A0A087X5B7_POEFO Loading...

Structural maintenance of chromosomes protein 6

Core component of the SMC5-SMC6 complex, a complex involved in repair of DNA double-strand breaks by homologous recombination. The complex may promote sister chromatid homologous recombination by recruiting the SMC1-SMC3 cohesin complex to double-strand breaks. The complex is required for telomere maintenance via recombination and mediates sumoylation of shelterin complex (telosome) components.

AlphaFold DB , UniProt , Accession A0A087X5B7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,092 aa.

						>A0A087X5B7_POEFO|A0A087X5B7
MSKRRNTAVSETPNKRLRPENGENEDDEDQNIAESEQGDSALSKRFQCSGDVVSDAGIVESITLKNFMCHSLLGPFAFGSNVNFVVGNNGSGKSAILTALIVALGGNAQATNRGSSLKGFVKEGESSADVSITLRNKGRDAYKLDVYGPAITIDLRITREGLRTYKLKSNGGQVISTKKEELISILDNFNIQVNNPVSVLTQEMSKYFLHSKGEGDKYKFFMKATQLEQMREDFIYIKATKQVTEEKVEQHGECLKDLKRKYLEKEDRYKSLASLGEMHTKLEELQKQMAWSLVTEMERELEPVKEKLQADKRSTEKYDEKVDEWKNKVEQSEKKYKQIQEQLEGITQQVQELQPKCAELKAEAQKRNSLLKSCELTVHRCRTNLRDLEKDKAQLTSRIKDLTLSISQTTGAESQARAERMAQIQAEQENLDLHISTLGQQIDLFQHASNRAKEEQGKMKMEYNGLKKSIEANKRKLQTMKSSRSNRLRRFGEHMPALLSAIEEANSKGHFRHKPRGPLGYLIGLKDPELALAVEVCLKYLLMAFTCDNYDDEKVLKSLMAKVYRSGQRPTIITSQFLHHVHDTRRRAVNHPQYPSVLQALDIEDPIVANCLIDQKNIESILLIKNRTEARRIMQGKNPPANCIQAFSKDGDQIFTNRNYSSDQTRPNYLSGDVEEEIRHLQRELENQAGQEARFQQQMRKLDEDIKHNEGLLRKVLMEQKTTKDKATKLQLELTDLKNVEEPQSEDLRPLEEELQEIVAKISSKRAEYEEAKTKMANLKADYDKADQEYKQHKENISTITEEADSVKDELSKTDQEVMKCKHHKKHYDDKRSAHLRNIHTLEAQLKNKEANLAASVAKASEICPERLEVRRTAKSIDSEINRLKVKISTQQEQQGDREEIVRQYHEALESYKNMSQQMRSLNSFIRSLDTVMNYRLQVYADLRKFLSARCKYYFNSMLAQRGYSGSMTFDHKNETLTISVQPGQGNKADLNDMRSLSGGERSFSTVCFVLSLWAITESPFRCLDEFDVYMDMVNRRISMDMMLKVAASQRYRQFIFLTPQNMSSLPVSKTIRILRLKDPDRGQNNFRSEDQ
					

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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	29.5	Very low	26.5	Very low	250 Å²	250	167.5 Å²	167.5	100%	1.232	87%	0.866	S	S	*	*				0	127.6	0	-63	-161.2	-93.1	0	0	107.2
2	S	27.6	Very low	26.5	Very low	108 Å²	108	164.8 Å²	164.8	76%	0.755	86%	0.863	S	S	*	*			cis	-156.2	130	0.6	-163.9	0	0	0	0	108
3	K	28.3	Very low	26.8	Very low	188 Å²	188	162 Å²	162	82%	0.817	86%	0.861	S	S	*	*			trans	42	116	145.9	-66.7	176.7	179.4	176.3	0	120.9
4	R	27.6	Very low	26.8	Very low	235 Å²	235	162.1 Å²	162.1	89%	0.887	86%	0.861	S	S	*	*				65.5	124.3	96	-85	-174.6	177.4	177.9	-0.2	113.7
5	R	27	Very low	26.9	Very low	228 Å²	228	164.4 Å²	164.4	86%	0.86	86%	0.861	S	S	*	*				-173.1	136.6	64.9	-119.2	171.5	-179.8	171.4	-1.4	109.4
6	N	23.5	Very low	26.9	Very low	170 Å²	170	169.8 Å²	169.8	91%	0.909	87%	0.867	S	S	*	*			trans	-117.8	131.6	161.7	-110.6	-3.4	0	0	0	107.5
7	T	25.1	Very low	26.8	Very low	134 Å²	134	169.9 Å²	169.9	82%	0.822	87%	0.869	S	S	*	*			trans	-130	128	169.1	33.7	0	0	0	0	108.5
8	A	26.3	Very low	26.7	Very low	95 Å²	95	173.8 Å²	173.8	79%	0.785	87%	0.87	S	S	*	*			trans	-85.1	152.5	-179.9	0	0	0	0	0	112.2
9	V	25.7	Very low	27	Very low	144 Å²	144	171.3 Å²	171.3	87%	0.873	87%	0.868	S	S	*	*			trans	-142.2	143.1	144.4	179.3	0	0	0	0	108.2
10	S	25	Very low	26.9	Very low	99 Å²	99	172.3 Å²	172.3	69%	0.692	87%	0.869	S	S	*	*			trans	-62.8	150	-172.5	48.7	0	0	0	0	117
11	E	25.8	Very low	27	Very low	192 Å²	192	172.3 Å²	172.3	90%	0.897	87%	0.872	S	S	*	*				-162.1	136.8	123.8	-106.4	172.1	-161.2	0	0	111.3
12	T	26.5	Very low	26.9	Very low	135 Å²	135	164.1 Å²	164.1	83%	0.828	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-77.1	142.4	-169.9	42.8	0	0	0	0	114.3
13	P	30.7	Very low	27	Very low	128 Å²	128	167.7 Å²	167.7	83%	0.831	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-101.9	124.3	165	33.7	-24.6	0	0	0	112
14	N	26.2	Very low	27	Very low	163 Å²	163	166.4 Å²	166.4	87%	0.872	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-79.1	144.8	174.1	-114.3	-22.1	0	0	0	111.8
15	K	28.3	Very low	27.1	Very low	197 Å²	197	163.8 Å²	163.8	86%	0.857	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-58.1	135.5	-173.9	-71.4	166.1	171.9	172.1	0	113.8
16	R	27	Very low	27.2	Very low	251 Å²	251	161 Å²	161	95%	0.947	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-87.5	129.7	160.1	-83.2	-179	174.3	173.5	-2.1	110.3
17	L	26.4	Very low	27.5	Very low	172 Å²	172	160.7 Å²	160.7	90%	0.901	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-85.7	150	173.6	-82.5	150.2	0	0	0	111.1
18	R	25	Very low	27.6	Very low	239 Å²	239	162.8 Å²	162.8	90%	0.902	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-72	155	175.1	-76	173.2	168.9	171.7	-5.1	111.4
19	P	31.1	Very low	27.8	Very low	127 Å²	127	165 Å²	165	83%	0.825	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-87.8	138.7	168.4	29.9	-21.4	0	0	0	111.8
20	E	26.2	Very low	28.1	Very low	191 Å²	191	166 Å²	166	89%	0.893	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-89.8	145.9	167.4	-79.1	-177.9	152.2	0	0	110.7
21	N	28.5	Very low	28.1	Very low	173 Å²	173	169.4 Å²	169.4	93%	0.925	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-74.1	141.5	171.5	-72	-23.1	0	0	0	110.4
22	G	26.9	Very low	28.3	Very low	77 Å²	77	168.1 Å²	168.1	79%	0.794	86%	0.859	S	S	*	*			trans	-142.6	118	163.5	0	0	0	0	0	109.1
23	E	29.7	Very low	28.4	Very low	184 Å²	184	166.5 Å²	166.5	86%	0.86	86%	0.859	S	S	*	*			trans	-68.1	146	167.7	-65	168.9	158.5	0	0	109.7
24	N	28.5	Very low	28.4	Very low	160 Å²	160	169.4 Å²	169.4	86%	0.856	86%	0.861	S	S	*	*			trans	-173.3	149.2	136	-89.1	-18.4	0	0	0	111.3
25	E	30.6	Very low	28.4	Very low	181 Å²	181	167.4 Å²	167.4	85%	0.846	86%	0.86	S	S	*	*			trans	-69.9	149.2	-168	-60.4	158.1	149.7	0	0	113.6
26	D	29.3	Very low	28.7	Very low	170 Å²	170	167.1 Å²	167.1	91%	0.909	86%	0.861	S	S	*	*			trans	-129.7	116.7	162.4	-84.6	-32.6	0	0	0	108.9
27	D	28.3	Very low	28.9	Very low	163 Å²	163	164.8 Å²	164.8	87%	0.872	86%	0.861	S	S	*	*			trans	-123.9	155.2	164	-117.5	-19.9	0	0	0	107.3
28	E	28.2	Very low	28.9	Very low	178 Å²	178	159.8 Å²	159.8	83%	0.832	85%	0.852	S	S	*	*			trans	93	98.3	167.2	-56.3	-166.3	171	0	0	120.7
29	D	29.8	Very low	29.2	Very low	141 Å²	141	156.4 Å²	156.4	75%	0.754	85%	0.852	S	S	*	*				50.9	125.8	111.7	-84	-28.9	0	0	0	124.4
30	Q	31.3	Very low	29.1	Very low	166 Å²	166	155.5 Å²	155.5	78%	0.776	85%	0.848	S	S	*	*			trans	23.3	122	134.8	-58.7	-178.9	19	0	0	120
31	N	25.9	Very low	29.2	Very low	170 Å²	170	150.6 Å²	150.6	91%	0.909	84%	0.841	S	S	*	*				-158.4	128.5	129.7	-99.7	-42.1	0	0	0	112.8
32	I	30.9	Very low	29.3	Very low	165 Å²	165	149.9 Å²	149.9	85%	0.846	84%	0.836	S	S	*	*			trans	-92	129	169.7	-67.1	168.7	0	0	0	107.2
33	A	27	Very low	29.4	Very low	100 Å²	100	151.6 Å²	151.6	83%	0.826	84%	0.835	S	S	*	*			trans	-152.1	133.8	157.8	0	0	0	0	0	111.4
34	E	31.4	Very low	29.2	Very low	190 Å²	190	152.3 Å²	152.3	89%	0.888	84%	0.836	S	S	*	*			trans	-66.7	150.4	-179.3	-63	168.3	144.1	0	0	113
35	S	27	Very low	29.1	Very low	120 Å²	120	155.9 Å²	155.9	84%	0.839	84%	0.837	S	S	*	*			trans	-153.6	109.9	149.2	47.8	0	0	0	0	111.6
36	E	33	Very low	29.1	Very low	191 Å²	191	156.8 Å²	156.8	89%	0.893	84%	0.839	S	S	*	*			trans	-70.2	116.6	156.5	-70.5	-177.3	146.9	0	0	108.8
37	Q	31.1	Very low	29.1	Very low	202 Å²	202	157.8 Å²	157.8	94%	0.944	84%	0.838	S	S	*	*			trans	176.6	110.8	149.5	-101.2	166.4	27.7	0	0	109.4
38	G	28.2	Very low	29.1	Very low	68 Å²	68	156.2 Å²	156.2	70%	0.701	84%	0.838	S	S	*	*			trans	-178.9	23.8	177	0	0	0	0	0	117.2	S40	G38-S40 VanDerWaalsContact C-N 3.31Å; G38-S40 PolarHBondContact O-N 3.35Å
39	D	31.5	Very low	29.4	Very low	168 Å²	168	154.1 Å²	154.1	90%	0.898	84%	0.843	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	31	-172.9	-147.7	17.1	0	0	0	114.6
40	S	29	Very low	29.4	Very low	107 Å²	107	149.7 Å²	149.7	75%	0.748	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	0.3	178.3	91.3	0	0	0	0	116.6	G38	G38-S40 VanDerWaalsContact C-N 3.31Å; G38-S40 PolarHBondContact O-N 3.35Å
41	A	27.5	Very low	29.6	Very low	89 Å²	89	149.6 Å²	149.6	74%	0.736	84%	0.836	S	S	*	*	S	Bend	trans	-93.3	-10.4	-176.2	0	0	0	0	0	115.2
42	L	30.2	Very low	30.2	Very low	158 Å²	158	143.2 Å²	143.2	83%	0.827	80%	0.803	S	S	*	*	S	Bend	trans	-88	-11.2	-174.1	-82.2	158.6	0	0	0	114.9
43	S	28.6	Very low	30.9	Very low	112 Å²	112	140 Å²	140	78%	0.783	79%	0.79	S	S	*	*	S	Bend	trans	-94.6	-2.2	-170	-53	0	0	0	0	115.4
44	K	25.6	Very low	32.1	Very low	200 Å²	200	135.2 Å²	135.2	87%	0.87	75%	0.751	S	S	*	*	S	Bend	trans	-111.2	15.4	-171	-88.5	-175	178.4	177.5	0	117
45	R	27.3	Very low	33.7	Very low	234 Å²	234	129.1 Å²	129.1	88%	0.883	73%	0.725	S	S	*	*	S	Bend	trans	-111.4	6.4	178.9	-100.9	-176.4	-178.9	177.3	1.6	117.3
46	F	30.1	Very low	36.3	Very low	200 Å²	200	123.8 Å²	123.8	88%	0.877	69%	0.688	S	S	*	*			trans	-114.8	68.3	178.3	-72.9	-78.2	0	0	0	112.9
47	Q	29.2	Very low	38.9	Very low	191 Å²	191	114.7 Å²	114.7	89%	0.893	65%	0.646	S	S	*	*			trans	-132	92.5	153.8	-82.4	-175.8	-8.1	0	0	108.7
48	C	28	Very low	41.8	Very low	131 Å²	131	105.2 Å²	105.2	89%	0.885	60%	0.601	S	S	*	*			trans	-148.3	107.8	153.6	-99.3	0	0	0	0	108.2	G50	C48-G50 PolarHBondContact O-N 2.72Å
49	S	34.8	Very low	44.9	Very low	133 Å²	133	102 Å²	102	93%	0.93	57%	0.568	S	S	*	*			trans	-69	102.8	168.4	46.9	0	0	0	0	109.8
50	G	30.2	Very low	47.8	Very low	48 Å²	48	96.3 Å²	96.3	50%	0.495	54%	0.536	S	S	.	.			trans	-148.1	137.7	166.4	0	0	0	0	0	109.7	C48 V52 R1051	C48-G50 PolarHBondContact O-N 2.72Å; G50-V52 PolarHBondContact O-N 3.43Å; G50-R1051 PolarHBondContact O-NH2 3.42Å
51	D	35.3	Very low	50.9	Low	164 Å²	164	92.6 Å²	92.6	88%	0.877	51%	0.51	S	S	*	.			trans	-55.5	120.1	176.2	-82	-35.7	0	0	0	110.2	V53	D51-V53 PolarHBondContact O-N 3.43Å
52	V	39.3	Very low	54.1	Low	37 Å²	37	88.3 Å²	88.3	22%	0.224	48%	0.475	C	S	.	.			trans	-84.6	110.7	179	158.1	0	0	0	0	109.1	G50 R1051 Y1052	G50-V52 PolarHBondContact O-N 3.43Å; V52-R1051 HydrophobicContact CB-CG 4.01Å; V52-R1051 VanDerWaalsContact CB-NE 3.25Å; V52-R1051 VanDerWaalsContact CB-NH2 3.27Å; V52-R1051 HydrophobicContact CG1-CB 4.12Å; V52-R1051 HydrophobicContact CG1-CG 3.76Å; V52-R1051 HydrophobicContact CG2-CG 4.3Å; V52-Y1052 HydrophobicContact CB-CE1 4.28Å; V52-Y1052 HydrophobicContact CG1-CD1 3.56Å; V52-Y1052 HydrophobicContact CG1-CD2 4.41Å; V52-Y1052 HydrophobicContact CG1-CE1 3.31Å; V52-Y1052 HydrophobicContact CG1-CE2 4.22Å; V52-Y1052 HydrophobicContact CG1-CG 4.09Å; V52-Y1052 HydrophobicContact CG2-CE1 4.24Å
53	V	45.1	Very low	57.1	Low	96 Å²	96	82.7 Å²	82.7	58%	0.582	45%	0.447	S	S	*	.			trans	-81.7	109.6	167.1	-177.2	0	0	0	0	107.1	D51 Y1052	D51-V53 PolarHBondContact O-N 3.43Å; V53-Y1052 WeakPolarHBondContact O-CD1 3.37Å; V53-Y1052 WeakPolarHBondContact O-CE1 3.37Å
54	S	51	Low	60.3	Low	1 Å²	1	77.4 Å²	77.4	1%	0.007	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-64.6	140.7	171.6	160.4	0	0	0	0	111.4	I58 Y1052	S54-I58 WeakPolarHBondContact OG-CG2 3.44Å; S54-Y1052 WeakPolarHBondContact CB-O 3.37Å; S54-Y1052 PolarHBondContact OG-O 3.36Å
55	D	66.9	Low	63.6	Low	61 Å²	61	72.8 Å²	72.8	33%	0.326	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.9	160.4	-176.8	-61.3	-51.1	0	0	0	113.4
56	A	81.6	Confident	66.7	Low	9 Å²	9	62.5 Å²	62.5	7%	0.074	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	151.8	-176.9	0	0	0	0	0	113.8	K137 F189	A56-K137 WeakPolarHBondContact CA-O 3.43Å; A56-K137 WeakPolarHBondContact CB-O 3.42Å; A56-K137 PolarHBondContact N-O 3.48Å; A56-K137 VanDerWaalsContact N-O 3.16Å; A56-F189 HydrophobicContact CB-CD1 3.79Å; A56-F189 HydrophobicContact CB-CE1 3.51Å; A56-F189 HydrophobicContact CB-CZ 4.28Å
57	G	86.5	Confident	69.7	Low	0 Å²	0	53 Å²	53	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	-2	173	0	0	0	0	0	116.7	R135	G57-R135 PolarHBondContact N-O 3.48Å
58	I	91.1	Very high	72.5	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	28%	0.278	C	S	.	.			trans	-73.6	153.8	172.1	68.5	166.2	0	0	0	112.2	S54 L134 R135 Q1054	S54-I58 WeakPolarHBondContact OG-CG2 3.44Å; I58-L134 WeakPolarHBondContact O-CA 3.29Å; I58-R135 HydrophobicContact CG1-CB 3.68Å; I58-R135 HydrophobicContact CG1-CG 4.45Å; I58-R135 PolarHBondContact O-N 3.47Å; I58-Q1054 HydrophobicContact CB-CB 4.2Å; I58-Q1054 HydrophobicContact CG2-CB 3.93Å
59	V	93.6	Very high	75.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	118.7	178.5	-173.7	0	0	0	0	109.4	F78 L100 I132 L134 F1021 Q1054	V59-F78 HydrophobicContact CB-CD2 4.26Å; V59-F78 HydrophobicContact CG1-CD2 3.71Å; V59-F78 HydrophobicContact CG1-CE2 3.88Å; V59-F78 WeakPolarHBondContact O-CB 3.39Å; V59-L100 HydrophobicContact CG1-CD2 4.15Å; V59-L100 HydrophobicContact CG2-CD2 4.09Å; V59-I132 HydrophobicContact CG1-CG2 4.09Å; V59-L134 HydrophobicContact CG2-CD2 4.05Å; V59-F1021 HydrophobicContact CG2-CD1 3.85Å; V59-F1021 HydrophobicContact CG2-CE1 3.85Å; V59-F1021 HydrophobicContact CG2-CG 4.2Å; V59-F1021 HydrophobicContact CG2-CZ 4.22Å; V59-Q1054 PolarHBondContact O-NE2 3.03Å
60	E	92.3	Very high	77.8	Confident	50 Å²	50	39.3 Å²	39.3	23%	0.234	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-42	175.9	-63.6	-160.3	141.6	0	0	111.7	A77 F78 T133 R135	E60-A77 CarbonylContact O-C 3.57Å; E60-A77 WeakPolarHBondContact O-CA 3.46Å; E60-F78 PolarHBondContact O-N 3.13Å; E60-T133 HydrophobicContact CB-CG2 4.42Å; E60-T133 PolarHBondContact N-O 3.25Å; E60-R135 HydrophobicContact CG-CB 3.93Å; E60-R135 IonicContact OE1-CZ 3.76Å; E60-R135 IonicContact OE1-NE 2.79Å; E60-R135 PolarHBondContact OE1-NE 3.24Å; E60-R135 IonicContact OE1-NH2 2.66Å; E60-R135 PolarHBondContact OE1-NH2 3.15Å
61	S	93.9	Very high	80.6	Confident	28 Å²	28	39.9 Å²	39.9	20%	0.196	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.7	176.5	81	0	0	0	0	113.9	F76 I132 T133	S61-F76 CarbonylContact C-O 3.6Å; S61-F76 WeakPolarHBondContact CA-O 3.38Å; S61-F76 WeakPolarHBondContact CB-O 3.19Å; S61-I132 WeakPolarHBondContact O-CA 3.27Å; S61-T133 PolarHBondContact N-O 3.1Å; S61-T133 PolarHBondContact O-N 2.86Å; S61-T133 PolarHBondContact OG-OG1 3.39Å
62	I	94.9	Very high	83.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	139.7	171.5	-170.7	167.1	0	0	0	111.4	L64 F76 F78 I96 A99 L100 S131 I132	I62-L64 HydrophobicContact CD1-CD2 3.93Å; I62-L64 HydrophobicContact CG1-CD2 3.87Å; I62-F76 HydrophobicContact CG2-CB 4.09Å; I62-F76 HydrophobicContact CG2-CD2 4.22Å; I62-F76 PolarHBondContact N-O 3.25Å; I62-F76 VanDerWaalsContact N-O 3.07Å; I62-F76 PolarHBondContact O-N 2.88Å; I62-F78 HydrophobicContact CB-CE2 4.23Å; I62-F78 HydrophobicContact CG2-CE2 3.52Å; I62-F78 HydrophobicContact CG2-CZ 3.9Å; I62-I96 HydrophobicContact CD1-CG2 4.41Å; I62-I96 HydrophobicContact CG2-CG2 4.11Å; I62-A99 HydrophobicContact CD1-CB 4.07Å; I62-L100 HydrophobicContact CD1-CD2 3.78Å; I62-L100 HydrophobicContact CD1-CG 3.74Å; I62-S131 CarbonylContact C-O 3.5Å; I62-S131 WeakPolarHBondContact CA-O 3.29Å; I62-I132 HydrophobicContact CD1-CD1 4.34Å; I62-I132 HydrophobicContact CD1-CG1 3.99Å; I62-I132 HydrophobicContact CG1-CG1 3.96Å
63	T	94.8	Very high	85.5	Confident	40 Å²	40	36.8 Å²	36.8	25%	0.245	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.1	174.9	-51.6	0	0	0	0	110.1	L72 P75 S131	T63-L72 HydrophobicContact CG2-CD1 4.37Å; T63-P75 WeakPolarHBondContact OG1-CA 3.48Å; T63-P75 WeakPolarHBondContact OG1-CB 3.43Å; T63-S131 PolarHBondContact N-O 2.86Å; T63-S131 PolarHBondContact O-N 2.83Å
64	L	94.6	Very high	87.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.7	-179.7	-43.1	179.7	0	0	0	109.7	I62 F67 L72 L73 A95 I96 A99 V130	I62-L64 HydrophobicContact CD1-CD2 3.93Å; I62-L64 HydrophobicContact CG1-CD2 3.87Å; L64-F67 HydrophobicContact CB-CB 4.1Å; L64-F67 HydrophobicContact CD1-CD1 4.26Å; L64-L72 CarbonylContact O-C 3.51Å; L64-L72 WeakPolarHBondContact O-CA 3.31Å; L64-L73 HydrophobicContact CB-CB 4Å; L64-L73 HydrophobicContact CD1-CB 4.14Å; L64-L73 HydrophobicContact CD1-CD1 4.13Å; L64-L73 HydrophobicContact CG-CB 4.25Å; L64-L73 PolarHBondContact N-O 2.79Å; L64-L73 PolarHBondContact O-N 2.92Å; L64-A95 HydrophobicContact CD1-CB 4.49Å; L64-I96 HydrophobicContact CD1-CG1 4.33Å; L64-A99 HydrophobicContact CD1-CB 3.94Å; L64-A99 HydrophobicContact CD2-CB 3.18Å; L64-A99 HydrophobicContact CG-CB 4.21Å; L64-V130 HydrophobicContact CD2-CB 4.31Å; L64-V130 HydrophobicContact CD2-CG1 3.74Å; L64-V130 HydrophobicContact CD2-CG2 4.02Å
65	K	94.5	Very high	89	Confident	103 Å²	103	38.3 Å²	38.3	45%	0.448	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.5	174.9	-174.6	-175.8	177.4	-174.3	0	109.8	F67 S71 L72 A128 D129	K65-F67 PolarHBondContact O-N 2.76Å; K65-S71 CarbonylContact C-O 3.55Å; K65-S71 WeakPolarHBondContact CA-O 3.44Å; K65-L72 HydrophobicContact CB-CD1 4.32Å; K65-A128 WeakPolarHBondContact O-CA 3.47Å; K65-D129 HydrophobicContact CB-CB 4.28Å; K65-D129 PolarHBondContact N-O 2.71Å; K65-D129 PolarHBondContact O-N 3.38Å
66	N	93.8	Very high	90.1	Very high	18 Å²	18	36.9 Å²	36.9	10%	0.096	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.2	37.1	-179.9	-63.5	-12.7	0	0	0	113.4	H70 S71 K122 E125 S127 A128	N66-H70 CarbonylContact C-O 3.57Å; N66-H70 VanDerWaalsContact CA-O 3.32Å; N66-H70 WeakPolarHBondContact CA-O 3.37Å; N66-H70 PolarHBondContact N-O 2.87Å; N66-S71 PolarHBondContact N-O 2.59Å; N66-S71 PolarHBondContact OD1-O 3.31Å; N66-K122 HydrophobicContact CB-CB 4.37Å; N66-K122 WeakPolarHBondContact O-CB 3.45Å; N66-K122 PolarHBondContact O-N 2.96Å; N66-E125 HydrophobicContact CB-CB 4.07Å; N66-E125 HydrophobicContact CB-CG 3.92Å; N66-E125 VanDerWaalsContact ND2-CD 3.33Å; N66-E125 PolarHBondContact ND2-OE2 3.43Å; N66-S127 WeakPolarHBondContact CB-O 3.15Å; N66-A128 WeakPolarHBondContact O-CB 3.41Å
67	F	91.8	Very high	90.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.6	-172.8	-168.4	-92.4	0	0	0	110.1	L64 K65 C69 H70 T98 A99 F120 A128 V130 I157	L64-F67 HydrophobicContact CB-CB 4.1Å; L64-F67 HydrophobicContact CD1-CD1 4.26Å; K65-F67 PolarHBondContact O-N 2.76Å; F67-C69 PolarHBondContact O-N 2.99Å; F67-H70 PolarHBondContact N-O 2.82Å; F67-H70 PolarHBondContact O-N 2.85Å; F67-H70 VanDerWaalsContact O-N 3.09Å; F67-T98 HydrophobicContact CE1-CG2 4.36Å; F67-T98 HydrophobicContact CZ-CG2 4.23Å; F67-A99 HydrophobicContact CD1-CB 4.34Å; F67-A99 HydrophobicContact CE1-CB 3.83Å; F67-A99 HydrophobicContact CZ-CB 3.98Å; F67-F120 CarbonylContact C-O 3.54Å; F67-F120 WeakPolarHBondContact CA-O 3.4Å; F67-F120 HydrophobicContact CD2-CB 4.32Å; F67-F120 HydrophobicContact CE2-CB 3.73Å; F67-F120 HydrophobicContact CE2-CG 4.43Å; F67-F120 HydrophobicContact CZ-CB 3.9Å; F67-F120 HydrophobicContact CZ-CG 4.2Å; F67-A128 HydrophobicContact CB-CB 4.33Å; F67-A128 HydrophobicContact CD2-CB 3.98Å; F67-V130 HydrophobicContact CD2-CG2 3.55Å; F67-V130 HydrophobicContact CE2-CG2 3.69Å; F67-V130 HydrophobicContact CG-CG2 4.24Å; F67-V130 HydrophobicContact CZ-CG2 4.48Å; F67-I157 HydrophobicContact CE2-CD1 4.05Å
68	M	89.3	Confident	90.7	Very high	42 Å²	42	39 Å²	39	21%	0.207	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	-129.6	-170.5	-63.2	-178.3	165.7	0	0	111.4	H70 A95 T98 R113 F120 K122	M68-H70 PolarHBondContact O-N 3.47Å; M68-A95 HydrophobicContact SD-CB 3.86Å; M68-T98 HydrophobicContact CE-CG2 3.33Å; M68-R113 HydrophobicContact CE-CB 4.17Å; M68-F120 HydrophobicContact CE-CD1 3.41Å; M68-F120 VanDerWaalsContact CE-CD1 3.41Å; M68-F120 HydrophobicContact CE-CE1 3.58Å; M68-F120 HydrophobicContact CG-CD1 4.3Å; M68-F120 PolarHBondContact N-O 3.27Å; M68-K122 WeakPolarHBondContact O-CA 3.32Å; M68-K122 WeakPolarHBondContact O-CB 3.49Å; M68-K122 VanDerWaalsContact O-CG 3.3Å; M68-K122 WeakPolarHBondContact O-CG 3.3Å
69	C	86.1	Confident	90.5	Very high	93 Å²	93	39.7 Å²	39.7	63%	0.628	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	5.2	179.3	51.9	0	0	0	0	114.3	F67	F67-C69 PolarHBondContact O-N 2.99Å
70	H	87.9	Confident	90.1	Very high	32 Å²	32	42 Å²	42	15%	0.148	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127	-169.7	-56	-79.2	0	0	0	113	N66 F67 M68 L73 G92	N66-H70 CarbonylContact C-O 3.57Å; N66-H70 VanDerWaalsContact CA-O 3.32Å; N66-H70 WeakPolarHBondContact CA-O 3.37Å; N66-H70 PolarHBondContact N-O 2.87Å; F67-H70 PolarHBondContact N-O 2.82Å; F67-H70 PolarHBondContact O-N 2.85Å; F67-H70 VanDerWaalsContact O-N 3.09Å; M68-H70 PolarHBondContact O-N 3.47Å; H70-L73 HydrophobicContact CB-CD1 3.53Å; H70-L73 HydrophobicContact CB-CG 3.88Å; H70-L73 WeakPolarHBondContact CD2-CD1 3.41Å; H70-G92 WeakPolarHBondContact NE2-CA 3.36Å
71	S	88.4	Confident	90	Very high	60 Å²	60	39.8 Å²	39.8	42%	0.42	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-43.1	174.3	-55.6	0	0	0	0	111.9	K65 N66 K122	K65-S71 CarbonylContact C-O 3.55Å; K65-S71 WeakPolarHBondContact CA-O 3.44Å; N66-S71 PolarHBondContact N-O 2.59Å; N66-S71 PolarHBondContact OD1-O 3.31Å; S71-K122 PolarHBondContact OG-NZ 3.07Å
72	L	89.8	Confident	89.8	Confident	118 Å²	118	38.5 Å²	38.5	62%	0.618	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-151	126.1	176.6	-173.4	70.4	0	0	0	109.8	T63 L64 K65	T63-L72 HydrophobicContact CG2-CD1 4.37Å; L64-L72 CarbonylContact O-C 3.51Å; L64-L72 WeakPolarHBondContact O-CA 3.31Å; K65-L72 HydrophobicContact CB-CD1 4.32Å
73	L	88.6	Confident	89.6	Confident	18 Å²	18	38.5 Å²	38.5	9%	0.094	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.3	176.1	-100.2	170.2	0	0	0	108.7	L64 H70 F76 A95	L64-L73 HydrophobicContact CB-CB 4Å; L64-L73 HydrophobicContact CD1-CB 4.14Å; L64-L73 HydrophobicContact CD1-CD1 4.13Å; L64-L73 HydrophobicContact CG-CB 4.25Å; L64-L73 PolarHBondContact N-O 2.79Å; L64-L73 PolarHBondContact O-N 2.92Å; H70-L73 HydrophobicContact CB-CD1 3.53Å; H70-L73 HydrophobicContact CB-CG 3.88Å; H70-L73 WeakPolarHBondContact CD2-CD1 3.41Å; L73-F76 HydrophobicContact CB-CE2 4.15Å; L73-F76 HydrophobicContact CD2-CE2 3.87Å; L73-F76 HydrophobicContact CD2-CZ 3.75Å; L73-A95 HydrophobicContact CD1-CB 4.32Å
74	G	83.9	Confident	89.3	Confident	26 Å²	26	36.7 Å²	36.7	27%	0.268	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	101.2	-169.6	-177.3	0	0	0	0	0	113.4	F76	G74-F76 VanDerWaalsContact CA-CE2 3.5Å
75	P	85.1	Confident	89.1	Confident	103 Å²	103	36.7 Å²	36.7	67%	0.669	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	cis	-69.4	128.7	5.4	27.5	-34.3	0	0	0	112.7	T63	T63-P75 WeakPolarHBondContact OG1-CA 3.48Å; T63-P75 WeakPolarHBondContact OG1-CB 3.43Å
76	F	89	Confident	88.8	Confident	32 Å²	32	32.3 Å²	32.3	14%	0.14	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.1	171.4	-60.9	-70.6	0	0	0	109.3	S61 I62 L73 G74 I96 L1077	S61-F76 CarbonylContact C-O 3.6Å; S61-F76 WeakPolarHBondContact CA-O 3.38Å; S61-F76 WeakPolarHBondContact CB-O 3.19Å; I62-F76 HydrophobicContact CG2-CB 4.09Å; I62-F76 HydrophobicContact CG2-CD2 4.22Å; I62-F76 PolarHBondContact N-O 3.25Å; I62-F76 VanDerWaalsContact N-O 3.07Å; I62-F76 PolarHBondContact O-N 2.88Å; L73-F76 HydrophobicContact CB-CE2 4.15Å; L73-F76 HydrophobicContact CD2-CE2 3.87Å; L73-F76 HydrophobicContact CD2-CZ 3.75Å; G74-F76 VanDerWaalsContact CA-CE2 3.5Å; F76-I96 HydrophobicContact CD2-CD1 3.84Å; F76-I96 HydrophobicContact CD2-CG1 4.33Å; F76-I96 HydrophobicContact CE2-CD1 3.66Å; F76-I96 HydrophobicContact CE2-CG1 4.18Å; F76-I96 HydrophobicContact CZ-CD1 4.23Å; F76-L1077 HydrophobicContact CD1-CD2 4.28Å; F76-L1077 HydrophobicContact CE1-CD2 3.37Å; F76-L1077 HydrophobicContact CE2-CD2 4.17Å; F76-L1077 HydrophobicContact CZ-CD2 3.3Å
77	A	90.5	Very high	88.4	Confident	39 Å²	39	31.8 Å²	31.8	32%	0.322	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.9	173.3	0	0	0	0	0	109.8	E60 R1073	E60-A77 CarbonylContact O-C 3.57Å; E60-A77 WeakPolarHBondContact O-CA 3.46Å; A77-R1073 PolarHBondContact O-NE 3.34Å; A77-R1073 VanDerWaalsContact O-NE 3.09Å; A77-R1073 PolarHBondContact O-NH1 3.17Å; A77-R1073 PolarHBondContact O-NH2 3.01Å
78	F	91.1	Very high	87.9	Confident	13 Å²	13	36 Å²	36	6%	0.057	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-87.8	153.9	175.8	-63.1	-78.2	0	0	0	110.8	V59 E60 I62 N83 V85 I96 I1056 R1073 L1075	V59-F78 HydrophobicContact CB-CD2 4.26Å; V59-F78 HydrophobicContact CG1-CD2 3.71Å; V59-F78 HydrophobicContact CG1-CE2 3.88Å; V59-F78 WeakPolarHBondContact O-CB 3.39Å; E60-F78 PolarHBondContact O-N 3.13Å; I62-F78 HydrophobicContact CB-CE2 4.23Å; I62-F78 HydrophobicContact CG2-CE2 3.52Å; I62-F78 HydrophobicContact CG2-CZ 3.9Å; F78-N83 HydrophobicContact CD1-CB 3.97Å; F78-V85 HydrophobicContact CE1-CG2 4.06Å; F78-I96 HydrophobicContact CZ-CG2 4.25Å; F78-I1056 HydrophobicContact CD1-CD1 4.22Å; F78-I1056 HydrophobicContact CD1-CG1 4.41Å; F78-I1056 HydrophobicContact CE1-CD1 4.11Å; F78-I1056 HydrophobicContact CE1-CG1 4.46Å; F78-I1056 HydrophobicContact CE1-CG2 4.05Å; F78-I1056 HydrophobicContact CZ-CD1 4.33Å; F78-R1073 PolarHBondContact O-NH1 3.35Å; F78-L1075 HydrophobicContact CD1-CD1 3.63Å; F78-L1075 HydrophobicContact CE1-CD1 3.71Å; F78-L1075 HydrophobicContact CG-CD1 4.49Å
79	G	87.7	Confident	87.5	Confident	18 Å²	18	39.3 Å²	39.3	19%	0.186	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-84.6	167.3	166.9	0	0	0	0	0	111.6	N81 N83 Q1054	G79-N81 PolarHBondContact O-N 3.09Å; G79-N83 PolarHBondContact N-OD1 3.04Å; G79-N83 PolarHBondContact O-ND2 2.86Å; G79-Q1054 PolarHBondContact O-NE2 3.04Å
80	S	84.7	Confident	87	Confident	47 Å²	47	37.2 Å²	37.2	33%	0.329	24%	0.239	S	C	.	.	S	Bend	trans	-75.2	-17.6	-171	51.1	0	0	0	0	115.9
81	N	89	Confident	86.8	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-127.7	-92	-177.1	-174.5	-116.1	0	0	0	110.8	G79 N83 A1047 Q1050 R1053 Q1054 F1055	G79-N81 PolarHBondContact O-N 3.09Å; N81-N83 PolarHBondContact O-ND2 2.91Å; N81-A1047 PolarHBondContact ND2-O 2.7Å; N81-A1047 VanDerWaalsContact ND2-O 3.1Å; N81-A1047 PolarHBondContact OD1-O 3.31Å; N81-Q1050 PolarHBondContact ND2-O 2.79Å; N81-R1053 PolarHBondContact ND2-O 2.84Å; N81-Q1054 CarbonylContact O-C 3.6Å; N81-Q1054 WeakPolarHBondContact O-CA 3.3Å; N81-F1055 PolarHBondContact O-N 2.74Å
82	V	89.9	Confident	86.6	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132	-176.3	175.4	0	0	0	0	112	F84 L1044 A1047 F1055 F1057 T1071 I1072 R1073	V82-F84 HydrophobicContact CG1-CD2 3.93Å; V82-F84 HydrophobicContact CG1-CE2 3.43Å; V82-F84 VanDerWaalsContact CG1-CE2 3.43Å; V82-F84 HydrophobicContact CG1-CZ 4.08Å; V82-L1044 HydrophobicContact CG1-CD2 4.08Å; V82-L1044 HydrophobicContact CG2-CD2 4.32Å; V82-A1047 HydrophobicContact CG2-CB 3.41Å; V82-A1047 VanDerWaalsContact CG2-CB 3.41Å; V82-F1055 CarbonylContact C-O 3.57Å; V82-F1055 HydrophobicContact CG2-CB 4.49Å; V82-F1057 HydrophobicContact CG1-CD2 4Å; V82-F1057 HydrophobicContact CG1-CE2 3.89Å; V82-T1071 PolarHBondContact N-O 2.83Å; V82-I1072 HydrophobicContact CB-CG1 4.06Å; V82-I1072 HydrophobicContact CG1-CG1 4.18Å; V82-I1072 HydrophobicContact CG1-CG2 4.25Å; V82-I1072 CarbonylContact O-C 3.59Å; V82-I1072 WeakPolarHBondContact O-CA 3.39Å; V82-R1073 PolarHBondContact O-N 3.37Å
83	N	90.9	Very high	86.4	Confident	0 Å²	0	28 Å²	28	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.7	178.5	-62.8	-83.6	0	0	0	110.4	F78 G79 N81 F1055 I1056 F1057 R1073	F78-N83 HydrophobicContact CD1-CB 3.97Å; G79-N83 PolarHBondContact N-OD1 3.04Å; G79-N83 PolarHBondContact O-ND2 2.86Å; N81-N83 PolarHBondContact O-ND2 2.91Å; N83-F1055 WeakPolarHBondContact CB-O 3.33Å; N83-F1055 PolarHBondContact N-O 3.46Å; N83-F1055 PolarHBondContact ND2-O 3.47Å; N83-I1056 HydrophobicContact CB-CG1 4.25Å; N83-I1056 CarbonylContact O-C 3.55Å; N83-I1056 WeakPolarHBondContact O-CA 3.07Å; N83-F1057 PolarHBondContact O-N 3.09Å; N83-R1073 CarbonylContact C-O 3.6Å; N83-R1073 VanDerWaalsContact CA-O 3.31Å; N83-R1073 WeakPolarHBondContact CA-O 3.43Å
84	F	89.8	Confident	86.2	Confident	1 Å²	1	28.1 Å²	28.1	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120.6	171.9	-73.2	-79	0	0	0	109.9	V82 V86 M1040 L1044 F1057 L1066 I1072 R1073 I1074 L1075	V82-F84 HydrophobicContact CG1-CD2 3.93Å; V82-F84 HydrophobicContact CG1-CE2 3.43Å; V82-F84 VanDerWaalsContact CG1-CE2 3.43Å; V82-F84 HydrophobicContact CG1-CZ 4.08Å; F84-V86 HydrophobicContact CB-CG2 4.21Å; F84-M1040 HydrophobicContact CE1-CE 3.55Å; F84-M1040 HydrophobicContact CE1-SD 4.49Å; F84-M1040 HydrophobicContact CZ-CE 3.63Å; F84-L1044 HydrophobicContact CE2-CD2 4.25Å; F84-L1044 HydrophobicContact CZ-CD2 4.26Å; F84-F1057 CarbonylContact C-O 3.52Å; F84-F1057 WeakPolarHBondContact CA-O 3.45Å; F84-F1057 HydrophobicContact CD1-CB 3.51Å; F84-F1057 HydrophobicContact CD1-CD2 4.24Å; F84-F1057 HydrophobicContact CD1-CG 4.22Å; F84-F1057 HydrophobicContact CE1-CB 3.52Å; F84-F1057 AromaticContact CE1-CD2 3.71Å; F84-F1057 HydrophobicContact CE1-CD2 3.71Å; F84-F1057 AromaticContact CE1-CG 3.76Å; F84-F1057 HydrophobicContact CE1-CG 3.76Å; F84-F1057 HydrophobicContact CE2-CD2 4.41Å; F84-F1057 HydrophobicContact CG-CB 4.42Å; F84-F1057 HydrophobicContact CZ-CB 4.46Å; F84-F1057 AromaticContact CZ-CD2 3.82Å; F84-F1057 HydrophobicContact CZ-CD2 3.82Å; F84-F1057 HydrophobicContact CZ-CE2 4.39Å; F84-F1057 HydrophobicContact CZ-CG 4.31Å; F84-L1066 HydrophobicContact CD2-CD1 3.68Å; F84-L1066 HydrophobicContact CE1-CD1 4.49Å; F84-L1066 HydrophobicContact CE2-CD1 3.48Å; F84-L1066 VanDerWaalsContact CE2-CD1 3.48Å; F84-L1066 HydrophobicContact CG-CD1 4.27Å; F84-L1066 HydrophobicContact CZ-CD1 3.94Å; F84-I1072 HydrophobicContact CD2-CG2 3.85Å; F84-I1072 HydrophobicContact CE2-CG2 3.95Å; F84-R1073 PolarHBondContact N-O 3.17Å; F84-I1074 HydrophobicContact CB-CG1 4.35Å; F84-I1074 CarbonylContact O-C 3.57Å; F84-L1075 PolarHBondContact O-N 3.3Å
85	V	90.1	Very high	86.4	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	106.8	171.9	-176	0	0	0	0	108.1	F78 K93 I96 I1056 F1057 L1058 T1059 L1075 L1077	F78-V85 HydrophobicContact CE1-CG2 4.06Å; V85-K93 HydrophobicContact CG1-CG 4.48Å; V85-I96 HydrophobicContact CG1-CD1 4.05Å; V85-I1056 HydrophobicContact CG2-CG2 4.16Å; V85-F1057 PolarHBondContact N-O 3.27Å; V85-L1058 HydrophobicContact CB-CD2 4.27Å; V85-L1058 HydrophobicContact CB-CG 4.21Å; V85-L1058 HydrophobicContact CG1-CD2 4.38Å; V85-L1058 WeakPolarHBondContact O-CA 3.47Å; V85-T1059 PolarHBondContact O-N 3.19Å; V85-T1059 VanDerWaalsContact O-N 3.11Å; V85-L1075 WeakPolarHBondContact CA-O 3.4Å; V85-L1075 HydrophobicContact CG2-CB 4.48Å; V85-L1075 HydrophobicContact CG2-CD1 4.28Å; V85-L1077 HydrophobicContact CG1-CD1 3.89Å; V85-L1077 HydrophobicContact CG1-CD2 4.16Å; V85-L1077 HydrophobicContact CG1-CG 3.95Å
86	V	88.1	Confident	86.7	Confident	12 Å²	12	22.3 Å²	22.3	7%	0.073	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.9	-172.1	-173.1	0	0	0	0	110.3	F84 T1059 Q1061 M1063 I1074 L1075 R1076 L1077	F84-V86 HydrophobicContact CB-CG2 4.21Å; V86-T1059 WeakPolarHBondContact CA-O 3.32Å; V86-T1059 HydrophobicContact CG2-CG2 3.97Å; V86-Q1061 WeakPolarHBondContact CG1-O 3.43Å; V86-M1063 HydrophobicContact CG2-CB 4.46Å; V86-M1063 HydrophobicContact CG2-CG 4.09Å; V86-I1074 HydrophobicContact CG2-CG2 4.06Å; V86-L1075 PolarHBondContact N-O 3.47Å; V86-R1076 CarbonylContact O-C 3.48Å; V86-R1076 WeakPolarHBondContact O-CA 3.14Å; V86-L1077 PolarHBondContact O-N 3.5Å
87	G	84.9	Confident	86.7	Confident	7 Å²	7	21 Å²	21	7%	0.072	14%	0.142	C	C	.	.			trans	177.8	161.2	175.3	0	0	0	0	0	112.7	K93 P1060	G87-K93 WeakPolarHBondContact O-CD 3.17Å; G87-K93 WeakPolarHBondContact O-CE 3.49Å; G87-K93 PolarHBondContact O-NZ 3.05Å; G87-P1060 WeakPolarHBondContact O-CA 3.09Å
88	N	82.2	Confident	86.7	Confident	87 Å²	87	19.3 Å²	19.3	47%	0.465	13%	0.128	S	C	.	.			trans	-64.9	164.9	178.9	-75.5	-21	0	0	0	112.4	G90 S91 K93 D1079	N88-G90 PolarHBondContact O-N 3.36Å; N88-S91 VanDerWaalsContact O-CB 3.27Å; N88-S91 WeakPolarHBondContact O-CB 3.15Å; N88-S91 PolarHBondContact O-N 2.8Å; N88-S91 VanDerWaalsContact O-N 3.11Å; N88-S91 PolarHBondContact O-OG 2.93Å; N88-K93 PolarHBondContact O-NZ 3.18Å; N88-D1079 PolarHBondContact ND2-OD1 2.99Å
89	N	79.8	Confident	86.7	Confident	113 Å²	113	18.7 Å²	18.7	60%	0.604	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	131.5	175.8	-70	-5.2	0	0	0	110
90	G	76.1	Confident	86.9	Confident	49 Å²	49	18 Å²	18	51%	0.505	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	-4.2	-173.9	0	0	0	0	0	116	N88 G92	N88-G90 PolarHBondContact O-N 3.36Å; G90-G92 PolarHBondContact O-N 3.22Å
91	S	83.6	Confident	87.1	Confident	4 Å²	4	15.9 Å²	15.9	3%	0.028	10%	0.102	C	C	.	.	S	Bend	trans	-70.9	-4.7	177.9	56.9	0	0	0	0	115.6	N88 K1078	N88-S91 VanDerWaalsContact O-CB 3.27Å; N88-S91 WeakPolarHBondContact O-CB 3.15Å; N88-S91 PolarHBondContact O-N 2.8Å; N88-S91 VanDerWaalsContact O-N 3.11Å; N88-S91 PolarHBondContact O-OG 2.93Å; S91-K1078 WeakPolarHBondContact CB-O 3.39Å
92	G	83.4	Confident	87.3	Confident	5 Å²	5	15.8 Å²	15.8	5%	0.052	10%	0.102	C	C	.	.	S	Bend	trans	97.5	11.5	179.6	0	0	0	0	0	116.4	H70 G90 A95 I96	H70-G92 WeakPolarHBondContact NE2-CA 3.36Å; G90-G92 PolarHBondContact O-N 3.22Å; G92-A95 WeakPolarHBondContact O-CB 3.28Å; G92-A95 PolarHBondContact O-N 3.28Å; G92-I96 PolarHBondContact O-N 2.88Å; G92-I96 VanDerWaalsContact O-N 3.15Å
93	K	86.4	Confident	87.4	Confident	6 Å²	6	15.7 Å²	15.7	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-51.1	-61.9	174.1	-62.8	-171.1	-56.8	-71.9	0	112.1	V85 G87 N88 A95 I96 L97 L1058 T1059 L1077	V85-K93 HydrophobicContact CG1-CG 4.48Å; G87-K93 WeakPolarHBondContact O-CD 3.17Å; G87-K93 WeakPolarHBondContact O-CE 3.49Å; G87-K93 PolarHBondContact O-NZ 3.05Å; N88-K93 PolarHBondContact O-NZ 3.18Å; K93-A95 PolarHBondContact O-N 3.19Å; K93-I96 WeakPolarHBondContact O-CB 3.42Å; K93-I96 PolarHBondContact O-N 3Å; K93-I96 VanDerWaalsContact O-N 3.14Å; K93-L97 PolarHBondContact O-N 2.62Å; K93-L1058 HydrophobicContact CB-CD2 3.99Å; K93-L1058 WeakPolarHBondContact O-CD2 3.14Å; K93-T1059 WeakPolarHBondContact CD-O 3.2Å; K93-L1077 HydrophobicContact CB-CD1 4.2Å; K93-L1077 HydrophobicContact CG-CD1 3.52Å
94	S	84.2	Confident	87.4	Confident	22 Å²	22	15.8 Å²	15.8	15%	0.154	10%	0.102	C	C	.	.	H	α-helix	trans	-66	-24	-180	-52.3	0	0	0	0	112.6	I96 L97 T98 D1025	S94-I96 VanDerWaalsContact C-N 3.34Å; S94-L97 PolarHBondContact O-N 3.34Å; S94-T98 WeakPolarHBondContact O-CB 3.34Å; S94-T98 PolarHBondContact O-N 2.83Å; S94-T98 PolarHBondContact O-OG1 2.92Å; S94-D1025 PolarHBondContact OG-OD2 2.74Å
95	A	89.1	Confident	87.3	Confident	5 Å²	5	16.5 Å²	16.5	4%	0.041	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-37.8	174.5	0	0	0	0	0	111.9	L64 M68 L73 G92 K93 T98 A99	L64-A95 HydrophobicContact CD1-CB 4.49Å; M68-A95 HydrophobicContact SD-CB 3.86Å; L73-A95 HydrophobicContact CD1-CB 4.32Å; G92-A95 WeakPolarHBondContact O-CB 3.28Å; G92-A95 PolarHBondContact O-N 3.28Å; K93-A95 PolarHBondContact O-N 3.19Å; A95-T98 PolarHBondContact O-N 3.09Å; A95-A99 VanDerWaalsContact O-CB 3.23Å; A95-A99 WeakPolarHBondContact O-CB 3.4Å; A95-A99 PolarHBondContact O-N 3.2Å
96	I	90	Very high	87.1	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-61.2	-45.7	172.9	-66	166.4	0	0	0	110.7	I62 L64 F76 F78 V85 G92 K93 S94 A99 L100 L1077	I62-I96 HydrophobicContact CD1-CG2 4.41Å; I62-I96 HydrophobicContact CG2-CG2 4.11Å; L64-I96 HydrophobicContact CD1-CG1 4.33Å; F76-I96 HydrophobicContact CD2-CD1 3.84Å; F76-I96 HydrophobicContact CD2-CG1 4.33Å; F76-I96 HydrophobicContact CE2-CD1 3.66Å; F76-I96 HydrophobicContact CE2-CG1 4.18Å; F76-I96 HydrophobicContact CZ-CD1 4.23Å; F78-I96 HydrophobicContact CZ-CG2 4.25Å; V85-I96 HydrophobicContact CG1-CD1 4.05Å; G92-I96 PolarHBondContact O-N 2.88Å; G92-I96 VanDerWaalsContact O-N 3.15Å; K93-I96 WeakPolarHBondContact O-CB 3.42Å; K93-I96 PolarHBondContact O-N 3Å; K93-I96 VanDerWaalsContact O-N 3.14Å; S94-I96 VanDerWaalsContact C-N 3.34Å; I96-A99 PolarHBondContact O-N 2.89Å; I96-L100 HydrophobicContact CG2-CD1 4.43Å; I96-L100 WeakPolarHBondContact O-CG 3.44Å; I96-L100 PolarHBondContact O-N 2.88Å; I96-L1077 HydrophobicContact CD1-CD1 4.21Å; I96-L1077 HydrophobicContact CD1-CD2 3.96Å
97	L	89.4	Confident	86.9	Confident	3 Å²	3	20 Å²	20	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-46.7	178.8	-170.6	65.3	0	0	0	112.1	K93 S94 A99 L100 I101 V199 T201 C1023 D1025 L1058	K93-L97 PolarHBondContact O-N 2.62Å; S94-L97 PolarHBondContact O-N 3.34Å; L97-A99 VanDerWaalsContact C-N 3.3Å; L97-A99 PolarHBondContact O-N 3.35Å; L97-L100 WeakPolarHBondContact O-CB 3.3Å; L97-L100 PolarHBondContact O-N 2.88Å; L97-I101 HydrophobicContact CG-CD1 4.43Å; L97-I101 WeakPolarHBondContact O-CG1 3.42Å; L97-I101 PolarHBondContact O-N 3.18Å; L97-I101 VanDerWaalsContact O-N 3.1Å; L97-V199 HydrophobicContact CD1-CG1 3.56Å; L97-V199 HydrophobicContact CD2-CG1 4.41Å; L97-V199 HydrophobicContact CG-CG1 4.05Å; L97-T201 HydrophobicContact CD2-CG2 4.12Å; L97-C1023 HydrophobicContact CD1-CB 3.46Å; L97-C1023 VanDerWaalsContact CD1-CB 3.46Å; L97-D1025 HydrophobicContact CD2-CB 3.68Å; L97-L1058 HydrophobicContact CB-CD1 4.46Å; L97-L1058 HydrophobicContact CB-CD2 4.46Å; L97-L1058 HydrophobicContact CD1-CD1 4.16Å; L97-L1058 HydrophobicContact CD2-CD1 4.36Å
98	T	90.3	Very high	86.8	Confident	5 Å²	5	20.2 Å²	20.2	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-40.5	177.3	-59.8	0	0	0	0	111.4	F67 M68 S94 A95 I101 V102 T111 F120	F67-T98 HydrophobicContact CE1-CG2 4.36Å; F67-T98 HydrophobicContact CZ-CG2 4.23Å; M68-T98 HydrophobicContact CE-CG2 3.33Å; S94-T98 WeakPolarHBondContact O-CB 3.34Å; S94-T98 PolarHBondContact O-N 2.83Å; S94-T98 PolarHBondContact O-OG1 2.92Å; A95-T98 PolarHBondContact O-N 3.09Å; T98-I101 PolarHBondContact O-N 3.45Å; T98-V102 HydrophobicContact CG2-CG2 4.27Å; T98-V102 VanDerWaalsContact O-CG2 3.31Å; T98-V102 WeakPolarHBondContact O-CG2 3.42Å; T98-V102 PolarHBondContact O-N 3.11Å; T98-T111 HydrophobicContact CG2-CG2 3.7Å; T98-F120 HydrophobicContact CG2-CD1 4.14Å; T98-F120 HydrophobicContact CG2-CE1 3.77Å; T98-F120 HydrophobicContact CG2-CE2 4.47Å; T98-F120 HydrophobicContact CG2-CZ 3.96Å
99	A	91.4	Very high	86.7	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.4	-41.1	176.3	0	0	0	0	0	112.8	I62 L64 F67 A95 I96 L97 I101 V102 A103 V130	I62-A99 HydrophobicContact CD1-CB 4.07Å; L64-A99 HydrophobicContact CD1-CB 3.94Å; L64-A99 HydrophobicContact CD2-CB 3.18Å; L64-A99 HydrophobicContact CG-CB 4.21Å; F67-A99 HydrophobicContact CD1-CB 4.34Å; F67-A99 HydrophobicContact CE1-CB 3.83Å; F67-A99 HydrophobicContact CZ-CB 3.98Å; A95-A99 VanDerWaalsContact O-CB 3.23Å; A95-A99 WeakPolarHBondContact O-CB 3.4Å; A95-A99 PolarHBondContact O-N 3.2Å; I96-A99 PolarHBondContact O-N 2.89Å; L97-A99 VanDerWaalsContact C-N 3.3Å; L97-A99 PolarHBondContact O-N 3.35Å; A99-I101 PolarHBondContact O-N 2.89Å; A99-V102 PolarHBondContact O-N 3.45Å; A99-A103 VanDerWaalsContact O-CB 3.26Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 2.58Å; A99-V130 HydrophobicContact CB-CG1 3.97Å; A99-V130 HydrophobicContact CB-CG2 4.21Å
100	L	91.4	Very high	86.5	Confident	3 Å²	3	19.2 Å²	19.2	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-57.2	-47.7	173.3	-76.1	169.1	0	0	0	111.5	V59 I62 I96 L97 L104 I132 I1056	V59-L100 HydrophobicContact CG1-CD2 4.15Å; V59-L100 HydrophobicContact CG2-CD2 4.09Å; I62-L100 HydrophobicContact CD1-CD2 3.78Å; I62-L100 HydrophobicContact CD1-CG 3.74Å; I96-L100 HydrophobicContact CG2-CD1 4.43Å; I96-L100 WeakPolarHBondContact O-CG 3.44Å; I96-L100 PolarHBondContact O-N 2.88Å; L97-L100 WeakPolarHBondContact O-CB 3.3Å; L97-L100 PolarHBondContact O-N 2.88Å; L100-L104 VanDerWaalsContact O-CB 3.32Å; L100-L104 WeakPolarHBondContact O-CB 3.44Å; L100-L104 WeakPolarHBondContact O-CD1 3.19Å; L100-L104 VanDerWaalsContact O-CG 3.26Å; L100-L104 WeakPolarHBondContact O-CG 3.41Å; L100-L104 PolarHBondContact O-N 3.41Å; L100-I132 HydrophobicContact CD2-CD1 3.91Å; L100-I132 HydrophobicContact CD2-CG1 4.39Å; L100-I1056 HydrophobicContact CD1-CD1 4.49Å
101	I	90.2	Very high	86.7	Confident	2 Å²	2	17 Å²	17	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-61.3	-50.1	179.9	-63.8	165.6	0	0	0	110.6	L97 T98 A99 G106 A110 T111 V199 T201	L97-I101 HydrophobicContact CG-CD1 4.43Å; L97-I101 WeakPolarHBondContact O-CG1 3.42Å; L97-I101 PolarHBondContact O-N 3.18Å; L97-I101 VanDerWaalsContact O-N 3.1Å; T98-I101 PolarHBondContact O-N 3.45Å; A99-I101 PolarHBondContact O-N 2.89Å; I101-G106 VanDerWaalsContact O-CA 3.26Å; I101-G106 WeakPolarHBondContact O-CA 3.48Å; I101-G106 PolarHBondContact O-N 3.15Å; I101-A110 HydrophobicContact CG2-CB 4.37Å; I101-T111 HydrophobicContact CB-CG2 4.18Å; I101-T111 HydrophobicContact CD1-CG2 4.38Å; I101-T111 HydrophobicContact CG2-CG2 3.88Å; I101-V199 HydrophobicContact CD1-CG1 3.72Å; I101-V199 HydrophobicContact CG1-CG1 3.78Å; I101-T201 HydrophobicContact CD1-CG2 4.18Å
102	V	91.2	Very high	86.2	Confident	3 Å²	3	18.9 Å²	18.9	2%	0.018	11%	0.11	C	C	.	.	H	α-helix	trans	-72	-42.3	-172.2	175	0	0	0	0	112.1	T98 A99 L104 G105 T111 L117 F120 L155 I157	T98-V102 HydrophobicContact CG2-CG2 4.27Å; T98-V102 VanDerWaalsContact O-CG2 3.31Å; T98-V102 WeakPolarHBondContact O-CG2 3.42Å; T98-V102 PolarHBondContact O-N 3.11Å; A99-V102 PolarHBondContact O-N 3.45Å; V102-L104 VanDerWaalsContact C-N 3.32Å; V102-L104 PolarHBondContact O-N 3.14Å; V102-G105 PolarHBondContact O-N 3.35Å; V102-T111 HydrophobicContact CG2-CG2 3.69Å; V102-L117 HydrophobicContact CG1-CD2 3.58Å; V102-L117 HydrophobicContact CG2-CD2 4.36Å; V102-F120 HydrophobicContact CG2-CD2 4.13Å; V102-F120 HydrophobicContact CG2-CE2 3.8Å; V102-L155 HydrophobicContact CG1-CD2 3.71Å; V102-I157 HydrophobicContact CG1-CD1 3.85Å
103	A	92.1	Very high	85.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-72.7	-24.3	-179.4	0	0	0	0	0	113.6	A99 G105 V130 I132 L155 Y165	A99-A103 VanDerWaalsContact O-CB 3.26Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 2.58Å; A103-G105 PolarHBondContact O-N 3.05Å; A103-V130 HydrophobicContact CB-CB 4.07Å; A103-V130 HydrophobicContact CB-CG1 3.5Å; A103-V130 VanDerWaalsContact CB-CG1 3.5Å; A103-I132 HydrophobicContact CB-CD1 3.48Å; A103-I132 VanDerWaalsContact CB-CD1 3.48Å; A103-I132 HydrophobicContact CB-CG1 4.31Å; A103-L155 HydrophobicContact CB-CB 4.03Å; A103-L155 HydrophobicContact CB-CD2 4.08Å; A103-Y165 WeakPolarHBondContact O-CE1 3.45Å
104	L	92.1	Very high	85.2	Confident	2 Å²	2	25 Å²	25	1%	0.01	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	25.6	171.4	-58.6	171.8	0	0	0	112.1	L100 V102 I132 L134 I153 L186 I191 V193 F1021	L100-L104 VanDerWaalsContact O-CB 3.32Å; L100-L104 WeakPolarHBondContact O-CB 3.44Å; L100-L104 WeakPolarHBondContact O-CD1 3.19Å; L100-L104 VanDerWaalsContact O-CG 3.26Å; L100-L104 WeakPolarHBondContact O-CG 3.41Å; L100-L104 PolarHBondContact O-N 3.41Å; V102-L104 VanDerWaalsContact C-N 3.32Å; V102-L104 PolarHBondContact O-N 3.14Å; L104-I132 HydrophobicContact CD1-CD1 4.48Å; L104-I132 HydrophobicContact CD2-CD1 4.25Å; L104-I132 HydrophobicContact CG-CD1 3.98Å; L104-L134 HydrophobicContact CD2-CD1 4.19Å; L104-I153 HydrophobicContact CD2-CD1 3.63Å; L104-L186 HydrophobicContact CB-CD2 4.08Å; L104-L186 HydrophobicContact CD2-CD2 3.87Å; L104-L186 HydrophobicContact CG-CD2 4.49Å; L104-L186 WeakPolarHBondContact O-CD1 3.41Å; L104-I191 HydrophobicContact CD1-CG2 4.15Å; L104-V193 HydrophobicContact CB-CG1 3.63Å; L104-V193 HydrophobicContact CB-CG2 4.26Å; L104-V193 HydrophobicContact CD1-CG1 3.74Å; L104-V193 HydrophobicContact CG-CG1 4.32Å; L104-V193 WeakPolarHBondContact O-CG2 3.44Å; L104-F1021 HydrophobicContact CD1-CE1 4.13Å; L104-F1021 HydrophobicContact CD1-CZ 3.68Å
105	G	87.4	Confident	84.8	Confident	15 Å²	15	29 Å²	29	16%	0.155	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	2.9	168.4	0	0	0	0	0	116.4	V102 A103	V102-G105 PolarHBondContact O-N 3.35Å; A103-G105 PolarHBondContact O-N 3.05Å
106	G	86.2	Confident	84.6	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.01	18%	0.182	C	C	.	.			trans	-66.3	154.7	175.4	0	0	0	0	0	113.7	I101 N194	I101-G106 VanDerWaalsContact O-CA 3.26Å; I101-G106 WeakPolarHBondContact O-CA 3.48Å; I101-G106 PolarHBondContact O-N 3.15Å; G106-N194 WeakPolarHBondContact CA-OD1 3.35Å
107	N	84	Confident	84.4	Confident	87 Å²	87	32 Å²	32	47%	0.465	19%	0.186	S	C	.	.			trans	-82.7	152.8	178.8	-71.3	-18.6	0	0	0	111.4	Q109 A110	N107-Q109 VanDerWaalsContact C-N 3.27Å; N107-Q109 PolarHBondContact O-N 3.13Å; N107-A110 VanDerWaalsContact O-CB 3.32Å; N107-A110 WeakPolarHBondContact O-CB 3.46Å; N107-A110 PolarHBondContact O-N 2.87Å
108	A	82.9	Confident	84.3	Confident	11 Å²	11	37.3 Å²	37.3	9%	0.091	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-56	-41.4	179.2	0	0	0	0	0	112.3	A110 T111 G114 L117 F120	A108-A110 VanDerWaalsContact C-N 3.27Å; A108-A110 PolarHBondContact O-N 3.43Å; A108-T111 WeakPolarHBondContact O-CB 3.36Å; A108-T111 WeakPolarHBondContact O-CG2 3.45Å; A108-T111 PolarHBondContact O-N 2.71Å; A108-T111 VanDerWaalsContact O-N 3.1Å; A108-T111 PolarHBondContact O-OG1 2.94Å; A108-G114 CarbonylContact C-O 3.5Å; A108-G114 VanDerWaalsContact O-O 3.07Å; A108-L117 HydrophobicContact CB-CD2 4.12Å; A108-L117 HydrophobicContact CB-CG 4.43Å; A108-F120 HydrophobicContact CB-CE2 3.8Å; A108-F120 HydrophobicContact CB-CZ 4.2Å
109	Q	80.3	Confident	84	Confident	145 Å²	145	39.8 Å²	39.8	68%	0.678	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-59.9	-33.3	175.9	-68.5	177.3	-17.1	0	0	113.3	N107 T111 N112	N107-Q109 VanDerWaalsContact C-N 3.27Å; N107-Q109 PolarHBondContact O-N 3.13Å; Q109-T111 PolarHBondContact O-N 3.16Å; Q109-T111 VanDerWaalsContact O-N 3.15Å; Q109-N112 PolarHBondContact O-N 2.87Å; Q109-N112 VanDerWaalsContact O-N 3.11Å; Q109-N112 PolarHBondContact O-OD1 2.83Å
110	A	74.8	Confident	83.9	Confident	34 Å²	34	39.9 Å²	39.9	28%	0.281	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-65.9	-17.8	179.4	0	0	0	0	0	112.8	I101 N107 A108	I101-A110 HydrophobicContact CG2-CB 4.37Å; N107-A110 VanDerWaalsContact O-CB 3.32Å; N107-A110 WeakPolarHBondContact O-CB 3.46Å; N107-A110 PolarHBondContact O-N 2.87Å; A108-A110 VanDerWaalsContact C-N 3.27Å; A108-A110 PolarHBondContact O-N 3.43Å
111	T	80	Confident	83.9	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.018	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-83.3	-15.5	178.4	75.5	0	0	0	0	112.9	T98 I101 V102 A108 Q109 R113 F120	T98-T111 HydrophobicContact CG2-CG2 3.7Å; I101-T111 HydrophobicContact CB-CG2 4.18Å; I101-T111 HydrophobicContact CD1-CG2 4.38Å; I101-T111 HydrophobicContact CG2-CG2 3.88Å; V102-T111 HydrophobicContact CG2-CG2 3.69Å; A108-T111 WeakPolarHBondContact O-CB 3.36Å; A108-T111 WeakPolarHBondContact O-CG2 3.45Å; A108-T111 PolarHBondContact O-N 2.71Å; A108-T111 VanDerWaalsContact O-N 3.1Å; A108-T111 PolarHBondContact O-OG1 2.94Å; Q109-T111 PolarHBondContact O-N 3.16Å; Q109-T111 VanDerWaalsContact O-N 3.15Å; T111-R113 WeakPolarHBondContact O-CG 3.44Å; T111-R113 PolarHBondContact O-N 3.47Å; T111-R113 PolarHBondContact OG1-N 2.81Å; T111-F120 HydrophobicContact CG2-CZ 4.17Å; T111-F120 WeakPolarHBondContact OG1-CZ 3.45Å
112	N	73.6	Confident	83.9	Confident	42 Å²	42	43 Å²	43	23%	0.225	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	11.1	-169.5	-59.3	-31.6	0	0	0	115.9	Q109 T201 E203 M204	Q109-N112 PolarHBondContact O-N 2.87Å; Q109-N112 VanDerWaalsContact O-N 3.11Å; Q109-N112 PolarHBondContact O-OD1 2.83Å; N112-T201 PolarHBondContact ND2-OG1 2.79Å; N112-E203 HydrophobicContact CB-CB 4.2Å; N112-E203 WeakPolarHBondContact CB-OE2 3.44Å; N112-M204 WeakPolarHBondContact ND2-CE 3.47Å; N112-M204 WeakPolarHBondContact ND2-CG 3.26Å; N112-M204 WeakPolarHBondContact OD1-CE 3.35Å
113	R	76.1	Confident	83.6	Confident	116 Å²	116	51.9 Å²	51.9	44%	0.438	29%	0.292	S	S	.	.	S	Bend	trans	-110.2	-3.2	-177.7	-66.9	-69.5	-168.4	-173.9	-1.8	113.4	M68 T111 F120	M68-R113 HydrophobicContact CE-CB 4.17Å; T111-R113 WeakPolarHBondContact O-CG 3.44Å; T111-R113 PolarHBondContact O-N 3.47Å; T111-R113 PolarHBondContact OG1-N 2.81Å; R113-F120 HydrophobicContact CB-CE1 4.35Å
114	G	72.3	Confident	83.3	Confident	24 Å²	24	55 Å²	55	25%	0.247	32%	0.324	C	S	.	.			trans	-173.1	146.5	178.3	0	0	0	0	0	113.2	A108	A108-G114 CarbonylContact C-O 3.5Å; A108-G114 VanDerWaalsContact O-O 3.07Å
115	S	77.2	Confident	83.3	Confident	105 Å²	105	58.4 Å²	58.4	73%	0.734	34%	0.34	S	S	*	.	S	Bend	trans	-81.1	-21.6	177.2	56.6	0	0	0	0	113.2
116	S	84.6	Confident	83.5	Confident	52 Å²	52	61.7 Å²	61.7	36%	0.364	36%	0.361	S	S	.	.	S	Bend	trans	-141.1	154.9	-179.6	75.4	0	0	0	0	112.1	K118 G119	S116-K118 PolarHBondContact O-N 2.8Å; S116-G119 PolarHBondContact O-N 2.8Å
117	L	85.6	Confident	83.9	Confident	20 Å²	20	62 Å²	62	11%	0.105	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-64.1	-23.2	-179.9	-65.3	174	0	0	0	113.2	V102 A108 G119 F120 I157	V102-L117 HydrophobicContact CG1-CD2 3.58Å; V102-L117 HydrophobicContact CG2-CD2 4.36Å; A108-L117 HydrophobicContact CB-CD2 4.12Å; A108-L117 HydrophobicContact CB-CG 4.43Å; L117-G119 PolarHBondContact O-N 3.11Å; L117-F120 HydrophobicContact CD2-CD2 3.99Å; L117-F120 HydrophobicContact CD2-CE2 4Å; L117-F120 PolarHBondContact O-N 2.87Å; L117-F120 VanDerWaalsContact O-N 3.12Å; L117-I157 HydrophobicContact CB-CG2 4.07Å
118	K	86.3	Confident	84.4	Confident	114 Å²	114	57.8 Å²	57.8	50%	0.496	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-57.8	-36.3	177.2	-60.3	-179	174.5	178.2	0	111.9	S116 F120 V121 R159 E160	S116-K118 PolarHBondContact O-N 2.8Å; K118-F120 PolarHBondContact O-N 2.96Å; K118-V121 PolarHBondContact O-N 2.79Å; K118-R159 WeakPolarHBondContact CG-O 3.24Å; K118-E160 WeakPolarHBondContact CE-O 3.28Å
119	G	84.3	Confident	85	Confident	56 Å²	56	59.9 Å²	59.9	58%	0.577	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-69.8	-7.5	-179.6	0	0	0	0	0	114.6	S116 L117	S116-G119 PolarHBondContact O-N 2.8Å; L117-G119 PolarHBondContact O-N 3.11Å
120	F	89.7	Confident	85.8	Confident	2 Å²	2	53 Å²	53	1%	0.009	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-95.1	-5.2	175.7	-55.5	-44.6	0	0	0	113.5	F67 M68 T98 V102 A108 T111 R113 L117 K118	F67-F120 CarbonylContact C-O 3.54Å; F67-F120 WeakPolarHBondContact CA-O 3.4Å; F67-F120 HydrophobicContact CD2-CB 4.32Å; F67-F120 HydrophobicContact CE2-CB 3.73Å; F67-F120 HydrophobicContact CE2-CG 4.43Å; F67-F120 HydrophobicContact CZ-CB 3.9Å; F67-F120 HydrophobicContact CZ-CG 4.2Å; M68-F120 HydrophobicContact CE-CD1 3.41Å; M68-F120 VanDerWaalsContact CE-CD1 3.41Å; M68-F120 HydrophobicContact CE-CE1 3.58Å; M68-F120 HydrophobicContact CG-CD1 4.3Å; M68-F120 PolarHBondContact N-O 3.27Å; T98-F120 HydrophobicContact CG2-CD1 4.14Å; T98-F120 HydrophobicContact CG2-CE1 3.77Å; T98-F120 HydrophobicContact CG2-CE2 4.47Å; T98-F120 HydrophobicContact CG2-CZ 3.96Å; V102-F120 HydrophobicContact CG2-CD2 4.13Å; V102-F120 HydrophobicContact CG2-CE2 3.8Å; A108-F120 HydrophobicContact CB-CE2 3.8Å; A108-F120 HydrophobicContact CB-CZ 4.2Å; T111-F120 HydrophobicContact CG2-CZ 4.17Å; T111-F120 WeakPolarHBondContact OG1-CZ 3.45Å; R113-F120 HydrophobicContact CB-CE1 4.35Å; L117-F120 HydrophobicContact CD2-CD2 3.99Å; L117-F120 HydrophobicContact CD2-CE2 4Å; L117-F120 PolarHBondContact O-N 2.87Å; L117-F120 VanDerWaalsContact O-N 3.12Å; K118-F120 PolarHBondContact O-N 2.96Å
121	V	91.3	Very high	86.8	Confident	16 Å²	16	52.9 Å²	52.9	10%	0.097	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-82.8	131.3	172.3	-175.7	0	0	0	0	108.9	K118 E123 E125 A128 I157	K118-V121 PolarHBondContact O-N 2.79Å; V121-E123 PolarHBondContact O-N 2.82Å; V121-E125 HydrophobicContact CG1-CB 4.37Å; V121-A128 HydrophobicContact CG2-CB 4.15Å; V121-I157 HydrophobicContact CG2-CB 4.34Å; V121-I157 HydrophobicContact CG2-CG2 3.95Å
122	K	89.8	Confident	87.6	Confident	56 Å²	56	52.7 Å²	52.7	24%	0.243	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-57.1	136.2	177	-177.5	171.4	173	174	0	111	N66 M68 S71 G124 E125	N66-K122 HydrophobicContact CB-CB 4.37Å; N66-K122 WeakPolarHBondContact O-CB 3.45Å; N66-K122 PolarHBondContact O-N 2.96Å; M68-K122 WeakPolarHBondContact O-CA 3.32Å; M68-K122 WeakPolarHBondContact O-CB 3.49Å; M68-K122 VanDerWaalsContact O-CG 3.3Å; M68-K122 WeakPolarHBondContact O-CG 3.3Å; S71-K122 PolarHBondContact OG-NZ 3.07Å; K122-G124 PolarHBondContact O-N 3.42Å; K122-E125 HydrophobicContact CB-CB 4.42Å; K122-E125 HydrophobicContact CB-CG 4.1Å; K122-E125 HydrophobicContact CG-CG 4.38Å; K122-E125 WeakPolarHBondContact O-CB 3.1Å; K122-E125 PolarHBondContact O-N 3Å
123	E	85.6	Confident	88.6	Confident	188 Å²	188	51.8 Å²	51.8	88%	0.879	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	131.2	177.4	-167.2	168	-164.2	0	0	110.7	V121	V121-E123 PolarHBondContact O-N 2.82Å
124	G	84.9	Confident	89.5	Confident	67 Å²	67	46.2 Å²	46.2	69%	0.691	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-12.3	-173.8	0	0	0	0	0	115.5	K122	K122-G124 PolarHBondContact O-N 3.42Å
125	E	91.9	Very high	90.4	Very high	72 Å²	72	47.3 Å²	47.3	34%	0.336	29%	0.285	S	S	.	.			trans	-101	151.9	-178.1	-63.3	-69.6	161	0	0	112.6	N66 V121 K122	N66-E125 HydrophobicContact CB-CB 4.07Å; N66-E125 HydrophobicContact CB-CG 3.92Å; N66-E125 VanDerWaalsContact ND2-CD 3.33Å; N66-E125 PolarHBondContact ND2-OE2 3.43Å; V121-E125 HydrophobicContact CG1-CB 4.37Å; K122-E125 HydrophobicContact CB-CB 4.42Å; K122-E125 HydrophobicContact CB-CG 4.1Å; K122-E125 HydrophobicContact CG-CG 4.38Å; K122-E125 WeakPolarHBondContact O-CB 3.1Å; K122-E125 PolarHBondContact O-N 3Å
126	S	92.3	Very high	91.1	Very high	84 Å²	84	42.3 Å²	42.3	59%	0.587	25%	0.25	S	S	*	.	S	Bend	trans	-82.9	-25.5	-180	63	0	0	0	0	113.7	R159	S126-R159 PolarHBondContact O-N 2.76Å; S126-R159 VanDerWaalsContact O-N 3.15Å
127	S	94.4	Very high	91.3	Very high	7 Å²	7	44.3 Å²	44.3	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	153.4	-178.9	59.4	0	0	0	0	112.2	N66 R156 I157	N66-S127 WeakPolarHBondContact CB-O 3.15Å; S127-R156 PolarHBondContact OG-NE 3.42Å; S127-R156 VanDerWaalsContact OG-NE 3.12Å; S127-R156 PolarHBondContact OG-NH2 2.79Å; S127-I157 CarbonylContact C-O 3.43Å; S127-I157 WeakPolarHBondContact CA-O 3.35Å; S127-I157 VanDerWaalsContact CB-O 3.29Å; S127-I157 WeakPolarHBondContact CB-O 3.13Å
128	A	95.4	Very high	91.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	142.8	168.9	0	0	0	0	0	110.7	K65 N66 F67 V121 R156 I157	K65-A128 WeakPolarHBondContact O-CA 3.47Å; N66-A128 WeakPolarHBondContact O-CB 3.41Å; F67-A128 HydrophobicContact CB-CB 4.33Å; F67-A128 HydrophobicContact CD2-CB 3.98Å; V121-A128 HydrophobicContact CG2-CB 4.15Å; A128-R156 WeakPolarHBondContact O-CA 3.34Å; A128-I157 PolarHBondContact N-O 2.91Å; A128-I157 PolarHBondContact O-N 2.78Å
129	D	95.3	Very high	90.7	Very high	54 Å²	54	51.9 Å²	51.9	29%	0.289	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.5	175.9	-59.3	-61.4	0	0	0	110.1	K65 L155 R156	K65-D129 HydrophobicContact CB-CB 4.28Å; K65-D129 PolarHBondContact N-O 2.71Å; K65-D129 PolarHBondContact O-N 3.38Å; D129-L155 CarbonylContact C-O 3.57Å; D129-L155 WeakPolarHBondContact CA-O 3.06Å; D129-R156 WeakPolarHBondContact OD1-CB 3.42Å; D129-R156 WeakPolarHBondContact OD1-CD 3.32Å; D129-R156 WeakPolarHBondContact OD1-CG 3.21Å; D129-R156 IonicContact OD1-NE 2.83Å
130	V	96.3	Very high	90.7	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.9	175.1	178.8	0	0	0	0	108	L64 F67 A99 A103 I132 D154 L155	L64-V130 HydrophobicContact CD2-CB 4.31Å; L64-V130 HydrophobicContact CD2-CG1 3.74Å; L64-V130 HydrophobicContact CD2-CG2 4.02Å; F67-V130 HydrophobicContact CD2-CG2 3.55Å; F67-V130 HydrophobicContact CE2-CG2 3.69Å; F67-V130 HydrophobicContact CG-CG2 4.24Å; F67-V130 HydrophobicContact CZ-CG2 4.48Å; A99-V130 HydrophobicContact CB-CG1 3.97Å; A99-V130 HydrophobicContact CB-CG2 4.21Å; A103-V130 HydrophobicContact CB-CB 4.07Å; A103-V130 HydrophobicContact CB-CG1 3.5Å; A103-V130 VanDerWaalsContact CB-CG1 3.5Å; V130-I132 HydrophobicContact CG1-CD1 4.4Å; V130-I132 HydrophobicContact CG1-CG1 4.25Å; V130-D154 CarbonylContact O-C 3.59Å; V130-D154 WeakPolarHBondContact O-CA 3.39Å; V130-L155 HydrophobicContact CB-CB 4.47Å; V130-L155 PolarHBondContact N-O 2.79Å; V130-L155 PolarHBondContact O-N 2.82Å
131	S	96.4	Very high	90.6	Very high	31 Å²	31	54.7 Å²	54.7	22%	0.217	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.5	177.2	-170.9	0	0	0	0	109.8	I62 T63 T152 I153 D154	I62-S131 CarbonylContact C-O 3.5Å; I62-S131 WeakPolarHBondContact CA-O 3.29Å; T63-S131 PolarHBondContact N-O 2.86Å; T63-S131 PolarHBondContact O-N 2.83Å; S131-T152 WeakPolarHBondContact OG-CG2 3.47Å; S131-I153 WeakPolarHBondContact CA-O 3.33Å; S131-D154 WeakPolarHBondContact CB-OD1 3.49Å; S131-D154 PolarHBondContact OG-OD1 2.79Å
132	I	96.1	Very high	90.7	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.3	178.3	-63.2	170.3	0	0	0	109	V59 S61 I62 L100 A103 L104 V130 L134 T152 I153	V59-I132 HydrophobicContact CG1-CG2 4.09Å; S61-I132 WeakPolarHBondContact O-CA 3.27Å; I62-I132 HydrophobicContact CD1-CD1 4.34Å; I62-I132 HydrophobicContact CD1-CG1 3.99Å; I62-I132 HydrophobicContact CG1-CG1 3.96Å; L100-I132 HydrophobicContact CD2-CD1 3.91Å; L100-I132 HydrophobicContact CD2-CG1 4.39Å; A103-I132 HydrophobicContact CB-CD1 3.48Å; A103-I132 VanDerWaalsContact CB-CD1 3.48Å; A103-I132 HydrophobicContact CB-CG1 4.31Å; L104-I132 HydrophobicContact CD1-CD1 4.48Å; L104-I132 HydrophobicContact CD2-CD1 4.25Å; L104-I132 HydrophobicContact CG-CD1 3.98Å; V130-I132 HydrophobicContact CG1-CD1 4.4Å; V130-I132 HydrophobicContact CG1-CG1 4.25Å; I132-L134 HydrophobicContact CG2-CD2 3.87Å; I132-L134 HydrophobicContact CG2-CG 4.32Å; I132-T152 CarbonylContact O-C 3.57Å; I132-T152 WeakPolarHBondContact O-CA 3.23Å; I132-I153 PolarHBondContact N-O 2.88Å; I132-I153 PolarHBondContact O-N 2.82Å
133	T	95.4	Very high	90.8	Very high	22 Å²	22	56.9 Å²	56.9	14%	0.135	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.3	171.6	-51.4	0	0	0	0	109.8	E60 S61 A150 I151 T152	E60-T133 HydrophobicContact CB-CG2 4.42Å; E60-T133 PolarHBondContact N-O 3.25Å; S61-T133 PolarHBondContact N-O 3.1Å; S61-T133 PolarHBondContact O-N 2.86Å; S61-T133 PolarHBondContact OG-OG1 3.39Å; T133-A150 HydrophobicContact CG2-CB 3.97Å; T133-I151 CarbonylContact C-O 3.58Å; T133-I151 WeakPolarHBondContact CA-O 3.46Å; T133-T152 PolarHBondContact OG1-OG1 3.33Å
134	L	94.6	Very high	91	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.8	174.2	-59.2	-178.5	0	0	0	110.6	I58 V59 L104 I132 A150 I151 I153 F189 I191	I58-L134 WeakPolarHBondContact O-CA 3.29Å; V59-L134 HydrophobicContact CG2-CD2 4.05Å; L104-L134 HydrophobicContact CD2-CD1 4.19Å; I132-L134 HydrophobicContact CG2-CD2 3.87Å; I132-L134 HydrophobicContact CG2-CG 4.32Å; L134-A150 CarbonylContact O-C 3.58Å; L134-A150 WeakPolarHBondContact O-CA 3.26Å; L134-I151 PolarHBondContact N-O 2.81Å; L134-I151 PolarHBondContact O-N 2.92Å; L134-I153 HydrophobicContact CD1-CD1 3.57Å; L134-I153 HydrophobicContact CG-CD1 4.08Å; L134-F189 HydrophobicContact CD1-CD2 4.27Å; L134-F189 HydrophobicContact CD1-CE2 4.42Å; L134-I191 HydrophobicContact CD1-CD1 3.73Å; L134-I191 HydrophobicContact CD2-CD1 4.46Å
135	R	92.1	Very high	91.2	Very high	47 Å²	47	56.8 Å²	56.8	18%	0.177	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	130.4	173.3	179.1	170.1	-67.8	171.5	4	110.7	G57 I58 E60 K137	G57-R135 PolarHBondContact N-O 3.48Å; I58-R135 HydrophobicContact CG1-CB 3.68Å; I58-R135 HydrophobicContact CG1-CG 4.45Å; I58-R135 PolarHBondContact O-N 3.47Å; E60-R135 HydrophobicContact CG-CB 3.93Å; E60-R135 IonicContact OE1-CZ 3.76Å; E60-R135 IonicContact OE1-NE 2.79Å; E60-R135 PolarHBondContact OE1-NE 3.24Å; E60-R135 IonicContact OE1-NH2 2.66Å; E60-R135 PolarHBondContact OE1-NH2 3.15Å; R135-K137 HydrophobicContact CG-CB 4.1Å; R135-K137 HydrophobicContact CG-CD 4.37Å; R135-K137 HydrophobicContact CG-CG 4.14Å
136	N	92.4	Very high	91.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.298	C	S	.	.			trans	-122.4	63.6	177.3	-170.3	34.3	0	0	0	111	A141 Y142 L144 G148 P149 I151 F189	N136-A141 WeakPolarHBondContact OD1-CA 3.16Å; N136-A141 WeakPolarHBondContact OD1-CB 3.37Å; N136-Y142 PolarHBondContact ND2-O 3.32Å; N136-Y142 PolarHBondContact OD1-N 3.15Å; N136-Y142 PolarHBondContact OD1-O 3.2Å; N136-L144 VanDerWaalsContact O-CD1 3.28Å; N136-L144 WeakPolarHBondContact O-CD1 3.08Å; N136-G148 WeakPolarHBondContact CB-O 3.36Å; N136-G148 PolarHBondContact ND2-O 3.45Å; N136-P149 CarbonylContact C-O 3.48Å; N136-P149 WeakPolarHBondContact CA-O 3.42Å; N136-P149 PolarHBondContact N-O 2.87Å; N136-P149 CarbonylContact O-C 3.57Å; N136-P149 WeakPolarHBondContact O-CA 3.43Å; N136-I151 HydrophobicContact CB-CD1 4.04Å; N136-I151 HydrophobicContact CB-CG1 3.99Å; N136-F189 HydrophobicContact CB-CZ 4.33Å; N136-F189 VanDerWaalsContact OD1-CZ 3.32Å; N136-F189 WeakPolarHBondContact OD1-CZ 3.21Å
137	K	87.2	Confident	91.2	Very high	94 Å²	94	52.7 Å²	52.7	41%	0.409	27%	0.27	S	S	.	.			trans	-132.6	156.2	-176.5	-63.4	-179	-179.2	174.3	0	110.3	A56 R135 P149	A56-K137 WeakPolarHBondContact CA-O 3.43Å; A56-K137 WeakPolarHBondContact CB-O 3.42Å; A56-K137 PolarHBondContact N-O 3.48Å; A56-K137 VanDerWaalsContact N-O 3.16Å; R135-K137 HydrophobicContact CG-CB 4.1Å; R135-K137 HydrophobicContact CG-CD 4.37Å; R135-K137 HydrophobicContact CG-CG 4.14Å; K137-P149 HydrophobicContact CD-CB 4.35Å; K137-P149 VanDerWaalsContact CE-CB 3.46Å; K137-P149 HydrophobicContact CG-CB 3.96Å
138	G	81.6	Confident	91.1	Very high	50 Å²	50	53.2 Å²	53.2	52%	0.515	28%	0.277	S	S	.	.	S	Bend	trans	97.5	-170.2	179.2	0	0	0	0	0	112.6	D140 A141	G138-D140 VanDerWaalsContact C-N 3.27Å; G138-D140 PolarHBondContact O-N 2.85Å; G138-A141 PolarHBondContact O-N 3.32Å
139	R	77.6	Confident	90.9	Very high	242 Å²	242	55.7 Å²	55.7	91%	0.913	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.2	-175.5	-68.5	-176.8	178.6	-173.3	-0.4	113
140	D	84.1	Confident	90.8	Very high	96 Å²	96	53.3 Å²	53.3	51%	0.513	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	20.3	-176.8	-53.4	-41.1	0	0	0	112.9	G138 Y142 N188 F189	G138-D140 VanDerWaalsContact C-N 3.27Å; G138-D140 PolarHBondContact O-N 2.85Å; D140-Y142 PolarHBondContact O-N 3.32Å; D140-N188 PolarHBondContact O-ND2 3.36Å; D140-F189 WeakPolarHBondContact O-CE1 3.16Å
141	A	89.1	Confident	90.8	Very high	22 Å²	22	53.2 Å²	53.2	18%	0.182	28%	0.28	C	S	.	.			trans	-64.7	129.7	178.6	0	0	0	0	0	111.6	N136 G138 K143 L144	N136-A141 WeakPolarHBondContact OD1-CA 3.16Å; N136-A141 WeakPolarHBondContact OD1-CB 3.37Å; G138-A141 PolarHBondContact O-N 3.32Å; A141-K143 PolarHBondContact O-N 2.98Å; A141-L144 HydrophobicContact CB-CB 4.25Å; A141-L144 HydrophobicContact CB-CD1 3.98Å
142	Y	91.9	Very high	90.8	Very high	23 Å²	23	53 Å²	53	9%	0.09	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	117.7	178	-174.9	-99.9	0	0	0	110.9	N136 D140 L144 Y147 I151 E181 I185 N188	N136-Y142 PolarHBondContact ND2-O 3.32Å; N136-Y142 PolarHBondContact OD1-N 3.15Å; N136-Y142 PolarHBondContact OD1-O 3.2Å; D140-Y142 PolarHBondContact O-N 3.32Å; Y142-L144 VanDerWaalsContact C-N 3.31Å; Y142-L144 PolarHBondContact O-N 3.31Å; Y142-Y147 HydrophobicContact CD1-CD2 4.15Å; Y142-Y147 HydrophobicContact CD1-CE2 4.11Å; Y142-Y147 HydrophobicContact CE1-CD2 4.37Å; Y142-Y147 AromaticContact CE1-CE2 3.88Å; Y142-Y147 HydrophobicContact CE1-CE2 3.88Å; Y142-I151 HydrophobicContact CD1-CD1 4.39Å; Y142-E181 WeakPolarHBondContact CE1-OE1 3.46Å; Y142-E181 PolarHBondContact OH-OE1 2.92Å; Y142-I185 HydrophobicContact CD1-CD1 4.44Å; Y142-I185 HydrophobicContact CD1-CG1 3.55Å; Y142-I185 HydrophobicContact CE1-CD1 4.26Å; Y142-I185 HydrophobicContact CE1-CG1 3.44Å; Y142-I185 VanDerWaalsContact CE1-CG1 3.44Å; Y142-I185 HydrophobicContact CG-CG1 4.17Å; Y142-N188 HydrophobicContact CD2-CB 3.68Å; Y142-N188 HydrophobicContact CE2-CB 4.32Å
143	K	92.8	Very high	90.8	Very high	95 Å²	95	53 Å²	53	41%	0.413	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	40.2	58.3	176.3	-62.1	-179.6	-172.6	162.6	0	112	A141 D145 V146 Y147 E181	A141-K143 PolarHBondContact O-N 2.98Å; K143-D145 PolarHBondContact O-N 2.91Å; K143-D145 VanDerWaalsContact O-N 3.13Å; K143-V146 HydrophobicContact CB-CB 4.17Å; K143-V146 HydrophobicContact CB-CG2 4.23Å; K143-V146 PolarHBondContact O-N 2.94Å; K143-Y147 HydrophobicContact CB-CD2 4.17Å; K143-Y147 HydrophobicContact CD-CE2 4.42Å; K143-Y147 PolarHBondContact O-N 3.15Å; K143-Y147 VanDerWaalsContact O-N 3.1Å; K143-E181 IonicContact NZ-OE1 3.91Å; K143-E181 PolarHBondContact NZ-OE1 2.88Å; K143-E181 IonicContact NZ-OE2 2.86Å; K143-E181 PolarHBondContact NZ-OE2 3.27Å; K143-E181 VanDerWaalsContact NZ-OE2 3.13Å
144	L	89.4	Confident	90.9	Very high	85 Å²	85	53.5 Å²	53.5	45%	0.445	28%	0.279	S	S	.	.	H	α-helix	trans	-53.3	-37	-172.7	-172.3	69.2	0	0	0	112.5	N136 A141 Y142 V146 G148	N136-L144 VanDerWaalsContact O-CD1 3.28Å; N136-L144 WeakPolarHBondContact O-CD1 3.08Å; A141-L144 HydrophobicContact CB-CB 4.25Å; A141-L144 HydrophobicContact CB-CD1 3.98Å; Y142-L144 VanDerWaalsContact C-N 3.31Å; Y142-L144 PolarHBondContact O-N 3.31Å; L144-V146 PolarHBondContact O-N 3.12Å; L144-G148 WeakPolarHBondContact O-CA 3.43Å; L144-G148 PolarHBondContact O-N 3.37Å
145	D	90.1	Very high	90.9	Very high	167 Å²	167	53.7 Å²	53.7	89%	0.893	28%	0.28	S	S	*	.	H	α-helix	trans	-66	-24.7	178.9	-56	-39.6	0	0	0	113.7	K143	K143-D145 PolarHBondContact O-N 2.91Å; K143-D145 VanDerWaalsContact O-N 3.13Å
146	V	92.4	Very high	91.1	Very high	70 Å²	70	57.2 Å²	57.2	42%	0.424	29%	0.294	S	S	.	.	H	α-helix	trans	-95.4	-50.4	-176	-179.1	0	0	0	0	111.2	K143 L144 I175	K143-V146 HydrophobicContact CB-CB 4.17Å; K143-V146 HydrophobicContact CB-CG2 4.23Å; K143-V146 PolarHBondContact O-N 2.94Å; L144-V146 PolarHBondContact O-N 3.12Å; V146-I175 HydrophobicContact CG1-CD1 4.07Å; V146-I175 HydrophobicContact CG1-CG1 4.21Å; V146-I175 HydrophobicContact CG1-CG2 3.59Å
147	Y	91.3	Very high	91.1	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-93.6	-19.9	-174.7	-72.9	-87.8	0	0	0	113.3	Y142 K143 I151 L167 S169 N170 I175 E181	Y142-Y147 HydrophobicContact CD1-CD2 4.15Å; Y142-Y147 HydrophobicContact CD1-CE2 4.11Å; Y142-Y147 HydrophobicContact CE1-CD2 4.37Å; Y142-Y147 AromaticContact CE1-CE2 3.88Å; Y142-Y147 HydrophobicContact CE1-CE2 3.88Å; K143-Y147 HydrophobicContact CB-CD2 4.17Å; K143-Y147 HydrophobicContact CD-CE2 4.42Å; K143-Y147 PolarHBondContact O-N 3.15Å; K143-Y147 VanDerWaalsContact O-N 3.1Å; Y147-I151 HydrophobicContact CD1-CG1 3.92Å; Y147-I151 HydrophobicContact CD1-CG2 4.14Å; Y147-I151 HydrophobicContact CE1-CG2 4.43Å; Y147-I151 HydrophobicContact CG-CD1 4.23Å; Y147-I151 HydrophobicContact CG-CG1 3.87Å; Y147-L167 HydrophobicContact CE1-CB 4.18Å; Y147-S169 CarbonylContact O-C 3.58Å; Y147-S169 VanDerWaalsContact O-CA 3.3Å; Y147-S169 WeakPolarHBondContact O-CA 3.38Å; Y147-S169 WeakPolarHBondContact O-CB 3.32Å; Y147-N170 PolarHBondContact O-N 2.98Å; Y147-I175 HydrophobicContact CD1-CB 4.31Å; Y147-I175 HydrophobicContact CD1-CG1 3.94Å; Y147-I175 HydrophobicContact CE1-CB 3.61Å; Y147-I175 HydrophobicContact CE1-CG1 3.76Å; Y147-I175 HydrophobicContact CE1-CG2 3.93Å; Y147-I175 HydrophobicContact CE2-CG2 3.99Å; Y147-I175 WeakPolarHBondContact OH-CG2 3.36Å; Y147-E181 VanDerWaalsContact OH-CG 3.29Å; Y147-E181 WeakPolarHBondContact OH-CG 3.24Å; Y147-E181 PolarHBondContact OH-OE1 3.03Å
148	G	91.5	Very high	91.5	Very high	18 Å²	18	54 Å²	54	19%	0.186	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	-162.8	-173.7	0	0	0	0	0	112.8	N136 L144 A150	N136-G148 WeakPolarHBondContact CB-O 3.36Å; N136-G148 PolarHBondContact ND2-O 3.45Å; L144-G148 WeakPolarHBondContact O-CA 3.43Å; L144-G148 PolarHBondContact O-N 3.37Å; G148-A150 PolarHBondContact O-N 2.84Å; G148-A150 VanDerWaalsContact O-N 3.16Å
149	P	91.4	Very high	91.7	Very high	51 Å²	51	59.6 Å²	59.6	33%	0.331	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.8	-168.8	27.5	-35.5	0	0	0	115.8	N136 K137 N170	N136-P149 CarbonylContact C-O 3.48Å; N136-P149 WeakPolarHBondContact CA-O 3.42Å; N136-P149 PolarHBondContact N-O 2.87Å; N136-P149 CarbonylContact O-C 3.57Å; N136-P149 WeakPolarHBondContact O-CA 3.43Å; K137-P149 HydrophobicContact CD-CB 4.35Å; K137-P149 VanDerWaalsContact CE-CB 3.46Å; K137-P149 HydrophobicContact CG-CB 3.96Å; P149-N170 HydrophobicContact CG-CB 4.15Å
150	A	93.2	Very high	92.1	Very high	4 Å²	4	54 Å²	54	3%	0.033	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	142.3	178.7	0	0	0	0	0	110.3	T133 L134 G148 N170	T133-A150 HydrophobicContact CG2-CB 3.97Å; L134-A150 CarbonylContact O-C 3.58Å; L134-A150 WeakPolarHBondContact O-CA 3.26Å; G148-A150 PolarHBondContact O-N 2.84Å; G148-A150 VanDerWaalsContact O-N 3.16Å; A150-N170 HydrophobicContact CB-CB 4.43Å; A150-N170 PolarHBondContact O-N 2.8Å; A150-N170 VanDerWaalsContact O-N 3.13Å
151	I	95.8	Very high	92.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.3	177.8	-64.9	166.2	0	0	0	107.9	T133 L134 N136 Y142 Y147 I153 I185 F189	T133-I151 CarbonylContact C-O 3.58Å; T133-I151 WeakPolarHBondContact CA-O 3.46Å; L134-I151 PolarHBondContact N-O 2.81Å; L134-I151 PolarHBondContact O-N 2.92Å; N136-I151 HydrophobicContact CB-CD1 4.04Å; N136-I151 HydrophobicContact CB-CG1 3.99Å; Y142-I151 HydrophobicContact CD1-CD1 4.39Å; Y147-I151 HydrophobicContact CD1-CG1 3.92Å; Y147-I151 HydrophobicContact CD1-CG2 4.14Å; Y147-I151 HydrophobicContact CE1-CG2 4.43Å; Y147-I151 HydrophobicContact CG-CD1 4.23Å; Y147-I151 HydrophobicContact CG-CG1 3.87Å; I151-I153 HydrophobicContact CG2-CG1 4.3Å; I151-I185 HydrophobicContact CD1-CG2 4.13Å; I151-I185 HydrophobicContact CG2-CD1 4.3Å; I151-F189 HydrophobicContact CD1-CE2 3.93Å; I151-F189 HydrophobicContact CD1-CZ 3.88Å
152	T	96.4	Very high	92.1	Very high	27 Å²	27	54.7 Å²	54.7	17%	0.166	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.1	174.7	-57.8	0	0	0	0	110.4	S131 I132 T133 K168	S131-T152 WeakPolarHBondContact OG-CG2 3.47Å; I132-T152 CarbonylContact O-C 3.57Å; I132-T152 WeakPolarHBondContact O-CA 3.23Å; T133-T152 PolarHBondContact OG1-OG1 3.33Å; T152-K168 PolarHBondContact N-O 3.03Å; T152-K168 PolarHBondContact O-N 3.25Å
153	I	97.1	Very high	92	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.6	179.4	-57.8	165.1	0	0	0	107.3	L104 S131 I132 L134 I151 Y165 L167 L182	L104-I153 HydrophobicContact CD2-CD1 3.63Å; S131-I153 WeakPolarHBondContact CA-O 3.33Å; I132-I153 PolarHBondContact N-O 2.88Å; I132-I153 PolarHBondContact O-N 2.82Å; L134-I153 HydrophobicContact CD1-CD1 3.57Å; L134-I153 HydrophobicContact CG-CD1 4.08Å; I151-I153 HydrophobicContact CG2-CG1 4.3Å; I153-Y165 HydrophobicContact CG2-CD1 4.33Å; I153-L167 HydrophobicContact CB-CD2 4.3Å; I153-L167 HydrophobicContact CG1-CD2 3.89Å; I153-L167 HydrophobicContact CG2-CD2 4.01Å; I153-L182 HydrophobicContact CD1-CD1 3.71Å; I153-L182 HydrophobicContact CG1-CD1 4.22Å; I153-L182 HydrophobicContact CG2-CD1 4.15Å
154	D	96.1	Very high	92.1	Very high	32 Å²	32	57.2 Å²	57.2	17%	0.171	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.5	170.8	-67.4	-17.1	0	0	0	109.4	V130 S131 Y165 K166 K168	V130-D154 CarbonylContact O-C 3.59Å; V130-D154 WeakPolarHBondContact O-CA 3.39Å; S131-D154 WeakPolarHBondContact CB-OD1 3.49Å; S131-D154 PolarHBondContact OG-OD1 2.79Å; D154-Y165 CarbonylContact O-C 3.53Å; D154-Y165 WeakPolarHBondContact O-CA 3.43Å; D154-K166 HydrophobicContact CB-CB 4.21Å; D154-K166 PolarHBondContact N-O 3.49Å; D154-K166 PolarHBondContact O-N 2.83Å; D154-K168 WeakPolarHBondContact OD2-CE 3.16Å; D154-K168 IonicContact OD2-NZ 2.62Å; D154-K168 PolarHBondContact OD2-NZ 3.28Å
155	L	95.8	Very high	92.4	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.7	170	170.8	63.8	0	0	0	109.3	V102 A103 D129 V130 I157 R163 Y165	V102-L155 HydrophobicContact CG1-CD2 3.71Å; A103-L155 HydrophobicContact CB-CB 4.03Å; A103-L155 HydrophobicContact CB-CD2 4.08Å; D129-L155 CarbonylContact C-O 3.57Å; D129-L155 WeakPolarHBondContact CA-O 3.06Å; V130-L155 HydrophobicContact CB-CB 4.47Å; V130-L155 PolarHBondContact N-O 2.79Å; V130-L155 PolarHBondContact O-N 2.82Å; L155-I157 HydrophobicContact CD1-CG1 4.33Å; L155-I157 HydrophobicContact CD2-CD1 4Å; L155-I157 HydrophobicContact CD2-CG1 3.92Å; L155-I157 HydrophobicContact CG-CG1 3.95Å; L155-R163 HydrophobicContact CD1-CB 3.8Å; L155-Y165 HydrophobicContact CB-CD1 4.19Å; L155-Y165 HydrophobicContact CB-CE1 4.02Å; L155-Y165 HydrophobicContact CD1-CD1 4.02Å; L155-Y165 HydrophobicContact CD1-CE1 3.69Å; L155-Y165 HydrophobicContact CD1-CE2 4.45Å; L155-Y165 HydrophobicContact CD2-CE1 4.41Å; L155-Y165 HydrophobicContact CG-CE1 4.23Å
156	R	95.1	Very high	92.7	Very high	121 Å²	121	50.6 Å²	50.6	46%	0.457	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.9	166.1	-174.2	166.2	-170.6	-172.3	2.8	110.6	S127 A128 D129 T164	S127-R156 PolarHBondContact OG-NE 3.42Å; S127-R156 VanDerWaalsContact OG-NE 3.12Å; S127-R156 PolarHBondContact OG-NH2 2.79Å; A128-R156 WeakPolarHBondContact O-CA 3.34Å; D129-R156 WeakPolarHBondContact OD1-CB 3.42Å; D129-R156 WeakPolarHBondContact OD1-CD 3.32Å; D129-R156 WeakPolarHBondContact OD1-CG 3.21Å; D129-R156 IonicContact OD1-NE 2.83Å; R156-T164 PolarHBondContact N-O 3.38Å; R156-T164 PolarHBondContact O-N 3.4Å
157	I	94.4	Very high	92.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.4	176	-52.9	175.1	0	0	0	108.1	F67 V102 L117 V121 S127 A128 L155 L162	F67-I157 HydrophobicContact CE2-CD1 4.05Å; V102-I157 HydrophobicContact CG1-CD1 3.85Å; L117-I157 HydrophobicContact CB-CG2 4.07Å; V121-I157 HydrophobicContact CG2-CB 4.34Å; V121-I157 HydrophobicContact CG2-CG2 3.95Å; S127-I157 CarbonylContact C-O 3.43Å; S127-I157 WeakPolarHBondContact CA-O 3.35Å; S127-I157 VanDerWaalsContact CB-O 3.29Å; S127-I157 WeakPolarHBondContact CB-O 3.13Å; A128-I157 PolarHBondContact N-O 2.91Å; A128-I157 PolarHBondContact O-N 2.78Å; L155-I157 HydrophobicContact CD1-CG1 4.33Å; L155-I157 HydrophobicContact CD2-CD1 4Å; L155-I157 HydrophobicContact CD2-CG1 3.92Å; L155-I157 HydrophobicContact CG-CG1 3.95Å; I157-L162 WeakPolarHBondContact CA-O 3.5Å
158	T	93.6	Very high	93.1	Very high	27 Å²	27	49.8 Å²	49.8	17%	0.166	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	164.9	176	73.9	0	0	0	0	111.5	E160 G161 L162	T158-E160 WeakPolarHBondContact CB-OE2 3.36Å; T158-E160 PolarHBondContact O-N 3.48Å; T158-E160 PolarHBondContact OG1-N 2.91Å; T158-E160 PolarHBondContact OG1-OE2 2.9Å; T158-G161 WeakPolarHBondContact O-CA 3.4Å; T158-G161 PolarHBondContact O-N 2.76Å; T158-L162 HydrophobicContact CG2-CB 4.49Å; T158-L162 PolarHBondContact N-O 3.43Å; T158-L162 PolarHBondContact OG1-N 2.92Å
159	R	87.6	Confident	93.2	Very high	167 Å²	167	49.5 Å²	49.5	63%	0.63	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.1	175.2	-163.2	172.3	-177.5	-176.9	1.2	113.1	K118 S126 G161	K118-R159 WeakPolarHBondContact CG-O 3.24Å; S126-R159 PolarHBondContact O-N 2.76Å; S126-R159 VanDerWaalsContact O-N 3.15Å; R159-G161 PolarHBondContact O-N 3.42Å
160	E	86.1	Confident	93.1	Very high	124 Å²	124	51.7 Å²	51.7	58%	0.579	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.2	169.9	-50	80.1	-159.2	0	0	113.2	K118 T158 L162	K118-E160 WeakPolarHBondContact CE-O 3.28Å; T158-E160 WeakPolarHBondContact CB-OE2 3.36Å; T158-E160 PolarHBondContact O-N 3.48Å; T158-E160 PolarHBondContact OG1-N 2.91Å; T158-E160 PolarHBondContact OG1-OE2 2.9Å; E160-L162 HydrophobicContact CB-CD1 4.44Å; E160-L162 HydrophobicContact CB-CG 4.49Å
161	G	83.1	Confident	92.7	Very high	21 Å²	21	55 Å²	55	22%	0.216	28%	0.28	C	S	.	.			trans	82.1	14.4	178.6	0	0	0	0	0	113.6	T158 R159	T158-G161 WeakPolarHBondContact O-CA 3.4Å; T158-G161 PolarHBondContact O-N 2.76Å; R159-G161 PolarHBondContact O-N 3.42Å
162	L	88.7	Confident	92.2	Very high	112 Å²	112	57.1 Å²	57.1	59%	0.586	30%	0.302	S	S	*	.			trans	-77	137.4	175.3	-66.6	165.3	0	0	0	110.1	I157 T158 E160	I157-L162 WeakPolarHBondContact CA-O 3.5Å; T158-L162 HydrophobicContact CG2-CB 4.49Å; T158-L162 PolarHBondContact N-O 3.43Å; T158-L162 PolarHBondContact OG1-N 2.92Å; E160-L162 HydrophobicContact CB-CD1 4.44Å; E160-L162 HydrophobicContact CB-CG 4.49Å
163	R	90.6	Very high	92	Very high	100 Å²	100	62.3 Å²	62.3	38%	0.377	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.5	178.5	45.5	179.9	147.5	-164.4	-7.3	110.4	L155	L155-R163 HydrophobicContact CD1-CB 3.8Å
164	T	93.8	Very high	91.9	Very high	70 Å²	70	65.4 Å²	65.4	43%	0.429	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.4	175.8	-50.3	0	0	0	0	109.4	R156	R156-T164 PolarHBondContact N-O 3.38Å; R156-T164 PolarHBondContact O-N 3.4Å
165	Y	96.1	Very high	91.9	Very high	8 Å²	8	66.7 Å²	66.7	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	145.5	177.9	-68.9	-74.8	0	0	0	111.5	A103 I153 D154 L155 T177 K179 L182	A103-Y165 WeakPolarHBondContact O-CE1 3.45Å; I153-Y165 HydrophobicContact CG2-CD1 4.33Å; D154-Y165 CarbonylContact O-C 3.53Å; D154-Y165 WeakPolarHBondContact O-CA 3.43Å; L155-Y165 HydrophobicContact CB-CD1 4.19Å; L155-Y165 HydrophobicContact CB-CE1 4.02Å; L155-Y165 HydrophobicContact CD1-CD1 4.02Å; L155-Y165 HydrophobicContact CD1-CE1 3.69Å; L155-Y165 HydrophobicContact CD1-CE2 4.45Å; L155-Y165 HydrophobicContact CD2-CE1 4.41Å; L155-Y165 HydrophobicContact CG-CE1 4.23Å; Y165-T177 VanDerWaalsContact O-CA 3.26Å; Y165-T177 WeakPolarHBondContact O-CA 3.3Å; Y165-T177 VanDerWaalsContact O-CB 3.28Å; Y165-T177 WeakPolarHBondContact O-CB 3.11Å; Y165-T177 WeakPolarHBondContact O-CG2 3.38Å; Y165-K179 HydrophobicContact CD2-CB 4.45Å; Y165-K179 HydrophobicContact CE2-CB 4.5Å; Y165-K179 HydrophobicContact CE2-CG 4.16Å; Y165-L182 HydrophobicContact CD1-CD2 3.81Å; Y165-L182 HydrophobicContact CD2-CD2 4.45Å; Y165-L182 HydrophobicContact CE1-CD2 3.42Å; Y165-L182 VanDerWaalsContact CE1-CD2 3.42Å; Y165-L182 HydrophobicContact CE2-CD2 4.11Å; Y165-L182 HydrophobicContact CG-CD2 4.3Å
166	K	96.5	Very high	91.8	Very high	105 Å²	105	67.5 Å²	67.5	46%	0.457	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	113.4	162	-60.8	178.4	179.5	179.5	0	108.3	D154 V174 T177	D154-K166 HydrophobicContact CB-CB 4.21Å; D154-K166 PolarHBondContact N-O 3.49Å; D154-K166 PolarHBondContact O-N 2.83Å; K166-V174 HydrophobicContact CB-CG1 4.33Å; K166-V174 HydrophobicContact CB-CG2 4.44Å; K166-T177 HydrophobicContact CG-CG2 4.3Å
167	L	96.6	Very high	91.8	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.2	177.3	-53.7	174.2	0	0	0	107.8	Y147 I153 I175 S176 E181 L182 I185	Y147-L167 HydrophobicContact CE1-CB 4.18Å; I153-L167 HydrophobicContact CB-CD2 4.3Å; I153-L167 HydrophobicContact CG1-CD2 3.89Å; I153-L167 HydrophobicContact CG2-CD2 4.01Å; L167-I175 PolarHBondContact O-N 3.31Å; L167-S176 WeakPolarHBondContact CB-O 3.49Å; L167-S176 PolarHBondContact N-O 2.88Å; L167-S176 PolarHBondContact O-N 3.14Å; L167-E181 HydrophobicContact CD1-CB 3.81Å; L167-E181 HydrophobicContact CD1-CG 3.71Å; L167-L182 HydrophobicContact CD1-CB 4.18Å; L167-L182 HydrophobicContact CD2-CB 4.23Å; L167-L182 HydrophobicContact CD2-CD1 4.09Å; L167-I185 HydrophobicContact CD1-CD1 4.02Å
168	K	95.4	Very high	91.7	Very high	55 Å²	55	72.6 Å²	72.6	24%	0.239	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146	-172.6	-63.4	174.1	174.4	172.4	0	111.8	T152 D154 Q173 V174	T152-K168 PolarHBondContact N-O 3.03Å; T152-K168 PolarHBondContact O-N 3.25Å; D154-K168 WeakPolarHBondContact OD2-CE 3.16Å; D154-K168 IonicContact OD2-NZ 2.62Å; D154-K168 PolarHBondContact OD2-NZ 3.28Å; K168-Q173 CarbonylContact C-O 3.6Å; K168-Q173 WeakPolarHBondContact CA-O 3.5Å; K168-V174 HydrophobicContact CG-CG2 3.95Å
169	S	94.1	Very high	91.5	Very high	12 Å²	12	74.9 Å²	74.9	8%	0.084	40%	0.396	C	S	.	.			trans	-71.9	170.2	168.7	71.6	0	0	0	0	111.5	Y147 G171 G172 Q173	Y147-S169 CarbonylContact O-C 3.58Å; Y147-S169 VanDerWaalsContact O-CA 3.3Å; Y147-S169 WeakPolarHBondContact O-CA 3.38Å; Y147-S169 WeakPolarHBondContact O-CB 3.32Å; S169-G171 PolarHBondContact O-N 3.26Å; S169-G171 VanDerWaalsContact O-N 3.14Å; S169-G171 PolarHBondContact OG-N 3.1Å; S169-G172 PolarHBondContact O-N 3.45Å; S169-Q173 PolarHBondContact N-O 2.73Å
170	N	90.1	Very high	91.7	Very high	96 Å²	96	72.9 Å²	72.9	51%	0.513	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.1	173.7	-176.5	74.4	0	0	0	113.1	Y147 P149 A150 G172	Y147-N170 PolarHBondContact O-N 2.98Å; P149-N170 HydrophobicContact CG-CB 4.15Å; A150-N170 HydrophobicContact CB-CB 4.43Å; A150-N170 PolarHBondContact O-N 2.8Å; A150-N170 VanDerWaalsContact O-N 3.13Å; N170-G172 VanDerWaalsContact C-N 3.26Å; N170-G172 PolarHBondContact O-N 3.03Å
171	G	83.9	Confident	92	Very high	73 Å²	73	68.7 Å²	68.7	75%	0.753	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	1.8	175.3	0	0	0	0	0	114.6	S169 Q173	S169-G171 PolarHBondContact O-N 3.26Å; S169-G171 VanDerWaalsContact O-N 3.14Å; S169-G171 PolarHBondContact OG-N 3.1Å; G171-Q173 VanDerWaalsContact C-N 3.31Å; G171-Q173 PolarHBondContact O-N 3Å
172	G	86.3	Confident	92.5	Very high	45 Å²	45	67.8 Å²	67.8	46%	0.464	36%	0.364	S	S	.	.	S	Bend	trans	82.4	0.4	-179	0	0	0	0	0	115.1	S169 N170	S169-G172 PolarHBondContact O-N 3.45Å; N170-G172 VanDerWaalsContact C-N 3.26Å; N170-G172 PolarHBondContact O-N 3.03Å
173	Q	91.8	Very high	92.7	Very high	136 Å²	136	65.9 Å²	65.9	64%	0.636	35%	0.354	S	S	*	.			trans	-72.7	131.1	177.8	-175.4	-179.8	7.3	0	0	110.7	K168 S169 G171 I175	K168-Q173 CarbonylContact C-O 3.6Å; K168-Q173 WeakPolarHBondContact CA-O 3.5Å; S169-Q173 PolarHBondContact N-O 2.73Å; G171-Q173 VanDerWaalsContact C-N 3.31Å; G171-Q173 PolarHBondContact O-N 3Å; Q173-I175 HydrophobicContact CG-CD1 4.4Å; Q173-I175 PolarHBondContact O-N 2.88Å
174	V	94.8	Very high	92.8	Very high	66 Å²	66	63.6 Å²	63.6	40%	0.4	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	117.4	174.8	-177.5	0	0	0	0	109.3	K166 K168 T177	K166-V174 HydrophobicContact CB-CG1 4.33Å; K166-V174 HydrophobicContact CB-CG2 4.44Å; K168-V174 HydrophobicContact CG-CG2 3.95Å; V174-T177 HydrophobicContact CG1-CG2 4.08Å
175	I	94.8	Very high	92.8	Very high	59 Å²	59	60.2 Å²	60.2	30%	0.303	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-40.9	178.7	-57.3	-57	0	0	0	110.8	V146 Y147 L167 Q173	V146-I175 HydrophobicContact CG1-CD1 4.07Å; V146-I175 HydrophobicContact CG1-CG1 4.21Å; V146-I175 HydrophobicContact CG1-CG2 3.59Å; Y147-I175 HydrophobicContact CD1-CB 4.31Å; Y147-I175 HydrophobicContact CD1-CG1 3.94Å; Y147-I175 HydrophobicContact CE1-CB 3.61Å; Y147-I175 HydrophobicContact CE1-CG1 3.76Å; Y147-I175 HydrophobicContact CE1-CG2 3.93Å; Y147-I175 HydrophobicContact CE2-CG2 3.99Å; Y147-I175 WeakPolarHBondContact OH-CG2 3.36Å; L167-I175 PolarHBondContact O-N 3.31Å; Q173-I175 HydrophobicContact CG-CD1 4.4Å; Q173-I175 PolarHBondContact O-N 2.88Å
176	S	94.6	Very high	92.6	Very high	20 Å²	20	60.5 Å²	60.5	14%	0.14	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	152.2	-177.8	179.1	0	0	0	0	111.6	L167 K178	L167-S176 WeakPolarHBondContact CB-O 3.49Å; L167-S176 PolarHBondContact N-O 2.88Å; L167-S176 PolarHBondContact O-N 3.14Å; S176-K178 PolarHBondContact OG-N 2.9Å
177	T	94.6	Very high	92.3	Very high	86 Å²	86	61 Å²	61	53%	0.528	34%	0.342	S	S	.	.			trans	-118	1.3	172.4	54.8	0	0	0	0	112.1	Y165 K166 V174	Y165-T177 VanDerWaalsContact O-CA 3.26Å; Y165-T177 WeakPolarHBondContact O-CA 3.3Å; Y165-T177 VanDerWaalsContact O-CB 3.28Å; Y165-T177 WeakPolarHBondContact O-CB 3.11Å; Y165-T177 WeakPolarHBondContact O-CG2 3.38Å; K166-T177 HydrophobicContact CG-CG2 4.3Å; V174-T177 HydrophobicContact CG1-CG2 4.08Å
178	K	92.5	Very high	92	Very high	142 Å²	142	64.7 Å²	64.7	62%	0.617	36%	0.362	S	S	*	.			trans	-81.9	139.9	-175.5	-67.6	-174.3	-179.2	-178.7	0	111.2	S176 E180	S176-K178 PolarHBondContact OG-N 2.9Å; K178-E180 VanDerWaalsContact C-N 3.31Å; K178-E180 WeakPolarHBondContact CB-OE2 3.35Å; K178-E180 PolarHBondContact O-N 3.13Å
179	K	88.9	Confident	91.7	Very high	76 Å²	76	62.5 Å²	62.5	33%	0.33	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-31.8	177	-172.5	-173.5	174.6	-164.6	0	111.5	Y165 E181 L182 I183	Y165-K179 HydrophobicContact CD2-CB 4.45Å; Y165-K179 HydrophobicContact CE2-CB 4.5Å; Y165-K179 HydrophobicContact CE2-CG 4.16Å; K179-E181 VanDerWaalsContact C-N 3.31Å; K179-E181 PolarHBondContact O-N 2.89Å; K179-L182 WeakPolarHBondContact O-CB 3.39Å; K179-L182 PolarHBondContact O-N 3.19Å; K179-L182 VanDerWaalsContact O-N 3.16Å; K179-I183 HydrophobicContact CG-CD1 4.23Å; K179-I183 WeakPolarHBondContact O-CG1 3.47Å; K179-I183 PolarHBondContact O-N 3.48Å
180	E	92.4	Very high	91.4	Very high	125 Å²	125	64.3 Å²	64.3	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-63.3	-36.6	-179.5	-61.1	74	-157.4	0	0	112.2	K178 I183 S184	K178-E180 VanDerWaalsContact C-N 3.31Å; K178-E180 WeakPolarHBondContact CB-OE2 3.35Å; K178-E180 PolarHBondContact O-N 3.13Å; E180-I183 PolarHBondContact O-N 2.72Å; E180-S184 PolarHBondContact O-N 2.86Å; E180-S184 PolarHBondContact O-OG 2.82Å
181	E	93.6	Very high	91.3	Very high	36 Å²	36	60.3 Å²	60.3	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-68.4	-38.9	174.9	-176.2	76.9	178.6	0	0	110.8	Y142 K143 Y147 L167 K179 S184 I185	Y142-E181 WeakPolarHBondContact CE1-OE1 3.46Å; Y142-E181 PolarHBondContact OH-OE1 2.92Å; K143-E181 IonicContact NZ-OE1 3.91Å; K143-E181 PolarHBondContact NZ-OE1 2.88Å; K143-E181 IonicContact NZ-OE2 2.86Å; K143-E181 PolarHBondContact NZ-OE2 3.27Å; K143-E181 VanDerWaalsContact NZ-OE2 3.13Å; Y147-E181 VanDerWaalsContact OH-CG 3.29Å; Y147-E181 WeakPolarHBondContact OH-CG 3.24Å; Y147-E181 PolarHBondContact OH-OE1 3.03Å; L167-E181 HydrophobicContact CD1-CB 3.81Å; L167-E181 HydrophobicContact CD1-CG 3.71Å; K179-E181 VanDerWaalsContact C-N 3.31Å; K179-E181 PolarHBondContact O-N 2.89Å; E181-S184 WeakPolarHBondContact O-CB 3.42Å; E181-S184 PolarHBondContact O-N 2.92Å; E181-I185 HydrophobicContact CG-CD1 4.33Å; E181-I185 VanDerWaalsContact O-CG1 3.32Å; E181-I185 WeakPolarHBondContact O-CG1 3.13Å; E181-I185 PolarHBondContact O-N 2.83Å
182	L	93.5	Very high	91.4	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-48	172.8	173.3	64.4	0	0	0	110.7	I153 Y165 L167 K179 S184 I185 L186	I153-L182 HydrophobicContact CD1-CD1 3.71Å; I153-L182 HydrophobicContact CG1-CD1 4.22Å; I153-L182 HydrophobicContact CG2-CD1 4.15Å; Y165-L182 HydrophobicContact CD1-CD2 3.81Å; Y165-L182 HydrophobicContact CD2-CD2 4.45Å; Y165-L182 HydrophobicContact CE1-CD2 3.42Å; Y165-L182 VanDerWaalsContact CE1-CD2 3.42Å; Y165-L182 HydrophobicContact CE2-CD2 4.11Å; Y165-L182 HydrophobicContact CG-CD2 4.3Å; L167-L182 HydrophobicContact CD1-CB 4.18Å; L167-L182 HydrophobicContact CD2-CB 4.23Å; L167-L182 HydrophobicContact CD2-CD1 4.09Å; K179-L182 WeakPolarHBondContact O-CB 3.39Å; K179-L182 PolarHBondContact O-N 3.19Å; K179-L182 VanDerWaalsContact O-N 3.16Å; L182-S184 VanDerWaalsContact C-N 3.27Å; L182-S184 PolarHBondContact O-N 3.16Å; L182-I185 WeakPolarHBondContact O-CB 3.42Å; L182-I185 PolarHBondContact O-N 2.81Å; L182-I185 VanDerWaalsContact O-N 3.14Å; L182-L186 HydrophobicContact CD1-CD1 4.09Å; L182-L186 HydrophobicContact CD1-CD2 4.4Å; L182-L186 HydrophobicContact CD1-CG 4.09Å; L182-L186 HydrophobicContact CG-CD1 3.92Å; L182-L186 HydrophobicContact CG-CG 4.35Å; L182-L186 VanDerWaalsContact O-CG 3.25Å; L182-L186 WeakPolarHBondContact O-CG 3.28Å; L182-L186 PolarHBondContact O-N 3.35Å
183	I	91.5	Very high	91.3	Very high	73 Å²	73	56.4 Å²	56.4	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-57.5	-44	177.3	-66.3	166.3	0	0	0	110.2	K179 E180 I185 L186 D187	K179-I183 HydrophobicContact CG-CD1 4.23Å; K179-I183 WeakPolarHBondContact O-CG1 3.47Å; K179-I183 PolarHBondContact O-N 3.48Å; E180-I183 PolarHBondContact O-N 2.72Å; I183-I185 VanDerWaalsContact C-N 3.33Å; I183-I185 PolarHBondContact O-N 2.94Å; I183-L186 PolarHBondContact O-N 3.14Å; I183-L186 VanDerWaalsContact O-N 3.17Å; I183-D187 WeakPolarHBondContact O-CB 3.24Å; I183-D187 VanDerWaalsContact O-CG 3.3Å; I183-D187 PolarHBondContact O-N 3.37Å
184	S	93.4	Very high	90.8	Very high	51 Å²	51	53.9 Å²	53.9	36%	0.357	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-38.4	177.5	-56.4	0	0	0	0	113.2	E180 E181 L182 N188	E180-S184 PolarHBondContact O-N 2.86Å; E180-S184 PolarHBondContact O-OG 2.82Å; E181-S184 WeakPolarHBondContact O-CB 3.42Å; E181-S184 PolarHBondContact O-N 2.92Å; L182-S184 VanDerWaalsContact C-N 3.27Å; L182-S184 PolarHBondContact O-N 3.16Å; S184-N188 WeakPolarHBondContact O-CB 3.42Å; S184-N188 PolarHBondContact O-N 3.42Å
185	I	93.3	Very high	90.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-46.2	174.8	-68.5	161.7	0	0	0	110.2	Y142 I151 L167 E181 L182 I183 N188 F189	Y142-I185 HydrophobicContact CD1-CD1 4.44Å; Y142-I185 HydrophobicContact CD1-CG1 3.55Å; Y142-I185 HydrophobicContact CE1-CD1 4.26Å; Y142-I185 HydrophobicContact CE1-CG1 3.44Å; Y142-I185 VanDerWaalsContact CE1-CG1 3.44Å; Y142-I185 HydrophobicContact CG-CG1 4.17Å; I151-I185 HydrophobicContact CD1-CG2 4.13Å; I151-I185 HydrophobicContact CG2-CD1 4.3Å; L167-I185 HydrophobicContact CD1-CD1 4.02Å; E181-I185 HydrophobicContact CG-CD1 4.33Å; E181-I185 VanDerWaalsContact O-CG1 3.32Å; E181-I185 WeakPolarHBondContact O-CG1 3.13Å; E181-I185 PolarHBondContact O-N 2.83Å; L182-I185 WeakPolarHBondContact O-CB 3.42Å; L182-I185 PolarHBondContact O-N 2.81Å; L182-I185 VanDerWaalsContact O-N 3.14Å; I183-I185 VanDerWaalsContact C-N 3.33Å; I183-I185 PolarHBondContact O-N 2.94Å; I185-N188 PolarHBondContact O-N 2.78Å; I185-F189 HydrophobicContact CG2-CD2 3.77Å; I185-F189 HydrophobicContact CG2-CE2 3.58Å; I185-F189 HydrophobicContact CG2-CZ 4.46Å; I185-F189 WeakPolarHBondContact O-CD2 3.28Å; I185-F189 WeakPolarHBondContact O-CG 3.42Å; I185-F189 PolarHBondContact O-N 3.43Å
186	L	91.9	Very high	89.3	Confident	14 Å²	14	49 Å²	49	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-42.6	-179.6	-63.1	170.7	0	0	0	111.5	L104 L182 I183 F189 N190 I191	L104-L186 HydrophobicContact CB-CD2 4.08Å; L104-L186 HydrophobicContact CD2-CD2 3.87Å; L104-L186 HydrophobicContact CG-CD2 4.49Å; L104-L186 WeakPolarHBondContact O-CD1 3.41Å; L182-L186 HydrophobicContact CD1-CD1 4.09Å; L182-L186 HydrophobicContact CD1-CD2 4.4Å; L182-L186 HydrophobicContact CD1-CG 4.09Å; L182-L186 HydrophobicContact CG-CD1 3.92Å; L182-L186 HydrophobicContact CG-CG 4.35Å; L182-L186 VanDerWaalsContact O-CG 3.25Å; L182-L186 WeakPolarHBondContact O-CG 3.28Å; L182-L186 PolarHBondContact O-N 3.35Å; I183-L186 PolarHBondContact O-N 3.14Å; I183-L186 VanDerWaalsContact O-N 3.17Å; L186-F189 CarbonylContact O-C 3.58Å; L186-F189 PolarHBondContact O-N 3.41Å; L186-N190 WeakPolarHBondContact O-CA 3.35Å; L186-N190 PolarHBondContact O-N 2.72Å; L186-I191 HydrophobicContact CB-CB 4.37Å; L186-I191 HydrophobicContact CD2-CB 3.82Å; L186-I191 HydrophobicContact CD2-CD1 3.95Å; L186-I191 HydrophobicContact CD2-CG1 4.48Å; L186-I191 HydrophobicContact CD2-CG2 3.78Å; L186-I191 PolarHBondContact O-N 3.27Å
187	D	89.6	Confident	88.5	Confident	115 Å²	115	48.1 Å²	48.1	62%	0.615	25%	0.248	S	C	*	.	H	α-helix	trans	-64	-44.4	177.2	-71.6	-14.9	0	0	0	111.2	I183 F189 N190	I183-D187 WeakPolarHBondContact O-CB 3.24Å; I183-D187 VanDerWaalsContact O-CG 3.3Å; I183-D187 PolarHBondContact O-N 3.37Å; D187-F189 VanDerWaalsContact C-N 3.31Å; D187-F189 PolarHBondContact O-N 2.93Å; D187-N190 PolarHBondContact O-N 3Å
188	N	90.3	Very high	88	Confident	77 Å²	77	44.1 Å²	44.1	41%	0.412	22%	0.223	S	C	.	.	H	α-helix	trans	-61.6	-38.9	177.4	-175.6	88.6	0	0	0	112.3	D140 Y142 S184 I185 N190	D140-N188 PolarHBondContact O-ND2 3.36Å; Y142-N188 HydrophobicContact CD2-CB 3.68Å; Y142-N188 HydrophobicContact CE2-CB 4.32Å; S184-N188 WeakPolarHBondContact O-CB 3.42Å; S184-N188 PolarHBondContact O-N 3.42Å; I185-N188 PolarHBondContact O-N 2.78Å; N188-N190 VanDerWaalsContact C-N 3.3Å
189	F	89.6	Confident	87.6	Confident	9 Å²	9	37.7 Å²	37.7	4%	0.039	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.3	176.2	-63.9	-26.4	0	0	0	113.9	A56 L134 N136 D140 I151 I185 L186 D187 I191 P1020	A56-F189 HydrophobicContact CB-CD1 3.79Å; A56-F189 HydrophobicContact CB-CE1 3.51Å; A56-F189 HydrophobicContact CB-CZ 4.28Å; L134-F189 HydrophobicContact CD1-CD2 4.27Å; L134-F189 HydrophobicContact CD1-CE2 4.42Å; N136-F189 HydrophobicContact CB-CZ 4.33Å; N136-F189 VanDerWaalsContact OD1-CZ 3.32Å; N136-F189 WeakPolarHBondContact OD1-CZ 3.21Å; D140-F189 WeakPolarHBondContact O-CE1 3.16Å; I151-F189 HydrophobicContact CD1-CE2 3.93Å; I151-F189 HydrophobicContact CD1-CZ 3.88Å; I185-F189 HydrophobicContact CG2-CD2 3.77Å; I185-F189 HydrophobicContact CG2-CE2 3.58Å; I185-F189 HydrophobicContact CG2-CZ 4.46Å; I185-F189 WeakPolarHBondContact O-CD2 3.28Å; I185-F189 WeakPolarHBondContact O-CG 3.42Å; I185-F189 PolarHBondContact O-N 3.43Å; L186-F189 CarbonylContact O-C 3.58Å; L186-F189 PolarHBondContact O-N 3.41Å; D187-F189 VanDerWaalsContact C-N 3.31Å; D187-F189 PolarHBondContact O-N 2.93Å; F189-I191 VanDerWaalsContact C-N 3.28Å; F189-I191 HydrophobicContact CB-CD1 3.73Å; F189-I191 HydrophobicContact CB-CG1 3.79Å; F189-I191 HydrophobicContact CD2-CD1 3.96Å; F189-I191 HydrophobicContact CG-CD1 4.36Å; F189-I191 PolarHBondContact O-N 3.44Å; F189-P1020 WeakPolarHBondContact O-CD 3.44Å; F189-P1020 WeakPolarHBondContact O-CG 3.33Å
190	N	87.4	Confident	87.3	Confident	51 Å²	51	34.5 Å²	34.5	27%	0.273	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	43.3	-173.7	-165.3	18.9	0	0	0	113	L186 D187 N188 Q192 E1018 P1020	L186-N190 WeakPolarHBondContact O-CA 3.35Å; L186-N190 PolarHBondContact O-N 2.72Å; D187-N190 PolarHBondContact O-N 3Å; N188-N190 VanDerWaalsContact C-N 3.3Å; N190-Q192 PolarHBondContact OD1-NE2 3.46Å; N190-E1018 PolarHBondContact ND2-O 2.92Å; N190-P1020 WeakPolarHBondContact O-CD 3.39Å
191	I	89.6	Confident	86.7	Confident	12 Å²	12	29 Å²	29	6%	0.062	16%	0.158	C	C	.	.			trans	-86.5	114.5	178.4	-65.7	168.6	0	0	0	109.5	L104 L134 L186 F189 V193 P1020 F1021	L104-I191 HydrophobicContact CD1-CG2 4.15Å; L134-I191 HydrophobicContact CD1-CD1 3.73Å; L134-I191 HydrophobicContact CD2-CD1 4.46Å; L186-I191 HydrophobicContact CB-CB 4.37Å; L186-I191 HydrophobicContact CD2-CB 3.82Å; L186-I191 HydrophobicContact CD2-CD1 3.95Å; L186-I191 HydrophobicContact CD2-CG1 4.48Å; L186-I191 HydrophobicContact CD2-CG2 3.78Å; L186-I191 PolarHBondContact O-N 3.27Å; F189-I191 VanDerWaalsContact C-N 3.28Å; F189-I191 HydrophobicContact CB-CD1 3.73Å; F189-I191 HydrophobicContact CB-CG1 3.79Å; F189-I191 HydrophobicContact CD2-CD1 3.96Å; F189-I191 HydrophobicContact CG-CD1 4.36Å; F189-I191 PolarHBondContact O-N 3.44Å; I191-V193 HydrophobicContact CG2-CG1 3.99Å; I191-P1020 HydrophobicContact CD1-CG 4.39Å; I191-P1020 HydrophobicContact CG1-CG 3.45Å; I191-P1020 VanDerWaalsContact CG1-CG 3.45Å; I191-F1021 HydrophobicContact CD1-CE1 4.38Å; I191-F1021 HydrophobicContact CG1-CE1 4.2Å; I191-F1021 HydrophobicContact CG2-CE1 3.76Å; I191-F1021 HydrophobicContact CG2-CZ 4Å
192	Q	84.8	Confident	85.9	Confident	23 Å²	23	28.7 Å²	28.7	11%	0.107	16%	0.156	C	C	.	.			trans	-116.9	75.8	-172.7	-55.1	176.4	15	0	0	112.1	N190 N194 N195 S198 Q226	N190-Q192 PolarHBondContact OD1-NE2 3.46Å; Q192-N194 VanDerWaalsContact C-N 3.29Å; Q192-N194 PolarHBondContact O-N 2.95Å; Q192-N195 HydrophobicContact CB-CB 3.77Å; Q192-N195 WeakPolarHBondContact O-CB 3.26Å; Q192-N195 PolarHBondContact O-N 3.45Å; Q192-N195 VanDerWaalsContact O-N 3.17Å; Q192-N195 PolarHBondContact OE1-ND2 3.4Å; Q192-S198 WeakPolarHBondContact O-CB 3.37Å; Q192-Q226 VanDerWaalsContact CD-CD 3.4Å; Q192-Q226 VanDerWaalsContact OE1-NE2 3.11Å
193	V	84.4	Confident	84.9	Confident	12 Å²	12	31.6 Å²	31.6	7%	0.073	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-20.1	-176.2	-65.3	0	0	0	0	115.2	L104 I191 F1021	L104-V193 HydrophobicContact CB-CG1 3.63Å; L104-V193 HydrophobicContact CB-CG2 4.26Å; L104-V193 HydrophobicContact CD1-CG1 3.74Å; L104-V193 HydrophobicContact CG-CG1 4.32Å; L104-V193 WeakPolarHBondContact O-CG2 3.44Å; I191-V193 HydrophobicContact CG2-CG1 3.99Å; V193-F1021 HydrophobicContact CG1-CZ 4.4Å
194	N	80.7	Confident	84	Confident	83 Å²	83	31.1 Å²	31.1	44%	0.444	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.7	175	-64.7	-37.6	0	0	0	112.8	G106 Q192 P196	G106-N194 WeakPolarHBondContact CA-OD1 3.35Å; Q192-N194 VanDerWaalsContact C-N 3.29Å; Q192-N194 PolarHBondContact O-N 2.95Å; N194-P196 WeakPolarHBondContact O-CD 3.48Å
195	N	83.9	Confident	82.7	Confident	9 Å²	9	29.5 Å²	29.5	5%	0.048	16%	0.155	C	C	.	.			trans	-79.9	116.5	176.4	-176.1	-20.3	0	0	0	109	Q192 V197 S198 V199 A224	Q192-N195 HydrophobicContact CB-CB 3.77Å; Q192-N195 WeakPolarHBondContact O-CB 3.26Å; Q192-N195 PolarHBondContact O-N 3.45Å; Q192-N195 VanDerWaalsContact O-N 3.17Å; Q192-N195 PolarHBondContact OE1-ND2 3.4Å; N195-V197 PolarHBondContact O-N 2.86Å; N195-V197 VanDerWaalsContact O-N 3.08Å; N195-V197 WeakPolarHBondContact OD1-CB 3.39Å; N195-V197 PolarHBondContact OD1-N 2.76Å; N195-S198 PolarHBondContact O-N 3.34Å; N195-S198 VanDerWaalsContact O-N 3.08Å; N195-V199 PolarHBondContact O-N 3.26Å; N195-V199 VanDerWaalsContact O-N 3.08Å; N195-A224 PolarHBondContact ND2-O 2.88Å; N195-A224 WeakPolarHBondContact OD1-CA 3.46Å
196	P	74.4	Confident	81.5	Confident	15 Å²	15	32.6 Å²	32.6	10%	0.097	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.9	-175	28.4	-36.5	0	0	0	113.5	N194 V199 L200 F220	N194-P196 WeakPolarHBondContact O-CD 3.48Å; P196-V199 CarbonylContact O-C 3.59Å; P196-L200 WeakPolarHBondContact O-CA 3.26Å; P196-L200 WeakPolarHBondContact O-CD1 3.31Å; P196-L200 PolarHBondContact O-N 3.3Å; P196-F220 HydrophobicContact CB-CE2 3.65Å; P196-F220 HydrophobicContact CB-CZ 4.12Å; P196-F220 HydrophobicContact CG-CD2 4.04Å; P196-F220 HydrophobicContact CG-CE2 3.46Å; P196-F220 VanDerWaalsContact CG-CE2 3.46Å; P196-F220 HydrophobicContact CG-CZ 3.96Å
197	V	78.2	Confident	80.2	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-30.2	177	173	0	0	0	0	112.2	N195 F220 A224 L1013 W1014 T1017	N195-V197 PolarHBondContact O-N 2.86Å; N195-V197 VanDerWaalsContact O-N 3.08Å; N195-V197 WeakPolarHBondContact OD1-CB 3.39Å; N195-V197 PolarHBondContact OD1-N 2.76Å; V197-F220 HydrophobicContact CG2-CE1 3.58Å; V197-F220 HydrophobicContact CG2-CZ 3.66Å; V197-A224 HydrophobicContact CB-CB 4.12Å; V197-A224 HydrophobicContact CG2-CB 3.4Å; V197-A224 VanDerWaalsContact CG2-CB 3.4Å; V197-L1013 HydrophobicContact CG1-CB 3.86Å; V197-L1013 HydrophobicContact CG2-CB 4.26Å; V197-L1013 HydrophobicContact CG2-CD1 3.73Å; V197-W1014 PolarHBondContact O-NE1 3.44Å; V197-T1017 HydrophobicContact CG1-CG2 4.48Å
198	S	84.1	Confident	79	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.007	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-40.3	173.9	-60.3	0	0	0	0	111	Q192 N195 R1022 C1023	Q192-S198 WeakPolarHBondContact O-CB 3.37Å; N195-S198 PolarHBondContact O-N 3.34Å; N195-S198 VanDerWaalsContact O-N 3.08Å; S198-R1022 CarbonylContact O-C 3.47Å; S198-R1022 VanDerWaalsContact O-CA 3.24Å; S198-R1022 WeakPolarHBondContact O-CA 3.48Å; S198-C1023 PolarHBondContact O-N 3.45Å
199	V	85.3	Confident	77.3	Confident	8 Å²	8	33.1 Å²	33.1	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	95.2	175.9	-177	0	0	0	0	109.3	L97 I101 N195 P196 F1021 C1023	L97-V199 HydrophobicContact CD1-CG1 3.56Å; L97-V199 HydrophobicContact CD2-CG1 4.41Å; L97-V199 HydrophobicContact CG-CG1 4.05Å; I101-V199 HydrophobicContact CD1-CG1 3.72Å; I101-V199 HydrophobicContact CG1-CG1 3.78Å; N195-V199 PolarHBondContact O-N 3.26Å; N195-V199 VanDerWaalsContact O-N 3.08Å; P196-V199 CarbonylContact O-C 3.59Å; V199-F1021 HydrophobicContact CG2-CE2 4.44Å; V199-C1023 HydrophobicContact CG1-CB 4.23Å; V199-C1023 HydrophobicContact CG2-CB 4.45Å
200	L	80.9	Confident	75.8	Confident	9 Å²	9	38.1 Å²	38.1	5%	0.047	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	106.6	-179.4	-166.8	72.6	0	0	0	110.3	P196 M204 V1010 C1023 L1024 D1025	P196-L200 WeakPolarHBondContact O-CA 3.26Å; P196-L200 WeakPolarHBondContact O-CD1 3.31Å; P196-L200 PolarHBondContact O-N 3.3Å; L200-M204 HydrophobicContact CD1-CB 4.19Å; L200-V1010 HydrophobicContact CD2-CG2 4.24Å; L200-C1023 PolarHBondContact N-O 3.49Å; L200-L1024 HydrophobicContact CB-CD2 3.88Å; L200-L1024 HydrophobicContact CD2-CD2 3.41Å; L200-L1024 VanDerWaalsContact CD2-CD2 3.41Å; L200-L1024 HydrophobicContact CG-CD2 4.22Å; L200-D1025 PolarHBondContact O-N 3.04Å
201	T	81.4	Confident	74.6	Confident	10 Å²	10	37 Å²	37	6%	0.061	18%	0.178	C	C	.	.			trans	-79.5	158	174.1	66.1	0	0	0	0	111.4	L97 I101 N112 E203 M204 S205	L97-T201 HydrophobicContact CD2-CG2 4.12Å; I101-T201 HydrophobicContact CD1-CG2 4.18Å; N112-T201 PolarHBondContact ND2-OG1 2.79Å; T201-E203 VanDerWaalsContact C-N 3.26Å; T201-E203 PolarHBondContact O-N 3.35Å; T201-M204 PolarHBondContact O-N 2.84Å; T201-M204 WeakPolarHBondContact OG1-CB 3.49Å; T201-M204 VanDerWaalsContact OG1-CG 3.28Å; T201-M204 WeakPolarHBondContact OG1-CG 3.32Å; T201-M204 PolarHBondContact OG1-N 3.02Å; T201-S205 PolarHBondContact O-N 3.32Å; T201-S205 VanDerWaalsContact O-N 3.08Å
202	Q	76.1	Confident	73.1	Confident	28 Å²	28	44.6 Å²	44.6	13%	0.131	21%	0.211	C	C	.	.	H	α-helix	trans	-55.7	-38	179	-173.6	-165	13.6	0	0	113	S205 K206 E1026	Q202-S205 PolarHBondContact O-OG 3.34Å; Q202-K206 WeakPolarHBondContact O-CG 3.32Å; Q202-K206 PolarHBondContact O-N 3.07Å; Q202-E1026 HydrophobicContact CB-CB 4.47Å; Q202-E1026 HydrophobicContact CG-CB 4.1Å; Q202-E1026 PolarHBondContact NE2-OE2 3.47Å
203	E	72.6	Confident	72.4	Confident	63 Å²	63	44.8 Å²	44.8	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-76.2	-38.1	179.5	-71.3	-178.6	-161.2	0	0	111.8	N112 T201 S205 K206 Y207	N112-E203 HydrophobicContact CB-CB 4.2Å; N112-E203 WeakPolarHBondContact CB-OE2 3.44Å; T201-E203 VanDerWaalsContact C-N 3.26Å; T201-E203 PolarHBondContact O-N 3.35Å; E203-S205 VanDerWaalsContact C-N 3.33Å; E203-S205 PolarHBondContact O-N 3.01Å; E203-K206 WeakPolarHBondContact O-CB 3.49Å; E203-K206 PolarHBondContact O-N 3.44Å; E203-K206 VanDerWaalsContact O-N 3.15Å; E203-Y207 HydrophobicContact CB-CD2 4.47Å; E203-Y207 VanDerWaalsContact O-CD2 3.26Å; E203-Y207 WeakPolarHBondContact O-CD2 3.29Å; E203-Y207 PolarHBondContact O-N 3.4Å
204	M	71.6	Confident	72.3	Confident	63 Å²	63	48 Å²	48	31%	0.31	23%	0.234	S	C	.	.	H	α-helix	trans	-63.9	-38.6	177.3	-74.4	-62.8	171.9	0	0	112.2	N112 L200 T201 K206 Y207 F208	N112-M204 WeakPolarHBondContact ND2-CE 3.47Å; N112-M204 WeakPolarHBondContact ND2-CG 3.26Å; N112-M204 WeakPolarHBondContact OD1-CE 3.35Å; L200-M204 HydrophobicContact CD1-CB 4.19Å; T201-M204 PolarHBondContact O-N 2.84Å; T201-M204 WeakPolarHBondContact OG1-CB 3.49Å; T201-M204 VanDerWaalsContact OG1-CG 3.28Å; T201-M204 WeakPolarHBondContact OG1-CG 3.32Å; T201-M204 PolarHBondContact OG1-N 3.02Å; M204-K206 VanDerWaalsContact C-N 3.31Å; M204-K206 PolarHBondContact O-N 2.93Å; M204-Y207 PolarHBondContact O-N 3.35Å; M204-F208 WeakPolarHBondContact O-CB 3.48Å; M204-F208 PolarHBondContact O-N 2.99Å; M204-F208 VanDerWaalsContact O-N 3.09Å
205	S	67.1	Low	72.5	Confident	16 Å²	16	45.2 Å²	45.2	11%	0.112	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-36.4	174.6	65.1	0	0	0	0	112	T201 Q202 E203 L209	T201-S205 PolarHBondContact O-N 3.32Å; T201-S205 VanDerWaalsContact O-N 3.08Å; Q202-S205 PolarHBondContact O-OG 3.34Å; E203-S205 VanDerWaalsContact C-N 3.33Å; E203-S205 PolarHBondContact O-N 3.01Å; S205-L209 WeakPolarHBondContact O-CD1 3.4Å; S205-L209 WeakPolarHBondContact O-CG 3.46Å; S205-L209 PolarHBondContact O-N 2.9Å
206	K	66.8	Low	72.4	Confident	66 Å²	66	48.6 Å²	48.6	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-70	-44.3	173.9	-72.1	174.5	-175.5	174.8	0	113.5	Q202 E203 M204 F208 L209 H210 Y1030	Q202-K206 WeakPolarHBondContact O-CG 3.32Å; Q202-K206 PolarHBondContact O-N 3.07Å; E203-K206 WeakPolarHBondContact O-CB 3.49Å; E203-K206 PolarHBondContact O-N 3.44Å; E203-K206 VanDerWaalsContact O-N 3.15Å; M204-K206 VanDerWaalsContact C-N 3.31Å; M204-K206 PolarHBondContact O-N 2.93Å; K206-F208 VanDerWaalsContact C-N 3.28Å; K206-F208 PolarHBondContact O-N 3.18Å; K206-L209 WeakPolarHBondContact O-CB 3.42Å; K206-L209 PolarHBondContact O-N 2.83Å; K206-H210 PolarHBondContact O-N 3.34Å; K206-H210 PolarHBondContact O-ND1 3.49Å; K206-Y1030 VanDerWaalsContact CE-CE2 3.45Å; K206-Y1030 VanDerWaalsContact CE-CZ 3.47Å; K206-Y1030 WeakPolarHBondContact CE-OH 2.95Å; K206-Y1030 HydrophobicContact CG-CE2 4.5Å; K206-Y1030 PolarHBondContact NZ-OH 3.49Å
207	Y	65.8	Low	72.8	Confident	165 Å²	165	48.6 Å²	48.6	65%	0.647	24%	0.241	S	C	*	.	H	α-helix	trans	-62.1	-39.2	179.4	-90.5	-74.7	0	0	0	111.3	E203 M204 L209 H210 S211	E203-Y207 HydrophobicContact CB-CD2 4.47Å; E203-Y207 VanDerWaalsContact O-CD2 3.26Å; E203-Y207 WeakPolarHBondContact O-CD2 3.29Å; E203-Y207 PolarHBondContact O-N 3.4Å; M204-Y207 PolarHBondContact O-N 3.35Å; Y207-L209 PolarHBondContact O-N 2.64Å; Y207-H210 PolarHBondContact O-N 3.44Å; Y207-S211 PolarHBondContact O-N 2.96Å
208	F	63.2	Low	73.3	Confident	20 Å²	20	48.6 Å²	48.6	9%	0.088	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-38.7	175.6	-179	-99.8	0	0	0	113	M204 K206 H210 S211 F220 T1006 F1009	M204-F208 WeakPolarHBondContact O-CB 3.48Å; M204-F208 PolarHBondContact O-N 2.99Å; M204-F208 VanDerWaalsContact O-N 3.09Å; K206-F208 VanDerWaalsContact C-N 3.28Å; K206-F208 PolarHBondContact O-N 3.18Å; F208-H210 VanDerWaalsContact C-N 3.25Å; F208-H210 PolarHBondContact O-N 3.25Å; F208-S211 PolarHBondContact O-OG 2.62Å; F208-F220 HydrophobicContact CD2-CD1 4.13Å; F208-F220 HydrophobicContact CD2-CD2 4.32Å; F208-F220 HydrophobicContact CD2-CE1 4.37Å; F208-F220 HydrophobicContact CD2-CG 4.1Å; F208-F220 HydrophobicContact CE2-CD1 4.02Å; F208-F220 HydrophobicContact CE2-CE1 4.42Å; F208-F220 HydrophobicContact CE2-CG 4.29Å; F208-T1006 HydrophobicContact CD1-CG2 3.85Å; F208-T1006 HydrophobicContact CE1-CG2 4.08Å; F208-F1009 AromaticContact CE1-CD1 3.53Å; F208-F1009 HydrophobicContact CE1-CD1 3.53Å; F208-F1009 AromaticContact CE1-CE1 3.96Å; F208-F1009 HydrophobicContact CE1-CE1 3.96Å; F208-F1009 HydrophobicContact CE1-CG 4.37Å; F208-F1009 AromaticContact CE2-CD1 3.94Å; F208-F1009 HydrophobicContact CE2-CD1 3.94Å; F208-F1009 AromaticContact CE2-CE1 3.45Å; F208-F1009 HydrophobicContact CE2-CE1 3.45Å; F208-F1009 VanDerWaalsContact CE2-CE1 3.45Å; F208-F1009 HydrophobicContact CE2-CZ 4.28Å; F208-F1009 AromaticContact CZ-CD1 3.13Å; F208-F1009 HydrophobicContact CZ-CD1 3.13Å; F208-F1009 AromaticContact CZ-CE1 3.1Å; F208-F1009 HydrophobicContact CZ-CE1 3.1Å; F208-F1009 HydrophobicContact CZ-CG 4.05Å; F208-F1009 HydrophobicContact CZ-CZ 4.01Å
209	L	55.9	Low	73.4	Confident	31 Å²	31	54 Å²	54	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-66.7	-23.2	177.4	-78	163.5	0	0	0	113.9	S205 K206 Y207 R1002 T1006	S205-L209 WeakPolarHBondContact O-CD1 3.4Å; S205-L209 WeakPolarHBondContact O-CG 3.46Å; S205-L209 PolarHBondContact O-N 2.9Å; K206-L209 WeakPolarHBondContact O-CB 3.42Å; K206-L209 PolarHBondContact O-N 2.83Å; Y207-L209 PolarHBondContact O-N 2.64Å; L209-R1002 HydrophobicContact CD2-CG 3.72Å; L209-T1006 HydrophobicContact CD2-CG2 4.25Å; L209-T1006 WeakPolarHBondContact CD2-OG1 3.18Å; L209-T1006 HydrophobicContact CG-CG2 4.36Å
210	H	57.4	Low	73.3	Confident	115 Å²	115	55 Å²	55	53%	0.532	27%	0.268	S	S	.	.	H	α-helix	trans	-116.3	0.1	-173.2	-61.3	101.6	0	0	0	114.1	K206 Y207 F208 K212	K206-H210 PolarHBondContact O-N 3.34Å; K206-H210 PolarHBondContact O-ND1 3.49Å; Y207-H210 PolarHBondContact O-N 3.44Å; F208-H210 VanDerWaalsContact C-N 3.25Å; F208-H210 PolarHBondContact O-N 3.25Å; H210-K212 PolarHBondContact O-N 3.4Å
211	S	62.8	Low	73.6	Confident	26 Å²	26	54.6 Å²	54.6	18%	0.182	27%	0.266	C	S	.	.			trans	-64.3	121.2	179.8	63.4	0	0	0	0	110.8	Y207 F208	Y207-S211 PolarHBondContact O-N 2.96Å; F208-S211 PolarHBondContact O-OG 2.62Å
212	K	56.9	Low	73.9	Confident	172 Å²	172	54.4 Å²	54.4	75%	0.748	26%	0.264	S	S	*	.			trans	-80.5	-19.8	-173.6	-67	-176.1	-179.4	-179.8	0	113.8	H210 R995	H210-K212 PolarHBondContact O-N 3.4Å; K212-R995 PolarHBondContact O-NH2 3.24Å
213	G	72	Confident	74.4	Confident	27 Å²	27	58.4 Å²	58.4	28%	0.278	28%	0.281	S	S	.	.			trans	-98.1	131.4	-175.2	0	0	0	0	0	113.2	G215 D216 K217	G213-G215 PolarHBondContact O-N 2.9Å; G213-D216 PolarHBondContact O-N 3.04Å; G213-D216 VanDerWaalsContact O-N 3.08Å; G213-K217 PolarHBondContact O-N 3.19Å
214	E	82.1	Confident	74.9	Confident	81 Å²	81	55.4 Å²	55.4	38%	0.379	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-27.9	167	-58.4	-175.6	141.2	0	0	111.9	Y218 T976 L977 T978	E214-Y218 PolarHBondContact O-N 3.12Å; E214-T976 HydrophobicContact CB-CG2 4.19Å; E214-L977 PolarHBondContact O-N 2.84Å; E214-T978 VanDerWaalsContact CD-OG1 3.23Å; E214-T978 WeakPolarHBondContact OE1-CB 3.47Å; E214-T978 VanDerWaalsContact OE1-CG2 3.31Å; E214-T978 WeakPolarHBondContact OE1-CG2 3.48Å; E214-T978 PolarHBondContact OE1-OG1 3.24Å
215	G	84.4	Confident	75.6	Confident	24 Å²	24	53.2 Å²	53.2	25%	0.247	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-33.9	173.1	0	0	0	0	0	114.1	G213 Y218 K219 E975	G213-G215 PolarHBondContact O-N 2.9Å; G215-Y218 PolarHBondContact O-N 3.29Å; G215-K219 WeakPolarHBondContact O-CG 3.39Å; G215-K219 PolarHBondContact O-N 3.47Å; G215-E975 WeakPolarHBondContact CA-O 3.47Å
216	D	81.8	Confident	76.6	Confident	80 Å²	80	56.3 Å²	56.3	43%	0.428	27%	0.27	S	S	.	.	H	α-helix	trans	-69.5	-38	177.6	-63.6	-33.5	0	0	0	111.1	G213 Y218 K219 F220	G213-D216 PolarHBondContact O-N 3.04Å; G213-D216 VanDerWaalsContact O-N 3.08Å; D216-Y218 VanDerWaalsContact C-N 3.31Å; D216-Y218 PolarHBondContact O-N 3.26Å; D216-K219 PolarHBondContact O-N 3.23Å; D216-F220 WeakPolarHBondContact O-CB 3.49Å; D216-F220 PolarHBondContact O-N 3.41Å
217	K	82.1	Confident	77.7	Confident	14 Å²	14	53.2 Å²	53.2	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-41.2	173.1	-62.8	176.8	-176.8	175.8	0	111	G213 F220 F221 L977 D993	G213-K217 PolarHBondContact O-N 3.19Å; K217-F220 PolarHBondContact O-N 3.19Å; K217-F221 PolarHBondContact O-N 2.85Å; K217-F221 VanDerWaalsContact O-N 3.07Å; K217-L977 HydrophobicContact CB-CB 4Å; K217-L977 HydrophobicContact CB-CD2 4.15Å; K217-L977 HydrophobicContact CB-CG 4.2Å; K217-L977 WeakPolarHBondContact CD-O 3.24Å; K217-D993 IonicContact NZ-OD1 3.54Å
218	Y	88.1	Confident	78.8	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-66.7	-47.2	176.1	-175.1	-94.2	0	0	0	112.1	E214 G215 D216 F220 F221 M222 R944 F970 H972 E975 L977	E214-Y218 PolarHBondContact O-N 3.12Å; G215-Y218 PolarHBondContact O-N 3.29Å; D216-Y218 VanDerWaalsContact C-N 3.31Å; D216-Y218 PolarHBondContact O-N 3.26Å; Y218-F220 VanDerWaalsContact C-N 3.26Å; Y218-F220 PolarHBondContact O-N 3.01Å; Y218-F221 WeakPolarHBondContact O-CB 3.48Å; Y218-F221 PolarHBondContact O-N 3.34Å; Y218-F221 VanDerWaalsContact O-N 3.09Å; Y218-M222 HydrophobicContact CD1-CG 3.75Å; Y218-M222 HydrophobicContact CE1-CG 3.4Å; Y218-M222 VanDerWaalsContact CE1-CG 3.4Å; Y218-M222 HydrophobicContact CE1-SD 3.86Å; Y218-M222 HydrophobicContact CE2-SD 4.47Å; Y218-M222 HydrophobicContact CG-CG 4.48Å; Y218-M222 WeakPolarHBondContact O-CG 3.4Å; Y218-M222 PolarHBondContact O-N 2.8Å; Y218-R944 PolarHBondContact OH-NH1 3.21Å; Y218-F970 HydrophobicContact CD2-CD1 4.45Å; Y218-H972 AromaticContact CE2-ND1 3.45Å; Y218-H972 WeakPolarHBondContact CE2-ND1 3.4Å; Y218-H972 AromaticContact CZ-ND1 3.72Å; Y218-H972 PolarHBondContact OH-ND1 3.3Å; Y218-H972 VanDerWaalsContact OH-ND1 3.12Å; Y218-E975 WeakPolarHBondContact CB-O 3.36Å; Y218-E975 HydrophobicContact CD1-CB 3.65Å; Y218-E975 HydrophobicContact CD1-CG 4.33Å; Y218-E975 WeakPolarHBondContact CD1-O 3.21Å; Y218-E975 HydrophobicContact CE1-CB 3.66Å; Y218-E975 HydrophobicContact CE1-CG 3.84Å; Y218-E975 VanDerWaalsContact CG-C 3.45Å; Y218-E975 HydrophobicContact CG-CB 4.39Å; Y218-L977 HydrophobicContact CD2-CB 4.45Å
219	K	86.6	Confident	79.9	Confident	113 Å²	113	51.3 Å²	51.3	49%	0.491	25%	0.254	S	S	.	.	H	α-helix	trans	-56.3	-42.3	174.4	-74.8	176.1	-177.1	175.3	0	111.6	G215 D216 F221 M222 K223	G215-K219 WeakPolarHBondContact O-CG 3.39Å; G215-K219 PolarHBondContact O-N 3.47Å; D216-K219 PolarHBondContact O-N 3.23Å; K219-F221 PolarHBondContact O-N 2.99Å; K219-M222 PolarHBondContact O-N 3.1Å; K219-K223 WeakPolarHBondContact O-CB 3.37Å; K219-K223 PolarHBondContact O-N 2.91Å
220	F	82.9	Confident	81.5	Confident	31 Å²	31	52.7 Å²	52.7	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-45.7	175.2	-173.4	-90.6	0	0	0	112.1	P196 V197 F208 D216 K217 Y218 K223 A224 F1009 L1013	P196-F220 HydrophobicContact CB-CE2 3.65Å; P196-F220 HydrophobicContact CB-CZ 4.12Å; P196-F220 HydrophobicContact CG-CD2 4.04Å; P196-F220 HydrophobicContact CG-CE2 3.46Å; P196-F220 VanDerWaalsContact CG-CE2 3.46Å; P196-F220 HydrophobicContact CG-CZ 3.96Å; V197-F220 HydrophobicContact CG2-CE1 3.58Å; V197-F220 HydrophobicContact CG2-CZ 3.66Å; F208-F220 HydrophobicContact CD2-CD1 4.13Å; F208-F220 HydrophobicContact CD2-CD2 4.32Å; F208-F220 HydrophobicContact CD2-CE1 4.37Å; F208-F220 HydrophobicContact CD2-CG 4.1Å; F208-F220 HydrophobicContact CE2-CD1 4.02Å; F208-F220 HydrophobicContact CE2-CE1 4.42Å; F208-F220 HydrophobicContact CE2-CG 4.29Å; D216-F220 WeakPolarHBondContact O-CB 3.49Å; D216-F220 PolarHBondContact O-N 3.41Å; K217-F220 PolarHBondContact O-N 3.19Å; Y218-F220 VanDerWaalsContact C-N 3.26Å; Y218-F220 PolarHBondContact O-N 3.01Å; F220-K223 PolarHBondContact O-N 3.47Å; F220-A224 WeakPolarHBondContact O-CB 3.26Å; F220-A224 PolarHBondContact O-N 2.82Å; F220-F1009 HydrophobicContact CD1-CE1 4Å; F220-F1009 HydrophobicContact CE1-CE1 4.07Å; F220-L1013 HydrophobicContact CD1-CD1 4.03Å; F220-L1013 HydrophobicContact CE1-CD1 3.6Å
221	F	87.1	Confident	83	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-46.2	173.7	167.4	-94.8	0	0	0	112.1	K217 Y218 K219 K223 A224 T225 L227 L947 S948 C951 F970 L977 L1013 I1016	K217-F221 PolarHBondContact O-N 2.85Å; K217-F221 VanDerWaalsContact O-N 3.07Å; Y218-F221 WeakPolarHBondContact O-CB 3.48Å; Y218-F221 PolarHBondContact O-N 3.34Å; Y218-F221 VanDerWaalsContact O-N 3.09Å; K219-F221 PolarHBondContact O-N 2.99Å; F221-K223 VanDerWaalsContact C-N 3.34Å; F221-K223 PolarHBondContact O-N 3.43Å; F221-A224 PolarHBondContact O-N 2.97Å; F221-T225 HydrophobicContact CD2-CG2 4.07Å; F221-T225 HydrophobicContact CE2-CG2 3.73Å; F221-T225 HydrophobicContact CZ-CG2 3.99Å; F221-T225 WeakPolarHBondContact O-CB 3.32Å; F221-T225 WeakPolarHBondContact O-CG2 3.49Å; F221-T225 PolarHBondContact O-N 3.49Å; F221-T225 PolarHBondContact O-OG1 3.27Å; F221-L227 HydrophobicContact CE1-CD1 4.11Å; F221-L947 HydrophobicContact CZ-CB 4.16Å; F221-S948 WeakPolarHBondContact CZ-OG 3.24Å; F221-C951 HydrophobicContact CE2-CB 4.21Å; F221-F970 HydrophobicContact CB-CE1 4.37Å; F221-F970 HydrophobicContact CD1-CD1 4.39Å; F221-F970 AromaticContact CD1-CE1 3.85Å; F221-F970 HydrophobicContact CD1-CE1 3.85Å; F221-F970 AromaticContact CD2-CE1 3.71Å; F221-F970 HydrophobicContact CD2-CE1 3.71Å; F221-F970 HydrophobicContact CD2-CZ 4.01Å; F221-F970 HydrophobicContact CE1-CD1 4.42Å; F221-F970 HydrophobicContact CE1-CE1 4.01Å; F221-F970 AromaticContact CE2-CE1 3.87Å; F221-F970 HydrophobicContact CE2-CE1 3.87Å; F221-F970 AromaticContact CE2-CZ 3.99Å; F221-F970 HydrophobicContact CE2-CZ 3.99Å; F221-F970 AromaticContact CG-CE1 3.7Å; F221-F970 HydrophobicContact CG-CE1 3.7Å; F221-F970 HydrophobicContact CG-CZ 4.44Å; F221-F970 HydrophobicContact CZ-CE1 4.02Å; F221-F970 HydrophobicContact CZ-CZ 4.42Å; F221-L977 HydrophobicContact CB-CD2 4.3Å; F221-L1013 HydrophobicContact CD2-CD2 3.84Å; F221-L1013 HydrophobicContact CE2-CD2 4.44Å; F221-I1016 HydrophobicContact CD2-CD1 4.48Å; F221-I1016 HydrophobicContact CE2-CD1 3.78Å
222	M	89.1	Confident	84.3	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-39.8	179.4	-67.3	-62.1	-68.6	0	0	112.2	Y218 K219 T225 Q226 L227 E228 Y940	Y218-M222 HydrophobicContact CD1-CG 3.75Å; Y218-M222 HydrophobicContact CE1-CG 3.4Å; Y218-M222 VanDerWaalsContact CE1-CG 3.4Å; Y218-M222 HydrophobicContact CE1-SD 3.86Å; Y218-M222 HydrophobicContact CE2-SD 4.47Å; Y218-M222 HydrophobicContact CG-CG 4.48Å; Y218-M222 WeakPolarHBondContact O-CG 3.4Å; Y218-M222 PolarHBondContact O-N 2.8Å; K219-M222 PolarHBondContact O-N 3.1Å; M222-T225 PolarHBondContact O-OG1 2.9Å; M222-Q226 CarbonylContact O-C 3.49Å; M222-Q226 PolarHBondContact O-N 3.41Å; M222-L227 HydrophobicContact CE-CB 3.41Å; M222-L227 VanDerWaalsContact CE-CB 3.41Å; M222-L227 HydrophobicContact CE-CD1 4.33Å; M222-L227 PolarHBondContact O-N 3.39Å; M222-L227 HydrophobicContact SD-CB 3.94Å; M222-L227 HydrophobicContact SD-CD1 3.98Å; M222-E228 HydrophobicContact CB-CB 4.13Å; M222-E228 PolarHBondContact O-N 3.43Å; M222-E228 VanDerWaalsContact O-N 3.12Å; M222-Y940 WeakPolarHBondContact CE-OH 3.46Å
223	K	85.2	Confident	85.8	Confident	111 Å²	111	49.2 Å²	49.2	48%	0.483	24%	0.243	S	C	.	.	H	α-helix	trans	-70.3	-42.6	175.8	-169.6	169.2	-176.3	171.3	0	112.1	K219 F220 F221 T225 Q226 E228	K219-K223 WeakPolarHBondContact O-CB 3.37Å; K219-K223 PolarHBondContact O-N 2.91Å; F220-K223 PolarHBondContact O-N 3.47Å; F221-K223 VanDerWaalsContact C-N 3.34Å; F221-K223 PolarHBondContact O-N 3.43Å; K223-T225 VanDerWaalsContact C-N 3.32Å; K223-T225 PolarHBondContact O-N 3.01Å; K223-Q226 PolarHBondContact O-N 3.06Å; K223-E228 WeakPolarHBondContact CB-OE2 3.38Å
224	A	83.2	Confident	86.8	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-40	178.3	0	0	0	0	0	112.5	N195 V197 F220 F221 Q226 L1013 T1017	N195-A224 PolarHBondContact ND2-O 2.88Å; N195-A224 WeakPolarHBondContact OD1-CA 3.46Å; V197-A224 HydrophobicContact CB-CB 4.12Å; V197-A224 HydrophobicContact CG2-CB 3.4Å; V197-A224 VanDerWaalsContact CG2-CB 3.4Å; F220-A224 WeakPolarHBondContact O-CB 3.26Å; F220-A224 PolarHBondContact O-N 2.82Å; F221-A224 PolarHBondContact O-N 2.97Å; A224-Q226 VanDerWaalsContact C-N 3.33Å; A224-L1013 HydrophobicContact CB-CD1 4.23Å; A224-T1017 WeakPolarHBondContact O-CG2 3.21Å
225	T	87.7	Confident	87.2	Confident	17 Å²	17	49.9 Å²	49.9	10%	0.104	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	0.8	-179.5	54.7	0	0	0	0	113.7	F221 M222 K223 L227 L947 I1016	F221-T225 HydrophobicContact CD2-CG2 4.07Å; F221-T225 HydrophobicContact CE2-CG2 3.73Å; F221-T225 HydrophobicContact CZ-CG2 3.99Å; F221-T225 WeakPolarHBondContact O-CB 3.32Å; F221-T225 WeakPolarHBondContact O-CG2 3.49Å; F221-T225 PolarHBondContact O-N 3.49Å; F221-T225 PolarHBondContact O-OG1 3.27Å; M222-T225 PolarHBondContact O-OG1 2.9Å; K223-T225 VanDerWaalsContact C-N 3.32Å; K223-T225 PolarHBondContact O-N 3.01Å; T225-L227 PolarHBondContact O-N 2.86Å; T225-L227 VanDerWaalsContact O-N 3.11Å; T225-L227 WeakPolarHBondContact OG1-CD1 2.87Å; T225-L227 WeakPolarHBondContact OG1-CG 3.16Å; T225-L947 HydrophobicContact CG2-CD1 4.18Å; T225-I1016 HydrophobicContact CG2-CD1 3.52Å; T225-I1016 HydrophobicContact CG2-CG1 4.34Å
226	Q	86.9	Confident	87.5	Confident	81 Å²	81	56.6 Å²	56.6	38%	0.379	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	8.7	-173.2	-50.8	-165.4	-47.8	0	0	115.9	Q192 M222 K223 A224 E228 Q229 M230	Q192-Q226 VanDerWaalsContact CD-CD 3.4Å; Q192-Q226 VanDerWaalsContact OE1-NE2 3.11Å; M222-Q226 CarbonylContact O-C 3.49Å; M222-Q226 PolarHBondContact O-N 3.41Å; K223-Q226 PolarHBondContact O-N 3.06Å; A224-Q226 VanDerWaalsContact C-N 3.33Å; Q226-E228 PolarHBondContact O-N 3.47Å; Q226-Q229 PolarHBondContact O-N 2.79Å; Q226-Q229 VanDerWaalsContact O-N 3.16Å; Q226-M230 PolarHBondContact O-N 2.68Å; Q226-M230 VanDerWaalsContact O-N 3.08Å
227	L	89.8	Confident	87.9	Confident	0 Å²	0	55 Å²	55	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-30.1	175.6	-66.8	174.6	0	0	0	111.4	F221 M222 T225 M230 R231 Y940 L943 R944 L947	F221-L227 HydrophobicContact CE1-CD1 4.11Å; M222-L227 HydrophobicContact CE-CB 3.41Å; M222-L227 VanDerWaalsContact CE-CB 3.41Å; M222-L227 HydrophobicContact CE-CD1 4.33Å; M222-L227 PolarHBondContact O-N 3.39Å; M222-L227 HydrophobicContact SD-CB 3.94Å; M222-L227 HydrophobicContact SD-CD1 3.98Å; T225-L227 PolarHBondContact O-N 2.86Å; T225-L227 VanDerWaalsContact O-N 3.11Å; T225-L227 WeakPolarHBondContact OG1-CD1 2.87Å; T225-L227 WeakPolarHBondContact OG1-CG 3.16Å; L227-M230 HydrophobicContact CD2-SD 4.36Å; L227-R231 WeakPolarHBondContact O-CB 3.38Å; L227-R231 PolarHBondContact O-N 2.89Å; L227-Y940 HydrophobicContact CB-CE2 3.91Å; L227-Y940 HydrophobicContact CD2-CD2 3.91Å; L227-Y940 HydrophobicContact CD2-CE2 3.74Å; L227-Y940 HydrophobicContact CG-CE2 4.41Å; L227-Y940 WeakPolarHBondContact O-CE2 3.44Å; L227-L943 HydrophobicContact CD2-CD2 3.97Å; L227-L943 HydrophobicContact CD2-CG 4.27Å; L227-R944 HydrophobicContact CD1-CB 3.93Å; L227-R944 HydrophobicContact CD1-CG 3.94Å; L227-L947 HydrophobicContact CD1-CD1 4.2Å; L227-L947 HydrophobicContact CD2-CD1 4.36Å; L227-L947 HydrophobicContact CG-CD1 4.34Å
228	E	88.9	Confident	88.3	Confident	45 Å²	45	61.6 Å²	61.6	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-48.3	173.1	-174.6	168.2	-142.7	0	0	112.2	M222 K223 Q226 M230 R231 E232	M222-E228 HydrophobicContact CB-CB 4.13Å; M222-E228 PolarHBondContact O-N 3.43Å; M222-E228 VanDerWaalsContact O-N 3.12Å; K223-E228 WeakPolarHBondContact CB-OE2 3.38Å; Q226-E228 PolarHBondContact O-N 3.47Å; E228-M230 PolarHBondContact O-N 2.8Å; E228-R231 WeakPolarHBondContact O-CB 3.47Å; E228-R231 PolarHBondContact O-N 3.3Å; E228-R231 IonicContact OE1-NH2 3.9Å; E228-E232 WeakPolarHBondContact O-CG 3.32Å; E228-E232 PolarHBondContact O-N 3.35Å
229	Q	86.8	Confident	88.4	Confident	101 Å²	101	63.8 Å²	63.8	47%	0.472	30%	0.299	S	S	.	.	H	α-helix	trans	-61	-45.4	177.4	-175.7	65.1	52.1	0	0	111.2	Q226 R231 E232 D233	Q226-Q229 PolarHBondContact O-N 2.79Å; Q226-Q229 VanDerWaalsContact O-N 3.16Å; Q229-R231 VanDerWaalsContact C-N 3.28Å; Q229-R231 PolarHBondContact O-N 3Å; Q229-E232 PolarHBondContact O-N 3.28Å; Q229-D233 PolarHBondContact NE2-OD1 3.34Å; Q229-D233 PolarHBondContact O-N 2.98Å
230	M	89.7	Confident	88.5	Confident	59 Å²	59	61.2 Å²	61.2	29%	0.291	29%	0.292	S	S	.	.	H	α-helix	trans	-59	-40.8	176.5	-68.1	-177.7	70.5	0	0	112	Q226 L227 E228 D233 F234 Y940 L943	Q226-M230 PolarHBondContact O-N 2.68Å; Q226-M230 VanDerWaalsContact O-N 3.08Å; L227-M230 HydrophobicContact CD2-SD 4.36Å; E228-M230 PolarHBondContact O-N 2.8Å; M230-D233 PolarHBondContact O-N 3.12Å; M230-F234 HydrophobicContact CB-CE2 4.49Å; M230-F234 HydrophobicContact CE-CZ 4.04Å; M230-F234 WeakPolarHBondContact O-CD1 3.4Å; M230-F234 VanDerWaalsContact O-CD2 3.31Å; M230-F234 WeakPolarHBondContact O-CD2 3.49Å; M230-F234 WeakPolarHBondContact O-CG 3.42Å; M230-F234 PolarHBondContact O-N 3.4Å; M230-Y940 HydrophobicContact CB-CD2 4.17Å; M230-Y940 HydrophobicContact CB-CE2 4.27Å; M230-Y940 HydrophobicContact CE-CD2 4.37Å; M230-Y940 HydrophobicContact SD-CD2 4.48Å; M230-L943 HydrophobicContact SD-CD2 4.29Å
231	R	89.9	Confident	88.8	Confident	76 Å²	76	61.3 Å²	61.3	29%	0.287	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-45.9	176.3	-178.5	-176.2	68	170.7	-0.8	111.1	L227 E228 Q229 F234 I235 E975	L227-R231 WeakPolarHBondContact O-CB 3.38Å; L227-R231 PolarHBondContact O-N 2.89Å; E228-R231 WeakPolarHBondContact O-CB 3.47Å; E228-R231 PolarHBondContact O-N 3.3Å; E228-R231 IonicContact OE1-NH2 3.9Å; Q229-R231 VanDerWaalsContact C-N 3.28Å; Q229-R231 PolarHBondContact O-N 3Å; R231-F234 PolarHBondContact O-N 3.47Å; R231-I235 HydrophobicContact CG-CD1 4.13Å; R231-I235 VanDerWaalsContact O-CG1 3.32Å; R231-I235 WeakPolarHBondContact O-CG1 3.45Å; R231-I235 PolarHBondContact O-N 3.43Å; R231-E975 IonicContact NH1-OE1 2.64Å; R231-E975 PolarHBondContact NH1-OE1 2.89Å; R231-E975 IonicContact NH1-OE2 2.95Å
232	E	89.7	Confident	88.9	Confident	91 Å²	91	66.6 Å²	66.6	43%	0.425	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.4	-71.5	178.5	179.9	0	0	111.8	E228 Q229 F234 I235 Y236	E228-E232 WeakPolarHBondContact O-CG 3.32Å; E228-E232 PolarHBondContact O-N 3.35Å; Q229-E232 PolarHBondContact O-N 3.28Å; E232-F234 VanDerWaalsContact C-N 3.31Å; E232-F234 PolarHBondContact O-N 3.43Å; E232-I235 WeakPolarHBondContact O-CB 3.34Å; E232-I235 PolarHBondContact O-N 3.09Å; E232-Y236 WeakPolarHBondContact O-CB 3.45Å; E232-Y236 PolarHBondContact O-N 3.16Å
233	D	88.3	Confident	88.9	Confident	73 Å²	73	69.7 Å²	69.7	39%	0.39	34%	0.336	S	S	.	.	H	α-helix	trans	-60.4	-41.4	175.9	-65.5	-15.5	0	0	0	111.1	Q229 M230 Y236 I237	Q229-D233 PolarHBondContact NE2-OD1 3.34Å; Q229-D233 PolarHBondContact O-N 2.98Å; M230-D233 PolarHBondContact O-N 3.12Å; D233-Y236 PolarHBondContact O-N 3.09Å; D233-I237 WeakPolarHBondContact O-CB 3.25Å; D233-I237 WeakPolarHBondContact O-CD1 3.46Å; D233-I237 WeakPolarHBondContact O-CG1 3.08Å; D233-I237 PolarHBondContact O-N 3.1Å
234	F	91.9	Very high	89.1	Confident	16 Å²	16	65.9 Å²	65.9	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-38.9	175.9	-64.8	-19	0	0	0	112.9	M230 R231 E232 Y236 I237 K238 M933 R936 L937 Y940	M230-F234 HydrophobicContact CB-CE2 4.49Å; M230-F234 HydrophobicContact CE-CZ 4.04Å; M230-F234 WeakPolarHBondContact O-CD1 3.4Å; M230-F234 VanDerWaalsContact O-CD2 3.31Å; M230-F234 WeakPolarHBondContact O-CD2 3.49Å; M230-F234 WeakPolarHBondContact O-CG 3.42Å; M230-F234 PolarHBondContact O-N 3.4Å; R231-F234 PolarHBondContact O-N 3.47Å; E232-F234 VanDerWaalsContact C-N 3.31Å; E232-F234 PolarHBondContact O-N 3.43Å; F234-Y236 VanDerWaalsContact C-N 3.35Å; F234-I237 PolarHBondContact O-N 2.72Å; F234-K238 VanDerWaalsContact O-CB 3.29Å; F234-K238 WeakPolarHBondContact O-CB 3.45Å; F234-K238 PolarHBondContact O-N 3.05Å; F234-M933 HydrophobicContact CB-CE 3.84Å; F234-M933 HydrophobicContact CD1-CE 3.85Å; F234-M933 HydrophobicContact CD1-SD 4.29Å; F234-M933 HydrophobicContact CG-CE 3.93Å; F234-R936 HydrophobicContact CE1-CB 4Å; F234-R936 HydrophobicContact CZ-CB 3.87Å; F234-L937 HydrophobicContact CD2-CD2 3.73Å; F234-L937 HydrophobicContact CE2-CD2 4.28Å; F234-L937 HydrophobicContact CG-CD2 4.39Å; F234-Y940 HydrophobicContact CE2-CD2 4.05Å; F234-Y940 AromaticContact CE2-CG 3.92Å; F234-Y940 HydrophobicContact CE2-CG 3.92Å
235	I	90.6	Very high	89.4	Confident	106 Å²	106	69.6 Å²	69.6	54%	0.544	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-46.2	173.9	-69.4	165.3	0	0	0	109.7	R231 E232 K238 A239	R231-I235 HydrophobicContact CG-CD1 4.13Å; R231-I235 VanDerWaalsContact O-CG1 3.32Å; R231-I235 WeakPolarHBondContact O-CG1 3.45Å; R231-I235 PolarHBondContact O-N 3.43Å; E232-I235 WeakPolarHBondContact O-CB 3.34Å; E232-I235 PolarHBondContact O-N 3.09Å; I235-K238 PolarHBondContact O-N 3.13Å; I235-A239 WeakPolarHBondContact O-CB 3.28Å; I235-A239 PolarHBondContact O-N 2.95Å
236	Y	90.8	Very high	89.5	Confident	165 Å²	165	73 Å²	73	65%	0.647	36%	0.355	S	S	*	.	H	α-helix	trans	-61	-46	177.7	175.4	-99	0	0	0	112.4	E232 D233 F234 K238 A239 T240	E232-Y236 WeakPolarHBondContact O-CB 3.45Å; E232-Y236 PolarHBondContact O-N 3.16Å; D233-Y236 PolarHBondContact O-N 3.09Å; F234-Y236 VanDerWaalsContact C-N 3.35Å; Y236-K238 VanDerWaalsContact C-N 3.33Å; Y236-K238 PolarHBondContact O-N 3.36Å; Y236-A239 PolarHBondContact O-N 3.41Å; Y236-T240 WeakPolarHBondContact O-CB 3.41Å; Y236-T240 PolarHBondContact O-N 3.4Å; Y236-T240 PolarHBondContact O-OG1 3.41Å
237	I	89.9	Confident	89.5	Confident	46 Å²	46	74.7 Å²	74.7	24%	0.236	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-41.4	177.2	-68	163.1	0	0	0	110.4	D233 F234 T240 K241 L929 M933	D233-I237 WeakPolarHBondContact O-CB 3.25Å; D233-I237 WeakPolarHBondContact O-CD1 3.46Å; D233-I237 WeakPolarHBondContact O-CG1 3.08Å; D233-I237 PolarHBondContact O-N 3.1Å; F234-I237 PolarHBondContact O-N 2.72Å; I237-T240 PolarHBondContact O-N 3.24Å; I237-K241 WeakPolarHBondContact O-CB 3.49Å; I237-K241 PolarHBondContact O-N 3.49Å; I237-L929 HydrophobicContact CG2-CD1 3.89Å; I237-L929 HydrophobicContact CG2-CD2 4.23Å; I237-L929 HydrophobicContact CG2-CG 4.32Å; I237-M933 HydrophobicContact CB-SD 4.15Å; I237-M933 HydrophobicContact CD1-SD 4.21Å; I237-M933 HydrophobicContact CG2-CE 4.5Å; I237-M933 HydrophobicContact CG2-CG 4.01Å; I237-M933 HydrophobicContact CG2-SD 3.58Å; I237-M933 VanDerWaalsContact CG2-SD 3.58Å
238	K	90.4	Very high	89.5	Confident	153 Å²	153	75.1 Å²	75.1	67%	0.665	36%	0.363	S	S	*	.	H	α-helix	trans	-64.5	-43.1	177.7	-170.9	177.4	-179.4	-178.8	0	112	F234 I235 Y236 K241 Q242	F234-K238 VanDerWaalsContact O-CB 3.29Å; F234-K238 WeakPolarHBondContact O-CB 3.45Å; F234-K238 PolarHBondContact O-N 3.05Å; I235-K238 PolarHBondContact O-N 3.13Å; Y236-K238 VanDerWaalsContact C-N 3.33Å; Y236-K238 PolarHBondContact O-N 3.36Å; K238-K241 WeakPolarHBondContact O-CB 3.37Å; K238-K241 PolarHBondContact O-N 2.97Å; K238-Q242 PolarHBondContact O-N 3.23Å
239	A	90.5	Very high	89.4	Confident	49 Å²	49	79.5 Å²	79.5	41%	0.405	38%	0.384	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.1	0	0	0	0	0	111.5	I235 Y236 K241 Q242 V243	I235-A239 WeakPolarHBondContact O-CB 3.28Å; I235-A239 PolarHBondContact O-N 2.95Å; Y236-A239 PolarHBondContact O-N 3.41Å; A239-K241 VanDerWaalsContact C-N 3.33Å; A239-K241 PolarHBondContact O-N 3.04Å; A239-Q242 PolarHBondContact O-N 3.05Å; A239-V243 WeakPolarHBondContact O-CG2 3.43Å; A239-V243 PolarHBondContact O-N 3.17Å
240	T	88.6	Confident	89.4	Confident	58 Å²	58	80.7 Å²	80.7	36%	0.356	39%	0.389	S	S	.	.	H	α-helix	trans	-63.9	-38.6	177.1	-55.8	0	0	0	0	111.9	Y236 I237 V243 T244	Y236-T240 WeakPolarHBondContact O-CB 3.41Å; Y236-T240 PolarHBondContact O-N 3.4Å; Y236-T240 PolarHBondContact O-OG1 3.41Å; I237-T240 PolarHBondContact O-N 3.24Å; T240-V243 PolarHBondContact O-N 3.23Å; T240-T244 WeakPolarHBondContact O-CB 3.41Å; T240-T244 PolarHBondContact O-N 3.18Å; T240-T244 PolarHBondContact O-OG1 2.62Å
241	K	89.7	Confident	89.3	Confident	34 Å²	34	81.4 Å²	81.4	15%	0.148	39%	0.392	C	S	.	.	H	α-helix	trans	-58.8	-49.6	173.3	-176	-168.8	179.6	-140.8	0	110.6	I237 K238 A239 V243 T244 E245 L929 D930	I237-K241 WeakPolarHBondContact O-CB 3.49Å; I237-K241 PolarHBondContact O-N 3.49Å; K238-K241 WeakPolarHBondContact O-CB 3.37Å; K238-K241 PolarHBondContact O-N 2.97Å; A239-K241 VanDerWaalsContact C-N 3.33Å; A239-K241 PolarHBondContact O-N 3.04Å; K241-V243 PolarHBondContact O-N 3.1Å; K241-T244 CarbonylContact O-C 3.59Å; K241-T244 WeakPolarHBondContact O-CA 3.42Å; K241-T244 WeakPolarHBondContact O-CB 3.19Å; K241-T244 PolarHBondContact O-N 3.15Å; K241-E245 WeakPolarHBondContact CE-OE1 3.49Å; K241-E245 IonicContact NZ-OE1 3.09Å; K241-E245 PolarHBondContact NZ-OE1 3.25Å; K241-E245 VanDerWaalsContact NZ-OE1 3.17Å; K241-E245 WeakPolarHBondContact O-CG 3.34Å; K241-E245 PolarHBondContact O-N 2.97Å; K241-L929 HydrophobicContact CB-CD2 4.03Å; K241-L929 HydrophobicContact CG-CD2 4.17Å; K241-D930 WeakPolarHBondContact CE-OD1 3.26Å; K241-D930 IonicContact NZ-OD1 3.02Å; K241-D930 PolarHBondContact NZ-OD1 3.35Å
242	Q	89.6	Confident	89.2	Confident	111 Å²	111	78.4 Å²	78.4	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-48	179.5	-175.6	178.7	-10.4	0	0	111.9	K238 A239 T244 E245 E246	K238-Q242 PolarHBondContact O-N 3.23Å; A239-Q242 PolarHBondContact O-N 3.05Å; Q242-T244 PolarHBondContact O-N 3.29Å; Q242-E245 WeakPolarHBondContact O-CB 3.45Å; Q242-E245 PolarHBondContact O-N 3.16Å; Q242-E245 VanDerWaalsContact O-N 3.15Å; Q242-E246 WeakPolarHBondContact O-CG 3.33Å; Q242-E246 PolarHBondContact O-N 3.22Å
243	V	89.9	Confident	89.1	Confident	70 Å²	70	79.9 Å²	79.9	42%	0.424	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-34.9	175.6	173.1	0	0	0	0	111.8	A239 T240 K241 K247	A239-V243 WeakPolarHBondContact O-CG2 3.43Å; A239-V243 PolarHBondContact O-N 3.17Å; T240-V243 PolarHBondContact O-N 3.23Å; K241-V243 PolarHBondContact O-N 3.1Å; V243-K247 WeakPolarHBondContact O-CG 3Å; V243-K247 PolarHBondContact O-N 3Å; V243-K247 VanDerWaalsContact O-N 3.15Å
244	T	87.6	Confident	88.9	Confident	32 Å²	32	78.9 Å²	78.9	20%	0.196	39%	0.389	C	S	.	.	H	α-helix	trans	-72.9	-38.9	177.5	-52.9	0	0	0	0	111.6	T240 K241 Q242 K247 V248 I926	T240-T244 WeakPolarHBondContact O-CB 3.41Å; T240-T244 PolarHBondContact O-N 3.18Å; T240-T244 PolarHBondContact O-OG1 2.62Å; K241-T244 CarbonylContact O-C 3.59Å; K241-T244 WeakPolarHBondContact O-CA 3.42Å; K241-T244 WeakPolarHBondContact O-CB 3.19Å; K241-T244 PolarHBondContact O-N 3.15Å; Q242-T244 PolarHBondContact O-N 3.29Å; T244-K247 PolarHBondContact O-N 3.27Å; T244-V248 WeakPolarHBondContact O-CG2 3.44Å; T244-V248 PolarHBondContact O-N 2.97Å; T244-I926 HydrophobicContact CG2-CD1 4.2Å; T244-I926 HydrophobicContact CG2-CG1 4.32Å
245	E	90.8	Very high	88.9	Confident	79 Å²	79	79.4 Å²	79.4	37%	0.369	39%	0.393	S	S	.	.	H	α-helix	trans	-61	-45.3	173.7	-76	172.4	163.5	0	0	111.2	K241 Q242 K247 V248 E249 I926	K241-E245 WeakPolarHBondContact CE-OE1 3.49Å; K241-E245 IonicContact NZ-OE1 3.09Å; K241-E245 PolarHBondContact NZ-OE1 3.25Å; K241-E245 VanDerWaalsContact NZ-OE1 3.17Å; K241-E245 WeakPolarHBondContact O-CG 3.34Å; K241-E245 PolarHBondContact O-N 2.97Å; Q242-E245 WeakPolarHBondContact O-CB 3.45Å; Q242-E245 PolarHBondContact O-N 3.16Å; Q242-E245 VanDerWaalsContact O-N 3.15Å; E245-K247 VanDerWaalsContact C-N 3.34Å; E245-K247 PolarHBondContact O-N 3.11Å; E245-V248 WeakPolarHBondContact O-CB 3.39Å; E245-V248 PolarHBondContact O-N 3.26Å; E245-V248 VanDerWaalsContact O-N 3.11Å; E245-E249 PolarHBondContact O-N 3.4Å; E245-I926 HydrophobicContact CG-CD1 3.92Å; E245-I926 HydrophobicContact CG-CG1 4.48Å; E245-I926 HydrophobicContact CG-CG2 3.96Å; E245-I926 WeakPolarHBondContact OE1-CG2 3.43Å
246	E	89.3	Confident	88.8	Confident	89 Å²	89	81.3 Å²	81.3	42%	0.416	40%	0.397	S	S	.	.	H	α-helix	trans	-59	-43.3	174.5	-71.2	170.5	-168	0	0	111.9	Q242 V248 E249 Q250	Q242-E246 WeakPolarHBondContact O-CG 3.33Å; Q242-E246 PolarHBondContact O-N 3.22Å; E246-V248 VanDerWaalsContact C-N 3.34Å; E246-V248 PolarHBondContact O-N 2.98Å; E246-E249 PolarHBondContact O-N 3.37Å; E246-Q250 WeakPolarHBondContact O-CG 3.22Å; E246-Q250 PolarHBondContact O-N 3.36Å
247	K	86.4	Confident	88.7	Confident	115 Å²	115	76.9 Å²	76.9	50%	0.5	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-37.6	174.6	-75.1	177	-178.9	178.5	0	112.5	V243 T244 E245 E249 Q250 H251	V243-K247 WeakPolarHBondContact O-CG 3Å; V243-K247 PolarHBondContact O-N 3Å; V243-K247 VanDerWaalsContact O-N 3.15Å; T244-K247 PolarHBondContact O-N 3.27Å; E245-K247 VanDerWaalsContact C-N 3.34Å; E245-K247 PolarHBondContact O-N 3.11Å; K247-E249 VanDerWaalsContact C-N 3.32Å; K247-Q250 PolarHBondContact O-N 3.13Å; K247-H251 WeakPolarHBondContact O-CB 3.39Å; K247-H251 PolarHBondContact O-CD2 3.18Å; K247-H251 VanDerWaalsContact O-CG 3.3Å; K247-H251 PolarHBondContact O-N 2.88Å
248	V	89.6	Confident	88.7	Confident	9 Å²	9	76.2 Å²	76.2	6%	0.055	38%	0.381	C	S	.	.	H	α-helix	trans	-65.9	-37.9	176.1	168.2	0	0	0	0	110.9	T244 E245 E246 H251 G252 M919 L922 I926	T244-V248 WeakPolarHBondContact O-CG2 3.44Å; T244-V248 PolarHBondContact O-N 2.97Å; E245-V248 WeakPolarHBondContact O-CB 3.39Å; E245-V248 PolarHBondContact O-N 3.26Å; E245-V248 VanDerWaalsContact O-N 3.11Å; E246-V248 VanDerWaalsContact C-N 3.34Å; E246-V248 PolarHBondContact O-N 2.98Å; V248-H251 PolarHBondContact O-N 3.33Å; V248-G252 PolarHBondContact O-N 3.43Å; V248-M919 HydrophobicContact CG1-CE 4.13Å; V248-M919 HydrophobicContact CG1-CG 4.46Å; V248-L922 HydrophobicContact CG2-CB 3.79Å; V248-L922 HydrophobicContact CG2-CD1 4.13Å; V248-I926 HydrophobicContact CB-CD1 4.45Å; V248-I926 HydrophobicContact CG2-CD1 3.8Å
249	E	88.3	Confident	88.7	Confident	138 Å²	138	73.8 Å²	73.8	65%	0.645	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-48.7	175.1	-171.2	170	-162.4	0	0	111.5	E245 E246 K247 H251 G252 E253	E245-E249 PolarHBondContact O-N 3.4Å; E246-E249 PolarHBondContact O-N 3.37Å; K247-E249 VanDerWaalsContact C-N 3.32Å; E249-H251 PolarHBondContact O-N 3.25Å; E249-G252 WeakPolarHBondContact O-CA 3.48Å; E249-G252 PolarHBondContact O-N 2.87Å; E249-E253 PolarHBondContact O-N 3.14Å; E249-E253 VanDerWaalsContact O-N 3.11Å
250	Q	86.9	Confident	88.6	Confident	126 Å²	126	77.9 Å²	77.9	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-58.4	-45.2	174.9	-69.5	174.7	7.5	0	0	112.3	E246 K247 G252 E253 C254	E246-Q250 WeakPolarHBondContact O-CG 3.22Å; E246-Q250 PolarHBondContact O-N 3.36Å; K247-Q250 PolarHBondContact O-N 3.13Å; Q250-G252 PolarHBondContact O-N 2.84Å; Q250-E253 PolarHBondContact O-N 3.17Å; Q250-C254 PolarHBondContact O-N 2.95Å; Q250-C254 VanDerWaalsContact O-N 3.11Å
251	H	86.6	Confident	88.6	Confident	74 Å²	74	81 Å²	81	34%	0.343	38%	0.384	S	S	.	.	H	α-helix	trans	-65.5	-29.4	174.7	-72.5	-41.2	0	0	0	112.4	K247 V248 E249 C254 L255	K247-H251 WeakPolarHBondContact O-CB 3.39Å; K247-H251 PolarHBondContact O-CD2 3.18Å; K247-H251 VanDerWaalsContact O-CG 3.3Å; K247-H251 PolarHBondContact O-N 2.88Å; V248-H251 PolarHBondContact O-N 3.33Å; E249-H251 PolarHBondContact O-N 3.25Å; H251-C254 PolarHBondContact O-N 3.05Å; H251-L255 WeakPolarHBondContact O-CB 3.32Å; H251-L255 PolarHBondContact O-N 3.4Å
252	G	87.2	Confident	88.6	Confident	12 Å²	12	81.1 Å²	81.1	12%	0.124	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-39	172.6	0	0	0	0	0	113.1	V248 E249 Q250 L255 K256	V248-G252 PolarHBondContact O-N 3.43Å; E249-G252 WeakPolarHBondContact O-CA 3.48Å; E249-G252 PolarHBondContact O-N 2.87Å; Q250-G252 PolarHBondContact O-N 2.84Å; G252-L255 PolarHBondContact O-N 3.38Å; G252-K256 WeakPolarHBondContact O-CG 3.24Å; G252-K256 PolarHBondContact O-N 2.9Å
253	E	87.6	Confident	88.5	Confident	122 Å²	122	79.4 Å²	79.4	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-67	-46.9	172.2	-61.3	-165.3	146.4	0	0	111.6	E249 Q250 L255 K256 D257	E249-E253 PolarHBondContact O-N 3.14Å; E249-E253 VanDerWaalsContact O-N 3.11Å; Q250-E253 PolarHBondContact O-N 3.17Å; E253-L255 PolarHBondContact O-N 3.15Å; E253-K256 WeakPolarHBondContact O-CB 3.39Å; E253-K256 PolarHBondContact O-N 3.25Å; E253-D257 PolarHBondContact O-N 3.37Å
254	C	85.7	Confident	88.4	Confident	53 Å²	53	80.8 Å²	80.8	36%	0.358	38%	0.38	S	S	.	.	H	α-helix	trans	-58.2	-36.8	175.5	-171.9	0	0	0	0	112.4	Q250 H251 K256 D257 L258	Q250-C254 PolarHBondContact O-N 2.95Å; Q250-C254 VanDerWaalsContact O-N 3.11Å; H251-C254 PolarHBondContact O-N 3.05Å; C254-K256 VanDerWaalsContact C-N 3.35Å; C254-K256 PolarHBondContact O-N 2.85Å; C254-D257 WeakPolarHBondContact O-CB 3.48Å; C254-D257 PolarHBondContact O-N 3.17Å; C254-L258 PolarHBondContact O-N 3.08Å
255	L	89.9	Confident	88.3	Confident	27 Å²	27	81.6 Å²	81.6	14%	0.141	38%	0.381	C	S	.	.	H	α-helix	trans	-64.8	-37	176	-164.3	94.5	0	0	0	112	H251 G252 E253 D257 K259 Y912 M915 M919	H251-L255 WeakPolarHBondContact O-CB 3.32Å; H251-L255 PolarHBondContact O-N 3.4Å; G252-L255 PolarHBondContact O-N 3.38Å; E253-L255 PolarHBondContact O-N 3.15Å; L255-D257 VanDerWaalsContact C-N 3.31Å; L255-K259 VanDerWaalsContact O-CB 3.27Å; L255-K259 WeakPolarHBondContact O-CB 3.4Å; L255-K259 PolarHBondContact O-N 3.44Å; L255-Y912 HydrophobicContact CD1-CD2 4.3Å; L255-Y912 HydrophobicContact CD1-CE2 4.19Å; L255-Y912 HydrophobicContact CD2-CE2 4.21Å; L255-Y912 HydrophobicContact CG-CD2 4.32Å; L255-Y912 HydrophobicContact CG-CE2 3.91Å; L255-M915 HydrophobicContact CD1-CB 3.95Å; L255-M915 HydrophobicContact CD1-CG 3.74Å; L255-M919 HydrophobicContact CB-SD 4.44Å; L255-M919 HydrophobicContact CD2-SD 4.07Å
256	K	89.6	Confident	88.1	Confident	145 Å²	145	79.4 Å²	79.4	63%	0.63	37%	0.371	S	S	*	.	H	α-helix	trans	-63	-41.9	174.3	-67.5	170.3	-173.4	168.3	0	110.4	G252 E253 C254 K259 R260	G252-K256 WeakPolarHBondContact O-CG 3.24Å; G252-K256 PolarHBondContact O-N 2.9Å; E253-K256 WeakPolarHBondContact O-CB 3.39Å; E253-K256 PolarHBondContact O-N 3.25Å; C254-K256 VanDerWaalsContact C-N 3.35Å; C254-K256 PolarHBondContact O-N 2.85Å; K256-K259 PolarHBondContact O-N 3.45Å; K256-R260 PolarHBondContact O-N 3.34Å
257	D	88.6	Confident	87.8	Confident	73 Å²	73	80.1 Å²	80.1	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-45.4	177.1	-76.6	-20.7	0	0	0	112.9	E253 C254 L255 K259 R260 K261	E253-D257 PolarHBondContact O-N 3.37Å; C254-D257 WeakPolarHBondContact O-CB 3.48Å; C254-D257 PolarHBondContact O-N 3.17Å; L255-D257 VanDerWaalsContact C-N 3.31Å; D257-K259 VanDerWaalsContact C-N 3.3Å; D257-K259 PolarHBondContact O-N 3.08Å; D257-R260 PolarHBondContact O-N 3.08Å; D257-R260 IonicContact OD1-CZ 2.67Å; D257-R260 IonicContact OD1-NE 3.35Å; D257-R260 IonicContact OD1-NH2 3.77Å; D257-R260 PolarHBondContact OD1-NH2 3.06Å; D257-K261 WeakPolarHBondContact O-CG 3.36Å; D257-K261 PolarHBondContact O-N 3.08Å
258	L	89	Confident	87.5	Confident	32 Å²	32	81.3 Å²	81.3	17%	0.168	38%	0.379	C	S	.	.	H	α-helix	trans	-61.2	-40.2	174.1	-78.7	166.2	0	0	0	111.4	C254 K261 Y262 Y912 M915	C254-L258 PolarHBondContact O-N 3.08Å; L258-K261 PolarHBondContact O-N 3.09Å; L258-Y262 VanDerWaalsContact O-CB 3.31Å; L258-Y262 WeakPolarHBondContact O-CB 3.47Å; L258-Y262 PolarHBondContact O-N 2.78Å; L258-Y912 HydrophobicContact CB-CD2 4.42Å; L258-M915 HydrophobicContact CD1-CB 4.23Å; L258-M915 HydrophobicContact CD1-CG 4.26Å
259	K	90.4	Very high	87.1	Confident	101 Å²	101	85.6 Å²	85.6	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-42.7	175.7	-170.9	178.2	-178.9	-179	0	111.8	L255 K256 D257 Y262 L263 Y912	L255-K259 VanDerWaalsContact O-CB 3.27Å; L255-K259 WeakPolarHBondContact O-CB 3.4Å; L255-K259 PolarHBondContact O-N 3.44Å; K256-K259 PolarHBondContact O-N 3.45Å; D257-K259 VanDerWaalsContact C-N 3.3Å; D257-K259 PolarHBondContact O-N 3.08Å; K259-Y262 PolarHBondContact O-N 3.25Å; K259-L263 HydrophobicContact CG-CD1 4.31Å; K259-L263 WeakPolarHBondContact O-CG 3.48Å; K259-L263 PolarHBondContact O-N 2.71Å; K259-Y912 HydrophobicContact CB-CD2 4.08Å; K259-Y912 HydrophobicContact CB-CE2 3.69Å; K259-Y912 HydrophobicContact CD-CE2 4.36Å; K259-Y912 HydrophobicContact CG-CE2 4.02Å
260	R	90.2	Very high	86.7	Confident	135 Å²	135	84.4 Å²	84.4	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-60.8	-50	174.8	174.2	177.4	54.9	-177	-2.2	111.1	K256 D257 Y262 L263 E264	K256-R260 PolarHBondContact O-N 3.34Å; D257-R260 PolarHBondContact O-N 3.08Å; D257-R260 IonicContact OD1-CZ 2.67Å; D257-R260 IonicContact OD1-NE 3.35Å; D257-R260 IonicContact OD1-NH2 3.77Å; D257-R260 PolarHBondContact OD1-NH2 3.06Å; R260-Y262 VanDerWaalsContact C-N 3.32Å; R260-Y262 PolarHBondContact O-N 3.01Å; R260-L263 PolarHBondContact O-N 3.39Å; R260-E264 WeakPolarHBondContact CG-OE1 3.38Å; R260-E264 WeakPolarHBondContact O-CG 3.45Å; R260-E264 PolarHBondContact O-N 2.9Å
261	K	88.1	Confident	86.1	Confident	124 Å²	124	79.9 Å²	79.9	54%	0.539	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-42.6	177.1	-71.8	177.3	179.3	177.8	0	112	D257 L258 E264 K265	D257-K261 WeakPolarHBondContact O-CG 3.36Å; D257-K261 PolarHBondContact O-N 3.08Å; L258-K261 PolarHBondContact O-N 3.09Å; K261-E264 PolarHBondContact O-N 3.46Å; K261-K265 VanDerWaalsContact O-CG 3.27Å; K261-K265 WeakPolarHBondContact O-CG 3.43Å; K261-K265 PolarHBondContact O-N 2.86Å
262	Y	89.1	Confident	85.4	Confident	37 Å²	37	77.3 Å²	77.3	15%	0.145	36%	0.358	C	S	.	.	H	α-helix	trans	-58.3	-49.4	174.4	155.2	-100.1	0	0	0	111.6	L258 K259 R260 E264 K265 E266 Y905 L909	L258-Y262 VanDerWaalsContact O-CB 3.31Å; L258-Y262 WeakPolarHBondContact O-CB 3.47Å; L258-Y262 PolarHBondContact O-N 2.78Å; K259-Y262 PolarHBondContact O-N 3.25Å; R260-Y262 VanDerWaalsContact C-N 3.32Å; R260-Y262 PolarHBondContact O-N 3.01Å; Y262-E264 PolarHBondContact O-N 3.31Å; Y262-K265 PolarHBondContact O-N 3.03Å; Y262-E266 WeakPolarHBondContact CE1-OE2 3.49Å; Y262-E266 HydrophobicContact CE2-CB 4.48Å; Y262-E266 WeakPolarHBondContact O-CB 3.45Å; Y262-E266 PolarHBondContact O-N 3.21Å; Y262-E266 VanDerWaalsContact OH-CD 3.24Å; Y262-E266 PolarHBondContact OH-OE2 3.14Å; Y262-Y905 HydrophobicContact CD2-CE2 4.25Å; Y262-Y905 AromaticContact CE2-CE2 3.68Å; Y262-Y905 HydrophobicContact CE2-CE2 3.68Å; Y262-L909 HydrophobicContact CD2-CB 4.14Å; Y262-L909 HydrophobicContact CD2-CD1 4.07Å; Y262-L909 HydrophobicContact CE2-CB 4.24Å; Y262-L909 HydrophobicContact CE2-CD1 3.61Å; Y262-L909 HydrophobicContact CE2-CG 4.45Å
263	L	88.3	Confident	84.5	Confident	75 Å²	75	79.8 Å²	79.8	39%	0.393	38%	0.377	S	S	.	.	H	α-helix	trans	-63	-42	179.7	-73.1	168.8	0	0	0	112	K259 R260 K265 E266 D267	K259-L263 HydrophobicContact CG-CD1 4.31Å; K259-L263 WeakPolarHBondContact O-CG 3.48Å; K259-L263 PolarHBondContact O-N 2.71Å; R260-L263 PolarHBondContact O-N 3.39Å; L263-K265 VanDerWaalsContact C-N 3.32Å; L263-K265 PolarHBondContact O-N 3.32Å; L263-E266 WeakPolarHBondContact O-CB 3.13Å; L263-E266 PolarHBondContact O-N 2.97Å; L263-D267 PolarHBondContact O-N 3.49Å
264	E	87.2	Confident	83.7	Confident	98 Å²	98	76 Å²	76	46%	0.458	36%	0.364	S	S	.	.	H	α-helix	trans	-60.1	-41.5	175.4	-73.6	173.1	-169.3	0	0	112.1	R260 K261 Y262 R268	R260-E264 WeakPolarHBondContact CG-OE1 3.38Å; R260-E264 WeakPolarHBondContact O-CG 3.45Å; R260-E264 PolarHBondContact O-N 2.9Å; K261-E264 PolarHBondContact O-N 3.46Å; Y262-E264 PolarHBondContact O-N 3.31Å; E264-R268 WeakPolarHBondContact O-CG 3.36Å; E264-R268 PolarHBondContact O-N 3.3Å
265	K	85.8	Confident	83.1	Confident	49 Å²	49	74 Å²	74	21%	0.213	35%	0.35	C	S	.	.	H	α-helix	trans	-72.7	-34	176.8	-63.8	-67.1	-178.7	177.9	0	112.1	K261 Y262 L263 R268 Y269 Q904	K261-K265 VanDerWaalsContact O-CG 3.27Å; K261-K265 WeakPolarHBondContact O-CG 3.43Å; K261-K265 PolarHBondContact O-N 2.86Å; Y262-K265 PolarHBondContact O-N 3.03Å; L263-K265 VanDerWaalsContact C-N 3.32Å; L263-K265 PolarHBondContact O-N 3.32Å; K265-R268 PolarHBondContact O-N 2.61Å; K265-Y269 WeakPolarHBondContact O-CB 3.17Å; K265-Y269 PolarHBondContact O-N 3Å; K265-Q904 HydrophobicContact CD-CB 4.3Å
266	E	85.7	Confident	82.1	Confident	34 Å²	34	74.3 Å²	74.3	16%	0.159	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-44.3	174.2	-171.1	-175.2	171.5	0	0	111.6	Y262 L263 Y269 K270 Y905	Y262-E266 WeakPolarHBondContact CE1-OE2 3.49Å; Y262-E266 HydrophobicContact CE2-CB 4.48Å; Y262-E266 WeakPolarHBondContact O-CB 3.45Å; Y262-E266 PolarHBondContact O-N 3.21Å; Y262-E266 VanDerWaalsContact OH-CD 3.24Å; Y262-E266 PolarHBondContact OH-OE2 3.14Å; L263-E266 WeakPolarHBondContact O-CB 3.13Å; L263-E266 PolarHBondContact O-N 2.97Å; E266-Y269 PolarHBondContact O-N 3.49Å; E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.34Å; E266-K270 VanDerWaalsContact OE1-CE 3.23Å; E266-K270 WeakPolarHBondContact OE1-CE 3.47Å; E266-K270 IonicContact OE1-NZ 2.71Å; E266-K270 PolarHBondContact OE1-NZ 2.81Å; E266-Y905 HydrophobicContact CB-CD2 4.17Å; E266-Y905 HydrophobicContact CB-CE2 3.78Å; E266-Y905 HydrophobicContact CG-CE2 3.88Å
267	D	83.3	Confident	81.5	Confident	104 Å²	104	74.3 Å²	74.3	56%	0.556	36%	0.362	S	S	*	.	H	α-helix	trans	-65.3	-40.7	177.8	-76.6	-17.3	0	0	0	111.7	L263 K270 S271	L263-D267 PolarHBondContact O-N 3.49Å; D267-K270 PolarHBondContact O-N 2.95Å; D267-S271 PolarHBondContact O-N 3Å
268	R	79.4	Confident	80.9	Confident	140 Å²	140	72.4 Å²	72.4	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-44.7	172	-70.8	-178.5	-171.4	-160.3	2.5	111.6	E264 K265 K270 S271 L272 I901	E264-R268 WeakPolarHBondContact O-CG 3.36Å; E264-R268 PolarHBondContact O-N 3.3Å; K265-R268 PolarHBondContact O-N 2.61Å; R268-K270 PolarHBondContact O-N 2.91Å; R268-S271 PolarHBondContact O-N 3.05Å; R268-S271 PolarHBondContact O-OG 2.89Å; R268-L272 PolarHBondContact O-N 3.21Å; R268-I901 HydrophobicContact CB-CG2 4.34Å
269	Y	81.4	Confident	80.3	Confident	99 Å²	99	74.2 Å²	74.2	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-42.9	176.6	175.8	-102.6	0	0	0	112.5	K265 E266 S271 L272 V902 Y905	K265-Y269 WeakPolarHBondContact O-CB 3.17Å; K265-Y269 PolarHBondContact O-N 3Å; E266-Y269 PolarHBondContact O-N 3.49Å; Y269-S271 VanDerWaalsContact C-N 3.29Å; Y269-S271 PolarHBondContact O-N 3.39Å; Y269-L272 HydrophobicContact CD2-CD1 4.45Å; Y269-L272 WeakPolarHBondContact O-CB 3.5Å; Y269-L272 PolarHBondContact O-N 3.05Å; Y269-V902 HydrophobicContact CD2-CG2 3.92Å; Y269-V902 HydrophobicContact CE2-CG2 3.77Å; Y269-Y905 HydrophobicContact CG-CD1 4.49Å
270	K	81	Confident	79.8	Confident	112 Å²	112	73.8 Å²	73.8	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-34.6	176.1	-73.9	173.2	-175	161.7	0	112.7	E266 D267 R268 L272 A273	E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.34Å; E266-K270 VanDerWaalsContact OE1-CE 3.23Å; E266-K270 WeakPolarHBondContact OE1-CE 3.47Å; E266-K270 IonicContact OE1-NZ 2.71Å; E266-K270 PolarHBondContact OE1-NZ 2.81Å; D267-K270 PolarHBondContact O-N 2.95Å; R268-K270 PolarHBondContact O-N 2.91Å; K270-L272 VanDerWaalsContact C-N 3.25Å; K270-L272 PolarHBondContact O-N 2.68Å; K270-A273 WeakPolarHBondContact O-CB 3.42Å; K270-A273 PolarHBondContact O-N 3Å
271	S	73.9	Confident	79.3	Confident	32 Å²	32	72.5 Å²	72.5	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-25.6	177.1	71.1	0	0	0	0	113.7	D267 R268 Y269 A273 S274 L275 Q895	D267-S271 PolarHBondContact O-N 3Å; R268-S271 PolarHBondContact O-N 3.05Å; R268-S271 PolarHBondContact O-OG 2.89Å; Y269-S271 VanDerWaalsContact C-N 3.29Å; Y269-S271 PolarHBondContact O-N 3.39Å; S271-A273 VanDerWaalsContact C-N 3.33Å; S271-A273 PolarHBondContact O-N 2.92Å; S271-S274 PolarHBondContact O-N 3.43Å; S271-S274 PolarHBondContact O-OG 3.35Å; S271-L275 PolarHBondContact O-N 3.35Å; S271-Q895 PolarHBondContact OG-NE2 2.86Å
272	L	72.8	Confident	78.9	Confident	19 Å²	19	67.7 Å²	67.7	10%	0.099	34%	0.342	C	S	.	.	H	α-helix	trans	-65.4	-33.3	174.6	-71.1	167.7	0	0	0	112.9	R268 Y269 K270 S274 L275 G276 R898 I901	R268-L272 PolarHBondContact O-N 3.21Å; Y269-L272 HydrophobicContact CD2-CD1 4.45Å; Y269-L272 WeakPolarHBondContact O-CB 3.5Å; Y269-L272 PolarHBondContact O-N 3.05Å; K270-L272 VanDerWaalsContact C-N 3.25Å; K270-L272 PolarHBondContact O-N 2.68Å; L272-S274 VanDerWaalsContact C-N 3.27Å; L272-S274 PolarHBondContact O-N 3.49Å; L272-L275 HydrophobicContact CD2-CD1 4.38Å; L272-L275 WeakPolarHBondContact O-CB 3.16Å; L272-L275 PolarHBondContact O-N 3.41Å; L272-G276 PolarHBondContact O-N 3.34Å; L272-R898 HydrophobicContact CD1-CG 4.28Å; L272-R898 HydrophobicContact CD2-CG 4.39Å; L272-I901 HydrophobicContact CD1-CB 4.02Å; L272-I901 HydrophobicContact CD1-CD1 4.06Å; L272-I901 HydrophobicContact CD1-CG2 3.73Å; L272-I901 HydrophobicContact CD2-CD1 4.09Å; L272-I901 HydrophobicContact CG-CD1 4.36Å
273	A	68.4	Low	78.4	Confident	64 Å²	64	71.1 Å²	71.1	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-38.2	176.1	0	0	0	0	0	111.2	K270 S271 L275 G276 E277	K270-A273 WeakPolarHBondContact O-CB 3.42Å; K270-A273 PolarHBondContact O-N 3Å; S271-A273 VanDerWaalsContact C-N 3.33Å; S271-A273 PolarHBondContact O-N 2.92Å; A273-L275 VanDerWaalsContact C-N 3.31Å; A273-L275 PolarHBondContact O-N 3.01Å; A273-G276 PolarHBondContact O-N 3.37Å; A273-E277 PolarHBondContact O-N 2.95Å
274	S	70.9	Confident	78	Confident	42 Å²	42	73 Å²	73	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-66.9	-30.6	176.9	78.1	0	0	0	0	113.2	S271 L272 M278	S271-S274 PolarHBondContact O-N 3.43Å; S271-S274 PolarHBondContact O-OG 3.35Å; L272-S274 VanDerWaalsContact C-N 3.27Å; L272-S274 PolarHBondContact O-N 3.49Å; S274-M278 WeakPolarHBondContact O-CG 3.08Å; S274-M278 PolarHBondContact O-N 2.89Å
275	L	71.7	Confident	77.7	Confident	13 Å²	13	68.8 Å²	68.8	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-68.2	-38.3	173.9	-83.6	175.7	0	0	0	112.2	S271 L272 A273 M278 H279 Q891	S271-L275 PolarHBondContact O-N 3.35Å; L272-L275 HydrophobicContact CD2-CD1 4.38Å; L272-L275 WeakPolarHBondContact O-CB 3.16Å; L272-L275 PolarHBondContact O-N 3.41Å; A273-L275 VanDerWaalsContact C-N 3.31Å; A273-L275 PolarHBondContact O-N 3.01Å; L275-M278 PolarHBondContact O-N 3.4Å; L275-H279 PolarHBondContact O-N 3.32Å; L275-H279 VanDerWaalsContact O-N 3.16Å; L275-H279 PolarHBondContact O-ND1 3.32Å; L275-Q891 HydrophobicContact CD2-CB 3.73Å
276	G	69.8	Low	77.3	Confident	32 Å²	32	70.1 Å²	70.1	33%	0.33	35%	0.354	S	S	.	.	H	α-helix	trans	-59.6	-45	175.2	0	0	0	0	0	112.1	L272 A273 M278 H279 T280	L272-G276 PolarHBondContact O-N 3.34Å; A273-G276 PolarHBondContact O-N 3.37Å; G276-M278 VanDerWaalsContact C-N 3.31Å; G276-M278 PolarHBondContact O-N 3.49Å; G276-H279 PolarHBondContact O-N 3.06Å; G276-T280 PolarHBondContact O-N 3.34Å; G276-T280 PolarHBondContact O-OG1 3.48Å
277	E	76.4	Confident	76.9	Confident	146 Å²	146	73.3 Å²	73.3	68%	0.682	37%	0.367	S	S	*	.	H	α-helix	trans	-63.2	-35.2	176.7	-66.8	178.6	177.9	0	0	112.9	A273 K281	A273-E277 PolarHBondContact O-N 2.95Å; E277-K281 WeakPolarHBondContact O-CB 3.18Å; E277-K281 PolarHBondContact O-N 3.24Å
278	M	76.6	Confident	76.5	Confident	33 Å²	33	70.8 Å²	70.8	16%	0.163	35%	0.352	C	S	.	.	H	α-helix	trans	-69.3	-35.6	177.4	-69.7	-168.8	-138.5	0	0	112.8	S274 L275 G276 K281 L282 L884 K887 I888	S274-M278 WeakPolarHBondContact O-CG 3.08Å; S274-M278 PolarHBondContact O-N 2.89Å; L275-M278 PolarHBondContact O-N 3.4Å; G276-M278 VanDerWaalsContact C-N 3.31Å; G276-M278 PolarHBondContact O-N 3.49Å; M278-K281 PolarHBondContact O-N 2.99Å; M278-L282 WeakPolarHBondContact O-CB 3.25Å; M278-L282 PolarHBondContact O-N 3Å; M278-L884 HydrophobicContact CB-CD2 4Å; M278-L884 HydrophobicContact CG-CD2 4.42Å; M278-L884 WeakPolarHBondContact O-CD2 3.5Å; M278-K887 HydrophobicContact SD-CD 4.2Å; M278-K887 HydrophobicContact SD-CG 4.49Å; M278-I888 HydrophobicContact CB-CD1 4.09Å; M278-I888 HydrophobicContact CB-CG1 3.99Å
279	H	76.4	Confident	76.3	Confident	69 Å²	69	65.3 Å²	65.3	32%	0.319	33%	0.333	S	S	.	.	H	α-helix	trans	-66.9	-46.1	176.3	-76.1	78.3	0	0	0	111.7	L275 G276 K281 L282 E283 I888 Q892	L275-H279 PolarHBondContact O-N 3.32Å; L275-H279 VanDerWaalsContact O-N 3.16Å; L275-H279 PolarHBondContact O-ND1 3.32Å; G276-H279 PolarHBondContact O-N 3.06Å; H279-K281 VanDerWaalsContact C-N 3.26Å; H279-K281 PolarHBondContact O-N 3.24Å; H279-L282 WeakPolarHBondContact O-CB 3.45Å; H279-L282 PolarHBondContact O-N 3.45Å; H279-L282 VanDerWaalsContact O-N 3.09Å; H279-E283 PolarHBondContact O-N 3.27Å; H279-E283 VanDerWaalsContact O-N 3.11Å; H279-I888 WeakPolarHBondContact CE1-CG2 3.15Å; H279-Q892 PolarHBondContact NE2-NE2 3Å
280	T	79.3	Confident	75.9	Confident	92 Å²	92	61.2 Å²	61.2	56%	0.564	32%	0.32	S	S	*	.	H	α-helix	trans	-59.5	-39.6	176.9	-47.1	0	0	0	0	111.6	G276 L282 E283 E284	G276-T280 PolarHBondContact O-N 3.34Å; G276-T280 PolarHBondContact O-OG1 3.48Å; T280-L282 VanDerWaalsContact C-N 3.35Å; T280-E283 PolarHBondContact O-N 2.96Å; T280-E284 PolarHBondContact O-N 3.33Å
281	K	79.3	Confident	75.7	Confident	108 Å²	108	56.4 Å²	56.4	47%	0.47	30%	0.298	S	S	.	.	H	α-helix	trans	-68.8	-32.7	177.3	-168.7	169.1	-176.8	179.5	0	112.9	E277 M278 H279 L285	E277-K281 WeakPolarHBondContact O-CB 3.18Å; E277-K281 PolarHBondContact O-N 3.24Å; M278-K281 PolarHBondContact O-N 2.99Å; H279-K281 VanDerWaalsContact C-N 3.26Å; H279-K281 PolarHBondContact O-N 3.24Å; K281-L285 HydrophobicContact CG-CD1 4.45Å; K281-L285 WeakPolarHBondContact O-CG 3.26Å; K281-L285 PolarHBondContact O-N 2.82Å; K281-L285 VanDerWaalsContact O-N 3.11Å
282	L	80.7	Confident	75.7	Confident	23 Å²	23	54.9 Å²	54.9	12%	0.12	29%	0.288	C	S	.	.	H	α-helix	trans	-66.8	-43.4	175.6	-179.5	129.6	0	0	0	111.6	M278 H279 T280 E284 L285 Q286 L884 K885 I888	M278-L282 WeakPolarHBondContact O-CB 3.25Å; M278-L282 PolarHBondContact O-N 3Å; H279-L282 WeakPolarHBondContact O-CB 3.45Å; H279-L282 PolarHBondContact O-N 3.45Å; H279-L282 VanDerWaalsContact O-N 3.09Å; T280-L282 VanDerWaalsContact C-N 3.35Å; L282-E284 VanDerWaalsContact C-N 3.32Å; L282-E284 PolarHBondContact O-N 2.83Å; L282-L285 PolarHBondContact O-N 2.85Å; L282-Q286 WeakPolarHBondContact O-CG 3.29Å; L282-Q286 PolarHBondContact O-N 3.45Å; L282-L884 HydrophobicContact CD1-CB 4.29Å; L282-K885 HydrophobicContact CD1-CB 4.44Å; L282-K885 HydrophobicContact CD1-CG 3.43Å; L282-K885 VanDerWaalsContact CD1-CG 3.43Å; L282-I888 HydrophobicContact CB-CD1 4.3Å; L282-I888 HydrophobicContact CD1-CD1 3.97Å
283	E	78.6	Confident	75.5	Confident	110 Å²	110	57.9 Å²	57.9	51%	0.514	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-39.6	175.5	-70.5	-179.9	-179	0	0	112.1	H279 T280 Q286 K287	H279-E283 PolarHBondContact O-N 3.27Å; H279-E283 VanDerWaalsContact O-N 3.11Å; T280-E283 PolarHBondContact O-N 2.96Å; E283-Q286 PolarHBondContact O-N 2.81Å; E283-K287 WeakPolarHBondContact O-CG 3.5Å; E283-K287 PolarHBondContact O-N 3.26Å
284	E	79.5	Confident	75.8	Confident	114 Å²	114	54.9 Å²	54.9	53%	0.533	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-41.7	177.5	-166.1	179.7	177.2	0	0	112.3	T280 L282 K287 Q288	T280-E284 PolarHBondContact O-N 3.33Å; L282-E284 VanDerWaalsContact C-N 3.32Å; L282-E284 PolarHBondContact O-N 2.83Å; E284-K287 PolarHBondContact O-N 3.33Å; E284-Q288 WeakPolarHBondContact O-CG 3.16Å; E284-Q288 PolarHBondContact O-N 2.73Å; E284-Q288 VanDerWaalsContact O-N 3.15Å
285	L	80.1	Confident	75.8	Confident	9 Å²	9	55.2 Å²	55.2	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-67.2	-34.8	176.5	-72.3	170	0	0	0	112.4	K281 L282 K287 Q288 M289 I877 E880 I881 L884	K281-L285 HydrophobicContact CG-CD1 4.45Å; K281-L285 WeakPolarHBondContact O-CG 3.26Å; K281-L285 PolarHBondContact O-N 2.82Å; K281-L285 VanDerWaalsContact O-N 3.11Å; L282-L285 PolarHBondContact O-N 2.85Å; L285-K287 VanDerWaalsContact C-N 3.34Å; L285-Q288 PolarHBondContact O-N 3.05Å; L285-M289 WeakPolarHBondContact O-CB 3.36Å; L285-M289 PolarHBondContact O-N 2.99Å; L285-I877 HydrophobicContact CB-CG2 4.46Å; L285-I877 HydrophobicContact CD2-CG2 4.35Å; L285-E880 HydrophobicContact CD1-CG 4.01Å; L285-I881 HydrophobicContact CB-CD1 4.18Å; L285-I881 HydrophobicContact CB-CG1 3.73Å; L285-L884 HydrophobicContact CD1-CD1 3.94Å
286	Q	77.2	Confident	75.6	Confident	78 Å²	78	56.3 Å²	56.3	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-38.4	174.6	-75.5	175.6	-37.4	0	0	112.3	L282 E283 M289 A290 I881	L282-Q286 WeakPolarHBondContact O-CG 3.29Å; L282-Q286 PolarHBondContact O-N 3.45Å; E283-Q286 PolarHBondContact O-N 2.81Å; Q286-M289 WeakPolarHBondContact O-CB 3.43Å; Q286-M289 PolarHBondContact O-N 3.35Å; Q286-A290 PolarHBondContact O-N 3.49Å; Q286-I881 HydrophobicContact CG-CD1 4.29Å
287	K	77.4	Confident	75.5	Confident	100 Å²	100	58.1 Å²	58.1	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-39.9	174.3	-68.2	173.4	-176.7	176.5	0	112	E283 E284 L285	E283-K287 WeakPolarHBondContact O-CG 3.5Å; E283-K287 PolarHBondContact O-N 3.26Å; E284-K287 PolarHBondContact O-N 3.33Å; L285-K287 VanDerWaalsContact C-N 3.34Å
288	Q	75.5	Confident	75.2	Confident	51 Å²	51	54.4 Å²	54.4	24%	0.238	27%	0.267	C	S	.	.	H	α-helix	trans	-69	-34.9	176	-68.1	176.6	14.7	0	0	112.6	E284 L285 A290 S292 I877	E284-Q288 WeakPolarHBondContact O-CG 3.16Å; E284-Q288 PolarHBondContact O-N 2.73Å; E284-Q288 VanDerWaalsContact O-N 3.15Å; L285-Q288 PolarHBondContact O-N 3.05Å; Q288-A290 PolarHBondContact O-N 2.9Å; Q288-S292 WeakPolarHBondContact O-CB 3.5Å; Q288-S292 PolarHBondContact O-N 3Å; Q288-I877 HydrophobicContact CB-CD1 4.32Å
289	M	76.5	Confident	74.7	Confident	25 Å²	25	60.6 Å²	60.6	12%	0.123	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-49.1	176.4	174	58.4	78.3	0	0	111.9	L285 Q286 W291 S292 L293 A874 I877 D878 I881	L285-M289 WeakPolarHBondContact O-CB 3.36Å; L285-M289 PolarHBondContact O-N 2.99Å; Q286-M289 WeakPolarHBondContact O-CB 3.43Å; Q286-M289 PolarHBondContact O-N 3.35Å; M289-W291 VanDerWaalsContact C-N 3.29Å; M289-W291 PolarHBondContact O-N 3.45Å; M289-S292 PolarHBondContact O-N 2.88Å; M289-S292 PolarHBondContact O-OG 3.44Å; M289-L293 HydrophobicContact CG-CD1 4.16Å; M289-L293 PolarHBondContact O-N 2.98Å; M289-L293 HydrophobicContact SD-CD1 3.87Å; M289-L293 HydrophobicContact SD-CG 3.98Å; M289-A874 VanDerWaalsContact CE-O 3.32Å; M289-A874 WeakPolarHBondContact CE-O 3.41Å; M289-A874 HydrophobicContact SD-CB 4.07Å; M289-I877 HydrophobicContact CB-CG2 4Å; M289-I877 HydrophobicContact CE-CB 3.85Å; M289-I877 HydrophobicContact CE-CG2 3.87Å; M289-D878 HydrophobicContact CE-CB 3.39Å; M289-I881 HydrophobicContact CB-CD1 3.96Å; M289-I881 HydrophobicContact CE-CD1 3.97Å; M289-I881 HydrophobicContact CG-CD1 4.44Å
290	A	72.7	Confident	74	Confident	13 Å²	13	62 Å²	62	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-55.8	-41.6	-175.3	0	0	0	0	0	112.7	Q286 Q288 A860 I863	Q286-A290 PolarHBondContact O-N 3.49Å; Q288-A290 PolarHBondContact O-N 2.9Å; A290-A860 HydrophobicContact CB-CB 4.36Å; A290-A860 WeakPolarHBondContact O-CB 3.5Å; A290-I863 HydrophobicContact CB-CB 4.4Å; A290-I863 HydrophobicContact CB-CD1 4.19Å; A290-I863 HydrophobicContact CB-CG2 4.31Å
291	W	76.6	Confident	73.5	Confident	11 Å²	11	58.3 Å²	58.3	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-85.3	-27.7	179.3	-72.5	106.8	0	0	0	113.8	M289 L293 V294 T295 A860 C864 E866 R867 L868 V870	M289-W291 VanDerWaalsContact C-N 3.29Å; M289-W291 PolarHBondContact O-N 3.45Å; W291-L293 VanDerWaalsContact C-N 3.33Å; W291-L293 PolarHBondContact O-N 3.49Å; W291-V294 PolarHBondContact O-N 3.34Å; W291-T295 PolarHBondContact O-N 3.16Å; W291-T295 VanDerWaalsContact O-N 3.13Å; W291-T295 PolarHBondContact O-OG1 3.4Å; W291-A860 HydrophobicContact CD2-CB 4.17Å; W291-A860 HydrophobicContact CE3-CB 4.22Å; W291-A860 HydrophobicContact CH2-CB 4.44Å; W291-A860 HydrophobicContact CZ2-CB 4.4Å; W291-A860 HydrophobicContact CZ3-CB 4.35Å; W291-C864 WeakPolarHBondContact CZ2-O 3.41Å; W291-C864 PolarHBondContact NE1-O 3.02Å; W291-E866 PolarHBondContact NE1-O 2.84Å; W291-R867 HydrophobicContact CE3-CG 4.04Å; W291-R867 HydrophobicContact CH2-CB 4.24Å; W291-R867 HydrophobicContact CH2-CG 4.35Å; W291-R867 HydrophobicContact CZ2-CB 4.43Å; W291-R867 HydrophobicContact CZ3-CB 4.32Å; W291-R867 HydrophobicContact CZ3-CG 3.93Å; W291-L868 HydrophobicContact CB-CB 4.34Å; W291-L868 HydrophobicContact CG-CB 4.31Å; W291-V870 HydrophobicContact CB-CG2 4.12Å
292	S	72.9	Confident	72.6	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.007	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-37.5	175.5	75.4	0	0	0	0	113.2	Q288 M289 V294 T295 E296 A874	Q288-S292 WeakPolarHBondContact O-CB 3.5Å; Q288-S292 PolarHBondContact O-N 3Å; M289-S292 PolarHBondContact O-N 2.88Å; M289-S292 PolarHBondContact O-OG 3.44Å; S292-V294 VanDerWaalsContact C-N 3.29Å; S292-V294 PolarHBondContact O-N 2.95Å; S292-T295 PolarHBondContact O-N 3.05Å; S292-E296 WeakPolarHBondContact O-CG 3.41Å; S292-E296 PolarHBondContact O-N 3.48Å; S292-A874 WeakPolarHBondContact OG-CA 3.39Å
293	L	68.6	Low	71.6	Confident	81 Å²	81	60.5 Å²	60.5	42%	0.424	29%	0.288	S	S	.	.	H	α-helix	trans	-64.2	-35.3	177.8	-75.1	165.7	0	0	0	111.8	M289 W291 M297 A874	M289-L293 HydrophobicContact CG-CD1 4.16Å; M289-L293 PolarHBondContact O-N 2.98Å; M289-L293 HydrophobicContact SD-CD1 3.87Å; M289-L293 HydrophobicContact SD-CG 3.98Å; W291-L293 VanDerWaalsContact C-N 3.33Å; W291-L293 PolarHBondContact O-N 3.49Å; L293-M297 VanDerWaalsContact O-CG 3.29Å; L293-M297 WeakPolarHBondContact O-CG 3.34Å; L293-M297 PolarHBondContact O-N 3.4Å; L293-A874 HydrophobicContact CD2-CB 3.44Å; L293-A874 VanDerWaalsContact CD2-CB 3.44Å; L293-A874 HydrophobicContact CG-CB 3.83Å
294	V	74.4	Confident	71	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-70	-47.7	176.2	175.1	0	0	0	0	110.7	W291 S292 E296 M297 E298 L853 V857 A860	W291-V294 PolarHBondContact O-N 3.34Å; S292-V294 VanDerWaalsContact C-N 3.29Å; S292-V294 PolarHBondContact O-N 2.95Å; V294-E296 VanDerWaalsContact C-N 3.34Å; V294-E296 PolarHBondContact O-N 2.78Å; V294-M297 PolarHBondContact O-N 3.16Å; V294-E298 WeakPolarHBondContact O-CG 3.36Å; V294-E298 PolarHBondContact O-N 3.25Å; V294-L853 HydrophobicContact CG1-CD1 4.21Å; V294-V857 HydrophobicContact CG1-CG2 3.53Å; V294-V857 HydrophobicContact CG2-CG2 4.33Å; V294-A860 HydrophobicContact CG2-CB 3.86Å
295	T	70.8	Confident	70.2	Confident	49 Å²	49	55 Å²	55	30%	0.301	26%	0.263	S	S	.	.	H	α-helix	trans	-64.5	-35.8	-180	-54.2	0	0	0	0	112.7	W291 S292 R299	W291-T295 PolarHBondContact O-N 3.16Å; W291-T295 VanDerWaalsContact O-N 3.13Å; W291-T295 PolarHBondContact O-OG1 3.4Å; S292-T295 PolarHBondContact O-N 3.05Å; T295-R299 WeakPolarHBondContact O-CB 3.46Å; T295-R299 PolarHBondContact O-N 3.26Å; T295-R299 VanDerWaalsContact O-N 3.15Å
296	E	68.8	Low	69.4	Low	37 Å²	37	61.1 Å²	61.1	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-67.6	-39.7	173.9	-74	-169.2	146.4	0	0	112.3	S292 V294 R299 E300 T873 A874	S292-E296 WeakPolarHBondContact O-CG 3.41Å; S292-E296 PolarHBondContact O-N 3.48Å; V294-E296 VanDerWaalsContact C-N 3.34Å; V294-E296 PolarHBondContact O-N 2.78Å; E296-R299 PolarHBondContact O-N 3.22Å; E296-R299 IonicContact OE1-NH2 2.66Å; E296-E300 WeakPolarHBondContact O-CB 3.34Å; E296-E300 WeakPolarHBondContact O-CG 3.5Å; E296-E300 PolarHBondContact O-N 3.26Å; E296-T873 WeakPolarHBondContact OE1-CA 3.33Å; E296-T873 WeakPolarHBondContact OE1-CB 3.37Å; E296-T873 WeakPolarHBondContact OE1-CG2 3.4Å; E296-A874 VanDerWaalsContact CD-N 3.29Å; E296-A874 PolarHBondContact OE1-N 3.34Å; E296-A874 WeakPolarHBondContact OE2-CB 3.47Å; E296-A874 PolarHBondContact OE2-N 2.92Å
297	M	67.9	Low	68.5	Low	70 Å²	70	63.7 Å²	63.7	35%	0.345	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-38.1	176.1	-77.1	-174.8	158.1	0	0	113	L293 V294 L853 S856	L293-M297 VanDerWaalsContact O-CG 3.29Å; L293-M297 WeakPolarHBondContact O-CG 3.34Å; L293-M297 PolarHBondContact O-N 3.4Å; V294-M297 PolarHBondContact O-N 3.16Å; M297-L853 HydrophobicContact CB-CD1 3.82Å; M297-S856 PolarHBondContact SD-OG 3.39Å
298	E	68.7	Low	68	Low	67 Å²	67	60.5 Å²	60.5	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-46.2	174.3	-70.3	173.4	154.8	0	0	111.2	V294 E300 L301 L853 R867	V294-E298 WeakPolarHBondContact O-CG 3.36Å; V294-E298 PolarHBondContact O-N 3.25Å; E298-E300 VanDerWaalsContact C-N 3.28Å; E298-E300 PolarHBondContact O-N 3.11Å; E298-L301 WeakPolarHBondContact O-CB 3.39Å; E298-L301 PolarHBondContact O-N 3.45Å; E298-L853 HydrophobicContact CG-CD1 3.61Å; E298-L853 HydrophobicContact CG-CD2 3.87Å; E298-L853 HydrophobicContact CG-CG 4.36Å; E298-R867 IonicContact OE1-CZ 3.97Å; E298-R867 IonicContact OE1-NH1 2.93Å; E298-R867 IonicContact OE1-NH2 3.25Å; E298-R867 PolarHBondContact OE1-NH2 3.01Å; E298-R867 IonicContact OE2-NH2 3.1Å; E298-R867 PolarHBondContact OE2-NH2 3.08Å
299	R	67.1	Low	67.2	Low	163 Å²	163	65.6 Å²	65.6	62%	0.615	31%	0.312	S	S	*	.	H	α-helix	trans	-67.2	-27	-179.5	-168	-179.1	65.6	-167.6	-5.8	113.3	T295 E296 L301 P303	T295-R299 WeakPolarHBondContact O-CB 3.46Å; T295-R299 PolarHBondContact O-N 3.26Å; T295-R299 VanDerWaalsContact O-N 3.15Å; E296-R299 PolarHBondContact O-N 3.22Å; E296-R299 IonicContact OE1-NH2 2.66Å; R299-L301 VanDerWaalsContact C-N 3.3Å; R299-P303 VanDerWaalsContact O-CD 3.3Å; R299-P303 WeakPolarHBondContact O-CD 3.24Å
300	E	62.5	Low	66.3	Low	100 Å²	100	67.3 Å²	67.3	47%	0.467	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.9	177	-80.5	-169.7	-168.5	0	0	114.6	E296 E298 V304 K849	E296-E300 WeakPolarHBondContact O-CB 3.34Å; E296-E300 WeakPolarHBondContact O-CG 3.5Å; E296-E300 PolarHBondContact O-N 3.26Å; E298-E300 VanDerWaalsContact C-N 3.28Å; E298-E300 PolarHBondContact O-N 3.11Å; E300-V304 WeakPolarHBondContact O-CG2 3.24Å; E300-K849 IonicContact OE2-NZ 3.71Å; E300-K849 PolarHBondContact OE2-NZ 3.14Å
301	L	67.7	Low	65.8	Low	13 Å²	13	68.3 Å²	68.3	7%	0.068	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-35.7	-173.6	-138.8	149.2	0	0	0	112.1	E298 R299 V304 L846 K849 E850 L853	E298-L301 WeakPolarHBondContact O-CB 3.39Å; E298-L301 PolarHBondContact O-N 3.45Å; R299-L301 VanDerWaalsContact C-N 3.3Å; L301-V304 PolarHBondContact O-N 2.86Å; L301-L846 HydrophobicContact CD2-CD1 4.11Å; L301-K849 HydrophobicContact CD1-CB 4.25Å; L301-K849 HydrophobicContact CG-CB 4.45Å; L301-E850 HydrophobicContact CD1-CG 3.82Å; L301-E850 HydrophobicContact CD2-CG 3.81Å; L301-E850 HydrophobicContact CG-CG 4.35Å; L301-L853 HydrophobicContact CD1-CD2 4.05Å
302	E	61.3	Low	65	Low	119 Å²	119	73.3 Å²	73.3	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-62.1	-49.2	-178.5	-148.7	59.3	-157.9	0	0	114.9	V304 K305 E306	E302-V304 PolarHBondContact O-N 3.36Å; E302-K305 PolarHBondContact O-N 3.12Å; E302-E306 PolarHBondContact O-N 3.24Å
303	P	59.5	Low	64.3	Low	58 Å²	58	84.4 Å²	84.4	38%	0.377	40%	0.398	S	S	.	.	H	α-helix	trans	-71.8	-17.1	-178.6	28.1	-35.1	0	0	0	113.8	R299 K307	R299-P303 VanDerWaalsContact O-CD 3.3Å; R299-P303 WeakPolarHBondContact O-CD 3.24Å; P303-K307 WeakPolarHBondContact O-CB 3.39Å; P303-K307 PolarHBondContact O-N 3.39Å
304	V	65.8	Low	63.8	Low	18 Å²	18	82.5 Å²	82.5	11%	0.109	39%	0.391	C	S	.	.	H	α-helix	trans	-75.2	-33.9	176.4	176.9	0	0	0	0	110.5	E300 L301 E302 L842 L846	E300-V304 WeakPolarHBondContact O-CG2 3.24Å; L301-V304 PolarHBondContact O-N 2.86Å; E302-V304 PolarHBondContact O-N 3.36Å; V304-L842 HydrophobicContact CG1-CD2 3.95Å; V304-L846 HydrophobicContact CB-CD1 4.28Å; V304-L846 HydrophobicContact CG1-CD1 3.87Å
305	K	63.2	Low	63	Low	91 Å²	91	84.2 Å²	84.2	40%	0.396	40%	0.401	S	S	.	.	H	α-helix	trans	-67.9	-42.6	175	-71.6	-174.9	174.6	173.2	0	112	E302 L846 E850	E302-K305 PolarHBondContact O-N 3.12Å; K305-L846 HydrophobicContact CD-CD1 4.29Å; K305-L846 HydrophobicContact CG-CD1 3.43Å; K305-L846 VanDerWaalsContact CG-CD1 3.43Å; K305-L846 HydrophobicContact CG-CD2 4.38Å; K305-E850 WeakPolarHBondContact CE-OE1 3.49Å; K305-E850 IonicContact NZ-OE1 2.74Å; K305-E850 PolarHBondContact NZ-OE1 3.48Å
306	E	63.2	Low	62.3	Low	138 Å²	138	90.5 Å²	90.5	65%	0.645	43%	0.427	S	S	*	.	H	α-helix	trans	-72.2	-39.2	-178.5	-66.8	-176	155.2	0	0	113.2	E302 L308	E302-E306 PolarHBondContact O-N 3.24Å; E306-L308 PolarHBondContact O-N 3.48Å
307	K	56.9	Low	61.9	Low	132 Å²	132	96.9 Å²	96.9	57%	0.574	46%	0.455	S	S	*	.	H	α-helix	trans	-66.2	-34.4	179.4	-85.3	178.8	175	175.3	0	113.9	P303 Q309 A310 D311	P303-K307 WeakPolarHBondContact O-CB 3.39Å; P303-K307 PolarHBondContact O-N 3.39Å; K307-Q309 VanDerWaalsContact C-N 3.27Å; K307-Q309 PolarHBondContact O-N 3.09Å; K307-A310 PolarHBondContact O-N 2.88Å; K307-D311 PolarHBondContact O-N 2.71Å
308	L	66.7	Low	61.4	Low	32 Å²	32	96.7 Å²	96.7	17%	0.168	45%	0.45	C	S	.	.	H	α-helix	trans	-62.6	-33.4	-178.4	-171.1	75.6	0	0	0	112.9	E306 I839 L842 E843	E306-L308 PolarHBondContact O-N 3.48Å; L308-I839 HydrophobicContact CD1-CG2 4.27Å; L308-I839 WeakPolarHBondContact CD1-O 3.41Å; L308-L842 HydrophobicContact CD1-CB 3.61Å; L308-L842 HydrophobicContact CD1-CD1 4.42Å; L308-E843 HydrophobicContact CD1-CG 3.69Å; L308-E843 HydrophobicContact CD2-CG 3.59Å; L308-E843 HydrophobicContact CG-CG 4.25Å
309	Q	58.7	Low	60.9	Low	159 Å²	159	96.9 Å²	96.9	74%	0.743	45%	0.454	S	S	*	.	H	α-helix	trans	-75.5	-32.3	178.2	-85	-173	-14.5	0	0	113.3	K307	K307-Q309 VanDerWaalsContact C-N 3.27Å; K307-Q309 PolarHBondContact O-N 3.09Å
310	A	58.1	Low	60.6	Low	60 Å²	60	97.2 Å²	97.2	50%	0.496	46%	0.462	S	S	.	.	H	α-helix	trans	-76.2	-36.5	-178.8	0	0	0	0	0	112.7	K307 K312 R313	K307-A310 PolarHBondContact O-N 2.88Å; A310-K312 PolarHBondContact O-N 3.33Å; A310-R313 PolarHBondContact O-N 3.07Å
311	D	61.9	Low	60.5	Low	35 Å²	35	97.5 Å²	97.5	19%	0.187	46%	0.462	C	S	.	.	H	α-helix	trans	-72.3	-27.9	-174.1	-77.1	-8.2	0	0	0	113.4	K307 R313 S314 H835 I839	K307-D311 PolarHBondContact O-N 2.71Å; D311-R313 PolarHBondContact O-N 3.47Å; D311-S314 PolarHBondContact O-N 2.91Å; D311-S314 PolarHBondContact O-OG 3.49Å; D311-H835 VanDerWaalsContact CB-CE1 3.43Å; D311-H835 WeakPolarHBondContact CB-CE1 3.28Å; D311-H835 VanDerWaalsContact CG-CE1 3.49Å; D311-H835 PolarHBondContact O-CE1 3.39Å; D311-H835 VanDerWaalsContact O-CE1 3.31Å; D311-H835 PolarHBondContact O-NE2 3Å; D311-H835 IonicContact OD1-CE1 3.26Å; D311-H835 PolarHBondContact OD1-CE1 2.87Å; D311-I839 HydrophobicContact CB-CD1 4.11Å; D311-I839 HydrophobicContact CB-CG1 3.77Å
312	K	60.2	Low	60.3	Low	115 Å²	115	97.6 Å²	97.6	50%	0.5	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.2	177.9	-76.3	-178.1	179.3	175.8	0	114.8	A310 I839 E843	A310-K312 PolarHBondContact O-N 3.33Å; K312-I839 HydrophobicContact CD-CG2 4.48Å; K312-I839 HydrophobicContact CG-CD1 4.06Å; K312-I839 HydrophobicContact CG-CG1 4.5Å; K312-I839 HydrophobicContact CG-CG2 4.04Å; K312-E843 WeakPolarHBondContact CE-OE1 3.37Å; K312-E843 IonicContact NZ-OE1 2.89Å; K312-E843 PolarHBondContact NZ-OE1 2.99Å
313	R	58.1	Low	60.2	Low	235 Å²	235	97.4 Å²	97.4	89%	0.887	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.3	-176.5	-69.8	-177.1	179.3	176.7	0.6	114.9	A310 D311	A310-R313 PolarHBondContact O-N 3.07Å; D311-R313 PolarHBondContact O-N 3.47Å
314	S	57.6	Low	60.6	Low	40 Å²	40	100.3 Å²	100.3	28%	0.28	47%	0.474	S	S	.	.			trans	-113.2	9.2	-164.7	38.5	0	0	0	0	115.2	D311 Y318 H835	D311-S314 PolarHBondContact O-N 2.91Å; D311-S314 PolarHBondContact O-OG 3.49Å; S314-Y318 WeakPolarHBondContact O-CD2 3.49Å; S314-Y318 WeakPolarHBondContact O-CE2 3.34Å; S314-H835 PolarHBondContact OG-CE1 3.26Å; S314-H835 VanDerWaalsContact OG-CE1 3.27Å; S314-H835 PolarHBondContact OG-NE2 2.8Å
315	T	57.5	Low	60.8	Low	37 Å²	37	102 Å²	102	23%	0.227	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-74.7	-29	-169.5	-34.5	0	0	0	0	115	K317 L836	T315-K317 VanDerWaalsContact C-N 3.32Å; T315-K317 PolarHBondContact O-N 3.29Å; T315-L836 HydrophobicContact CG2-CD1 4.49Å; T315-L836 HydrophobicContact CG2-CD2 3.8Å; T315-L836 HydrophobicContact CG2-CG 4.08Å
316	E	57.4	Low	60.9	Low	181 Å²	181	102.9 Å²	102.9	85%	0.846	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-70.4	-19.8	-174.7	-69	175.3	165.9	0	0	114.7
317	K	59.7	Low	61.1	Low	172 Å²	172	102 Å²	102	75%	0.748	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-88.2	-10.9	-174	-68.9	-178.7	178.9	177.8	0	115.1	T315	T315-K317 VanDerWaalsContact C-N 3.32Å; T315-K317 PolarHBondContact O-N 3.29Å
318	Y	57.9	Low	61.5	Low	65 Å²	65	100.4 Å²	100.4	26%	0.255	48%	0.475	S	S	.	.	S	Bend	trans	-92.4	-17.3	-174.5	-70.2	-68.5	0	0	0	113.7	S314 K831	S314-Y318 WeakPolarHBondContact O-CD2 3.49Å; S314-Y318 WeakPolarHBondContact O-CE2 3.34Å; Y318-K831 HydrophobicContact CD1-CB 3.97Å; Y318-K831 HydrophobicContact CD1-CD 4.49Å; Y318-K831 HydrophobicContact CE1-CB 4.03Å; Y318-K831 HydrophobicContact CE1-CD 3.92Å; Y318-K831 HydrophobicContact CE1-CG 4.41Å
319	D	58.8	Low	61.5	Low	72 Å²	72	99.2 Å²	99.2	39%	0.385	47%	0.469	S	S	.	.	S	Bend	trans	-68.9	-39.6	-178.8	-98.5	-60.6	0	0	0	113.4	K321 R832	D319-K321 PolarHBondContact O-N 3.18Å; D319-R832 VanDerWaalsContact CG-CZ 3.48Å; D319-R832 WeakPolarHBondContact OD1-CD 3.45Å; D319-R832 IonicContact OD1-CZ 3Å; D319-R832 IonicContact OD1-NE 2.75Å; D319-R832 PolarHBondContact OD1-NE 3.4Å; D319-R832 IonicContact OD1-NH1 3.6Å; D319-R832 IonicContact OD1-NH2 3.46Å; D319-R832 PolarHBondContact OD1-NH2 3.03Å; D319-R832 IonicContact OD2-CZ 2.78Å; D319-R832 IonicContact OD2-NE 2.71Å; D319-R832 PolarHBondContact OD2-NE 3.45Å; D319-R832 IonicContact OD2-NH2 3.84Å; D319-R832 PolarHBondContact OD2-NH2 3.42Å; D319-R832 VanDerWaalsContact OD2-NH2 3.12Å
320	E	60.1	Low	61.9	Low	170 Å²	170	98 Å²	98	79%	0.794	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-21.5	-174.5	-66.8	178.1	160	0	0	114.7
321	K	59.8	Low	62.3	Low	106 Å²	106	102.6 Å²	102.6	46%	0.461	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-11.1	-174.2	-73.8	-158.5	173.2	-170.6	0	115.2	D319 Y828	D319-K321 PolarHBondContact O-N 3.18Å; K321-Y828 HydrophobicContact CB-CD1 3.71Å; K321-Y828 HydrophobicContact CB-CD2 4.35Å; K321-Y828 HydrophobicContact CB-CE1 4.04Å; K321-Y828 HydrophobicContact CB-CG 3.89Å; K321-Y828 HydrophobicContact CD-CD1 4.05Å; K321-Y828 HydrophobicContact CD-CE1 3.48Å; K321-Y828 VanDerWaalsContact CD-CE1 3.48Å; K321-Y828 HydrophobicContact CD-CE2 4.44Å; K321-Y828 HydrophobicContact CG-CE1 4.39Å
322	V	62.9	Low	62.4	Low	14 Å²	14	102.3 Å²	102.3	9%	0.085	48%	0.475	C	S	.	.	H	α-helix	trans	-77.1	-38.5	-175.4	170.2	0	0	0	0	112.1	E324 Y828 D829	V322-E324 PolarHBondContact O-N 3.41Å; V322-Y828 VanDerWaalsContact CG2-C 3.42Å; V322-Y828 WeakPolarHBondContact CG2-O 3.5Å; V322-D829 HydrophobicContact CG1-CB 4.23Å; V322-D829 VanDerWaalsContact CG1-OD1 3.27Å; V322-D829 WeakPolarHBondContact CG1-OD1 3.44Å; V322-D829 HydrophobicContact CG2-CB 4.48Å
323	D	60.5	Low	62.8	Low	116 Å²	116	100.3 Å²	100.3	62%	0.62	47%	0.468	S	S	*	.	H	α-helix	trans	-70.4	-30.4	-172.7	-80	-28.8	0	0	0	113.7
324	E	67	Low	63.4	Low	119 Å²	119	97 Å²	97	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-67.5	-39.5	-178.6	-166.1	-166.5	152.9	0	0	113.1	V322 K326	V322-E324 PolarHBondContact O-N 3.41Å; E324-K326 VanDerWaalsContact C-N 3.32Å; E324-K326 PolarHBondContact O-N 2.72Å
325	W	71.4	Confident	63.8	Low	53 Å²	53	101.9 Å²	101.9	20%	0.201	48%	0.476	C	S	.	.	H	α-helix	trans	-83.1	-10.2	-175.3	-72	97.8	0	0	0	113.5	N327 K328 H824 K825 Y828	W325-N327 PolarHBondContact O-N 2.95Å; W325-K328 HydrophobicContact CE3-CD 4.1Å; W325-K328 HydrophobicContact CZ3-CD 3.98Å; W325-H824 HydrophobicContact CD2-CB 3.45Å; W325-H824 VanDerWaalsContact CD2-CB 3.45Å; W325-H824 HydrophobicContact CE3-CB 3.42Å; W325-H824 VanDerWaalsContact CE3-CB 3.42Å; W325-H824 HydrophobicContact CG-CB 3.99Å; W325-H824 HydrophobicContact CH2-CB 4.12Å; W325-H824 AromaticContact CH2-CD2 3.43Å; W325-H824 VanDerWaalsContact CH2-CD2 3.43Å; W325-H824 WeakPolarHBondContact CH2-CD2 3.39Å; W325-H824 HydrophobicContact CZ2-CB 4.15Å; W325-H824 AromaticContact CZ2-CD2 3.93Å; W325-H824 HydrophobicContact CZ3-CB 3.77Å; W325-H824 AromaticContact CZ3-CD2 3.59Å; W325-K825 VanDerWaalsContact CB-CA 3.5Å; W325-K825 HydrophobicContact CB-CB 3.77Å; W325-K825 HydrophobicContact CB-CG 4.37Å; W325-Y828 AromaticContact CD1-CD2 3.81Å; W325-Y828 AromaticContact NE1-CE2 3.88Å
326	K	65.5	Low	64.5	Low	110 Å²	110	102.8 Å²	102.8	48%	0.478	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-38.2	179.6	-176.9	159.1	-179.6	-173.2	0	113.2	E324 K825	E324-K326 VanDerWaalsContact C-N 3.32Å; E324-K326 PolarHBondContact O-N 2.72Å; K326-K825 HydrophobicContact CB-CD 4.34Å
327	N	65.8	Low	64.9	Low	118 Å²	118	101.1 Å²	101.1	63%	0.631	47%	0.466	S	S	*	.	H	α-helix	trans	-81.4	-25.1	-175.9	-70	-19.1	0	0	0	114.2	W325	W325-N327 PolarHBondContact O-N 2.95Å
328	K	66	Low	65.5	Low	99 Å²	99	99.6 Å²	99.6	43%	0.43	46%	0.461	S	S	.	.	H	α-helix	trans	-78.2	-19.5	-179.2	-74.4	177	179	163.5	0	114	W325	W325-K328 HydrophobicContact CE3-CD 4.1Å; W325-K328 HydrophobicContact CZ3-CD 3.98Å
329	V	67.2	Low	66.1	Low	7 Å²	7	98.1 Å²	98.1	4%	0.042	46%	0.457	C	S	.	.	H	α-helix	trans	-74.9	-38.2	-177.7	168.6	0	0	0	0	113	Q331 S332 E333 C821 K822 K825	V329-Q331 VanDerWaalsContact C-N 3.29Å; V329-Q331 PolarHBondContact O-N 3.45Å; V329-S332 PolarHBondContact O-N 3.31Å; V329-E333 HydrophobicContact CG1-CG 4.39Å; V329-E333 PolarHBondContact O-N 3.04Å; V329-C821 HydrophobicContact CG2-CB 4.1Å; V329-C821 WeakPolarHBondContact CG2-O 3.49Å; V329-K822 HydrophobicContact CB-CG 4.49Å; V329-K822 HydrophobicContact CG1-CD 4.48Å; V329-K822 HydrophobicContact CG1-CG 3.49Å; V329-K822 VanDerWaalsContact CG1-CG 3.49Å; V329-K822 HydrophobicContact CG2-CG 4.21Å; V329-K825 HydrophobicContact CB-CD 4.28Å; V329-K825 HydrophobicContact CG2-CB 3.81Å; V329-K825 HydrophobicContact CG2-CD 3.81Å; V329-K825 HydrophobicContact CG2-CG 4.46Å
330	E	66.4	Low	66.5	Low	135 Å²	135	97.8 Å²	97.8	63%	0.631	45%	0.454	S	S	*	.	H	α-helix	trans	-71	-24.7	-167.5	-158.9	168.1	-156.2	0	0	112.9
331	Q	66.1	Low	67	Low	155 Å²	155	96.4 Å²	96.4	72%	0.724	45%	0.447	S	S	*	.	H	α-helix	trans	-78.7	-36.2	177.6	-69.1	-178.5	-6.6	0	0	113	V329	V329-Q331 VanDerWaalsContact C-N 3.29Å; V329-Q331 PolarHBondContact O-N 3.45Å
332	S	65	Low	67.4	Low	29 Å²	29	97.4 Å²	97.4	20%	0.203	45%	0.454	C	S	.	.	H	α-helix	trans	-77.3	-32.8	-176.6	-53.2	0	0	0	0	112.2	V329 K334 K335 V818	V329-S332 PolarHBondContact O-N 3.31Å; S332-K334 VanDerWaalsContact C-N 3.29Å; S332-K334 PolarHBondContact O-N 2.84Å; S332-K335 PolarHBondContact O-N 3.12Å; S332-V818 VanDerWaalsContact C-CG2 3.41Å; S332-V818 WeakPolarHBondContact O-CG2 3.46Å
333	E	67.8	Low	67.6	Low	73 Å²	73	98.2 Å²	98.2	34%	0.341	46%	0.457	S	S	.	.	H	α-helix	trans	-62.1	-30.1	-179.1	-76.6	-178.2	115.9	0	0	114.5	V329 K335 V818 K822	V329-E333 HydrophobicContact CG1-CG 4.39Å; V329-E333 PolarHBondContact O-N 3.04Å; E333-K335 PolarHBondContact O-N 2.66Å; E333-V818 HydrophobicContact CG-CG1 3.94Å; E333-K822 WeakPolarHBondContact OE1-CE 3.29Å; E333-K822 IonicContact OE1-NZ 3.47Å; E333-K822 PolarHBondContact OE1-NZ 3.5Å
334	K	70.5	Confident	67.9	Low	166 Å²	166	98.1 Å²	98.1	72%	0.722	45%	0.453	S	S	*	.	H	α-helix	trans	-67.5	-33.2	179.5	-82.4	-177	176.2	177	0	113.2	S332	S332-K334 VanDerWaalsContact C-N 3.29Å; S332-K334 PolarHBondContact O-N 2.84Å
335	K	66.8	Low	68	Low	143 Å²	143	94 Å²	94	62%	0.622	44%	0.443	S	S	*	.	H	α-helix	trans	-75.8	-35	179.8	-70.5	-177.3	177.3	-179.8	0	112.6	S332 E333 T814	S332-K335 PolarHBondContact O-N 3.12Å; E333-K335 PolarHBondContact O-N 2.66Å; K335-T814 HydrophobicContact CB-CG2 4.24Å
336	Y	71.6	Confident	67.9	Low	55 Å²	55	93.3 Å²	93.3	22%	0.216	44%	0.443	C	S	.	.	H	α-helix	trans	-65.3	-39.9	179.7	176	-97.2	0	0	0	113.3	Q338 I339 Q340 L811 D815	Y336-Q338 VanDerWaalsContact C-N 3.3Å; Y336-Q338 PolarHBondContact O-N 3.17Å; Y336-I339 PolarHBondContact O-N 3.41Å; Y336-Q340 PolarHBondContact O-N 3.36Å; Y336-L811 HydrophobicContact CD2-CD1 3.99Å; Y336-L811 HydrophobicContact CE2-CD1 3.77Å; Y336-L811 HydrophobicContact CE2-CG 4.1Å; Y336-D815 HydrophobicContact CD2-CB 3.99Å; Y336-D815 HydrophobicContact CE2-CB 3.54Å; Y336-D815 VanDerWaalsContact CE2-OD1 3.29Å; Y336-D815 WeakPolarHBondContact CE2-OD1 3.47Å
337	K	67.3	Low	67.8	Low	147 Å²	147	91.2 Å²	91.2	64%	0.639	44%	0.439	S	S	*	.	H	α-helix	trans	-60.3	-34.9	179.9	-88.8	-174.5	171.1	-174.8	0	114	E341	K337-E341 PolarHBondContact O-N 2.96Å
338	Q	71.4	Confident	68	Low	139 Å²	139	91.7 Å²	91.7	65%	0.65	44%	0.438	S	S	*	.	H	α-helix	trans	-71.3	-33.2	-178.4	-72.1	179.6	-27.6	0	0	113.1	Y336	Y336-Q338 VanDerWaalsContact C-N 3.3Å; Y336-Q338 PolarHBondContact O-N 3.17Å
339	I	69.8	Low	68	Low	34 Å²	34	92.1 Å²	92.1	17%	0.174	44%	0.441	C	S	.	.	H	α-helix	trans	-82.4	-29.6	-179.9	-57.6	175.5	0	0	0	110.5	Y336 Q342 L343 L811 T814	Y336-I339 PolarHBondContact O-N 3.41Å; I339-Q342 PolarHBondContact O-N 2.93Å; I339-L343 PolarHBondContact O-N 2.91Å; I339-L811 HydrophobicContact CB-CD1 3.84Å; I339-L811 HydrophobicContact CG2-CB 3.91Å; I339-L811 HydrophobicContact CG2-CD1 3.72Å; I339-L811 HydrophobicContact CG2-CG 4.44Å; I339-T814 HydrophobicContact CD1-CG2 4.23Å; I339-T814 WeakPolarHBondContact CD1-OG1 3.48Å
340	Q	66.9	Low	68	Low	65 Å²	65	92.8 Å²	92.8	30%	0.304	45%	0.445	S	S	.	.	H	α-helix	trans	-65.7	-39.8	178.1	-171.9	177.2	-8.1	0	0	112.6	Y336 Q342 L343 E344 L811	Y336-Q340 PolarHBondContact O-N 3.36Å; Q340-Q342 VanDerWaalsContact C-N 3.26Å; Q340-Q342 PolarHBondContact O-N 3.37Å; Q340-L343 PolarHBondContact O-N 3.47Å; Q340-E344 PolarHBondContact O-N 3.46Å; Q340-L811 HydrophobicContact CB-CD1 4.04Å
341	E	70.4	Confident	68	Low	142 Å²	142	93 Å²	93	66%	0.664	45%	0.446	S	S	*	.	H	α-helix	trans	-64.4	-28.6	178.1	-74.9	174	174.5	0	0	112.8	K337	K337-E341 PolarHBondContact O-N 2.96Å
342	Q	68.3	Low	68.2	Low	127 Å²	127	92.3 Å²	92.3	59%	0.593	44%	0.443	S	S	*	.	H	α-helix	trans	-75.1	-33.8	176.3	-67.6	-178.8	-27.4	0	0	112.8	I339 Q340	I339-Q342 PolarHBondContact O-N 2.93Å; Q340-Q342 VanDerWaalsContact C-N 3.26Å; Q340-Q342 PolarHBondContact O-N 3.37Å
343	L	67.4	Low	68.4	Low	30 Å²	30	93.1 Å²	93.1	16%	0.157	45%	0.445	C	S	.	.	H	α-helix	trans	-74	-35.9	179.5	-162.2	86.5	0	0	0	112.5	I339 Q340 G345 I346 T347 V807 K808 L811	I339-L343 PolarHBondContact O-N 2.91Å; Q340-L343 PolarHBondContact O-N 3.47Å; L343-G345 VanDerWaalsContact C-N 3.31Å; L343-G345 PolarHBondContact O-N 3.35Å; L343-I346 PolarHBondContact O-N 2.97Å; L343-T347 WeakPolarHBondContact O-CB 3.46Å; L343-T347 PolarHBondContact O-N 2.8Å; L343-T347 VanDerWaalsContact O-N 3.13Å; L343-T347 PolarHBondContact O-OG1 2.88Å; L343-V807 HydrophobicContact CB-CG1 4.4Å; L343-V807 HydrophobicContact CD1-CB 3.84Å; L343-V807 HydrophobicContact CD1-CG1 3.7Å; L343-K808 HydrophobicContact CD1-CB 3.93Å; L343-L811 HydrophobicContact CD2-CD2 3.74Å
344	E	66.6	Low	68.4	Low	114 Å²	114	95 Å²	95	53%	0.533	45%	0.454	S	S	.	.	H	α-helix	trans	-64.5	-34.9	178.4	-81.1	175	-179.2	0	0	112.1	Q340 Q348	Q340-E344 PolarHBondContact O-N 3.46Å; E344-Q348 PolarHBondContact O-N 3.18Å
345	G	70.5	Confident	68.7	Low	34 Å²	34	90.6 Å²	90.6	35%	0.351	44%	0.442	S	S	.	.	H	α-helix	trans	-66.5	-39.4	176.4	0	0	0	0	0	114.4	L343	L343-G345 VanDerWaalsContact C-N 3.31Å; L343-G345 PolarHBondContact O-N 3.35Å
346	I	67.6	Low	69.1	Low	37 Å²	37	89.5 Å²	89.5	19%	0.19	44%	0.437	C	S	.	.	H	α-helix	trans	-74.6	-36.7	178.9	-59.5	173.4	0	0	0	110.7	L343 Q348 Q349 V350 I800 A804 V807	L343-I346 PolarHBondContact O-N 2.97Å; I346-Q348 VanDerWaalsContact C-N 3.35Å; I346-Q348 PolarHBondContact O-N 2.97Å; I346-Q349 PolarHBondContact O-N 3Å; I346-V350 PolarHBondContact O-N 2.87Å; I346-I800 HydrophobicContact CG2-CG2 4.26Å; I346-A804 HydrophobicContact CG2-CB 3.7Å; I346-V807 HydrophobicContact CD1-CG2 4.05Å
347	T	64.4	Low	69.4	Low	66 Å²	66	87.7 Å²	87.7	41%	0.405	43%	0.432	S	S	.	.	H	α-helix	trans	-67.9	-33.1	-179.1	-51.2	0	0	0	0	112.5	L343 V350 Q351	L343-T347 WeakPolarHBondContact O-CB 3.46Å; L343-T347 PolarHBondContact O-N 2.8Å; L343-T347 VanDerWaalsContact O-N 3.13Å; L343-T347 PolarHBondContact O-OG1 2.88Å; T347-V350 PolarHBondContact O-N 3.34Å; T347-Q351 PolarHBondContact O-N 3.08Å
348	Q	69.1	Low	69.8	Low	129 Å²	129	83.6 Å²	83.6	60%	0.603	43%	0.426	S	S	*	.	H	α-helix	trans	-63.8	-38.6	173.2	-87.3	-179.5	-18.5	0	0	112.8	E344 I346 V350 Q351 E352	E344-Q348 PolarHBondContact O-N 3.18Å; I346-Q348 VanDerWaalsContact C-N 3.35Å; I346-Q348 PolarHBondContact O-N 2.97Å; Q348-V350 VanDerWaalsContact C-N 3.33Å; Q348-V350 PolarHBondContact O-N 3.18Å; Q348-Q351 PolarHBondContact O-N 3.25Å; Q348-E352 PolarHBondContact O-N 3.46Å
349	Q	67.5	Low	70.3	Confident	107 Å²	107	83.5 Å²	83.5	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-35.1	179.5	-66.1	-179.9	2.6	0	0	112.7	I346 L353	I346-Q349 PolarHBondContact O-N 3Å; Q349-L353 WeakPolarHBondContact O-CG 3.37Å; Q349-L353 PolarHBondContact O-N 2.86Å
350	V	67.1	Low	70.9	Confident	22 Å²	22	84 Å²	84	13%	0.133	43%	0.428	C	S	.	.	H	α-helix	trans	-70.6	-41	176	178.1	0	0	0	0	111.5	I346 T347 Q348 E352 L353 Q354 I800	I346-V350 PolarHBondContact O-N 2.87Å; T347-V350 PolarHBondContact O-N 3.34Å; Q348-V350 VanDerWaalsContact C-N 3.33Å; Q348-V350 PolarHBondContact O-N 3.18Å; V350-E352 VanDerWaalsContact C-N 3.29Å; V350-E352 PolarHBondContact O-N 3.01Å; V350-L353 PolarHBondContact O-N 3.48Å; V350-Q354 PolarHBondContact O-N 3.12Å; V350-I800 HydrophobicContact CG2-CB 4.37Å; V350-I800 HydrophobicContact CG2-CG2 3.57Å
351	Q	65.1	Low	71.5	Confident	140 Å²	140	85.6 Å²	85.6	65%	0.654	43%	0.434	S	S	*	.	H	α-helix	trans	-63.8	-30.7	178	-87.9	-174.7	-12.8	0	0	113.5	T347 Q348 P355	T347-Q351 PolarHBondContact O-N 3.08Å; Q348-Q351 PolarHBondContact O-N 3.25Å; Q351-P355 WeakPolarHBondContact O-CD 3.47Å
352	E	70.5	Confident	72.1	Confident	140 Å²	140	81.5 Å²	81.5	65%	0.654	43%	0.425	S	S	*	.	H	α-helix	trans	-76.9	-30.1	177.7	-72.1	-175.9	176.1	0	0	113.8	Q348 V350	Q348-E352 PolarHBondContact O-N 3.46Å; V350-E352 VanDerWaalsContact C-N 3.29Å; V350-E352 PolarHBondContact O-N 3.01Å
353	L	69.5	Low	72.8	Confident	45 Å²	45	78.5 Å²	78.5	24%	0.236	41%	0.411	C	S	.	.	H	α-helix	trans	-87.3	-25.2	-176	-71	169.7	0	0	0	113.5	Q349 V350 K356 C357 I797 I800	Q349-L353 WeakPolarHBondContact O-CG 3.37Å; Q349-L353 PolarHBondContact O-N 2.86Å; V350-L353 PolarHBondContact O-N 3.48Å; L353-K356 PolarHBondContact O-N 2.91Å; L353-C357 PolarHBondContact O-N 3.28Å; L353-I797 HydrophobicContact CB-CD1 4.16Å; L353-I797 HydrophobicContact CB-CG1 4Å; L353-I800 HydrophobicContact CD1-CD1 3.9Å
354	Q	68.9	Low	73.5	Confident	114 Å²	114	77.4 Å²	77.4	53%	0.533	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-42.1	-176.8	-150.9	144.7	12.4	0	0	115.6	V350 C357 A358	V350-Q354 PolarHBondContact O-N 3.12Å; Q354-C357 PolarHBondContact O-N 3.19Å; Q354-A358 PolarHBondContact O-N 2.81Å
355	P	75.5	Confident	74.2	Confident	72 Å²	72	78 Å²	78	47%	0.468	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-37	175.3	22.7	-30.5	0	0	0	112.7	Q351 C357 A358 E359	Q351-P355 WeakPolarHBondContact O-CD 3.47Å; P355-C357 VanDerWaalsContact C-N 3.32Å; P355-C357 PolarHBondContact O-N 3.04Å; P355-A358 PolarHBondContact O-N 3.35Å; P355-A358 VanDerWaalsContact O-N 3.16Å; P355-E359 PolarHBondContact O-N 2.9Å; P355-E359 VanDerWaalsContact O-N 3.07Å
356	K	76.2	Confident	74.9	Confident	121 Å²	121	82.3 Å²	82.3	53%	0.526	42%	0.417	S	S	.	.	H	α-helix	trans	-62	-37.2	176.1	-74	176.7	179.1	169.2	0	112.6	L353 E359 L360	L353-K356 PolarHBondContact O-N 2.91Å; K356-E359 PolarHBondContact O-N 3.49Å; K356-L360 WeakPolarHBondContact O-CG 3.4Å; K356-L360 PolarHBondContact O-N 2.73Å; K356-L360 VanDerWaalsContact O-N 3.1Å
357	C	77.1	Confident	75.7	Confident	16 Å²	16	84.2 Å²	84.2	11%	0.108	42%	0.422	C	S	.	.	H	α-helix	trans	-67	-35.9	176.1	-171.9	0	0	0	0	112.4	L353 Q354 P355 K361 I797	L353-C357 PolarHBondContact O-N 3.28Å; Q354-C357 PolarHBondContact O-N 3.19Å; P355-C357 VanDerWaalsContact C-N 3.32Å; P355-C357 PolarHBondContact O-N 3.04Å; C357-K361 PolarHBondContact O-N 3.48Å; C357-I797 HydrophobicContact CB-CD1 3.78Å
358	A	76.4	Confident	76.6	Confident	62 Å²	62	83.3 Å²	83.3	51%	0.512	42%	0.415	S	S	.	.	H	α-helix	trans	-68.8	-39.4	175.8	0	0	0	0	0	112.4	Q354 P355 K361 A362	Q354-A358 PolarHBondContact O-N 2.81Å; P355-A358 PolarHBondContact O-N 3.35Å; P355-A358 VanDerWaalsContact O-N 3.16Å; A358-K361 PolarHBondContact O-N 2.96Å; A358-A362 PolarHBondContact O-N 3.45Å; A358-A362 VanDerWaalsContact O-N 3.15Å
359	E	81.2	Confident	77.3	Confident	137 Å²	137	80.5 Å²	80.5	64%	0.64	41%	0.41	S	S	*	.	H	α-helix	trans	-63.9	-46.8	175.4	-73.8	-180	171.7	0	0	112.3	P355 K356 K361 A362 E363	P355-E359 PolarHBondContact O-N 2.9Å; P355-E359 VanDerWaalsContact O-N 3.07Å; K356-E359 PolarHBondContact O-N 3.49Å; E359-K361 VanDerWaalsContact C-N 3.27Å; E359-K361 PolarHBondContact O-N 2.85Å; E359-A362 PolarHBondContact O-N 3.26Å; E359-A362 VanDerWaalsContact O-N 3.15Å; E359-E363 PolarHBondContact O-N 3.05Å
360	L	81.8	Confident	78.1	Confident	44 Å²	44	79.3 Å²	79.3	23%	0.23	41%	0.406	C	S	.	.	H	α-helix	trans	-61.5	-35.8	178	-71	171.2	0	0	0	112.3	K356 E363 A364 H793	K356-L360 WeakPolarHBondContact O-CG 3.4Å; K356-L360 PolarHBondContact O-N 2.73Å; K356-L360 VanDerWaalsContact O-N 3.1Å; L360-E363 PolarHBondContact O-N 3.02Å; L360-A364 PolarHBondContact O-N 3.36Å; L360-H793 HydrophobicContact CD1-CB 4.39Å
361	K	81.1	Confident	78.9	Confident	98 Å²	98	78.8 Å²	78.8	43%	0.426	40%	0.403	S	S	.	.	H	α-helix	trans	-65.4	-42.7	174.5	-172.7	-179.6	177.5	-177.5	0	112.4	C357 A358 E359 E363 Q365 Y790	C357-K361 PolarHBondContact O-N 3.48Å; A358-K361 PolarHBondContact O-N 2.96Å; E359-K361 VanDerWaalsContact C-N 3.27Å; E359-K361 PolarHBondContact O-N 2.85Å; K361-E363 VanDerWaalsContact C-N 3.33Å; K361-Q365 WeakPolarHBondContact O-CG 3.31Å; K361-Q365 PolarHBondContact O-N 3.5Å; K361-Q365 VanDerWaalsContact O-N 3.15Å; K361-Y790 HydrophobicContact CB-CD2 3.82Å; K361-Y790 HydrophobicContact CB-CE2 3.7Å; K361-Y790 HydrophobicContact CD-CE2 4.08Å; K361-Y790 HydrophobicContact CG-CD2 4.45Å; K361-Y790 HydrophobicContact CG-CE2 4Å
362	A	81.5	Confident	79.7	Confident	56 Å²	56	77.9 Å²	77.9	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-39.2	177.4	0	0	0	0	0	111.3	A358 E359 Q365 K366	A358-A362 PolarHBondContact O-N 3.45Å; A358-A362 VanDerWaalsContact O-N 3.15Å; E359-A362 PolarHBondContact O-N 3.26Å; E359-A362 VanDerWaalsContact O-N 3.15Å; A362-Q365 PolarHBondContact O-N 3Å; A362-K366 PolarHBondContact O-N 3.12Å
363	E	83.8	Confident	80.3	Confident	65 Å²	65	74.2 Å²	74.2	30%	0.304	39%	0.386	S	S	.	.	H	α-helix	trans	-67.2	-42	177.8	-171.8	61.5	-161.4	0	0	112.4	E359 L360 K361 Q365 K366 R367	E359-E363 PolarHBondContact O-N 3.05Å; L360-E363 PolarHBondContact O-N 3.02Å; K361-E363 VanDerWaalsContact C-N 3.33Å; E363-Q365 VanDerWaalsContact C-N 3.33Å; E363-Q365 PolarHBondContact O-N 2.82Å; E363-K366 PolarHBondContact O-N 3.49Å; E363-R367 VanDerWaalsContact CG-CZ 3.46Å; E363-R367 PolarHBondContact O-N 2.98Å; E363-R367 IonicContact OE1-CZ 3.13Å; E363-R367 IonicContact OE1-NE 2.72Å; E363-R367 PolarHBondContact OE1-NE 2.86Å; E363-R367 IonicContact OE1-NH1 2.99Å; E363-R367 IonicContact OE1-NH2 3.62Å; E363-R367 PolarHBondContact OE1-NH2 3.39Å
364	A	82.1	Confident	81	Confident	6 Å²	6	72.8 Å²	72.8	5%	0.05	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-40.1	174.1	0	0	0	0	0	112.1	L360 R367 N368 Y783 A786	L360-A364 PolarHBondContact O-N 3.36Å; A364-R367 PolarHBondContact O-N 2.92Å; A364-N368 PolarHBondContact O-N 2.99Å; A364-N368 VanDerWaalsContact O-N 3.11Å; A364-Y783 WeakPolarHBondContact O-CD2 3.37Å; A364-A786 HydrophobicContact CB-CB 4.16Å
365	Q	81.4	Confident	81.6	Confident	126 Å²	126	71.8 Å²	71.8	59%	0.589	38%	0.375	S	S	*	.	H	α-helix	trans	-66.1	-39.5	176	-74.2	-177.9	-15.8	0	0	112.6	K361 A362 E363 N368 S369	K361-Q365 WeakPolarHBondContact O-CG 3.31Å; K361-Q365 PolarHBondContact O-N 3.5Å; K361-Q365 VanDerWaalsContact O-N 3.15Å; A362-Q365 PolarHBondContact O-N 3Å; E363-Q365 VanDerWaalsContact C-N 3.33Å; E363-Q365 PolarHBondContact O-N 2.82Å; Q365-N368 PolarHBondContact O-N 3.3Å; Q365-S369 PolarHBondContact O-N 2.98Å; Q365-S369 VanDerWaalsContact O-N 3.17Å
366	K	84.4	Confident	81.9	Confident	125 Å²	125	74.6 Å²	74.6	54%	0.543	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-46.5	176	-171.9	-179.4	176.8	-173.1	0	111.4	A362 E363 N368 S369 L370	A362-K366 PolarHBondContact O-N 3.12Å; E363-K366 PolarHBondContact O-N 3.49Å; K366-N368 VanDerWaalsContact C-N 3.34Å; K366-N368 PolarHBondContact O-N 3.46Å; K366-S369 PolarHBondContact O-N 3.33Å; K366-S369 PolarHBondContact O-OG 2.88Å; K366-L370 PolarHBondContact O-N 3.17Å
367	R	85.1	Confident	82.3	Confident	78 Å²	78	71.6 Å²	71.6	29%	0.294	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-36.3	177.5	-69.3	-178.6	-178.7	134.3	10.4	112.9	E363 A364 S369 L370 L371 D782 A786	E363-R367 VanDerWaalsContact CG-CZ 3.46Å; E363-R367 PolarHBondContact O-N 2.98Å; E363-R367 IonicContact OE1-CZ 3.13Å; E363-R367 IonicContact OE1-NE 2.72Å; E363-R367 PolarHBondContact OE1-NE 2.86Å; E363-R367 IonicContact OE1-NH1 2.99Å; E363-R367 IonicContact OE1-NH2 3.62Å; E363-R367 PolarHBondContact OE1-NH2 3.39Å; A364-R367 PolarHBondContact O-N 2.92Å; R367-S369 PolarHBondContact O-N 3.43Å; R367-L370 PolarHBondContact O-N 2.99Å; R367-L371 PolarHBondContact O-N 3.36Å; R367-D782 WeakPolarHBondContact CD-O 3.48Å; R367-A786 VanDerWaalsContact NH1-CB 3.32Å
368	N	84.1	Confident	82.6	Confident	46 Å²	46	71.6 Å²	71.6	25%	0.246	38%	0.377	C	S	.	.	H	α-helix	trans	-63	-39.8	174	-167.8	1.6	0	0	0	112.7	A364 Q365 K366 L370 L371 K372 Y783	A364-N368 PolarHBondContact O-N 2.99Å; A364-N368 VanDerWaalsContact O-N 3.11Å; Q365-N368 PolarHBondContact O-N 3.3Å; K366-N368 VanDerWaalsContact C-N 3.34Å; K366-N368 PolarHBondContact O-N 3.46Å; N368-L370 VanDerWaalsContact C-N 3.34Å; N368-L370 PolarHBondContact O-N 3.46Å; N368-L371 PolarHBondContact O-N 3.25Å; N368-K372 WeakPolarHBondContact O-CG 3.12Å; N368-K372 PolarHBondContact O-N 2.9Å; N368-K372 VanDerWaalsContact O-N 3.1Å; N368-Y783 HydrophobicContact CB-CD2 3.75Å; N368-Y783 HydrophobicContact CB-CE2 3.64Å
369	S	82.1	Confident	82.9	Confident	71 Å²	71	74.8 Å²	74.8	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-64.5	-38.5	177.7	72.7	0	0	0	0	112.5	Q365 K366 R367 S373	Q365-S369 PolarHBondContact O-N 2.98Å; Q365-S369 VanDerWaalsContact O-N 3.17Å; K366-S369 PolarHBondContact O-N 3.33Å; K366-S369 PolarHBondContact O-OG 2.88Å; R367-S369 PolarHBondContact O-N 3.43Å; S369-S373 PolarHBondContact O-N 2.9Å
370	L	84.3	Confident	83	Confident	82 Å²	82	75.9 Å²	75.9	43%	0.429	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-43.8	175	-76.4	154.6	0	0	0	111.6	K366 R367 N368 K372 S373 C374	K366-L370 PolarHBondContact O-N 3.17Å; R367-L370 PolarHBondContact O-N 2.99Å; N368-L370 VanDerWaalsContact C-N 3.34Å; N368-L370 PolarHBondContact O-N 3.46Å; L370-K372 PolarHBondContact O-N 3.46Å; L370-S373 PolarHBondContact O-N 3.27Å; L370-S373 PolarHBondContact O-OG 3.42Å; L370-C374 PolarHBondContact O-N 3.21Å; L370-C374 VanDerWaalsContact O-N 3.15Å
371	L	85.1	Confident	83	Confident	11 Å²	11	74.4 Å²	74.4	6%	0.058	37%	0.373	C	S	.	.	H	α-helix	trans	-56.4	-49.2	175.7	178.3	61.7	0	0	0	111.8	R367 N368 S373 C374 E375 M776 L779 K780	R367-L371 PolarHBondContact O-N 3.36Å; N368-L371 PolarHBondContact O-N 3.25Å; L371-S373 VanDerWaalsContact C-N 3.31Å; L371-S373 PolarHBondContact O-N 3.44Å; L371-C374 WeakPolarHBondContact O-CB 3.38Å; L371-C374 PolarHBondContact O-N 3.41Å; L371-C374 VanDerWaalsContact O-N 3.08Å; L371-E375 WeakPolarHBondContact O-CG 3.38Å; L371-E375 PolarHBondContact O-N 3.13Å; L371-M776 HydrophobicContact CD1-CG 3.94Å; L371-L779 HydrophobicContact CD1-CB 4.18Å; L371-K780 HydrophobicContact CD1-CB 3.89Å; L371-K780 HydrophobicContact CD2-CB 4.22Å; L371-K780 HydrophobicContact CD2-CG 4.28Å
372	K	81.8	Confident	83.2	Confident	121 Å²	121	76.4 Å²	76.4	53%	0.526	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-37.1	179	-73.3	179.9	-179.6	179.9	0	113.2	N368 L370 C374 L376	N368-K372 WeakPolarHBondContact O-CG 3.12Å; N368-K372 PolarHBondContact O-N 2.9Å; N368-K372 VanDerWaalsContact O-N 3.1Å; L370-K372 PolarHBondContact O-N 3.46Å; K372-C374 VanDerWaalsContact C-N 3.33Å; K372-L376 PolarHBondContact O-N 2.93Å
373	S	82.9	Confident	83.1	Confident	62 Å²	62	76.1 Å²	76.1	43%	0.434	37%	0.37	S	S	.	.	H	α-helix	trans	-67.5	-34.6	176.3	75.5	0	0	0	0	112.6	S369 L370 L371 T377	S369-S373 PolarHBondContact O-N 2.9Å; L370-S373 PolarHBondContact O-N 3.27Å; L370-S373 PolarHBondContact O-OG 3.42Å; L371-S373 VanDerWaalsContact C-N 3.31Å; L371-S373 PolarHBondContact O-N 3.44Å; S373-T377 PolarHBondContact O-N 3.05Å; S373-T377 PolarHBondContact O-OG1 3.49Å
374	C	84.4	Confident	83	Confident	16 Å²	16	76.6 Å²	76.6	11%	0.108	38%	0.375	C	S	.	.	H	α-helix	trans	-74.1	-36.6	177.5	-162.1	0	0	0	0	111.8	L370 L371 K372 L376 T377 V378 L779	L370-C374 PolarHBondContact O-N 3.21Å; L370-C374 VanDerWaalsContact O-N 3.15Å; L371-C374 WeakPolarHBondContact O-CB 3.38Å; L371-C374 PolarHBondContact O-N 3.41Å; L371-C374 VanDerWaalsContact O-N 3.08Å; K372-C374 VanDerWaalsContact C-N 3.33Å; C374-L376 VanDerWaalsContact C-N 3.33Å; C374-L376 PolarHBondContact O-N 3.03Å; C374-T377 WeakPolarHBondContact O-CB 3.45Å; C374-T377 PolarHBondContact O-N 3.22Å; C374-T377 VanDerWaalsContact O-N 3.07Å; C374-V378 WeakPolarHBondContact O-CG2 3.2Å; C374-V378 PolarHBondContact O-N 3.31Å; C374-L779 HydrophobicContact CB-CD1 3.84Å
375	E	81.6	Confident	83	Confident	92 Å²	92	77 Å²	77	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-57.2	-43.2	174.5	-74.6	176.8	163	0	0	112.3	L371 T377 V378 H379 M776	L371-E375 WeakPolarHBondContact O-CG 3.38Å; L371-E375 PolarHBondContact O-N 3.13Å; E375-T377 VanDerWaalsContact C-N 3.28Å; E375-T377 PolarHBondContact O-N 3.11Å; E375-V378 PolarHBondContact O-N 2.89Å; E375-H379 PolarHBondContact O-N 3.44Å; E375-M776 HydrophobicContact CG-CG 4.16Å; E375-M776 HydrophobicContact CG-SD 3.86Å
376	L	82.6	Confident	83.1	Confident	131 Å²	131	77.9 Å²	77.9	69%	0.686	37%	0.374	S	S	*	.	H	α-helix	trans	-61.7	-37.2	175.4	-68.8	170.4	0	0	0	112.1	K372 C374 H379 R380	K372-L376 PolarHBondContact O-N 2.93Å; C374-L376 VanDerWaalsContact C-N 3.33Å; C374-L376 PolarHBondContact O-N 3.03Å; L376-H379 PolarHBondContact O-N 3.36Å; L376-R380 PolarHBondContact O-N 2.88Å; L376-R380 VanDerWaalsContact O-N 3.1Å
377	T	83.5	Confident	82.8	Confident	58 Å²	58	75.9 Å²	75.9	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-69.9	-43.1	179.2	-55.9	0	0	0	0	111.4	S373 C374 E375 H379 R380 C381	S373-T377 PolarHBondContact O-N 3.05Å; S373-T377 PolarHBondContact O-OG1 3.49Å; C374-T377 WeakPolarHBondContact O-CB 3.45Å; C374-T377 PolarHBondContact O-N 3.22Å; C374-T377 VanDerWaalsContact O-N 3.07Å; E375-T377 VanDerWaalsContact C-N 3.28Å; E375-T377 PolarHBondContact O-N 3.11Å; T377-H379 VanDerWaalsContact C-N 3.32Å; T377-H379 PolarHBondContact O-N 2.74Å; T377-R380 PolarHBondContact O-N 2.99Å; T377-C381 PolarHBondContact O-N 2.67Å; T377-C381 PolarHBondContact O-SG 3.21Å; T377-C381 VanDerWaalsContact O-SG 3.38Å
378	V	84.4	Confident	82.7	Confident	16 Å²	16	74 Å²	74	10%	0.097	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-42.7	174.4	173.3	0	0	0	0	111	C374 E375 R380 C381 R382 Y769 A772 M776	C374-V378 WeakPolarHBondContact O-CG2 3.2Å; C374-V378 PolarHBondContact O-N 3.31Å; E375-V378 PolarHBondContact O-N 2.89Å; V378-R380 PolarHBondContact O-N 3.04Å; V378-C381 PolarHBondContact O-N 2.91Å; V378-R382 WeakPolarHBondContact O-CB 3.18Å; V378-R382 PolarHBondContact O-N 3.24Å; V378-Y769 HydrophobicContact CG1-CD2 4.39Å; V378-Y769 HydrophobicContact CG1-CE2 3.78Å; V378-A772 VanDerWaalsContact CG2-C 3.47Å; V378-A772 HydrophobicContact CG2-CB 3.78Å; V378-A772 VanDerWaalsContact CG2-O 3.29Å; V378-A772 WeakPolarHBondContact CG2-O 3.32Å; V378-M776 HydrophobicContact CG2-CB 4.12Å; V378-M776 HydrophobicContact CG2-SD 4.15Å
379	H	82.1	Confident	82.5	Confident	129 Å²	129	75.6 Å²	75.6	60%	0.597	37%	0.371	S	S	*	.	H	α-helix	trans	-62	-43.1	177.6	-169.8	-77.6	0	0	0	111.9	E375 L376 T377 R382 T383	E375-H379 PolarHBondContact O-N 3.44Å; L376-H379 PolarHBondContact O-N 3.36Å; T377-H379 VanDerWaalsContact C-N 3.32Å; T377-H379 PolarHBondContact O-N 2.74Å; H379-R382 PolarHBondContact O-N 3.41Å; H379-T383 PolarHBondContact O-N 3.34Å; H379-T383 PolarHBondContact O-OG1 3.05Å
380	R	82.8	Confident	82.4	Confident	160 Å²	160	78.5 Å²	78.5	60%	0.604	38%	0.375	S	S	*	.	H	α-helix	trans	-61.9	-46.6	176.9	-171.4	-179.4	69.5	179.2	1.4	112.2	L376 T377 V378 R382 T383 N384	L376-R380 PolarHBondContact O-N 2.88Å; L376-R380 VanDerWaalsContact O-N 3.1Å; T377-R380 PolarHBondContact O-N 2.99Å; V378-R380 PolarHBondContact O-N 3.04Å; R380-R382 VanDerWaalsContact C-N 3.31Å; R380-R382 PolarHBondContact O-N 2.91Å; R380-T383 PolarHBondContact O-N 2.68Å; R380-N384 PolarHBondContact O-N 3.23Å
381	C	82.8	Confident	82.2	Confident	14 Å²	14	78 Å²	78	10%	0.095	37%	0.372	C	S	.	.	H	α-helix	trans	-64.7	-35.4	179.5	-64.5	0	0	0	0	112.3	T377 V378 T383 L385 Y769	T377-C381 PolarHBondContact O-N 2.67Å; T377-C381 PolarHBondContact O-SG 3.21Å; T377-C381 VanDerWaalsContact O-SG 3.38Å; V378-C381 PolarHBondContact O-N 2.91Å; C381-T383 PolarHBondContact O-N 2.91Å; C381-L385 WeakPolarHBondContact O-CB 3.43Å; C381-L385 PolarHBondContact O-N 3.48Å; C381-Y769 HydrophobicContact CB-CD2 4.12Å
382	R	83.4	Confident	82.1	Confident	139 Å²	139	81.5 Å²	81.5	53%	0.525	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-40	176.7	-171.8	177.5	179.4	178.3	-0.8	113	V378 H379 R380 R386 Y769	V378-R382 WeakPolarHBondContact O-CB 3.18Å; V378-R382 PolarHBondContact O-N 3.24Å; H379-R382 PolarHBondContact O-N 3.41Å; R380-R382 VanDerWaalsContact C-N 3.31Å; R380-R382 PolarHBondContact O-N 2.91Å; R382-R386 PolarHBondContact O-N 3.18Å; R382-Y769 HydrophobicContact CB-CD2 4.14Å; R382-Y769 HydrophobicContact CB-CE2 3.75Å; R382-Y769 HydrophobicContact CG-CE2 4.21Å
383	T	79.9	Confident	81.8	Confident	51 Å²	51	78.8 Å²	78.8	31%	0.313	39%	0.387	S	S	.	.	H	α-helix	trans	-66.7	-49.6	179.8	-54.2	0	0	0	0	110.9	H379 R380 C381 L385 R386 D387	H379-T383 PolarHBondContact O-N 3.34Å; H379-T383 PolarHBondContact O-OG1 3.05Å; R380-T383 PolarHBondContact O-N 2.68Å; C381-T383 PolarHBondContact O-N 2.91Å; T383-L385 PolarHBondContact O-N 3.42Å; T383-R386 WeakPolarHBondContact O-CB 3.32Å; T383-R386 PolarHBondContact O-N 2.83Å; T383-R386 VanDerWaalsContact O-N 3.08Å; T383-D387 PolarHBondContact O-N 2.9Å
384	N	81.9	Confident	81.5	Confident	74 Å²	74	81.6 Å²	81.6	40%	0.396	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-36	179.7	-67.2	-2.7	0	0	0	112.9	R380 L388	R380-N384 PolarHBondContact O-N 3.23Å; N384-L388 WeakPolarHBondContact O-CG 3.4Å; N384-L388 PolarHBondContact O-N 3.27Å
385	L	82.9	Confident	81	Confident	15 Å²	15	82.3 Å²	82.3	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-68.6	-38	178.8	-160.4	153.9	0	0	0	111.8	C381 T383 E389 R766 Y769	C381-L385 WeakPolarHBondContact O-CB 3.43Å; C381-L385 PolarHBondContact O-N 3.48Å; T383-L385 PolarHBondContact O-N 3.42Å; L385-E389 HydrophobicContact CD2-CG 4.14Å; L385-E389 WeakPolarHBondContact CD2-OE1 3.45Å; L385-E389 WeakPolarHBondContact O-CG 3.24Å; L385-E389 PolarHBondContact O-N 3.33Å; L385-E389 VanDerWaalsContact O-N 3.1Å; L385-R766 HydrophobicContact CD1-CB 3.7Å; L385-R766 HydrophobicContact CD1-CG 4.06Å; L385-Y769 HydrophobicContact CD1-CG 4.47Å
386	R	82.4	Confident	80.6	Confident	144 Å²	144	80.9 Å²	80.9	54%	0.543	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-39.9	176.8	-173.8	-172.6	-66.2	164.5	-0.9	112.1	R382 T383 E389 K390	R382-R386 PolarHBondContact O-N 3.18Å; T383-R386 WeakPolarHBondContact O-CB 3.32Å; T383-R386 PolarHBondContact O-N 2.83Å; T383-R386 VanDerWaalsContact O-N 3.08Å; R386-E389 PolarHBondContact O-N 3.27Å; R386-K390 PolarHBondContact O-N 2.81Å
387	D	79.4	Confident	80.1	Confident	84 Å²	84	77.7 Å²	77.7	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-67.9	-44.9	-178.9	-64.1	-27.8	0	0	0	110.8	T383 E389 K390 D391	T383-D387 PolarHBondContact O-N 2.9Å; D387-E389 VanDerWaalsContact C-N 3.35Å; D387-E389 PolarHBondContact O-N 3.22Å; D387-K390 WeakPolarHBondContact O-CB 3.31Å; D387-K390 PolarHBondContact O-N 2.99Å; D387-K390 VanDerWaalsContact O-N 3.13Å; D387-D391 PolarHBondContact O-N 2.9Å
388	L	82.4	Confident	79.4	Confident	39 Å²	39	83 Å²	83	20%	0.204	40%	0.396	C	S	.	.	H	α-helix	trans	-64.3	-35	175.8	-68.6	170.8	0	0	0	113.3	N384 K390 D391 K392 K761 I762 K765	N384-L388 WeakPolarHBondContact O-CG 3.4Å; N384-L388 PolarHBondContact O-N 3.27Å; L388-K390 VanDerWaalsContact C-N 3.26Å; L388-K390 PolarHBondContact O-N 3.41Å; L388-D391 PolarHBondContact O-N 3.48Å; L388-K392 PolarHBondContact O-N 3.39Å; L388-K392 VanDerWaalsContact O-N 3.11Å; L388-K761 HydrophobicContact CD1-CB 4.45Å; L388-I762 HydrophobicContact CB-CD1 4.27Å; L388-I762 HydrophobicContact CB-CG1 3.61Å; L388-I762 WeakPolarHBondContact O-CD1 3.5Å; L388-K765 HydrophobicContact CD1-CB 4.45Å; L388-K765 HydrophobicContact CD1-CG 4.05Å
389	E	79.5	Confident	78.6	Confident	78 Å²	78	83.2 Å²	83.2	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-64.3	-31.6	174.7	-79.1	178.9	167.2	0	0	112.7	L385 R386 D387 A393 I762 R766	L385-E389 HydrophobicContact CD2-CG 4.14Å; L385-E389 WeakPolarHBondContact CD2-OE1 3.45Å; L385-E389 WeakPolarHBondContact O-CG 3.24Å; L385-E389 PolarHBondContact O-N 3.33Å; L385-E389 VanDerWaalsContact O-N 3.1Å; R386-E389 PolarHBondContact O-N 3.27Å; D387-E389 VanDerWaalsContact C-N 3.35Å; D387-E389 PolarHBondContact O-N 3.22Å; E389-A393 PolarHBondContact O-N 3.16Å; E389-I762 HydrophobicContact CG-CD1 4.44Å; E389-R766 IonicContact OE1-CZ 2.7Å; E389-R766 IonicContact OE1-NH2 3.69Å; E389-R766 PolarHBondContact OE1-NH2 2.94Å
390	K	80.6	Confident	77.9	Confident	133 Å²	133	83.9 Å²	83.9	58%	0.578	40%	0.397	S	S	*	.	H	α-helix	trans	-70	-42.3	175.6	-169.1	-176.3	175	-169.6	0	111.4	R386 D387 L388 A393 Q394	R386-K390 PolarHBondContact O-N 2.81Å; D387-K390 WeakPolarHBondContact O-CB 3.31Å; D387-K390 PolarHBondContact O-N 2.99Å; D387-K390 VanDerWaalsContact O-N 3.13Å; L388-K390 VanDerWaalsContact C-N 3.26Å; L388-K390 PolarHBondContact O-N 3.41Å; K390-A393 PolarHBondContact O-N 2.82Å; K390-Q394 PolarHBondContact O-N 3.35Å
391	D	78.8	Confident	77	Confident	71 Å²	71	80.5 Å²	80.5	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-40.9	178.6	-62.8	-16.6	0	0	0	111.4	D387 L388 A393 Q394 L395 I758	D387-D391 PolarHBondContact O-N 2.9Å; L388-D391 PolarHBondContact O-N 3.48Å; D391-A393 VanDerWaalsContact C-N 3.33Å; D391-A393 PolarHBondContact O-N 3.4Å; D391-Q394 PolarHBondContact O-N 2.73Å; D391-L395 PolarHBondContact O-N 3.25Å; D391-L395 VanDerWaalsContact O-N 3.15Å; D391-I758 HydrophobicContact CB-CD1 4.42Å
392	K	82.8	Confident	75.9	Confident	84 Å²	84	83.2 Å²	83.2	37%	0.365	40%	0.404	S	S	.	.	H	α-helix	trans	-57.5	-44.1	172.8	-179.3	-175.3	175.3	179.3	0	112.2	L388 Q394 T396 L755 I758 V759 I762	L388-K392 PolarHBondContact O-N 3.39Å; L388-K392 VanDerWaalsContact O-N 3.11Å; K392-Q394 VanDerWaalsContact C-N 3.31Å; K392-Q394 PolarHBondContact O-N 2.92Å; K392-T396 WeakPolarHBondContact O-CB 3.33Å; K392-T396 PolarHBondContact O-N 2.85Å; K392-T396 PolarHBondContact O-OG1 3.07Å; K392-L755 HydrophobicContact CG-CD1 4.01Å; K392-I758 HydrophobicContact CB-CG2 4.11Å; K392-V759 HydrophobicContact CD-CG2 3.92Å; K392-V759 HydrophobicContact CG-CG2 4.34Å; K392-I762 HydrophobicContact CB-CD1 3.87Å; K392-I762 HydrophobicContact CD-CD1 3.93Å; K392-I762 HydrophobicContact CG-CD1 4.45Å
393	A	75.4	Confident	74.6	Confident	64 Å²	64	80.2 Å²	80.2	53%	0.529	40%	0.402	S	S	.	.	H	α-helix	trans	-64.3	-36.9	-178.3	0	0	0	0	0	112	E389 K390 D391 S397	E389-A393 PolarHBondContact O-N 3.16Å; K390-A393 PolarHBondContact O-N 2.82Å; D391-A393 VanDerWaalsContact C-N 3.33Å; D391-A393 PolarHBondContact O-N 3.4Å; A393-S397 PolarHBondContact O-N 2.94Å
394	Q	77.8	Confident	73.6	Confident	122 Å²	122	82.1 Å²	82.1	57%	0.57	41%	0.41	S	S	*	.	H	α-helix	trans	-69.1	-46.5	178.1	-70.1	-178.1	-18.9	0	0	112.5	K390 D391 K392 S397 R398	K390-Q394 PolarHBondContact O-N 3.35Å; D391-Q394 PolarHBondContact O-N 2.73Å; K392-Q394 VanDerWaalsContact C-N 3.31Å; K392-Q394 PolarHBondContact O-N 2.92Å; Q394-S397 PolarHBondContact O-N 2.93Å; Q394-R398 PolarHBondContact O-N 3.29Å
395	L	74.8	Confident	72.3	Confident	31 Å²	31	82 Å²	82	16%	0.162	42%	0.415	C	S	.	.	H	α-helix	trans	-65.6	-37.4	176.9	-94.2	151.1	0	0	0	112.8	D391 S397 R398 I399 L751 L755 I758	D391-L395 PolarHBondContact O-N 3.25Å; D391-L395 VanDerWaalsContact O-N 3.15Å; L395-S397 VanDerWaalsContact C-N 3.34Å; L395-S397 PolarHBondContact O-N 3.46Å; L395-R398 WeakPolarHBondContact O-CB 3.28Å; L395-R398 PolarHBondContact O-N 2.9Å; L395-I399 PolarHBondContact O-N 2.97Å; L395-L751 HydrophobicContact CD2-CD2 4.04Å; L395-L755 HydrophobicContact CB-CD1 4.15Å; L395-I758 HydrophobicContact CD1-CD1 3.34Å
396	T	72.8	Confident	70.8	Confident	61 Å²	61	87.3 Å²	87.3	37%	0.374	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-38.2	176.8	-52.6	0	0	0	0	111.8	K392 K400	K392-T396 WeakPolarHBondContact O-CB 3.33Å; K392-T396 PolarHBondContact O-N 2.85Å; K392-T396 PolarHBondContact O-OG1 3.07Å; T396-K400 PolarHBondContact O-N 2.91Å
397	S	71	Confident	69.4	Low	64 Å²	64	84.6 Å²	84.6	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-62.7	-46.5	175.2	-165.3	0	0	0	0	111	A393 Q394 L395 I399 K400 D401	A393-S397 PolarHBondContact O-N 2.94Å; Q394-S397 PolarHBondContact O-N 2.93Å; L395-S397 VanDerWaalsContact C-N 3.34Å; L395-S397 PolarHBondContact O-N 3.46Å; S397-I399 PolarHBondContact O-N 3.27Å; S397-K400 WeakPolarHBondContact O-CB 3.38Å; S397-K400 PolarHBondContact O-N 3.37Å; S397-K400 VanDerWaalsContact O-N 3.13Å; S397-D401 PolarHBondContact O-N 3.42Å; S397-D401 VanDerWaalsContact O-OD2 3.14Å
398	R	70.1	Confident	67.8	Low	171 Å²	171	85.7 Å²	85.7	65%	0.645	45%	0.447	S	S	*	.	H	α-helix	trans	-59	-42.6	-177.9	-159.6	83.5	173.3	-174.9	1.9	113	Q394 L395 L402	Q394-R398 PolarHBondContact O-N 3.29Å; L395-R398 WeakPolarHBondContact O-CB 3.28Å; L395-R398 PolarHBondContact O-N 2.9Å; R398-L402 WeakPolarHBondContact O-CG 3.41Å; R398-L402 PolarHBondContact O-N 3.11Å
399	I	66.9	Low	66.1	Low	20 Å²	20	90.2 Å²	90.2	10%	0.103	48%	0.476	C	S	.	.	H	α-helix	trans	-67.9	-38.3	177.6	-68.1	167.6	0	0	0	111.1	L395 S397 L402 T403 L751 E752 L755	L395-I399 PolarHBondContact O-N 2.97Å; S397-I399 PolarHBondContact O-N 3.27Å; I399-L402 PolarHBondContact O-N 2.94Å; I399-T403 PolarHBondContact O-N 3.12Å; I399-T403 PolarHBondContact O-OG1 3.32Å; I399-L751 HydrophobicContact CD1-CB 4.38Å; I399-L751 HydrophobicContact CG1-CB 4.19Å; I399-E752 HydrophobicContact CD1-CG 4.42Å; I399-L755 HydrophobicContact CD1-CB 4.22Å; I399-L755 HydrophobicContact CD1-CD2 3.87Å
400	K	67.5	Low	64.5	Low	143 Å²	143	92.1 Å²	92.1	62%	0.622	49%	0.494	S	S	*	.	H	α-helix	trans	-64.5	-40.8	179	-139.4	177.8	-174.1	-176.3	0	112	T396 S397 T403 L404	T396-K400 PolarHBondContact O-N 2.91Å; S397-K400 WeakPolarHBondContact O-CB 3.38Å; S397-K400 PolarHBondContact O-N 3.37Å; S397-K400 VanDerWaalsContact O-N 3.13Å; K400-T403 PolarHBondContact O-N 2.91Å; K400-L404 PolarHBondContact O-N 3.15Å
401	D	64.3	Low	63.1	Low	89 Å²	89	89.8 Å²	89.8	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-38.9	178.1	-59.9	-25.9	0	0	0	111.5	S397 S405	S397-D401 PolarHBondContact O-N 3.42Å; S397-D401 VanDerWaalsContact O-OD2 3.14Å; D401-S405 PolarHBondContact O-N 3.42Å; D401-S405 PolarHBondContact O-OG 3.46Å
402	L	60.3	Low	61.6	Low	70 Å²	70	90.5 Å²	90.5	37%	0.366	52%	0.523	S	S	.	.	H	α-helix	trans	-69.4	-34.7	174.2	-73	163	0	0	0	112.7	R398 I399 S405 I406 L748 L751	R398-L402 WeakPolarHBondContact O-CG 3.41Å; R398-L402 PolarHBondContact O-N 3.11Å; I399-L402 PolarHBondContact O-N 2.94Å; L402-S405 PolarHBondContact O-N 2.96Å; L402-I406 WeakPolarHBondContact O-CG1 3.5Å; L402-L748 HydrophobicContact CB-CD2 3.9Å; L402-L748 HydrophobicContact CD1-CD2 4.14Å; L402-L751 HydrophobicContact CD1-CD1 3.91Å
403	T	56	Low	60.2	Low	77 Å²	77	90.5 Å²	90.5	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-71.1	-37.7	177.4	-51.6	0	0	0	0	111.8	I399 K400 S405 I406	I399-T403 PolarHBondContact O-N 3.12Å; I399-T403 PolarHBondContact O-OG1 3.32Å; K400-T403 PolarHBondContact O-N 2.91Å; T403-S405 VanDerWaalsContact C-N 3.34Å; T403-I406 PolarHBondContact O-N 3.48Å
404	L	57.6	Low	59.1	Low	91 Å²	91	91.9 Å²	91.9	48%	0.476	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-39.4	175.2	-107.3	132.9	0	0	0	111.8	K400 I406 S407	K400-L404 PolarHBondContact O-N 3.15Å; L404-I406 PolarHBondContact O-N 3.26Å; L404-S407 PolarHBondContact O-N 3.07Å; L404-S407 VanDerWaalsContact O-N 3.14Å; L404-S407 PolarHBondContact O-OG 3.15Å
405	S	54.8	Low	58.1	Low	72 Å²	72	93.4 Å²	93.4	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-63.1	-23.6	179.2	-58.3	0	0	0	0	113.9	D401 L402 T403	D401-S405 PolarHBondContact O-N 3.42Å; D401-S405 PolarHBondContact O-OG 3.46Å; L402-S405 PolarHBondContact O-N 2.96Å; T403-S405 VanDerWaalsContact C-N 3.34Å
406	I	52.3	Low	57.5	Low	126 Å²	126	94.6 Å²	94.6	65%	0.646	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-18.7	178.1	-66.6	167.5	0	0	0	112.4	L402 T403 L404 L748	L402-I406 WeakPolarHBondContact O-CG1 3.5Å; T403-I406 PolarHBondContact O-N 3.48Å; L404-I406 PolarHBondContact O-N 3.26Å; I406-L748 HydrophobicContact CD1-CD1 3.75Å
407	S	51.9	Low	57.2	Low	86 Å²	86	95.7 Å²	95.7	60%	0.601	55%	0.549	S	S	*	.	S	Bend	trans	-97.3	-2.4	-168.2	67.7	0	0	0	0	116	L404	L404-S407 PolarHBondContact O-N 3.07Å; L404-S407 VanDerWaalsContact O-N 3.14Å; L404-S407 PolarHBondContact O-OG 3.15Å
408	Q	45.8	Very low	56.9	Low	107 Å²	107	95 Å²	95	50%	0.5	55%	0.548	S	S	.	.			trans	-121.3	89.1	-168.9	-69.5	-176.8	-18.9	0	0	113.1
409	T	47.3	Very low	57.2	Low	134 Å²	134	93.7 Å²	93.7	82%	0.822	55%	0.548	S	S	*	.			trans	-130.4	93.7	161.3	33.7	0	0	0	0	110.2
410	T	46	Very low	57.9	Low	118 Å²	118	99.7 Å²	99.7	72%	0.724	57%	0.57	S	S	*	*			trans	-155.5	127.6	157.9	15.1	0	0	0	0	111.1	A412	T410-A412 PolarHBondContact O-N 3.47Å
411	G	50.1	Low	58.4	Low	84 Å²	84	95.1 Å²	95.1	87%	0.866	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	11.2	-166.9	0	0	0	0	0	118.5
412	A	48.5	Very low	59.2	Low	87 Å²	87	93.8 Å²	93.8	72%	0.719	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-15.2	174.8	0	0	0	0	0	113.2	T410	T410-A412 PolarHBondContact O-N 3.47Å
413	E	53.5	Low	60.4	Low	83 Å²	83	96.5 Å²	96.5	39%	0.388	56%	0.564	S	S	.	*	H	α-helix	trans	-84.1	-16.3	-173	-75.9	-173.9	155.9	0	0	115.2	Q415 A416 R417	E413-Q415 PolarHBondContact O-N 3.23Å; E413-A416 PolarHBondContact O-N 3.45Å; E413-R417 WeakPolarHBondContact O-CB 3.19Å; E413-R417 PolarHBondContact O-N 3.11Å
414	S	52.3	Low	61.9	Low	93 Å²	93	93.2 Å²	93.2	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-29.2	-177.3	-171.8	0	0	0	0	113	A418	S414-A418 PolarHBondContact O-N 2.94Å
415	Q	55.7	Low	63.2	Low	155 Å²	155	92.9 Å²	92.9	72%	0.724	54%	0.539	S	S	*	.	H	α-helix	trans	-85.3	-40.8	-179.1	-142.9	154.5	-6.1	0	0	111.1	E413 R417 A418 E419	E413-Q415 PolarHBondContact O-N 3.23Å; Q415-R417 VanDerWaalsContact C-N 3.27Å; Q415-R417 PolarHBondContact O-N 2.87Å; Q415-A418 PolarHBondContact O-N 3.04Å; Q415-E419 PolarHBondContact O-N 3.45Å; Q415-E419 VanDerWaalsContact O-N 3.14Å
416	A	62.4	Low	64.7	Low	55 Å²	55	92.3 Å²	92.3	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-62.7	-33	170.4	0	0	0	0	0	112.6	E413 R420	E413-A416 PolarHBondContact O-N 3.45Å; A416-R420 VanDerWaalsContact O-CB 3.29Å; A416-R420 WeakPolarHBondContact O-CB 3.46Å; A416-R420 PolarHBondContact O-N 3.36Å
417	R	66	Low	66.5	Low	84 Å²	84	90.7 Å²	90.7	32%	0.317	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-41.6	175.2	-166.7	177.7	-60.7	180	1.1	111.7	E413 Q415 R420 M421 L737	E413-R417 WeakPolarHBondContact O-CB 3.19Å; E413-R417 PolarHBondContact O-N 3.11Å; Q415-R417 VanDerWaalsContact C-N 3.27Å; Q415-R417 PolarHBondContact O-N 2.87Å; R417-R420 PolarHBondContact O-N 3.35Å; R417-M421 WeakPolarHBondContact O-CB 3.46Å; R417-M421 VanDerWaalsContact O-CG 3.31Å; R417-M421 WeakPolarHBondContact O-CG 3.29Å; R417-M421 PolarHBondContact O-N 3.17Å; R417-L737 HydrophobicContact CG-CD2 4.04Å
418	A	66	Low	68.2	Low	51 Å²	51	87.9 Å²	87.9	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-42.5	176.9	0	0	0	0	0	112.3	S414 Q415 M421 A422	S414-A418 PolarHBondContact O-N 2.94Å; Q415-A418 PolarHBondContact O-N 3.04Å; A418-M421 PolarHBondContact O-N 2.68Å; A418-A422 PolarHBondContact O-N 3.38Å; A418-A422 VanDerWaalsContact O-N 3.11Å
419	E	76.6	Confident	70.2	Confident	142 Å²	142	89.1 Å²	89.1	66%	0.664	51%	0.511	S	S	*	.	H	α-helix	trans	-64.6	-42	175.7	-72.4	177.5	176	0	0	112.1	Q415 A422 Q423	Q415-E419 PolarHBondContact O-N 3.45Å; Q415-E419 VanDerWaalsContact O-N 3.14Å; E419-A422 PolarHBondContact O-N 3.35Å; E419-Q423 PolarHBondContact O-N 3.12Å
420	R	80.2	Confident	72.2	Confident	147 Å²	147	88.1 Å²	88.1	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-68.5	-37.3	178.1	-168	149.9	-177.1	141.4	0.6	112.8	A416 R417 Q423 I424 E733	A416-R420 VanDerWaalsContact O-CB 3.29Å; A416-R420 WeakPolarHBondContact O-CB 3.46Å; A416-R420 PolarHBondContact O-N 3.36Å; R417-R420 PolarHBondContact O-N 3.35Å; R420-Q423 PolarHBondContact O-N 2.84Å; R420-I424 HydrophobicContact CG-CD1 3.95Å; R420-I424 HydrophobicContact CG-CG1 4.48Å; R420-I424 WeakPolarHBondContact O-CB 3.32Å; R420-I424 VanDerWaalsContact O-CG1 3.23Å; R420-I424 WeakPolarHBondContact O-CG1 3.22Å; R420-I424 PolarHBondContact O-N 2.98Å; R420-E733 IonicContact NE-OE1 2.72Å; R420-E733 IonicContact NH2-OE1 3.58Å
421	M	77.8	Confident	74.4	Confident	47 Å²	47	84.1 Å²	84.1	23%	0.232	48%	0.475	C	S	.	.	H	α-helix	trans	-60.5	-45.2	171.5	-77.6	-169.6	-60.9	0	0	111.5	R417 A418 Q423 I424 Q425 L737 K738	R417-M421 WeakPolarHBondContact O-CB 3.46Å; R417-M421 VanDerWaalsContact O-CG 3.31Å; R417-M421 WeakPolarHBondContact O-CG 3.29Å; R417-M421 PolarHBondContact O-N 3.17Å; A418-M421 PolarHBondContact O-N 2.68Å; M421-Q423 VanDerWaalsContact C-N 3.35Å; M421-Q423 PolarHBondContact O-N 3.34Å; M421-I424 PolarHBondContact O-N 2.67Å; M421-Q425 WeakPolarHBondContact O-CB 3.5Å; M421-Q425 PolarHBondContact O-N 3.06Å; M421-L737 HydrophobicContact CG-CB 4.05Å; M421-L737 HydrophobicContact CG-CD1 4.19Å; M421-L737 HydrophobicContact SD-CB 4.35Å; M421-K738 HydrophobicContact SD-CG 4.15Å
422	A	82.3	Confident	76.3	Confident	61 Å²	61	84 Å²	84	50%	0.504	46%	0.455	S	S	.	.	H	α-helix	trans	-63.3	-39.9	178.5	0	0	0	0	0	112.5	A418 E419 Q425 A426	A418-A422 PolarHBondContact O-N 3.38Å; A418-A422 VanDerWaalsContact O-N 3.11Å; E419-A422 PolarHBondContact O-N 3.35Å; A422-Q425 PolarHBondContact O-N 3.48Å; A422-A426 PolarHBondContact O-N 3.46Å; A422-A426 VanDerWaalsContact O-N 3.13Å
423	Q	86.1	Confident	78.3	Confident	127 Å²	127	85.5 Å²	85.5	59%	0.593	45%	0.45	S	S	*	.	H	α-helix	trans	-66.4	-44.4	177.5	-166.1	170.6	10.1	0	0	112.2	E419 R420 M421 Q425 A426 E427	E419-Q423 PolarHBondContact O-N 3.12Å; R420-Q423 PolarHBondContact O-N 2.84Å; M421-Q423 VanDerWaalsContact C-N 3.35Å; M421-Q423 PolarHBondContact O-N 3.34Å; Q423-Q425 VanDerWaalsContact C-N 3.3Å; Q423-Q425 PolarHBondContact O-N 3Å; Q423-A426 PolarHBondContact O-N 2.95Å; Q423-E427 PolarHBondContact O-N 3.44Å
424	I	86.5	Confident	80.2	Confident	8 Å²	8	84.9 Å²	84.9	4%	0.041	45%	0.447	C	S	.	.	H	α-helix	trans	-63.1	-38.3	176.2	-68.5	168.1	0	0	0	110.8	R420 M421 E427 Q428 L730 E733 L734 L737	R420-I424 HydrophobicContact CG-CD1 3.95Å; R420-I424 HydrophobicContact CG-CG1 4.48Å; R420-I424 WeakPolarHBondContact O-CB 3.32Å; R420-I424 VanDerWaalsContact O-CG1 3.23Å; R420-I424 WeakPolarHBondContact O-CG1 3.22Å; R420-I424 PolarHBondContact O-N 2.98Å; M421-I424 PolarHBondContact O-N 2.67Å; I424-E427 PolarHBondContact O-N 2.71Å; I424-Q428 WeakPolarHBondContact O-CB 3.24Å; I424-Q428 PolarHBondContact O-N 3.13Å; I424-L730 HydrophobicContact CG1-CD2 4.41Å; I424-L730 HydrophobicContact CG2-CB 3.98Å; I424-L730 HydrophobicContact CG2-CD2 4.14Å; I424-L730 WeakPolarHBondContact CG2-O 3.48Å; I424-E733 HydrophobicContact CD1-CB 4.43Å; I424-E733 HydrophobicContact CD1-CG 3.83Å; I424-L734 HydrophobicContact CB-CD1 4.3Å; I424-L734 HydrophobicContact CG2-CB 4.05Å; I424-L734 HydrophobicContact CG2-CD1 3.84Å; I424-L737 HydrophobicContact CD1-CD1 3.8Å
425	Q	84	Confident	82.1	Confident	84 Å²	84	81.6 Å²	81.6	39%	0.393	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-41.7	178	-126.9	153.6	-20.5	0	0	112.3	M421 A422 Q423 Q428 E429 L734	M421-Q425 WeakPolarHBondContact O-CB 3.5Å; M421-Q425 PolarHBondContact O-N 3.06Å; A422-Q425 PolarHBondContact O-N 3.48Å; Q423-Q425 VanDerWaalsContact C-N 3.3Å; Q423-Q425 PolarHBondContact O-N 3Å; Q425-Q428 PolarHBondContact O-N 2.92Å; Q425-E429 PolarHBondContact O-N 3.34Å; Q425-E429 VanDerWaalsContact O-N 3.08Å; Q425-L734 HydrophobicContact CB-CD1 4.13Å; Q425-L734 HydrophobicContact CG-CD1 3.78Å
426	A	86.8	Confident	83.8	Confident	59 Å²	59	77.5 Å²	77.5	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-38.6	175.2	0	0	0	0	0	112.7	A422 Q423 Q428 N430	A422-A426 PolarHBondContact O-N 3.46Å; A422-A426 VanDerWaalsContact O-N 3.13Å; Q423-A426 PolarHBondContact O-N 2.95Å; A426-Q428 VanDerWaalsContact C-N 3.34Å; A426-N430 PolarHBondContact O-N 3.44Å
427	E	89.9	Confident	85.3	Confident	93 Å²	93	78 Å²	78	44%	0.435	41%	0.408	S	S	.	.	H	α-helix	trans	-66.5	-36.5	174	-73.4	-178	-168	0	0	112.2	Q423 I424 N430 L431 L730	Q423-E427 PolarHBondContact O-N 3.44Å; I424-E427 PolarHBondContact O-N 2.71Å; E427-N430 PolarHBondContact O-N 2.96Å; E427-L431 WeakPolarHBondContact O-CG 3.43Å; E427-L431 PolarHBondContact O-N 3.29Å; E427-L730 HydrophobicContact CB-CD1 4.03Å
428	Q	87.3	Confident	86.6	Confident	27 Å²	27	74.1 Å²	74.1	13%	0.126	39%	0.393	C	S	.	.	H	α-helix	trans	-64.6	-45.2	177	-161.2	-174.3	7	0	0	111.6	I424 Q425 A426 N430 L431 D432	I424-Q428 WeakPolarHBondContact O-CB 3.24Å; I424-Q428 PolarHBondContact O-N 3.13Å; Q425-Q428 PolarHBondContact O-N 2.92Å; A426-Q428 VanDerWaalsContact C-N 3.34Å; Q428-N430 VanDerWaalsContact C-N 3.3Å; Q428-N430 PolarHBondContact O-N 3.47Å; Q428-L431 PolarHBondContact O-N 3.02Å; Q428-D432 PolarHBondContact O-N 3.19Å
429	E	87.9	Confident	87.8	Confident	133 Å²	133	72.5 Å²	72.5	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-59.6	-39.3	175.8	-74.4	-179.9	179.3	0	0	112.2	Q425 D432 L433	Q425-E429 PolarHBondContact O-N 3.34Å; Q425-E429 VanDerWaalsContact O-N 3.08Å; E429-D432 PolarHBondContact O-N 3.09Å; E429-L433 WeakPolarHBondContact O-CG 3.32Å; E429-L433 PolarHBondContact O-N 2.96Å
430	N	91.1	Very high	88.6	Confident	112 Å²	112	71.8 Å²	71.8	60%	0.599	38%	0.378	S	S	*	.	H	α-helix	trans	-68.5	-40.5	177.6	-162.4	-10.5	0	0	0	112.1	A426 E427 Q428 L433 H434	A426-N430 PolarHBondContact O-N 3.44Å; E427-N430 PolarHBondContact O-N 2.96Å; Q428-N430 VanDerWaalsContact C-N 3.3Å; Q428-N430 PolarHBondContact O-N 3.47Å; N430-L433 PolarHBondContact O-N 3.04Å; N430-H434 PolarHBondContact O-N 2.93Å
431	L	91.7	Very high	89.2	Confident	35 Å²	35	68.3 Å²	68.3	18%	0.183	37%	0.368	C	S	.	.	H	α-helix	trans	-65.7	-37.5	174.4	-70.5	172.2	0	0	0	112.1	E427 Q428 H434 I435 T723 K726 A727 L730	E427-L431 WeakPolarHBondContact O-CG 3.43Å; E427-L431 PolarHBondContact O-N 3.29Å; Q428-L431 PolarHBondContact O-N 3.02Å; L431-H434 PolarHBondContact O-N 3.3Å; L431-I435 WeakPolarHBondContact O-CB 3.48Å; L431-I435 WeakPolarHBondContact O-CD1 3.41Å; L431-I435 WeakPolarHBondContact O-CG1 3.32Å; L431-I435 PolarHBondContact O-N 3.44Å; L431-T723 HydrophobicContact CB-CG2 4.4Å; L431-T723 HydrophobicContact CD2-CG2 3.7Å; L431-K726 HydrophobicContact CD1-CB 4.17Å; L431-A727 HydrophobicContact CB-CB 4.21Å; L431-A727 HydrophobicContact CD1-CB 4.25Å; L431-L730 HydrophobicContact CD1-CD1 3.57Å
432	D	89.2	Confident	89.9	Confident	82 Å²	82	66.7 Å²	66.7	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-66.2	-40.2	176.6	-75	-24.2	0	0	0	111.9	Q428 E429 H434 I435 S436	Q428-D432 PolarHBondContact O-N 3.19Å; E429-D432 PolarHBondContact O-N 3.09Å; D432-H434 VanDerWaalsContact C-N 3.33Å; D432-H434 PolarHBondContact O-N 2.93Å; D432-I435 PolarHBondContact O-N 3.48Å; D432-S436 WeakPolarHBondContact O-CB 3.36Å; D432-S436 PolarHBondContact O-N 3.36Å
433	L	90.9	Very high	90.4	Very high	118 Å²	118	68.1 Å²	68.1	62%	0.618	36%	0.359	S	S	*	.	H	α-helix	trans	-60.8	-41.5	170.4	-73.6	169.2	0	0	0	111.8	E429 N430 S436 T437	E429-L433 WeakPolarHBondContact O-CG 3.32Å; E429-L433 PolarHBondContact O-N 2.96Å; N430-L433 PolarHBondContact O-N 3.04Å; L433-S436 WeakPolarHBondContact O-CB 3.46Å; L433-S436 PolarHBondContact O-N 3.23Å; L433-T437 PolarHBondContact O-N 2.97Å; L433-T437 PolarHBondContact O-OG1 2.84Å
434	H	92.8	Very high	90.8	Very high	70 Å²	70	67.9 Å²	67.9	32%	0.324	36%	0.361	S	S	.	.	H	α-helix	trans	-66.9	-41.5	177.1	-167	51.8	0	0	0	112.2	N430 L431 D432 S436 T437 L438 T723	N430-H434 PolarHBondContact O-N 2.93Å; L431-H434 PolarHBondContact O-N 3.3Å; D432-H434 VanDerWaalsContact C-N 3.33Å; D432-H434 PolarHBondContact O-N 2.93Å; H434-S436 VanDerWaalsContact C-N 3.31Å; H434-S436 PolarHBondContact O-N 3.39Å; H434-T437 WeakPolarHBondContact O-CB 3.46Å; H434-T437 PolarHBondContact O-N 2.99Å; H434-L438 WeakPolarHBondContact O-CG 3.44Å; H434-L438 PolarHBondContact O-N 3.42Å; H434-T723 HydrophobicContact CB-CG2 4.38Å
435	I	92.3	Very high	91.2	Very high	23 Å²	23	69.9 Å²	69.9	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-40.9	174.8	-71.2	161.7	0	0	0	111.1	L431 D432 L438 G439 Q720 T723 K724 A727	L431-I435 WeakPolarHBondContact O-CB 3.48Å; L431-I435 WeakPolarHBondContact O-CD1 3.41Å; L431-I435 WeakPolarHBondContact O-CG1 3.32Å; L431-I435 PolarHBondContact O-N 3.44Å; D432-I435 PolarHBondContact O-N 3.48Å; I435-L438 PolarHBondContact O-N 3.1Å; I435-G439 PolarHBondContact O-N 3.11Å; I435-Q720 HydrophobicContact CG2-CG 4.25Å; I435-Q720 PolarHBondContact O-NE2 3.18Å; I435-T723 HydrophobicContact CD1-CG2 4.19Å; I435-T723 HydrophobicContact CG1-CG2 3.65Å; I435-K724 HydrophobicContact CD1-CB 4.43Å; I435-K724 HydrophobicContact CD1-CG 3.7Å; I435-K724 HydrophobicContact CG1-CG 4.04Å; I435-K724 HydrophobicContact CG2-CG 4.21Å; I435-A727 HydrophobicContact CD1-CB 3.99Å
436	S	92.5	Very high	91.6	Very high	69 Å²	69	70 Å²	70	48%	0.483	37%	0.371	S	S	.	.	H	α-helix	trans	-62.6	-45.4	175.3	-174.3	0	0	0	0	111.7	D432 L433 H434 L438 G439 Q440	D432-S436 WeakPolarHBondContact O-CB 3.36Å; D432-S436 PolarHBondContact O-N 3.36Å; L433-S436 WeakPolarHBondContact O-CB 3.46Å; L433-S436 PolarHBondContact O-N 3.23Å; H434-S436 VanDerWaalsContact C-N 3.31Å; H434-S436 PolarHBondContact O-N 3.39Å; S436-L438 PolarHBondContact O-N 3.48Å; S436-G439 WeakPolarHBondContact O-CA 3.45Å; S436-G439 PolarHBondContact O-N 3.27Å; S436-G439 VanDerWaalsContact O-N 3.13Å; S436-Q440 PolarHBondContact O-N 3.45Å; S436-Q440 VanDerWaalsContact O-N 3.08Å
437	T	93.2	Very high	91.8	Very high	67 Å²	67	73.2 Å²	73.2	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-45.3	176.3	-52	0	0	0	0	111.7	L433 H434 G439 Q440 Q441	L433-T437 PolarHBondContact O-N 2.97Å; L433-T437 PolarHBondContact O-OG1 2.84Å; H434-T437 WeakPolarHBondContact O-CB 3.46Å; H434-T437 PolarHBondContact O-N 2.99Å; T437-G439 VanDerWaalsContact C-N 3.28Å; T437-G439 PolarHBondContact O-N 2.94Å; T437-Q440 PolarHBondContact O-N 3.43Å; T437-Q441 PolarHBondContact O-N 2.85Å; T437-Q441 VanDerWaalsContact O-N 3.16Å
438	L	93.7	Very high	92	Very high	2 Å²	2	70.1 Å²	70.1	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-64.4	-33.5	175.4	-67.8	169.3	0	0	0	111.6	H434 I435 S436 Q441 I442 V716 E719 Q720	H434-L438 WeakPolarHBondContact O-CG 3.44Å; H434-L438 PolarHBondContact O-N 3.42Å; I435-L438 PolarHBondContact O-N 3.1Å; S436-L438 PolarHBondContact O-N 3.48Å; L438-Q441 PolarHBondContact O-N 3.02Å; L438-I442 WeakPolarHBondContact O-CD1 3.42Å; L438-I442 VanDerWaalsContact O-CG1 3.29Å; L438-I442 WeakPolarHBondContact O-CG1 3.41Å; L438-I442 PolarHBondContact O-N 3.11Å; L438-V716 HydrophobicContact CB-CG1 4.13Å; L438-V716 HydrophobicContact CD2-CG1 3.79Å; L438-V716 WeakPolarHBondContact O-CG1 3.43Å; L438-E719 HydrophobicContact CD1-CB 4.47Å; L438-E719 HydrophobicContact CD1-CG 4.05Å; L438-E719 HydrophobicContact CD2-CB 4.48Å; L438-E719 HydrophobicContact CD2-CG 4.19Å; L438-Q720 HydrophobicContact CB-CB 4.14Å; L438-Q720 HydrophobicContact CB-CG 4.23Å; L438-Q720 HydrophobicContact CD1-CB 4.17Å
439	G	91.6	Very high	92.2	Very high	17 Å²	17	69 Å²	69	18%	0.175	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-47.2	172.1	0	0	0	0	0	112.7	I435 S436 T437 Q441 I442 D443	I435-G439 PolarHBondContact O-N 3.11Å; S436-G439 WeakPolarHBondContact O-CA 3.45Å; S436-G439 PolarHBondContact O-N 3.27Å; S436-G439 VanDerWaalsContact O-N 3.13Å; T437-G439 VanDerWaalsContact C-N 3.28Å; T437-G439 PolarHBondContact O-N 2.94Å; G439-Q441 VanDerWaalsContact C-N 3.33Å; G439-Q441 PolarHBondContact O-N 3Å; G439-I442 WeakPolarHBondContact O-CB 3.35Å; G439-I442 PolarHBondContact O-N 2.84Å; G439-D443 PolarHBondContact O-N 3.21Å; G439-D443 VanDerWaalsContact O-N 3.1Å
440	Q	92.4	Very high	92.4	Very high	126 Å²	126	66.1 Å²	66.1	59%	0.589	35%	0.349	S	S	*	.	H	α-helix	trans	-62.5	-39	175.9	-65.7	178.4	-4.6	0	0	112.3	S436 T437 D443 L444	S436-Q440 PolarHBondContact O-N 3.45Å; S436-Q440 VanDerWaalsContact O-N 3.08Å; T437-Q440 PolarHBondContact O-N 3.43Å; Q440-D443 PolarHBondContact O-N 3.02Å; Q440-L444 VanDerWaalsContact O-CG 3.32Å; Q440-L444 WeakPolarHBondContact O-CG 3.49Å; Q440-L444 PolarHBondContact O-N 3.32Å; Q440-L444 VanDerWaalsContact O-N 3.07Å
441	Q	92.8	Very high	92.5	Very high	75 Å²	75	68.2 Å²	68.2	35%	0.35	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-38.5	176	-69.2	-177.7	10	0	0	112.6	T437 L438 G439 L444 F445 V716	T437-Q441 PolarHBondContact O-N 2.85Å; T437-Q441 VanDerWaalsContact O-N 3.16Å; L438-Q441 PolarHBondContact O-N 3.02Å; G439-Q441 VanDerWaalsContact C-N 3.33Å; G439-Q441 PolarHBondContact O-N 3Å; Q441-L444 PolarHBondContact O-N 3.48Å; Q441-F445 HydrophobicContact CB-CE2 4.3Å; Q441-F445 WeakPolarHBondContact O-CD2 3.41Å; Q441-F445 PolarHBondContact O-N 3.17Å; Q441-V716 HydrophobicContact CB-CG1 3.97Å
442	I	93.8	Very high	92.5	Very high	13 Å²	13	66.9 Å²	66.9	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-57.5	-50	173.5	-76.2	159.7	0	0	0	110	L438 G439 L444 F445 Q446 L713 V716 L717 Q720	L438-I442 WeakPolarHBondContact O-CD1 3.42Å; L438-I442 VanDerWaalsContact O-CG1 3.29Å; L438-I442 WeakPolarHBondContact O-CG1 3.41Å; L438-I442 PolarHBondContact O-N 3.11Å; G439-I442 WeakPolarHBondContact O-CB 3.35Å; G439-I442 PolarHBondContact O-N 2.84Å; I442-L444 VanDerWaalsContact C-N 3.34Å; I442-L444 PolarHBondContact O-N 3.16Å; I442-F445 PolarHBondContact O-N 3.41Å; I442-Q446 WeakPolarHBondContact O-CB 3.32Å; I442-Q446 PolarHBondContact O-N 3.34Å; I442-L713 HydrophobicContact CB-CD1 4.22Å; I442-L713 HydrophobicContact CG1-CD1 4.26Å; I442-L713 HydrophobicContact CG2-CD1 3.88Å; I442-V716 HydrophobicContact CD1-CG1 4.23Å; I442-V716 HydrophobicContact CG1-CB 4.29Å; I442-V716 HydrophobicContact CG1-CG1 3.68Å; I442-L717 HydrophobicContact CD1-CD2 3.65Å; I442-L717 HydrophobicContact CD1-CG 4.27Å; I442-L717 HydrophobicContact CG1-CD2 4.02Å; I442-L717 HydrophobicContact CG1-CG 4.22Å; I442-L717 HydrophobicContact CG2-CD2 4.34Å; I442-Q720 HydrophobicContact CD1-CB 4.12Å; I442-Q720 HydrophobicContact CD1-CG 4.38Å
443	D	92.4	Very high	92.7	Very high	91 Å²	91	67 Å²	67	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-43.8	-179.9	-68	-22.6	0	0	0	111.4	G439 Q440 Q446 H447	G439-D443 PolarHBondContact O-N 3.21Å; G439-D443 VanDerWaalsContact O-N 3.1Å; Q440-D443 PolarHBondContact O-N 3.02Å; D443-Q446 PolarHBondContact O-N 3.26Å; D443-H447 WeakPolarHBondContact O-CB 3.44Å; D443-H447 PolarHBondContact O-CD2 3.33Å; D443-H447 PolarHBondContact O-N 3.46Å
444	L	93.8	Very high	92.8	Very high	121 Å²	121	67.4 Å²	67.4	63%	0.634	34%	0.339	S	S	*	.	H	α-helix	trans	-59.6	-50.1	177.4	-73.1	169.6	0	0	0	112.5	Q440 Q441 I442 H447 A448	Q440-L444 VanDerWaalsContact O-CG 3.32Å; Q440-L444 WeakPolarHBondContact O-CG 3.49Å; Q440-L444 PolarHBondContact O-N 3.32Å; Q440-L444 VanDerWaalsContact O-N 3.07Å; Q441-L444 PolarHBondContact O-N 3.48Å; I442-L444 VanDerWaalsContact C-N 3.34Å; I442-L444 PolarHBondContact O-N 3.16Å; L444-H447 PolarHBondContact O-N 2.99Å; L444-A448 WeakPolarHBondContact O-CB 3.41Å; L444-A448 PolarHBondContact O-N 3.08Å
445	F	95.1	Very high	92.8	Very high	50 Å²	50	68.6 Å²	68.6	22%	0.219	34%	0.344	C	S	.	.	H	α-helix	trans	-69.5	-34	-179.9	-67.4	-50.7	0	0	0	112.5	Q441 I442 A448 S449 L712 L713 V716	Q441-F445 HydrophobicContact CB-CE2 4.3Å; Q441-F445 WeakPolarHBondContact O-CD2 3.41Å; Q441-F445 PolarHBondContact O-N 3.17Å; I442-F445 PolarHBondContact O-N 3.41Å; F445-A448 PolarHBondContact O-N 2.82Å; F445-S449 WeakPolarHBondContact O-CB 3.48Å; F445-S449 PolarHBondContact O-N 2.66Å; F445-L712 HydrophobicContact CD1-CB 4.11Å; F445-L712 HydrophobicContact CD1-CD1 4.05Å; F445-L712 HydrophobicContact CD2-CB 4.12Å; F445-L712 HydrophobicContact CE1-CB 4.08Å; F445-L712 HydrophobicContact CE1-CD1 3.47Å; F445-L712 VanDerWaalsContact CE1-CD1 3.47Å; F445-L712 HydrophobicContact CE1-CG 4.4Å; F445-L712 HydrophobicContact CE2-CB 4.08Å; F445-L712 HydrophobicContact CG-CB 4.15Å; F445-L712 HydrophobicContact CZ-CB 4.06Å; F445-L712 HydrophobicContact CZ-CD1 3.82Å; F445-L712 HydrophobicContact CZ-CG 4.48Å; F445-L713 HydrophobicContact CB-CB 4.13Å; F445-L713 HydrophobicContact CB-CD1 4.37Å; F445-V716 HydrophobicContact CD2-CG2 4.14Å; F445-V716 HydrophobicContact CE2-CG2 3.88Å
446	Q	92.3	Very high	92.8	Very high	88 Å²	88	69.3 Å²	69.3	41%	0.411	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-44	175.9	-171.2	167.4	-12.9	0	0	111.4	I442 D443 S449 N450 L713	I442-Q446 WeakPolarHBondContact O-CB 3.32Å; I442-Q446 PolarHBondContact O-N 3.34Å; D443-Q446 PolarHBondContact O-N 3.26Å; Q446-S449 PolarHBondContact O-N 3.19Å; Q446-N450 WeakPolarHBondContact O-CB 3.43Å; Q446-N450 VanDerWaalsContact O-CG 3.25Å; Q446-N450 PolarHBondContact O-N 2.97Å; Q446-N450 PolarHBondContact O-ND2 2.97Å; Q446-L713 HydrophobicContact CB-CD1 4.45Å; Q446-L713 HydrophobicContact CB-CD2 4.42Å
447	H	92.2	Very high	92.8	Very high	126 Å²	126	67.4 Å²	67.4	58%	0.583	34%	0.338	S	S	*	.	H	α-helix	trans	-62.8	-42.5	173.1	-79	-58	0	0	0	112.6	D443 L444 N450 R451	D443-H447 WeakPolarHBondContact O-CB 3.44Å; D443-H447 PolarHBondContact O-CD2 3.33Å; D443-H447 PolarHBondContact O-N 3.46Å; L444-H447 PolarHBondContact O-N 2.99Å; H447-N450 PolarHBondContact O-N 3.48Å; H447-R451 PolarHBondContact O-N 3.26Å
448	A	92.3	Very high	92.7	Very high	28 Å²	28	70.4 Å²	70.4	23%	0.231	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-43	176.6	0	0	0	0	0	112.3	L444 F445 A452	L444-A448 WeakPolarHBondContact O-CB 3.41Å; L444-A448 PolarHBondContact O-N 3.08Å; F445-A448 PolarHBondContact O-N 2.82Å; A448-A452 PolarHBondContact O-N 3.48Å; A448-A452 VanDerWaalsContact O-N 3.15Å
449	S	92.8	Very high	92.6	Very high	3 Å²	3	72.8 Å²	72.8	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-44.2	176.2	-175.3	0	0	0	0	112.1	F445 Q446 A452 K453	F445-S449 WeakPolarHBondContact O-CB 3.48Å; F445-S449 PolarHBondContact O-N 2.66Å; Q446-S449 PolarHBondContact O-N 3.19Å; S449-A452 PolarHBondContact O-N 2.97Å; S449-K453 WeakPolarHBondContact O-CG 3.38Å; S449-K453 PolarHBondContact O-N 2.85Å
450	N	92.3	Very high	92.6	Very high	72 Å²	72	77.6 Å²	77.6	39%	0.385	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-43.1	179.5	-72.5	-15.2	0	0	0	112	Q446 H447 A452 K453 E454	Q446-N450 WeakPolarHBondContact O-CB 3.43Å; Q446-N450 VanDerWaalsContact O-CG 3.25Å; Q446-N450 PolarHBondContact O-N 2.97Å; Q446-N450 PolarHBondContact O-ND2 2.97Å; H447-N450 PolarHBondContact O-N 3.48Å; N450-A452 PolarHBondContact O-N 3.32Å; N450-K453 PolarHBondContact O-N 3.4Å; N450-E454 WeakPolarHBondContact O-CG 3.48Å; N450-E454 PolarHBondContact O-N 3.45Å
451	R	93.3	Very high	92.5	Very high	156 Å²	156	78.4 Å²	78.4	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-59.4	-46.9	176.3	-170.5	-173.4	-58.3	139.1	2.9	111.8	H447 K453 E454 E455	H447-R451 PolarHBondContact O-N 3.26Å; R451-K453 VanDerWaalsContact C-N 3.32Å; R451-K453 PolarHBondContact O-N 3.43Å; R451-E454 PolarHBondContact O-N 2.96Å; R451-E455 PolarHBondContact O-N 3.26Å
452	A	92	Very high	92.4	Very high	8 Å²	8	80.1 Å²	80.1	7%	0.066	39%	0.387	C	S	.	.	H	α-helix	trans	-63.2	-36.9	178.3	0	0	0	0	0	112.3	A448 S449 N450 Q456 L702 I706	A448-A452 PolarHBondContact O-N 3.48Å; A448-A452 VanDerWaalsContact O-N 3.15Å; S449-A452 PolarHBondContact O-N 2.97Å; N450-A452 PolarHBondContact O-N 3.32Å; A452-Q456 WeakPolarHBondContact O-CB 3.43Å; A452-Q456 PolarHBondContact O-N 3.4Å; A452-L702 HydrophobicContact CB-CD2 4.38Å; A452-I706 HydrophobicContact CB-CD1 4.35Å; A452-I706 HydrophobicContact CB-CG1 3.63Å
453	K	92.7	Very high	92.3	Very high	85 Å²	85	80.9 Å²	80.9	37%	0.37	39%	0.389	S	S	.	.	H	α-helix	trans	-65.8	-40.4	174.2	-75.6	172.9	-178.3	169.5	0	112.9	S449 N450 R451 Q456 G457 I706 E710	S449-K453 WeakPolarHBondContact O-CG 3.38Å; S449-K453 PolarHBondContact O-N 2.85Å; N450-K453 PolarHBondContact O-N 3.4Å; R451-K453 VanDerWaalsContact C-N 3.32Å; R451-K453 PolarHBondContact O-N 3.43Å; K453-Q456 PolarHBondContact O-N 3.36Å; K453-G457 PolarHBondContact O-N 3.38Å; K453-I706 HydrophobicContact CB-CD1 4.48Å; K453-I706 HydrophobicContact CG-CD1 3.73Å; K453-I706 HydrophobicContact CG-CG1 4.05Å; K453-I706 HydrophobicContact CG-CG2 4.38Å; K453-E710 WeakPolarHBondContact CE-OE1 3.44Å; K453-E710 IonicContact NZ-OE1 3.45Å; K453-E710 PolarHBondContact NZ-OE1 2.88Å
454	E	93.2	Very high	92.2	Very high	126 Å²	126	80.1 Å²	80.1	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-64.3	-45.6	176.2	-74.7	178.6	-169.4	0	0	111.8	N450 R451 Q456 G457 K458	N450-E454 WeakPolarHBondContact O-CG 3.48Å; N450-E454 PolarHBondContact O-N 3.45Å; R451-E454 PolarHBondContact O-N 2.96Å; E454-Q456 VanDerWaalsContact C-N 3.35Å; E454-G457 PolarHBondContact O-N 3.26Å; E454-K458 PolarHBondContact O-N 2.87Å
455	E	92.2	Very high	92	Very high	94 Å²	94	76.4 Å²	76.4	44%	0.439	38%	0.376	S	S	.	.	H	α-helix	trans	-61.1	-43.5	175.1	-72.8	-179.9	-171.7	0	0	111.5	R451 G457 K458 M459 L702	R451-E455 PolarHBondContact O-N 3.26Å; E455-G457 VanDerWaalsContact C-N 3.3Å; E455-G457 PolarHBondContact O-N 3.02Å; E455-K458 PolarHBondContact O-N 3.36Å; E455-M459 WeakPolarHBondContact O-CG 3.39Å; E455-M459 PolarHBondContact O-N 3.26Å; E455-L702 HydrophobicContact CB-CD1 4.14Å; E455-L702 HydrophobicContact CB-CD2 4.28Å
456	Q	93.4	Very high	91.9	Very high	39 Å²	39	75 Å²	75	18%	0.182	37%	0.37	C	S	.	.	H	α-helix	trans	-60.9	-40.4	174.5	-174.5	-173.8	60.8	0	0	111.8	A452 K453 E454 M459 K460 L702 D703 I706	A452-Q456 WeakPolarHBondContact O-CB 3.43Å; A452-Q456 PolarHBondContact O-N 3.4Å; K453-Q456 PolarHBondContact O-N 3.36Å; E454-Q456 VanDerWaalsContact C-N 3.35Å; Q456-M459 PolarHBondContact O-N 3.23Å; Q456-K460 VanDerWaalsContact O-CB 3.3Å; Q456-K460 WeakPolarHBondContact O-CB 3.36Å; Q456-K460 PolarHBondContact O-N 3.17Å; Q456-L702 HydrophobicContact CB-CB 4.38Å; Q456-L702 HydrophobicContact CB-CD1 4.25Å; Q456-D703 PolarHBondContact NE2-OD1 3.27Å; Q456-D703 PolarHBondContact NE2-OD2 3.48Å; Q456-I706 HydrophobicContact CB-CD1 4.4Å
457	G	90.8	Very high	91.8	Very high	28 Å²	28	75.9 Å²	75.9	29%	0.289	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-47.2	176.1	0	0	0	0	0	112.4	K453 E454 E455 K460 M461	K453-G457 PolarHBondContact O-N 3.38Å; E454-G457 PolarHBondContact O-N 3.26Å; E455-G457 VanDerWaalsContact C-N 3.3Å; E455-G457 PolarHBondContact O-N 3.02Å; G457-K460 PolarHBondContact O-N 3.25Å; G457-M461 WeakPolarHBondContact O-CG 3.49Å; G457-M461 PolarHBondContact O-N 2.68Å
458	K	91.5	Very high	91.7	Very high	131 Å²	131	77.5 Å²	77.5	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-60.8	-50.6	175.9	-68.4	174.5	-175.8	173.1	0	111.3	E454 E455 K460 M461 E462	E454-K458 PolarHBondContact O-N 2.87Å; E455-K458 PolarHBondContact O-N 3.36Å; K458-K460 VanDerWaalsContact C-N 3.28Å; K458-K460 PolarHBondContact O-N 3.5Å; K458-M461 PolarHBondContact O-N 3.45Å; K458-M461 VanDerWaalsContact O-N 3.1Å; K458-E462 PolarHBondContact O-N 3.17Å
459	M	91.4	Very high	91.5	Very high	51 Å²	51	78.4 Å²	78.4	25%	0.251	38%	0.383	S	S	.	.	H	α-helix	trans	-58.7	-38.4	178.7	-70.9	-65.5	179.6	0	0	112.5	E455 Q456 M461 E462 Y463 F695 M699 L702	E455-M459 WeakPolarHBondContact O-CG 3.39Å; E455-M459 PolarHBondContact O-N 3.26Å; Q456-M459 PolarHBondContact O-N 3.23Å; M459-M461 PolarHBondContact O-N 3.48Å; M459-E462 PolarHBondContact O-N 3.3Å; M459-Y463 VanDerWaalsContact O-CB 3.29Å; M459-Y463 WeakPolarHBondContact O-CB 3.39Å; M459-Y463 PolarHBondContact O-N 3.05Å; M459-F695 HydrophobicContact SD-CD1 3.84Å; M459-F695 HydrophobicContact SD-CE1 3.75Å; M459-M699 HydrophobicContact CB-CG 4.17Å; M459-L702 HydrophobicContact CG-CD1 4.4Å
460	K	91.9	Very high	91.4	Very high	118 Å²	118	78.8 Å²	78.8	51%	0.513	39%	0.385	S	S	.	.	H	α-helix	trans	-66.9	-35.1	178.2	-168.8	173.3	-175.5	174.3	0	112.6	Q456 G457 K458 N464 M699	Q456-K460 VanDerWaalsContact O-CB 3.3Å; Q456-K460 WeakPolarHBondContact O-CB 3.36Å; Q456-K460 PolarHBondContact O-N 3.17Å; G457-K460 PolarHBondContact O-N 3.25Å; K458-K460 VanDerWaalsContact C-N 3.28Å; K458-K460 PolarHBondContact O-N 3.5Å; K460-N464 WeakPolarHBondContact O-CB 3.5Å; K460-N464 PolarHBondContact O-N 2.65Å; K460-N464 PolarHBondContact O-ND2 3.41Å; K460-N464 VanDerWaalsContact O-ND2 3.14Å; K460-M699 HydrophobicContact CB-CE 4.09Å; K460-M699 HydrophobicContact CD-CE 4.47Å; K460-M699 HydrophobicContact CG-CE 4.15Å
461	M	90.8	Very high	91.3	Very high	144 Å²	144	80 Å²	80	71%	0.709	39%	0.388	S	S	*	.	H	α-helix	trans	-66.9	-45.7	175	-66	-171.4	-151.4	0	0	111.3	G457 K458 M459 N464 G465	G457-M461 WeakPolarHBondContact O-CG 3.49Å; G457-M461 PolarHBondContact O-N 2.68Å; K458-M461 PolarHBondContact O-N 3.45Å; K458-M461 VanDerWaalsContact O-N 3.1Å; M459-M461 PolarHBondContact O-N 3.48Å; M461-N464 PolarHBondContact O-N 3.24Å; M461-G465 PolarHBondContact O-N 3.43Å
462	E	90.3	Very high	90.9	Very high	111 Å²	111	75.2 Å²	75.2	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.5	-68	-179.4	-169.2	0	0	111.8	K458 M459 N464 G465 L466 F695	K458-E462 PolarHBondContact O-N 3.17Å; M459-E462 PolarHBondContact O-N 3.3Å; E462-N464 VanDerWaalsContact C-N 3.32Å; E462-N464 PolarHBondContact O-N 3.17Å; E462-G465 WeakPolarHBondContact O-CA 3.44Å; E462-G465 PolarHBondContact O-N 2.77Å; E462-G465 VanDerWaalsContact O-N 3.07Å; E462-L466 PolarHBondContact O-N 3.49Å; E462-F695 HydrophobicContact CB-CE1 4.28Å; E462-F695 HydrophobicContact CB-CZ 4.18Å
463	Y	91.9	Very high	90.7	Very high	29 Å²	29	75.9 Å²	75.9	11%	0.114	38%	0.384	C	S	.	.	H	α-helix	trans	-56.7	-44.1	175	177.5	-98.2	0	0	0	112.2	M459 G465 L466 K467 E692 F695 Q696 M699	M459-Y463 VanDerWaalsContact O-CB 3.29Å; M459-Y463 WeakPolarHBondContact O-CB 3.39Å; M459-Y463 PolarHBondContact O-N 3.05Å; Y463-G465 VanDerWaalsContact C-N 3.32Å; Y463-G465 PolarHBondContact O-N 3.36Å; Y463-L466 PolarHBondContact O-N 3.29Å; Y463-K467 HydrophobicContact CE1-CD 4.23Å; Y463-K467 WeakPolarHBondContact O-CB 3.43Å; Y463-K467 PolarHBondContact O-N 3.05Å; Y463-E692 HydrophobicContact CD2-CG 4.34Å; Y463-E692 HydrophobicContact CE2-CG 3.44Å; Y463-E692 VanDerWaalsContact CE2-CG 3.44Å; Y463-E692 PolarHBondContact OH-OE1 3.01Å; Y463-F695 HydrophobicContact CD2-CB 3.89Å; Y463-Q696 HydrophobicContact CE2-CG 3.87Å; Y463-Q696 PolarHBondContact OH-NE2 3.42Å; Y463-M699 HydrophobicContact CG-SD 4.45Å
464	N	90.8	Very high	90.5	Very high	75 Å²	75	77.6 Å²	77.6	40%	0.401	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-35.8	176.8	-75	-28	0	0	0	112.3	K460 M461 E462 K468	K460-N464 WeakPolarHBondContact O-CB 3.5Å; K460-N464 PolarHBondContact O-N 2.65Å; K460-N464 PolarHBondContact O-ND2 3.41Å; K460-N464 VanDerWaalsContact O-ND2 3.14Å; M461-N464 PolarHBondContact O-N 3.24Å; E462-N464 VanDerWaalsContact C-N 3.32Å; E462-N464 PolarHBondContact O-N 3.17Å; N464-K468 WeakPolarHBondContact O-CG 3.05Å; N464-K468 PolarHBondContact O-N 3.08Å
465	G	89.9	Confident	90.1	Very high	43 Å²	43	78.9 Å²	78.9	44%	0.443	39%	0.391	S	S	.	.	H	α-helix	trans	-62.2	-49.6	172.5	0	0	0	0	0	111.8	M461 E462 Y463 K467 K468 S469	M461-G465 PolarHBondContact O-N 3.43Å; E462-G465 WeakPolarHBondContact O-CA 3.44Å; E462-G465 PolarHBondContact O-N 2.77Å; E462-G465 VanDerWaalsContact O-N 3.07Å; Y463-G465 VanDerWaalsContact C-N 3.32Å; Y463-G465 PolarHBondContact O-N 3.36Å; G465-K467 VanDerWaalsContact C-N 3.34Å; G465-K467 PolarHBondContact O-N 3.27Å; G465-K468 PolarHBondContact O-N 3.37Å; G465-S469 PolarHBondContact O-N 3.19Å; G465-S469 VanDerWaalsContact O-N 3.16Å
466	L	91.8	Very high	89.6	Confident	19 Å²	19	77.4 Å²	77.4	10%	0.099	38%	0.383	C	S	.	.	H	α-helix	trans	-58.7	-44.6	176.3	179.9	63	0	0	0	111.7	E462 Y463 K468 S469 I470 Q688 Q691 E692 F695	E462-L466 PolarHBondContact O-N 3.49Å; Y463-L466 PolarHBondContact O-N 3.29Å; L466-K468 PolarHBondContact O-N 3.25Å; L466-S469 WeakPolarHBondContact O-CA 3.4Å; L466-S469 WeakPolarHBondContact O-CB 3.48Å; L466-S469 PolarHBondContact O-N 3.48Å; L466-S469 VanDerWaalsContact O-N 3.08Å; L466-I470 HydrophobicContact CD1-CD1 4.38Å; L466-I470 HydrophobicContact CD1-CG1 4.45Å; L466-I470 HydrophobicContact CG-CD1 3.98Å; L466-I470 HydrophobicContact CG-CG1 4.47Å; L466-I470 WeakPolarHBondContact O-CG1 3.35Å; L466-I470 PolarHBondContact O-N 3.13Å; L466-Q688 HydrophobicContact CD1-CB 4.07Å; L466-Q688 HydrophobicContact CD1-CG 3.96Å; L466-Q691 HydrophobicContact CD2-CB 3.75Å; L466-E692 HydrophobicContact CD2-CB 4.21Å; L466-F695 HydrophobicContact CD2-CD2 3.76Å; L466-F695 HydrophobicContact CD2-CE2 3.94Å
467	K	90.5	Very high	89.3	Confident	108 Å²	108	76.3 Å²	76.3	47%	0.47	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-41.1	179.9	-169.9	173.8	-177.1	173.5	0	112.8	Y463 G465 S469 I470 E471	Y463-K467 HydrophobicContact CE1-CD 4.23Å; Y463-K467 WeakPolarHBondContact O-CB 3.43Å; Y463-K467 PolarHBondContact O-N 3.05Å; G465-K467 VanDerWaalsContact C-N 3.34Å; G465-K467 PolarHBondContact O-N 3.27Å; K467-S469 VanDerWaalsContact C-N 3.32Å; K467-I470 PolarHBondContact O-N 3.45Å; K467-E471 PolarHBondContact O-N 3.38Å
468	K	89.8	Confident	89	Confident	159 Å²	159	81.4 Å²	81.4	69%	0.691	40%	0.395	S	S	*	.	H	α-helix	trans	-62.2	-40.8	173.8	-72.7	176.2	-178.4	179.4	0	111.5	N464 G465 L466 E471 A472	N464-K468 WeakPolarHBondContact O-CG 3.05Å; N464-K468 PolarHBondContact O-N 3.08Å; G465-K468 PolarHBondContact O-N 3.37Å; L466-K468 PolarHBondContact O-N 3.25Å; K468-E471 PolarHBondContact O-N 2.94Å; K468-A472 PolarHBondContact O-N 3.14Å
469	S	89.3	Confident	88.5	Confident	47 Å²	47	77.8 Å²	77.8	33%	0.329	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-45.2	176.9	-170.8	0	0	0	0	112.1	G465 L466 K467 E471 A472 N473 Q688	G465-S469 PolarHBondContact O-N 3.19Å; G465-S469 VanDerWaalsContact O-N 3.16Å; L466-S469 WeakPolarHBondContact O-CA 3.4Å; L466-S469 WeakPolarHBondContact O-CB 3.48Å; L466-S469 PolarHBondContact O-N 3.48Å; L466-S469 VanDerWaalsContact O-N 3.08Å; K467-S469 VanDerWaalsContact C-N 3.32Å; S469-E471 VanDerWaalsContact C-N 3.3Å; S469-E471 PolarHBondContact O-N 2.79Å; S469-A472 PolarHBondContact O-N 3.25Å; S469-N473 WeakPolarHBondContact O-CB 3.49Å; S469-N473 PolarHBondContact O-N 3.19Å; S469-Q688 PolarHBondContact OG-NE2 3.03Å
470	I	90.5	Very high	88	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.062	37%	0.373	C	S	.	.	H	α-helix	trans	-56.5	-45.3	174.2	-70.7	169.2	0	0	0	110.9	L466 K467 N473 K474 L685 Q688 E692	L466-I470 HydrophobicContact CD1-CD1 4.38Å; L466-I470 HydrophobicContact CD1-CG1 4.45Å; L466-I470 HydrophobicContact CG-CD1 3.98Å; L466-I470 HydrophobicContact CG-CG1 4.47Å; L466-I470 WeakPolarHBondContact O-CG1 3.35Å; L466-I470 PolarHBondContact O-N 3.13Å; K467-I470 PolarHBondContact O-N 3.45Å; I470-N473 PolarHBondContact O-N 3.41Å; I470-K474 HydrophobicContact CG2-CD 4.08Å; I470-K474 HydrophobicContact CG2-CG 4.45Å; I470-K474 WeakPolarHBondContact O-CB 3.45Å; I470-K474 WeakPolarHBondContact O-CG 3.48Å; I470-K474 PolarHBondContact O-N 3.33Å; I470-L685 HydrophobicContact CG2-CD2 4.06Å; I470-Q688 HydrophobicContact CD1-CB 3.99Å; I470-Q688 HydrophobicContact CG1-CB 3.6Å; I470-Q688 HydrophobicContact CG1-CG 4.3Å; I470-E692 HydrophobicContact CD1-CB 4.24Å; I470-E692 HydrophobicContact CD1-CG 4.48Å
471	E	88.9	Confident	87.6	Confident	97 Å²	97	74.5 Å²	74.5	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-66.2	-40.6	-179.8	-164.3	177	170.1	0	0	112.2	K467 K468 S469 K474 R475	K467-E471 PolarHBondContact O-N 3.38Å; K468-E471 PolarHBondContact O-N 2.94Å; S469-E471 VanDerWaalsContact C-N 3.3Å; S469-E471 PolarHBondContact O-N 2.79Å; E471-K474 PolarHBondContact O-N 2.85Å; E471-R475 WeakPolarHBondContact O-CG 3.35Å; E471-R475 PolarHBondContact O-N 2.93Å; E471-R475 IonicContact OE1-CZ 3.08Å; E471-R475 IonicContact OE1-NE 3.64Å; E471-R475 IonicContact OE1-NH2 3.54Å; E471-R475 PolarHBondContact OE1-NH2 3.49Å
472	A	85.3	Confident	87.1	Confident	55 Å²	55	69 Å²	69	46%	0.455	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-47.3	174.2	0	0	0	0	0	111.8	K468 S469 K474 R475 K476	K468-A472 PolarHBondContact O-N 3.14Å; S469-A472 PolarHBondContact O-N 3.25Å; A472-K474 PolarHBondContact O-N 3.29Å; A472-R475 PolarHBondContact O-N 3.4Å; A472-K476 PolarHBondContact O-N 2.85Å
473	N	87.6	Confident	86.4	Confident	22 Å²	22	64.1 Å²	64.1	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-36.5	178	-78.4	-10.5	0	0	0	112.3	S469 I470 K476 L477 E684 L685 Q688	S469-N473 WeakPolarHBondContact O-CB 3.49Å; S469-N473 PolarHBondContact O-N 3.19Å; I470-N473 PolarHBondContact O-N 3.41Å; N473-K476 PolarHBondContact O-N 3.39Å; N473-L477 WeakPolarHBondContact O-CB 3.35Å; N473-L477 PolarHBondContact O-N 3.22Å; N473-E684 VanDerWaalsContact ND2-CD 3.34Å; N473-E684 PolarHBondContact ND2-OE1 2.97Å; N473-L685 HydrophobicContact CB-CD2 3.73Å; N473-L685 HydrophobicContact CB-CG 4.09Å; N473-Q688 PolarHBondContact ND2-NE2 3.4Å; N473-Q688 PolarHBondContact ND2-OE1 3.39Å; N473-Q688 VanDerWaalsContact ND2-OE1 3.15Å
474	K	89.3	Confident	85.8	Confident	121 Å²	121	69.5 Å²	69.5	53%	0.526	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-45.7	172.4	-79.9	178.2	-179.4	175.2	0	112.1	I470 E471 A472 L477 Q478 L685	I470-K474 HydrophobicContact CG2-CD 4.08Å; I470-K474 HydrophobicContact CG2-CG 4.45Å; I470-K474 WeakPolarHBondContact O-CB 3.45Å; I470-K474 WeakPolarHBondContact O-CG 3.48Å; I470-K474 PolarHBondContact O-N 3.33Å; E471-K474 PolarHBondContact O-N 2.85Å; A472-K474 PolarHBondContact O-N 3.29Å; K474-L477 PolarHBondContact O-N 2.89Å; K474-Q478 WeakPolarHBondContact O-CB 3.3Å; K474-Q478 PolarHBondContact O-N 3.45Å; K474-L685 HydrophobicContact CG-CD1 4.02Å; K474-L685 HydrophobicContact CG-CD2 3.83Å
475	R	84.1	Confident	85.1	Confident	154 Å²	154	70.6 Å²	70.6	58%	0.581	36%	0.356	S	S	*	.	H	α-helix	trans	-62.8	-41.9	176.2	-69.2	174.9	-170.6	-171	4.2	111.4	E471 A472 Q478 T479	E471-R475 WeakPolarHBondContact O-CG 3.35Å; E471-R475 PolarHBondContact O-N 2.93Å; E471-R475 IonicContact OE1-CZ 3.08Å; E471-R475 IonicContact OE1-NE 3.64Å; E471-R475 IonicContact OE1-NH2 3.54Å; E471-R475 PolarHBondContact OE1-NH2 3.49Å; A472-R475 PolarHBondContact O-N 3.4Å; R475-Q478 PolarHBondContact O-N 3.31Å; R475-T479 PolarHBondContact O-N 2.89Å; R475-T479 PolarHBondContact O-OG1 2.92Å
476	K	82.5	Confident	84.7	Confident	62 Å²	62	71 Å²	71	27%	0.27	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-46.9	175.2	-162.6	-176.5	-177.9	-158.3	0	111	A472 N473 Q478 T479 M480 N668 E677 L681	A472-K476 PolarHBondContact O-N 2.85Å; N473-K476 PolarHBondContact O-N 3.39Å; K476-Q478 PolarHBondContact O-N 2.98Å; K476-T479 WeakPolarHBondContact O-CB 3.38Å; K476-T479 PolarHBondContact O-N 3.25Å; K476-M480 WeakPolarHBondContact O-CG 3.46Å; K476-M480 PolarHBondContact O-N 3.44Å; K476-N668 WeakPolarHBondContact CE-OD1 3.37Å; K476-N668 PolarHBondContact NZ-OD1 2.92Å; K476-E677 IonicContact NZ-OE1 2.73Å; K476-E677 PolarHBondContact NZ-OE1 3.26Å; K476-L681 HydrophobicContact CB-CD1 4.24Å; K476-L681 HydrophobicContact CD-CD1 3.98Å; K476-L681 HydrophobicContact CD-CD2 3.95Å; K476-L681 HydrophobicContact CG-CD1 3.92Å
477	L	86.9	Confident	84.1	Confident	17 Å²	17	75.9 Å²	75.9	9%	0.089	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-43.1	177	179.3	64.1	0	0	0	112.2	N473 K474 T479 M480 K481 I678 L681 Q682 L685	N473-L477 WeakPolarHBondContact O-CB 3.35Å; N473-L477 PolarHBondContact O-N 3.22Å; K474-L477 PolarHBondContact O-N 2.89Å; L477-T479 VanDerWaalsContact C-N 3.33Å; L477-T479 PolarHBondContact O-N 3.18Å; L477-M480 PolarHBondContact O-N 3.35Å; L477-K481 HydrophobicContact CD1-CD 4.49Å; L477-K481 HydrophobicContact CD1-CG 4.35Å; L477-K481 HydrophobicContact CG-CD 4.29Å; L477-K481 WeakPolarHBondContact O-CB 3.29Å; L477-K481 WeakPolarHBondContact O-CG 3.47Å; L477-K481 PolarHBondContact O-N 3.26Å; L477-I678 HydrophobicContact CD1-CB 4.37Å; L477-I678 HydrophobicContact CD1-CG1 4.38Å; L477-I678 HydrophobicContact CD1-CG2 3.97Å; L477-L681 HydrophobicContact CB-CB 4.36Å; L477-L681 HydrophobicContact CB-CD1 4.47Å; L477-L681 HydrophobicContact CD1-CB 4.09Å; L477-Q682 HydrophobicContact CD1-CG 3.97Å; L477-Q682 HydrophobicContact CD2-CG 3.91Å; L477-L685 HydrophobicContact CB-CD1 4.37Å; L477-L685 HydrophobicContact CD2-CD1 3.69Å
478	Q	84.3	Confident	83.8	Confident	134 Å²	134	71.9 Å²	71.9	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-62.6	-42	176.8	-174.5	176.2	-6.7	0	0	111.5	K474 R475 K476 K481 S482	K474-Q478 WeakPolarHBondContact O-CB 3.3Å; K474-Q478 PolarHBondContact O-N 3.45Å; R475-Q478 PolarHBondContact O-N 3.31Å; K476-Q478 PolarHBondContact O-N 2.98Å; Q478-K481 PolarHBondContact O-N 3.42Å; Q478-S482 WeakPolarHBondContact O-CB 3.36Å; Q478-S482 PolarHBondContact O-N 3.43Å
479	T	81.1	Confident	83.5	Confident	55 Å²	55	68.7 Å²	68.7	34%	0.337	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-48.5	175.3	-54.6	0	0	0	0	110.7	R475 K476 L477 K481 S482 S483	R475-T479 PolarHBondContact O-N 2.89Å; R475-T479 PolarHBondContact O-OG1 2.92Å; K476-T479 WeakPolarHBondContact O-CB 3.38Å; K476-T479 PolarHBondContact O-N 3.25Å; L477-T479 VanDerWaalsContact C-N 3.33Å; L477-T479 PolarHBondContact O-N 3.18Å; T479-K481 PolarHBondContact O-N 3.36Å; T479-S482 PolarHBondContact O-N 3.46Å; T479-S482 PolarHBondContact O-OG 2.64Å; T479-S483 PolarHBondContact O-N 3.46Å
480	M	81.2	Confident	83.1	Confident	7 Å²	7	67.7 Å²	67.7	3%	0.034	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-43.3	177.9	-66.8	-56.5	-71.9	0	0	112.5	K476 L477 S482 S483 V674 E677 I678 L681	K476-M480 WeakPolarHBondContact O-CG 3.46Å; K476-M480 PolarHBondContact O-N 3.44Å; L477-M480 PolarHBondContact O-N 3.35Å; M480-S482 VanDerWaalsContact C-N 3.33Å; M480-S482 PolarHBondContact O-N 2.92Å; M480-S483 WeakPolarHBondContact O-CB 3.39Å; M480-S483 PolarHBondContact O-N 3.21Å; M480-S483 VanDerWaalsContact O-N 3.1Å; M480-S483 PolarHBondContact O-OG 3.23Å; M480-V674 HydrophobicContact CE-CG1 4.33Å; M480-E677 HydrophobicContact CE-CB 3.91Å; M480-E677 HydrophobicContact CE-CG 3.81Å; M480-E677 HydrophobicContact CG-CG 4.48Å; M480-I678 HydrophobicContact CB-CD1 4.45Å; M480-I678 HydrophobicContact CB-CG1 3.85Å; M480-L681 HydrophobicContact CG-CD1 4.15Å
481	K	83.8	Confident	82.9	Confident	93 Å²	93	67.3 Å²	67.3	40%	0.404	32%	0.319	S	S	.	.	H	α-helix	trans	-60	-42.7	174.4	-77.3	-179.1	176.4	-175.8	0	112.1	L477 Q478 T479 S483 R484 I678	L477-K481 HydrophobicContact CD1-CD 4.49Å; L477-K481 HydrophobicContact CD1-CG 4.35Å; L477-K481 HydrophobicContact CG-CD 4.29Å; L477-K481 WeakPolarHBondContact O-CB 3.29Å; L477-K481 WeakPolarHBondContact O-CG 3.47Å; L477-K481 PolarHBondContact O-N 3.26Å; Q478-K481 PolarHBondContact O-N 3.42Å; T479-K481 PolarHBondContact O-N 3.36Å; K481-S483 PolarHBondContact O-N 3.43Å; K481-R484 WeakPolarHBondContact O-CB 3.37Å; K481-R484 WeakPolarHBondContact O-CG 3.48Å; K481-R484 PolarHBondContact O-N 2.96Å; K481-I678 HydrophobicContact CG-CD1 4.15Å
482	S	78.6	Confident	82.5	Confident	29 Å²	29	63.7 Å²	63.7	20%	0.203	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-27.9	177.7	81.4	0	0	0	0	112.6	Q478 T479 M480 R484 S485	Q478-S482 WeakPolarHBondContact O-CB 3.36Å; Q478-S482 PolarHBondContact O-N 3.43Å; T479-S482 PolarHBondContact O-N 3.46Å; T479-S482 PolarHBondContact O-OG 2.64Å; M480-S482 VanDerWaalsContact C-N 3.33Å; M480-S482 PolarHBondContact O-N 2.92Å; S482-R484 PolarHBondContact O-N 3.24Å; S482-S485 PolarHBondContact O-N 2.84Å; S482-S485 PolarHBondContact O-OG 3.23Å
483	S	77	Confident	82.3	Confident	8 Å²	8	67.7 Å²	67.7	6%	0.056	32%	0.318	C	S	.	.	H	α-helix	trans	-70.5	-14.6	178.9	82.8	0	0	0	0	114.4	T479 M480 K481 S485 N486	T479-S483 PolarHBondContact O-N 3.46Å; M480-S483 WeakPolarHBondContact O-CB 3.39Å; M480-S483 PolarHBondContact O-N 3.21Å; M480-S483 VanDerWaalsContact O-N 3.1Å; M480-S483 PolarHBondContact O-OG 3.23Å; K481-S483 PolarHBondContact O-N 3.43Å; S483-S485 PolarHBondContact O-N 3.41Å; S483-N486 CarbonylContact O-C 3.51Å; S483-N486 PolarHBondContact O-N 3.06Å
484	R	79.2	Confident	82.3	Confident	142 Å²	142	70.5 Å²	70.5	54%	0.536	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-35	172.2	-70.5	179.8	170.2	171.2	-0.9	112.5	K481 S482 V674 E675 I678	K481-R484 WeakPolarHBondContact O-CB 3.37Å; K481-R484 WeakPolarHBondContact O-CG 3.48Å; K481-R484 PolarHBondContact O-N 2.96Å; S482-R484 PolarHBondContact O-N 3.24Å; R484-V674 HydrophobicContact CG-CG1 4.36Å; R484-E675 IonicContact CZ-OE1 3.12Å; R484-E675 IonicContact CZ-OE2 3.45Å; R484-E675 IonicContact NE-OE1 3.41Å; R484-E675 PolarHBondContact NE-OE1 3.46Å; R484-E675 IonicContact NE-OE2 2.6Å; R484-E675 VanDerWaalsContact NH2-CD 3.27Å; R484-E675 IonicContact NH2-OE1 2.76Å; R484-E675 PolarHBondContact NH2-OE1 2.87Å; R484-E675 IonicContact NH2-OE2 3.6Å; R484-E675 PolarHBondContact NH2-OE2 3.47Å; R484-I678 HydrophobicContact CG-CD1 4.32Å
485	S	75.6	Confident	82.2	Confident	99 Å²	99	64.7 Å²	64.7	69%	0.692	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-33.1	-178.3	64.9	0	0	0	0	113.3	S482 S483	S482-S485 PolarHBondContact O-N 2.84Å; S482-S485 PolarHBondContact O-OG 3.23Å; S483-S485 PolarHBondContact O-N 3.41Å
486	N	80.7	Confident	82.5	Confident	52 Å²	52	58.8 Å²	58.8	28%	0.278	29%	0.286	S	S	.	.			trans	-148.9	111.3	-177.3	-172.8	-18.8	0	0	0	110.8	S483 L488 R489	S483-N486 CarbonylContact O-C 3.51Å; S483-N486 PolarHBondContact O-N 3.06Å; N486-L488 PolarHBondContact O-N 3.48Å; N486-L488 VanDerWaalsContact O-N 3.16Å; N486-L488 VanDerWaalsContact OD1-CB 3.23Å; N486-L488 WeakPolarHBondContact OD1-CB 3.34Å; N486-L488 PolarHBondContact OD1-N 3.46Å; N486-R489 HydrophobicContact CB-CG 4.25Å; N486-R489 WeakPolarHBondContact O-CB 3.36Å; N486-R489 PolarHBondContact O-N 2.95Å
487	R	80.4	Confident	82.8	Confident	120 Å²	120	58.4 Å²	58.4	45%	0.453	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-58	-27.9	-179.9	-171.6	176.6	177.8	-170.2	-2	113	R489 R490 Y521	R487-R489 PolarHBondContact O-N 3.18Å; R487-R490 WeakPolarHBondContact O-CB 3.48Å; R487-R490 WeakPolarHBondContact O-CG 3.19Å; R487-R490 PolarHBondContact O-N 2.68Å; R487-Y521 HydrophobicContact CB-CE2 4.35Å; R487-Y521 HydrophobicContact CG-CE2 4.34Å
488	L	83.6	Confident	83	Confident	24 Å²	24	57.6 Å²	57.6	13%	0.126	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-64	-25.6	178	-67.3	164.5	0	0	0	113	N486 R490 F491 P496 L499 Y521	N486-L488 PolarHBondContact O-N 3.48Å; N486-L488 VanDerWaalsContact O-N 3.16Å; N486-L488 VanDerWaalsContact OD1-CB 3.23Å; N486-L488 WeakPolarHBondContact OD1-CB 3.34Å; N486-L488 PolarHBondContact OD1-N 3.46Å; L488-R490 PolarHBondContact O-N 3.41Å; L488-F491 PolarHBondContact O-N 3.44Å; L488-F491 VanDerWaalsContact O-N 3.1Å; L488-P496 HydrophobicContact CB-CG 4.12Å; L488-L499 HydrophobicContact CD1-CD1 3.71Å; L488-L499 HydrophobicContact CD2-CD1 3.5Å; L488-L499 VanDerWaalsContact CD2-CD1 3.5Å; L488-L499 HydrophobicContact CG-CD1 4.14Å; L488-Y521 HydrophobicContact CD2-CD1 3.62Å; L488-Y521 HydrophobicContact CD2-CD2 3.55Å; L488-Y521 HydrophobicContact CD2-CE1 3.74Å; L488-Y521 HydrophobicContact CD2-CE2 3.67Å; L488-Y521 HydrophobicContact CD2-CG 3.51Å; L488-Y521 HydrophobicContact CG-CD2 4.3Å; L488-Y521 HydrophobicContact CG-CE1 4.49Å; L488-Y521 HydrophobicContact CG-CE2 4.01Å
489	R	83.8	Confident	83.4	Confident	93 Å²	93	53.1 Å²	53.1	35%	0.351	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-67	-16.3	177.7	-67.9	-174.8	175.9	-160	1.5	113.4	N486 R487 F491 G492 P496	N486-R489 HydrophobicContact CB-CG 4.25Å; N486-R489 WeakPolarHBondContact O-CB 3.36Å; N486-R489 PolarHBondContact O-N 2.95Å; R487-R489 PolarHBondContact O-N 3.18Å; R489-F491 PolarHBondContact O-N 3.35Å; R489-G492 CarbonylContact O-C 3.43Å; R489-G492 PolarHBondContact O-N 2.85Å; R489-P496 HydrophobicContact CG-CG 3.78Å
490	R	81.7	Confident	83.9	Confident	26 Å²	26	54.1 Å²	54.1	10%	0.098	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62.1	-29.6	171.3	-64.5	-170	-174.4	179.6	3.2	112.4	R487 L488 G492 Y669 S671	R487-R490 WeakPolarHBondContact O-CB 3.48Å; R487-R490 WeakPolarHBondContact O-CG 3.19Å; R487-R490 PolarHBondContact O-N 2.68Å; L488-R490 PolarHBondContact O-N 3.41Å; R490-G492 VanDerWaalsContact C-N 3.25Å; R490-G492 PolarHBondContact O-N 2.98Å; R490-Y669 PolarHBondContact NH1-O 3.44Å; R490-Y669 WeakPolarHBondContact O-CE1 3.38Å; R490-S671 PolarHBondContact NH1-O 3.49Å; R490-S671 PolarHBondContact NH2-O 2.82Å
491	F	84.4	Confident	84.4	Confident	3 Å²	3	54.7 Å²	54.7	1%	0.013	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-89.8	11.2	177.3	-56.4	-87.4	0	0	0	112.3	L488 R489 M495 P518 G520 Y521 L542 M543 Y669	L488-F491 PolarHBondContact O-N 3.44Å; L488-F491 VanDerWaalsContact O-N 3.1Å; R489-F491 PolarHBondContact O-N 3.35Å; F491-M495 HydrophobicContact CB-CE 4Å; F491-M495 HydrophobicContact CB-CG 4.14Å; F491-M495 WeakPolarHBondContact O-CE 3.49Å; F491-P518 HydrophobicContact CB-CB 4.37Å; F491-P518 HydrophobicContact CB-CG 4.05Å; F491-P518 HydrophobicContact CD1-CB 4.31Å; F491-P518 HydrophobicContact CD1-CG 4.39Å; F491-P518 HydrophobicContact CD2-CG 4.23Å; F491-P518 HydrophobicContact CG-CB 4.31Å; F491-P518 HydrophobicContact CG-CG 3.96Å; F491-G520 VanDerWaalsContact CZ-C 3.4Å; F491-G520 WeakPolarHBondContact CZ-O 3.46Å; F491-Y521 HydrophobicContact CE2-CD2 4.2Å; F491-L542 WeakPolarHBondContact CD1-O 3.43Å; F491-L542 HydrophobicContact CE1-CB 4.36Å; F491-L542 WeakPolarHBondContact CE1-O 3.23Å; F491-M543 HydrophobicContact CD1-CG 4.39Å; F491-M543 WeakPolarHBondContact O-CE 3.43Å; F491-Y669 AromaticContact CD1-CD1 3.55Å; F491-Y669 HydrophobicContact CD1-CD1 3.55Å; F491-Y669 HydrophobicContact CD1-CE1 4.03Å; F491-Y669 HydrophobicContact CD1-CG 4.4Å; F491-Y669 AromaticContact CE1-CD1 3.59Å; F491-Y669 HydrophobicContact CE1-CD1 3.59Å; F491-Y669 HydrophobicContact CE1-CE1 4.46Å; F491-Y669 HydrophobicContact CE1-CG 4.02Å; F491-Y669 HydrophobicContact CG-CD1 4.23Å; F491-Y669 HydrophobicContact CZ-CD1 4.29Å
492	G	81.6	Confident	84.9	Confident	22 Å²	22	50.4 Å²	50.4	23%	0.227	27%	0.267	C	S	.	.			trans	126.9	147.8	176.3	0	0	0	0	0	113	R489 R490 H494 M495	R489-G492 CarbonylContact O-C 3.43Å; R489-G492 PolarHBondContact O-N 2.85Å; R490-G492 VanDerWaalsContact C-N 3.25Å; R490-G492 PolarHBondContact O-N 2.98Å; G492-H494 VanDerWaalsContact C-N 3.28Å; G492-H494 PolarHBondContact O-N 3.42Å; G492-M495 VanDerWaalsContact O-CB 3.28Å; G492-M495 WeakPolarHBondContact O-CB 3.13Å; G492-M495 PolarHBondContact O-N 3.47Å; G492-M495 VanDerWaalsContact O-N 3.11Å
493	E	81.1	Confident	85.6	Confident	139 Å²	139	53.5 Å²	53.5	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-40.4	-177.9	-174.8	176.9	177.1	0	0	112.8
494	H	86.4	Confident	86.3	Confident	80 Å²	80	58 Å²	58	37%	0.37	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.4	-178.3	-55.1	-50	0	0	0	114.5	G492 A497 L498 V563 Y564	G492-H494 VanDerWaalsContact C-N 3.28Å; G492-H494 PolarHBondContact O-N 3.42Å; H494-A497 WeakPolarHBondContact O-CB 3.47Å; H494-A497 PolarHBondContact O-N 3.11Å; H494-L498 PolarHBondContact O-N 2.94Å; H494-V563 HydrophobicContact CB-CG1 3.8Å; H494-Y564 HydrophobicContact CB-CE1 4.07Å; H494-Y564 HydrophobicContact CB-CE2 4.4Å
495	M	89.1	Confident	86.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-42.6	-175.9	-168.1	62.6	65.5	0	0	113.6	F491 G492 A497 L498 L499 P518 F545 P570	F491-M495 HydrophobicContact CB-CE 4Å; F491-M495 HydrophobicContact CB-CG 4.14Å; F491-M495 WeakPolarHBondContact O-CE 3.49Å; G492-M495 VanDerWaalsContact O-CB 3.28Å; G492-M495 WeakPolarHBondContact O-CB 3.13Å; G492-M495 PolarHBondContact O-N 3.47Å; G492-M495 VanDerWaalsContact O-N 3.11Å; M495-A497 VanDerWaalsContact C-N 3.29Å; M495-A497 PolarHBondContact O-N 3.48Å; M495-L498 PolarHBondContact O-N 3.39Å; M495-L498 HydrophobicContact SD-CD2 4.21Å; M495-L499 HydrophobicContact CG-CD1 4.45Å; M495-L499 PolarHBondContact O-N 2.98Å; M495-P518 HydrophobicContact CE-CB 4.35Å; M495-P518 HydrophobicContact CE-CG 4.44Å; M495-P518 HydrophobicContact CG-CG 4.07Å; M495-P518 HydrophobicContact SD-CB 4.33Å; M495-P518 HydrophobicContact SD-CG 3.99Å; M495-F545 HydrophobicContact CE-CE2 4.25Å; M495-F545 HydrophobicContact SD-CE2 3.81Å; M495-F545 HydrophobicContact SD-CZ 3.68Å; M495-P570 HydrophobicContact CE-CG 3.9Å
496	P	88.6	Confident	87.8	Confident	29 Å²	29	49 Å²	49	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-37	175.8	-22.5	34.1	0	0	0	113	L488 R489 L499 S500	L488-P496 HydrophobicContact CB-CG 4.12Å; R489-P496 HydrophobicContact CG-CG 3.78Å; P496-L499 PolarHBondContact O-N 3.3Å; P496-S500 WeakPolarHBondContact O-CB 3.3Å; P496-S500 PolarHBondContact O-N 3.49Å
497	A	89.2	Confident	88.3	Confident	55 Å²	55	51 Å²	51	46%	0.455	27%	0.272	S	S	.	.	H	α-helix	trans	-68.4	-38.8	177.7	0	0	0	0	0	111.4	H494 M495 S500 A501 V563	H494-A497 WeakPolarHBondContact O-CB 3.47Å; H494-A497 PolarHBondContact O-N 3.11Å; M495-A497 VanDerWaalsContact C-N 3.29Å; M495-A497 PolarHBondContact O-N 3.48Å; A497-S500 PolarHBondContact O-N 3.01Å; A497-A501 WeakPolarHBondContact O-CB 3.49Å; A497-A501 PolarHBondContact O-N 2.7Å; A497-V563 HydrophobicContact CB-CG1 4.3Å
498	L	91.9	Very high	88.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-46.7	174	178.2	63.3	0	0	0	111.6	H494 M495 S500 A501 I502 F545 L559 M560 V563 Y564 P570	H494-L498 PolarHBondContact O-N 2.94Å; M495-L498 PolarHBondContact O-N 3.39Å; M495-L498 HydrophobicContact SD-CD2 4.21Å; L498-S500 VanDerWaalsContact C-N 3.34Å; L498-S500 PolarHBondContact O-N 3.14Å; L498-A501 PolarHBondContact O-N 2.97Å; L498-I502 HydrophobicContact CD1-CD1 4.19Å; L498-I502 HydrophobicContact CD1-CG1 4.36Å; L498-I502 HydrophobicContact CD2-CD1 4.49Å; L498-I502 HydrophobicContact CG-CD1 3.91Å; L498-I502 HydrophobicContact CG-CG1 4.5Å; L498-I502 VanDerWaalsContact O-CG1 3.3Å; L498-I502 WeakPolarHBondContact O-CG1 3.33Å; L498-I502 PolarHBondContact O-N 3.32Å; L498-F545 HydrophobicContact CD2-CE2 3.91Å; L498-F545 HydrophobicContact CD2-CZ 3.81Å; L498-L559 HydrophobicContact CD1-CB 4.47Å; L498-M560 HydrophobicContact CD1-CG 3.75Å; L498-M560 HydrophobicContact CD2-CE 3.85Å; L498-M560 HydrophobicContact CD2-CG 3.94Å; L498-V563 HydrophobicContact CB-CG1 4.21Å; L498-V563 HydrophobicContact CD1-CG2 4.38Å; L498-Y564 HydrophobicContact CB-CE2 4.3Å; L498-Y564 HydrophobicContact CD2-CE2 3.97Å; L498-P570 HydrophobicContact CD2-CG 4.36Å
499	L	91.9	Very high	89.1	Confident	39 Å²	39	52.4 Å²	52.4	20%	0.204	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-40	179.2	-71.7	172.9	0	0	0	112.4	L488 M495 P496 A501 I502 E503 G517 F545	L488-L499 HydrophobicContact CD1-CD1 3.71Å; L488-L499 HydrophobicContact CD2-CD1 3.5Å; L488-L499 VanDerWaalsContact CD2-CD1 3.5Å; L488-L499 HydrophobicContact CG-CD1 4.14Å; M495-L499 HydrophobicContact CG-CD1 4.45Å; M495-L499 PolarHBondContact O-N 2.98Å; P496-L499 PolarHBondContact O-N 3.3Å; L499-A501 VanDerWaalsContact C-N 3.34Å; L499-A501 PolarHBondContact O-N 2.96Å; L499-I502 HydrophobicContact CD2-CD1 4.37Å; L499-I502 PolarHBondContact O-N 2.9Å; L499-E503 PolarHBondContact O-N 3.13Å; L499-G517 WeakPolarHBondContact CD2-O 3.46Å; L499-F545 HydrophobicContact CD2-CE1 3.86Å; L499-F545 HydrophobicContact CD2-CZ 4.11Å
500	S	91.8	Very high	89.5	Confident	77 Å²	77	52.5 Å²	52.5	54%	0.538	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-44.5	172.9	-172.4	0	0	0	0	111.7	P496 A497 L498 I502 E503 E504	P496-S500 WeakPolarHBondContact O-CB 3.3Å; P496-S500 PolarHBondContact O-N 3.49Å; A497-S500 PolarHBondContact O-N 3.01Å; L498-S500 VanDerWaalsContact C-N 3.34Å; L498-S500 PolarHBondContact O-N 3.14Å; S500-I502 VanDerWaalsContact C-N 3.33Å; S500-I502 PolarHBondContact O-N 3.33Å; S500-E503 PolarHBondContact O-N 3.08Å; S500-E504 WeakPolarHBondContact O-CB 3.41Å; S500-E504 PolarHBondContact O-N 3.42Å
501	A	92.3	Very high	90.1	Very high	18 Å²	18	51.9 Å²	51.9	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-33.7	176.9	0	0	0	0	0	113.1	A497 L498 L499 A505 L559 V563	A497-A501 WeakPolarHBondContact O-CB 3.49Å; A497-A501 PolarHBondContact O-N 2.7Å; L498-A501 PolarHBondContact O-N 2.97Å; L499-A501 VanDerWaalsContact C-N 3.34Å; L499-A501 PolarHBondContact O-N 2.96Å; A501-A505 WeakPolarHBondContact O-CB 3.27Å; A501-A505 PolarHBondContact O-N 3.37Å; A501-L559 HydrophobicContact CB-CD2 4.48Å; A501-V563 HydrophobicContact CB-CG2 4.47Å
502	I	93.8	Very high	90.4	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-67.4	-44.3	174	-69.7	166.1	0	0	0	110.4	L498 L499 S500 E504 A505 N506 F511 P515 F545 L556 L559	L498-I502 HydrophobicContact CD1-CD1 4.19Å; L498-I502 HydrophobicContact CD1-CG1 4.36Å; L498-I502 HydrophobicContact CD2-CD1 4.49Å; L498-I502 HydrophobicContact CG-CD1 3.91Å; L498-I502 HydrophobicContact CG-CG1 4.5Å; L498-I502 VanDerWaalsContact O-CG1 3.3Å; L498-I502 WeakPolarHBondContact O-CG1 3.33Å; L498-I502 PolarHBondContact O-N 3.32Å; L499-I502 HydrophobicContact CD2-CD1 4.37Å; L499-I502 PolarHBondContact O-N 2.9Å; S500-I502 VanDerWaalsContact C-N 3.33Å; S500-I502 PolarHBondContact O-N 3.33Å; I502-E504 VanDerWaalsContact C-N 3.34Å; I502-E504 PolarHBondContact O-N 3.37Å; I502-A505 PolarHBondContact O-N 3.49Å; I502-N506 VanDerWaalsContact O-CB 3.3Å; I502-N506 WeakPolarHBondContact O-CB 3.27Å; I502-N506 PolarHBondContact O-N 2.97Å; I502-F511 HydrophobicContact CG2-CE2 4.12Å; I502-P515 HydrophobicContact CG2-CG 3.79Å; I502-F545 HydrophobicContact CD1-CD1 4.18Å; I502-F545 HydrophobicContact CD1-CE1 3.67Å; I502-F545 HydrophobicContact CD1-CZ 4.38Å; I502-L556 HydrophobicContact CD1-CD1 3.47Å; I502-L556 VanDerWaalsContact CD1-CD1 3.47Å; I502-L556 HydrophobicContact CG1-CD1 3.7Å; I502-L559 HydrophobicContact CG1-CD1 4.26Å
503	E	93.3	Very high	90.9	Very high	95 Å²	95	63.3 Å²	63.3	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177	-157.3	67.8	-126.9	0	0	111.5	L499 S500 N506 S507 K514	L499-E503 PolarHBondContact O-N 3.13Å; S500-E503 PolarHBondContact O-N 3.08Å; E503-N506 PolarHBondContact O-N 3.42Å; E503-S507 WeakPolarHBondContact O-CB 3.47Å; E503-S507 PolarHBondContact O-N 3.23Å; E503-S507 PolarHBondContact O-OG 3.43Å; E503-K514 IonicContact OE1-NZ 3.89Å; E503-K514 PolarHBondContact OE1-NZ 3.14Å; E503-K514 WeakPolarHBondContact OE2-CE 3.16Å; E503-K514 IonicContact OE2-NZ 2.68Å; E503-K514 PolarHBondContact OE2-NZ 3.47Å
504	E	92.8	Very high	91.5	Very high	101 Å²	101	59.6 Å²	59.6	47%	0.472	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-43.7	176.8	-167.5	-169.4	160.4	0	0	111.6	S500 I502 S507 K508	S500-E504 WeakPolarHBondContact O-CB 3.41Å; S500-E504 PolarHBondContact O-N 3.42Å; I502-E504 VanDerWaalsContact C-N 3.34Å; I502-E504 PolarHBondContact O-N 3.37Å; E504-S507 WeakPolarHBondContact CA-OG 3.21Å; E504-S507 PolarHBondContact O-OG 3.42Å; E504-K508 HydrophobicContact CG-CD 4.34Å; E504-K508 WeakPolarHBondContact O-CB 3.44Å; E504-K508 VanDerWaalsContact O-CG 3.28Å; E504-K508 WeakPolarHBondContact O-CG 3.43Å; E504-K508 PolarHBondContact O-N 3.05Å; E504-K508 VanDerWaalsContact O-N 3.15Å; E504-K508 IonicContact OE1-NZ 2.71Å; E504-K508 PolarHBondContact OE1-NZ 3.38Å
505	A	91.3	Very high	91.9	Very high	4 Å²	4	56 Å²	56	3%	0.033	30%	0.304	C	S	.	.	H	α-helix	trans	-67.5	-35.9	176.5	0	0	0	0	0	112.4	A501 I502 K508 G509 H510 F511 L559	A501-A505 WeakPolarHBondContact O-CB 3.27Å; A501-A505 PolarHBondContact O-N 3.37Å; I502-A505 PolarHBondContact O-N 3.49Å; A505-K508 PolarHBondContact O-N 3.36Å; A505-G509 PolarHBondContact O-N 3.12Å; A505-H510 HydrophobicContact CB-CB 4.33Å; A505-H510 WeakPolarHBondContact O-CB 3.46Å; A505-H510 PolarHBondContact O-N 2.85Å; A505-F511 HydrophobicContact CB-CD2 4.12Å; A505-F511 HydrophobicContact CB-CE2 3.68Å; A505-L559 HydrophobicContact CB-CD1 3.66Å; A505-L559 HydrophobicContact CB-CD2 4.46Å
506	N	93.2	Very high	92.1	Very high	49 Å²	49	59.6 Å²	59.6	26%	0.262	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-45.6	177.1	-172.7	65.2	0	0	0	112	I502 E503 K508 G509 F511 K514	I502-N506 VanDerWaalsContact O-CB 3.3Å; I502-N506 WeakPolarHBondContact O-CB 3.27Å; I502-N506 PolarHBondContact O-N 2.97Å; E503-N506 PolarHBondContact O-N 3.42Å; N506-K508 PolarHBondContact O-N 2.91Å; N506-G509 PolarHBondContact O-N 3.19Å; N506-F511 HydrophobicContact CB-CD2 4.1Å; N506-K514 HydrophobicContact CB-CG 4.44Å; N506-K514 WeakPolarHBondContact OD1-CB 3.46Å
507	S	91.9	Very high	92.3	Very high	94 Å²	94	58.7 Å²	58.7	66%	0.657	31%	0.313	S	S	*	.	H	α-helix	trans	-63	-27.7	175.4	54.7	0	0	0	0	113.2	E503 E504 G509	E503-S507 WeakPolarHBondContact O-CB 3.47Å; E503-S507 PolarHBondContact O-N 3.23Å; E503-S507 PolarHBondContact O-OG 3.43Å; E504-S507 WeakPolarHBondContact CA-OG 3.21Å; E504-S507 PolarHBondContact O-OG 3.42Å; S507-G509 PolarHBondContact O-N 3.12Å
508	K	91.4	Very high	92.5	Very high	116 Å²	116	56 Å²	56	50%	0.504	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	1.8	171.8	-70.8	173.7	177.9	177	0	113.9	E504 A505 N506 H510	E504-K508 HydrophobicContact CG-CD 4.34Å; E504-K508 WeakPolarHBondContact O-CB 3.44Å; E504-K508 VanDerWaalsContact O-CG 3.28Å; E504-K508 WeakPolarHBondContact O-CG 3.43Å; E504-K508 PolarHBondContact O-N 3.05Å; E504-K508 VanDerWaalsContact O-N 3.15Å; E504-K508 IonicContact OE1-NZ 2.71Å; E504-K508 PolarHBondContact OE1-NZ 3.38Å; A505-K508 PolarHBondContact O-N 3.36Å; N506-K508 PolarHBondContact O-N 2.91Å; K508-H510 VanDerWaalsContact C-N 3.29Å; K508-H510 PolarHBondContact O-N 2.99Å
509	G	90.4	Very high	92.5	Very high	58 Å²	58	56.1 Å²	56.1	60%	0.598	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	21	179.6	0	0	0	0	0	114.3	A505 N506 S507 F511	A505-G509 PolarHBondContact O-N 3.12Å; N506-G509 PolarHBondContact O-N 3.19Å; S507-G509 PolarHBondContact O-N 3.12Å; G509-F511 VanDerWaalsContact C-N 3.31Å
510	H	91.2	Very high	92.4	Very high	94 Å²	94	54.2 Å²	54.2	44%	0.435	28%	0.282	S	S	.	.			trans	-76.7	-18.2	179	-63.7	167.8	0	0	0	113.4	A505 K508 V555	A505-H510 HydrophobicContact CB-CB 4.33Å; A505-H510 WeakPolarHBondContact O-CB 3.46Å; A505-H510 PolarHBondContact O-N 2.85Å; K508-H510 VanDerWaalsContact C-N 3.29Å; K508-H510 PolarHBondContact O-N 2.99Å; H510-V555 HydrophobicContact CB-CG1 4.24Å
511	F	93.8	Very high	92.4	Very high	13 Å²	13	55.1 Å²	55.1	6%	0.057	27%	0.274	C	S	.	.			trans	-103.7	139.2	173.8	-69.6	-68.7	0	0	0	109.9	I502 A505 N506 G509 P515 D552 V555 L556 L559	I502-F511 HydrophobicContact CG2-CE2 4.12Å; A505-F511 HydrophobicContact CB-CD2 4.12Å; A505-F511 HydrophobicContact CB-CE2 3.68Å; N506-F511 HydrophobicContact CB-CD2 4.1Å; G509-F511 VanDerWaalsContact C-N 3.31Å; F511-P515 HydrophobicContact CD1-CG 4.37Å; F511-P515 HydrophobicContact CE1-CG 3.91Å; F511-P515 HydrophobicContact CE2-CG 4.17Å; F511-P515 HydrophobicContact CZ-CG 3.8Å; F511-D552 VanDerWaalsContact CA-OD1 3.3Å; F511-D552 WeakPolarHBondContact CA-OD1 3.38Å; F511-D552 HydrophobicContact CD1-CB 3.91Å; F511-D552 HydrophobicContact CE1-CB 4.46Å; F511-D552 WeakPolarHBondContact CE1-O 3.37Å; F511-V555 HydrophobicContact CD1-CB 4.03Å; F511-V555 HydrophobicContact CD1-CG1 3.97Å; F511-V555 HydrophobicContact CE1-CB 3.57Å; F511-V555 HydrophobicContact CE1-CG1 3.48Å; F511-V555 VanDerWaalsContact CE1-CG1 3.48Å; F511-V555 HydrophobicContact CE2-CG1 4.15Å; F511-V555 HydrophobicContact CZ-CB 4.15Å; F511-V555 HydrophobicContact CZ-CG1 3.58Å; F511-L556 HydrophobicContact CE1-CB 4.15Å; F511-L556 HydrophobicContact CZ-CB 4.28Å; F511-L559 HydrophobicContact CE2-CD1 3.98Å; F511-L559 HydrophobicContact CZ-CD1 3.8Å
512	R	90.9	Very high	92.3	Very high	182 Å²	182	57.1 Å²	57.1	69%	0.687	28%	0.282	S	S	*	.	S	Bend	trans	-73.5	-46.2	167.3	-63.1	-174.7	179.9	176.7	6.7	110	D551 D552	R512-D551 IonicContact CZ-OD2 2.65Å; R512-D551 IonicContact NH2-OD2 3.5Å; R512-D552 PolarHBondContact N-OD1 3.25Å
513	H	91.9	Very high	92.3	Very high	83 Å²	83	57.3 Å²	57.3	38%	0.384	28%	0.283	S	S	.	.	S	Bend	trans	-128.3	130	170.8	-65.2	-77.2	0	0	0	110.4	P515 D548 D552 F577	H513-P515 WeakPolarHBondContact O-CD 3.38Å; H513-D548 HydrophobicContact CB-CB 3.74Å; H513-D548 IonicContact CD2-OD2 2.94Å; H513-D548 PolarHBondContact CD2-OD2 3.16Å; H513-D548 VanDerWaalsContact CD2-OD2 3.26Å; H513-D552 PolarHBondContact N-OD2 3.42Å; H513-F577 HydrophobicContact CB-CD2 3.9Å; H513-F577 HydrophobicContact CB-CE2 3.96Å
514	K	93.9	Very high	92.1	Very high	61 Å²	61	54.1 Å²	54.1	27%	0.265	28%	0.276	S	S	.	.			trans	-61.1	121.8	-178.8	-179	176.5	175.9	176.5	0	110.6	E503 N506	E503-K514 IonicContact OE1-NZ 3.89Å; E503-K514 PolarHBondContact OE1-NZ 3.14Å; E503-K514 WeakPolarHBondContact OE2-CE 3.16Å; E503-K514 IonicContact OE2-NZ 2.68Å; E503-K514 PolarHBondContact OE2-NZ 3.47Å; N506-K514 HydrophobicContact CB-CG 4.44Å; N506-K514 WeakPolarHBondContact OD1-CB 3.46Å
515	P	95.1	Very high	92	Very high	5 Å²	5	51 Å²	51	3%	0.032	26%	0.262	C	S	.	.			trans	-62.8	147.1	177.8	25.5	-33.5	0	0	0	111.8	I502 F511 H513 T546 L556	I502-P515 HydrophobicContact CG2-CG 3.79Å; F511-P515 HydrophobicContact CD1-CG 4.37Å; F511-P515 HydrophobicContact CE1-CG 3.91Å; F511-P515 HydrophobicContact CE2-CG 4.17Å; F511-P515 HydrophobicContact CZ-CG 3.8Å; H513-P515 WeakPolarHBondContact O-CD 3.38Å; P515-T546 CarbonylContact C-O 3.53Å; P515-T546 VanDerWaalsContact CA-O 3.28Å; P515-T546 WeakPolarHBondContact CA-O 3.31Å; P515-T546 WeakPolarHBondContact CB-O 3.48Å; P515-L556 HydrophobicContact CB-CD2 3.9Å; P515-L556 HydrophobicContact CG-CD1 4.27Å; P515-L556 HydrophobicContact CG-CD2 4.26Å
516	R	94.1	Very high	92	Very high	76 Å²	76	57.5 Å²	57.5	29%	0.287	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-107.4	124.8	-179.5	-59.7	-58.6	-164.7	-131.4	2.4	110.8	L522 F545 T546 F577 D605 I607 V608	R516-L522 HydrophobicContact CB-CD1 4.03Å; R516-F545 CarbonylContact O-C 3.54Å; R516-F545 VanDerWaalsContact O-CA 3.27Å; R516-F545 WeakPolarHBondContact O-CA 3.46Å; R516-T546 HydrophobicContact CB-CG2 3.7Å; R516-T546 HydrophobicContact CG-CG2 4.43Å; R516-T546 PolarHBondContact N-O 2.81Å; R516-T546 PolarHBondContact O-N 3.31Å; R516-F577 HydrophobicContact CG-CZ 4.46Å; R516-D605 WeakPolarHBondContact CD-OD2 3.36Å; R516-D605 IonicContact CZ-OD2 3.16Å; R516-D605 IonicContact NE-OD2 2.75Å; R516-D605 PolarHBondContact NE-OD2 3.38Å; R516-D605 IonicContact NH2-OD2 3.67Å; R516-I607 HydrophobicContact CG-CG2 4.45Å; R516-V608 HydrophobicContact CB-CG2 4.22Å
517	G	91.5	Very high	91.8	Very high	9 Å²	9	57.3 Å²	57.3	9%	0.093	29%	0.289	C	S	.	.			trans	167.4	-179.2	172.3	0	0	0	0	0	112.6	L499 F545	L499-G517 WeakPolarHBondContact CD2-O 3.46Å; G517-F545 VanDerWaalsContact CA-CD1 3.47Å; G517-F545 WeakPolarHBondContact O-CE1 3.4Å
518	P	93.3	Very high	91.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.287	C	S	.	.			cis	-63	136.8	-9.5	27.5	-33.1	0	0	0	110.6	F491 M495 G520 Y521 A544 F545	F491-P518 HydrophobicContact CB-CB 4.37Å; F491-P518 HydrophobicContact CB-CG 4.05Å; F491-P518 HydrophobicContact CD1-CB 4.31Å; F491-P518 HydrophobicContact CD1-CG 4.39Å; F491-P518 HydrophobicContact CD2-CG 4.23Å; F491-P518 HydrophobicContact CG-CB 4.31Å; F491-P518 HydrophobicContact CG-CG 3.96Å; M495-P518 HydrophobicContact CE-CB 4.35Å; M495-P518 HydrophobicContact CE-CG 4.44Å; M495-P518 HydrophobicContact CG-CG 4.07Å; M495-P518 HydrophobicContact SD-CB 4.33Å; M495-P518 HydrophobicContact SD-CG 3.99Å; P518-G520 PolarHBondContact O-N 2.82Å; P518-G520 VanDerWaalsContact O-N 3.14Å; P518-Y521 WeakPolarHBondContact O-CB 3.31Å; P518-Y521 PolarHBondContact O-N 3.17Å; P518-A544 CarbonylContact C-O 3.6Å; P518-A544 VanDerWaalsContact CA-O 3.29Å; P518-A544 WeakPolarHBondContact CA-O 3.33Å; P518-F545 HydrophobicContact CB-CE2 4.2Å; P518-F545 HydrophobicContact CB-CZ 4.39Å
519	L	93.3	Very high	91.4	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-58.3	-34.6	-170	-57.8	179.8	0	0	0	112.6	Y521 L522 I523 L541 A544 T546 I573 V608 L612	L519-Y521 PolarHBondContact O-N 2.98Å; L519-L522 PolarHBondContact O-N 3.13Å; L519-I523 PolarHBondContact O-N 3.27Å; L519-L541 WeakPolarHBondContact CB-O 3.3Å; L519-A544 HydrophobicContact CD1-CB 4.23Å; L519-A544 HydrophobicContact CG-CB 4.48Å; L519-A544 WeakPolarHBondContact CG-O 3.36Å; L519-A544 PolarHBondContact N-O 3.09Å; L519-T546 HydrophobicContact CD2-CG2 4.02Å; L519-I573 HydrophobicContact CD1-CD1 4.38Å; L519-V608 HydrophobicContact CD2-CG1 4.23Å; L519-V608 HydrophobicContact CD2-CG2 4.21Å; L519-L612 HydrophobicContact CD1-CD2 4.01Å
520	G	90.1	Very high	91.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-65.7	-18.9	178.1	0	0	0	0	0	114.5	F491 P518 L542	F491-G520 VanDerWaalsContact CZ-C 3.4Å; F491-G520 WeakPolarHBondContact CZ-O 3.46Å; P518-G520 PolarHBondContact O-N 2.82Å; P518-G520 VanDerWaalsContact O-N 3.14Å; G520-L542 WeakPolarHBondContact CA-O 3.46Å; G520-L542 PolarHBondContact N-O 3.4Å
521	Y	90.3	Very high	91.4	Very high	96 Å²	96	51 Å²	51	38%	0.376	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-83.9	-25.3	173.1	-178	-103.5	0	0	0	112.5	R487 L488 F491 P518 L519 I523	R487-Y521 HydrophobicContact CB-CE2 4.35Å; R487-Y521 HydrophobicContact CG-CE2 4.34Å; L488-Y521 HydrophobicContact CD2-CD1 3.62Å; L488-Y521 HydrophobicContact CD2-CD2 3.55Å; L488-Y521 HydrophobicContact CD2-CE1 3.74Å; L488-Y521 HydrophobicContact CD2-CE2 3.67Å; L488-Y521 HydrophobicContact CD2-CG 3.51Å; L488-Y521 HydrophobicContact CG-CD2 4.3Å; L488-Y521 HydrophobicContact CG-CE1 4.49Å; L488-Y521 HydrophobicContact CG-CE2 4.01Å; F491-Y521 HydrophobicContact CE2-CD2 4.2Å; P518-Y521 WeakPolarHBondContact O-CB 3.31Å; P518-Y521 PolarHBondContact O-N 3.17Å; L519-Y521 PolarHBondContact O-N 2.98Å; Y521-I523 VanDerWaalsContact C-N 3.3Å
522	L	91.8	Very high	91.2	Very high	60 Å²	60	51 Å²	51	31%	0.314	24%	0.244	S	C	.	.	S	Bend	trans	-90.6	7.7	-177.8	-58.6	177.4	0	0	0	113	R516 L519 V608	R516-L522 HydrophobicContact CB-CD1 4.03Å; L519-L522 PolarHBondContact O-N 3.13Å; L522-V608 HydrophobicContact CB-CG1 4.35Å; L522-V608 HydrophobicContact CB-CG2 4.12Å; L522-V608 HydrophobicContact CD1-CG2 3.71Å
523	I	92.2	Very high	91.3	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.3	177.7	65.3	-179.2	0	0	0	110.4	L519 Y521 L538 L542 L601 I603 V608 L612 L670	L519-I523 PolarHBondContact O-N 3.27Å; Y521-I523 VanDerWaalsContact C-N 3.3Å; I523-L538 HydrophobicContact CD1-CD1 3.61Å; I523-L542 HydrophobicContact CD1-CD2 4.18Å; I523-L601 HydrophobicContact CB-CD2 4.42Å; I523-L601 HydrophobicContact CD1-CD1 4.45Å; I523-L601 HydrophobicContact CD1-CD2 4.08Å; I523-L601 HydrophobicContact CG1-CD2 4.48Å; I523-I603 HydrophobicContact CB-CG1 4.47Å; I523-I603 HydrophobicContact CG2-CD1 4.21Å; I523-I603 HydrophobicContact CG2-CG1 3.93Å; I523-I603 HydrophobicContact CG2-CG2 4.36Å; I523-V608 HydrophobicContact CG2-CG1 3.84Å; I523-L612 HydrophobicContact CG2-CD1 3.99Å; I523-L670 HydrophobicContact CG1-CD2 4.36Å
524	G	89.9	Confident	91.4	Very high	29 Å²	29	38.3 Å²	38.3	30%	0.299	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	162.1	167.7	0	0	0	0	0	111.2	L601 D602	G524-L601 WeakPolarHBondContact O-CA 3.49Å; G524-L601 WeakPolarHBondContact O-CD2 3.5Å; G524-D602 PolarHBondContact N-O 2.84Å; G524-D602 PolarHBondContact O-N 2.65Å
525	L	90.7	Very high	91.3	Very high	36 Å²	36	35.5 Å²	35.5	19%	0.188	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.7	175.7	-173.2	68.5	0	0	0	109.1	D527 L530 A531 V534 L601	L525-D527 WeakPolarHBondContact CD2-O 3.27Å; L525-D527 VanDerWaalsContact CG-O 3.28Å; L525-D527 WeakPolarHBondContact CG-O 3.42Å; L525-L530 HydrophobicContact CD2-CB 4.48Å; L525-A531 VanDerWaalsContact CD2-CA 3.42Å; L525-A531 HydrophobicContact CD2-CB 3.82Å; L525-V534 HydrophobicContact CD1-CB 4.48Å; L525-V534 HydrophobicContact CD1-CG2 3.71Å; L525-L601 HydrophobicContact CD1-CD2 4.12Å
526	K	90.6	Very high	91.2	Very high	139 Å²	139	35.9 Å²	35.9	60%	0.604	18%	0.183	S	C	*	.	S	Bend	trans	-72.1	-34.9	-178.3	-65.3	176.3	-175.4	167.2	0	112.7	Q599 A600 L601	K526-Q599 PolarHBondContact NZ-O 3.36Å; K526-A600 WeakPolarHBondContact CG-O 3.46Å; K526-A600 PolarHBondContact N-O 2.73Å; K526-L601 WeakPolarHBondContact CE-O 3.29Å
527	D	89.3	Confident	91.2	Very high	46 Å²	46	32.5 Å²	32.5	25%	0.246	17%	0.171	C	C	.	.			trans	-119.4	105.8	177.9	-176.1	-8.1	0	0	0	110.5	L525 E529 L530 K625	L525-D527 WeakPolarHBondContact CD2-O 3.27Å; L525-D527 VanDerWaalsContact CG-O 3.28Å; L525-D527 WeakPolarHBondContact CG-O 3.42Å; D527-E529 PolarHBondContact O-N 3.01Å; D527-E529 VanDerWaalsContact O-N 3.14Å; D527-E529 WeakPolarHBondContact OD1-CB 3.47Å; D527-E529 PolarHBondContact OD1-N 3.47Å; D527-L530 HydrophobicContact CB-CD1 4.1Å; D527-L530 HydrophobicContact CB-CG 4.31Å; D527-L530 PolarHBondContact O-N 2.91Å; D527-L530 VanDerWaalsContact O-N 3.1Å; D527-K625 IonicContact OD1-NZ 3.86Å; D527-K625 WeakPolarHBondContact OD2-CE 3.44Å; D527-K625 IonicContact OD2-NZ 2.8Å; D527-K625 PolarHBondContact OD2-NZ 3.5Å
528	P	86.9	Confident	91.2	Very high	95 Å²	95	32.1 Å²	32.1	62%	0.617	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	-56.6	-26.8	-180	-25.9	34.8	0	0	0	114.7	L530 A531	P528-L530 PolarHBondContact O-N 3.36Å; P528-A531 VanDerWaalsContact O-CB 3.26Å; P528-A531 WeakPolarHBondContact O-CB 3.23Å; P528-A531 PolarHBondContact O-N 2.92Å
529	E	88.6	Confident	91.1	Very high	125 Å²	125	37.7 Å²	37.7	58%	0.584	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-66.7	-20.6	179.9	-64.5	-173.2	166.6	0	0	112.8	D527 A531 K625	D527-E529 PolarHBondContact O-N 3.01Å; D527-E529 VanDerWaalsContact O-N 3.14Å; D527-E529 WeakPolarHBondContact OD1-CB 3.47Å; D527-E529 PolarHBondContact OD1-N 3.47Å; E529-A531 VanDerWaalsContact C-N 3.34Å; E529-K625 IonicContact OE2-NZ 3.79Å; E529-K625 PolarHBondContact OE2-NZ 3.04Å
530	L	90.4	Very high	90.9	Very high	5 Å²	5	43 Å²	43	3%	0.026	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-90.4	3.7	179.3	-62.2	176.3	0	0	0	112.9	L525 D527 P528 L532 A533 V534 L623 K625	L525-L530 HydrophobicContact CD2-CB 4.48Å; D527-L530 HydrophobicContact CB-CD1 4.1Å; D527-L530 HydrophobicContact CB-CG 4.31Å; D527-L530 PolarHBondContact O-N 2.91Å; D527-L530 VanDerWaalsContact O-N 3.1Å; P528-L530 PolarHBondContact O-N 3.36Å; L530-L532 VanDerWaalsContact C-N 3.31Å; L530-L532 PolarHBondContact O-N 3.11Å; L530-A533 WeakPolarHBondContact O-CB 3.5Å; L530-A533 PolarHBondContact O-N 3.13Å; L530-A533 VanDerWaalsContact O-N 3.11Å; L530-V534 WeakPolarHBondContact O-CG2 3.3Å; L530-V534 PolarHBondContact O-N 3.39Å; L530-L623 HydrophobicContact CB-CD1 4.37Å; L530-L623 HydrophobicContact CD1-CB 4.01Å; L530-L623 HydrophobicContact CD1-CD1 3.92Å; L530-L623 HydrophobicContact CD2-CB 4.31Å; L530-K625 HydrophobicContact CD2-CG 3.88Å
531	A	89.9	Confident	91.1	Very high	3 Å²	3	43 Å²	43	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-43.8	-174.5	0	0	0	0	0	112.7	L525 P528 E529 V534 E535 P667 L670	L525-A531 VanDerWaalsContact CD2-CA 3.42Å; L525-A531 HydrophobicContact CD2-CB 3.82Å; P528-A531 VanDerWaalsContact O-CB 3.26Å; P528-A531 WeakPolarHBondContact O-CB 3.23Å; P528-A531 PolarHBondContact O-N 2.92Å; E529-A531 VanDerWaalsContact C-N 3.34Å; A531-V534 PolarHBondContact O-N 3.42Å; A531-E535 WeakPolarHBondContact O-CB 3.41Å; A531-E535 WeakPolarHBondContact O-CG 3.25Å; A531-E535 PolarHBondContact O-N 3.24Å; A531-P667 HydrophobicContact CB-CB 3.92Å; A531-P667 HydrophobicContact CB-CG 4.14Å; A531-L670 HydrophobicContact CB-CB 4.13Å
532	L	91.1	Very high	91.1	Very high	13 Å²	13	38.5 Å²	38.5	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-64.9	-44.6	177.9	178.3	58.3	0	0	0	111.7	L530 V534 E535 V536 D650 Q664 P667	L530-L532 VanDerWaalsContact C-N 3.31Å; L530-L532 PolarHBondContact O-N 3.11Å; L532-V534 VanDerWaalsContact C-N 3.33Å; L532-V534 PolarHBondContact O-N 3.35Å; L532-E535 PolarHBondContact O-N 3.24Å; L532-V536 HydrophobicContact CD1-CG2 3.83Å; L532-V536 HydrophobicContact CG-CG2 4.39Å; L532-V536 WeakPolarHBondContact O-CB 3.15Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.46Å; L532-V536 PolarHBondContact O-N 3.45Å; L532-D650 WeakPolarHBondContact CD2-O 3.35Å; L532-Q664 HydrophobicContact CD1-CB 4.23Å; L532-Q664 HydrophobicContact CD1-CG 3.75Å; L532-P667 HydrophobicContact CB-CB 4.42Å
533	A	92.9	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-45.3	178.1	0	0	0	0	0	111.9	L530 C537 L623 F647 S648	L530-A533 WeakPolarHBondContact O-CB 3.5Å; L530-A533 PolarHBondContact O-N 3.13Å; L530-A533 VanDerWaalsContact O-N 3.11Å; A533-C537 VanDerWaalsContact O-CB 3.3Å; A533-C537 WeakPolarHBondContact O-CB 3.38Å; A533-C537 PolarHBondContact O-N 3.28Å; A533-L623 HydrophobicContact CB-CD2 3.87Å; A533-F647 HydrophobicContact CB-CB 4.02Å; A533-S648 WeakPolarHBondContact CB-O 3.38Å
534	V	93.3	Very high	91.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.1	-40.9	178.1	175.2	0	0	0	0	111.5	L525 L530 A531 L532 C537 L538 L601 L623 L670	L525-V534 HydrophobicContact CD1-CB 4.48Å; L525-V534 HydrophobicContact CD1-CG2 3.71Å; L530-V534 WeakPolarHBondContact O-CG2 3.3Å; L530-V534 PolarHBondContact O-N 3.39Å; A531-V534 PolarHBondContact O-N 3.42Å; L532-V534 VanDerWaalsContact C-N 3.33Å; L532-V534 PolarHBondContact O-N 3.35Å; V534-C537 WeakPolarHBondContact O-CB 3.47Å; V534-C537 PolarHBondContact O-N 3.24Å; V534-L538 HydrophobicContact CG1-CD1 3.87Å; V534-L538 HydrophobicContact CG1-CG 4.3Å; V534-L538 WeakPolarHBondContact O-CG 3.47Å; V534-L538 PolarHBondContact O-N 3.29Å; V534-L601 HydrophobicContact CG1-CD2 3.87Å; V534-L623 HydrophobicContact CG2-CD1 3.76Å; V534-L623 HydrophobicContact CG2-CD2 4.48Å; V534-L670 HydrophobicContact CB-CD1 4.19Å; V534-L670 HydrophobicContact CG1-CD1 3.68Å
535	E	92.6	Very high	91.5	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-44.2	177.9	-77.2	-173.8	-157.1	0	0	112.9	A531 L532 C537 L538 K539 L542 Q664 P667 N668 Y669 L670	A531-E535 WeakPolarHBondContact O-CB 3.41Å; A531-E535 WeakPolarHBondContact O-CG 3.25Å; A531-E535 PolarHBondContact O-N 3.24Å; L532-E535 PolarHBondContact O-N 3.24Å; E535-C537 PolarHBondContact O-N 3.4Å; E535-L538 PolarHBondContact O-N 2.67Å; E535-K539 WeakPolarHBondContact O-CA 3.42Å; E535-K539 PolarHBondContact O-N 3.29Å; E535-L542 HydrophobicContact CB-CD1 4.04Å; E535-L542 HydrophobicContact CG-CD1 3.8Å; E535-Q664 PolarHBondContact OE2-NE2 3.15Å; E535-P667 WeakPolarHBondContact OE1-CA 3.43Å; E535-P667 VanDerWaalsContact OE1-CB 3.26Å; E535-P667 WeakPolarHBondContact OE1-CB 3.33Å; E535-P667 WeakPolarHBondContact OE2-CA 3.44Å; E535-N668 VanDerWaalsContact CD-N 3.28Å; E535-N668 PolarHBondContact OE1-N 2.99Å; E535-N668 PolarHBondContact OE2-N 3.49Å; E535-Y669 HydrophobicContact CG-CD2 4.39Å; E535-Y669 WeakPolarHBondContact OE1-CA 3.36Å; E535-Y669 PolarHBondContact OE1-N 2.94Å; E535-L670 HydrophobicContact CG-CB 4.26Å; E535-L670 HydrophobicContact CG-CD1 4.06Å; E535-L670 HydrophobicContact CG-CG 4.05Å; E535-L670 PolarHBondContact OE1-N 3.23Å
536	V	92.6	Very high	91.7	Very high	13 Å²	13	34.7 Å²	34.7	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-67.1	-29.4	177.7	177.4	0	0	0	0	111.1	L532 K539 F647 G651 Q664	L532-V536 HydrophobicContact CD1-CG2 3.83Å; L532-V536 HydrophobicContact CG-CG2 4.39Å; L532-V536 WeakPolarHBondContact O-CB 3.15Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.46Å; L532-V536 PolarHBondContact O-N 3.45Å; V536-K539 WeakPolarHBondContact O-CE 3.47Å; V536-K539 WeakPolarHBondContact O-CG 3.43Å; V536-F647 HydrophobicContact CG1-CD1 4.4Å; V536-F647 HydrophobicContact CG1-CE1 4.03Å; V536-G651 WeakPolarHBondContact CG1-O 3.29Å; V536-Q664 HydrophobicContact CG2-CB 4.12Å
537	C	93.3	Very high	92	Very high	5 Å²	5	28 Å²	28	3%	0.034	14%	0.138	C	C	.	.	H	α-helix	trans	-68.7	-50.5	172.9	-179.9	0	0	0	0	112.2	A533 V534 E535 F647	A533-C537 VanDerWaalsContact O-CB 3.3Å; A533-C537 WeakPolarHBondContact O-CB 3.38Å; A533-C537 PolarHBondContact O-N 3.28Å; V534-C537 WeakPolarHBondContact O-CB 3.47Å; V534-C537 PolarHBondContact O-N 3.24Å; E535-C537 PolarHBondContact O-N 3.4Å; C537-F647 HydrophobicContact CB-CD2 4Å; C537-F647 HydrophobicContact CB-CE1 4.37Å; C537-F647 HydrophobicContact CB-CE2 3.71Å; C537-F647 HydrophobicContact CB-CG 4.44Å; C537-F647 HydrophobicContact CB-CZ 3.91Å
538	L	92.5	Very high	92.2	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-81.2	-29.7	-173.2	-63.5	-176.6	0	0	0	113.3	I523 V534 E535 Y540 L541 L542 L612 K616 I618	I523-L538 HydrophobicContact CD1-CD1 3.61Å; V534-L538 HydrophobicContact CG1-CD1 3.87Å; V534-L538 HydrophobicContact CG1-CG 4.3Å; V534-L538 WeakPolarHBondContact O-CG 3.47Å; V534-L538 PolarHBondContact O-N 3.29Å; E535-L538 PolarHBondContact O-N 2.67Å; L538-Y540 PolarHBondContact O-N 3.42Å; L538-L541 HydrophobicContact CB-CB 4.49Å; L538-L541 VanDerWaalsContact O-CB 3.27Å; L538-L541 WeakPolarHBondContact O-CB 3.45Å; L538-L541 WeakPolarHBondContact O-CG 3.33Å; L538-L541 PolarHBondContact O-N 3Å; L538-L542 HydrophobicContact CB-CD2 3.95Å; L538-L542 HydrophobicContact CB-CG 3.92Å; L538-L542 HydrophobicContact CD1-CD2 3.81Å; L538-L612 HydrophobicContact CD2-CD2 4.14Å; L538-K616 HydrophobicContact CD2-CG 4.43Å; L538-I618 HydrophobicContact CD2-CG2 3.96Å
539	K	90.3	Very high	92.5	Very high	117 Å²	117	24 Å²	24	51%	0.509	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	46.4	-120.7	178.8	-55.7	-169	177.8	-176.1	0	112.1	E535 V536 L541 L542	E535-K539 WeakPolarHBondContact O-CA 3.42Å; E535-K539 PolarHBondContact O-N 3.29Å; V536-K539 WeakPolarHBondContact O-CE 3.47Å; V536-K539 WeakPolarHBondContact O-CG 3.43Å; K539-L541 PolarHBondContact O-N 3.25Å; K539-L541 VanDerWaalsContact O-N 3.13Å; K539-L542 PolarHBondContact O-N 2.94Å
540	Y	90.4	Very high	92.8	Very high	112 Å²	112	25.7 Å²	25.7	44%	0.439	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-61.4	-21.4	-177	71.1	-92.8	0	0	0	113.6	L538 L542 M543 A544 T571	L538-Y540 PolarHBondContact O-N 3.42Å; Y540-L542 PolarHBondContact O-N 3.35Å; Y540-M543 PolarHBondContact O-N 3.28Å; Y540-M543 VanDerWaalsContact O-N 3.14Å; Y540-A544 PolarHBondContact O-N 3.11Å; Y540-T571 HydrophobicContact CD2-CG2 4.4Å; Y540-T571 HydrophobicContact CE2-CG2 4.31Å
541	L	92.8	Very high	92.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-65.8	-26.2	-179.9	-64.9	173.3	0	0	0	112.6	L519 L538 K539 M543 A544 I573 L612 Q615 K616	L519-L541 WeakPolarHBondContact CB-O 3.3Å; L538-L541 HydrophobicContact CB-CB 4.49Å; L538-L541 VanDerWaalsContact O-CB 3.27Å; L538-L541 WeakPolarHBondContact O-CB 3.45Å; L538-L541 WeakPolarHBondContact O-CG 3.33Å; L538-L541 PolarHBondContact O-N 3Å; K539-L541 PolarHBondContact O-N 3.25Å; K539-L541 VanDerWaalsContact O-N 3.13Å; L541-M543 PolarHBondContact O-N 2.85Å; L541-A544 HydrophobicContact CD2-CB 4.36Å; L541-A544 WeakPolarHBondContact O-CB 3.23Å; L541-A544 PolarHBondContact O-N 3.11Å; L541-I573 HydrophobicContact CD2-CD1 3.48Å; L541-I573 VanDerWaalsContact CD2-CD1 3.48Å; L541-L612 HydrophobicContact CB-CD2 4.32Å; L541-L612 HydrophobicContact CD1-CD2 4.37Å; L541-Q615 HydrophobicContact CD1-CB 4.01Å; L541-Q615 HydrophobicContact CD2-CB 4.26Å; L541-K616 HydrophobicContact CD1-CB 4.41Å; L541-K616 HydrophobicContact CD1-CD 4.03Å; L541-K616 HydrophobicContact CD1-CG 3.22Å
542	L	91.8	Very high	93.1	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-58.3	-30.5	175.1	-65	171.2	0	0	0	112.3	F491 G520 I523 E535 L538 K539 Y540 Y669 L670	F491-L542 WeakPolarHBondContact CD1-O 3.43Å; F491-L542 HydrophobicContact CE1-CB 4.36Å; F491-L542 WeakPolarHBondContact CE1-O 3.23Å; G520-L542 WeakPolarHBondContact CA-O 3.46Å; G520-L542 PolarHBondContact N-O 3.4Å; I523-L542 HydrophobicContact CD1-CD2 4.18Å; E535-L542 HydrophobicContact CB-CD1 4.04Å; E535-L542 HydrophobicContact CG-CD1 3.8Å; L538-L542 HydrophobicContact CB-CD2 3.95Å; L538-L542 HydrophobicContact CB-CG 3.92Å; L538-L542 HydrophobicContact CD1-CD2 3.81Å; K539-L542 PolarHBondContact O-N 2.94Å; Y540-L542 PolarHBondContact O-N 3.35Å; L542-Y669 HydrophobicContact CD1-CD2 3.49Å; L542-Y669 VanDerWaalsContact CD1-CD2 3.49Å; L542-Y669 HydrophobicContact CD1-CE2 4.06Å; L542-Y669 HydrophobicContact CD1-CG 4.07Å; L542-L670 HydrophobicContact CD2-CD1 4.4Å
543	M	91.3	Very high	93.3	Very high	49 Å²	49	29.1 Å²	29.1	24%	0.241	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-96.8	-6.5	177.4	-64.8	177.6	71.7	0	0	112.7	F491 Y540 L541 P570 Y669	F491-M543 HydrophobicContact CD1-CG 4.39Å; F491-M543 WeakPolarHBondContact O-CE 3.43Å; Y540-M543 PolarHBondContact O-N 3.28Å; Y540-M543 VanDerWaalsContact O-N 3.14Å; L541-M543 PolarHBondContact O-N 2.85Å; M543-P570 WeakPolarHBondContact O-CB 3.35Å; M543-Y669 HydrophobicContact CG-CE1 4.28Å; M543-Y669 HydrophobicContact SD-CE1 4.46Å
544	A	94.4	Very high	93.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.157	C	C	.	.			trans	-73.1	161.9	-173	0	0	0	0	0	112.7	P518 L519 Y540 L541 T571 I573	P518-A544 CarbonylContact C-O 3.6Å; P518-A544 VanDerWaalsContact CA-O 3.29Å; P518-A544 WeakPolarHBondContact CA-O 3.33Å; L519-A544 HydrophobicContact CD1-CB 4.23Å; L519-A544 HydrophobicContact CG-CB 4.48Å; L519-A544 WeakPolarHBondContact CG-O 3.36Å; L519-A544 PolarHBondContact N-O 3.09Å; Y540-A544 PolarHBondContact O-N 3.11Å; L541-A544 HydrophobicContact CD2-CB 4.36Å; L541-A544 WeakPolarHBondContact O-CB 3.23Å; L541-A544 PolarHBondContact O-N 3.11Å; A544-T571 CarbonylContact C-O 3.2Å; A544-T571 WeakPolarHBondContact CA-O 3.41Å; A544-I573 HydrophobicContact CB-CD1 3.83Å; A544-I573 HydrophobicContact CB-CG1 4.43Å
545	F	96	Very high	93.4	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.3	170.6	-75.8	-104	0	0	0	109.1	M495 L498 L499 I502 R516 G517 P518 L556 M560 P570 T571 I572 I573	M495-F545 HydrophobicContact CE-CE2 4.25Å; M495-F545 HydrophobicContact SD-CE2 3.81Å; M495-F545 HydrophobicContact SD-CZ 3.68Å; L498-F545 HydrophobicContact CD2-CE2 3.91Å; L498-F545 HydrophobicContact CD2-CZ 3.81Å; L499-F545 HydrophobicContact CD2-CE1 3.86Å; L499-F545 HydrophobicContact CD2-CZ 4.11Å; I502-F545 HydrophobicContact CD1-CD1 4.18Å; I502-F545 HydrophobicContact CD1-CE1 3.67Å; I502-F545 HydrophobicContact CD1-CZ 4.38Å; R516-F545 CarbonylContact O-C 3.54Å; R516-F545 VanDerWaalsContact O-CA 3.27Å; R516-F545 WeakPolarHBondContact O-CA 3.46Å; G517-F545 VanDerWaalsContact CA-CD1 3.47Å; G517-F545 WeakPolarHBondContact O-CE1 3.4Å; P518-F545 HydrophobicContact CB-CE2 4.2Å; P518-F545 HydrophobicContact CB-CZ 4.39Å; F545-L556 HydrophobicContact CB-CD2 3.78Å; F545-L556 HydrophobicContact CD1-CD2 4.39Å; F545-L556 HydrophobicContact CG-CD2 4.24Å; F545-M560 HydrophobicContact CB-CE 4.3Å; F545-M560 HydrophobicContact CD2-CE 3.54Å; F545-M560 HydrophobicContact CE2-CE 4Å; F545-M560 HydrophobicContact CG-CE 3.92Å; F545-P570 HydrophobicContact CD2-CB 3.86Å; F545-P570 HydrophobicContact CE2-CB 3.96Å; F545-P570 HydrophobicContact CE2-CG 4.25Å; F545-T571 PolarHBondContact N-O 3.41Å; F545-I572 CarbonylContact O-C 3.55Å; F545-I572 WeakPolarHBondContact O-CA 3.48Å; F545-I573 PolarHBondContact O-N 3.1Å
546	T	95.4	Very high	93.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.7	171.2	-175.4	0	0	0	0	111.7	P515 R516 L519 I573 S575 F577 I607 C611	P515-T546 CarbonylContact C-O 3.53Å; P515-T546 VanDerWaalsContact CA-O 3.28Å; P515-T546 WeakPolarHBondContact CA-O 3.31Å; P515-T546 WeakPolarHBondContact CB-O 3.48Å; R516-T546 HydrophobicContact CB-CG2 3.7Å; R516-T546 HydrophobicContact CG-CG2 4.43Å; R516-T546 PolarHBondContact N-O 2.81Å; R516-T546 PolarHBondContact O-N 3.31Å; L519-T546 HydrophobicContact CD2-CG2 4.02Å; T546-I573 CarbonylContact C-O 3.53Å; T546-I573 WeakPolarHBondContact CA-O 3.35Å; T546-I573 PolarHBondContact OG1-O 3.27Å; T546-S575 PolarHBondContact OG1-OG 3.41Å; T546-F577 HydrophobicContact CG2-CE1 4.13Å; T546-F577 HydrophobicContact CG2-CZ 4.42Å; T546-I607 HydrophobicContact CG2-CG2 3.93Å; T546-C611 HydrophobicContact CG2-CB 4.44Å
547	C	95.9	Very high	93.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.3	180	-74.1	0	0	0	0	109.6	E553 L556 I572 I573 T574 S575	C547-E553 HydrophobicContact CB-CB 4.37Å; C547-L556 VanDerWaalsContact SG-CD2 3.5Å; C547-I572 HydrophobicContact CB-CG2 4.28Å; C547-I573 PolarHBondContact N-O 3.08Å; C547-T574 CarbonylContact O-C 3.48Å; C547-T574 WeakPolarHBondContact O-CA 3.38Å; C547-S575 PolarHBondContact O-N 3.24Å; C547-S575 VanDerWaalsContact O-O 3.05Å
548	D	94.4	Very high	93.5	Very high	27 Å²	27	44.2 Å²	44.2	14%	0.144	21%	0.205	C	C	.	.	S	Bend	trans	-67.2	-41.6	180	175.4	71.6	0	0	0	112.5	H513 S575 Q576 F577	H513-D548 HydrophobicContact CB-CB 3.74Å; H513-D548 IonicContact CD2-OD2 2.94Å; H513-D548 PolarHBondContact CD2-OD2 3.16Å; H513-D548 VanDerWaalsContact CD2-OD2 3.26Å; D548-S575 WeakPolarHBondContact CA-O 3.49Å; D548-S575 CarbonylContact O-C 3.41Å; D548-Q576 WeakPolarHBondContact O-CA 3.46Å; D548-Q576 PolarHBondContact O-N 3.29Å; D548-F577 HydrophobicContact CB-CB 4.33Å; D548-F577 HydrophobicContact CB-CD1 3.86Å; D548-F577 HydrophobicContact CB-CD2 3.77Å; D548-F577 HydrophobicContact CB-CE1 4.09Å; D548-F577 HydrophobicContact CB-CE2 3.99Å; D548-F577 HydrophobicContact CB-CG 3.71Å; D548-F577 HydrophobicContact CB-CZ 4.16Å; D548-F577 WeakPolarHBondContact OD1-CB 3.17Å; D548-F577 PolarHBondContact OD1-N 2.93Å
549	N	93.7	Very high	93.5	Very high	28 Å²	28	45.1 Å²	45.1	15%	0.15	21%	0.21	C	C	.	.	S	Bend	trans	-144.5	166.9	-172.2	59.6	73.8	0	0	0	112.1	D551 D552 E553 T574	N549-D551 VanDerWaalsContact C-N 3.26Å; N549-D551 PolarHBondContact O-N 3.27Å; N549-D551 PolarHBondContact OD1-N 3.26Å; N549-D551 VanDerWaalsContact OD1-N 3.13Å; N549-D552 PolarHBondContact ND2-OD2 3.26Å; N549-D552 PolarHBondContact O-N 3.33Å; N549-D552 PolarHBondContact OD1-N 3.18Å; N549-E553 PolarHBondContact O-N 3.37Å; N549-T574 VanDerWaalsContact C-CG2 3.48Å
550	Y	94.2	Very high	93.6	Very high	162 Å²	162	39.8 Å²	39.8	64%	0.635	19%	0.187	S	C	*	.	H	α-helix	trans	-67.2	-22.5	-177.9	-70.2	-72.4	0	0	0	113.8	E553 K554 T574	Y550-E553 VanDerWaalsContact CD1-OE2 3.31Å; Y550-E553 WeakPolarHBondContact CD1-OE2 3.42Å; Y550-E553 WeakPolarHBondContact O-CB 3.48Å; Y550-K554 VanDerWaalsContact O-CG 3.31Å; Y550-K554 WeakPolarHBondContact O-CG 3.21Å; Y550-K554 PolarHBondContact O-N 3.23Å; Y550-K554 VanDerWaalsContact O-N 3.1Å; Y550-T574 HydrophobicContact CD1-CG2 4.1Å; Y550-T574 HydrophobicContact CE1-CG2 4.21Å; Y550-T574 HydrophobicContact CG-CG2 4.28Å
551	D	92.6	Very high	93.6	Very high	68 Å²	68	36.4 Å²	36.4	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-76	-44.8	177.5	-68.1	-30	0	0	0	110.7	R512 N549 E553 K554 V555	R512-D551 IonicContact CZ-OD2 2.65Å; R512-D551 IonicContact NH2-OD2 3.5Å; N549-D551 VanDerWaalsContact C-N 3.26Å; N549-D551 PolarHBondContact O-N 3.27Å; N549-D551 PolarHBondContact OD1-N 3.26Å; N549-D551 VanDerWaalsContact OD1-N 3.13Å; D551-E553 VanDerWaalsContact C-N 3.26Å; D551-E553 PolarHBondContact O-N 3.25Å; D551-K554 WeakPolarHBondContact O-CB 3.4Å; D551-K554 PolarHBondContact O-N 2.64Å; D551-K554 VanDerWaalsContact O-N 3.16Å; D551-K554 IonicContact OD1-NZ 3.9Å; D551-K554 PolarHBondContact OD1-NZ 2.84Å; D551-K554 VanDerWaalsContact OD1-NZ 3.08Å; D551-V555 WeakPolarHBondContact O-CG2 3.45Å; D551-V555 PolarHBondContact O-N 2.94Å; D551-V555 VanDerWaalsContact O-N 3.13Å
552	D	94.1	Very high	93.3	Very high	2 Å²	2	43 Å²	43	1%	0.011	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-37.4	171	-68.7	-26.7	0	0	0	111	F511 R512 H513 N549 K554 V555 L556	F511-D552 VanDerWaalsContact CA-OD1 3.3Å; F511-D552 WeakPolarHBondContact CA-OD1 3.38Å; F511-D552 HydrophobicContact CD1-CB 3.91Å; F511-D552 HydrophobicContact CE1-CB 4.46Å; F511-D552 WeakPolarHBondContact CE1-O 3.37Å; R512-D552 PolarHBondContact N-OD1 3.25Å; H513-D552 PolarHBondContact N-OD2 3.42Å; N549-D552 PolarHBondContact ND2-OD2 3.26Å; N549-D552 PolarHBondContact O-N 3.33Å; N549-D552 PolarHBondContact OD1-N 3.18Å; D552-K554 PolarHBondContact O-N 3.34Å; D552-V555 PolarHBondContact O-N 2.82Å; D552-L556 WeakPolarHBondContact O-CB 3.42Å; D552-L556 PolarHBondContact O-N 3.39Å
553	E	95.1	Very high	93.1	Very high	23 Å²	23	44.4 Å²	44.4	11%	0.107	22%	0.219	C	C	.	.	H	α-helix	trans	-59	-44.5	173.5	-164	-155.2	172.2	0	0	112.1	C547 N549 Y550 D551 V555 L556 K557 I572 T574	C547-E553 HydrophobicContact CB-CB 4.37Å; N549-E553 PolarHBondContact O-N 3.37Å; Y550-E553 VanDerWaalsContact CD1-OE2 3.31Å; Y550-E553 WeakPolarHBondContact CD1-OE2 3.42Å; Y550-E553 WeakPolarHBondContact O-CB 3.48Å; D551-E553 VanDerWaalsContact C-N 3.26Å; D551-E553 PolarHBondContact O-N 3.25Å; E553-V555 VanDerWaalsContact C-N 3.35Å; E553-V555 PolarHBondContact O-N 3.08Å; E553-L556 PolarHBondContact O-N 3.05Å; E553-K557 HydrophobicContact CG-CD 4.35Å; E553-K557 WeakPolarHBondContact O-CB 3.44Å; E553-K557 WeakPolarHBondContact O-CG 3.31Å; E553-K557 PolarHBondContact O-N 3.29Å; E553-K557 WeakPolarHBondContact OE1-CE 3.21Å; E553-K557 IonicContact OE1-NZ 3.99Å; E553-K557 PolarHBondContact OE1-NZ 3.32Å; E553-K557 IonicContact OE2-NZ 2.68Å; E553-I572 HydrophobicContact CG-CB 4.34Å; E553-I572 HydrophobicContact CG-CG2 3.65Å; E553-T574 VanDerWaalsContact CD-OG1 3.3Å; E553-T574 WeakPolarHBondContact CG-OG1 3.43Å
554	K	94.2	Very high	92.8	Very high	128 Å²	128	42.8 Å²	42.8	56%	0.557	21%	0.211	S	C	*	.	H	α-helix	trans	-62.1	-42.5	177.3	-72.2	165.8	-167.3	160.2	0	111.6	Y550 D551 D552 K557 S558	Y550-K554 VanDerWaalsContact O-CG 3.31Å; Y550-K554 WeakPolarHBondContact O-CG 3.21Å; Y550-K554 PolarHBondContact O-N 3.23Å; Y550-K554 VanDerWaalsContact O-N 3.1Å; D551-K554 WeakPolarHBondContact O-CB 3.4Å; D551-K554 PolarHBondContact O-N 2.64Å; D551-K554 VanDerWaalsContact O-N 3.16Å; D551-K554 IonicContact OD1-NZ 3.9Å; D551-K554 PolarHBondContact OD1-NZ 2.84Å; D551-K554 VanDerWaalsContact OD1-NZ 3.08Å; D552-K554 PolarHBondContact O-N 3.34Å; K554-K557 PolarHBondContact O-N 3.07Å; K554-S558 WeakPolarHBondContact O-CB 3.43Å; K554-S558 PolarHBondContact O-N 2.83Å
555	V	94.1	Very high	91.8	Very high	41 Å²	41	53.8 Å²	53.8	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-47.2	177.6	177.9	0	0	0	0	109.9	H510 F511 D551 D552 E553 K557 S558 L559	H510-V555 HydrophobicContact CB-CG1 4.24Å; F511-V555 HydrophobicContact CD1-CB 4.03Å; F511-V555 HydrophobicContact CD1-CG1 3.97Å; F511-V555 HydrophobicContact CE1-CB 3.57Å; F511-V555 HydrophobicContact CE1-CG1 3.48Å; F511-V555 VanDerWaalsContact CE1-CG1 3.48Å; F511-V555 HydrophobicContact CE2-CG1 4.15Å; F511-V555 HydrophobicContact CZ-CB 4.15Å; F511-V555 HydrophobicContact CZ-CG1 3.58Å; D551-V555 WeakPolarHBondContact O-CG2 3.45Å; D551-V555 PolarHBondContact O-N 2.94Å; D551-V555 VanDerWaalsContact O-N 3.13Å; D552-V555 PolarHBondContact O-N 2.82Å; E553-V555 VanDerWaalsContact C-N 3.35Å; E553-V555 PolarHBondContact O-N 3.08Å; V555-K557 PolarHBondContact O-N 3.35Å; V555-S558 WeakPolarHBondContact O-CB 3.5Å; V555-S558 PolarHBondContact O-N 3.4Å; V555-L559 HydrophobicContact CG1-CD1 4.44Å; V555-L559 WeakPolarHBondContact O-CG 3.34Å; V555-L559 PolarHBondContact O-N 3.2Å
556	L	94.4	Very high	90.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-42.9	177.5	-177.2	60.2	0	0	0	112.1	I502 F511 P515 F545 C547 D552 E553 S558 L559 M560 I572	I502-L556 HydrophobicContact CD1-CD1 3.47Å; I502-L556 VanDerWaalsContact CD1-CD1 3.47Å; I502-L556 HydrophobicContact CG1-CD1 3.7Å; F511-L556 HydrophobicContact CE1-CB 4.15Å; F511-L556 HydrophobicContact CZ-CB 4.28Å; P515-L556 HydrophobicContact CB-CD2 3.9Å; P515-L556 HydrophobicContact CG-CD1 4.27Å; P515-L556 HydrophobicContact CG-CD2 4.26Å; F545-L556 HydrophobicContact CB-CD2 3.78Å; F545-L556 HydrophobicContact CD1-CD2 4.39Å; F545-L556 HydrophobicContact CG-CD2 4.24Å; C547-L556 VanDerWaalsContact SG-CD2 3.5Å; D552-L556 WeakPolarHBondContact O-CB 3.42Å; D552-L556 PolarHBondContact O-N 3.39Å; E553-L556 PolarHBondContact O-N 3.05Å; L556-S558 VanDerWaalsContact C-N 3.3Å; L556-S558 PolarHBondContact O-N 3.46Å; L556-L559 PolarHBondContact O-N 3.02Å; L556-M560 HydrophobicContact CD1-CE 4.04Å; L556-M560 HydrophobicContact CD1-CG 4.43Å; L556-M560 HydrophobicContact CD2-CE 3.99Å; L556-M560 HydrophobicContact CG-CE 3.9Å; L556-M560 WeakPolarHBondContact O-CG 3.43Å; L556-M560 PolarHBondContact O-N 3.03Å; L556-I572 HydrophobicContact CB-CD1 4.29Å; L556-I572 HydrophobicContact CD2-CD1 3.96Å; L556-I572 HydrophobicContact CD2-CG1 3.91Å; L556-I572 HydrophobicContact CD2-CG2 4.03Å; L556-I572 HydrophobicContact CG-CD1 3.9Å; L556-I572 HydrophobicContact CG-CG1 4.36Å
557	K	93.7	Very high	88.8	Confident	107 Å²	107	61.6 Å²	61.6	47%	0.465	32%	0.317	S	S	.	.	H	α-helix	trans	-57.3	-42.5	173.6	-80.6	176.7	167.4	164.7	0	111.9	E553 K554 V555 M560 A561 I572	E553-K557 HydrophobicContact CG-CD 4.35Å; E553-K557 WeakPolarHBondContact O-CB 3.44Å; E553-K557 WeakPolarHBondContact O-CG 3.31Å; E553-K557 PolarHBondContact O-N 3.29Å; E553-K557 WeakPolarHBondContact OE1-CE 3.21Å; E553-K557 IonicContact OE1-NZ 3.99Å; E553-K557 PolarHBondContact OE1-NZ 3.32Å; E553-K557 IonicContact OE2-NZ 2.68Å; K554-K557 PolarHBondContact O-N 3.07Å; V555-K557 PolarHBondContact O-N 3.35Å; K557-M560 PolarHBondContact O-N 3.06Å; K557-A561 WeakPolarHBondContact O-CB 3.37Å; K557-A561 PolarHBondContact O-N 3.06Å; K557-I572 HydrophobicContact CB-CD1 4.4Å; K557-I572 HydrophobicContact CG-CD1 3.46Å; K557-I572 VanDerWaalsContact CG-CD1 3.46Å
558	S	91.9	Very high	87.5	Confident	60 Å²	60	70.2 Å²	70.2	42%	0.42	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-42.4	177.4	-174.4	0	0	0	0	112.1	K554 V555 L556 A561 K562	K554-S558 WeakPolarHBondContact O-CB 3.43Å; K554-S558 PolarHBondContact O-N 2.83Å; V555-S558 WeakPolarHBondContact O-CB 3.5Å; V555-S558 PolarHBondContact O-N 3.4Å; L556-S558 VanDerWaalsContact C-N 3.3Å; L556-S558 PolarHBondContact O-N 3.46Å; S558-A561 PolarHBondContact O-N 3.47Å; S558-K562 WeakPolarHBondContact O-CG 3.27Å; S558-K562 PolarHBondContact O-N 2.9Å
559	L	92.6	Very high	87.1	Confident	21 Å²	21	75.2 Å²	75.2	11%	0.11	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-46	175.1	-65.5	174.5	0	0	0	111.5	L498 A501 I502 A505 F511 V555 L556 A561 K562 V563	L498-L559 HydrophobicContact CD1-CB 4.47Å; A501-L559 HydrophobicContact CB-CD2 4.48Å; I502-L559 HydrophobicContact CG1-CD1 4.26Å; A505-L559 HydrophobicContact CB-CD1 3.66Å; A505-L559 HydrophobicContact CB-CD2 4.46Å; F511-L559 HydrophobicContact CE2-CD1 3.98Å; F511-L559 HydrophobicContact CZ-CD1 3.8Å; V555-L559 HydrophobicContact CG1-CD1 4.44Å; V555-L559 WeakPolarHBondContact O-CG 3.34Å; V555-L559 PolarHBondContact O-N 3.2Å; L556-L559 PolarHBondContact O-N 3.02Å; L559-A561 VanDerWaalsContact C-N 3.27Å; L559-A561 PolarHBondContact O-N 2.89Å; L559-K562 WeakPolarHBondContact O-CB 3.45Å; L559-K562 PolarHBondContact O-N 3.47Å; L559-K562 VanDerWaalsContact O-N 3.09Å; L559-V563 WeakPolarHBondContact O-CG2 3.48Å; L559-V563 PolarHBondContact O-N 3.22Å; L559-V563 VanDerWaalsContact O-N 3.09Å
560	M	92.6	Very high	86.9	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.02	37%	0.37	C	S	.	.	H	α-helix	trans	-59.4	-37.8	175.7	-73.7	-172.5	-179.8	0	0	111.9	L498 F545 L556 K557 K562 V563 Y564 P570 I572	L498-M560 HydrophobicContact CD1-CG 3.75Å; L498-M560 HydrophobicContact CD2-CE 3.85Å; L498-M560 HydrophobicContact CD2-CG 3.94Å; F545-M560 HydrophobicContact CB-CE 4.3Å; F545-M560 HydrophobicContact CD2-CE 3.54Å; F545-M560 HydrophobicContact CE2-CE 4Å; F545-M560 HydrophobicContact CG-CE 3.92Å; L556-M560 HydrophobicContact CD1-CE 4.04Å; L556-M560 HydrophobicContact CD1-CG 4.43Å; L556-M560 HydrophobicContact CD2-CE 3.99Å; L556-M560 HydrophobicContact CG-CE 3.9Å; L556-M560 WeakPolarHBondContact O-CG 3.43Å; L556-M560 PolarHBondContact O-N 3.03Å; K557-M560 PolarHBondContact O-N 3.06Å; M560-K562 VanDerWaalsContact C-N 3.3Å; M560-K562 PolarHBondContact O-N 2.82Å; M560-V563 PolarHBondContact O-N 2.99Å; M560-Y564 WeakPolarHBondContact O-CB 3.32Å; M560-Y564 PolarHBondContact O-N 3.37Å; M560-P570 HydrophobicContact CE-CB 3.76Å; M560-P570 HydrophobicContact CE-CG 4.21Å; M560-P570 HydrophobicContact SD-CB 4.25Å; M560-P570 HydrophobicContact SD-CG 4.5Å; M560-I572 HydrophobicContact CE-CD1 4.14Å; M560-I572 HydrophobicContact CE-CG1 3.83Å; M560-I572 HydrophobicContact SD-CD1 3.78Å; M560-I572 HydrophobicContact SD-CG1 3.94Å
561	A	89.6	Confident	86.8	Confident	41 Å²	41	69.5 Å²	69.5	34%	0.339	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-31	176.7	0	0	0	0	0	113.3	K557 S558 L559	K557-A561 WeakPolarHBondContact O-CB 3.37Å; K557-A561 PolarHBondContact O-N 3.06Å; S558-A561 PolarHBondContact O-N 3.47Å; L559-A561 VanDerWaalsContact C-N 3.27Å; L559-A561 PolarHBondContact O-N 2.89Å
562	K	87.8	Confident	86.9	Confident	139 Å²	139	67.7 Å²	67.7	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-74.6	-40.5	176	-68.1	171.7	-174.2	175.2	0	112.2	S558 L559 M560	S558-K562 WeakPolarHBondContact O-CG 3.27Å; S558-K562 PolarHBondContact O-N 2.9Å; L559-K562 WeakPolarHBondContact O-CB 3.45Å; L559-K562 PolarHBondContact O-N 3.47Å; L559-K562 VanDerWaalsContact O-N 3.09Å; M560-K562 VanDerWaalsContact C-N 3.3Å; M560-K562 PolarHBondContact O-N 2.82Å
563	V	87.6	Confident	87	Confident	31 Å²	31	68.1 Å²	68.1	19%	0.188	35%	0.35	C	S	.	.	H	α-helix	trans	-79.5	-42.4	-176.7	177.8	0	0	0	0	111.3	H494 A497 L498 A501 L559 M560 R565	H494-V563 HydrophobicContact CB-CG1 3.8Å; A497-V563 HydrophobicContact CB-CG1 4.3Å; L498-V563 HydrophobicContact CB-CG1 4.21Å; L498-V563 HydrophobicContact CD1-CG2 4.38Å; A501-V563 HydrophobicContact CB-CG2 4.47Å; L559-V563 WeakPolarHBondContact O-CG2 3.48Å; L559-V563 PolarHBondContact O-N 3.22Å; L559-V563 VanDerWaalsContact O-N 3.09Å; M560-V563 PolarHBondContact O-N 2.99Å; V563-R565 PolarHBondContact O-N 3.27Å
564	Y	84.9	Confident	87	Confident	16 Å²	16	68.8 Å²	68.8	6%	0.063	36%	0.355	C	S	.	.			trans	-100.8	83.7	179.4	-65.7	-96.8	0	0	0	110.9	H494 L498 M560 R569 P570	H494-Y564 HydrophobicContact CB-CE1 4.07Å; H494-Y564 HydrophobicContact CB-CE2 4.4Å; L498-Y564 HydrophobicContact CB-CE2 4.3Å; L498-Y564 HydrophobicContact CD2-CE2 3.97Å; M560-Y564 WeakPolarHBondContact O-CB 3.32Å; M560-Y564 PolarHBondContact O-N 3.37Å; Y564-R569 HydrophobicContact CG-CG 4.36Å; Y564-R569 PolarHBondContact O-NH2 3.08Å; Y564-P570 HydrophobicContact CE2-CG 4.32Å
565	R	74.1	Confident	86.9	Confident	231 Å²	231	64.2 Å²	64.2	87%	0.872	34%	0.34	S	S	*	.	S	Bend	trans	-71.7	-29.9	175.6	-63.2	-174.9	-174.7	177.9	1.7	112.8	V563	V563-R565 PolarHBondContact O-N 3.27Å
566	S	62.1	Low	86.8	Confident	101 Å²	101	69.5 Å²	69.5	71%	0.706	36%	0.362	S	S	*	.	S	Bend	trans	-149.9	137.9	175.9	56	0	0	0	0	110.1
567	G	64.8	Low	86.8	Confident	64 Å²	64	70.3 Å²	70.3	66%	0.66	37%	0.365	S	S	*	.	S	Bend	trans	117.2	179.4	177.6	0	0	0	0	0	114.5
568	Q	70	Confident	86.7	Confident	181 Å²	181	67.8 Å²	67.8	85%	0.846	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-76.2	124.1	-177	-167.2	175	7.1	0	0	110.7
569	R	85.9	Confident	86.6	Confident	132 Å²	132	72 Å²	72	50%	0.498	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-87.5	146.4	-178.9	-65.2	-179.4	-179.9	168.1	1.6	111.3	Y564	Y564-R569 HydrophobicContact CG-CG 4.36Å; Y564-R569 PolarHBondContact O-NH2 3.08Å
570	P	88.3	Confident	86.6	Confident	9 Å²	9	76.8 Å²	76.8	6%	0.058	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-55.7	144.1	169.6	-26.6	37	0	0	0	112.3	M495 L498 M543 F545 M560 Y564	M495-P570 HydrophobicContact CE-CG 3.9Å; L498-P570 HydrophobicContact CD2-CG 4.36Å; M543-P570 WeakPolarHBondContact O-CB 3.35Å; F545-P570 HydrophobicContact CD2-CB 3.86Å; F545-P570 HydrophobicContact CE2-CB 3.96Å; F545-P570 HydrophobicContact CE2-CG 4.25Å; M560-P570 HydrophobicContact CE-CB 3.76Å; M560-P570 HydrophobicContact CE-CG 4.21Å; M560-P570 HydrophobicContact SD-CB 4.25Å; M560-P570 HydrophobicContact SD-CG 4.5Å; Y564-P570 HydrophobicContact CE2-CG 4.32Å
571	T	92.7	Very high	86.6	Confident	61 Å²	61	80 Å²	80	37%	0.374	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-74.6	141.9	175.4	-56.2	0	0	0	0	110	Y540 A544 F545 I573	Y540-T571 HydrophobicContact CD2-CG2 4.4Å; Y540-T571 HydrophobicContact CE2-CG2 4.31Å; A544-T571 CarbonylContact C-O 3.2Å; A544-T571 WeakPolarHBondContact CA-O 3.41Å; F545-T571 PolarHBondContact N-O 3.41Å; T571-I573 HydrophobicContact CG2-CG1 4.48Å
572	I	95.1	Very high	86.7	Confident	29 Å²	29	80.2 Å²	80.2	15%	0.149	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132	173.4	-54.2	165.6	0	0	0	108.3	F545 C547 E553 L556 K557 M560	F545-I572 CarbonylContact O-C 3.55Å; F545-I572 WeakPolarHBondContact O-CA 3.48Å; C547-I572 HydrophobicContact CB-CG2 4.28Å; E553-I572 HydrophobicContact CG-CB 4.34Å; E553-I572 HydrophobicContact CG-CG2 3.65Å; L556-I572 HydrophobicContact CB-CD1 4.29Å; L556-I572 HydrophobicContact CD2-CD1 3.96Å; L556-I572 HydrophobicContact CD2-CG1 3.91Å; L556-I572 HydrophobicContact CD2-CG2 4.03Å; L556-I572 HydrophobicContact CG-CD1 3.9Å; L556-I572 HydrophobicContact CG-CG1 4.36Å; K557-I572 HydrophobicContact CB-CD1 4.4Å; K557-I572 HydrophobicContact CG-CD1 3.46Å; K557-I572 VanDerWaalsContact CG-CD1 3.46Å; M560-I572 HydrophobicContact CE-CD1 4.14Å; M560-I572 HydrophobicContact CE-CG1 3.83Å; M560-I572 HydrophobicContact SD-CD1 3.78Å; M560-I572 HydrophobicContact SD-CG1 3.94Å
573	I	95.8	Very high	86.8	Confident	11 Å²	11	79 Å²	79	6%	0.056	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.6	-179.4	-57.7	167.8	0	0	0	106.3	L519 L541 A544 F545 T546 C547 T571 Q615	L519-I573 HydrophobicContact CD1-CD1 4.38Å; L541-I573 HydrophobicContact CD2-CD1 3.48Å; L541-I573 VanDerWaalsContact CD2-CD1 3.48Å; A544-I573 HydrophobicContact CB-CD1 3.83Å; A544-I573 HydrophobicContact CB-CG1 4.43Å; F545-I573 PolarHBondContact O-N 3.1Å; T546-I573 CarbonylContact C-O 3.53Å; T546-I573 WeakPolarHBondContact CA-O 3.35Å; T546-I573 PolarHBondContact OG1-O 3.27Å; C547-I573 PolarHBondContact N-O 3.08Å; T571-I573 HydrophobicContact CG2-CG1 4.48Å; I573-Q615 HydrophobicContact CD1-CG 4.17Å; I573-Q615 HydrophobicContact CG2-CG 4.27Å
574	T	95.1	Very high	86.9	Confident	37 Å²	37	78.5 Å²	78.5	23%	0.227	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114.9	-177.2	-56.4	0	0	0	0	109.3	C547 N549 Y550 E553	C547-T574 CarbonylContact O-C 3.48Å; C547-T574 WeakPolarHBondContact O-CA 3.38Å; N549-T574 VanDerWaalsContact C-CG2 3.48Å; Y550-T574 HydrophobicContact CD1-CG2 4.1Å; Y550-T574 HydrophobicContact CE1-CG2 4.21Å; Y550-T574 HydrophobicContact CG-CG2 4.28Å; E553-T574 VanDerWaalsContact CD-OG1 3.3Å; E553-T574 WeakPolarHBondContact CG-OG1 3.43Å
575	S	91.8	Very high	87	Confident	33 Å²	33	88.2 Å²	88.2	23%	0.231	44%	0.438	C	S	.	.			trans	-153.6	136.5	-178	58.1	0	0	0	0	109.2	T546 C547 D548 F577	T546-S575 PolarHBondContact OG1-OG 3.41Å; C547-S575 PolarHBondContact O-N 3.24Å; C547-S575 VanDerWaalsContact O-O 3.05Å; D548-S575 WeakPolarHBondContact CA-O 3.49Å; D548-S575 CarbonylContact O-C 3.41Å; S575-F577 WeakPolarHBondContact O-CD1 3.5Å; S575-F577 PolarHBondContact O-N 3.33Å
576	Q	92.1	Very high	87.5	Confident	152 Å²	152	88.3 Å²	88.3	71%	0.71	44%	0.439	S	S	*	.			trans	-54.7	132.9	178.1	-173	177.4	10.7	0	0	111.2	D548 L578	D548-Q576 WeakPolarHBondContact O-CA 3.46Å; D548-Q576 PolarHBondContact O-N 3.29Å; Q576-L578 PolarHBondContact O-N 3.42Å
577	F	95.1	Very high	88.7	Confident	16 Å²	16	87.7 Å²	87.7	7%	0.07	42%	0.421	C	S	.	.			trans	-75.8	122.7	-179.2	-72.8	-0.8	0	0	0	110.4	H513 R516 T546 D548 S575 I607	H513-F577 HydrophobicContact CB-CD2 3.9Å; H513-F577 HydrophobicContact CB-CE2 3.96Å; R516-F577 HydrophobicContact CG-CZ 4.46Å; T546-F577 HydrophobicContact CG2-CE1 4.13Å; T546-F577 HydrophobicContact CG2-CZ 4.42Å; D548-F577 HydrophobicContact CB-CB 4.33Å; D548-F577 HydrophobicContact CB-CD1 3.86Å; D548-F577 HydrophobicContact CB-CD2 3.77Å; D548-F577 HydrophobicContact CB-CE1 4.09Å; D548-F577 HydrophobicContact CB-CE2 3.99Å; D548-F577 HydrophobicContact CB-CG 3.71Å; D548-F577 HydrophobicContact CB-CZ 4.16Å; D548-F577 WeakPolarHBondContact OD1-CB 3.17Å; D548-F577 PolarHBondContact OD1-N 2.93Å; S575-F577 WeakPolarHBondContact O-CD1 3.5Å; S575-F577 PolarHBondContact O-N 3.33Å; F577-I607 HydrophobicContact CB-CD1 3.85Å; F577-I607 HydrophobicContact CB-CG1 4.02Å; F577-I607 HydrophobicContact CD1-CD1 4.41Å; F577-I607 HydrophobicContact CD1-CG1 4.44Å; F577-I607 HydrophobicContact CD1-CG2 3.38Å; F577-I607 HydrophobicContact CD2-CD1 3.62Å; F577-I607 HydrophobicContact CD2-CG1 4.46Å; F577-I607 HydrophobicContact CD2-CG2 4.37Å; F577-I607 HydrophobicContact CE1-CG2 3.5Å; F577-I607 VanDerWaalsContact CE1-CG2 3.5Å; F577-I607 HydrophobicContact CE2-CD1 4.23Å; F577-I607 HydrophobicContact CE2-CG2 4.46Å; F577-I607 HydrophobicContact CG-CD1 3.72Å; F577-I607 HydrophobicContact CG-CG1 4.08Å; F577-I607 HydrophobicContact CG-CG2 3.85Å; F577-I607 HydrophobicContact CZ-CG2 4.06Å
578	L	91.5	Very high	89.9	Confident	55 Å²	55	85.7 Å²	85.7	29%	0.288	40%	0.398	S	S	.	.			trans	-112.9	128.9	174.2	-61.2	174.8	0	0	0	108.8	Q576 H580 H582	Q576-L578 PolarHBondContact O-N 3.42Å; L578-H580 PolarHBondContact O-N 3.13Å; L578-H582 VanDerWaalsContact CD1-CE1 3.43Å; L578-H582 WeakPolarHBondContact CD1-CE1 3.31Å
579	H	90	Very high	90.9	Very high	149 Å²	149	77.1 Å²	77.1	69%	0.69	36%	0.358	S	S	*	.	S	Bend	trans	-83.4	4.9	-177	-63	-66.1	0	0	0	114.1
580	H	92.4	Very high	90.9	Very high	120 Å²	120	77.6 Å²	77.6	56%	0.556	37%	0.37	S	S	*	.	S	Bend	trans	-126	147.1	173	60.9	-86	0	0	0	109.3	L578 N610	L578-H580 PolarHBondContact O-N 3.13Å; H580-N610 PolarHBondContact O-ND2 3.01Å
581	V	91.4	Very high	90.8	Very high	72 Å²	72	79.1 Å²	79.1	44%	0.436	38%	0.377	S	S	.	.			trans	-70.6	139.7	176.5	-176.3	0	0	0	0	109.3	D583 P606 A609 N610 I613	V581-D583 PolarHBondContact O-N 3.49Å; V581-P606 HydrophobicContact CG2-CB 3.96Å; V581-A609 HydrophobicContact CG1-CB 4.39Å; V581-A609 HydrophobicContact CG2-CB 4.3Å; V581-N610 VanDerWaalsContact CA-OD1 3.29Å; V581-N610 WeakPolarHBondContact CA-OD1 3.33Å; V581-I613 HydrophobicContact CG1-CD1 3.96Å
582	H	91.5	Very high	90.5	Very high	45 Å²	45	82.1 Å²	82.1	21%	0.208	40%	0.397	C	S	.	.			trans	-53.6	138.2	175.3	-71.7	-54.9	0	0	0	111.7	L578 T584 N610 I613 D614	L578-H582 VanDerWaalsContact CD1-CE1 3.43Å; L578-H582 WeakPolarHBondContact CD1-CE1 3.31Å; H582-T584 PolarHBondContact O-N 2.91Å; H582-N610 PolarHBondContact CD2-OD1 3.19Å; H582-N610 PolarHBondContact N-OD1 2.89Å; H582-I613 HydrophobicContact CB-CG2 4.49Å; H582-D614 IonicContact CD2-OD1 3.75Å; H582-D614 IonicContact NE2-OD1 3.87Å; H582-D614 IonicContact NE2-OD2 3.69Å
583	D	90.4	Very high	90.1	Very high	113 Å²	113	87.5 Å²	87.5	60%	0.604	42%	0.422	S	S	*	.			trans	-70.3	102.3	171.8	-174.5	1.7	0	0	0	109.9	V581 R585	V581-D583 PolarHBondContact O-N 3.49Å; D583-R585 VanDerWaalsContact OD1-CB 3.3Å; D583-R585 WeakPolarHBondContact OD1-CB 3.36Å; D583-R585 WeakPolarHBondContact OD1-CD 3.3Å; D583-R585 WeakPolarHBondContact OD1-CG 3.41Å; D583-R585 PolarHBondContact OD1-N 3.23Å
584	T	89.8	Confident	90	Very high	21 Å²	21	88.3 Å²	88.3	13%	0.129	42%	0.424	C	S	.	.			trans	-95.4	0.4	-179.6	52.8	0	0	0	0	113.2	H582 R586 R587 A588 L598 I613 E619	H582-T584 PolarHBondContact O-N 2.91Å; T584-R586 PolarHBondContact O-N 3.01Å; T584-R587 HydrophobicContact CG2-CG 4.46Å; T584-R587 CarbonylContact O-C 3.55Å; T584-R587 WeakPolarHBondContact O-CG 3.47Å; T584-R587 PolarHBondContact O-N 3.39Å; T584-A588 VanDerWaalsContact O-CB 3.27Å; T584-A588 WeakPolarHBondContact O-CB 3.48Å; T584-A588 PolarHBondContact O-N 3.16Å; T584-L598 HydrophobicContact CG2-CD2 4.43Å; T584-I613 HydrophobicContact CG2-CD1 4.03Å; T584-I613 HydrophobicContact CG2-CG2 4.12Å; T584-E619 HydrophobicContact CG2-CB 4.05Å; T584-E619 HydrophobicContact CG2-CG 3.83Å
585	R	86.2	Confident	89.9	Confident	220 Å²	220	88.8 Å²	88.8	83%	0.83	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.6	-170.9	-69.6	172.2	-179.6	-172.8	1.8	114.5	D583	D583-R585 VanDerWaalsContact OD1-CB 3.3Å; D583-R585 WeakPolarHBondContact OD1-CB 3.36Å; D583-R585 WeakPolarHBondContact OD1-CD 3.3Å; D583-R585 WeakPolarHBondContact OD1-CG 3.41Å; D583-R585 PolarHBondContact OD1-N 3.23Å
586	R	84.8	Confident	90	Very high	234 Å²	234	87.3 Å²	87.3	88%	0.883	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-21.3	179.7	-65.3	-174.6	179.2	-172.2	-0	114.2	T584 N642	T584-R586 PolarHBondContact O-N 3.01Å; R586-N642 PolarHBondContact O-ND2 3.42Å; R586-N642 VanDerWaalsContact O-ND2 3.12Å
587	R	87.3	Confident	90.2	Very high	88 Å²	88	80 Å²	80	33%	0.332	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-13.2	-170.2	58.7	-172.2	-105.7	-163.3	7.2	113.8	T584 E619 N642	T584-R587 HydrophobicContact CG2-CG 4.46Å; T584-R587 CarbonylContact O-C 3.55Å; T584-R587 WeakPolarHBondContact O-CG 3.47Å; T584-R587 PolarHBondContact O-N 3.39Å; R587-E619 HydrophobicContact CG-CG 4.22Å; R587-E619 IonicContact CZ-OE1 3.57Å; R587-E619 IonicContact NE-OE1 2.91Å; R587-E619 PolarHBondContact NE-OE1 2.74Å; R587-E619 IonicContact NH2-OE1 2.8Å; R587-E619 PolarHBondContact NH2-OE1 2.68Å; R587-E619 IonicContact NH2-OE2 2.84Å; R587-N642 WeakPolarHBondContact O-CB 3.38Å
588	A	89.8	Confident	90.1	Very high	22 Å²	22	81 Å²	81	18%	0.182	39%	0.389	C	S	.	.	S	Bend	trans	-71.2	143	177.5	0	0	0	0	0	110.6	T584 E619	T584-A588 VanDerWaalsContact O-CB 3.27Å; T584-A588 WeakPolarHBondContact O-CB 3.48Å; T584-A588 PolarHBondContact O-N 3.16Å; A588-E619 CarbonylContact C-O 3.53Å; A588-E619 VanDerWaalsContact CA-O 3.31Å; A588-E619 WeakPolarHBondContact CA-O 3.37Å; A588-E619 HydrophobicContact CB-CB 4.08Å; A588-E619 HydrophobicContact CB-CG 4.31Å
589	V	91.7	Very high	90.2	Very high	1 Å²	1	82.7 Å²	82.7	1%	0.006	40%	0.395	C	S	.	.			trans	-72	132.5	166.9	65.5	0	0	0	0	108.7	E619 L622 P640 C643	V589-E619 WeakPolarHBondContact CG1-O 3.34Å; V589-E619 PolarHBondContact N-O 2.88Å; V589-L622 HydrophobicContact CB-CD2 4.43Å; V589-L622 HydrophobicContact CG1-CD2 3.54Å; V589-L622 HydrophobicContact CG1-CG 3.88Å; V589-L622 HydrophobicContact CG2-CD1 4.04Å; V589-L622 HydrophobicContact CG2-CD2 3.95Å; V589-L622 HydrophobicContact CG2-CG 3.95Å; V589-P640 HydrophobicContact CG2-CB 3.94Å; V589-C643 HydrophobicContact CB-CB 4.28Å; V589-C643 HydrophobicContact CG2-CB 3.7Å
590	N	85.1	Confident	90.3	Very high	142 Å²	142	75.9 Å²	75.9	76%	0.759	37%	0.365	S	S	*	.			trans	-115.9	106.4	175.1	-171.4	15.5	0	0	0	109
591	H	87.9	Confident	90.4	Very high	41 Å²	41	70.4 Å²	70.4	19%	0.19	34%	0.34	C	S	.	.			trans	-127.8	131.5	177.6	-167.6	-81.3	0	0	0	110	Q593 Y594 L622	H591-Q593 VanDerWaalsContact C-N 3.31Å; H591-Q593 PolarHBondContact ND1-N 3.47Å; H591-Q593 PolarHBondContact O-N 3.43Å; H591-Y594 AromaticContact CE1-CD2 3.16Å; H591-Y594 WeakPolarHBondContact CE1-CD2 3.45Å; H591-Y594 AromaticContact CE1-CE2 3.44Å; H591-Y594 VanDerWaalsContact CE1-CE2 3.44Å; H591-Y594 WeakPolarHBondContact CE1-CE2 3.22Å; H591-Y594 AromaticContact ND1-CD2 3.23Å; H591-Y594 WeakPolarHBondContact ND1-CD2 3.38Å; H591-Y594 AromaticContact ND1-CE2 3.96Å; H591-Y594 AromaticContact ND1-CG 3.91Å; H591-Y594 PolarHBondContact ND1-N 2.88Å; H591-Y594 AromaticContact NE2-CD2 3.94Å; H591-L622 HydrophobicContact CB-CD1 4.29Å; H591-L622 HydrophobicContact CB-CD2 3.97Å
592	P	84.8	Confident	90.4	Very high	123 Å²	123	71.3 Å²	71.3	80%	0.799	34%	0.342	S	S	*	.	S	Bend	trans	-68.8	-25.6	-170.8	25.4	-34.9	0	0	0	114.3
593	Q	88.1	Confident	90.6	Very high	143 Å²	143	70.8 Å²	70.8	67%	0.668	34%	0.341	S	S	*	.	S	Bend	trans	-112.4	-18.4	-173.4	-64	178.4	8.5	0	0	114.6	H591	H591-Q593 VanDerWaalsContact C-N 3.31Å; H591-Q593 PolarHBondContact ND1-N 3.47Å; H591-Q593 PolarHBondContact O-N 3.43Å
594	Y	92.3	Very high	90.6	Very high	28 Å²	28	73.9 Å²	73.9	11%	0.11	35%	0.352	C	S	.	.	S	Bend	trans	-126.5	123.3	-172.8	-56.7	-61.6	0	0	0	109	H591 L622 I624 E629 I633	H591-Y594 AromaticContact CE1-CD2 3.16Å; H591-Y594 WeakPolarHBondContact CE1-CD2 3.45Å; H591-Y594 AromaticContact CE1-CE2 3.44Å; H591-Y594 VanDerWaalsContact CE1-CE2 3.44Å; H591-Y594 WeakPolarHBondContact CE1-CE2 3.22Å; H591-Y594 AromaticContact ND1-CD2 3.23Å; H591-Y594 WeakPolarHBondContact ND1-CD2 3.38Å; H591-Y594 AromaticContact ND1-CE2 3.96Å; H591-Y594 AromaticContact ND1-CG 3.91Å; H591-Y594 PolarHBondContact ND1-N 2.88Å; H591-Y594 AromaticContact NE2-CD2 3.94Å; Y594-L622 WeakPolarHBondContact O-CD2 3.29Å; Y594-I624 HydrophobicContact CD1-CB 4.31Å; Y594-I624 HydrophobicContact CD1-CG1 4.06Å; Y594-I624 HydrophobicContact CD1-CG2 4.1Å; Y594-I624 HydrophobicContact CD2-CD1 4.22Å; Y594-I624 HydrophobicContact CD2-CG1 4Å; Y594-I624 HydrophobicContact CE1-CG2 3.88Å; Y594-I624 HydrophobicContact CE2-CG2 4.48Å; Y594-I624 HydrophobicContact CG-CB 4.48Å; Y594-I624 HydrophobicContact CG-CD1 4.46Å; Y594-I624 HydrophobicContact CG-CG1 3.75Å; Y594-I624 HydrophobicContact CG-CG2 4.47Å; Y594-E629 WeakPolarHBondContact OH-CG 3.42Å; Y594-E629 PolarHBondContact OH-OE1 3.21Å; Y594-E629 PolarHBondContact OH-OE2 3.27Å; Y594-I633 HydrophobicContact CD2-CD1 3.86Å; Y594-I633 HydrophobicContact CE2-CD1 3.24Å
595	P	94.1	Very high	90.7	Very high	46 Å²	46	74.5 Å²	74.5	30%	0.299	35%	0.354	S	S	.	.			trans	-72.5	151.4	179.6	31	-34.3	0	0	0	110.6	Q599 A600 L623	P595-Q599 HydrophobicContact CB-CB 4.04Å; P595-A600 HydrophobicContact CB-CB 4.33Å; P595-A600 HydrophobicContact CG-CB 4.27Å; P595-L623 PolarHBondContact O-N 2.86Å
596	S	94.5	Very high	91.1	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.014	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-70.4	161.9	160.4	63.1	0	0	0	0	111.1	L598 Q599 A600 I621	S596-L598 PolarHBondContact O-N 3.34Å; S596-Q599 PolarHBondContact O-N 2.99Å; S596-Q599 WeakPolarHBondContact OG-CG 3.19Å; S596-Q599 PolarHBondContact OG-N 3.07Å; S596-Q599 PolarHBondContact OG-OE1 3.07Å; S596-A600 WeakPolarHBondContact O-CB 3.49Å; S596-A600 PolarHBondContact O-N 2.75Å; S596-I621 CarbonylContact C-O 3.5Å; S596-I621 WeakPolarHBondContact CA-O 3.34Å; S596-I621 WeakPolarHBondContact CB-O 3.34Å
597	V	94.6	Very high	91.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-40.1	174.2	176.5	0	0	0	0	110.5	Q599 A600 L601 I618 I621 L623	V597-Q599 VanDerWaalsContact C-N 3.34Å; V597-Q599 PolarHBondContact O-N 3.15Å; V597-A600 PolarHBondContact O-N 3.2Å; V597-L601 HydrophobicContact CG1-CD1 3.94Å; V597-L601 HydrophobicContact CG1-CG 4.37Å; V597-L601 VanDerWaalsContact O-CG 3.3Å; V597-L601 WeakPolarHBondContact O-CG 3.43Å; V597-L601 PolarHBondContact O-N 2.84Å; V597-L601 VanDerWaalsContact O-N 3.14Å; V597-I618 HydrophobicContact CB-CB 3.96Å; V597-I618 HydrophobicContact CB-CG2 4.33Å; V597-I618 WeakPolarHBondContact CB-O 3.42Å; V597-I618 HydrophobicContact CG1-CB 3.9Å; V597-I618 HydrophobicContact CG1-CG2 3.86Å; V597-I618 PolarHBondContact N-O 3.03Å; V597-I621 HydrophobicContact CB-CB 4.48Å; V597-I621 HydrophobicContact CG2-CB 3.8Å; V597-I621 HydrophobicContact CG2-CG2 3.54Å; V597-I621 PolarHBondContact N-O 3.41Å; V597-L623 HydrophobicContact CG2-CD1 4.17Å; V597-L623 HydrophobicContact CG2-CD2 3.84Å; V597-L623 HydrophobicContact CG2-CG 3.86Å
598	L	93.9	Very high	91.9	Very high	36 Å²	36	51 Å²	51	19%	0.188	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-40.6	174.8	-178.1	61.3	0	0	0	112.9	T584 S596 I613 I618 E619	T584-L598 HydrophobicContact CG2-CD2 4.43Å; S596-L598 PolarHBondContact O-N 3.34Å; L598-I613 HydrophobicContact CD1-CD1 4.08Å; L598-I613 HydrophobicContact CD1-CG1 4.24Å; L598-I613 HydrophobicContact CD2-CD1 3.95Å; L598-I613 HydrophobicContact CD2-CG1 4.26Å; L598-I618 HydrophobicContact CB-CB 4.48Å; L598-I618 HydrophobicContact CB-CD1 4.06Å; L598-I618 HydrophobicContact CB-CG1 4.03Å; L598-I618 HydrophobicContact CD1-CD1 3.64Å; L598-I618 HydrophobicContact CD1-CG1 4.25Å; L598-I618 HydrophobicContact CG-CD1 4.44Å; L598-I618 PolarHBondContact N-O 3.39Å; L598-E619 HydrophobicContact CB-CB 4.25Å; L598-E619 HydrophobicContact CD2-CB 3.74Å
599	Q	92.6	Very high	92.2	Very high	90 Å²	90	50.1 Å²	50.1	42%	0.421	26%	0.264	S	S	.	.	H	α-helix	trans	-73.6	-30.5	179	-73.1	167.2	-21.2	0	0	113	K526 P595 S596 V597	K526-Q599 PolarHBondContact NZ-O 3.36Å; P595-Q599 HydrophobicContact CB-CB 4.04Å; S596-Q599 PolarHBondContact O-N 2.99Å; S596-Q599 WeakPolarHBondContact OG-CG 3.19Å; S596-Q599 PolarHBondContact OG-N 3.07Å; S596-Q599 PolarHBondContact OG-OE1 3.07Å; V597-Q599 VanDerWaalsContact C-N 3.34Å; V597-Q599 PolarHBondContact O-N 3.15Å
600	A	92.8	Very high	92.3	Very high	6 Å²	6	50.4 Å²	50.4	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-78.3	-23.3	-179.2	0	0	0	0	0	113.5	K526 P595 S596 V597 L623	K526-A600 WeakPolarHBondContact CG-O 3.46Å; K526-A600 PolarHBondContact N-O 2.73Å; P595-A600 HydrophobicContact CB-CB 4.33Å; P595-A600 HydrophobicContact CG-CB 4.27Å; S596-A600 WeakPolarHBondContact O-CB 3.49Å; S596-A600 PolarHBondContact O-N 2.75Å; V597-A600 PolarHBondContact O-N 3.2Å; A600-L623 HydrophobicContact CB-CD1 3.55Å
601	L	93.9	Very high	92.8	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	149.9	175.4	-68.4	174.4	0	0	0	111.6	I523 G524 L525 K526 V534 V597 I603 L612 I618	I523-L601 HydrophobicContact CB-CD2 4.42Å; I523-L601 HydrophobicContact CD1-CD1 4.45Å; I523-L601 HydrophobicContact CD1-CD2 4.08Å; I523-L601 HydrophobicContact CG1-CD2 4.48Å; G524-L601 WeakPolarHBondContact O-CA 3.49Å; G524-L601 WeakPolarHBondContact O-CD2 3.5Å; L525-L601 HydrophobicContact CD1-CD2 4.12Å; K526-L601 WeakPolarHBondContact CE-O 3.29Å; V534-L601 HydrophobicContact CG1-CD2 3.87Å; V597-L601 HydrophobicContact CG1-CD1 3.94Å; V597-L601 HydrophobicContact CG1-CG 4.37Å; V597-L601 VanDerWaalsContact O-CG 3.3Å; V597-L601 WeakPolarHBondContact O-CG 3.43Å; V597-L601 PolarHBondContact O-N 2.84Å; V597-L601 VanDerWaalsContact O-N 3.14Å; L601-I603 HydrophobicContact CB-CD1 4Å; L601-I603 HydrophobicContact CB-CG1 3.84Å; L601-I603 HydrophobicContact CD1-CD1 4.09Å; L601-L612 HydrophobicContact CD1-CD1 4.3Å; L601-I618 HydrophobicContact CD1-CD1 4.29Å
602	D	93	Very high	93.1	Very high	91 Å²	91	41.8 Å²	41.8	49%	0.487	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.3	166.1	-167.4	16	0	0	0	108	G524	G524-D602 PolarHBondContact N-O 2.84Å; G524-D602 PolarHBondContact O-N 2.65Å
603	I	94.1	Very high	93.5	Very high	34 Å²	34	36 Å²	36	17%	0.174	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	109.3	-172.5	-47.3	179.5	0	0	0	108.3	I523 L601 D605 V608 A609 L612 I618	I523-I603 HydrophobicContact CB-CG1 4.47Å; I523-I603 HydrophobicContact CG2-CD1 4.21Å; I523-I603 HydrophobicContact CG2-CG1 3.93Å; I523-I603 HydrophobicContact CG2-CG2 4.36Å; L601-I603 HydrophobicContact CB-CD1 4Å; L601-I603 HydrophobicContact CB-CG1 3.84Å; L601-I603 HydrophobicContact CD1-CD1 4.09Å; I603-D605 WeakPolarHBondContact CG2-O 3.31Å; I603-V608 HydrophobicContact CG2-CB 3.95Å; I603-V608 HydrophobicContact CG2-CG1 3.92Å; I603-A609 HydrophobicContact CB-CB 4.36Å; I603-A609 HydrophobicContact CD1-CB 4.13Å; I603-A609 HydrophobicContact CG2-CB 3.96Å; I603-L612 HydrophobicContact CD1-CD1 4.14Å; I603-I618 HydrophobicContact CD1-CD1 4.46Å
604	E	90.6	Very high	93.8	Very high	179 Å²	179	32.8 Å²	32.8	84%	0.836	17%	0.17	S	C	*	.			trans	-77.2	-36.8	-178.8	-64.1	-179.1	179.8	0	0	112.5	P606	E604-P606 WeakPolarHBondContact O-CD 3.5Å
605	D	93.3	Very high	93.9	Very high	34 Å²	34	35.4 Å²	35.4	18%	0.182	18%	0.184	C	C	.	.			trans	-91.5	115.4	-176.6	-168.9	-25.6	0	0	0	111.2	R516 I603 I607 V608 A609	R516-D605 WeakPolarHBondContact CD-OD2 3.36Å; R516-D605 IonicContact CZ-OD2 3.16Å; R516-D605 IonicContact NE-OD2 2.75Å; R516-D605 PolarHBondContact NE-OD2 3.38Å; R516-D605 IonicContact NH2-OD2 3.67Å; I603-D605 WeakPolarHBondContact CG2-O 3.31Å; D605-I607 PolarHBondContact O-N 3.03Å; D605-I607 VanDerWaalsContact O-N 3.14Å; D605-I607 VanDerWaalsContact OD1-CB 3.27Å; D605-I607 WeakPolarHBondContact OD1-CB 3.45Å; D605-I607 PolarHBondContact OD1-N 2.86Å; D605-V608 HydrophobicContact CB-CB 4.27Å; D605-V608 HydrophobicContact CB-CG2 3.89Å; D605-V608 WeakPolarHBondContact O-CB 3.37Å; D605-V608 PolarHBondContact O-N 2.86Å; D605-A609 PolarHBondContact O-N 2.95Å
606	P	93.6	Very high	93.8	Very high	39 Å²	39	35.9 Å²	35.9	25%	0.253	18%	0.181	S	C	.	.	H	α-helix	trans	-56.3	-29.9	177.9	-26	35.4	0	0	0	113.8	V581 E604 A609 N610	V581-P606 HydrophobicContact CG2-CB 3.96Å; E604-P606 WeakPolarHBondContact O-CD 3.5Å; P606-A609 PolarHBondContact O-N 3.46Å; P606-N610 WeakPolarHBondContact O-CB 3.27Å; P606-N610 PolarHBondContact O-N 3.05Å; P606-N610 PolarHBondContact O-ND2 2.76Å
607	I	94.8	Very high	93.8	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-39.9	179.1	-61.6	161.3	0	0	0	110.3	R516 T546 F577 D605 C611	R516-I607 HydrophobicContact CG-CG2 4.45Å; T546-I607 HydrophobicContact CG2-CG2 3.93Å; F577-I607 HydrophobicContact CB-CD1 3.85Å; F577-I607 HydrophobicContact CB-CG1 4.02Å; F577-I607 HydrophobicContact CD1-CD1 4.41Å; F577-I607 HydrophobicContact CD1-CG1 4.44Å; F577-I607 HydrophobicContact CD1-CG2 3.38Å; F577-I607 HydrophobicContact CD2-CD1 3.62Å; F577-I607 HydrophobicContact CD2-CG1 4.46Å; F577-I607 HydrophobicContact CD2-CG2 4.37Å; F577-I607 HydrophobicContact CE1-CG2 3.5Å; F577-I607 VanDerWaalsContact CE1-CG2 3.5Å; F577-I607 HydrophobicContact CE2-CD1 4.23Å; F577-I607 HydrophobicContact CE2-CG2 4.46Å; F577-I607 HydrophobicContact CG-CD1 3.72Å; F577-I607 HydrophobicContact CG-CG1 4.08Å; F577-I607 HydrophobicContact CG-CG2 3.85Å; F577-I607 HydrophobicContact CZ-CG2 4.06Å; D605-I607 PolarHBondContact O-N 3.03Å; D605-I607 VanDerWaalsContact O-N 3.14Å; D605-I607 VanDerWaalsContact OD1-CB 3.27Å; D605-I607 WeakPolarHBondContact OD1-CB 3.45Å; D605-I607 PolarHBondContact OD1-N 2.86Å; I607-C611 VanDerWaalsContact O-CB 3.31Å; I607-C611 WeakPolarHBondContact O-CB 3.27Å; I607-C611 PolarHBondContact O-N 3.09Å
608	V	95	Very high	93.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68	-43.1	177.3	175.7	0	0	0	0	110.1	R516 L519 L522 I523 I603 D605 C611 L612	R516-V608 HydrophobicContact CB-CG2 4.22Å; L519-V608 HydrophobicContact CD2-CG1 4.23Å; L519-V608 HydrophobicContact CD2-CG2 4.21Å; L522-V608 HydrophobicContact CB-CG1 4.35Å; L522-V608 HydrophobicContact CB-CG2 4.12Å; L522-V608 HydrophobicContact CD1-CG2 3.71Å; I523-V608 HydrophobicContact CG2-CG1 3.84Å; I603-V608 HydrophobicContact CG2-CB 3.95Å; I603-V608 HydrophobicContact CG2-CG1 3.92Å; D605-V608 HydrophobicContact CB-CB 4.27Å; D605-V608 HydrophobicContact CB-CG2 3.89Å; D605-V608 WeakPolarHBondContact O-CB 3.37Å; D605-V608 PolarHBondContact O-N 2.86Å; V608-C611 PolarHBondContact O-N 2.9Å; V608-L612 HydrophobicContact CG1-CD1 4.42Å; V608-L612 WeakPolarHBondContact O-CG 3.32Å; V608-L612 PolarHBondContact O-N 3.45Å; V608-L612 VanDerWaalsContact O-N 3.08Å
609	A	94.6	Very high	93.8	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.033	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-49.2	176.4	0	0	0	0	0	111.1	V581 I603 D605 P606 C611 L612 I613	V581-A609 HydrophobicContact CG1-CB 4.39Å; V581-A609 HydrophobicContact CG2-CB 4.3Å; I603-A609 HydrophobicContact CB-CB 4.36Å; I603-A609 HydrophobicContact CD1-CB 4.13Å; I603-A609 HydrophobicContact CG2-CB 3.96Å; D605-A609 PolarHBondContact O-N 2.95Å; P606-A609 PolarHBondContact O-N 3.46Å; A609-C611 PolarHBondContact O-N 3.08Å; A609-L612 PolarHBondContact O-N 2.85Å; A609-I613 WeakPolarHBondContact O-CB 3.29Å; A609-I613 WeakPolarHBondContact O-CD1 3.13Å; A609-I613 WeakPolarHBondContact O-CG1 3.45Å; A609-I613 PolarHBondContact O-N 3.27Å
610	N	94.9	Very high	93.9	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-43.9	178.2	-70.9	-16.6	0	0	0	112.1	H580 V581 H582 P606 L612 I613 D614	H580-N610 PolarHBondContact O-ND2 3.01Å; V581-N610 VanDerWaalsContact CA-OD1 3.29Å; V581-N610 WeakPolarHBondContact CA-OD1 3.33Å; H582-N610 PolarHBondContact CD2-OD1 3.19Å; H582-N610 PolarHBondContact N-OD1 2.89Å; P606-N610 WeakPolarHBondContact O-CB 3.27Å; P606-N610 PolarHBondContact O-N 3.05Å; P606-N610 PolarHBondContact O-ND2 2.76Å; N610-L612 VanDerWaalsContact C-N 3.31Å; N610-L612 PolarHBondContact O-N 2.83Å; N610-I613 WeakPolarHBondContact O-CB 3.2Å; N610-I613 PolarHBondContact O-N 3.36Å; N610-D614 VanDerWaalsContact O-CG 3.32Å; N610-D614 PolarHBondContact O-N 3.43Å
611	C	94.6	Very high	94.1	Very high	2 Å²	2	33 Å²	33	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-41	176.6	-175.8	0	0	0	0	112.4	T546 I607 V608 A609 Q615	T546-C611 HydrophobicContact CG2-CB 4.44Å; I607-C611 VanDerWaalsContact O-CB 3.31Å; I607-C611 WeakPolarHBondContact O-CB 3.27Å; I607-C611 PolarHBondContact O-N 3.09Å; V608-C611 PolarHBondContact O-N 2.9Å; A609-C611 PolarHBondContact O-N 3.08Å; C611-Q615 VanDerWaalsContact O-CB 3.3Å; C611-Q615 WeakPolarHBondContact O-CB 3.46Å; C611-Q615 WeakPolarHBondContact O-CG 3.3Å; C611-Q615 PolarHBondContact O-N 3.46Å; C611-Q615 VanDerWaalsContact O-N 3.15Å
612	L	94.9	Very high	94.2	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-73.5	-35.8	178.1	-65.4	178.3	0	0	0	112.3	L519 I523 L538 L541 L601 I603 V608 A609 N610 K616 I618	L519-L612 HydrophobicContact CD1-CD2 4.01Å; I523-L612 HydrophobicContact CG2-CD1 3.99Å; L538-L612 HydrophobicContact CD2-CD2 4.14Å; L541-L612 HydrophobicContact CB-CD2 4.32Å; L541-L612 HydrophobicContact CD1-CD2 4.37Å; L601-L612 HydrophobicContact CD1-CD1 4.3Å; I603-L612 HydrophobicContact CD1-CD1 4.14Å; V608-L612 HydrophobicContact CG1-CD1 4.42Å; V608-L612 WeakPolarHBondContact O-CG 3.32Å; V608-L612 PolarHBondContact O-N 3.45Å; V608-L612 VanDerWaalsContact O-N 3.08Å; A609-L612 PolarHBondContact O-N 2.85Å; N610-L612 VanDerWaalsContact C-N 3.31Å; N610-L612 PolarHBondContact O-N 2.83Å; L612-K616 PolarHBondContact O-N 2.99Å; L612-I618 HydrophobicContact CB-CD1 3.56Å; L612-I618 HydrophobicContact CB-CG1 4.17Å; L612-I618 HydrophobicContact CB-CG2 4.36Å; L612-I618 HydrophobicContact CD1-CD1 4.36Å
613	I	94.1	Very high	94.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-48.5	173.1	-74.4	167.5	0	0	0	110	V581 H582 T584 L598 A609 N610 N617 I618	V581-I613 HydrophobicContact CG1-CD1 3.96Å; H582-I613 HydrophobicContact CB-CG2 4.49Å; T584-I613 HydrophobicContact CG2-CD1 4.03Å; T584-I613 HydrophobicContact CG2-CG2 4.12Å; L598-I613 HydrophobicContact CD1-CD1 4.08Å; L598-I613 HydrophobicContact CD1-CG1 4.24Å; L598-I613 HydrophobicContact CD2-CD1 3.95Å; L598-I613 HydrophobicContact CD2-CG1 4.26Å; A609-I613 WeakPolarHBondContact O-CB 3.29Å; A609-I613 WeakPolarHBondContact O-CD1 3.13Å; A609-I613 WeakPolarHBondContact O-CG1 3.45Å; A609-I613 PolarHBondContact O-N 3.27Å; N610-I613 WeakPolarHBondContact O-CB 3.2Å; N610-I613 PolarHBondContact O-N 3.36Å; I613-N617 WeakPolarHBondContact O-CA 3.4Å; I613-N617 PolarHBondContact O-N 2.97Å; I613-N617 PolarHBondContact O-OD1 3.45Å; I613-I618 HydrophobicContact CG1-CD1 4.22Å; I613-I618 HydrophobicContact CG1-CG1 3.85Å
614	D	93.4	Very high	94.3	Very high	76 Å²	76	27 Å²	27	41%	0.406	14%	0.136	S	C	.	.	H	α-helix	trans	-70.9	-35.3	-177.1	-68.6	-18.5	0	0	0	113.1	H582 N610	H582-D614 IonicContact CD2-OD1 3.75Å; H582-D614 IonicContact NE2-OD1 3.87Å; H582-D614 IonicContact NE2-OD2 3.69Å; N610-D614 VanDerWaalsContact O-CG 3.32Å; N610-D614 PolarHBondContact O-N 3.43Å
615	Q	94.4	Very high	94.4	Very high	83 Å²	83	22.1 Å²	22.1	39%	0.388	11%	0.112	S	C	.	.	H	α-helix	trans	-87.3	-29.6	-174.1	-64.2	-68	-35.6	0	0	113.4	L541 I573 C611	L541-Q615 HydrophobicContact CD1-CB 4.01Å; L541-Q615 HydrophobicContact CD2-CB 4.26Å; I573-Q615 HydrophobicContact CD1-CG 4.17Å; I573-Q615 HydrophobicContact CG2-CG 4.27Å; C611-Q615 VanDerWaalsContact O-CB 3.3Å; C611-Q615 WeakPolarHBondContact O-CB 3.46Å; C611-Q615 WeakPolarHBondContact O-CG 3.3Å; C611-Q615 PolarHBondContact O-N 3.46Å; C611-Q615 VanDerWaalsContact O-N 3.15Å
616	K	92.7	Very high	94.4	Very high	57 Å²	57	24.6 Å²	24.6	25%	0.248	13%	0.125	C	C	.	.	H	α-helix	trans	-129.8	-4.5	-174.8	-72.5	-65.5	-178.8	-176.5	0	115.2	L538 L541 L612 I618 I621	L538-K616 HydrophobicContact CD2-CG 4.43Å; L541-K616 HydrophobicContact CD1-CB 4.41Å; L541-K616 HydrophobicContact CD1-CD 4.03Å; L541-K616 HydrophobicContact CD1-CG 3.22Å; L612-K616 PolarHBondContact O-N 2.99Å; K616-I618 HydrophobicContact CB-CG2 3.79Å; K616-I618 PolarHBondContact O-N 3.19Å; K616-I621 VanDerWaalsContact O-CD1 3.27Å; K616-I621 WeakPolarHBondContact O-CD1 3.27Å
617	N	94.2	Very high	94.3	Very high	64 Å²	64	26.2 Å²	26.2	34%	0.342	13%	0.126	S	C	.	.			trans	49.7	48.1	-174.1	-54.6	-45.9	0	0	0	111.1	I613 E619 S620 I644	I613-N617 WeakPolarHBondContact O-CA 3.4Å; I613-N617 PolarHBondContact O-N 2.97Å; I613-N617 PolarHBondContact O-OD1 3.45Å; N617-E619 WeakPolarHBondContact CA-OE2 3.31Å; N617-E619 PolarHBondContact O-N 3.33Å; N617-S620 VanDerWaalsContact CB-OG 3.27Å; N617-S620 WeakPolarHBondContact CB-OG 3.36Å; N617-S620 WeakPolarHBondContact O-CB 3.37Å; N617-S620 PolarHBondContact O-N 2.71Å; N617-S620 PolarHBondContact O-OG 3.46Å; N617-I644 HydrophobicContact CB-CD1 4.38Å
618	I	94.6	Very high	94	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-58.6	-19.4	-173.9	53.1	164.2	0	0	0	113.9	L538 V597 L598 L601 I603 L612 I613 K616 S620	L538-I618 HydrophobicContact CD2-CG2 3.96Å; V597-I618 HydrophobicContact CB-CB 3.96Å; V597-I618 HydrophobicContact CB-CG2 4.33Å; V597-I618 WeakPolarHBondContact CB-O 3.42Å; V597-I618 HydrophobicContact CG1-CB 3.9Å; V597-I618 HydrophobicContact CG1-CG2 3.86Å; V597-I618 PolarHBondContact N-O 3.03Å; L598-I618 HydrophobicContact CB-CB 4.48Å; L598-I618 HydrophobicContact CB-CD1 4.06Å; L598-I618 HydrophobicContact CB-CG1 4.03Å; L598-I618 HydrophobicContact CD1-CD1 3.64Å; L598-I618 HydrophobicContact CD1-CG1 4.25Å; L598-I618 HydrophobicContact CG-CD1 4.44Å; L598-I618 PolarHBondContact N-O 3.39Å; L601-I618 HydrophobicContact CD1-CD1 4.29Å; I603-I618 HydrophobicContact CD1-CD1 4.46Å; L612-I618 HydrophobicContact CB-CD1 3.56Å; L612-I618 HydrophobicContact CB-CG1 4.17Å; L612-I618 HydrophobicContact CB-CG2 4.36Å; L612-I618 HydrophobicContact CD1-CD1 4.36Å; I613-I618 HydrophobicContact CG1-CD1 4.22Å; I613-I618 HydrophobicContact CG1-CG1 3.85Å; K616-I618 HydrophobicContact CB-CG2 3.79Å; K616-I618 PolarHBondContact O-N 3.19Å; I618-S620 VanDerWaalsContact C-N 3.26Å; I618-S620 PolarHBondContact O-N 3.37Å
619	E	94.4	Very high	93.8	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.014	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-71.2	-16.4	171.8	75.8	-73.6	178.7	0	0	114.1	T584 R587 A588 V589 L598 N617	T584-E619 HydrophobicContact CG2-CB 4.05Å; T584-E619 HydrophobicContact CG2-CG 3.83Å; R587-E619 HydrophobicContact CG-CG 4.22Å; R587-E619 IonicContact CZ-OE1 3.57Å; R587-E619 IonicContact NE-OE1 2.91Å; R587-E619 PolarHBondContact NE-OE1 2.74Å; R587-E619 IonicContact NH2-OE1 2.8Å; R587-E619 PolarHBondContact NH2-OE1 2.68Å; R587-E619 IonicContact NH2-OE2 2.84Å; A588-E619 CarbonylContact C-O 3.53Å; A588-E619 VanDerWaalsContact CA-O 3.31Å; A588-E619 WeakPolarHBondContact CA-O 3.37Å; A588-E619 HydrophobicContact CB-CB 4.08Å; A588-E619 HydrophobicContact CB-CG 4.31Å; V589-E619 WeakPolarHBondContact CG1-O 3.34Å; V589-E619 PolarHBondContact N-O 2.88Å; L598-E619 HydrophobicContact CB-CB 4.25Å; L598-E619 HydrophobicContact CD2-CB 3.74Å; N617-E619 WeakPolarHBondContact CA-OE2 3.31Å; N617-E619 PolarHBondContact O-N 3.33Å
620	S	94.6	Very high	93.7	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-109.1	9.1	-175.5	71.7	0	0	0	0	113.2	N617 I618 N642 C643 I644	N617-S620 VanDerWaalsContact CB-OG 3.27Å; N617-S620 WeakPolarHBondContact CB-OG 3.36Å; N617-S620 WeakPolarHBondContact O-CB 3.37Å; N617-S620 PolarHBondContact O-N 2.71Å; N617-S620 PolarHBondContact O-OG 3.46Å; I618-S620 VanDerWaalsContact C-N 3.26Å; I618-S620 PolarHBondContact O-N 3.37Å; S620-N642 VanDerWaalsContact CB-O 3.29Å; S620-N642 WeakPolarHBondContact CB-O 3.2Å; S620-C643 WeakPolarHBondContact O-CA 3.42Å; S620-I644 PolarHBondContact O-N 2.98Å; S620-I644 WeakPolarHBondContact OG-CD1 3.46Å
621	I	95.9	Very high	93.4	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.5	-175.5	-59.7	174.5	0	0	0	109.3	S596 V597 K616 Q645 F647	S596-I621 CarbonylContact C-O 3.5Å; S596-I621 WeakPolarHBondContact CA-O 3.34Å; S596-I621 WeakPolarHBondContact CB-O 3.34Å; V597-I621 HydrophobicContact CB-CB 4.48Å; V597-I621 HydrophobicContact CG2-CB 3.8Å; V597-I621 HydrophobicContact CG2-CG2 3.54Å; V597-I621 PolarHBondContact N-O 3.41Å; K616-I621 VanDerWaalsContact O-CD1 3.27Å; K616-I621 WeakPolarHBondContact O-CD1 3.27Å; I621-Q645 WeakPolarHBondContact CA-O 3.23Å; I621-Q645 HydrophobicContact CB-CG 4.43Å; I621-Q645 HydrophobicContact CD1-CG 4.22Å; I621-Q645 VanDerWaalsContact CD1-NE2 3.26Å; I621-Q645 HydrophobicContact CG1-CG 3.82Å; I621-Q645 HydrophobicContact CG2-CG 4.04Å; I621-F647 HydrophobicContact CG2-CD2 3.68Å; I621-F647 HydrophobicContact CG2-CE2 3.88Å
622	L	95.7	Very high	93.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	149.3	177.4	-72.3	176.6	0	0	0	113.1	V589 H591 Y594 I624 P640 Q645 A646 F647	V589-L622 HydrophobicContact CB-CD2 4.43Å; V589-L622 HydrophobicContact CG1-CD2 3.54Å; V589-L622 HydrophobicContact CG1-CG 3.88Å; V589-L622 HydrophobicContact CG2-CD1 4.04Å; V589-L622 HydrophobicContact CG2-CD2 3.95Å; V589-L622 HydrophobicContact CG2-CG 3.95Å; H591-L622 HydrophobicContact CB-CD1 4.29Å; H591-L622 HydrophobicContact CB-CD2 3.97Å; Y594-L622 WeakPolarHBondContact O-CD2 3.29Å; L622-I624 HydrophobicContact CB-CD1 4.33Å; L622-I624 HydrophobicContact CB-CG1 4.24Å; L622-I624 HydrophobicContact CD1-CD1 4.45Å; L622-P640 HydrophobicContact CD1-CB 4.36Å; L622-P640 HydrophobicContact CD1-CG 4.01Å; L622-Q645 PolarHBondContact N-O 3.41Å; L622-Q645 VanDerWaalsContact N-O 3.08Å; L622-A646 HydrophobicContact CB-CB 4.07Å; L622-A646 CarbonylContact O-C 3.48Å; L622-A646 WeakPolarHBondContact O-CA 3.4Å; L622-F647 PolarHBondContact O-N 3.1Å
623	L	95.1	Very high	92.9	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.9	169.6	-63.6	176.5	0	0	0	109.8	L530 A533 V534 P595 V597 A600 F647	L530-L623 HydrophobicContact CB-CD1 4.37Å; L530-L623 HydrophobicContact CD1-CB 4.01Å; L530-L623 HydrophobicContact CD1-CD1 3.92Å; L530-L623 HydrophobicContact CD2-CB 4.31Å; A533-L623 HydrophobicContact CB-CD2 3.87Å; V534-L623 HydrophobicContact CG2-CD1 3.76Å; V534-L623 HydrophobicContact CG2-CD2 4.48Å; P595-L623 PolarHBondContact O-N 2.86Å; V597-L623 HydrophobicContact CG2-CD1 4.17Å; V597-L623 HydrophobicContact CG2-CD2 3.84Å; V597-L623 HydrophobicContact CG2-CG 3.86Å; A600-L623 HydrophobicContact CB-CD1 3.55Å; L623-F647 HydrophobicContact CD2-CB 3.98Å
624	I	94.4	Very high	92.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.212	C	C	.	.			trans	-127.8	108.8	-173.6	-55.5	174.7	0	0	0	108.7	Y594 L622 N626 E629 A630 I633 A646 F647 S648	Y594-I624 HydrophobicContact CD1-CB 4.31Å; Y594-I624 HydrophobicContact CD1-CG1 4.06Å; Y594-I624 HydrophobicContact CD1-CG2 4.1Å; Y594-I624 HydrophobicContact CD2-CD1 4.22Å; Y594-I624 HydrophobicContact CD2-CG1 4Å; Y594-I624 HydrophobicContact CE1-CG2 3.88Å; Y594-I624 HydrophobicContact CE2-CG2 4.48Å; Y594-I624 HydrophobicContact CG-CB 4.48Å; Y594-I624 HydrophobicContact CG-CD1 4.46Å; Y594-I624 HydrophobicContact CG-CG1 3.75Å; Y594-I624 HydrophobicContact CG-CG2 4.47Å; L622-I624 HydrophobicContact CB-CD1 4.33Å; L622-I624 HydrophobicContact CB-CG1 4.24Å; L622-I624 HydrophobicContact CD1-CD1 4.45Å; I624-N626 VanDerWaalsContact C-N 3.32Å; I624-N626 PolarHBondContact O-N 3.21Å; I624-E629 HydrophobicContact CG2-CB 4.32Å; I624-E629 HydrophobicContact CG2-CG 4.07Å; I624-A630 HydrophobicContact CB-CB 3.77Å; I624-A630 HydrophobicContact CD1-CB 4.05Å; I624-A630 HydrophobicContact CG1-CB 4.47Å; I624-A630 HydrophobicContact CG2-CB 3.82Å; I624-I633 HydrophobicContact CD1-CB 4.41Å; I624-I633 HydrophobicContact CD1-CD1 4.18Å; I624-I633 HydrophobicContact CD1-CG2 4.4Å; I624-A646 HydrophobicContact CD1-CB 3.96Å; I624-A646 HydrophobicContact CG1-CB 4.42Å; I624-F647 PolarHBondContact N-O 2.81Å; I624-S648 VanDerWaalsContact O-CA 3.28Å; I624-S648 WeakPolarHBondContact O-CA 3.36Å
625	K	93.1	Very high	92.6	Very high	78 Å²	78	45.3 Å²	45.3	34%	0.339	21%	0.209	S	C	.	.	S	Bend	trans	-55.7	-43.2	-170.7	-66.1	-173.8	179.8	-166.2	0	113.6	D527 E529 L530 K649	D527-K625 IonicContact OD1-NZ 3.86Å; D527-K625 WeakPolarHBondContact OD2-CE 3.44Å; D527-K625 IonicContact OD2-NZ 2.8Å; D527-K625 PolarHBondContact OD2-NZ 3.5Å; E529-K625 IonicContact OE2-NZ 3.79Å; E529-K625 PolarHBondContact OE2-NZ 3.04Å; L530-K625 HydrophobicContact CD2-CG 3.88Å; K625-K649 HydrophobicContact CB-CB 4.43Å; K625-K649 VanDerWaalsContact O-CG 3.31Å; K625-K649 WeakPolarHBondContact O-CG 3.45Å; K625-K649 PolarHBondContact O-N 3.46Å
626	N	92.8	Very high	91.9	Very high	86 Å²	86	43 Å²	43	46%	0.46	21%	0.207	S	C	.	.			trans	-90.2	121.8	-178.3	-175.3	-34.9	0	0	0	111.4	I624 T628 E629 A630	I624-N626 VanDerWaalsContact C-N 3.32Å; I624-N626 PolarHBondContact O-N 3.21Å; N626-T628 PolarHBondContact O-N 3.45Å; N626-T628 WeakPolarHBondContact OD1-CB 3.18Å; N626-T628 PolarHBondContact OD1-N 3.39Å; N626-E629 HydrophobicContact CB-CB 3.91Å; N626-E629 WeakPolarHBondContact O-CB 3.48Å; N626-E629 PolarHBondContact O-N 3.43Å; N626-E629 PolarHBondContact OD1-N 3.34Å; N626-A630 WeakPolarHBondContact O-CB 3.41Å; N626-A630 PolarHBondContact O-N 3.2Å
627	R	91.1	Very high	91	Very high	72 Å²	72	50.3 Å²	50.3	27%	0.272	24%	0.239	S	C	.	.	H	α-helix	trans	-57.4	-43.9	-179.9	-173.2	-172.8	-164.2	174.6	7.9	113.7	E629 A630 R631 D652 S661	R627-E629 VanDerWaalsContact C-N 3.3Å; R627-A630 PolarHBondContact O-N 3.19Å; R627-R631 VanDerWaalsContact NE-NH2 3.1Å; R627-R631 VanDerWaalsContact NH2-NH2 3.15Å; R627-R631 WeakPolarHBondContact O-CG 3.46Å; R627-R631 PolarHBondContact O-N 3.28Å; R627-D652 WeakPolarHBondContact CD-OD2 3.38Å; R627-D652 WeakPolarHBondContact CG-OD2 3.37Å; R627-D652 IonicContact CZ-OD1 3.96Å; R627-D652 IonicContact CZ-OD2 2.85Å; R627-D652 IonicContact NE-OD1 2.57Å; R627-D652 IonicContact NE-OD2 3.41Å; R627-D652 PolarHBondContact NE-OD2 3.46Å; R627-D652 IonicContact NH2-OD1 2.61Å; R627-D652 PolarHBondContact NH2-OD1 3.42Å; R627-S661 PolarHBondContact NH2-OG 3.31Å
628	T	90.5	Very high	90.3	Very high	101 Å²	101	54.4 Å²	54.4	62%	0.62	26%	0.261	S	S	*	.	H	α-helix	trans	-67.1	-39	-177.4	-54.8	0	0	0	0	110.6	N626 R631 R632	N626-T628 PolarHBondContact O-N 3.45Å; N626-T628 WeakPolarHBondContact OD1-CB 3.18Å; N626-T628 PolarHBondContact OD1-N 3.39Å; T628-R631 PolarHBondContact O-N 3.26Å; T628-R632 WeakPolarHBondContact O-CB 3.41Å; T628-R632 PolarHBondContact O-N 3.1Å
629	E	90.9	Very high	89.9	Confident	48 Å²	48	57 Å²	57	22%	0.224	28%	0.278	C	S	.	.	H	α-helix	trans	-67.2	-42.5	175	180	156.6	-117.8	0	0	112.2	Y594 I624 N626 R627 R631 R632 I633	Y594-E629 WeakPolarHBondContact OH-CG 3.42Å; Y594-E629 PolarHBondContact OH-OE1 3.21Å; Y594-E629 PolarHBondContact OH-OE2 3.27Å; I624-E629 HydrophobicContact CG2-CB 4.32Å; I624-E629 HydrophobicContact CG2-CG 4.07Å; N626-E629 HydrophobicContact CB-CB 3.91Å; N626-E629 WeakPolarHBondContact O-CB 3.48Å; N626-E629 PolarHBondContact O-N 3.43Å; N626-E629 PolarHBondContact OD1-N 3.34Å; R627-E629 VanDerWaalsContact C-N 3.3Å; E629-R631 VanDerWaalsContact C-N 3.3Å; E629-R631 PolarHBondContact O-N 3.48Å; E629-R632 PolarHBondContact O-N 3.43Å; E629-R632 IonicContact OE1-NH2 3.62Å; E629-R632 PolarHBondContact OE1-NH2 3.22Å; E629-I633 HydrophobicContact CG-CD1 3.82Å; E629-I633 WeakPolarHBondContact O-CG1 3.35Å; E629-I633 PolarHBondContact O-N 3.34Å
630	A	90.6	Very high	89.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58	-43.5	175	0	0	0	0	0	111.7	I624 N626 R627 I633 M634 I654	I624-A630 HydrophobicContact CB-CB 3.77Å; I624-A630 HydrophobicContact CD1-CB 4.05Å; I624-A630 HydrophobicContact CG1-CB 4.47Å; I624-A630 HydrophobicContact CG2-CB 3.82Å; N626-A630 WeakPolarHBondContact O-CB 3.41Å; N626-A630 PolarHBondContact O-N 3.2Å; R627-A630 PolarHBondContact O-N 3.19Å; A630-I633 PolarHBondContact O-N 3.08Å; A630-M634 WeakPolarHBondContact O-CB 3.35Å; A630-M634 WeakPolarHBondContact O-CG 3.39Å; A630-M634 PolarHBondContact O-N 3.34Å; A630-I654 HydrophobicContact CB-CD1 3.88Å; A630-I654 HydrophobicContact CB-CG1 4.26Å
631	R	90.4	Very high	89.2	Confident	84 Å²	84	61.6 Å²	61.6	32%	0.317	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-47	174.7	-71.8	175.3	177.9	177.6	-3.6	111.9	R627 T628 E629 I633 M634 Q635 I654 N659	R627-R631 VanDerWaalsContact NE-NH2 3.1Å; R627-R631 VanDerWaalsContact NH2-NH2 3.15Å; R627-R631 WeakPolarHBondContact O-CG 3.46Å; R627-R631 PolarHBondContact O-N 3.28Å; T628-R631 PolarHBondContact O-N 3.26Å; E629-R631 VanDerWaalsContact C-N 3.3Å; E629-R631 PolarHBondContact O-N 3.48Å; R631-I633 VanDerWaalsContact C-N 3.27Å; R631-I633 PolarHBondContact O-N 3.29Å; R631-M634 PolarHBondContact O-N 3.28Å; R631-Q635 WeakPolarHBondContact O-CA 3.38Å; R631-Q635 WeakPolarHBondContact O-CB 3.28Å; R631-Q635 WeakPolarHBondContact O-CG 3.33Å; R631-Q635 PolarHBondContact O-N 3.5Å; R631-I654 HydrophobicContact CG-CG1 4.29Å; R631-I654 HydrophobicContact CG-CG2 4.39Å; R631-N659 PolarHBondContact NE-ND2 3.21Å
632	R	89.8	Confident	88.9	Confident	159 Å²	159	65.8 Å²	65.8	60%	0.6	34%	0.337	S	S	*	.	H	α-helix	trans	-58.1	-40.1	178.9	175.5	-179.4	53.6	173	-5.3	112.2	T628 E629 G636	T628-R632 WeakPolarHBondContact O-CB 3.41Å; T628-R632 PolarHBondContact O-N 3.1Å; E629-R632 PolarHBondContact O-N 3.43Å; E629-R632 IonicContact OE1-NH2 3.62Å; E629-R632 PolarHBondContact OE1-NH2 3.22Å; R632-G636 WeakPolarHBondContact O-CA 3.16Å; R632-G636 PolarHBondContact O-N 3.16Å; R632-G636 VanDerWaalsContact O-N 3.13Å
633	I	89.1	Confident	88.7	Confident	30 Å²	30	66.4 Å²	66.4	15%	0.154	34%	0.341	C	S	.	.	H	α-helix	trans	-76.6	-44.1	-178.4	-67.9	166.1	0	0	0	111.4	Y594 I624 E629 A630 R631 P640	Y594-I633 HydrophobicContact CD2-CD1 3.86Å; Y594-I633 HydrophobicContact CE2-CD1 3.24Å; I624-I633 HydrophobicContact CD1-CB 4.41Å; I624-I633 HydrophobicContact CD1-CD1 4.18Å; I624-I633 HydrophobicContact CD1-CG2 4.4Å; E629-I633 HydrophobicContact CG-CD1 3.82Å; E629-I633 WeakPolarHBondContact O-CG1 3.35Å; E629-I633 PolarHBondContact O-N 3.34Å; A630-I633 PolarHBondContact O-N 3.08Å; R631-I633 VanDerWaalsContact C-N 3.27Å; R631-I633 PolarHBondContact O-N 3.29Å; I633-P640 HydrophobicContact CG2-CG 3.64Å
634	M	90.6	Very high	88.5	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-79.3	-32.9	-176.7	-68.6	-59.9	-62.3	0	0	113.6	A630 R631 C643 A646 I654 T656	A630-M634 WeakPolarHBondContact O-CB 3.35Å; A630-M634 WeakPolarHBondContact O-CG 3.39Å; A630-M634 PolarHBondContact O-N 3.34Å; R631-M634 PolarHBondContact O-N 3.28Å; M634-C643 HydrophobicContact CE-CB 4.43Å; M634-C643 HydrophobicContact SD-CB 4.35Å; M634-C643 PolarHBondContact SD-SG 3.32Å; M634-A646 HydrophobicContact CG-CB 3.66Å; M634-A646 HydrophobicContact SD-CB 3.97Å; M634-I654 HydrophobicContact CB-CG2 3.61Å; M634-I654 HydrophobicContact CG-CG2 3.86Å; M634-T656 HydrophobicContact CE-CG2 4.26Å; M634-T656 WeakPolarHBondContact O-CA 3.29Å
635	Q	88.8	Confident	88.5	Confident	77 Å²	77	71.5 Å²	71.5	36%	0.36	37%	0.367	S	S	.	.	S	Bend	trans	-105.8	5.5	-176.3	-46.7	-171.1	-41.4	0	0	112.2	R631 F655 T656 N659	R631-Q635 WeakPolarHBondContact O-CA 3.38Å; R631-Q635 WeakPolarHBondContact O-CB 3.28Å; R631-Q635 WeakPolarHBondContact O-CG 3.33Å; R631-Q635 PolarHBondContact O-N 3.5Å; Q635-F655 PolarHBondContact NE2-O 3.48Å; Q635-F655 VanDerWaalsContact NE2-O 3.12Å; Q635-T656 WeakPolarHBondContact CG-O 3.33Å; Q635-N659 VanDerWaalsContact NE2-CG 3.33Å; Q635-N659 PolarHBondContact NE2-ND2 3.46Å; Q635-N659 VanDerWaalsContact NE2-ND2 3.14Å; Q635-N659 PolarHBondContact NE2-OD1 3.5Å; Q635-N659 PolarHBondContact OE1-ND2 3.2Å
636	G	81.1	Confident	88.6	Confident	33 Å²	33	67.8 Å²	67.8	34%	0.34	35%	0.351	S	S	.	.	S	Bend	trans	-69.8	171.2	171.4	0	0	0	0	0	111.9	R632 N638	R632-G636 WeakPolarHBondContact O-CA 3.16Å; R632-G636 PolarHBondContact O-N 3.16Å; R632-G636 VanDerWaalsContact O-N 3.13Å; G636-N638 PolarHBondContact O-N 2.89Å; G636-N638 VanDerWaalsContact O-N 3.17Å
637	K	74.1	Confident	88.8	Confident	211 Å²	211	63.8 Å²	63.8	92%	0.917	33%	0.329	S	S	*	.	S	Bend	trans	-57.3	-33.1	-177.3	-71.4	-175.3	177.1	-178.8	0	113.5
638	N	79.7	Confident	88.9	Confident	151 Å²	151	60.4 Å²	60.4	81%	0.807	32%	0.316	S	S	*	.	S	Bend	trans	-129.3	86.1	-178.3	-67	-10.1	0	0	0	110.3	G636	G636-N638 PolarHBondContact O-N 2.89Å; G636-N638 VanDerWaalsContact O-N 3.17Å
639	P	85.7	Confident	88.9	Confident	55 Å²	55	60.1 Å²	60.1	36%	0.357	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-62.7	152.1	173.1	26.1	-33.2	0	0	0	111.1	A641 T656	P639-A641 PolarHBondContact O-N 3.36Å; P639-T656 HydrophobicContact CB-CG2 4.2Å; P639-T656 HydrophobicContact CG-CG2 4.19Å
640	P	87.9	Confident	88.9	Confident	23 Å²	23	61.9 Å²	61.9	15%	0.149	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-55.5	134	179.3	-25	34	0	0	0	112	V589 L622 I633 N642 C643	V589-P640 HydrophobicContact CG2-CB 3.94Å; L622-P640 HydrophobicContact CD1-CB 4.36Å; L622-P640 HydrophobicContact CD1-CG 4.01Å; I633-P640 HydrophobicContact CG2-CG 3.64Å; P640-N642 PolarHBondContact O-N 2.89Å; P640-C643 HydrophobicContact CB-CB 4.04Å; P640-C643 WeakPolarHBondContact O-CB 3.32Å; P640-C643 PolarHBondContact O-N 3.32Å; P640-C643 VanDerWaalsContact O-N 3.09Å
641	A	85.9	Confident	88.8	Confident	79 Å²	79	61.9 Å²	61.9	65%	0.653	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	139.3	-180	0	0	0	0	0	110.8	P639 C643	P639-A641 PolarHBondContact O-N 3.36Å; A641-C643 PolarHBondContact O-N 3.25Å
642	N	89.5	Confident	88.9	Confident	89 Å²	89	58.4 Å²	58.4	48%	0.476	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	12.7	-176.2	-53.5	-32	0	0	0	115.7	R586 R587 S620 P640	R586-N642 PolarHBondContact O-ND2 3.42Å; R586-N642 VanDerWaalsContact O-ND2 3.12Å; R587-N642 WeakPolarHBondContact O-CB 3.38Å; S620-N642 VanDerWaalsContact CB-O 3.29Å; S620-N642 WeakPolarHBondContact CB-O 3.2Å; P640-N642 PolarHBondContact O-N 2.89Å
643	C	92.1	Very high	89.1	Confident	15 Å²	15	52.8 Å²	52.8	10%	0.101	29%	0.286	C	S	.	.			trans	-88	119.9	173.7	-166.1	0	0	0	0	111.5	V589 S620 M634 P640 A641	V589-C643 HydrophobicContact CB-CB 4.28Å; V589-C643 HydrophobicContact CG2-CB 3.7Å; S620-C643 WeakPolarHBondContact O-CA 3.42Å; M634-C643 HydrophobicContact CE-CB 4.43Å; M634-C643 HydrophobicContact SD-CB 4.35Å; M634-C643 PolarHBondContact SD-SG 3.32Å; P640-C643 HydrophobicContact CB-CB 4.04Å; P640-C643 WeakPolarHBondContact O-CB 3.32Å; P640-C643 PolarHBondContact O-N 3.32Å; P640-C643 VanDerWaalsContact O-N 3.09Å; A641-C643 PolarHBondContact O-N 3.25Å
644	I	91.3	Very high	89.3	Confident	86 Å²	86	51.4 Å²	51.4	44%	0.441	28%	0.279	S	S	.	.			trans	-89.1	-38.9	-179.4	-56.8	179.9	0	0	0	111.3	N617 S620	N617-I644 HydrophobicContact CB-CD1 4.38Å; S620-I644 PolarHBondContact O-N 2.98Å; S620-I644 WeakPolarHBondContact OG-CD1 3.46Å
645	Q	94.2	Very high	89.4	Confident	24 Å²	24	52.8 Å²	52.8	11%	0.112	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	160.6	-176.2	58	-174.4	-2.6	0	0	110.4	I621 L622 F647 I654 F655	I621-Q645 WeakPolarHBondContact CA-O 3.23Å; I621-Q645 HydrophobicContact CB-CG 4.43Å; I621-Q645 HydrophobicContact CD1-CG 4.22Å; I621-Q645 VanDerWaalsContact CD1-NE2 3.26Å; I621-Q645 HydrophobicContact CG1-CG 3.82Å; I621-Q645 HydrophobicContact CG2-CG 4.04Å; L622-Q645 PolarHBondContact N-O 3.41Å; L622-Q645 VanDerWaalsContact N-O 3.08Å; Q645-F647 HydrophobicContact CG-CE2 4.21Å; Q645-I654 CarbonylContact C-O 3.48Å; Q645-I654 WeakPolarHBondContact CA-O 3.49Å; Q645-F655 HydrophobicContact CB-CD1 3.83Å; Q645-F655 HydrophobicContact CB-CE1 3.83Å; Q645-F655 HydrophobicContact CB-CG 4.5Å; Q645-F655 HydrophobicContact CG-CE1 4.5Å
646	A	94.9	Very high	89.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.1	172.1	0	0	0	0	0	111	L622 I624 M634 I654	L622-A646 HydrophobicContact CB-CB 4.07Å; L622-A646 CarbonylContact O-C 3.48Å; L622-A646 WeakPolarHBondContact O-CA 3.4Å; I624-A646 HydrophobicContact CD1-CB 3.96Å; I624-A646 HydrophobicContact CG1-CB 4.42Å; M634-A646 HydrophobicContact CG-CB 3.66Å; M634-A646 HydrophobicContact SD-CB 3.97Å; A646-I654 PolarHBondContact N-O 3.04Å; A646-I654 PolarHBondContact O-N 3.44Å
647	F	95.9	Very high	89.5	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.4	172.2	-71.2	-94.7	0	0	0	111.6	A533 V536 C537 I621 L622 L623 I624 Q645 D652 Q653	A533-F647 HydrophobicContact CB-CB 4.02Å; V536-F647 HydrophobicContact CG1-CD1 4.4Å; V536-F647 HydrophobicContact CG1-CE1 4.03Å; C537-F647 HydrophobicContact CB-CD2 4Å; C537-F647 HydrophobicContact CB-CE1 4.37Å; C537-F647 HydrophobicContact CB-CE2 3.71Å; C537-F647 HydrophobicContact CB-CG 4.44Å; C537-F647 HydrophobicContact CB-CZ 3.91Å; I621-F647 HydrophobicContact CG2-CD2 3.68Å; I621-F647 HydrophobicContact CG2-CE2 3.88Å; L622-F647 PolarHBondContact O-N 3.1Å; L623-F647 HydrophobicContact CD2-CB 3.98Å; I624-F647 PolarHBondContact N-O 2.81Å; Q645-F647 HydrophobicContact CG-CE2 4.21Å; F647-D652 CarbonylContact C-O 3.34Å; F647-D652 VanDerWaalsContact CA-O 3.25Å; F647-D652 WeakPolarHBondContact CA-O 3.31Å; F647-Q653 HydrophobicContact CD1-CB 4.16Å; F647-Q653 HydrophobicContact CD1-CG 4.39Å; F647-Q653 HydrophobicContact CE1-CB 3.69Å; F647-Q653 HydrophobicContact CE1-CG 3.66Å; F647-Q653 HydrophobicContact CE2-CG 4.41Å; F647-Q653 HydrophobicContact CZ-CB 4.25Å; F647-Q653 HydrophobicContact CZ-CG 3.67Å
648	S	94.4	Very high	90.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.			trans	-79.6	163.7	170.1	80.3	0	0	0	0	111.5	A533 I624 D650 G651 D652	A533-S648 WeakPolarHBondContact CB-O 3.38Å; I624-S648 VanDerWaalsContact O-CA 3.28Å; I624-S648 WeakPolarHBondContact O-CA 3.36Å; S648-D650 PolarHBondContact O-N 3.08Å; S648-D650 PolarHBondContact OG-N 3.21Å; S648-G651 PolarHBondContact O-N 3.23Å; S648-D652 PolarHBondContact N-O 3.33Å; S648-D652 VanDerWaalsContact OG-CB 3.23Å; S648-D652 WeakPolarHBondContact OG-CB 3.45Å; S648-D652 PolarHBondContact OG-N 3.23Å; S648-D652 PolarHBondContact OG-OD2 3.02Å
649	K	91.1	Very high	90.7	Very high	96 Å²	96	48.9 Å²	48.9	42%	0.417	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.9	173.8	75.8	-176.9	-173.8	170.4	0	112.3	K625 G651	K625-K649 HydrophobicContact CB-CB 4.43Å; K625-K649 VanDerWaalsContact O-CG 3.31Å; K625-K649 WeakPolarHBondContact O-CG 3.45Å; K625-K649 PolarHBondContact O-N 3.46Å; K649-G651 PolarHBondContact O-N 3.16Å
650	D	89.1	Confident	90.9	Very high	84 Å²	84	51.7 Å²	51.7	45%	0.449	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.4	-178.6	-53.9	-49.4	0	0	0	111.9	L532 S648 S662	L532-D650 WeakPolarHBondContact CD2-O 3.35Å; S648-D650 PolarHBondContact O-N 3.08Å; S648-D650 PolarHBondContact OG-N 3.21Å; D650-S662 WeakPolarHBondContact O-CB 3.28Å
651	G	89.1	Confident	90.9	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.01	28%	0.284	C	S	.	.			trans	84.2	4.3	178.8	0	0	0	0	0	114.6	V536 S648 K649 Q653 S662	V536-G651 WeakPolarHBondContact CG1-O 3.29Å; S648-G651 PolarHBondContact O-N 3.23Å; K649-G651 PolarHBondContact O-N 3.16Å; G651-Q653 PolarHBondContact O-N 3.34Å; G651-S662 WeakPolarHBondContact O-CB 3.11Å
652	D	92.2	Very high	90.8	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.059	26%	0.262	C	S	.	.			trans	-61.5	138.9	176.9	-57.5	-57.1	0	0	0	109.9	R627 F647 S648 I654 Y660 S661	R627-D652 WeakPolarHBondContact CD-OD2 3.38Å; R627-D652 WeakPolarHBondContact CG-OD2 3.37Å; R627-D652 IonicContact CZ-OD1 3.96Å; R627-D652 IonicContact CZ-OD2 2.85Å; R627-D652 IonicContact NE-OD1 2.57Å; R627-D652 IonicContact NE-OD2 3.41Å; R627-D652 PolarHBondContact NE-OD2 3.46Å; R627-D652 IonicContact NH2-OD1 2.61Å; R627-D652 PolarHBondContact NH2-OD1 3.42Å; F647-D652 CarbonylContact C-O 3.34Å; F647-D652 VanDerWaalsContact CA-O 3.25Å; F647-D652 WeakPolarHBondContact CA-O 3.31Å; S648-D652 PolarHBondContact N-O 3.33Å; S648-D652 VanDerWaalsContact OG-CB 3.23Å; S648-D652 WeakPolarHBondContact OG-CB 3.45Å; S648-D652 PolarHBondContact OG-N 3.23Å; S648-D652 PolarHBondContact OG-OD2 3.02Å; D652-I654 HydrophobicContact CB-CD1 4.02Å; D652-I654 WeakPolarHBondContact O-CD1 3.46Å; D652-Y660 CarbonylContact C-O 3.55Å; D652-Y660 WeakPolarHBondContact CA-O 3.46Å; D652-S661 VanDerWaalsContact OD1-CA 3.25Å; D652-S661 WeakPolarHBondContact OD1-CA 3.37Å
653	Q	94.2	Very high	90.3	Very high	40 Å²	40	55.6 Å²	55.6	19%	0.187	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118.4	178.5	-170.7	175.8	12.4	0	0	109.5	F647 G651 F655 N659 Y660	F647-Q653 HydrophobicContact CD1-CB 4.16Å; F647-Q653 HydrophobicContact CD1-CG 4.39Å; F647-Q653 HydrophobicContact CE1-CB 3.69Å; F647-Q653 HydrophobicContact CE1-CG 3.66Å; F647-Q653 HydrophobicContact CE2-CG 4.41Å; F647-Q653 HydrophobicContact CZ-CB 4.25Å; F647-Q653 HydrophobicContact CZ-CG 3.67Å; G651-Q653 PolarHBondContact O-N 3.34Å; Q653-F655 HydrophobicContact CG-CD2 4.29Å; Q653-F655 HydrophobicContact CG-CE2 3.66Å; Q653-F655 HydrophobicContact CG-CZ 4.09Å; Q653-N659 WeakPolarHBondContact O-CA 3.31Å; Q653-Y660 PolarHBondContact N-O 3.33Å; Q653-Y660 PolarHBondContact O-N 2.93Å
654	I	94.1	Very high	89.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.7	-175.9	-62.4	96.3	0	0	0	108.9	A630 R631 M634 Q645 A646 D652 N659	A630-I654 HydrophobicContact CB-CD1 3.88Å; A630-I654 HydrophobicContact CB-CG1 4.26Å; R631-I654 HydrophobicContact CG-CG1 4.29Å; R631-I654 HydrophobicContact CG-CG2 4.39Å; M634-I654 HydrophobicContact CB-CG2 3.61Å; M634-I654 HydrophobicContact CG-CG2 3.86Å; Q645-I654 CarbonylContact C-O 3.48Å; Q645-I654 WeakPolarHBondContact CA-O 3.49Å; A646-I654 PolarHBondContact N-O 3.04Å; A646-I654 PolarHBondContact O-N 3.44Å; D652-I654 HydrophobicContact CB-CD1 4.02Å; D652-I654 WeakPolarHBondContact O-CD1 3.46Å; I654-N659 WeakPolarHBondContact CG2-OD1 3.44Å
655	F	92.6	Very high	89	Confident	30 Å²	30	59 Å²	59	13%	0.132	30%	0.303	C	S	.	.			trans	-106.5	169.6	168.9	-64.1	-88.4	0	0	0	109.9	Q635 Q645 Q653 N657 R658 Y660	Q635-F655 PolarHBondContact NE2-O 3.48Å; Q635-F655 VanDerWaalsContact NE2-O 3.12Å; Q645-F655 HydrophobicContact CB-CD1 3.83Å; Q645-F655 HydrophobicContact CB-CE1 3.83Å; Q645-F655 HydrophobicContact CB-CG 4.5Å; Q645-F655 HydrophobicContact CG-CE1 4.5Å; Q653-F655 HydrophobicContact CG-CD2 4.29Å; Q653-F655 HydrophobicContact CG-CE2 3.66Å; Q653-F655 HydrophobicContact CG-CZ 4.09Å; F655-N657 PolarHBondContact O-N 3.37Å; F655-R658 WeakPolarHBondContact CA-O 3.28Å; F655-R658 HydrophobicContact CB-CG 3.73Å; F655-R658 WeakPolarHBondContact CB-O 3.22Å; F655-R658 HydrophobicContact CD2-CG 3.73Å; F655-R658 HydrophobicContact CG-CG 4.01Å; F655-R658 PolarHBondContact N-O 3.36Å; F655-Y660 HydrophobicContact CD2-CD2 4.17Å; F655-Y660 HydrophobicContact CD2-CE2 4.13Å; F655-Y660 AromaticContact CE2-CD2 3.94Å; F655-Y660 HydrophobicContact CE2-CD2 3.94Å; F655-Y660 AromaticContact CE2-CE2 3.94Å; F655-Y660 HydrophobicContact CE2-CE2 3.94Å
656	T	88.4	Confident	88.3	Confident	56 Å²	56	62.4 Å²	62.4	34%	0.344	32%	0.315	S	S	.	.	S	Bend	trans	-54.3	-35.4	175.7	52.2	0	0	0	0	113.6	M634 Q635 P639	M634-T656 HydrophobicContact CE-CG2 4.26Å; M634-T656 WeakPolarHBondContact O-CA 3.29Å; Q635-T656 WeakPolarHBondContact CG-O 3.33Å; P639-T656 HydrophobicContact CB-CG2 4.2Å; P639-T656 HydrophobicContact CG-CG2 4.19Å
657	N	84.2	Confident	87.8	Confident	150 Å²	150	63.5 Å²	63.5	80%	0.802	32%	0.322	S	S	*	.	S	Bend	trans	-119.5	-3.1	-174	-61.8	-8.2	0	0	0	114.8	F655	F655-N657 PolarHBondContact O-N 3.37Å
658	R	88.5	Confident	87	Confident	134 Å²	134	65.5 Å²	65.5	51%	0.506	33%	0.333	S	S	.	.			trans	-156.9	154.3	-172.2	60.6	-176.1	-176.1	-179.6	-5	112.6	F655 Y660	F655-R658 WeakPolarHBondContact CA-O 3.28Å; F655-R658 HydrophobicContact CB-CG 3.73Å; F655-R658 WeakPolarHBondContact CB-O 3.22Å; F655-R658 HydrophobicContact CD2-CG 3.73Å; F655-R658 HydrophobicContact CG-CG 4.01Å; F655-R658 PolarHBondContact N-O 3.36Å; R658-Y660 HydrophobicContact CB-CE2 4.49Å; R658-Y660 WeakPolarHBondContact CD-OH 3.15Å; R658-Y660 HydrophobicContact CG-CE2 3.93Å; R658-Y660 PolarHBondContact NH1-OH 3.11Å
659	N	89.1	Confident	86.5	Confident	51 Å²	51	68 Å²	68	27%	0.273	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.6	-179.5	-62.7	-41.2	0	0	0	110.5	R631 Q635 Q653 I654	R631-N659 PolarHBondContact NE-ND2 3.21Å; Q635-N659 VanDerWaalsContact NE2-CG 3.33Å; Q635-N659 PolarHBondContact NE2-ND2 3.46Å; Q635-N659 VanDerWaalsContact NE2-ND2 3.14Å; Q635-N659 PolarHBondContact NE2-OD1 3.5Å; Q635-N659 PolarHBondContact OE1-ND2 3.2Å; Q653-N659 WeakPolarHBondContact O-CA 3.31Å; I654-N659 WeakPolarHBondContact CG2-OD1 3.44Å
660	Y	90.1	Very high	86.1	Confident	114 Å²	114	64.1 Å²	64.1	45%	0.447	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.4	173.4	-61.2	-82	0	0	0	109.5	D652 Q653 F655 R658	D652-Y660 CarbonylContact C-O 3.55Å; D652-Y660 WeakPolarHBondContact CA-O 3.46Å; Q653-Y660 PolarHBondContact N-O 3.33Å; Q653-Y660 PolarHBondContact O-N 2.93Å; F655-Y660 HydrophobicContact CD2-CD2 4.17Å; F655-Y660 HydrophobicContact CD2-CE2 4.13Å; F655-Y660 AromaticContact CE2-CD2 3.94Å; F655-Y660 HydrophobicContact CE2-CD2 3.94Å; F655-Y660 AromaticContact CE2-CE2 3.94Å; F655-Y660 HydrophobicContact CE2-CE2 3.94Å; R658-Y660 HydrophobicContact CB-CE2 4.49Å; R658-Y660 WeakPolarHBondContact CD-OH 3.15Å; R658-Y660 HydrophobicContact CG-CE2 3.93Å; R658-Y660 PolarHBondContact NH1-OH 3.11Å
661	S	88.4	Confident	85.3	Confident	78 Å²	78	61 Å²	61	55%	0.545	31%	0.311	S	S	.	.			trans	-79.3	148.2	171.4	-55.4	0	0	0	0	110.2	R627 D652	R627-S661 PolarHBondContact NH2-OG 3.31Å; D652-S661 VanDerWaalsContact OD1-CA 3.25Å; D652-S661 WeakPolarHBondContact OD1-CA 3.37Å
662	S	84.3	Confident	84.2	Confident	26 Å²	26	64.4 Å²	64.4	18%	0.182	35%	0.346	C	S	.	.			trans	-75.1	132.1	175.5	-175.2	0	0	0	0	111.5	D650 G651 Q664	D650-S662 WeakPolarHBondContact O-CB 3.28Å; G651-S662 WeakPolarHBondContact O-CB 3.11Å; S662-Q664 VanDerWaalsContact C-N 3.26Å; S662-Q664 WeakPolarHBondContact CB-O 3.5Å; S662-Q664 PolarHBondContact OG-N 2.95Å; S662-Q664 PolarHBondContact OG-O 3.35Å
663	D	78.1	Confident	83.3	Confident	169 Å²	169	67.2 Å²	67.2	90%	0.904	36%	0.361	S	S	*	.	S	Bend	trans	-75.2	-21.2	166.3	-62.4	-35.5	0	0	0	111.5
664	Q	80	Confident	82.5	Confident	53 Å²	53	66.4 Å²	66.4	25%	0.248	36%	0.359	C	S	.	.			trans	-89.6	117.8	177.2	-173.2	176.4	-18.6	0	0	109.3	L532 E535 V536 S662 R666 N668	L532-Q664 HydrophobicContact CD1-CB 4.23Å; L532-Q664 HydrophobicContact CD1-CG 3.75Å; E535-Q664 PolarHBondContact OE2-NE2 3.15Å; V536-Q664 HydrophobicContact CG2-CB 4.12Å; S662-Q664 VanDerWaalsContact C-N 3.26Å; S662-Q664 WeakPolarHBondContact CB-O 3.5Å; S662-Q664 PolarHBondContact OG-N 2.95Å; S662-Q664 PolarHBondContact OG-O 3.35Å; Q664-R666 VanDerWaalsContact CG-O 3.25Å; Q664-R666 WeakPolarHBondContact CG-O 3Å; Q664-R666 PolarHBondContact NE2-O 3.19Å; Q664-N668 PolarHBondContact NE2-ND2 2.95Å
665	T	76.7	Confident	81.9	Confident	120 Å²	120	69.6 Å²	69.6	74%	0.736	37%	0.374	S	S	*	.			trans	-92.5	-17.4	-177	53.5	0	0	0	0	113.6
666	R	79.6	Confident	81.4	Confident	94 Å²	94	73.6 Å²	73.6	36%	0.355	39%	0.393	S	S	.	.	S	Bend	trans	-145.2	149	-178	-67.8	-163.3	-176.8	-87.2	-2.1	113.2	Q664 E677	Q664-R666 VanDerWaalsContact CG-O 3.25Å; Q664-R666 WeakPolarHBondContact CG-O 3Å; Q664-R666 PolarHBondContact NE2-O 3.19Å; R666-E677 WeakPolarHBondContact CD-OE2 3.34Å
667	P	83.1	Confident	81	Confident	24 Å²	24	71.5 Å²	71.5	16%	0.156	38%	0.379	C	S	.	.			trans	-72.5	133.9	177.4	27	-29.6	0	0	0	111.7	A531 L532 E535	A531-P667 HydrophobicContact CB-CB 3.92Å; A531-P667 HydrophobicContact CB-CG 4.14Å; L532-P667 HydrophobicContact CB-CB 4.42Å; E535-P667 WeakPolarHBondContact OE1-CA 3.43Å; E535-P667 VanDerWaalsContact OE1-CB 3.26Å; E535-P667 WeakPolarHBondContact OE1-CB 3.33Å; E535-P667 WeakPolarHBondContact OE2-CA 3.44Å
668	N	80.3	Confident	81	Confident	43 Å²	43	64.4 Å²	64.4	23%	0.23	34%	0.341	C	S	.	.	S	Bend	trans	-103	-27.1	-176.2	-65.8	-39.5	0	0	0	113.5	K476 E535 Q664	K476-N668 WeakPolarHBondContact CE-OD1 3.37Å; K476-N668 PolarHBondContact NZ-OD1 2.92Å; E535-N668 VanDerWaalsContact CD-N 3.28Å; E535-N668 PolarHBondContact OE1-N 2.99Å; E535-N668 PolarHBondContact OE2-N 3.49Å; Q664-N668 PolarHBondContact NE2-ND2 2.95Å
669	Y	82.8	Confident	81	Confident	52 Å²	52	64.4 Å²	64.4	20%	0.204	34%	0.341	C	S	.	.	S	Bend	trans	-113	-51.2	-169.6	-58.6	-78	0	0	0	112.2	R490 F491 E535 L542 M543	R490-Y669 PolarHBondContact NH1-O 3.44Å; R490-Y669 WeakPolarHBondContact O-CE1 3.38Å; F491-Y669 AromaticContact CD1-CD1 3.55Å; F491-Y669 HydrophobicContact CD1-CD1 3.55Å; F491-Y669 HydrophobicContact CD1-CE1 4.03Å; F491-Y669 HydrophobicContact CD1-CG 4.4Å; F491-Y669 AromaticContact CE1-CD1 3.59Å; F491-Y669 HydrophobicContact CE1-CD1 3.59Å; F491-Y669 HydrophobicContact CE1-CE1 4.46Å; F491-Y669 HydrophobicContact CE1-CG 4.02Å; F491-Y669 HydrophobicContact CG-CD1 4.23Å; F491-Y669 HydrophobicContact CZ-CD1 4.29Å; E535-Y669 HydrophobicContact CG-CD2 4.39Å; E535-Y669 WeakPolarHBondContact OE1-CA 3.36Å; E535-Y669 PolarHBondContact OE1-N 2.94Å; L542-Y669 HydrophobicContact CD1-CD2 3.49Å; L542-Y669 VanDerWaalsContact CD1-CD2 3.49Å; L542-Y669 HydrophobicContact CD1-CE2 4.06Å; L542-Y669 HydrophobicContact CD1-CG 4.07Å; M543-Y669 HydrophobicContact CG-CE1 4.28Å; M543-Y669 HydrophobicContact SD-CE1 4.46Å
670	L	82.7	Confident	80.8	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.079	34%	0.343	C	S	.	.	S	Bend	trans	-93	0.2	-174.3	-59.5	179.6	0	0	0	113.1	I523 A531 V534 E535 L542 G672	I523-L670 HydrophobicContact CG1-CD2 4.36Å; A531-L670 HydrophobicContact CB-CB 4.13Å; V534-L670 HydrophobicContact CB-CD1 4.19Å; V534-L670 HydrophobicContact CG1-CD1 3.68Å; E535-L670 HydrophobicContact CG-CB 4.26Å; E535-L670 HydrophobicContact CG-CD1 4.06Å; E535-L670 HydrophobicContact CG-CG 4.05Å; E535-L670 PolarHBondContact OE1-N 3.23Å; L542-L670 HydrophobicContact CD2-CD1 4.4Å; L670-G672 PolarHBondContact O-N 3.48Å
671	S	73.8	Confident	80.7	Confident	19 Å²	19	59.8 Å²	59.8	13%	0.133	32%	0.322	C	S	.	.			trans	-58.5	133.9	175.6	-174.1	0	0	0	0	112.4	R490	R490-S671 PolarHBondContact NH1-O 3.49Å; R490-S671 PolarHBondContact NH2-O 2.82Å
672	G	65	Low	80.8	Confident	72 Å²	72	60 Å²	60	74%	0.742	31%	0.314	S	S	*	.	S	Bend	trans	-77.9	-36.9	178	0	0	0	0	0	114	L670	L670-G672 PolarHBondContact O-N 3.48Å
673	D	73.4	Confident	81.2	Confident	71 Å²	71	66.5 Å²	66.5	38%	0.38	34%	0.335	S	S	.	.			trans	-105.9	99.3	-175	-165.6	-20.9	0	0	0	112	E675 E676	D673-E675 VanDerWaalsContact C-N 3.32Å; D673-E675 WeakPolarHBondContact OD1-CA 3.49Å; D673-E675 PolarHBondContact OD1-N 3.44Å; D673-E676 HydrophobicContact CB-CB 4.11Å; D673-E676 PolarHBondContact OD1-N 2.78Å
674	V	77.4	Confident	81.7	Confident	22 Å²	22	61.5 Å²	61.5	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-67.8	-33.8	175.7	179.6	0	0	0	0	111.7	M480 R484 I678	M480-V674 HydrophobicContact CE-CG1 4.33Å; R484-V674 HydrophobicContact CG-CG1 4.36Å; V674-I678 HydrophobicContact CG1-CD1 3.68Å; V674-I678 HydrophobicContact CG1-CG1 4.25Å; V674-I678 WeakPolarHBondContact O-CB 3.42Å; V674-I678 VanDerWaalsContact O-CG1 3.28Å; V674-I678 WeakPolarHBondContact O-CG1 3.43Å; V674-I678 PolarHBondContact O-N 2.7Å
675	E	82.6	Confident	82.3	Confident	69 Å²	69	60.1 Å²	60.1	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-76.9	-30.3	-172.4	-71.3	-57.6	155	0	0	112.1	R484 D673 R679	R484-E675 IonicContact CZ-OE1 3.12Å; R484-E675 IonicContact CZ-OE2 3.45Å; R484-E675 IonicContact NE-OE1 3.41Å; R484-E675 PolarHBondContact NE-OE1 3.46Å; R484-E675 IonicContact NE-OE2 2.6Å; R484-E675 VanDerWaalsContact NH2-CD 3.27Å; R484-E675 IonicContact NH2-OE1 2.76Å; R484-E675 PolarHBondContact NH2-OE1 2.87Å; R484-E675 IonicContact NH2-OE2 3.6Å; R484-E675 PolarHBondContact NH2-OE2 3.47Å; D673-E675 VanDerWaalsContact C-N 3.32Å; D673-E675 WeakPolarHBondContact OD1-CA 3.49Å; D673-E675 PolarHBondContact OD1-N 3.44Å; E675-R679 WeakPolarHBondContact O-CB 3.35Å; E675-R679 WeakPolarHBondContact O-CG 3.22Å; E675-R679 PolarHBondContact O-N 3.41Å; E675-R679 PolarHBondContact O-NE 3.37Å
676	E	80.9	Confident	83.1	Confident	114 Å²	114	61 Å²	61	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-45.3	171.9	-167.1	178.9	178.7	0	0	111.6	D673 I678 R679 H680	D673-E676 HydrophobicContact CB-CB 4.11Å; D673-E676 PolarHBondContact OD1-N 2.78Å; E676-I678 PolarHBondContact O-N 2.89Å; E676-R679 PolarHBondContact O-N 3.03Å; E676-H680 WeakPolarHBondContact O-CB 3.43Å; E676-H680 PolarHBondContact O-N 2.9Å
677	E	79.7	Confident	83.7	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-68.1	-37.3	179.3	-171.5	67.8	-171.9	0	0	111.8	K476 M480 R666 H680 L681	K476-E677 IonicContact NZ-OE1 2.73Å; K476-E677 PolarHBondContact NZ-OE1 3.26Å; M480-E677 HydrophobicContact CE-CB 3.91Å; M480-E677 HydrophobicContact CE-CG 3.81Å; M480-E677 HydrophobicContact CG-CG 4.48Å; R666-E677 WeakPolarHBondContact CD-OE2 3.34Å; E677-H680 PolarHBondContact O-N 2.68Å; E677-L681 HydrophobicContact CG-CD1 4.25Å; E677-L681 WeakPolarHBondContact O-CB 3.08Å; E677-L681 WeakPolarHBondContact O-CG 3.3Å; E677-L681 PolarHBondContact O-N 3.13Å
678	I	85.4	Confident	84.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-47.4	172	-74.1	174.3	0	0	0	110.4	L477 M480 K481 R484 V674 E676 H680 L681 Q682	L477-I678 HydrophobicContact CD1-CB 4.37Å; L477-I678 HydrophobicContact CD1-CG1 4.38Å; L477-I678 HydrophobicContact CD1-CG2 3.97Å; M480-I678 HydrophobicContact CB-CD1 4.45Å; M480-I678 HydrophobicContact CB-CG1 3.85Å; K481-I678 HydrophobicContact CG-CD1 4.15Å; R484-I678 HydrophobicContact CG-CD1 4.32Å; V674-I678 HydrophobicContact CG1-CD1 3.68Å; V674-I678 HydrophobicContact CG1-CG1 4.25Å; V674-I678 WeakPolarHBondContact O-CB 3.42Å; V674-I678 VanDerWaalsContact O-CG1 3.28Å; V674-I678 WeakPolarHBondContact O-CG1 3.43Å; V674-I678 PolarHBondContact O-N 2.7Å; E676-I678 PolarHBondContact O-N 2.89Å; I678-H680 VanDerWaalsContact C-N 3.34Å; I678-H680 PolarHBondContact O-N 3.4Å; I678-L681 PolarHBondContact O-N 3.16Å; I678-Q682 HydrophobicContact CG2-CG 4.48Å; I678-Q682 WeakPolarHBondContact O-CB 3.35Å; I678-Q682 VanDerWaalsContact O-CG 3.25Å; I678-Q682 WeakPolarHBondContact O-CG 3.48Å; I678-Q682 PolarHBondContact O-N 3.35Å
679	R	87.6	Confident	84.7	Confident	134 Å²	134	61.8 Å²	61.8	51%	0.506	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-40.5	178.1	-81.8	-178.2	-95	-179.4	-6.3	112	E675 E676 Q682 R683	E675-R679 WeakPolarHBondContact O-CB 3.35Å; E675-R679 WeakPolarHBondContact O-CG 3.22Å; E675-R679 PolarHBondContact O-N 3.41Å; E675-R679 PolarHBondContact O-NE 3.37Å; E676-R679 PolarHBondContact O-N 3.03Å; R679-Q682 PolarHBondContact O-N 3.1Å; R679-R683 WeakPolarHBondContact O-CG 3.37Å; R679-R683 PolarHBondContact O-N 3.01Å
680	H	85.5	Confident	85.1	Confident	67 Å²	67	61 Å²	61	31%	0.31	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-53.4	175.9	-177.5	-78.7	0	0	0	111.6	E676 E677 I678 Q682 R683 E684	E676-H680 WeakPolarHBondContact O-CB 3.43Å; E676-H680 PolarHBondContact O-N 2.9Å; E677-H680 PolarHBondContact O-N 2.68Å; I678-H680 VanDerWaalsContact C-N 3.34Å; I678-H680 PolarHBondContact O-N 3.4Å; H680-Q682 PolarHBondContact O-N 3.45Å; H680-R683 PolarHBondContact O-N 3.44Å; H680-R683 VanDerWaalsContact O-N 3.15Å; H680-E684 IonicContact CE1-OE2 3.66Å; H680-E684 PolarHBondContact CE1-OE2 3.26Å; H680-E684 IonicContact ND1-OE2 2.72Å; H680-E684 PolarHBondContact O-N 2.6Å
681	L	87.6	Confident	85.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-61.8	-33.6	179.7	-71.9	170.1	0	0	0	112.3	K476 L477 M480 E677 I678 L685	K476-L681 HydrophobicContact CB-CD1 4.24Å; K476-L681 HydrophobicContact CD-CD1 3.98Å; K476-L681 HydrophobicContact CD-CD2 3.95Å; K476-L681 HydrophobicContact CG-CD1 3.92Å; L477-L681 HydrophobicContact CB-CB 4.36Å; L477-L681 HydrophobicContact CB-CD1 4.47Å; L477-L681 HydrophobicContact CD1-CB 4.09Å; M480-L681 HydrophobicContact CG-CD1 4.15Å; E677-L681 HydrophobicContact CG-CD1 4.25Å; E677-L681 WeakPolarHBondContact O-CB 3.08Å; E677-L681 WeakPolarHBondContact O-CG 3.3Å; E677-L681 PolarHBondContact O-N 3.13Å; I678-L681 PolarHBondContact O-N 3.16Å; L681-L685 WeakPolarHBondContact O-CB 3.31Å; L681-L685 VanDerWaalsContact O-CG 3.27Å; L681-L685 WeakPolarHBondContact O-CG 3.5Å; L681-L685 PolarHBondContact O-N 2.98Å
682	Q	91.4	Very high	86.3	Confident	81 Å²	81	66 Å²	66	38%	0.379	34%	0.341	S	S	.	.	H	α-helix	trans	-65.3	-46.6	173.4	-75.9	176.8	-50.1	0	0	112.4	L477 I678 R679 H680 E684 L685 E686	L477-Q682 HydrophobicContact CD1-CG 3.97Å; L477-Q682 HydrophobicContact CD2-CG 3.91Å; I678-Q682 HydrophobicContact CG2-CG 4.48Å; I678-Q682 WeakPolarHBondContact O-CB 3.35Å; I678-Q682 VanDerWaalsContact O-CG 3.25Å; I678-Q682 WeakPolarHBondContact O-CG 3.48Å; I678-Q682 PolarHBondContact O-N 3.35Å; R679-Q682 PolarHBondContact O-N 3.1Å; H680-Q682 PolarHBondContact O-N 3.45Å; Q682-E684 VanDerWaalsContact C-N 3.33Å; Q682-E684 PolarHBondContact O-N 2.89Å; Q682-L685 PolarHBondContact O-N 3.44Å; Q682-E686 PolarHBondContact O-N 3.4Å
683	R	91.3	Very high	87.6	Confident	164 Å²	164	65 Å²	65	62%	0.619	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-39.5	175.7	-72.6	178	-172.5	158.4	1	112.2	R679 H680 E686 N687	R679-R683 WeakPolarHBondContact O-CG 3.37Å; R679-R683 PolarHBondContact O-N 3.01Å; H680-R683 PolarHBondContact O-N 3.44Å; H680-R683 VanDerWaalsContact O-N 3.15Å; R683-E686 PolarHBondContact O-N 3.02Å; R683-N687 PolarHBondContact O-N 3.41Å; R683-N687 PolarHBondContact O-ND2 3.34Å
684	E	89.5	Confident	88.6	Confident	64 Å²	64	70.3 Å²	70.3	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-43.7	177.7	-165.1	178.5	159.5	0	0	111.1	N473 H680 Q682 E686 N687 Q688	N473-E684 VanDerWaalsContact ND2-CD 3.34Å; N473-E684 PolarHBondContact ND2-OE1 2.97Å; H680-E684 IonicContact CE1-OE2 3.66Å; H680-E684 PolarHBondContact CE1-OE2 3.26Å; H680-E684 IonicContact ND1-OE2 2.72Å; H680-E684 PolarHBondContact O-N 2.6Å; Q682-E684 VanDerWaalsContact C-N 3.33Å; Q682-E684 PolarHBondContact O-N 2.89Å; E684-E686 VanDerWaalsContact C-N 3.32Å; E684-E686 PolarHBondContact O-N 3.4Å; E684-N687 PolarHBondContact O-N 3.19Å; E684-Q688 WeakPolarHBondContact O-CB 3.27Å; E684-Q688 VanDerWaalsContact O-CG 3.23Å; E684-Q688 WeakPolarHBondContact O-CG 3.05Å; E684-Q688 PolarHBondContact O-N 3.04Å
685	L	92.4	Very high	89.3	Confident	23 Å²	23	71 Å²	71	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-35.7	173.9	-76.7	170.4	0	0	0	112.8	I470 N473 K474 L477 L681 Q682 Q688 A689	I470-L685 HydrophobicContact CG2-CD2 4.06Å; N473-L685 HydrophobicContact CB-CD2 3.73Å; N473-L685 HydrophobicContact CB-CG 4.09Å; K474-L685 HydrophobicContact CG-CD1 4.02Å; K474-L685 HydrophobicContact CG-CD2 3.83Å; L477-L685 HydrophobicContact CB-CD1 4.37Å; L477-L685 HydrophobicContact CD2-CD1 3.69Å; L681-L685 WeakPolarHBondContact O-CB 3.31Å; L681-L685 VanDerWaalsContact O-CG 3.27Å; L681-L685 WeakPolarHBondContact O-CG 3.5Å; L681-L685 PolarHBondContact O-N 2.98Å; Q682-L685 PolarHBondContact O-N 3.44Å; L685-Q688 PolarHBondContact O-N 3.23Å; L685-A689 VanDerWaalsContact O-CB 3.3Å; L685-A689 WeakPolarHBondContact O-CB 3.04Å; L685-A689 PolarHBondContact O-N 3.43Å
686	E	93.1	Very high	89.6	Confident	140 Å²	140	71.3 Å²	71.3	65%	0.654	34%	0.343	S	S	*	.	H	α-helix	trans	-65.9	-45.5	174.9	-173.4	172.6	-163.1	0	0	111.6	Q682 R683 E684 Q688 A689 G690	Q682-E686 PolarHBondContact O-N 3.4Å; R683-E686 PolarHBondContact O-N 3.02Å; E684-E686 VanDerWaalsContact C-N 3.32Å; E684-E686 PolarHBondContact O-N 3.4Å; E686-Q688 PolarHBondContact O-N 3.47Å; E686-A689 PolarHBondContact O-N 2.99Å; E686-G690 PolarHBondContact O-N 3.42Å
687	N	92.2	Very high	90.2	Very high	111 Å²	111	72.3 Å²	72.3	59%	0.594	35%	0.348	S	S	*	.	H	α-helix	trans	-60.8	-44.5	173.9	-72.7	-21.6	0	0	0	111.7	R683 E684 A689 G690 Q691	R683-N687 PolarHBondContact O-N 3.41Å; R683-N687 PolarHBondContact O-ND2 3.34Å; E684-N687 PolarHBondContact O-N 3.19Å; N687-A689 VanDerWaalsContact C-N 3.34Å; N687-G690 PolarHBondContact O-N 2.92Å; N687-Q691 PolarHBondContact O-N 3.15Å
688	Q	93.4	Very high	90.8	Very high	16 Å²	16	76 Å²	76	8%	0.075	37%	0.365	C	S	.	.	H	α-helix	trans	-65.4	-36.7	177.4	-71.7	177.5	-35.8	0	0	111.9	L466 S469 I470 N473 E684 L685 E686 G690 Q691 E692	L466-Q688 HydrophobicContact CD1-CB 4.07Å; L466-Q688 HydrophobicContact CD1-CG 3.96Å; S469-Q688 PolarHBondContact OG-NE2 3.03Å; I470-Q688 HydrophobicContact CD1-CB 3.99Å; I470-Q688 HydrophobicContact CG1-CB 3.6Å; I470-Q688 HydrophobicContact CG1-CG 4.3Å; N473-Q688 PolarHBondContact ND2-NE2 3.4Å; N473-Q688 PolarHBondContact ND2-OE1 3.39Å; N473-Q688 VanDerWaalsContact ND2-OE1 3.15Å; E684-Q688 WeakPolarHBondContact O-CB 3.27Å; E684-Q688 VanDerWaalsContact O-CG 3.23Å; E684-Q688 WeakPolarHBondContact O-CG 3.05Å; E684-Q688 PolarHBondContact O-N 3.04Å; L685-Q688 PolarHBondContact O-N 3.23Å; E686-Q688 PolarHBondContact O-N 3.47Å; Q688-G690 VanDerWaalsContact C-N 3.34Å; Q688-Q691 PolarHBondContact O-N 3.46Å; Q688-E692 WeakPolarHBondContact O-CB 3.29Å; Q688-E692 PolarHBondContact O-N 2.97Å
689	A	90.7	Very high	91.1	Very high	50 Å²	50	77.6 Å²	77.6	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-38.7	173.6	0	0	0	0	0	111.8	L685 E686 N687 E692 A693	L685-A689 VanDerWaalsContact O-CB 3.3Å; L685-A689 WeakPolarHBondContact O-CB 3.04Å; L685-A689 PolarHBondContact O-N 3.43Å; E686-A689 PolarHBondContact O-N 2.99Å; N687-A689 VanDerWaalsContact C-N 3.34Å; A689-E692 WeakPolarHBondContact O-CB 3.36Å; A689-E692 PolarHBondContact O-N 2.81Å; A689-A693 PolarHBondContact O-N 2.78Å
690	G	91.6	Very high	91.4	Very high	35 Å²	35	78.2 Å²	78.2	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-41.9	172.3	0	0	0	0	0	113	E686 N687 Q688 R694	E686-G690 PolarHBondContact O-N 3.42Å; N687-G690 PolarHBondContact O-N 2.92Å; Q688-G690 VanDerWaalsContact C-N 3.34Å; G690-R694 WeakPolarHBondContact O-CG 3.46Å; G690-R694 PolarHBondContact O-N 3.39Å
691	Q	91.1	Very high	91.8	Very high	95 Å²	95	81.5 Å²	81.5	44%	0.444	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-41.5	173.3	-69.4	178	2	0	0	111.9	L466 N687 Q688 A693 R694 F695	L466-Q691 HydrophobicContact CD2-CB 3.75Å; N687-Q691 PolarHBondContact O-N 3.15Å; Q688-Q691 PolarHBondContact O-N 3.46Å; Q691-A693 VanDerWaalsContact C-N 3.33Å; Q691-A693 PolarHBondContact O-N 3.29Å; Q691-R694 PolarHBondContact O-N 3.22Å; Q691-F695 VanDerWaalsContact O-CD2 3.26Å; Q691-F695 WeakPolarHBondContact O-CD2 3.4Å; Q691-F695 PolarHBondContact O-N 3.05Å
692	E	91.5	Very high	92.1	Very high	43 Å²	43	82.2 Å²	82.2	20%	0.201	39%	0.392	C	S	.	.	H	α-helix	trans	-58	-46.4	177.6	-165.9	-177.1	-179.4	0	0	111.1	Y463 L466 I470 Q688 A689 R694 F695 Q696	Y463-E692 HydrophobicContact CD2-CG 4.34Å; Y463-E692 HydrophobicContact CE2-CG 3.44Å; Y463-E692 VanDerWaalsContact CE2-CG 3.44Å; Y463-E692 PolarHBondContact OH-OE1 3.01Å; L466-E692 HydrophobicContact CD2-CB 4.21Å; I470-E692 HydrophobicContact CD1-CB 4.24Å; I470-E692 HydrophobicContact CD1-CG 4.48Å; Q688-E692 WeakPolarHBondContact O-CB 3.29Å; Q688-E692 PolarHBondContact O-N 2.97Å; A689-E692 WeakPolarHBondContact O-CB 3.36Å; A689-E692 PolarHBondContact O-N 2.81Å; E692-R694 PolarHBondContact O-N 3.26Å; E692-F695 PolarHBondContact O-N 3.43Å; E692-Q696 WeakPolarHBondContact O-CG 3.42Å; E692-Q696 PolarHBondContact O-N 2.89Å; E692-Q696 PolarHBondContact OE1-NE2 3.47Å
693	A	92.4	Very high	92.1	Very high	52 Å²	52	81.4 Å²	81.4	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-41	177.4	0	0	0	0	0	112.4	A689 Q691 Q696 Q697	A689-A693 PolarHBondContact O-N 2.78Å; Q691-A693 VanDerWaalsContact C-N 3.33Å; Q691-A693 PolarHBondContact O-N 3.29Å; A693-Q696 PolarHBondContact O-N 2.82Å; A693-Q697 WeakPolarHBondContact O-CB 3.19Å; A693-Q697 PolarHBondContact O-N 3.04Å
694	R	92.4	Very high	92.3	Very high	182 Å²	182	79.8 Å²	79.8	69%	0.687	39%	0.39	S	S	*	.	H	α-helix	trans	-63.3	-47.2	176.4	-71.8	177	-176.1	-174.2	1.7	111.8	G690 Q691 E692 Q696 Q697 Q698	G690-R694 WeakPolarHBondContact O-CG 3.46Å; G690-R694 PolarHBondContact O-N 3.39Å; Q691-R694 PolarHBondContact O-N 3.22Å; E692-R694 PolarHBondContact O-N 3.26Å; R694-Q696 VanDerWaalsContact C-N 3.34Å; R694-Q696 PolarHBondContact O-N 3.44Å; R694-Q697 PolarHBondContact O-N 3.38Å; R694-Q698 WeakPolarHBondContact O-CG 3.3Å; R694-Q698 PolarHBondContact O-N 3.23Å
695	F	92.4	Very high	92.4	Very high	36 Å²	36	79.8 Å²	79.8	16%	0.158	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-43.7	176.5	-78.8	-57.8	0	0	0	111.7	M459 E462 Y463 L466 Q691 E692 Q697 Q698 M699	M459-F695 HydrophobicContact SD-CD1 3.84Å; M459-F695 HydrophobicContact SD-CE1 3.75Å; E462-F695 HydrophobicContact CB-CE1 4.28Å; E462-F695 HydrophobicContact CB-CZ 4.18Å; Y463-F695 HydrophobicContact CD2-CB 3.89Å; L466-F695 HydrophobicContact CD2-CD2 3.76Å; L466-F695 HydrophobicContact CD2-CE2 3.94Å; Q691-F695 VanDerWaalsContact O-CD2 3.26Å; Q691-F695 WeakPolarHBondContact O-CD2 3.4Å; Q691-F695 PolarHBondContact O-N 3.05Å; E692-F695 PolarHBondContact O-N 3.43Å; F695-Q697 VanDerWaalsContact C-N 3.31Å; F695-Q697 PolarHBondContact O-N 2.74Å; F695-Q698 PolarHBondContact O-N 3.36Å; F695-M699 WeakPolarHBondContact O-CB 3.49Å; F695-M699 VanDerWaalsContact O-CG 3.29Å; F695-M699 WeakPolarHBondContact O-CG 3.45Å; F695-M699 PolarHBondContact O-N 3.46Å
696	Q	90.5	Very high	92.5	Very high	77 Å²	77	79.2 Å²	79.2	36%	0.36	39%	0.389	S	S	.	.	H	α-helix	trans	-63.2	-35.1	176.2	-73.6	178.6	-0.8	0	0	112.9	Y463 E692 A693 R694 R700	Y463-Q696 HydrophobicContact CE2-CG 3.87Å; Y463-Q696 PolarHBondContact OH-NE2 3.42Å; E692-Q696 WeakPolarHBondContact O-CG 3.42Å; E692-Q696 PolarHBondContact O-N 2.89Å; E692-Q696 PolarHBondContact OE1-NE2 3.47Å; A693-Q696 PolarHBondContact O-N 2.82Å; R694-Q696 VanDerWaalsContact C-N 3.34Å; R694-Q696 PolarHBondContact O-N 3.44Å; Q696-R700 WeakPolarHBondContact O-CB 3.36Å; Q696-R700 WeakPolarHBondContact O-CG 3.25Å; Q696-R700 PolarHBondContact O-N 2.82Å; Q696-R700 VanDerWaalsContact O-N 3.15Å; Q696-R700 PolarHBondContact O-NE 2.93Å
697	Q	93.1	Very high	92.5	Very high	134 Å²	134	79.6 Å²	79.6	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-68.7	-45.4	175	-172.7	-179.4	6.2	0	0	111.7	A693 R694 F695 R700 K701	A693-Q697 WeakPolarHBondContact O-CB 3.19Å; A693-Q697 PolarHBondContact O-N 3.04Å; R694-Q697 PolarHBondContact O-N 3.38Å; F695-Q697 VanDerWaalsContact C-N 3.31Å; F695-Q697 PolarHBondContact O-N 2.74Å; Q697-R700 PolarHBondContact O-N 2.85Å; Q697-K701 PolarHBondContact O-N 2.95Å; Q697-K701 VanDerWaalsContact O-N 3.08Å
698	Q	92.2	Very high	92.6	Very high	91 Å²	91	80 Å²	80	43%	0.425	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-42.6	177.9	-72.5	176.7	-15.9	0	0	112.1	R694 F695 R700 K701 L702	R694-Q698 WeakPolarHBondContact O-CG 3.3Å; R694-Q698 PolarHBondContact O-N 3.23Å; F695-Q698 PolarHBondContact O-N 3.36Å; Q698-R700 VanDerWaalsContact C-N 3.32Å; Q698-R700 PolarHBondContact O-N 3.21Å; Q698-K701 PolarHBondContact O-N 3.02Å; Q698-L702 PolarHBondContact O-N 3.17Å
699	M	91.8	Very high	92.6	Very high	32 Å²	32	80.6 Å²	80.6	16%	0.158	39%	0.39	C	S	.	.	H	α-helix	trans	-61.9	-39.4	175.6	-74	-178	67.3	0	0	112.2	M459 K460 Y463 F695 L702 D703	M459-M699 HydrophobicContact CB-CG 4.17Å; K460-M699 HydrophobicContact CB-CE 4.09Å; K460-M699 HydrophobicContact CD-CE 4.47Å; K460-M699 HydrophobicContact CG-CE 4.15Å; Y463-M699 HydrophobicContact CG-SD 4.45Å; F695-M699 WeakPolarHBondContact O-CB 3.49Å; F695-M699 VanDerWaalsContact O-CG 3.29Å; F695-M699 WeakPolarHBondContact O-CG 3.45Å; F695-M699 PolarHBondContact O-N 3.46Å; M699-L702 PolarHBondContact O-N 2.81Å; M699-D703 PolarHBondContact O-N 3.27Å
700	R	93.2	Very high	92.7	Very high	148 Å²	148	80.7 Å²	80.7	56%	0.558	38%	0.382	S	S	*	.	H	α-helix	trans	-62	-43.8	174.9	-82.3	-177.3	-79.2	-166.3	-1.6	112.2	Q696 Q697 Q698 D703 E704	Q696-R700 WeakPolarHBondContact O-CB 3.36Å; Q696-R700 WeakPolarHBondContact O-CG 3.25Å; Q696-R700 PolarHBondContact O-N 2.82Å; Q696-R700 VanDerWaalsContact O-N 3.15Å; Q696-R700 PolarHBondContact O-NE 2.93Å; Q697-R700 PolarHBondContact O-N 2.85Å; Q698-R700 VanDerWaalsContact C-N 3.32Å; Q698-R700 PolarHBondContact O-N 3.21Å; R700-D703 WeakPolarHBondContact O-CB 3.25Å; R700-D703 PolarHBondContact O-N 3.08Å; R700-E704 WeakPolarHBondContact O-CG 3.21Å; R700-E704 PolarHBondContact O-N 3.5Å
701	K	93.8	Very high	92.7	Very high	135 Å²	135	80.4 Å²	80.4	59%	0.587	38%	0.379	S	S	*	.	H	α-helix	trans	-61	-46.1	176.1	-172.6	-178.8	176.8	-175.2	0	111.6	Q697 Q698 D703 E704 D705	Q697-K701 PolarHBondContact O-N 2.95Å; Q697-K701 VanDerWaalsContact O-N 3.08Å; Q698-K701 PolarHBondContact O-N 3.02Å; K701-D703 VanDerWaalsContact C-N 3.32Å; K701-D703 PolarHBondContact O-N 3.4Å; K701-E704 WeakPolarHBondContact O-CB 3.23Å; K701-E704 PolarHBondContact O-N 3Å; K701-D705 PolarHBondContact O-N 3.34Å
702	L	93.9	Very high	92.9	Very high	18 Å²	18	78 Å²	78	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-37.9	176.4	-71.6	169.5	0	0	0	112.2	A452 E455 Q456 M459 Q698 M699 E704 D705 I706	A452-L702 HydrophobicContact CB-CD2 4.38Å; E455-L702 HydrophobicContact CB-CD1 4.14Å; E455-L702 HydrophobicContact CB-CD2 4.28Å; Q456-L702 HydrophobicContact CB-CB 4.38Å; Q456-L702 HydrophobicContact CB-CD1 4.25Å; M459-L702 HydrophobicContact CG-CD1 4.4Å; Q698-L702 PolarHBondContact O-N 3.17Å; M699-L702 PolarHBondContact O-N 2.81Å; L702-E704 VanDerWaalsContact C-N 3.34Å; L702-D705 PolarHBondContact O-N 3.23Å; L702-I706 WeakPolarHBondContact O-CB 3.43Å; L702-I706 WeakPolarHBondContact O-CD1 3.08Å; L702-I706 WeakPolarHBondContact O-CG1 3.46Å; L702-I706 PolarHBondContact O-N 3.04Å
703	D	92.4	Very high	93	Very high	63 Å²	63	77.2 Å²	77.2	34%	0.337	37%	0.366	S	S	.	.	H	α-helix	trans	-62.4	-40.2	173.5	-93.8	-35	0	0	0	112.4	Q456 M699 R700 K701 K707	Q456-D703 PolarHBondContact NE2-OD1 3.27Å; Q456-D703 PolarHBondContact NE2-OD2 3.48Å; M699-D703 PolarHBondContact O-N 3.27Å; R700-D703 WeakPolarHBondContact O-CB 3.25Å; R700-D703 PolarHBondContact O-N 3.08Å; K701-D703 VanDerWaalsContact C-N 3.32Å; K701-D703 PolarHBondContact O-N 3.4Å; D703-K707 WeakPolarHBondContact O-CB 3.49Å; D703-K707 VanDerWaalsContact O-CG 3.27Å; D703-K707 WeakPolarHBondContact O-CG 3.33Å; D703-K707 PolarHBondContact O-N 3.04Å
704	E	94	Very high	93	Very high	130 Å²	130	82.9 Å²	82.9	61%	0.607	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-45	174.7	-72.6	171	-176	0	0	111.2	R700 K701 L702 I706 K707 H708	R700-E704 WeakPolarHBondContact O-CG 3.21Å; R700-E704 PolarHBondContact O-N 3.5Å; K701-E704 WeakPolarHBondContact O-CB 3.23Å; K701-E704 PolarHBondContact O-N 3Å; L702-E704 VanDerWaalsContact C-N 3.34Å; E704-I706 PolarHBondContact O-N 3.29Å; E704-K707 PolarHBondContact O-N 2.95Å; E704-H708 VanDerWaalsContact O-CB 3.31Å; E704-H708 WeakPolarHBondContact O-CB 3.19Å; E704-H708 PolarHBondContact O-N 3.06Å
705	D	92.4	Very high	93.1	Very high	64 Å²	64	81.2 Å²	81.2	34%	0.342	37%	0.374	S	S	.	.	H	α-helix	trans	-62.8	-41.6	177.3	-69	-23.3	0	0	0	111.8	K701 L702 H708 N709	K701-D705 PolarHBondContact O-N 3.34Å; L702-D705 PolarHBondContact O-N 3.23Å; D705-H708 PolarHBondContact O-N 2.95Å; D705-N709 WeakPolarHBondContact O-CB 3.37Å; D705-N709 PolarHBondContact O-N 3.47Å; D705-N709 PolarHBondContact O-ND2 3.37Å; D705-N709 VanDerWaalsContact O-ND2 3.07Å
706	I	94.1	Very high	93.1	Very high	12 Å²	12	80 Å²	80	6%	0.062	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-50.6	174.9	-69.9	162.8	0	0	0	109.9	A452 K453 Q456 L702 E704 H708 N709 E710	A452-I706 HydrophobicContact CB-CD1 4.35Å; A452-I706 HydrophobicContact CB-CG1 3.63Å; K453-I706 HydrophobicContact CB-CD1 4.48Å; K453-I706 HydrophobicContact CG-CD1 3.73Å; K453-I706 HydrophobicContact CG-CG1 4.05Å; K453-I706 HydrophobicContact CG-CG2 4.38Å; Q456-I706 HydrophobicContact CB-CD1 4.4Å; L702-I706 WeakPolarHBondContact O-CB 3.43Å; L702-I706 WeakPolarHBondContact O-CD1 3.08Å; L702-I706 WeakPolarHBondContact O-CG1 3.46Å; L702-I706 PolarHBondContact O-N 3.04Å; E704-I706 PolarHBondContact O-N 3.29Å; I706-H708 VanDerWaalsContact C-N 3.31Å; I706-H708 PolarHBondContact O-N 3.45Å; I706-N709 PolarHBondContact O-N 2.85Å; I706-E710 HydrophobicContact CG2-CG 4.27Å; I706-E710 WeakPolarHBondContact O-CB 3.04Å; I706-E710 VanDerWaalsContact O-CG 3.3Å; I706-E710 WeakPolarHBondContact O-CG 3.42Å; I706-E710 PolarHBondContact O-N 3.28Å
707	K	93.7	Very high	93.1	Very high	148 Å²	148	79.9 Å²	79.9	64%	0.643	37%	0.371	S	S	*	.	H	α-helix	trans	-61	-40.4	179.5	-76.3	173.3	-176.7	173.2	0	112	D703 E704 G711	D703-K707 WeakPolarHBondContact O-CB 3.49Å; D703-K707 VanDerWaalsContact O-CG 3.27Å; D703-K707 WeakPolarHBondContact O-CG 3.33Å; D703-K707 PolarHBondContact O-N 3.04Å; E704-K707 PolarHBondContact O-N 2.95Å; K707-G711 PolarHBondContact O-N 2.92Å
708	H	93.8	Very high	93.1	Very high	119 Å²	119	80 Å²	80	55%	0.551	37%	0.374	S	S	*	.	H	α-helix	trans	-63.2	-52.9	178.1	-175.9	73	0	0	0	111.2	E704 D705 I706 E710 G711 L712	E704-H708 VanDerWaalsContact O-CB 3.31Å; E704-H708 WeakPolarHBondContact O-CB 3.19Å; E704-H708 PolarHBondContact O-N 3.06Å; D705-H708 PolarHBondContact O-N 2.95Å; I706-H708 VanDerWaalsContact C-N 3.31Å; I706-H708 PolarHBondContact O-N 3.45Å; H708-E710 PolarHBondContact O-N 3.04Å; H708-G711 PolarHBondContact O-N 2.94Å; H708-G711 VanDerWaalsContact O-N 3.14Å; H708-L712 PolarHBondContact O-N 3Å
709	N	93.4	Very high	93.1	Very high	29 Å²	29	80 Å²	80	16%	0.155	37%	0.374	C	S	.	.	H	α-helix	trans	-65.5	-38.5	-179.4	-72	-38.1	0	0	0	112.5	D705 I706 G711 L712 L713	D705-N709 WeakPolarHBondContact O-CB 3.37Å; D705-N709 PolarHBondContact O-N 3.47Å; D705-N709 PolarHBondContact O-ND2 3.37Å; D705-N709 VanDerWaalsContact O-ND2 3.07Å; I706-N709 PolarHBondContact O-N 2.85Å; N709-G711 VanDerWaalsContact C-N 3.32Å; N709-L712 PolarHBondContact O-N 3.35Å; N709-L713 VanDerWaalsContact O-CB 3.28Å; N709-L713 WeakPolarHBondContact O-CB 3.23Å; N709-L713 PolarHBondContact O-N 2.9Å
710	E	92.5	Very high	93.2	Very high	51 Å²	51	79.9 Å²	79.9	24%	0.238	37%	0.373	C	S	.	.	H	α-helix	trans	-66	-35.5	172.9	-74.4	-174.1	173.6	0	0	112.3	K453 I706 H708 R714	K453-E710 WeakPolarHBondContact CE-OE1 3.44Å; K453-E710 IonicContact NZ-OE1 3.45Å; K453-E710 PolarHBondContact NZ-OE1 2.88Å; I706-E710 HydrophobicContact CG2-CG 4.27Å; I706-E710 WeakPolarHBondContact O-CB 3.04Å; I706-E710 VanDerWaalsContact O-CG 3.3Å; I706-E710 WeakPolarHBondContact O-CG 3.42Å; I706-E710 PolarHBondContact O-N 3.28Å; H708-E710 PolarHBondContact O-N 3.04Å; E710-R714 WeakPolarHBondContact O-CG 3.49Å; E710-R714 PolarHBondContact O-N 3.39Å; E710-R714 IonicContact OE2-NH2 3.84Å
711	G	93.1	Very high	93.2	Very high	29 Å²	29	79.2 Å²	79.2	30%	0.299	37%	0.374	S	S	.	.	H	α-helix	trans	-63.7	-44.7	173.9	0	0	0	0	0	112.2	K707 H708 N709 R714 K715	K707-G711 PolarHBondContact O-N 2.92Å; H708-G711 PolarHBondContact O-N 2.94Å; H708-G711 VanDerWaalsContact O-N 3.14Å; N709-G711 VanDerWaalsContact C-N 3.32Å; G711-R714 PolarHBondContact O-N 2.94Å; G711-K715 WeakPolarHBondContact O-CG 3.16Å; G711-K715 PolarHBondContact O-N 2.99Å; G711-K715 VanDerWaalsContact O-N 3.16Å
712	L	93.9	Very high	93.1	Very high	45 Å²	45	75.7 Å²	75.7	24%	0.236	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-46.3	174.1	-68.2	177.5	0	0	0	111.5	F445 H708 N709 R714 K715 V716	F445-L712 HydrophobicContact CD1-CB 4.11Å; F445-L712 HydrophobicContact CD1-CD1 4.05Å; F445-L712 HydrophobicContact CD2-CB 4.12Å; F445-L712 HydrophobicContact CE1-CB 4.08Å; F445-L712 HydrophobicContact CE1-CD1 3.47Å; F445-L712 VanDerWaalsContact CE1-CD1 3.47Å; F445-L712 HydrophobicContact CE1-CG 4.4Å; F445-L712 HydrophobicContact CE2-CB 4.08Å; F445-L712 HydrophobicContact CG-CB 4.15Å; F445-L712 HydrophobicContact CZ-CB 4.06Å; F445-L712 HydrophobicContact CZ-CD1 3.82Å; F445-L712 HydrophobicContact CZ-CG 4.48Å; H708-L712 PolarHBondContact O-N 3Å; N709-L712 PolarHBondContact O-N 3.35Å; L712-R714 VanDerWaalsContact C-N 3.31Å; L712-R714 PolarHBondContact O-N 3.3Å; L712-K715 WeakPolarHBondContact O-CB 3.38Å; L712-K715 PolarHBondContact O-N 3.26Å; L712-V716 WeakPolarHBondContact O-CG2 3.48Å; L712-V716 PolarHBondContact O-N 2.94Å
713	L	93.6	Very high	93	Very high	26 Å²	26	75.2 Å²	75.2	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-55.6	-44.9	176.2	-179.3	62.7	0	0	0	111.7	I442 F445 Q446 N709 K715 V716 L717	I442-L713 HydrophobicContact CB-CD1 4.22Å; I442-L713 HydrophobicContact CG1-CD1 4.26Å; I442-L713 HydrophobicContact CG2-CD1 3.88Å; F445-L713 HydrophobicContact CB-CB 4.13Å; F445-L713 HydrophobicContact CB-CD1 4.37Å; Q446-L713 HydrophobicContact CB-CD1 4.45Å; Q446-L713 HydrophobicContact CB-CD2 4.42Å; N709-L713 VanDerWaalsContact O-CB 3.28Å; N709-L713 WeakPolarHBondContact O-CB 3.23Å; N709-L713 PolarHBondContact O-N 2.9Å; L713-K715 PolarHBondContact O-N 2.98Å; L713-V716 PolarHBondContact O-N 3.29Å; L713-L717 HydrophobicContact CD1-CD1 4.11Å; L713-L717 HydrophobicContact CD1-CG 4.23Å; L713-L717 HydrophobicContact CG-CD1 3.87Å; L713-L717 HydrophobicContact CG-CG 4.43Å; L713-L717 VanDerWaalsContact O-CB 3.29Å; L713-L717 WeakPolarHBondContact O-CB 3.49Å; L713-L717 WeakPolarHBondContact O-CG 3.44Å; L713-L717 PolarHBondContact O-N 3.46Å
714	R	93.1	Very high	92.9	Very high	172 Å²	172	76.6 Å²	76.6	65%	0.649	36%	0.364	S	S	*	.	H	α-helix	trans	-62.4	-40.3	176.2	-74.1	179.3	-151.9	178.7	7.9	112.6	E710 G711 L712 M718	E710-R714 WeakPolarHBondContact O-CG 3.49Å; E710-R714 PolarHBondContact O-N 3.39Å; E710-R714 IonicContact OE2-NH2 3.84Å; G711-R714 PolarHBondContact O-N 2.94Å; L712-R714 VanDerWaalsContact C-N 3.31Å; L712-R714 PolarHBondContact O-N 3.3Å; R714-M718 WeakPolarHBondContact O-CB 3.44Å; R714-M718 PolarHBondContact O-N 3.4Å
715	K	93.3	Very high	92.7	Very high	147 Å²	147	74 Å²	74	64%	0.639	36%	0.355	S	S	*	.	H	α-helix	trans	-62.7	-50.5	177.1	-72.6	177.4	-179.1	-177.8	0	110.9	G711 L712 L713 L717 M718 E719	G711-K715 WeakPolarHBondContact O-CG 3.16Å; G711-K715 PolarHBondContact O-N 2.99Å; G711-K715 VanDerWaalsContact O-N 3.16Å; L712-K715 WeakPolarHBondContact O-CB 3.38Å; L712-K715 PolarHBondContact O-N 3.26Å; L713-K715 PolarHBondContact O-N 2.98Å; K715-L717 PolarHBondContact O-N 3.31Å; K715-M718 PolarHBondContact O-N 3.01Å; K715-E719 WeakPolarHBondContact O-CB 3.48Å; K715-E719 PolarHBondContact O-N 3.1Å
716	V	93.1	Very high	92.6	Very high	9 Å²	9	77 Å²	77	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-38.1	-179.8	-177.6	0	0	0	0	111.4	L438 Q441 I442 F445 L712 L713 M718 E719 Q720	L438-V716 HydrophobicContact CB-CG1 4.13Å; L438-V716 HydrophobicContact CD2-CG1 3.79Å; L438-V716 WeakPolarHBondContact O-CG1 3.43Å; Q441-V716 HydrophobicContact CB-CG1 3.97Å; I442-V716 HydrophobicContact CD1-CG1 4.23Å; I442-V716 HydrophobicContact CG1-CB 4.29Å; I442-V716 HydrophobicContact CG1-CG1 3.68Å; F445-V716 HydrophobicContact CD2-CG2 4.14Å; F445-V716 HydrophobicContact CE2-CG2 3.88Å; L712-V716 WeakPolarHBondContact O-CG2 3.48Å; L712-V716 PolarHBondContact O-N 2.94Å; L713-V716 PolarHBondContact O-N 3.29Å; V716-M718 VanDerWaalsContact C-N 3.35Å; V716-M718 PolarHBondContact O-N 3.12Å; V716-E719 PolarHBondContact O-N 3.09Å; V716-Q720 WeakPolarHBondContact O-CB 3.49Å; V716-Q720 PolarHBondContact O-N 2.75Å
717	L	91.8	Very high	92.3	Very high	76 Å²	76	76.7 Å²	76.7	40%	0.398	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-40.5	173.6	-77.5	169.2	0	0	0	112.3	I442 L713 K715 K721	I442-L717 HydrophobicContact CD1-CD2 3.65Å; I442-L717 HydrophobicContact CD1-CG 4.27Å; I442-L717 HydrophobicContact CG1-CD2 4.02Å; I442-L717 HydrophobicContact CG1-CG 4.22Å; I442-L717 HydrophobicContact CG2-CD2 4.34Å; L713-L717 HydrophobicContact CD1-CD1 4.11Å; L713-L717 HydrophobicContact CD1-CG 4.23Å; L713-L717 HydrophobicContact CG-CD1 3.87Å; L713-L717 HydrophobicContact CG-CG 4.43Å; L713-L717 VanDerWaalsContact O-CB 3.29Å; L713-L717 WeakPolarHBondContact O-CB 3.49Å; L713-L717 WeakPolarHBondContact O-CG 3.44Å; L713-L717 PolarHBondContact O-N 3.46Å; K715-L717 PolarHBondContact O-N 3.31Å; L717-K721 WeakPolarHBondContact O-CB 3.42Å; L717-K721 PolarHBondContact O-N 3.03Å
718	M	92.6	Very high	92	Very high	137 Å²	137	72.9 Å²	72.9	68%	0.675	35%	0.353	S	S	*	.	H	α-helix	trans	-66.7	-40.8	176.5	-169.1	167.5	-176.3	0	0	111.1	R714 K715 V716 K721 T722	R714-M718 WeakPolarHBondContact O-CB 3.44Å; R714-M718 PolarHBondContact O-N 3.4Å; K715-M718 PolarHBondContact O-N 3.01Å; V716-M718 VanDerWaalsContact C-N 3.35Å; V716-M718 PolarHBondContact O-N 3.12Å; M718-K721 PolarHBondContact O-N 2.93Å; M718-T722 WeakPolarHBondContact O-CG2 3.5Å; M718-T722 PolarHBondContact O-N 3.31Å; M718-T722 PolarHBondContact O-OG1 3.3Å
719	E	92.6	Very high	91.7	Very high	91 Å²	91	74.4 Å²	74.4	43%	0.425	36%	0.358	S	S	.	.	H	α-helix	trans	-67.6	-39.2	175.7	-169.6	166.6	-158.1	0	0	112.6	L438 K715 V716 K721 T722 T723	L438-E719 HydrophobicContact CD1-CB 4.47Å; L438-E719 HydrophobicContact CD1-CG 4.05Å; L438-E719 HydrophobicContact CD2-CB 4.48Å; L438-E719 HydrophobicContact CD2-CG 4.19Å; K715-E719 WeakPolarHBondContact O-CB 3.48Å; K715-E719 PolarHBondContact O-N 3.1Å; V716-E719 PolarHBondContact O-N 3.09Å; E719-K721 VanDerWaalsContact C-N 3.32Å; E719-K721 PolarHBondContact O-N 3.48Å; E719-T722 WeakPolarHBondContact CA-OG1 3.47Å; E719-T722 PolarHBondContact O-N 3.39Å; E719-T722 PolarHBondContact O-OG1 3.1Å; E719-T723 VanDerWaalsContact O-CB 3.28Å; E719-T723 WeakPolarHBondContact O-CB 3.37Å; E719-T723 PolarHBondContact O-N 3.48Å; E719-T723 PolarHBondContact O-OG1 3.44Å
720	Q	93.8	Very high	91.5	Very high	29 Å²	29	74.2 Å²	74.2	14%	0.136	36%	0.357	C	S	.	.	H	α-helix	trans	-65.1	-39.8	173.5	-166.5	-167.6	66.6	0	0	110.7	I435 L438 I442 V716 T723 K724	I435-Q720 HydrophobicContact CG2-CG 4.25Å; I435-Q720 PolarHBondContact O-NE2 3.18Å; L438-Q720 HydrophobicContact CB-CB 4.14Å; L438-Q720 HydrophobicContact CB-CG 4.23Å; L438-Q720 HydrophobicContact CD1-CB 4.17Å; I442-Q720 HydrophobicContact CD1-CB 4.12Å; I442-Q720 HydrophobicContact CD1-CG 4.38Å; V716-Q720 WeakPolarHBondContact O-CB 3.49Å; V716-Q720 PolarHBondContact O-N 2.75Å; Q720-T723 PolarHBondContact O-N 3.44Å; Q720-K724 HydrophobicContact CG-CD 4.3Å; Q720-K724 VanDerWaalsContact O-CB 3.3Å; Q720-K724 WeakPolarHBondContact O-CB 3.47Å; Q720-K724 WeakPolarHBondContact O-CG 3.43Å; Q720-K724 PolarHBondContact O-N 3.4Å; Q720-K724 VanDerWaalsContact OE1-NZ 3.07Å
721	K	92.6	Very high	91	Very high	134 Å²	134	76.4 Å²	76.4	58%	0.583	37%	0.367	S	S	*	.	H	α-helix	trans	-63.4	-48.5	175.9	-175.2	179	178.1	-179.2	0	111.5	L717 M718 E719 T723 K724 D725	L717-K721 WeakPolarHBondContact O-CB 3.42Å; L717-K721 PolarHBondContact O-N 3.03Å; M718-K721 PolarHBondContact O-N 2.93Å; E719-K721 VanDerWaalsContact C-N 3.32Å; E719-K721 PolarHBondContact O-N 3.48Å; K721-T723 VanDerWaalsContact C-N 3.29Å; K721-T723 PolarHBondContact O-N 3.07Å; K721-K724 PolarHBondContact O-N 3.39Å; K721-D725 WeakPolarHBondContact O-CB 3.48Å; K721-D725 PolarHBondContact O-N 3.06Å
722	T	92.3	Very high	90.5	Very high	61 Å²	61	80 Å²	80	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-64.5	-35.6	178.7	55.8	0	0	0	0	112	M718 E719 K726	M718-T722 WeakPolarHBondContact O-CG2 3.5Å; M718-T722 PolarHBondContact O-N 3.31Å; M718-T722 PolarHBondContact O-OG1 3.3Å; E719-T722 WeakPolarHBondContact CA-OG1 3.47Å; E719-T722 PolarHBondContact O-N 3.39Å; E719-T722 PolarHBondContact O-OG1 3.1Å; T722-K726 VanDerWaalsContact O-CG 3.31Å; T722-K726 WeakPolarHBondContact O-CG 3.29Å; T722-K726 PolarHBondContact O-N 3.49Å
723	T	90.9	Very high	90	Very high	7 Å²	7	81.2 Å²	81.2	4%	0.043	38%	0.384	C	S	.	.	H	α-helix	trans	-69.8	-42.9	176	-53.8	0	0	0	0	111.5	L431 H434 I435 E719 Q720 K721 K726 A727	L431-T723 HydrophobicContact CB-CG2 4.4Å; L431-T723 HydrophobicContact CD2-CG2 3.7Å; H434-T723 HydrophobicContact CB-CG2 4.38Å; I435-T723 HydrophobicContact CD1-CG2 4.19Å; I435-T723 HydrophobicContact CG1-CG2 3.65Å; E719-T723 VanDerWaalsContact O-CB 3.28Å; E719-T723 WeakPolarHBondContact O-CB 3.37Å; E719-T723 PolarHBondContact O-N 3.48Å; E719-T723 PolarHBondContact O-OG1 3.44Å; Q720-T723 PolarHBondContact O-N 3.44Å; K721-T723 VanDerWaalsContact C-N 3.29Å; K721-T723 PolarHBondContact O-N 3.07Å; T723-K726 WeakPolarHBondContact O-CB 3.4Å; T723-K726 PolarHBondContact O-N 3.04Å; T723-A727 PolarHBondContact O-N 3.38Å
724	K	90.1	Very high	89.4	Confident	93 Å²	93	80.5 Å²	80.5	40%	0.404	38%	0.38	S	S	.	.	H	α-helix	trans	-60.2	-45.7	171.6	-82.2	175.7	175.4	167.2	0	111.5	I435 Q720 K721 K726 A727 T728	I435-K724 HydrophobicContact CD1-CB 4.43Å; I435-K724 HydrophobicContact CD1-CG 3.7Å; I435-K724 HydrophobicContact CG1-CG 4.04Å; I435-K724 HydrophobicContact CG2-CG 4.21Å; Q720-K724 HydrophobicContact CG-CD 4.3Å; Q720-K724 VanDerWaalsContact O-CB 3.3Å; Q720-K724 WeakPolarHBondContact O-CB 3.47Å; Q720-K724 WeakPolarHBondContact O-CG 3.43Å; Q720-K724 PolarHBondContact O-N 3.4Å; Q720-K724 VanDerWaalsContact OE1-NZ 3.07Å; K721-K724 PolarHBondContact O-N 3.39Å; K724-K726 VanDerWaalsContact C-N 3.28Å; K724-K726 PolarHBondContact O-N 3.38Å; K724-A727 WeakPolarHBondContact O-CB 3.19Å; K724-A727 PolarHBondContact O-N 3.41Å; K724-A727 VanDerWaalsContact O-N 3.08Å; K724-T728 PolarHBondContact O-N 3.49Å; K724-T728 PolarHBondContact O-OG1 3.35Å
725	D	89.8	Confident	88.6	Confident	76 Å²	76	75 Å²	75	41%	0.406	37%	0.365	S	S	.	.	H	α-helix	trans	-58.2	-42.2	177.9	-69.5	-18.3	0	0	0	110.7	K721 T728 K729	K721-D725 WeakPolarHBondContact O-CB 3.48Å; K721-D725 PolarHBondContact O-N 3.06Å; D725-T728 VanDerWaalsContact CA-OG1 3.31Å; D725-T728 WeakPolarHBondContact CA-OG1 3.49Å; D725-T728 PolarHBondContact O-OG1 3.38Å; D725-K729 WeakPolarHBondContact O-CG 3.41Å; D725-K729 PolarHBondContact O-N 2.8Å
726	K	90.5	Very high	87.7	Confident	125 Å²	125	73 Å²	73	54%	0.543	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-46	172.8	-71.8	172.3	-177.1	179.8	0	112.2	L431 T722 T723 K724 T728 K729 L730	L431-K726 HydrophobicContact CD1-CB 4.17Å; T722-K726 VanDerWaalsContact O-CG 3.31Å; T722-K726 WeakPolarHBondContact O-CG 3.29Å; T722-K726 PolarHBondContact O-N 3.49Å; T723-K726 WeakPolarHBondContact O-CB 3.4Å; T723-K726 PolarHBondContact O-N 3.04Å; K724-K726 VanDerWaalsContact C-N 3.28Å; K724-K726 PolarHBondContact O-N 3.38Å; K726-T728 PolarHBondContact O-N 2.66Å; K726-K729 PolarHBondContact O-N 3.47Å; K726-L730 PolarHBondContact O-N 2.99Å
727	A	88.9	Confident	86.5	Confident	6 Å²	6	74.6 Å²	74.6	5%	0.05	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-43.9	178.3	0	0	0	0	0	111.6	L431 I435 T723 K724 K729 L730 Q731	L431-A727 HydrophobicContact CB-CB 4.21Å; L431-A727 HydrophobicContact CD1-CB 4.25Å; I435-A727 HydrophobicContact CD1-CB 3.99Å; T723-A727 PolarHBondContact O-N 3.38Å; K724-A727 WeakPolarHBondContact O-CB 3.19Å; K724-A727 PolarHBondContact O-N 3.41Å; K724-A727 VanDerWaalsContact O-N 3.08Å; A727-K729 VanDerWaalsContact C-N 3.35Å; A727-K729 PolarHBondContact O-N 3.26Å; A727-L730 PolarHBondContact O-N 3.44Å; A727-Q731 VanDerWaalsContact O-CB 3.3Å; A727-Q731 WeakPolarHBondContact O-CB 3.46Å; A727-Q731 PolarHBondContact O-N 3.39Å
728	T	86.3	Confident	85.3	Confident	69 Å²	69	76.9 Å²	76.9	42%	0.423	38%	0.377	S	S	.	.	H	α-helix	trans	-63.9	-36	174.4	31.5	0	0	0	0	113	K724 D725 K726 Q731 L732	K724-T728 PolarHBondContact O-N 3.49Å; K724-T728 PolarHBondContact O-OG1 3.35Å; D725-T728 VanDerWaalsContact CA-OG1 3.31Å; D725-T728 WeakPolarHBondContact CA-OG1 3.49Å; D725-T728 PolarHBondContact O-OG1 3.38Å; K726-T728 PolarHBondContact O-N 2.66Å; T728-Q731 PolarHBondContact O-N 3.04Å; T728-L732 WeakPolarHBondContact O-CB 3.26Å; T728-L732 VanDerWaalsContact O-CG 3.25Å; T728-L732 WeakPolarHBondContact O-CG 3.48Å; T728-L732 PolarHBondContact O-N 3Å
729	K	88.4	Confident	83.7	Confident	150 Å²	150	75.9 Å²	75.9	65%	0.652	37%	0.374	S	S	*	.	H	α-helix	trans	-64.7	-46	175.5	-77.6	176.7	-179.4	-175.8	0	111.7	D725 K726 A727 Q731 L732 E733	D725-K729 WeakPolarHBondContact O-CG 3.41Å; D725-K729 PolarHBondContact O-N 2.8Å; K726-K729 PolarHBondContact O-N 3.47Å; A727-K729 VanDerWaalsContact C-N 3.35Å; A727-K729 PolarHBondContact O-N 3.26Å; K729-Q731 VanDerWaalsContact C-N 3.31Å; K729-Q731 PolarHBondContact O-N 3.05Å; K729-L732 PolarHBondContact O-N 3.43Å; K729-E733 PolarHBondContact O-N 2.95Å
730	L	87.5	Confident	81.9	Confident	25 Å²	25	76 Å²	76	13%	0.131	38%	0.381	C	S	.	.	H	α-helix	trans	-65	-36.7	175.8	-72.7	176.4	0	0	0	111.7	I424 E427 L431 K726 A727 E733 L734	I424-L730 HydrophobicContact CG1-CD2 4.41Å; I424-L730 HydrophobicContact CG2-CB 3.98Å; I424-L730 HydrophobicContact CG2-CD2 4.14Å; I424-L730 WeakPolarHBondContact CG2-O 3.48Å; E427-L730 HydrophobicContact CB-CD1 4.03Å; L431-L730 HydrophobicContact CD1-CD1 3.57Å; K726-L730 PolarHBondContact O-N 2.99Å; A727-L730 PolarHBondContact O-N 3.44Å; L730-E733 PolarHBondContact O-N 3.38Å; L730-L734 WeakPolarHBondContact O-CB 3.4Å; L730-L734 PolarHBondContact O-N 2.79Å
731	Q	84.1	Confident	79.5	Confident	98 Å²	98	83.1 Å²	83.1	46%	0.458	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-39.2	175.3	-168.2	171.4	7.5	0	0	112.3	A727 T728 K729 L734 T735	A727-Q731 VanDerWaalsContact O-CB 3.3Å; A727-Q731 WeakPolarHBondContact O-CB 3.46Å; A727-Q731 PolarHBondContact O-N 3.39Å; T728-Q731 PolarHBondContact O-N 3.04Å; K729-Q731 VanDerWaalsContact C-N 3.31Å; K729-Q731 PolarHBondContact O-N 3.05Å; Q731-L734 PolarHBondContact O-N 3.49Å; Q731-T735 WeakPolarHBondContact O-CB 3.37Å; Q731-T735 PolarHBondContact O-N 3.45Å; Q731-T735 PolarHBondContact O-OG1 2.85Å
732	L	82.1	Confident	77.1	Confident	105 Å²	105	85.9 Å²	85.9	55%	0.55	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-47.6	172.7	-74.4	165.7	0	0	0	110.7	T728 K729 L734 T735 D736	T728-L732 WeakPolarHBondContact O-CB 3.26Å; T728-L732 VanDerWaalsContact O-CG 3.25Å; T728-L732 WeakPolarHBondContact O-CG 3.48Å; T728-L732 PolarHBondContact O-N 3Å; K729-L732 PolarHBondContact O-N 3.43Å; L732-L734 VanDerWaalsContact C-N 3.27Å; L732-L734 PolarHBondContact O-N 2.82Å; L732-T735 CarbonylContact O-C 3.39Å; L732-T735 WeakPolarHBondContact O-CA 3.22Å; L732-T735 WeakPolarHBondContact O-CB 3.32Å; L732-T735 PolarHBondContact O-N 3.19Å; L732-D736 VanDerWaalsContact O-CG 3.27Å; L732-D736 PolarHBondContact O-N 3.21Å
733	E	83.3	Confident	74.6	Confident	70 Å²	70	87.4 Å²	87.4	33%	0.327	44%	0.44	S	S	.	.	H	α-helix	trans	-57.1	-40.6	175.5	-168.8	175.3	170	0	0	111.4	R420 I424 K729 L730 T735 D736 L737	R420-E733 IonicContact NE-OE1 2.72Å; R420-E733 IonicContact NH2-OE1 3.58Å; I424-E733 HydrophobicContact CD1-CB 4.43Å; I424-E733 HydrophobicContact CD1-CG 3.83Å; K729-E733 PolarHBondContact O-N 2.95Å; L730-E733 PolarHBondContact O-N 3.38Å; E733-T735 VanDerWaalsContact C-N 3.34Å; E733-T735 PolarHBondContact O-N 3.04Å; E733-D736 PolarHBondContact O-N 3.26Å; E733-L737 HydrophobicContact CG-CD1 4.21Å; E733-L737 WeakPolarHBondContact O-CB 3.45Å; E733-L737 WeakPolarHBondContact O-CD1 3.45Å; E733-L737 WeakPolarHBondContact O-CG 3.49Å; E733-L737 PolarHBondContact O-N 3.06Å
734	L	80.8	Confident	72	Confident	10 Å²	10	95.8 Å²	95.8	5%	0.052	48%	0.479	C	S	.	.	H	α-helix	trans	-69.2	-30.1	175.9	-164.4	140.2	0	0	0	113.1	I424 Q425 L730 Q731 L732 K738	I424-L734 HydrophobicContact CB-CD1 4.3Å; I424-L734 HydrophobicContact CG2-CB 4.05Å; I424-L734 HydrophobicContact CG2-CD1 3.84Å; Q425-L734 HydrophobicContact CB-CD1 4.13Å; Q425-L734 HydrophobicContact CG-CD1 3.78Å; L730-L734 WeakPolarHBondContact O-CB 3.4Å; L730-L734 PolarHBondContact O-N 2.79Å; Q731-L734 PolarHBondContact O-N 3.49Å; L732-L734 VanDerWaalsContact C-N 3.27Å; L732-L734 PolarHBondContact O-N 2.82Å; L734-K738 HydrophobicContact CD2-CD 3.95Å; L734-K738 VanDerWaalsContact CD2-CE 3.49Å; L734-K738 VanDerWaalsContact CD2-NZ 3.33Å; L734-K738 WeakPolarHBondContact O-CB 3.47Å; L734-K738 VanDerWaalsContact O-CG 3.29Å; L734-K738 WeakPolarHBondContact O-CG 3.42Å; L734-K738 PolarHBondContact O-N 3.15Å
735	T	75.4	Confident	69.8	Low	56 Å²	56	97.3 Å²	97.3	34%	0.344	50%	0.501	S	S	.	.	H	α-helix	trans	-76.5	-40.4	176.8	-53	0	0	0	0	110.8	Q731 L732 E733 K738 N739	Q731-T735 WeakPolarHBondContact O-CB 3.37Å; Q731-T735 PolarHBondContact O-N 3.45Å; Q731-T735 PolarHBondContact O-OG1 2.85Å; L732-T735 CarbonylContact O-C 3.39Å; L732-T735 WeakPolarHBondContact O-CA 3.22Å; L732-T735 WeakPolarHBondContact O-CB 3.32Å; L732-T735 PolarHBondContact O-N 3.19Å; E733-T735 VanDerWaalsContact C-N 3.34Å; E733-T735 PolarHBondContact O-N 3.04Å; T735-K738 PolarHBondContact O-N 3.28Å; T735-N739 WeakPolarHBondContact O-CB 3.48Å; T735-N739 VanDerWaalsContact O-CG 3.29Å; T735-N739 PolarHBondContact O-N 3.31Å; T735-N739 PolarHBondContact O-ND2 3.44Å
736	D	74.2	Confident	67.6	Low	105 Å²	105	102.4 Å²	102.4	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-66.8	-40.8	176.7	-65.4	-20.9	0	0	0	111.1	L732 E733 K738 N739	L732-D736 VanDerWaalsContact O-CG 3.27Å; L732-D736 PolarHBondContact O-N 3.21Å; E733-D736 PolarHBondContact O-N 3.26Å; D736-K738 PolarHBondContact O-N 3.5Å; D736-N739 PolarHBondContact O-N 3.37Å
737	L	69.2	Low	65.8	Low	44 Å²	44	101.3 Å²	101.3	23%	0.23	52%	0.522	C	S	.	.	H	α-helix	trans	-65.7	-24.2	173.8	-69.6	168.3	0	0	0	113.1	R417 M421 I424 E733	R417-L737 HydrophobicContact CG-CD2 4.04Å; M421-L737 HydrophobicContact CG-CB 4.05Å; M421-L737 HydrophobicContact CG-CD1 4.19Å; M421-L737 HydrophobicContact SD-CB 4.35Å; I424-L737 HydrophobicContact CD1-CD1 3.8Å; E733-L737 HydrophobicContact CG-CD1 4.21Å; E733-L737 WeakPolarHBondContact O-CB 3.45Å; E733-L737 WeakPolarHBondContact O-CD1 3.45Å; E733-L737 WeakPolarHBondContact O-CG 3.49Å; E733-L737 PolarHBondContact O-N 3.06Å
738	K	66.8	Low	64.3	Low	124 Å²	124	102.9 Å²	102.9	54%	0.539	53%	0.53	S	S	.	.	H	α-helix	trans	-86	-26.5	176.4	-82.2	178.1	179.5	175.5	0	114	M421 L734 T735 D736	M421-K738 HydrophobicContact SD-CG 4.15Å; L734-K738 HydrophobicContact CD2-CD 3.95Å; L734-K738 VanDerWaalsContact CD2-CE 3.49Å; L734-K738 VanDerWaalsContact CD2-NZ 3.33Å; L734-K738 WeakPolarHBondContact O-CB 3.47Å; L734-K738 VanDerWaalsContact O-CG 3.29Å; L734-K738 WeakPolarHBondContact O-CG 3.42Å; L734-K738 PolarHBondContact O-N 3.15Å; T735-K738 PolarHBondContact O-N 3.28Å; D736-K738 PolarHBondContact O-N 3.5Å
739	N	57.8	Low	63	Low	116 Å²	116	107 Å²	107	62%	0.62	54%	0.537	S	S	*	.			trans	-99.7	22.2	-169	-75.2	-12.6	0	0	0	114.7	T735 D736 E741	T735-N739 WeakPolarHBondContact O-CB 3.48Å; T735-N739 VanDerWaalsContact O-CG 3.29Å; T735-N739 PolarHBondContact O-N 3.31Å; T735-N739 PolarHBondContact O-ND2 3.44Å; D736-N739 PolarHBondContact O-N 3.37Å; N739-E741 PolarHBondContact O-N 2.88Å
740	V	54.6	Low	61.7	Low	94 Å²	94	103.6 Å²	103.6	57%	0.57	53%	0.531	S	S	*	.			trans	-79.2	86	175.8	-172.5	0	0	0	0	110
741	E	43.5	Very low	60.5	Low	178 Å²	178	105 Å²	105	83%	0.832	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-85.9	142.5	155.3	-81	-177.4	158	0	0	109.4	N739 P743	N739-E741 PolarHBondContact O-N 2.88Å; E741-P743 WeakPolarHBondContact O-CD 3.43Å
742	E	42.9	Very low	59.8	Low	191 Å²	191	104.8 Å²	104.8	89%	0.893	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-52.9	121.3	178	-71.5	178.4	157.1	0	0	111.5	Q744	E742-Q744 PolarHBondContact O-N 2.85Å
743	P	40.3	Very low	59.4	Low	93 Å²	93	106.2 Å²	106.2	60%	0.604	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-79.7	118.8	174.4	20.7	-13.7	0	0	0	110	E741	E741-P743 WeakPolarHBondContact O-CD 3.43Å
744	Q	35.7	Very low	58.9	Low	184 Å²	184	107.9 Å²	107.9	86%	0.86	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-60.7	134.3	157.5	-72.7	-176.9	-19.9	0	0	108.4	E742 E746	E742-Q744 PolarHBondContact O-N 2.85Å; Q744-E746 PolarHBondContact O-N 2.9Å
745	S	44.1	Very low	58.8	Low	125 Å²	125	109.2 Å²	109.2	87%	0.874	56%	0.556	S	S	*	*			trans	-62.9	106.4	-179.5	58.5	0	0	0	0	110.6
746	E	44.4	Very low	58.9	Low	182 Å²	182	113.3 Å²	113.3	85%	0.85	57%	0.571	S	S	*	*			trans	-103.5	136.8	159	-75.8	-167.4	160.4	0	0	110.2	Q744 L748	Q744-E746 PolarHBondContact O-N 2.9Å; E746-L748 PolarHBondContact O-N 2.96Å
747	D	52.1	Low	59.2	Low	102 Å²	102	113.3 Å²	113.3	55%	0.545	57%	0.567	S	S	.	*			trans	-61.8	120.9	-171.9	-145.4	-29.1	0	0	0	111	R749 P750	D747-R749 PolarHBondContact O-N 3.33Å; D747-R749 VanDerWaalsContact O-N 3.16Å; D747-R749 IonicContact OD1-CZ 3.17Å; D747-R749 IonicContact OD1-NE 2.68Å; D747-R749 PolarHBondContact OD1-NE 3.16Å; D747-R749 IonicContact OD1-NH2 3.36Å; D747-R749 PolarHBondContact OD1-NH2 2.95Å; D747-R749 IonicContact OD2-CZ 3.9Å; D747-R749 IonicContact OD2-NE 2.91Å; D747-R749 PolarHBondContact OD2-NE 3.25Å; D747-R749 IonicContact OD2-NH2 3.99Å; D747-R749 PolarHBondContact OD2-NH2 3.46Å; D747-P750 WeakPolarHBondContact O-CD 3.42Å
748	L	57.2	Low	59.8	Low	39 Å²	39	112.5 Å²	112.5	20%	0.204	56%	0.563	C	S	.	*	S	Bend	trans	-69.2	-7.2	-174.6	-83.6	160.4	0	0	0	114.9	L402 I406 E746 E752	L402-L748 HydrophobicContact CB-CD2 3.9Å; L402-L748 HydrophobicContact CD1-CD2 4.14Å; I406-L748 HydrophobicContact CD1-CD1 3.75Å; E746-L748 PolarHBondContact O-N 2.96Å; L748-E752 PolarHBondContact O-N 3.48Å
749	R	57.9	Low	60.6	Low	156 Å²	156	109.3 Å²	109.3	59%	0.589	55%	0.554	S	S	*	*	H	α-helix	trans	-62.1	-40.5	-171.5	-70.8	-176.1	-93.9	-179.7	-4.1	115.9	D747 L751 E752 E753	D747-R749 PolarHBondContact O-N 3.33Å; D747-R749 VanDerWaalsContact O-N 3.16Å; D747-R749 IonicContact OD1-CZ 3.17Å; D747-R749 IonicContact OD1-NE 2.68Å; D747-R749 PolarHBondContact OD1-NE 3.16Å; D747-R749 IonicContact OD1-NH2 3.36Å; D747-R749 PolarHBondContact OD1-NH2 2.95Å; D747-R749 IonicContact OD2-CZ 3.9Å; D747-R749 IonicContact OD2-NE 2.91Å; D747-R749 PolarHBondContact OD2-NE 3.25Å; D747-R749 IonicContact OD2-NH2 3.99Å; D747-R749 PolarHBondContact OD2-NH2 3.46Å; R749-L751 PolarHBondContact O-N 3.13Å; R749-E752 PolarHBondContact O-N 3.2Å; R749-E753 WeakPolarHBondContact O-CG 3.45Å; R749-E753 PolarHBondContact O-N 3.39Å
750	P	62.2	Low	61.7	Low	79 Å²	79	106.5 Å²	106.5	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-67.8	-34	-177.7	-19.1	31.9	0	0	0	113.8	D747 E753 E754	D747-P750 WeakPolarHBondContact O-CD 3.42Å; P750-E753 PolarHBondContact O-N 3.07Å; P750-E754 PolarHBondContact O-N 3.29Å
751	L	62.9	Low	63.1	Low	54 Å²	54	106.8 Å²	106.8	28%	0.283	54%	0.54	S	S	.	.	H	α-helix	trans	-75.2	-32.2	-179.9	-74.1	159.3	0	0	0	111.7	L395 I399 L402 R749 L755	L395-L751 HydrophobicContact CD2-CD2 4.04Å; I399-L751 HydrophobicContact CD1-CB 4.38Å; I399-L751 HydrophobicContact CG1-CB 4.19Å; L402-L751 HydrophobicContact CD1-CD1 3.91Å; R749-L751 PolarHBondContact O-N 3.13Å; L751-L755 PolarHBondContact O-N 3.38Å
752	E	67.8	Low	65	Low	93 Å²	93	99 Å²	99	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-69.5	-36.1	173	-69.7	-179.7	161.2	0	0	111.8	I399 L748 R749 L755 Q756	I399-E752 HydrophobicContact CD1-CG 4.42Å; L748-E752 PolarHBondContact O-N 3.48Å; R749-E752 PolarHBondContact O-N 3.2Å; E752-L755 PolarHBondContact O-N 3.44Å; E752-Q756 WeakPolarHBondContact O-CG 3.3Å; E752-Q756 PolarHBondContact O-N 2.96Å; E752-Q756 VanDerWaalsContact O-N 3.08Å
753	E	73.5	Confident	67	Low	135 Å²	135	93.5 Å²	93.5	63%	0.631	49%	0.487	S	S	*	.	H	α-helix	trans	-66.3	-44.2	174.8	-73.6	176	-179.9	0	0	112.4	R749 P750 L755 Q756 E757	R749-E753 WeakPolarHBondContact O-CG 3.45Å; R749-E753 PolarHBondContact O-N 3.39Å; P750-E753 PolarHBondContact O-N 3.07Å; E753-L755 VanDerWaalsContact C-N 3.35Å; E753-L755 PolarHBondContact O-N 3.26Å; E753-Q756 PolarHBondContact O-N 3.01Å; E753-E757 PolarHBondContact O-N 3.48Å
754	E	73.9	Confident	69.1	Low	106 Å²	106	92.2 Å²	92.2	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-38.6	174.5	-83.7	-171.6	160	0	0	112.6	P750 Q756 E757 I758	P750-E754 PolarHBondContact O-N 3.29Å; E754-Q756 VanDerWaalsContact C-N 3.33Å; E754-Q756 PolarHBondContact O-N 3.42Å; E754-E757 PolarHBondContact O-N 2.93Å; E754-I758 WeakPolarHBondContact O-CG1 3.3Å; E754-I758 PolarHBondContact O-N 3.33Å
755	L	78.6	Confident	71.4	Confident	37 Å²	37	86.8 Å²	86.8	19%	0.194	45%	0.453	C	S	.	.	H	α-helix	trans	-64.1	-40.4	175.8	-177.3	66.5	0	0	0	111.2	K392 L395 I399 L751 E752 E753 I758 V759	K392-L755 HydrophobicContact CG-CD1 4.01Å; L395-L755 HydrophobicContact CB-CD1 4.15Å; I399-L755 HydrophobicContact CD1-CB 4.22Å; I399-L755 HydrophobicContact CD1-CD2 3.87Å; L751-L755 PolarHBondContact O-N 3.38Å; E752-L755 PolarHBondContact O-N 3.44Å; E753-L755 VanDerWaalsContact C-N 3.35Å; E753-L755 PolarHBondContact O-N 3.26Å; L755-I758 PolarHBondContact O-N 3.4Å; L755-V759 WeakPolarHBondContact O-CB 3.33Å; L755-V759 WeakPolarHBondContact O-CG2 3.42Å; L755-V759 PolarHBondContact O-N 2.86Å
756	Q	78.3	Confident	73.3	Confident	143 Å²	143	86.9 Å²	86.9	67%	0.668	43%	0.434	S	S	*	.	H	α-helix	trans	-63.9	-40.1	175.1	-76.1	-175.7	6	0	0	112	E752 E753 E754 V759 A760	E752-Q756 WeakPolarHBondContact O-CG 3.3Å; E752-Q756 PolarHBondContact O-N 2.96Å; E752-Q756 VanDerWaalsContact O-N 3.08Å; E753-Q756 PolarHBondContact O-N 3.01Å; E754-Q756 VanDerWaalsContact C-N 3.33Å; E754-Q756 PolarHBondContact O-N 3.42Å; Q756-V759 PolarHBondContact O-N 3.4Å; Q756-A760 WeakPolarHBondContact O-CB 3.47Å; Q756-A760 PolarHBondContact O-N 2.87Å
757	E	80.4	Confident	75.2	Confident	104 Å²	104	81.1 Å²	81.1	49%	0.486	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-42.5	178.3	-161.7	-169.7	155	0	0	112.1	E753 E754 A760 K761	E753-E757 PolarHBondContact O-N 3.48Å; E754-E757 PolarHBondContact O-N 2.93Å; E757-A760 PolarHBondContact O-N 3.47Å; E757-K761 WeakPolarHBondContact O-CG 3.41Å; E757-K761 PolarHBondContact O-N 2.95Å; E757-K761 VanDerWaalsContact OE1-CE 3.23Å; E757-K761 WeakPolarHBondContact OE1-CE 3.44Å; E757-K761 IonicContact OE1-NZ 3.34Å; E757-K761 PolarHBondContact OE1-NZ 2.94Å
758	I	81.1	Confident	76.7	Confident	28 Å²	28	79.8 Å²	79.8	14%	0.144	41%	0.408	C	S	.	.	H	α-helix	trans	-67.2	-40.3	176.7	-68.2	176.4	0	0	0	111	D391 K392 L395 E754 L755 A760 K761 I762	D391-I758 HydrophobicContact CB-CD1 4.42Å; K392-I758 HydrophobicContact CB-CG2 4.11Å; L395-I758 HydrophobicContact CD1-CD1 3.34Å; E754-I758 WeakPolarHBondContact O-CG1 3.3Å; E754-I758 PolarHBondContact O-N 3.33Å; L755-I758 PolarHBondContact O-N 3.4Å; I758-A760 VanDerWaalsContact C-N 3.33Å; I758-A760 PolarHBondContact O-N 2.96Å; I758-K761 PolarHBondContact O-N 3.14Å; I758-I762 HydrophobicContact CG2-CD1 3.97Å; I758-I762 HydrophobicContact CG2-CG1 4.46Å; I758-I762 VanDerWaalsContact O-CG1 3.31Å; I758-I762 WeakPolarHBondContact O-CG1 3.37Å; I758-I762 PolarHBondContact O-N 3.4Å
759	V	82.4	Confident	78.1	Confident	57 Å²	57	79.9 Å²	79.9	35%	0.345	41%	0.406	S	S	.	.	H	α-helix	trans	-62.6	-40.8	175.5	169.7	0	0	0	0	111.2	K392 L755 Q756 I762 S763	K392-V759 HydrophobicContact CD-CG2 3.92Å; K392-V759 HydrophobicContact CG-CG2 4.34Å; L755-V759 WeakPolarHBondContact O-CB 3.33Å; L755-V759 WeakPolarHBondContact O-CG2 3.42Å; L755-V759 PolarHBondContact O-N 2.86Å; Q756-V759 PolarHBondContact O-N 3.4Å; V759-I762 PolarHBondContact O-N 2.78Å; V759-S763 PolarHBondContact O-N 2.86Å
760	A	82.6	Confident	79.4	Confident	56 Å²	56	76.2 Å²	76.2	46%	0.463	40%	0.396	S	S	.	.	H	α-helix	trans	-62.2	-45.1	174.3	0	0	0	0	0	111.7	Q756 E757 I758 I762 S763 S764	Q756-A760 WeakPolarHBondContact O-CB 3.47Å; Q756-A760 PolarHBondContact O-N 2.87Å; E757-A760 PolarHBondContact O-N 3.47Å; I758-A760 VanDerWaalsContact C-N 3.33Å; I758-A760 PolarHBondContact O-N 2.96Å; A760-I762 PolarHBondContact O-N 2.92Å; A760-S763 PolarHBondContact O-N 3.35Å; A760-S763 PolarHBondContact O-OG 3.14Å; A760-S764 PolarHBondContact O-N 3.06Å; A760-S764 VanDerWaalsContact O-N 3.1Å
761	K	83	Confident	80.5	Confident	101 Å²	101	77.3 Å²	77.3	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-40.2	176.1	-74.3	173.3	-174.1	163.8	0	112.8	L388 E757 I758 S763 S764 K765	L388-K761 HydrophobicContact CD1-CB 4.45Å; E757-K761 WeakPolarHBondContact O-CG 3.41Å; E757-K761 PolarHBondContact O-N 2.95Å; E757-K761 VanDerWaalsContact OE1-CE 3.23Å; E757-K761 WeakPolarHBondContact OE1-CE 3.44Å; E757-K761 IonicContact OE1-NZ 3.34Å; E757-K761 PolarHBondContact OE1-NZ 2.94Å; I758-K761 PolarHBondContact O-N 3.14Å; K761-S763 VanDerWaalsContact C-N 3.35Å; K761-S764 PolarHBondContact O-N 2.91Å; K761-K765 WeakPolarHBondContact O-CG 3.42Å; K761-K765 PolarHBondContact O-N 3.44Å
762	I	84	Confident	81.5	Confident	15 Å²	15	75.2 Å²	75.2	8%	0.077	39%	0.385	C	S	.	.	H	α-helix	trans	-61.9	-43.8	174.9	-70.1	167.4	0	0	0	110.6	L388 E389 K392 I758 V759 A760 S764 K765 R766	L388-I762 HydrophobicContact CB-CD1 4.27Å; L388-I762 HydrophobicContact CB-CG1 3.61Å; L388-I762 WeakPolarHBondContact O-CD1 3.5Å; E389-I762 HydrophobicContact CG-CD1 4.44Å; K392-I762 HydrophobicContact CB-CD1 3.87Å; K392-I762 HydrophobicContact CD-CD1 3.93Å; K392-I762 HydrophobicContact CG-CD1 4.45Å; I758-I762 HydrophobicContact CG2-CD1 3.97Å; I758-I762 HydrophobicContact CG2-CG1 4.46Å; I758-I762 VanDerWaalsContact O-CG1 3.31Å; I758-I762 WeakPolarHBondContact O-CG1 3.37Å; I758-I762 PolarHBondContact O-N 3.4Å; V759-I762 PolarHBondContact O-N 2.78Å; A760-I762 PolarHBondContact O-N 2.92Å; I762-S764 PolarHBondContact O-N 3.43Å; I762-K765 PolarHBondContact O-N 2.94Å; I762-R766 WeakPolarHBondContact O-CB 3.3Å; I762-R766 PolarHBondContact O-N 2.83Å
763	S	83.9	Confident	82.3	Confident	75 Å²	75	74.6 Å²	74.6	52%	0.524	38%	0.381	S	S	.	.	H	α-helix	trans	-61.6	-43.2	179.5	76.2	0	0	0	0	112.1	V759 A760 K761 R766 A767	V759-S763 PolarHBondContact O-N 2.86Å; A760-S763 PolarHBondContact O-N 3.35Å; A760-S763 PolarHBondContact O-OG 3.14Å; K761-S763 VanDerWaalsContact C-N 3.35Å; S763-R766 PolarHBondContact O-N 3.07Å; S763-A767 PolarHBondContact O-N 2.81Å; S763-A767 VanDerWaalsContact O-N 3.1Å
764	S	85.5	Confident	83	Confident	65 Å²	65	71.7 Å²	71.7	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-47.6	175.8	-173.9	0	0	0	0	112	A760 K761 I762 R766 A767 E768	A760-S764 PolarHBondContact O-N 3.06Å; A760-S764 VanDerWaalsContact O-N 3.1Å; K761-S764 PolarHBondContact O-N 2.91Å; I762-S764 PolarHBondContact O-N 3.43Å; S764-R766 VanDerWaalsContact C-N 3.32Å; S764-R766 PolarHBondContact O-N 3.48Å; S764-A767 WeakPolarHBondContact O-CB 3.17Å; S764-A767 PolarHBondContact O-N 3.32Å; S764-E768 PolarHBondContact O-N 3.45Å; S764-E768 VanDerWaalsContact O-N 3.12Å
765	K	82.9	Confident	83.5	Confident	70 Å²	70	71.7 Å²	71.7	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-70.7	-26.9	-179.7	-68.3	-49.7	-174.2	-167.1	0	113.4	L388 K761 I762 E768 Y769	L388-K765 HydrophobicContact CD1-CB 4.45Å; L388-K765 HydrophobicContact CD1-CG 4.05Å; K761-K765 WeakPolarHBondContact O-CG 3.42Å; K761-K765 PolarHBondContact O-N 3.44Å; I762-K765 PolarHBondContact O-N 2.94Å; K765-E768 VanDerWaalsContact CD-OE2 3.29Å; K765-E768 WeakPolarHBondContact CD-OE2 3.48Å; K765-E768 IonicContact NZ-OE1 2.69Å; K765-E768 PolarHBondContact NZ-OE1 3.05Å; K765-E768 IonicContact NZ-OE2 2.71Å; K765-E768 PolarHBondContact NZ-OE2 3.19Å; K765-Y769 WeakPolarHBondContact O-CB 3.33Å; K765-Y769 PolarHBondContact O-N 3.37Å
766	R	84	Confident	83.9	Confident	127 Å²	127	72.3 Å²	72.3	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-70	-38	172.4	-171	172.7	-88	-109.7	4.2	112.3	L385 E389 I762 S763 S764 Y769 E770	L385-R766 HydrophobicContact CD1-CB 3.7Å; L385-R766 HydrophobicContact CD1-CG 4.06Å; E389-R766 IonicContact OE1-CZ 2.7Å; E389-R766 IonicContact OE1-NH2 3.69Å; E389-R766 PolarHBondContact OE1-NH2 2.94Å; I762-R766 WeakPolarHBondContact O-CB 3.3Å; I762-R766 PolarHBondContact O-N 2.83Å; S763-R766 PolarHBondContact O-N 3.07Å; S764-R766 VanDerWaalsContact C-N 3.32Å; S764-R766 PolarHBondContact O-N 3.48Å; R766-Y769 PolarHBondContact O-N 3.31Å; R766-E770 PolarHBondContact O-N 2.88Å; R766-E770 VanDerWaalsContact O-N 3.09Å
767	A	85.6	Confident	84.3	Confident	61 Å²	61	68 Å²	68	50%	0.504	36%	0.362	S	S	.	.	H	α-helix	trans	-62.8	-47	171.2	0	0	0	0	0	111.6	S763 S764 Y769 E770 E771	S763-A767 PolarHBondContact O-N 2.81Å; S763-A767 VanDerWaalsContact O-N 3.1Å; S764-A767 WeakPolarHBondContact O-CB 3.17Å; S764-A767 PolarHBondContact O-N 3.32Å; A767-Y769 VanDerWaalsContact C-N 3.28Å; A767-Y769 PolarHBondContact O-N 2.88Å; A767-E770 PolarHBondContact O-N 3.43Å; A767-E771 WeakPolarHBondContact O-CB 3.29Å; A767-E771 PolarHBondContact O-N 3.16Å
768	E	83.6	Confident	84.6	Confident	74 Å²	74	68.2 Å²	68.2	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-36.8	176.2	-71.4	175.2	-148.9	0	0	112.8	S764 K765 A772	S764-E768 PolarHBondContact O-N 3.45Å; S764-E768 VanDerWaalsContact O-N 3.12Å; K765-E768 VanDerWaalsContact CD-OE2 3.29Å; K765-E768 WeakPolarHBondContact CD-OE2 3.48Å; K765-E768 IonicContact NZ-OE1 2.69Å; K765-E768 PolarHBondContact NZ-OE1 3.05Å; K765-E768 IonicContact NZ-OE2 2.71Å; K765-E768 PolarHBondContact NZ-OE2 3.19Å; E768-A772 WeakPolarHBondContact O-CB 3.37Å; E768-A772 PolarHBondContact O-N 3.07Å
769	Y	86.1	Confident	84.9	Confident	41 Å²	41	69.2 Å²	69.2	16%	0.161	37%	0.372	C	S	.	.	H	α-helix	trans	-68.7	-46.7	177	171.2	-102.5	0	0	0	112.7	V378 C381 R382 L385 K765 R766 A767 E771 A772 K773	V378-Y769 HydrophobicContact CG1-CD2 4.39Å; V378-Y769 HydrophobicContact CG1-CE2 3.78Å; C381-Y769 HydrophobicContact CB-CD2 4.12Å; R382-Y769 HydrophobicContact CB-CD2 4.14Å; R382-Y769 HydrophobicContact CB-CE2 3.75Å; R382-Y769 HydrophobicContact CG-CE2 4.21Å; L385-Y769 HydrophobicContact CD1-CG 4.47Å; K765-Y769 WeakPolarHBondContact O-CB 3.33Å; K765-Y769 PolarHBondContact O-N 3.37Å; R766-Y769 PolarHBondContact O-N 3.31Å; A767-Y769 VanDerWaalsContact C-N 3.28Å; A767-Y769 PolarHBondContact O-N 2.88Å; Y769-E771 VanDerWaalsContact C-N 3.32Å; Y769-E771 PolarHBondContact O-N 3.48Å; Y769-A772 PolarHBondContact O-N 2.98Å; Y769-K773 HydrophobicContact CE1-CD 4.04Å; Y769-K773 VanDerWaalsContact O-CB 3.27Å; Y769-K773 WeakPolarHBondContact O-CB 3.21Å; Y769-K773 PolarHBondContact O-N 2.79Å
770	E	85.1	Confident	85	Confident	79 Å²	79	71.7 Å²	71.7	37%	0.369	38%	0.378	S	S	.	.	H	α-helix	trans	-68.2	-32.7	177.6	-72.4	-61.4	157.5	0	0	111.8	R766 A767 K773 T774	R766-E770 PolarHBondContact O-N 2.88Å; R766-E770 VanDerWaalsContact O-N 3.09Å; A767-E770 PolarHBondContact O-N 3.43Å; E770-K773 PolarHBondContact O-N 2.91Å; E770-K773 IonicContact OE1-NZ 2.71Å; E770-K773 PolarHBondContact OE1-NZ 3.18Å; E770-K773 VanDerWaalsContact OE1-NZ 3.09Å; E770-K773 WeakPolarHBondContact OE2-CD 3.29Å; E770-K773 IonicContact OE2-NZ 2.74Å; E770-K773 PolarHBondContact OE2-NZ 3.38Å; E770-T774 WeakPolarHBondContact O-CB 3.38Å; E770-T774 WeakPolarHBondContact O-CG2 3.42Å; E770-T774 PolarHBondContact O-N 2.9Å; E770-T774 PolarHBondContact O-OG1 3.4Å
771	E	86.1	Confident	85.2	Confident	103 Å²	103	71.7 Å²	71.7	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-44.9	171.7	-165.3	-168.4	156.7	0	0	111.9	A767 Y769 K773 T774 K775	A767-E771 WeakPolarHBondContact O-CB 3.29Å; A767-E771 PolarHBondContact O-N 3.16Å; Y769-E771 VanDerWaalsContact C-N 3.32Å; Y769-E771 PolarHBondContact O-N 3.48Å; E771-K773 VanDerWaalsContact C-N 3.3Å; E771-K773 PolarHBondContact O-N 2.99Å; E771-T774 WeakPolarHBondContact CA-OG1 3.47Å; E771-T774 PolarHBondContact O-OG1 3.1Å; E771-K775 HydrophobicContact CG-CD 4.43Å; E771-K775 WeakPolarHBondContact O-CB 3.42Å; E771-K775 WeakPolarHBondContact O-CG 3.42Å; E771-K775 PolarHBondContact O-N 3.28Å; E771-K775 WeakPolarHBondContact OE1-CE 3.27Å; E771-K775 IonicContact OE1-NZ 3.66Å; E771-K775 PolarHBondContact OE1-NZ 3.36Å
772	A	83.6	Confident	85.4	Confident	10 Å²	10	70.9 Å²	70.9	8%	0.083	38%	0.378	C	S	.	.	H	α-helix	trans	-64.7	-36	176.2	0	0	0	0	0	112.2	V378 E768 Y769 M776	V378-A772 VanDerWaalsContact CG2-C 3.47Å; V378-A772 HydrophobicContact CG2-CB 3.78Å; V378-A772 VanDerWaalsContact CG2-O 3.29Å; V378-A772 WeakPolarHBondContact CG2-O 3.32Å; E768-A772 WeakPolarHBondContact O-CB 3.37Å; E768-A772 PolarHBondContact O-N 3.07Å; Y769-A772 PolarHBondContact O-N 2.98Å; A772-M776 WeakPolarHBondContact O-CB 3.27Å; A772-M776 PolarHBondContact O-N 2.89Å
773	K	84.8	Confident	85.6	Confident	80 Å²	80	72.6 Å²	72.6	35%	0.348	38%	0.384	S	S	.	.	H	α-helix	trans	-72.9	-39.9	-179.9	-178.3	178.5	156.5	-142.7	0	112.6	Y769 E770 E771 M776 A777	Y769-K773 HydrophobicContact CE1-CD 4.04Å; Y769-K773 VanDerWaalsContact O-CB 3.27Å; Y769-K773 WeakPolarHBondContact O-CB 3.21Å; Y769-K773 PolarHBondContact O-N 2.79Å; E770-K773 PolarHBondContact O-N 2.91Å; E770-K773 IonicContact OE1-NZ 2.71Å; E770-K773 PolarHBondContact OE1-NZ 3.18Å; E770-K773 VanDerWaalsContact OE1-NZ 3.09Å; E770-K773 WeakPolarHBondContact OE2-CD 3.29Å; E770-K773 IonicContact OE2-NZ 2.74Å; E770-K773 PolarHBondContact OE2-NZ 3.38Å; E771-K773 VanDerWaalsContact C-N 3.3Å; E771-K773 PolarHBondContact O-N 2.99Å; K773-M776 PolarHBondContact O-N 3.04Å; K773-A777 PolarHBondContact O-N 3.24Å
774	T	87.1	Confident	85.6	Confident	73 Å²	73	72.3 Å²	72.3	45%	0.448	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-42.2	173.1	46.7	0	0	0	0	111.2	E770 E771 M776 A777 N778	E770-T774 WeakPolarHBondContact O-CB 3.38Å; E770-T774 WeakPolarHBondContact O-CG2 3.42Å; E770-T774 PolarHBondContact O-N 2.9Å; E770-T774 PolarHBondContact O-OG1 3.4Å; E771-T774 WeakPolarHBondContact CA-OG1 3.47Å; E771-T774 PolarHBondContact O-OG1 3.1Å; T774-M776 VanDerWaalsContact C-N 3.34Å; T774-M776 PolarHBondContact O-N 2.93Å; T774-A777 PolarHBondContact O-N 3.14Å; T774-N778 PolarHBondContact O-N 3.17Å
775	K	85.7	Confident	85.6	Confident	107 Å²	107	75.4 Å²	75.4	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-58.1	-42.7	171.6	-77.2	172.4	172.8	169.1	0	112.6	E771 N778 L779	E771-K775 HydrophobicContact CG-CD 4.43Å; E771-K775 WeakPolarHBondContact O-CB 3.42Å; E771-K775 WeakPolarHBondContact O-CG 3.42Å; E771-K775 PolarHBondContact O-N 3.28Å; E771-K775 WeakPolarHBondContact OE1-CE 3.27Å; E771-K775 IonicContact OE1-NZ 3.66Å; E771-K775 PolarHBondContact OE1-NZ 3.36Å; K775-N778 PolarHBondContact O-N 3.3Å; K775-L779 WeakPolarHBondContact O-CG 3.46Å; K775-L779 PolarHBondContact O-N 3.18Å
776	M	87.3	Confident	85.7	Confident	50 Å²	50	72.2 Å²	72.2	25%	0.246	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-41.9	175.9	-175.7	-166.3	75.8	0	0	112.3	L371 E375 V378 A772 K773 T774 L779 K780	L371-M776 HydrophobicContact CD1-CG 3.94Å; E375-M776 HydrophobicContact CG-CG 4.16Å; E375-M776 HydrophobicContact CG-SD 3.86Å; V378-M776 HydrophobicContact CG2-CB 4.12Å; V378-M776 HydrophobicContact CG2-SD 4.15Å; A772-M776 WeakPolarHBondContact O-CB 3.27Å; A772-M776 PolarHBondContact O-N 2.89Å; K773-M776 PolarHBondContact O-N 3.04Å; T774-M776 VanDerWaalsContact C-N 3.34Å; T774-M776 PolarHBondContact O-N 2.93Å; M776-L779 PolarHBondContact O-N 2.95Å; M776-K780 WeakPolarHBondContact O-CB 3.45Å; M776-K780 PolarHBondContact O-N 3.14Å
777	A	85.6	Confident	85.7	Confident	53 Å²	53	67.7 Å²	67.7	44%	0.438	35%	0.354	S	S	.	.	H	α-helix	trans	-63.4	-41.4	178	0	0	0	0	0	112	K773 T774 K780 A781	K773-A777 PolarHBondContact O-N 3.24Å; T774-A777 PolarHBondContact O-N 3.14Å; A777-K780 PolarHBondContact O-N 3.13Å; A777-A781 PolarHBondContact O-N 2.82Å
778	N	87.7	Confident	85.6	Confident	107 Å²	107	71.2 Å²	71.2	57%	0.572	36%	0.36	S	S	*	.	H	α-helix	trans	-65.2	-47.5	176.6	-67.2	-11.9	0	0	0	111.6	T774 K775 K780 A781 D782	T774-N778 PolarHBondContact O-N 3.17Å; K775-N778 PolarHBondContact O-N 3.3Å; N778-K780 PolarHBondContact O-N 2.92Å; N778-A781 PolarHBondContact O-N 3.4Å; N778-A781 VanDerWaalsContact O-N 3.17Å; N778-D782 PolarHBondContact O-N 2.94Å
779	L	86.2	Confident	85.6	Confident	49 Å²	49	71.7 Å²	71.7	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-30.5	177.2	-72	172.8	0	0	0	112.8	L371 C374 K775 M776 Y783	L371-L779 HydrophobicContact CD1-CB 4.18Å; C374-L779 HydrophobicContact CB-CD1 3.84Å; K775-L779 WeakPolarHBondContact O-CG 3.46Å; K775-L779 PolarHBondContact O-N 3.18Å; M776-L779 PolarHBondContact O-N 2.95Å; L779-Y783 WeakPolarHBondContact O-CB 3.48Å; L779-Y783 PolarHBondContact O-N 3.04Å; L779-Y783 VanDerWaalsContact O-N 3.1Å
780	K	84.8	Confident	85.4	Confident	110 Å²	110	71.7 Å²	71.7	48%	0.478	36%	0.362	S	S	.	.	H	α-helix	trans	-70.4	-45.2	175	-174.5	171.2	-179.5	172.2	0	111.7	L371 M776 A777 N778 D782 Y783 D784	L371-K780 HydrophobicContact CD1-CB 3.89Å; L371-K780 HydrophobicContact CD2-CB 4.22Å; L371-K780 HydrophobicContact CD2-CG 4.28Å; M776-K780 WeakPolarHBondContact O-CB 3.45Å; M776-K780 PolarHBondContact O-N 3.14Å; A777-K780 PolarHBondContact O-N 3.13Å; N778-K780 PolarHBondContact O-N 2.92Å; K780-D782 VanDerWaalsContact C-N 3.31Å; K780-D782 PolarHBondContact O-N 3.41Å; K780-Y783 PolarHBondContact O-N 3.3Å; K780-D784 PolarHBondContact O-N 3.36Å
781	A	86.9	Confident	85.2	Confident	56 Å²	56	73.3 Å²	73.3	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-40.8	175.1	0	0	0	0	0	111.9	A777 N778 Y783 D784 K785	A777-A781 PolarHBondContact O-N 2.82Å; N778-A781 PolarHBondContact O-N 3.4Å; N778-A781 VanDerWaalsContact O-N 3.17Å; A781-Y783 VanDerWaalsContact C-N 3.35Å; A781-Y783 PolarHBondContact O-N 3.14Å; A781-D784 PolarHBondContact O-N 2.94Å; A781-K785 WeakPolarHBondContact O-CB 3.49Å; A781-K785 PolarHBondContact O-N 3.26Å
782	D	86.3	Confident	85	Confident	83 Å²	83	74.7 Å²	74.7	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-65.1	-37.1	176.9	-69.7	-23.1	0	0	0	112.7	R367 N778 K780 A786	R367-D782 WeakPolarHBondContact CD-O 3.48Å; N778-D782 PolarHBondContact O-N 2.94Å; K780-D782 VanDerWaalsContact C-N 3.31Å; K780-D782 PolarHBondContact O-N 3.41Å; D782-A786 WeakPolarHBondContact O-CB 3.42Å; D782-A786 PolarHBondContact O-N 2.75Å
783	Y	88.3	Confident	84.8	Confident	51 Å²	51	77.3 Å²	77.3	20%	0.2	39%	0.385	C	S	.	.	H	α-helix	trans	-67.3	-48.6	173.7	166.5	-100.2	0	0	0	111.8	A364 N368 L779 K780 A781 K785 A786 D787	A364-Y783 WeakPolarHBondContact O-CD2 3.37Å; N368-Y783 HydrophobicContact CB-CD2 3.75Å; N368-Y783 HydrophobicContact CB-CE2 3.64Å; L779-Y783 WeakPolarHBondContact O-CB 3.48Å; L779-Y783 PolarHBondContact O-N 3.04Å; L779-Y783 VanDerWaalsContact O-N 3.1Å; K780-Y783 PolarHBondContact O-N 3.3Å; A781-Y783 VanDerWaalsContact C-N 3.35Å; A781-Y783 PolarHBondContact O-N 3.14Å; Y783-K785 VanDerWaalsContact C-N 3.28Å; Y783-K785 PolarHBondContact O-N 3.31Å; Y783-A786 WeakPolarHBondContact O-CB 3.49Å; Y783-A786 PolarHBondContact O-N 3.33Å; Y783-A786 VanDerWaalsContact O-N 3.12Å; Y783-D787 PolarHBondContact O-N 3.05Å
784	D	84	Confident	84.5	Confident	69 Å²	69	79.3 Å²	79.3	37%	0.369	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-38.3	-177.4	-71.3	-26.2	0	0	0	111.2	K780 A781 D787 Q788	K780-D784 PolarHBondContact O-N 3.36Å; A781-D784 PolarHBondContact O-N 2.94Å; D784-D787 PolarHBondContact O-N 2.94Å; D784-Q788 WeakPolarHBondContact O-CG 3.42Å; D784-Q788 PolarHBondContact O-N 3.21Å; D784-Q788 VanDerWaalsContact O-N 3.12Å
785	K	86.9	Confident	84	Confident	131 Å²	131	82.4 Å²	82.4	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-62.4	-45.9	173.2	-173	180	177.7	-175.6	0	112.1	A781 Y783 D787 Q788 E789	A781-K785 WeakPolarHBondContact O-CB 3.49Å; A781-K785 PolarHBondContact O-N 3.26Å; Y783-K785 VanDerWaalsContact C-N 3.28Å; Y783-K785 PolarHBondContact O-N 3.31Å; K785-D787 PolarHBondContact O-N 3.43Å; K785-Q788 PolarHBondContact O-N 2.98Å; K785-E789 VanDerWaalsContact CE-OE1 3.3Å; K785-E789 WeakPolarHBondContact CE-OE1 3.25Å; K785-E789 WeakPolarHBondContact O-CG 3.27Å; K785-E789 PolarHBondContact O-N 3.11Å; K785-E789 VanDerWaalsContact O-N 3.15Å
786	A	84.1	Confident	83.6	Confident	2 Å²	2	81.1 Å²	81.1	2%	0.017	40%	0.401	C	S	.	.	H	α-helix	trans	-64.9	-37.4	179.8	0	0	0	0	0	112.9	A364 R367 D782 Y783 Y790	A364-A786 HydrophobicContact CB-CB 4.16Å; R367-A786 VanDerWaalsContact NH1-CB 3.32Å; D782-A786 WeakPolarHBondContact O-CB 3.42Å; D782-A786 PolarHBondContact O-N 2.75Å; Y783-A786 WeakPolarHBondContact O-CB 3.49Å; Y783-A786 PolarHBondContact O-N 3.33Å; Y783-A786 VanDerWaalsContact O-N 3.12Å; A786-Y790 PolarHBondContact O-N 2.98Å
787	D	83.4	Confident	83	Confident	32 Å²	32	79.9 Å²	79.9	17%	0.171	40%	0.395	C	S	.	.	H	α-helix	trans	-71.4	-35.3	178.9	-173.9	60.9	0	0	0	112.2	Y783 D784 K785 K791	Y783-D787 PolarHBondContact O-N 3.05Å; D784-D787 PolarHBondContact O-N 2.94Å; K785-D787 PolarHBondContact O-N 3.43Å; D787-K791 WeakPolarHBondContact O-CG 3.42Å; D787-K791 PolarHBondContact O-N 3.19Å; D787-K791 VanDerWaalsContact O-N 3.12Å; D787-K791 VanDerWaalsContact OD2-CE 3.24Å; D787-K791 WeakPolarHBondContact OD2-CE 3.47Å; D787-K791 IonicContact OD2-NZ 2.6Å; D787-K791 PolarHBondContact OD2-NZ 2.64Å
788	Q	83.4	Confident	82.4	Confident	135 Å²	135	80.3 Å²	80.3	63%	0.631	40%	0.395	S	S	*	.	H	α-helix	trans	-65.8	-46.4	173.6	-76.5	179.7	-1.1	0	0	112.3	D784 K785 Y790 K791 Q792	D784-Q788 WeakPolarHBondContact O-CG 3.42Å; D784-Q788 PolarHBondContact O-N 3.21Å; D784-Q788 VanDerWaalsContact O-N 3.12Å; K785-Q788 PolarHBondContact O-N 2.98Å; Q788-Y790 VanDerWaalsContact C-N 3.31Å; Q788-Y790 PolarHBondContact O-N 3.35Å; Q788-K791 PolarHBondContact O-N 3.3Å; Q788-K791 VanDerWaalsContact O-N 3.16Å; Q788-Q792 PolarHBondContact O-N 2.72Å; Q788-Q792 VanDerWaalsContact O-N 3.07Å
789	E	83.7	Confident	81.9	Confident	84 Å²	84	78.7 Å²	78.7	39%	0.393	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-40.6	177.9	-72.9	172.7	-175.6	0	0	111.8	K785 H793	K785-E789 VanDerWaalsContact CE-OE1 3.3Å; K785-E789 WeakPolarHBondContact CE-OE1 3.25Å; K785-E789 WeakPolarHBondContact O-CG 3.27Å; K785-E789 PolarHBondContact O-N 3.11Å; K785-E789 VanDerWaalsContact O-N 3.15Å; E789-H793 PolarHBondContact O-CD2 2.99Å; E789-H793 PolarHBondContact O-N 3.39Å
790	Y	83.6	Confident	81.3	Confident	42 Å²	42	77.9 Å²	77.9	17%	0.165	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-45.2	173.6	162.9	-108.5	0	0	0	112.6	K361 A786 Q788 Q792 H793 K794	K361-Y790 HydrophobicContact CB-CD2 3.82Å; K361-Y790 HydrophobicContact CB-CE2 3.7Å; K361-Y790 HydrophobicContact CD-CE2 4.08Å; K361-Y790 HydrophobicContact CG-CD2 4.45Å; K361-Y790 HydrophobicContact CG-CE2 4Å; A786-Y790 PolarHBondContact O-N 2.98Å; Q788-Y790 VanDerWaalsContact C-N 3.31Å; Q788-Y790 PolarHBondContact O-N 3.35Å; Y790-Q792 PolarHBondContact O-N 3.39Å; Y790-H793 PolarHBondContact O-N 2.94Å; Y790-K794 PolarHBondContact O-N 3.34Å; Y790-K794 VanDerWaalsContact O-N 3.11Å
791	K	79.9	Confident	80.4	Confident	113 Å²	113	75.2 Å²	75.2	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-42.2	-179	-78.2	168.5	175.9	162.7	0	112.2	D787 Q788 K794 E795	D787-K791 WeakPolarHBondContact O-CG 3.42Å; D787-K791 PolarHBondContact O-N 3.19Å; D787-K791 VanDerWaalsContact O-N 3.12Å; D787-K791 VanDerWaalsContact OD2-CE 3.24Å; D787-K791 WeakPolarHBondContact OD2-CE 3.47Å; D787-K791 IonicContact OD2-NZ 2.6Å; D787-K791 PolarHBondContact OD2-NZ 2.64Å; Q788-K791 PolarHBondContact O-N 3.3Å; Q788-K791 VanDerWaalsContact O-N 3.16Å; K791-K794 WeakPolarHBondContact O-CB 3.3Å; K791-K794 PolarHBondContact O-N 3.03Å; K791-E795 PolarHBondContact O-N 2.95Å; K791-E795 VanDerWaalsContact O-N 3.16Å
792	Q	82	Confident	79.7	Confident	131 Å²	131	78.7 Å²	78.7	61%	0.612	38%	0.384	S	S	*	.	H	α-helix	trans	-67.8	-39.1	-179.2	-166.3	149.8	18.4	0	0	112.6	Q788 Y790 K794 E795 N796	Q788-Q792 PolarHBondContact O-N 2.72Å; Q788-Q792 VanDerWaalsContact O-N 3.07Å; Y790-Q792 PolarHBondContact O-N 3.39Å; Q792-K794 VanDerWaalsContact C-N 3.3Å; Q792-K794 PolarHBondContact O-N 2.92Å; Q792-E795 PolarHBondContact O-N 3.42Å; Q792-N796 PolarHBondContact O-N 2.83Å
793	H	79.5	Confident	78.9	Confident	65 Å²	65	80.8 Å²	80.8	30%	0.301	39%	0.391	S	S	.	.	H	α-helix	trans	-66.8	-30.8	173.8	-91.9	-75.1	0	0	0	113.4	L360 E789 Y790 I797	L360-H793 HydrophobicContact CD1-CB 4.39Å; E789-H793 PolarHBondContact O-CD2 2.99Å; E789-H793 PolarHBondContact O-N 3.39Å; Y790-H793 PolarHBondContact O-N 2.94Å; H793-I797 WeakPolarHBondContact O-CG1 3.39Å; H793-I797 PolarHBondContact O-N 2.91Å
794	K	78.1	Confident	77.8	Confident	122 Å²	122	79.1 Å²	79.1	53%	0.53	39%	0.388	S	S	.	.	H	α-helix	trans	-69.4	-40	176	-172	-174.8	174.4	-166.1	0	112.2	Y790 K791 Q792 I797 S798	Y790-K794 PolarHBondContact O-N 3.34Å; Y790-K794 VanDerWaalsContact O-N 3.11Å; K791-K794 WeakPolarHBondContact O-CB 3.3Å; K791-K794 PolarHBondContact O-N 3.03Å; Q792-K794 VanDerWaalsContact C-N 3.3Å; Q792-K794 PolarHBondContact O-N 2.92Å; K794-I797 PolarHBondContact O-N 3.25Å; K794-S798 PolarHBondContact O-N 3.1Å
795	E	77.8	Confident	77	Confident	139 Å²	139	79.6 Å²	79.6	65%	0.65	39%	0.391	S	S	*	.	H	α-helix	trans	-64.8	-43.1	175.9	-81.8	177.9	164.2	0	0	111.9	K791 Q792 I797 S798 T799	K791-E795 PolarHBondContact O-N 2.95Å; K791-E795 VanDerWaalsContact O-N 3.16Å; Q792-E795 PolarHBondContact O-N 3.42Å; E795-I797 VanDerWaalsContact C-N 3.31Å; E795-I797 PolarHBondContact O-N 3.25Å; E795-S798 VanDerWaalsContact O-CB 3.29Å; E795-S798 WeakPolarHBondContact O-CB 3.14Å; E795-S798 PolarHBondContact O-N 3.15Å; E795-T799 PolarHBondContact O-N 3.5Å; E795-T799 PolarHBondContact O-OG1 3.34Å
796	N	77.3	Confident	76.3	Confident	80 Å²	80	77 Å²	77	43%	0.428	39%	0.389	S	S	.	.	H	α-helix	trans	-62.5	-34.1	177.9	-70.8	-9.6	0	0	0	113.6	Q792 S798 T799 I800	Q792-N796 PolarHBondContact O-N 2.83Å; N796-S798 VanDerWaalsContact C-N 3.32Å; N796-T799 PolarHBondContact O-OG1 2.97Å; N796-T799 VanDerWaalsContact O-OG1 3.11Å; N796-I800 WeakPolarHBondContact O-CG1 3.48Å; N796-I800 PolarHBondContact O-N 3.08Å
797	I	74.6	Confident	75.7	Confident	23 Å²	23	78.3 Å²	78.3	12%	0.118	40%	0.397	C	S	.	.	H	α-helix	trans	-68.6	-35.1	174.4	-69.6	169.7	0	0	0	110.5	L353 C357 H793 K794 E795 T801	L353-I797 HydrophobicContact CB-CD1 4.16Å; L353-I797 HydrophobicContact CB-CG1 4Å; C357-I797 HydrophobicContact CB-CD1 3.78Å; H793-I797 WeakPolarHBondContact O-CG1 3.39Å; H793-I797 PolarHBondContact O-N 2.91Å; K794-I797 PolarHBondContact O-N 3.25Å; E795-I797 VanDerWaalsContact C-N 3.31Å; E795-I797 PolarHBondContact O-N 3.25Å; I797-T801 WeakPolarHBondContact O-CB 3.47Å; I797-T801 PolarHBondContact O-N 3.32Å; I797-T801 VanDerWaalsContact O-N 3.09Å; I797-T801 PolarHBondContact O-OG1 3.45Å
798	S	72.8	Confident	74.8	Confident	62 Å²	62	82.4 Å²	82.4	43%	0.434	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-46.1	179.7	-161.3	0	0	0	0	111.8	K794 E795 N796 T801 E802	K794-S798 PolarHBondContact O-N 3.1Å; E795-S798 VanDerWaalsContact O-CB 3.29Å; E795-S798 WeakPolarHBondContact O-CB 3.14Å; E795-S798 PolarHBondContact O-N 3.15Å; N796-S798 VanDerWaalsContact C-N 3.32Å; S798-T801 PolarHBondContact O-N 3.25Å; S798-E802 PolarHBondContact O-N 3.4Å; S798-E802 VanDerWaalsContact O-N 3.14Å
799	T	76.3	Confident	74	Confident	73 Å²	73	80.7 Å²	80.7	45%	0.448	41%	0.408	S	S	.	.	H	α-helix	trans	-66.1	-41.9	179.9	35.2	0	0	0	0	112.9	E795 N796 T801 E802 E803	E795-T799 PolarHBondContact O-N 3.5Å; E795-T799 PolarHBondContact O-OG1 3.34Å; N796-T799 PolarHBondContact O-OG1 2.97Å; N796-T799 VanDerWaalsContact O-OG1 3.11Å; T799-T801 VanDerWaalsContact C-N 3.28Å; T799-T801 PolarHBondContact O-N 3.5Å; T799-E802 PolarHBondContact O-N 3.05Å; T799-E803 PolarHBondContact O-N 3.48Å
800	I	73	Confident	73.3	Confident	33 Å²	33	82.2 Å²	82.2	17%	0.169	42%	0.415	C	S	.	.	H	α-helix	trans	-67.2	-31.7	177	-62.2	169.9	0	0	0	111.3	I346 V350 L353 N796 E803 A804	I346-I800 HydrophobicContact CG2-CG2 4.26Å; V350-I800 HydrophobicContact CG2-CB 4.37Å; V350-I800 HydrophobicContact CG2-CG2 3.57Å; L353-I800 HydrophobicContact CD1-CD1 3.9Å; N796-I800 WeakPolarHBondContact O-CG1 3.48Å; N796-I800 PolarHBondContact O-N 3.08Å; I800-E803 PolarHBondContact O-N 3.09Å; I800-A804 PolarHBondContact O-N 3.05Å; I800-A804 VanDerWaalsContact O-N 3.15Å
801	T	67.4	Low	72.6	Confident	53 Å²	53	81.1 Å²	81.1	33%	0.325	41%	0.412	S	S	.	.	H	α-helix	trans	-68.6	-37.8	176.1	-54.4	0	0	0	0	111.5	I797 S798 T799 A804 D805	I797-T801 WeakPolarHBondContact O-CB 3.47Å; I797-T801 PolarHBondContact O-N 3.32Å; I797-T801 VanDerWaalsContact O-N 3.09Å; I797-T801 PolarHBondContact O-OG1 3.45Å; S798-T801 PolarHBondContact O-N 3.25Å; T799-T801 VanDerWaalsContact C-N 3.28Å; T799-T801 PolarHBondContact O-N 3.5Å; T801-A804 WeakPolarHBondContact O-CB 3.46Å; T801-A804 PolarHBondContact O-N 3.32Å; T801-D805 PolarHBondContact O-N 2.97Å; T801-D805 VanDerWaalsContact O-N 3.1Å
802	E	72.1	Confident	71.8	Confident	129 Å²	129	77.9 Å²	77.9	60%	0.603	40%	0.404	S	S	*	.	H	α-helix	trans	-64.8	-37.5	176	-73.1	173.2	-171	0	0	112.4	S798 T799 D805 S806	S798-E802 PolarHBondContact O-N 3.4Å; S798-E802 VanDerWaalsContact O-N 3.14Å; T799-E802 PolarHBondContact O-N 3.05Å; E802-D805 PolarHBondContact O-N 3.47Å; E802-S806 PolarHBondContact O-N 3.22Å
803	E	69.4	Low	71.3	Confident	128 Å²	128	78.3 Å²	78.3	60%	0.598	40%	0.403	S	S	*	.	H	α-helix	trans	-66.8	-38.4	173.7	-69.7	179.6	176.7	0	0	112.3	T799 I800 D805 S806 V807	T799-E803 PolarHBondContact O-N 3.48Å; I800-E803 PolarHBondContact O-N 3.09Å; E803-D805 PolarHBondContact O-N 3.45Å; E803-S806 PolarHBondContact O-N 3.07Å; E803-V807 PolarHBondContact O-N 3.42Å
804	A	65.6	Low	70.7	Confident	15 Å²	15	76.5 Å²	76.5	12%	0.124	40%	0.397	C	S	.	.	H	α-helix	trans	-64.1	-38.8	176.5	0	0	0	0	0	112.5	I346 I800 T801 V807 K808	I346-A804 HydrophobicContact CG2-CB 3.7Å; I800-A804 PolarHBondContact O-N 3.05Å; I800-A804 VanDerWaalsContact O-N 3.15Å; T801-A804 WeakPolarHBondContact O-CB 3.46Å; T801-A804 PolarHBondContact O-N 3.32Å; A804-V807 PolarHBondContact O-N 3.21Å; A804-K808 VanDerWaalsContact O-CB 3.31Å; A804-K808 WeakPolarHBondContact O-CB 3.28Å; A804-K808 PolarHBondContact O-N 3.41Å
805	D	65.3	Low	70	Confident	80 Å²	80	73 Å²	73	43%	0.428	38%	0.384	S	S	.	.	H	α-helix	trans	-68.1	-34.4	179.5	-78.2	-30.8	0	0	0	112.2	T801 E802 E803 K808 D809	T801-D805 PolarHBondContact O-N 2.97Å; T801-D805 VanDerWaalsContact O-N 3.1Å; E802-D805 PolarHBondContact O-N 3.47Å; E803-D805 PolarHBondContact O-N 3.45Å; D805-K808 WeakPolarHBondContact O-CB 3.42Å; D805-K808 PolarHBondContact O-N 3.28Å; D805-D809 PolarHBondContact O-N 2.98Å; D805-D809 VanDerWaalsContact O-N 3.17Å
806	S	73.5	Confident	69.3	Low	76 Å²	76	71.6 Å²	71.6	53%	0.531	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-42	174.8	-174.5	0	0	0	0	112.8	E802 E803	E802-S806 PolarHBondContact O-N 3.22Å; E803-S806 PolarHBondContact O-N 3.07Å
807	V	70.4	Confident	68.8	Low	30 Å²	30	73.7 Å²	73.7	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-73.4	-31.5	178.8	-179.7	0	0	0	0	111.2	L343 I346 E803 A804 D809 E810 L811	L343-V807 HydrophobicContact CB-CG1 4.4Å; L343-V807 HydrophobicContact CD1-CB 3.84Å; L343-V807 HydrophobicContact CD1-CG1 3.7Å; I346-V807 HydrophobicContact CD1-CG2 4.05Å; E803-V807 PolarHBondContact O-N 3.42Å; A804-V807 PolarHBondContact O-N 3.21Å; V807-D809 VanDerWaalsContact C-N 3.32Å; V807-D809 PolarHBondContact O-N 3.47Å; V807-E810 PolarHBondContact O-N 3.09Å; V807-L811 PolarHBondContact O-N 3.13Å
808	K	64.3	Low	68.4	Low	117 Å²	117	72.7 Å²	72.7	51%	0.509	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-35.8	175.6	-169.9	176.8	178.2	-177.5	0	112.6	L343 A804 D805 L811 S812	L343-K808 HydrophobicContact CD1-CB 3.93Å; A804-K808 VanDerWaalsContact O-CB 3.31Å; A804-K808 WeakPolarHBondContact O-CB 3.28Å; A804-K808 PolarHBondContact O-N 3.41Å; D805-K808 WeakPolarHBondContact O-CB 3.42Å; D805-K808 PolarHBondContact O-N 3.28Å; K808-L811 PolarHBondContact O-N 3.36Å; K808-S812 WeakPolarHBondContact O-CB 3.33Å; K808-S812 PolarHBondContact O-N 3.43Å
809	D	67.3	Low	67.8	Low	100 Å²	100	74.8 Å²	74.8	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-66.9	-37.2	176.6	-84.2	-9.6	0	0	0	112.4	D805 V807 S812 K813	D805-D809 PolarHBondContact O-N 2.98Å; D805-D809 VanDerWaalsContact O-N 3.17Å; V807-D809 VanDerWaalsContact C-N 3.32Å; V807-D809 PolarHBondContact O-N 3.47Å; D809-S812 PolarHBondContact O-N 3.24Å; D809-S812 PolarHBondContact O-OG 2.85Å; D809-K813 WeakPolarHBondContact O-CG 3.41Å; D809-K813 PolarHBondContact O-N 3.02Å
810	E	69.1	Low	67.4	Low	115 Å²	115	77.5 Å²	77.5	54%	0.537	39%	0.39	S	S	.	.	H	α-helix	trans	-71.5	-38.1	174.9	-68.5	-169.6	164.6	0	0	112.8	V807 S812 K813 T814	V807-E810 PolarHBondContact O-N 3.09Å; E810-S812 VanDerWaalsContact C-N 3.34Å; E810-K813 PolarHBondContact O-N 2.91Å; E810-T814 PolarHBondContact O-N 2.98Å; E810-T814 PolarHBondContact O-OG1 3.17Å
811	L	68.8	Low	66.9	Low	20 Å²	20	77.2 Å²	77.2	11%	0.105	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-41.8	171.7	-171.3	70.5	0	0	0	111	Y336 I339 Q340 L343 V807 K808 K813 T814 D815	Y336-L811 HydrophobicContact CD2-CD1 3.99Å; Y336-L811 HydrophobicContact CE2-CD1 3.77Å; Y336-L811 HydrophobicContact CE2-CG 4.1Å; I339-L811 HydrophobicContact CB-CD1 3.84Å; I339-L811 HydrophobicContact CG2-CB 3.91Å; I339-L811 HydrophobicContact CG2-CD1 3.72Å; I339-L811 HydrophobicContact CG2-CG 4.44Å; Q340-L811 HydrophobicContact CB-CD1 4.04Å; L343-L811 HydrophobicContact CD2-CD2 3.74Å; V807-L811 PolarHBondContact O-N 3.13Å; K808-L811 PolarHBondContact O-N 3.36Å; L811-K813 PolarHBondContact O-N 3.26Å; L811-T814 PolarHBondContact O-N 3.42Å; L811-D815 VanDerWaalsContact O-CB 3.32Å; L811-D815 WeakPolarHBondContact O-CB 3.4Å; L811-D815 PolarHBondContact O-N 3.21Å
812	S	63.8	Low	66.6	Low	45 Å²	45	78.2 Å²	78.2	32%	0.315	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-37.3	-179	90	0	0	0	0	113	K808 D809 E810 Q816	K808-S812 WeakPolarHBondContact O-CB 3.33Å; K808-S812 PolarHBondContact O-N 3.43Å; D809-S812 PolarHBondContact O-N 3.24Å; D809-S812 PolarHBondContact O-OG 2.85Å; E810-S812 VanDerWaalsContact C-N 3.34Å; S812-Q816 WeakPolarHBondContact O-CB 3.46Å; S812-Q816 VanDerWaalsContact O-CG 3.23Å; S812-Q816 WeakPolarHBondContact O-CG 3.29Å; S812-Q816 PolarHBondContact O-N 2.86Å
813	K	71.2	Confident	66	Low	139 Å²	139	77.6 Å²	77.6	60%	0.604	39%	0.387	S	S	*	.	H	α-helix	trans	-67.2	-41.3	177.7	-72.2	171.9	-174.9	167.6	0	111.4	D809 E810 L811 Q816 E817	D809-K813 WeakPolarHBondContact O-CG 3.41Å; D809-K813 PolarHBondContact O-N 3.02Å; E810-K813 PolarHBondContact O-N 2.91Å; L811-K813 PolarHBondContact O-N 3.26Å; K813-Q816 PolarHBondContact O-N 3.3Å; K813-E817 PolarHBondContact O-N 3.33Å
814	T	66.4	Low	65.6	Low	27 Å²	27	75.1 Å²	75.1	17%	0.166	38%	0.375	C	S	.	.	H	α-helix	trans	-74	-36.1	179.2	-45.5	0	0	0	0	111.6	K335 I339 E810 L811 E817 V818	K335-T814 HydrophobicContact CB-CG2 4.24Å; I339-T814 HydrophobicContact CD1-CG2 4.23Å; I339-T814 WeakPolarHBondContact CD1-OG1 3.48Å; E810-T814 PolarHBondContact O-N 2.98Å; E810-T814 PolarHBondContact O-OG1 3.17Å; L811-T814 PolarHBondContact O-N 3.42Å; T814-E817 PolarHBondContact O-N 3.19Å; T814-V818 PolarHBondContact O-N 2.98Å; T814-V818 VanDerWaalsContact O-N 3.17Å
815	D	62.9	Low	65.4	Low	49 Å²	49	77 Å²	77	26%	0.262	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-43.1	171.1	-165.1	34.9	0	0	0	111.6	Y336 L811 E817 V818 M819	Y336-D815 HydrophobicContact CD2-CB 3.99Å; Y336-D815 HydrophobicContact CE2-CB 3.54Å; Y336-D815 VanDerWaalsContact CE2-OD1 3.29Å; Y336-D815 WeakPolarHBondContact CE2-OD1 3.47Å; L811-D815 VanDerWaalsContact O-CB 3.32Å; L811-D815 WeakPolarHBondContact O-CB 3.4Å; L811-D815 PolarHBondContact O-N 3.21Å; D815-E817 VanDerWaalsContact C-N 3.26Å; D815-E817 PolarHBondContact O-N 3.23Å; D815-V818 PolarHBondContact O-N 3.32Å; D815-M819 WeakPolarHBondContact O-CB 3.41Å; D815-M819 WeakPolarHBondContact O-CG 3.36Å; D815-M819 PolarHBondContact O-N 3.25Å
816	Q	64.4	Low	65.1	Low	109 Å²	109	79.3 Å²	79.3	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-60.5	-33.8	178.3	-79	175.9	24.3	0	0	112.7	S812 K813 K820	S812-Q816 WeakPolarHBondContact O-CB 3.46Å; S812-Q816 VanDerWaalsContact O-CG 3.23Å; S812-Q816 WeakPolarHBondContact O-CG 3.29Å; S812-Q816 PolarHBondContact O-N 2.86Å; K813-Q816 PolarHBondContact O-N 3.3Å; Q816-K820 WeakPolarHBondContact O-CB 3.46Å; Q816-K820 WeakPolarHBondContact O-CD 3.49Å; Q816-K820 WeakPolarHBondContact O-CG 3.27Å; Q816-K820 PolarHBondContact O-N 3.09Å
817	E	66.1	Low	64.5	Low	125 Å²	125	78.5 Å²	78.5	58%	0.584	38%	0.375	S	S	*	.	H	α-helix	trans	-74.9	-42.6	175.6	-74.9	-171.7	156.4	0	0	112.8	K813 T814 D815 M819 K820 C821	K813-E817 PolarHBondContact O-N 3.33Å; T814-E817 PolarHBondContact O-N 3.19Å; D815-E817 VanDerWaalsContact C-N 3.26Å; D815-E817 PolarHBondContact O-N 3.23Å; E817-M819 VanDerWaalsContact C-N 3.35Å; E817-K820 PolarHBondContact O-N 3.1Å; E817-C821 PolarHBondContact O-N 3.4Å; E817-C821 VanDerWaalsContact O-N 3.17Å
818	V	66.4	Low	64	Low	2 Å²	2	79.2 Å²	79.2	1%	0.012	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-44	173.9	174.9	0	0	0	0	111	S332 E333 T814 D815 C821 K822	S332-V818 VanDerWaalsContact C-CG2 3.41Å; S332-V818 WeakPolarHBondContact O-CG2 3.46Å; E333-V818 HydrophobicContact CG-CG1 3.94Å; T814-V818 PolarHBondContact O-N 2.98Å; T814-V818 VanDerWaalsContact O-N 3.17Å; D815-V818 PolarHBondContact O-N 3.32Å; V818-C821 PolarHBondContact O-N 3.23Å; V818-K822 HydrophobicContact CG1-CD 3.89Å; V818-K822 HydrophobicContact CG1-CG 4.25Å; V818-K822 VanDerWaalsContact O-CB 3.31Å; V818-K822 WeakPolarHBondContact O-CB 3.47Å; V818-K822 WeakPolarHBondContact O-CG 3.45Å; V818-K822 PolarHBondContact O-N 3.09Å
819	M	60.9	Low	63.8	Low	106 Å²	106	76.8 Å²	76.8	52%	0.522	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176.9	-74	-66.1	-127.2	0	0	111.2	D815 E817 C821 H823	D815-M819 WeakPolarHBondContact O-CB 3.41Å; D815-M819 WeakPolarHBondContact O-CG 3.36Å; D815-M819 PolarHBondContact O-N 3.25Å; E817-M819 VanDerWaalsContact C-N 3.35Å; M819-C821 PolarHBondContact O-N 3.4Å; M819-H823 WeakPolarHBondContact O-CA 3.29Å; M819-H823 WeakPolarHBondContact O-CB 3.32Å; M819-H823 PolarHBondContact O-N 2.68Å
820	K	66.4	Low	63.4	Low	129 Å²	129	75.6 Å²	75.6	56%	0.561	36%	0.36	S	S	*	.	H	α-helix	trans	-60	-45.7	174.4	-79.3	166.8	-172.8	173.5	0	112.3	Q816 E817 H824	Q816-K820 WeakPolarHBondContact O-CB 3.46Å; Q816-K820 WeakPolarHBondContact O-CD 3.49Å; Q816-K820 WeakPolarHBondContact O-CG 3.27Å; Q816-K820 PolarHBondContact O-N 3.09Å; E817-K820 PolarHBondContact O-N 3.1Å; K820-H824 PolarHBondContact O-CD2 2.84Å; K820-H824 PolarHBondContact O-N 3Å
821	C	62.8	Low	63	Low	27 Å²	27	74 Å²	74	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-69.4	-46.1	179	-66.1	0	0	0	0	112.2	V329 E817 V818 M819 H823 H824 K825	V329-C821 HydrophobicContact CG2-CB 4.1Å; V329-C821 WeakPolarHBondContact CG2-O 3.49Å; E817-C821 PolarHBondContact O-N 3.4Å; E817-C821 VanDerWaalsContact O-N 3.17Å; V818-C821 PolarHBondContact O-N 3.23Å; M819-C821 PolarHBondContact O-N 3.4Å; C821-H823 VanDerWaalsContact C-N 3.35Å; C821-H824 PolarHBondContact O-N 3.41Å; C821-K825 PolarHBondContact O-N 3.45Å
822	K	61.6	Low	62.7	Low	74 Å²	74	77.4 Å²	77.4	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.4	-81	-175.2	179.2	177.9	0	111.7	V329 E333 V818 H824 K825 K826	V329-K822 HydrophobicContact CB-CG 4.49Å; V329-K822 HydrophobicContact CG1-CD 4.48Å; V329-K822 HydrophobicContact CG1-CG 3.49Å; V329-K822 VanDerWaalsContact CG1-CG 3.49Å; V329-K822 HydrophobicContact CG2-CG 4.21Å; E333-K822 WeakPolarHBondContact OE1-CE 3.29Å; E333-K822 IonicContact OE1-NZ 3.47Å; E333-K822 PolarHBondContact OE1-NZ 3.5Å; V818-K822 HydrophobicContact CG1-CD 3.89Å; V818-K822 HydrophobicContact CG1-CG 4.25Å; V818-K822 VanDerWaalsContact O-CB 3.31Å; V818-K822 WeakPolarHBondContact O-CB 3.47Å; V818-K822 WeakPolarHBondContact O-CG 3.45Å; V818-K822 PolarHBondContact O-N 3.09Å; K822-H824 VanDerWaalsContact C-N 3.34Å; K822-K825 PolarHBondContact O-N 2.82Å; K822-K826 WeakPolarHBondContact O-CB 3.46Å; K822-K826 PolarHBondContact O-N 2.72Å
823	H	59.8	Low	62.6	Low	117 Å²	117	76.9 Å²	76.9	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-43	177.7	-169.1	75.7	0	0	0	109.5	M819 C821 H827	M819-H823 WeakPolarHBondContact O-CA 3.29Å; M819-H823 WeakPolarHBondContact O-CB 3.32Å; M819-H823 PolarHBondContact O-N 2.68Å; C821-H823 VanDerWaalsContact C-N 3.35Å; H823-H827 VanDerWaalsContact O-CA 3.3Å; H823-H827 WeakPolarHBondContact O-CA 3.49Å; H823-H827 WeakPolarHBondContact O-CB 3.47Å; H823-H827 PolarHBondContact O-N 3.15Å
824	H	60.2	Low	62	Low	75 Å²	75	72.2 Å²	72.2	35%	0.347	35%	0.347	S	S	.	.	H	α-helix	trans	-67.5	-40	177.4	-74.1	-30.6	0	0	0	114.4	W325 K820 C821 K822 Y828	W325-H824 HydrophobicContact CD2-CB 3.45Å; W325-H824 VanDerWaalsContact CD2-CB 3.45Å; W325-H824 HydrophobicContact CE3-CB 3.42Å; W325-H824 VanDerWaalsContact CE3-CB 3.42Å; W325-H824 HydrophobicContact CG-CB 3.99Å; W325-H824 HydrophobicContact CH2-CB 4.12Å; W325-H824 AromaticContact CH2-CD2 3.43Å; W325-H824 VanDerWaalsContact CH2-CD2 3.43Å; W325-H824 WeakPolarHBondContact CH2-CD2 3.39Å; W325-H824 HydrophobicContact CZ2-CB 4.15Å; W325-H824 AromaticContact CZ2-CD2 3.93Å; W325-H824 HydrophobicContact CZ3-CB 3.77Å; W325-H824 AromaticContact CZ3-CD2 3.59Å; K820-H824 PolarHBondContact O-CD2 2.84Å; K820-H824 PolarHBondContact O-N 3Å; C821-H824 PolarHBondContact O-N 3.41Å; K822-H824 VanDerWaalsContact C-N 3.34Å; H824-Y828 VanDerWaalsContact O-CD2 3.23Å; H824-Y828 WeakPolarHBondContact O-CD2 3.18Å; H824-Y828 PolarHBondContact O-N 3.39Å
825	K	61.5	Low	61.9	Low	55 Å²	55	71.6 Å²	71.6	24%	0.239	34%	0.342	C	S	.	.	H	α-helix	trans	-63.5	-54.6	173.7	-175.5	-167.9	179.3	171.3	0	111.9	W325 K326 V329 C821 K822 H827 Y828 D829	W325-K825 VanDerWaalsContact CB-CA 3.5Å; W325-K825 HydrophobicContact CB-CB 3.77Å; W325-K825 HydrophobicContact CB-CG 4.37Å; K326-K825 HydrophobicContact CB-CD 4.34Å; V329-K825 HydrophobicContact CB-CD 4.28Å; V329-K825 HydrophobicContact CG2-CB 3.81Å; V329-K825 HydrophobicContact CG2-CD 3.81Å; V329-K825 HydrophobicContact CG2-CG 4.46Å; C821-K825 PolarHBondContact O-N 3.45Å; K822-K825 PolarHBondContact O-N 2.82Å; K825-H827 VanDerWaalsContact C-N 3.27Å; K825-H827 PolarHBondContact O-N 3.44Å; K825-Y828 PolarHBondContact O-N 3.3Å; K825-D829 PolarHBondContact O-N 3.19Å; K825-D829 VanDerWaalsContact O-N 3.08Å
826	K	58.5	Low	61.8	Low	129 Å²	129	73.7 Å²	73.7	56%	0.561	35%	0.353	S	S	*	.	H	α-helix	trans	-62.7	-33.3	178.1	-177.5	171.1	178.4	178.7	0	111.6	K822 Y828 D829 D830	K822-K826 WeakPolarHBondContact O-CB 3.46Å; K822-K826 PolarHBondContact O-N 2.72Å; K826-Y828 PolarHBondContact O-N 3.31Å; K826-D829 PolarHBondContact O-N 3Å; K826-D830 WeakPolarHBondContact CE-OD2 3.46Å; K826-D830 WeakPolarHBondContact CG-OD2 3.36Å; K826-D830 WeakPolarHBondContact O-CA 3.35Å; K826-D830 WeakPolarHBondContact O-CB 3.49Å; K826-D830 PolarHBondContact O-N 3.43Å
827	H	62.2	Low	61.7	Low	59 Å²	59	76.4 Å²	76.4	27%	0.273	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-38.6	177.8	175.5	88.5	0	0	0	112.4	H823 K825 K831	H823-H827 VanDerWaalsContact O-CA 3.3Å; H823-H827 WeakPolarHBondContact O-CA 3.49Å; H823-H827 WeakPolarHBondContact O-CB 3.47Å; H823-H827 PolarHBondContact O-N 3.15Å; K825-H827 VanDerWaalsContact C-N 3.27Å; K825-H827 PolarHBondContact O-N 3.44Å; H827-K831 WeakPolarHBondContact CE1-CE 3.3Å; H827-K831 PolarHBondContact CE1-NZ 3.36Å; H827-K831 VanDerWaalsContact NE2-CE 3.26Å; H827-K831 WeakPolarHBondContact NE2-CE 3.39Å; H827-K831 PolarHBondContact NE2-NZ 2.93Å; H827-K831 WeakPolarHBondContact O-CB 3.27Å; H827-K831 WeakPolarHBondContact O-CD 3.33Å; H827-K831 WeakPolarHBondContact O-CG 3.42Å; H827-K831 PolarHBondContact O-N 3.27Å
828	Y	60.6	Low	61.5	Low	44 Å²	44	74.2 Å²	74.2	17%	0.173	35%	0.351	C	S	.	.	H	α-helix	trans	-82	-35	177.2	-72.8	-69.2	0	0	0	112.1	K321 V322 W325 H824 K825 K826 K831 R832	K321-Y828 HydrophobicContact CB-CD1 3.71Å; K321-Y828 HydrophobicContact CB-CD2 4.35Å; K321-Y828 HydrophobicContact CB-CE1 4.04Å; K321-Y828 HydrophobicContact CB-CG 3.89Å; K321-Y828 HydrophobicContact CD-CD1 4.05Å; K321-Y828 HydrophobicContact CD-CE1 3.48Å; K321-Y828 VanDerWaalsContact CD-CE1 3.48Å; K321-Y828 HydrophobicContact CD-CE2 4.44Å; K321-Y828 HydrophobicContact CG-CE1 4.39Å; V322-Y828 VanDerWaalsContact CG2-C 3.42Å; V322-Y828 WeakPolarHBondContact CG2-O 3.5Å; W325-Y828 AromaticContact CD1-CD2 3.81Å; W325-Y828 AromaticContact NE1-CE2 3.88Å; H824-Y828 VanDerWaalsContact O-CD2 3.23Å; H824-Y828 WeakPolarHBondContact O-CD2 3.18Å; H824-Y828 PolarHBondContact O-N 3.39Å; K825-Y828 PolarHBondContact O-N 3.3Å; K826-Y828 PolarHBondContact O-N 3.31Å; Y828-K831 PolarHBondContact O-N 2.92Å; Y828-R832 PolarHBondContact O-N 3.02Å
829	D	59.8	Low	61.5	Low	66 Å²	66	75.1 Å²	75.1	35%	0.353	36%	0.355	S	S	.	.	H	α-helix	trans	-70.8	-42.5	176.4	-118.9	-23.3	0	0	0	112.4	V322 K825 K826 R832 S833	V322-D829 HydrophobicContact CG1-CB 4.23Å; V322-D829 VanDerWaalsContact CG1-OD1 3.27Å; V322-D829 WeakPolarHBondContact CG1-OD1 3.44Å; V322-D829 HydrophobicContact CG2-CB 4.48Å; K825-D829 PolarHBondContact O-N 3.19Å; K825-D829 VanDerWaalsContact O-N 3.08Å; K826-D829 PolarHBondContact O-N 3Å; D829-R832 PolarHBondContact O-N 3.22Å; D829-S833 WeakPolarHBondContact O-CB 3.47Å; D829-S833 PolarHBondContact O-N 2.88Å; D829-S833 PolarHBondContact O-OG 2.88Å
830	D	58.4	Low	61.7	Low	75 Å²	75	76.9 Å²	76.9	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-70.8	-35.6	172.4	-70.4	-13.6	0	0	0	110.4	K826 R832 A834	K826-D830 WeakPolarHBondContact CE-OD2 3.46Å; K826-D830 WeakPolarHBondContact CG-OD2 3.36Å; K826-D830 WeakPolarHBondContact O-CA 3.35Å; K826-D830 WeakPolarHBondContact O-CB 3.49Å; K826-D830 PolarHBondContact O-N 3.43Å; D830-R832 VanDerWaalsContact C-N 3.34Å; D830-R832 PolarHBondContact O-N 3.08Å; D830-A834 WeakPolarHBondContact O-CA 3.31Å; D830-A834 WeakPolarHBondContact O-CB 3.46Å; D830-A834 PolarHBondContact O-N 3.32Å
831	K	60.9	Low	61.5	Low	82 Å²	82	73.7 Å²	73.7	36%	0.357	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-44.6	173.8	-91.1	175.3	165.5	-179.7	0	111.3	Y318 H827 Y828 H835	Y318-K831 HydrophobicContact CD1-CB 3.97Å; Y318-K831 HydrophobicContact CD1-CD 4.49Å; Y318-K831 HydrophobicContact CE1-CB 4.03Å; Y318-K831 HydrophobicContact CE1-CD 3.92Å; Y318-K831 HydrophobicContact CE1-CG 4.41Å; H827-K831 WeakPolarHBondContact CE1-CE 3.3Å; H827-K831 PolarHBondContact CE1-NZ 3.36Å; H827-K831 VanDerWaalsContact NE2-CE 3.26Å; H827-K831 WeakPolarHBondContact NE2-CE 3.39Å; H827-K831 PolarHBondContact NE2-NZ 2.93Å; H827-K831 WeakPolarHBondContact O-CB 3.27Å; H827-K831 WeakPolarHBondContact O-CD 3.33Å; H827-K831 WeakPolarHBondContact O-CG 3.42Å; H827-K831 PolarHBondContact O-N 3.27Å; Y828-K831 PolarHBondContact O-N 2.92Å; K831-H835 WeakPolarHBondContact O-CB 3.5Å; K831-H835 PolarHBondContact O-N 3.32Å
832	R	62.2	Low	61.7	Low	91 Å²	91	73.2 Å²	73.2	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-47.7	179.5	-172.1	-178.7	168.6	-125.3	11.7	112.6	D319 Y828 D829 D830 H835 L836	D319-R832 VanDerWaalsContact CG-CZ 3.48Å; D319-R832 WeakPolarHBondContact OD1-CD 3.45Å; D319-R832 IonicContact OD1-CZ 3Å; D319-R832 IonicContact OD1-NE 2.75Å; D319-R832 PolarHBondContact OD1-NE 3.4Å; D319-R832 IonicContact OD1-NH1 3.6Å; D319-R832 IonicContact OD1-NH2 3.46Å; D319-R832 PolarHBondContact OD1-NH2 3.03Å; D319-R832 IonicContact OD2-CZ 2.78Å; D319-R832 IonicContact OD2-NE 2.71Å; D319-R832 PolarHBondContact OD2-NE 3.45Å; D319-R832 IonicContact OD2-NH2 3.84Å; D319-R832 PolarHBondContact OD2-NH2 3.42Å; D319-R832 VanDerWaalsContact OD2-NH2 3.12Å; Y828-R832 PolarHBondContact O-N 3.02Å; D829-R832 PolarHBondContact O-N 3.22Å; D830-R832 VanDerWaalsContact C-N 3.34Å; D830-R832 PolarHBondContact O-N 3.08Å; R832-H835 PolarHBondContact O-N 3.39Å; R832-L836 PolarHBondContact O-N 2.95Å
833	S	60.8	Low	62	Low	35 Å²	35	73.5 Å²	73.5	25%	0.245	35%	0.352	C	S	.	.	H	α-helix	trans	-78.1	-32.2	-176.6	61.6	0	0	0	0	113.6	D829 R837	D829-S833 WeakPolarHBondContact O-CB 3.47Å; D829-S833 PolarHBondContact O-N 2.88Å; D829-S833 PolarHBondContact O-OG 2.88Å; S833-R837 WeakPolarHBondContact O-CB 3.46Å; S833-R837 WeakPolarHBondContact O-CG 3.35Å; S833-R837 PolarHBondContact O-N 3.14Å
834	A	58.8	Low	62.5	Low	40 Å²	40	70.9 Å²	70.9	33%	0.331	35%	0.35	S	S	.	.	H	α-helix	trans	-72.3	-28.7	170.2	0	0	0	0	0	111.8	D830 N838	D830-A834 WeakPolarHBondContact O-CA 3.31Å; D830-A834 WeakPolarHBondContact O-CB 3.46Å; D830-A834 PolarHBondContact O-N 3.32Å; A834-N838 WeakPolarHBondContact O-CA 3.11Å; A834-N838 WeakPolarHBondContact O-CB 3.4Å; A834-N838 VanDerWaalsContact O-CG 3.24Å; A834-N838 PolarHBondContact O-N 2.99Å
835	H	64.9	Low	62.6	Low	15 Å²	15	71.4 Å²	71.4	7%	0.069	35%	0.353	C	S	.	.	H	α-helix	trans	-65.8	-47.1	175.1	-161.7	44.6	0	0	0	111.8	D311 S314 K831 R832 N838 I839	D311-H835 VanDerWaalsContact CB-CE1 3.43Å; D311-H835 WeakPolarHBondContact CB-CE1 3.28Å; D311-H835 VanDerWaalsContact CG-CE1 3.49Å; D311-H835 PolarHBondContact O-CE1 3.39Å; D311-H835 VanDerWaalsContact O-CE1 3.31Å; D311-H835 PolarHBondContact O-NE2 3Å; D311-H835 IonicContact OD1-CE1 3.26Å; D311-H835 PolarHBondContact OD1-CE1 2.87Å; S314-H835 PolarHBondContact OG-CE1 3.26Å; S314-H835 VanDerWaalsContact OG-CE1 3.27Å; S314-H835 PolarHBondContact OG-NE2 2.8Å; K831-H835 WeakPolarHBondContact O-CB 3.5Å; K831-H835 PolarHBondContact O-N 3.32Å; R832-H835 PolarHBondContact O-N 3.39Å; H835-N838 PolarHBondContact O-N 2.91Å; H835-I839 WeakPolarHBondContact O-CG1 3.37Å; H835-I839 PolarHBondContact O-N 3.34Å
836	L	59.8	Low	63.1	Low	93 Å²	93	70.7 Å²	70.7	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-69.2	-37.8	176.7	-74.8	169	0	0	0	113.1	T315 R832	T315-L836 HydrophobicContact CG2-CD1 4.49Å; T315-L836 HydrophobicContact CG2-CD2 3.8Å; T315-L836 HydrophobicContact CG2-CG 4.08Å; R832-L836 PolarHBondContact O-N 2.95Å
837	R	62.3	Low	63.8	Low	165 Å²	165	72.6 Å²	72.6	62%	0.623	36%	0.359	S	S	*	.	H	α-helix	trans	-70.7	-38.1	172.7	-73.7	-176.8	-128.6	148.4	5.4	112.1	S833 I839 H840 T841	S833-R837 WeakPolarHBondContact O-CB 3.46Å; S833-R837 WeakPolarHBondContact O-CG 3.35Å; S833-R837 PolarHBondContact O-N 3.14Å; R837-I839 VanDerWaalsContact C-N 3.31Å; R837-I839 PolarHBondContact O-N 2.88Å; R837-H840 PolarHBondContact O-N 3.24Å; R837-T841 WeakPolarHBondContact O-CB 3.5Å; R837-T841 PolarHBondContact O-N 3.5Å; R837-T841 PolarHBondContact O-OG1 3.24Å
838	N	62.6	Low	64.2	Low	79 Å²	79	74.4 Å²	74.4	42%	0.422	37%	0.371	S	S	.	.	H	α-helix	trans	-57.8	-43.8	178.3	-95.2	-10.3	0	0	0	111.1	A834 H835 H840 T841 L842	A834-N838 WeakPolarHBondContact O-CA 3.11Å; A834-N838 WeakPolarHBondContact O-CB 3.4Å; A834-N838 VanDerWaalsContact O-CG 3.24Å; A834-N838 PolarHBondContact O-N 2.99Å; H835-N838 PolarHBondContact O-N 2.91Å; N838-H840 PolarHBondContact O-N 3.07Å; N838-T841 PolarHBondContact O-N 2.73Å; N838-L842 HydrophobicContact CB-CD1 4.3Å; N838-L842 WeakPolarHBondContact O-CB 3.44Å; N838-L842 WeakPolarHBondContact O-CD1 3.48Å; N838-L842 WeakPolarHBondContact O-CG 3.43Å; N838-L842 PolarHBondContact O-N 2.91Å
839	I	65.8	Low	64.6	Low	21 Å²	21	75.4 Å²	75.4	11%	0.108	38%	0.376	C	S	.	.	H	α-helix	trans	-59.1	-48.1	179	-66.3	167	0	0	0	111.1	L308 D311 K312 H835 R837 T841 E843	L308-I839 HydrophobicContact CD1-CG2 4.27Å; L308-I839 WeakPolarHBondContact CD1-O 3.41Å; D311-I839 HydrophobicContact CB-CD1 4.11Å; D311-I839 HydrophobicContact CB-CG1 3.77Å; K312-I839 HydrophobicContact CD-CG2 4.48Å; K312-I839 HydrophobicContact CG-CD1 4.06Å; K312-I839 HydrophobicContact CG-CG1 4.5Å; K312-I839 HydrophobicContact CG-CG2 4.04Å; H835-I839 WeakPolarHBondContact O-CG1 3.37Å; H835-I839 PolarHBondContact O-N 3.34Å; R837-I839 VanDerWaalsContact C-N 3.31Å; R837-I839 PolarHBondContact O-N 2.88Å; I839-T841 PolarHBondContact O-N 2.74Å; I839-E843 PolarHBondContact O-N 2.78Å
840	H	65.8	Low	65.1	Low	143 Å²	143	76.2 Å²	76.2	66%	0.662	38%	0.378	S	S	*	.	H	α-helix	trans	-72	-28.5	-179.6	-161	-62.1	0	0	0	113.1	R837 N838 A844	R837-H840 PolarHBondContact O-N 3.24Å; N838-H840 PolarHBondContact O-N 3.07Å; H840-A844 PolarHBondContact O-N 2.72Å
841	T	63	Low	65.8	Low	62 Å²	62	75.5 Å²	75.5	38%	0.38	38%	0.383	S	S	.	.	H	α-helix	trans	-80.3	-37	179	-40	0	0	0	0	111.1	R837 N838 I839 E843 A844 Q845	R837-T841 WeakPolarHBondContact O-CB 3.5Å; R837-T841 PolarHBondContact O-N 3.5Å; R837-T841 PolarHBondContact O-OG1 3.24Å; N838-T841 PolarHBondContact O-N 2.73Å; I839-T841 PolarHBondContact O-N 2.74Å; T841-E843 VanDerWaalsContact C-N 3.34Å; T841-E843 PolarHBondContact O-N 3.05Å; T841-A844 PolarHBondContact O-N 3.46Å; T841-Q845 HydrophobicContact CG2-CG 4.33Å; T841-Q845 VanDerWaalsContact O-CB 3.23Å; T841-Q845 WeakPolarHBondContact O-CB 3.29Å; T841-Q845 WeakPolarHBondContact O-CG 3.42Å; T841-Q845 PolarHBondContact O-N 2.83Å
842	L	67	Low	66.1	Low	17 Å²	17	75.2 Å²	75.2	9%	0.089	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-36.5	175.8	-72.6	166.5	0	0	0	111.4	V304 L308 N838 L846	V304-L842 HydrophobicContact CG1-CD2 3.95Å; L308-L842 HydrophobicContact CD1-CB 3.61Å; L308-L842 HydrophobicContact CD1-CD1 4.42Å; N838-L842 HydrophobicContact CB-CD1 4.3Å; N838-L842 WeakPolarHBondContact O-CB 3.44Å; N838-L842 WeakPolarHBondContact O-CD1 3.48Å; N838-L842 WeakPolarHBondContact O-CG 3.43Å; N838-L842 PolarHBondContact O-N 2.91Å; L842-L846 WeakPolarHBondContact O-CB 3.33Å; L842-L846 PolarHBondContact O-N 2.85Å
843	E	68.3	Low	66.7	Low	81 Å²	81	72.4 Å²	72.4	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-65.4	-44.1	174.2	-78.9	171.7	177.7	0	0	112.7	L308 K312 I839 T841	L308-E843 HydrophobicContact CD1-CG 3.69Å; L308-E843 HydrophobicContact CD2-CG 3.59Å; L308-E843 HydrophobicContact CG-CG 4.25Å; K312-E843 WeakPolarHBondContact CE-OE1 3.37Å; K312-E843 IonicContact NZ-OE1 2.89Å; K312-E843 PolarHBondContact NZ-OE1 2.99Å; I839-E843 PolarHBondContact O-N 2.78Å; T841-E843 VanDerWaalsContact C-N 3.34Å; T841-E843 PolarHBondContact O-N 3.05Å
844	A	68.4	Low	67.3	Low	62 Å²	62	73.9 Å²	73.9	51%	0.512	39%	0.391	S	S	.	.	H	α-helix	trans	-71.9	-35.1	176.8	0	0	0	0	0	112.9	H840 T841 N848	H840-A844 PolarHBondContact O-N 2.72Å; T841-A844 PolarHBondContact O-N 3.46Å; A844-N848 PolarHBondContact O-N 2.82Å
845	Q	63.2	Low	68	Low	86 Å²	86	74.4 Å²	74.4	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-37	177.1	-78.2	173.5	-0.6	0	0	112.3	T841 N848 K849	T841-Q845 HydrophobicContact CG2-CG 4.33Å; T841-Q845 VanDerWaalsContact O-CB 3.23Å; T841-Q845 WeakPolarHBondContact O-CB 3.29Å; T841-Q845 WeakPolarHBondContact O-CG 3.42Å; T841-Q845 PolarHBondContact O-N 2.83Å; Q845-N848 PolarHBondContact O-N 3.27Å; Q845-K849 WeakPolarHBondContact O-CB 3.26Å; Q845-K849 WeakPolarHBondContact O-CG 3.49Å; Q845-K849 PolarHBondContact O-N 2.69Å
846	L	71.9	Confident	68.3	Low	39 Å²	39	75.3 Å²	75.3	20%	0.204	40%	0.404	C	S	.	.	H	α-helix	trans	-58.6	-50.5	176.6	-164.9	85.8	0	0	0	111.3	L301 V304 K305 L842 N848 K849 E850	L301-L846 HydrophobicContact CD2-CD1 4.11Å; V304-L846 HydrophobicContact CB-CD1 4.28Å; V304-L846 HydrophobicContact CG1-CD1 3.87Å; K305-L846 HydrophobicContact CD-CD1 4.29Å; K305-L846 HydrophobicContact CG-CD1 3.43Å; K305-L846 VanDerWaalsContact CG-CD1 3.43Å; K305-L846 HydrophobicContact CG-CD2 4.38Å; L842-L846 WeakPolarHBondContact O-CB 3.33Å; L842-L846 PolarHBondContact O-N 2.85Å; L846-N848 VanDerWaalsContact C-N 3.35Å; L846-N848 PolarHBondContact O-N 3.17Å; L846-K849 PolarHBondContact O-N 3.06Å; L846-E850 WeakPolarHBondContact O-CG 3.49Å; L846-E850 PolarHBondContact O-N 3.1Å; L846-E850 VanDerWaalsContact O-N 3.1Å
847	K	73.1	Confident	69	Low	169 Å²	169	73 Å²	73	74%	0.735	39%	0.393	S	S	*	.	H	α-helix	trans	-64.5	-36.2	-178	-168.2	175.9	-179	178.3	0	113.1
848	N	70.8	Confident	69.5	Low	97 Å²	97	67.9 Å²	67.9	52%	0.519	39%	0.386	S	S	.	.	H	α-helix	trans	-75.9	-39.4	178.1	-164.3	-9.9	0	0	0	111.8	A844 Q845 L846 E850 A851 N852	A844-N848 PolarHBondContact O-N 2.82Å; Q845-N848 PolarHBondContact O-N 3.27Å; L846-N848 VanDerWaalsContact C-N 3.35Å; L846-N848 PolarHBondContact O-N 3.17Å; N848-E850 PolarHBondContact O-N 2.71Å; N848-A851 PolarHBondContact O-N 3.2Å; N848-N852 PolarHBondContact O-N 2.66Å; N848-N852 VanDerWaalsContact O-N 3.11Å; N848-N852 PolarHBondContact O-ND2 3.46Å; N848-N852 PolarHBondContact OD1-ND2 2.83Å
849	K	67.9	Low	70	Confident	65 Å²	65	71 Å²	71	28%	0.283	40%	0.396	S	S	.	.	H	α-helix	trans	-65.6	-35.9	177.1	-74.9	-166	178.8	-158.4	0	112.8	E300 L301 Q845 L846 N852 L853	E300-K849 IonicContact OE2-NZ 3.71Å; E300-K849 PolarHBondContact OE2-NZ 3.14Å; L301-K849 HydrophobicContact CD1-CB 4.25Å; L301-K849 HydrophobicContact CG-CB 4.45Å; Q845-K849 WeakPolarHBondContact O-CB 3.26Å; Q845-K849 WeakPolarHBondContact O-CG 3.49Å; Q845-K849 PolarHBondContact O-N 2.69Å; L846-K849 PolarHBondContact O-N 3.06Å; K849-N852 PolarHBondContact O-N 3.28Å; K849-L853 WeakPolarHBondContact O-CB 3.45Å; K849-L853 PolarHBondContact O-N 3.43Å
850	E	71.8	Confident	70.1	Confident	83 Å²	83	70.1 Å²	70.1	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-39.5	175.5	-72.4	177.3	161.4	0	0	112.5	L301 K305 L846 N848 A854	L301-E850 HydrophobicContact CD1-CG 3.82Å; L301-E850 HydrophobicContact CD2-CG 3.81Å; L301-E850 HydrophobicContact CG-CG 4.35Å; K305-E850 WeakPolarHBondContact CE-OE1 3.49Å; K305-E850 IonicContact NZ-OE1 2.74Å; K305-E850 PolarHBondContact NZ-OE1 3.48Å; L846-E850 WeakPolarHBondContact O-CG 3.49Å; L846-E850 PolarHBondContact O-N 3.1Å; L846-E850 VanDerWaalsContact O-N 3.1Å; N848-E850 PolarHBondContact O-N 2.71Å; E850-A854 PolarHBondContact O-N 3.04Å
851	A	72.6	Confident	70.3	Confident	61 Å²	61	65.7 Å²	65.7	50%	0.504	38%	0.377	S	S	.	.	H	α-helix	trans	-69.5	-39.7	176.4	0	0	0	0	0	113.1	N848 A854 A855	N848-A851 PolarHBondContact O-N 3.2Å; A851-A854 PolarHBondContact O-N 3.42Å; A851-A855 PolarHBondContact O-N 3.42Å
852	N	68.3	Low	70.7	Confident	76 Å²	76	70.9 Å²	70.9	41%	0.406	40%	0.397	S	S	.	.	H	α-helix	trans	-71	-31.1	178.6	-69.8	-37	0	0	0	113.1	N848 K849 A855 S856	N848-N852 PolarHBondContact O-N 2.66Å; N848-N852 VanDerWaalsContact O-N 3.11Å; N848-N852 PolarHBondContact O-ND2 3.46Å; N848-N852 PolarHBondContact OD1-ND2 2.83Å; K849-N852 PolarHBondContact O-N 3.28Å; N852-A855 PolarHBondContact O-N 3.38Å; N852-S856 WeakPolarHBondContact O-CB 3Å; N852-S856 PolarHBondContact O-N 3.17Å; N852-S856 PolarHBondContact O-OG 3.04Å
853	L	74.9	Confident	70.9	Confident	32 Å²	32	75.1 Å²	75.1	17%	0.168	42%	0.419	C	S	.	.	H	α-helix	trans	-63.5	-45.9	174.4	177.1	61.6	0	0	0	110.9	V294 M297 E298 L301 K849 A855 S856 V857	V294-L853 HydrophobicContact CG1-CD1 4.21Å; M297-L853 HydrophobicContact CB-CD1 3.82Å; E298-L853 HydrophobicContact CG-CD1 3.61Å; E298-L853 HydrophobicContact CG-CD2 3.87Å; E298-L853 HydrophobicContact CG-CG 4.36Å; L301-L853 HydrophobicContact CD1-CD2 4.05Å; K849-L853 WeakPolarHBondContact O-CB 3.45Å; K849-L853 PolarHBondContact O-N 3.43Å; L853-A855 VanDerWaalsContact C-N 3.35Å; L853-A855 PolarHBondContact O-N 3.05Å; L853-S856 PolarHBondContact O-N 3.47Å; L853-V857 HydrophobicContact CD1-CG2 4.29Å; L853-V857 VanDerWaalsContact O-CG2 3.29Å; L853-V857 WeakPolarHBondContact O-CG2 3.4Å; L853-V857 PolarHBondContact O-N 3.11Å
854	A	72.8	Confident	70.6	Confident	66 Å²	66	72.1 Å²	72.1	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-60.7	-41.3	177.9	0	0	0	0	0	112.7	E850 A851 A858	E850-A854 PolarHBondContact O-N 3.04Å; A851-A854 PolarHBondContact O-N 3.42Å; A854-A858 PolarHBondContact O-N 2.99Å
855	A	74	Confident	70.3	Confident	50 Å²	50	75.1 Å²	75.1	41%	0.413	42%	0.42	S	S	.	.	H	α-helix	trans	-68.7	-35.5	177.3	0	0	0	0	0	113.3	A851 N852 L853 K859	A851-A855 PolarHBondContact O-N 3.42Å; N852-A855 PolarHBondContact O-N 3.38Å; L853-A855 VanDerWaalsContact C-N 3.35Å; L853-A855 PolarHBondContact O-N 3.05Å; A855-K859 PolarHBondContact O-N 3.23Å
856	S	69.5	Low	70.1	Confident	35 Å²	35	78 Å²	78	25%	0.245	43%	0.434	C	S	.	.	H	α-helix	trans	-73.2	-35	179	-62.7	0	0	0	0	112.7	M297 N852 L853 K859 A860	M297-S856 PolarHBondContact SD-OG 3.39Å; N852-S856 WeakPolarHBondContact O-CB 3Å; N852-S856 PolarHBondContact O-N 3.17Å; N852-S856 PolarHBondContact O-OG 3.04Å; L853-S856 PolarHBondContact O-N 3.47Å; S856-K859 PolarHBondContact O-N 2.9Å; S856-A860 WeakPolarHBondContact O-CB 3.26Å; S856-A860 PolarHBondContact O-N 3.38Å
857	V	75.6	Confident	69.8	Low	45 Å²	45	83.3 Å²	83.3	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-62.5	-41.5	174	171.6	0	0	0	0	111.5	V294 L853 A860 S861	V294-V857 HydrophobicContact CG1-CG2 3.53Å; V294-V857 HydrophobicContact CG2-CG2 4.33Å; L853-V857 HydrophobicContact CD1-CG2 4.29Å; L853-V857 VanDerWaalsContact O-CG2 3.29Å; L853-V857 WeakPolarHBondContact O-CG2 3.4Å; L853-V857 PolarHBondContact O-N 3.11Å; V857-A860 PolarHBondContact O-N 3.37Å; V857-S861 PolarHBondContact O-N 3.43Å; V857-S861 VanDerWaalsContact O-N 3.16Å; V857-S861 PolarHBondContact O-OG 3.03Å
858	A	73.5	Confident	69.5	Low	57 Å²	57	78.5 Å²	78.5	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-46.6	177.4	0	0	0	0	0	112	A854 S861 E862	A854-A858 PolarHBondContact O-N 2.99Å; A858-S861 PolarHBondContact O-N 3.02Å; A858-E862 PolarHBondContact O-N 2.94Å
859	K	72.8	Confident	68.8	Low	143 Å²	143	82.4 Å²	82.4	62%	0.622	45%	0.448	S	S	*	.	H	α-helix	trans	-66.8	-36.6	178.3	-70.1	177.5	-179.4	177.8	0	113.4	A855 S856 S861 E862	A855-K859 PolarHBondContact O-N 3.23Å; S856-K859 PolarHBondContact O-N 2.9Å; K859-S861 VanDerWaalsContact C-N 3.31Å; K859-S861 PolarHBondContact O-N 3.04Å; K859-E862 PolarHBondContact O-N 3.49Å
860	A	67.9	Low	68.5	Low	3 Å²	3	80.1 Å²	80.1	3%	0.025	44%	0.44	C	S	.	.	H	α-helix	trans	-66	-35.9	177	0	0	0	0	0	112	A290 W291 V294 S856 V857 E862 I863 C864	A290-A860 HydrophobicContact CB-CB 4.36Å; A290-A860 WeakPolarHBondContact O-CB 3.5Å; W291-A860 HydrophobicContact CD2-CB 4.17Å; W291-A860 HydrophobicContact CE3-CB 4.22Å; W291-A860 HydrophobicContact CH2-CB 4.44Å; W291-A860 HydrophobicContact CZ2-CB 4.4Å; W291-A860 HydrophobicContact CZ3-CB 4.35Å; V294-A860 HydrophobicContact CG2-CB 3.86Å; S856-A860 WeakPolarHBondContact O-CB 3.26Å; S856-A860 PolarHBondContact O-N 3.38Å; V857-A860 PolarHBondContact O-N 3.37Å; A860-E862 VanDerWaalsContact C-N 3.34Å; A860-E862 PolarHBondContact O-N 3.11Å; A860-I863 PolarHBondContact O-N 3.48Å; A860-C864 PolarHBondContact O-N 3.1Å; A860-C864 VanDerWaalsContact O-N 3.16Å
861	S	68.7	Low	67.9	Low	50 Å²	50	86.4 Å²	86.4	35%	0.35	46%	0.46	S	S	.	.	H	α-helix	trans	-70.2	-26.5	-179.3	-55.7	0	0	0	0	113.5	V857 A858 K859	V857-S861 PolarHBondContact O-N 3.43Å; V857-S861 VanDerWaalsContact O-N 3.16Å; V857-S861 PolarHBondContact O-OG 3.03Å; A858-S861 PolarHBondContact O-N 3.02Å; K859-S861 VanDerWaalsContact C-N 3.31Å; K859-S861 PolarHBondContact O-N 3.04Å
862	E	72.6	Confident	67.7	Low	172 Å²	172	90.4 Å²	90.4	80%	0.804	46%	0.462	S	S	*	.	H	α-helix	trans	-71.2	-30.3	173.3	-72.6	179.9	173.8	0	0	113	A858 K859 A860	A858-E862 PolarHBondContact O-N 2.94Å; K859-E862 PolarHBondContact O-N 3.49Å; A860-E862 VanDerWaalsContact C-N 3.34Å; A860-E862 PolarHBondContact O-N 3.11Å
863	I	69.4	Low	67.7	Low	106 Å²	106	89.8 Å²	89.8	54%	0.544	46%	0.461	S	S	.	.	H	α-helix	trans	-86.3	-37	-176.5	-62.5	170.1	0	0	0	111.2	A290 A860	A290-I863 HydrophobicContact CB-CB 4.4Å; A290-I863 HydrophobicContact CB-CD1 4.19Å; A290-I863 HydrophobicContact CB-CG2 4.31Å; A860-I863 PolarHBondContact O-N 3.48Å
864	C	62.7	Low	67.5	Low	18 Å²	18	88.5 Å²	88.5	12%	0.122	46%	0.455	C	S	.	.			trans	-148.5	110.4	175.8	-179.9	0	0	0	0	109.1	W291 A860 E866	W291-C864 WeakPolarHBondContact CZ2-O 3.41Å; W291-C864 PolarHBondContact NE1-O 3.02Å; A860-C864 PolarHBondContact O-N 3.1Å; A860-C864 VanDerWaalsContact O-N 3.16Å; C864-E866 PolarHBondContact O-N 3.39Å; C864-E866 PolarHBondContact SG-O 3.15Å; C864-E866 VanDerWaalsContact SG-O 3.37Å
865	P	61.5	Low	67.5	Low	124 Å²	124	94 Å²	94	81%	0.805	47%	0.467	S	S	*	.	S	Bend	trans	-68.8	-17.4	-175.1	25.3	-33.7	0	0	0	113.7
866	E	60.3	Low	67.6	Low	148 Å²	148	94.2 Å²	94.2	69%	0.692	47%	0.465	S	S	*	.	S	Bend	trans	-94.4	127.3	177.8	-158	172	-166.3	0	0	110.8	W291 C864 L868	W291-E866 PolarHBondContact NE1-O 2.84Å; C864-E866 PolarHBondContact O-N 3.39Å; C864-E866 PolarHBondContact SG-O 3.15Å; C864-E866 VanDerWaalsContact SG-O 3.37Å; E866-L868 PolarHBondContact O-N 3.2Å
867	R	65.4	Low	68	Low	150 Å²	150	92.5 Å²	92.5	57%	0.566	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-72.2	117.2	-178.5	-175.7	172.4	-176.9	142.2	4	110.1	W291 E298	W291-R867 HydrophobicContact CE3-CG 4.04Å; W291-R867 HydrophobicContact CH2-CB 4.24Å; W291-R867 HydrophobicContact CH2-CG 4.35Å; W291-R867 HydrophobicContact CZ2-CB 4.43Å; W291-R867 HydrophobicContact CZ3-CB 4.32Å; W291-R867 HydrophobicContact CZ3-CG 3.93Å; E298-R867 IonicContact OE1-CZ 3.97Å; E298-R867 IonicContact OE1-NH1 2.93Å; E298-R867 IonicContact OE1-NH2 3.25Å; E298-R867 PolarHBondContact OE1-NH2 3.01Å; E298-R867 IonicContact OE2-NH2 3.1Å; E298-R867 PolarHBondContact OE2-NH2 3.08Å
868	L	67.1	Low	68.1	Low	68 Å²	68	94 Å²	94	36%	0.356	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-98.2	127.8	178.1	-68.8	167.3	0	0	0	111.1	W291 E866 V870	W291-L868 HydrophobicContact CB-CB 4.34Å; W291-L868 HydrophobicContact CG-CB 4.31Å; E866-L868 PolarHBondContact O-N 3.2Å; L868-V870 HydrophobicContact CB-CG2 4.34Å; L868-V870 PolarHBondContact O-N 3.07Å
869	E	56.2	Low	68.4	Low	178 Å²	178	94.6 Å²	94.6	83%	0.832	46%	0.461	S	S	*	.			trans	-76.4	104.6	171.3	-75.5	-164.8	171.6	0	0	110.9
870	V	61.8	Low	68.7	Low	18 Å²	18	90.6 Å²	90.6	11%	0.109	44%	0.444	C	S	.	.			trans	-102.2	112.1	-178.7	-170.1	0	0	0	0	110.5	W291 L868 R872 I877	W291-V870 HydrophobicContact CB-CG2 4.12Å; L868-V870 HydrophobicContact CB-CG2 4.34Å; L868-V870 PolarHBondContact O-N 3.07Å; V870-R872 VanDerWaalsContact C-N 3.32Å; V870-R872 HydrophobicContact CG1-CB 4.3Å; V870-I877 HydrophobicContact CG1-CD1 3.81Å
871	R	59	Low	69.5	Low	215 Å²	215	90.9 Å²	90.9	81%	0.811	45%	0.445	S	S	*	.			trans	-81.7	-7.3	176.8	-64.9	-173.6	-179.3	-167.9	1.4	114.1
872	R	67.4	Low	70	Confident	145 Å²	145	91.9 Å²	91.9	55%	0.547	45%	0.446	S	S	.	.	S	Bend	trans	-99.8	152.9	-176.2	-62.7	-175.3	-175.7	-176.6	4.6	110.8	V870 I877	V870-R872 VanDerWaalsContact C-N 3.32Å; V870-R872 HydrophobicContact CG1-CB 4.3Å; R872-I877 HydrophobicContact CB-CD1 4.17Å; R872-I877 HydrophobicContact CB-CG1 4.28Å
873	T	68.7	Low	70.4	Confident	62 Å²	62	93.1 Å²	93.1	38%	0.38	44%	0.444	S	S	.	.			trans	-79.4	146.8	-177.8	53.2	0	0	0	0	112.5	E296 K875 S876 I877	E296-T873 WeakPolarHBondContact OE1-CA 3.33Å; E296-T873 WeakPolarHBondContact OE1-CB 3.37Å; E296-T873 WeakPolarHBondContact OE1-CG2 3.4Å; T873-K875 VanDerWaalsContact C-N 3.28Å; T873-K875 PolarHBondContact O-N 3.2Å; T873-S876 WeakPolarHBondContact O-CB 3.47Å; T873-S876 PolarHBondContact O-N 3.06Å; T873-S876 WeakPolarHBondContact OG1-CB 3.33Å; T873-I877 PolarHBondContact O-N 2.89Å
874	A	71.5	Confident	71	Confident	6 Å²	6	89.1 Å²	89.1	5%	0.05	42%	0.423	C	S	.	.	H	α-helix	trans	-60.8	-38.6	-176.9	0	0	0	0	0	111.4	M289 S292 L293 E296 S876 I877 D878	M289-A874 VanDerWaalsContact CE-O 3.32Å; M289-A874 WeakPolarHBondContact CE-O 3.41Å; M289-A874 HydrophobicContact SD-CB 4.07Å; S292-A874 WeakPolarHBondContact OG-CA 3.39Å; L293-A874 HydrophobicContact CD2-CB 3.44Å; L293-A874 VanDerWaalsContact CD2-CB 3.44Å; L293-A874 HydrophobicContact CG-CB 3.83Å; E296-A874 VanDerWaalsContact CD-N 3.29Å; E296-A874 PolarHBondContact OE1-N 3.34Å; E296-A874 WeakPolarHBondContact OE2-CB 3.47Å; E296-A874 PolarHBondContact OE2-N 2.92Å; A874-S876 VanDerWaalsContact C-N 3.31Å; A874-S876 PolarHBondContact O-N 3.41Å; A874-I877 PolarHBondContact O-N 2.61Å; A874-I877 VanDerWaalsContact O-N 3.17Å; A874-D878 WeakPolarHBondContact O-CB 3.44Å; A874-D878 PolarHBondContact O-N 3.07Å
875	K	71.3	Confident	71.8	Confident	181 Å²	181	92.8 Å²	92.8	79%	0.787	44%	0.437	S	S	*	.	H	α-helix	trans	-61.1	-35.7	175.5	-71.2	-176.4	177.8	178.9	0	113.9	T873 S879	T873-K875 VanDerWaalsContact C-N 3.28Å; T873-K875 PolarHBondContact O-N 3.2Å; K875-S879 WeakPolarHBondContact O-CB 3.42Å; K875-S879 PolarHBondContact O-N 3.47Å; K875-S879 VanDerWaalsContact O-N 3.09Å; K875-S879 PolarHBondContact O-OG 2.93Å
876	S	76.9	Confident	72.7	Confident	54 Å²	54	91.4 Å²	91.4	38%	0.378	43%	0.426	S	S	.	.	H	α-helix	trans	-69.8	-37	177.6	-177	0	0	0	0	111.3	T873 A874 S879 E880	T873-S876 WeakPolarHBondContact O-CB 3.47Å; T873-S876 PolarHBondContact O-N 3.06Å; T873-S876 WeakPolarHBondContact OG1-CB 3.33Å; A874-S876 VanDerWaalsContact C-N 3.31Å; A874-S876 PolarHBondContact O-N 3.41Å; S876-S879 PolarHBondContact O-OG 3.29Å; S876-S879 VanDerWaalsContact O-OG 3.1Å; S876-E880 WeakPolarHBondContact O-CB 3.48Å; S876-E880 PolarHBondContact O-N 3.39Å
877	I	77.6	Confident	73.6	Confident	0 Å²	0	89.4 Å²	89.4	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-73.8	-37.2	177.8	-58.3	172.5	0	0	0	109.8	L285 Q288 M289 V870 R872 T873 A874 E880 I881	L285-I877 HydrophobicContact CB-CG2 4.46Å; L285-I877 HydrophobicContact CD2-CG2 4.35Å; Q288-I877 HydrophobicContact CB-CD1 4.32Å; M289-I877 HydrophobicContact CB-CG2 4Å; M289-I877 HydrophobicContact CE-CB 3.85Å; M289-I877 HydrophobicContact CE-CG2 3.87Å; V870-I877 HydrophobicContact CG1-CD1 3.81Å; R872-I877 HydrophobicContact CB-CD1 4.17Å; R872-I877 HydrophobicContact CB-CG1 4.28Å; T873-I877 PolarHBondContact O-N 2.89Å; A874-I877 PolarHBondContact O-N 2.61Å; A874-I877 VanDerWaalsContact O-N 3.17Å; I877-E880 PolarHBondContact O-N 3.31Å; I877-I881 HydrophobicContact CG2-CD1 3.89Å; I877-I881 HydrophobicContact CG2-CG1 4.36Å; I877-I881 WeakPolarHBondContact O-CB 3.05Å; I877-I881 VanDerWaalsContact O-CG1 3.26Å; I877-I881 WeakPolarHBondContact O-CG1 3.28Å; I877-I881 PolarHBondContact O-N 3.42Å
878	D	78.5	Confident	74.1	Confident	77 Å²	77	82.8 Å²	82.8	41%	0.412	39%	0.391	S	S	.	.	H	α-helix	trans	-67.9	-44.5	-178.5	-172	56.1	0	0	0	111.8	M289 A874 E880 I881 N882	M289-D878 HydrophobicContact CE-CB 3.39Å; A874-D878 WeakPolarHBondContact O-CB 3.44Å; A874-D878 PolarHBondContact O-N 3.07Å; D878-E880 VanDerWaalsContact C-N 3.29Å; D878-E880 PolarHBondContact O-N 2.89Å; D878-I881 PolarHBondContact O-N 3.15Å; D878-N882 WeakPolarHBondContact O-CB 3.43Å; D878-N882 PolarHBondContact O-N 2.87Å; D878-N882 PolarHBondContact O-ND2 2.98Å; D878-N882 PolarHBondContact OD1-ND2 3.49Å; D878-N882 PolarHBondContact OD2-ND2 2.94Å
879	S	79.4	Confident	74.5	Confident	69 Å²	69	82 Å²	82	48%	0.483	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-35.9	175	54	0	0	0	0	112.3	K875 S876 R883	K875-S879 WeakPolarHBondContact O-CB 3.42Å; K875-S879 PolarHBondContact O-N 3.47Å; K875-S879 VanDerWaalsContact O-N 3.09Å; K875-S879 PolarHBondContact O-OG 2.93Å; S876-S879 PolarHBondContact O-OG 3.29Å; S876-S879 VanDerWaalsContact O-OG 3.1Å; S879-R883 WeakPolarHBondContact O-CB 3.31Å; S879-R883 PolarHBondContact O-N 2.99Å
880	E	79.9	Confident	75.4	Confident	59 Å²	59	76.4 Å²	76.4	28%	0.276	37%	0.369	S	S	.	.	H	α-helix	trans	-70.2	-41.5	174.7	-164.7	170	-177.7	0	0	111.6	L285 S876 I877 D878 R883 L884	L285-E880 HydrophobicContact CD1-CG 4.01Å; S876-E880 WeakPolarHBondContact O-CB 3.48Å; S876-E880 PolarHBondContact O-N 3.39Å; I877-E880 PolarHBondContact O-N 3.31Å; D878-E880 VanDerWaalsContact C-N 3.29Å; D878-E880 PolarHBondContact O-N 2.89Å; E880-R883 PolarHBondContact O-N 2.94Å; E880-L884 HydrophobicContact CG-CD1 4.21Å; E880-L884 WeakPolarHBondContact O-CB 3.37Å; E880-L884 PolarHBondContact O-N 3.26Å
881	I	82.7	Confident	75.8	Confident	8 Å²	8	77.6 Å²	77.6	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-60.6	-50.5	173.6	-72.3	169.9	0	0	0	110.7	L285 Q286 M289 I877 D878 R883 L884 K885	L285-I881 HydrophobicContact CB-CD1 4.18Å; L285-I881 HydrophobicContact CB-CG1 3.73Å; Q286-I881 HydrophobicContact CG-CD1 4.29Å; M289-I881 HydrophobicContact CB-CD1 3.96Å; M289-I881 HydrophobicContact CE-CD1 3.97Å; M289-I881 HydrophobicContact CG-CD1 4.44Å; I877-I881 HydrophobicContact CG2-CD1 3.89Å; I877-I881 HydrophobicContact CG2-CG1 4.36Å; I877-I881 WeakPolarHBondContact O-CB 3.05Å; I877-I881 VanDerWaalsContact O-CG1 3.26Å; I877-I881 WeakPolarHBondContact O-CG1 3.28Å; I877-I881 PolarHBondContact O-N 3.42Å; D878-I881 PolarHBondContact O-N 3.15Å; I881-R883 VanDerWaalsContact C-N 3.34Å; I881-R883 PolarHBondContact O-N 2.89Å; I881-L884 PolarHBondContact O-N 3.3Å; I881-K885 HydrophobicContact CG2-CD 4.12Å; I881-K885 HydrophobicContact CG2-CG 4.32Å; I881-K885 WeakPolarHBondContact O-CG 3.38Å; I881-K885 PolarHBondContact O-N 3.42Å
882	N	81.2	Confident	76.2	Confident	71 Å²	71	72.2 Å²	72.2	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-39.6	-178.4	-72.8	-34	0	0	0	111.3	D878 L884 K885 V886	D878-N882 WeakPolarHBondContact O-CB 3.43Å; D878-N882 PolarHBondContact O-N 2.87Å; D878-N882 PolarHBondContact O-ND2 2.98Å; D878-N882 PolarHBondContact OD1-ND2 3.49Å; D878-N882 PolarHBondContact OD2-ND2 2.94Å; N882-L884 PolarHBondContact O-N 3.34Å; N882-K885 PolarHBondContact O-N 2.91Å; N882-V886 WeakPolarHBondContact O-CB 3.26Å; N882-V886 VanDerWaalsContact O-CG2 3.29Å; N882-V886 WeakPolarHBondContact O-CG2 2.97Å; N882-V886 PolarHBondContact O-N 3.2Å
883	R	80.8	Confident	76.3	Confident	199 Å²	199	72.5 Å²	72.5	75%	0.751	37%	0.365	S	S	*	.	H	α-helix	trans	-63.7	-40.2	173.6	-172.5	178.8	-179.9	-177	1.5	112.1	S879 E880 I881 K887	S879-R883 WeakPolarHBondContact O-CB 3.31Å; S879-R883 PolarHBondContact O-N 2.99Å; E880-R883 PolarHBondContact O-N 2.94Å; I881-R883 VanDerWaalsContact C-N 3.34Å; I881-R883 PolarHBondContact O-N 2.89Å; R883-K887 WeakPolarHBondContact O-CB 3.49Å; R883-K887 PolarHBondContact O-N 3.01Å
884	L	81.6	Confident	76.2	Confident	22 Å²	22	76.7 Å²	76.7	12%	0.115	38%	0.38	C	S	.	.	H	α-helix	trans	-68.8	-41.7	175.5	-109.7	123.5	0	0	0	111.9	M278 L282 L285 E880 I881 N882 K887 I888	M278-L884 HydrophobicContact CB-CD2 4Å; M278-L884 HydrophobicContact CG-CD2 4.42Å; M278-L884 WeakPolarHBondContact O-CD2 3.5Å; L282-L884 HydrophobicContact CD1-CB 4.29Å; L285-L884 HydrophobicContact CD1-CD1 3.94Å; E880-L884 HydrophobicContact CG-CD1 4.21Å; E880-L884 WeakPolarHBondContact O-CB 3.37Å; E880-L884 PolarHBondContact O-N 3.26Å; I881-L884 PolarHBondContact O-N 3.3Å; N882-L884 PolarHBondContact O-N 3.34Å; L884-K887 PolarHBondContact O-N 3.47Å; L884-I888 HydrophobicContact CD2-CD1 4.12Å; L884-I888 WeakPolarHBondContact O-CB 3.47Å; L884-I888 VanDerWaalsContact O-CG1 3.23Å; L884-I888 WeakPolarHBondContact O-CG1 3.08Å; L884-I888 PolarHBondContact O-N 3.49Å
885	K	79.8	Confident	75.9	Confident	95 Å²	95	78.8 Å²	78.8	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-49.1	176	-77	-174.8	177.4	178.5	0	112.1	L282 I881 N882 K887 I888 S889	L282-K885 HydrophobicContact CD1-CB 4.44Å; L282-K885 HydrophobicContact CD1-CG 3.43Å; L282-K885 VanDerWaalsContact CD1-CG 3.43Å; I881-K885 HydrophobicContact CG2-CD 4.12Å; I881-K885 HydrophobicContact CG2-CG 4.32Å; I881-K885 WeakPolarHBondContact O-CG 3.38Å; I881-K885 PolarHBondContact O-N 3.42Å; N882-K885 PolarHBondContact O-N 2.91Å; K885-K887 VanDerWaalsContact C-N 3.31Å; K885-K887 PolarHBondContact O-N 3.24Å; K885-I888 PolarHBondContact O-N 3.24Å; K885-S889 WeakPolarHBondContact O-CB 2.94Å; K885-S889 PolarHBondContact O-N 3.18Å
886	V	79.9	Confident	75.7	Confident	95 Å²	95	72.6 Å²	72.6	58%	0.576	38%	0.377	S	S	*	.	H	α-helix	trans	-60.1	-46.2	176.5	172.1	0	0	0	0	109.6	N882 I888 S889 T890	N882-V886 WeakPolarHBondContact O-CB 3.26Å; N882-V886 VanDerWaalsContact O-CG2 3.29Å; N882-V886 WeakPolarHBondContact O-CG2 2.97Å; N882-V886 PolarHBondContact O-N 3.2Å; V886-I888 PolarHBondContact O-N 3.01Å; V886-S889 PolarHBondContact O-N 3.27Å; V886-T890 WeakPolarHBondContact O-CB 2.99Å; V886-T890 PolarHBondContact O-N 3.49Å; V886-T890 PolarHBondContact O-OG1 3.48Å
887	K	78.4	Confident	75.6	Confident	106 Å²	106	74.8 Å²	74.8	46%	0.461	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-39.5	179.3	-167.6	176.8	-177.5	-173.8	0	113.1	M278 R883 L884 K885 Q891	M278-K887 HydrophobicContact SD-CD 4.2Å; M278-K887 HydrophobicContact SD-CG 4.49Å; R883-K887 WeakPolarHBondContact O-CB 3.49Å; R883-K887 PolarHBondContact O-N 3.01Å; L884-K887 PolarHBondContact O-N 3.47Å; K885-K887 VanDerWaalsContact C-N 3.31Å; K885-K887 PolarHBondContact O-N 3.24Å; K887-Q891 WeakPolarHBondContact O-CB 3.41Å; K887-Q891 VanDerWaalsContact O-CG 3.28Å; K887-Q891 WeakPolarHBondContact O-CG 3.47Å; K887-Q891 PolarHBondContact O-N 3.02Å; K887-Q891 VanDerWaalsContact O-N 3.08Å
888	I	77.3	Confident	75.4	Confident	10 Å²	10	82.8 Å²	82.8	5%	0.051	42%	0.415	C	S	.	.	H	α-helix	trans	-66.1	-48.3	175.8	-72.9	165.3	0	0	0	110.3	M278 H279 L282 L884 K885 V886 Q891 Q892	M278-I888 HydrophobicContact CB-CD1 4.09Å; M278-I888 HydrophobicContact CB-CG1 3.99Å; H279-I888 WeakPolarHBondContact CE1-CG2 3.15Å; L282-I888 HydrophobicContact CB-CD1 4.3Å; L282-I888 HydrophobicContact CD1-CD1 3.97Å; L884-I888 HydrophobicContact CD2-CD1 4.12Å; L884-I888 WeakPolarHBondContact O-CB 3.47Å; L884-I888 VanDerWaalsContact O-CG1 3.23Å; L884-I888 WeakPolarHBondContact O-CG1 3.08Å; L884-I888 PolarHBondContact O-N 3.49Å; K885-I888 PolarHBondContact O-N 3.24Å; V886-I888 PolarHBondContact O-N 3.01Å; I888-Q891 PolarHBondContact O-N 3.37Å; I888-Q892 WeakPolarHBondContact O-CB 3.45Å; I888-Q892 PolarHBondContact O-N 3.19Å
889	S	75.3	Confident	75.3	Confident	53 Å²	53	86.6 Å²	86.6	37%	0.371	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-47.9	179.3	-162.1	0	0	0	0	111.6	K885 V886 Q891 Q892 E893	K885-S889 WeakPolarHBondContact O-CB 2.94Å; K885-S889 PolarHBondContact O-N 3.18Å; V886-S889 PolarHBondContact O-N 3.27Å; S889-Q891 VanDerWaalsContact C-N 3.3Å; S889-Q891 PolarHBondContact O-N 3.19Å; S889-Q892 PolarHBondContact O-N 2.57Å; S889-E893 WeakPolarHBondContact O-CB 3.46Å; S889-E893 WeakPolarHBondContact O-CG 3.3Å; S889-E893 PolarHBondContact O-N 3.11Å
890	T	74.8	Confident	75.3	Confident	59 Å²	59	86.9 Å²	86.9	36%	0.362	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-35.9	178.3	-50.4	0	0	0	0	111.9	V886 Q894	V886-T890 WeakPolarHBondContact O-CB 2.99Å; V886-T890 PolarHBondContact O-N 3.49Å; V886-T890 PolarHBondContact O-OG1 3.48Å; T890-Q894 WeakPolarHBondContact O-CB 3.42Å; T890-Q894 WeakPolarHBondContact O-CG 3.48Å; T890-Q894 PolarHBondContact O-N 3.48Å
891	Q	69.1	Low	75.4	Confident	44 Å²	44	84.7 Å²	84.7	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-76.2	-33.9	177.1	-76	-173.4	-27.9	0	0	113	L275 K887 I888 S889 Q895	L275-Q891 HydrophobicContact CD2-CB 3.73Å; K887-Q891 WeakPolarHBondContact O-CB 3.41Å; K887-Q891 VanDerWaalsContact O-CG 3.28Å; K887-Q891 WeakPolarHBondContact O-CG 3.47Å; K887-Q891 PolarHBondContact O-N 3.02Å; K887-Q891 VanDerWaalsContact O-N 3.08Å; I888-Q891 PolarHBondContact O-N 3.37Å; S889-Q891 VanDerWaalsContact C-N 3.3Å; S889-Q891 PolarHBondContact O-N 3.19Å; Q891-Q895 WeakPolarHBondContact O-CB 3.47Å; Q891-Q895 VanDerWaalsContact O-CG 3.27Å; Q891-Q895 WeakPolarHBondContact O-CG 3.28Å; Q891-Q895 PolarHBondContact O-N 2.69Å; Q891-Q895 VanDerWaalsContact O-N 3.11Å
892	Q	68.4	Low	75.5	Confident	101 Å²	101	86.3 Å²	86.3	47%	0.472	42%	0.424	S	S	.	.	H	α-helix	trans	-67.4	-44.5	173.8	-87.9	172.8	-31.6	0	0	111.9	H279 I888 S889 Q894 Q895 G896	H279-Q892 PolarHBondContact NE2-NE2 3Å; I888-Q892 WeakPolarHBondContact O-CB 3.45Å; I888-Q892 PolarHBondContact O-N 3.19Å; S889-Q892 PolarHBondContact O-N 2.57Å; Q892-Q894 VanDerWaalsContact C-N 3.26Å; Q892-Q894 PolarHBondContact O-N 3.07Å; Q892-Q895 PolarHBondContact O-N 2.85Å; Q892-G896 PolarHBondContact O-N 2.99Å
893	E	69.7	Low	75.8	Confident	152 Å²	152	89.1 Å²	89.1	71%	0.71	43%	0.429	S	S	*	.	H	α-helix	trans	-62.8	-32.5	176.2	-75.6	171.5	-165.4	0	0	112.6	S889	S889-E893 WeakPolarHBondContact O-CB 3.46Å; S889-E893 WeakPolarHBondContact O-CG 3.3Å; S889-E893 PolarHBondContact O-N 3.11Å
894	Q	66.9	Low	76	Confident	149 Å²	149	82.2 Å²	82.2	70%	0.696	41%	0.406	S	S	*	.	H	α-helix	trans	-81.9	-28.4	180	-75.3	175.8	4.8	0	0	114.3	T890 Q892	T890-Q894 WeakPolarHBondContact O-CB 3.42Å; T890-Q894 WeakPolarHBondContact O-CG 3.48Å; T890-Q894 PolarHBondContact O-N 3.48Å; Q892-Q894 VanDerWaalsContact C-N 3.26Å; Q892-Q894 PolarHBondContact O-N 3.07Å
895	Q	65.2	Low	76.4	Confident	50 Å²	50	82.8 Å²	82.8	23%	0.234	41%	0.407	C	S	.	.	H	α-helix	trans	-93.2	-27.1	-170.6	-71.8	-176.3	11.8	0	0	113.8	S271 Q891 Q892 I901	S271-Q895 PolarHBondContact OG-NE2 2.86Å; Q891-Q895 WeakPolarHBondContact O-CB 3.47Å; Q891-Q895 VanDerWaalsContact O-CG 3.27Å; Q891-Q895 WeakPolarHBondContact O-CG 3.28Å; Q891-Q895 PolarHBondContact O-N 2.69Å; Q891-Q895 VanDerWaalsContact O-N 3.11Å; Q892-Q895 PolarHBondContact O-N 2.85Å; Q895-I901 HydrophobicContact CB-CD1 4.4Å; Q895-I901 VanDerWaalsContact O-CD1 3.3Å; Q895-I901 WeakPolarHBondContact O-CD1 3.42Å
896	G	66.8	Low	76.8	Confident	52 Å²	52	83.1 Å²	83.1	54%	0.536	41%	0.409	S	S	.	.			trans	82.3	-166.6	-178.7	0	0	0	0	0	113.3	Q892	Q892-G896 PolarHBondContact O-N 2.99Å
897	D	74.8	Confident	77.3	Confident	100 Å²	100	83.6 Å²	83.6	54%	0.535	41%	0.405	S	S	.	.			trans	-69.3	135.9	-174	-175.4	20.6	0	0	0	112.9	E900 I901	D897-E900 HydrophobicContact CB-CB 3.97Å; D897-E900 WeakPolarHBondContact O-CB 3.48Å; D897-I901 WeakPolarHBondContact O-CD1 3.5Å; D897-I901 VanDerWaalsContact O-CG1 3.3Å; D897-I901 WeakPolarHBondContact O-CG1 3.46Å; D897-I901 PolarHBondContact O-N 3.39Å
898	R	73.4	Confident	77.9	Confident	167 Å²	167	79.5 Å²	79.5	63%	0.63	39%	0.391	S	S	*	.	H	α-helix	trans	-66.9	-42.5	-173.8	179.6	176.7	173.1	158.2	-2.1	111.6	L272 I901 V902	L272-R898 HydrophobicContact CD1-CG 4.28Å; L272-R898 HydrophobicContact CD2-CG 4.39Å; R898-I901 PolarHBondContact O-N 3.04Å; R898-V902 WeakPolarHBondContact O-CG2 3.32Å; R898-V902 PolarHBondContact O-N 3.27Å
899	E	76.7	Confident	78.5	Confident	158 Å²	158	80.5 Å²	80.5	74%	0.738	40%	0.397	S	S	*	.	H	α-helix	trans	-68.1	-39.6	-178.7	-68.2	-172.2	169.4	0	0	111.4	I901 V902 R903	E899-I901 PolarHBondContact O-N 3.41Å; E899-V902 PolarHBondContact O-N 3.36Å; E899-R903 WeakPolarHBondContact O-CB 3.33Å; E899-R903 PolarHBondContact O-N 2.88Å
900	E	79.6	Confident	79.3	Confident	75 Å²	75	83.9 Å²	83.9	35%	0.35	41%	0.407	S	S	.	.	H	α-helix	trans	-58.1	-44.8	175.4	-173.5	79.8	-132.9	0	0	112	D897 R903 Q904	D897-E900 HydrophobicContact CB-CB 3.97Å; D897-E900 WeakPolarHBondContact O-CB 3.48Å; E900-R903 VanDerWaalsContact CD-NH2 3.3Å; E900-R903 PolarHBondContact O-N 3.42Å; E900-R903 IonicContact OE1-CZ 3.96Å; E900-R903 IonicContact OE1-NH2 2.98Å; E900-R903 PolarHBondContact OE1-NH2 3.36Å; E900-R903 IonicContact OE2-NH2 3.93Å; E900-R903 PolarHBondContact OE2-NH2 3.45Å; E900-Q904 WeakPolarHBondContact O-CB 3.47Å; E900-Q904 WeakPolarHBondContact O-CG 3.45Å; E900-Q904 PolarHBondContact O-N 2.95Å; E900-Q904 PolarHBondContact OE1-NE2 3.42Å
901	I	81.8	Confident	80	Confident	12 Å²	12	83.8 Å²	83.8	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-65.9	-43	179.1	-64.3	161.3	0	0	0	111.5	R268 L272 Q895 D897 R898 E899 Q904 Y905	R268-I901 HydrophobicContact CB-CG2 4.34Å; L272-I901 HydrophobicContact CD1-CB 4.02Å; L272-I901 HydrophobicContact CD1-CD1 4.06Å; L272-I901 HydrophobicContact CD1-CG2 3.73Å; L272-I901 HydrophobicContact CD2-CD1 4.09Å; L272-I901 HydrophobicContact CG-CD1 4.36Å; Q895-I901 HydrophobicContact CB-CD1 4.4Å; Q895-I901 VanDerWaalsContact O-CD1 3.3Å; Q895-I901 WeakPolarHBondContact O-CD1 3.42Å; D897-I901 WeakPolarHBondContact O-CD1 3.5Å; D897-I901 VanDerWaalsContact O-CG1 3.3Å; D897-I901 WeakPolarHBondContact O-CG1 3.46Å; D897-I901 PolarHBondContact O-N 3.39Å; R898-I901 PolarHBondContact O-N 3.04Å; E899-I901 PolarHBondContact O-N 3.41Å; I901-Q904 PolarHBondContact O-N 3.08Å; I901-Y905 WeakPolarHBondContact O-CB 3.38Å; I901-Y905 PolarHBondContact O-N 3.1Å
902	V	84.6	Confident	81.1	Confident	43 Å²	43	84 Å²	84	26%	0.261	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-45.7	178.8	175.9	0	0	0	0	110.2	Y269 R898 E899 Y905 H906	Y269-V902 HydrophobicContact CD2-CG2 3.92Å; Y269-V902 HydrophobicContact CE2-CG2 3.77Å; R898-V902 WeakPolarHBondContact O-CG2 3.32Å; R898-V902 PolarHBondContact O-N 3.27Å; E899-V902 PolarHBondContact O-N 3.36Å; V902-Y905 PolarHBondContact O-N 3.35Å; V902-H906 PolarHBondContact O-CD2 3.19Å; V902-H906 PolarHBondContact O-N 3.22Å; V902-H906 VanDerWaalsContact O-N 3.09Å
903	R	87.1	Confident	82.2	Confident	129 Å²	129	84.7 Å²	84.7	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-58.1	-51.5	175.5	-176.5	-178.3	66.8	175.7	-1.7	111.5	E899 E900 Y905 H906 E907	E899-R903 WeakPolarHBondContact O-CB 3.33Å; E899-R903 PolarHBondContact O-N 2.88Å; E900-R903 VanDerWaalsContact CD-NH2 3.3Å; E900-R903 PolarHBondContact O-N 3.42Å; E900-R903 IonicContact OE1-CZ 3.96Å; E900-R903 IonicContact OE1-NH2 2.98Å; E900-R903 PolarHBondContact OE1-NH2 3.36Å; E900-R903 IonicContact OE2-NH2 3.93Å; E900-R903 PolarHBondContact OE2-NH2 3.45Å; R903-Y905 VanDerWaalsContact C-N 3.27Å; R903-Y905 PolarHBondContact O-N 2.97Å; R903-H906 PolarHBondContact O-N 3.46Å; R903-H906 VanDerWaalsContact O-N 3.13Å; R903-E907 HydrophobicContact CG-CG 4.39Å; R903-E907 WeakPolarHBondContact CG-OE1 3.34Å; R903-E907 IonicContact NE-OE1 3.96Å; R903-E907 WeakPolarHBondContact O-CG 3.28Å; R903-E907 PolarHBondContact O-N 2.96Å
904	Q	85.7	Confident	83.3	Confident	55 Å²	55	81.4 Å²	81.4	26%	0.257	40%	0.396	S	S	.	.	H	α-helix	trans	-62	-33.6	-178.9	-72.4	176.3	14.7	0	0	112.8	K265 E900 I901 A908	K265-Q904 HydrophobicContact CD-CB 4.3Å; E900-Q904 WeakPolarHBondContact O-CB 3.47Å; E900-Q904 WeakPolarHBondContact O-CG 3.45Å; E900-Q904 PolarHBondContact O-N 2.95Å; E900-Q904 PolarHBondContact OE1-NE2 3.42Å; I901-Q904 PolarHBondContact O-N 3.08Å; Q904-A908 VanDerWaalsContact O-CB 3.27Å; Q904-A908 WeakPolarHBondContact O-CB 3.41Å; Q904-A908 PolarHBondContact O-N 3.2Å; Q904-A908 VanDerWaalsContact O-N 3.08Å
905	Y	89.4	Confident	84.3	Confident	34 Å²	34	76.3 Å²	76.3	13%	0.133	37%	0.373	C	S	.	.	H	α-helix	trans	-65.2	-48.1	173	166.9	-104.3	0	0	0	111.8	Y262 E266 Y269 I901 V902 R903 A908 L909	Y262-Y905 HydrophobicContact CD2-CE2 4.25Å; Y262-Y905 AromaticContact CE2-CE2 3.68Å; Y262-Y905 HydrophobicContact CE2-CE2 3.68Å; E266-Y905 HydrophobicContact CB-CD2 4.17Å; E266-Y905 HydrophobicContact CB-CE2 3.78Å; E266-Y905 HydrophobicContact CG-CE2 3.88Å; Y269-Y905 HydrophobicContact CG-CD1 4.49Å; I901-Y905 WeakPolarHBondContact O-CB 3.38Å; I901-Y905 PolarHBondContact O-N 3.1Å; V902-Y905 PolarHBondContact O-N 3.35Å; R903-Y905 VanDerWaalsContact C-N 3.27Å; R903-Y905 PolarHBondContact O-N 2.97Å; Y905-A908 PolarHBondContact O-N 3.43Å; Y905-L909 HydrophobicContact CE1-CD2 4.43Å; Y905-L909 WeakPolarHBondContact O-CB 3.33Å; Y905-L909 PolarHBondContact O-N 3.37Å
906	H	88.3	Confident	85.6	Confident	101 Å²	101	74.7 Å²	74.7	47%	0.468	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-43.6	179.5	-79.5	-68.1	0	0	0	112.2	V902 R903 A908 L909 E910	V902-H906 PolarHBondContact O-CD2 3.19Å; V902-H906 PolarHBondContact O-N 3.22Å; V902-H906 VanDerWaalsContact O-N 3.09Å; R903-H906 PolarHBondContact O-N 3.46Å; R903-H906 VanDerWaalsContact O-N 3.13Å; H906-A908 PolarHBondContact O-N 2.85Å; H906-L909 PolarHBondContact O-N 2.94Å; H906-E910 WeakPolarHBondContact O-CB 3.36Å; H906-E910 PolarHBondContact O-N 2.95Å
907	E	90.6	Very high	86.7	Confident	106 Å²	106	78.6 Å²	78.6	50%	0.495	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-44.9	175.2	-73.2	174.7	-176.2	0	0	111.8	R903 E910 S911	R903-E907 HydrophobicContact CG-CG 4.39Å; R903-E907 WeakPolarHBondContact CG-OE1 3.34Å; R903-E907 IonicContact NE-OE1 3.96Å; R903-E907 WeakPolarHBondContact O-CG 3.28Å; R903-E907 PolarHBondContact O-N 2.96Å; E907-E910 PolarHBondContact O-N 3.15Å; E907-S911 VanDerWaalsContact O-CB 3.3Å; E907-S911 WeakPolarHBondContact O-CB 3.47Å; E907-S911 PolarHBondContact O-N 2.92Å
908	A	90.1	Very high	87.4	Confident	20 Å²	20	79 Å²	79	17%	0.165	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-39.5	177.9	0	0	0	0	0	112.4	Q904 Y905 H906 Y912	Q904-A908 VanDerWaalsContact O-CB 3.27Å; Q904-A908 WeakPolarHBondContact O-CB 3.41Å; Q904-A908 PolarHBondContact O-N 3.2Å; Q904-A908 VanDerWaalsContact O-N 3.08Å; Y905-A908 PolarHBondContact O-N 3.43Å; H906-A908 PolarHBondContact O-N 2.85Å; A908-Y912 WeakPolarHBondContact O-CB 3.38Å; A908-Y912 PolarHBondContact O-N 2.83Å
909	L	91.3	Very high	88.2	Confident	31 Å²	31	72.9 Å²	72.9	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-64.7	-44.9	176.6	175.6	63.6	0	0	0	111.8	Y262 Y905 H906 K913	Y262-L909 HydrophobicContact CD2-CB 4.14Å; Y262-L909 HydrophobicContact CD2-CD1 4.07Å; Y262-L909 HydrophobicContact CE2-CB 4.24Å; Y262-L909 HydrophobicContact CE2-CD1 3.61Å; Y262-L909 HydrophobicContact CE2-CG 4.45Å; Y905-L909 HydrophobicContact CE1-CD2 4.43Å; Y905-L909 WeakPolarHBondContact O-CB 3.33Å; Y905-L909 PolarHBondContact O-N 3.37Å; H906-L909 PolarHBondContact O-N 2.94Å; L909-K913 HydrophobicContact CD1-CD 4.29Å; L909-K913 HydrophobicContact CD1-CG 4.4Å; L909-K913 HydrophobicContact CG-CD 4.32Å; L909-K913 WeakPolarHBondContact O-CB 3.44Å; L909-K913 WeakPolarHBondContact O-CG 3.35Å; L909-K913 PolarHBondContact O-N 3.47Å
910	E	91.3	Very high	88.8	Confident	124 Å²	124	73.4 Å²	73.4	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-67.6	-44.3	-179.6	-169.1	168.6	-161.3	0	0	111.4	H906 E907 Y912 K913 N914	H906-E910 WeakPolarHBondContact O-CB 3.36Å; H906-E910 PolarHBondContact O-N 2.95Å; E907-E910 PolarHBondContact O-N 3.15Å; E910-Y912 PolarHBondContact O-N 3.31Å; E910-K913 PolarHBondContact O-N 2.86Å; E910-N914 WeakPolarHBondContact O-CB 3.23Å; E910-N914 PolarHBondContact O-N 2.99Å
911	S	89.6	Confident	89.3	Confident	56 Å²	56	72.8 Å²	72.8	39%	0.392	35%	0.348	S	S	.	.	H	α-helix	trans	-58	-46.6	174.4	-172.3	0	0	0	0	112.1	E907 M915	E907-S911 VanDerWaalsContact O-CB 3.3Å; E907-S911 WeakPolarHBondContact O-CB 3.47Å; E907-S911 PolarHBondContact O-N 2.92Å; S911-M915 WeakPolarHBondContact O-CB 3.49Å; S911-M915 PolarHBondContact O-N 3.26Å; S911-M915 VanDerWaalsContact O-N 3.1Å
912	Y	92.6	Very high	89.7	Confident	48 Å²	48	75 Å²	75	19%	0.188	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-44.1	176.3	172.7	-107.2	0	0	0	112.5	L255 L258 K259 A908 E910 S916	L255-Y912 HydrophobicContact CD1-CD2 4.3Å; L255-Y912 HydrophobicContact CD1-CE2 4.19Å; L255-Y912 HydrophobicContact CD2-CE2 4.21Å; L255-Y912 HydrophobicContact CG-CD2 4.32Å; L255-Y912 HydrophobicContact CG-CE2 3.91Å; L258-Y912 HydrophobicContact CB-CD2 4.42Å; K259-Y912 HydrophobicContact CB-CD2 4.08Å; K259-Y912 HydrophobicContact CB-CE2 3.69Å; K259-Y912 HydrophobicContact CD-CE2 4.36Å; K259-Y912 HydrophobicContact CG-CE2 4.02Å; A908-Y912 WeakPolarHBondContact O-CB 3.38Å; A908-Y912 PolarHBondContact O-N 2.83Å; E910-Y912 PolarHBondContact O-N 3.31Å; Y912-S916 WeakPolarHBondContact O-CB 3.39Å; Y912-S916 PolarHBondContact O-N 2.78Å
913	K	91.7	Very high	90	Very high	117 Å²	117	75.9 Å²	75.9	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-48.1	178.7	-81.6	178.7	175.9	174.2	0	112	L909 E910 S916 Q917	L909-K913 HydrophobicContact CD1-CD 4.29Å; L909-K913 HydrophobicContact CD1-CG 4.4Å; L909-K913 HydrophobicContact CG-CD 4.32Å; L909-K913 WeakPolarHBondContact O-CB 3.44Å; L909-K913 WeakPolarHBondContact O-CG 3.35Å; L909-K913 PolarHBondContact O-N 3.47Å; E910-K913 PolarHBondContact O-N 2.86Å; K913-S916 PolarHBondContact O-N 3.29Å; K913-Q917 WeakPolarHBondContact O-CB 3.37Å; K913-Q917 PolarHBondContact O-N 3.02Å
914	N	91.8	Very high	90.2	Very high	83 Å²	83	72.9 Å²	72.9	44%	0.444	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-48.9	-179.6	-75.1	-16.6	0	0	0	111.1	E910 S916 Q917 Q918	E910-N914 WeakPolarHBondContact O-CB 3.23Å; E910-N914 PolarHBondContact O-N 2.99Å; N914-S916 PolarHBondContact O-N 3.41Å; N914-Q917 PolarHBondContact O-N 3.2Å; N914-Q918 WeakPolarHBondContact O-CG 3.42Å; N914-Q918 PolarHBondContact O-N 3.23Å
915	M	89.3	Confident	90.4	Very high	42 Å²	42	76 Å²	76	21%	0.207	38%	0.375	C	S	.	.	H	α-helix	trans	-64.7	-39.2	177.8	-171.2	60.3	69.7	0	0	112.1	L255 L258 S911 Q917 Q918 M919	L255-M915 HydrophobicContact CD1-CB 3.95Å; L255-M915 HydrophobicContact CD1-CG 3.74Å; L258-M915 HydrophobicContact CD1-CB 4.23Å; L258-M915 HydrophobicContact CD1-CG 4.26Å; S911-M915 WeakPolarHBondContact O-CB 3.49Å; S911-M915 PolarHBondContact O-N 3.26Å; S911-M915 VanDerWaalsContact O-N 3.1Å; M915-Q917 VanDerWaalsContact C-N 3.32Å; M915-Q917 PolarHBondContact O-N 3.43Å; M915-Q918 PolarHBondContact O-N 2.99Å; M915-M919 WeakPolarHBondContact O-CB 3.4Å; M915-M919 PolarHBondContact O-N 2.9Å
916	S	91.4	Very high	90.5	Very high	15 Å²	15	75 Å²	75	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-38	175.9	-179.8	0	0	0	0	112.6	Y912 K913 N914 R920	Y912-S916 WeakPolarHBondContact O-CB 3.39Å; Y912-S916 PolarHBondContact O-N 2.78Å; K913-S916 PolarHBondContact O-N 3.29Å; N914-S916 PolarHBondContact O-N 3.41Å; S916-R920 PolarHBondContact O-N 2.87Å; S916-R920 VanDerWaalsContact O-N 3.11Å; S916-R920 PolarHBondContact O-NE 3.47Å; S916-R920 PolarHBondContact OG-NH2 3.02Å
917	Q	90.9	Very high	90.7	Very high	134 Å²	134	79.1 Å²	79.1	63%	0.626	38%	0.383	S	S	*	.	H	α-helix	trans	-70.9	-43.9	177	-174.4	172.5	-5.9	0	0	111.3	K913 N914 M915 M919 R920 S921	K913-Q917 WeakPolarHBondContact O-CB 3.37Å; K913-Q917 PolarHBondContact O-N 3.02Å; N914-Q917 PolarHBondContact O-N 3.2Å; M915-Q917 VanDerWaalsContact C-N 3.32Å; M915-Q917 PolarHBondContact O-N 3.43Å; Q917-M919 VanDerWaalsContact C-N 3.34Å; Q917-M919 PolarHBondContact O-N 3.33Å; Q917-R920 PolarHBondContact O-N 3.44Å; Q917-S921 PolarHBondContact O-N 3.47Å
918	Q	88.9	Confident	90.8	Very high	109 Å²	109	77.5 Å²	77.5	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-47.3	173.9	-74	178.3	-8	0	0	111.1	N914 M915 R920 S921 L922	N914-Q918 WeakPolarHBondContact O-CG 3.42Å; N914-Q918 PolarHBondContact O-N 3.23Å; M915-Q918 PolarHBondContact O-N 2.99Å; Q918-R920 VanDerWaalsContact C-N 3.32Å; Q918-R920 PolarHBondContact O-N 3.23Å; Q918-S921 PolarHBondContact O-N 2.71Å; Q918-S921 VanDerWaalsContact O-N 3.12Å; Q918-S921 PolarHBondContact O-OG 3Å; Q918-L922 PolarHBondContact O-N 3.44Å
919	M	90.3	Very high	90.8	Very high	39 Å²	39	78.3 Å²	78.3	19%	0.192	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-37.4	178.4	-166.6	179.7	-178.4	0	0	112.6	V248 L255 M915 Q917 N923	V248-M919 HydrophobicContact CG1-CE 4.13Å; V248-M919 HydrophobicContact CG1-CG 4.46Å; L255-M919 HydrophobicContact CB-SD 4.44Å; L255-M919 HydrophobicContact CD2-SD 4.07Å; M915-M919 WeakPolarHBondContact O-CB 3.4Å; M915-M919 PolarHBondContact O-N 2.9Å; Q917-M919 VanDerWaalsContact C-N 3.34Å; Q917-M919 PolarHBondContact O-N 3.33Å; M919-N923 WeakPolarHBondContact O-CB 3.42Å; M919-N923 PolarHBondContact O-N 3.15Å; M919-N923 PolarHBondContact O-ND2 3.42Å
920	R	89.8	Confident	90.8	Very high	168 Å²	168	79.7 Å²	79.7	63%	0.634	39%	0.393	S	S	*	.	H	α-helix	trans	-64.9	-44	173.1	-83.8	-178.9	-97.6	173.4	-10.3	112	S916 Q917 Q918 N923 S924	S916-R920 PolarHBondContact O-N 2.87Å; S916-R920 VanDerWaalsContact O-N 3.11Å; S916-R920 PolarHBondContact O-NE 3.47Å; S916-R920 PolarHBondContact OG-NH2 3.02Å; Q917-R920 PolarHBondContact O-N 3.44Å; Q918-R920 VanDerWaalsContact C-N 3.32Å; Q918-R920 PolarHBondContact O-N 3.23Å; R920-N923 PolarHBondContact O-N 3.02Å; R920-S924 PolarHBondContact O-N 3.27Å; R920-S924 PolarHBondContact O-OG 3.26Å
921	S	90.2	Very high	90.9	Very high	63 Å²	63	78.5 Å²	78.5	44%	0.441	39%	0.394	S	S	.	.	H	α-helix	trans	-63.6	-44.3	178.6	70.5	0	0	0	0	112.1	Q917 Q918 S924 F925	Q917-S921 PolarHBondContact O-N 3.47Å; Q918-S921 PolarHBondContact O-N 2.71Å; Q918-S921 VanDerWaalsContact O-N 3.12Å; Q918-S921 PolarHBondContact O-OG 3Å; S921-S924 PolarHBondContact O-N 3.25Å; S921-S924 PolarHBondContact O-OG 3.45Å; S921-F925 PolarHBondContact O-N 3.15Å
922	L	89.4	Confident	91	Very high	59 Å²	59	79.1 Å²	79.1	31%	0.309	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-44.2	176.7	-73.1	171.3	0	0	0	112.1	V248 Q918 S924 F925 I926	V248-L922 HydrophobicContact CG2-CB 3.79Å; V248-L922 HydrophobicContact CG2-CD1 4.13Å; Q918-L922 PolarHBondContact O-N 3.44Å; L922-S924 VanDerWaalsContact C-N 3.31Å; L922-S924 PolarHBondContact O-N 3.36Å; L922-F925 PolarHBondContact O-N 3Å; L922-I926 WeakPolarHBondContact O-CG1 3.38Å; L922-I926 PolarHBondContact O-N 3.32Å
923	N	90.6	Very high	90.9	Very high	60 Å²	60	77.7 Å²	77.7	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-38.5	175.4	-84.5	-62.3	0	0	0	112.4	M919 R920 R927	M919-N923 WeakPolarHBondContact O-CB 3.42Å; M919-N923 PolarHBondContact O-N 3.15Å; M919-N923 PolarHBondContact O-ND2 3.42Å; R920-N923 PolarHBondContact O-N 3.02Å; N923-R927 WeakPolarHBondContact O-CG 3.11Å; N923-R927 PolarHBondContact O-N 3.45Å
924	S	90.7	Very high	90.9	Very high	66 Å²	66	76.4 Å²	76.4	46%	0.462	39%	0.389	S	S	.	.	H	α-helix	trans	-65.7	-41.5	174.6	70.4	0	0	0	0	112	R920 S921 L922 R927 S928	R920-S924 PolarHBondContact O-N 3.27Å; R920-S924 PolarHBondContact O-OG 3.26Å; S921-S924 PolarHBondContact O-N 3.25Å; S921-S924 PolarHBondContact O-OG 3.45Å; L922-S924 VanDerWaalsContact C-N 3.31Å; L922-S924 PolarHBondContact O-N 3.36Å; S924-R927 PolarHBondContact O-N 3.17Å; S924-S928 PolarHBondContact O-N 3.1Å; S924-S928 PolarHBondContact O-OG 3.49Å
925	F	90.4	Very high	91	Very high	120 Å²	120	79.9 Å²	79.9	53%	0.526	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-45	176.6	176.7	-102.4	0	0	0	112	S921 L922 R927 S928 L929	S921-F925 PolarHBondContact O-N 3.15Å; L922-F925 PolarHBondContact O-N 3Å; F925-R927 VanDerWaalsContact C-N 3.33Å; F925-R927 PolarHBondContact O-N 3.25Å; F925-S928 PolarHBondContact O-N 3.23Å; F925-L929 HydrophobicContact CE1-CD2 4.29Å; F925-L929 VanDerWaalsContact O-CB 3.32Å; F925-L929 WeakPolarHBondContact O-CB 3.4Å; F925-L929 PolarHBondContact O-N 2.97Å
926	I	92.1	Very high	91.1	Very high	13 Å²	13	84.1 Å²	84.1	7%	0.067	41%	0.411	C	S	.	.	H	α-helix	trans	-59.5	-43.7	177.3	-70	164.6	0	0	0	111	T244 E245 V248 L922 L929 D930	T244-I926 HydrophobicContact CG2-CD1 4.2Å; T244-I926 HydrophobicContact CG2-CG1 4.32Å; E245-I926 HydrophobicContact CG-CD1 3.92Å; E245-I926 HydrophobicContact CG-CG1 4.48Å; E245-I926 HydrophobicContact CG-CG2 3.96Å; E245-I926 WeakPolarHBondContact OE1-CG2 3.43Å; V248-I926 HydrophobicContact CB-CD1 4.45Å; V248-I926 HydrophobicContact CG2-CD1 3.8Å; L922-I926 WeakPolarHBondContact O-CG1 3.38Å; L922-I926 PolarHBondContact O-N 3.32Å; I926-L929 PolarHBondContact O-N 3.36Å; I926-D930 WeakPolarHBondContact O-CB 3.49Å; I926-D930 PolarHBondContact O-N 3.27Å
927	R	91.8	Very high	91.1	Very high	188 Å²	188	87.3 Å²	87.3	71%	0.709	43%	0.426	S	S	*	.	H	α-helix	trans	-64	-44	177.4	-71.7	176.9	-178.4	-166.3	-0.6	112.3	N923 S924 F925 D930 T931	N923-R927 WeakPolarHBondContact O-CG 3.11Å; N923-R927 PolarHBondContact O-N 3.45Å; S924-R927 PolarHBondContact O-N 3.17Å; F925-R927 VanDerWaalsContact C-N 3.33Å; F925-R927 PolarHBondContact O-N 3.25Å; R927-D930 PolarHBondContact O-N 3.4Å; R927-T931 PolarHBondContact O-N 2.93Å; R927-T931 PolarHBondContact O-OG1 2.93Å
928	S	92.7	Very high	91.1	Very high	72 Å²	72	86.8 Å²	86.8	50%	0.503	42%	0.424	S	S	.	.	H	α-helix	trans	-63	-43.2	175.2	-65.3	0	0	0	0	111.5	S924 F925 D930 T931 V932	S924-S928 PolarHBondContact O-N 3.1Å; S924-S928 PolarHBondContact O-OG 3.49Å; F925-S928 PolarHBondContact O-N 3.23Å; S928-D930 VanDerWaalsContact C-N 3.35Å; S928-D930 PolarHBondContact O-N 3.45Å; S928-T931 PolarHBondContact O-N 3.06Å; S928-V932 WeakPolarHBondContact O-CG2 3.48Å; S928-V932 PolarHBondContact O-N 2.8Å
929	L	90.6	Very high	91.3	Very high	37 Å²	37	84.4 Å²	84.4	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-61.1	-43.8	177	-175.2	64.6	0	0	0	111.2	I237 K241 F925 I926 V932 M933	I237-L929 HydrophobicContact CG2-CD1 3.89Å; I237-L929 HydrophobicContact CG2-CD2 4.23Å; I237-L929 HydrophobicContact CG2-CG 4.32Å; K241-L929 HydrophobicContact CB-CD2 4.03Å; K241-L929 HydrophobicContact CG-CD2 4.17Å; F925-L929 HydrophobicContact CE1-CD2 4.29Å; F925-L929 VanDerWaalsContact O-CB 3.32Å; F925-L929 WeakPolarHBondContact O-CB 3.4Å; F925-L929 PolarHBondContact O-N 2.97Å; I926-L929 PolarHBondContact O-N 3.36Å; L929-V932 PolarHBondContact O-N 3.15Å; L929-M933 HydrophobicContact CD1-CG 4.29Å; L929-M933 HydrophobicContact CG-CG 4.32Å; L929-M933 VanDerWaalsContact O-CB 3.24Å; L929-M933 WeakPolarHBondContact O-CB 3.4Å; L929-M933 WeakPolarHBondContact O-CG 3.32Å; L929-M933 PolarHBondContact O-N 2.94Å
930	D	90.8	Very high	91.4	Very high	61 Å²	61	83.6 Å²	83.6	33%	0.326	41%	0.411	S	S	.	.	H	α-helix	trans	-61.8	-45.6	178.1	-162.6	66.5	0	0	0	112	K241 I926 R927 S928 V932 M933 N934	K241-D930 WeakPolarHBondContact CE-OD1 3.26Å; K241-D930 IonicContact NZ-OD1 3.02Å; K241-D930 PolarHBondContact NZ-OD1 3.35Å; I926-D930 WeakPolarHBondContact O-CB 3.49Å; I926-D930 PolarHBondContact O-N 3.27Å; R927-D930 PolarHBondContact O-N 3.4Å; S928-D930 VanDerWaalsContact C-N 3.35Å; S928-D930 PolarHBondContact O-N 3.45Å; D930-V932 PolarHBondContact O-N 3.21Å; D930-M933 PolarHBondContact O-N 3.46Å; D930-N934 VanDerWaalsContact O-CG 3.26Å; D930-N934 PolarHBondContact O-N 3.21Å; D930-N934 PolarHBondContact O-ND2 3.42Å; D930-N934 VanDerWaalsContact O-ND2 3.16Å; D930-N934 PolarHBondContact OD2-ND2 2.92Å
931	T	92.6	Very high	91.5	Very high	99 Å²	99	77 Å²	77	61%	0.607	39%	0.393	S	S	*	.	H	α-helix	trans	-60.3	-47.4	177.5	-51.3	0	0	0	0	111.3	R927 S928 Y935	R927-T931 PolarHBondContact O-N 2.93Å; R927-T931 PolarHBondContact O-OG1 2.93Å; S928-T931 PolarHBondContact O-N 3.06Å; T931-Y935 PolarHBondContact O-N 3.04Å
932	V	91.9	Very high	91.5	Very high	69 Å²	69	77.9 Å²	77.9	42%	0.418	39%	0.393	S	S	.	.	H	α-helix	trans	-66.8	-38.2	178.8	172.6	0	0	0	0	111.3	S928 L929 D930 Y935 R936	S928-V932 WeakPolarHBondContact O-CG2 3.48Å; S928-V932 PolarHBondContact O-N 2.8Å; L929-V932 PolarHBondContact O-N 3.15Å; D930-V932 PolarHBondContact O-N 3.21Å; V932-Y935 PolarHBondContact O-N 3.34Å; V932-R936 HydrophobicContact CG1-CG 4.29Å; V932-R936 WeakPolarHBondContact O-CB 3.39Å; V932-R936 VanDerWaalsContact O-CG 3.32Å; V932-R936 WeakPolarHBondContact O-CG 3.47Å; V932-R936 PolarHBondContact O-N 3.27Å
933	M	92.1	Very high	91.6	Very high	17 Å²	17	78 Å²	78	8%	0.084	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-43.7	178.5	-81.8	-57.7	-54.9	0	0	112.1	F234 I237 L929 D930 Y935 R936 L937	F234-M933 HydrophobicContact CB-CE 3.84Å; F234-M933 HydrophobicContact CD1-CE 3.85Å; F234-M933 HydrophobicContact CD1-SD 4.29Å; F234-M933 HydrophobicContact CG-CE 3.93Å; I237-M933 HydrophobicContact CB-SD 4.15Å; I237-M933 HydrophobicContact CD1-SD 4.21Å; I237-M933 HydrophobicContact CG2-CE 4.5Å; I237-M933 HydrophobicContact CG2-CG 4.01Å; I237-M933 HydrophobicContact CG2-SD 3.58Å; I237-M933 VanDerWaalsContact CG2-SD 3.58Å; L929-M933 HydrophobicContact CD1-CG 4.29Å; L929-M933 HydrophobicContact CG-CG 4.32Å; L929-M933 VanDerWaalsContact O-CB 3.24Å; L929-M933 WeakPolarHBondContact O-CB 3.4Å; L929-M933 WeakPolarHBondContact O-CG 3.32Å; L929-M933 PolarHBondContact O-N 2.94Å; D930-M933 PolarHBondContact O-N 3.46Å; M933-Y935 VanDerWaalsContact C-N 3.33Å; M933-Y935 PolarHBondContact O-N 2.73Å; M933-R936 PolarHBondContact O-N 3.06Å; M933-L937 HydrophobicContact CE-CG 4.5Å; M933-L937 WeakPolarHBondContact O-CB 3.42Å; M933-L937 WeakPolarHBondContact O-CG 3.44Å; M933-L937 PolarHBondContact O-N 3.5Å
934	N	90.9	Very high	91.7	Very high	91 Å²	91	77.8 Å²	77.8	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-60.9	-44.2	176.7	-69.3	-29.7	0	0	0	111.2	D930 L937 Q938	D930-N934 VanDerWaalsContact O-CG 3.26Å; D930-N934 PolarHBondContact O-N 3.21Å; D930-N934 PolarHBondContact O-ND2 3.42Å; D930-N934 VanDerWaalsContact O-ND2 3.16Å; D930-N934 PolarHBondContact OD2-ND2 2.92Å; N934-L937 PolarHBondContact O-N 2.63Å; N934-Q938 PolarHBondContact O-N 2.94Å; N934-Q938 VanDerWaalsContact O-N 3.11Å
935	Y	92.9	Very high	91.7	Very high	155 Å²	155	80.9 Å²	80.9	61%	0.608	39%	0.393	S	S	*	.	H	α-helix	trans	-61.7	-46	174.3	178.7	-105	0	0	0	112.4	T931 V932 M933 L937 Q938 V939	T931-Y935 PolarHBondContact O-N 3.04Å; V932-Y935 PolarHBondContact O-N 3.34Å; M933-Y935 VanDerWaalsContact C-N 3.33Å; M933-Y935 PolarHBondContact O-N 2.73Å; Y935-L937 VanDerWaalsContact C-N 3.34Å; Y935-L937 PolarHBondContact O-N 3.05Å; Y935-Q938 WeakPolarHBondContact O-CB 3.35Å; Y935-Q938 PolarHBondContact O-N 3.34Å; Y935-V939 HydrophobicContact CD1-CG2 4.24Å; Y935-V939 HydrophobicContact CD2-CG2 4.47Å; Y935-V939 HydrophobicContact CE1-CG2 3.79Å; Y935-V939 HydrophobicContact CE2-CG2 4.05Å; Y935-V939 WeakPolarHBondContact O-CG2 3.37Å; Y935-V939 PolarHBondContact O-N 3.34Å
936	R	92.9	Very high	91.7	Very high	132 Å²	132	80.9 Å²	80.9	50%	0.498	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-37.2	178.5	-76.7	179.5	176.5	-128.8	-1	112.9	F234 V932 M933 V939 Y940	F234-R936 HydrophobicContact CE1-CB 4Å; F234-R936 HydrophobicContact CZ-CB 3.87Å; V932-R936 HydrophobicContact CG1-CG 4.29Å; V932-R936 WeakPolarHBondContact O-CB 3.39Å; V932-R936 VanDerWaalsContact O-CG 3.32Å; V932-R936 WeakPolarHBondContact O-CG 3.47Å; V932-R936 PolarHBondContact O-N 3.27Å; M933-R936 PolarHBondContact O-N 3.06Å; R936-V939 PolarHBondContact O-N 2.97Å; R936-Y940 VanDerWaalsContact O-CB 3.24Å; R936-Y940 WeakPolarHBondContact O-CB 3.5Å; R936-Y940 PolarHBondContact O-N 3.16Å
937	L	91	Very high	91.6	Very high	82 Å²	82	81 Å²	81	43%	0.429	39%	0.394	S	S	.	.	H	α-helix	trans	-66.4	-37.9	175.5	-75.8	169.9	0	0	0	112	F234 M933 N934 Y935 Y940 A941	F234-L937 HydrophobicContact CD2-CD2 3.73Å; F234-L937 HydrophobicContact CE2-CD2 4.28Å; F234-L937 HydrophobicContact CG-CD2 4.39Å; M933-L937 HydrophobicContact CE-CG 4.5Å; M933-L937 WeakPolarHBondContact O-CB 3.42Å; M933-L937 WeakPolarHBondContact O-CG 3.44Å; M933-L937 PolarHBondContact O-N 3.5Å; N934-L937 PolarHBondContact O-N 2.63Å; Y935-L937 VanDerWaalsContact C-N 3.34Å; Y935-L937 PolarHBondContact O-N 3.05Å; L937-Y940 PolarHBondContact O-N 3.49Å; L937-A941 PolarHBondContact O-N 2.85Å
938	Q	91.6	Very high	91.6	Very high	122 Å²	122	72.4 Å²	72.4	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-63.9	-51.7	173.5	-174.4	178.2	0.6	0	0	111	N934 Y935 Y940 A941 D942	N934-Q938 PolarHBondContact O-N 2.94Å; N934-Q938 VanDerWaalsContact O-N 3.11Å; Y935-Q938 WeakPolarHBondContact O-CB 3.35Å; Y935-Q938 PolarHBondContact O-N 3.34Å; Q938-Y940 VanDerWaalsContact C-N 3.25Å; Q938-Y940 PolarHBondContact O-N 3.42Å; Q938-A941 WeakPolarHBondContact O-CB 3.38Å; Q938-A941 PolarHBondContact O-N 3.35Å; Q938-D942 PolarHBondContact O-N 3.25Å
939	V	91.8	Very high	91.5	Very high	59 Å²	59	71.9 Å²	71.9	36%	0.358	36%	0.363	S	S	.	.	H	α-helix	trans	-57.6	-39.8	176.7	173.1	0	0	0	0	111.4	Y935 R936 D942 L943	Y935-V939 HydrophobicContact CD1-CG2 4.24Å; Y935-V939 HydrophobicContact CD2-CG2 4.47Å; Y935-V939 HydrophobicContact CE1-CG2 3.79Å; Y935-V939 HydrophobicContact CE2-CG2 4.05Å; Y935-V939 WeakPolarHBondContact O-CG2 3.37Å; Y935-V939 PolarHBondContact O-N 3.34Å; R936-V939 PolarHBondContact O-N 2.97Å; V939-D942 PolarHBondContact O-N 3.1Å; V939-L943 VanDerWaalsContact O-CB 3.24Å; V939-L943 WeakPolarHBondContact O-CB 3.42Å; V939-L943 PolarHBondContact O-N 3.24Å
940	Y	92.9	Very high	91.5	Very high	22 Å²	22	74.5 Å²	74.5	9%	0.086	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-42.4	175.5	169.1	-93.7	0	0	0	112.7	M222 L227 M230 F234 R936 L937 Q938 D942 L943 R944	M222-Y940 WeakPolarHBondContact CE-OH 3.46Å; L227-Y940 HydrophobicContact CB-CE2 3.91Å; L227-Y940 HydrophobicContact CD2-CD2 3.91Å; L227-Y940 HydrophobicContact CD2-CE2 3.74Å; L227-Y940 HydrophobicContact CG-CE2 4.41Å; L227-Y940 WeakPolarHBondContact O-CE2 3.44Å; M230-Y940 HydrophobicContact CB-CD2 4.17Å; M230-Y940 HydrophobicContact CB-CE2 4.27Å; M230-Y940 HydrophobicContact CE-CD2 4.37Å; M230-Y940 HydrophobicContact SD-CD2 4.48Å; F234-Y940 HydrophobicContact CE2-CD2 4.05Å; F234-Y940 AromaticContact CE2-CG 3.92Å; F234-Y940 HydrophobicContact CE2-CG 3.92Å; R936-Y940 VanDerWaalsContact O-CB 3.24Å; R936-Y940 WeakPolarHBondContact O-CB 3.5Å; R936-Y940 PolarHBondContact O-N 3.16Å; L937-Y940 PolarHBondContact O-N 3.49Å; Q938-Y940 VanDerWaalsContact C-N 3.25Å; Q938-Y940 PolarHBondContact O-N 3.42Å; Y940-D942 VanDerWaalsContact C-N 3.33Å; Y940-D942 PolarHBondContact O-N 2.99Å; Y940-L943 PolarHBondContact O-N 3.42Å; Y940-R944 VanDerWaalsContact O-CB 3.28Å; Y940-R944 WeakPolarHBondContact O-CB 3.3Å; Y940-R944 PolarHBondContact O-N 3.46Å
941	A	90.8	Very high	91.4	Very high	31 Å²	31	71.6 Å²	71.6	26%	0.256	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-40.7	176.5	0	0	0	0	0	111.6	L937 Q938 K945	L937-A941 PolarHBondContact O-N 2.85Å; Q938-A941 WeakPolarHBondContact O-CB 3.38Å; Q938-A941 PolarHBondContact O-N 3.35Å; A941-K945 WeakPolarHBondContact O-CG 3.48Å; A941-K945 PolarHBondContact O-N 3.5Å; A941-K945 VanDerWaalsContact O-N 3.12Å
942	D	91.7	Very high	91.3	Very high	80 Å²	80	71 Å²	71	43%	0.428	34%	0.343	S	S	.	.	H	α-helix	trans	-68.6	-44.7	177.7	-65.7	-24.7	0	0	0	111.6	Q938 V939 Y940 R944 K945 F946	Q938-D942 PolarHBondContact O-N 3.25Å; V939-D942 PolarHBondContact O-N 3.1Å; Y940-D942 VanDerWaalsContact C-N 3.33Å; Y940-D942 PolarHBondContact O-N 2.99Å; D942-R944 VanDerWaalsContact C-N 3.35Å; D942-R944 PolarHBondContact O-N 2.96Å; D942-K945 PolarHBondContact O-N 3.4Å; D942-F946 WeakPolarHBondContact O-CB 3.43Å; D942-F946 PolarHBondContact O-N 3.04Å
943	L	90.6	Very high	91.2	Very high	63 Å²	63	75.2 Å²	75.2	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175.4	-174.7	66.2	0	0	0	111.1	L227 M230 V939 Y940 K945 F946 L947	L227-L943 HydrophobicContact CD2-CD2 3.97Å; L227-L943 HydrophobicContact CD2-CG 4.27Å; M230-L943 HydrophobicContact SD-CD2 4.29Å; V939-L943 VanDerWaalsContact O-CB 3.24Å; V939-L943 WeakPolarHBondContact O-CB 3.42Å; V939-L943 PolarHBondContact O-N 3.24Å; Y940-L943 PolarHBondContact O-N 3.42Å; L943-K945 PolarHBondContact O-N 2.96Å; L943-F946 PolarHBondContact O-N 3.06Å; L943-L947 HydrophobicContact CD1-CD1 3.97Å; L943-L947 HydrophobicContact CD1-CD2 4.44Å; L943-L947 HydrophobicContact CD1-CG 3.99Å; L943-L947 HydrophobicContact CD2-CD1 4.33Å; L943-L947 HydrophobicContact CG-CD1 3.73Å; L943-L947 HydrophobicContact CG-CG 4.15Å; L943-L947 WeakPolarHBondContact O-CB 3.48Å; L943-L947 VanDerWaalsContact O-CG 3.24Å; L943-L947 WeakPolarHBondContact O-CG 3.23Å; L943-L947 PolarHBondContact O-N 3.24Å
944	R	92.9	Very high	91	Very high	54 Å²	54	77.8 Å²	77.8	20%	0.204	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-44.2	176.8	-178.2	170.9	68.6	150.1	-0.8	112	Y218 L227 Y940 D942 S948 H972	Y218-R944 PolarHBondContact OH-NH1 3.21Å; L227-R944 HydrophobicContact CD1-CB 3.93Å; L227-R944 HydrophobicContact CD1-CG 3.94Å; Y940-R944 VanDerWaalsContact O-CB 3.28Å; Y940-R944 WeakPolarHBondContact O-CB 3.3Å; Y940-R944 PolarHBondContact O-N 3.46Å; D942-R944 VanDerWaalsContact C-N 3.35Å; D942-R944 PolarHBondContact O-N 2.96Å; R944-S948 WeakPolarHBondContact O-CB 3.4Å; R944-S948 PolarHBondContact O-N 3.36Å; R944-S948 VanDerWaalsContact O-N 3.17Å; R944-S948 PolarHBondContact O-OG 2.9Å; R944-H972 PolarHBondContact NH1-O 3.5Å; R944-H972 VanDerWaalsContact NH1-O 3.13Å
945	K	90.4	Very high	90.8	Very high	131 Å²	131	73.4 Å²	73.4	57%	0.57	34%	0.339	S	S	*	.	H	α-helix	trans	-64.6	-47.1	175.6	-72.3	172.2	-177.2	172.8	0	111.5	A941 D942 L943 S948 A949	A941-K945 WeakPolarHBondContact O-CG 3.48Å; A941-K945 PolarHBondContact O-N 3.5Å; A941-K945 VanDerWaalsContact O-N 3.12Å; D942-K945 PolarHBondContact O-N 3.4Å; L943-K945 PolarHBondContact O-N 2.96Å; K945-S948 PolarHBondContact O-N 3Å; K945-A949 WeakPolarHBondContact O-CB 3.36Å; K945-A949 PolarHBondContact O-N 2.97Å
946	F	91.1	Very high	90.5	Very high	121 Å²	121	68.5 Å²	68.5	53%	0.531	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-48.3	-178.6	179	-99.7	0	0	0	112.2	D942 L943 S948 A949 R950	D942-F946 WeakPolarHBondContact O-CB 3.43Å; D942-F946 PolarHBondContact O-N 3.04Å; L943-F946 PolarHBondContact O-N 3.06Å; F946-S948 VanDerWaalsContact C-N 3.31Å; F946-S948 PolarHBondContact O-N 3.49Å; F946-A949 PolarHBondContact O-N 3.3Å; F946-R950 VanDerWaalsContact O-CB 3.29Å; F946-R950 WeakPolarHBondContact O-CB 3.43Å; F946-R950 PolarHBondContact O-N 3.46Å
947	L	90.6	Very high	90.2	Very high	16 Å²	16	64.5 Å²	64.5	8%	0.084	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-38.2	178.3	-68.8	175.3	0	0	0	111.6	F221 T225 L227 L943 R950 C951 I1016	F221-L947 HydrophobicContact CZ-CB 4.16Å; T225-L947 HydrophobicContact CG2-CD1 4.18Å; L227-L947 HydrophobicContact CD1-CD1 4.2Å; L227-L947 HydrophobicContact CD2-CD1 4.36Å; L227-L947 HydrophobicContact CG-CD1 4.34Å; L943-L947 HydrophobicContact CD1-CD1 3.97Å; L943-L947 HydrophobicContact CD1-CD2 4.44Å; L943-L947 HydrophobicContact CD1-CG 3.99Å; L943-L947 HydrophobicContact CD2-CD1 4.33Å; L943-L947 HydrophobicContact CG-CD1 3.73Å; L943-L947 HydrophobicContact CG-CG 4.15Å; L943-L947 WeakPolarHBondContact O-CB 3.48Å; L943-L947 VanDerWaalsContact O-CG 3.24Å; L943-L947 WeakPolarHBondContact O-CG 3.23Å; L943-L947 PolarHBondContact O-N 3.24Å; L947-R950 PolarHBondContact O-N 3.4Å; L947-C951 VanDerWaalsContact O-CB 3.25Å; L947-C951 WeakPolarHBondContact O-CB 3.27Å; L947-C951 PolarHBondContact O-N 3.28Å; L947-I1016 HydrophobicContact CB-CD1 4.32Å; L947-I1016 HydrophobicContact CD2-CB 3.93Å
948	S	91.6	Very high	89.8	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-66.7	-45	177.3	-56.7	0	0	0	0	112	F221 R944 K945 F946 C951 K952 F970 H972	F221-S948 WeakPolarHBondContact CZ-OG 3.24Å; R944-S948 WeakPolarHBondContact O-CB 3.4Å; R944-S948 PolarHBondContact O-N 3.36Å; R944-S948 VanDerWaalsContact O-N 3.17Å; R944-S948 PolarHBondContact O-OG 2.9Å; K945-S948 PolarHBondContact O-N 3Å; F946-S948 VanDerWaalsContact C-N 3.31Å; F946-S948 PolarHBondContact O-N 3.49Å; S948-C951 PolarHBondContact O-N 3.49Å; S948-K952 WeakPolarHBondContact O-CB 3.38Å; S948-K952 PolarHBondContact O-N 3.07Å; S948-F970 WeakPolarHBondContact O-CE2 3.47Å; S948-H972 PolarHBondContact OG-CE1 3.15Å; S948-H972 PolarHBondContact OG-NE2 3.05Å; S948-H972 VanDerWaalsContact OG-NE2 3.12Å
949	A	90.1	Very high	89.4	Confident	61 Å²	61	55.9 Å²	55.9	50%	0.504	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-43.5	175.5	0	0	0	0	0	111.9	K945 F946 K952 Y953	K945-A949 WeakPolarHBondContact O-CB 3.36Å; K945-A949 PolarHBondContact O-N 2.97Å; F946-A949 PolarHBondContact O-N 3.3Å; A949-K952 PolarHBondContact O-N 3.16Å; A949-Y953 PolarHBondContact O-N 3.1Å
950	R	90	Very high	88.9	Confident	93 Å²	93	56 Å²	56	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-66.6	-41	178.1	-170	173.2	149.1	134.5	-9.9	111.6	F946 L947 K952 Y953 Y954 A1015 I1016	F946-R950 VanDerWaalsContact O-CB 3.29Å; F946-R950 WeakPolarHBondContact O-CB 3.43Å; F946-R950 PolarHBondContact O-N 3.46Å; L947-R950 PolarHBondContact O-N 3.4Å; R950-K952 PolarHBondContact O-N 3.36Å; R950-Y953 PolarHBondContact O-N 3.38Å; R950-Y954 HydrophobicContact CG-CD2 3.7Å; R950-Y954 HydrophobicContact CG-CE2 3.51Å; R950-Y954 VanDerWaalsContact O-CD2 3.23Å; R950-Y954 WeakPolarHBondContact O-CD2 3.28Å; R950-Y954 PolarHBondContact O-N 3.15Å; R950-A1015 PolarHBondContact NE-O 3.48Å; R950-A1015 PolarHBondContact NH2-O 2.93Å; R950-I1016 HydrophobicContact CB-CG2 3.84Å; R950-I1016 HydrophobicContact CG-CG2 3.56Å
951	C	89.2	Confident	88.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-48	173.3	-165.2	0	0	0	0	111.1	F221 L947 S948 Y953 Y954 F955 F970 I1016	F221-C951 HydrophobicContact CE2-CB 4.21Å; L947-C951 VanDerWaalsContact O-CB 3.25Å; L947-C951 WeakPolarHBondContact O-CB 3.27Å; L947-C951 PolarHBondContact O-N 3.28Å; S948-C951 PolarHBondContact O-N 3.49Å; C951-Y953 PolarHBondContact O-N 3.01Å; C951-Y954 PolarHBondContact O-N 2.88Å; C951-F955 VanDerWaalsContact O-CB 3.26Å; C951-F955 WeakPolarHBondContact O-CB 3.38Å; C951-F955 PolarHBondContact O-N 3.44Å; C951-F970 HydrophobicContact CB-CE2 4.4Å; C951-F970 HydrophobicContact CB-CZ 4.13Å; C951-I1016 HydrophobicContact CB-CD1 4.01Å
952	K	90.2	Very high	87.2	Confident	86 Å²	86	61.3 Å²	61.3	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-47.1	176.7	179	177.4	-176.4	170.5	0	112	S948 A949 R950 F955 N956 M968	S948-K952 WeakPolarHBondContact O-CB 3.38Å; S948-K952 PolarHBondContact O-N 3.07Å; A949-K952 PolarHBondContact O-N 3.16Å; R950-K952 PolarHBondContact O-N 3.36Å; K952-F955 PolarHBondContact O-N 3.4Å; K952-N956 WeakPolarHBondContact O-CB 3.49Å; K952-N956 PolarHBondContact O-N 3.12Å; K952-M968 HydrophobicContact CB-CB 4.42Å; K952-M968 WeakPolarHBondContact CD-O 3.37Å; K952-M968 WeakPolarHBondContact CE-O 3.49Å; K952-M968 HydrophobicContact CG-CB 4.26Å
953	Y	89.7	Confident	86.3	Confident	158 Å²	158	60 Å²	60	62%	0.62	30%	0.303	S	S	*	.	H	α-helix	trans	-60	-51.3	178.9	174.9	-96.6	0	0	0	112	A949 R950 C951 F955 N956 S957	A949-Y953 PolarHBondContact O-N 3.1Å; R950-Y953 PolarHBondContact O-N 3.38Å; C951-Y953 PolarHBondContact O-N 3.01Å; Y953-F955 PolarHBondContact O-N 3.2Å; Y953-N956 PolarHBondContact O-N 3.12Å; Y953-S957 WeakPolarHBondContact O-CB 3.25Å; Y953-S957 PolarHBondContact O-N 2.94Å
954	Y	87.7	Confident	85.9	Confident	70 Å²	70	58.2 Å²	58.2	28%	0.275	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-41.6	179.4	-80.4	-68.3	0	0	0	111.6	R950 C951 N956 S957 M958 A1015	R950-Y954 HydrophobicContact CG-CD2 3.7Å; R950-Y954 HydrophobicContact CG-CE2 3.51Å; R950-Y954 VanDerWaalsContact O-CD2 3.23Å; R950-Y954 WeakPolarHBondContact O-CD2 3.28Å; R950-Y954 PolarHBondContact O-N 3.15Å; C951-Y954 PolarHBondContact O-N 2.88Å; Y954-N956 PolarHBondContact O-N 3.4Å; Y954-S957 PolarHBondContact O-N 3.47Å; Y954-M958 HydrophobicContact CD1-CE 4.25Å; Y954-M958 WeakPolarHBondContact O-CB 3.3Å; Y954-M958 WeakPolarHBondContact O-CG 3.42Å; Y954-M958 PolarHBondContact O-N 3.03Å; Y954-A1015 HydrophobicContact CD1-CB 3.98Å; Y954-A1015 HydrophobicContact CD2-CB 3.53Å; Y954-A1015 HydrophobicContact CE1-CB 4.15Å; Y954-A1015 HydrophobicContact CE2-CB 3.72Å; Y954-A1015 HydrophobicContact CG-CB 3.68Å
955	F	88.1	Confident	85.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-48.3	177.4	-176.9	-107.8	0	0	0	112	C951 K952 Y953 M958 L959 M968 I979 V981 C1008 F1009	C951-F955 VanDerWaalsContact O-CB 3.26Å; C951-F955 WeakPolarHBondContact O-CB 3.38Å; C951-F955 PolarHBondContact O-N 3.44Å; K952-F955 PolarHBondContact O-N 3.4Å; Y953-F955 PolarHBondContact O-N 3.2Å; F955-M958 PolarHBondContact O-N 3.35Å; F955-L959 HydrophobicContact CD1-CD1 3.89Å; F955-L959 HydrophobicContact CE1-CD1 3.38Å; F955-L959 HydrophobicContact CE1-CG 4.38Å; F955-L959 HydrophobicContact CE2-CD1 4.28Å; F955-L959 HydrophobicContact CZ-CD1 3.61Å; F955-L959 HydrophobicContact CZ-CG 4.31Å; F955-L959 WeakPolarHBondContact O-CG 3.44Å; F955-L959 PolarHBondContact O-N 3.38Å; F955-M968 HydrophobicContact CB-CE 3.88Å; F955-M968 HydrophobicContact CD1-CB 4.43Å; F955-M968 HydrophobicContact CD1-CE 3.74Å; F955-M968 HydrophobicContact CD2-CE 3.89Å; F955-M968 HydrophobicContact CE1-CE 4.19Å; F955-M968 HydrophobicContact CE2-CE 4.35Å; F955-M968 HydrophobicContact CG-CE 3.55Å; F955-M968 HydrophobicContact CZ-CE 4.47Å; F955-I979 HydrophobicContact CE1-CG2 3.79Å; F955-I979 HydrophobicContact CZ-CG2 3.6Å; F955-V981 HydrophobicContact CE1-CG2 4.27Å; F955-V981 HydrophobicContact CZ-CG2 3.93Å; F955-C1008 HydrophobicContact CD2-CB 4.19Å; F955-C1008 HydrophobicContact CE2-CB 4.11Å; F955-F1009 HydrophobicContact CD2-CB 4.11Å; F955-F1009 HydrophobicContact CD2-CD2 4.39Å; F955-F1009 HydrophobicContact CE2-CB 3.9Å
956	N	86.6	Confident	84.6	Confident	52 Å²	52	52.8 Å²	52.8	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-43.2	178.9	-71.6	1.5	0	0	0	112.2	K952 Y953 Y954 M958 L959 A960 G966	K952-N956 WeakPolarHBondContact O-CB 3.49Å; K952-N956 PolarHBondContact O-N 3.12Å; Y953-N956 PolarHBondContact O-N 3.12Å; Y954-N956 PolarHBondContact O-N 3.4Å; N956-M958 VanDerWaalsContact C-N 3.29Å; N956-M958 PolarHBondContact O-N 3.48Å; N956-L959 PolarHBondContact O-N 2.86Å; N956-A960 WeakPolarHBondContact O-CB 3.47Å; N956-A960 PolarHBondContact O-N 3.12Å; N956-G966 PolarHBondContact OD1-O 3.5Å
957	S	85.1	Confident	84.1	Confident	47 Å²	47	48.9 Å²	48.9	33%	0.329	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-40.7	176.4	177	0	0	0	0	112	Y953 Y954 A960	Y953-S957 WeakPolarHBondContact O-CB 3.25Å; Y953-S957 PolarHBondContact O-N 2.94Å; Y954-S957 PolarHBondContact O-N 3.47Å; S957-A960 PolarHBondContact O-N 3.2Å
958	M	83.2	Confident	84	Confident	23 Å²	23	48.1 Å²	48.1	11%	0.113	27%	0.265	C	S	.	.	H	α-helix	trans	-69.6	-39.4	179.3	-78	-41.6	127.5	0	0	112.7	Y954 F955 N956 C1008 M1042	Y954-M958 HydrophobicContact CD1-CE 4.25Å; Y954-M958 WeakPolarHBondContact O-CB 3.3Å; Y954-M958 WeakPolarHBondContact O-CG 3.42Å; Y954-M958 PolarHBondContact O-N 3.03Å; F955-M958 PolarHBondContact O-N 3.35Å; N956-M958 VanDerWaalsContact C-N 3.29Å; N956-M958 PolarHBondContact O-N 3.48Å; M958-C1008 HydrophobicContact CB-CB 4.11Å; M958-M1042 HydrophobicContact CB-CE 3.18Å; M958-M1042 HydrophobicContact CG-CE 3.3Å; M958-M1042 HydrophobicContact SD-CE 3.16Å; M958-M1042 WeakPolarHBondContact SD-CE 3.31Å; M958-M1042 HydrophobicContact SD-CG 4.37Å
959	L	83.2	Confident	83.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-39.1	173.2	-75.8	174.9	0	0	0	112.7	F955 N956 Q961 R962 Y964 V981 F1004 C1008	F955-L959 HydrophobicContact CD1-CD1 3.89Å; F955-L959 HydrophobicContact CE1-CD1 3.38Å; F955-L959 HydrophobicContact CE1-CG 4.38Å; F955-L959 HydrophobicContact CE2-CD1 4.28Å; F955-L959 HydrophobicContact CZ-CD1 3.61Å; F955-L959 HydrophobicContact CZ-CG 4.31Å; F955-L959 WeakPolarHBondContact O-CG 3.44Å; F955-L959 PolarHBondContact O-N 3.38Å; N956-L959 PolarHBondContact O-N 2.86Å; L959-Q961 PolarHBondContact O-N 2.66Å; L959-R962 PolarHBondContact O-N 3.28Å; L959-Y964 CarbonylContact C-O 3.59Å; L959-Y964 HydrophobicContact CD2-CD2 4.36Å; L959-Y964 PolarHBondContact O-N 3.49Å; L959-V981 HydrophobicContact CD1-CG1 4.17Å; L959-V981 HydrophobicContact CD1-CG2 4.07Å; L959-V981 HydrophobicContact CD2-CG1 4.06Å; L959-F1004 HydrophobicContact CD2-CD1 4.49Å; L959-F1004 HydrophobicContact CD2-CE1 4.28Å; L959-C1008 HydrophobicContact CD2-CB 4.24Å; L959-C1008 HydrophobicContact CG-CB 4.38Å
960	A	82.1	Confident	83.8	Confident	62 Å²	62	50.4 Å²	50.4	51%	0.512	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-26.4	-178.8	0	0	0	0	0	113.2	N956 S957 R962 G963	N956-A960 WeakPolarHBondContact O-CB 3.47Å; N956-A960 PolarHBondContact O-N 3.12Å; S957-A960 PolarHBondContact O-N 3.2Å; A960-R962 PolarHBondContact O-N 3.25Å; A960-G963 PolarHBondContact O-N 3.44Å
961	Q	75.8	Confident	83.8	Confident	104 Å²	104	48.5 Å²	48.5	49%	0.486	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.9	175.1	-66.4	-174.1	16.8	0	0	113.6	L959	L959-Q961 PolarHBondContact O-N 2.66Å
962	R	71.9	Confident	83.9	Confident	61 Å²	61	50.2 Å²	50.2	23%	0.23	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	7.9	177	-158.5	-179.4	164.5	172.3	-1.5	113.1	L959 A960 Y964 F1004 N1035	L959-R962 PolarHBondContact O-N 3.28Å; A960-R962 PolarHBondContact O-N 3.25Å; R962-Y964 HydrophobicContact CB-CG 4.45Å; R962-Y964 HydrophobicContact CG-CE1 4.33Å; R962-Y964 HydrophobicContact CG-CE2 4.48Å; R962-Y964 PolarHBondContact NE-OH 3.5Å; R962-Y964 PolarHBondContact NH2-OH 3.25Å; R962-Y964 VanDerWaalsContact NH2-OH 3.13Å; R962-Y964 PolarHBondContact O-N 3.24Å; R962-F1004 HydrophobicContact CB-CE1 3.84Å; R962-F1004 HydrophobicContact CB-CZ 3.83Å; R962-F1004 HydrophobicContact CG-CE1 4.32Å; R962-F1004 HydrophobicContact CG-CZ 4.31Å; R962-N1035 PolarHBondContact NH1-OD1 3.14Å; R962-N1035 PolarHBondContact NH2-OD1 3.47Å
963	G	72.6	Confident	83.8	Confident	51 Å²	51	55.3 Å²	55.3	53%	0.526	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	22.1	-174	0	0	0	0	0	113.6	A960	A960-G963 PolarHBondContact O-N 3.44Å
964	Y	81.4	Confident	83.8	Confident	26 Å²	26	53.4 Å²	53.4	10%	0.102	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.3	172.2	-66.7	-4.2	0	0	0	109.6	L959 R962 P983 E1001 F1004	L959-Y964 CarbonylContact C-O 3.59Å; L959-Y964 HydrophobicContact CD2-CD2 4.36Å; L959-Y964 PolarHBondContact O-N 3.49Å; R962-Y964 HydrophobicContact CB-CG 4.45Å; R962-Y964 HydrophobicContact CG-CE1 4.33Å; R962-Y964 HydrophobicContact CG-CE2 4.48Å; R962-Y964 PolarHBondContact NE-OH 3.5Å; R962-Y964 PolarHBondContact NH2-OH 3.25Å; R962-Y964 VanDerWaalsContact NH2-OH 3.13Å; R962-Y964 PolarHBondContact O-N 3.24Å; Y964-P983 HydrophobicContact CD1-CB 3.88Å; Y964-P983 HydrophobicContact CE1-CB 3.48Å; Y964-P983 VanDerWaalsContact CE1-CB 3.48Å; Y964-P983 HydrophobicContact CE2-CB 4.32Å; Y964-P983 HydrophobicContact CG-CB 4.43Å; Y964-E1001 HydrophobicContact CE2-CG 4.32Å; Y964-F1004 AromaticContact CD2-CD1 4Å; Y964-F1004 HydrophobicContact CD2-CD1 4Å; Y964-F1004 HydrophobicContact CD2-CE1 4.11Å; Y964-F1004 AromaticContact CE2-CD1 3.94Å; Y964-F1004 HydrophobicContact CE2-CD1 3.94Å; Y964-F1004 HydrophobicContact CE2-CE1 4.35Å
965	S	78.3	Confident	84	Confident	54 Å²	54	53.6 Å²	53.6	38%	0.378	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.7	170.3	51.2	0	0	0	0	109.3	Q982	S965-Q982 PolarHBondContact N-O 3.11Å; S965-Q982 PolarHBondContact O-N 3.49Å
966	G	77.7	Confident	84.1	Confident	18 Å²	18	55.2 Å²	55.2	19%	0.186	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159.3	178.9	0	0	0	0	0	112.1	N956 S980	N956-G966 PolarHBondContact OD1-O 3.5Å; G966-S980 CarbonylContact C-O 3.57Å; G966-S980 WeakPolarHBondContact CA-O 3.49Å
967	S	82.3	Confident	84.2	Confident	38 Å²	38	52.7 Å²	52.7	27%	0.266	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.9	173.7	-171	0	0	0	0	110.4	I979 S980	S967-I979 WeakPolarHBondContact O-CA 3.44Å; S967-S980 PolarHBondContact N-O 3.44Å; S967-S980 PolarHBondContact O-N 3.23Å
968	M	86.6	Confident	84.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.9	173.9	-171.2	177	-74.1	0	0	108.3	K952 F955 F970 L977 T978 I979 F1009	K952-M968 HydrophobicContact CB-CB 4.42Å; K952-M968 WeakPolarHBondContact CD-O 3.37Å; K952-M968 WeakPolarHBondContact CE-O 3.49Å; K952-M968 HydrophobicContact CG-CB 4.26Å; F955-M968 HydrophobicContact CB-CE 3.88Å; F955-M968 HydrophobicContact CD1-CB 4.43Å; F955-M968 HydrophobicContact CD1-CE 3.74Å; F955-M968 HydrophobicContact CD2-CE 3.89Å; F955-M968 HydrophobicContact CE1-CE 4.19Å; F955-M968 HydrophobicContact CE2-CE 4.35Å; F955-M968 HydrophobicContact CG-CE 3.55Å; F955-M968 HydrophobicContact CZ-CE 4.47Å; M968-F970 HydrophobicContact CG-CD2 4.19Å; M968-F970 HydrophobicContact CG-CE2 3.61Å; M968-F970 HydrophobicContact CG-CZ 4.1Å; M968-F970 HydrophobicContact SD-CD2 4.49Å; M968-F970 HydrophobicContact SD-CE2 3.39Å; M968-F970 WeakPolarHBondContact SD-CE2 3.45Å; M968-F970 HydrophobicContact SD-CZ 3.5Å; M968-F970 WeakPolarHBondContact SD-CZ 3.35Å; M968-L977 HydrophobicContact CG-CD1 3.51Å; M968-L977 HydrophobicContact SD-CD1 4.18Å; M968-T978 WeakPolarHBondContact CA-O 3.49Å; M968-I979 HydrophobicContact CE-CD1 3.99Å; M968-I979 HydrophobicContact CE-CG1 4.08Å; M968-I979 HydrophobicContact CG-CG1 4.3Å; M968-F1009 HydrophobicContact CE-CD2 3.47Å; M968-F1009 VanDerWaalsContact CE-CD2 3.47Å; M968-F1009 HydrophobicContact CE-CE2 3.61Å; M968-F1009 HydrophobicContact SD-CE2 4.38Å
969	T	87.8	Confident	84.2	Confident	79 Å²	79	51.8 Å²	51.8	49%	0.485	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.4	-177.9	-53.9	0	0	0	0	108.9	T978	T969-T978 PolarHBondContact N-O 2.91Å; T969-T978 PolarHBondContact O-N 3.44Å
970	F	90.9	Very high	84.1	Confident	36 Å²	36	52.8 Å²	52.8	16%	0.158	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.1	174.9	-69.3	-93	0	0	0	109.3	Y218 F221 S948 C951 M968 L977	Y218-F970 HydrophobicContact CD2-CD1 4.45Å; F221-F970 HydrophobicContact CB-CE1 4.37Å; F221-F970 HydrophobicContact CD1-CD1 4.39Å; F221-F970 AromaticContact CD1-CE1 3.85Å; F221-F970 HydrophobicContact CD1-CE1 3.85Å; F221-F970 AromaticContact CD2-CE1 3.71Å; F221-F970 HydrophobicContact CD2-CE1 3.71Å; F221-F970 HydrophobicContact CD2-CZ 4.01Å; F221-F970 HydrophobicContact CE1-CD1 4.42Å; F221-F970 HydrophobicContact CE1-CE1 4.01Å; F221-F970 AromaticContact CE2-CE1 3.87Å; F221-F970 HydrophobicContact CE2-CE1 3.87Å; F221-F970 AromaticContact CE2-CZ 3.99Å; F221-F970 HydrophobicContact CE2-CZ 3.99Å; F221-F970 AromaticContact CG-CE1 3.7Å; F221-F970 HydrophobicContact CG-CE1 3.7Å; F221-F970 HydrophobicContact CG-CZ 4.44Å; F221-F970 HydrophobicContact CZ-CE1 4.02Å; F221-F970 HydrophobicContact CZ-CZ 4.42Å; S948-F970 WeakPolarHBondContact O-CE2 3.47Å; C951-F970 HydrophobicContact CB-CE2 4.4Å; C951-F970 HydrophobicContact CB-CZ 4.13Å; M968-F970 HydrophobicContact CG-CD2 4.19Å; M968-F970 HydrophobicContact CG-CE2 3.61Å; M968-F970 HydrophobicContact CG-CZ 4.1Å; M968-F970 HydrophobicContact SD-CD2 4.49Å; M968-F970 HydrophobicContact SD-CE2 3.39Å; M968-F970 WeakPolarHBondContact SD-CE2 3.45Å; M968-F970 HydrophobicContact SD-CZ 3.5Å; M968-F970 WeakPolarHBondContact SD-CZ 3.35Å; F970-L977 HydrophobicContact CD1-CD1 3.7Å; F970-L977 HydrophobicContact CD1-CG 4.49Å; F970-L977 HydrophobicContact CD2-CD1 4.11Å; F970-L977 HydrophobicContact CE1-CD1 3.59Å; F970-L977 HydrophobicContact CE1-CD2 3.84Å; F970-L977 HydrophobicContact CE1-CG 4.24Å; F970-L977 HydrophobicContact CE2-CD1 4.03Å; F970-L977 HydrophobicContact CG-CD1 3.95Å; F970-L977 HydrophobicContact CZ-CD1 3.76Å; F970-L977 HydrophobicContact CZ-CD2 4.25Å
971	D	90.1	Very high	84	Confident	52 Å²	52	49.9 Å²	49.9	28%	0.278	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	97.1	165.3	-169.9	-21.5	0	0	0	109.3	K973 N974 E975 T976	D971-K973 PolarHBondContact O-N 3.37Å; D971-K973 WeakPolarHBondContact OD1-CA 3.13Å; D971-K973 WeakPolarHBondContact OD1-CB 3.23Å; D971-K973 PolarHBondContact OD1-N 3.32Å; D971-N974 HydrophobicContact CB-CB 4.42Å; D971-N974 PolarHBondContact OD1-N 3.28Å; D971-N974 PolarHBondContact OD2-ND2 2.99Å; D971-E975 WeakPolarHBondContact O-CA 3.24Å; D971-E975 PolarHBondContact O-N 2.72Å; D971-T976 WeakPolarHBondContact CB-OG1 3.37Å; D971-T976 PolarHBondContact N-O 3.21Å; D971-T976 PolarHBondContact O-N 3.44Å
972	H	90.6	Very high	84.1	Confident	37 Å²	37	46.2 Å²	46.2	17%	0.171	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.1	178.8	-72.9	-44.8	0	0	0	114.7	Y218 R944 S948	Y218-H972 AromaticContact CE2-ND1 3.45Å; Y218-H972 WeakPolarHBondContact CE2-ND1 3.4Å; Y218-H972 AromaticContact CZ-ND1 3.72Å; Y218-H972 PolarHBondContact OH-ND1 3.3Å; Y218-H972 VanDerWaalsContact OH-ND1 3.12Å; R944-H972 PolarHBondContact NH1-O 3.5Å; R944-H972 VanDerWaalsContact NH1-O 3.13Å; S948-H972 PolarHBondContact OG-CE1 3.15Å; S948-H972 PolarHBondContact OG-NE2 3.05Å; S948-H972 VanDerWaalsContact OG-NE2 3.12Å
973	K	88.3	Confident	84	Confident	192 Å²	192	45.7 Å²	45.7	84%	0.835	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-45.7	178.2	-67	-177.1	179.2	-179.8	0	110.4	D971 E975	D971-K973 PolarHBondContact O-N 3.37Å; D971-K973 WeakPolarHBondContact OD1-CA 3.13Å; D971-K973 WeakPolarHBondContact OD1-CB 3.23Å; D971-K973 PolarHBondContact OD1-N 3.32Å; K973-E975 VanDerWaalsContact C-N 3.33Å
974	N	89.8	Confident	83.5	Confident	119 Å²	119	45 Å²	45	64%	0.636	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.9	178.7	-64.7	-43.1	0	0	0	113.3	D971 T976	D971-N974 HydrophobicContact CB-CB 4.42Å; D971-N974 PolarHBondContact OD1-N 3.28Å; D971-N974 PolarHBondContact OD2-ND2 2.99Å; N974-T976 VanDerWaalsContact C-N 3.33Å; N974-T976 HydrophobicContact CB-CG2 4.37Å; N974-T976 PolarHBondContact O-N 2.72Å
975	E	91.4	Very high	82	Confident	74 Å²	74	54 Å²	54	35%	0.346	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	43.6	-177.7	-59.3	-166.2	155.6	0	0	112.9	G215 Y218 R231 D971 K973	G215-E975 WeakPolarHBondContact CA-O 3.47Å; Y218-E975 WeakPolarHBondContact CB-O 3.36Å; Y218-E975 HydrophobicContact CD1-CB 3.65Å; Y218-E975 HydrophobicContact CD1-CG 4.33Å; Y218-E975 WeakPolarHBondContact CD1-O 3.21Å; Y218-E975 HydrophobicContact CE1-CB 3.66Å; Y218-E975 HydrophobicContact CE1-CG 3.84Å; Y218-E975 VanDerWaalsContact CG-C 3.45Å; Y218-E975 HydrophobicContact CG-CB 4.39Å; R231-E975 IonicContact NH1-OE1 2.64Å; R231-E975 PolarHBondContact NH1-OE1 2.89Å; R231-E975 IonicContact NH1-OE2 2.95Å; D971-E975 WeakPolarHBondContact O-CA 3.24Å; D971-E975 PolarHBondContact O-N 2.72Å; K973-E975 VanDerWaalsContact C-N 3.33Å
976	T	90.2	Very high	80.6	Confident	33 Å²	33	53.6 Å²	53.6	20%	0.202	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.1	179.5	62.8	0	0	0	0	112.8	E214 D971 N974	E214-T976 HydrophobicContact CB-CG2 4.19Å; D971-T976 WeakPolarHBondContact CB-OG1 3.37Å; D971-T976 PolarHBondContact N-O 3.21Å; D971-T976 PolarHBondContact O-N 3.44Å; N974-T976 VanDerWaalsContact C-N 3.33Å; N974-T976 HydrophobicContact CB-CG2 4.37Å; N974-T976 PolarHBondContact O-N 2.72Å
977	L	88.5	Confident	79.1	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	110.4	174.4	173.9	56.2	0	0	0	110	E214 K217 Y218 F221 M968 F970 I979 F1009	E214-L977 PolarHBondContact O-N 2.84Å; K217-L977 HydrophobicContact CB-CB 4Å; K217-L977 HydrophobicContact CB-CD2 4.15Å; K217-L977 HydrophobicContact CB-CG 4.2Å; K217-L977 WeakPolarHBondContact CD-O 3.24Å; Y218-L977 HydrophobicContact CD2-CB 4.45Å; F221-L977 HydrophobicContact CB-CD2 4.3Å; M968-L977 HydrophobicContact CG-CD1 3.51Å; M968-L977 HydrophobicContact SD-CD1 4.18Å; F970-L977 HydrophobicContact CD1-CD1 3.7Å; F970-L977 HydrophobicContact CD1-CG 4.49Å; F970-L977 HydrophobicContact CD2-CD1 4.11Å; F970-L977 HydrophobicContact CE1-CD1 3.59Å; F970-L977 HydrophobicContact CE1-CD2 3.84Å; F970-L977 HydrophobicContact CE1-CG 4.24Å; F970-L977 HydrophobicContact CE2-CD1 4.03Å; F970-L977 HydrophobicContact CG-CD1 3.95Å; F970-L977 HydrophobicContact CZ-CD1 3.76Å; F970-L977 HydrophobicContact CZ-CD2 4.25Å; L977-I979 HydrophobicContact CD1-CG1 4.33Å; L977-I979 HydrophobicContact CD2-CD1 4.37Å; L977-I979 HydrophobicContact CG-CD1 4.4Å; L977-I979 HydrophobicContact CG-CG1 4.17Å; L977-F1009 HydrophobicContact CD2-CE2 4.35Å; L977-F1009 HydrophobicContact CD2-CZ 4.3Å
978	T	86	Confident	77.6	Confident	50 Å²	50	67.8 Å²	67.8	31%	0.307	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132	175.6	-46.4	0	0	0	0	109.6	E214 M968 T969	E214-T978 VanDerWaalsContact CD-OG1 3.23Å; E214-T978 WeakPolarHBondContact OE1-CB 3.47Å; E214-T978 VanDerWaalsContact OE1-CG2 3.31Å; E214-T978 WeakPolarHBondContact OE1-CG2 3.48Å; E214-T978 PolarHBondContact OE1-OG1 3.24Å; M968-T978 WeakPolarHBondContact CA-O 3.49Å; T969-T978 PolarHBondContact N-O 2.91Å; T969-T978 PolarHBondContact O-N 3.44Å
979	I	83.3	Confident	75.6	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.4	178.9	-55.9	174.5	0	0	0	107.5	F955 S967 M968 L977 V981 F1009	F955-I979 HydrophobicContact CE1-CG2 3.79Å; F955-I979 HydrophobicContact CZ-CG2 3.6Å; S967-I979 WeakPolarHBondContact O-CA 3.44Å; M968-I979 HydrophobicContact CE-CD1 3.99Å; M968-I979 HydrophobicContact CE-CG1 4.08Å; M968-I979 HydrophobicContact CG-CG1 4.3Å; L977-I979 HydrophobicContact CD1-CG1 4.33Å; L977-I979 HydrophobicContact CD2-CD1 4.37Å; L977-I979 HydrophobicContact CG-CD1 4.4Å; L977-I979 HydrophobicContact CG-CG1 4.17Å; I979-V981 HydrophobicContact CG2-CG2 4.36Å; I979-F1009 HydrophobicContact CD1-CD2 4.06Å; I979-F1009 HydrophobicContact CD1-CE2 4.01Å
980	S	81	Confident	73.7	Confident	21 Å²	21	73.7 Å²	73.7	15%	0.147	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142	174.2	56.9	0	0	0	0	110.5	G966 S967	G966-S980 CarbonylContact C-O 3.57Å; G966-S980 WeakPolarHBondContact CA-O 3.49Å; S967-S980 PolarHBondContact N-O 3.44Å; S967-S980 PolarHBondContact O-N 3.23Å
981	V	80.4	Confident	72	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.006	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.2	-177.8	-176.6	0	0	0	0	109.3	F955 L959 I979 L997	F955-V981 HydrophobicContact CE1-CG2 4.27Å; F955-V981 HydrophobicContact CZ-CG2 3.93Å; L959-V981 HydrophobicContact CD1-CG1 4.17Å; L959-V981 HydrophobicContact CD1-CG2 4.07Å; L959-V981 HydrophobicContact CD2-CG1 4.06Å; I979-V981 HydrophobicContact CG2-CG2 4.36Å; V981-L997 HydrophobicContact CB-CD1 4.1Å
982	Q	77.9	Confident	70.4	Confident	27 Å²	27	78 Å²	78	13%	0.126	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.7	178.7	-174.2	-178.2	15	0	0	110	S965 G986 N987	S965-Q982 PolarHBondContact N-O 3.11Å; S965-Q982 PolarHBondContact O-N 3.49Å; Q982-G986 PolarHBondContact NE2-O 3.43Å; Q982-N987 PolarHBondContact NE2-O 3.25Å
983	P	68.9	Low	69	Low	50 Å²	50	79.2 Å²	79.2	33%	0.325	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	117.8	174.2	28.4	-28.6	0	0	0	112	Y964 L997 E1001	Y964-P983 HydrophobicContact CD1-CB 3.88Å; Y964-P983 HydrophobicContact CE1-CB 3.48Å; Y964-P983 VanDerWaalsContact CE1-CB 3.48Å; Y964-P983 HydrophobicContact CE2-CB 4.32Å; Y964-P983 HydrophobicContact CG-CB 4.43Å; P983-L997 HydrophobicContact CG-CD2 4.17Å; P983-E1001 WeakPolarHBondContact CB-OE1 3.47Å; P983-E1001 WeakPolarHBondContact CG-OE1 3.49Å
984	G	62.9	Low	67.7	Low	36 Å²	36	70.7 Å²	70.7	37%	0.371	40%	0.396	S	S	.	.	S	Bend	trans	98.2	177.2	168.6	0	0	0	0	0	117.5	G986	G984-G986 VanDerWaalsContact C-N 3.31Å; G984-G986 PolarHBondContact O-N 3.46Å
985	Q	49	Very low	66.4	Low	214 Å²	214	71.8 Å²	71.8	100%	1	39%	0.391	S	S	*	.	S	Bend	trans	-86	50.8	176.4	-72.7	-173.9	-11.3	0	0	112.7
986	G	50	Low	65	Low	47 Å²	47	71.7 Å²	71.7	49%	0.485	40%	0.399	S	S	.	.			trans	-91.2	155.8	172.1	0	0	0	0	0	112.2	Q982 G984	Q982-G986 PolarHBondContact NE2-O 3.43Å; G984-G986 VanDerWaalsContact C-N 3.31Å; G984-G986 PolarHBondContact O-N 3.46Å
987	N	46	Very low	63.8	Low	152 Å²	152	71 Å²	71	81%	0.813	39%	0.394	S	S	*	.			trans	-42	138.5	-180	-88.7	-20.1	0	0	0	113.1	Q982 A989	Q982-N987 PolarHBondContact NE2-O 3.25Å; N987-A989 PolarHBondContact O-N 3.24Å
988	K	49.9	Very low	62.7	Low	202 Å²	202	73.8 Å²	73.8	88%	0.878	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	4.3	-176.6	-72.8	-179.9	174.7	177.1	0	116
989	A	44.9	Very low	61.8	Low	84 Å²	84	73.4 Å²	73.4	69%	0.694	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-22.2	-167.3	0	0	0	0	0	115.1	N987	N987-A989 PolarHBondContact O-N 3.24Å
990	D	47.8	Very low	61	Low	119 Å²	119	73.9 Å²	73.9	64%	0.636	42%	0.424	S	S	*	.			trans	-115.5	79.1	-176.2	-70.2	-28.1	0	0	0	112.2	N992	D990-N992 PolarHBondContact O-N 3.47Å
991	L	54.5	Low	60.7	Low	103 Å²	103	74.9 Å²	74.9	54%	0.539	43%	0.427	S	S	.	.			trans	-77.4	107	165.4	-79.1	164.7	0	0	0	109.1
992	N	57	Low	60.3	Low	77 Å²	77	78 Å²	78	41%	0.412	44%	0.438	S	S	.	.			trans	-90.8	138.1	-176.8	-90.8	-20.8	0	0	0	112	D990 S996	D990-N992 PolarHBondContact O-N 3.47Å; N992-S996 WeakPolarHBondContact CB-OG 3.38Å; N992-S996 VanDerWaalsContact CG-OG 3.28Å
993	D	61.1	Low	60	Low	62 Å²	62	77.3 Å²	77.3	33%	0.332	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-60.2	148.2	168.2	-174.9	12.8	0	0	0	108.6	K217 R995 S996	K217-D993 IonicContact NZ-OD1 3.54Å; D993-R995 PolarHBondContact O-N 3.39Å; D993-R995 WeakPolarHBondContact OD2-CD 3.33Å; D993-R995 IonicContact OD2-CZ 3.8Å; D993-R995 IonicContact OD2-NE 3.13Å; D993-R995 PolarHBondContact OD2-NE 3.42Å; D993-R995 IonicContact OD2-NH2 2.8Å; D993-S996 PolarHBondContact O-N 3.07Å; D993-S996 PolarHBondContact O-OG 3.16Å; D993-S996 VanDerWaalsContact O-OG 3.05Å
994	M	61.8	Low	60.4	Low	12 Å²	12	74.9 Å²	74.9	6%	0.059	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-12.8	-174.9	-158.5	-175.5	-167.3	0	0	114.1	L997 R1002 T1006	M994-L997 HydrophobicContact CG-CD1 4.09Å; M994-R1002 HydrophobicContact CG-CG 4.47Å; M994-T1006 VanDerWaalsContact CE-OG1 3.22Å; M994-T1006 WeakPolarHBondContact CE-OG1 3.42Å
995	R	60.9	Low	61.1	Low	142 Å²	142	73.2 Å²	73.2	54%	0.536	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-29	179.9	-56.7	177.9	-158.5	-171.6	-1.3	114.3	K212 D993 L997	K212-R995 PolarHBondContact O-NH2 3.24Å; D993-R995 PolarHBondContact O-N 3.39Å; D993-R995 WeakPolarHBondContact OD2-CD 3.33Å; D993-R995 IonicContact OD2-CZ 3.8Å; D993-R995 IonicContact OD2-NE 3.13Å; D993-R995 PolarHBondContact OD2-NE 3.42Å; D993-R995 IonicContact OD2-NH2 2.8Å; R995-L997 VanDerWaalsContact C-N 3.28Å
996	S	62.5	Low	62.4	Low	73 Å²	73	63.5 Å²	63.5	51%	0.51	36%	0.359	S	S	.	.	S	Bend	trans	-88.6	4.2	179.7	47.2	0	0	0	0	113.2	N992 D993	N992-S996 WeakPolarHBondContact CB-OG 3.38Å; N992-S996 VanDerWaalsContact CG-OG 3.28Å; D993-S996 PolarHBondContact O-N 3.07Å; D993-S996 PolarHBondContact O-OG 3.16Å; D993-S996 VanDerWaalsContact O-OG 3.05Å
997	L	65.3	Low	63.8	Low	18 Å²	18	61.9 Å²	61.9	9%	0.094	34%	0.34	C	S	.	.	S	Bend	trans	-79	152.5	173.7	-62	172.4	0	0	0	111.8	V981 P983 M994 R995 E1001 R1002	V981-L997 HydrophobicContact CB-CD1 4.1Å; P983-L997 HydrophobicContact CG-CD2 4.17Å; M994-L997 HydrophobicContact CG-CD1 4.09Å; R995-L997 VanDerWaalsContact C-N 3.28Å; L997-E1001 HydrophobicContact CB-CB 4.02Å; L997-E1001 HydrophobicContact CD2-CB 4.49Å; L997-R1002 HydrophobicContact CB-CB 4.38Å
998	S	65.7	Low	65.6	Low	59 Å²	59	54.7 Å²	54.7	41%	0.413	30%	0.301	S	S	.	.			trans	-61.8	156.5	171.4	68.4	0	0	0	0	111.6	G1000 E1001 R1002	S998-G1000 PolarHBondContact O-N 3.47Å; S998-G1000 VanDerWaalsContact O-N 3.1Å; S998-E1001 WeakPolarHBondContact CB-OE2 3.3Å; S998-E1001 PolarHBondContact N-OE2 2.57Å; S998-E1001 PolarHBondContact O-N 3.16Å; S998-E1001 VanDerWaalsContact O-N 3.09Å; S998-E1001 WeakPolarHBondContact OG-CB 3.2Å; S998-E1001 WeakPolarHBondContact OG-CG 3.34Å; S998-E1001 PolarHBondContact OG-N 2.74Å; S998-E1001 PolarHBondContact OG-OE2 2.85Å; S998-R1002 WeakPolarHBondContact O-CB 3.32Å; S998-R1002 PolarHBondContact O-N 3.31Å
999	G	66.3	Low	67.1	Low	42 Å²	42	45.1 Å²	45.1	43%	0.433	26%	0.259	S	S	.	.	H	α-helix	trans	-55.3	-31.7	-179.5	0	0	0	0	0	114.1	S1003	G999-S1003 PolarHBondContact O-N 3.26Å; G999-S1003 PolarHBondContact O-OG 3.25Å
1000	G	67.4	Low	68.8	Low	10 Å²	10	41.6 Å²	41.6	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-73.6	-44.4	174.8	0	0	0	0	0	113.8	S998 S1003 F1004 N1035	S998-G1000 PolarHBondContact O-N 3.47Å; S998-G1000 VanDerWaalsContact O-N 3.1Å; G1000-S1003 PolarHBondContact O-N 3.36Å; G1000-F1004 PolarHBondContact O-N 3.31Å; G1000-N1035 VanDerWaalsContact CA-ND2 3.26Å; G1000-N1035 WeakPolarHBondContact CA-ND2 3.08Å; G1000-N1035 PolarHBondContact O-ND2 3.01Å; G1000-N1035 VanDerWaalsContact O-ND2 3.16Å
1001	E	74.2	Confident	70.5	Confident	42 Å²	42	36.3 Å²	36.3	20%	0.196	20%	0.201	C	C	.	.	H	α-helix	trans	-68	-37.9	178.6	-73.2	163.7	157.6	0	0	112.4	Y964 P983 L997 S998 F1004 S1005	Y964-E1001 HydrophobicContact CE2-CG 4.32Å; P983-E1001 WeakPolarHBondContact CB-OE1 3.47Å; P983-E1001 WeakPolarHBondContact CG-OE1 3.49Å; L997-E1001 HydrophobicContact CB-CB 4.02Å; L997-E1001 HydrophobicContact CD2-CB 4.49Å; S998-E1001 WeakPolarHBondContact CB-OE2 3.3Å; S998-E1001 PolarHBondContact N-OE2 2.57Å; S998-E1001 PolarHBondContact O-N 3.16Å; S998-E1001 VanDerWaalsContact O-N 3.09Å; S998-E1001 WeakPolarHBondContact OG-CB 3.2Å; S998-E1001 WeakPolarHBondContact OG-CG 3.34Å; S998-E1001 PolarHBondContact OG-N 2.74Å; S998-E1001 PolarHBondContact OG-OE2 2.85Å; E1001-F1004 PolarHBondContact O-N 3.26Å; E1001-S1005 WeakPolarHBondContact O-CB 3.37Å; E1001-S1005 PolarHBondContact O-N 3.36Å; E1001-S1005 PolarHBondContact O-OG 2.78Å
1002	R	73.3	Confident	72	Confident	67 Å²	67	31.4 Å²	31.4	25%	0.253	18%	0.175	S	C	.	.	H	α-helix	trans	-60.9	-48	173.8	-168.8	-179.2	63	174.8	1.5	111	L209 M994 L997 S998 F1004 S1005 T1006	L209-R1002 HydrophobicContact CD2-CG 3.72Å; M994-R1002 HydrophobicContact CG-CG 4.47Å; L997-R1002 HydrophobicContact CB-CB 4.38Å; S998-R1002 WeakPolarHBondContact O-CB 3.32Å; S998-R1002 PolarHBondContact O-N 3.31Å; R1002-F1004 PolarHBondContact O-N 3.22Å; R1002-S1005 PolarHBondContact O-N 3.46Å; R1002-T1006 PolarHBondContact O-N 3.09Å; R1002-T1006 PolarHBondContact O-OG1 2.66Å
1003	S	71.5	Confident	73.4	Confident	12 Å²	12	27.7 Å²	27.7	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-63.6	-40.1	178.8	-57.9	0	0	0	0	112.3	G999 G1000 T1006 V1007	G999-S1003 PolarHBondContact O-N 3.26Å; G999-S1003 PolarHBondContact O-OG 3.25Å; G1000-S1003 PolarHBondContact O-N 3.36Å; S1003-T1006 PolarHBondContact O-N 3.46Å; S1003-V1007 WeakPolarHBondContact O-CG2 3.39Å; S1003-V1007 PolarHBondContact O-N 3.22Å; S1003-V1007 VanDerWaalsContact O-N 3.09Å
1004	F	76.9	Confident	74.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-46	175.5	-178.8	-100.9	0	0	0	112.2	L959 R962 Y964 G1000 E1001 R1002 T1006 V1007 C1008 I1038 S1039 M1042	L959-F1004 HydrophobicContact CD2-CD1 4.49Å; L959-F1004 HydrophobicContact CD2-CE1 4.28Å; R962-F1004 HydrophobicContact CB-CE1 3.84Å; R962-F1004 HydrophobicContact CB-CZ 3.83Å; R962-F1004 HydrophobicContact CG-CE1 4.32Å; R962-F1004 HydrophobicContact CG-CZ 4.31Å; Y964-F1004 AromaticContact CD2-CD1 4Å; Y964-F1004 HydrophobicContact CD2-CD1 4Å; Y964-F1004 HydrophobicContact CD2-CE1 4.11Å; Y964-F1004 AromaticContact CE2-CD1 3.94Å; Y964-F1004 HydrophobicContact CE2-CD1 3.94Å; Y964-F1004 HydrophobicContact CE2-CE1 4.35Å; G1000-F1004 PolarHBondContact O-N 3.31Å; E1001-F1004 PolarHBondContact O-N 3.26Å; R1002-F1004 PolarHBondContact O-N 3.22Å; F1004-T1006 VanDerWaalsContact C-N 3.27Å; F1004-T1006 PolarHBondContact O-N 3.41Å; F1004-V1007 WeakPolarHBondContact O-CB 3.46Å; F1004-V1007 PolarHBondContact O-N 3.48Å; F1004-V1007 VanDerWaalsContact O-N 3.12Å; F1004-C1008 PolarHBondContact O-N 3.33Å; F1004-C1008 PolarHBondContact O-SG 3.47Å; F1004-C1008 VanDerWaalsContact O-SG 3.4Å; F1004-I1038 HydrophobicContact CE2-CB 4.47Å; F1004-I1038 HydrophobicContact CE2-CG2 3.77Å; F1004-I1038 HydrophobicContact CZ-CG2 4.35Å; F1004-S1039 WeakPolarHBondContact CD2-OG 3.32Å; F1004-M1042 HydrophobicContact CE2-SD 4.42Å; F1004-M1042 HydrophobicContact CZ-SD 4.49Å
1005	S	78.1	Confident	75.4	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-35.2	178.8	-56.9	0	0	0	0	112.1	E1001 R1002 C1008 F1009	E1001-S1005 WeakPolarHBondContact O-CB 3.37Å; E1001-S1005 PolarHBondContact O-N 3.36Å; E1001-S1005 PolarHBondContact O-OG 2.78Å; R1002-S1005 PolarHBondContact O-N 3.46Å; S1005-C1008 PolarHBondContact O-N 3.22Å; S1005-F1009 PolarHBondContact O-N 3.43Å
1006	T	76.1	Confident	76.5	Confident	10 Å²	10	19.1 Å²	19.1	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-41.1	173	-63.5	0	0	0	0	112.5	F208 L209 M994 R1002 S1003 F1004 C1008 F1009 V1010	F208-T1006 HydrophobicContact CD1-CG2 3.85Å; F208-T1006 HydrophobicContact CE1-CG2 4.08Å; L209-T1006 HydrophobicContact CD2-CG2 4.25Å; L209-T1006 WeakPolarHBondContact CD2-OG1 3.18Å; L209-T1006 HydrophobicContact CG-CG2 4.36Å; M994-T1006 VanDerWaalsContact CE-OG1 3.22Å; M994-T1006 WeakPolarHBondContact CE-OG1 3.42Å; R1002-T1006 PolarHBondContact O-N 3.09Å; R1002-T1006 PolarHBondContact O-OG1 2.66Å; S1003-T1006 PolarHBondContact O-N 3.46Å; F1004-T1006 VanDerWaalsContact C-N 3.27Å; F1004-T1006 PolarHBondContact O-N 3.41Å; T1006-C1008 VanDerWaalsContact C-N 3.34Å; T1006-C1008 PolarHBondContact O-N 3.4Å; T1006-F1009 WeakPolarHBondContact O-CB 3.06Å; T1006-F1009 PolarHBondContact O-N 2.74Å; T1006-V1010 HydrophobicContact CG2-CG2 4.48Å; T1006-V1010 WeakPolarHBondContact O-CG2 3.41Å; T1006-V1010 PolarHBondContact O-N 3.03Å
1007	V	78.8	Confident	77.5	Confident	14 Å²	14	16.1 Å²	16.1	9%	0.085	10%	0.101	C	C	.	.	H	α-helix	trans	-60.2	-45.3	173	168.6	0	0	0	0	110.6	S1003 F1004 F1009 V1010 L1011 M1043	S1003-V1007 WeakPolarHBondContact O-CG2 3.39Å; S1003-V1007 PolarHBondContact O-N 3.22Å; S1003-V1007 VanDerWaalsContact O-N 3.09Å; F1004-V1007 WeakPolarHBondContact O-CB 3.46Å; F1004-V1007 PolarHBondContact O-N 3.48Å; F1004-V1007 VanDerWaalsContact O-N 3.12Å; V1007-F1009 VanDerWaalsContact C-N 3.27Å; V1007-F1009 PolarHBondContact O-N 3.29Å; V1007-V1010 PolarHBondContact O-N 3.34Å; V1007-L1011 HydrophobicContact CG1-CD1 3.8Å; V1007-L1011 HydrophobicContact CG1-CG 4.2Å; V1007-L1011 WeakPolarHBondContact O-CB 3.46Å; V1007-L1011 VanDerWaalsContact O-CG 3.24Å; V1007-L1011 WeakPolarHBondContact O-CG 3.42Å; V1007-L1011 PolarHBondContact O-N 3.49Å; V1007-M1043 HydrophobicContact CB-CE 4.5Å; V1007-M1043 HydrophobicContact CG1-CE 3.66Å; V1007-M1043 HydrophobicContact CG2-CE 3.96Å
1008	C	82.9	Confident	78.1	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.3	-40.2	175.7	-66.1	0	0	0	0	112.2	F955 M958 L959 F1004 S1005 T1006 S1012	F955-C1008 HydrophobicContact CD2-CB 4.19Å; F955-C1008 HydrophobicContact CE2-CB 4.11Å; M958-C1008 HydrophobicContact CB-CB 4.11Å; L959-C1008 HydrophobicContact CD2-CB 4.24Å; L959-C1008 HydrophobicContact CG-CB 4.38Å; F1004-C1008 PolarHBondContact O-N 3.33Å; F1004-C1008 PolarHBondContact O-SG 3.47Å; F1004-C1008 VanDerWaalsContact O-SG 3.4Å; S1005-C1008 PolarHBondContact O-N 3.22Å; T1006-C1008 VanDerWaalsContact C-N 3.34Å; T1006-C1008 PolarHBondContact O-N 3.4Å; C1008-S1012 WeakPolarHBondContact O-CB 2.88Å; C1008-S1012 PolarHBondContact O-N 3.19Å
1009	F	81.7	Confident	79.1	Confident	1 Å²	1	18.4 Å²	18.4	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-64.9	-51.1	175.4	-178	-110.7	0	0	0	112.2	F208 F220 F955 M968 L977 I979 S1005 T1006 V1007 L1011 S1012 L1013	F208-F1009 AromaticContact CE1-CD1 3.53Å; F208-F1009 HydrophobicContact CE1-CD1 3.53Å; F208-F1009 AromaticContact CE1-CE1 3.96Å; F208-F1009 HydrophobicContact CE1-CE1 3.96Å; F208-F1009 HydrophobicContact CE1-CG 4.37Å; F208-F1009 AromaticContact CE2-CD1 3.94Å; F208-F1009 HydrophobicContact CE2-CD1 3.94Å; F208-F1009 AromaticContact CE2-CE1 3.45Å; F208-F1009 HydrophobicContact CE2-CE1 3.45Å; F208-F1009 VanDerWaalsContact CE2-CE1 3.45Å; F208-F1009 HydrophobicContact CE2-CZ 4.28Å; F208-F1009 AromaticContact CZ-CD1 3.13Å; F208-F1009 HydrophobicContact CZ-CD1 3.13Å; F208-F1009 AromaticContact CZ-CE1 3.1Å; F208-F1009 HydrophobicContact CZ-CE1 3.1Å; F208-F1009 HydrophobicContact CZ-CG 4.05Å; F208-F1009 HydrophobicContact CZ-CZ 4.01Å; F220-F1009 HydrophobicContact CD1-CE1 4Å; F220-F1009 HydrophobicContact CE1-CE1 4.07Å; F955-F1009 HydrophobicContact CD2-CB 4.11Å; F955-F1009 HydrophobicContact CD2-CD2 4.39Å; F955-F1009 HydrophobicContact CE2-CB 3.9Å; M968-F1009 HydrophobicContact CE-CD2 3.47Å; M968-F1009 VanDerWaalsContact CE-CD2 3.47Å; M968-F1009 HydrophobicContact CE-CE2 3.61Å; M968-F1009 HydrophobicContact SD-CE2 4.38Å; L977-F1009 HydrophobicContact CD2-CE2 4.35Å; L977-F1009 HydrophobicContact CD2-CZ 4.3Å; I979-F1009 HydrophobicContact CD1-CD2 4.06Å; I979-F1009 HydrophobicContact CD1-CE2 4.01Å; S1005-F1009 PolarHBondContact O-N 3.43Å; T1006-F1009 WeakPolarHBondContact O-CB 3.06Å; T1006-F1009 PolarHBondContact O-N 2.74Å; V1007-F1009 VanDerWaalsContact C-N 3.27Å; V1007-F1009 PolarHBondContact O-N 3.29Å; F1009-L1011 VanDerWaalsContact C-N 3.26Å; F1009-L1011 PolarHBondContact O-N 3.3Å; F1009-S1012 WeakPolarHBondContact CA-OG 3.41Å; F1009-S1012 PolarHBondContact O-N 3.06Å; F1009-S1012 PolarHBondContact O-OG 3.34Å; F1009-L1013 HydrophobicContact CD1-CD1 3.98Å; F1009-L1013 HydrophobicContact CE1-CD1 3.38Å; F1009-L1013 HydrophobicContact CE1-CG 4.2Å; F1009-L1013 HydrophobicContact CE2-CD1 4.31Å; F1009-L1013 HydrophobicContact CE2-CG 4.33Å; F1009-L1013 HydrophobicContact CZ-CD1 3.6Å; F1009-L1013 HydrophobicContact CZ-CD2 4.32Å; F1009-L1013 HydrophobicContact CZ-CG 4.09Å; F1009-L1013 PolarHBondContact O-N 3.28Å
1010	V	81.6	Confident	80.1	Confident	11 Å²	11	16.5 Å²	16.5	7%	0.067	9%	0.085	C	C	.	.	H	α-helix	trans	-57.6	-42	177.6	173.1	0	0	0	0	110.9	L200 T1006 V1007 L1013 W1014	L200-V1010 HydrophobicContact CD2-CG2 4.24Å; T1006-V1010 HydrophobicContact CG2-CG2 4.48Å; T1006-V1010 WeakPolarHBondContact O-CG2 3.41Å; T1006-V1010 PolarHBondContact O-N 3.03Å; V1007-V1010 PolarHBondContact O-N 3.34Å; V1010-L1013 PolarHBondContact O-N 3.46Å; V1010-W1014 HydrophobicContact CG1-CD2 4.33Å; V1010-W1014 HydrophobicContact CG1-CZ2 4.36Å; V1010-W1014 PolarHBondContact O-N 3.13Å
1011	L	83.1	Confident	81.2	Confident	7 Å²	7	16.2 Å²	16.2	4%	0.037	8%	0.081	C	C	.	.	H	α-helix	trans	-64.7	-37.9	175.7	-70.3	178.4	0	0	0	112.8	V1007 F1009 L1013 W1014 A1015 M1042 M1043 V1046	V1007-L1011 HydrophobicContact CG1-CD1 3.8Å; V1007-L1011 HydrophobicContact CG1-CG 4.2Å; V1007-L1011 WeakPolarHBondContact O-CB 3.46Å; V1007-L1011 VanDerWaalsContact O-CG 3.24Å; V1007-L1011 WeakPolarHBondContact O-CG 3.42Å; V1007-L1011 PolarHBondContact O-N 3.49Å; F1009-L1011 VanDerWaalsContact C-N 3.26Å; F1009-L1011 PolarHBondContact O-N 3.3Å; L1011-L1013 VanDerWaalsContact C-N 3.31Å; L1011-L1013 PolarHBondContact O-N 3.47Å; L1011-W1014 HydrophobicContact CD2-CD2 4.28Å; L1011-W1014 HydrophobicContact CD2-CE3 3.47Å; L1011-W1014 VanDerWaalsContact CD2-CE3 3.47Å; L1011-W1014 HydrophobicContact CD2-CZ3 3.9Å; L1011-W1014 WeakPolarHBondContact O-CB 3.44Å; L1011-W1014 PolarHBondContact O-N 3.44Å; L1011-A1015 PolarHBondContact O-N 3.23Å; L1011-M1042 HydrophobicContact CD1-CB 4.41Å; L1011-M1042 HydrophobicContact CD1-CE 3.61Å; L1011-M1042 HydrophobicContact CD1-CG 3.72Å; L1011-M1042 HydrophobicContact CD1-SD 3.8Å; L1011-M1043 HydrophobicContact CD1-CG 4.42Å; L1011-M1043 HydrophobicContact CD2-CG 4.16Å; L1011-V1046 HydrophobicContact CD2-CB 4.35Å; L1011-V1046 HydrophobicContact CD2-CG1 4.34Å; L1011-V1046 HydrophobicContact CD2-CG2 4.21Å
1012	S	86.3	Confident	82	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.2	-36.4	173.1	69.7	0	0	0	0	112.4	C1008 F1009 A1015 I1016	C1008-S1012 WeakPolarHBondContact O-CB 2.88Å; C1008-S1012 PolarHBondContact O-N 3.19Å; F1009-S1012 WeakPolarHBondContact CA-OG 3.41Å; F1009-S1012 PolarHBondContact O-N 3.06Å; F1009-S1012 PolarHBondContact O-OG 3.34Å; S1012-A1015 WeakPolarHBondContact O-CB 3.05Å; S1012-A1015 PolarHBondContact O-N 3.15Å; S1012-I1016 PolarHBondContact O-N 3.35Å
1013	L	85.4	Confident	82.7	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-70.5	-38.5	173.8	-67.3	179	0	0	0	111.8	V197 F220 F221 A224 F1009 V1010 L1011 A1015 I1016 T1017	V197-L1013 HydrophobicContact CG1-CB 3.86Å; V197-L1013 HydrophobicContact CG2-CB 4.26Å; V197-L1013 HydrophobicContact CG2-CD1 3.73Å; F220-L1013 HydrophobicContact CD1-CD1 4.03Å; F220-L1013 HydrophobicContact CE1-CD1 3.6Å; F221-L1013 HydrophobicContact CD2-CD2 3.84Å; F221-L1013 HydrophobicContact CE2-CD2 4.44Å; A224-L1013 HydrophobicContact CB-CD1 4.23Å; F1009-L1013 HydrophobicContact CD1-CD1 3.98Å; F1009-L1013 HydrophobicContact CE1-CD1 3.38Å; F1009-L1013 HydrophobicContact CE1-CG 4.2Å; F1009-L1013 HydrophobicContact CE2-CD1 4.31Å; F1009-L1013 HydrophobicContact CE2-CG 4.33Å; F1009-L1013 HydrophobicContact CZ-CD1 3.6Å; F1009-L1013 HydrophobicContact CZ-CD2 4.32Å; F1009-L1013 HydrophobicContact CZ-CG 4.09Å; F1009-L1013 PolarHBondContact O-N 3.28Å; V1010-L1013 PolarHBondContact O-N 3.46Å; L1011-L1013 VanDerWaalsContact C-N 3.31Å; L1011-L1013 PolarHBondContact O-N 3.47Å; L1013-A1015 PolarHBondContact O-N 2.76Å; L1013-I1016 HydrophobicContact CD2-CD1 3.91Å; L1013-I1016 HydrophobicContact CD2-CG1 4.37Å; L1013-I1016 CarbonylContact O-C 3.51Å; L1013-I1016 VanDerWaalsContact O-CG1 3.24Å; L1013-I1016 WeakPolarHBondContact O-CG1 3.34Å; L1013-I1016 PolarHBondContact O-N 3.45Å; L1013-T1017 WeakPolarHBondContact O-CB 3.49Å; L1013-T1017 WeakPolarHBondContact O-CG2 3.29Å; L1013-T1017 PolarHBondContact O-N 3.11Å; L1013-T1017 PolarHBondContact O-OG1 3.26Å
1014	W	84.7	Confident	83.4	Confident	1 Å²	1	11.1 Å²	11.1	0%	0.004	6%	0.058	C	C	.	.	H	α-helix	trans	-61.8	-30.5	172.4	-73	1.1	0	0	0	113.3	V197 V1010 L1011 I1016 T1017 R1022 L1024 F1055 F1057	V197-W1014 PolarHBondContact O-NE1 3.44Å; V1010-W1014 HydrophobicContact CG1-CD2 4.33Å; V1010-W1014 HydrophobicContact CG1-CZ2 4.36Å; V1010-W1014 PolarHBondContact O-N 3.13Å; L1011-W1014 HydrophobicContact CD2-CD2 4.28Å; L1011-W1014 HydrophobicContact CD2-CE3 3.47Å; L1011-W1014 VanDerWaalsContact CD2-CE3 3.47Å; L1011-W1014 HydrophobicContact CD2-CZ3 3.9Å; L1011-W1014 WeakPolarHBondContact O-CB 3.44Å; L1011-W1014 PolarHBondContact O-N 3.44Å; W1014-I1016 PolarHBondContact O-N 3.26Å; W1014-T1017 WeakPolarHBondContact CA-OG1 3.5Å; W1014-R1022 VanDerWaalsContact CE2-CD 3.46Å; W1014-R1022 HydrophobicContact CH2-CB 4.24Å; W1014-R1022 HydrophobicContact CZ2-CB 3.86Å; W1014-R1022 PolarHBondContact O-NH2 2.81Å; W1014-L1024 HydrophobicContact CH2-CD1 3.14Å; W1014-L1024 HydrophobicContact CH2-CG 3.94Å; W1014-L1024 HydrophobicContact CZ2-CD1 3.43Å; W1014-L1024 VanDerWaalsContact CZ2-CD1 3.43Å; W1014-L1024 HydrophobicContact CZ2-CD2 4.47Å; W1014-L1024 HydrophobicContact CZ2-CG 3.75Å; W1014-L1024 HydrophobicContact CZ3-CD1 4.1Å; W1014-F1055 HydrophobicContact CE3-CD1 4.32Å; W1014-F1055 AromaticContact CE3-CE1 3.83Å; W1014-F1055 HydrophobicContact CE3-CE1 3.83Å; W1014-F1055 AromaticContact CH2-CD1 3.86Å; W1014-F1055 HydrophobicContact CH2-CD1 3.86Å; W1014-F1055 HydrophobicContact CH2-CE1 4.2Å; W1014-F1055 AromaticContact CZ3-CD1 3.61Å; W1014-F1055 HydrophobicContact CZ3-CD1 3.61Å; W1014-F1055 AromaticContact CZ3-CE1 3.57Å; W1014-F1055 HydrophobicContact CZ3-CE1 3.57Å; W1014-F1057 HydrophobicContact CH2-CE1 4.23Å
1015	A	81.1	Confident	83.9	Confident	16 Å²	16	11.4 Å²	11.4	13%	0.132	6%	0.06	C	C	.	.	H	α-helix	trans	-70.3	-22.4	174.9	0	0	0	0	0	112.3	R950 Y954 L1011 S1012 L1013	R950-A1015 PolarHBondContact NE-O 3.48Å; R950-A1015 PolarHBondContact NH2-O 2.93Å; Y954-A1015 HydrophobicContact CD1-CB 3.98Å; Y954-A1015 HydrophobicContact CD2-CB 3.53Å; Y954-A1015 HydrophobicContact CE1-CB 4.15Å; Y954-A1015 HydrophobicContact CE2-CB 3.72Å; Y954-A1015 HydrophobicContact CG-CB 3.68Å; L1011-A1015 PolarHBondContact O-N 3.23Å; S1012-A1015 WeakPolarHBondContact O-CB 3.05Å; S1012-A1015 PolarHBondContact O-N 3.15Å; L1013-A1015 PolarHBondContact O-N 2.76Å
1016	I	84.3	Confident	84	Confident	19 Å²	19	12.2 Å²	12.2	10%	0.097	6%	0.064	C	C	.	.	H	α-helix	trans	-110.5	-7.8	-178.6	64	164.2	0	0	0	114.3	F221 T225 L947 R950 C951 S1012 L1013 W1014	F221-I1016 HydrophobicContact CD2-CD1 4.48Å; F221-I1016 HydrophobicContact CE2-CD1 3.78Å; T225-I1016 HydrophobicContact CG2-CD1 3.52Å; T225-I1016 HydrophobicContact CG2-CG1 4.34Å; L947-I1016 HydrophobicContact CB-CD1 4.32Å; L947-I1016 HydrophobicContact CD2-CB 3.93Å; R950-I1016 HydrophobicContact CB-CG2 3.84Å; R950-I1016 HydrophobicContact CG-CG2 3.56Å; C951-I1016 HydrophobicContact CB-CD1 4.01Å; S1012-I1016 PolarHBondContact O-N 3.35Å; L1013-I1016 HydrophobicContact CD2-CD1 3.91Å; L1013-I1016 HydrophobicContact CD2-CG1 4.37Å; L1013-I1016 CarbonylContact O-C 3.51Å; L1013-I1016 VanDerWaalsContact O-CG1 3.24Å; L1013-I1016 WeakPolarHBondContact O-CG1 3.34Å; L1013-I1016 PolarHBondContact O-N 3.45Å; W1014-I1016 PolarHBondContact O-N 3.26Å
1017	T	82.8	Confident	83.9	Confident	9 Å²	9	13 Å²	13	6%	0.055	7%	0.066	C	C	.	.			trans	-107.7	136.4	-179.9	52.4	0	0	0	0	111	V197 A224 L1013 W1014 R1022	V197-T1017 HydrophobicContact CG1-CG2 4.48Å; A224-T1017 WeakPolarHBondContact O-CG2 3.21Å; L1013-T1017 WeakPolarHBondContact O-CB 3.49Å; L1013-T1017 WeakPolarHBondContact O-CG2 3.29Å; L1013-T1017 PolarHBondContact O-N 3.11Å; L1013-T1017 PolarHBondContact O-OG1 3.26Å; W1014-T1017 WeakPolarHBondContact CA-OG1 3.5Å; T1017-R1022 PolarHBondContact O-NH2 3.45Å
1018	E	78.5	Confident	83.7	Confident	125 Å²	125	12.5 Å²	12.5	58%	0.584	6%	0.063	S	C	*	.			trans	-100.7	124.9	175.8	-66.1	-166	167.4	0	0	110.7	N190	N190-E1018 PolarHBondContact ND2-O 2.92Å
1019	S	85.9	Confident	83.1	Confident	1 Å²	1	15 Å²	15	1%	0.007	8%	0.078	C	C	.	.			trans	-153.1	138.6	172.2	-179.8	0	0	0	0	108.1	F1021 R1053	S1019-F1021 VanDerWaalsContact C-N 3.26Å; S1019-F1021 WeakPolarHBondContact CB-O 3.03Å; S1019-F1021 PolarHBondContact O-N 3.45Å; S1019-F1021 PolarHBondContact OG-O 2.74Å; S1019-R1053 VanDerWaalsContact O-CD 3.32Å; S1019-R1053 WeakPolarHBondContact O-CD 2.8Å
1020	P	88.3	Confident	82.5	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.013	10%	0.101	C	C	.	.	S	Bend	trans	-64.9	-31.8	-179.6	26.3	-34.4	0	0	0	112.4	F189 N190 I191 Q1054	F189-P1020 WeakPolarHBondContact O-CD 3.44Å; F189-P1020 WeakPolarHBondContact O-CG 3.33Å; N190-P1020 WeakPolarHBondContact O-CD 3.39Å; I191-P1020 HydrophobicContact CD1-CG 4.39Å; I191-P1020 HydrophobicContact CG1-CG 3.45Å; I191-P1020 VanDerWaalsContact CG1-CG 3.45Å; P1020-Q1054 PolarHBondContact O-N 3.04Å
1021	F	90.5	Very high	82.1	Confident	3 Å²	3	21.1 Å²	21.1	1%	0.013	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	155.5	172.2	69.4	-92.8	0	0	0	112.3	V59 L104 I191 V193 V199 S1019 Q1054	V59-F1021 HydrophobicContact CG2-CD1 3.85Å; V59-F1021 HydrophobicContact CG2-CE1 3.85Å; V59-F1021 HydrophobicContact CG2-CG 4.2Å; V59-F1021 HydrophobicContact CG2-CZ 4.22Å; L104-F1021 HydrophobicContact CD1-CE1 4.13Å; L104-F1021 HydrophobicContact CD1-CZ 3.68Å; I191-F1021 HydrophobicContact CD1-CE1 4.38Å; I191-F1021 HydrophobicContact CG1-CE1 4.2Å; I191-F1021 HydrophobicContact CG2-CE1 3.76Å; I191-F1021 HydrophobicContact CG2-CZ 4Å; V193-F1021 HydrophobicContact CG1-CZ 4.4Å; V199-F1021 HydrophobicContact CG2-CE2 4.44Å; S1019-F1021 VanDerWaalsContact C-N 3.26Å; S1019-F1021 WeakPolarHBondContact CB-O 3.03Å; S1019-F1021 PolarHBondContact O-N 3.45Å; S1019-F1021 PolarHBondContact OG-O 2.74Å; F1021-Q1054 CarbonylContact C-O 3.59Å; F1021-Q1054 WeakPolarHBondContact CA-O 3.3Å; F1021-Q1054 HydrophobicContact CB-CB 3.8Å; F1021-Q1054 HydrophobicContact CB-CG 4.31Å
1022	R	90	Very high	81.6	Confident	5 Å²	5	24.4 Å²	24.4	2%	0.019	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.7	174.8	-58.2	-169.6	-176.5	90	-6.8	110.7	S198 W1014 T1017 Q1054 F1055 I1056	S198-R1022 CarbonylContact O-C 3.47Å; S198-R1022 VanDerWaalsContact O-CA 3.24Å; S198-R1022 WeakPolarHBondContact O-CA 3.48Å; W1014-R1022 VanDerWaalsContact CE2-CD 3.46Å; W1014-R1022 HydrophobicContact CH2-CB 4.24Å; W1014-R1022 HydrophobicContact CZ2-CB 3.86Å; W1014-R1022 PolarHBondContact O-NH2 2.81Å; T1017-R1022 PolarHBondContact O-NH2 3.45Å; R1022-Q1054 PolarHBondContact N-O 3.29Å; R1022-F1055 HydrophobicContact CB-CD1 4.29Å; R1022-F1055 CarbonylContact O-C 3.4Å; R1022-F1055 WeakPolarHBondContact O-CA 2.86Å; R1022-I1056 PolarHBondContact O-N 2.97Å
1023	C	88.9	Confident	80.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.4	-179.6	-59.3	0	0	0	0	111.2	L97 S198 V199 L200 I1056	L97-C1023 HydrophobicContact CD1-CB 3.46Å; L97-C1023 VanDerWaalsContact CD1-CB 3.46Å; S198-C1023 PolarHBondContact O-N 3.45Å; V199-C1023 HydrophobicContact CG1-CB 4.23Å; V199-C1023 HydrophobicContact CG2-CB 4.45Å; L200-C1023 PolarHBondContact N-O 3.49Å; C1023-I1056 CarbonylContact C-O 3.56Å; C1023-I1056 VanDerWaalsContact CA-O 3.24Å; C1023-I1056 WeakPolarHBondContact CA-O 3.23Å
1024	L	86.6	Confident	80.3	Confident	9 Å²	9	36.6 Å²	36.6	5%	0.047	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118.3	175.5	-86.8	160.1	0	0	0	110.1	L200 W1014 F1027 M1043 I1056 F1057 L1058	L200-L1024 HydrophobicContact CB-CD2 3.88Å; L200-L1024 HydrophobicContact CD2-CD2 3.41Å; L200-L1024 VanDerWaalsContact CD2-CD2 3.41Å; L200-L1024 HydrophobicContact CG-CD2 4.22Å; W1014-L1024 HydrophobicContact CH2-CD1 3.14Å; W1014-L1024 HydrophobicContact CH2-CG 3.94Å; W1014-L1024 HydrophobicContact CZ2-CD1 3.43Å; W1014-L1024 VanDerWaalsContact CZ2-CD1 3.43Å; W1014-L1024 HydrophobicContact CZ2-CD2 4.47Å; W1014-L1024 HydrophobicContact CZ2-CG 3.75Å; W1014-L1024 HydrophobicContact CZ3-CD1 4.1Å; L1024-F1027 HydrophobicContact CB-CD1 3.97Å; L1024-F1027 HydrophobicContact CD2-CB 4.14Å; L1024-M1043 HydrophobicContact CD1-SD 3.98Å; L1024-I1056 PolarHBondContact N-O 2.97Å; L1024-F1057 HydrophobicContact CB-CD1 4Å; L1024-F1057 HydrophobicContact CD1-CD1 3.78Å; L1024-F1057 HydrophobicContact CD1-CE1 3.48Å; L1024-F1057 VanDerWaalsContact CD1-CE1 3.48Å; L1024-L1058 PolarHBondContact O-N 2.81Å
1025	D	86.1	Confident	79.7	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.032	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.2	175.3	-154.4	13.5	0	0	0	111.6	S94 L97 L200 F1027 L1058	S94-D1025 PolarHBondContact OG-OD2 2.74Å; L97-D1025 HydrophobicContact CD2-CB 3.68Å; L200-D1025 PolarHBondContact O-N 3.04Å; D1025-F1027 PolarHBondContact O-N 3.1Å; D1025-L1058 HydrophobicContact CB-CD1 4.42Å; D1025-L1058 WeakPolarHBondContact OD1-CB 2.91Å
1026	E	80	Confident	79.5	Confident	18 Å²	18	38.1 Å²	38.1	8%	0.084	19%	0.188	C	C	.	.	S	Bend	trans	52.2	32.2	168.8	-63.2	-162.8	175	0	0	115.1	Q202 D1028 V1029 L1058	Q202-E1026 HydrophobicContact CB-CB 4.47Å; Q202-E1026 HydrophobicContact CG-CB 4.1Å; Q202-E1026 PolarHBondContact NE2-OE2 3.47Å; E1026-D1028 PolarHBondContact O-N 3.49Å; E1026-D1028 VanDerWaalsContact O-N 3.14Å; E1026-V1029 HydrophobicContact CB-CG2 3.7Å; E1026-V1029 HydrophobicContact CG-CG2 4.18Å; E1026-V1029 PolarHBondContact O-N 3.14Å; E1026-L1058 PolarHBondContact N-O 3.25Å
1027	F	73.6	Confident	79.2	Confident	25 Å²	25	46.1 Å²	46.1	11%	0.11	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.7	-177.6	68.7	-85.5	0	0	0	113.4	L1024 D1025 M1040 M1043 F1057	L1024-F1027 HydrophobicContact CB-CD1 3.97Å; L1024-F1027 HydrophobicContact CD2-CB 4.14Å; D1025-F1027 PolarHBondContact O-N 3.1Å; F1027-M1040 HydrophobicContact CE2-SD 3.5Å; F1027-M1040 WeakPolarHBondContact CE2-SD 3.03Å; F1027-M1040 HydrophobicContact CZ-CE 4.49Å; F1027-M1040 HydrophobicContact CZ-SD 3.32Å; F1027-M1040 WeakPolarHBondContact CZ-SD 3.47Å; F1027-M1043 HydrophobicContact CD2-CE 3.28Å; F1027-M1043 HydrophobicContact CD2-SD 3.99Å; F1027-M1043 HydrophobicContact CE2-CE 3.39Å; F1027-M1043 HydrophobicContact CE2-SD 3.76Å; F1027-M1043 HydrophobicContact CG-CE 4.16Å; F1027-M1043 HydrophobicContact CZ-CE 4.37Å; F1027-M1043 HydrophobicContact CZ-SD 4.18Å; F1027-F1057 HydrophobicContact CD1-CD1 4.29Å; F1027-F1057 HydrophobicContact CE1-CB 3.99Å; F1027-F1057 AromaticContact CE1-CD1 3.76Å; F1027-F1057 HydrophobicContact CE1-CD1 3.76Å; F1027-F1057 HydrophobicContact CE1-CG 4.27Å; F1027-F1057 HydrophobicContact CZ-CD1 4.18Å
1028	D	74.4	Confident	78.9	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-2.3	-174.7	66.7	-26.9	0	0	0	114.7	E1026 Y1030 M1031 R1036 T1059 M1063	E1026-D1028 PolarHBondContact O-N 3.49Å; E1026-D1028 VanDerWaalsContact O-N 3.14Å; D1028-Y1030 VanDerWaalsContact C-N 3.34Å; D1028-Y1030 PolarHBondContact O-N 3.29Å; D1028-M1031 PolarHBondContact O-N 3.28Å; D1028-R1036 HydrophobicContact CB-CG 4.13Å; D1028-R1036 IonicContact OD2-CZ 3.33Å; D1028-R1036 IonicContact OD2-NE 3.18Å; D1028-R1036 PolarHBondContact OD2-NE 3.38Å; D1028-R1036 IonicContact OD2-NH2 2.96Å; D1028-R1036 PolarHBondContact OD2-NH2 3.25Å; D1028-T1059 VanDerWaalsContact CG-OG1 3.29Å; D1028-T1059 PolarHBondContact OD1-OG1 3.3Å; D1028-T1059 PolarHBondContact OD2-OG1 3.43Å; D1028-M1063 WeakPolarHBondContact OD2-CE 3.23Å
1029	V	72.4	Confident	78.9	Confident	52 Å²	52	42.4 Å²	42.4	32%	0.315	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.7	-172.2	173.6	0	0	0	0	113.6	E1026 P1060	E1026-V1029 HydrophobicContact CB-CG2 3.7Å; E1026-V1029 HydrophobicContact CG-CG2 4.18Å; E1026-V1029 PolarHBondContact O-N 3.14Å; V1029-P1060 HydrophobicContact CG2-CG 3.76Å
1030	Y	67.4	Low	78.7	Confident	121 Å²	121	42.9 Å²	42.9	48%	0.475	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	12.6	-177.1	-59.1	-71.5	0	0	0	113.6	K206 D1028	K206-Y1030 VanDerWaalsContact CE-CE2 3.45Å; K206-Y1030 VanDerWaalsContact CE-CZ 3.47Å; K206-Y1030 WeakPolarHBondContact CE-OH 2.95Å; K206-Y1030 HydrophobicContact CG-CE2 4.5Å; K206-Y1030 PolarHBondContact NZ-OH 3.49Å; D1028-Y1030 VanDerWaalsContact C-N 3.34Å; D1028-Y1030 PolarHBondContact O-N 3.29Å
1031	M	73.3	Confident	78.4	Confident	20 Å²	20	46.2 Å²	46.2	10%	0.099	22%	0.22	C	C	.	.			trans	-101.8	139.8	-177.3	-57.5	-170.1	79.3	0	0	111	D1028 N1035 R1036 S1039	D1028-M1031 PolarHBondContact O-N 3.28Å; M1031-N1035 HydrophobicContact CE-CB 3.72Å; M1031-N1035 WeakPolarHBondContact CE-O 3.43Å; M1031-R1036 HydrophobicContact CB-CB 4.07Å; M1031-S1039 WeakPolarHBondContact CE-OG 3.27Å
1032	D	73.6	Confident	77.9	Confident	76 Å²	76	46.2 Å²	46.2	41%	0.406	22%	0.22	S	C	.	.			trans	-66	163.9	165.2	65.7	43.3	0	0	0	111.1	V1034 N1035 R1036	D1032-V1034 PolarHBondContact O-N 2.83Å; D1032-V1034 PolarHBondContact OD1-N 2.96Å; D1032-V1034 VanDerWaalsContact OD1-N 3.15Å; D1032-N1035 VanDerWaalsContact CG-CG 3.48Å; D1032-N1035 VanDerWaalsContact CG-ND2 3.3Å; D1032-N1035 PolarHBondContact O-N 3.45Å; D1032-N1035 VanDerWaalsContact OD1-CB 3.24Å; D1032-N1035 WeakPolarHBondContact OD1-CB 3.31Å; D1032-N1035 PolarHBondContact OD1-N 3.27Å; D1032-N1035 PolarHBondContact OD1-ND2 3.4Å; D1032-N1035 PolarHBondContact OD1-OD1 3.31Å; D1032-N1035 PolarHBondContact OD2-ND2 3.27Å; D1032-R1036 WeakPolarHBondContact O-CB 3.08Å; D1032-R1036 PolarHBondContact O-N 3.17Å
1033	M	71.3	Confident	77.5	Confident	162 Å²	162	46.2 Å²	46.2	80%	0.798	22%	0.22	S	C	*	.	H	α-helix	trans	-54.8	-36	-177.3	-78.3	-98.5	-55.1	0	0	113.8	R1037	M1033-R1037 PolarHBondContact O-N 2.6Å
1034	V	71.8	Confident	77.3	Confident	95 Å²	95	47.3 Å²	47.3	58%	0.576	23%	0.226	S	C	*	.	H	α-helix	trans	-77.7	-49.5	-174.5	177.7	0	0	0	0	110.2	D1032 R1036 R1037 I1038	D1032-V1034 PolarHBondContact O-N 2.83Å; D1032-V1034 PolarHBondContact OD1-N 2.96Å; D1032-V1034 VanDerWaalsContact OD1-N 3.15Å; V1034-R1036 VanDerWaalsContact C-N 3.27Å; V1034-R1036 PolarHBondContact O-N 3.47Å; V1034-R1037 PolarHBondContact O-N 3.17Å; V1034-I1038 HydrophobicContact CG1-CD1 4.1Å; V1034-I1038 WeakPolarHBondContact O-CG1 3.07Å; V1034-I1038 PolarHBondContact O-N 3.12Å
1035	N	72.9	Confident	77.2	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-38.9	179.7	-58.1	-14.5	0	0	0	110.4	R962 G1000 M1031 D1032 R1037 I1038 S1039	R962-N1035 PolarHBondContact NH1-OD1 3.14Å; R962-N1035 PolarHBondContact NH2-OD1 3.47Å; G1000-N1035 VanDerWaalsContact CA-ND2 3.26Å; G1000-N1035 WeakPolarHBondContact CA-ND2 3.08Å; G1000-N1035 PolarHBondContact O-ND2 3.01Å; G1000-N1035 VanDerWaalsContact O-ND2 3.16Å; M1031-N1035 HydrophobicContact CE-CB 3.72Å; M1031-N1035 WeakPolarHBondContact CE-O 3.43Å; D1032-N1035 VanDerWaalsContact CG-CG 3.48Å; D1032-N1035 VanDerWaalsContact CG-ND2 3.3Å; D1032-N1035 PolarHBondContact O-N 3.45Å; D1032-N1035 VanDerWaalsContact OD1-CB 3.24Å; D1032-N1035 WeakPolarHBondContact OD1-CB 3.31Å; D1032-N1035 PolarHBondContact OD1-N 3.27Å; D1032-N1035 PolarHBondContact OD1-ND2 3.4Å; D1032-N1035 PolarHBondContact OD1-OD1 3.31Å; D1032-N1035 PolarHBondContact OD2-ND2 3.27Å; N1035-R1037 PolarHBondContact O-N 3.45Å; N1035-I1038 PolarHBondContact O-N 3.31Å; N1035-S1039 WeakPolarHBondContact O-CB 3.26Å; N1035-S1039 PolarHBondContact O-N 2.97Å; N1035-S1039 PolarHBondContact O-OG 2.71Å
1036	R	76.8	Confident	77	Confident	47 Å²	47	54 Å²	54	18%	0.177	26%	0.256	C	S	.	.	H	α-helix	trans	-56	-50.5	174.9	-178	173.4	-177.8	-140.3	-11.6	111.4	D1028 M1031 D1032 V1034 I1038 S1039 M1040	D1028-R1036 HydrophobicContact CB-CG 4.13Å; D1028-R1036 IonicContact OD2-CZ 3.33Å; D1028-R1036 IonicContact OD2-NE 3.18Å; D1028-R1036 PolarHBondContact OD2-NE 3.38Å; D1028-R1036 IonicContact OD2-NH2 2.96Å; D1028-R1036 PolarHBondContact OD2-NH2 3.25Å; M1031-R1036 HydrophobicContact CB-CB 4.07Å; D1032-R1036 WeakPolarHBondContact O-CB 3.08Å; D1032-R1036 PolarHBondContact O-N 3.17Å; V1034-R1036 VanDerWaalsContact C-N 3.27Å; V1034-R1036 PolarHBondContact O-N 3.47Å; R1036-I1038 PolarHBondContact O-N 3.24Å; R1036-S1039 PolarHBondContact O-N 3.34Å; R1036-M1040 HydrophobicContact CG-CG 4.45Å; R1036-M1040 WeakPolarHBondContact O-CB 2.74Å; R1036-M1040 WeakPolarHBondContact O-CG 3.29Å; R1036-M1040 PolarHBondContact O-N 3.48Å
1037	R	77.1	Confident	77.2	Confident	187 Å²	187	53.2 Å²	53.2	71%	0.706	25%	0.252	S	S	*	.	H	α-helix	trans	-60	-46	179.7	-173.1	177.4	-179.7	177.2	1.3	111.8	M1033 V1034 N1035 M1040 D1041	M1033-R1037 PolarHBondContact O-N 2.6Å; V1034-R1037 PolarHBondContact O-N 3.17Å; N1035-R1037 PolarHBondContact O-N 3.45Å; R1037-M1040 PolarHBondContact O-N 3.08Å; R1037-D1041 PolarHBondContact O-N 2.82Å
1038	I	76.9	Confident	77.6	Confident	55 Å²	55	55 Å²	55	28%	0.282	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-46.4	-179	-60.8	168.6	0	0	0	110.9	F1004 V1034 N1035 R1036 M1040 D1041 M1042	F1004-I1038 HydrophobicContact CE2-CB 4.47Å; F1004-I1038 HydrophobicContact CE2-CG2 3.77Å; F1004-I1038 HydrophobicContact CZ-CG2 4.35Å; V1034-I1038 HydrophobicContact CG1-CD1 4.1Å; V1034-I1038 WeakPolarHBondContact O-CG1 3.07Å; V1034-I1038 PolarHBondContact O-N 3.12Å; N1035-I1038 PolarHBondContact O-N 3.31Å; R1036-I1038 PolarHBondContact O-N 3.24Å; I1038-M1040 VanDerWaalsContact C-N 3.31Å; I1038-M1040 PolarHBondContact O-N 3.44Å; I1038-D1041 PolarHBondContact O-N 3.28Å; I1038-M1042 VanDerWaalsContact O-CB 3.28Å; I1038-M1042 WeakPolarHBondContact O-CB 3.07Å; I1038-M1042 PolarHBondContact O-N 2.71Å
1039	S	78.8	Confident	77.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-36.4	177.2	-72.6	0	0	0	0	112.5	F1004 M1031 N1035 R1036 M1042 M1043	F1004-S1039 WeakPolarHBondContact CD2-OG 3.32Å; M1031-S1039 WeakPolarHBondContact CE-OG 3.27Å; N1035-S1039 WeakPolarHBondContact O-CB 3.26Å; N1035-S1039 PolarHBondContact O-N 2.97Å; N1035-S1039 PolarHBondContact O-OG 2.71Å; R1036-S1039 PolarHBondContact O-N 3.34Å; S1039-M1042 PolarHBondContact O-N 2.76Å; S1039-M1043 WeakPolarHBondContact O-CB 3.2Å; S1039-M1043 VanDerWaalsContact O-CG 3.3Å; S1039-M1043 WeakPolarHBondContact O-CG 3.16Å; S1039-M1043 PolarHBondContact O-N 2.89Å
1040	M	81.1	Confident	78.4	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-49.3	173.8	-72.8	-68.6	-74	0	0	111.9	F84 F1027 R1036 R1037 I1038 M1042 M1043 L1044 M1063 L1066	F84-M1040 HydrophobicContact CE1-CE 3.55Å; F84-M1040 HydrophobicContact CE1-SD 4.49Å; F84-M1040 HydrophobicContact CZ-CE 3.63Å; F1027-M1040 HydrophobicContact CE2-SD 3.5Å; F1027-M1040 WeakPolarHBondContact CE2-SD 3.03Å; F1027-M1040 HydrophobicContact CZ-CE 4.49Å; F1027-M1040 HydrophobicContact CZ-SD 3.32Å; F1027-M1040 WeakPolarHBondContact CZ-SD 3.47Å; R1036-M1040 HydrophobicContact CG-CG 4.45Å; R1036-M1040 WeakPolarHBondContact O-CB 2.74Å; R1036-M1040 WeakPolarHBondContact O-CG 3.29Å; R1036-M1040 PolarHBondContact O-N 3.48Å; R1037-M1040 PolarHBondContact O-N 3.08Å; I1038-M1040 VanDerWaalsContact C-N 3.31Å; I1038-M1040 PolarHBondContact O-N 3.44Å; M1040-M1042 PolarHBondContact O-N 3.36Å; M1040-M1043 PolarHBondContact O-N 2.69Å; M1040-L1044 WeakPolarHBondContact O-CB 3.32Å; M1040-L1044 VanDerWaalsContact O-CG 3.3Å; M1040-L1044 WeakPolarHBondContact O-CG 3.47Å; M1040-L1044 PolarHBondContact O-N 3.48Å; M1040-M1063 HydrophobicContact CE-CE 3.86Å; M1040-M1063 HydrophobicContact CE-SD 3.75Å; M1040-L1066 HydrophobicContact CE-CD2 3.86Å
1041	D	81.9	Confident	78.8	Confident	72 Å²	72	58 Å²	58	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-38.6	177.7	-77.1	-16	0	0	0	111.4	R1037 I1038 L1044 K1045	R1037-D1041 PolarHBondContact O-N 2.82Å; I1038-D1041 PolarHBondContact O-N 3.28Å; D1041-L1044 PolarHBondContact O-N 3.41Å; D1041-K1045 WeakPolarHBondContact O-CB 3.44Å; D1041-K1045 VanDerWaalsContact O-CG 3.24Å; D1041-K1045 WeakPolarHBondContact O-CG 3.46Å; D1041-K1045 PolarHBondContact O-N 3.45Å
1042	M	80.6	Confident	79	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-44.3	178.1	-166.5	-177.8	171.5	0	0	112.6	M958 F1004 L1011 I1038 S1039 M1040 L1044 K1045 V1046	M958-M1042 HydrophobicContact CB-CE 3.18Å; M958-M1042 HydrophobicContact CG-CE 3.3Å; M958-M1042 HydrophobicContact SD-CE 3.16Å; M958-M1042 WeakPolarHBondContact SD-CE 3.31Å; M958-M1042 HydrophobicContact SD-CG 4.37Å; F1004-M1042 HydrophobicContact CE2-SD 4.42Å; F1004-M1042 HydrophobicContact CZ-SD 4.49Å; L1011-M1042 HydrophobicContact CD1-CB 4.41Å; L1011-M1042 HydrophobicContact CD1-CE 3.61Å; L1011-M1042 HydrophobicContact CD1-CG 3.72Å; L1011-M1042 HydrophobicContact CD1-SD 3.8Å; I1038-M1042 VanDerWaalsContact O-CB 3.28Å; I1038-M1042 WeakPolarHBondContact O-CB 3.07Å; I1038-M1042 PolarHBondContact O-N 2.71Å; S1039-M1042 PolarHBondContact O-N 2.76Å; M1040-M1042 PolarHBondContact O-N 3.36Å; M1042-L1044 VanDerWaalsContact C-N 3.34Å; M1042-L1044 PolarHBondContact O-N 2.75Å; M1042-K1045 PolarHBondContact O-N 2.95Å; M1042-V1046 WeakPolarHBondContact O-CG2 3.44Å; M1042-V1046 PolarHBondContact O-N 3.31Å
1043	M	82.9	Confident	79.6	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.02	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-41.5	173.5	-74.4	-176.3	-136.1	0	0	111.8	V1007 L1011 L1024 F1027 S1039 M1040 V1046 A1047 F1057	V1007-M1043 HydrophobicContact CB-CE 4.5Å; V1007-M1043 HydrophobicContact CG1-CE 3.66Å; V1007-M1043 HydrophobicContact CG2-CE 3.96Å; L1011-M1043 HydrophobicContact CD1-CG 4.42Å; L1011-M1043 HydrophobicContact CD2-CG 4.16Å; L1024-M1043 HydrophobicContact CD1-SD 3.98Å; F1027-M1043 HydrophobicContact CD2-CE 3.28Å; F1027-M1043 HydrophobicContact CD2-SD 3.99Å; F1027-M1043 HydrophobicContact CE2-CE 3.39Å; F1027-M1043 HydrophobicContact CE2-SD 3.76Å; F1027-M1043 HydrophobicContact CG-CE 4.16Å; F1027-M1043 HydrophobicContact CZ-CE 4.37Å; F1027-M1043 HydrophobicContact CZ-SD 4.18Å; S1039-M1043 WeakPolarHBondContact O-CB 3.2Å; S1039-M1043 VanDerWaalsContact O-CG 3.3Å; S1039-M1043 WeakPolarHBondContact O-CG 3.16Å; S1039-M1043 PolarHBondContact O-N 2.89Å; M1040-M1043 PolarHBondContact O-N 2.69Å; M1043-V1046 PolarHBondContact O-N 3.42Å; M1043-A1047 WeakPolarHBondContact O-CB 3.43Å; M1043-A1047 PolarHBondContact O-N 3.46Å; M1043-F1057 HydrophobicContact CB-CE1 4.29Å; M1043-F1057 HydrophobicContact CB-CZ 4.14Å; M1043-F1057 HydrophobicContact CG-CE1 4.38Å; M1043-F1057 HydrophobicContact SD-CD1 4.2Å; M1043-F1057 HydrophobicContact SD-CE1 3.53Å; M1043-F1057 VanDerWaalsContact SD-CE1 3.53Å; M1043-F1057 HydrophobicContact SD-CZ 4.31Å
1044	L	84.4	Confident	80.5	Confident	23 Å²	23	53.8 Å²	53.8	12%	0.12	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-39.7	176.6	-70.3	173.1	0	0	0	111.8	V82 F84 M1040 D1041 M1042 A1047 A1048 L1066 I1072	V82-L1044 HydrophobicContact CG1-CD2 4.08Å; V82-L1044 HydrophobicContact CG2-CD2 4.32Å; F84-L1044 HydrophobicContact CE2-CD2 4.25Å; F84-L1044 HydrophobicContact CZ-CD2 4.26Å; M1040-L1044 WeakPolarHBondContact O-CB 3.32Å; M1040-L1044 VanDerWaalsContact O-CG 3.3Å; M1040-L1044 WeakPolarHBondContact O-CG 3.47Å; M1040-L1044 PolarHBondContact O-N 3.48Å; D1041-L1044 PolarHBondContact O-N 3.41Å; M1042-L1044 VanDerWaalsContact C-N 3.34Å; M1042-L1044 PolarHBondContact O-N 2.75Å; L1044-A1047 PolarHBondContact O-N 3.27Å; L1044-A1048 VanDerWaalsContact O-CB 3.29Å; L1044-A1048 WeakPolarHBondContact O-CB 3.42Å; L1044-A1048 PolarHBondContact O-N 3.27Å; L1044-L1066 HydrophobicContact CD1-CD2 4Å; L1044-I1072 HydrophobicContact CD2-CD1 4.03Å; L1044-I1072 HydrophobicContact CD2-CG1 4.49Å
1045	K	83.4	Confident	81.4	Confident	137 Å²	137	49.3 Å²	49.3	60%	0.596	23%	0.234	S	C	*	.	H	α-helix	trans	-60.6	-44.1	173	-77.9	171.7	-176.2	177.3	0	111.9	D1041 M1042 A1048 S1049	D1041-K1045 WeakPolarHBondContact O-CB 3.44Å; D1041-K1045 VanDerWaalsContact O-CG 3.24Å; D1041-K1045 WeakPolarHBondContact O-CG 3.46Å; D1041-K1045 PolarHBondContact O-N 3.45Å; M1042-K1045 PolarHBondContact O-N 2.95Å; K1045-A1048 PolarHBondContact O-N 3.06Å; K1045-S1049 PolarHBondContact O-N 3.38Å
1046	V	83.2	Confident	82.3	Confident	20 Å²	20	49.3 Å²	49.3	12%	0.121	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-41.6	175.8	172.9	0	0	0	0	111.2	L1011 M1042 M1043 A1048 S1049 Q1050	L1011-V1046 HydrophobicContact CD2-CB 4.35Å; L1011-V1046 HydrophobicContact CD2-CG1 4.34Å; L1011-V1046 HydrophobicContact CD2-CG2 4.21Å; M1042-V1046 WeakPolarHBondContact O-CG2 3.44Å; M1042-V1046 PolarHBondContact O-N 3.31Å; M1043-V1046 PolarHBondContact O-N 3.42Å; V1046-A1048 VanDerWaalsContact C-N 3.31Å; V1046-A1048 PolarHBondContact O-N 3.46Å; V1046-S1049 PolarHBondContact O-N 3.03Å; V1046-S1049 PolarHBondContact O-OG 2.83Å; V1046-Q1050 WeakPolarHBondContact O-CG 3.47Å; V1046-Q1050 PolarHBondContact O-N 3.33Å; V1046-Q1050 VanDerWaalsContact O-N 3.07Å
1047	A	83.6	Confident	82.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.2	-36.1	176.9	0	0	0	0	0	112.6	N81 V82 M1043 L1044 Q1050 F1055	N81-A1047 PolarHBondContact ND2-O 2.7Å; N81-A1047 VanDerWaalsContact ND2-O 3.1Å; N81-A1047 PolarHBondContact OD1-O 3.31Å; V82-A1047 HydrophobicContact CG2-CB 3.41Å; V82-A1047 VanDerWaalsContact CG2-CB 3.41Å; M1043-A1047 WeakPolarHBondContact O-CB 3.43Å; M1043-A1047 PolarHBondContact O-N 3.46Å; L1044-A1047 PolarHBondContact O-N 3.27Å; A1047-Q1050 CarbonylContact O-C 3.52Å; A1047-Q1050 PolarHBondContact O-N 3.44Å; A1047-F1055 VanDerWaalsContact CA-CE2 3.47Å; A1047-F1055 HydrophobicContact CB-CD1 4.48Å; A1047-F1055 HydrophobicContact CB-CD2 3.56Å; A1047-F1055 HydrophobicContact CB-CE2 3.66Å; A1047-F1055 HydrophobicContact CB-CG 4.01Å; A1047-F1055 HydrophobicContact CB-CZ 4.15Å
1048	A	82.1	Confident	83.4	Confident	62 Å²	62	38.4 Å²	38.4	51%	0.512	19%	0.193	S	C	.	.	H	α-helix	trans	-69.9	-37.2	176.5	0	0	0	0	0	112.4	L1044 K1045 V1046 Q1050	L1044-A1048 VanDerWaalsContact O-CB 3.29Å; L1044-A1048 WeakPolarHBondContact O-CB 3.42Å; L1044-A1048 PolarHBondContact O-N 3.27Å; K1045-A1048 PolarHBondContact O-N 3.06Å; V1046-A1048 VanDerWaalsContact C-N 3.31Å; V1046-A1048 PolarHBondContact O-N 3.46Å; A1048-Q1050 VanDerWaalsContact C-N 3.27Å; A1048-Q1050 PolarHBondContact O-N 3.17Å
1049	S	81.1	Confident	83.8	Confident	93 Å²	93	35.8 Å²	35.8	65%	0.65	18%	0.179	S	C	*	.	H	α-helix	trans	-70	-25.6	174.1	72.3	0	0	0	0	112.4	K1045 V1046	K1045-S1049 PolarHBondContact O-N 3.38Å; V1046-S1049 PolarHBondContact O-N 3.03Å; V1046-S1049 PolarHBondContact O-OG 2.83Å
1050	Q	82.9	Confident	83.7	Confident	43 Å²	43	37 Å²	37	20%	0.201	19%	0.187	C	C	.	.			trans	-102	60.5	176.8	-61.5	-170.5	3.1	0	0	112.4	N81 V1046 A1047 A1048 Y1052 R1053 F1055	N81-Q1050 PolarHBondContact ND2-O 2.79Å; V1046-Q1050 WeakPolarHBondContact O-CG 3.47Å; V1046-Q1050 PolarHBondContact O-N 3.33Å; V1046-Q1050 VanDerWaalsContact O-N 3.07Å; A1047-Q1050 CarbonylContact O-C 3.52Å; A1047-Q1050 PolarHBondContact O-N 3.44Å; A1048-Q1050 VanDerWaalsContact C-N 3.27Å; A1048-Q1050 PolarHBondContact O-N 3.17Å; Q1050-Y1052 PolarHBondContact O-N 3.41Å; Q1050-R1053 HydrophobicContact CB-CB 4.29Å; Q1050-R1053 HydrophobicContact CB-CG 4.24Å; Q1050-R1053 PolarHBondContact O-N 3.3Å; Q1050-F1055 HydrophobicContact CB-CE2 4.17Å; Q1050-F1055 HydrophobicContact CB-CZ 4.05Å
1051	R	74.6	Confident	83.3	Confident	106 Å²	106	40.8 Å²	40.8	40%	0.4	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.4	-171.3	-154	160.1	122	82.2	-5.5	115.3	G50 V52	G50-R1051 PolarHBondContact O-NH2 3.42Å; V52-R1051 HydrophobicContact CB-CG 4.01Å; V52-R1051 VanDerWaalsContact CB-NE 3.25Å; V52-R1051 VanDerWaalsContact CB-NH2 3.27Å; V52-R1051 HydrophobicContact CG1-CB 4.12Å; V52-R1051 HydrophobicContact CG1-CG 3.76Å; V52-R1051 HydrophobicContact CG2-CG 4.3Å
1052	Y	78.3	Confident	82.6	Confident	110 Å²	110	42.6 Å²	42.6	43%	0.431	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-1	179.1	-58.2	-87.2	0	0	0	114.2	V52 V53 S54 Q1050	V52-Y1052 HydrophobicContact CB-CE1 4.28Å; V52-Y1052 HydrophobicContact CG1-CD1 3.56Å; V52-Y1052 HydrophobicContact CG1-CD2 4.41Å; V52-Y1052 HydrophobicContact CG1-CE1 3.31Å; V52-Y1052 HydrophobicContact CG1-CE2 4.22Å; V52-Y1052 HydrophobicContact CG1-CG 4.09Å; V52-Y1052 HydrophobicContact CG2-CE1 4.24Å; V53-Y1052 WeakPolarHBondContact O-CD1 3.37Å; V53-Y1052 WeakPolarHBondContact O-CE1 3.37Å; S54-Y1052 WeakPolarHBondContact CB-O 3.37Å; S54-Y1052 PolarHBondContact OG-O 3.36Å; Q1050-Y1052 PolarHBondContact O-N 3.41Å
1053	R	85.9	Confident	82.1	Confident	59 Å²	59	42.9 Å²	42.9	22%	0.223	22%	0.216	C	C	.	.	S	Bend	trans	-109	149.3	-179.8	-56.4	-57.7	-167.4	173.6	-0.6	111	N81 S1019 Q1050 F1055	N81-R1053 PolarHBondContact ND2-O 2.84Å; S1019-R1053 VanDerWaalsContact O-CD 3.32Å; S1019-R1053 WeakPolarHBondContact O-CD 2.8Å; Q1050-R1053 HydrophobicContact CB-CB 4.29Å; Q1050-R1053 HydrophobicContact CB-CG 4.24Å; Q1050-R1053 PolarHBondContact O-N 3.3Å; R1053-F1055 HydrophobicContact CB-CE2 4.02Å; R1053-F1055 HydrophobicContact CB-CZ 4.35Å
1054	Q	90.9	Very high	81.2	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	140.1	177.4	-174	-177.9	58.1	0	0	111.2	I58 V59 G79 N81 P1020 F1021 R1022 I1056	I58-Q1054 HydrophobicContact CB-CB 4.2Å; I58-Q1054 HydrophobicContact CG2-CB 3.93Å; V59-Q1054 PolarHBondContact O-NE2 3.03Å; G79-Q1054 PolarHBondContact O-NE2 3.04Å; N81-Q1054 CarbonylContact O-C 3.6Å; N81-Q1054 WeakPolarHBondContact O-CA 3.3Å; P1020-Q1054 PolarHBondContact O-N 3.04Å; F1021-Q1054 CarbonylContact C-O 3.59Å; F1021-Q1054 WeakPolarHBondContact CA-O 3.3Å; F1021-Q1054 HydrophobicContact CB-CB 3.8Å; F1021-Q1054 HydrophobicContact CB-CG 4.31Å; R1022-Q1054 PolarHBondContact N-O 3.29Å; Q1054-I1056 HydrophobicContact CG-CG1 4.3Å
1055	F	90.8	Very high	80.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.5	178	-61.1	-94.6	0	0	0	108.5	N81 V82 N83 W1014 R1022 A1047 Q1050 R1053 F1057	N81-F1055 PolarHBondContact O-N 2.74Å; V82-F1055 CarbonylContact C-O 3.57Å; V82-F1055 HydrophobicContact CG2-CB 4.49Å; N83-F1055 WeakPolarHBondContact CB-O 3.33Å; N83-F1055 PolarHBondContact N-O 3.46Å; N83-F1055 PolarHBondContact ND2-O 3.47Å; W1014-F1055 HydrophobicContact CE3-CD1 4.32Å; W1014-F1055 AromaticContact CE3-CE1 3.83Å; W1014-F1055 HydrophobicContact CE3-CE1 3.83Å; W1014-F1055 AromaticContact CH2-CD1 3.86Å; W1014-F1055 HydrophobicContact CH2-CD1 3.86Å; W1014-F1055 HydrophobicContact CH2-CE1 4.2Å; W1014-F1055 AromaticContact CZ3-CD1 3.61Å; W1014-F1055 HydrophobicContact CZ3-CD1 3.61Å; W1014-F1055 AromaticContact CZ3-CE1 3.57Å; W1014-F1055 HydrophobicContact CZ3-CE1 3.57Å; R1022-F1055 HydrophobicContact CB-CD1 4.29Å; R1022-F1055 CarbonylContact O-C 3.4Å; R1022-F1055 WeakPolarHBondContact O-CA 2.86Å; A1047-F1055 VanDerWaalsContact CA-CE2 3.47Å; A1047-F1055 HydrophobicContact CB-CD1 4.48Å; A1047-F1055 HydrophobicContact CB-CD2 3.56Å; A1047-F1055 HydrophobicContact CB-CE2 3.66Å; A1047-F1055 HydrophobicContact CB-CG 4.01Å; A1047-F1055 HydrophobicContact CB-CZ 4.15Å; Q1050-F1055 HydrophobicContact CB-CE2 4.17Å; Q1050-F1055 HydrophobicContact CB-CZ 4.05Å; R1053-F1055 HydrophobicContact CB-CE2 4.02Å; R1053-F1055 HydrophobicContact CB-CZ 4.35Å; F1055-F1057 HydrophobicContact CB-CD2 4.31Å; F1055-F1057 HydrophobicContact CB-CE2 3.56Å; F1055-F1057 HydrophobicContact CB-CZ 3.88Å; F1055-F1057 HydrophobicContact CD1-CZ 4.32Å; F1055-F1057 HydrophobicContact CG-CE2 4.45Å; F1055-F1057 HydrophobicContact CG-CZ 4.41Å
1056	I	91.3	Very high	79.7	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	106.2	-179.2	-55.5	175.6	0	0	0	107.9	F78 N83 V85 L100 R1022 C1023 L1024 Q1054 L1058	F78-I1056 HydrophobicContact CD1-CD1 4.22Å; F78-I1056 HydrophobicContact CD1-CG1 4.41Å; F78-I1056 HydrophobicContact CE1-CD1 4.11Å; F78-I1056 HydrophobicContact CE1-CG1 4.46Å; F78-I1056 HydrophobicContact CE1-CG2 4.05Å; F78-I1056 HydrophobicContact CZ-CD1 4.33Å; N83-I1056 HydrophobicContact CB-CG1 4.25Å; N83-I1056 CarbonylContact O-C 3.55Å; N83-I1056 WeakPolarHBondContact O-CA 3.07Å; V85-I1056 HydrophobicContact CG2-CG2 4.16Å; L100-I1056 HydrophobicContact CD1-CD1 4.49Å; R1022-I1056 PolarHBondContact O-N 2.97Å; C1023-I1056 CarbonylContact C-O 3.56Å; C1023-I1056 VanDerWaalsContact CA-O 3.24Å; C1023-I1056 WeakPolarHBondContact CA-O 3.23Å; L1024-I1056 PolarHBondContact N-O 2.97Å; Q1054-I1056 HydrophobicContact CG-CG1 4.3Å; I1056-L1058 HydrophobicContact CG2-CD1 4.49Å
1057	F	89.4	Confident	79	Confident	3 Å²	3	49.4 Å²	49.4	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.5	-179.3	-61.5	-76.1	0	0	0	109.2	V82 N83 F84 V85 W1014 L1024 F1027 M1043 F1055	V82-F1057 HydrophobicContact CG1-CD2 4Å; V82-F1057 HydrophobicContact CG1-CE2 3.89Å; N83-F1057 PolarHBondContact O-N 3.09Å; F84-F1057 CarbonylContact C-O 3.52Å; F84-F1057 WeakPolarHBondContact CA-O 3.45Å; F84-F1057 HydrophobicContact CD1-CB 3.51Å; F84-F1057 HydrophobicContact CD1-CD2 4.24Å; F84-F1057 HydrophobicContact CD1-CG 4.22Å; F84-F1057 HydrophobicContact CE1-CB 3.52Å; F84-F1057 AromaticContact CE1-CD2 3.71Å; F84-F1057 HydrophobicContact CE1-CD2 3.71Å; F84-F1057 AromaticContact CE1-CG 3.76Å; F84-F1057 HydrophobicContact CE1-CG 3.76Å; F84-F1057 HydrophobicContact CE2-CD2 4.41Å; F84-F1057 HydrophobicContact CG-CB 4.42Å; F84-F1057 HydrophobicContact CZ-CB 4.46Å; F84-F1057 AromaticContact CZ-CD2 3.82Å; F84-F1057 HydrophobicContact CZ-CD2 3.82Å; F84-F1057 HydrophobicContact CZ-CE2 4.39Å; F84-F1057 HydrophobicContact CZ-CG 4.31Å; V85-F1057 PolarHBondContact N-O 3.27Å; W1014-F1057 HydrophobicContact CH2-CE1 4.23Å; L1024-F1057 HydrophobicContact CB-CD1 4Å; L1024-F1057 HydrophobicContact CD1-CD1 3.78Å; L1024-F1057 HydrophobicContact CD1-CE1 3.48Å; L1024-F1057 VanDerWaalsContact CD1-CE1 3.48Å; F1027-F1057 HydrophobicContact CD1-CD1 4.29Å; F1027-F1057 HydrophobicContact CE1-CB 3.99Å; F1027-F1057 AromaticContact CE1-CD1 3.76Å; F1027-F1057 HydrophobicContact CE1-CD1 3.76Å; F1027-F1057 HydrophobicContact CE1-CG 4.27Å; F1027-F1057 HydrophobicContact CZ-CD1 4.18Å; M1043-F1057 HydrophobicContact CB-CE1 4.29Å; M1043-F1057 HydrophobicContact CB-CZ 4.14Å; M1043-F1057 HydrophobicContact CG-CE1 4.38Å; M1043-F1057 HydrophobicContact SD-CD1 4.2Å; M1043-F1057 HydrophobicContact SD-CE1 3.53Å; M1043-F1057 VanDerWaalsContact SD-CE1 3.53Å; M1043-F1057 HydrophobicContact SD-CZ 4.31Å; F1055-F1057 HydrophobicContact CB-CD2 4.31Å; F1055-F1057 HydrophobicContact CB-CE2 3.56Å; F1055-F1057 HydrophobicContact CB-CZ 3.88Å; F1055-F1057 HydrophobicContact CD1-CZ 4.32Å; F1055-F1057 HydrophobicContact CG-CE2 4.45Å; F1055-F1057 HydrophobicContact CG-CZ 4.41Å
1058	L	88.3	Confident	78.2	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126	174.1	-53.8	101.2	0	0	0	109.3	V85 K93 L97 L1024 D1025 E1026 I1056	V85-L1058 HydrophobicContact CB-CD2 4.27Å; V85-L1058 HydrophobicContact CB-CG 4.21Å; V85-L1058 HydrophobicContact CG1-CD2 4.38Å; V85-L1058 WeakPolarHBondContact O-CA 3.47Å; K93-L1058 HydrophobicContact CB-CD2 3.99Å; K93-L1058 WeakPolarHBondContact O-CD2 3.14Å; L97-L1058 HydrophobicContact CB-CD1 4.46Å; L97-L1058 HydrophobicContact CB-CD2 4.46Å; L97-L1058 HydrophobicContact CD1-CD1 4.16Å; L97-L1058 HydrophobicContact CD2-CD1 4.36Å; L1024-L1058 PolarHBondContact O-N 2.81Å; D1025-L1058 HydrophobicContact CB-CD1 4.42Å; D1025-L1058 WeakPolarHBondContact OD1-CB 2.91Å; E1026-L1058 PolarHBondContact N-O 3.25Å; I1056-L1058 HydrophobicContact CG2-CD1 4.49Å
1059	T	84.8	Confident	77.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	139.4	-175.5	-179.6	0	0	0	0	111	V85 V86 K93 D1028 Q1061 M1063	V85-T1059 PolarHBondContact O-N 3.19Å; V85-T1059 VanDerWaalsContact O-N 3.11Å; V86-T1059 WeakPolarHBondContact CA-O 3.32Å; V86-T1059 HydrophobicContact CG2-CG2 3.97Å; K93-T1059 WeakPolarHBondContact CD-O 3.2Å; D1028-T1059 VanDerWaalsContact CG-OG1 3.29Å; D1028-T1059 PolarHBondContact OD1-OG1 3.3Å; D1028-T1059 PolarHBondContact OD2-OG1 3.43Å; T1059-Q1061 VanDerWaalsContact C-N 3.25Å; T1059-Q1061 PolarHBondContact OG1-N 3.35Å; T1059-M1063 HydrophobicContact CG2-CE 3.32Å; T1059-M1063 HydrophobicContact CG2-CG 4Å
1060	P	75.5	Confident	77.5	Confident	26 Å²	26	62.5 Å²	62.5	17%	0.169	33%	0.331	C	S	.	.	S	Bend	trans	-79.4	-10.7	174.4	31.5	-31.7	0	0	0	112.9	G87 V1029	G87-P1060 WeakPolarHBondContact O-CA 3.09Å; V1029-P1060 HydrophobicContact CG2-CG 3.76Å
1061	Q	73.3	Confident	77.3	Confident	92 Å²	92	62.7 Å²	62.7	43%	0.43	34%	0.335	S	S	.	.	S	Bend	trans	-95.4	152.5	-168.3	-65	-68.9	-9	0	0	112.4	V86 T1059	V86-Q1061 WeakPolarHBondContact CG1-O 3.43Å; T1059-Q1061 VanDerWaalsContact C-N 3.25Å; T1059-Q1061 PolarHBondContact OG1-N 3.35Å
1062	N	67.5	Low	77.8	Confident	109 Å²	109	59.1 Å²	59.1	58%	0.583	32%	0.323	S	S	*	.			trans	-69.9	136.3	179	-163.2	-3.9	0	0	0	111.4	S1064	N1062-S1064 PolarHBondContact ND2-OG 3.31Å; N1062-S1064 PolarHBondContact OD1-OG 3.28Å
1063	M	70.7	Confident	78.3	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.044	32%	0.322	C	S	.	.			trans	-113.7	23.5	-172.3	-70.5	-62.1	174.3	0	0	113.3	V86 D1028 M1040 T1059 S1065 L1066	V86-M1063 HydrophobicContact CG2-CB 4.46Å; V86-M1063 HydrophobicContact CG2-CG 4.09Å; D1028-M1063 WeakPolarHBondContact OD2-CE 3.23Å; M1040-M1063 HydrophobicContact CE-CE 3.86Å; M1040-M1063 HydrophobicContact CE-SD 3.75Å; T1059-M1063 HydrophobicContact CG2-CE 3.32Å; T1059-M1063 HydrophobicContact CG2-CG 4Å; M1063-S1065 PolarHBondContact O-N 3.49Å; M1063-S1065 VanDerWaalsContact O-N 3.09Å; M1063-L1066 HydrophobicContact CB-CD1 3.78Å; M1063-L1066 HydrophobicContact CB-CG 4.25Å; M1063-L1066 HydrophobicContact CG-CD1 4.26Å; M1063-L1066 WeakPolarHBondContact O-CG 3.19Å; M1063-L1066 PolarHBondContact O-N 3.3Å; M1063-L1066 HydrophobicContact SD-CD1 4.24Å; M1063-L1066 HydrophobicContact SD-CG 4.45Å
1064	S	63.8	Low	78.4	Confident	101 Å²	101	60.3 Å²	60.3	71%	0.706	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.2	-179.7	-53.7	0	0	0	0	115.2	N1062	N1062-S1064 PolarHBondContact ND2-OG 3.31Å; N1062-S1064 PolarHBondContact OD1-OG 3.28Å
1065	S	64.9	Low	78.2	Confident	113 Å²	113	61.3 Å²	61.3	79%	0.79	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	3.3	-178.3	54.9	0	0	0	0	114.6	M1063	M1063-S1065 PolarHBondContact O-N 3.49Å; M1063-S1065 VanDerWaalsContact O-N 3.09Å
1066	L	70.1	Confident	78	Confident	28 Å²	28	71 Å²	71	15%	0.147	37%	0.374	C	S	.	.	S	Bend	trans	-76.9	147.6	-179.3	-69.5	178.3	0	0	0	112.7	F84 M1040 L1044 M1063 I1074	F84-L1066 HydrophobicContact CD2-CD1 3.68Å; F84-L1066 HydrophobicContact CE1-CD1 4.49Å; F84-L1066 HydrophobicContact CE2-CD1 3.48Å; F84-L1066 VanDerWaalsContact CE2-CD1 3.48Å; F84-L1066 HydrophobicContact CG-CD1 4.27Å; F84-L1066 HydrophobicContact CZ-CD1 3.94Å; M1040-L1066 HydrophobicContact CE-CD2 3.86Å; L1044-L1066 HydrophobicContact CD1-CD2 4Å; M1063-L1066 HydrophobicContact CB-CD1 3.78Å; M1063-L1066 HydrophobicContact CB-CG 4.25Å; M1063-L1066 HydrophobicContact CG-CD1 4.26Å; M1063-L1066 WeakPolarHBondContact O-CG 3.19Å; M1063-L1066 PolarHBondContact O-N 3.3Å; M1063-L1066 HydrophobicContact SD-CD1 4.24Å; M1063-L1066 HydrophobicContact SD-CG 4.45Å; L1066-I1074 HydrophobicContact CD1-CD1 4.42Å
1067	P	69.2	Low	77.7	Confident	80 Å²	80	71.3 Å²	71.3	52%	0.519	38%	0.376	S	S	.	.			trans	-64.8	135.8	173.5	26.4	-32.8	0	0	0	111	S1069 I1072	P1067-S1069 PolarHBondContact O-N 3.32Å; P1067-I1072 HydrophobicContact CG-CD1 4.44Å
1068	V	66.3	Low	77.4	Confident	156 Å²	156	80 Å²	80	95%	0.945	41%	0.414	S	S	*	.			trans	-72.5	108.6	176.3	-175.9	0	0	0	0	108.9
1069	S	76.4	Confident	76.8	Confident	50 Å²	50	84.7 Å²	84.7	35%	0.35	44%	0.439	S	S	.	.			trans	-132	143.9	177.7	176.2	0	0	0	0	111.1	P1067 T1071 I1072	P1067-S1069 PolarHBondContact O-N 3.32Å; S1069-T1071 PolarHBondContact O-N 3.42Å; S1069-T1071 VanDerWaalsContact O-N 3.15Å; S1069-T1071 PolarHBondContact OG-N 3.18Å; S1069-T1071 PolarHBondContact OG-OG1 3.34Å; S1069-I1072 PolarHBondContact O-N 3.42Å; S1069-I1072 VanDerWaalsContact O-N 3.13Å
1070	K	72.7	Confident	76.1	Confident	224 Å²	224	86.7 Å²	86.7	97%	0.974	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.3	172.8	-67.5	-175	179.8	-178.9	0	113.2
1071	T	78.3	Confident	75.5	Confident	46 Å²	46	93.5 Å²	93.5	28%	0.282	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.7	178.8	58.9	0	0	0	0	113.8	V82 S1069	V82-T1071 PolarHBondContact N-O 2.83Å; S1069-T1071 PolarHBondContact O-N 3.42Å; S1069-T1071 VanDerWaalsContact O-N 3.15Å; S1069-T1071 PolarHBondContact OG-N 3.18Å; S1069-T1071 PolarHBondContact OG-OG1 3.34Å
1072	I	86.1	Confident	74.5	Confident	32 Å²	32	100.3 Å²	100.3	16%	0.164	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.1	-177.7	-60.1	172.8	0	0	0	109	V82 F84 L1044 P1067 S1069 I1074	V82-I1072 HydrophobicContact CB-CG1 4.06Å; V82-I1072 HydrophobicContact CG1-CG1 4.18Å; V82-I1072 HydrophobicContact CG1-CG2 4.25Å; V82-I1072 CarbonylContact O-C 3.59Å; V82-I1072 WeakPolarHBondContact O-CA 3.39Å; F84-I1072 HydrophobicContact CD2-CG2 3.85Å; F84-I1072 HydrophobicContact CE2-CG2 3.95Å; L1044-I1072 HydrophobicContact CD2-CD1 4.03Å; L1044-I1072 HydrophobicContact CD2-CG1 4.49Å; P1067-I1072 HydrophobicContact CG-CD1 4.44Å; S1069-I1072 PolarHBondContact O-N 3.42Å; S1069-I1072 VanDerWaalsContact O-N 3.13Å; I1072-I1074 HydrophobicContact CG2-CG1 4.46Å
1073	R	87.8	Confident	73.6	Confident	105 Å²	105	98.1 Å²	98.1	40%	0.396	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.4	174.5	-169.2	172.5	-170.1	164.5	0.9	110.2	A77 F78 V82 N83 F84	A77-R1073 PolarHBondContact O-NE 3.34Å; A77-R1073 VanDerWaalsContact O-NE 3.09Å; A77-R1073 PolarHBondContact O-NH1 3.17Å; A77-R1073 PolarHBondContact O-NH2 3.01Å; F78-R1073 PolarHBondContact O-NH1 3.35Å; V82-R1073 PolarHBondContact O-N 3.37Å; N83-R1073 CarbonylContact C-O 3.6Å; N83-R1073 VanDerWaalsContact CA-O 3.31Å; N83-R1073 WeakPolarHBondContact CA-O 3.43Å; F84-R1073 PolarHBondContact N-O 3.17Å
1074	I	88.1	Confident	72.1	Confident	89 Å²	89	106.8 Å²	106.8	46%	0.456	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	121.8	176.2	-55.2	176.3	0	0	0	108.6	F84 V86 L1066 I1072	F84-I1074 HydrophobicContact CB-CG1 4.35Å; F84-I1074 CarbonylContact O-C 3.57Å; V86-I1074 HydrophobicContact CG2-CG2 4.06Å; L1066-I1074 HydrophobicContact CD1-CD1 4.42Å; I1072-I1074 HydrophobicContact CG2-CG1 4.46Å
1075	L	87.1	Confident	70.8	Confident	21 Å²	21	109.8 Å²	109.8	11%	0.11	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.4	106.9	178.3	-64.3	170.1	0	0	0	108.1	F78 F84 V85 V86	F78-L1075 HydrophobicContact CD1-CD1 3.63Å; F78-L1075 HydrophobicContact CE1-CD1 3.71Å; F78-L1075 HydrophobicContact CG-CD1 4.49Å; F84-L1075 PolarHBondContact O-N 3.3Å; V85-L1075 WeakPolarHBondContact CA-O 3.4Å; V85-L1075 HydrophobicContact CG2-CB 4.48Å; V85-L1075 HydrophobicContact CG2-CD1 4.28Å; V86-L1075 PolarHBondContact N-O 3.47Å
1076	R	85.9	Confident	69.5	Low	202 Å²	202	111.8 Å²	111.8	76%	0.762	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.2	120.7	178.8	-168.1	172.2	-178.6	173	-0.6	110.3	V86	V86-R1076 CarbonylContact O-C 3.48Å; V86-R1076 WeakPolarHBondContact O-CA 3.14Å
1077	L	85.9	Confident	67.8	Low	9 Å²	9	119.8 Å²	119.8	5%	0.047	60%	0.596	C	S	.	*	P	Polyproline II helix	trans	-78.3	151	175	-57.4	-175.8	0	0	0	110.6	F76 V85 V86 K93 I96	F76-L1077 HydrophobicContact CD1-CD2 4.28Å; F76-L1077 HydrophobicContact CE1-CD2 3.37Å; F76-L1077 HydrophobicContact CE2-CD2 4.17Å; F76-L1077 HydrophobicContact CZ-CD2 3.3Å; V85-L1077 HydrophobicContact CG1-CD1 3.89Å; V85-L1077 HydrophobicContact CG1-CD2 4.16Å; V85-L1077 HydrophobicContact CG1-CG 3.95Å; V86-L1077 PolarHBondContact O-N 3.5Å; K93-L1077 HydrophobicContact CB-CD1 4.2Å; K93-L1077 HydrophobicContact CG-CD1 3.52Å; I96-L1077 HydrophobicContact CD1-CD1 4.21Å; I96-L1077 HydrophobicContact CD1-CD2 3.96Å
1078	K	81.9	Confident	66.2	Low	187 Å²	187	125.8 Å²	125.8	81%	0.813	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-69.3	151.6	172.3	-65.9	-176.2	-179.7	-179	0	110.1	S91	S91-K1078 WeakPolarHBondContact CB-O 3.39Å
1079	D	76.1	Confident	64.6	Low	99 Å²	99	124.4 Å²	124.4	53%	0.529	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-65.1	147.3	173.1	-72.6	-41.2	0	0	0	110.9	N88	N88-D1079 PolarHBondContact ND2-OD1 2.99Å
1080	P	70.3	Confident	62.8	Low	42 Å²	42	129.3 Å²	129.3	27%	0.273	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-64.8	135.3	-178.6	24.1	-32.1	0	0	0	111.9	R1082	P1080-R1082 PolarHBondContact O-N 3.44Å
1081	D	64.1	Low	61.2	Low	170 Å²	170	126 Å²	126	91%	0.909	62%	0.616	S	S	*	*			trans	-66.9	97.8	173.9	-70.3	-37.8	0	0	0	109.9	G1083	D1081-G1083 VanDerWaalsContact C-N 3.26Å; D1081-G1083 PolarHBondContact O-N 3.45Å
1082	R	51.2	Low	59	Low	235 Å²	235	136.6 Å²	136.6	89%	0.887	66%	0.663	S	S	*	*			trans	-83.6	15.1	180	-75.2	-172.5	175.9	-175.6	-0.7	114.6	P1080	P1080-R1082 PolarHBondContact O-N 3.44Å
1083	G	49.5	Very low	57.7	Low	63 Å²	63	141.9 Å²	141.9	65%	0.649	69%	0.688	S	S	*	*			trans	-121.6	85.8	-172.8	0	0	0	0	0	113.7	D1081	D1081-G1083 VanDerWaalsContact C-N 3.26Å; D1081-G1083 PolarHBondContact O-N 3.45Å
1084	Q	39.3	Very low	56.1	Low	191 Å²	191	143.8 Å²	143.8	89%	0.893	70%	0.703	S	S	*	*			trans	179.2	69.8	154.2	-102.9	173.2	18.1	0	0	109.5
1085	N	35.1	Very low	54.3	Low	164 Å²	164	146.8 Å²	146.8	88%	0.877	72%	0.717	S	S	*	*			trans	-154.6	40.1	164.4	-107.5	0	0	0	0	111.4
1086	N	38.2	Very low	52.4	Low	155 Å²	155	154.2 Å²	154.2	83%	0.829	75%	0.752	S	S	*	*			trans	-116.4	83.8	163.1	-90.9	0.3	0	0	0	108.1
1087	F	34.2	Very low	50.3	Low	195 Å²	195	151.3 Å²	151.3	86%	0.855	75%	0.752	S	S	*	*			trans	-137.8	98.2	156.1	-97.4	-79.7	0	0	0	109.5
1088	R	35.1	Very low	47.9	Very low	207 Å²	207	160.7 Å²	160.7	78%	0.781	80%	0.799	S	S	*	*			trans	38	100	141.2	-66	-177.3	175.3	179.9	-4.5	117.4	E1090	R1088-E1090 PolarHBondContact O-N 3.47Å
1089	S	34.3	Very low	45.5	Very low	127 Å²	127	158.9 Å²	158.9	89%	0.888	80%	0.798	S	S	*	*			trans	-79.2	87.7	141.3	53.9	0	0	0	0	108.7
1090	E	37.8	Very low	43.1	Very low	152 Å²	152	163.5 Å²	163.5	71%	0.71	82%	0.818	S	S	*	*			trans	-117	132	150.9	-88.8	179.4	162.7	0	0	106.6	R1088	R1088-E1090 PolarHBondContact O-N 3.47Å
1091	D	38.7	Very low	40.9	Very low	154 Å²	154	173.6 Å²	173.6	82%	0.824	86%	0.864	S	S	*	*			trans	77.8	114.6	167.2	-61.9	-22	0	0	0	121.1
1092	Q	33	Very low	38.8	Very low	270 Å²	270	173.9 Å²	173.9	100%	1.262	86%	0.86	S	S	*	*			trans	86.7	0	155.8	-64.7	-177.9	9.1	0	0	119.5

Retrieved 1,092 of 1,092 residues in 1933.2 ms (Link to these results)

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