.63Å; L941-A971 HydrophobicContact CD2-CB 3.84Å; L941-A971 HydrophobicContact CG-CB 4.41Å; L967-A971 VanDerWaalsContact O-CB 3.25Å; L967-A971 WeakPolarHBondContact O-CB 3.49Å; L967-A971 PolarHBondContact O-N 2.97Å; L968-A971 PolarHBondContact O-N 3.18Å; A971-S975 WeakPolarHBondContact O-CB 3.36Å; A971-S975 PolarHBondContact O-N 3.33Å; A971-L1002 HydrophobicContact CB-CD2 4.48Å
972	A	90.6	Very high	90.5	Very high	4 Å²	4	21 Å²	21	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-42.5	173.5	0	0	0	0	0	112.1	L968 G970 S976 L1002	L968-A972 VanDerWaalsContact O-CB 3.31Å; L968-A972 WeakPolarHBondContact O-CB 3.22Å; L968-A972 PolarHBondContact O-N 3.16Å; G970-A972 PolarHBondContact O-N 2.88Å; A972-S976 PolarHBondContact O-N 2.9Å; A972-L1002 HydrophobicContact CB-CB 3.88Å
973	S	86.8	Confident	90.5	Very high	38 Å²	38	24.5 Å²	24.5	27%	0.266	14%	0.138	S	C	.	.	H	α-helix	trans	-66.9	-49.9	178.4	-55.7	0	0	0	0	111.1	T969 G970 S975 S976 C977	T969-S973 WeakPolarHBondContact O-CB 3.46Å; T969-S973 PolarHBondContact O-N 2.95Å; T969-S973 PolarHBondContact O-OG 2.64Å; G970-S973 PolarHBondContact O-N 2.91Å; S973-S975 VanDerWaalsContact C-N 3.34Å; S973-S975 PolarHBondContact O-N 2.76Å; S973-S976 WeakPolarHBondContact O-CA 3.48Å; S973-S976 VanDerWaalsContact O-CB 3.27Å; S973-S976 WeakPolarHBondContact O-CB 3.39Å; S973-S976 PolarHBondContact O-N 3.02Å; S973-C977 PolarHBondContact O-N 3.36Å; S973-C977 PolarHBondContact O-SG 3.45Å; S973-C977 VanDerWaalsContact O-SG 3.32Å
974	F	90.6	Very high	90.5	Very high	28 Å²	28	25.1 Å²	25.1	12%	0.123	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-35.3	177.7	-171.4	-107.3	0	0	0	112.5	I842 L850 P875 Y876 G970 S976 C977 V978	I842-F974 HydrophobicContact CD1-CE2 3.97Å; L850-F974 HydrophobicContact CD1-CZ 4.37Å; P875-F974 HydrophobicContact CB-CB 4.32Å; P875-F974 HydrophobicContact CB-CG 4.33Å; P875-F974 HydrophobicContact CG-CB 3.92Å; P875-F974 HydrophobicContact CG-CG 4.36Å; Y876-F974 HydrophobicContact CD2-CE1 4.38Å; Y876-F974 HydrophobicContact CD2-CE2 4.4Å; Y876-F974 AromaticContact CD2-CZ 3.78Å; Y876-F974 HydrophobicContact CD2-CZ 3.78Å; Y876-F974 HydrophobicContact CE2-CE1 4.24Å; Y876-F974 AromaticContact CE2-CZ 3.7Å; Y876-F974 HydrophobicContact CE2-CZ 3.7Å; G970-F974 WeakPolarHBondContact O-CB 3.36Å; G970-F974 PolarHBondContact O-N 3.14Å; F974-S976 VanDerWaalsContact C-N 3.25Å; F974-S976 PolarHBondContact O-N 3.23Å; F974-C977 HydrophobicContact CD2-CB 4.45Å; F974-C977 WeakPolarHBondContact O-CB 3.22Å; F974-C977 PolarHBondContact O-N 3.31Å; F974-C977 VanDerWaalsContact O-N 3.09Å; F974-V978 HydrophobicContact CD1-CG2 3.84Å; F974-V978 HydrophobicContact CE1-CG2 3.41Å; F974-V978 VanDerWaalsContact CE1-CG2 3.41Å; F974-V978 HydrophobicContact CE2-CG2 4.19Å; F974-V978 HydrophobicContact CG-CG2 4.38Å; F974-V978 HydrophobicContact CZ-CG2 3.6Å; F974-V978 WeakPolarHBondContact O-CG2 3.44Å; F974-V978 PolarHBondContact O-N 2.87Å
975	S	92.1	Very high	90.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-34.2	171.1	-171.9	0	0	0	0	112.3	A971 S973 L979 T999	A971-S975 WeakPolarHBondContact O-CB 3.36Å; A971-S975 PolarHBondContact O-N 3.33Å; S973-S975 VanDerWaalsContact C-N 3.34Å; S973-S975 PolarHBondContact O-N 2.76Å; S975-L979 VanDerWaalsContact O-CB 3.3Å; S975-L979 WeakPolarHBondContact O-CB 3.36Å; S975-L979 PolarHBondContact O-N 3.26Å; S975-T999 WeakPolarHBondContact CB-OG1 3.47Å; S975-T999 PolarHBondContact O-OG1 3.3Å; S975-T999 PolarHBondContact OG-OG1 3.49Å
976	S	88.8	Confident	90.3	Very high	32 Å²	32	31.1 Å²	31.1	22%	0.224	17%	0.17	C	C	.	.	H	α-helix	trans	-71	-39	171.5	-156.8	0	0	0	0	112.4	A972 S973 F974 L979 H980	A972-S976 PolarHBondContact O-N 2.9Å; S973-S976 WeakPolarHBondContact O-CA 3.48Å; S973-S976 VanDerWaalsContact O-CB 3.27Å; S973-S976 WeakPolarHBondContact O-CB 3.39Å; S973-S976 PolarHBondContact O-N 3.02Å; F974-S976 VanDerWaalsContact C-N 3.25Å; F974-S976 PolarHBondContact O-N 3.23Å; S976-L979 PolarHBondContact O-N 3.34Å; S976-H980 PolarHBondContact O-CD2 3.23Å; S976-H980 PolarHBondContact O-N 2.78Å; S976-H980 VanDerWaalsContact O-N 3.1Å
977	C	88.8	Confident	90.5	Very high	26 Å²	26	31.8 Å²	31.8	18%	0.176	17%	0.171	C	C	.	.	H	α-helix	trans	-62.2	-48.2	175.3	-63.3	0	0	0	0	111.9	G840 I842 S973 F974 L979 H980 F981	G840-C977 WeakPolarHBondContact CA-O 3.45Å; G840-C977 WeakPolarHBondContact O-CA 3.48Å; G840-C977 WeakPolarHBondContact O-CB 3.39Å; I842-C977 HydrophobicContact CD1-CB 3.71Å; S973-C977 PolarHBondContact O-N 3.36Å; S973-C977 PolarHBondContact O-SG 3.45Å; S973-C977 VanDerWaalsContact O-SG 3.32Å; F974-C977 HydrophobicContact CD2-CB 4.45Å; F974-C977 WeakPolarHBondContact O-CB 3.22Å; F974-C977 PolarHBondContact O-N 3.31Å; F974-C977 VanDerWaalsContact O-N 3.09Å; C977-L979 VanDerWaalsContact C-N 3.35Å; C977-L979 PolarHBondContact O-N 3.1Å; C977-H980 PolarHBondContact O-N 2.99Å; C977-F981 WeakPolarHBondContact O-CB 3.48Å; C977-F981 PolarHBondContact O-N 3.35Å
978	V	92	Very high	90.5	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-36.6	176.2	178	0	0	0	0	111.4	L850 L854 F974 F981 C982 L995	L850-V978 HydrophobicContact CD1-CG1 4.22Å; L850-V978 HydrophobicContact CD1-CG2 3.84Å; L850-V978 HydrophobicContact CD2-CG2 4.03Å; L854-V978 HydrophobicContact CD1-CG1 4.3Å; L854-V978 HydrophobicContact CD2-CG1 4.01Å; F974-V978 HydrophobicContact CD1-CG2 3.84Å; F974-V978 HydrophobicContact CE1-CG2 3.41Å; F974-V978 VanDerWaalsContact CE1-CG2 3.41Å; F974-V978 HydrophobicContact CE2-CG2 4.19Å; F974-V978 HydrophobicContact CG-CG2 4.38Å; F974-V978 HydrophobicContact CZ-CG2 3.6Å; F974-V978 WeakPolarHBondContact O-CG2 3.44Å; F974-V978 PolarHBondContact O-N 2.87Å; V978-F981 PolarHBondContact O-N 3.03Å; V978-C982 WeakPolarHBondContact O-CB 3.45Å; V978-C982 PolarHBondContact O-N 3.43Å; V978-C982 PolarHBondContact O-SG 3.4Å; V978-L995 HydrophobicContact CB-CD1 4.35Å; V978-L995 HydrophobicContact CG1-CD1 3.76Å
979	L	91.6	Very high	90.4	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-55.7	172.1	170.2	58.9	0	0	0	110.9	S975 S976 C977 F981 C982 E983 R992 L995 V996	S975-L979 VanDerWaalsContact O-CB 3.3Å; S975-L979 WeakPolarHBondContact O-CB 3.36Å; S975-L979 PolarHBondContact O-N 3.26Å; S976-L979 PolarHBondContact O-N 3.34Å; C977-L979 VanDerWaalsContact C-N 3.35Å; C977-L979 PolarHBondContact O-N 3.1Å; L979-F981 VanDerWaalsContact C-N 3.3Å; L979-F981 PolarHBondContact O-N 2.9Å; L979-C982 CarbonylContact O-C 3.31Å; L979-C982 WeakPolarHBondContact O-CA 3.36Å; L979-C982 WeakPolarHBondContact O-CB 3.48Å; L979-C982 PolarHBondContact O-N 2.87Å; L979-E983 HydrophobicContact CD1-CG 4.18Å; L979-E983 WeakPolarHBondContact O-CG 3.47Å; L979-E983 PolarHBondContact O-N 2.79Å; L979-R992 HydrophobicContact CD1-CG 4.25Å; L979-L995 HydrophobicContact CB-CB 4.19Å; L979-L995 HydrophobicContact CB-CD1 4.46Å; L979-L995 HydrophobicContact CD1-CB 4.2Å; L979-V996 HydrophobicContact CD1-CG2 3.88Å; L979-V996 HydrophobicContact CD2-CG2 3.77Å
980	H	88.3	Confident	90.5	Very high	62 Å²	62	38 Å²	38	29%	0.287	19%	0.19	S	C	.	.	H	α-helix	trans	-65.6	-31.1	-178.6	-63.2	-43.8	0	0	0	113.4	S976 C977 C982 E983	S976-H980 PolarHBondContact O-CD2 3.23Å; S976-H980 PolarHBondContact O-N 2.78Å; S976-H980 VanDerWaalsContact O-N 3.1Å; C977-H980 PolarHBondContact O-N 2.99Å; H980-C982 VanDerWaalsContact C-N 3.35Å; H980-E983 IonicContact CE1-OE2 2.7Å; H980-E983 IonicContact ND1-OE2 3.17Å; H980-E983 PolarHBondContact ND1-OE2 3.47Å; H980-E983 PolarHBondContact O-N 3.16Å
981	F	91.3	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-43.5	169.3	-176.9	-91.1	0	0	0	111.7	L833 A836 I842 L850 Y851 L854 C977 V978 L979 E983 L985 F988	L833-F981 HydrophobicContact CD1-CE2 4.11Å; L833-F981 HydrophobicContact CD1-CZ 3.74Å; A836-F981 VanDerWaalsContact C-CD2 3.48Å; A836-F981 HydrophobicContact CB-CD2 3.75Å; A836-F981 HydrophobicContact CB-CE2 3.89Å; A836-F981 HydrophobicContact CB-CG 4.21Å; A836-F981 HydrophobicContact CB-CZ 4.48Å; A836-F981 WeakPolarHBondContact O-CD2 3.47Å; I842-F981 HydrophobicContact CG1-CB 4.26Å; I842-F981 HydrophobicContact CG1-CD2 3.92Å; I842-F981 HydrophobicContact CG1-CG 4.35Å; L850-F981 HydrophobicContact CD2-CD1 4.17Å; L850-F981 HydrophobicContact CD2-CE1 4.4Å; L850-F981 HydrophobicContact CD2-CG 4.22Å; Y851-F981 HydrophobicContact CD2-CZ 4.45Å; L854-F981 HydrophobicContact CD1-CD1 3.88Å; L854-F981 HydrophobicContact CD1-CE1 3.93Å; C977-F981 WeakPolarHBondContact O-CB 3.48Å; C977-F981 PolarHBondContact O-N 3.35Å; V978-F981 PolarHBondContact O-N 3.03Å; L979-F981 VanDerWaalsContact C-N 3.3Å; L979-F981 PolarHBondContact O-N 2.9Å; F981-E983 VanDerWaalsContact C-N 3.32Å; F981-E983 PolarHBondContact O-N 3.29Å; F981-L985 HydrophobicContact CD1-CD1 4.14Å; F981-L985 HydrophobicContact CE1-CD1 3.62Å; F981-L985 HydrophobicContact CZ-CD1 3.86Å; F981-F988 HydrophobicContact CE1-CD2 4.48Å; F981-F988 HydrophobicContact CE1-CE2 4.13Å
982	C	92.4	Very high	90.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-72.9	-17.2	175.7	-67.8	0	0	0	0	114.2	V978 L979 H980 F988	V978-C982 WeakPolarHBondContact O-CB 3.45Å; V978-C982 PolarHBondContact O-N 3.43Å; V978-C982 PolarHBondContact O-SG 3.4Å; L979-C982 CarbonylContact O-C 3.31Å; L979-C982 WeakPolarHBondContact O-CA 3.36Å; L979-C982 WeakPolarHBondContact O-CB 3.48Å; L979-C982 PolarHBondContact O-N 2.87Å; H980-C982 VanDerWaalsContact C-N 3.35Å; C982-F988 HydrophobicContact CB-CB 3.84Å
983	E	90.2	Very high	90.2	Very high	73 Å²	73	46.2 Å²	46.2	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-76.4	-27.9	177.5	-69.9	-164.2	104.4	0	0	113.6	L979 H980 F981 R992	L979-E983 HydrophobicContact CD1-CG 4.18Å; L979-E983 WeakPolarHBondContact O-CG 3.47Å; L979-E983 PolarHBondContact O-N 2.79Å; H980-E983 IonicContact CE1-OE2 2.7Å; H980-E983 IonicContact ND1-OE2 3.17Å; H980-E983 PolarHBondContact ND1-OE2 3.47Å; H980-E983 PolarHBondContact O-N 3.16Å; F981-E983 VanDerWaalsContact C-N 3.32Å; F981-E983 PolarHBondContact O-N 3.29Å; E983-R992 HydrophobicContact CG-CG 3.93Å; E983-R992 IonicContact OE1-CZ 2.71Å; E983-R992 IonicContact OE1-NE 2.77Å; E983-R992 PolarHBondContact OE1-NE 3.16Å; E983-R992 IonicContact OE1-NH2 2.61Å; E983-R992 PolarHBondContact OE1-NH2 2.91Å
984	E	90.1	Very high	90.5	Very high	42 Å²	42	47 Å²	47	20%	0.196	23%	0.228	C	C	.	.	S	Bend	trans	-89.8	-6.3	177.4	-69.7	-77	160.2	0	0	113.1	R835 A836 K839	R835-E984 VanDerWaalsContact CD-OE2 3.22Å; R835-E984 WeakPolarHBondContact CD-OE2 3.35Å; R835-E984 HydrophobicContact CG-CG 4.46Å; R835-E984 IonicContact CZ-OE1 2.69Å; R835-E984 IonicContact CZ-OE2 2.76Å; R835-E984 IonicContact NE-OE1 3.82Å; R835-E984 IonicContact NE-OE2 3.63Å; R835-E984 PolarHBondContact NE-OE2 3.21Å; R835-E984 VanDerWaalsContact NH1-CD 3.33Å; R835-E984 IonicContact NH1-OE1 3.75Å; R835-E984 PolarHBondContact NH1-OE1 3.44Å; R835-E984 IonicContact NH1-OE2 2.79Å; R835-E984 PolarHBondContact NH1-OE2 3.5Å; R835-E984 IonicContact NH2-OE1 2.64Å; A836-E984 HydrophobicContact CB-CB 3.99Å; K839-E984 HydrophobicContact CB-CG 4.47Å; K839-E984 HydrophobicContact CD-CG 3.95Å; K839-E984 VanDerWaalsContact CD-OE1 3.28Å; K839-E984 WeakPolarHBondContact CD-OE1 3.16Å; K839-E984 VanDerWaalsContact CE-OE1 3.27Å; K839-E984 WeakPolarHBondContact CE-OE1 3.42Å; K839-E984 IonicContact NZ-OE1 2.68Å; K839-E984 PolarHBondContact NZ-OE1 3.06Å
985	L	91.1	Very high	90.5	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.058	22%	0.223	C	C	.	.			trans	-118.3	100.1	-178.8	-65	178.6	0	0	0	111.3	K832 L833 A836 Y851 F981 E987 F988	K832-L985 HydrophobicContact CB-CD2 4.04Å; L833-L985 HydrophobicContact CD1-CD1 4.39Å; A836-L985 HydrophobicContact CB-CD1 3.88Å; A836-L985 HydrophobicContact CB-CD2 4.21Å; A836-L985 HydrophobicContact CB-CG 3.74Å; Y851-L985 HydrophobicContact CD2-CD1 4.31Å; Y851-L985 HydrophobicContact CE2-CD1 4.4Å; F981-L985 HydrophobicContact CD1-CD1 4.14Å; F981-L985 HydrophobicContact CE1-CD1 3.62Å; F981-L985 HydrophobicContact CZ-CD1 3.86Å; L985-E987 PolarHBondContact O-N 3.04Å; L985-F988 HydrophobicContact CB-CD2 3.76Å; L985-F988 HydrophobicContact CB-CE2 4.44Å; L985-F988 HydrophobicContact CD1-CD2 3.74Å; L985-F988 HydrophobicContact CD1-CE2 3.71Å; L985-F988 HydrophobicContact CG-CD2 4.41Å; L985-F988 PolarHBondContact O-N 2.97Å
986	E	88.8	Confident	90.4	Very high	144 Å²	144	48.5 Å²	48.5	67%	0.673	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-51.7	-32.4	-177.3	-70	153.4	-119.4	0	0	114.5	K832 F988 W989	K832-E986 IonicContact NZ-OE1 2.96Å; K832-E986 PolarHBondContact NZ-OE1 3.06Å; K832-E986 IonicContact NZ-OE2 3.51Å; E986-F988 PolarHBondContact O-N 2.93Å; E986-W989 PolarHBondContact O-N 3.34Å
987	E	91.8	Very high	90.3	Very high	80 Å²	80	52.4 Å²	52.4	37%	0.374	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-65.8	-21.3	177.1	63.8	-178.5	154.5	0	0	113.3	Y851 K855 L858 L985	Y851-E987 VanDerWaalsContact CE2-OE1 3.24Å; Y851-E987 WeakPolarHBondContact CE2-OE1 3.34Å; Y851-E987 VanDerWaalsContact CZ-OE1 3.32Å; Y851-E987 PolarHBondContact OH-OE1 3.32Å; Y851-E987 PolarHBondContact OH-OE2 2.87Å; K855-E987 IonicContact NZ-OE1 2.72Å; K855-E987 IonicContact NZ-OE2 3.7Å; K855-E987 PolarHBondContact NZ-OE2 3.22Å; L858-E987 WeakPolarHBondContact CD1-O 3.49Å; L985-E987 PolarHBondContact O-N 3.04Å
988	F	92.9	Very high	90.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-98.6	17.9	-179.5	-65.1	-41.1	0	0	0	114.4	Y851 L854 K855 L858 F981 C982 L985 E986 V990 Y991 R992	Y851-F988 AromaticContact CD2-CE2 3.69Å; Y851-F988 HydrophobicContact CD2-CE2 3.69Å; Y851-F988 AromaticContact CD2-CZ 3.85Å; Y851-F988 HydrophobicContact CD2-CZ 3.85Å; Y851-F988 AromaticContact CE2-CE2 3.71Å; Y851-F988 HydrophobicContact CE2-CE2 3.71Å; Y851-F988 AromaticContact CE2-CZ 3.74Å; Y851-F988 HydrophobicContact CE2-CZ 3.74Å; L854-F988 HydrophobicContact CB-CD1 4.2Å; L854-F988 HydrophobicContact CB-CE1 3.68Å; L854-F988 HydrophobicContact CB-CE2 4.29Å; L854-F988 HydrophobicContact CB-CZ 3.74Å; L854-F988 HydrophobicContact CD1-CD2 4.34Å; L854-F988 HydrophobicContact CD1-CE2 4.18Å; L854-F988 HydrophobicContact CD1-CZ 4.46Å; K855-F988 HydrophobicContact CB-CE1 4.35Å; K855-F988 HydrophobicContact CB-CZ 4.4Å; L858-F988 HydrophobicContact CD1-CD1 3.79Å; L858-F988 HydrophobicContact CD1-CE1 3.97Å; L858-F988 HydrophobicContact CG-CD1 4.33Å; L858-F988 HydrophobicContact CG-CE1 4.5Å; F981-F988 HydrophobicContact CE1-CD2 4.48Å; F981-F988 HydrophobicContact CE1-CE2 4.13Å; C982-F988 HydrophobicContact CB-CB 3.84Å; L985-F988 HydrophobicContact CB-CD2 3.76Å; L985-F988 HydrophobicContact CB-CE2 4.44Å; L985-F988 HydrophobicContact CD1-CD2 3.74Å; L985-F988 HydrophobicContact CD1-CE2 3.71Å; L985-F988 HydrophobicContact CG-CD2 4.41Å; L985-F988 PolarHBondContact O-N 2.97Å; E986-F988 PolarHBondContact O-N 2.93Å; F988-V990 PolarHBondContact O-N 2.86Å; F988-Y991 HydrophobicContact CB-CD2 4.01Å; F988-Y991 AromaticContact CD1-CD2 3.86Å; F988-Y991 HydrophobicContact CD1-CD2 3.86Å; F988-Y991 AromaticContact CD1-CE2 3.84Å; F988-Y991 HydrophobicContact CD1-CE2 3.84Å; F988-Y991 HydrophobicContact CE1-CE2 4.39Å; F988-Y991 HydrophobicContact CG-CD2 4.18Å; F988-Y991 PolarHBondContact O-N 2.84Å; F988-R992 PolarHBondContact O-N 2.92Å
989	W	89.2	Confident	90.3	Very high	180 Å²	180	51.9 Å²	51.9	68%	0.682	25%	0.251	S	S	*	.	H	α-helix	trans	-51.7	-31.4	-179.8	73.7	-91.8	0	0	0	114.6	E986 R992 A993	E986-W989 PolarHBondContact O-N 3.34Å; W989-R992 WeakPolarHBondContact O-CB 3.48Å; W989-R992 PolarHBondContact O-N 3.17Å; W989-A993 PolarHBondContact O-N 3.17Å
990	V	90.9	Very high	90	Very high	38 Å²	38	57.3 Å²	57.3	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-44.8	177.4	-177.1	0	0	0	0	110.8	L858 L861 F988 R992 A993 L994	L858-V990 HydrophobicContact CD2-CB 4.28Å; L858-V990 HydrophobicContact CD2-CG2 4.41Å; L861-V990 HydrophobicContact CD2-CG1 4.21Å; F988-V990 PolarHBondContact O-N 2.86Å; V990-R992 VanDerWaalsContact C-N 3.32Å; V990-R992 PolarHBondContact O-N 2.84Å; V990-A993 PolarHBondContact O-N 2.67Å; V990-L994 HydrophobicContact CG1-CD1 3.84Å; V990-L994 WeakPolarHBondContact O-CG 3.26Å; V990-L994 PolarHBondContact O-N 2.75Å
991	Y	91.9	Very high	90.1	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-33.3	178.4	-63.6	-56.6	0	0	0	111.8	L854 G857 L858 L861 L869 L872 F988 A993 L994 L995	L854-Y991 HydrophobicContact CB-CE2 3.91Å; L854-Y991 HydrophobicContact CD2-CD2 3.87Å; L854-Y991 HydrophobicContact CD2-CE2 3.75Å; L854-Y991 HydrophobicContact CD2-CG 4.29Å; L854-Y991 HydrophobicContact CG-CE2 4.43Å; L854-Y991 WeakPolarHBondContact O-CE2 3.46Å; L854-Y991 PolarHBondContact O-OH 3.06Å; G857-Y991 VanDerWaalsContact CA-OH 3.25Å; G857-Y991 WeakPolarHBondContact CA-OH 3.41Å; L858-Y991 HydrophobicContact CD2-CD2 4.23Å; L858-Y991 HydrophobicContact CD2-CE2 3.6Å; L858-Y991 HydrophobicContact CG-CE2 3.82Å; L858-Y991 PolarHBondContact N-OH 3.44Å; L858-Y991 VanDerWaalsContact N-OH 3.13Å; L861-Y991 HydrophobicContact CD1-CE1 4.15Å; L861-Y991 HydrophobicContact CD2-CE1 4.01Å; L869-Y991 HydrophobicContact CD2-CD1 4.05Å; L869-Y991 HydrophobicContact CD2-CE1 4.11Å; L872-Y991 HydrophobicContact CD1-CE1 3.73Å; F988-Y991 HydrophobicContact CB-CD2 4.01Å; F988-Y991 AromaticContact CD1-CD2 3.86Å; F988-Y991 HydrophobicContact CD1-CD2 3.86Å; F988-Y991 AromaticContact CD1-CE2 3.84Å; F988-Y991 HydrophobicContact CD1-CE2 3.84Å; F988-Y991 HydrophobicContact CE1-CE2 4.39Å; F988-Y991 HydrophobicContact CG-CD2 4.18Å; F988-Y991 PolarHBondContact O-N 2.84Å; Y991-A993 VanDerWaalsContact C-N 3.26Å; Y991-A993 PolarHBondContact O-N 3Å; Y991-L994 PolarHBondContact O-N 3.06Å; Y991-L995 WeakPolarHBondContact O-CB 3.39Å; Y991-L995 VanDerWaalsContact O-CG 3.23Å; Y991-L995 WeakPolarHBondContact O-CG 3.08Å; Y991-L995 PolarHBondContact O-N 3.5Å
992	R	87.8	Confident	90	Very high	130 Å²	130	58.4 Å²	58.4	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-55.3	-42.4	174.6	-174.4	178.8	-168.9	-154.5	5	112.1	L979 E983 F988 W989 V990 V996	L979-R992 HydrophobicContact CD1-CG 4.25Å; E983-R992 HydrophobicContact CG-CG 3.93Å; E983-R992 IonicContact OE1-CZ 2.71Å; E983-R992 IonicContact OE1-NE 2.77Å; E983-R992 PolarHBondContact OE1-NE 3.16Å; E983-R992 IonicContact OE1-NH2 2.61Å; E983-R992 PolarHBondContact OE1-NH2 2.91Å; F988-R992 PolarHBondContact O-N 2.92Å; W989-R992 WeakPolarHBondContact O-CB 3.48Å; W989-R992 PolarHBondContact O-N 3.17Å; V990-R992 VanDerWaalsContact C-N 3.32Å; V990-R992 PolarHBondContact O-N 2.84Å; R992-V996 VanDerWaalsContact O-CG2 3.25Å; R992-V996 WeakPolarHBondContact O-CG2 3.01Å
993	A	88.1	Confident	89.7	Confident	69 Å²	69	60.1 Å²	60.1	57%	0.57	29%	0.288	S	S	*	.	H	α-helix	trans	-70.3	-46.3	177.3	0	0	0	0	0	112.4	W989 V990 Y991	W989-A993 PolarHBondContact O-N 3.17Å; V990-A993 PolarHBondContact O-N 2.67Å; Y991-A993 VanDerWaalsContact C-N 3.26Å; Y991-A993 PolarHBondContact O-N 3Å
994	L	91.6	Very high	89.3	Confident	53 Å²	53	59.1 Å²	59.1	28%	0.277	28%	0.282	S	S	.	.	H	α-helix	trans	-72.9	-39.6	-174.1	-63.5	171.2	0	0	0	113.2	L861 L863 L869 V990 Y991 E997 L998	L861-L994 HydrophobicContact CD2-CD1 3.84Å; L863-L994 HydrophobicContact CD2-CD1 3.69Å; L863-L994 HydrophobicContact CD2-CD2 4.33Å; L869-L994 HydrophobicContact CD1-CB 4.05Å; L869-L994 HydrophobicContact CD1-CD1 4.22Å; L869-L994 HydrophobicContact CD2-CB 4.33Å; L869-L994 HydrophobicContact CD2-CD1 4.04Å; V990-L994 HydrophobicContact CG1-CD1 3.84Å; V990-L994 WeakPolarHBondContact O-CG 3.26Å; V990-L994 PolarHBondContact O-N 2.75Å; Y991-L994 PolarHBondContact O-N 3.06Å; L994-E997 PolarHBondContact O-N 3.08Å; L994-L998 PolarHBondContact O-N 3.23Å
995	L	91.3	Very high	89.1	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-73.8	-27.9	-175.8	-64.3	-177.9	0	0	0	112.8	T873 V978 L979 Y991 E997 L998 T999	T873-L995 HydrophobicContact CG2-CD2 3.56Å; V978-L995 HydrophobicContact CB-CD1 4.35Å; V978-L995 HydrophobicContact CG1-CD1 3.76Å; L979-L995 HydrophobicContact CB-CB 4.19Å; L979-L995 HydrophobicContact CB-CD1 4.46Å; L979-L995 HydrophobicContact CD1-CB 4.2Å; Y991-L995 WeakPolarHBondContact O-CB 3.39Å; Y991-L995 VanDerWaalsContact O-CG 3.23Å; Y991-L995 WeakPolarHBondContact O-CG 3.08Å; Y991-L995 PolarHBondContact O-N 3.5Å; L995-E997 PolarHBondContact O-N 3.32Å; L995-L998 HydrophobicContact CD2-CD2 4.03Å; L995-L998 PolarHBondContact O-N 2.93Å; L995-T999 WeakPolarHBondContact O-CB 3.29Å; L995-T999 PolarHBondContact O-N 3.42Å; L995-T999 PolarHBondContact O-OG1 2.92Å
996	V	89.2	Confident	88.7	Confident	59 Å²	59	58.2 Å²	58.2	36%	0.358	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-33.2	175.2	166.1	0	0	0	0	112.3	L979 R992 K1000	L979-V996 HydrophobicContact CD1-CG2 3.88Å; L979-V996 HydrophobicContact CD2-CG2 3.77Å; R992-V996 VanDerWaalsContact O-CG2 3.25Å; R992-V996 WeakPolarHBondContact O-CG2 3.01Å; V996-K1000 WeakPolarHBondContact O-CD 3.47Å; V996-K1000 WeakPolarHBondContact O-CG 3.21Å
997	E	87.5	Confident	88.4	Confident	113 Å²	113	57.5 Å²	57.5	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-83.7	-40	174	-157.8	-171.4	151.1	0	0	112	L994 L995 K1000 K1001	L994-E997 PolarHBondContact O-N 3.08Å; L995-E997 PolarHBondContact O-N 3.32Å; E997-K1000 PolarHBondContact O-N 2.93Å; E997-K1001 HydrophobicContact CG-CD 4.37Å; E997-K1001 WeakPolarHBondContact O-CG 3.48Å; E997-K1001 PolarHBondContact O-N 3.35Å; E997-K1001 WeakPolarHBondContact OE1-CE 3.47Å; E997-K1001 IonicContact OE1-NZ 3.01Å; E997-K1001 PolarHBondContact OE1-NZ 3.26Å
998	L	90.3	Very high	88	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-44.8	179.5	-176.8	59	0	0	0	112.6	L869 I870 T873 L945 L994 L995 K1000 K1001 L1002	L869-L998 HydrophobicContact CB-CD2 3.7Å; I870-L998 HydrophobicContact CG1-CD1 3.99Å; I870-L998 HydrophobicContact CG1-CD2 4.32Å; T873-L998 HydrophobicContact CG2-CD2 4.29Å; L945-L998 HydrophobicContact CD1-CD1 4.24Å; L994-L998 PolarHBondContact O-N 3.23Å; L995-L998 HydrophobicContact CD2-CD2 4.03Å; L995-L998 PolarHBondContact O-N 2.93Å; L998-K1000 PolarHBondContact O-N 3.27Å; L998-K1001 PolarHBondContact O-N 3.4Å; L998-K1001 VanDerWaalsContact O-N 3.11Å; L998-L1002 HydrophobicContact CD1-CD1 4.15Å; L998-L1002 HydrophobicContact CD1-CG 4.1Å; L998-L1002 HydrophobicContact CD2-CD1 4.49Å; L998-L1002 HydrophobicContact CG-CD1 3.87Å; L998-L1002 HydrophobicContact CG-CG 4.31Å; L998-L1002 WeakPolarHBondContact O-CB 3.45Å; L998-L1002 WeakPolarHBondContact O-CG 3.37Å; L998-L1002 PolarHBondContact O-N 2.62Å
999	T	89.8	Confident	87.7	Confident	15 Å²	15	61.2 Å²	61.2	9%	0.092	31%	0.305	C	S	.	.	H	α-helix	trans	-59	-36.6	176.7	-59.4	0	0	0	0	111.3	S975 L995 T1003	S975-T999 WeakPolarHBondContact CB-OG1 3.47Å; S975-T999 PolarHBondContact O-OG1 3.3Å; S975-T999 PolarHBondContact OG-OG1 3.49Å; L995-T999 WeakPolarHBondContact O-CB 3.29Å; L995-T999 PolarHBondContact O-N 3.42Å; L995-T999 PolarHBondContact O-OG1 2.92Å; T999-T1003 WeakPolarHBondContact O-CB 3.39Å; T999-T1003 PolarHBondContact O-N 3.14Å; T999-T1003 PolarHBondContact O-OG1 2.98Å
1000	K	86.1	Confident	87.7	Confident	127 Å²	127	53 Å²	53	55%	0.552	27%	0.274	S	S	*	.	H	α-helix	trans	-69.6	-43.6	174.5	-69	173.6	-173.1	176.4	0	111.8	V996 E997 L998 T1003 Y1004	V996-K1000 WeakPolarHBondContact O-CD 3.47Å; V996-K1000 WeakPolarHBondContact O-CG 3.21Å; E997-K1000 PolarHBondContact O-N 2.93Å; L998-K1000 PolarHBondContact O-N 3.27Å; K1000-T1003 PolarHBondContact O-N 2.94Å; K1000-Y1004 WeakPolarHBondContact O-CD2 3.4Å; K1000-Y1004 PolarHBondContact O-N 3.22Å; K1000-Y1004 VanDerWaalsContact O-N 3.12Å
1001	K	88.8	Confident	87.5	Confident	84 Å²	84	53.3 Å²	53.3	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-44.2	176	-77.8	170.6	167.8	167.6	0	112.2	L866 L945 E997 L998 C1005	L866-K1001 HydrophobicContact CD1-CD 4.44Å; L945-K1001 HydrophobicContact CD2-CB 4.12Å; L945-K1001 WeakPolarHBondContact CD2-O 3.28Å; E997-K1001 HydrophobicContact CG-CD 4.37Å; E997-K1001 WeakPolarHBondContact O-CG 3.48Å; E997-K1001 PolarHBondContact O-N 3.35Å; E997-K1001 WeakPolarHBondContact OE1-CE 3.47Å; E997-K1001 IonicContact OE1-NZ 3.01Å; E997-K1001 PolarHBondContact OE1-NZ 3.26Å; L998-K1001 PolarHBondContact O-N 3.4Å; L998-K1001 VanDerWaalsContact O-N 3.11Å; K1001-C1005 VanDerWaalsContact O-CA 3.25Å; K1001-C1005 WeakPolarHBondContact O-CA 3.26Å; K1001-C1005 PolarHBondContact O-N 3.36Å
1002	L	89.8	Confident	87.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-43.4	174.4	-71.9	168.5	0	0	0	112.1	L941 L945 L968 A971 A972 L998 Y1004	L941-L1002 HydrophobicContact CD2-CD2 4.36Å; L945-L1002 HydrophobicContact CD1-CD2 3.79Å; L945-L1002 HydrophobicContact CD1-CG 4.38Å; L945-L1002 HydrophobicContact CG-CD2 4.36Å; L968-L1002 HydrophobicContact CD1-CB 4.48Å; L968-L1002 HydrophobicContact CD1-CD2 3.98Å; L968-L1002 VanDerWaalsContact CD1-O 3.27Å; L968-L1002 WeakPolarHBondContact CD1-O 3.32Å; A971-L1002 HydrophobicContact CB-CD2 4.48Å; A972-L1002 HydrophobicContact CB-CB 3.88Å; L998-L1002 HydrophobicContact CD1-CD1 4.15Å; L998-L1002 HydrophobicContact CD1-CG 4.1Å; L998-L1002 HydrophobicContact CD2-CD1 4.49Å; L998-L1002 HydrophobicContact CG-CD1 3.87Å; L998-L1002 HydrophobicContact CG-CG 4.31Å; L998-L1002 WeakPolarHBondContact O-CB 3.45Å; L998-L1002 WeakPolarHBondContact O-CG 3.37Å; L998-L1002 PolarHBondContact O-N 2.62Å; L1002-Y1004 PolarHBondContact O-N 3.02Å
1003	T	86.4	Confident	87.4	Confident	39 Å²	39	49.3 Å²	49.3	24%	0.239	27%	0.266	C	S	.	.	H	α-helix	trans	-58.6	-44.8	-179.6	-71.7	0	0	0	0	112.9	S418 T999 K1000	S418-T1003 VanDerWaalsContact OG-CG2 3.27Å; S418-T1003 WeakPolarHBondContact OG-CG2 3.37Å; T999-T1003 WeakPolarHBondContact O-CB 3.39Å; T999-T1003 PolarHBondContact O-N 3.14Å; T999-T1003 PolarHBondContact O-OG1 2.98Å; K1000-T1003 PolarHBondContact O-N 2.94Å
1004	Y	82.2	Confident	87.3	Confident	52 Å²	52	47.6 Å²	47.6	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-98.2	-40	-174.2	-70.6	-68.4	0	0	0	113.2	K1000 L1002 V1006 I1011 M1014	K1000-Y1004 WeakPolarHBondContact O-CD2 3.4Å; K1000-Y1004 PolarHBondContact O-N 3.22Å; K1000-Y1004 VanDerWaalsContact O-N 3.12Å; L1002-Y1004 PolarHBondContact O-N 3.02Å; Y1004-V1006 WeakPolarHBondContact O-CG1 3.46Å; Y1004-V1006 PolarHBondContact O-N 2.94Å; Y1004-I1011 HydrophobicContact CD1-CG1 4.34Å; Y1004-I1011 HydrophobicContact CD1-CG2 4.1Å; Y1004-I1011 HydrophobicContact CD2-CD1 4.05Å; Y1004-I1011 HydrophobicContact CD2-CG1 4.21Å; Y1004-I1011 HydrophobicContact CD2-CG2 3.77Å; Y1004-I1011 HydrophobicContact CE1-CG2 3.97Å; Y1004-I1011 HydrophobicContact CE2-CG2 3.62Å; Y1004-I1011 HydrophobicContact CG-CB 4.5Å; Y1004-I1011 HydrophobicContact CG-CD1 4.14Å; Y1004-I1011 HydrophobicContact CG-CG1 3.91Å; Y1004-I1011 HydrophobicContact CG-CG2 4.01Å; Y1004-M1014 HydrophobicContact CD1-CB 4.42Å; Y1004-M1014 HydrophobicContact CE1-CB 4.41Å
1005	C	85.2	Confident	87	Confident	13 Å²	13	47.5 Å²	47.5	9%	0.088	24%	0.244	C	C	.	.			trans	50.3	25.6	178.8	-148.5	0	0	0	0	116.1	L968 K1001	L968-C1005 HydrophobicContact CD1-CB 4.12Å; L968-C1005 HydrophobicContact CD2-CB 3.51Å; L968-C1005 HydrophobicContact CG-CB 4.4Å; K1001-C1005 VanDerWaalsContact O-CA 3.25Å; K1001-C1005 WeakPolarHBondContact O-CA 3.26Å; K1001-C1005 PolarHBondContact O-N 3.36Å
1006	V	83.1	Confident	86.8	Confident	21 Å²	21	47.5 Å²	47.5	13%	0.127	24%	0.244	C	C	.	.	S	Bend	trans	-128.4	171.7	-176.7	-66.9	0	0	0	0	111.4	Y1004 A1008 L1010 I1011 M1014 E1021	Y1004-V1006 WeakPolarHBondContact O-CG1 3.46Å; Y1004-V1006 PolarHBondContact O-N 2.94Å; V1006-A1008 PolarHBondContact O-N 2.65Å; V1006-L1010 HydrophobicContact CB-CD1 4.47Å; V1006-L1010 HydrophobicContact CG2-CB 4.29Å; V1006-I1011 HydrophobicContact CG2-CG1 4.18Å; V1006-M1014 HydrophobicContact CB-SD 4.41Å; V1006-M1014 HydrophobicContact CG1-CE 4.22Å; V1006-M1014 HydrophobicContact CG1-SD 4.11Å; V1006-M1014 HydrophobicContact CG2-CE 4.31Å; V1006-M1014 HydrophobicContact CG2-SD 3.66Å; V1006-E1021 HydrophobicContact CG1-CB 4.25Å; V1006-E1021 HydrophobicContact CG1-CG 3.61Å
1007	K	82.6	Confident	86.3	Confident	129 Å²	129	45.2 Å²	45.2	56%	0.561	23%	0.231	S	C	*	.			trans	-54.5	133.1	168.5	-62	-175.4	179.6	-176.7	0	110.9	E1009 L1010	K1007-E1009 HydrophobicContact CB-CG 4.1Å; K1007-E1009 WeakPolarHBondContact CD-OE1 3.29Å; K1007-E1009 PolarHBondContact O-N 2.88Å; K1007-L1010 PolarHBondContact O-N 3.48Å
1008	A	83.6	Confident	85.8	Confident	77 Å²	77	41.7 Å²	41.7	64%	0.636	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-56.4	-28.2	-174.8	0	0	0	0	0	114.2	V1006 L1010 I1011	V1006-A1008 PolarHBondContact O-N 2.65Å; A1008-L1010 PolarHBondContact O-N 3.34Å; A1008-I1011 HydrophobicContact CB-CD1 4.46Å; A1008-I1011 PolarHBondContact O-N 3.4Å
1009	E	87.3	Confident	85.5	Confident	81 Å²	81	41.8 Å²	41.8	38%	0.379	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-63.4	-20.4	177	69.3	-168.1	152.8	0	0	114.5	K1007 Y1028	K1007-E1009 HydrophobicContact CB-CG 4.1Å; K1007-E1009 WeakPolarHBondContact CD-OE1 3.29Å; K1007-E1009 PolarHBondContact O-N 2.88Å; E1009-Y1028 HydrophobicContact CB-CE2 3.93Å; E1009-Y1028 HydrophobicContact CG-CE1 4.15Å; E1009-Y1028 HydrophobicContact CG-CE2 4.27Å; E1009-Y1028 WeakPolarHBondContact OE2-CE1 3.23Å; E1009-Y1028 PolarHBondContact OE2-OH 3.07Å
1010	L	87.8	Confident	85.1	Confident	7 Å²	7	43.3 Å²	43.3	4%	0.037	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-92.5	-19.6	-179.5	-57.4	178.9	0	0	0	113.3	V1006 K1007 A1008 L1013 M1014 E1021 A1024 R1025 Y1028	V1006-L1010 HydrophobicContact CB-CD1 4.47Å; V1006-L1010 HydrophobicContact CG2-CB 4.29Å; K1007-L1010 PolarHBondContact O-N 3.48Å; A1008-L1010 PolarHBondContact O-N 3.34Å; L1010-L1013 WeakPolarHBondContact O-CB 3.33Å; L1010-L1013 PolarHBondContact O-N 3.4Å; L1010-M1014 HydrophobicContact CB-SD 4.32Å; L1010-M1014 PolarHBondContact O-N 3.41Å; L1010-M1014 VanDerWaalsContact O-N 3.15Å; L1010-E1021 HydrophobicContact CD1-CG 4.42Å; L1010-A1024 HydrophobicContact CB-CB 4.28Å; L1010-A1024 HydrophobicContact CD2-CB 4.4Å; L1010-R1025 HydrophobicContact CD1-CG 3.59Å; L1010-R1025 HydrophobicContact CD2-CG 4.2Å; L1010-Y1028 HydrophobicContact CD2-CG 4.15Å
1011	I	87.5	Confident	85	Confident	44 Å²	44	39.2 Å²	39.2	23%	0.226	22%	0.215	C	C	.	.	H	α-helix	trans	-54.7	-47.2	-174.4	-63.1	178.1	0	0	0	112.3	Y1004 V1006 A1008 L1013 M1014 E1015	Y1004-I1011 HydrophobicContact CD1-CG1 4.34Å; Y1004-I1011 HydrophobicContact CD1-CG2 4.1Å; Y1004-I1011 HydrophobicContact CD2-CD1 4.05Å; Y1004-I1011 HydrophobicContact CD2-CG1 4.21Å; Y1004-I1011 HydrophobicContact CD2-CG2 3.77Å; Y1004-I1011 HydrophobicContact CE1-CG2 3.97Å; Y1004-I1011 HydrophobicContact CE2-CG2 3.62Å; Y1004-I1011 HydrophobicContact CG-CB 4.5Å; Y1004-I1011 HydrophobicContact CG-CD1 4.14Å; Y1004-I1011 HydrophobicContact CG-CG1 3.91Å; Y1004-I1011 HydrophobicContact CG-CG2 4.01Å; V1006-I1011 HydrophobicContact CG2-CG1 4.18Å; A1008-I1011 HydrophobicContact CB-CD1 4.46Å; A1008-I1011 PolarHBondContact O-N 3.4Å; I1011-L1013 PolarHBondContact O-N 2.98Å; I1011-M1014 PolarHBondContact O-N 2.83Å; I1011-M1014 VanDerWaalsContact O-N 3.11Å; I1011-E1015 PolarHBondContact O-N 2.91Å; I1011-E1015 VanDerWaalsContact O-N 3.16Å
1012	P	87.9	Confident	84.5	Confident	48 Å²	48	35.6 Å²	35.6	31%	0.312	20%	0.201	S	C	.	.	H	α-helix	trans	-64.2	-14.6	-179.6	-21.7	34.5	0	0	0	114.6	L1035	P1012-L1035 WeakPolarHBondContact O-CD2 3.39Å; P1012-L1035 WeakPolarHBondContact O-CG 3.38Å
1013	L	89.3	Confident	84.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-92.6	-36.4	176.1	-53.3	177.8	0	0	0	111	L1010 I1011 E1015 V1016 V1019 A1024 L1027 Y1028 Y1032 L1038	L1010-L1013 WeakPolarHBondContact O-CB 3.33Å; L1010-L1013 PolarHBondContact O-N 3.4Å; I1011-L1013 PolarHBondContact O-N 2.98Å; L1013-E1015 VanDerWaalsContact C-N 3.27Å; L1013-E1015 PolarHBondContact O-N 3.01Å; L1013-V1016 WeakPolarHBondContact O-CB 3.27Å; L1013-V1016 WeakPolarHBondContact O-CG2 3.48Å; L1013-V1016 PolarHBondContact O-N 2.98Å; L1013-V1016 VanDerWaalsContact O-N 3.16Å; L1013-V1019 HydrophobicContact CB-CG1 4.36Å; L1013-V1019 WeakPolarHBondContact O-CB 3.34Å; L1013-V1019 WeakPolarHBondContact O-CG1 3.47Å; L1013-A1024 HydrophobicContact CB-CB 3.98Å; L1013-A1024 HydrophobicContact CD1-CB 4.48Å; L1013-A1024 WeakPolarHBondContact CD1-O 3.48Å; L1013-L1027 HydrophobicContact CD1-CB 4.04Å; L1013-Y1028 HydrophobicContact CD1-CD2 4.3Å; L1013-Y1032 WeakPolarHBondContact CD1-O 3.17Å; L1013-Y1032 VanDerWaalsContact CD2-O 3.23Å; L1013-Y1032 WeakPolarHBondContact CD2-O 3.48Å; L1013-L1038 HydrophobicContact CD2-CD1 3.91Å
1014	M	87.1	Confident	84.3	Confident	32 Å²	32	35.6 Å²	35.6	16%	0.158	20%	0.197	C	C	.	.	H	α-helix	trans	-74.4	-12.5	177.4	-67.6	174.9	62.6	0	0	114	Y1004 V1006 L1010 I1011 V1016 E1021 A1024	Y1004-M1014 HydrophobicContact CD1-CB 4.42Å; Y1004-M1014 HydrophobicContact CE1-CB 4.41Å; V1006-M1014 HydrophobicContact CB-SD 4.41Å; V1006-M1014 HydrophobicContact CG1-CE 4.22Å; V1006-M1014 HydrophobicContact CG1-SD 4.11Å; V1006-M1014 HydrophobicContact CG2-CE 4.31Å; V1006-M1014 HydrophobicContact CG2-SD 3.66Å; L1010-M1014 HydrophobicContact CB-SD 4.32Å; L1010-M1014 PolarHBondContact O-N 3.41Å; L1010-M1014 VanDerWaalsContact O-N 3.15Å; I1011-M1014 PolarHBondContact O-N 2.83Å; I1011-M1014 VanDerWaalsContact O-N 3.11Å; M1014-V1016 PolarHBondContact O-N 2.89Å; M1014-E1021 HydrophobicContact CE-CB 4.15Å; M1014-E1021 HydrophobicContact SD-CB 4.18Å; M1014-A1024 HydrophobicContact CG-CB 3.67Å; M1014-A1024 HydrophobicContact SD-CB 4.33Å
1015	E	84.4	Confident	84.5	Confident	52 Å²	52	36.2 Å²	36.2	24%	0.243	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.3	164.5	-72.8	-177.8	-176.7	0	0	111.7	K419 I1011 L1013 L1068 K1072	K419-E1015 PolarHBondContact NZ-O 2.9Å; I1011-E1015 PolarHBondContact O-N 2.91Å; I1011-E1015 VanDerWaalsContact O-N 3.16Å; L1013-E1015 VanDerWaalsContact C-N 3.27Å; L1013-E1015 PolarHBondContact O-N 3.01Å; E1015-L1068 HydrophobicContact CB-CD1 4.46Å; E1015-K1072 IonicContact OE1-NZ 3.87Å; E1015-K1072 IonicContact OE2-NZ 2.61Å; E1015-K1072 PolarHBondContact OE2-NZ 3.13Å
1016	V	86.1	Confident	84.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.203	C	C	.	.	S	Bend	trans	-71.9	128.2	-176.2	-170.9	0	0	0	0	111.3	L1013 M1014 G1018 V1019 L1035 L1038 I1061 A1065 L1068	L1013-V1016 WeakPolarHBondContact O-CB 3.27Å; L1013-V1016 WeakPolarHBondContact O-CG2 3.48Å; L1013-V1016 PolarHBondContact O-N 2.98Å; L1013-V1016 VanDerWaalsContact O-N 3.16Å; M1014-V1016 PolarHBondContact O-N 2.89Å; V1016-G1018 PolarHBondContact O-N 2.74Å; V1016-V1019 HydrophobicContact CB-CB 4.3Å; V1016-V1019 HydrophobicContact CB-CG2 3.93Å; V1016-V1019 HydrophobicContact CG1-CG2 4.12Å; V1016-V1019 WeakPolarHBondContact O-CB 3.19Å; V1016-V1019 PolarHBondContact O-N 2.74Å; V1016-L1035 HydrophobicContact CG2-CD2 3.34Å; V1016-L1038 HydrophobicContact CG2-CD1 4Å; V1016-I1061 HydrophobicContact CG1-CG2 4.18Å; V1016-A1065 HydrophobicContact CG1-CB 4.43Å; V1016-A1065 HydrophobicContact CG2-CB 4.33Å; V1016-L1068 HydrophobicContact CB-CD1 4.48Å; V1016-L1068 HydrophobicContact CG2-CD1 4.18Å
1017	T	80.4	Confident	84.8	Confident	12 Å²	12	36.3 Å²	36.3	7%	0.074	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	133.1	176.1	37.2	0	0	0	0	111.8	I398 E414 V1019 S1064	I398-T1017 HydrophobicContact CG2-CG2 3.94Å; E414-T1017 WeakPolarHBondContact OE2-CG2 3.31Å; T1017-V1019 VanDerWaalsContact C-N 3.32Å; T1017-S1064 WeakPolarHBondContact OG1-CB 3.34Å; T1017-S1064 PolarHBondContact OG1-OG 2.76Å
1018	G	76.3	Confident	85.2	Confident	39 Å²	39	32.7 Å²	32.7	40%	0.402	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-5.9	-174.8	0	0	0	0	0	115.4	V1016	V1016-G1018 PolarHBondContact O-N 2.74Å
1019	V	83.7	Confident	85.5	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.018	18%	0.184	C	C	.	.			trans	-100.6	102.5	174.9	-176.1	0	0	0	0	110	L1013 V1016 T1017 A1024 L1027 I1061	L1013-V1019 HydrophobicContact CB-CG1 4.36Å; L1013-V1019 WeakPolarHBondContact O-CB 3.34Å; L1013-V1019 WeakPolarHBondContact O-CG1 3.47Å; V1016-V1019 HydrophobicContact CB-CB 4.3Å; V1016-V1019 HydrophobicContact CB-CG2 3.93Å; V1016-V1019 HydrophobicContact CG1-CG2 4.12Å; V1016-V1019 WeakPolarHBondContact O-CB 3.19Å; V1016-V1019 PolarHBondContact O-N 2.74Å; T1017-V1019 VanDerWaalsContact C-N 3.32Å; V1019-A1024 HydrophobicContact CG1-CB 3.92Å; V1019-L1027 HydrophobicContact CG1-CD1 3.79Å; V1019-L1027 HydrophobicContact CG2-CD1 4.01Å; V1019-I1061 HydrophobicContact CG2-CD1 4.01Å; V1019-I1061 HydrophobicContact CG2-CG1 3.96Å; V1019-I1061 HydrophobicContact CG2-CG2 3.98Å
1020	L	82.1	Confident	85.5	Confident	48 Å²	48	31.9 Å²	31.9	25%	0.251	18%	0.181	S	C	.	.			trans	-96.7	174.4	169.9	-58.2	177.7	0	0	0	110.7	D650 K653 G1022 R1023 A1024	D650-L1020 HydrophobicContact CB-CD1 4.36Å; D650-L1020 WeakPolarHBondContact OD2-CB 3.3Å; K653-L1020 HydrophobicContact CD-CD1 3.9Å; L1020-G1022 PolarHBondContact O-N 3.43Å; L1020-R1023 PolarHBondContact O-N 3.49Å; L1020-A1024 PolarHBondContact O-N 3.09Å
1021	E	82.8	Confident	85.7	Confident	41 Å²	41	33.3 Å²	33.3	19%	0.192	20%	0.197	C	C	.	.	H	α-helix	trans	-51.6	-50	-168.7	-174.7	-156.1	139.2	0	0	112.9	V1006 L1010 M1014 R1023 A1024 R1025	V1006-E1021 HydrophobicContact CG1-CB 4.25Å; V1006-E1021 HydrophobicContact CG1-CG 3.61Å; L1010-E1021 HydrophobicContact CD1-CG 4.42Å; M1014-E1021 HydrophobicContact CE-CB 4.15Å; M1014-E1021 HydrophobicContact SD-CB 4.18Å; E1021-R1023 PolarHBondContact O-N 3.41Å; E1021-A1024 WeakPolarHBondContact O-CB 3.37Å; E1021-A1024 PolarHBondContact O-N 3.41Å; E1021-A1024 VanDerWaalsContact O-N 3.17Å; E1021-R1025 PolarHBondContact O-N 3.12Å; E1021-R1025 IonicContact OE1-CZ 2.98Å; E1021-R1025 IonicContact OE1-NE 2.88Å; E1021-R1025 PolarHBondContact OE1-NE 2.99Å; E1021-R1025 IonicContact OE1-NH2 3.7Å; E1021-R1025 PolarHBondContact OE1-NH2 2.98Å
1022	G	79.3	Confident	85.8	Confident	7 Å²	7	32.6 Å²	32.6	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-36	-178.6	0	0	0	0	0	112.9	L1020 Q1026	L1020-G1022 PolarHBondContact O-N 3.43Å; G1022-Q1026 WeakPolarHBondContact O-CG 3.3Å; G1022-Q1026 PolarHBondContact O-N 3.5Å
1023	R	83.6	Confident	86	Confident	41 Å²	41	35.4 Å²	35.4	16%	0.155	20%	0.199	C	C	.	.	H	α-helix	trans	-83.3	-30.5	178.5	-173.5	156.5	-79.8	175.9	-11.7	112.6	L1020 E1021 R1025 Q1026 L1027	L1020-R1023 PolarHBondContact O-N 3.49Å; E1021-R1023 PolarHBondContact O-N 3.41Å; R1023-R1025 VanDerWaalsContact C-N 3.33Å; R1023-Q1026 PolarHBondContact O-N 3.27Å; R1023-L1027 HydrophobicContact CG-CD1 4.38Å; R1023-L1027 WeakPolarHBondContact O-CB 3.43Å; R1023-L1027 WeakPolarHBondContact O-CG 3.5Å; R1023-L1027 PolarHBondContact O-N 3.33Å
1024	A	87.8	Confident	86	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-42.2	168	0	0	0	0	0	111.1	L1010 L1013 M1014 V1019 L1020 E1021 L1027 Y1028	L1010-A1024 HydrophobicContact CB-CB 4.28Å; L1010-A1024 HydrophobicContact CD2-CB 4.4Å; L1013-A1024 HydrophobicContact CB-CB 3.98Å; L1013-A1024 HydrophobicContact CD1-CB 4.48Å; L1013-A1024 WeakPolarHBondContact CD1-O 3.48Å; M1014-A1024 HydrophobicContact CG-CB 3.67Å; M1014-A1024 HydrophobicContact SD-CB 4.33Å; V1019-A1024 HydrophobicContact CG1-CB 3.92Å; L1020-A1024 PolarHBondContact O-N 3.09Å; E1021-A1024 WeakPolarHBondContact O-CB 3.37Å; E1021-A1024 PolarHBondContact O-N 3.41Å; E1021-A1024 VanDerWaalsContact O-N 3.17Å; A1024-L1027 PolarHBondContact O-N 3.27Å; A1024-Y1028 VanDerWaalsContact O-CB 3.28Å; A1024-Y1028 WeakPolarHBondContact O-CB 3.38Å; A1024-Y1028 PolarHBondContact O-N 2.74Å
1025	R	86.4	Confident	86.2	Confident	64 Å²	64	36.3 Å²	36.3	24%	0.242	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-48.4	173.6	-74.1	-168.7	-95.5	117.5	-8.2	111.8	N622 I623 N625 L1010 E1021 R1023 Y1028 S1029	N622-R1025 PolarHBondContact O-NH1 3.28Å; I623-R1025 PolarHBondContact O-NH2 2.83Å; N625-R1025 PolarHBondContact OD1-NH1 3Å; N625-R1025 PolarHBondContact OD1-NH2 3.09Å; L1010-R1025 HydrophobicContact CD1-CG 3.59Å; L1010-R1025 HydrophobicContact CD2-CG 4.2Å; E1021-R1025 PolarHBondContact O-N 3.12Å; E1021-R1025 IonicContact OE1-CZ 2.98Å; E1021-R1025 IonicContact OE1-NE 2.88Å; E1021-R1025 PolarHBondContact OE1-NE 2.99Å; E1021-R1025 IonicContact OE1-NH2 3.7Å; E1021-R1025 PolarHBondContact OE1-NH2 2.98Å; R1023-R1025 VanDerWaalsContact C-N 3.33Å; R1025-Y1028 PolarHBondContact O-N 3.25Å; R1025-S1029 PolarHBondContact O-N 3.08Å; R1025-S1029 PolarHBondContact O-OG 2.84Å; R1025-S1029 VanDerWaalsContact O-OG 3.11Å
1026	Q	85.9	Confident	86.4	Confident	36 Å²	36	38.6 Å²	38.6	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-57.2	-51.3	175.2	-70.8	176.3	-50.6	0	0	112.2	G1022 R1023 Y1028 S1029 A1030 I1050	G1022-Q1026 WeakPolarHBondContact O-CG 3.3Å; G1022-Q1026 PolarHBondContact O-N 3.5Å; R1023-Q1026 PolarHBondContact O-N 3.27Å; Q1026-Y1028 VanDerWaalsContact C-N 3.35Å; Q1026-Y1028 PolarHBondContact O-N 3.17Å; Q1026-S1029 WeakPolarHBondContact CA-OG 3.32Å; Q1026-S1029 PolarHBondContact O-N 3.19Å; Q1026-S1029 PolarHBondContact O-OG 3.16Å; Q1026-A1030 PolarHBondContact O-N 3.1Å; Q1026-I1050 HydrophobicContact CB-CG2 4.18Å
1027	L	89.1	Confident	86.7	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-55.4	-47.4	177.5	-85.2	163	0	0	0	112.5	L1013 V1019 R1023 A1024 A1030 G1031 Y1032 L1038 L1046 I1050	L1013-L1027 HydrophobicContact CD1-CB 4.04Å; V1019-L1027 HydrophobicContact CG1-CD1 3.79Å; V1019-L1027 HydrophobicContact CG2-CD1 4.01Å; R1023-L1027 HydrophobicContact CG-CD1 4.38Å; R1023-L1027 WeakPolarHBondContact O-CB 3.43Å; R1023-L1027 WeakPolarHBondContact O-CG 3.5Å; R1023-L1027 PolarHBondContact O-N 3.33Å; A1024-L1027 PolarHBondContact O-N 3.27Å; L1027-A1030 CarbonylContact O-C 2.94Å; L1027-A1030 PolarHBondContact O-N 3.16Å; L1027-G1031 PolarHBondContact O-N 2.86Å; L1027-Y1032 HydrophobicContact CD2-CD2 3.99Å; L1027-Y1032 HydrophobicContact CD2-CG 4.02Å; L1027-Y1032 WeakPolarHBondContact O-CB 3.06Å; L1027-Y1032 PolarHBondContact O-N 3.44Å; L1027-L1038 HydrophobicContact CD1-CD1 4.36Å; L1027-L1038 HydrophobicContact CD1-CD2 4.32Å; L1027-L1038 HydrophobicContact CD2-CD2 3.49Å; L1027-L1038 VanDerWaalsContact CD2-CD2 3.49Å; L1027-L1038 HydrophobicContact CD2-CG 4.36Å; L1027-L1046 HydrophobicContact CD2-CD1 4.04Å; L1027-I1050 HydrophobicContact CD2-CD1 3.41Å; L1027-I1050 VanDerWaalsContact CD2-CD1 3.41Å; L1027-I1050 HydrophobicContact CG-CD1 3.86Å
1028	Y	90.8	Very high	87.2	Confident	52 Å²	52	42.6 Å²	42.6	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-40.7	-179.3	-169.9	-97.2	0	0	0	112.1	E1009 L1010 L1013 A1024 R1025 Q1026 A1030 G1031 K1033	E1009-Y1028 HydrophobicContact CB-CE2 3.93Å; E1009-Y1028 HydrophobicContact CG-CE1 4.15Å; E1009-Y1028 HydrophobicContact CG-CE2 4.27Å; E1009-Y1028 WeakPolarHBondContact OE2-CE1 3.23Å; E1009-Y1028 PolarHBondContact OE2-OH 3.07Å; L1010-Y1028 HydrophobicContact CD2-CG 4.15Å; L1013-Y1028 HydrophobicContact CD1-CD2 4.3Å; A1024-Y1028 VanDerWaalsContact O-CB 3.28Å; A1024-Y1028 WeakPolarHBondContact O-CB 3.38Å; A1024-Y1028 PolarHBondContact O-N 2.74Å; R1025-Y1028 PolarHBondContact O-N 3.25Å; Q1026-Y1028 VanDerWaalsContact C-N 3.35Å; Q1026-Y1028 PolarHBondContact O-N 3.17Å; Y1028-A1030 VanDerWaalsContact C-N 3.29Å; Y1028-A1030 PolarHBondContact O-N 2.76Å; Y1028-G1031 PolarHBondContact O-N 3.11Å; Y1028-G1031 VanDerWaalsContact O-N 3.1Å; Y1028-K1033 HydrophobicContact CD2-CB 4.08Å; Y1028-K1033 HydrophobicContact CD2-CD 4.2Å; Y1028-K1033 HydrophobicContact CD2-CG 3.71Å; Y1028-K1033 HydrophobicContact CE2-CB 3.9Å; Y1028-K1033 HydrophobicContact CE2-CD 3.54Å; Y1028-K1033 HydrophobicContact CE2-CG 3.55Å; Y1028-K1033 HydrophobicContact CG-CG 4.48Å; Y1028-K1033 PolarHBondContact OH-NZ 3.29Å; Y1028-K1033 VanDerWaalsContact OH-NZ 3.12Å
1029	S	88.9	Confident	87.8	Confident	102 Å²	102	41 Å²	41	71%	0.713	22%	0.219	S	C	*	.	H	α-helix	trans	-65.3	-29.7	173.2	55.4	0	0	0	0	113.6	R1025 Q1026 G1031	R1025-S1029 PolarHBondContact O-N 3.08Å; R1025-S1029 PolarHBondContact O-OG 2.84Å; R1025-S1029 VanDerWaalsContact O-OG 3.11Å; Q1026-S1029 WeakPolarHBondContact CA-OG 3.32Å; Q1026-S1029 PolarHBondContact O-N 3.19Å; Q1026-S1029 PolarHBondContact O-OG 3.16Å; S1029-G1031 PolarHBondContact O-N 3.01Å
1030	A	89.3	Confident	88.2	Confident	39 Å²	39	46.9 Å²	46.9	32%	0.322	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.4	173.1	0	0	0	0	0	113.8	Q1026 L1027 Y1028 Y1032 I1050	Q1026-A1030 PolarHBondContact O-N 3.1Å; L1027-A1030 CarbonylContact O-C 2.94Å; L1027-A1030 PolarHBondContact O-N 3.16Å; Y1028-A1030 VanDerWaalsContact C-N 3.29Å; Y1028-A1030 PolarHBondContact O-N 2.76Å; A1030-Y1032 HydrophobicContact CB-CD2 3.93Å; A1030-Y1032 HydrophobicContact CB-CE2 4.13Å; A1030-I1050 HydrophobicContact CB-CG1 4.41Å
1031	G	90	Very high	88.6	Confident	37 Å²	37	45.2 Å²	45.2	38%	0.381	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-0.8	176.5	0	0	0	0	0	115.8	L1027 Y1028 S1029 K1033 H1037	L1027-G1031 PolarHBondContact O-N 2.86Å; Y1028-G1031 PolarHBondContact O-N 3.11Å; Y1028-G1031 VanDerWaalsContact O-N 3.1Å; S1029-G1031 PolarHBondContact O-N 3.01Å; G1031-K1033 VanDerWaalsContact C-N 3.26Å; G1031-K1033 PolarHBondContact O-N 3.01Å; G1031-H1037 PolarHBondContact O-ND1 3.49Å
1032	Y	91.2	Very high	88.9	Confident	30 Å²	30	47.6 Å²	47.6	12%	0.118	26%	0.258	C	S	.	.			trans	-79.3	74.7	174.6	-61	-80.7	0	0	0	110.2	L1013 L1027 A1030 H1037 A1041 L1046	L1013-Y1032 WeakPolarHBondContact CD1-O 3.17Å; L1013-Y1032 VanDerWaalsContact CD2-O 3.23Å; L1013-Y1032 WeakPolarHBondContact CD2-O 3.48Å; L1027-Y1032 HydrophobicContact CD2-CD2 3.99Å; L1027-Y1032 HydrophobicContact CD2-CG 4.02Å; L1027-Y1032 WeakPolarHBondContact O-CB 3.06Å; L1027-Y1032 PolarHBondContact O-N 3.44Å; A1030-Y1032 HydrophobicContact CB-CD2 3.93Å; A1030-Y1032 HydrophobicContact CB-CE2 4.13Å; Y1032-H1037 HydrophobicContact CD1-CB 4.07Å; Y1032-A1041 HydrophobicContact CD1-CB 4.38Å; Y1032-A1041 HydrophobicContact CE1-CB 3.68Å; Y1032-L1046 HydrophobicContact CD1-CD1 4.36Å; Y1032-L1046 HydrophobicContact CD2-CD1 3.99Å; Y1032-L1046 HydrophobicContact CE1-CD1 4Å; Y1032-L1046 HydrophobicContact CE2-CD1 3.57Å; Y1032-L1046 HydrophobicContact CG-CD1 4.36Å
1033	K	90.9	Very high	89.3	Confident	107 Å²	107	48.7 Å²	48.7	47%	0.465	26%	0.264	S	S	.	.			trans	-87	-2.2	-174.4	-59.3	-160.4	170.2	-157	0	115.6	Y1028 G1031	Y1028-K1033 HydrophobicContact CD2-CB 4.08Å; Y1028-K1033 HydrophobicContact CD2-CD 4.2Å; Y1028-K1033 HydrophobicContact CD2-CG 3.71Å; Y1028-K1033 HydrophobicContact CE2-CB 3.9Å; Y1028-K1033 HydrophobicContact CE2-CD 3.54Å; Y1028-K1033 HydrophobicContact CE2-CG 3.55Å; Y1028-K1033 HydrophobicContact CG-CG 4.48Å; Y1028-K1033 PolarHBondContact OH-NZ 3.29Å; Y1028-K1033 VanDerWaalsContact OH-NZ 3.12Å; G1031-K1033 VanDerWaalsContact C-N 3.26Å; G1031-K1033 PolarHBondContact O-N 3.01Å
1034	S	90.8	Very high	89.5	Confident	34 Å²	34	50.1 Å²	50.1	24%	0.238	27%	0.272	C	S	.	.	S	Bend	trans	-151.6	160.3	-177.4	71.4	0	0	0	0	112.6	M1036 H1037 L1038	S1034-M1036 PolarHBondContact O-N 2.8Å; S1034-H1037 PolarHBondContact O-N 3.03Å; S1034-H1037 PolarHBondContact OG-CD2 3.44Å; S1034-H1037 PolarHBondContact OG-N 2.75Å; S1034-L1038 PolarHBondContact O-N 3.48Å; S1034-L1038 VanDerWaalsContact O-N 3.16Å
1035	L	90.5	Very high	89.5	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.084	29%	0.292	C	S	.	.	H	α-helix	trans	-53.4	-38.7	171.9	-67.9	171.9	0	0	0	112.2	P1012 V1016 H1037 L1038 A1039 L1068 L1069	P1012-L1035 WeakPolarHBondContact O-CD2 3.39Å; P1012-L1035 WeakPolarHBondContact O-CG 3.38Å; V1016-L1035 HydrophobicContact CG2-CD2 3.34Å; L1035-H1037 PolarHBondContact O-N 2.97Å; L1035-L1038 PolarHBondContact O-N 3.36Å; L1035-A1039 WeakPolarHBondContact O-CB 3.22Å; L1035-A1039 PolarHBondContact O-N 3.07Å; L1035-L1068 HydrophobicContact CD2-CD1 4.42Å; L1035-L1069 HydrophobicContact CB-CD1 4.46Å; L1035-L1069 HydrophobicContact CB-CD2 3.78Å; L1035-L1069 HydrophobicContact CB-CG 4.1Å; L1035-L1069 HydrophobicContact CD1-CD2 4.46Å
1036	M	89.5	Confident	89.5	Confident	100 Å²	100	50.3 Å²	50.3	49%	0.493	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-39.3	176.3	-66.6	-58.1	-54.1	0	0	112.5	S1034 L1038 N1040 L1069	S1034-M1036 PolarHBondContact O-N 2.8Å; M1036-L1038 VanDerWaalsContact C-N 3.35Å; M1036-N1040 WeakPolarHBondContact O-CB 3.19Å; M1036-N1040 PolarHBondContact O-N 3.13Å; M1036-N1040 PolarHBondContact O-ND2 3.45Å; M1036-L1069 HydrophobicContact CE-CD1 4.48Å; M1036-L1069 HydrophobicContact CG-CD2 4.4Å; M1036-L1069 HydrophobicContact SD-CD1 3.55Å; M1036-L1069 VanDerWaalsContact SD-CD1 3.55Å; M1036-L1069 HydrophobicContact SD-CD2 3.63Å; M1036-L1069 HydrophobicContact SD-CG 4.22Å
1037	H	90.8	Very high	89.6	Confident	98 Å²	98	51 Å²	51	45%	0.454	29%	0.285	S	S	.	.	H	α-helix	trans	-68.1	-38.4	177.6	-65.4	-163.7	0	0	0	110.7	G1031 Y1032 S1034 L1035 A1041	G1031-H1037 PolarHBondContact O-ND1 3.49Å; Y1032-H1037 HydrophobicContact CD1-CB 4.07Å; S1034-H1037 PolarHBondContact O-N 3.03Å; S1034-H1037 PolarHBondContact OG-CD2 3.44Å; S1034-H1037 PolarHBondContact OG-N 2.75Å; L1035-H1037 PolarHBondContact O-N 2.97Å; H1037-A1041 PolarHBondContact O-N 2.81Å
1038	L	90.9	Very high	89.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.7	-49	177.3	-90.8	176.8	0	0	0	112.7	L1013 V1016 L1027 S1034 L1035 M1036 N1040 A1041 L1046 I1061 A1065	L1013-L1038 HydrophobicContact CD2-CD1 3.91Å; V1016-L1038 HydrophobicContact CG2-CD1 4Å; L1027-L1038 HydrophobicContact CD1-CD1 4.36Å; L1027-L1038 HydrophobicContact CD1-CD2 4.32Å; L1027-L1038 HydrophobicContact CD2-CD2 3.49Å; L1027-L1038 VanDerWaalsContact CD2-CD2 3.49Å; L1027-L1038 HydrophobicContact CD2-CG 4.36Å; S1034-L1038 PolarHBondContact O-N 3.48Å; S1034-L1038 VanDerWaalsContact O-N 3.16Å; L1035-L1038 PolarHBondContact O-N 3.36Å; M1036-L1038 VanDerWaalsContact C-N 3.35Å; L1038-N1040 VanDerWaalsContact C-N 3.29Å; L1038-N1040 PolarHBondContact O-N 3.3Å; L1038-A1041 VanDerWaalsContact O-CB 3.22Å; L1038-A1041 WeakPolarHBondContact O-CB 3.48Å; L1038-A1041 PolarHBondContact O-N 2.92Å; L1038-A1041 VanDerWaalsContact O-N 3.08Å; L1038-L1046 HydrophobicContact CD2-CD1 4.47Å; L1038-I1061 HydrophobicContact CD1-CG2 4.28Å; L1038-I1061 HydrophobicContact CD2-CG2 3.73Å; L1038-A1065 HydrophobicContact CB-CB 3.75Å
1039	A	89.9	Confident	89	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-30.4	-176.9	0	0	0	0	0	113.5	L1035 A1065 K1066 L1069	L1035-A1039 WeakPolarHBondContact O-CB 3.22Å; L1035-A1039 PolarHBondContact O-N 3.07Å; A1039-A1065 HydrophobicContact CB-CB 4.19Å; A1039-K1066 HydrophobicContact CB-CG 3.75Å; A1039-K1066 WeakPolarHBondContact O-CE 3.46Å; A1039-L1069 HydrophobicContact CB-CD1 3.32Å
1040	N	91.1	Very high	88.7	Confident	128 Å²	128	55.6 Å²	55.6	68%	0.684	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	0.3	174.9	-68.1	-24.3	0	0	0	113.4	M1036 L1038	M1036-N1040 WeakPolarHBondContact O-CB 3.19Å; M1036-N1040 PolarHBondContact O-N 3.13Å; M1036-N1040 PolarHBondContact O-ND2 3.45Å; L1038-N1040 VanDerWaalsContact C-N 3.29Å; L1038-N1040 PolarHBondContact O-N 3.3Å
1041	A	90.3	Very high	87.9	Confident	13 Å²	13	58.6 Å²	58.6	11%	0.107	31%	0.309	C	S	.	.			trans	-70.6	143.2	179.7	0	0	0	0	0	111.9	Y1032 H1037 L1038 L1046 I1062	Y1032-A1041 HydrophobicContact CD1-CB 4.38Å; Y1032-A1041 HydrophobicContact CE1-CB 3.68Å; H1037-A1041 PolarHBondContact O-N 2.81Å; L1038-A1041 VanDerWaalsContact O-CB 3.22Å; L1038-A1041 WeakPolarHBondContact O-CB 3.48Å; L1038-A1041 PolarHBondContact O-N 2.92Å; L1038-A1041 VanDerWaalsContact O-N 3.08Å; A1041-L1046 HydrophobicContact CB-CD1 4.35Å; A1041-I1062 HydrophobicContact CB-CD1 4.2Å; A1041-I1062 HydrophobicContact CB-CG1 4.32Å; A1041-I1062 WeakPolarHBondContact O-CD1 3.33Å
1042	N	88.9	Confident	86.7	Confident	90 Å²	90	60.4 Å²	60.4	48%	0.481	31%	0.308	S	S	.	.			trans	-82	126.8	166.9	-177.8	-30.5	0	0	0	109	E1044 V1045 L1046	N1042-E1044 PolarHBondContact O-N 3.25Å; N1042-E1044 PolarHBondContact OD1-N 2.95Å; N1042-V1045 HydrophobicContact CB-CB 4.32Å; N1042-V1045 HydrophobicContact CB-CG2 3.99Å; N1042-V1045 PolarHBondContact O-N 3.38Å; N1042-L1046 PolarHBondContact O-N 3.13Å
1043	P	87.8	Confident	86	Confident	30 Å²	30	59.3 Å²	59.3	20%	0.195	30%	0.304	C	S	.	.	H	α-helix	trans	-51.6	-39.6	178.4	-24.5	30.4	0	0	0	113.8	V1045 L1046 I1047 A1058 K1059 I1062	P1043-V1045 VanDerWaalsContact C-N 3.29Å; P1043-V1045 PolarHBondContact O-N 3.43Å; P1043-L1046 PolarHBondContact O-N 3.47Å; P1043-I1047 WeakPolarHBondContact O-CD1 3.4Å; P1043-I1047 WeakPolarHBondContact O-CG1 3.3Å; P1043-I1047 PolarHBondContact O-N 3.31Å; P1043-A1058 HydrophobicContact CB-CB 4.32Å; P1043-K1059 HydrophobicContact CB-CG 4.33Å; P1043-K1059 HydrophobicContact CG-CG 4.25Å; P1043-I1062 HydrophobicContact CB-CD1 4.06Å; P1043-I1062 HydrophobicContact CG-CD1 3.65Å
1044	E	88.7	Confident	85.2	Confident	71 Å²	71	56.2 Å²	56.2	33%	0.332	30%	0.296	S	S	.	.	H	α-helix	trans	-73.5	-20.1	-177.2	-52	-56.3	146.4	0	0	113.3	N1042 K1048 R1055	N1042-E1044 PolarHBondContact O-N 3.25Å; N1042-E1044 PolarHBondContact OD1-N 2.95Å; E1044-K1048 WeakPolarHBondContact O-CD 3.49Å; E1044-K1048 WeakPolarHBondContact O-CG 3.47Å; E1044-R1055 IonicContact OE1-CZ 2.62Å; E1044-R1055 IonicContact OE1-NE 2.91Å; E1044-R1055 PolarHBondContact OE1-NE 2.87Å; E1044-R1055 IonicContact OE1-NH2 2.77Å; E1044-R1055 PolarHBondContact OE1-NH2 2.92Å; E1044-R1055 IonicContact OE2-NE 2.74Å; E1044-R1055 IonicContact OE2-NH2 3.11Å
1045	V	88.3	Confident	84.7	Confident	68 Å²	68	61.8 Å²	61.8	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-81.1	-46.7	169.6	177.3	0	0	0	0	109.1	N1042 P1043 I1047 K1048 T1049	N1042-V1045 HydrophobicContact CB-CB 4.32Å; N1042-V1045 HydrophobicContact CB-CG2 3.99Å; N1042-V1045 PolarHBondContact O-N 3.38Å; P1043-V1045 VanDerWaalsContact C-N 3.29Å; P1043-V1045 PolarHBondContact O-N 3.43Å; V1045-I1047 VanDerWaalsContact C-N 3.27Å; V1045-I1047 PolarHBondContact O-N 3.29Å; V1045-K1048 WeakPolarHBondContact O-CA 3.4Å; V1045-K1048 WeakPolarHBondContact O-CB 3.42Å; V1045-K1048 PolarHBondContact O-N 3.01Å; V1045-T1049 HydrophobicContact CG1-CG2 4.06Å; V1045-T1049 PolarHBondContact O-N 3.32Å; V1045-T1049 PolarHBondContact O-OG1 3.22Å; V1045-T1049 VanDerWaalsContact O-OG1 3.06Å
1046	L	86.9	Confident	84.1	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-55.4	-41.8	-178.3	-159.7	70.5	0	0	0	112.1	L1027 Y1032 L1038 A1041 N1042 P1043 K1048 T1049 I1050 L1053 A1058 I1062	L1027-L1046 HydrophobicContact CD2-CD1 4.04Å; Y1032-L1046 HydrophobicContact CD1-CD1 4.36Å; Y1032-L1046 HydrophobicContact CD2-CD1 3.99Å; Y1032-L1046 HydrophobicContact CE1-CD1 4Å; Y1032-L1046 HydrophobicContact CE2-CD1 3.57Å; Y1032-L1046 HydrophobicContact CG-CD1 4.36Å; L1038-L1046 HydrophobicContact CD2-CD1 4.47Å; A1041-L1046 HydrophobicContact CB-CD1 4.35Å; N1042-L1046 PolarHBondContact O-N 3.13Å; P1043-L1046 PolarHBondContact O-N 3.47Å; L1046-K1048 VanDerWaalsContact C-N 3.33Å; L1046-K1048 PolarHBondContact O-N 2.88Å; L1046-T1049 WeakPolarHBondContact CA-OG1 3.27Å; L1046-T1049 PolarHBondContact O-N 3.15Å; L1046-T1049 PolarHBondContact O-OG1 3.13Å; L1046-T1049 VanDerWaalsContact O-OG1 3.09Å; L1046-I1050 HydrophobicContact CD1-CD1 3.66Å; L1046-I1050 HydrophobicContact CG-CD1 3.95Å; L1046-I1050 WeakPolarHBondContact O-CB 3.46Å; L1046-I1050 WeakPolarHBondContact O-CG1 3.26Å; L1046-I1050 PolarHBondContact O-N 2.9Å; L1046-I1050 VanDerWaalsContact O-N 3.12Å; L1046-L1053 HydrophobicContact CB-CD2 4.25Å; L1046-L1053 HydrophobicContact CD2-CD2 3.66Å; L1046-L1053 HydrophobicContact CG-CD2 3.58Å; L1046-A1058 HydrophobicContact CD2-CB 4.21Å; L1046-I1062 HydrophobicContact CD2-CD1 3.92Å; L1046-I1062 HydrophobicContact CD2-CG1 4.07Å
1047	I	86.1	Confident	83.6	Confident	50 Å²	50	66.6 Å²	66.6	26%	0.256	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-31.7	175.5	-64.3	157.7	0	0	0	112.7	P1043 V1045 R1055 A1058	P1043-I1047 WeakPolarHBondContact O-CD1 3.4Å; P1043-I1047 WeakPolarHBondContact O-CG1 3.3Å; P1043-I1047 PolarHBondContact O-N 3.31Å; V1045-I1047 VanDerWaalsContact C-N 3.27Å; V1045-I1047 PolarHBondContact O-N 3.29Å; I1047-R1055 HydrophobicContact CD1-CB 3.82Å; I1047-R1055 HydrophobicContact CD1-CG 3.73Å; I1047-A1058 HydrophobicContact CD1-CB 4.07Å; I1047-A1058 HydrophobicContact CG1-CB 3.71Å
1048	K	84.3	Confident	83.3	Confident	183 Å²	183	61.9 Å²	61.9	80%	0.796	30%	0.303	S	S	*	.	H	α-helix	trans	-83.5	-27.1	178.9	-70.2	175.5	-177.6	-179.2	0	113	E1044 V1045 L1046	E1044-K1048 WeakPolarHBondContact O-CD 3.49Å; E1044-K1048 WeakPolarHBondContact O-CG 3.47Å; V1045-K1048 WeakPolarHBondContact O-CA 3.4Å; V1045-K1048 WeakPolarHBondContact O-CB 3.42Å; V1045-K1048 PolarHBondContact O-N 3.01Å; L1046-K1048 VanDerWaalsContact C-N 3.33Å; L1046-K1048 PolarHBondContact O-N 2.88Å
1049	T	84.8	Confident	83	Confident	64 Å²	64	67.2 Å²	67.2	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-90.4	-14.8	-179.6	50.1	0	0	0	0	114	V1045 L1046	V1045-T1049 HydrophobicContact CG1-CG2 4.06Å; V1045-T1049 PolarHBondContact O-N 3.32Å; V1045-T1049 PolarHBondContact O-OG1 3.22Å; V1045-T1049 VanDerWaalsContact O-OG1 3.06Å; L1046-T1049 WeakPolarHBondContact CA-OG1 3.27Å; L1046-T1049 PolarHBondContact O-N 3.15Å; L1046-T1049 PolarHBondContact O-OG1 3.13Å; L1046-T1049 VanDerWaalsContact O-OG1 3.09Å
1050	I	82.2	Confident	82.7	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.026	33%	0.332	C	S	.	.	S	Bend	trans	-129.1	113.5	-173	-56.9	177.9	0	0	0	109.7	Q1026 L1027 A1030 L1046 H1052 L1053	Q1026-I1050 HydrophobicContact CB-CG2 4.18Å; L1027-I1050 HydrophobicContact CD2-CD1 3.41Å; L1027-I1050 VanDerWaalsContact CD2-CD1 3.41Å; L1027-I1050 HydrophobicContact CG-CD1 3.86Å; A1030-I1050 HydrophobicContact CB-CG1 4.41Å; L1046-I1050 HydrophobicContact CD1-CD1 3.66Å; L1046-I1050 HydrophobicContact CG-CD1 3.95Å; L1046-I1050 WeakPolarHBondContact O-CB 3.46Å; L1046-I1050 WeakPolarHBondContact O-CG1 3.26Å; L1046-I1050 PolarHBondContact O-N 2.9Å; L1046-I1050 VanDerWaalsContact O-N 3.12Å; I1050-H1052 PolarHBondContact O-N 3.17Å; I1050-L1053 HydrophobicContact CB-CB 4.2Å; I1050-L1053 HydrophobicContact CB-CD2 4.4Å; I1050-L1053 HydrophobicContact CD1-CD2 4.33Å; I1050-L1053 HydrophobicContact CG2-CB 4.11Å; I1050-L1053 PolarHBondContact O-N 2.99Å
1051	D	71.5	Confident	82.6	Confident	103 Å²	103	62.7 Å²	62.7	55%	0.551	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	124.4	179.1	-64.5	-31.4	0	0	0	112.1	L1053	D1051-L1053 VanDerWaalsContact C-N 3.27Å; D1051-L1053 PolarHBondContact O-N 3.47Å
1052	H	65.9	Low	82.5	Confident	75 Å²	75	62.5 Å²	62.5	35%	0.347	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	29.8	173.2	-42.6	-67.7	0	0	0	115	E615 N619 I1050	E615-H1052 WeakPolarHBondContact CG-CE1 3.47Å; E615-H1052 IonicContact OE1-CE1 3.49Å; E615-H1052 IonicContact OE2-CE1 3.33Å; E615-H1052 PolarHBondContact OE2-CE1 3.21Å; E615-H1052 IonicContact OE2-ND1 3.17Å; E615-H1052 PolarHBondContact OE2-ND1 3.08Å; E615-H1052 VanDerWaalsContact OE2-ND1 3.07Å; N619-H1052 PolarHBondContact ND2-CD2 3.1Å; N619-H1052 VanDerWaalsContact ND2-CD2 3.3Å; I1050-H1052 PolarHBondContact O-N 3.17Å
1053	L	75.1	Confident	82.4	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.037	28%	0.28	C	S	.	.			trans	-80.1	114.5	168.4	-176	67.7	0	0	0	110.8	L1046 I1050 D1051 Q1057 A1058 I1061	L1046-L1053 HydrophobicContact CB-CD2 4.25Å; L1046-L1053 HydrophobicContact CD2-CD2 3.66Å; L1046-L1053 HydrophobicContact CG-CD2 3.58Å; I1050-L1053 HydrophobicContact CB-CB 4.2Å; I1050-L1053 HydrophobicContact CB-CD2 4.4Å; I1050-L1053 HydrophobicContact CD1-CD2 4.33Å; I1050-L1053 HydrophobicContact CG2-CB 4.11Å; I1050-L1053 PolarHBondContact O-N 2.99Å; D1051-L1053 VanDerWaalsContact C-N 3.27Å; D1051-L1053 PolarHBondContact O-N 3.47Å; L1053-Q1057 HydrophobicContact CD1-CB 3.64Å; L1053-Q1057 HydrophobicContact CG-CB 4.48Å; L1053-A1058 HydrophobicContact CD2-CB 3.79Å; L1053-A1058 HydrophobicContact CG-CB 4.1Å; L1053-I1061 HydrophobicContact CD1-CD1 3.88Å
1054	S	75.4	Confident	82.4	Confident	42 Å²	42	57.5 Å²	57.5	29%	0.294	27%	0.271	S	S	.	.			trans	-72.1	149.5	180	69.3	0	0	0	0	112.3	E657 R1056 Q1057 A1058	E657-S1054 PolarHBondContact OE1-OG 3.16Å; S1054-R1056 PolarHBondContact O-N 3.23Å; S1054-R1056 VanDerWaalsContact O-N 3.08Å; S1054-Q1057 PolarHBondContact O-N 3.46Å; S1054-Q1057 VanDerWaalsContact OG-CG 3.28Å; S1054-Q1057 WeakPolarHBondContact OG-CG 3.44Å; S1054-Q1057 PolarHBondContact OG-N 3.23Å; S1054-Q1057 PolarHBondContact OG-OE1 3.15Å; S1054-A1058 PolarHBondContact O-N 2.83Å
1055	R	80.6	Confident	82.4	Confident	151 Å²	151	54.1 Å²	54.1	57%	0.57	26%	0.255	S	S	*	.	H	α-helix	trans	-58.1	-27	-178.3	-164.3	177.5	-162.9	-162.6	7	113.4	E1044 I1047 K1059	E1044-R1055 IonicContact OE1-CZ 2.62Å; E1044-R1055 IonicContact OE1-NE 2.91Å; E1044-R1055 PolarHBondContact OE1-NE 2.87Å; E1044-R1055 IonicContact OE1-NH2 2.77Å; E1044-R1055 PolarHBondContact OE1-NH2 2.92Å; E1044-R1055 IonicContact OE2-NE 2.74Å; E1044-R1055 IonicContact OE2-NH2 3.11Å; I1047-R1055 HydrophobicContact CD1-CB 3.82Å; I1047-R1055 HydrophobicContact CD1-CG 3.73Å; R1055-K1059 WeakPolarHBondContact O-CG 3.42Å; R1055-K1059 PolarHBondContact O-N 2.88Å
1056	R	76.8	Confident	82.5	Confident	181 Å²	181	54.9 Å²	54.9	68%	0.683	25%	0.253	S	S	*	.	H	α-helix	trans	-69.7	-53.5	172	-174.3	178.2	176.4	168.6	-0.3	110.9	S1054 A1058 K1059 Q1060	S1054-R1056 PolarHBondContact O-N 3.23Å; S1054-R1056 VanDerWaalsContact O-N 3.08Å; R1056-A1058 PolarHBondContact O-N 3.04Å; R1056-K1059 PolarHBondContact O-N 2.9Å; R1056-Q1060 VanDerWaalsContact O-CG 3.32Å; R1056-Q1060 WeakPolarHBondContact O-CG 3.18Å; R1056-Q1060 PolarHBondContact O-N 2.7Å; R1056-Q1060 PolarHBondContact O-OE1 2.71Å
1057	Q	78.8	Confident	82.5	Confident	35 Å²	35	55.3 Å²	55.3	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-43	177.2	-72.9	175.4	-21.7	0	0	112.5	E657 L1053 S1054 K1059 Q1060 I1061	E657-Q1057 VanDerWaalsContact OE1-CD 3.22Å; E657-Q1057 PolarHBondContact OE1-NE2 2.78Å; E657-Q1057 PolarHBondContact OE1-OE1 2.85Å; E657-Q1057 PolarHBondContact OE2-NE2 2.72Å; L1053-Q1057 HydrophobicContact CD1-CB 3.64Å; L1053-Q1057 HydrophobicContact CG-CB 4.48Å; S1054-Q1057 PolarHBondContact O-N 3.46Å; S1054-Q1057 VanDerWaalsContact OG-CG 3.28Å; S1054-Q1057 WeakPolarHBondContact OG-CG 3.44Å; S1054-Q1057 PolarHBondContact OG-N 3.23Å; S1054-Q1057 PolarHBondContact OG-OE1 3.15Å; Q1057-K1059 PolarHBondContact O-N 2.64Å; Q1057-Q1060 PolarHBondContact O-N 2.72Å; Q1057-Q1060 VanDerWaalsContact O-N 3.14Å; Q1057-I1061 WeakPolarHBondContact O-CG1 3.46Å; Q1057-I1061 PolarHBondContact O-N 2.78Å
1058	A	85.2	Confident	82.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.4	-48.3	177.1	0	0	0	0	0	111.8	P1043 L1046 I1047 L1053 S1054 R1056 I1062	P1043-A1058 HydrophobicContact CB-CB 4.32Å; L1046-A1058 HydrophobicContact CD2-CB 4.21Å; I1047-A1058 HydrophobicContact CD1-CB 4.07Å; I1047-A1058 HydrophobicContact CG1-CB 3.71Å; L1053-A1058 HydrophobicContact CD2-CB 3.79Å; L1053-A1058 HydrophobicContact CG-CB 4.1Å; S1054-A1058 PolarHBondContact O-N 2.83Å; R1056-A1058 PolarHBondContact O-N 3.04Å; A1058-I1062 WeakPolarHBondContact O-CD1 3.23Å; A1058-I1062 VanDerWaalsContact O-CG1 3.26Å; A1058-I1062 WeakPolarHBondContact O-CG1 3.47Å; A1058-I1062 PolarHBondContact O-N 2.96Å; A1058-I1062 VanDerWaalsContact O-N 3.14Å
1059	K	85.3	Confident	82.6	Confident	111 Å²	111	47.7 Å²	47.7	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-41.8	174.6	-74.6	-177.8	173.8	-169.3	0	112.5	P1043 R1055 R1056 Q1057 I1062 A1063	P1043-K1059 HydrophobicContact CB-CG 4.33Å; P1043-K1059 HydrophobicContact CG-CG 4.25Å; R1055-K1059 WeakPolarHBondContact O-CG 3.42Å; R1055-K1059 PolarHBondContact O-N 2.88Å; R1056-K1059 PolarHBondContact O-N 2.9Å; Q1057-K1059 PolarHBondContact O-N 2.64Å; K1059-I1062 PolarHBondContact O-N 2.86Å; K1059-A1063 VanDerWaalsContact O-CB 3.28Å; K1059-A1063 WeakPolarHBondContact O-CB 3.37Å; K1059-A1063 PolarHBondContact O-N 3.27Å
1060	Q	83.6	Confident	82.7	Confident	33 Å²	33	49.6 Å²	49.6	15%	0.154	23%	0.227	C	C	.	.	H	α-helix	trans	-65.8	-44.3	-179.9	-71.5	171.9	-54.8	0	0	112.7	S399 R1056 Q1057 A1063 S1064	S399-Q1060 WeakPolarHBondContact O-CG 3.32Å; S399-Q1060 PolarHBondContact O-NE2 3.19Å; R1056-Q1060 VanDerWaalsContact O-CG 3.32Å; R1056-Q1060 WeakPolarHBondContact O-CG 3.18Å; R1056-Q1060 PolarHBondContact O-N 2.7Å; R1056-Q1060 PolarHBondContact O-OE1 2.71Å; Q1057-Q1060 PolarHBondContact O-N 2.72Å; Q1057-Q1060 VanDerWaalsContact O-N 3.14Å; Q1060-A1063 PolarHBondContact O-N 3.15Å; Q1060-S1064 VanDerWaalsContact O-CB 3.31Å; Q1060-S1064 WeakPolarHBondContact O-CB 3.45Å; Q1060-S1064 PolarHBondContact O-N 2.97Å; Q1060-S1064 PolarHBondContact O-OG 2.88Å
1061	I	87.6	Confident	82.7	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-45	176.4	-68.2	170.1	0	0	0	110.1	V1016 V1019 L1038 L1053 Q1057 S1064 A1065	V1016-I1061 HydrophobicContact CG1-CG2 4.18Å; V1019-I1061 HydrophobicContact CG2-CD1 4.01Å; V1019-I1061 HydrophobicContact CG2-CG1 3.96Å; V1019-I1061 HydrophobicContact CG2-CG2 3.98Å; L1038-I1061 HydrophobicContact CD1-CG2 4.28Å; L1038-I1061 HydrophobicContact CD2-CG2 3.73Å; L1053-I1061 HydrophobicContact CD1-CD1 3.88Å; Q1057-I1061 WeakPolarHBondContact O-CG1 3.46Å; Q1057-I1061 PolarHBondContact O-N 2.78Å; I1061-S1064 PolarHBondContact O-N 2.75Å; I1061-A1065 VanDerWaalsContact O-CB 3.28Å; I1061-A1065 WeakPolarHBondContact O-CB 3.42Å; I1061-A1065 PolarHBondContact O-N 2.95Å
1062	I	89.4	Confident	83.3	Confident	10 Å²	10	50.2 Å²	50.2	5%	0.051	23%	0.225	C	C	.	.	H	α-helix	trans	-66.9	-43	178.7	-66.3	163.3	0	0	0	111.3	A1041 P1043 L1046 A1058 K1059 A1065 K1066	A1041-I1062 HydrophobicContact CB-CD1 4.2Å; A1041-I1062 HydrophobicContact CB-CG1 4.32Å; A1041-I1062 WeakPolarHBondContact O-CD1 3.33Å; P1043-I1062 HydrophobicContact CB-CD1 4.06Å; P1043-I1062 HydrophobicContact CG-CD1 3.65Å; L1046-I1062 HydrophobicContact CD2-CD1 3.92Å; L1046-I1062 HydrophobicContact CD2-CG1 4.07Å; A1058-I1062 WeakPolarHBondContact O-CD1 3.23Å; A1058-I1062 VanDerWaalsContact O-CG1 3.26Å; A1058-I1062 WeakPolarHBondContact O-CG1 3.47Å; A1058-I1062 PolarHBondContact O-N 2.96Å; A1058-I1062 VanDerWaalsContact O-N 3.14Å; K1059-I1062 PolarHBondContact O-N 2.86Å; I1062-A1065 PolarHBondContact O-N 2.76Å; I1062-K1066 HydrophobicContact CG2-CD 4.43Å; I1062-K1066 WeakPolarHBondContact O-CB 3.43Å; I1062-K1066 WeakPolarHBondContact O-CG 3.44Å; I1062-K1066 PolarHBondContact O-N 3.4Å
1063	A	86.5	Confident	84.2	Confident	13 Å²	13	48.8 Å²	48.8	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-41.2	176.7	0	0	0	0	0	112	K1059 Q1060 K1066 M1067	K1059-A1063 VanDerWaalsContact O-CB 3.28Å; K1059-A1063 WeakPolarHBondContact O-CB 3.37Å; K1059-A1063 PolarHBondContact O-N 3.27Å; Q1060-A1063 PolarHBondContact O-N 3.15Å; A1063-K1066 PolarHBondContact O-N 3.2Å; A1063-M1067 WeakPolarHBondContact O-CB 3.24Å; A1063-M1067 PolarHBondContact O-N 2.91Å
1064	S	87.4	Confident	84.5	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-72.1	-37.9	178.7	-53.9	0	0	0	0	112.2	T1017 Q1060 I1061 M1067 L1068	T1017-S1064 WeakPolarHBondContact OG1-CB 3.34Å; T1017-S1064 PolarHBondContact OG1-OG 2.76Å; Q1060-S1064 VanDerWaalsContact O-CB 3.31Å; Q1060-S1064 WeakPolarHBondContact O-CB 3.45Å; Q1060-S1064 PolarHBondContact O-N 2.97Å; Q1060-S1064 PolarHBondContact O-OG 2.88Å; I1061-S1064 PolarHBondContact O-N 2.75Å; S1064-M1067 PolarHBondContact O-N 2.83Å; S1064-L1068 WeakPolarHBondContact O-CG 3.36Å; S1064-L1068 PolarHBondContact O-N 3.25Å
1065	A	89.5	Confident	84.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-40	172.1	0	0	0	0	0	111.9	V1016 L1038 A1039 I1061 I1062 L1069	V1016-A1065 HydrophobicContact CG1-CB 4.43Å; V1016-A1065 HydrophobicContact CG2-CB 4.33Å; L1038-A1065 HydrophobicContact CB-CB 3.75Å; A1039-A1065 HydrophobicContact CB-CB 4.19Å; I1061-A1065 VanDerWaalsContact O-CB 3.28Å; I1061-A1065 WeakPolarHBondContact O-CB 3.42Å; I1061-A1065 PolarHBondContact O-N 2.95Å; I1062-A1065 PolarHBondContact O-N 2.76Å; A1065-L1069 WeakPolarHBondContact O-CG 3.22Å; A1065-L1069 PolarHBondContact O-N 3.15Å; A1065-L1069 VanDerWaalsContact O-N 3.14Å
1066	K	89.9	Confident	84.9	Confident	83 Å²	83	46.3 Å²	46.3	36%	0.361	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-47	170.5	-76.1	179.3	178.9	-169.2	0	111.7	A1039 I1062 A1063 L1068 L1069 H1070	A1039-K1066 HydrophobicContact CB-CG 3.75Å; A1039-K1066 WeakPolarHBondContact O-CE 3.46Å; I1062-K1066 HydrophobicContact CG2-CD 4.43Å; I1062-K1066 WeakPolarHBondContact O-CB 3.43Å; I1062-K1066 WeakPolarHBondContact O-CG 3.44Å; I1062-K1066 PolarHBondContact O-N 3.4Å; A1063-K1066 PolarHBondContact O-N 3.2Å; K1066-L1068 PolarHBondContact O-N 3.29Å; K1066-L1069 PolarHBondContact O-N 2.94Å; K1066-H1070 PolarHBondContact O-CD2 2.66Å; K1066-H1070 PolarHBondContact O-N 2.68Å
1067	M	86.6	Confident	85.2	Confident	10 Å²	10	43.5 Å²	43.5	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-56.1	-52.3	178.8	-170.2	63.3	77.5	0	0	111.2	V406 F410 F411 V412 A1063 S1064 L1069 H1070 E1071	V406-M1067 HydrophobicContact CG2-CE 3.95Å; F410-M1067 WeakPolarHBondContact O-CE 3.09Å; F411-M1067 HydrophobicContact CB-SD 4.46Å; F411-M1067 HydrophobicContact CD1-CG 4.34Å; F411-M1067 HydrophobicContact CD1-SD 3.45Å; F411-M1067 WeakPolarHBondContact CD1-SD 3.39Å; F411-M1067 HydrophobicContact CE1-SD 3.9Å; F411-M1067 HydrophobicContact CG-SD 4.22Å; V412-M1067 HydrophobicContact CG2-CE 4.46Å; A1063-M1067 WeakPolarHBondContact O-CB 3.24Å; A1063-M1067 PolarHBondContact O-N 2.91Å; S1064-M1067 PolarHBondContact O-N 2.83Å; M1067-L1069 VanDerWaalsContact C-N 3.28Å; M1067-L1069 PolarHBondContact O-N 3.27Å; M1067-H1070 PolarHBondContact O-N 2.72Å; M1067-E1071 VanDerWaalsContact O-CB 3.3Å; M1067-E1071 WeakPolarHBondContact O-CB 3.42Å; M1067-E1071 PolarHBondContact O-N 2.9Å
1068	L	85.5	Confident	85.2	Confident	33 Å²	33	43.7 Å²	43.7	17%	0.173	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-30.9	178.4	-70.2	170.2	0	0	0	113.5	E1015 V1016 L1035 S1064 K1066 K1072	E1015-L1068 HydrophobicContact CB-CD1 4.46Å; V1016-L1068 HydrophobicContact CB-CD1 4.48Å; V1016-L1068 HydrophobicContact CG2-CD1 4.18Å; L1035-L1068 HydrophobicContact CD2-CD1 4.42Å; S1064-L1068 WeakPolarHBondContact O-CG 3.36Å; S1064-L1068 PolarHBondContact O-N 3.25Å; K1066-L1068 PolarHBondContact O-N 3.29Å; L1068-K1072 WeakPolarHBondContact O-CB 3.32Å; L1068-K1072 VanDerWaalsContact O-CG 3.26Å; L1068-K1072 WeakPolarHBondContact O-CG 3.46Å; L1068-K1072 PolarHBondContact O-N 3.24Å; L1068-K1072 VanDerWaalsContact O-N 3.12Å
1069	L	87.4	Confident	85	Confident	40 Å²	40	47.7 Å²	47.7	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-75.6	-42.7	174.6	-73.7	175.1	0	0	0	112.6	L1035 M1036 A1039 A1065 K1066 M1067 E1071 K1072 A1073	L1035-L1069 HydrophobicContact CB-CD1 4.46Å; L1035-L1069 HydrophobicContact CB-CD2 3.78Å; L1035-L1069 HydrophobicContact CB-CG 4.1Å; L1035-L1069 HydrophobicContact CD1-CD2 4.46Å; M1036-L1069 HydrophobicContact CE-CD1 4.48Å; M1036-L1069 HydrophobicContact CG-CD2 4.4Å; M1036-L1069 HydrophobicContact SD-CD1 3.55Å; M1036-L1069 VanDerWaalsContact SD-CD1 3.55Å; M1036-L1069 HydrophobicContact SD-CD2 3.63Å; M1036-L1069 HydrophobicContact SD-CG 4.22Å; A1039-L1069 HydrophobicContact CB-CD1 3.32Å; A1065-L1069 WeakPolarHBondContact O-CG 3.22Å; A1065-L1069 PolarHBondContact O-N 3.15Å; A1065-L1069 VanDerWaalsContact O-N 3.14Å; K1066-L1069 PolarHBondContact O-N 2.94Å; M1067-L1069 VanDerWaalsContact C-N 3.28Å; M1067-L1069 PolarHBondContact O-N 3.27Å; L1069-E1071 VanDerWaalsContact C-N 3.26Å; L1069-E1071 PolarHBondContact O-N 3.27Å; L1069-K1072 PolarHBondContact O-N 3.39Å; L1069-A1073 VanDerWaalsContact O-CB 3.23Å; L1069-A1073 WeakPolarHBondContact O-CB 3.16Å; L1069-A1073 PolarHBondContact O-N 2.85Å
1070	H	85.5	Confident	84.9	Confident	104 Å²	104	46.3 Å²	46.3	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-37.8	172.6	-70.5	-59.4	0	0	0	111	F411 K1066 M1067 A1073 E1074	F411-H1070 HydrophobicContact CE1-CB 4Å; F411-H1070 HydrophobicContact CZ-CB 4.18Å; K1066-H1070 PolarHBondContact O-CD2 2.66Å; K1066-H1070 PolarHBondContact O-N 2.68Å; M1067-H1070 PolarHBondContact O-N 2.72Å; H1070-A1073 PolarHBondContact O-N 3.05Å; H1070-E1074 PolarHBondContact O-N 2.95Å
1071	E	83	Confident	84.7	Confident	38 Å²	38	49.1 Å²	49.1	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-49.5	177.6	-163.2	-148.6	137	0	0	111.3	F411 M1067 L1069 A1075	F411-E1071 HydrophobicContact CD1-CB 4.17Å; F411-E1071 HydrophobicContact CD1-CG 4.31Å; F411-E1071 HydrophobicContact CE1-CB 3.95Å; F411-E1071 HydrophobicContact CE1-CG 4.45Å; M1067-E1071 VanDerWaalsContact O-CB 3.3Å; M1067-E1071 WeakPolarHBondContact O-CB 3.42Å; M1067-E1071 PolarHBondContact O-N 2.9Å; L1069-E1071 VanDerWaalsContact C-N 3.26Å; L1069-E1071 PolarHBondContact O-N 3.27Å; E1071-A1075 WeakPolarHBondContact O-CB 3.39Å; E1071-A1075 PolarHBondContact O-N 3.07Å
1072	K	84.7	Confident	84.3	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-68.4	-35.2	177.1	-70.8	175	-174.3	-174.7	0	112.5	E1015 L1068 L1069 L1076	E1015-K1072 IonicContact OE1-NZ 3.87Å; E1015-K1072 IonicContact OE2-NZ 2.61Å; E1015-K1072 PolarHBondContact OE2-NZ 3.13Å; L1068-K1072 WeakPolarHBondContact O-CB 3.32Å; L1068-K1072 VanDerWaalsContact O-CG 3.26Å; L1068-K1072 WeakPolarHBondContact O-CG 3.46Å; L1068-K1072 PolarHBondContact O-N 3.24Å; L1068-K1072 VanDerWaalsContact O-N 3.12Å; L1069-K1072 PolarHBondContact O-N 3.39Å; K1072-L1076 WeakPolarHBondContact O-CB 3.19Å; K1072-L1076 VanDerWaalsContact O-CG 3.3Å; K1072-L1076 WeakPolarHBondContact O-CG 3.45Å; K1072-L1076 PolarHBondContact O-N 3.49Å
1073	A	84.6	Confident	84	Confident	46 Å²	46	61.2 Å²	61.2	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-45.1	175.8	0	0	0	0	0	111.7	L1069 H1070 L1076 Q1077	L1069-A1073 VanDerWaalsContact O-CB 3.23Å; L1069-A1073 WeakPolarHBondContact O-CB 3.16Å; L1069-A1073 PolarHBondContact O-N 2.85Å; H1070-A1073 PolarHBondContact O-N 3.05Å; A1073-L1076 PolarHBondContact O-N 2.89Å; A1073-Q1077 WeakPolarHBondContact O-CG 3.4Å; A1073-Q1077 PolarHBondContact O-N 2.96Å
1074	E	81.9	Confident	83.6	Confident	30 Å²	30	67 Å²	67	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-66.5	-39.6	174.9	-78.9	-172.9	-170.9	0	0	112.7	F411 R427 K430 H1070 L1076 Q1077 E1078	F411-E1074 VanDerWaalsContact CE2-OE1 3.27Å; F411-E1074 WeakPolarHBondContact CE2-OE1 3.49Å; F411-E1074 WeakPolarHBondContact CE2-OE2 3.21Å; F411-E1074 HydrophobicContact CZ-CG 4.27Å; F411-E1074 WeakPolarHBondContact CZ-OE1 3.42Å; F411-E1074 VanDerWaalsContact CZ-OE2 3.31Å; F411-E1074 WeakPolarHBondContact CZ-OE2 3.49Å; R427-E1074 IonicContact CZ-OE2 2.68Å; R427-E1074 IonicContact NH1-OE2 3.41Å; R427-E1074 PolarHBondContact NH1-OE2 2.96Å; K430-E1074 WeakPolarHBondContact CD-OE1 3.48Å; K430-E1074 IonicContact NZ-OE1 3.24Å; K430-E1074 PolarHBondContact NZ-OE1 3.41Å; H1070-E1074 PolarHBondContact O-N 2.95Å; E1074-L1076 VanDerWaalsContact C-N 3.31Å; E1074-L1076 PolarHBondContact O-N 2.89Å; E1074-Q1077 CarbonylContact O-C 3.58Å; E1074-Q1077 WeakPolarHBondContact O-CB 3.46Å; E1074-Q1077 PolarHBondContact O-N 3.03Å; E1074-Q1077 VanDerWaalsContact O-N 3.12Å; E1074-E1078 PolarHBondContact O-N 3.39Å
1075	A	80.4	Confident	83	Confident	9 Å²	9	73 Å²	73	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-60	-42.7	175.9	0	0	0	0	0	111.4	T425 E1071 Q1077 E1078 E1079	T425-A1075 HydrophobicContact CG2-CB 4.21Å; E1071-A1075 WeakPolarHBondContact O-CB 3.39Å; E1071-A1075 PolarHBondContact O-N 3.07Å; A1075-Q1077 VanDerWaalsContact C-N 3.35Å; A1075-E1078 PolarHBondContact O-N 2.79Å; A1075-E1079 WeakPolarHBondContact O-CB 3.09Å; A1075-E1079 VanDerWaalsContact O-CG 3.29Å; A1075-E1079 WeakPolarHBondContact O-CG 3.47Å; A1075-E1079 PolarHBondContact O-N 2.75Å
1076	L	84.2	Confident	81.2	Confident	108 Å²	108	79.8 Å²	79.8	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-67.6	-32.6	174.1	-71	169.3	0	0	0	112.7	K1072 A1073 E1074 V1080	K1072-L1076 WeakPolarHBondContact O-CB 3.19Å; K1072-L1076 VanDerWaalsContact O-CG 3.3Å; K1072-L1076 WeakPolarHBondContact O-CG 3.45Å; K1072-L1076 PolarHBondContact O-N 3.49Å; A1073-L1076 PolarHBondContact O-N 2.89Å; E1074-L1076 VanDerWaalsContact C-N 3.31Å; E1074-L1076 PolarHBondContact O-N 2.89Å; L1076-V1080 WeakPolarHBondContact O-CB 3.49Å; L1076-V1080 VanDerWaalsContact O-CG2 3.24Å; L1076-V1080 WeakPolarHBondContact O-CG2 3.36Å; L1076-V1080 PolarHBondContact O-N 3.01Å
1077	Q	82	Confident	79.9	Confident	123 Å²	123	79.6 Å²	79.6	58%	0.575	40%	0.403	S	S	*	.	H	α-helix	trans	-68.6	-40.9	172.8	-75	172.1	-35.6	0	0	111.8	A1073 E1074 A1075 V1080 E1081	A1073-Q1077 WeakPolarHBondContact O-CG 3.4Å; A1073-Q1077 PolarHBondContact O-N 2.96Å; E1074-Q1077 CarbonylContact O-C 3.58Å; E1074-Q1077 WeakPolarHBondContact O-CB 3.46Å; E1074-Q1077 PolarHBondContact O-N 3.03Å; E1074-Q1077 VanDerWaalsContact O-N 3.12Å; A1075-Q1077 VanDerWaalsContact C-N 3.35Å; Q1077-V1080 PolarHBondContact O-N 2.88Å; Q1077-E1081 WeakPolarHBondContact O-CB 3.49Å; Q1077-E1081 PolarHBondContact O-N 3.24Å
1078	E	78.4	Confident	78.3	Confident	38 Å²	38	84.6 Å²	84.6	18%	0.178	44%	0.439	C	S	.	.	H	α-helix	trans	-65.9	-44.1	175.1	-172.7	175.1	-164.8	0	0	111.4	T425 K426 E1074 A1075 V1080 E1081 E1082	T425-E1078 VanDerWaalsContact CG2-OE2 3.29Å; T425-E1078 WeakPolarHBondContact CG2-OE2 3.49Å; K426-E1078 WeakPolarHBondContact CB-OE1 3.37Å; K426-E1078 PolarHBondContact N-OE2 3.01Å; K426-E1078 VanDerWaalsContact O-OE1 3.08Å; E1074-E1078 PolarHBondContact O-N 3.39Å; A1075-E1078 PolarHBondContact O-N 2.79Å; E1078-V1080 VanDerWaalsContact C-N 3.34Å; E1078-V1080 PolarHBondContact O-N 3.03Å; E1078-E1081 PolarHBondContact O-N 3.05Å; E1078-E1082 WeakPolarHBondContact O-CB 3.46Å; E1078-E1082 PolarHBondContact O-N 2.85Å
1079	E	80.6	Confident	76.6	Confident	84 Å²	84	89.6 Å²	89.6	39%	0.393	47%	0.466	S	S	.	.	H	α-helix	trans	-61.8	-39.3	175.8	-72.8	170.6	-167.3	0	0	111.2	R421 A1075 L1083	R421-E1079 IonicContact CZ-OE1 3.64Å; R421-E1079 IonicContact NH1-OE1 3.67Å; R421-E1079 IonicContact NH2-OE1 3.73Å; R421-E1079 PolarHBondContact NH2-OE1 2.73Å; A1075-E1079 WeakPolarHBondContact O-CB 3.09Å; A1075-E1079 VanDerWaalsContact O-CG 3.29Å; A1075-E1079 WeakPolarHBondContact O-CG 3.47Å; A1075-E1079 PolarHBondContact O-N 2.75Å; E1079-L1083 VanDerWaalsContact O-CG 3.27Å; E1079-L1083 WeakPolarHBondContact O-CG 3.11Å; E1079-L1083 PolarHBondContact O-N 2.88Å; E1079-L1083 VanDerWaalsContact O-N 3.11Å
1080	V	83.1	Confident	74.7	Confident	83 Å²	83	94.3 Å²	94.3	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-43	172.7	166.8	0	0	0	0	112.1	L1076 Q1077 E1078 E1082 L1083 L1084	L1076-V1080 WeakPolarHBondContact O-CB 3.49Å; L1076-V1080 VanDerWaalsContact O-CG2 3.24Å; L1076-V1080 WeakPolarHBondContact O-CG2 3.36Å; L1076-V1080 PolarHBondContact O-N 3.01Å; Q1077-V1080 PolarHBondContact O-N 2.88Å; E1078-V1080 VanDerWaalsContact C-N 3.34Å; E1078-V1080 PolarHBondContact O-N 3.03Å; V1080-E1082 VanDerWaalsContact C-N 3.32Å; V1080-E1082 PolarHBondContact O-N 3.14Å; V1080-L1083 PolarHBondContact O-N 3.08Å; V1080-L1084 HydrophobicContact CG1-CD1 3.81Å; V1080-L1084 HydrophobicContact CG1-CG 4.39Å; V1080-L1084 WeakPolarHBondContact O-CB 3.34Å; V1080-L1084 VanDerWaalsContact O-CG 3.25Å; V1080-L1084 WeakPolarHBondContact O-CG 3.5Å; V1080-L1084 PolarHBondContact O-N 2.96Å
1081	E	80.1	Confident	72.9	Confident	91 Å²	91	95 Å²	95	43%	0.425	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-38.2	175.7	-88.6	-162.6	-147.5	0	0	112.4	R428 Q1077 E1078 L1084 R1085	R428-E1081 IonicContact CZ-OE2 3.93Å; R428-E1081 IonicContact NH1-OE2 2.7Å; R428-E1081 PolarHBondContact NH1-OE2 2.74Å; R428-E1081 IonicContact NH2-OE2 2.73Å; R428-E1081 PolarHBondContact NH2-OE2 2.91Å; Q1077-E1081 WeakPolarHBondContact O-CB 3.49Å; Q1077-E1081 PolarHBondContact O-N 3.24Å; E1078-E1081 PolarHBondContact O-N 3.05Å; E1081-L1084 PolarHBondContact O-N 3.13Å; E1081-R1085 WeakPolarHBondContact O-CG 3.34Å; E1081-R1085 PolarHBondContact O-N 3.41Å; E1081-R1085 VanDerWaalsContact O-N 3.15Å
1082	E	79.9	Confident	70.9	Confident	115 Å²	115	96.4 Å²	96.4	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-42.4	176.5	-173	147.3	-97.7	0	0	111.8	E1078 V1080 L1084 R1085	E1078-E1082 WeakPolarHBondContact O-CB 3.46Å; E1078-E1082 PolarHBondContact O-N 2.85Å; V1080-E1082 VanDerWaalsContact C-N 3.32Å; V1080-E1082 PolarHBondContact O-N 3.14Å; E1082-L1084 PolarHBondContact O-N 2.94Å; E1082-R1085 PolarHBondContact O-N 3.37Å; E1082-R1085 VanDerWaalsContact O-N 3.15Å; E1082-R1085 IonicContact OE1-CZ 2.78Å; E1082-R1085 IonicContact OE1-NH1 3.96Å; E1082-R1085 PolarHBondContact OE1-NH1 2.87Å
1083	L	81.9	Confident	68.7	Low	154 Å²	154	97.3 Å²	97.3	81%	0.806	55%	0.546	S	S	*	.	H	α-helix	trans	-66	-22.5	171.9	-69.4	170.6	0	0	0	113.7	E1079 V1080	E1079-L1083 VanDerWaalsContact O-CG 3.27Å; E1079-L1083 WeakPolarHBondContact O-CG 3.11Å; E1079-L1083 PolarHBondContact O-N 2.88Å; E1079-L1083 VanDerWaalsContact O-N 3.11Å; V1080-L1083 PolarHBondContact O-N 3.08Å
1084	L	79.3	Confident	66.3	Low	134 Å²	134	101.8 Å²	101.8	70%	0.702	57%	0.568	S	S	*	*	H	α-helix	trans	-86	-10.3	174.2	-73.9	171	0	0	0	113.6	V1080 E1081 E1082	V1080-L1084 HydrophobicContact CG1-CD1 3.81Å; V1080-L1084 HydrophobicContact CG1-CG 4.39Å; V1080-L1084 WeakPolarHBondContact O-CB 3.34Å; V1080-L1084 VanDerWaalsContact O-CG 3.25Å; V1080-L1084 WeakPolarHBondContact O-CG 3.5Å; V1080-L1084 PolarHBondContact O-N 2.96Å; E1081-L1084 PolarHBondContact O-N 3.13Å; E1082-L1084 PolarHBondContact O-N 2.94Å
1085	R	73.6	Confident	64.1	Low	128 Å²	128	104.7 Å²	104.7	48%	0.483	60%	0.597	S	S	.	*	S	Bend	trans	-74	128.5	171.9	-71.5	-174.4	-112.4	162.5	-162.1	109.5	E1081 E1082	E1081-R1085 WeakPolarHBondContact O-CG 3.34Å; E1081-R1085 PolarHBondContact O-N 3.41Å; E1081-R1085 VanDerWaalsContact O-N 3.15Å; E1082-R1085 PolarHBondContact O-N 3.37Å; E1082-R1085 VanDerWaalsContact O-N 3.15Å; E1082-R1085 IonicContact OE1-CZ 2.78Å; E1082-R1085 IonicContact OE1-NH1 3.96Å; E1082-R1085 PolarHBondContact OE1-NH1 2.87Å
1086	L	53.3	Low	61.9	Low	143 Å²	143	108.7 Å²	108.7	75%	0.749	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-59	136.7	166.6	-68.6	170.1	0	0	0	108.9
1087	P	61.5	Low	59.7	Low	79 Å²	79	109.6 Å²	109.6	51%	0.513	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-54.4	143.2	173.3	-26.1	34.3	0	0	0	111.6	D1089 F1090	P1087-D1089 PolarHBondContact O-N 2.87Å; P1087-F1090 HydrophobicContact CB-CD2 4.48Å; P1087-F1090 HydrophobicContact CG-CD2 4.38Å; P1087-F1090 PolarHBondContact O-N 3.35Å; P1087-F1090 VanDerWaalsContact O-N 3.15Å
1088	S	53.2	Low	57.7	Low	114 Å²	114	108.8 Å²	108.8	80%	0.797	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-23.7	174.7	45.1	0	0	0	0	113.8	F1090	S1088-F1090 VanDerWaalsContact C-N 3.33Å
1089	D	50.9	Low	55.5	Low	138 Å²	138	114.8 Å²	114.8	74%	0.738	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	0	-170.7	-49.4	-8.1	0	0	0	112	P1087 P1091	P1087-D1089 PolarHBondContact O-N 2.87Å; D1089-P1091 WeakPolarHBondContact O-CD 3.14Å
1090	F	46.8	Very low	53.4	Low	140 Å²	140	121.1 Å²	121.1	61%	0.614	70%	0.703	S	S	*	*	S	Bend	trans	-73.3	116.2	166.6	-103.5	-90.9	0	0	0	109.5	P1087 S1088 G1092	P1087-F1090 HydrophobicContact CB-CD2 4.48Å; P1087-F1090 HydrophobicContact CG-CD2 4.38Å; P1087-F1090 PolarHBondContact O-N 3.35Å; P1087-F1090 VanDerWaalsContact O-N 3.15Å; S1088-F1090 VanDerWaalsContact C-N 3.33Å; F1090-G1092 PolarHBondContact O-N 3.36Å; F1090-G1092 VanDerWaalsContact O-N 3.08Å
1091	P	47.4	Very low	51.1	Low	119 Å²	119	125.5 Å²	125.5	77%	0.773	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-62.4	118.2	174.8	26.3	-33.1	0	0	0	108.7	D1089 A1093	D1089-P1091 WeakPolarHBondContact O-CD 3.14Å; P1091-A1093 PolarHBondContact O-N 3.08Å
1092	G	41.6	Very low	49.7	Very low	66 Å²	66	127.2 Å²	127.2	68%	0.68	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-55.4	128.7	-174.2	0	0	0	0	0	111.5	F1090 V1094	F1090-G1092 PolarHBondContact O-N 3.36Å; F1090-G1092 VanDerWaalsContact O-N 3.08Å; G1092-V1094 PolarHBondContact O-N 3.08Å; G1092-V1094 VanDerWaalsContact O-N 3.09Å
1093	A	37.2	Very low	48.1	Very low	102 Å²	102	127.8 Å²	127.8	84%	0.843	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-56.8	118.8	171.2	0	0	0	0	0	108.4	P1091 A1095	P1091-A1093 PolarHBondContact O-N 3.08Å; A1093-A1095 PolarHBondContact O-N 3.15Å
1094	V	36.2	Very low	46.2	Very low	140 Å²	140	126.4 Å²	126.4	85%	0.848	77%	0.774	S	S	*	*			trans	-59.6	110.6	-177.2	177.6	0	0	0	0	108.3	G1092 S1096	G1092-V1094 PolarHBondContact O-N 3.08Å; G1092-V1094 VanDerWaalsContact O-N 3.09Å; V1094-S1096 PolarHBondContact O-N 2.89Å
1095	A	35.4	Very low	44.3	Very low	90 Å²	90	125.9 Å²	125.9	74%	0.744	78%	0.779	S	S	*	*			trans	-63.6	104.6	173.5	0	0	0	0	0	108.2	A1093 S1097	A1093-A1095 PolarHBondContact O-N 3.15Å; A1095-S1097 PolarHBondContact O-N 2.97Å; A1095-S1097 VanDerWaalsContact O-N 3.08Å
1096	S	33.5	Very low	42.4	Very low	93 Å²	93	125.8 Å²	125.8	65%	0.65	80%	0.797	S	S	*	*			trans	-63.3	110.3	-179	49.7	0	0	0	0	109.6	V1094 T1098	V1094-S1096 PolarHBondContact O-N 2.89Å; S1096-T1098 PolarHBondContact O-N 3.06Å
1097	S	37	Very low	41.7	Very low	128 Å²	128	124.7 Å²	124.7	90%	0.895	80%	0.8	S	S	*	*			trans	-75.5	55.8	178.7	45.2	0	0	0	0	112.1	A1095	A1095-S1097 PolarHBondContact O-N 2.97Å; A1095-S1097 VanDerWaalsContact O-N 3.08Å
1098	T	40.5	Very low	40.3	Very low	105 Å²	105	127.9 Å²	127.9	64%	0.644	82%	0.821	S	S	*	*			trans	-119.5	82.5	174.3	52.9	0	0	0	0	109.2	S1096	S1096-T1098 PolarHBondContact O-N 3.06Å
1099	D	32.6	Very low	39.3	Very low	164 Å²	164	129 Å²	129	88%	0.877	82%	0.823	S	S	*	*				-156.1	123.2	127.9	-95.4	-29.1	0	0	0	110.2
1100	K	37.3	Very low	38.4	Very low	217 Å²	217	128.3 Å²	128.3	94%	0.943	83%	0.83	S	S	*	*			trans	-122.7	102.5	165.3	-87.2	-171.4	175	-176.5	0	106.7
1101	A	34.8	Very low	37.6	Very low	175 Å²	175	127.2 Å²	127.2	100%	1.446	85%	0.85	S	S	*	*			trans	-150.1	0	166.6	0	0	0	0	0	108.1

Retrieved 1,101 of 1,101 residues in 400.9 ms (Link to these results)

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